Browse entries in the PDBbind-CN Database
HEADER 5F90_COMPLEX COMPND 5F90_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 150 MET THR THR PHE LEU ILE LYS HIS LYS ALA SER GLY LYS SEQRES 2 A 150 PHE LEU HIS PRO TYR GLY GLY SER SER ASN PRO ALA ASN SEQRES 3 A 150 ASN THR LYS LEU VAL LEU HIS SER ASP ILE HIS GLU ARG SEQRES 4 A 150 MET TYR PHE GLN PHE ASP VAL VAL ASP GLU ARG TRP GLY SEQRES 5 A 150 TYR ILE LYS HIS VAL ALA SER GLY LYS ILE VAL HIS PRO SEQRES 6 A 150 TYR GLY GLY GLN ALA ASN PRO PRO ASN GLU THR ASN MET SEQRES 7 A 150 VAL LEU HIS GLN ASP ARG HIS ASP ARG ALA LEU PHE ALA SEQRES 8 A 150 MET ASP PHE PHE ASN ASP ASN ILE MET HIS LYS GLY GLY SEQRES 9 A 150 LYS TYR ILE HIS PRO LYS GLY GLY SER PRO ASN PRO PRO SEQRES 10 A 150 ASN ASN THR GLU THR VAL ILE HIS GLY ASP LYS HIS ALA SEQRES 11 A 150 ALA MET GLU PHE ILE PHE VAL SER PRO LYS ASN LYS ASP SEQRES 12 A 150 LYS ARG VAL LEU VAL TYR ALA SEQRES 1 B 149 THR THR PHE LEU ILE LYS HIS LYS ALA SER GLY LYS PHE SEQRES 2 B 149 LEU HIS PRO TYR GLY GLY SER SER ASN PRO ALA ASN ASN SEQRES 3 B 149 THR LYS LEU VAL LEU HIS SER ASP ILE HIS GLU ARG MET SEQRES 4 B 149 TYR PHE GLN PHE ASP VAL VAL ASP GLU ARG TRP GLY TYR SEQRES 5 B 149 ILE LYS HIS VAL ALA SER GLY LYS ILE VAL HIS PRO TYR SEQRES 6 B 149 GLY GLY GLN ALA ASN PRO PRO ASN GLU THR ASN MET VAL SEQRES 7 B 149 LEU HIS GLN ASP ARG HIS ASP ARG ALA LEU PHE ALA MET SEQRES 8 B 149 ASP PHE PHE ASN ASP ASN ILE MET HIS LYS GLY GLY LYS SEQRES 9 B 149 TYR ILE HIS PRO LYS GLY GLY SER PRO ASN PRO PRO ASN SEQRES 10 B 149 ASN THR GLU THR VAL ILE HIS GLY ASP LYS HIS ALA ALA SEQRES 11 B 149 MET GLU PHE ILE PHE VAL SER PRO LYS ASN LYS ASP LYS SEQRES 12 B 149 ARG VAL LEU VAL TYR ALA HET GLA A 723 75 ATOM 1 N MET A 1 -14.369 -5.196 24.164 1.00 75.41 N ATOM 2 CA MET A 1 -13.006 -4.612 24.320 1.00 56.02 C ATOM 3 C MET A 1 -12.667 -3.779 23.086 1.00 41.15 C ATOM 4 O MET A 1 -13.396 -3.851 22.088 1.00 76.72 O ATOM 5 CB MET A 1 -11.986 -5.736 24.552 1.00 63.58 C ATOM 6 CG MET A 1 -12.000 -6.265 25.985 1.00 76.28 C ATOM 7 SD MET A 1 -11.483 -5.044 27.233 1.00 73.02 S ATOM 8 CE MET A 1 -9.701 -5.145 27.050 1.00 70.62 C ATOM 9 HN3 MET A 1 -14.391 -5.802 23.319 1.00 0.00 H ATOM 10 HN2 MET A 1 -15.064 -4.429 24.060 1.00 0.00 H ATOM 11 HN1 MET A 1 -14.600 -5.763 25.004 1.00 0.00 H ATOM 12 N THR A 2 -11.609 -2.966 23.118 1.00 23.75 N ATOM 13 CA THR A 2 -10.821 -2.665 24.312 1.00 17.24 C ATOM 14 C THR A 2 -11.654 -1.785 25.201 1.00 13.78 C ATOM 15 O THR A 2 -12.211 -0.808 24.737 1.00 15.09 O ATOM 16 CB THR A 2 -9.535 -1.911 23.919 1.00 22.13 C ATOM 17 OG1 THR A 2 -8.737 -2.759 23.080 1.00 27.17 O ATOM 18 CG2 THR A 2 -8.738 -1.501 25.125 1.00 23.65 C ATOM 19 HG1 THR A 2 -7.909 -2.282 22.823 1.00 0.00 H ATOM 20 H THR A 2 -11.324 -2.513 22.227 1.00 0.00 H ATOM 21 N THR A 3 -11.714 -2.102 26.492 1.00 11.18 N ATOM 22 CA THR A 3 -12.448 -1.275 27.446 1.00 9.87 C ATOM 23 C THR A 3 -11.506 -0.250 28.040 1.00 9.00 C ATOM 24 O THR A 3 -10.330 -0.549 28.290 1.00 10.74 O ATOM 25 CB THR A 3 -13.006 -2.186 28.553 1.00 11.88 C ATOM 26 OG1 THR A 3 -13.862 -3.154 27.940 1.00 16.67 O ATOM 27 CG2 THR A 3 -13.783 -1.403 29.574 1.00 14.51 C ATOM 28 HG1 THR A 3 -14.233 -3.752 28.636 1.00 0.00 H ATOM 29 H THR A 3 -11.228 -2.957 26.829 1.00 0.00 H ATOM 30 N PHE A 4 -11.995 0.966 28.248 1.00 6.85 N ATOM 31 CA PHE A 4 -11.152 2.045 28.743 1.00 6.61 C ATOM 32 C PHE A 4 -11.930 3.026 29.577 1.00 6.68 C ATOM 33 O PHE A 4 -13.172 3.041 29.555 1.00 7.16 O ATOM 34 CB PHE A 4 -10.463 2.776 27.580 1.00 7.30 C ATOM 35 CG PHE A 4 -11.407 3.298 26.528 1.00 7.47 C ATOM 36 CD1 PHE A 4 -11.955 4.550 26.642 1.00 7.67 C ATOM 37 CD2 PHE A 4 -11.773 2.496 25.444 1.00 8.57 C ATOM 38 CE1 PHE A 4 -12.811 5.052 25.683 1.00 8.30 C ATOM 39 CE2 PHE A 4 -12.642 2.967 24.481 1.00 6.72 C ATOM 40 CZ PHE A 4 -13.192 4.241 24.613 1.00 7.15 C ATOM 41 H PHE A 4 -13.000 1.152 28.054 1.00 0.00 H ATOM 42 N LEU A 5 -11.197 3.818 30.334 1.00 5.82 N ATOM 43 CA LEU A 5 -11.722 4.969 31.033 1.00 6.32 C ATOM 44 C LEU A 5 -11.414 6.203 30.225 1.00 6.30 C ATOM 45 O LEU A 5 -10.320 6.301 29.615 1.00 7.21 O ATOM 46 CB LEU A 5 -11.095 5.106 32.427 1.00 7.35 C ATOM 47 CG LEU A 5 -10.906 3.828 33.220 1.00 7.82 C ATOM 48 CD1 LEU A 5 -10.266 4.156 34.572 1.00 9.37 C ATOM 49 CD2 LEU A 5 -12.210 3.072 33.370 1.00 9.34 C ATOM 50 H LEU A 5 -10.184 3.603 30.434 1.00 0.00 H ATOM 51 N ILE A 6 -12.374 7.132 30.179 1.00 6.11 N ATOM 52 CA ILE A 6 -12.171 8.434 29.499 1.00 5.88 C ATOM 53 C ILE A 6 -11.762 9.432 30.567 1.00 6.18 C ATOM 54 O ILE A 6 -12.583 9.828 31.435 1.00 6.89 O ATOM 55 CB ILE A 6 -13.426 8.876 28.728 1.00 6.20 C ATOM 56 CG1 ILE A 6 -13.713 7.861 27.624 1.00 6.65 C ATOM 57 CG2 ILE A 6 -13.296 10.318 28.235 1.00 6.56 C ATOM 58 CD1 ILE A 6 -15.043 8.088 26.931 1.00 8.48 C ATOM 59 H ILE A 6 -13.289 6.936 30.633 1.00 0.00 H ATOM 60 N LYS A 7 -10.472 9.771 30.557 1.00 6.03 N ATOM 61 CA LYS A 7 -9.858 10.593 31.640 1.00 6.42 C ATOM 62 C LYS A 7 -9.592 12.016 31.174 1.00 6.44 C ATOM 63 O LYS A 7 -8.876 12.256 30.199 1.00 8.06 O ATOM 64 CB LYS A 7 -8.568 9.941 32.150 1.00 6.82 C ATOM 65 CG LYS A 7 -8.036 10.589 33.414 1.00 9.68 C ATOM 66 CD LYS A 7 -6.870 9.851 34.058 1.00 14.17 C ATOM 67 CE LYS A 7 -5.558 10.115 33.440 1.00 16.36 C ATOM 68 NZ LYS A 7 -4.505 9.624 34.409 1.00 18.71 N ATOM 69 HZ1 LYS A 7 -4.598 10.137 35.309 1.00 0.00 H ATOM 70 HZ2 LYS A 7 -4.636 8.606 34.574 1.00 0.00 H ATOM 71 HZ3 LYS A 7 -3.561 9.793 34.008 1.00 0.00 H ATOM 72 H LYS A 7 -9.874 9.452 29.768 1.00 0.00 H ATOM 73 N HIS A 8 -10.186 12.964 31.856 1.00 7.15 N ATOM 74 CA HIS A 8 -9.955 14.369 31.607 1.00 7.23 C ATOM 75 C HIS A 8 -8.504 14.651 31.978 1.00 7.93 C ATOM 76 O HIS A 8 -8.098 14.426 33.122 1.00 11.06 O ATOM 77 CB HIS A 8 -10.896 15.175 32.472 1.00 8.00 C ATOM 78 CG HIS A 8 -10.789 16.640 32.251 1.00 8.96 C ATOM 79 ND1 HIS A 8 -10.455 17.505 33.263 1.00 12.03 N ATOM 80 CD2 HIS A 8 -10.987 17.399 31.154 1.00 9.91 C ATOM 81 CE1 HIS A 8 -10.447 18.736 32.799 1.00 12.51 C ATOM 82 NE2 HIS A 8 -10.758 18.697 31.515 1.00 10.11 N ATOM 83 H HIS A 8 -10.852 12.694 32.608 1.00 0.00 H ATOM 84 N LYS A 9 -7.706 15.090 31.024 1.00 8.06 N ATOM 85 CA LYS A 9 -6.242 15.078 31.216 1.00 8.91 C ATOM 86 C LYS A 9 -5.797 16.037 32.324 1.00 9.92 C ATOM 87 O LYS A 9 -4.893 15.716 33.151 1.00 11.70 O ATOM 88 CB LYS A 9 -5.546 15.442 29.902 1.00 10.74 C ATOM 89 CG LYS A 9 -4.028 15.253 29.898 1.00 13.48 C ATOM 90 CD LYS A 9 -3.502 15.450 28.468 1.00 15.21 C ATOM 91 CE LYS A 9 -2.044 15.110 28.344 1.00 17.90 C ATOM 92 NZ LYS A 9 -1.649 15.522 26.989 1.00 19.92 N ATOM 93 HZ1 LYS A 9 -2.218 15.003 26.290 1.00 0.00 H ATOM 94 HZ2 LYS A 9 -1.809 16.544 26.878 1.00 0.00 H ATOM 95 HZ3 LYS A 9 -0.641 15.310 26.843 1.00 0.00 H ATOM 96 H LYS A 9 -8.109 15.446 30.134 1.00 0.00 H ATOM 97 N ALA A 10 -6.401 17.228 32.334 1.00 10.95 N ATOM 98 CA ALA A 10 -5.949 18.292 33.257 1.00 13.05 C ATOM 99 C ALA A 10 -6.274 17.933 34.723 1.00 13.80 C ATOM 100 O ALA A 10 -5.477 18.204 35.597 1.00 18.82 O ATOM 101 CB ALA A 10 -6.548 19.634 32.894 1.00 15.89 C ATOM 102 H ALA A 10 -7.195 17.409 31.688 1.00 0.00 H ATOM 103 N SER A 11 -7.434 17.328 34.976 1.00 11.48 N ATOM 104 CA SER A 11 -7.898 17.089 36.350 1.00 10.59 C ATOM 105 C SER A 11 -7.757 15.650 36.851 1.00 10.88 C ATOM 106 O SER A 11 -7.801 15.419 38.074 1.00 12.61 O ATOM 107 CB SER A 11 -9.374 17.453 36.478 1.00 13.29 C ATOM 108 OG SER A 11 -10.183 16.537 35.758 1.00 11.76 O ATOM 109 HG SER A 11 -9.931 16.557 34.801 1.00 0.00 H ATOM 110 H SER A 11 -8.027 17.017 34.180 1.00 0.00 H ATOM 111 N GLY A 12 -7.664 14.681 35.932 1.00 9.73 N ATOM 112 CA GLY A 12 -7.686 13.278 36.287 1.00 9.90 C ATOM 113 C GLY A 12 -9.066 12.733 36.582 1.00 9.14 C ATOM 114 O GLY A 12 -9.209 11.577 36.918 1.00 11.72 O ATOM 115 H GLY A 12 -7.573 14.945 34.930 1.00 0.00 H ATOM 116 N LYS A 13 -10.103 13.547 36.438 1.00 8.20 N ATOM 117 CA LYS A 13 -11.451 13.030 36.618 1.00 8.23 C ATOM 118 C LYS A 13 -11.889 12.263 35.363 1.00 8.21 C ATOM 119 O LYS A 13 -11.258 12.385 34.328 1.00 9.84 O ATOM 120 CB LYS A 13 -12.385 14.169 36.941 1.00 9.99 C ATOM 121 CG LYS A 13 -12.144 14.756 38.337 1.00 12.42 C ATOM 122 CD LYS A 13 -13.295 15.598 38.809 1.00 15.59 C ATOM 123 CE LYS A 13 -13.102 16.078 40.264 1.00 15.50 C ATOM 124 NZ LYS A 13 -11.835 16.817 40.428 1.00 23.42 N ATOM 125 HZ1 LYS A 13 -11.039 16.197 40.178 1.00 0.00 H ATOM 126 HZ2 LYS A 13 -11.837 17.649 39.804 1.00 0.00 H ATOM 127 HZ3 LYS A 13 -11.740 17.124 41.417 1.00 0.00 H ATOM 128 H LYS A 13 -9.954 14.548 36.198 1.00 0.00 H ATOM 129 N PHE A 14 -12.931 11.451 35.487 1.00 7.40 N ATOM 130 CA PHE A 14 -13.391 10.562 34.419 1.00 6.54 C ATOM 131 C PHE A 14 -14.808 10.866 33.929 1.00 7.00 C ATOM 132 O PHE A 14 -15.623 11.433 34.659 1.00 7.09 O ATOM 133 CB PHE A 14 -13.373 9.110 34.910 1.00 7.45 C ATOM 134 CG PHE A 14 -12.040 8.676 35.428 1.00 7.19 C ATOM 135 CD1 PHE A 14 -11.054 8.247 34.571 1.00 8.56 C ATOM 136 CD2 PHE A 14 -11.770 8.713 36.785 1.00 7.70 C ATOM 137 CE1 PHE A 14 -9.821 7.852 35.048 1.00 8.42 C ATOM 138 CE2 PHE A 14 -10.516 8.342 37.272 1.00 9.34 C ATOM 139 CZ PHE A 14 -9.554 7.896 36.400 1.00 9.64 C ATOM 140 H PHE A 14 -13.448 11.446 36.390 1.00 0.00 H ATOM 141 N LEU A 15 -15.094 10.512 32.678 1.00 5.99 N ATOM 142 CA LEU A 15 -16.451 10.645 32.156 1.00 6.08 C ATOM 143 C LEU A 15 -17.352 9.560 32.790 1.00 6.54 C ATOM 144 O LEU A 15 -16.996 8.367 32.800 1.00 7.71 O ATOM 145 CB LEU A 15 -16.462 10.474 30.629 1.00 6.19 C ATOM 146 CG LEU A 15 -17.711 11.053 29.934 1.00 7.59 C ATOM 147 CD1 LEU A 15 -17.699 12.578 30.008 1.00 8.27 C ATOM 148 CD2 LEU A 15 -17.730 10.531 28.507 1.00 8.94 C ATOM 149 H LEU A 15 -14.342 10.136 32.065 1.00 0.00 H ATOM 150 N HIS A 16 -18.501 9.977 33.318 1.00 6.44 N ATOM 151 CA HIS A 16 -19.481 9.083 33.918 1.00 6.79 C ATOM 152 C HIS A 16 -20.884 9.468 33.408 1.00 6.00 C ATOM 153 O HIS A 16 -21.144 10.630 33.182 1.00 6.25 O ATOM 154 CB HIS A 16 -19.614 9.355 35.436 1.00 7.80 C ATOM 155 CG HIS A 16 -18.515 8.835 36.282 1.00 7.69 C ATOM 156 ND1 HIS A 16 -18.751 8.001 37.344 1.00 8.42 N ATOM 157 CD2 HIS A 16 -17.198 9.119 36.313 1.00 7.81 C ATOM 158 CE1 HIS A 16 -17.625 7.749 37.965 1.00 8.06 C ATOM 159 NE2 HIS A 16 -16.667 8.418 37.356 1.00 7.69 N ATOM 160 H HIS A 16 -18.710 10.996 33.301 1.00 0.00 H ATOM 161 N PRO A 17 -21.819 8.521 33.357 1.00 6.44 N ATOM 162 CA PRO A 17 -23.253 8.957 33.376 1.00 7.06 C ATOM 163 C PRO A 17 -23.555 9.582 34.733 1.00 7.57 C ATOM 164 O PRO A 17 -23.143 9.033 35.747 1.00 8.60 O ATOM 165 CB PRO A 17 -24.016 7.662 33.204 1.00 9.02 C ATOM 166 CG PRO A 17 -23.146 6.584 33.698 1.00 9.62 C ATOM 167 CD PRO A 17 -21.682 7.075 33.586 1.00 7.40 C ATOM 168 N TYR A 18 -24.234 10.717 34.753 1.00 7.10 N ATOM 169 CA TYR A 18 -24.616 11.344 36.020 1.00 8.95 C ATOM 170 C TYR A 18 -25.415 10.322 36.831 1.00 8.82 C ATOM 171 O TYR A 18 -26.421 9.796 36.369 1.00 11.76 O ATOM 172 CB TYR A 18 -25.435 12.596 35.775 1.00 9.43 C ATOM 173 CG TYR A 18 -25.875 13.296 37.018 1.00 12.85 C ATOM 174 CD1 TYR A 18 -24.947 13.702 37.988 1.00 12.87 C ATOM 175 CD2 TYR A 18 -27.207 13.584 37.233 1.00 21.36 C ATOM 176 CE1 TYR A 18 -25.353 14.376 39.131 1.00 17.98 C ATOM 177 CE2 TYR A 18 -27.615 14.256 38.382 1.00 25.57 C ATOM 178 CZ TYR A 18 -26.690 14.637 39.320 1.00 22.67 C ATOM 179 OH TYR A 18 -27.103 15.289 40.467 1.00 32.42 O ATOM 180 HH TYR A 18 -26.316 15.491 41.032 1.00 0.00 H ATOM 181 H TYR A 18 -24.500 11.171 33.856 1.00 0.00 H ATOM 182 N GLY A 19 -24.984 10.063 38.065 1.00 9.17 N ATOM 183 CA GLY A 19 -25.633 9.028 38.881 1.00 10.63 C ATOM 184 C GLY A 19 -24.974 7.658 38.854 1.00 9.45 C ATOM 185 O GLY A 19 -25.196 6.846 39.734 1.00 12.45 O ATOM 186 H GLY A 19 -24.181 10.598 38.454 1.00 0.00 H ATOM 187 N GLY A 20 -24.166 7.370 37.839 1.00 7.72 N ATOM 188 CA GLY A 20 -23.449 6.116 37.770 1.00 8.20 C ATOM 189 C GLY A 20 -24.245 4.861 37.468 1.00 7.61 C ATOM 190 O GLY A 20 -23.799 3.798 37.789 1.00 9.00 O ATOM 191 H GLY A 20 -24.046 8.065 37.074 1.00 0.00 H ATOM 192 N SER A 21 -25.415 4.976 36.825 1.00 7.75 N ATOM 193 CA SER A 21 -26.269 3.825 36.609 1.00 7.30 C ATOM 194 C SER A 21 -25.729 2.804 35.639 1.00 6.06 C ATOM 195 O SER A 21 -25.092 3.197 34.628 1.00 8.50 O ATOM 196 CB SER A 21 -27.639 4.263 36.092 1.00 9.02 C ATOM 197 OG SER A 21 -28.528 3.156 35.949 1.00 10.18 O ATOM 198 HG SER A 21 -29.402 3.477 35.613 1.00 0.00 H ATOM 199 H SER A 21 -25.716 5.908 36.475 1.00 0.00 H ATOM 200 N SER A 22 -26.009 1.540 35.893 1.00 3.31 N ATOM 201 CA SER A 22 -25.713 0.474 34.950 1.00 3.26 C ATOM 202 C SER A 22 -26.651 0.489 33.748 1.00 3.93 C ATOM 203 O SER A 22 -26.362 -0.078 32.737 1.00 3.07 O ATOM 204 CB SER A 22 -25.748 -0.866 35.665 1.00 2.79 C ATOM 205 OG SER A 22 -27.037 -1.177 36.143 1.00 2.31 O ATOM 206 HG SER A 22 -27.015 -2.055 36.600 1.00 0.00 H ATOM 207 H SER A 22 -26.457 1.298 36.800 1.00 0.00 H ATOM 208 N ASN A 23 -27.778 1.171 33.894 1.00 6.21 N ATOM 209 CA ASN A 23 -28.732 1.378 32.788 1.00 8.73 C ATOM 210 C ASN A 23 -29.336 2.776 32.812 1.00 9.21 C ATOM 211 O ASN A 23 -30.508 2.967 33.142 1.00 11.20 O ATOM 212 CB ASN A 23 -29.815 0.311 32.770 1.00 12.70 C ATOM 213 CG ASN A 23 -30.588 0.325 31.460 1.00 16.59 C ATOM 214 OD1 ASN A 23 -30.141 0.927 30.487 1.00 21.44 O ATOM 215 ND2 ASN A 23 -31.732 -0.320 31.424 1.00 21.70 N ATOM 216 HD22 ASN A 23 -32.075 -0.817 32.270 1.00 0.00 H ATOM 217 HD21 ASN A 23 -32.294 -0.333 30.549 1.00 0.00 H ATOM 218 H ASN A 23 -27.999 1.577 34.826 1.00 0.00 H ATOM 219 N PRO A 24 -28.543 3.782 32.439 1.00 9.39 N ATOM 220 CA PRO A 24 -29.025 5.146 32.489 1.00 9.40 C ATOM 221 C PRO A 24 -30.154 5.352 31.483 1.00 8.72 C ATOM 222 O PRO A 24 -30.091 4.833 30.361 1.00 10.10 O ATOM 223 CB PRO A 24 -27.813 5.979 32.050 1.00 11.64 C ATOM 224 CG PRO A 24 -26.647 5.089 32.139 1.00 12.36 C ATOM 225 CD PRO A 24 -27.156 3.688 31.970 1.00 9.73 C ATOM 226 N ALA A 25 -31.168 6.110 31.873 1.00 9.79 N ATOM 227 CA ALA A 25 -32.209 6.477 30.932 1.00 10.02 C ATOM 228 C ALA A 25 -31.625 7.242 29.751 1.00 9.72 C ATOM 229 O ALA A 25 -30.633 7.969 29.872 1.00 8.95 O ATOM 230 CB ALA A 25 -33.252 7.349 31.602 1.00 12.94 C ATOM 231 H ALA A 25 -31.218 6.443 32.857 1.00 0.00 H ATOM 232 N ASN A 26 -32.295 7.155 28.620 1.00 9.84 N ATOM 233 CA ASN A 26 -31.955 8.040 27.517 1.00 9.60 C ATOM 234 C ASN A 26 -31.918 9.488 27.953 1.00 8.46 C ATOM 235 O ASN A 26 -32.773 9.940 28.755 1.00 9.37 O ATOM 236 CB ASN A 26 -32.973 7.906 26.393 1.00 10.06 C ATOM 237 CG ASN A 26 -32.791 6.641 25.563 1.00 11.61 C ATOM 238 OD1 ASN A 26 -31.684 6.120 25.387 1.00 10.63 O ATOM 239 ND2 ASN A 26 -33.904 6.137 25.040 1.00 14.48 N ATOM 240 HD22 ASN A 26 -34.817 6.605 25.211 1.00 0.00 H ATOM 241 HD21 ASN A 26 -33.862 5.275 24.460 1.00 0.00 H ATOM 242 H ASN A 26 -33.061 6.459 28.517 1.00 0.00 H ATOM 243 N ASN A 27 -30.910 10.206 27.448 1.00 8.82 N ATOM 244 CA ASN A 27 -30.652 11.624 27.704 1.00 9.24 C ATOM 245 C ASN A 27 -30.062 11.923 29.083 1.00 8.22 C ATOM 246 O ASN A 27 -29.968 13.093 29.500 1.00 10.13 O ATOM 247 CB ASN A 27 -31.863 12.513 27.371 1.00 9.64 C ATOM 248 CG ASN A 27 -32.164 12.489 25.905 1.00 12.50 C ATOM 249 OD1 ASN A 27 -31.236 12.514 25.066 1.00 14.10 O ATOM 250 ND2 ASN A 27 -33.420 12.371 25.571 1.00 18.90 N ATOM 251 HD22 ASN A 27 -34.155 12.355 26.307 1.00 0.00 H ATOM 252 HD21 ASN A 27 -33.686 12.293 24.569 1.00 0.00 H ATOM 253 H ASN A 27 -30.249 9.712 26.815 1.00 0.00 H ATOM 254 N THR A 28 -29.607 10.881 29.767 1.00 7.51 N ATOM 255 CA THR A 28 -28.793 11.086 30.965 1.00 8.61 C ATOM 256 C THR A 28 -27.535 11.843 30.596 1.00 7.90 C ATOM 257 O THR A 28 -26.839 11.478 29.639 1.00 7.92 O ATOM 258 CB THR A 28 -28.421 9.745 31.633 1.00 8.73 C ATOM 259 OG1 THR A 28 -29.613 9.064 32.075 1.00 10.52 O ATOM 260 CG2 THR A 28 -27.515 9.941 32.841 1.00 11.32 C ATOM 261 HG1 THR A 28 -30.199 8.888 31.297 1.00 0.00 H ATOM 262 H THR A 28 -29.830 9.916 29.450 1.00 0.00 H ATOM 263 N LYS A 29 -27.258 12.906 31.334 1.00 7.90 N ATOM 264 CA LYS A 29 -26.048 13.715 31.109 1.00 8.99 C ATOM 265 C LYS A 29 -24.761 12.967 31.445 1.00 8.29 C ATOM 266 O LYS A 29 -24.703 12.157 32.351 1.00 7.82 O ATOM 267 CB LYS A 29 -26.110 15.030 31.877 1.00 10.54 C ATOM 268 CG LYS A 29 -27.178 15.960 31.381 1.00 13.22 C ATOM 269 CD LYS A 29 -27.316 17.151 32.267 1.00 18.40 C ATOM 270 CE LYS A 29 -28.281 18.135 31.617 1.00 25.95 C ATOM 271 NZ LYS A 29 -28.488 19.273 32.542 1.00 35.69 N ATOM 272 HZ1 LYS A 29 -28.887 18.923 33.436 1.00 0.00 H ATOM 273 HZ2 LYS A 29 -27.577 19.739 32.726 1.00 0.00 H ATOM 274 HZ3 LYS A 29 -29.146 19.954 32.111 1.00 0.00 H ATOM 275 H LYS A 29 -27.913 13.178 32.094 1.00 0.00 H ATOM 276 N LEU A 30 -23.727 13.278 30.672 1.00 7.77 N ATOM 277 CA LEU A 30 -22.379 12.804 30.936 1.00 7.05 C ATOM 278 C LEU A 30 -21.613 13.865 31.667 1.00 6.49 C ATOM 279 O LEU A 30 -21.560 15.028 31.232 1.00 8.39 O ATOM 280 CB LEU A 30 -21.710 12.460 29.614 1.00 6.95 C ATOM 281 CG LEU A 30 -22.246 11.159 29.031 1.00 7.06 C ATOM 282 CD1 LEU A 30 -22.058 11.182 27.507 1.00 7.32 C ATOM 283 CD2 LEU A 30 -21.655 9.912 29.657 1.00 7.00 C ATOM 284 H LEU A 30 -23.889 13.886 29.844 1.00 0.00 H ATOM 285 N VAL A 31 -21.060 13.478 32.804 1.00 6.66 N ATOM 286 CA VAL A 31 -20.373 14.406 33.709 1.00 6.57 C ATOM 287 C VAL A 31 -18.971 13.919 33.956 1.00 6.64 C ATOM 288 O VAL A 31 -18.625 12.797 33.606 1.00 7.21 O ATOM 289 CB VAL A 31 -21.116 14.550 35.062 1.00 7.53 C ATOM 290 CG1 VAL A 31 -22.509 15.079 34.844 1.00 9.34 C ATOM 291 CG2 VAL A 31 -21.181 13.232 35.805 1.00 7.28 C ATOM 292 H VAL A 31 -21.114 12.473 33.068 1.00 0.00 H ATOM 293 N LEU A 32 -18.180 14.765 34.615 1.00 7.10 N ATOM 294 CA LEU A 32 -16.884 14.353 35.132 1.00 7.31 C ATOM 295 C LEU A 32 -16.986 14.020 36.614 1.00 7.89 C ATOM 296 O LEU A 32 -17.577 14.790 37.370 1.00 9.12 O ATOM 297 CB LEU A 32 -15.879 15.481 34.895 1.00 8.05 C ATOM 298 CG LEU A 32 -15.634 15.798 33.405 1.00 8.43 C ATOM 299 CD1 LEU A 32 -14.695 17.010 33.222 1.00 10.08 C ATOM 300 CD2 LEU A 32 -15.092 14.602 32.644 1.00 9.86 C ATOM 301 H LEU A 32 -18.497 15.744 34.763 1.00 0.00 H ATOM 302 N HIS A 33 -16.369 12.907 37.005 1.00 7.61 N ATOM 303 CA HIS A 33 -16.349 12.469 38.409 1.00 7.82 C ATOM 304 C HIS A 33 -15.087 11.647 38.674 1.00 8.39 C ATOM 305 O HIS A 33 -14.618 10.916 37.823 1.00 8.05 O ATOM 306 CB HIS A 33 -17.623 11.659 38.714 1.00 7.95 C ATOM 307 CG HIS A 33 -17.924 11.533 40.176 1.00 9.48 C ATOM 308 ND1 HIS A 33 -17.220 10.682 41.006 1.00 11.70 N ATOM 309 CD2 HIS A 33 -18.853 12.142 40.959 1.00 11.65 C ATOM 310 CE1 HIS A 33 -17.675 10.801 42.241 1.00 12.91 C ATOM 311 NE2 HIS A 33 -18.653 11.686 42.245 1.00 12.76 N ATOM 312 H HIS A 33 -15.884 12.326 36.292 1.00 0.00 H ATOM 313 N SER A 34 -14.522 11.801 39.872 1.00 9.27 N ATOM 314 CA SER A 34 -13.304 11.093 40.259 1.00 9.28 C ATOM 315 C SER A 34 -13.429 9.579 40.485 1.00 7.75 C ATOM 316 O SER A 34 -12.430 8.892 40.494 1.00 10.10 O ATOM 317 CB SER A 34 -12.701 11.740 41.510 1.00 12.31 C ATOM 318 OG SER A 34 -13.652 11.888 42.531 1.00 13.98 O ATOM 319 HG SER A 34 -14.007 10.998 42.781 1.00 0.00 H ATOM 320 H SER A 34 -14.964 12.448 40.555 1.00 0.00 H ATOM 321 N ASP A 35 -14.637 9.072 40.744 1.00 8.28 N ATOM 322 CA ASP A 35 -14.815 7.639 41.063 1.00 9.53 C ATOM 323 C ASP A 35 -14.465 6.737 39.876 1.00 8.18 C ATOM 324 O ASP A 35 -14.673 7.118 38.705 1.00 9.84 O ATOM 325 CB ASP A 35 -16.254 7.324 41.517 1.00 10.02 C ATOM 326 CG ASP A 35 -16.542 7.709 42.948 1.00 12.25 C ATOM 327 OD1 ASP A 35 -15.666 8.227 43.704 1.00 15.19 O ATOM 328 OD2 ASP A 35 -17.721 7.506 43.302 1.00 14.48 O ATOM 329 H ASP A 35 -15.468 9.697 40.721 1.00 0.00 H ATOM 330 N ILE A 36 -13.927 5.576 40.183 1.00 9.27 N ATOM 331 CA ILE A 36 -13.743 4.494 39.237 1.00 9.12 C ATOM 332 C ILE A 36 -14.624 3.299 39.616 1.00 10.06 C ATOM 333 O ILE A 36 -14.623 2.865 40.754 1.00 10.56 O ATOM 334 CB ILE A 36 -12.266 4.052 39.128 1.00 11.06 C ATOM 335 CG1 ILE A 36 -11.397 5.231 38.708 1.00 12.27 C ATOM 336 CG2 ILE A 36 -12.155 2.844 38.189 1.00 11.69 C ATOM 337 CD1 ILE A 36 -9.923 4.920 38.741 1.00 13.08 C ATOM 338 H ILE A 36 -13.615 5.426 41.164 1.00 0.00 H ATOM 339 N HIS A 37 -15.398 2.808 38.652 1.00 8.32 N ATOM 340 CA HIS A 37 -16.211 1.608 38.780 1.00 8.60 C ATOM 341 C HIS A 37 -16.702 1.145 37.405 1.00 9.07 C ATOM 342 O HIS A 37 -16.567 1.896 36.418 1.00 7.99 O ATOM 343 CB HIS A 37 -17.415 1.819 39.736 1.00 8.54 C ATOM 344 CG HIS A 37 -18.311 2.975 39.411 1.00 8.04 C ATOM 345 ND1 HIS A 37 -19.085 3.046 38.274 1.00 8.49 N ATOM 346 CD2 HIS A 37 -18.569 4.103 40.107 1.00 8.45 C ATOM 347 CE1 HIS A 37 -19.760 4.180 38.284 1.00 8.90 C ATOM 348 NE2 HIS A 37 -19.463 4.837 39.390 1.00 8.08 N ATOM 349 H HIS A 37 -15.424 3.316 37.745 1.00 0.00 H ATOM 350 N GLU A 38 -17.287 -0.056 37.343 1.00 8.87 N ATOM 351 CA GLU A 38 -17.628 -0.631 36.040 1.00 9.44 C ATOM 352 C GLU A 38 -18.699 0.173 35.259 1.00 8.00 C ATOM 353 O GLU A 38 -18.812 -0.024 34.052 1.00 10.62 O ATOM 354 CB GLU A 38 -17.987 -2.116 36.131 1.00 14.68 C ATOM 355 CG GLU A 38 -19.314 -2.342 36.767 1.00 20.21 C ATOM 356 CD GLU A 38 -19.619 -3.793 37.044 1.00 28.66 C ATOM 357 OE1 GLU A 38 -18.800 -4.664 36.625 1.00 26.75 O ATOM 358 OE2 GLU A 38 -20.698 -4.020 37.672 1.00 33.23 O ATOM 359 H GLU A 38 -17.499 -0.579 38.216 1.00 0.00 H ATOM 360 N ARG A 39 -19.450 1.068 35.901 1.00 8.44 N ATOM 361 CA ARG A 39 -20.460 1.870 35.212 1.00 8.42 C ATOM 362 C ARG A 39 -19.907 3.172 34.597 1.00 7.64 C ATOM 363 O ARG A 39 -20.663 4.027 34.128 1.00 7.89 O ATOM 364 CB ARG A 39 -21.700 2.143 36.105 1.00 9.37 C ATOM 365 CG ARG A 39 -22.427 0.883 36.516 1.00 11.74 C ATOM 366 CD ARG A 39 -22.214 0.471 37.931 1.00 13.91 C ATOM 367 NE ARG A 39 -22.463 1.540 38.891 1.00 11.20 N ATOM 368 CZ ARG A 39 -21.939 1.557 40.106 1.00 12.70 C ATOM 369 NH1 ARG A 39 -21.166 0.568 40.506 1.00 14.04 N ATOM 370 NH2 ARG A 39 -22.170 2.574 40.903 1.00 15.33 N ATOM 371 HE ARG A 39 -23.082 2.326 38.607 1.00 0.00 H ATOM 372 HH12 ARG A 39 -20.755 0.583 41.461 1.00 0.00 H ATOM 373 HH11 ARG A 39 -20.967 -0.228 39.867 1.00 0.00 H ATOM 374 HH22 ARG A 39 -21.759 2.590 41.858 1.00 0.00 H ATOM 375 HH21 ARG A 39 -22.764 3.364 40.579 1.00 0.00 H ATOM 376 H ARG A 39 -19.313 1.200 36.924 1.00 0.00 H ATOM 377 N MET A 40 -18.579 3.321 34.614 1.00 7.01 N ATOM 378 CA MET A 40 -17.929 4.400 33.880 1.00 8.01 C ATOM 379 C MET A 40 -16.904 3.865 32.867 1.00 7.71 C ATOM 380 O MET A 40 -16.111 4.615 32.324 1.00 8.25 O ATOM 381 CB MET A 40 -17.406 5.491 34.822 1.00 7.69 C ATOM 382 CG MET A 40 -16.593 5.021 36.028 1.00 7.93 C ATOM 383 SD MET A 40 -14.997 4.314 35.611 1.00 9.32 S ATOM 384 CE MET A 40 -14.067 5.822 35.356 1.00 8.92 C ATOM 385 H MET A 40 -17.998 2.654 35.161 1.00 0.00 H ATOM 386 N TYR A 41 -16.970 2.562 32.592 1.00 7.10 N ATOM 387 CA TYR A 41 -16.180 1.969 31.513 1.00 7.46 C ATOM 388 C TYR A 41 -16.833 2.266 30.147 1.00 7.67 C ATOM 389 O TYR A 41 -18.064 2.167 29.994 1.00 7.90 O ATOM 390 CB TYR A 41 -16.109 0.475 31.647 1.00 8.46 C ATOM 391 CG TYR A 41 -15.367 -0.101 32.866 1.00 8.56 C ATOM 392 CD1 TYR A 41 -14.750 0.706 33.831 1.00 9.01 C ATOM 393 CD2 TYR A 41 -15.289 -1.490 33.029 1.00 12.05 C ATOM 394 CE1 TYR A 41 -14.101 0.141 34.935 1.00 10.02 C ATOM 395 CE2 TYR A 41 -14.623 -2.051 34.107 1.00 13.03 C ATOM 396 CZ TYR A 41 -14.041 -1.225 35.061 1.00 10.64 C ATOM 397 OH TYR A 41 -13.390 -1.801 36.139 1.00 12.34 O ATOM 398 HH TYR A 41 -13.031 -1.089 36.725 1.00 0.00 H ATOM 399 H TYR A 41 -17.597 1.954 33.157 1.00 0.00 H ATOM 400 N PHE A 42 -15.984 2.520 29.143 1.00 6.53 N ATOM 401 CA PHE A 42 -16.419 2.742 27.762 1.00 6.37 C ATOM 402 C PHE A 42 -15.688 1.806 26.801 1.00 6.75 C ATOM 403 O PHE A 42 -14.621 1.257 27.105 1.00 7.32 O ATOM 404 CB PHE A 42 -16.207 4.218 27.379 1.00 6.47 C ATOM 405 CG PHE A 42 -17.154 5.151 28.085 1.00 6.91 C ATOM 406 CD1 PHE A 42 -16.853 5.666 29.348 1.00 6.92 C ATOM 407 CD2 PHE A 42 -18.391 5.462 27.519 1.00 6.90 C ATOM 408 CE1 PHE A 42 -17.740 6.508 30.015 1.00 8.57 C ATOM 409 CE2 PHE A 42 -19.282 6.279 28.175 1.00 8.02 C ATOM 410 CZ PHE A 42 -18.990 6.771 29.434 1.00 8.07 C ATOM 411 H PHE A 42 -14.966 2.562 29.354 1.00 0.00 H ATOM 412 N GLN A 43 -16.258 1.690 25.606 1.00 7.07 N ATOM 413 CA GLN A 43 -15.631 1.023 24.469 1.00 7.65 C ATOM 414 C GLN A 43 -15.923 1.873 23.245 1.00 7.10 C ATOM 415 O GLN A 43 -16.758 2.768 23.287 1.00 8.17 O ATOM 416 CB GLN A 43 -16.175 -0.409 24.252 1.00 10.58 C ATOM 417 CG GLN A 43 -15.614 -1.396 25.253 1.00 14.77 C ATOM 418 CD GLN A 43 -16.388 -2.731 25.379 1.00 19.50 C ATOM 419 OE1 GLN A 43 -15.997 -3.633 26.183 1.00 25.74 O ATOM 420 NE2 GLN A 43 -17.480 -2.861 24.645 1.00 15.93 N ATOM 421 HE22 GLN A 43 -17.766 -2.098 23.998 1.00 0.00 H ATOM 422 HE21 GLN A 43 -18.053 -3.726 24.714 1.00 0.00 H ATOM 423 H GLN A 43 -17.205 2.098 25.473 1.00 0.00 H ATOM 424 N PHE A 44 -15.168 1.671 22.186 1.00 6.70 N ATOM 425 CA PHE A 44 -15.350 2.442 20.949 1.00 6.91 C ATOM 426 C PHE A 44 -15.636 1.468 19.829 1.00 7.64 C ATOM 427 O PHE A 44 -14.863 0.531 19.585 1.00 8.36 O ATOM 428 CB PHE A 44 -14.114 3.288 20.641 1.00 7.05 C ATOM 429 CG PHE A 44 -14.271 4.231 19.505 1.00 6.51 C ATOM 430 CD1 PHE A 44 -15.083 5.351 19.614 1.00 6.82 C ATOM 431 CD2 PHE A 44 -13.583 4.044 18.318 1.00 8.25 C ATOM 432 CE1 PHE A 44 -15.214 6.259 18.585 1.00 6.77 C ATOM 433 CE2 PHE A 44 -13.723 4.959 17.279 1.00 8.10 C ATOM 434 CZ PHE A 44 -14.505 6.078 17.417 1.00 6.65 C ATOM 435 H PHE A 44 -14.423 0.946 22.226 1.00 0.00 H ATOM 436 N ASP A 45 -16.773 1.678 19.169 1.00 7.22 N ATOM 437 CA ASP A 45 -17.219 0.824 18.071 1.00 8.69 C ATOM 438 C ASP A 45 -16.992 1.575 16.746 1.00 8.51 C ATOM 439 O ASP A 45 -17.693 2.546 16.415 1.00 7.89 O ATOM 440 CB ASP A 45 -18.679 0.495 18.242 1.00 10.13 C ATOM 441 CG ASP A 45 -18.953 -0.477 19.410 1.00 13.27 C ATOM 442 OD1 ASP A 45 -18.034 -1.152 19.908 1.00 17.88 O ATOM 443 OD2 ASP A 45 -20.121 -0.567 19.845 1.00 17.30 O ATOM 444 H ASP A 45 -17.369 2.484 19.447 1.00 0.00 H ATOM 445 N VAL A 46 -15.971 1.131 16.004 1.00 8.31 N ATOM 446 CA VAL A 46 -15.596 1.781 14.760 1.00 8.15 C ATOM 447 C VAL A 46 -16.690 1.598 13.721 1.00 8.01 C ATOM 448 O VAL A 46 -17.177 0.478 13.551 1.00 9.44 O ATOM 449 CB VAL A 46 -14.254 1.236 14.237 1.00 9.61 C ATOM 450 CG1 VAL A 46 -13.946 1.829 12.874 1.00 12.37 C ATOM 451 CG2 VAL A 46 -13.139 1.526 15.230 1.00 10.51 C ATOM 452 H VAL A 46 -15.433 0.301 16.325 1.00 0.00 H ATOM 453 N VAL A 47 -17.079 2.706 13.078 1.00 7.60 N ATOM 454 CA VAL A 47 -18.043 2.728 11.983 1.00 9.42 C ATOM 455 C VAL A 47 -17.369 2.954 10.629 1.00 10.20 C ATOM 456 O VAL A 47 -17.662 2.243 9.680 1.00 13.18 O ATOM 457 CB VAL A 47 -19.121 3.778 12.236 1.00 10.24 C ATOM 458 CG1 VAL A 47 -20.057 3.902 11.046 1.00 13.85 C ATOM 459 CG2 VAL A 47 -19.917 3.378 13.458 1.00 10.40 C ATOM 460 H VAL A 47 -16.666 3.612 13.379 1.00 0.00 H ATOM 461 N ASP A 48 -16.507 3.960 10.557 1.00 9.36 N ATOM 462 CA ASP A 48 -15.881 4.399 9.302 1.00 10.62 C ATOM 463 C ASP A 48 -14.540 5.039 9.636 1.00 9.40 C ATOM 464 O ASP A 48 -14.465 6.242 9.920 1.00 9.55 O ATOM 465 CB ASP A 48 -16.804 5.407 8.604 1.00 16.70 C ATOM 466 CG ASP A 48 -16.186 6.051 7.354 1.00 21.14 C ATOM 467 OD1 ASP A 48 -15.236 5.488 6.785 1.00 22.85 O ATOM 468 OD2 ASP A 48 -16.680 7.137 6.930 1.00 32.04 O ATOM 469 H ASP A 48 -16.262 4.464 11.433 1.00 0.00 H ATOM 470 N GLU A 49 -13.493 4.218 9.602 1.00 9.33 N ATOM 471 CA GLU A 49 -12.120 4.657 9.819 1.00 9.61 C ATOM 472 C GLU A 49 -11.961 5.299 11.204 1.00 8.94 C ATOM 473 O GLU A 49 -12.044 4.554 12.203 1.00 11.10 O ATOM 474 CB GLU A 49 -11.603 5.513 8.644 1.00 9.65 C ATOM 475 CG GLU A 49 -10.110 5.881 8.704 1.00 9.65 C ATOM 476 CD GLU A 49 -9.818 7.383 8.816 1.00 9.09 C ATOM 477 OE1 GLU A 49 -10.761 8.233 9.025 1.00 8.88 O ATOM 478 OE2 GLU A 49 -8.620 7.741 8.722 1.00 9.26 O ATOM 479 H GLU A 49 -13.663 3.210 9.411 1.00 0.00 H ATOM 480 N ARG A 50 -11.791 6.637 11.293 1.00 7.68 N ATOM 481 CA ARG A 50 -11.630 7.259 12.606 1.00 6.32 C ATOM 482 C ARG A 50 -12.963 7.368 13.347 1.00 6.50 C ATOM 483 O ARG A 50 -12.968 7.579 14.569 1.00 7.31 O ATOM 484 CB ARG A 50 -11.001 8.648 12.520 1.00 7.17 C ATOM 485 CG ARG A 50 -11.862 9.685 11.864 1.00 7.69 C ATOM 486 CD ARG A 50 -11.077 10.907 11.405 1.00 9.34 C ATOM 487 NE ARG A 50 -10.103 10.517 10.397 1.00 8.98 N ATOM 488 CZ ARG A 50 -8.945 11.101 10.155 1.00 8.69 C ATOM 489 NH1 ARG A 50 -8.597 12.238 10.748 1.00 9.79 N ATOM 490 NH2 ARG A 50 -8.162 10.566 9.242 1.00 10.34 N ATOM 491 HE ARG A 50 -10.344 9.695 9.808 1.00 0.00 H ATOM 492 HH12 ARG A 50 -7.677 12.674 10.537 1.00 0.00 H ATOM 493 HH11 ARG A 50 -9.245 12.692 11.424 1.00 0.00 H ATOM 494 HH22 ARG A 50 -7.242 11.001 9.026 1.00 0.00 H ATOM 495 HH21 ARG A 50 -8.463 9.709 8.736 1.00 0.00 H ATOM 496 H ARG A 50 -11.775 7.221 10.432 1.00 0.00 H ATOM 497 N TRP A 51 -14.077 7.329 12.604 1.00 6.19 N ATOM 498 CA TRP A 51 -15.392 7.632 13.148 1.00 6.70 C ATOM 499 C TRP A 51 -16.056 6.413 13.735 1.00 5.92 C ATOM 500 O TRP A 51 -16.051 5.351 13.161 1.00 6.62 O ATOM 501 CB TRP A 51 -16.309 8.269 12.092 1.00 7.17 C ATOM 502 CG TRP A 51 -15.712 9.525 11.520 1.00 6.94 C ATOM 503 CD1 TRP A 51 -15.165 9.670 10.283 1.00 9.39 C ATOM 504 CD2 TRP A 51 -15.525 10.776 12.189 1.00 7.74 C ATOM 505 NE1 TRP A 51 -14.677 10.944 10.133 1.00 10.85 N ATOM 506 CE2 TRP A 51 -14.862 11.636 11.299 1.00 9.00 C ATOM 507 CE3 TRP A 51 -15.841 11.252 13.475 1.00 7.77 C ATOM 508 CZ2 TRP A 51 -14.518 12.946 11.638 1.00 10.39 C ATOM 509 CZ3 TRP A 51 -15.498 12.560 13.803 1.00 9.93 C ATOM 510 CH2 TRP A 51 -14.849 13.388 12.887 1.00 10.35 C ATOM 511 HE1 TRP A 51 -14.237 11.323 9.270 1.00 0.00 H ATOM 512 H TRP A 51 -13.999 7.072 11.599 1.00 0.00 H ATOM 513 N GLY A 52 -16.632 6.589 14.919 1.00 5.87 N ATOM 514 CA GLY A 52 -17.352 5.500 15.576 1.00 5.95 C ATOM 515 C GLY A 52 -18.206 5.966 16.736 1.00 5.60 C ATOM 516 O GLY A 52 -18.374 7.182 16.970 1.00 5.28 O ATOM 517 H GLY A 52 -16.570 7.516 15.386 1.00 0.00 H ATOM 518 N TYR A 53 -18.779 4.991 17.426 1.00 5.36 N ATOM 519 CA TYR A 53 -19.624 5.249 18.579 1.00 5.52 C ATOM 520 C TYR A 53 -18.856 5.035 19.871 1.00 6.10 C ATOM 521 O TYR A 53 -18.167 4.037 20.025 1.00 6.33 O ATOM 522 CB TYR A 53 -20.849 4.335 18.569 1.00 5.58 C ATOM 523 CG TYR A 53 -21.667 4.336 17.253 1.00 5.95 C ATOM 524 CD1 TYR A 53 -22.135 5.510 16.708 1.00 6.39 C ATOM 525 CD2 TYR A 53 -21.987 3.142 16.610 1.00 8.15 C ATOM 526 CE1 TYR A 53 -22.904 5.517 15.572 1.00 8.97 C ATOM 527 CE2 TYR A 53 -22.737 3.150 15.436 1.00 9.02 C ATOM 528 CZ TYR A 53 -23.209 4.328 14.950 1.00 8.14 C ATOM 529 OH TYR A 53 -23.964 4.348 13.782 1.00 13.09 O ATOM 530 HH TYR A 53 -24.224 5.280 13.574 1.00 0.00 H ATOM 531 H TYR A 53 -18.618 4.006 17.132 1.00 0.00 H ATOM 532 N ILE A 54 -19.038 5.964 20.796 1.00 5.87 N ATOM 533 CA ILE A 54 -18.508 5.842 22.146 1.00 5.66 C ATOM 534 C ILE A 54 -19.570 5.160 23.026 1.00 5.59 C ATOM 535 O ILE A 54 -20.598 5.757 23.339 1.00 6.86 O ATOM 536 CB ILE A 54 -18.118 7.174 22.738 1.00 6.59 C ATOM 537 CG1 ILE A 54 -17.173 7.951 21.830 1.00 7.27 C ATOM 538 CG2 ILE A 54 -17.437 6.925 24.110 1.00 6.75 C ATOM 539 CD1 ILE A 54 -16.960 9.406 22.200 1.00 9.25 C ATOM 540 H ILE A 54 -19.582 6.815 20.548 1.00 0.00 H ATOM 541 N LYS A 55 -19.316 3.917 23.378 1.00 6.26 N ATOM 542 CA LYS A 55 -20.319 3.063 24.017 1.00 6.34 C ATOM 543 C LYS A 55 -20.074 2.891 25.517 1.00 6.64 C ATOM 544 O LYS A 55 -19.006 2.511 25.934 1.00 8.18 O ATOM 545 CB LYS A 55 -20.373 1.703 23.338 1.00 7.65 C ATOM 546 CG LYS A 55 -21.487 0.833 23.860 1.00 9.51 C ATOM 547 CD LYS A 55 -21.688 -0.386 22.973 1.00 13.44 C ATOM 548 CE LYS A 55 -20.589 -1.397 23.078 1.00 18.24 C ATOM 549 NZ LYS A 55 -20.725 -2.344 21.929 1.00 22.66 N ATOM 550 HZ1 LYS A 55 -21.652 -2.813 21.976 1.00 0.00 H ATOM 551 HZ2 LYS A 55 -20.646 -1.817 21.036 1.00 0.00 H ATOM 552 HZ3 LYS A 55 -19.971 -3.058 21.979 1.00 0.00 H ATOM 553 H LYS A 55 -18.369 3.528 23.196 1.00 0.00 H ATOM 554 N HIS A 56 -21.097 3.194 26.301 1.00 5.78 N ATOM 555 CA HIS A 56 -21.136 2.906 27.732 1.00 6.12 C ATOM 556 C HIS A 56 -21.273 1.393 27.920 1.00 6.80 C ATOM 557 O HIS A 56 -22.303 0.784 27.559 1.00 8.52 O ATOM 558 CB HIS A 56 -22.324 3.663 28.314 1.00 6.61 C ATOM 559 CG HIS A 56 -22.499 3.506 29.786 1.00 6.85 C ATOM 560 ND1 HIS A 56 -23.643 2.982 30.360 1.00 7.64 N ATOM 561 CD2 HIS A 56 -21.668 3.810 30.801 1.00 7.65 C ATOM 562 CE1 HIS A 56 -23.498 2.960 31.676 1.00 7.57 C ATOM 563 NE2 HIS A 56 -22.313 3.479 31.966 1.00 8.32 N ATOM 564 H HIS A 56 -21.920 3.664 25.873 1.00 0.00 H ATOM 565 N VAL A 57 -20.261 0.757 28.487 1.00 7.22 N ATOM 566 CA VAL A 57 -20.247 -0.722 28.484 1.00 7.52 C ATOM 567 C VAL A 57 -21.433 -1.323 29.243 1.00 8.40 C ATOM 568 O VAL A 57 -22.057 -2.289 28.795 1.00 9.91 O ATOM 569 CB VAL A 57 -18.923 -1.248 29.012 1.00 9.24 C ATOM 570 CG1 VAL A 57 -18.935 -2.763 29.165 1.00 11.98 C ATOM 571 CG2 VAL A 57 -17.786 -0.805 28.099 1.00 9.41 C ATOM 572 H VAL A 57 -19.485 1.290 28.929 1.00 0.00 H ATOM 573 N ALA A 58 -21.733 -0.763 30.403 1.00 8.56 N ATOM 574 CA ALA A 58 -22.751 -1.361 31.274 1.00 9.65 C ATOM 575 C ALA A 58 -24.133 -1.389 30.627 1.00 9.49 C ATOM 576 O ALA A 58 -24.856 -2.360 30.794 1.00 13.03 O ATOM 577 CB ALA A 58 -22.799 -0.649 32.611 1.00 10.68 C ATOM 578 H ALA A 58 -21.245 0.106 30.699 1.00 0.00 H ATOM 579 N SER A 59 -24.470 -0.361 29.852 1.00 8.49 N ATOM 580 CA SER A 59 -25.811 -0.232 29.277 1.00 8.27 C ATOM 581 C SER A 59 -25.925 -0.519 27.782 1.00 9.20 C ATOM 582 O SER A 59 -27.041 -0.793 27.296 1.00 10.77 O ATOM 583 CB SER A 59 -26.361 1.162 29.550 1.00 8.70 C ATOM 584 OG SER A 59 -25.719 2.156 28.769 1.00 9.01 O ATOM 585 HG SER A 59 -24.751 2.162 28.975 1.00 0.00 H ATOM 586 H SER A 59 -23.761 0.372 29.649 1.00 0.00 H ATOM 587 N GLY A 60 -24.808 -0.379 27.072 1.00 9.34 N ATOM 588 CA GLY A 60 -24.810 -0.328 25.590 1.00 9.30 C ATOM 589 C GLY A 60 -25.300 0.946 24.969 1.00 8.17 C ATOM 590 O GLY A 60 -25.342 1.040 23.733 1.00 10.87 O ATOM 591 H GLY A 60 -23.901 -0.303 27.575 1.00 0.00 H ATOM 592 N LYS A 61 -25.696 1.924 25.763 1.00 7.80 N ATOM 593 CA LYS A 61 -26.034 3.218 25.203 1.00 8.09 C ATOM 594 C LYS A 61 -24.734 3.909 24.756 1.00 7.32 C ATOM 595 O LYS A 61 -23.654 3.570 25.217 1.00 7.99 O ATOM 596 CB LYS A 61 -26.854 4.075 26.159 1.00 8.04 C ATOM 597 CG LYS A 61 -28.220 3.476 26.477 1.00 10.14 C ATOM 598 CD LYS A 61 -29.101 4.481 27.228 1.00 10.36 C ATOM 599 CE LYS A 61 -30.546 4.013 27.416 1.00 14.18 C ATOM 600 NZ LYS A 61 -30.646 2.881 28.324 1.00 16.87 N ATOM 601 HZ1 LYS A 61 -30.096 2.084 27.945 1.00 0.00 H ATOM 602 HZ2 LYS A 61 -30.271 3.151 29.255 1.00 0.00 H ATOM 603 HZ3 LYS A 61 -31.643 2.601 28.419 1.00 0.00 H ATOM 604 H LYS A 61 -25.765 1.766 26.789 1.00 0.00 H ATOM 605 N ILE A 62 -24.878 4.887 23.879 1.00 6.82 N ATOM 606 CA ILE A 62 -23.747 5.616 23.316 1.00 6.24 C ATOM 607 C ILE A 62 -23.833 7.133 23.524 1.00 6.70 C ATOM 608 O ILE A 62 -24.890 7.689 23.864 1.00 6.27 O ATOM 609 CB ILE A 62 -23.521 5.267 21.816 1.00 6.85 C ATOM 610 CG1 ILE A 62 -24.630 5.791 20.921 1.00 7.07 C ATOM 611 CG2 ILE A 62 -23.289 3.771 21.627 1.00 7.87 C ATOM 612 CD1 ILE A 62 -24.257 5.645 19.452 1.00 7.52 C ATOM 613 H ILE A 62 -25.838 5.148 23.577 1.00 0.00 H ATOM 614 N VAL A 63 -22.689 7.797 23.393 1.00 6.68 N ATOM 615 CA VAL A 63 -22.591 9.231 23.573 1.00 6.06 C ATOM 616 C VAL A 63 -23.241 9.962 22.397 1.00 6.16 C ATOM 617 O VAL A 63 -23.007 9.614 21.229 1.00 7.24 O ATOM 618 CB VAL A 63 -21.132 9.676 23.722 1.00 5.89 C ATOM 619 CG1 VAL A 63 -21.040 11.192 23.889 1.00 6.53 C ATOM 620 CG2 VAL A 63 -20.444 8.941 24.889 1.00 6.41 C ATOM 621 H VAL A 63 -21.829 7.265 23.151 1.00 0.00 H ATOM 622 N HIS A 64 -24.074 10.955 22.721 1.00 6.37 N ATOM 623 CA HIS A 64 -24.674 11.836 21.737 1.00 6.22 C ATOM 624 C HIS A 64 -24.547 13.293 22.215 1.00 6.37 C ATOM 625 O HIS A 64 -24.637 13.567 23.444 1.00 6.99 O ATOM 626 CB HIS A 64 -26.196 11.611 21.645 1.00 7.19 C ATOM 627 CG HIS A 64 -26.614 10.335 21.002 1.00 7.21 C ATOM 628 ND1 HIS A 64 -27.357 10.301 19.834 1.00 8.85 N ATOM 629 CD2 HIS A 64 -26.411 9.054 21.346 1.00 6.76 C ATOM 630 CE1 HIS A 64 -27.606 9.046 19.514 1.00 8.06 C ATOM 631 NE2 HIS A 64 -27.043 8.270 20.410 1.00 7.54 N ATOM 632 H HIS A 64 -24.303 11.103 23.725 1.00 0.00 H ATOM 633 N PRO A 65 -24.516 14.233 21.269 1.00 7.65 N ATOM 634 CA PRO A 65 -24.919 15.596 21.632 1.00 8.40 C ATOM 635 C PRO A 65 -26.444 15.606 21.838 1.00 9.34 C ATOM 636 O PRO A 65 -27.177 15.018 21.036 1.00 10.19 O ATOM 637 CB PRO A 65 -24.558 16.417 20.398 1.00 10.18 C ATOM 638 CG PRO A 65 -24.694 15.448 19.247 1.00 10.60 C ATOM 639 CD PRO A 65 -24.428 14.058 19.794 1.00 7.89 C ATOM 640 N TYR A 66 -26.916 16.262 22.904 1.00 9.84 N ATOM 641 CA TYR A 66 -28.353 16.281 23.162 1.00 10.97 C ATOM 642 C TYR A 66 -29.077 16.854 21.974 1.00 12.15 C ATOM 643 O TYR A 66 -28.709 17.927 21.508 1.00 13.33 O ATOM 644 CB TYR A 66 -28.676 17.080 24.439 1.00 12.26 C ATOM 645 CG TYR A 66 -30.148 17.170 24.687 1.00 15.00 C ATOM 646 CD1 TYR A 66 -30.863 16.042 25.037 1.00 14.60 C ATOM 647 CD2 TYR A 66 -30.822 18.347 24.503 1.00 19.25 C ATOM 648 CE1 TYR A 66 -32.215 16.091 25.247 1.00 20.08 C ATOM 649 CE2 TYR A 66 -32.192 18.418 24.708 1.00 26.77 C ATOM 650 CZ TYR A 66 -32.881 17.277 25.072 1.00 25.87 C ATOM 651 OH TYR A 66 -34.248 17.287 25.297 1.00 36.79 O ATOM 652 HH TYR A 66 -34.547 16.377 25.546 1.00 0.00 H ATOM 653 H TYR A 66 -26.263 16.756 23.545 1.00 0.00 H ATOM 654 N GLY A 67 -30.091 16.139 21.490 1.00 12.12 N ATOM 655 CA GLY A 67 -30.843 16.589 20.327 1.00 14.09 C ATOM 656 C GLY A 67 -30.385 16.001 18.991 1.00 12.58 C ATOM 657 O GLY A 67 -31.106 16.126 17.994 1.00 13.83 O ATOM 658 H GLY A 67 -30.350 15.243 21.951 1.00 0.00 H ATOM 659 N GLY A 68 -29.177 15.425 18.954 1.00 11.22 N ATOM 660 CA GLY A 68 -28.706 14.716 17.787 1.00 12.45 C ATOM 661 C GLY A 68 -28.536 15.521 16.508 1.00 11.89 C ATOM 662 O GLY A 68 -28.846 15.025 15.425 1.00 13.21 O ATOM 663 H GLY A 68 -28.560 15.490 19.789 1.00 0.00 H ATOM 664 N GLN A 69 -28.072 16.757 16.636 1.00 12.45 N ATOM 665 CA GLN A 69 -27.844 17.618 15.475 1.00 12.23 C ATOM 666 C GLN A 69 -26.541 17.255 14.789 1.00 13.08 C ATOM 667 O GLN A 69 -25.602 16.768 15.415 1.00 12.90 O ATOM 668 CB GLN A 69 -27.831 19.085 15.879 1.00 14.19 C ATOM 669 CG GLN A 69 -29.109 19.600 16.482 1.00 15.66 C ATOM 670 CD GLN A 69 -28.898 20.847 17.327 1.00 19.43 C ATOM 671 OE1 GLN A 69 -28.179 20.829 18.340 1.00 20.50 O ATOM 672 NE2 GLN A 69 -29.540 21.929 16.940 1.00 25.35 N ATOM 673 HE22 GLN A 69 -30.133 21.904 16.086 1.00 0.00 H ATOM 674 HE21 GLN A 69 -29.455 22.808 17.488 1.00 0.00 H ATOM 675 H GLN A 69 -27.865 17.124 17.587 1.00 0.00 H ATOM 676 N ALA A 70 -26.470 17.494 13.483 1.00 13.33 N ATOM 677 CA ALA A 70 -25.213 17.259 12.748 1.00 13.66 C ATOM 678 C ALA A 70 -24.168 18.279 13.151 1.00 13.50 C ATOM 679 O ALA A 70 -22.970 17.951 13.199 1.00 14.29 O ATOM 680 CB ALA A 70 -25.460 17.330 11.254 1.00 16.67 C ATOM 681 H ALA A 70 -27.306 17.849 12.976 1.00 0.00 H ATOM 682 N ASN A 71 -24.631 19.505 13.455 1.00 12.78 N ATOM 683 CA ASN A 71 -23.775 20.622 13.823 1.00 13.71 C ATOM 684 C ASN A 71 -24.267 21.227 15.134 1.00 13.11 C ATOM 685 O ASN A 71 -24.824 22.331 15.147 1.00 14.23 O ATOM 686 CB ASN A 71 -23.792 21.718 12.739 1.00 18.84 C ATOM 687 CG ASN A 71 -23.177 21.263 11.437 1.00 23.68 C ATOM 688 OD1 ASN A 71 -21.998 20.921 11.375 1.00 29.99 O ATOM 689 ND2 ASN A 71 -23.968 21.281 10.389 1.00 34.64 N ATOM 690 HD22 ASN A 71 -24.959 21.578 10.491 1.00 0.00 H ATOM 691 HD21 ASN A 71 -23.603 20.998 9.457 1.00 0.00 H ATOM 692 H ASN A 71 -25.658 19.663 13.425 1.00 0.00 H ATOM 693 N PRO A 72 -24.076 20.495 16.250 1.00 13.17 N ATOM 694 CA PRO A 72 -24.577 21.054 17.513 1.00 11.60 C ATOM 695 C PRO A 72 -23.858 22.348 17.855 1.00 12.06 C ATOM 696 O PRO A 72 -22.630 22.430 17.676 1.00 12.27 O ATOM 697 CB PRO A 72 -24.235 19.975 18.530 1.00 11.63 C ATOM 698 CG PRO A 72 -23.142 19.154 17.903 1.00 11.84 C ATOM 699 CD PRO A 72 -23.423 19.185 16.424 1.00 11.33 C ATOM 700 N PRO A 73 -24.592 23.346 18.370 1.00 13.39 N ATOM 701 CA PRO A 73 -23.896 24.568 18.777 1.00 14.79 C ATOM 702 C PRO A 73 -23.064 24.394 20.017 1.00 12.67 C ATOM 703 O PRO A 73 -23.244 23.431 20.793 1.00 12.42 O ATOM 704 CB PRO A 73 -25.018 25.574 19.021 1.00 16.30 C ATOM 705 CG PRO A 73 -26.246 24.773 19.177 1.00 18.72 C ATOM 706 CD PRO A 73 -26.060 23.484 18.441 1.00 15.42 C ATOM 707 N ASN A 74 -22.161 25.336 20.222 1.00 12.85 N ATOM 708 CA ASN A 74 -21.404 25.382 21.457 1.00 13.40 C ATOM 709 C ASN A 74 -22.373 25.322 22.651 1.00 15.09 C ATOM 710 O ASN A 74 -23.497 25.889 22.608 1.00 16.26 O ATOM 711 CB ASN A 74 -20.599 26.665 21.533 1.00 14.62 C ATOM 712 CG ASN A 74 -19.461 26.696 20.553 1.00 15.35 C ATOM 713 OD1 ASN A 74 -18.989 25.653 20.095 1.00 14.38 O ATOM 714 ND2 ASN A 74 -18.968 27.884 20.271 1.00 16.39 N ATOM 715 HD22 ASN A 74 -19.400 28.737 20.681 1.00 0.00 H ATOM 716 HD21 ASN A 74 -18.147 27.970 19.638 1.00 0.00 H ATOM 717 H ASN A 74 -21.991 26.053 19.488 1.00 0.00 H ATOM 718 N GLU A 75 -21.929 24.605 23.683 1.00 12.34 N ATOM 719 CA GLU A 75 -22.644 24.425 24.952 1.00 15.51 C ATOM 720 C GLU A 75 -23.730 23.374 24.944 1.00 14.37 C ATOM 721 O GLU A 75 -24.381 23.151 25.955 1.00 16.38 O ATOM 722 CB GLU A 75 -23.229 25.734 25.461 1.00 19.70 C ATOM 723 CG GLU A 75 -22.135 26.764 25.658 1.00 20.97 C ATOM 724 CD GLU A 75 -21.097 26.307 26.680 1.00 26.50 C ATOM 725 OE1 GLU A 75 -21.480 25.914 27.795 1.00 40.63 O ATOM 726 OE2 GLU A 75 -19.889 26.350 26.377 1.00 35.00 O ATOM 727 H GLU A 75 -21.006 24.137 23.581 1.00 0.00 H ATOM 728 N THR A 76 -23.914 22.707 23.819 1.00 12.80 N ATOM 729 CA THR A 76 -24.873 21.573 23.767 1.00 11.94 C ATOM 730 C THR A 76 -24.404 20.465 24.723 1.00 11.30 C ATOM 731 O THR A 76 -23.225 20.080 24.695 1.00 9.56 O ATOM 732 CB THR A 76 -24.948 20.995 22.361 1.00 11.83 C ATOM 733 OG1 THR A 76 -25.430 21.986 21.458 1.00 13.67 O ATOM 734 CG2 THR A 76 -25.864 19.783 22.313 1.00 12.75 C ATOM 735 HG1 THR A 76 -24.815 22.761 21.462 1.00 0.00 H ATOM 736 H THR A 76 -23.385 22.977 22.965 1.00 0.00 H ATOM 737 N ASN A 77 -25.308 19.979 25.572 1.00 12.54 N ATOM 738 CA ASN A 77 -24.946 18.969 26.552 1.00 12.59 C ATOM 739 C ASN A 77 -24.636 17.633 25.900 1.00 9.94 C ATOM 740 O ASN A 77 -25.277 17.247 24.919 1.00 10.50 O ATOM 741 CB ASN A 77 -26.060 18.715 27.559 1.00 14.18 C ATOM 742 CG ASN A 77 -26.100 19.757 28.634 1.00 17.48 C ATOM 743 OD1 ASN A 77 -26.754 20.773 28.474 1.00 19.66 O ATOM 744 ND2 ASN A 77 -25.379 19.525 29.727 1.00 16.39 N ATOM 745 HD22 ASN A 77 -24.838 18.641 29.815 1.00 0.00 H ATOM 746 HD21 ASN A 77 -25.356 20.227 30.494 1.00 0.00 H ATOM 747 H ASN A 77 -26.287 20.327 25.533 1.00 0.00 H ATOM 748 N MET A 78 -23.644 16.947 26.446 1.00 6.92 N ATOM 749 CA MET A 78 -23.432 15.546 26.089 1.00 7.42 C ATOM 750 C MET A 78 -24.302 14.637 26.936 1.00 7.31 C ATOM 751 O MET A 78 -24.399 14.824 28.147 1.00 8.01 O ATOM 752 CB MET A 78 -21.967 15.145 26.293 1.00 7.33 C ATOM 753 CG MET A 78 -20.948 16.082 25.630 1.00 8.38 C ATOM 754 SD MET A 78 -21.279 16.429 23.894 1.00 11.13 S ATOM 755 CE MET A 78 -21.215 14.787 23.208 1.00 10.60 C ATOM 756 H MET A 78 -23.013 17.407 27.132 1.00 0.00 H ATOM 757 N VAL A 79 -24.870 13.626 26.304 1.00 7.33 N ATOM 758 CA VAL A 79 -25.746 12.653 26.954 1.00 7.48 C ATOM 759 C VAL A 79 -25.490 11.237 26.428 1.00 7.73 C ATOM 760 O VAL A 79 -24.839 11.061 25.412 1.00 7.74 O ATOM 761 CB VAL A 79 -27.257 12.994 26.710 1.00 8.56 C ATOM 762 CG1 VAL A 79 -27.575 14.400 27.193 1.00 9.65 C ATOM 763 CG2 VAL A 79 -27.649 12.825 25.227 1.00 9.16 C ATOM 764 H VAL A 79 -24.684 13.516 25.287 1.00 0.00 H ATOM 765 N LEU A 80 -26.068 10.240 27.098 1.00 6.73 N ATOM 766 CA LEU A 80 -26.162 8.888 26.584 1.00 7.13 C ATOM 767 C LEU A 80 -27.541 8.715 25.951 1.00 7.89 C ATOM 768 O LEU A 80 -28.553 9.225 26.470 1.00 8.14 O ATOM 769 CB LEU A 80 -25.976 7.837 27.682 1.00 7.68 C ATOM 770 CG LEU A 80 -24.578 7.734 28.238 1.00 7.64 C ATOM 771 CD1 LEU A 80 -24.587 6.747 29.387 1.00 8.96 C ATOM 772 CD2 LEU A 80 -23.588 7.304 27.172 1.00 7.80 C ATOM 773 H LEU A 80 -26.471 10.442 28.035 1.00 0.00 H ATOM 774 N HIS A 81 -27.589 7.946 24.867 1.00 7.54 N ATOM 775 CA HIS A 81 -28.867 7.596 24.221 1.00 9.10 C ATOM 776 C HIS A 81 -28.674 6.265 23.485 1.00 8.81 C ATOM 777 O HIS A 81 -27.546 5.985 23.004 1.00 8.59 O ATOM 778 CB HIS A 81 -29.296 8.710 23.269 1.00 9.43 C ATOM 779 CG HIS A 81 -30.757 8.691 22.915 1.00 10.57 C ATOM 780 ND1 HIS A 81 -31.292 7.798 22.021 1.00 11.42 N ATOM 781 CD2 HIS A 81 -31.776 9.492 23.300 1.00 11.85 C ATOM 782 CE1 HIS A 81 -32.592 8.031 21.883 1.00 10.41 C ATOM 783 NE2 HIS A 81 -32.896 9.086 22.622 1.00 9.74 N ATOM 784 H HIS A 81 -26.702 7.582 24.465 1.00 0.00 H ATOM 785 N GLN A 82 -29.733 5.435 23.411 1.00 8.61 N ATOM 786 CA GLN A 82 -29.706 4.134 22.734 1.00 9.05 C ATOM 787 C GLN A 82 -29.494 4.233 21.211 1.00 8.79 C ATOM 788 O GLN A 82 -28.999 3.326 20.593 1.00 10.28 O ATOM 789 CB GLN A 82 -31.028 3.371 22.993 1.00 9.96 C ATOM 790 CG GLN A 82 -32.288 3.999 22.348 1.00 11.23 C ATOM 791 CD GLN A 82 -33.629 3.329 22.759 1.00 11.74 C ATOM 792 OE1 GLN A 82 -34.202 3.690 23.761 1.00 10.02 O ATOM 793 NE2 GLN A 82 -34.146 2.389 21.940 1.00 10.98 N ATOM 794 HE22 GLN A 82 -33.627 2.101 21.086 1.00 0.00 H ATOM 795 HE21 GLN A 82 -35.063 1.952 22.163 1.00 0.00 H ATOM 796 H GLN A 82 -30.622 5.734 23.860 1.00 0.00 H ATOM 797 N ASP A 83 -29.928 5.327 20.613 1.00 10.02 N ATOM 798 CA ASP A 83 -29.985 5.443 19.139 1.00 9.81 C ATOM 799 C ASP A 83 -28.602 5.420 18.525 1.00 9.94 C ATOM 800 O ASP A 83 -27.621 5.934 19.088 1.00 10.21 O ATOM 801 CB ASP A 83 -30.666 6.746 18.709 1.00 10.05 C ATOM 802 CG ASP A 83 -32.184 6.716 18.862 1.00 10.66 C ATOM 803 OD1 ASP A 83 -32.725 5.654 19.252 1.00 11.53 O ATOM 804 OD2 ASP A 83 -32.811 7.776 18.559 1.00 12.04 O ATOM 805 H ASP A 83 -30.239 6.131 21.195 1.00 0.00 H ATOM 806 N ARG A 84 -28.536 4.819 17.350 1.00 9.69 N ATOM 807 CA ARG A 84 -27.349 4.872 16.504 1.00 10.17 C ATOM 808 C ARG A 84 -27.717 5.633 15.234 1.00 10.85 C ATOM 809 O ARG A 84 -28.703 5.295 14.552 1.00 12.59 O ATOM 810 CB ARG A 84 -26.928 3.472 16.108 1.00 10.46 C ATOM 811 CG ARG A 84 -25.986 2.774 17.040 1.00 11.81 C ATOM 812 CD ARG A 84 -26.510 2.554 18.430 1.00 12.10 C ATOM 813 NE ARG A 84 -25.574 1.693 19.149 1.00 12.36 N ATOM 814 CZ ARG A 84 -25.670 1.374 20.438 1.00 11.95 C ATOM 815 NH1 ARG A 84 -26.624 1.889 21.184 1.00 11.38 N ATOM 816 NH2 ARG A 84 -24.770 0.565 20.977 1.00 12.64 N ATOM 817 HE ARG A 84 -24.773 1.300 18.614 1.00 0.00 H ATOM 818 HH12 ARG A 84 -26.692 1.635 22.190 1.00 0.00 H ATOM 819 HH11 ARG A 84 -27.310 2.550 20.767 1.00 0.00 H ATOM 820 HH22 ARG A 84 -24.836 0.310 21.983 1.00 0.00 H ATOM 821 HH21 ARG A 84 -23.997 0.185 20.394 1.00 0.00 H ATOM 822 H ARG A 84 -29.364 4.287 17.015 1.00 0.00 H ATOM 823 N HIS A 85 -26.929 6.642 14.913 1.00 10.60 N ATOM 824 CA HIS A 85 -27.065 7.368 13.653 1.00 10.69 C ATOM 825 C HIS A 85 -25.802 8.189 13.506 1.00 10.31 C ATOM 826 O HIS A 85 -24.957 8.236 14.436 1.00 9.97 O ATOM 827 CB HIS A 85 -28.331 8.253 13.592 1.00 11.21 C ATOM 828 CG HIS A 85 -28.543 9.120 14.779 1.00 11.03 C ATOM 829 ND1 HIS A 85 -27.677 10.135 15.120 1.00 11.15 N ATOM 830 CD2 HIS A 85 -29.527 9.138 15.710 1.00 11.98 C ATOM 831 CE1 HIS A 85 -28.117 10.736 16.212 1.00 11.31 C ATOM 832 NE2 HIS A 85 -29.240 10.152 16.582 1.00 11.66 N ATOM 833 H HIS A 85 -26.185 6.930 15.581 1.00 0.00 H ATOM 834 N ASP A 86 -25.691 8.916 12.404 1.00 10.59 N ATOM 835 CA ASP A 86 -24.454 9.618 12.103 1.00 10.59 C ATOM 836 C ASP A 86 -24.158 10.823 12.976 1.00 10.34 C ATOM 837 O ASP A 86 -23.029 11.301 12.960 1.00 11.99 O ATOM 838 CB ASP A 86 -24.427 10.053 10.641 1.00 13.85 C ATOM 839 CG ASP A 86 -24.181 8.924 9.696 1.00 22.06 C ATOM 840 OD1 ASP A 86 -23.922 7.764 10.134 1.00 25.34 O ATOM 841 OD2 ASP A 86 -24.253 9.197 8.465 1.00 31.64 O ATOM 842 H ASP A 86 -26.496 8.985 11.749 1.00 0.00 H ATOM 843 N ARG A 87 -25.131 11.310 13.749 1.00 9.54 N ATOM 844 CA ARG A 87 -24.878 12.448 14.626 1.00 10.46 C ATOM 845 C ARG A 87 -24.313 11.990 15.968 1.00 8.39 C ATOM 846 O ARG A 87 -24.007 12.819 16.804 1.00 9.37 O ATOM 847 CB ARG A 87 -26.108 13.353 14.778 1.00 10.53 C ATOM 848 CG ARG A 87 -26.619 13.889 13.442 1.00 10.67 C ATOM 849 CD ARG A 87 -27.829 13.080 12.972 1.00 12.43 C ATOM 850 NE ARG A 87 -28.332 13.636 11.721 1.00 17.87 N ATOM 851 CZ ARG A 87 -29.139 14.686 11.618 1.00 14.67 C ATOM 852 NH1 ARG A 87 -29.573 15.325 12.687 1.00 14.49 N ATOM 853 NH2 ARG A 87 -29.525 15.096 10.416 1.00 18.76 N ATOM 854 HE ARG A 87 -28.035 13.173 10.838 1.00 0.00 H ATOM 855 HH12 ARG A 87 -30.204 16.145 12.582 1.00 0.00 H ATOM 856 HH11 ARG A 87 -29.284 15.009 13.635 1.00 0.00 H ATOM 857 HH22 ARG A 87 -30.157 15.917 10.325 1.00 0.00 H ATOM 858 HH21 ARG A 87 -29.196 14.596 9.566 1.00 0.00 H ATOM 859 H ARG A 87 -26.076 10.875 13.726 1.00 0.00 H ATOM 860 N ALA A 88 -24.165 10.674 16.141 1.00 6.94 N ATOM 861 CA ALA A 88 -23.494 10.128 17.296 1.00 7.35 C ATOM 862 C ALA A 88 -22.084 9.602 16.976 1.00 7.29 C ATOM 863 O ALA A 88 -21.509 8.860 17.754 1.00 8.00 O ATOM 864 CB ALA A 88 -24.357 9.055 17.927 1.00 8.42 C ATOM 865 H ALA A 88 -24.544 10.024 15.423 1.00 0.00 H ATOM 866 N LEU A 89 -21.531 10.025 15.831 1.00 7.03 N ATOM 867 CA LEU A 89 -20.169 9.695 15.474 1.00 6.19 C ATOM 868 C LEU A 89 -19.163 10.652 16.067 1.00 5.82 C ATOM 869 O LEU A 89 -19.333 11.906 16.010 1.00 6.52 O ATOM 870 CB LEU A 89 -20.036 9.675 13.944 1.00 6.91 C ATOM 871 CG LEU A 89 -20.773 8.519 13.248 1.00 8.23 C ATOM 872 CD1 LEU A 89 -20.766 8.766 11.753 1.00 9.34 C ATOM 873 CD2 LEU A 89 -20.254 7.133 13.597 1.00 8.93 C ATOM 874 H LEU A 89 -22.097 10.607 15.181 1.00 0.00 H ATOM 875 N PHE A 90 -18.123 10.049 16.663 1.00 5.61 N ATOM 876 CA PHE A 90 -16.989 10.771 17.207 1.00 5.44 C ATOM 877 C PHE A 90 -15.696 10.117 16.723 1.00 6.20 C ATOM 878 O PHE A 90 -15.710 8.948 16.272 1.00 6.02 O ATOM 879 CB PHE A 90 -17.007 10.706 18.751 1.00 6.30 C ATOM 880 CG PHE A 90 -18.191 11.385 19.366 1.00 6.33 C ATOM 881 CD1 PHE A 90 -19.435 10.728 19.460 1.00 6.63 C ATOM 882 CD2 PHE A 90 -18.109 12.707 19.792 1.00 7.08 C ATOM 883 CE1 PHE A 90 -20.540 11.385 19.965 1.00 6.36 C ATOM 884 CE2 PHE A 90 -19.218 13.348 20.318 1.00 7.30 C ATOM 885 CZ PHE A 90 -20.426 12.685 20.387 1.00 6.56 C ATOM 886 H PHE A 90 -18.131 9.012 16.739 1.00 0.00 H ATOM 887 N ALA A 91 -14.605 10.870 16.850 1.00 6.21 N ATOM 888 CA ALA A 91 -13.260 10.373 16.645 1.00 6.20 C ATOM 889 C ALA A 91 -12.497 10.540 17.957 1.00 6.52 C ATOM 890 O ALA A 91 -12.596 11.567 18.613 1.00 7.34 O ATOM 891 CB ALA A 91 -12.595 11.088 15.493 1.00 8.24 C ATOM 892 H ALA A 91 -14.725 11.870 17.111 1.00 0.00 H ATOM 893 N MET A 92 -11.749 9.510 18.324 1.00 6.59 N ATOM 894 CA MET A 92 -10.964 9.487 19.561 1.00 6.69 C ATOM 895 C MET A 92 -9.525 9.815 19.204 1.00 6.60 C ATOM 896 O MET A 92 -8.767 8.919 18.870 1.00 6.80 O ATOM 897 CB MET A 92 -11.045 8.096 20.189 1.00 8.62 C ATOM 898 CG MET A 92 -12.439 7.585 20.359 1.00 11.88 C ATOM 899 SD MET A 92 -13.388 8.574 21.543 1.00 15.70 S ATOM 900 CE MET A 92 -12.782 7.799 23.039 1.00 19.48 C ATOM 901 H MET A 92 -11.717 8.676 17.703 1.00 0.00 H ATOM 902 N ASP A 93 -9.191 11.096 19.238 1.00 6.02 N ATOM 903 CA ASP A 93 -7.883 11.589 18.766 1.00 6.23 C ATOM 904 C ASP A 93 -6.855 11.427 19.877 1.00 6.27 C ATOM 905 O ASP A 93 -6.698 12.275 20.748 1.00 6.88 O ATOM 906 CB ASP A 93 -8.016 13.014 18.276 1.00 6.30 C ATOM 907 CG ASP A 93 -6.743 13.558 17.706 1.00 7.45 C ATOM 908 OD1 ASP A 93 -5.660 12.952 17.925 1.00 8.03 O ATOM 909 OD2 ASP A 93 -6.829 14.627 17.030 1.00 9.85 O ATOM 910 H ASP A 93 -9.878 11.782 19.612 1.00 0.00 H ATOM 911 N PHE A 94 -6.174 10.278 19.832 1.00 6.25 N ATOM 912 CA PHE A 94 -5.230 9.923 20.863 1.00 6.70 C ATOM 913 C PHE A 94 -3.848 10.501 20.585 1.00 8.48 C ATOM 914 O PHE A 94 -2.918 10.306 21.385 1.00 9.21 O ATOM 915 CB PHE A 94 -5.195 8.410 21.118 1.00 6.62 C ATOM 916 CG PHE A 94 -4.815 7.537 19.930 1.00 6.68 C ATOM 917 CD1 PHE A 94 -5.774 7.146 18.977 1.00 7.00 C ATOM 918 CD2 PHE A 94 -3.542 7.005 19.814 1.00 7.16 C ATOM 919 CE1 PHE A 94 -5.459 6.281 17.938 1.00 6.54 C ATOM 920 CE2 PHE A 94 -3.223 6.116 18.777 1.00 7.67 C ATOM 921 CZ PHE A 94 -4.181 5.776 17.837 1.00 7.60 C ATOM 922 H PHE A 94 -6.328 9.626 19.037 1.00 0.00 H ATOM 923 N PHE A 95 -3.739 11.266 19.484 1.00 8.34 N ATOM 924 CA PHE A 95 -2.520 11.990 19.160 1.00 7.27 C ATOM 925 C PHE A 95 -2.551 13.437 19.697 1.00 8.16 C ATOM 926 O PHE A 95 -1.597 13.889 20.351 1.00 12.47 O ATOM 927 CB PHE A 95 -2.269 11.928 17.656 1.00 7.49 C ATOM 928 CG PHE A 95 -1.825 10.582 17.189 1.00 7.55 C ATOM 929 CD1 PHE A 95 -0.510 10.234 17.276 1.00 9.24 C ATOM 930 CD2 PHE A 95 -2.730 9.629 16.782 1.00 8.56 C ATOM 931 CE1 PHE A 95 -0.061 8.988 16.900 1.00 8.90 C ATOM 932 CE2 PHE A 95 -2.296 8.382 16.383 1.00 8.14 C ATOM 933 CZ PHE A 95 -0.945 8.057 16.455 1.00 9.65 C ATOM 934 H PHE A 95 -4.554 11.342 18.843 1.00 0.00 H ATOM 935 N ASN A 96 -3.651 14.137 19.434 1.00 8.78 N ATOM 936 CA ASN A 96 -3.904 15.454 20.011 1.00 8.14 C ATOM 937 C ASN A 96 -4.626 15.456 21.368 1.00 8.12 C ATOM 938 O ASN A 96 -4.798 16.507 21.969 1.00 9.76 O ATOM 939 CB ASN A 96 -4.656 16.316 19.019 1.00 8.49 C ATOM 940 CG ASN A 96 -3.875 16.493 17.723 1.00 10.10 C ATOM 941 OD1 ASN A 96 -2.682 16.861 17.737 1.00 11.86 O ATOM 942 ND2 ASN A 96 -4.508 16.192 16.602 1.00 10.53 N ATOM 943 HD22 ASN A 96 -5.502 15.889 16.632 1.00 0.00 H ATOM 944 HD21 ASN A 96 -4.011 16.258 15.691 1.00 0.00 H ATOM 945 H ASN A 96 -4.360 13.730 18.791 1.00 0.00 H ATOM 946 N ASP A 97 -5.063 14.288 21.799 1.00 7.32 N ATOM 947 CA ASP A 97 -5.719 14.070 23.091 1.00 7.09 C ATOM 948 C ASP A 97 -7.030 14.811 23.191 1.00 7.14 C ATOM 949 O ASP A 97 -7.251 15.612 24.102 1.00 8.17 O ATOM 950 CB ASP A 97 -4.787 14.396 24.267 1.00 8.39 C ATOM 951 CG ASP A 97 -3.603 13.435 24.386 1.00 9.15 C ATOM 952 OD1 ASP A 97 -3.610 12.343 23.776 1.00 10.04 O ATOM 953 OD2 ASP A 97 -2.639 13.793 25.116 1.00 10.54 O ATOM 954 H ASP A 97 -4.933 13.464 21.178 1.00 0.00 H ATOM 955 N ASN A 98 -7.929 14.506 22.264 1.00 6.43 N ATOM 956 CA ASN A 98 -9.295 15.086 22.342 1.00 6.64 C ATOM 957 C ASN A 98 -10.323 14.151 21.747 1.00 6.12 C ATOM 958 O ASN A 98 -9.968 13.138 21.172 1.00 7.03 O ATOM 959 CB ASN A 98 -9.392 16.492 21.732 1.00 7.50 C ATOM 960 CG ASN A 98 -9.096 16.515 20.246 1.00 7.70 C ATOM 961 OD1 ASN A 98 -9.731 15.814 19.462 1.00 8.36 O ATOM 962 ND2 ASN A 98 -8.138 17.329 19.856 1.00 9.10 N ATOM 963 HD22 ASN A 98 -7.627 17.904 20.556 1.00 0.00 H ATOM 964 HD21 ASN A 98 -7.892 17.397 18.848 1.00 0.00 H ATOM 965 H ASN A 98 -7.679 13.863 21.486 1.00 0.00 H ATOM 966 N ILE A 99 -11.591 14.488 21.955 1.00 6.31 N ATOM 967 CA ILE A 99 -12.681 13.743 21.395 1.00 6.74 C ATOM 968 C ILE A 99 -13.490 14.715 20.525 1.00 6.26 C ATOM 969 O ILE A 99 -14.048 15.706 21.016 1.00 6.51 O ATOM 970 CB ILE A 99 -13.590 13.133 22.491 1.00 6.96 C ATOM 971 CG1 ILE A 99 -12.768 12.205 23.456 1.00 8.09 C ATOM 972 CG2 ILE A 99 -14.785 12.458 21.840 1.00 7.32 C ATOM 973 CD1 ILE A 99 -13.511 11.775 24.724 1.00 9.09 C ATOM 974 H ILE A 99 -11.800 15.320 22.543 1.00 0.00 H ATOM 975 N MET A 100 -13.509 14.434 19.213 1.00 7.29 N ATOM 976 CA MET A 100 -14.158 15.288 18.250 1.00 6.91 C ATOM 977 C MET A 100 -15.447 14.670 17.723 1.00 6.79 C ATOM 978 O MET A 100 -15.477 13.514 17.293 1.00 6.98 O ATOM 979 CB MET A 100 -13.230 15.561 17.057 1.00 8.11 C ATOM 980 CG MET A 100 -13.783 16.631 16.134 1.00 10.30 C ATOM 981 SD MET A 100 -12.977 16.738 14.529 1.00 12.79 S ATOM 982 CE MET A 100 -11.563 17.702 14.996 1.00 14.47 C ATOM 983 H MET A 100 -13.038 13.569 18.879 1.00 0.00 H ATOM 984 N HIS A 101 -16.513 15.437 17.789 1.00 6.51 N ATOM 985 CA HIS A 101 -17.764 15.070 17.148 1.00 7.56 C ATOM 986 C HIS A 101 -17.661 15.231 15.631 1.00 7.58 C ATOM 987 O HIS A 101 -16.880 16.055 15.149 1.00 9.59 O ATOM 988 CB HIS A 101 -18.869 15.960 17.716 1.00 8.05 C ATOM 989 CG HIS A 101 -20.223 15.669 17.150 1.00 8.41 C ATOM 990 ND1 HIS A 101 -20.841 16.502 16.250 1.00 10.13 N ATOM 991 CD2 HIS A 101 -21.075 14.632 17.352 1.00 7.81 C ATOM 992 CE1 HIS A 101 -22.020 16.000 15.929 1.00 8.84 C ATOM 993 NE2 HIS A 101 -22.170 14.848 16.552 1.00 8.46 N ATOM 994 H HIS A 101 -16.459 16.332 18.315 1.00 0.00 H ATOM 995 N LYS A 102 -18.488 14.481 14.891 1.00 7.60 N ATOM 996 CA LYS A 102 -18.480 14.501 13.404 1.00 8.98 C ATOM 997 C LYS A 102 -18.626 15.909 12.827 1.00 9.31 C ATOM 998 O LYS A 102 -18.096 16.201 11.748 1.00 11.25 O ATOM 999 CB LYS A 102 -19.582 13.557 12.913 1.00 11.23 C ATOM 1000 CG LYS A 102 -19.599 13.228 11.442 1.00 15.25 C ATOM 1001 CD LYS A 102 -18.321 12.592 11.030 1.00 18.20 C ATOM 1002 CE LYS A 102 -18.487 11.649 9.863 1.00 24.88 C ATOM 1003 NZ LYS A 102 -18.640 12.378 8.630 1.00 23.54 N ATOM 1004 HZ1 LYS A 102 -19.481 12.987 8.691 1.00 0.00 H ATOM 1005 HZ2 LYS A 102 -17.797 12.965 8.469 1.00 0.00 H ATOM 1006 HZ3 LYS A 102 -18.752 11.707 7.844 1.00 0.00 H ATOM 1007 H LYS A 102 -19.164 13.858 15.377 1.00 0.00 H ATOM 1008 N GLY A 103 -19.310 16.798 13.544 1.00 8.35 N ATOM 1009 CA GLY A 103 -19.473 18.188 13.130 1.00 10.28 C ATOM 1010 C GLY A 103 -18.281 19.095 13.316 1.00 10.49 C ATOM 1011 O GLY A 103 -18.341 20.287 12.937 1.00 14.63 O ATOM 1012 H GLY A 103 -19.746 16.489 14.436 1.00 0.00 H ATOM 1013 N GLY A 104 -17.224 18.559 13.934 1.00 9.28 N ATOM 1014 CA GLY A 104 -15.938 19.265 14.080 1.00 9.82 C ATOM 1015 C GLY A 104 -15.658 19.904 15.427 1.00 9.90 C ATOM 1016 O GLY A 104 -14.570 20.435 15.615 1.00 12.05 O ATOM 1017 H GLY A 104 -17.313 17.601 14.329 1.00 0.00 H ATOM 1018 N LYS A 105 -16.647 19.907 16.331 1.00 7.74 N ATOM 1019 CA LYS A 105 -16.467 20.431 17.682 1.00 7.95 C ATOM 1020 C LYS A 105 -16.043 19.304 18.616 1.00 7.79 C ATOM 1021 O LYS A 105 -15.976 18.132 18.207 1.00 8.60 O ATOM 1022 CB LYS A 105 -17.703 21.160 18.168 1.00 8.94 C ATOM 1023 CG LYS A 105 -18.054 22.401 17.336 1.00 10.57 C ATOM 1024 CD LYS A 105 -19.240 23.107 17.920 1.00 11.34 C ATOM 1025 CE LYS A 105 -19.745 24.230 17.040 1.00 17.00 C ATOM 1026 NZ LYS A 105 -18.856 25.400 17.175 1.00 19.58 N ATOM 1027 HZ1 LYS A 105 -18.846 25.714 18.166 1.00 0.00 H ATOM 1028 HZ2 LYS A 105 -17.893 25.137 16.884 1.00 0.00 H ATOM 1029 HZ3 LYS A 105 -19.205 26.170 16.570 1.00 0.00 H ATOM 1030 H LYS A 105 -17.575 19.523 16.061 1.00 0.00 H ATOM 1031 N TYR A 106 -15.659 19.683 19.836 1.00 7.73 N ATOM 1032 CA TYR A 106 -15.050 18.759 20.791 1.00 7.64 C ATOM 1033 C TYR A 106 -15.859 18.637 22.068 1.00 8.04 C ATOM 1034 O TYR A 106 -16.681 19.511 22.385 1.00 9.39 O ATOM 1035 CB TYR A 106 -13.662 19.236 21.146 1.00 7.51 C ATOM 1036 CG TYR A 106 -12.754 19.468 19.962 1.00 8.66 C ATOM 1037 CD1 TYR A 106 -12.005 18.429 19.427 1.00 8.99 C ATOM 1038 CD2 TYR A 106 -12.552 20.739 19.466 1.00 9.20 C ATOM 1039 CE1 TYR A 106 -11.143 18.637 18.383 1.00 10.78 C ATOM 1040 CE2 TYR A 106 -11.713 20.963 18.396 1.00 11.97 C ATOM 1041 CZ TYR A 106 -10.978 19.937 17.869 1.00 11.79 C ATOM 1042 OH TYR A 106 -10.096 20.151 16.816 1.00 14.41 O ATOM 1043 HH TYR A 106 -9.659 19.296 16.574 1.00 0.00 H ATOM 1044 H TYR A 106 -15.798 20.674 20.119 1.00 0.00 H ATOM 1045 N ILE A 107 -15.603 17.558 22.809 1.00 7.35 N ATOM 1046 CA ILE A 107 -16.175 17.401 24.149 1.00 7.42 C ATOM 1047 C ILE A 107 -15.321 18.234 25.127 1.00 7.35 C ATOM 1048 O ILE A 107 -14.096 18.161 25.130 1.00 7.56 O ATOM 1049 CB ILE A 107 -16.240 15.925 24.586 1.00 6.90 C ATOM 1050 CG1 ILE A 107 -17.130 15.104 23.637 1.00 8.67 C ATOM 1051 CG2 ILE A 107 -16.661 15.855 26.058 1.00 7.17 C ATOM 1052 CD1 ILE A 107 -17.354 13.662 24.027 1.00 9.74 C ATOM 1053 H ILE A 107 -14.985 16.813 22.428 1.00 0.00 H ATOM 1054 N HIS A 108 -15.996 19.041 25.933 1.00 8.26 N ATOM 1055 CA HIS A 108 -15.399 19.943 26.939 1.00 8.19 C ATOM 1056 C HIS A 108 -16.083 19.788 28.307 1.00 7.81 C ATOM 1057 O HIS A 108 -17.253 19.483 28.366 1.00 8.08 O ATOM 1058 CB HIS A 108 -15.672 21.418 26.562 1.00 8.97 C ATOM 1059 CG HIS A 108 -14.836 21.941 25.466 1.00 8.40 C ATOM 1060 ND1 HIS A 108 -14.002 23.016 25.640 1.00 9.84 N ATOM 1061 CD2 HIS A 108 -14.714 21.568 24.170 1.00 9.36 C ATOM 1062 CE1 HIS A 108 -13.395 23.288 24.501 1.00 9.17 C ATOM 1063 NE2 HIS A 108 -13.822 22.433 23.595 1.00 9.72 N ATOM 1064 H HIS A 108 -17.033 19.039 25.850 1.00 0.00 H ATOM 1065 N PRO A 109 -15.359 20.088 29.405 1.00 8.72 N ATOM 1066 CA PRO A 109 -16.068 20.400 30.650 1.00 7.89 C ATOM 1067 C PRO A 109 -16.830 21.699 30.481 1.00 7.61 C ATOM 1068 O PRO A 109 -16.267 22.708 30.000 1.00 8.27 O ATOM 1069 CB PRO A 109 -14.941 20.601 31.662 1.00 9.88 C ATOM 1070 CG PRO A 109 -13.753 21.003 30.854 1.00 9.55 C ATOM 1071 CD PRO A 109 -13.929 20.440 29.470 1.00 8.44 C ATOM 1072 N LYS A 110 -18.076 21.715 30.913 1.00 8.26 N ATOM 1073 CA LYS A 110 -18.870 22.929 30.827 1.00 9.99 C ATOM 1074 C LYS A 110 -18.159 24.064 31.546 1.00 10.68 C ATOM 1075 O LYS A 110 -17.787 23.929 32.720 1.00 11.93 O ATOM 1076 CB LYS A 110 -20.255 22.689 31.426 1.00 11.41 C ATOM 1077 CG LYS A 110 -21.195 23.885 31.369 1.00 15.31 C ATOM 1078 CD LYS A 110 -22.561 23.490 31.908 1.00 21.17 C ATOM 1079 CE LYS A 110 -23.503 24.659 31.970 1.00 27.83 C ATOM 1080 NZ LYS A 110 -23.846 25.064 30.582 1.00 36.01 N ATOM 1081 HZ1 LYS A 110 -22.978 25.334 30.076 1.00 0.00 H ATOM 1082 HZ2 LYS A 110 -24.301 24.267 30.092 1.00 0.00 H ATOM 1083 HZ3 LYS A 110 -24.498 25.873 30.610 1.00 0.00 H ATOM 1084 H LYS A 110 -18.493 20.853 31.318 1.00 0.00 H ATOM 1085 N GLY A 111 -17.995 25.186 30.847 1.00 9.92 N ATOM 1086 CA GLY A 111 -17.400 26.380 31.455 1.00 11.33 C ATOM 1087 C GLY A 111 -15.892 26.470 31.377 1.00 11.63 C ATOM 1088 O GLY A 111 -15.331 27.548 31.651 1.00 12.35 O ATOM 1089 H GLY A 111 -18.295 25.216 29.852 1.00 0.00 H ATOM 1090 N GLY A 112 -15.222 25.373 30.987 1.00 10.28 N ATOM 1091 CA GLY A 112 -13.797 25.400 30.662 1.00 11.41 C ATOM 1092 C GLY A 112 -12.791 25.244 31.783 1.00 10.51 C ATOM 1093 O GLY A 112 -11.590 25.382 31.566 1.00 10.56 O ATOM 1094 H GLY A 112 -15.736 24.472 30.914 1.00 0.00 H ATOM 1095 N SER A 113 -13.252 24.944 32.990 1.00 10.48 N ATOM 1096 CA SER A 113 -12.311 24.782 34.084 1.00 11.40 C ATOM 1097 C SER A 113 -11.402 23.581 33.834 1.00 11.40 C ATOM 1098 O SER A 113 -11.881 22.489 33.491 1.00 12.21 O ATOM 1099 CB SER A 113 -13.055 24.563 35.402 1.00 11.78 C ATOM 1100 OG SER A 113 -12.123 24.368 36.443 1.00 12.46 O ATOM 1101 HG SER A 113 -11.544 25.167 36.520 1.00 0.00 H ATOM 1102 H SER A 113 -14.273 24.826 33.151 1.00 0.00 H ATOM 1103 N PRO A 114 -10.090 23.751 34.079 1.00 10.71 N ATOM 1104 CA PRO A 114 -9.155 22.610 34.058 1.00 11.40 C ATOM 1105 C PRO A 114 -9.233 21.727 35.299 1.00 11.23 C ATOM 1106 O PRO A 114 -8.754 20.587 35.250 1.00 14.43 O ATOM 1107 CB PRO A 114 -7.789 23.279 33.941 1.00 13.06 C ATOM 1108 CG PRO A 114 -7.962 24.618 34.559 1.00 12.73 C ATOM 1109 CD PRO A 114 -9.403 25.025 34.323 1.00 12.51 C ATOM 1110 N ASN A 115 -9.832 22.242 36.392 1.00 11.36 N ATOM 1111 CA ASN A 115 -10.022 21.462 37.639 1.00 13.44 C ATOM 1112 C ASN A 115 -11.466 21.530 38.063 1.00 11.87 C ATOM 1113 O ASN A 115 -11.784 21.985 39.167 1.00 13.18 O ATOM 1114 CB ASN A 115 -9.062 21.856 38.776 1.00 15.71 C ATOM 1115 CG ASN A 115 -9.263 23.258 39.277 1.00 15.73 C ATOM 1116 OD1 ASN A 115 -9.332 24.228 38.492 1.00 16.62 O ATOM 1117 ND2 ASN A 115 -9.327 23.392 40.613 1.00 16.44 N ATOM 1118 HD22 ASN A 115 -9.265 22.552 41.223 1.00 0.00 H ATOM 1119 HD21 ASN A 115 -9.439 24.335 41.036 1.00 0.00 H ATOM 1120 H ASN A 115 -10.174 23.224 36.359 1.00 0.00 H ATOM 1121 N PRO A 116 -12.359 21.054 37.180 1.00 14.03 N ATOM 1122 CA PRO A 116 -13.790 21.096 37.447 1.00 14.36 C ATOM 1123 C PRO A 116 -14.170 20.201 38.639 1.00 13.84 C ATOM 1124 O PRO A 116 -13.547 19.158 38.858 1.00 12.51 O ATOM 1125 CB PRO A 116 -14.383 20.552 36.147 1.00 15.05 C ATOM 1126 CG PRO A 116 -13.356 19.622 35.630 1.00 15.98 C ATOM 1127 CD PRO A 116 -12.045 20.232 35.993 1.00 12.85 C ATOM 1128 N PRO A 117 -15.177 20.605 39.421 1.00 14.05 N ATOM 1129 CA PRO A 117 -15.594 19.723 40.507 1.00 15.49 C ATOM 1130 C PRO A 117 -16.370 18.479 40.003 1.00 12.10 C ATOM 1131 O PRO A 117 -16.836 18.437 38.864 1.00 10.87 O ATOM 1132 CB PRO A 117 -16.526 20.616 41.335 1.00 18.32 C ATOM 1133 CG PRO A 117 -17.129 21.512 40.341 1.00 18.93 C ATOM 1134 CD PRO A 117 -16.006 21.822 39.367 1.00 17.66 C ATOM 1135 N ASN A 118 -16.497 17.481 40.865 1.00 12.20 N ATOM 1136 CA ASN A 118 -17.327 16.351 40.584 1.00 12.40 C ATOM 1137 C ASN A 118 -18.728 16.786 40.133 1.00 11.40 C ATOM 1138 O ASN A 118 -19.296 17.782 40.641 1.00 12.76 O ATOM 1139 CB ASN A 118 -17.426 15.444 41.797 1.00 12.99 C ATOM 1140 CG ASN A 118 -16.231 14.527 41.964 1.00 13.63 C ATOM 1141 OD1 ASN A 118 -15.447 14.279 41.038 1.00 12.95 O ATOM 1142 ND2 ASN A 118 -16.098 13.982 43.171 1.00 16.57 N ATOM 1143 HD22 ASN A 118 -16.777 14.214 43.924 1.00 0.00 H ATOM 1144 HD21 ASN A 118 -15.316 13.324 43.361 1.00 0.00 H ATOM 1145 H ASN A 118 -15.981 17.520 41.767 1.00 0.00 H ATOM 1146 N ASN A 119 -19.241 16.046 39.141 1.00 10.29 N ATOM 1147 CA ASN A 119 -20.550 16.252 38.523 1.00 11.33 C ATOM 1148 C ASN A 119 -20.636 17.442 37.570 1.00 11.35 C ATOM 1149 O ASN A 119 -21.718 17.878 37.195 1.00 11.99 O ATOM 1150 CB ASN A 119 -21.669 16.179 39.554 1.00 15.11 C ATOM 1151 CG ASN A 119 -21.773 14.787 40.188 1.00 18.67 C ATOM 1152 OD1 ASN A 119 -21.582 13.756 39.530 1.00 18.62 O ATOM 1153 ND2 ASN A 119 -22.080 14.754 41.451 1.00 23.50 N ATOM 1154 HD22 ASN A 119 -22.233 15.641 41.972 1.00 0.00 H ATOM 1155 HD21 ASN A 119 -22.172 13.841 41.940 1.00 0.00 H ATOM 1156 H ASN A 119 -18.661 15.261 38.781 1.00 0.00 H ATOM 1157 N THR A 120 -19.476 17.964 37.175 1.00 10.32 N ATOM 1158 CA THR A 120 -19.436 18.981 36.117 1.00 10.68 C ATOM 1159 C THR A 120 -19.942 18.338 34.839 1.00 9.82 C ATOM 1160 O THR A 120 -19.461 17.259 34.433 1.00 9.71 O ATOM 1161 CB THR A 120 -18.007 19.487 35.928 1.00 11.57 C ATOM 1162 OG1 THR A 120 -17.616 20.207 37.103 1.00 15.34 O ATOM 1163 CG2 THR A 120 -17.860 20.394 34.713 1.00 11.88 C ATOM 1164 HG1 THR A 120 -16.690 20.540 36.992 1.00 0.00 H ATOM 1165 H THR A 120 -18.591 17.648 37.620 1.00 0.00 H ATOM 1166 N GLU A 121 -20.882 19.003 34.200 1.00 9.65 N ATOM 1167 CA GLU A 121 -21.441 18.522 32.933 1.00 9.59 C ATOM 1168 C GLU A 121 -20.414 18.649 31.821 1.00 9.45 C ATOM 1169 O GLU A 121 -19.517 19.472 31.897 1.00 13.17 O ATOM 1170 CB GLU A 121 -22.672 19.338 32.576 1.00 11.18 C ATOM 1171 CG GLU A 121 -23.790 19.105 33.564 1.00 14.59 C ATOM 1172 CD GLU A 121 -25.013 19.991 33.359 1.00 19.25 C ATOM 1173 OE1 GLU A 121 -25.063 20.767 32.372 1.00 17.24 O ATOM 1174 OE2 GLU A 121 -25.943 19.889 34.202 1.00 22.29 O ATOM 1175 H GLU A 121 -21.237 19.893 34.605 1.00 0.00 H ATOM 1176 N THR A 122 -20.561 17.831 30.793 1.00 7.56 N ATOM 1177 CA THR A 122 -19.743 17.963 29.605 1.00 7.87 C ATOM 1178 C THR A 122 -20.612 18.469 28.477 1.00 8.26 C ATOM 1179 O THR A 122 -21.811 18.190 28.433 1.00 7.78 O ATOM 1180 CB THR A 122 -19.018 16.641 29.202 1.00 8.27 C ATOM 1181 OG1 THR A 122 -19.970 15.581 28.962 1.00 8.95 O ATOM 1182 CG2 THR A 122 -18.068 16.206 30.272 1.00 9.67 C ATOM 1183 HG1 THR A 122 -20.495 15.418 29.785 1.00 0.00 H ATOM 1184 H THR A 122 -21.277 17.079 30.838 1.00 0.00 H ATOM 1185 N VAL A 123 -19.984 19.225 27.575 1.00 7.82 N ATOM 1186 CA VAL A 123 -20.664 19.879 26.493 1.00 8.03 C ATOM 1187 C VAL A 123 -19.806 19.856 25.244 1.00 8.41 C ATOM 1188 O VAL A 123 -18.627 19.606 25.317 1.00 9.78 O ATOM 1189 CB VAL A 123 -21.015 21.356 26.800 1.00 9.75 C ATOM 1190 CG1 VAL A 123 -21.929 21.438 28.018 1.00 10.66 C ATOM 1191 CG2 VAL A 123 -19.788 22.221 26.983 1.00 10.95 C ATOM 1192 H VAL A 123 -18.955 19.346 27.660 1.00 0.00 H ATOM 1193 N ILE A 124 -20.455 20.075 24.102 1.00 9.32 N ATOM 1194 CA ILE A 124 -19.813 20.363 22.843 1.00 11.60 C ATOM 1195 C ILE A 124 -19.242 21.806 22.841 1.00 10.94 C ATOM 1196 O ILE A 124 -19.942 22.751 23.225 1.00 11.23 O ATOM 1197 CB ILE A 124 -20.906 20.312 21.722 1.00 14.80 C ATOM 1198 CG1 ILE A 124 -21.341 18.890 21.472 1.00 17.07 C ATOM 1199 CG2 ILE A 124 -20.517 21.018 20.451 1.00 15.53 C ATOM 1200 CD1 ILE A 124 -20.326 18.015 20.764 1.00 21.95 C ATOM 1201 H ILE A 124 -21.494 20.036 24.119 1.00 0.00 H ATOM 1202 N HIS A 125 -18.026 21.992 22.324 1.00 9.71 N ATOM 1203 CA HIS A 125 -17.541 23.328 22.057 1.00 10.06 C ATOM 1204 C HIS A 125 -16.432 23.269 21.024 1.00 9.99 C ATOM 1205 O HIS A 125 -15.667 22.303 21.000 1.00 8.89 O ATOM 1206 CB HIS A 125 -17.063 24.012 23.361 1.00 10.26 C ATOM 1207 CG HIS A 125 -17.048 25.509 23.279 1.00 12.98 C ATOM 1208 ND1 HIS A 125 -16.087 26.210 22.583 1.00 13.52 N ATOM 1209 CD2 HIS A 125 -17.857 26.442 23.834 1.00 14.31 C ATOM 1210 CE1 HIS A 125 -16.324 27.508 22.677 1.00 14.80 C ATOM 1211 NE2 HIS A 125 -17.383 27.679 23.440 1.00 15.22 N ATOM 1212 H HIS A 125 -17.423 21.171 22.112 1.00 0.00 H ATOM 1213 N GLY A 126 -16.324 24.290 20.178 1.00 10.51 N ATOM 1214 CA GLY A 126 -15.318 24.277 19.120 1.00 11.89 C ATOM 1215 C GLY A 126 -13.909 24.620 19.545 1.00 12.25 C ATOM 1216 O GLY A 126 -12.964 24.365 18.798 1.00 13.34 O ATOM 1217 H GLY A 126 -16.963 25.106 20.271 1.00 0.00 H ATOM 1218 N ASP A 127 -13.752 25.185 20.750 1.00 11.47 N ATOM 1219 CA ASP A 127 -12.433 25.686 21.179 1.00 12.90 C ATOM 1220 C ASP A 127 -11.484 24.491 21.450 1.00 11.84 C ATOM 1221 O ASP A 127 -11.917 23.390 21.837 1.00 12.10 O ATOM 1222 CB ASP A 127 -12.497 26.507 22.491 1.00 14.42 C ATOM 1223 CG ASP A 127 -13.010 27.913 22.320 1.00 16.98 C ATOM 1224 OD1 ASP A 127 -13.218 28.384 21.181 1.00 20.23 O ATOM 1225 OD2 ASP A 127 -13.216 28.561 23.370 1.00 19.05 O ATOM 1226 H ASP A 127 -14.568 25.271 21.389 1.00 0.00 H ATOM 1227 N LYS A 128 -10.192 24.735 21.248 1.00 12.43 N ATOM 1228 CA LYS A 128 -9.107 23.761 21.584 1.00 14.04 C ATOM 1229 C LYS A 128 -8.178 24.443 22.586 1.00 12.78 C ATOM 1230 O LYS A 128 -7.735 25.591 22.355 1.00 16.07 O ATOM 1231 CB LYS A 128 -8.286 23.446 20.340 1.00 18.23 C ATOM 1232 CG LYS A 128 -8.654 22.219 19.547 1.00 27.33 C ATOM 1233 CD LYS A 128 -7.487 21.694 18.693 1.00 30.38 C ATOM 1234 CE LYS A 128 -6.213 21.495 19.507 1.00 39.83 C ATOM 1235 NZ LYS A 128 -5.113 20.731 18.836 1.00 50.20 N ATOM 1236 HZ1 LYS A 128 -5.452 19.778 18.594 1.00 0.00 H ATOM 1237 HZ2 LYS A 128 -4.826 21.228 17.969 1.00 0.00 H ATOM 1238 HZ3 LYS A 128 -4.300 20.658 19.481 1.00 0.00 H ATOM 1239 H LYS A 128 -9.922 25.650 20.835 1.00 0.00 H ATOM 1240 N HIS A 129 -7.938 23.758 23.701 1.00 12.24 N ATOM 1241 CA HIS A 129 -7.104 24.224 24.791 1.00 12.79 C ATOM 1242 C HIS A 129 -6.867 23.051 25.728 1.00 11.18 C ATOM 1243 O HIS A 129 -7.439 21.986 25.560 1.00 11.35 O ATOM 1244 CB HIS A 129 -7.689 25.448 25.532 1.00 13.75 C ATOM 1245 CG HIS A 129 -9.105 25.282 25.971 1.00 12.88 C ATOM 1246 ND1 HIS A 129 -9.501 24.243 26.770 1.00 14.63 N ATOM 1247 CD2 HIS A 129 -10.214 26.018 25.729 1.00 13.37 C ATOM 1248 CE1 HIS A 129 -10.802 24.323 26.982 1.00 12.74 C ATOM 1249 NE2 HIS A 129 -11.252 25.406 26.372 1.00 12.49 N ATOM 1250 H HIS A 129 -8.380 22.822 23.797 1.00 0.00 H ATOM 1251 N ALA A 130 -6.002 23.240 26.709 1.00 13.83 N ATOM 1252 CA ALA A 130 -5.586 22.151 27.593 1.00 12.96 C ATOM 1253 C ALA A 130 -6.726 21.523 28.404 1.00 11.34 C ATOM 1254 O ALA A 130 -6.653 20.336 28.742 1.00 13.30 O ATOM 1255 CB ALA A 130 -4.497 22.631 28.562 1.00 13.65 C ATOM 1256 H ALA A 130 -5.606 24.190 26.857 1.00 0.00 H ATOM 1257 N ALA A 131 -7.733 22.333 28.739 1.00 11.83 N ATOM 1258 CA ALA A 131 -8.854 21.898 29.554 1.00 10.97 C ATOM 1259 C ALA A 131 -9.853 21.046 28.785 1.00 10.09 C ATOM 1260 O ALA A 131 -10.763 20.495 29.404 1.00 9.75 O ATOM 1261 CB ALA A 131 -9.553 23.107 30.265 1.00 11.68 C ATOM 1262 H ALA A 131 -7.714 23.317 28.402 1.00 0.00 H ATOM 1263 N MET A 132 -9.693 20.885 27.462 1.00 8.66 N ATOM 1264 CA MET A 132 -10.597 19.952 26.740 1.00 8.88 C ATOM 1265 C MET A 132 -9.894 18.649 26.318 1.00 8.26 C ATOM 1266 O MET A 132 -10.445 17.848 25.569 1.00 8.75 O ATOM 1267 CB MET A 132 -11.313 20.613 25.572 1.00 10.12 C ATOM 1268 CG MET A 132 -10.438 21.407 24.632 1.00 9.82 C ATOM 1269 SD MET A 132 -9.241 20.499 23.640 1.00 10.40 S ATOM 1270 CE MET A 132 -10.324 19.904 22.314 1.00 8.85 C ATOM 1271 H MET A 132 -8.950 21.404 26.952 1.00 0.00 H ATOM 1272 N GLU A 133 -8.685 18.442 26.833 1.00 7.37 N ATOM 1273 CA GLU A 133 -7.946 17.257 26.504 1.00 7.07 C ATOM 1274 C GLU A 133 -8.411 16.053 27.319 1.00 7.28 C ATOM 1275 O GLU A 133 -8.714 16.194 28.532 1.00 7.07 O ATOM 1276 CB GLU A 133 -6.445 17.484 26.675 1.00 7.67 C ATOM 1277 CG GLU A 133 -5.915 18.394 25.576 1.00 8.79 C ATOM 1278 CD GLU A 133 -4.485 18.840 25.754 1.00 13.39 C ATOM 1279 OE1 GLU A 133 -3.749 18.317 26.647 1.00 20.18 O ATOM 1280 OE2 GLU A 133 -4.094 19.748 24.984 1.00 15.42 O ATOM 1281 H GLU A 133 -8.272 19.145 27.479 1.00 0.00 H ATOM 1282 N PHE A 134 -8.446 14.891 26.652 1.00 6.44 N ATOM 1283 CA PHE A 134 -8.809 13.616 27.260 1.00 6.80 C ATOM 1284 C PHE A 134 -7.834 12.551 26.823 1.00 7.09 C ATOM 1285 O PHE A 134 -7.357 12.586 25.681 1.00 7.25 O ATOM 1286 CB PHE A 134 -10.215 13.176 26.840 1.00 6.70 C ATOM 1287 CG PHE A 134 -11.301 13.971 27.451 1.00 7.21 C ATOM 1288 CD1 PHE A 134 -11.776 15.111 26.821 1.00 7.98 C ATOM 1289 CD2 PHE A 134 -11.834 13.611 28.662 1.00 8.29 C ATOM 1290 CE1 PHE A 134 -12.793 15.864 27.379 1.00 10.02 C ATOM 1291 CE2 PHE A 134 -12.864 14.372 29.231 1.00 9.55 C ATOM 1292 CZ PHE A 134 -13.346 15.485 28.588 1.00 8.77 C ATOM 1293 H PHE A 134 -8.200 14.899 25.642 1.00 0.00 H ATOM 1294 N ILE A 135 -7.552 11.617 27.726 1.00 6.36 N ATOM 1295 CA ILE A 135 -6.748 10.429 27.415 1.00 6.95 C ATOM 1296 C ILE A 135 -7.542 9.188 27.790 1.00 6.58 C ATOM 1297 O ILE A 135 -8.524 9.280 28.572 1.00 7.41 O ATOM 1298 CB ILE A 135 -5.325 10.450 28.040 1.00 7.47 C ATOM 1299 CG1 ILE A 135 -5.327 10.360 29.576 1.00 8.72 C ATOM 1300 CG2 ILE A 135 -4.609 11.719 27.626 1.00 9.01 C ATOM 1301 CD1 ILE A 135 -3.898 10.138 30.147 1.00 11.19 C ATOM 1302 H ILE A 135 -7.916 11.733 28.693 1.00 0.00 H ATOM 1303 N PHE A 136 -7.142 8.062 27.209 1.00 5.73 N ATOM 1304 CA PHE A 136 -7.937 6.834 27.219 1.00 6.17 C ATOM 1305 C PHE A 136 -7.108 5.753 27.867 1.00 6.69 C ATOM 1306 O PHE A 136 -6.047 5.371 27.337 1.00 6.40 O ATOM 1307 CB PHE A 136 -8.398 6.467 25.776 1.00 6.77 C ATOM 1308 CG PHE A 136 -8.831 7.652 24.973 1.00 7.19 C ATOM 1309 CD1 PHE A 136 -9.788 8.558 25.472 1.00 8.45 C ATOM 1310 CD2 PHE A 136 -8.264 7.935 23.745 1.00 7.40 C ATOM 1311 CE1 PHE A 136 -10.131 9.702 24.789 1.00 8.77 C ATOM 1312 CE2 PHE A 136 -8.633 9.075 23.034 1.00 7.50 C ATOM 1313 CZ PHE A 136 -9.582 9.954 23.553 1.00 7.94 C ATOM 1314 H PHE A 136 -6.222 8.053 26.725 1.00 0.00 H ATOM 1315 N VAL A 137 -7.524 5.340 29.069 1.00 7.16 N ATOM 1316 CA VAL A 137 -6.645 4.559 29.949 1.00 7.02 C ATOM 1317 C VAL A 137 -7.259 3.236 30.417 1.00 7.15 C ATOM 1318 O VAL A 137 -8.464 3.003 30.340 1.00 8.16 O ATOM 1319 CB VAL A 137 -6.167 5.421 31.154 1.00 8.17 C ATOM 1320 CG1 VAL A 137 -5.368 6.640 30.670 1.00 9.47 C ATOM 1321 CG2 VAL A 137 -7.360 5.821 32.050 1.00 8.94 C ATOM 1322 H VAL A 137 -8.486 5.576 29.386 1.00 0.00 H ATOM 1323 N SER A 138 -6.402 2.347 30.890 1.00 9.25 N ATOM 1324 CA SER A 138 -6.819 1.047 31.350 1.00 10.04 C ATOM 1325 C SER A 138 -7.681 1.142 32.594 1.00 9.23 C ATOM 1326 O SER A 138 -7.326 1.865 33.522 1.00 11.07 O ATOM 1327 CB SER A 138 -5.565 0.246 31.712 1.00 11.69 C ATOM 1328 OG SER A 138 -5.891 -1.011 32.259 1.00 13.77 O ATOM 1329 HG SER A 138 -6.414 -1.531 31.599 1.00 0.00 H ATOM 1330 H SER A 138 -5.393 2.595 30.931 1.00 0.00 H ATOM 1331 N PRO A 139 -8.770 0.350 32.658 1.00 10.30 N ATOM 1332 CA PRO A 139 -9.565 0.285 33.908 1.00 12.64 C ATOM 1333 C PRO A 139 -8.740 -0.231 35.094 1.00 14.24 C ATOM 1334 O PRO A 139 -9.078 0.068 36.254 1.00 18.73 O ATOM 1335 CB PRO A 139 -10.679 -0.682 33.536 1.00 14.05 C ATOM 1336 CG PRO A 139 -10.824 -0.526 32.049 1.00 13.26 C ATOM 1337 CD PRO A 139 -9.412 -0.412 31.570 1.00 11.81 C ATOM 1338 N LYS A 140 -7.649 -0.948 34.811 1.00 14.31 N ATOM 1339 CA LYS A 140 -6.764 -1.479 35.862 1.00 16.71 C ATOM 1340 C LYS A 140 -5.535 -0.615 36.176 1.00 17.99 C ATOM 1341 O LYS A 140 -4.776 -0.902 37.120 1.00 20.43 O ATOM 1342 CB LYS A 140 -6.346 -2.890 35.487 1.00 20.12 C ATOM 1343 CG LYS A 140 -7.522 -3.871 35.499 1.00 26.81 C ATOM 1344 CD LYS A 140 -7.097 -5.305 35.195 1.00 43.35 C ATOM 1345 CE LYS A 140 -6.355 -5.415 33.865 1.00 52.73 C ATOM 1346 NZ LYS A 140 -6.552 -6.743 33.217 1.00 70.56 N ATOM 1347 HZ1 LYS A 140 -6.198 -7.491 33.847 1.00 0.00 H ATOM 1348 HZ2 LYS A 140 -7.565 -6.892 33.035 1.00 0.00 H ATOM 1349 HZ3 LYS A 140 -6.030 -6.770 32.318 1.00 0.00 H ATOM 1350 H LYS A 140 -7.417 -1.138 33.815 1.00 0.00 H ATOM 1351 N ASN A 141 -5.352 0.451 35.414 1.00 14.70 N ATOM 1352 CA ASN A 141 -4.264 1.380 35.644 1.00 14.55 C ATOM 1353 C ASN A 141 -4.573 2.682 34.960 1.00 12.39 C ATOM 1354 O ASN A 141 -4.352 2.819 33.745 1.00 12.06 O ATOM 1355 CB ASN A 141 -2.938 0.815 35.135 1.00 15.35 C ATOM 1356 CG ASN A 141 -1.767 1.729 35.432 1.00 14.88 C ATOM 1357 OD1 ASN A 141 -1.923 2.926 35.731 1.00 17.42 O ATOM 1358 ND2 ASN A 141 -0.585 1.183 35.324 1.00 18.81 N ATOM 1359 HD22 ASN A 141 -0.498 0.178 35.072 1.00 0.00 H ATOM 1360 HD21 ASN A 141 0.269 1.754 35.490 1.00 0.00 H ATOM 1361 H ASN A 141 -6.008 0.627 34.627 1.00 0.00 H ATOM 1362 N LYS A 142 -5.039 3.646 35.746 1.00 13.49 N ATOM 1363 CA LYS A 142 -5.549 4.899 35.217 1.00 12.33 C ATOM 1364 C LYS A 142 -4.490 5.797 34.634 1.00 12.61 C ATOM 1365 O LYS A 142 -4.818 6.851 34.118 1.00 12.46 O ATOM 1366 CB LYS A 142 -6.430 5.643 36.253 1.00 14.38 C ATOM 1367 CG LYS A 142 -5.758 6.061 37.561 1.00 18.23 C ATOM 1368 CD LYS A 142 -4.797 7.227 37.389 1.00 25.43 C ATOM 1369 CE LYS A 142 -4.091 7.664 38.686 1.00 29.33 C ATOM 1370 NZ LYS A 142 -5.042 7.700 39.804 1.00 38.76 N ATOM 1371 HZ1 LYS A 142 -5.802 8.376 39.589 1.00 0.00 H ATOM 1372 HZ2 LYS A 142 -5.448 6.753 39.943 1.00 0.00 H ATOM 1373 HZ3 LYS A 142 -4.547 7.997 40.669 1.00 0.00 H ATOM 1374 H LYS A 142 -5.039 3.499 36.776 1.00 0.00 H ATOM 1375 N ASP A 143 -3.208 5.395 34.728 1.00 12.97 N ATOM 1376 CA ASP A 143 -2.122 6.174 34.109 1.00 14.07 C ATOM 1377 C ASP A 143 -1.579 5.531 32.844 1.00 12.33 C ATOM 1378 O ASP A 143 -0.665 6.058 32.225 1.00 16.52 O ATOM 1379 CB ASP A 143 -1.005 6.376 35.117 1.00 19.10 C ATOM 1380 CG ASP A 143 -1.424 7.273 36.274 1.00 21.39 C ATOM 1381 OD1 ASP A 143 -2.104 8.281 36.031 1.00 22.84 O ATOM 1382 OD2 ASP A 143 -1.084 6.964 37.421 1.00 29.79 O ATOM 1383 H ASP A 143 -2.982 4.522 35.245 1.00 0.00 H ATOM 1384 N LYS A 144 -2.122 4.381 32.482 1.00 11.49 N ATOM 1385 CA LYS A 144 -1.660 3.661 31.294 1.00 10.39 C ATOM 1386 C LYS A 144 -2.610 3.848 30.120 1.00 9.62 C ATOM 1387 O LYS A 144 -3.736 3.327 30.127 1.00 9.44 O ATOM 1388 CB LYS A 144 -1.532 2.189 31.589 1.00 12.33 C ATOM 1389 CG LYS A 144 -1.002 1.401 30.418 1.00 18.02 C ATOM 1390 CD LYS A 144 -0.910 -0.058 30.740 1.00 26.71 C ATOM 1391 CE LYS A 144 0.228 -0.668 29.931 1.00 41.63 C ATOM 1392 NZ LYS A 144 0.199 -2.156 29.950 1.00 57.76 N ATOM 1393 HZ1 LYS A 144 0.284 -2.491 30.931 1.00 0.00 H ATOM 1394 HZ2 LYS A 144 -0.699 -2.489 29.546 1.00 0.00 H ATOM 1395 HZ3 LYS A 144 0.992 -2.524 29.386 1.00 0.00 H ATOM 1396 H LYS A 144 -2.893 3.980 33.053 1.00 0.00 H ATOM 1397 N ARG A 145 -2.130 4.526 29.086 1.00 9.69 N ATOM 1398 CA ARG A 145 -2.908 4.668 27.876 1.00 8.41 C ATOM 1399 C ARG A 145 -3.124 3.306 27.189 1.00 8.60 C ATOM 1400 O ARG A 145 -2.218 2.460 27.113 1.00 9.90 O ATOM 1401 CB ARG A 145 -2.254 5.630 26.920 1.00 8.87 C ATOM 1402 CG ARG A 145 -2.259 7.076 27.393 1.00 8.99 C ATOM 1403 CD ARG A 145 -1.417 7.848 26.450 1.00 9.51 C ATOM 1404 NE ARG A 145 -1.153 9.230 26.715 1.00 10.79 N ATOM 1405 CZ ARG A 145 -1.697 10.266 26.079 1.00 9.46 C ATOM 1406 NH1 ARG A 145 -2.674 10.087 25.187 1.00 9.44 N ATOM 1407 NH2 ARG A 145 -1.250 11.487 26.331 1.00 10.23 N ATOM 1408 HE ARG A 145 -0.474 9.444 27.473 1.00 0.00 H ATOM 1409 HH12 ARG A 145 -3.089 10.906 24.699 1.00 0.00 H ATOM 1410 HH11 ARG A 145 -3.020 9.128 24.981 1.00 0.00 H ATOM 1411 HH22 ARG A 145 -1.666 12.305 25.841 1.00 0.00 H ATOM 1412 HH21 ARG A 145 -0.483 11.628 27.019 1.00 0.00 H ATOM 1413 H ARG A 145 -1.186 4.959 29.146 1.00 0.00 H ATOM 1414 N VAL A 146 -4.334 3.117 26.680 1.00 7.83 N ATOM 1415 CA VAL A 146 -4.682 1.931 25.900 1.00 7.79 C ATOM 1416 C VAL A 146 -5.213 2.344 24.531 1.00 8.02 C ATOM 1417 O VAL A 146 -5.757 3.444 24.364 1.00 7.17 O ATOM 1418 CB VAL A 146 -5.683 1.023 26.624 1.00 9.37 C ATOM 1419 CG1 VAL A 146 -5.082 0.487 27.916 1.00 11.24 C ATOM 1420 CG2 VAL A 146 -7.020 1.714 26.907 1.00 9.16 C ATOM 1421 H VAL A 146 -5.063 3.841 26.842 1.00 0.00 H ATOM 1422 N LEU A 147 -5.037 1.451 23.568 1.00 8.65 N ATOM 1423 CA LEU A 147 -5.507 1.691 22.210 1.00 8.05 C ATOM 1424 C LEU A 147 -6.996 1.427 22.096 1.00 8.60 C ATOM 1425 O LEU A 147 -7.452 0.290 22.267 1.00 10.32 O ATOM 1426 CB LEU A 147 -4.765 0.789 21.237 1.00 9.83 C ATOM 1427 CG LEU A 147 -5.126 0.869 19.764 1.00 9.63 C ATOM 1428 CD1 LEU A 147 -4.883 2.265 19.196 1.00 9.83 C ATOM 1429 CD2 LEU A 147 -4.336 -0.186 19.008 1.00 11.10 C ATOM 1430 H LEU A 147 -4.552 0.558 23.787 1.00 0.00 H ATOM 1431 N VAL A 148 -7.755 2.462 21.763 1.00 7.29 N ATOM 1432 CA VAL A 148 -9.223 2.329 21.733 1.00 7.31 C ATOM 1433 C VAL A 148 -9.752 1.818 20.401 1.00 7.36 C ATOM 1434 O VAL A 148 -10.879 1.356 20.357 1.00 10.21 O ATOM 1435 CB VAL A 148 -9.958 3.653 22.086 1.00 7.11 C ATOM 1436 CG1 VAL A 148 -9.474 4.227 23.421 1.00 8.62 C ATOM 1437 CG2 VAL A 148 -9.810 4.707 20.995 1.00 7.95 C ATOM 1438 H VAL A 148 -7.313 3.372 21.522 1.00 0.00 H ATOM 1439 N TYR A 149 -8.954 1.908 19.348 1.00 6.82 N ATOM 1440 CA TYR A 149 -9.307 1.470 18.004 1.00 8.08 C ATOM 1441 C TYR A 149 -9.025 -0.007 17.769 1.00 12.56 C ATOM 1442 O TYR A 149 -7.952 -0.450 17.988 1.00 18.87 O ATOM 1443 CB TYR A 149 -8.551 2.307 16.950 1.00 7.81 C ATOM 1444 CG TYR A 149 -9.151 3.661 16.742 1.00 6.85 C ATOM 1445 CD1 TYR A 149 -10.166 3.846 15.829 1.00 6.93 C ATOM 1446 CD2 TYR A 149 -8.745 4.747 17.492 1.00 6.73 C ATOM 1447 CE1 TYR A 149 -10.740 5.093 15.622 1.00 7.87 C ATOM 1448 CE2 TYR A 149 -9.311 6.004 17.317 1.00 7.18 C ATOM 1449 CZ TYR A 149 -10.321 6.180 16.375 1.00 7.64 C ATOM 1450 OH TYR A 149 -10.893 7.416 16.243 1.00 7.45 O ATOM 1451 HH TYR A 149 -11.589 7.383 15.540 1.00 0.00 H ATOM 1452 H TYR A 149 -8.010 2.320 19.490 1.00 0.00 H ATOM 1453 N ALA A 150 -9.976 -0.717 17.192 1.00 19.92 N ATOM 1454 CA ALA A 150 -9.819 -2.147 16.793 1.00 28.10 C ATOM 1455 C ALA A 150 -10.892 -2.497 15.757 1.00 39.10 C ATOM 1456 O ALA A 150 -11.939 -1.839 15.704 1.00 34.85 O ATOM 1457 CB ALA A 150 -9.914 -3.076 18.000 1.00 33.28 C ATOM 1458 H ALA A 150 -10.888 -0.253 17.004 1.00 0.00 H TER 1459 ALA A 150 ATOM 1460 N THR B 2 -5.145 -4.885 8.927 1.00 25.41 N ATOM 1461 CA THR B 2 -5.609 -4.072 7.763 1.00 16.39 C ATOM 1462 C THR B 2 -4.408 -3.753 6.879 1.00 12.60 C ATOM 1463 O THR B 2 -3.388 -3.240 7.350 1.00 13.76 O ATOM 1464 CB THR B 2 -6.267 -2.741 8.215 1.00 21.82 C ATOM 1465 OG1 THR B 2 -7.396 -3.032 9.039 1.00 30.09 O ATOM 1466 CG2 THR B 2 -6.758 -1.890 7.030 1.00 19.94 C ATOM 1467 HG1 THR B 2 -7.818 -2.185 9.329 1.00 0.00 H ATOM 1468 HN3 THR B 2 -4.441 -4.343 9.468 1.00 0.00 H ATOM 1469 HN2 THR B 2 -4.715 -5.767 8.583 1.00 0.00 H ATOM 1470 HN1 THR B 2 -5.957 -5.109 9.538 1.00 0.00 H ATOM 1471 N THR B 3 -4.540 -4.047 5.594 1.00 12.09 N ATOM 1472 CA THR B 3 -3.531 -3.707 4.611 1.00 10.44 C ATOM 1473 C THR B 3 -3.811 -2.326 4.044 1.00 8.75 C ATOM 1474 O THR B 3 -4.957 -1.963 3.844 1.00 10.24 O ATOM 1475 CB THR B 3 -3.517 -4.775 3.518 1.00 13.20 C ATOM 1476 OG1 THR B 3 -3.254 -6.037 4.153 1.00 16.18 O ATOM 1477 CG2 THR B 3 -2.443 -4.507 2.526 1.00 15.98 C ATOM 1478 HG1 THR B 3 -3.238 -6.752 3.469 1.00 0.00 H ATOM 1479 H THR B 3 -5.400 -4.540 5.279 1.00 0.00 H ATOM 1480 N PHE B 4 -2.764 -1.561 3.768 1.00 7.14 N ATOM 1481 CA PHE B 4 -2.912 -0.196 3.296 1.00 7.57 C ATOM 1482 C PHE B 4 -1.744 0.234 2.447 1.00 7.04 C ATOM 1483 O PHE B 4 -0.680 -0.399 2.447 1.00 7.30 O ATOM 1484 CB PHE B 4 -3.121 0.794 4.444 1.00 7.17 C ATOM 1485 CG PHE B 4 -2.058 0.765 5.481 1.00 7.89 C ATOM 1486 CD1 PHE B 4 -2.132 -0.127 6.546 1.00 7.65 C ATOM 1487 CD2 PHE B 4 -0.963 1.616 5.395 1.00 8.42 C ATOM 1488 CE1 PHE B 4 -1.131 -0.165 7.516 1.00 6.81 C ATOM 1489 CE2 PHE B 4 0.054 1.566 6.349 1.00 9.07 C ATOM 1490 CZ PHE B 4 -0.028 0.650 7.404 1.00 8.56 C ATOM 1491 H PHE B 4 -1.808 -1.950 3.893 1.00 0.00 H ATOM 1492 N LEU B 5 -1.980 1.312 1.699 1.00 7.68 N ATOM 1493 CA LEU B 5 -0.947 2.022 0.994 1.00 7.17 C ATOM 1494 C LEU B 5 -0.572 3.253 1.801 1.00 6.70 C ATOM 1495 O LEU B 5 -1.438 3.934 2.368 1.00 8.10 O ATOM 1496 CB LEU B 5 -1.425 2.472 -0.390 1.00 7.48 C ATOM 1497 CG LEU B 5 -2.310 1.491 -1.156 1.00 7.86 C ATOM 1498 CD1 LEU B 5 -2.657 2.103 -2.486 1.00 9.80 C ATOM 1499 CD2 LEU B 5 -1.581 0.155 -1.289 1.00 8.91 C ATOM 1500 H LEU B 5 -2.958 1.656 1.622 1.00 0.00 H ATOM 1501 N ILE B 6 0.720 3.554 1.835 1.00 6.13 N ATOM 1502 CA ILE B 6 1.227 4.758 2.476 1.00 7.03 C ATOM 1503 C ILE B 6 1.399 5.847 1.403 1.00 7.15 C ATOM 1504 O ILE B 6 2.290 5.767 0.562 1.00 8.06 O ATOM 1505 CB ILE B 6 2.553 4.495 3.206 1.00 7.56 C ATOM 1506 CG1 ILE B 6 2.307 3.488 4.340 1.00 8.03 C ATOM 1507 CG2 ILE B 6 3.135 5.792 3.759 1.00 7.50 C ATOM 1508 CD1 ILE B 6 3.562 2.997 5.051 1.00 7.65 C ATOM 1509 H ILE B 6 1.397 2.904 1.386 1.00 0.00 H ATOM 1510 N LYS B 7 0.482 6.796 1.419 1.00 6.83 N ATOM 1511 CA LYS B 7 0.351 7.799 0.374 1.00 7.69 C ATOM 1512 C LYS B 7 0.875 9.161 0.830 1.00 7.56 C ATOM 1513 O LYS B 7 0.386 9.766 1.785 1.00 7.46 O ATOM 1514 CB LYS B 7 -1.119 7.906 -0.088 1.00 8.11 C ATOM 1515 CG LYS B 7 -1.271 8.840 -1.315 1.00 10.02 C ATOM 1516 CD LYS B 7 -2.585 8.710 -2.067 1.00 16.37 C ATOM 1517 CE LYS B 7 -3.657 9.613 -1.611 1.00 17.75 C ATOM 1518 NZ LYS B 7 -4.717 9.721 -2.688 1.00 17.90 N ATOM 1519 HZ1 LYS B 7 -4.289 10.100 -3.557 1.00 0.00 H ATOM 1520 HZ2 LYS B 7 -5.114 8.779 -2.878 1.00 0.00 H ATOM 1521 HZ3 LYS B 7 -5.473 10.358 -2.366 1.00 0.00 H ATOM 1522 H LYS B 7 -0.181 6.828 2.220 1.00 0.00 H ATOM 1523 N HIS B 8 1.891 9.649 0.137 1.00 7.89 N ATOM 1524 CA HIS B 8 2.398 10.984 0.363 1.00 8.42 C ATOM 1525 C HIS B 8 1.304 11.967 -0.023 1.00 9.15 C ATOM 1526 O HIS B 8 0.822 11.989 -1.172 1.00 10.61 O ATOM 1527 CB HIS B 8 3.634 11.189 -0.472 1.00 9.48 C ATOM 1528 CG HIS B 8 4.313 12.502 -0.249 1.00 9.95 C ATOM 1529 ND1 HIS B 8 4.459 13.430 -1.264 1.00 12.69 N ATOM 1530 CD2 HIS B 8 4.916 13.033 0.831 1.00 10.49 C ATOM 1531 CE1 HIS B 8 5.104 14.480 -0.803 1.00 12.08 C ATOM 1532 NE2 HIS B 8 5.395 14.264 0.467 1.00 11.25 N ATOM 1533 H HIS B 8 2.338 9.055 -0.591 1.00 0.00 H ATOM 1534 N LYS B 9 0.841 12.734 0.943 1.00 8.91 N ATOM 1535 CA LYS B 9 -0.412 13.496 0.767 1.00 11.16 C ATOM 1536 C LYS B 9 -0.280 14.571 -0.300 1.00 12.15 C ATOM 1537 O LYS B 9 -1.202 14.717 -1.142 1.00 14.65 O ATOM 1538 CB LYS B 9 -0.860 14.102 2.089 1.00 12.37 C ATOM 1539 CG LYS B 9 -2.258 14.677 2.146 1.00 15.20 C ATOM 1540 CD LYS B 9 -2.554 15.120 3.596 1.00 15.75 C ATOM 1541 CE LYS B 9 -3.985 15.547 3.775 1.00 18.83 C ATOM 1542 NZ LYS B 9 -4.103 16.276 5.075 1.00 18.48 N ATOM 1543 HZ1 LYS B 9 -3.820 15.645 5.852 1.00 0.00 H ATOM 1544 HZ2 LYS B 9 -3.482 17.110 5.061 1.00 0.00 H ATOM 1545 HZ3 LYS B 9 -5.088 16.578 5.213 1.00 0.00 H ATOM 1546 H LYS B 9 1.364 12.804 1.839 1.00 0.00 H ATOM 1547 N ALA B 10 0.852 15.286 -0.315 1.00 13.06 N ATOM 1548 CA ALA B 10 1.021 16.394 -1.262 1.00 15.24 C ATOM 1549 C ALA B 10 1.125 15.934 -2.704 1.00 14.26 C ATOM 1550 O ALA B 10 0.596 16.623 -3.604 1.00 19.65 O ATOM 1551 CB ALA B 10 2.222 17.275 -0.893 1.00 13.96 C ATOM 1552 H ALA B 10 1.617 15.054 0.350 1.00 0.00 H ATOM 1553 N SER B 11 1.799 14.813 -2.941 1.00 12.61 N ATOM 1554 CA SER B 11 2.084 14.351 -4.326 1.00 12.70 C ATOM 1555 C SER B 11 1.200 13.223 -4.847 1.00 12.92 C ATOM 1556 O SER B 11 1.079 13.037 -6.075 1.00 15.18 O ATOM 1557 CB SER B 11 3.520 13.859 -4.448 1.00 12.44 C ATOM 1558 OG SER B 11 3.734 12.611 -3.759 1.00 11.23 O ATOM 1559 HG SER B 11 3.531 12.727 -2.797 1.00 0.00 H ATOM 1560 H SER B 11 2.136 14.245 -2.138 1.00 0.00 H ATOM 1561 N GLY B 12 0.625 12.440 -3.943 1.00 12.73 N ATOM 1562 CA GLY B 12 -0.114 11.246 -4.323 1.00 12.62 C ATOM 1563 C GLY B 12 0.754 10.056 -4.643 1.00 11.55 C ATOM 1564 O GLY B 12 0.237 9.007 -5.055 1.00 13.37 O ATOM 1565 H GLY B 12 0.705 12.687 -2.936 1.00 0.00 H ATOM 1566 N LYS B 13 2.071 10.176 -4.452 1.00 10.47 N ATOM 1567 CA LYS B 13 2.941 9.033 -4.651 1.00 10.71 C ATOM 1568 C LYS B 13 2.898 8.173 -3.373 1.00 10.01 C ATOM 1569 O LYS B 13 2.368 8.597 -2.343 1.00 11.98 O ATOM 1570 CB LYS B 13 4.371 9.480 -4.999 1.00 12.43 C ATOM 1571 CG LYS B 13 4.482 10.237 -6.341 1.00 13.41 C ATOM 1572 CD LYS B 13 5.919 10.396 -6.788 1.00 15.14 C ATOM 1573 CE LYS B 13 6.047 10.945 -8.225 1.00 14.57 C ATOM 1574 NZ LYS B 13 5.723 12.411 -8.241 1.00 15.53 N ATOM 1575 HZ1 LYS B 13 4.750 12.553 -7.904 1.00 0.00 H ATOM 1576 HZ2 LYS B 13 6.384 12.918 -7.619 1.00 0.00 H ATOM 1577 HZ3 LYS B 13 5.811 12.774 -9.212 1.00 0.00 H ATOM 1578 H LYS B 13 2.473 11.090 -4.160 1.00 0.00 H ATOM 1579 N PHE B 14 3.455 6.974 -3.451 1.00 8.06 N ATOM 1580 CA PHE B 14 3.356 5.992 -2.354 1.00 8.20 C ATOM 1581 C PHE B 14 4.736 5.529 -1.891 1.00 8.11 C ATOM 1582 O PHE B 14 5.711 5.536 -2.654 1.00 8.52 O ATOM 1583 CB PHE B 14 2.579 4.756 -2.830 1.00 7.82 C ATOM 1584 CG PHE B 14 1.203 5.078 -3.348 1.00 8.28 C ATOM 1585 CD1 PHE B 14 0.126 5.227 -2.481 1.00 9.48 C ATOM 1586 CD2 PHE B 14 0.997 5.255 -4.704 1.00 9.99 C ATOM 1587 CE1 PHE B 14 -1.132 5.528 -2.946 1.00 10.00 C ATOM 1588 CE2 PHE B 14 -0.270 5.601 -5.189 1.00 11.08 C ATOM 1589 CZ PHE B 14 -1.328 5.737 -4.306 1.00 12.28 C ATOM 1590 H PHE B 14 3.978 6.717 -4.312 1.00 0.00 H ATOM 1591 N LEU B 15 4.793 5.047 -0.654 1.00 6.90 N ATOM 1592 CA LEU B 15 6.009 4.442 -0.172 1.00 7.57 C ATOM 1593 C LEU B 15 6.229 3.082 -0.795 1.00 7.81 C ATOM 1594 O LEU B 15 5.337 2.230 -0.785 1.00 8.09 O ATOM 1595 CB LEU B 15 5.985 4.347 1.355 1.00 7.85 C ATOM 1596 CG LEU B 15 7.311 4.089 2.061 1.00 8.60 C ATOM 1597 CD1 LEU B 15 8.198 5.319 1.948 1.00 10.33 C ATOM 1598 CD2 LEU B 15 7.146 3.689 3.517 1.00 9.38 C ATOM 1599 H LEU B 15 3.960 5.106 -0.034 1.00 0.00 H ATOM 1600 N HIS B 16 7.451 2.850 -1.291 1.00 7.98 N ATOM 1601 CA HIS B 16 7.846 1.600 -1.932 1.00 8.75 C ATOM 1602 C HIS B 16 9.232 1.199 -1.462 1.00 8.17 C ATOM 1603 O HIS B 16 10.039 2.074 -1.230 1.00 8.13 O ATOM 1604 CB HIS B 16 8.071 1.799 -3.445 1.00 8.78 C ATOM 1605 CG HIS B 16 6.836 1.900 -4.281 1.00 9.26 C ATOM 1606 ND1 HIS B 16 6.600 1.052 -5.339 1.00 10.36 N ATOM 1607 CD2 HIS B 16 5.827 2.806 -4.296 1.00 10.38 C ATOM 1608 CE1 HIS B 16 5.474 1.394 -5.935 1.00 10.55 C ATOM 1609 NE2 HIS B 16 4.991 2.462 -5.335 1.00 11.59 N ATOM 1610 H HIS B 16 8.161 3.606 -1.215 1.00 0.00 H ATOM 1611 N PRO B 17 9.542 -0.119 -1.407 1.00 9.22 N ATOM 1612 CA PRO B 17 10.973 -0.491 -1.383 1.00 9.54 C ATOM 1613 C PRO B 17 11.585 -0.123 -2.736 1.00 10.17 C ATOM 1614 O PRO B 17 10.966 -0.401 -3.774 1.00 10.04 O ATOM 1615 CB PRO B 17 10.950 -2.011 -1.220 1.00 10.40 C ATOM 1616 CG PRO B 17 9.648 -2.447 -1.804 1.00 10.27 C ATOM 1617 CD PRO B 17 8.674 -1.278 -1.665 1.00 10.09 C ATOM 1618 N TYR B 18 12.773 0.479 -2.742 1.00 10.72 N ATOM 1619 CA TYR B 18 13.421 0.807 -4.009 1.00 12.06 C ATOM 1620 C TYR B 18 13.605 -0.504 -4.767 1.00 12.33 C ATOM 1621 O TYR B 18 14.158 -1.473 -4.229 1.00 13.96 O ATOM 1622 CB TYR B 18 14.780 1.468 -3.761 1.00 12.13 C ATOM 1623 CG TYR B 18 15.551 1.780 -5.027 1.00 13.62 C ATOM 1624 CD1 TYR B 18 15.084 2.707 -5.925 1.00 14.61 C ATOM 1625 CD2 TYR B 18 16.744 1.135 -5.299 1.00 19.25 C ATOM 1626 CE1 TYR B 18 15.777 2.994 -7.084 1.00 17.03 C ATOM 1627 CE2 TYR B 18 17.452 1.411 -6.445 1.00 23.49 C ATOM 1628 CZ TYR B 18 16.967 2.355 -7.317 1.00 22.37 C ATOM 1629 OH TYR B 18 17.651 2.608 -8.459 1.00 27.43 O ATOM 1630 HH TYR B 18 17.178 3.307 -8.977 1.00 0.00 H ATOM 1631 H TYR B 18 13.240 0.716 -1.843 1.00 0.00 H ATOM 1632 N GLY B 19 13.168 -0.516 -6.029 1.00 12.64 N ATOM 1633 CA GLY B 19 13.211 -1.720 -6.836 1.00 12.66 C ATOM 1634 C GLY B 19 11.966 -2.570 -6.835 1.00 12.01 C ATOM 1635 O GLY B 19 11.834 -3.464 -7.667 1.00 14.08 O ATOM 1636 H GLY B 19 12.788 0.359 -6.443 1.00 0.00 H ATOM 1637 N GLY B 20 11.078 -2.363 -5.866 1.00 12.69 N ATOM 1638 CA GLY B 20 9.798 -3.032 -5.873 1.00 14.05 C ATOM 1639 C GLY B 20 9.768 -4.535 -5.676 1.00 11.93 C ATOM 1640 O GLY B 20 8.838 -5.178 -6.108 1.00 14.14 O ATOM 1641 H GLY B 20 11.309 -1.709 -5.091 1.00 0.00 H ATOM 1642 N SER B 21 10.759 -5.093 -4.994 1.00 11.98 N ATOM 1643 CA SER B 21 10.852 -6.546 -4.824 1.00 12.33 C ATOM 1644 C SER B 21 9.854 -7.100 -3.828 1.00 12.41 C ATOM 1645 O SER B 21 9.542 -6.441 -2.834 1.00 10.90 O ATOM 1646 CB SER B 21 12.276 -6.919 -4.363 1.00 13.48 C ATOM 1647 OG SER B 21 12.401 -8.323 -4.257 1.00 15.00 O ATOM 1648 HG SER B 21 13.318 -8.550 -3.961 1.00 0.00 H ATOM 1649 H SER B 21 11.488 -4.485 -4.569 1.00 0.00 H ATOM 1650 N SER B 22 9.389 -8.331 -4.064 1.00 13.34 N ATOM 1651 CA SER B 22 8.641 -9.074 -3.048 1.00 13.91 C ATOM 1652 C SER B 22 9.507 -9.473 -1.851 1.00 13.29 C ATOM 1653 O SER B 22 8.971 -9.764 -0.766 1.00 15.68 O ATOM 1654 CB SER B 22 7.921 -10.283 -3.663 1.00 17.33 C ATOM 1655 OG SER B 22 8.855 -11.187 -4.167 1.00 22.19 O ATOM 1656 HG SER B 22 9.443 -11.496 -3.433 1.00 0.00 H ATOM 1657 H SER B 22 9.563 -8.771 -4.990 1.00 0.00 H ATOM 1658 N ASN B 23 10.821 -9.498 -2.036 1.00 13.66 N ATOM 1659 CA ASN B 23 11.756 -9.747 -0.929 1.00 14.88 C ATOM 1660 C ASN B 23 13.009 -8.862 -1.008 1.00 13.45 C ATOM 1661 O ASN B 23 14.116 -9.334 -1.347 1.00 15.97 O ATOM 1662 CB ASN B 23 12.121 -11.231 -0.845 1.00 16.21 C ATOM 1663 CG ASN B 23 12.875 -11.578 0.434 1.00 19.10 C ATOM 1664 OD1 ASN B 23 12.812 -10.868 1.418 1.00 20.42 O ATOM 1665 ND2 ASN B 23 13.587 -12.686 0.407 1.00 25.80 N ATOM 1666 HD22 ASN B 23 13.614 -13.266 -0.456 1.00 0.00 H ATOM 1667 HD21 ASN B 23 14.122 -12.981 1.249 1.00 0.00 H ATOM 1668 H ASN B 23 11.200 -9.337 -2.991 1.00 0.00 H ATOM 1669 N PRO B 24 12.850 -7.574 -0.673 1.00 12.33 N ATOM 1670 CA PRO B 24 13.963 -6.646 -0.695 1.00 11.92 C ATOM 1671 C PRO B 24 15.018 -7.095 0.312 1.00 13.74 C ATOM 1672 O PRO B 24 14.668 -7.582 1.418 1.00 13.16 O ATOM 1673 CB PRO B 24 13.318 -5.293 -0.268 1.00 13.67 C ATOM 1674 CG PRO B 24 11.865 -5.484 -0.477 1.00 13.04 C ATOM 1675 CD PRO B 24 11.638 -6.930 -0.143 1.00 11.73 C ATOM 1676 N ALA B 25 16.288 -6.972 -0.044 1.00 12.59 N ATOM 1677 CA ALA B 25 17.347 -7.266 0.921 1.00 13.57 C ATOM 1678 C ALA B 25 17.240 -6.363 2.136 1.00 11.60 C ATOM 1679 O ALA B 25 16.752 -5.216 2.055 1.00 12.01 O ATOM 1680 CB ALA B 25 18.695 -7.094 0.286 1.00 15.63 C ATOM 1681 H ALA B 25 16.532 -6.667 -1.008 1.00 0.00 H ATOM 1682 N ASN B 26 17.767 -6.834 3.258 1.00 11.32 N ATOM 1683 CA ASN B 26 18.002 -5.916 4.374 1.00 11.76 C ATOM 1684 C ASN B 26 18.734 -4.624 3.930 1.00 10.99 C ATOM 1685 O ASN B 26 19.689 -4.654 3.118 1.00 13.87 O ATOM 1686 CB ASN B 26 18.768 -6.592 5.497 1.00 11.24 C ATOM 1687 CG ASN B 26 17.924 -7.594 6.250 1.00 12.70 C ATOM 1688 OD1 ASN B 26 16.741 -7.350 6.532 1.00 11.60 O ATOM 1689 ND2 ASN B 26 18.513 -8.742 6.564 1.00 15.09 N ATOM 1690 HD22 ASN B 26 19.508 -8.903 6.307 1.00 0.00 H ATOM 1691 HD21 ASN B 26 17.979 -9.480 7.067 1.00 0.00 H ATOM 1692 H ASN B 26 18.010 -7.842 3.344 1.00 0.00 H ATOM 1693 N ASN B 27 18.247 -3.499 4.461 1.00 10.80 N ATOM 1694 CA ASN B 27 18.781 -2.171 4.237 1.00 11.43 C ATOM 1695 C ASN B 27 18.419 -1.583 2.858 1.00 11.60 C ATOM 1696 O ASN B 27 18.940 -0.555 2.474 1.00 12.97 O ATOM 1697 CB ASN B 27 20.294 -2.096 4.590 1.00 12.42 C ATOM 1698 CG ASN B 27 20.519 -2.247 6.074 1.00 14.36 C ATOM 1699 OD1 ASN B 27 19.734 -1.701 6.890 1.00 16.06 O ATOM 1700 ND2 ASN B 27 21.533 -2.974 6.448 1.00 19.39 N ATOM 1701 HD22 ASN B 27 22.155 -3.405 5.735 1.00 0.00 H ATOM 1702 HD21 ASN B 27 21.721 -3.123 7.460 1.00 0.00 H ATOM 1703 H ASN B 27 17.419 -3.583 5.085 1.00 0.00 H ATOM 1704 N THR B 28 17.455 -2.201 2.159 1.00 11.84 N ATOM 1705 CA THR B 28 16.884 -1.557 0.960 1.00 11.98 C ATOM 1706 C THR B 28 16.188 -0.262 1.365 1.00 11.02 C ATOM 1707 O THR B 28 15.429 -0.245 2.330 1.00 12.32 O ATOM 1708 CB THR B 28 15.903 -2.488 0.253 1.00 10.74 C ATOM 1709 OG1 THR B 28 16.584 -3.686 -0.147 1.00 12.26 O ATOM 1710 CG2 THR B 28 15.271 -1.788 -0.946 1.00 11.68 C ATOM 1711 HG1 THR B 28 15.947 -4.289 -0.605 1.00 0.00 H ATOM 1712 H THR B 28 17.110 -3.134 2.462 1.00 0.00 H ATOM 1713 N LYS B 29 16.480 0.824 0.656 1.00 11.56 N ATOM 1714 CA LYS B 29 15.904 2.119 0.908 1.00 10.96 C ATOM 1715 C LYS B 29 14.432 2.125 0.548 1.00 10.24 C ATOM 1716 O LYS B 29 13.972 1.441 -0.350 1.00 10.26 O ATOM 1717 CB LYS B 29 16.612 3.238 0.122 1.00 12.46 C ATOM 1718 CG LYS B 29 18.035 3.480 0.582 1.00 14.91 C ATOM 1719 CD LYS B 29 18.749 4.532 -0.210 1.00 20.71 C ATOM 1720 CE LYS B 29 20.196 4.631 0.243 1.00 28.62 C ATOM 1721 NZ LYS B 29 20.876 5.734 -0.478 1.00 36.10 N ATOM 1722 HZ1 LYS B 29 20.848 5.547 -1.501 1.00 0.00 H ATOM 1723 HZ2 LYS B 29 20.390 6.631 -0.275 1.00 0.00 H ATOM 1724 HZ3 LYS B 29 21.865 5.795 -0.162 1.00 0.00 H ATOM 1725 H LYS B 29 17.162 0.733 -0.124 1.00 0.00 H ATOM 1726 N LEU B 30 13.711 2.937 1.284 1.00 9.98 N ATOM 1727 CA LEU B 30 12.306 3.174 1.021 1.00 8.62 C ATOM 1728 C LEU B 30 12.187 4.510 0.289 1.00 8.99 C ATOM 1729 O LEU B 30 12.681 5.528 0.756 1.00 9.68 O ATOM 1730 CB LEU B 30 11.539 3.208 2.338 1.00 8.74 C ATOM 1731 CG LEU B 30 11.347 1.817 2.941 1.00 9.84 C ATOM 1732 CD1 LEU B 30 11.193 1.979 4.448 1.00 10.64 C ATOM 1733 CD2 LEU B 30 10.194 1.052 2.284 1.00 10.00 C ATOM 1734 H LEU B 30 14.163 3.427 2.083 1.00 0.00 H ATOM 1735 N VAL B 31 11.549 4.464 -0.870 1.00 9.13 N ATOM 1736 CA VAL B 31 11.395 5.624 -1.746 1.00 9.36 C ATOM 1737 C VAL B 31 9.937 5.933 -1.978 1.00 8.16 C ATOM 1738 O VAL B 31 9.050 5.166 -1.555 1.00 9.29 O ATOM 1739 CB VAL B 31 12.082 5.368 -3.125 1.00 9.87 C ATOM 1740 CG1 VAL B 31 13.567 5.119 -2.912 1.00 12.33 C ATOM 1741 CG2 VAL B 31 11.419 4.195 -3.861 1.00 11.38 C ATOM 1742 H VAL B 31 11.137 3.558 -1.172 1.00 0.00 H ATOM 1743 N LEU B 32 9.674 7.061 -2.647 1.00 9.06 N ATOM 1744 CA LEU B 32 8.322 7.354 -3.136 1.00 8.01 C ATOM 1745 C LEU B 32 8.228 7.018 -4.608 1.00 8.65 C ATOM 1746 O LEU B 32 9.154 7.323 -5.361 1.00 10.52 O ATOM 1747 CB LEU B 32 7.977 8.811 -2.914 1.00 9.74 C ATOM 1748 CG LEU B 32 7.939 9.250 -1.451 1.00 10.16 C ATOM 1749 CD1 LEU B 32 7.526 10.704 -1.419 1.00 14.03 C ATOM 1750 CD2 LEU B 32 6.941 8.416 -0.678 1.00 11.06 C ATOM 1751 H LEU B 32 10.440 7.742 -2.823 1.00 0.00 H ATOM 1752 N HIS B 33 7.129 6.375 -4.998 1.00 8.37 N ATOM 1753 CA HIS B 33 6.899 6.037 -6.419 1.00 8.91 C ATOM 1754 C HIS B 33 5.394 6.036 -6.688 1.00 10.68 C ATOM 1755 O HIS B 33 4.597 5.681 -5.808 1.00 9.56 O ATOM 1756 CB HIS B 33 7.584 4.692 -6.749 1.00 9.79 C ATOM 1757 CG HIS B 33 7.774 4.438 -8.212 1.00 11.82 C ATOM 1758 ND1 HIS B 33 6.745 4.067 -9.044 1.00 11.38 N ATOM 1759 CD2 HIS B 33 8.891 4.446 -8.975 1.00 11.83 C ATOM 1760 CE1 HIS B 33 7.203 3.960 -10.282 1.00 13.66 C ATOM 1761 NE2 HIS B 33 8.508 4.131 -10.254 1.00 13.74 N ATOM 1762 H HIS B 33 6.418 6.105 -4.289 1.00 0.00 H ATOM 1763 N SER B 34 4.997 6.457 -7.894 1.00 10.96 N ATOM 1764 CA SER B 34 3.609 6.571 -8.267 1.00 12.83 C ATOM 1765 C SER B 34 2.873 5.213 -8.508 1.00 10.13 C ATOM 1766 O SER B 34 1.630 5.157 -8.442 1.00 10.62 O ATOM 1767 CB SER B 34 3.471 7.547 -9.469 1.00 17.35 C ATOM 1768 OG SER B 34 4.249 7.115 -10.529 1.00 22.88 O ATOM 1769 HG SER B 34 5.198 7.079 -10.248 1.00 0.00 H ATOM 1770 H SER B 34 5.722 6.714 -8.594 1.00 0.00 H ATOM 1771 N ASP B 35 3.611 4.129 -8.736 1.00 9.82 N ATOM 1772 CA ASP B 35 3.000 2.816 -9.052 1.00 10.68 C ATOM 1773 C ASP B 35 2.264 2.226 -7.854 1.00 10.02 C ATOM 1774 O ASP B 35 2.626 2.487 -6.697 1.00 10.92 O ATOM 1775 CB ASP B 35 4.022 1.770 -9.522 1.00 12.07 C ATOM 1776 CG ASP B 35 4.563 2.014 -10.916 1.00 13.83 C ATOM 1777 OD1 ASP B 35 4.129 2.965 -11.620 1.00 16.46 O ATOM 1778 OD2 ASP B 35 5.461 1.217 -11.288 1.00 17.38 O ATOM 1779 H ASP B 35 4.647 4.206 -8.691 1.00 0.00 H ATOM 1780 N ILE B 36 1.231 1.439 -8.144 1.00 9.92 N ATOM 1781 CA ILE B 36 0.559 0.639 -7.146 1.00 9.26 C ATOM 1782 C ILE B 36 0.649 -0.827 -7.542 1.00 10.05 C ATOM 1783 O ILE B 36 0.388 -1.189 -8.718 1.00 10.79 O ATOM 1784 CB ILE B 36 -0.925 1.050 -7.000 1.00 10.74 C ATOM 1785 CG1 ILE B 36 -1.060 2.520 -6.630 1.00 13.58 C ATOM 1786 CG2 ILE B 36 -1.663 0.118 -6.028 1.00 11.63 C ATOM 1787 CD1 ILE B 36 -2.493 3.002 -6.666 1.00 16.25 C ATOM 1788 H ILE B 36 0.894 1.398 -9.127 1.00 0.00 H ATOM 1789 N HIS B 37 1.050 -1.660 -6.572 1.00 8.69 N ATOM 1790 CA HIS B 37 1.159 -3.101 -6.742 1.00 9.16 C ATOM 1791 C HIS B 37 1.360 -3.753 -5.389 1.00 10.38 C ATOM 1792 O HIS B 37 1.544 -3.060 -4.388 1.00 10.23 O ATOM 1793 CB HIS B 37 2.268 -3.505 -7.713 1.00 9.56 C ATOM 1794 CG HIS B 37 3.609 -2.953 -7.376 1.00 10.34 C ATOM 1795 ND1 HIS B 37 4.292 -3.277 -6.213 1.00 10.44 N ATOM 1796 CD2 HIS B 37 4.401 -2.079 -8.047 1.00 12.79 C ATOM 1797 CE1 HIS B 37 5.453 -2.646 -6.204 1.00 11.56 C ATOM 1798 NE2 HIS B 37 5.546 -1.930 -7.315 1.00 11.58 N ATOM 1799 H HIS B 37 1.297 -1.254 -5.647 1.00 0.00 H ATOM 1800 N GLU B 38 1.309 -5.071 -5.350 1.00 11.35 N ATOM 1801 CA GLU B 38 1.246 -5.782 -4.066 1.00 10.89 C ATOM 1802 C GLU B 38 2.563 -5.674 -3.263 1.00 10.04 C ATOM 1803 O GLU B 38 2.581 -5.957 -2.050 1.00 11.04 O ATOM 1804 CB GLU B 38 0.872 -7.237 -4.298 1.00 13.70 C ATOM 1805 CG GLU B 38 2.020 -8.041 -4.857 1.00 18.28 C ATOM 1806 CD GLU B 38 1.630 -9.376 -5.390 1.00 27.48 C ATOM 1807 OE1 GLU B 38 0.593 -9.933 -4.963 1.00 33.65 O ATOM 1808 OE2 GLU B 38 2.415 -9.870 -6.219 1.00 43.66 O ATOM 1809 H GLU B 38 1.313 -5.612 -6.238 1.00 0.00 H ATOM 1810 N ARG B 39 3.666 -5.299 -3.928 1.00 9.60 N ATOM 1811 CA ARG B 39 4.961 -5.128 -3.274 1.00 9.82 C ATOM 1812 C ARG B 39 5.158 -3.727 -2.679 1.00 8.50 C ATOM 1813 O ARG B 39 6.252 -3.378 -2.222 1.00 9.96 O ATOM 1814 CB ARG B 39 6.093 -5.571 -4.208 1.00 11.16 C ATOM 1815 CG ARG B 39 5.984 -7.053 -4.662 1.00 14.48 C ATOM 1816 CD ARG B 39 5.609 -7.260 -6.168 1.00 21.13 C ATOM 1817 NE ARG B 39 6.387 -6.362 -6.952 1.00 22.75 N ATOM 1818 CZ ARG B 39 6.058 -5.751 -8.080 1.00 19.02 C ATOM 1819 NH1 ARG B 39 4.879 -5.915 -8.714 1.00 16.90 N ATOM 1820 NH2 ARG B 39 6.974 -4.944 -8.583 1.00 22.22 N ATOM 1821 HE ARG B 39 7.341 -6.159 -6.591 1.00 0.00 H ATOM 1822 HH12 ARG B 39 4.688 -5.402 -9.598 1.00 0.00 H ATOM 1823 HH11 ARG B 39 4.161 -6.555 -8.319 1.00 0.00 H ATOM 1824 HH22 ARG B 39 6.785 -4.430 -9.467 1.00 0.00 H ATOM 1825 HH21 ARG B 39 7.884 -4.822 -8.095 1.00 0.00 H ATOM 1826 H ARG B 39 3.596 -5.123 -4.951 1.00 0.00 H ATOM 1827 N MET B 40 4.078 -2.929 -2.629 1.00 7.59 N ATOM 1828 CA MET B 40 4.106 -1.667 -1.875 1.00 8.27 C ATOM 1829 C MET B 40 2.965 -1.575 -0.852 1.00 6.92 C ATOM 1830 O MET B 40 2.709 -0.524 -0.266 1.00 8.03 O ATOM 1831 CB MET B 40 4.191 -0.437 -2.798 1.00 9.04 C ATOM 1832 CG MET B 40 3.238 -0.393 -3.973 1.00 8.28 C ATOM 1833 SD MET B 40 1.533 -0.170 -3.518 1.00 9.27 S ATOM 1834 CE MET B 40 1.486 1.617 -3.278 1.00 9.22 C ATOM 1835 H MET B 40 3.211 -3.208 -3.130 1.00 0.00 H ATOM 1836 N TYR B 41 2.323 -2.713 -0.586 1.00 7.01 N ATOM 1837 CA TYR B 41 1.359 -2.824 0.496 1.00 6.94 C ATOM 1838 C TYR B 41 2.074 -2.911 1.851 1.00 6.32 C ATOM 1839 O TYR B 41 3.099 -3.594 1.982 1.00 7.13 O ATOM 1840 CB TYR B 41 0.525 -4.099 0.364 1.00 7.35 C ATOM 1841 CG TYR B 41 -0.466 -4.185 -0.785 1.00 8.18 C ATOM 1842 CD1 TYR B 41 -0.529 -3.219 -1.772 1.00 7.11 C ATOM 1843 CD2 TYR B 41 -1.344 -5.250 -0.863 1.00 9.89 C ATOM 1844 CE1 TYR B 41 -1.415 -3.348 -2.831 1.00 8.96 C ATOM 1845 CE2 TYR B 41 -2.239 -5.384 -1.904 1.00 11.51 C ATOM 1846 CZ TYR B 41 -2.295 -4.432 -2.874 1.00 9.58 C ATOM 1847 OH TYR B 41 -3.206 -4.568 -3.910 1.00 10.82 O ATOM 1848 HH TYR B 41 -3.120 -3.798 -4.527 1.00 0.00 H ATOM 1849 H TYR B 41 2.519 -3.549 -1.172 1.00 0.00 H ATOM 1850 N PHE B 42 1.482 -2.265 2.861 1.00 7.02 N ATOM 1851 CA PHE B 42 1.962 -2.279 4.247 1.00 6.27 C ATOM 1852 C PHE B 42 0.867 -2.694 5.204 1.00 6.86 C ATOM 1853 O PHE B 42 -0.332 -2.643 4.889 1.00 7.77 O ATOM 1854 CB PHE B 42 2.556 -0.907 4.619 1.00 6.57 C ATOM 1855 CG PHE B 42 3.854 -0.629 3.917 1.00 6.53 C ATOM 1856 CD1 PHE B 42 5.070 -1.029 4.473 1.00 7.59 C ATOM 1857 CD2 PHE B 42 3.866 -0.012 2.664 1.00 7.89 C ATOM 1858 CE1 PHE B 42 6.267 -0.796 3.812 1.00 8.78 C ATOM 1859 CE2 PHE B 42 5.070 0.232 1.992 1.00 8.45 C ATOM 1860 CZ PHE B 42 6.271 -0.195 2.543 1.00 9.37 C ATOM 1861 H PHE B 42 0.624 -1.716 2.650 1.00 0.00 H ATOM 1862 N GLN B 43 1.295 -3.126 6.384 1.00 6.61 N ATOM 1863 CA GLN B 43 0.419 -3.395 7.519 1.00 7.65 C ATOM 1864 C GLN B 43 1.104 -2.781 8.724 1.00 7.17 C ATOM 1865 O GLN B 43 2.288 -2.475 8.683 1.00 9.45 O ATOM 1866 CB GLN B 43 0.201 -4.896 7.751 1.00 10.15 C ATOM 1867 CG GLN B 43 -0.755 -5.495 6.758 1.00 14.05 C ATOM 1868 CD GLN B 43 -0.719 -7.013 6.741 1.00 17.28 C ATOM 1869 OE1 GLN B 43 0.125 -7.632 7.380 1.00 19.52 O ATOM 1870 NE2 GLN B 43 -1.630 -7.613 5.960 1.00 24.84 N ATOM 1871 HE22 GLN B 43 -2.325 -7.042 5.438 1.00 0.00 H ATOM 1872 HE21 GLN B 43 -1.641 -8.650 5.876 1.00 0.00 H ATOM 1873 H GLN B 43 2.316 -3.282 6.507 1.00 0.00 H ATOM 1874 N PHE B 44 0.356 -2.579 9.795 1.00 6.78 N ATOM 1875 CA PHE B 44 0.887 -1.988 11.001 1.00 7.02 C ATOM 1876 C PHE B 44 0.648 -2.961 12.151 1.00 8.01 C ATOM 1877 O PHE B 44 -0.477 -3.365 12.397 1.00 9.55 O ATOM 1878 CB PHE B 44 0.256 -0.630 11.286 1.00 6.70 C ATOM 1879 CG PHE B 44 0.891 0.097 12.434 1.00 6.57 C ATOM 1880 CD1 PHE B 44 2.162 0.647 12.319 1.00 7.26 C ATOM 1881 CD2 PHE B 44 0.205 0.274 13.615 1.00 7.80 C ATOM 1882 CE1 PHE B 44 2.734 1.338 13.366 1.00 7.58 C ATOM 1883 CE2 PHE B 44 0.776 0.975 14.664 1.00 8.01 C ATOM 1884 CZ PHE B 44 2.008 1.517 14.535 1.00 7.85 C ATOM 1885 H PHE B 44 -0.647 -2.854 9.768 1.00 0.00 H ATOM 1886 N ASP B 45 1.735 -3.379 12.793 1.00 8.56 N ATOM 1887 CA ASP B 45 1.693 -4.349 13.870 1.00 9.08 C ATOM 1888 C ASP B 45 1.869 -3.619 15.174 1.00 8.11 C ATOM 1889 O ASP B 45 2.971 -3.173 15.512 1.00 8.09 O ATOM 1890 CB ASP B 45 2.785 -5.430 13.676 1.00 9.90 C ATOM 1891 CG ASP B 45 2.466 -6.416 12.539 1.00 13.40 C ATOM 1892 OD1 ASP B 45 1.308 -6.499 12.090 1.00 18.84 O ATOM 1893 OD2 ASP B 45 3.397 -7.103 12.070 1.00 16.42 O ATOM 1894 H ASP B 45 2.658 -2.992 12.510 1.00 0.00 H ATOM 1895 N VAL B 46 0.781 -3.484 15.919 1.00 8.42 N ATOM 1896 CA VAL B 46 0.798 -2.722 17.168 1.00 8.03 C ATOM 1897 C VAL B 46 1.611 -3.452 18.215 1.00 8.63 C ATOM 1898 O VAL B 46 1.419 -4.675 18.422 1.00 10.30 O ATOM 1899 CB VAL B 46 -0.658 -2.511 17.683 1.00 8.93 C ATOM 1900 CG1 VAL B 46 -0.656 -1.878 19.057 1.00 10.63 C ATOM 1901 CG2 VAL B 46 -1.451 -1.681 16.702 1.00 10.44 C ATOM 1902 H VAL B 46 -0.106 -3.930 15.608 1.00 0.00 H ATOM 1903 N VAL B 47 2.520 -2.698 18.852 1.00 7.94 N ATOM 1904 CA VAL B 47 3.317 -3.181 19.953 1.00 8.87 C ATOM 1905 C VAL B 47 2.907 -2.613 21.300 1.00 9.14 C ATOM 1906 O VAL B 47 2.827 -3.359 22.295 1.00 12.15 O ATOM 1907 CB VAL B 47 4.818 -2.927 19.672 1.00 9.07 C ATOM 1908 CG1 VAL B 47 5.686 -3.237 20.878 1.00 9.36 C ATOM 1909 CG2 VAL B 47 5.227 -3.726 18.464 1.00 11.16 C ATOM 1910 H VAL B 47 2.657 -1.717 18.536 1.00 0.00 H ATOM 1911 N ASP B 48 2.699 -1.300 21.368 1.00 8.90 N ATOM 1912 CA ASP B 48 2.354 -0.643 22.619 1.00 12.15 C ATOM 1913 C ASP B 48 1.530 0.606 22.319 1.00 9.86 C ATOM 1914 O ASP B 48 2.079 1.674 22.036 1.00 8.99 O ATOM 1915 CB ASP B 48 3.632 -0.279 23.363 1.00 15.83 C ATOM 1916 CG ASP B 48 3.380 0.517 24.641 1.00 19.90 C ATOM 1917 OD1 ASP B 48 2.261 0.485 25.180 1.00 24.26 O ATOM 1918 OD2 ASP B 48 4.329 1.203 25.102 1.00 30.48 O ATOM 1919 H ASP B 48 2.785 -0.729 20.503 1.00 0.00 H ATOM 1920 N GLU B 49 0.214 0.445 22.354 1.00 10.04 N ATOM 1921 CA GLU B 49 -0.736 1.539 22.128 1.00 10.40 C ATOM 1922 C GLU B 49 -0.505 2.161 20.758 1.00 9.49 C ATOM 1923 O GLU B 49 -0.779 1.491 19.777 1.00 10.43 O ATOM 1924 CB GLU B 49 -0.747 2.492 23.326 1.00 10.71 C ATOM 1925 CG GLU B 49 -1.843 3.575 23.322 1.00 10.24 C ATOM 1926 CD GLU B 49 -1.338 5.002 23.169 1.00 8.64 C ATOM 1927 OE1 GLU B 49 -0.107 5.231 22.977 1.00 9.27 O ATOM 1928 OE2 GLU B 49 -2.190 5.923 23.235 1.00 9.37 O ATOM 1929 H GLU B 49 -0.163 -0.504 22.551 1.00 0.00 H ATOM 1930 N ARG B 50 -0.009 3.396 20.659 1.00 6.77 N ATOM 1931 CA ARG B 50 0.190 4.024 19.353 1.00 6.15 C ATOM 1932 C ARG B 50 1.398 3.445 18.604 1.00 6.51 C ATOM 1933 O ARG B 50 1.498 3.608 17.373 1.00 8.13 O ATOM 1934 CB ARG B 50 0.393 5.534 19.488 1.00 5.70 C ATOM 1935 CG ARG B 50 1.674 5.980 20.191 1.00 6.94 C ATOM 1936 CD ARG B 50 1.629 7.452 20.594 1.00 8.06 C ATOM 1937 NE ARG B 50 0.597 7.573 21.607 1.00 9.01 N ATOM 1938 CZ ARG B 50 -0.130 8.653 21.840 1.00 9.56 C ATOM 1939 NH1 ARG B 50 0.145 9.826 21.266 1.00 10.66 N ATOM 1940 NH2 ARG B 50 -1.115 8.558 22.717 1.00 10.37 N ATOM 1941 HE ARG B 50 0.413 6.739 22.201 1.00 0.00 H ATOM 1942 HH12 ARG B 50 -0.447 10.656 21.471 1.00 0.00 H ATOM 1943 HH11 ARG B 50 0.951 9.910 20.614 1.00 0.00 H ATOM 1944 HH22 ARG B 50 -1.707 9.387 22.925 1.00 0.00 H ATOM 1945 HH21 ARG B 50 -1.297 7.654 23.198 1.00 0.00 H ATOM 1946 H ARG B 50 0.240 3.919 21.523 1.00 0.00 H ATOM 1947 N TRP B 51 2.331 2.839 19.342 1.00 6.93 N ATOM 1948 CA TRP B 51 3.624 2.431 18.781 1.00 6.58 C ATOM 1949 C TRP B 51 3.567 1.032 18.199 1.00 6.22 C ATOM 1950 O TRP B 51 3.018 0.087 18.805 1.00 6.38 O ATOM 1951 CB TRP B 51 4.722 2.511 19.861 1.00 7.16 C ATOM 1952 CG TRP B 51 4.849 3.866 20.427 1.00 7.36 C ATOM 1953 CD1 TRP B 51 4.469 4.268 21.667 1.00 8.46 C ATOM 1954 CD2 TRP B 51 5.331 5.033 19.753 1.00 7.63 C ATOM 1955 NE1 TRP B 51 4.714 5.599 21.822 1.00 9.44 N ATOM 1956 CE2 TRP B 51 5.242 6.101 20.654 1.00 8.47 C ATOM 1957 CE3 TRP B 51 5.869 5.269 18.478 1.00 7.77 C ATOM 1958 CZ2 TRP B 51 5.605 7.422 20.303 1.00 10.27 C ATOM 1959 CZ3 TRP B 51 6.246 6.555 18.135 1.00 8.33 C ATOM 1960 CH2 TRP B 51 6.120 7.622 19.037 1.00 10.49 C ATOM 1961 HE1 TRP B 51 4.531 6.149 22.686 1.00 0.00 H ATOM 1962 H TRP B 51 2.135 2.650 20.346 1.00 0.00 H ATOM 1963 N GLY B 52 4.184 0.883 17.011 1.00 5.88 N ATOM 1964 CA GLY B 52 4.245 -0.403 16.368 1.00 5.76 C ATOM 1965 C GLY B 52 5.202 -0.469 15.213 1.00 5.57 C ATOM 1966 O GLY B 52 5.944 0.495 14.968 1.00 6.41 O ATOM 1967 H GLY B 52 4.622 1.708 16.553 1.00 0.00 H ATOM 1968 N TYR B 53 5.175 -1.597 14.507 1.00 5.53 N ATOM 1969 CA TYR B 53 6.059 -1.835 13.363 1.00 6.47 C ATOM 1970 C TYR B 53 5.305 -1.620 12.067 1.00 7.05 C ATOM 1971 O TYR B 53 4.160 -2.123 11.892 1.00 7.01 O ATOM 1972 CB TYR B 53 6.587 -3.256 13.388 1.00 8.02 C ATOM 1973 CG TYR B 53 7.306 -3.655 14.683 1.00 7.70 C ATOM 1974 CD1 TYR B 53 8.324 -2.820 15.225 1.00 6.95 C ATOM 1975 CD2 TYR B 53 7.022 -4.871 15.335 1.00 8.22 C ATOM 1976 CE1 TYR B 53 9.012 -3.168 16.377 1.00 7.91 C ATOM 1977 CE2 TYR B 53 7.756 -5.232 16.472 1.00 9.26 C ATOM 1978 CZ TYR B 53 8.712 -4.372 16.985 1.00 8.49 C ATOM 1979 OH TYR B 53 9.411 -4.705 18.129 1.00 13.04 O ATOM 1980 HH TYR B 53 10.048 -3.979 18.348 1.00 0.00 H ATOM 1981 H TYR B 53 4.499 -2.339 14.778 1.00 0.00 H ATOM 1982 N ILE B 54 5.947 -0.915 11.142 1.00 6.03 N ATOM 1983 CA ILE B 54 5.383 -0.730 9.791 1.00 5.67 C ATOM 1984 C ILE B 54 5.944 -1.856 8.915 1.00 5.83 C ATOM 1985 O ILE B 54 7.149 -1.875 8.609 1.00 7.35 O ATOM 1986 CB ILE B 54 5.746 0.637 9.211 1.00 6.20 C ATOM 1987 CG1 ILE B 54 5.358 1.808 10.131 1.00 6.89 C ATOM 1988 CG2 ILE B 54 5.096 0.778 7.832 1.00 6.95 C ATOM 1989 CD1 ILE B 54 5.891 3.140 9.677 1.00 7.86 C ATOM 1990 H ILE B 54 6.865 -0.485 11.375 1.00 0.00 H ATOM 1991 N LYS B 55 5.085 -2.805 8.563 1.00 6.45 N ATOM 1992 CA LYS B 55 5.508 -4.058 7.929 1.00 6.95 C ATOM 1993 C LYS B 55 5.208 -4.055 6.434 1.00 6.94 C ATOM 1994 O LYS B 55 4.058 -3.848 6.007 1.00 7.23 O ATOM 1995 CB LYS B 55 4.831 -5.250 8.612 1.00 7.30 C ATOM 1996 CG LYS B 55 5.290 -6.592 8.068 1.00 9.57 C ATOM 1997 CD LYS B 55 4.826 -7.768 8.898 1.00 12.44 C ATOM 1998 CE LYS B 55 3.345 -8.035 8.865 1.00 15.15 C ATOM 1999 NZ LYS B 55 3.001 -8.910 10.047 1.00 18.07 N ATOM 2000 HZ1 LYS B 55 3.529 -9.804 9.981 1.00 0.00 H ATOM 2001 HZ2 LYS B 55 3.258 -8.419 10.927 1.00 0.00 H ATOM 2002 HZ3 LYS B 55 1.980 -9.108 10.045 1.00 0.00 H ATOM 2003 H LYS B 55 4.072 -2.654 8.744 1.00 0.00 H ATOM 2004 N HIS B 56 6.230 -4.346 5.642 1.00 6.36 N ATOM 2005 CA HIS B 56 6.087 -4.601 4.205 1.00 6.96 C ATOM 2006 C HIS B 56 5.452 -5.979 4.055 1.00 7.57 C ATOM 2007 O HIS B 56 6.051 -7.000 4.419 1.00 9.21 O ATOM 2008 CB HIS B 56 7.477 -4.594 3.610 1.00 8.01 C ATOM 2009 CG HIS B 56 7.521 -4.777 2.140 1.00 7.98 C ATOM 2010 ND1 HIS B 56 8.227 -5.806 1.550 1.00 9.05 N ATOM 2011 CD2 HIS B 56 6.996 -4.048 1.139 1.00 8.47 C ATOM 2012 CE1 HIS B 56 8.094 -5.725 0.240 1.00 9.16 C ATOM 2013 NE2 HIS B 56 7.364 -4.657 -0.033 1.00 9.01 N ATOM 2014 H HIS B 56 7.181 -4.396 6.060 1.00 0.00 H ATOM 2015 N VAL B 57 4.235 -6.005 3.509 1.00 7.95 N ATOM 2016 CA VAL B 57 3.445 -7.214 3.489 1.00 8.84 C ATOM 2017 C VAL B 57 4.156 -8.342 2.704 1.00 9.94 C ATOM 2018 O VAL B 57 4.246 -9.459 3.184 1.00 10.74 O ATOM 2019 CB VAL B 57 2.033 -6.957 2.932 1.00 9.41 C ATOM 2020 CG1 VAL B 57 1.281 -8.268 2.764 1.00 10.55 C ATOM 2021 CG2 VAL B 57 1.249 -5.988 3.833 1.00 10.90 C ATOM 2022 H VAL B 57 3.847 -5.136 3.089 1.00 0.00 H ATOM 2023 N ALA B 58 4.682 -8.034 1.516 1.00 8.47 N ATOM 2024 CA ALA B 58 5.269 -9.086 0.661 1.00 9.61 C ATOM 2025 C ALA B 58 6.462 -9.826 1.302 1.00 11.49 C ATOM 2026 O ALA B 58 6.583 -11.059 1.128 1.00 14.28 O ATOM 2027 CB ALA B 58 5.661 -8.519 -0.687 1.00 9.20 C ATOM 2028 H ALA B 58 4.678 -7.046 1.190 1.00 0.00 H ATOM 2029 N SER B 59 7.299 -9.095 2.072 1.00 9.79 N ATOM 2030 CA SER B 59 8.558 -9.650 2.626 1.00 11.21 C ATOM 2031 C SER B 59 8.505 -9.917 4.144 1.00 10.81 C ATOM 2032 O SER B 59 9.308 -10.693 4.682 1.00 11.66 O ATOM 2033 CB SER B 59 9.744 -8.725 2.362 1.00 11.69 C ATOM 2034 OG SER B 59 9.673 -7.535 3.122 1.00 9.41 O ATOM 2035 HG SER B 59 8.844 -7.046 2.891 1.00 0.00 H ATOM 2036 H SER B 59 7.051 -8.107 2.284 1.00 0.00 H ATOM 2037 N GLY B 60 7.571 -9.251 4.822 1.00 10.31 N ATOM 2038 CA GLY B 60 7.558 -9.271 6.281 1.00 10.70 C ATOM 2039 C GLY B 60 8.648 -8.431 6.965 1.00 9.37 C ATOM 2040 O GLY B 60 8.726 -8.379 8.190 1.00 9.58 O ATOM 2041 H GLY B 60 6.845 -8.713 4.307 1.00 0.00 H ATOM 2042 N LYS B 61 9.527 -7.812 6.196 1.00 8.28 N ATOM 2043 CA LYS B 61 10.475 -6.866 6.761 1.00 8.32 C ATOM 2044 C LYS B 61 9.722 -5.594 7.192 1.00 7.38 C ATOM 2045 O LYS B 61 8.615 -5.311 6.696 1.00 8.28 O ATOM 2046 CB LYS B 61 11.606 -6.565 5.761 1.00 9.14 C ATOM 2047 CG LYS B 61 12.470 -7.772 5.427 1.00 10.06 C ATOM 2048 CD LYS B 61 13.733 -7.350 4.677 1.00 10.54 C ATOM 2049 CE LYS B 61 14.682 -8.499 4.347 1.00 12.12 C ATOM 2050 NZ LYS B 61 14.124 -9.482 3.408 1.00 12.49 N ATOM 2051 HZ1 LYS B 61 13.264 -9.900 3.816 1.00 0.00 H ATOM 2052 HZ2 LYS B 61 13.889 -9.009 2.512 1.00 0.00 H ATOM 2053 HZ3 LYS B 61 14.825 -10.230 3.233 1.00 0.00 H ATOM 2054 H LYS B 61 9.540 -8.004 5.174 1.00 0.00 H ATOM 2055 N ILE B 62 10.321 -4.827 8.098 1.00 7.74 N ATOM 2056 CA ILE B 62 9.704 -3.624 8.638 1.00 6.31 C ATOM 2057 C ILE B 62 10.601 -2.396 8.424 1.00 6.24 C ATOM 2058 O ILE B 62 11.832 -2.481 8.076 1.00 7.68 O ATOM 2059 CB ILE B 62 9.336 -3.800 10.132 1.00 6.13 C ATOM 2060 CG1 ILE B 62 10.606 -3.960 10.987 1.00 6.58 C ATOM 2061 CG2 ILE B 62 8.408 -4.989 10.355 1.00 6.75 C ATOM 2062 CD1 ILE B 62 10.291 -3.803 12.466 1.00 7.23 C ATOM 2063 H ILE B 62 11.267 -5.097 8.434 1.00 0.00 H ATOM 2064 N VAL B 63 9.997 -1.233 8.596 1.00 6.72 N ATOM 2065 CA VAL B 63 10.686 0.029 8.381 1.00 7.33 C ATOM 2066 C VAL B 63 11.614 0.329 9.577 1.00 6.98 C ATOM 2067 O VAL B 63 11.216 0.169 10.732 1.00 7.84 O ATOM 2068 CB VAL B 63 9.659 1.184 8.199 1.00 6.94 C ATOM 2069 CG1 VAL B 63 10.344 2.530 8.063 1.00 7.53 C ATOM 2070 CG2 VAL B 63 8.725 0.918 7.028 1.00 7.33 C ATOM 2071 H VAL B 63 9.001 -1.220 8.894 1.00 0.00 H ATOM 2072 N HIS B 64 12.853 0.717 9.281 1.00 7.25 N ATOM 2073 CA HIS B 64 13.862 1.127 10.249 1.00 7.46 C ATOM 2074 C HIS B 64 14.528 2.426 9.787 1.00 7.22 C ATOM 2075 O HIS B 64 14.730 2.626 8.582 1.00 7.89 O ATOM 2076 CB HIS B 64 15.028 0.139 10.318 1.00 7.63 C ATOM 2077 CG HIS B 64 14.703 -1.165 10.963 1.00 8.03 C ATOM 2078 ND1 HIS B 64 15.370 -1.619 12.079 1.00 8.80 N ATOM 2079 CD2 HIS B 64 13.788 -2.111 10.656 1.00 8.67 C ATOM 2080 CE1 HIS B 64 14.870 -2.783 12.437 1.00 9.33 C ATOM 2081 NE2 HIS B 64 13.937 -3.126 11.560 1.00 7.64 N ATOM 2082 H HIS B 64 13.123 0.728 8.277 1.00 0.00 H ATOM 2083 N PRO B 65 14.986 3.236 10.738 1.00 8.33 N ATOM 2084 CA PRO B 65 16.026 4.214 10.399 1.00 8.80 C ATOM 2085 C PRO B 65 17.325 3.429 10.141 1.00 9.00 C ATOM 2086 O PRO B 65 17.601 2.478 10.848 1.00 9.27 O ATOM 2087 CB PRO B 65 16.145 5.059 11.656 1.00 10.33 C ATOM 2088 CG PRO B 65 15.686 4.154 12.767 1.00 10.10 C ATOM 2089 CD PRO B 65 14.764 3.134 12.197 1.00 8.06 C ATOM 2090 N TYR B 66 18.078 3.777 9.099 1.00 8.79 N ATOM 2091 CA TYR B 66 19.306 3.032 8.769 1.00 10.30 C ATOM 2092 C TYR B 66 20.312 3.127 9.914 1.00 10.55 C ATOM 2093 O TYR B 66 20.755 4.225 10.249 1.00 12.75 O ATOM 2094 CB TYR B 66 19.904 3.566 7.459 1.00 10.61 C ATOM 2095 CG TYR B 66 21.172 2.894 7.000 1.00 11.29 C ATOM 2096 CD1 TYR B 66 21.200 1.523 6.717 1.00 13.15 C ATOM 2097 CD2 TYR B 66 22.356 3.622 6.894 1.00 17.92 C ATOM 2098 CE1 TYR B 66 22.366 0.887 6.296 1.00 16.17 C ATOM 2099 CE2 TYR B 66 23.528 3.004 6.481 1.00 21.99 C ATOM 2100 CZ TYR B 66 23.528 1.651 6.182 1.00 19.87 C ATOM 2101 OH TYR B 66 24.693 1.070 5.777 1.00 25.28 O ATOM 2102 HH TYR B 66 24.537 0.108 5.601 1.00 0.00 H ATOM 2103 H TYR B 66 17.795 4.586 8.510 1.00 0.00 H ATOM 2104 N GLY B 67 20.672 1.969 10.478 1.00 10.46 N ATOM 2105 CA GLY B 67 21.545 1.889 11.647 1.00 10.45 C ATOM 2106 C GLY B 67 20.806 1.699 12.947 1.00 11.51 C ATOM 2107 O GLY B 67 21.436 1.487 13.978 1.00 14.91 O ATOM 2108 H GLY B 67 20.314 1.084 10.065 1.00 0.00 H ATOM 2109 N GLY B 68 19.469 1.777 12.931 1.00 10.87 N ATOM 2110 CA GLY B 68 18.709 1.426 14.126 1.00 9.40 C ATOM 2111 C GLY B 68 18.866 2.328 15.346 1.00 9.57 C ATOM 2112 O GLY B 68 18.847 1.834 16.477 1.00 11.51 O ATOM 2113 H GLY B 68 18.974 2.087 12.070 1.00 0.00 H ATOM 2114 N GLN B 69 18.954 3.634 15.128 1.00 8.26 N ATOM 2115 CA GLN B 69 19.035 4.622 16.211 1.00 10.58 C ATOM 2116 C GLN B 69 17.720 4.820 16.911 1.00 9.51 C ATOM 2117 O GLN B 69 16.655 4.784 16.295 1.00 9.76 O ATOM 2118 CB GLN B 69 19.479 6.017 15.715 1.00 11.48 C ATOM 2119 CG GLN B 69 20.768 6.061 14.938 1.00 13.48 C ATOM 2120 CD GLN B 69 20.593 5.616 13.501 1.00 15.60 C ATOM 2121 OE1 GLN B 69 19.459 5.450 13.007 1.00 16.92 O ATOM 2122 NE2 GLN B 69 21.694 5.355 12.847 1.00 15.79 N ATOM 2123 HE22 GLN B 69 22.617 5.509 13.300 1.00 0.00 H ATOM 2124 HE21 GLN B 69 21.647 4.993 11.873 1.00 0.00 H ATOM 2125 H GLN B 69 18.966 3.973 14.145 1.00 0.00 H ATOM 2126 N ALA B 70 17.801 5.056 18.215 1.00 10.40 N ATOM 2127 CA ALA B 70 16.630 5.485 18.969 1.00 9.05 C ATOM 2128 C ALA B 70 16.302 6.951 18.644 1.00 9.70 C ATOM 2129 O ALA B 70 15.136 7.343 18.651 1.00 10.40 O ATOM 2130 CB ALA B 70 16.868 5.313 20.456 1.00 9.98 C ATOM 2131 H ALA B 70 18.711 4.933 18.704 1.00 0.00 H ATOM 2132 N ASN B 71 17.345 7.741 18.351 1.00 10.58 N ATOM 2133 CA ASN B 71 17.205 9.171 18.040 1.00 10.17 C ATOM 2134 C ASN B 71 17.950 9.484 16.769 1.00 10.96 C ATOM 2135 O ASN B 71 18.979 10.201 16.766 1.00 13.68 O ATOM 2136 CB ASN B 71 17.717 9.993 19.202 1.00 11.61 C ATOM 2137 CG ASN B 71 16.914 9.741 20.455 1.00 13.24 C ATOM 2138 OD1 ASN B 71 17.305 8.938 21.328 1.00 15.07 O ATOM 2139 ND2 ASN B 71 15.764 10.390 20.539 1.00 14.77 N ATOM 2140 HD22 ASN B 71 15.483 11.049 19.785 1.00 0.00 H ATOM 2141 HD21 ASN B 71 15.142 10.241 21.359 1.00 0.00 H ATOM 2142 H ASN B 71 18.297 7.323 18.343 1.00 0.00 H ATOM 2143 N PRO B 72 17.457 8.917 15.656 1.00 9.94 N ATOM 2144 CA PRO B 72 18.167 9.105 14.386 1.00 10.58 C ATOM 2145 C PRO B 72 18.314 10.574 14.042 1.00 11.18 C ATOM 2146 O PRO B 72 17.378 11.351 14.184 1.00 11.70 O ATOM 2147 CB PRO B 72 17.300 8.358 13.364 1.00 11.20 C ATOM 2148 CG PRO B 72 15.947 8.251 14.018 1.00 11.10 C ATOM 2149 CD PRO B 72 16.209 8.145 15.502 1.00 9.55 C ATOM 2150 N PRO B 73 19.511 10.981 13.598 1.00 12.21 N ATOM 2151 CA PRO B 73 19.621 12.370 13.154 1.00 12.56 C ATOM 2152 C PRO B 73 18.817 12.692 11.895 1.00 11.87 C ATOM 2153 O PRO B 73 18.511 11.795 11.101 1.00 11.03 O ATOM 2154 CB PRO B 73 21.106 12.507 12.816 1.00 16.74 C ATOM 2155 CG PRO B 73 21.777 11.503 13.664 1.00 16.17 C ATOM 2156 CD PRO B 73 20.825 10.332 13.750 1.00 14.42 C ATOM 2157 N ASN B 74 18.536 13.979 11.708 1.00 12.24 N ATOM 2158 CA ASN B 74 17.963 14.439 10.455 1.00 13.75 C ATOM 2159 C ASN B 74 18.772 13.920 9.281 1.00 13.54 C ATOM 2160 O ASN B 74 20.023 13.875 9.300 1.00 16.22 O ATOM 2161 CB ASN B 74 17.885 15.962 10.384 1.00 14.99 C ATOM 2162 CG ASN B 74 16.864 16.578 11.346 1.00 15.71 C ATOM 2163 OD1 ASN B 74 15.946 15.929 11.860 1.00 14.98 O ATOM 2164 ND2 ASN B 74 17.011 17.871 11.559 1.00 19.53 N ATOM 2165 HD22 ASN B 74 17.795 18.386 11.110 1.00 0.00 H ATOM 2166 HD21 ASN B 74 16.343 18.376 12.176 1.00 0.00 H ATOM 2167 H ASN B 74 18.729 14.663 12.467 1.00 0.00 H ATOM 2168 N GLU B 75 18.020 13.539 8.255 1.00 13.31 N ATOM 2169 CA GLU B 75 18.496 12.943 6.988 1.00 14.75 C ATOM 2170 C GLU B 75 18.884 11.468 7.038 1.00 12.68 C ATOM 2171 O GLU B 75 19.314 10.899 6.016 1.00 15.31 O ATOM 2172 CB GLU B 75 19.630 13.793 6.343 1.00 15.64 C ATOM 2173 CG GLU B 75 19.243 15.241 6.126 1.00 19.64 C ATOM 2174 CD GLU B 75 18.098 15.402 5.127 1.00 17.97 C ATOM 2175 OE1 GLU B 75 18.060 14.660 4.127 1.00 28.31 O ATOM 2176 OE2 GLU B 75 17.258 16.286 5.326 1.00 25.60 O ATOM 2177 H GLU B 75 16.993 13.673 8.352 1.00 0.00 H ATOM 2178 N THR B 76 18.707 10.812 8.186 1.00 12.32 N ATOM 2179 CA THR B 76 18.920 9.366 8.238 1.00 11.21 C ATOM 2180 C THR B 76 17.991 8.691 7.253 1.00 11.27 C ATOM 2181 O THR B 76 16.784 8.982 7.279 1.00 10.83 O ATOM 2182 CB THR B 76 18.662 8.826 9.656 1.00 11.50 C ATOM 2183 OG1 THR B 76 19.556 9.460 10.596 1.00 12.15 O ATOM 2184 CG2 THR B 76 18.845 7.333 9.740 1.00 11.80 C ATOM 2185 HG1 THR B 76 19.403 10.438 10.587 1.00 0.00 H ATOM 2186 H THR B 76 18.418 11.328 9.042 1.00 0.00 H ATOM 2187 N ASN B 77 18.509 7.796 6.416 1.00 10.02 N ATOM 2188 CA ASN B 77 17.663 7.094 5.447 1.00 10.23 C ATOM 2189 C ASN B 77 16.703 6.100 6.115 1.00 9.73 C ATOM 2190 O ASN B 77 17.066 5.460 7.084 1.00 10.42 O ATOM 2191 CB ASN B 77 18.469 6.328 4.419 1.00 12.32 C ATOM 2192 CG ASN B 77 19.054 7.211 3.374 1.00 14.58 C ATOM 2193 OD1 ASN B 77 20.148 7.774 3.551 1.00 18.60 O ATOM 2194 ND2 ASN B 77 18.335 7.375 2.286 1.00 14.86 N ATOM 2195 HD22 ASN B 77 17.425 6.882 2.185 1.00 0.00 H ATOM 2196 HD21 ASN B 77 18.676 7.998 1.526 1.00 0.00 H ATOM 2197 H ASN B 77 19.528 7.592 6.450 1.00 0.00 H ATOM 2198 N MET B 78 15.485 6.004 5.582 1.00 8.90 N ATOM 2199 CA MET B 78 14.571 4.936 5.918 1.00 8.67 C ATOM 2200 C MET B 78 14.848 3.732 5.056 1.00 8.55 C ATOM 2201 O MET B 78 15.010 3.839 3.816 1.00 9.56 O ATOM 2202 CB MET B 78 13.097 5.354 5.706 1.00 9.01 C ATOM 2203 CG MET B 78 12.690 6.645 6.364 1.00 11.29 C ATOM 2204 SD MET B 78 13.216 6.857 8.044 1.00 14.23 S ATOM 2205 CE MET B 78 12.318 5.558 8.815 1.00 12.40 C ATOM 2206 H MET B 78 15.181 6.726 4.898 1.00 0.00 H ATOM 2207 N VAL B 79 14.876 2.564 5.691 1.00 8.56 N ATOM 2208 CA VAL B 79 15.110 1.300 5.000 1.00 9.95 C ATOM 2209 C VAL B 79 14.172 0.213 5.527 1.00 8.44 C ATOM 2210 O VAL B 79 13.525 0.403 6.543 1.00 9.29 O ATOM 2211 CB VAL B 79 16.563 0.776 5.221 1.00 9.15 C ATOM 2212 CG1 VAL B 79 17.601 1.773 4.720 1.00 10.04 C ATOM 2213 CG2 VAL B 79 16.838 0.436 6.694 1.00 9.16 C ATOM 2214 H VAL B 79 14.725 2.551 6.720 1.00 0.00 H ATOM 2215 N LEU B 80 14.111 -0.901 4.821 1.00 8.35 N ATOM 2216 CA LEU B 80 13.526 -2.111 5.355 1.00 8.62 C ATOM 2217 C LEU B 80 14.598 -3.005 5.977 1.00 9.89 C ATOM 2218 O LEU B 80 15.744 -3.115 5.473 1.00 9.80 O ATOM 2219 CB LEU B 80 12.782 -2.902 4.283 1.00 7.80 C ATOM 2220 CG LEU B 80 11.522 -2.279 3.715 1.00 8.04 C ATOM 2221 CD1 LEU B 80 10.994 -3.095 2.586 1.00 10.51 C ATOM 2222 CD2 LEU B 80 10.432 -2.151 4.761 1.00 8.11 C ATOM 2223 H LEU B 80 14.494 -0.909 3.854 1.00 0.00 H ATOM 2224 N HIS B 81 14.217 -3.655 7.069 1.00 9.29 N ATOM 2225 CA HIS B 81 15.097 -4.606 7.713 1.00 8.53 C ATOM 2226 C HIS B 81 14.256 -5.665 8.460 1.00 7.35 C ATOM 2227 O HIS B 81 13.191 -5.322 8.983 1.00 7.84 O ATOM 2228 CB HIS B 81 16.052 -3.881 8.662 1.00 9.21 C ATOM 2229 CG HIS B 81 17.282 -4.684 9.010 1.00 10.65 C ATOM 2230 ND1 HIS B 81 17.256 -5.733 9.881 1.00 10.94 N ATOM 2231 CD2 HIS B 81 18.565 -4.596 8.575 1.00 11.19 C ATOM 2232 CE1 HIS B 81 18.461 -6.262 9.981 1.00 11.96 C ATOM 2233 NE2 HIS B 81 19.269 -5.599 9.182 1.00 12.54 N ATOM 2234 H HIS B 81 13.273 -3.479 7.468 1.00 0.00 H ATOM 2235 N GLN B 82 14.716 -6.911 8.493 1.00 3.29 N ATOM 2236 CA GLN B 82 13.989 -7.976 9.170 1.00 3.37 C ATOM 2237 C GLN B 82 13.882 -7.843 10.692 1.00 4.09 C ATOM 2238 O GLN B 82 12.988 -8.376 11.298 1.00 3.16 O ATOM 2239 CB GLN B 82 14.648 -9.326 8.878 1.00 3.05 C ATOM 2240 CG GLN B 82 16.034 -9.446 9.478 1.00 3.11 C ATOM 2241 CD GLN B 82 16.705 -10.747 9.091 1.00 3.26 C ATOM 2242 OE1 GLN B 82 17.104 -10.914 7.958 1.00 4.00 O ATOM 2243 NE2 GLN B 82 16.896 -11.634 10.054 1.00 3.24 N ATOM 2244 HE22 GLN B 82 16.536 -11.448 11.012 1.00 0.00 H ATOM 2245 HE21 GLN B 82 17.407 -12.518 9.853 1.00 0.00 H ATOM 2246 H GLN B 82 15.618 -7.131 8.024 1.00 0.00 H ATOM 2247 N ASP B 83 14.823 -7.149 11.312 1.00 6.64 N ATOM 2248 CA ASP B 83 14.907 -7.144 12.765 1.00 7.40 C ATOM 2249 C ASP B 83 13.705 -6.408 13.400 1.00 8.20 C ATOM 2250 O ASP B 83 13.141 -5.474 12.821 1.00 9.33 O ATOM 2251 CB ASP B 83 16.192 -6.484 13.275 1.00 8.74 C ATOM 2252 CG ASP B 83 17.455 -7.346 13.089 1.00 9.75 C ATOM 2253 OD1 ASP B 83 17.359 -8.505 12.583 1.00 10.18 O ATOM 2254 OD2 ASP B 83 18.566 -6.822 13.474 1.00 12.42 O ATOM 2255 H ASP B 83 15.510 -6.601 10.755 1.00 0.00 H ATOM 2256 N ARG B 84 13.400 -6.776 14.632 1.00 8.01 N ATOM 2257 CA ARG B 84 12.350 -6.166 15.438 1.00 9.16 C ATOM 2258 C ARG B 84 12.959 -5.702 16.759 1.00 8.09 C ATOM 2259 O ARG B 84 13.599 -6.497 17.466 1.00 11.24 O ATOM 2260 CB ARG B 84 11.256 -7.165 15.768 1.00 11.42 C ATOM 2261 CG ARG B 84 10.086 -7.156 14.836 1.00 15.25 C ATOM 2262 CD ARG B 84 10.428 -7.609 13.466 1.00 13.09 C ATOM 2263 NE ARG B 84 9.177 -7.855 12.753 1.00 10.41 N ATOM 2264 CZ ARG B 84 9.104 -8.163 11.467 1.00 10.74 C ATOM 2265 NH1 ARG B 84 10.219 -8.269 10.747 1.00 11.47 N ATOM 2266 NH2 ARG B 84 7.913 -8.404 10.921 1.00 10.64 N ATOM 2267 HE ARG B 84 8.288 -7.784 13.289 1.00 0.00 H ATOM 2268 HH12 ARG B 84 10.165 -8.511 9.737 1.00 0.00 H ATOM 2269 HH11 ARG B 84 11.144 -8.110 11.195 1.00 0.00 H ATOM 2270 HH22 ARG B 84 7.843 -8.647 9.912 1.00 0.00 H ATOM 2271 HH21 ARG B 84 7.053 -8.349 11.504 1.00 0.00 H ATOM 2272 H ARG B 84 13.946 -7.553 15.055 1.00 0.00 H ATOM 2273 N HIS B 85 12.840 -4.409 17.023 1.00 7.15 N ATOM 2274 CA HIS B 85 13.277 -3.832 18.299 1.00 8.37 C ATOM 2275 C HIS B 85 12.680 -2.447 18.462 1.00 8.19 C ATOM 2276 O HIS B 85 11.993 -1.945 17.551 1.00 9.00 O ATOM 2277 CB HIS B 85 14.801 -3.789 18.389 1.00 9.28 C ATOM 2278 CG HIS B 85 15.463 -3.164 17.200 1.00 8.48 C ATOM 2279 ND1 HIS B 85 15.251 -1.859 16.830 1.00 9.35 N ATOM 2280 CD2 HIS B 85 16.368 -3.655 16.328 1.00 9.96 C ATOM 2281 CE1 HIS B 85 15.987 -1.583 15.765 1.00 10.14 C ATOM 2282 NE2 HIS B 85 16.669 -2.656 15.445 1.00 10.08 N ATOM 2283 H HIS B 85 12.424 -3.784 16.303 1.00 0.00 H ATOM 2284 N ASP B 86 12.883 -1.822 19.620 1.00 8.42 N ATOM 2285 CA ASP B 86 12.217 -0.573 19.908 1.00 9.10 C ATOM 2286 C ASP B 86 12.686 0.634 19.074 1.00 10.39 C ATOM 2287 O ASP B 86 12.055 1.685 19.115 1.00 11.60 O ATOM 2288 CB ASP B 86 12.390 -0.164 21.367 1.00 12.71 C ATOM 2289 CG ASP B 86 11.696 -1.039 22.331 1.00 21.51 C ATOM 2290 OD1 ASP B 86 10.756 -1.811 21.938 1.00 24.68 O ATOM 2291 OD2 ASP B 86 12.116 -0.896 23.543 1.00 37.84 O ATOM 2292 H ASP B 86 13.527 -2.237 20.324 1.00 0.00 H ATOM 2293 N ARG B 87 13.780 0.504 18.318 1.00 8.34 N ATOM 2294 CA ARG B 87 14.231 1.583 17.473 1.00 7.97 C ATOM 2295 C ARG B 87 13.562 1.517 16.073 1.00 7.70 C ATOM 2296 O ARG B 87 13.790 2.393 15.232 1.00 8.80 O ATOM 2297 CB ARG B 87 15.760 1.590 17.376 1.00 8.39 C ATOM 2298 CG ARG B 87 16.436 1.765 18.722 1.00 10.46 C ATOM 2299 CD ARG B 87 17.000 0.467 19.248 1.00 12.13 C ATOM 2300 NE ARG B 87 18.030 -0.128 18.377 1.00 13.34 N ATOM 2301 CZ ARG B 87 18.452 -1.397 18.419 1.00 15.05 C ATOM 2302 NH1 ARG B 87 17.949 -2.269 19.284 1.00 15.10 N ATOM 2303 NH2 ARG B 87 19.377 -1.809 17.551 1.00 17.74 N ATOM 2304 HE ARG B 87 18.467 0.494 17.667 1.00 0.00 H ATOM 2305 HH12 ARG B 87 18.295 -3.250 19.295 1.00 0.00 H ATOM 2306 HH11 ARG B 87 17.208 -1.972 19.951 1.00 0.00 H ATOM 2307 HH22 ARG B 87 19.711 -2.793 17.576 1.00 0.00 H ATOM 2308 HH21 ARG B 87 19.764 -1.146 16.849 1.00 0.00 H ATOM 2309 H ARG B 87 14.314 -0.388 18.339 1.00 0.00 H ATOM 2310 N ALA B 88 12.747 0.483 15.851 1.00 6.66 N ATOM 2311 CA ALA B 88 11.916 0.356 14.639 1.00 7.10 C ATOM 2312 C ALA B 88 10.441 0.645 14.967 1.00 7.12 C ATOM 2313 O ALA B 88 9.574 0.269 14.212 1.00 7.60 O ATOM 2314 CB ALA B 88 12.069 -1.038 14.014 1.00 7.09 C ATOM 2315 H ALA B 88 12.696 -0.269 16.567 1.00 0.00 H ATOM 2316 N LEU B 89 10.168 1.278 16.113 1.00 6.86 N ATOM 2317 CA LEU B 89 8.804 1.686 16.436 1.00 6.31 C ATOM 2318 C LEU B 89 8.399 3.015 15.819 1.00 6.38 C ATOM 2319 O LEU B 89 9.156 3.982 15.868 1.00 6.41 O ATOM 2320 CB LEU B 89 8.627 1.705 17.947 1.00 6.48 C ATOM 2321 CG LEU B 89 8.660 0.363 18.691 1.00 7.36 C ATOM 2322 CD1 LEU B 89 8.689 0.667 20.179 1.00 8.24 C ATOM 2323 CD2 LEU B 89 7.458 -0.488 18.318 1.00 8.22 C ATOM 2324 H LEU B 89 10.937 1.482 16.783 1.00 0.00 H ATOM 2325 N PHE B 90 7.167 3.053 15.297 1.00 6.65 N ATOM 2326 CA PHE B 90 6.575 4.251 14.729 1.00 6.26 C ATOM 2327 C PHE B 90 5.134 4.371 15.214 1.00 5.59 C ATOM 2328 O PHE B 90 4.541 3.370 15.680 1.00 6.09 O ATOM 2329 CB PHE B 90 6.569 4.225 13.199 1.00 6.03 C ATOM 2330 CG PHE B 90 7.948 4.194 12.577 1.00 5.81 C ATOM 2331 CD1 PHE B 90 8.640 3.005 12.474 1.00 6.31 C ATOM 2332 CD2 PHE B 90 8.513 5.340 12.092 1.00 6.79 C ATOM 2333 CE1 PHE B 90 9.902 2.962 11.913 1.00 7.20 C ATOM 2334 CE2 PHE B 90 9.799 5.314 11.537 1.00 7.49 C ATOM 2335 CZ PHE B 90 10.482 4.126 11.453 1.00 7.68 C ATOM 2336 H PHE B 90 6.604 2.178 15.298 1.00 0.00 H ATOM 2337 N ALA B 91 4.598 5.578 15.110 1.00 6.05 N ATOM 2338 CA ALA B 91 3.191 5.824 15.320 1.00 6.26 C ATOM 2339 C ALA B 91 2.597 6.384 14.026 1.00 7.19 C ATOM 2340 O ALA B 91 3.233 7.231 13.369 1.00 7.64 O ATOM 2341 CB ALA B 91 2.996 6.799 16.479 1.00 7.75 C ATOM 2342 H ALA B 91 5.215 6.380 14.868 1.00 0.00 H ATOM 2343 N MET B 92 1.414 5.873 13.661 1.00 7.00 N ATOM 2344 CA MET B 92 0.763 6.237 12.399 1.00 7.33 C ATOM 2345 C MET B 92 -0.285 7.286 12.757 1.00 6.78 C ATOM 2346 O MET B 92 -1.427 6.968 13.096 1.00 7.20 O ATOM 2347 CB MET B 92 0.125 5.015 11.783 1.00 9.02 C ATOM 2348 CG MET B 92 1.076 3.849 11.561 1.00 11.35 C ATOM 2349 SD MET B 92 2.423 4.254 10.447 1.00 13.90 S ATOM 2350 CE MET B 92 1.564 3.982 8.896 1.00 18.99 C ATOM 2351 H MET B 92 0.942 5.196 14.294 1.00 0.00 H ATOM 2352 N ASP B 93 0.119 8.534 12.732 1.00 6.39 N ATOM 2353 CA ASP B 93 -0.742 9.638 13.189 1.00 6.35 C ATOM 2354 C ASP B 93 -1.722 10.041 12.082 1.00 5.68 C ATOM 2355 O ASP B 93 -1.427 10.889 11.239 1.00 7.05 O ATOM 2356 CB ASP B 93 0.097 10.812 13.681 1.00 6.12 C ATOM 2357 CG ASP B 93 -0.745 11.964 14.275 1.00 7.01 C ATOM 2358 OD1 ASP B 93 -1.986 12.001 14.043 1.00 8.30 O ATOM 2359 OD2 ASP B 93 -0.157 12.847 14.966 1.00 9.76 O ATOM 2360 H ASP B 93 1.073 8.750 12.380 1.00 0.00 H ATOM 2361 N PHE B 94 -2.900 9.421 12.119 1.00 6.32 N ATOM 2362 CA PHE B 94 -3.935 9.616 11.126 1.00 6.69 C ATOM 2363 C PHE B 94 -4.818 10.817 11.422 1.00 7.34 C ATOM 2364 O PHE B 94 -5.734 11.118 10.643 1.00 9.52 O ATOM 2365 CB PHE B 94 -4.757 8.328 10.866 1.00 6.77 C ATOM 2366 CG PHE B 94 -5.480 7.754 12.049 1.00 6.40 C ATOM 2367 CD1 PHE B 94 -4.839 6.953 12.981 1.00 6.21 C ATOM 2368 CD2 PHE B 94 -6.857 7.940 12.180 1.00 6.47 C ATOM 2369 CE1 PHE B 94 -5.540 6.384 14.015 1.00 6.42 C ATOM 2370 CE2 PHE B 94 -7.562 7.368 13.198 1.00 7.25 C ATOM 2371 CZ PHE B 94 -6.914 6.574 14.121 1.00 6.53 C ATOM 2372 H PHE B 94 -3.086 8.762 12.902 1.00 0.00 H ATOM 2373 N PHE B 95 -4.533 11.521 12.523 1.00 8.04 N ATOM 2374 CA PHE B 95 -5.178 12.798 12.801 1.00 8.15 C ATOM 2375 C PHE B 95 -4.394 14.012 12.289 1.00 8.45 C ATOM 2376 O PHE B 95 -4.951 14.881 11.650 1.00 12.04 O ATOM 2377 CB PHE B 95 -5.481 12.890 14.303 1.00 9.00 C ATOM 2378 CG PHE B 95 -6.521 11.913 14.749 1.00 8.73 C ATOM 2379 CD1 PHE B 95 -7.860 12.262 14.681 1.00 9.33 C ATOM 2380 CD2 PHE B 95 -6.194 10.651 15.188 1.00 9.63 C ATOM 2381 CE1 PHE B 95 -8.832 11.387 15.049 1.00 10.01 C ATOM 2382 CE2 PHE B 95 -7.190 9.763 15.571 1.00 8.95 C ATOM 2383 CZ PHE B 95 -8.504 10.134 15.481 1.00 9.81 C ATOM 2384 H PHE B 95 -3.834 11.148 13.197 1.00 0.00 H ATOM 2385 N ASN B 96 -3.088 14.048 12.544 1.00 8.59 N ATOM 2386 CA ASN B 96 -2.208 15.058 11.997 1.00 8.64 C ATOM 2387 C ASN B 96 -1.594 14.721 10.609 1.00 8.45 C ATOM 2388 O ASN B 96 -0.911 15.559 10.005 1.00 10.21 O ATOM 2389 CB ASN B 96 -1.138 15.399 13.005 1.00 9.87 C ATOM 2390 CG ASN B 96 -1.735 15.909 14.293 1.00 11.49 C ATOM 2391 OD1 ASN B 96 -2.541 16.876 14.279 1.00 14.41 O ATOM 2392 ND2 ASN B 96 -1.355 15.297 15.410 1.00 10.83 N ATOM 2393 HD22 ASN B 96 -0.686 14.502 15.366 1.00 0.00 H ATOM 2394 HD21 ASN B 96 -1.727 15.613 16.328 1.00 0.00 H ATOM 2395 H ASN B 96 -2.682 13.318 13.164 1.00 0.00 H ATOM 2396 N ASP B 97 -1.840 13.487 10.171 1.00 6.94 N ATOM 2397 CA ASP B 97 -1.383 12.920 8.889 1.00 7.57 C ATOM 2398 C ASP B 97 0.145 12.909 8.783 1.00 7.64 C ATOM 2399 O ASP B 97 0.750 13.492 7.876 1.00 8.13 O ATOM 2400 CB ASP B 97 -2.006 13.625 7.680 1.00 8.43 C ATOM 2401 CG ASP B 97 -3.513 13.463 7.592 1.00 8.72 C ATOM 2402 OD1 ASP B 97 -4.063 12.540 8.214 1.00 9.92 O ATOM 2403 OD2 ASP B 97 -4.133 14.259 6.831 1.00 11.61 O ATOM 2404 H ASP B 97 -2.404 12.869 10.788 1.00 0.00 H ATOM 2405 N ASN B 98 0.778 12.208 9.708 1.00 7.35 N ATOM 2406 CA ASN B 98 2.212 11.997 9.629 1.00 6.93 C ATOM 2407 C ASN B 98 2.616 10.657 10.220 1.00 7.04 C ATOM 2408 O ASN B 98 1.791 9.951 10.796 1.00 7.52 O ATOM 2409 CB ASN B 98 2.990 13.159 10.236 1.00 7.98 C ATOM 2410 CG ASN B 98 2.789 13.299 11.720 1.00 7.91 C ATOM 2411 OD1 ASN B 98 2.998 12.350 12.459 1.00 8.47 O ATOM 2412 ND2 ASN B 98 2.489 14.527 12.176 1.00 9.54 N ATOM 2413 HD22 ASN B 98 2.319 15.304 11.505 1.00 0.00 H ATOM 2414 HD21 ASN B 98 2.426 14.701 13.199 1.00 0.00 H ATOM 2415 H ASN B 98 0.242 11.803 10.502 1.00 0.00 H ATOM 2416 N ILE B 99 3.868 10.274 9.993 1.00 6.26 N ATOM 2417 CA ILE B 99 4.411 9.045 10.531 1.00 6.96 C ATOM 2418 C ILE B 99 5.589 9.454 11.410 1.00 7.20 C ATOM 2419 O ILE B 99 6.603 9.987 10.921 1.00 8.26 O ATOM 2420 CB ILE B 99 4.878 8.051 9.458 1.00 6.91 C ATOM 2421 CG1 ILE B 99 3.739 7.707 8.520 1.00 7.80 C ATOM 2422 CG2 ILE B 99 5.492 6.853 10.134 1.00 6.91 C ATOM 2423 CD1 ILE B 99 4.153 6.978 7.272 1.00 8.98 C ATOM 2424 H ILE B 99 4.479 10.879 9.408 1.00 0.00 H ATOM 2425 N MET B 100 5.434 9.245 12.710 1.00 6.10 N ATOM 2426 CA MET B 100 6.434 9.620 13.695 1.00 7.12 C ATOM 2427 C MET B 100 7.252 8.415 14.196 1.00 6.73 C ATOM 2428 O MET B 100 6.704 7.390 14.612 1.00 7.34 O ATOM 2429 CB MET B 100 5.755 10.305 14.887 1.00 8.47 C ATOM 2430 CG MET B 100 6.792 10.885 15.838 1.00 10.61 C ATOM 2431 SD MET B 100 6.192 11.452 17.436 1.00 13.27 S ATOM 2432 CE MET B 100 5.553 13.045 17.000 1.00 13.52 C ATOM 2433 H MET B 100 4.557 8.792 13.039 1.00 0.00 H ATOM 2434 N HIS B 101 8.570 8.539 14.152 1.00 7.32 N ATOM 2435 CA HIS B 101 9.461 7.520 14.731 1.00 7.27 C ATOM 2436 C HIS B 101 9.448 7.700 16.277 1.00 7.91 C ATOM 2437 O HIS B 101 9.208 8.791 16.791 1.00 8.50 O ATOM 2438 CB HIS B 101 10.884 7.702 14.162 1.00 7.27 C ATOM 2439 CG HIS B 101 11.890 6.756 14.726 1.00 7.86 C ATOM 2440 ND1 HIS B 101 12.812 7.137 15.692 1.00 7.61 N ATOM 2441 CD2 HIS B 101 12.086 5.435 14.507 1.00 7.68 C ATOM 2442 CE1 HIS B 101 13.554 6.093 15.999 1.00 9.27 C ATOM 2443 NE2 HIS B 101 13.132 5.052 15.302 1.00 8.13 N ATOM 2444 H HIS B 101 8.986 9.377 13.697 1.00 0.00 H ATOM 2445 N LYS B 102 9.763 6.633 16.996 1.00 7.79 N ATOM 2446 CA LYS B 102 9.796 6.652 18.467 1.00 9.44 C ATOM 2447 C LYS B 102 10.625 7.799 19.074 1.00 8.91 C ATOM 2448 O LYS B 102 10.356 8.292 20.173 1.00 9.80 O ATOM 2449 CB LYS B 102 10.288 5.285 18.930 1.00 9.64 C ATOM 2450 CG LYS B 102 10.114 5.054 20.417 1.00 12.05 C ATOM 2451 CD LYS B 102 8.654 4.871 20.804 1.00 14.13 C ATOM 2452 CE LYS B 102 8.474 4.186 22.137 1.00 17.76 C ATOM 2453 NZ LYS B 102 8.932 5.032 23.211 1.00 20.43 N ATOM 2454 HZ1 LYS B 102 9.941 5.246 23.076 1.00 0.00 H ATOM 2455 HZ2 LYS B 102 8.386 5.917 23.211 1.00 0.00 H ATOM 2456 HZ3 LYS B 102 8.799 4.541 24.118 1.00 0.00 H ATOM 2457 H LYS B 102 9.996 5.748 16.502 1.00 0.00 H ATOM 2458 N GLY B 103 11.657 8.230 18.366 1.00 8.88 N ATOM 2459 CA GLY B 103 12.490 9.310 18.834 1.00 8.96 C ATOM 2460 C GLY B 103 11.920 10.702 18.661 1.00 10.18 C ATOM 2461 O GLY B 103 12.555 11.679 19.073 1.00 13.76 O ATOM 2462 H GLY B 103 11.872 7.780 17.453 1.00 0.00 H ATOM 2463 N GLY B 104 10.752 10.802 18.017 1.00 9.01 N ATOM 2464 CA GLY B 104 10.030 12.067 17.875 1.00 9.62 C ATOM 2465 C GLY B 104 10.118 12.806 16.548 1.00 9.33 C ATOM 2466 O GLY B 104 9.457 13.835 16.393 1.00 11.13 O ATOM 2467 H GLY B 104 10.339 9.944 17.599 1.00 0.00 H ATOM 2468 N LYS B 105 10.940 12.299 15.613 1.00 8.93 N ATOM 2469 CA LYS B 105 11.054 12.825 14.262 1.00 8.97 C ATOM 2470 C LYS B 105 10.132 12.080 13.311 1.00 8.64 C ATOM 2471 O LYS B 105 9.484 11.101 13.695 1.00 9.74 O ATOM 2472 CB LYS B 105 12.525 12.806 13.803 1.00 9.14 C ATOM 2473 CG LYS B 105 13.436 13.678 14.680 1.00 11.01 C ATOM 2474 CD LYS B 105 14.838 13.712 14.063 1.00 12.59 C ATOM 2475 CE LYS B 105 15.847 14.450 14.906 1.00 17.42 C ATOM 2476 NZ LYS B 105 15.688 15.919 14.866 1.00 17.94 N ATOM 2477 HZ1 LYS B 105 15.797 16.252 13.887 1.00 0.00 H ATOM 2478 HZ2 LYS B 105 14.743 16.174 15.217 1.00 0.00 H ATOM 2479 HZ3 LYS B 105 16.413 16.361 15.466 1.00 0.00 H ATOM 2480 H LYS B 105 11.529 11.482 15.871 1.00 0.00 H ATOM 2481 N TYR B 106 10.050 12.574 12.074 1.00 8.34 N ATOM 2482 CA TYR B 106 9.053 12.115 11.117 1.00 8.59 C ATOM 2483 C TYR B 106 9.694 11.555 9.851 1.00 8.37 C ATOM 2484 O TYR B 106 10.846 11.889 9.545 1.00 10.18 O ATOM 2485 CB TYR B 106 8.126 13.259 10.737 1.00 10.05 C ATOM 2486 CG TYR B 106 7.471 13.948 11.899 1.00 9.18 C ATOM 2487 CD1 TYR B 106 6.318 13.433 12.484 1.00 9.83 C ATOM 2488 CD2 TYR B 106 7.987 15.122 12.426 1.00 9.55 C ATOM 2489 CE1 TYR B 106 5.709 14.070 13.561 1.00 10.53 C ATOM 2490 CE2 TYR B 106 7.375 15.751 13.493 1.00 11.98 C ATOM 2491 CZ TYR B 106 6.229 15.239 14.039 1.00 12.22 C ATOM 2492 OH TYR B 106 5.624 15.872 15.109 1.00 13.60 O ATOM 2493 HH TYR B 106 4.813 15.369 15.373 1.00 0.00 H ATOM 2494 H TYR B 106 10.722 13.313 11.783 1.00 0.00 H ATOM 2495 N ILE B 107 8.923 10.724 9.107 1.00 6.95 N ATOM 2496 CA ILE B 107 9.324 10.346 7.771 1.00 7.79 C ATOM 2497 C ILE B 107 9.030 11.495 6.799 1.00 8.38 C ATOM 2498 O ILE B 107 7.941 12.047 6.799 1.00 9.31 O ATOM 2499 CB ILE B 107 8.664 9.039 7.332 1.00 8.17 C ATOM 2500 CG1 ILE B 107 9.027 7.876 8.305 1.00 9.51 C ATOM 2501 CG2 ILE B 107 9.043 8.707 5.884 1.00 8.83 C ATOM 2502 CD1 ILE B 107 8.469 6.531 7.929 1.00 10.75 C ATOM 2503 H ILE B 107 8.034 10.355 9.502 1.00 0.00 H ATOM 2504 N HIS B 108 10.046 11.844 6.005 1.00 8.03 N ATOM 2505 CA HIS B 108 9.978 12.894 4.962 1.00 9.29 C ATOM 2506 C HIS B 108 10.473 12.365 3.653 1.00 9.97 C ATOM 2507 O HIS B 108 11.328 11.496 3.626 1.00 9.66 O ATOM 2508 CB HIS B 108 10.964 14.049 5.262 1.00 10.21 C ATOM 2509 CG HIS B 108 10.547 14.954 6.371 1.00 10.62 C ATOM 2510 ND1 HIS B 108 10.477 16.324 6.223 1.00 10.92 N ATOM 2511 CD2 HIS B 108 10.219 14.693 7.658 1.00 9.52 C ATOM 2512 CE1 HIS B 108 10.074 16.861 7.356 1.00 11.68 C ATOM 2513 NE2 HIS B 108 9.909 15.890 8.244 1.00 10.85 N ATOM 2514 H HIS B 108 10.949 11.343 6.128 1.00 0.00 H ATOM 2515 N PRO B 109 9.987 12.922 2.543 1.00 10.71 N ATOM 2516 CA PRO B 109 10.826 12.812 1.319 1.00 10.76 C ATOM 2517 C PRO B 109 12.132 13.602 1.464 1.00 9.69 C ATOM 2518 O PRO B 109 12.099 14.743 1.968 1.00 11.36 O ATOM 2519 CB PRO B 109 9.937 13.421 0.236 1.00 11.30 C ATOM 2520 CG PRO B 109 9.163 14.451 0.977 1.00 12.27 C ATOM 2521 CD PRO B 109 8.953 13.947 2.406 1.00 10.63 C ATOM 2522 N LYS B 110 13.256 13.012 1.026 1.00 10.54 N ATOM 2523 CA LYS B 110 14.554 13.668 1.086 1.00 11.73 C ATOM 2524 C LYS B 110 14.489 14.911 0.215 1.00 12.69 C ATOM 2525 O LYS B 110 14.148 14.826 -0.996 1.00 14.78 O ATOM 2526 CB LYS B 110 15.648 12.748 0.579 1.00 14.88 C ATOM 2527 CG LYS B 110 17.022 13.335 0.710 1.00 17.30 C ATOM 2528 CD LYS B 110 18.049 12.273 0.395 1.00 24.59 C ATOM 2529 CE LYS B 110 19.417 12.882 0.278 1.00 31.96 C ATOM 2530 NZ LYS B 110 20.223 11.986 -0.593 1.00 43.13 N ATOM 2531 HZ1 LYS B 110 20.278 11.042 -0.161 1.00 0.00 H ATOM 2532 HZ2 LYS B 110 19.772 11.915 -1.527 1.00 0.00 H ATOM 2533 HZ3 LYS B 110 21.181 12.377 -0.698 1.00 0.00 H ATOM 2534 H LYS B 110 13.197 12.052 0.630 1.00 0.00 H ATOM 2535 N GLY B 111 14.798 16.050 0.813 1.00 16.12 N ATOM 2536 CA GLY B 111 14.617 17.325 0.182 1.00 19.53 C ATOM 2537 C GLY B 111 13.343 18.131 0.479 1.00 18.84 C ATOM 2538 O GLY B 111 13.277 19.351 0.182 1.00 18.75 O ATOM 2539 H GLY B 111 15.187 16.020 1.777 1.00 0.00 H ATOM 2540 N GLY B 112 12.306 17.468 0.971 1.00 15.33 N ATOM 2541 CA GLY B 112 11.072 18.132 1.381 1.00 15.74 C ATOM 2542 C GLY B 112 10.173 18.699 0.290 1.00 16.53 C ATOM 2543 O GLY B 112 9.394 19.594 0.572 1.00 16.25 O ATOM 2544 H GLY B 112 12.374 16.435 1.069 1.00 0.00 H ATOM 2545 N SER B 113 10.255 18.148 -0.944 1.00 13.79 N ATOM 2546 CA SER B 113 9.401 18.572 -2.025 1.00 15.64 C ATOM 2547 C SER B 113 7.940 18.146 -1.841 1.00 17.02 C ATOM 2548 O SER B 113 7.668 16.996 -1.535 1.00 15.77 O ATOM 2549 CB SER B 113 9.904 18.020 -3.355 1.00 17.22 C ATOM 2550 OG SER B 113 9.135 18.548 -4.425 1.00 17.58 O ATOM 2551 HG SER B 113 9.470 18.183 -5.282 1.00 0.00 H ATOM 2552 H SER B 113 10.954 17.398 -1.117 1.00 0.00 H ATOM 2553 N PRO B 114 7.005 19.065 -2.097 1.00 14.93 N ATOM 2554 CA PRO B 114 5.596 18.687 -2.247 1.00 16.59 C ATOM 2555 C PRO B 114 5.324 17.751 -3.435 1.00 13.81 C ATOM 2556 O PRO B 114 4.273 17.095 -3.470 1.00 16.96 O ATOM 2557 CB PRO B 114 4.875 20.031 -2.449 1.00 20.54 C ATOM 2558 CG PRO B 114 5.865 21.089 -2.135 1.00 24.23 C ATOM 2559 CD PRO B 114 7.229 20.512 -2.303 1.00 20.11 C ATOM 2560 N ASN B 115 6.248 17.687 -4.388 1.00 14.14 N ATOM 2561 CA ASN B 115 6.106 16.810 -5.560 1.00 14.92 C ATOM 2562 C ASN B 115 7.411 16.130 -5.924 1.00 14.90 C ATOM 2563 O ASN B 115 7.999 16.383 -6.988 1.00 15.45 O ATOM 2564 CB ASN B 115 5.562 17.546 -6.785 1.00 17.39 C ATOM 2565 CG ASN B 115 5.168 16.579 -7.893 1.00 21.55 C ATOM 2566 OD1 ASN B 115 4.863 15.396 -7.631 1.00 21.24 O ATOM 2567 ND2 ASN B 115 5.215 17.062 -9.160 1.00 20.30 N ATOM 2568 HD22 ASN B 115 5.474 18.055 -9.329 1.00 0.00 H ATOM 2569 HD21 ASN B 115 4.992 16.439 -9.962 1.00 0.00 H ATOM 2570 H ASN B 115 7.100 18.277 -4.302 1.00 0.00 H ATOM 2571 N PRO B 116 7.866 15.224 -5.055 1.00 14.36 N ATOM 2572 CA PRO B 116 9.137 14.548 -5.313 1.00 15.53 C ATOM 2573 C PRO B 116 8.992 13.626 -6.512 1.00 13.40 C ATOM 2574 O PRO B 116 7.957 13.016 -6.685 1.00 13.90 O ATOM 2575 CB PRO B 116 9.392 13.728 -4.042 1.00 15.60 C ATOM 2576 CG PRO B 116 8.209 13.933 -3.181 1.00 18.64 C ATOM 2577 CD PRO B 116 7.177 14.741 -3.856 1.00 15.19 C ATOM 2578 N PRO B 117 10.019 13.542 -7.354 1.00 15.28 N ATOM 2579 CA PRO B 117 9.981 12.623 -8.467 1.00 15.79 C ATOM 2580 C PRO B 117 10.028 11.180 -8.009 1.00 14.51 C ATOM 2581 O PRO B 117 10.459 10.907 -6.880 1.00 14.15 O ATOM 2582 CB PRO B 117 11.259 12.958 -9.240 1.00 19.49 C ATOM 2583 CG PRO B 117 12.146 13.604 -8.270 1.00 19.75 C ATOM 2584 CD PRO B 117 11.277 14.307 -7.302 1.00 16.63 C ATOM 2585 N ASN B 118 9.612 10.264 -8.887 1.00 14.74 N ATOM 2586 CA ASN B 118 9.760 8.836 -8.656 1.00 13.61 C ATOM 2587 C ASN B 118 11.160 8.491 -8.176 1.00 15.14 C ATOM 2588 O ASN B 118 12.166 9.023 -8.680 1.00 14.21 O ATOM 2589 CB ASN B 118 9.381 7.974 -9.874 1.00 14.08 C ATOM 2590 CG ASN B 118 7.879 7.853 -10.070 1.00 15.48 C ATOM 2591 OD1 ASN B 118 7.084 8.019 -9.142 1.00 16.91 O ATOM 2592 ND2 ASN B 118 7.478 7.547 -11.291 1.00 20.26 N ATOM 2593 HD22 ASN B 118 8.177 7.414 -12.050 1.00 0.00 H ATOM 2594 HD21 ASN B 118 6.464 7.439 -11.493 1.00 0.00 H ATOM 2595 H ASN B 118 9.165 10.584 -9.770 1.00 0.00 H ATOM 2596 N ASN B 119 11.188 7.588 -7.191 1.00 12.46 N ATOM 2597 CA ASN B 119 12.400 7.056 -6.596 1.00 13.80 C ATOM 2598 C ASN B 119 13.143 8.013 -5.678 1.00 13.51 C ATOM 2599 O ASN B 119 14.286 7.745 -5.287 1.00 14.50 O ATOM 2600 CB ASN B 119 13.310 6.372 -7.637 1.00 13.87 C ATOM 2601 CG ASN B 119 12.709 5.079 -8.161 1.00 14.37 C ATOM 2602 OD1 ASN B 119 12.061 4.343 -7.415 1.00 16.18 O ATOM 2603 ND2 ASN B 119 12.892 4.802 -9.442 1.00 16.23 N ATOM 2604 HD22 ASN B 119 13.445 5.448 -10.040 1.00 0.00 H ATOM 2605 HD21 ASN B 119 12.482 3.938 -9.851 1.00 0.00 H ATOM 2606 H ASN B 119 10.278 7.243 -6.825 1.00 0.00 H ATOM 2607 N THR B 120 12.473 9.094 -5.272 1.00 12.51 N ATOM 2608 CA THR B 120 12.994 9.950 -4.207 1.00 11.99 C ATOM 2609 C THR B 120 13.091 9.177 -2.905 1.00 10.59 C ATOM 2610 O THR B 120 12.138 8.540 -2.504 1.00 11.65 O ATOM 2611 CB THR B 120 12.123 11.193 -4.003 1.00 11.72 C ATOM 2612 OG1 THR B 120 12.209 12.018 -5.184 1.00 14.40 O ATOM 2613 CG2 THR B 120 12.636 12.012 -2.804 1.00 12.65 C ATOM 2614 HG1 THR B 120 11.886 11.506 -5.967 1.00 0.00 H ATOM 2615 H THR B 120 11.565 9.331 -5.721 1.00 0.00 H ATOM 2616 N GLU B 121 14.248 9.207 -2.267 1.00 10.69 N ATOM 2617 CA GLU B 121 14.469 8.488 -1.007 1.00 11.55 C ATOM 2618 C GLU B 121 13.667 9.152 0.104 1.00 11.39 C ATOM 2619 O GLU B 121 13.424 10.351 0.064 1.00 12.35 O ATOM 2620 CB GLU B 121 15.964 8.501 -0.611 1.00 13.60 C ATOM 2621 CG GLU B 121 16.857 7.813 -1.616 1.00 15.65 C ATOM 2622 CD GLU B 121 18.327 7.911 -1.305 1.00 19.65 C ATOM 2623 OE1 GLU B 121 18.703 8.582 -0.300 1.00 18.98 O ATOM 2624 OE2 GLU B 121 19.107 7.305 -2.101 1.00 25.55 O ATOM 2625 H GLU B 121 15.030 9.760 -2.672 1.00 0.00 H ATOM 2626 N THR B 122 13.291 8.373 1.118 1.00 10.33 N ATOM 2627 CA THR B 122 12.736 8.938 2.340 1.00 9.75 C ATOM 2628 C THR B 122 13.748 8.923 3.478 1.00 9.62 C ATOM 2629 O THR B 122 14.647 8.054 3.525 1.00 10.12 O ATOM 2630 CB THR B 122 11.437 8.211 2.753 1.00 9.61 C ATOM 2631 OG1 THR B 122 11.672 6.817 2.983 1.00 9.94 O ATOM 2632 CG2 THR B 122 10.420 8.362 1.644 1.00 10.04 C ATOM 2633 HG1 THR B 122 12.017 6.400 2.154 1.00 0.00 H ATOM 2634 H THR B 122 13.396 7.342 1.035 1.00 0.00 H ATOM 2635 N VAL B 123 13.605 9.909 4.366 1.00 9.28 N ATOM 2636 CA VAL B 123 14.522 10.132 5.447 1.00 9.89 C ATOM 2637 C VAL B 123 13.760 10.553 6.696 1.00 10.14 C ATOM 2638 O VAL B 123 12.617 11.008 6.618 1.00 11.16 O ATOM 2639 CB VAL B 123 15.539 11.259 5.107 1.00 10.36 C ATOM 2640 CG1 VAL B 123 16.426 10.847 3.915 1.00 11.42 C ATOM 2641 CG2 VAL B 123 14.833 12.607 4.882 1.00 9.99 C ATOM 2642 H VAL B 123 12.789 10.547 4.270 1.00 0.00 H ATOM 2643 N ILE B 124 14.437 10.436 7.848 1.00 10.20 N ATOM 2644 CA ILE B 124 13.989 11.035 9.096 1.00 11.19 C ATOM 2645 C ILE B 124 14.243 12.552 9.079 1.00 10.74 C ATOM 2646 O ILE B 124 15.303 12.987 8.665 1.00 11.51 O ATOM 2647 CB ILE B 124 14.848 10.470 10.267 1.00 12.90 C ATOM 2648 CG1 ILE B 124 14.544 9.011 10.510 1.00 15.23 C ATOM 2649 CG2 ILE B 124 14.742 11.304 11.501 1.00 14.80 C ATOM 2650 CD1 ILE B 124 13.170 8.782 11.106 1.00 18.68 C ATOM 2651 H ILE B 124 15.323 9.892 7.849 1.00 0.00 H ATOM 2652 N HIS B 125 13.295 13.347 9.546 1.00 10.80 N ATOM 2653 CA HIS B 125 13.553 14.771 9.783 1.00 11.47 C ATOM 2654 C HIS B 125 12.551 15.280 10.808 1.00 12.14 C ATOM 2655 O HIS B 125 11.377 14.851 10.839 1.00 10.94 O ATOM 2656 CB HIS B 125 13.505 15.574 8.466 1.00 11.58 C ATOM 2657 CG HIS B 125 14.204 16.885 8.520 1.00 12.86 C ATOM 2658 ND1 HIS B 125 13.696 17.964 9.194 1.00 14.66 N ATOM 2659 CD2 HIS B 125 15.375 17.299 7.967 1.00 15.25 C ATOM 2660 CE1 HIS B 125 14.524 18.994 9.070 1.00 17.22 C ATOM 2661 NE2 HIS B 125 15.550 18.620 8.324 1.00 15.47 N ATOM 2662 H HIS B 125 12.353 12.957 9.748 1.00 0.00 H ATOM 2663 N GLY B 126 13.023 16.140 11.700 1.00 10.58 N ATOM 2664 CA GLY B 126 12.162 16.658 12.742 1.00 11.78 C ATOM 2665 C GLY B 126 11.135 17.694 12.341 1.00 12.83 C ATOM 2666 O GLY B 126 10.181 17.940 13.094 1.00 13.42 O ATOM 2667 H GLY B 126 14.016 16.444 11.651 1.00 0.00 H ATOM 2668 N ASP B 127 11.315 18.312 11.163 1.00 12.93 N ATOM 2669 CA ASP B 127 10.411 19.371 10.726 1.00 14.44 C ATOM 2670 C ASP B 127 8.992 18.838 10.448 1.00 14.82 C ATOM 2671 O ASP B 127 8.794 17.674 10.048 1.00 12.42 O ATOM 2672 CB ASP B 127 10.930 20.041 9.445 1.00 16.39 C ATOM 2673 CG ASP B 127 12.034 21.024 9.697 1.00 19.92 C ATOM 2674 OD1 ASP B 127 12.406 21.240 10.878 1.00 21.48 O ATOM 2675 OD2 ASP B 127 12.562 21.560 8.688 1.00 22.18 O ATOM 2676 H ASP B 127 12.110 18.032 10.553 1.00 0.00 H ATOM 2677 N LYS B 128 8.018 19.712 10.670 1.00 14.37 N ATOM 2678 CA LYS B 128 6.634 19.455 10.312 1.00 15.06 C ATOM 2679 C LYS B 128 6.206 20.517 9.278 1.00 17.08 C ATOM 2680 O LYS B 128 6.406 21.727 9.487 1.00 17.39 O ATOM 2681 CB LYS B 128 5.794 19.501 11.583 1.00 20.69 C ATOM 2682 CG LYS B 128 4.397 18.958 11.421 1.00 27.71 C ATOM 2683 CD LYS B 128 3.574 18.980 12.709 1.00 30.65 C ATOM 2684 CE LYS B 128 4.439 18.950 13.935 1.00 34.65 C ATOM 2685 NZ LYS B 128 3.570 18.979 15.135 1.00 50.35 N ATOM 2686 HZ1 LYS B 128 2.999 19.848 15.127 1.00 0.00 H ATOM 2687 HZ2 LYS B 128 2.942 18.150 15.127 1.00 0.00 H ATOM 2688 HZ3 LYS B 128 4.161 18.958 15.990 1.00 0.00 H ATOM 2689 H LYS B 128 8.256 20.619 11.119 1.00 0.00 H ATOM 2690 N HIS B 129 5.652 20.053 8.159 1.00 14.69 N ATOM 2691 CA HIS B 129 5.110 20.906 7.109 1.00 14.33 C ATOM 2692 C HIS B 129 4.250 20.039 6.195 1.00 13.29 C ATOM 2693 O HIS B 129 4.191 18.815 6.389 1.00 12.06 O ATOM 2694 CB HIS B 129 6.220 21.620 6.333 1.00 17.44 C ATOM 2695 CG HIS B 129 7.336 20.736 5.860 1.00 16.55 C ATOM 2696 ND1 HIS B 129 7.158 19.730 4.933 1.00 14.87 N ATOM 2697 CD2 HIS B 129 8.663 20.746 6.148 1.00 17.02 C ATOM 2698 CE1 HIS B 129 8.313 19.142 4.688 1.00 16.30 C ATOM 2699 NE2 HIS B 129 9.241 19.730 5.423 1.00 16.30 N ATOM 2700 H HIS B 129 5.603 19.023 8.027 1.00 0.00 H ATOM 2701 N ALA B 130 3.631 20.641 5.183 1.00 13.98 N ATOM 2702 CA ALA B 130 2.704 19.929 4.335 1.00 13.70 C ATOM 2703 C ALA B 130 3.349 18.775 3.520 1.00 11.41 C ATOM 2704 O ALA B 130 2.695 17.768 3.210 1.00 13.45 O ATOM 2705 CB ALA B 130 2.013 20.915 3.391 1.00 16.50 C ATOM 2706 H ALA B 130 3.819 21.647 4.998 1.00 0.00 H ATOM 2707 N ALA B 131 4.630 18.913 3.204 1.00 12.59 N ATOM 2708 CA ALA B 131 5.311 17.948 2.365 1.00 12.71 C ATOM 2709 C ALA B 131 5.811 16.719 3.113 1.00 10.91 C ATOM 2710 O ALA B 131 6.397 15.845 2.503 1.00 12.29 O ATOM 2711 CB ALA B 131 6.455 18.612 1.608 1.00 13.18 C ATOM 2712 H ALA B 131 5.157 19.733 3.567 1.00 0.00 H ATOM 2713 N MET B 132 5.598 16.655 4.419 1.00 9.85 N ATOM 2714 CA MET B 132 5.887 15.401 5.154 1.00 9.79 C ATOM 2715 C MET B 132 4.605 14.675 5.614 1.00 9.24 C ATOM 2716 O MET B 132 4.676 13.723 6.392 1.00 9.11 O ATOM 2717 CB MET B 132 6.876 15.623 6.335 1.00 11.02 C ATOM 2718 CG MET B 132 6.581 16.780 7.271 1.00 11.82 C ATOM 2719 SD MET B 132 5.058 16.639 8.233 1.00 12.20 S ATOM 2720 CE MET B 132 5.636 15.544 9.542 1.00 12.08 C ATOM 2721 H MET B 132 5.229 17.483 4.928 1.00 0.00 H ATOM 2722 N GLU B 133 3.452 15.122 5.128 1.00 8.37 N ATOM 2723 CA GLU B 133 2.189 14.498 5.477 1.00 8.41 C ATOM 2724 C GLU B 133 1.945 13.198 4.657 1.00 8.50 C ATOM 2725 O GLU B 133 2.260 13.136 3.475 1.00 8.50 O ATOM 2726 CB GLU B 133 1.048 15.479 5.322 1.00 10.05 C ATOM 2727 CG GLU B 133 1.148 16.586 6.349 1.00 10.94 C ATOM 2728 CD GLU B 133 0.077 17.655 6.247 1.00 13.60 C ATOM 2729 OE1 GLU B 133 -0.809 17.595 5.370 1.00 18.98 O ATOM 2730 OE2 GLU B 133 0.143 18.600 7.039 1.00 17.59 O ATOM 2731 H GLU B 133 3.455 15.938 4.483 1.00 0.00 H ATOM 2732 N PHE B 134 1.399 12.185 5.314 1.00 7.67 N ATOM 2733 CA PHE B 134 1.024 10.907 4.714 1.00 7.53 C ATOM 2734 C PHE B 134 -0.369 10.527 5.193 1.00 8.12 C ATOM 2735 O PHE B 134 -0.733 10.804 6.333 1.00 8.91 O ATOM 2736 CB PHE B 134 1.983 9.797 5.150 1.00 7.84 C ATOM 2737 CG PHE B 134 3.352 9.922 4.555 1.00 7.61 C ATOM 2738 CD1 PHE B 134 3.645 9.362 3.324 1.00 8.35 C ATOM 2739 CD2 PHE B 134 4.349 10.637 5.222 1.00 7.89 C ATOM 2740 CE1 PHE B 134 4.925 9.458 2.771 1.00 9.00 C ATOM 2741 CE2 PHE B 134 5.609 10.796 4.658 1.00 8.94 C ATOM 2742 CZ PHE B 134 5.907 10.203 3.425 1.00 8.01 C ATOM 2743 H PHE B 134 1.225 12.309 6.332 1.00 0.00 H ATOM 2744 N ILE B 135 -1.125 9.902 4.305 1.00 7.78 N ATOM 2745 CA ILE B 135 -2.397 9.310 4.616 1.00 7.78 C ATOM 2746 C ILE B 135 -2.351 7.832 4.253 1.00 7.07 C ATOM 2747 O ILE B 135 -1.475 7.382 3.498 1.00 8.04 O ATOM 2748 CB ILE B 135 -3.588 10.059 3.979 1.00 8.42 C ATOM 2749 CG1 ILE B 135 -3.619 9.960 2.457 1.00 10.24 C ATOM 2750 CG2 ILE B 135 -3.545 11.511 4.409 1.00 9.52 C ATOM 2751 CD1 ILE B 135 -4.939 10.430 1.866 1.00 11.97 C ATOM 2752 H ILE B 135 -0.779 9.835 3.326 1.00 0.00 H ATOM 2753 N PHE B 136 -3.263 7.072 4.820 1.00 6.49 N ATOM 2754 CA PHE B 136 -3.188 5.601 4.785 1.00 6.66 C ATOM 2755 C PHE B 136 -4.461 5.090 4.152 1.00 6.65 C ATOM 2756 O PHE B 136 -5.544 5.256 4.699 1.00 7.00 O ATOM 2757 CB PHE B 136 -2.978 5.025 6.195 1.00 6.87 C ATOM 2758 CG PHE B 136 -1.996 5.829 7.027 1.00 7.57 C ATOM 2759 CD1 PHE B 136 -0.717 6.105 6.546 1.00 8.39 C ATOM 2760 CD2 PHE B 136 -2.367 6.378 8.252 1.00 7.22 C ATOM 2761 CE1 PHE B 136 0.173 6.908 7.249 1.00 8.99 C ATOM 2762 CE2 PHE B 136 -1.460 7.147 8.982 1.00 7.15 C ATOM 2763 CZ PHE B 136 -0.203 7.413 8.484 1.00 8.67 C ATOM 2764 H PHE B 136 -4.062 7.524 5.308 1.00 0.00 H ATOM 2765 N VAL B 137 -4.331 4.546 2.944 1.00 6.70 N ATOM 2766 CA VAL B 137 -5.476 4.324 2.086 1.00 7.48 C ATOM 2767 C VAL B 137 -5.677 2.875 1.662 1.00 6.64 C ATOM 2768 O VAL B 137 -4.774 2.012 1.722 1.00 7.15 O ATOM 2769 CB VAL B 137 -5.425 5.260 0.860 1.00 8.36 C ATOM 2770 CG1 VAL B 137 -5.462 6.709 1.322 1.00 8.98 C ATOM 2771 CG2 VAL B 137 -4.209 4.997 -0.003 1.00 9.91 C ATOM 2772 H VAL B 137 -3.385 4.274 2.609 1.00 0.00 H ATOM 2773 N SER B 138 -6.876 2.590 1.187 1.00 7.09 N ATOM 2774 CA SER B 138 -7.209 1.223 0.775 1.00 7.63 C ATOM 2775 C SER B 138 -6.428 0.790 -0.470 1.00 8.14 C ATOM 2776 O SER B 138 -6.352 1.563 -1.428 1.00 9.61 O ATOM 2777 CB SER B 138 -8.697 1.182 0.383 1.00 8.23 C ATOM 2778 OG SER B 138 -9.054 -0.098 -0.160 1.00 9.93 O ATOM 2779 HG SER B 138 -10.014 -0.096 -0.403 1.00 0.00 H ATOM 2780 H SER B 138 -7.590 3.342 1.105 1.00 0.00 H ATOM 2781 N PRO B 139 -5.920 -0.455 -0.490 1.00 9.34 N ATOM 2782 CA PRO B 139 -5.319 -0.969 -1.737 1.00 10.64 C ATOM 2783 C PRO B 139 -6.311 -1.044 -2.898 1.00 11.95 C ATOM 2784 O PRO B 139 -5.864 -1.163 -4.039 1.00 17.24 O ATOM 2785 CB PRO B 139 -4.820 -2.365 -1.352 1.00 13.34 C ATOM 2786 CG PRO B 139 -4.638 -2.304 0.149 1.00 14.75 C ATOM 2787 CD PRO B 139 -5.784 -1.430 0.607 1.00 11.61 C ATOM 2788 N LYS B 140 -7.621 -1.010 -2.622 1.00 10.48 N ATOM 2789 CA LYS B 140 -8.651 -1.014 -3.687 1.00 11.93 C ATOM 2790 C LYS B 140 -9.188 0.369 -4.061 1.00 12.06 C ATOM 2791 O LYS B 140 -9.984 0.487 -5.005 1.00 15.95 O ATOM 2792 CB LYS B 140 -9.820 -1.897 -3.317 1.00 14.00 C ATOM 2793 CG LYS B 140 -9.422 -3.302 -2.966 1.00 19.01 C ATOM 2794 CD LYS B 140 -10.577 -4.274 -2.883 1.00 23.89 C ATOM 2795 CE LYS B 140 -11.581 -3.951 -1.818 1.00 28.17 C ATOM 2796 NZ LYS B 140 -12.473 -5.144 -1.713 1.00 32.02 N ATOM 2797 HZ1 LYS B 140 -12.938 -5.310 -2.629 1.00 0.00 H ATOM 2798 HZ2 LYS B 140 -11.907 -5.977 -1.454 1.00 0.00 H ATOM 2799 HZ3 LYS B 140 -13.194 -4.973 -0.983 1.00 0.00 H ATOM 2800 H LYS B 140 -7.925 -0.980 -1.628 1.00 0.00 H ATOM 2801 N ASN B 141 -8.813 1.402 -3.310 1.00 11.70 N ATOM 2802 CA ASN B 141 -9.284 2.760 -3.568 1.00 12.38 C ATOM 2803 C ASN B 141 -8.330 3.724 -2.903 1.00 11.40 C ATOM 2804 O ASN B 141 -8.407 3.968 -1.687 1.00 11.43 O ATOM 2805 CB ASN B 141 -10.712 2.997 -3.059 1.00 12.84 C ATOM 2806 CG ASN B 141 -11.205 4.412 -3.363 1.00 14.55 C ATOM 2807 OD1 ASN B 141 -10.431 5.320 -3.708 1.00 14.92 O ATOM 2808 ND2 ASN B 141 -12.493 4.620 -3.194 1.00 22.49 N ATOM 2809 HD22 ASN B 141 -13.113 3.837 -2.904 1.00 0.00 H ATOM 2810 HD21 ASN B 141 -12.892 5.568 -3.350 1.00 0.00 H ATOM 2811 H ASN B 141 -8.164 1.237 -2.514 1.00 0.00 H ATOM 2812 N LYS B 142 -7.398 4.237 -3.695 1.00 12.60 N ATOM 2813 CA LYS B 142 -6.321 5.100 -3.203 1.00 12.91 C ATOM 2814 C LYS B 142 -6.729 6.439 -2.628 1.00 11.41 C ATOM 2815 O LYS B 142 -5.868 7.160 -2.150 1.00 13.91 O ATOM 2816 CB LYS B 142 -5.291 5.331 -4.321 1.00 15.41 C ATOM 2817 CG LYS B 142 -5.809 6.178 -5.487 1.00 17.30 C ATOM 2818 CD LYS B 142 -4.824 6.088 -6.635 1.00 22.79 C ATOM 2819 CE LYS B 142 -5.305 6.700 -7.937 1.00 27.36 C ATOM 2820 NZ LYS B 142 -5.959 7.961 -7.618 1.00 35.21 N ATOM 2821 HZ1 LYS B 142 -6.763 7.782 -6.983 1.00 0.00 H ATOM 2822 HZ2 LYS B 142 -5.279 8.594 -7.149 1.00 0.00 H ATOM 2823 HZ3 LYS B 142 -6.300 8.405 -8.495 1.00 0.00 H ATOM 2824 H LYS B 142 -7.433 4.017 -4.711 1.00 0.00 H ATOM 2825 N ASP B 143 -8.017 6.775 -2.700 1.00 11.03 N ATOM 2826 CA ASP B 143 -8.575 7.969 -2.099 1.00 13.11 C ATOM 2827 C ASP B 143 -9.317 7.689 -0.796 1.00 13.23 C ATOM 2828 O ASP B 143 -9.738 8.622 -0.160 1.00 16.49 O ATOM 2829 CB ASP B 143 -9.522 8.616 -3.104 1.00 17.50 C ATOM 2830 CG ASP B 143 -8.782 9.198 -4.285 1.00 21.97 C ATOM 2831 OD1 ASP B 143 -7.641 9.666 -4.123 1.00 25.53 O ATOM 2832 OD2 ASP B 143 -9.336 9.190 -5.385 1.00 30.30 O ATOM 2833 H ASP B 143 -8.659 6.142 -3.218 1.00 0.00 H ATOM 2834 N LYS B 144 -9.488 6.413 -0.411 1.00 11.29 N ATOM 2835 CA LYS B 144 -10.277 6.047 0.772 1.00 11.21 C ATOM 2836 C LYS B 144 -9.342 5.732 1.927 1.00 10.40 C ATOM 2837 O LYS B 144 -8.620 4.715 1.884 1.00 8.74 O ATOM 2838 CB LYS B 144 -11.129 4.799 0.503 1.00 13.15 C ATOM 2839 CG LYS B 144 -12.084 4.422 1.642 1.00 18.02 C ATOM 2840 CD LYS B 144 -12.848 3.154 1.251 1.00 25.70 C ATOM 2841 CE LYS B 144 -13.862 2.714 2.291 1.00 37.03 C ATOM 2842 NZ LYS B 144 -14.972 3.700 2.382 1.00 47.37 N ATOM 2843 HZ1 LYS B 144 -14.588 4.628 2.653 1.00 0.00 H ATOM 2844 HZ2 LYS B 144 -15.444 3.775 1.458 1.00 0.00 H ATOM 2845 HZ3 LYS B 144 -15.657 3.384 3.098 1.00 0.00 H ATOM 2846 H LYS B 144 -9.045 5.657 -0.971 1.00 0.00 H ATOM 2847 N ARG B 145 -9.367 6.587 2.945 1.00 8.92 N ATOM 2848 CA ARG B 145 -8.603 6.303 4.152 1.00 9.05 C ATOM 2849 C ARG B 145 -9.124 5.038 4.819 1.00 8.80 C ATOM 2850 O ARG B 145 -10.352 4.814 4.879 1.00 11.04 O ATOM 2851 CB ARG B 145 -8.677 7.473 5.118 1.00 8.36 C ATOM 2852 CG ARG B 145 -7.975 8.706 4.634 1.00 8.83 C ATOM 2853 CD ARG B 145 -8.333 9.845 5.567 1.00 10.02 C ATOM 2854 NE ARG B 145 -7.814 11.172 5.285 1.00 10.57 N ATOM 2855 CZ ARG B 145 -6.788 11.761 5.922 1.00 10.66 C ATOM 2856 NH1 ARG B 145 -6.056 11.089 6.808 1.00 9.55 N ATOM 2857 NH2 ARG B 145 -6.493 13.041 5.668 1.00 12.63 N ATOM 2858 HE ARG B 145 -8.276 11.712 4.526 1.00 0.00 H ATOM 2859 HH12 ARG B 145 -5.265 11.559 7.293 1.00 0.00 H ATOM 2860 HH11 ARG B 145 -6.275 10.094 7.016 1.00 0.00 H ATOM 2861 HH22 ARG B 145 -5.699 13.499 6.160 1.00 0.00 H ATOM 2862 HH21 ARG B 145 -7.057 13.578 4.979 1.00 0.00 H ATOM 2863 H ARG B 145 -9.932 7.458 2.879 1.00 0.00 H ATOM 2864 N VAL B 146 -8.198 4.238 5.359 1.00 7.98 N ATOM 2865 CA VAL B 146 -8.541 3.068 6.123 1.00 8.00 C ATOM 2866 C VAL B 146 -7.861 3.112 7.510 1.00 7.67 C ATOM 2867 O VAL B 146 -6.819 3.747 7.704 1.00 7.77 O ATOM 2868 CB VAL B 146 -8.188 1.758 5.417 1.00 8.71 C ATOM 2869 CG1 VAL B 146 -8.930 1.643 4.086 1.00 9.62 C ATOM 2870 CG2 VAL B 146 -6.681 1.612 5.228 1.00 9.31 C ATOM 2871 H VAL B 146 -7.194 4.470 5.222 1.00 0.00 H ATOM 2872 N LEU B 147 -8.483 2.451 8.458 1.00 8.41 N ATOM 2873 CA LEU B 147 -7.947 2.404 9.832 1.00 7.47 C ATOM 2874 C LEU B 147 -6.793 1.422 9.913 1.00 7.51 C ATOM 2875 O LEU B 147 -6.980 0.199 9.715 1.00 9.81 O ATOM 2876 CB LEU B 147 -9.055 1.953 10.803 1.00 9.16 C ATOM 2877 CG LEU B 147 -8.691 1.859 12.283 1.00 9.27 C ATOM 2878 CD1 LEU B 147 -8.205 3.207 12.802 1.00 9.62 C ATOM 2879 CD2 LEU B 147 -9.869 1.321 13.069 1.00 10.61 C ATOM 2880 H LEU B 147 -9.368 1.952 8.237 1.00 0.00 H ATOM 2881 N VAL B 148 -5.610 1.915 10.256 1.00 7.47 N ATOM 2882 CA VAL B 148 -4.428 1.039 10.299 1.00 8.06 C ATOM 2883 C VAL B 148 -4.243 0.329 11.628 1.00 8.12 C ATOM 2884 O VAL B 148 -3.488 -0.628 11.694 1.00 10.11 O ATOM 2885 CB VAL B 148 -3.124 1.769 9.898 1.00 9.61 C ATOM 2886 CG1 VAL B 148 -3.277 2.452 8.526 1.00 11.31 C ATOM 2887 CG2 VAL B 148 -2.648 2.744 10.971 1.00 9.92 C ATOM 2888 H VAL B 148 -5.518 2.923 10.495 1.00 0.00 H ATOM 2889 N TYR B 149 -4.931 0.796 12.664 1.00 7.53 N ATOM 2890 CA TYR B 149 -4.843 0.253 14.009 1.00 8.27 C ATOM 2891 C TYR B 149 -5.883 -0.811 14.229 1.00 13.93 C ATOM 2892 O TYR B 149 -7.051 -0.549 14.182 1.00 19.32 O ATOM 2893 CB TYR B 149 -5.028 1.378 15.043 1.00 7.87 C ATOM 2894 CG TYR B 149 -3.791 2.228 15.253 1.00 6.89 C ATOM 2895 CD1 TYR B 149 -3.571 3.350 14.511 1.00 6.77 C ATOM 2896 CD2 TYR B 149 -2.823 1.856 16.181 1.00 7.08 C ATOM 2897 CE1 TYR B 149 -2.425 4.132 14.675 1.00 6.23 C ATOM 2898 CE2 TYR B 149 -1.679 2.624 16.368 1.00 6.99 C ATOM 2899 CZ TYR B 149 -1.466 3.756 15.611 1.00 7.29 C ATOM 2900 OH TYR B 149 -0.312 4.518 15.753 1.00 8.02 O ATOM 2901 HH TYR B 149 0.479 3.958 15.550 1.00 0.00 H ATOM 2902 H TYR B 149 -5.572 1.599 12.503 1.00 0.00 H ATOM 2903 N ALA B 150 -5.421 -1.997 14.576 1.00 23.18 N ATOM 2904 CA ALA B 150 -6.291 -3.128 14.998 1.00 32.11 C ATOM 2905 C ALA B 150 -5.547 -3.987 16.035 1.00 40.05 C ATOM 2906 O ALA B 150 -6.173 -4.643 16.875 1.00 49.72 O ATOM 2907 CB ALA B 150 -6.730 -3.958 13.796 1.00 37.46 C ATOM 2908 H ALA B 150 -4.393 -2.150 14.553 1.00 0.00 H TER 2909 ALA B 150 HETATM 2910 O HOH 1 -16.378 28.942 29.164 1.00 25.28 O HETATM 2911 O HOH 2 -22.569 6.031 9.144 1.00 42.50 O HETATM 2912 O HOH 3 -10.673 18.750 39.334 1.00 27.61 O HETATM 2913 O HOH 4 -14.656 3.106 6.204 1.00 25.28 O HETATM 2914 O HOH 5 -17.925 -2.835 22.158 1.00 28.32 O HETATM 2915 O HOH 6 -24.340 5.814 11.748 1.00 33.40 O HETATM 2916 O HOH 7 -1.220 18.431 27.007 1.00 34.85 O HETATM 2917 O HOH 8 -9.917 22.501 15.807 1.00 41.72 O HETATM 2918 O HOH 9 -18.684 8.399 45.531 1.00 36.80 O HETATM 2919 O HOH 10 -28.984 10.162 36.452 1.00 33.65 O HETATM 2920 O HOH 11 -9.194 15.664 16.757 1.00 11.13 O HETATM 2921 O HOH 12 -13.472 9.600 43.964 1.00 17.28 O HETATM 2922 O HOH 13 -5.748 20.857 23.289 1.00 11.70 O HETATM 2923 O HOH 14 -5.638 27.089 22.816 1.00 42.72 O HETATM 2924 O HOH 15 -12.382 9.180 7.166 1.00 27.48 O HETATM 2925 O HOH 16 -4.358 13.240 33.939 1.00 34.96 O HETATM 2926 O HOH 17 -9.859 9.406 41.026 1.00 23.34 O HETATM 2927 O HOH 18 -24.043 28.392 21.836 1.00 39.48 O HETATM 2928 O HOH 19 -12.652 20.844 13.791 1.00 24.78 O HETATM 2929 O HOH 20 -35.322 9.288 29.257 1.00 27.26 O HETATM 2930 O HOH 21 -6.329 6.401 8.354 1.00 7.05 O HETATM 2931 O HOH 22 -11.380 -0.601 37.455 1.00 26.70 O HETATM 2932 O HOH 23 -27.967 -1.388 24.843 1.00 26.93 O HETATM 2933 O HOH 24 -12.290 18.005 42.802 1.00 33.21 O HETATM 2934 O HOH 25 -26.822 7.261 35.548 1.00 14.54 O HETATM 2935 O HOH 26 -26.497 22.208 10.504 1.00 45.11 O HETATM 2936 O HOH 27 -27.406 18.360 19.102 1.00 16.33 O HETATM 2937 O HOH 28 -8.418 -2.425 28.609 1.00 32.36 O HETATM 2938 O HOH 29 -25.112 23.568 28.518 1.00 29.62 O HETATM 2939 O HOH 30 -21.217 7.751 20.196 1.00 6.77 O HETATM 2940 O HOH 31 -23.907 24.869 15.051 1.00 39.17 O HETATM 2941 O HOH 32 -19.757 -4.167 25.282 1.00 21.76 O HETATM 2942 O HOH 33 -19.557 0.326 9.484 1.00 35.20 O HETATM 2943 O HOH 34 -12.336 21.056 41.645 1.00 26.73 O HETATM 2944 O HOH 35 -12.082 16.871 23.652 1.00 6.50 O HETATM 2945 O HOH 36 -12.468 0.007 18.434 1.00 20.58 O HETATM 2946 O HOH 37 -11.320 26.067 38.541 1.00 12.53 O HETATM 2947 O HOH 38 -28.090 22.320 21.029 1.00 32.75 O HETATM 2948 O HOH 39 -15.822 -2.514 19.106 1.00 43.20 O HETATM 2949 O HOH 40 -6.569 -2.654 30.200 1.00 24.90 O HETATM 2950 O HOH 41 -24.741 1.929 12.807 1.00 32.10 O HETATM 2951 O HOH 42 -0.513 8.728 31.704 1.00 32.27 O HETATM 2952 O HOH 43 -10.195 26.406 29.460 1.00 18.27 O HETATM 2953 O HOH 44 -14.145 27.779 18.690 1.00 33.07 O HETATM 2954 O HOH 45 -19.998 27.680 16.209 1.00 43.66 O HETATM 2955 O HOH 46 -12.657 0.136 22.217 1.00 12.39 O HETATM 2956 O HOH 47 -22.609 0.269 19.095 1.00 25.51 O HETATM 2957 O HOH 48 -15.800 15.846 10.314 1.00 38.88 O HETATM 2958 O HOH 49 -20.757 -2.013 39.523 1.00 28.30 O HETATM 2959 O HOH 50 -36.093 15.087 25.480 1.00 37.27 O HETATM 2960 O HOH 51 -19.125 18.632 43.249 1.00 37.89 O HETATM 2961 O HOH 52 -18.973 22.569 37.468 1.00 15.72 O HETATM 2962 O HOH 53 -1.700 -0.175 26.528 1.00 19.10 O HETATM 2963 O HOH 54 -10.147 11.498 39.507 1.00 23.60 O HETATM 2964 O HOH 55 -33.322 2.638 28.943 1.00 36.29 O HETATM 2965 O HOH 56 -7.916 18.305 30.126 1.00 9.87 O HETATM 2966 O HOH 57 -32.807 2.534 19.526 1.00 29.99 O HETATM 2967 O HOH 58 -17.328 22.848 13.221 1.00 38.21 O HETATM 2968 O HOH 59 -6.285 18.800 21.521 1.00 12.44 O HETATM 2969 O HOH 60 -29.619 0.179 27.589 1.00 22.81 O HETATM 2970 O HOH 61 -21.933 15.846 11.724 1.00 18.05 O HETATM 2971 O HOH 62 -18.872 -2.343 32.535 1.00 19.28 O HETATM 2972 O HOH 63 -7.993 18.340 16.849 1.00 20.24 O HETATM 2973 O HOH 64 -33.134 3.070 32.246 1.00 24.11 O HETATM 2974 O HOH 65 -2.072 10.351 33.280 1.00 24.89 O HETATM 2975 O HOH 66 -14.661 6.963 31.966 1.00 6.81 O HETATM 2976 O HOH 67 -32.413 14.596 15.663 1.00 32.22 O HETATM 2977 O HOH 68 -23.841 16.991 29.928 1.00 10.01 O HETATM 2978 O HOH 69 -5.848 10.688 23.998 1.00 7.98 O HETATM 2979 O HOH 70 -22.218 -5.018 29.409 1.00 33.29 O HETATM 2980 O HOH 71 -7.128 10.128 38.110 1.00 18.30 O HETATM 2981 O HOH 72 -10.643 25.066 17.393 1.00 32.38 O HETATM 2982 O HOH 73 -1.386 4.195 38.172 1.00 47.04 O HETATM 2983 O HOH 74 -2.132 21.608 25.728 1.00 35.29 O HETATM 2984 O HOH 75 -19.969 1.125 31.769 1.00 8.46 O HETATM 2985 O HOH 76 -23.223 13.578 11.331 1.00 22.93 O HETATM 2986 O HOH 77 -30.496 15.850 29.497 1.00 30.48 O HETATM 2987 O HOH 78 -21.010 21.340 15.647 1.00 13.45 O HETATM 2988 O HOH 79 -4.454 25.620 26.833 1.00 19.83 O HETATM 2989 O HOH 80 -11.982 28.323 27.982 1.00 21.04 O HETATM 2990 O HOH 81 -33.316 1.908 25.797 1.00 41.88 O HETATM 2991 O HOH 82 -4.319 18.992 29.669 1.00 20.60 O HETATM 2992 O HOH 83 0.357 9.582 29.110 1.00 29.46 O HETATM 2993 O HOH 84 -2.544 -0.126 38.724 1.00 56.76 O HETATM 2994 O HOH 85 -31.677 10.566 33.356 1.00 29.84 O HETATM 2995 O HOH 86 -6.573 24.788 38.001 1.00 21.50 O HETATM 2996 O HOH 87 0.587 5.414 29.131 1.00 18.28 O HETATM 2997 O HOH 88 -11.138 7.344 42.521 1.00 41.11 O HETATM 2998 O HOH 89 -21.914 27.371 18.226 1.00 20.11 O HETATM 2999 O HOH 90 -19.584 23.723 34.937 1.00 16.51 O HETATM 3000 O HOH 91 -20.947 20.101 40.346 1.00 37.76 O HETATM 3001 O HOH 92 -22.154 -2.750 25.972 1.00 17.47 O HETATM 3002 O HOH 93 -13.926 23.166 16.218 1.00 22.94 O HETATM 3003 O HOH 94 -12.817 24.412 40.305 1.00 14.37 O HETATM 3004 O HOH 95 -15.199 17.744 43.416 1.00 25.40 O HETATM 3005 O HOH 96 -15.648 7.362 46.446 1.00 35.15 O HETATM 3006 O HOH 97 -26.153 17.512 35.812 1.00 35.91 O HETATM 3007 O HOH 98 -34.547 5.360 28.494 1.00 20.90 O HETATM 3008 O HOH 99 -19.504 19.058 16.279 1.00 9.05 O HETATM 3009 O HOH 100 -7.834 8.410 40.037 1.00 32.88 O HETATM 3010 O HOH 101 -13.565 1.392 8.970 1.00 22.34 O HETATM 3011 O HOH 102 -9.979 14.257 12.302 1.00 14.33 O HETATM 3012 O HOH 103 -21.661 21.640 35.121 1.00 15.30 O HETATM 3013 O HOH 104 -0.361 -1.578 34.454 1.00 45.41 O HETATM 3014 O HOH 105 -28.922 13.635 33.602 1.00 17.56 O HETATM 3015 O HOH 106 0.633 3.037 27.107 1.00 27.64 O HETATM 3016 O HOH 107 -4.573 10.610 37.145 1.00 22.67 O HETATM 3017 O HOH 108 -16.422 -1.455 11.508 1.00 46.12 O HETATM 3018 O HOH 109 -0.915 12.250 22.675 1.00 11.57 O HETATM 3019 O HOH 110 -15.128 -4.602 30.129 1.00 38.77 O HETATM 3020 O HOH 111 -26.331 25.724 23.281 1.00 41.12 O HETATM 3021 O HOH 112 -28.102 20.811 25.455 1.00 24.13 O HETATM 3022 O HOH 113 -30.409 1.578 18.728 1.00 30.19 O HETATM 3023 O HOH 114 -4.990 8.310 25.164 1.00 7.84 O HETATM 3024 O HOH 115 -13.327 12.487 8.054 1.00 37.24 O HETATM 3025 O HOH 116 -27.128 20.779 12.632 1.00 20.69 O HETATM 3026 O HOH 117 -29.443 7.972 34.780 1.00 34.45 O HETATM 3027 O HOH 118 -27.611 8.780 10.200 1.00 23.71 O HETATM 3028 O HOH 119 -32.993 11.534 31.206 1.00 27.58 O HETATM 3029 O HOH 120 -35.561 12.446 27.574 1.00 40.42 O HETATM 3030 O HOH 121 -14.657 -1.406 16.719 1.00 16.39 O HETATM 3031 O HOH 122 -27.750 -2.525 31.901 1.00 20.64 O HETATM 3032 O HOH 123 -3.458 -0.946 24.206 1.00 19.05 O HETATM 3033 O HOH 124 -9.476 27.202 19.805 1.00 33.21 O HETATM 3034 O HOH 125 -29.555 20.611 22.416 1.00 34.28 O HETATM 3035 O HOH 126 -16.650 27.412 18.493 1.00 25.80 O HETATM 3036 O HOH 127 -20.068 22.596 13.617 1.00 38.18 O HETATM 3037 O HOH 128 -30.761 3.084 16.436 1.00 15.00 O HETATM 3038 O HOH 129 -5.819 2.646 38.430 1.00 18.67 O HETATM 3039 O HOH 130 1.973 4.690 32.084 1.00 47.77 O HETATM 3040 O HOH 131 -18.516 8.479 8.855 1.00 35.18 O HETATM 3041 O HOH 132 -7.765 1.254 38.654 1.00 39.10 O HETATM 3042 O HOH 133 -6.273 5.034 21.444 1.00 8.11 O HETATM 3043 O HOH 134 1.182 13.396 19.361 1.00 27.72 O HETATM 3044 O HOH 135 -28.268 3.431 12.245 1.00 37.13 O HETATM 3045 O HOH 136 -12.774 5.328 42.940 1.00 19.88 O HETATM 3046 O HOH 137 1.013 14.134 27.043 1.00 42.61 O HETATM 3047 O HOH 138 -6.248 20.869 36.908 1.00 29.91 O HETATM 3048 O HOH 139 -2.300 18.187 22.376 1.00 41.41 O HETATM 3049 O HOH 140 -20.627 27.493 30.263 1.00 29.59 O HETATM 3050 O HOH 141 -18.669 29.996 24.975 1.00 43.52 O HETATM 3051 O HOH 142 -16.302 24.795 15.578 1.00 27.05 O HETATM 3052 O HOH 143 -20.295 30.047 22.044 1.00 30.82 O HETATM 3053 O HOH 144 -7.462 25.464 29.021 1.00 26.31 O HETATM 3054 O HOH 145 -19.813 23.020 10.481 1.00 35.17 O HETATM 3055 O HOH 146 -21.800 12.481 8.669 1.00 27.74 O HETATM 3056 O HOH 147 -18.912 13.918 44.806 1.00 37.65 O HETATM 3057 O HOH 148 -24.243 -0.528 17.324 1.00 37.45 O HETATM 3058 O HOH 149 -20.066 -0.594 14.615 1.00 43.36 O HETATM 3059 O HOH 150 -17.332 -7.526 37.194 1.00 80.39 O HETATM 3060 O HOH 151 -15.393 11.744 45.557 1.00 35.45 O HETATM 3061 O HOH 152 -28.576 18.217 9.374 1.00 38.43 O HETATM 3062 O HOH 153 -15.744 14.221 8.272 1.00 39.41 O HETATM 3063 O HOH 154 -6.303 13.045 40.097 1.00 51.52 O HETATM 3064 O HOH 155 1.165 12.794 24.162 1.00 37.07 O HETATM 3065 O HOH 156 -26.387 11.865 40.933 1.00 30.02 O HETATM 3066 O HOH 157 -9.868 13.925 41.126 1.00 40.64 O HETATM 3067 O HOH 158 -17.496 -6.031 39.715 1.00 38.59 O HETATM 3068 O HOH 159 -4.631 23.200 22.330 1.00 27.08 O HETATM 3069 O HOH 160 -29.537 24.007 19.942 1.00 42.79 O HETATM 3070 O HOH 161 -31.232 15.248 32.232 1.00 40.31 O HETATM 3071 O HOH 162 -8.895 -4.125 31.870 1.00 49.49 O HETATM 3072 O HOH 163 -25.283 13.744 9.515 1.00 36.46 O HETATM 3073 O HOH 164 -10.178 12.771 43.873 1.00 54.63 O HETATM 3074 O HOH 165 -6.130 19.583 39.108 1.00 45.00 O HETATM 3075 O HOH 166 -2.914 24.090 24.607 1.00 36.64 O HETATM 3076 O HOH 167 -4.133 13.455 36.779 1.00 33.31 O HETATM 3077 O HOH 168 2.258 8.795 24.998 1.00 47.66 O HETATM 3078 O HOH 169 -20.844 -3.805 33.470 1.00 28.72 O HETATM 3079 O HOH 170 -20.434 27.572 32.740 1.00 31.79 O HETATM 3080 O HOH 171 -20.601 7.117 8.140 1.00 47.91 O HETATM 3081 O HOH 172 -13.962 21.716 11.945 1.00 30.01 O HETATM 3082 O HOH 173 -11.499 14.863 10.172 1.00 35.51 O HETATM 3083 O HOH 174 -19.611 5.390 46.088 1.00 28.69 O HETATM 3084 O HOH 175 -29.335 7.883 38.389 1.00 43.02 O HETATM 3085 O HOH 176 -5.304 24.166 40.505 1.00 30.31 O HETATM 3086 O HOH 177 -21.064 29.815 24.442 1.00 48.61 O HETATM 3087 O HOH 178 -29.724 17.820 28.369 1.00 42.48 O HETATM 3088 O HOH 179 -28.319 -0.123 16.489 1.00 40.71 O HETATM 3089 O HOH 180 -2.962 19.654 31.510 1.00 49.09 O HETATM 3090 O HOH 181 -14.673 19.564 10.610 1.00 36.21 O HETATM 3091 O HOH 182 -12.066 -4.465 31.650 1.00 45.02 O HETATM 3092 O HOH 183 -23.458 3.490 9.550 1.00 38.97 O HETATM 3093 O HOH 184 -30.201 12.054 35.237 1.00 23.73 O HETATM 3094 O HOH 185 -29.393 10.384 45.517 1.00 40.54 O HETATM 3095 O HOH 186 -11.631 -0.398 40.136 1.00 38.33 O HETATM 3096 O HOH 187 -36.228 9.469 31.627 1.00 42.85 O HETATM 3097 O HOH 188 -10.772 14.310 14.845 1.00 11.09 O HETATM 3098 O HOH 189 -1.692 12.788 31.671 1.00 47.98 O HETATM 3099 O HOH 190 -33.701 7.704 35.430 1.00 45.09 O HETATM 3100 O HOH 191 -12.903 22.521 43.654 1.00 38.50 O HETATM 3101 O HOH 192 -25.147 -0.287 14.872 1.00 44.81 O HETATM 3102 O HOH 193 -16.733 15.104 4.946 1.00 40.85 O HETATM 3103 O HOH 194 -17.092 -4.441 31.948 1.00 26.94 O HETATM 3104 O HOH 195 -19.189 21.991 43.523 1.00 40.78 O HETATM 3105 O HOH 196 -33.574 14.270 32.986 1.00 56.80 O HETATM 3106 O HOH 197 -4.757 25.387 36.211 1.00 25.60 O HETATM 3107 O HOH 198 -6.827 27.636 32.531 1.00 28.11 O HETATM 3108 O HOH 199 -15.056 22.355 44.479 1.00 42.16 O HETATM 3109 O HOH 200 -21.618 26.372 11.735 1.00 40.04 O HETATM 3110 O HOH 201 -18.247 4.233 48.018 1.00 38.84 O HETATM 3111 O HOH 202 -4.775 28.421 30.576 1.00 43.66 O HETATM 3112 O HOH 203 -33.126 9.099 37.766 1.00 43.78 O HETATM 3113 O HOH 204 -31.146 10.302 43.203 1.00 34.33 O HETATM 3114 O HOH 205 -25.598 -8.215 27.196 1.00 46.56 O HETATM 3115 O HOH 206 -22.794 33.358 22.301 1.00 50.66 O HETATM 3116 O HOH 207 -27.344 -4.567 16.438 1.00 46.60 O HETATM 3117 O HOH 208 -17.195 1.781 49.013 1.00 29.92 O HETATM 3118 O HOH 209 0.004 29.762 30.030 1.00 45.13 O HETATM 3119 O HOH 210 0.595 -1.031 25.847 1.00 24.76 O HETATM 3120 O HOH 211 9.960 -3.390 20.350 1.00 24.01 O HETATM 3121 O HOH 212 0.169 -7.915 9.819 1.00 34.95 O HETATM 3122 O HOH 213 -6.838 10.068 -6.669 1.00 40.51 O HETATM 3123 O HOH 214 -1.041 -6.551 12.921 1.00 42.82 O HETATM 3124 O HOH 215 6.561 1.148 -13.532 1.00 31.96 O HETATM 3125 O HOH 216 12.841 20.348 13.273 1.00 33.18 O HETATM 3126 O HOH 217 -7.427 -2.669 3.473 1.00 28.31 O HETATM 3127 O HOH 218 19.510 22.463 7.441 1.00 44.86 O HETATM 3128 O HOH 219 2.425 12.503 15.143 1.00 9.37 O HETATM 3129 O HOH 220 -4.359 10.460 -5.174 1.00 30.02 O HETATM 3130 O HOH 221 5.865 -7.704 12.769 1.00 25.40 O HETATM 3131 O HOH 222 21.521 -6.548 3.014 1.00 29.86 O HETATM 3132 O HOH 223 9.299 -7.095 19.247 1.00 21.95 O HETATM 3133 O HOH 224 20.204 1.932 -8.594 1.00 50.95 O HETATM 3134 O HOH 225 -8.744 11.047 0.195 1.00 29.10 O HETATM 3135 O HOH 226 3.253 -5.980 22.379 1.00 32.37 O HETATM 3136 O HOH 227 22.803 -5.522 13.446 1.00 27.87 O HETATM 3137 O HOH 228 9.606 18.356 -7.763 1.00 29.07 O HETATM 3138 O HOH 229 24.032 0.926 14.133 1.00 31.96 O HETATM 3139 O HOH 230 18.270 16.511 1.832 1.00 28.37 O HETATM 3140 O HOH 231 -4.815 5.957 23.692 1.00 8.00 O HETATM 3141 O HOH 232 6.475 -3.511 -10.926 1.00 27.47 O HETATM 3142 O HOH 233 1.869 5.167 24.770 1.00 33.44 O HETATM 3143 O HOH 234 6.705 18.134 16.029 1.00 39.22 O HETATM 3144 O HOH 235 14.924 3.837 -12.355 1.00 45.26 O HETATM 3145 O HOH 236 22.033 8.510 11.022 1.00 26.87 O HETATM 3146 O HOH 237 -3.189 18.794 4.856 1.00 33.19 O HETATM 3147 O HOH 238 16.643 4.409 -10.182 1.00 50.81 O HETATM 3148 O HOH 239 2.258 18.761 8.693 1.00 12.27 O HETATM 3149 O HOH 240 1.647 2.974 -12.667 1.00 23.93 O HETATM 3150 O HOH 241 8.281 15.211 18.389 1.00 22.04 O HETATM 3151 O HOH 242 23.090 -4.102 4.548 1.00 37.23 O HETATM 3152 O HOH 243 -2.564 -2.609 9.846 1.00 11.82 O HETATM 3153 O HOH 244 13.376 6.251 20.389 1.00 13.46 O HETATM 3154 O HOH 245 23.132 5.471 0.994 1.00 58.83 O HETATM 3155 O HOH 246 1.608 -6.780 -7.430 1.00 40.09 O HETATM 3156 O HOH 247 -2.081 -4.330 -6.363 1.00 13.41 O HETATM 3157 O HOH 248 -3.166 12.902 -1.592 1.00 40.32 O HETATM 3158 O HOH 249 19.571 -9.813 11.714 1.00 25.01 O HETATM 3159 O HOH 250 5.403 -12.397 -0.917 1.00 36.79 O HETATM 3160 O HOH 251 8.577 -0.642 -13.330 1.00 37.62 O HETATM 3161 O HOH 252 8.867 7.751 22.387 1.00 33.91 O HETATM 3162 O HOH 253 3.956 -9.947 5.847 1.00 20.54 O HETATM 3163 O HOH 254 15.073 22.598 8.500 1.00 39.28 O HETATM 3164 O HOH 255 2.480 18.360 -5.084 1.00 38.60 O HETATM 3165 O HOH 256 11.976 -11.172 4.388 1.00 12.84 O HETATM 3166 O HOH 257 16.575 -2.607 -4.786 1.00 21.45 O HETATM 3167 O HOH 258 2.628 2.185 0.042 1.00 7.62 O HETATM 3168 O HOH 259 13.921 -4.363 -9.177 1.00 49.15 O HETATM 3169 O HOH 260 -12.382 6.642 4.916 1.00 30.41 O HETATM 3170 O HOH 261 21.791 -6.852 8.053 1.00 24.70 O HETATM 3171 O HOH 262 -2.238 8.763 -6.192 1.00 22.98 O HETATM 3172 O HOH 263 18.974 -3.539 -1.471 1.00 25.74 O HETATM 3173 O HOH 264 2.768 15.387 1.863 1.00 11.01 O HETATM 3174 O HOH 265 3.239 -11.919 2.522 1.00 33.71 O HETATM 3175 O HOH 266 15.793 6.009 2.107 1.00 10.02 O HETATM 3176 O HOH 267 5.569 11.980 8.308 1.00 8.01 O HETATM 3177 O HOH 268 -9.672 1.671 -7.458 1.00 14.18 O HETATM 3178 O HOH 269 13.105 -3.937 -3.643 1.00 14.33 O HETATM 3179 O HOH 270 5.564 4.040 -13.697 1.00 35.98 O HETATM 3180 O HOH 271 -11.741 0.209 -0.624 1.00 29.11 O HETATM 3181 O HOH 272 1.552 16.691 10.433 1.00 13.46 O HETATM 3182 O HOH 273 20.248 10.847 3.432 1.00 28.15 O HETATM 3183 O HOH 274 21.235 -0.360 16.135 1.00 22.41 O HETATM 3184 O HOH 275 4.150 -5.486 0.159 1.00 9.62 O HETATM 3185 O HOH 276 11.795 15.807 -2.028 1.00 18.17 O HETATM 3186 O HOH 277 1.417 -8.043 -0.682 1.00 18.06 O HETATM 3187 O HOH 278 -2.970 -2.714 13.538 1.00 23.22 O HETATM 3188 O HOH 279 -0.679 21.114 6.258 1.00 37.24 O HETATM 3189 O HOH 280 -12.160 2.842 5.551 1.00 17.72 O HETATM 3190 O HOH 281 8.741 21.825 2.064 1.00 32.52 O HETATM 3191 O HOH 282 -4.453 -4.591 19.039 1.00 51.88 O HETATM 3192 O HOH 283 9.825 4.651 -12.632 1.00 24.91 O HETATM 3193 O HOH 284 8.692 -0.450 11.685 1.00 7.14 O HETATM 3194 O HOH 285 -2.665 16.962 -1.836 1.00 33.73 O HETATM 3195 O HOH 286 15.694 13.752 -3.029 1.00 19.97 O HETATM 3196 O HOH 287 22.379 6.270 9.319 1.00 21.10 O HETATM 3197 O HOH 288 16.058 -10.942 12.837 1.00 12.88 O HETATM 3198 O HOH 289 9.527 -13.381 -2.599 1.00 35.90 O HETATM 3199 O HOH 290 16.399 -10.522 -0.278 1.00 21.63 O HETATM 3200 O HOH 291 2.876 15.402 15.184 1.00 17.98 O HETATM 3201 O HOH 292 14.678 0.632 -8.776 1.00 35.10 O HETATM 3202 O HOH 293 14.152 14.024 -5.320 1.00 22.34 O HETATM 3203 O HOH 294 2.962 13.034 -8.142 1.00 24.76 O HETATM 3204 O HOH 295 -2.986 9.960 7.987 1.00 7.24 O HETATM 3205 O HOH 296 20.821 1.528 2.413 1.00 30.22 O HETATM 3206 O HOH 297 8.524 19.681 14.550 1.00 31.18 O HETATM 3207 O HOH 298 12.251 9.917 -11.344 1.00 27.88 O HETATM 3208 O HOH 299 -10.974 6.607 -6.151 1.00 44.04 O HETATM 3209 O HOH 300 22.193 12.153 8.801 1.00 31.69 O HETATM 3210 O HOH 301 9.996 -5.023 -9.128 1.00 28.62 O HETATM 3211 O HOH 302 20.091 -4.627 16.743 1.00 19.97 O HETATM 3212 O HOH 303 17.017 -6.565 -2.756 1.00 21.47 O HETATM 3213 O HOH 304 16.554 -1.818 21.714 1.00 19.88 O HETATM 3214 O HOH 305 -6.960 -5.260 4.734 1.00 23.94 O HETATM 3215 O HOH 306 15.443 -11.503 5.729 1.00 19.06 O HETATM 3216 O HOH 307 19.413 15.817 13.690 1.00 17.70 O HETATM 3217 O HOH 308 6.149 19.730 -9.538 1.00 26.22 O HETATM 3218 O HOH 309 -0.051 17.768 2.439 1.00 22.36 O HETATM 3219 O HOH 310 14.751 10.098 -8.122 1.00 30.36 O HETATM 3220 O HOH 311 3.476 23.490 5.081 1.00 22.84 O HETATM 3221 O HOH 312 16.895 6.643 -5.648 1.00 34.91 O HETATM 3222 O HOH 313 16.463 -10.812 2.451 1.00 23.70 O HETATM 3223 O HOH 314 19.141 19.301 10.303 1.00 42.38 O HETATM 3224 O HOH 315 2.271 10.860 19.650 1.00 14.51 O HETATM 3225 O HOH 316 15.380 11.246 16.241 1.00 11.40 O HETATM 3226 O HOH 317 -2.042 19.117 16.003 1.00 40.93 O HETATM 3227 O HOH 318 14.039 -3.396 21.725 1.00 18.53 O HETATM 3228 O HOH 319 7.549 4.146 25.567 1.00 39.86 O HETATM 3229 O HOH 320 5.312 24.280 8.755 1.00 45.75 O HETATM 3230 O HOH 321 -1.188 -1.990 22.971 1.00 19.93 O HETATM 3231 O HOH 322 16.284 11.013 -3.206 1.00 18.93 O HETATM 3232 O HOH 323 12.693 -3.552 24.493 1.00 49.46 O HETATM 3233 O HOH 324 8.438 15.348 -9.639 1.00 24.25 O HETATM 3234 O HOH 325 13.500 3.560 20.756 1.00 18.43 O HETATM 3235 O HOH 326 14.894 18.699 13.336 1.00 31.87 O HETATM 3236 O HOH 327 8.575 11.242 -11.396 1.00 22.22 O HETATM 3237 O HOH 328 -6.382 13.846 9.344 1.00 11.41 O HETATM 3238 O HOH 329 20.789 -3.293 0.811 1.00 33.15 O HETATM 3239 O HOH 330 23.425 0.400 9.293 1.00 34.05 O HETATM 3240 O HOH 331 -11.187 8.846 2.938 1.00 21.76 O HETATM 3241 O HOH 332 1.268 -10.140 6.453 1.00 26.08 O HETATM 3242 O HOH 333 18.863 -9.530 3.144 1.00 19.65 O HETATM 3243 O HOH 334 3.957 4.092 25.221 1.00 38.15 O HETATM 3244 O HOH 335 18.045 5.230 -3.854 1.00 33.29 O HETATM 3245 O HOH 336 -11.073 1.340 7.706 1.00 16.59 O HETATM 3246 O HOH 337 8.738 22.261 11.899 1.00 37.69 O HETATM 3247 O HOH 338 14.550 6.531 -11.117 1.00 46.21 O HETATM 3248 O HOH 339 21.376 7.322 6.752 1.00 19.50 O HETATM 3249 O HOH 340 -4.998 8.360 6.863 1.00 7.55 O HETATM 3250 O HOH 341 -1.672 -5.046 15.294 1.00 14.49 O HETATM 3251 O HOH 342 16.930 21.131 7.405 1.00 35.69 O HETATM 3252 O HOH 343 12.907 10.072 15.629 1.00 9.11 O HETATM 3253 O HOH 344 10.063 -9.597 -6.631 1.00 22.61 O HETATM 3254 O HOH 345 8.929 -12.615 -0.039 1.00 26.17 O HETATM 3255 O HOH 346 10.516 16.495 15.674 1.00 24.25 O HETATM 3256 O HOH 347 -7.808 3.620 -6.555 1.00 23.87 O HETATM 3257 O HOH 348 2.136 1.181 28.049 1.00 59.86 O HETATM 3258 O HOH 349 -5.588 4.860 10.593 1.00 7.59 O HETATM 3259 O HOH 350 -8.900 12.314 2.774 1.00 32.34 O HETATM 3260 O HOH 351 18.339 0.636 -1.653 1.00 17.10 O HETATM 3261 O HOH 352 4.198 7.670 23.893 1.00 37.14 O HETATM 3262 O HOH 353 -6.613 11.545 -1.272 1.00 25.79 O HETATM 3263 O HOH 354 8.187 10.177 20.996 1.00 37.57 O HETATM 3264 O HOH 355 13.213 16.850 16.274 1.00 27.69 O HETATM 3265 O HOH 356 -7.689 15.858 12.469 1.00 26.46 O HETATM 3266 O HOH 357 -0.915 4.356 -9.862 1.00 33.07 O HETATM 3267 O HOH 358 -5.256 17.895 13.288 1.00 56.51 O HETATM 3268 O HOH 359 25.358 -2.804 6.877 1.00 39.51 O HETATM 3269 O HOH 360 21.492 -8.881 5.827 1.00 47.36 O HETATM 3270 O HOH 361 15.413 12.636 18.438 1.00 27.39 O HETATM 3271 O HOH 362 4.512 -4.023 -11.118 1.00 16.05 O HETATM 3272 O HOH 363 -14.090 2.093 -2.394 1.00 39.50 O HETATM 3273 O HOH 364 18.200 -5.371 19.412 1.00 29.91 O HETATM 3274 O HOH 365 6.881 1.618 23.340 1.00 35.41 O HETATM 3275 O HOH 366 11.666 3.442 23.236 1.00 25.61 O HETATM 3276 O HOH 367 -6.370 -4.492 -3.754 1.00 24.13 O HETATM 3277 O HOH 368 9.918 7.167 -13.290 1.00 39.72 O HETATM 3278 O HOH 369 5.818 21.903 2.751 1.00 27.25 O HETATM 3279 O HOH 370 6.274 -12.753 3.931 1.00 43.39 O HETATM 3280 O HOH 371 8.240 -0.497 23.637 1.00 54.98 O HETATM 3281 O HOH 372 14.100 -14.069 -2.573 1.00 44.47 O HETATM 3282 O HOH 373 9.043 23.590 8.692 1.00 43.03 O HETATM 3283 O HOH 374 -4.317 17.232 8.572 1.00 41.00 O HETATM 3284 O HOH 375 8.011 3.355 -13.927 1.00 36.96 O HETATM 3285 O HOH 376 11.917 17.973 -6.562 1.00 31.40 O HETATM 3286 O HOH 377 -6.713 14.209 2.261 1.00 42.73 O HETATM 3287 O HOH 378 -7.165 16.015 7.711 1.00 44.17 O HETATM 3288 O HOH 379 20.987 0.581 -0.307 1.00 43.50 O HETATM 3289 O HOH 380 13.295 14.483 21.329 1.00 44.53 O HETATM 3290 O HOH 381 23.022 0.492 2.555 1.00 44.98 O HETATM 3291 O HOH 382 9.920 -7.642 -8.650 1.00 37.57 O HETATM 3292 O HOH 383 5.180 -6.558 -12.432 1.00 16.73 O HETATM 3293 O HOH 384 5.341 23.380 12.763 1.00 52.43 O HETATM 3294 O HOH 385 -3.116 -8.274 1.043 1.00 34.05 O HETATM 3295 O HOH 386 18.215 16.828 -0.751 1.00 33.01 O HETATM 3296 O HOH 387 2.276 21.402 9.428 1.00 26.34 O HETATM 3297 O HOH 388 0.710 18.773 12.503 1.00 36.07 O HETATM 3298 O HOH 389 13.428 7.743 22.643 1.00 35.50 O HETATM 3299 O HOH 390 15.423 -5.244 -4.410 1.00 20.34 O HETATM 3300 O HOH 391 11.706 12.437 22.899 1.00 43.74 O HETATM 3301 O HOH 392 4.037 10.477 21.875 1.00 46.26 O HETATM 3302 O HOH 393 -4.812 -6.409 0.491 1.00 36.04 O HETATM 3303 O HOH 394 -11.534 11.753 6.670 1.00 35.63 O HETATM 3304 O HOH 395 6.350 21.382 -5.948 1.00 46.64 O HETATM 3305 O HOH 396 1.340 23.003 7.503 1.00 42.18 O HETATM 3306 O HOH 397 20.993 3.751 3.381 1.00 33.95 O HETATM 3307 O HOH 398 -11.499 3.795 -7.466 1.00 53.00 O HETATM 3308 O HOH 399 12.679 16.295 -4.642 1.00 25.61 O HETATM 3309 O HOH 400 19.676 2.717 -3.174 1.00 40.60 O HETATM 3310 O HOH 401 18.653 -1.534 -3.283 1.00 22.15 O HETATM 3311 O HOH 402 15.316 -6.299 -6.835 1.00 33.11 O HETATM 3312 O HOH 403 -13.712 -2.024 -4.586 1.00 38.53 O HETATM 3313 O HOH 404 21.393 17.463 12.030 1.00 36.10 O HETATM 3314 O HOH 405 -0.511 19.402 0.575 1.00 49.41 O HETATM 3315 O HOH 406 -5.501 13.971 -0.184 1.00 44.81 O HETATM 3316 O HOH 407 25.922 0.077 9.991 1.00 51.60 O HETATM 3317 O HOH 408 -10.004 -1.696 5.635 1.00 42.74 O HETATM 3318 O HOH 409 3.092 10.542 17.081 1.00 11.63 O HETATM 3319 O HOH 410 7.917 -6.775 21.896 1.00 40.55 O HETATM 3320 O HOH 411 17.309 -2.343 -7.420 1.00 38.39 O HETATM 3321 O HOH 412 16.541 7.314 25.577 1.00 41.29 O HETATM 3322 O HOH 413 15.385 2.425 22.332 1.00 23.76 O HETATM 3323 O HOH 414 19.568 -5.757 -3.189 1.00 36.33 O HETATM 3324 O HOH 415 -5.206 -8.343 -1.794 1.00 22.17 O HETATM 3325 O HOH 416 15.261 14.727 -7.661 1.00 41.05 O HETATM 3326 O HOH 417 25.002 5.974 8.946 1.00 43.29 O HETATM 3327 O HOH 418 26.275 4.775 10.429 1.00 36.47 O HETATM 3328 O HOH 419 16.162 4.401 24.013 1.00 33.25 O HETATM 3329 O HOH 420 20.757 -1.222 -5.002 1.00 34.74 O HETATM 3330 O HOH 421 -3.845 2.917 -12.117 1.00 35.47 O HETATM 3331 O HOH 422 -1.971 3.963 -14.239 1.00 36.73 O HETATM 3332 O HOH 423 24.300 18.583 12.114 1.00 21.56 O HETATM 3333 C1 GLA A 424 -22.995 8.706 41.784 1.00 0.19 C HETATM 3334 C2 GLA A 424 -22.028 7.474 41.916 1.00 0.13 C HETATM 3335 C3 GLA A 424 -20.541 7.900 41.590 1.00 0.11 C HETATM 3336 C4 GLA A 424 -20.492 8.509 40.203 1.00 0.11 C HETATM 3337 C5 GLA A 424 -21.517 9.626 40.155 1.00 0.11 C HETATM 3338 C6 GLA A 424 -21.520 10.208 38.751 1.00 0.07 C HETATM 3339 O6 GLA A 424 -22.418 11.319 38.773 1.00 -0.39 O HETATM 3340 H11 GLA A 424 -22.113 11.959 39.405 1.00 0.21 H HETATM 3341 H6 GLA A 424 -21.866 9.454 38.028 1.00 0.06 H HETATM 3342 H7 GLA A 424 -20.509 10.543 38.476 1.00 0.06 H HETATM 3343 O5 GLA A 424 -22.863 9.094 40.430 1.00 -0.34 O HETATM 3344 H5 GLA A 424 -21.262 10.402 40.891 1.00 0.06 H HETATM 3345 O4 GLA A 424 -20.803 7.480 39.191 1.00 -0.39 O HETATM 3346 H10 GLA A 424 -20.153 6.789 39.234 1.00 0.21 H HETATM 3347 H4 GLA A 424 -19.489 8.917 40.010 1.00 0.06 H HETATM 3348 O3 GLA A 424 -19.694 6.767 41.676 1.00 -0.39 O HETATM 3349 H9 GLA A 424 -19.975 6.114 41.045 1.00 0.21 H HETATM 3350 H3 GLA A 424 -20.209 8.650 42.323 1.00 0.06 H HETATM 3351 O2 GLA A 424 -22.088 6.854 43.191 1.00 -0.38 O HETATM 3352 H8 GLA A 424 -21.534 6.082 43.193 1.00 0.21 H HETATM 3353 H2 GLA A 424 -22.340 6.728 41.170 1.00 0.07 H HETATM 3354 O4 GLA A 424 -22.777 9.531 42.903 1.00 -0.34 O HETATM 3355 C4 GLA A 424 -23.900 10.436 43.148 1.00 0.12 C HETATM 3356 C3 GLA A 424 -23.422 11.876 42.969 1.00 0.11 C HETATM 3357 C2 GLA A 424 -22.278 12.166 43.951 1.00 0.13 C HETATM 3358 C1 GLA A 424 -22.764 11.901 45.347 1.00 0.19 C HETATM 3359 O5 GLA A 424 -23.200 10.531 45.410 1.00 -0.34 O HETATM 3360 C5 GLA A 424 -24.361 10.298 44.589 1.00 0.11 C HETATM 3361 C6 GLA A 424 -24.944 8.932 44.897 1.00 0.07 C HETATM 3362 O6 GLA A 424 -25.267 8.878 46.331 1.00 -0.39 O HETATM 3363 H21 GLA A 424 -24.476 9.016 46.838 1.00 0.21 H HETATM 3364 H17 GLA A 424 -24.209 8.151 44.652 1.00 0.06 H HETATM 3365 H18 GLA A 424 -25.857 8.776 44.304 1.00 0.06 H HETATM 3366 H16 GLA A 424 -25.126 11.060 44.799 1.00 0.06 H HETATM 3367 O4 GLA A 424 -21.618 12.178 46.222 1.00 -0.34 O HETATM 3368 C4 GLA A 424 -21.642 12.580 47.641 1.00 0.12 C HETATM 3369 C3 GLA A 424 -22.770 13.513 48.029 1.00 0.11 C HETATM 3370 C2 GLA A 424 -22.560 14.004 49.453 1.00 0.13 C HETATM 3371 C1 GLA A 424 -21.667 13.089 50.347 1.00 0.19 C HETATM 3372 O5 GLA A 424 -21.609 11.692 49.946 1.00 -0.34 O HETATM 3373 C5 GLA A 424 -21.674 11.354 48.463 1.00 0.11 C HETATM 3374 C6 GLA A 424 -20.481 10.523 48.105 1.00 0.07 C HETATM 3375 O6 GLA A 424 -20.989 9.199 48.040 1.00 -0.39 O HETATM 3376 H31 GLA A 424 -20.285 8.602 47.815 1.00 0.21 H HETATM 3377 H26 GLA A 424 -19.702 10.605 48.877 1.00 0.06 H HETATM 3378 H27 GLA A 424 -20.068 10.831 47.133 1.00 0.06 H HETATM 3379 H25 GLA A 424 -22.598 10.795 48.255 1.00 0.06 H HETATM 3380 O GLA A 424 -20.332 13.626 50.378 1.00 -0.35 O HETATM 3381 C1 GLA A 424 -20.140 14.631 51.399 1.00 0.05 C HETATM 3382 C2 GLA A 424 -19.555 13.983 52.660 1.00 -0.03 C HETATM 3383 C3 GLA A 424 -18.391 14.834 53.189 1.00 -0.06 C HETATM 3384 H36 GLA A 424 -17.975 14.365 54.093 1.00 0.02 H HETATM 3385 H37 GLA A 424 -18.756 15.842 53.434 1.00 0.02 H HETATM 3386 H38 GLA A 424 -17.608 14.904 52.419 1.00 0.02 H HETATM 3387 H34 GLA A 424 -19.189 12.975 52.416 1.00 0.03 H HETATM 3388 H35 GLA A 424 -20.336 13.913 53.431 1.00 0.03 H HETATM 3389 H32 GLA A 424 -21.107 15.095 51.642 1.00 0.06 H HETATM 3390 H33 GLA A 424 -19.447 15.401 51.029 1.00 0.06 H HETATM 3391 H28 GLA A 424 -22.081 13.120 51.365 1.00 0.09 H HETATM 3392 O2 GLA A 424 -23.855 14.173 50.099 1.00 -0.38 O HETATM 3393 H29 GLA A 424 -24.406 14.729 49.561 1.00 0.21 H HETATM 3394 H22 GLA A 424 -22.068 14.986 49.392 1.00 0.07 H HETATM 3395 O3 GLA A 424 -22.796 14.661 47.155 1.00 -0.39 O HETATM 3396 H30 GLA A 424 -22.926 14.373 46.259 1.00 0.21 H HETATM 3397 H23 GLA A 424 -23.727 12.975 47.959 1.00 0.06 H HETATM 3398 H24 GLA A 424 -20.701 13.111 47.849 1.00 0.07 H HETATM 3399 H12 GLA A 424 -23.602 12.565 45.605 1.00 0.09 H HETATM 3400 O2 GLA A 424 -21.915 13.539 43.884 1.00 -0.38 O HETATM 3401 H19 GLA A 424 -21.207 13.708 44.495 1.00 0.21 H HETATM 3402 H13 GLA A 424 -21.411 11.531 43.717 1.00 0.07 H HETATM 3403 O3 GLA A 424 -22.952 12.101 41.665 1.00 -0.39 O HETATM 3404 H20 GLA A 424 -22.663 13.002 41.585 1.00 0.21 H HETATM 3405 H14 GLA A 424 -24.261 12.557 43.172 1.00 0.06 H HETATM 3406 H15 GLA A 424 -24.725 10.212 42.456 1.00 0.07 H HETATM 3407 H1 GLA A 424 -24.035 8.363 41.888 1.00 0.09 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 1460 1461 1468 1469 1470 CONECT 1468 1460 CONECT 1469 1460 CONECT 1470 1460 CONECT 3333 3334 3343 3354 3407 CONECT 3334 3333 3335 3351 3353 CONECT 3335 3334 3336 3348 3350 CONECT 3336 3335 3337 3345 3347 CONECT 3337 3336 3338 3343 3344 CONECT 3338 3337 3339 3341 3342 CONECT 3339 3338 3340 CONECT 3340 3339 CONECT 3341 3338 CONECT 3342 3338 CONECT 3343 3333 3337 CONECT 3344 3337 CONECT 3345 3336 3346 CONECT 3346 3345 CONECT 3347 3336 CONECT 3348 3335 3349 CONECT 3349 3348 CONECT 3350 3335 CONECT 3351 3334 3352 CONECT 3352 3351 CONECT 3353 3334 CONECT 3354 3333 3355 CONECT 3355 3354 3356 3360 3406 CONECT 3356 3355 3357 3403 3405 CONECT 3357 3356 3358 3400 3402 CONECT 3358 3357 3359 3367 3399 CONECT 3359 3358 3360 CONECT 3360 3355 3359 3361 3366 CONECT 3361 3360 3362 3364 3365 CONECT 3362 3361 3363 CONECT 3363 3362 CONECT 3364 3361 CONECT 3365 3361 CONECT 3366 3360 CONECT 3367 3358 3368 CONECT 3368 3367 3369 3373 3398 CONECT 3369 3368 3370 3395 3397 CONECT 3370 3369 3371 3392 3394 CONECT 3371 3370 3372 3380 3391 CONECT 3372 3371 3373 CONECT 3373 3368 3372 3374 3379 CONECT 3374 3373 3375 3377 3378 CONECT 3375 3374 3376 CONECT 3376 3375 CONECT 3377 3374 CONECT 3378 3374 CONECT 3379 3373 CONECT 3380 3371 3381 CONECT 3381 3380 3382 3389 3390 CONECT 3382 3381 3383 3387 3388 CONECT 3383 3382 3384 3385 3386 CONECT 3384 3383 CONECT 3385 3383 CONECT 3386 3383 CONECT 3387 3382 CONECT 3388 3382 CONECT 3389 3381 CONECT 3390 3381 CONECT 3391 3371 CONECT 3392 3370 3393 CONECT 3393 3392 CONECT 3394 3370 CONECT 3395 3369 3396 CONECT 3396 3395 CONECT 3397 3369 CONECT 3398 3368 CONECT 3399 3358 CONECT 3400 3357 3401 CONECT 3401 3400 CONECT 3402 3357 CONECT 3403 3356 3404 CONECT 3404 3403 CONECT 3405 3356 CONECT 3406 3355 CONECT 3407 3333 MASTER 0 0 0 0 0 0 0 0 3405 2 83 24 END
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156aa, >5F8Y_1|Chains... *
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RCSB PDB
PDBbind
4-mer
3nik
RCSB PDB
PDBbind
4-mer
3nil
RCSB PDB
PDBbind
4-mer
3nim
RCSB PDB
PDBbind
4-mer
3ny3
RCSB PDB
PDBbind
4-mer
3qmk
RCSB PDB
PDBbind
4-mer
3t1n
RCSB PDB
PDBbind
4-mer
3t4p
RCSB PDB
PDBbind
4-mer
3u3z
RCSB PDB
PDBbind
4-mer
3uec
RCSB PDB
PDBbind
4-mer
3ut5
RCSB PDB
PDBbind
4-mer
3uw4
RCSB PDB
PDBbind
4-mer
3uw5
RCSB PDB
PDBbind
4-mer
3zyb
RCSB PDB
PDBbind
4-mer
4b9h
RCSB PDB
PDBbind
4-mer
4c16
RCSB PDB
PDBbind
4-mer
4c1t
RCSB PDB
PDBbind
4-mer
4dxg
RCSB PDB
PDBbind
4-mer
4fgt
RCSB PDB
PDBbind
4-mer
4fzc
RCSB PDB
PDBbind
4-mer
4fzg
RCSB PDB
PDBbind
4-mer
4gk7
RCSB PDB
PDBbind
4-mer
4hp0
RCSB PDB
PDBbind
4-mer
4i67
RCSB PDB
PDBbind
4-mer
4imq
RCSB PDB
PDBbind
4-mer
4imz
RCSB PDB
PDBbind
4-mer
4in9
RCSB PDB
PDBbind
4-mer
4inh
RCSB PDB
PDBbind
4-mer
4j44
RCSB PDB
PDBbind
4-mer
4j45
RCSB PDB
PDBbind
4-mer
4j46
RCSB PDB
PDBbind
4-mer
4j47
RCSB PDB
PDBbind
4-mer
4j48
RCSB PDB
PDBbind
4-mer
4k63
RCSB PDB
PDBbind
4-mer
4k66
RCSB PDB
PDBbind
4-mer
4kom
RCSB PDB
PDBbind
4-mer
4kx8
RCSB PDB
PDBbind
4-mer
4lkd
RCSB PDB
PDBbind
4-mer
4lke
RCSB PDB
PDBbind
4-mer
4lkf
RCSB PDB
PDBbind
4-mer
4mbp
RCSB PDB
PDBbind
4-mer
4q4i
RCSB PDB
PDBbind
4-mer
4trw
RCSB PDB
PDBbind
4-mer
4trz
RCSB PDB
PDBbind
4-mer
4x0z
RCSB PDB
PDBbind
4-mer
4x14
RCSB PDB
PDBbind
4-mer
4z7n
RCSB PDB
PDBbind
4-mer
4z7o
RCSB PDB
PDBbind
4-mer
5ab1
RCSB PDB
PDBbind
4-mer
5ajc
RCSB PDB
PDBbind
4-mer
5azf
RCSB PDB
PDBbind
4-mer
5btv
RCSB PDB
PDBbind
4-mer
5e6o
RCSB PDB
PDBbind
4-mer
5efj
RCSB PDB
PDBbind
4-mer
5f2u
RCSB PDB
PDBbind
4-mer
5izj
RCSB PDB
PDBbind
4-mer
5jop
RCSB PDB
PDBbind
4-mer
5jy0
RCSB PDB
PDBbind
4-mer
5tdb
RCSB PDB
PDBbind
4-mer
5vi6
RCSB PDB
PDBbind
4-mer
5wxp
RCSB PDB
PDBbind
4-mer
5yzd
RCSB PDB
PDBbind
4-mer
5zmq
RCSB PDB
PDBbind
4-mer
5zms
RCSB PDB
PDBbind
4-mer
6cct
RCSB PDB
PDBbind
4-mer
6ccu
RCSB PDB
PDBbind
4-mer
6cd8
RCSB PDB
PDBbind
4-mer
6cd9
RCSB PDB
PDBbind
4-mer
6cdc
RCSB PDB
PDBbind
4-mer
6m8w
RCSB PDB
PDBbind
4-mer
6m8y
RCSB PDB
PDBbind
4-mer
6m9f
RCSB PDB
PDBbind
4-mer
6msy
RCSB PDB
PDBbind
4-mer
6mu3
RCSB PDB
PDBbind
4-mer
6pu3
RCSB PDB
PDBbind
4-mer
6prg
RCSB PDB
PDBbind
4-mer
6n3f
RCSB PDB
PDBbind
4-mer
6jjn
RCSB PDB
PDBbind
4-mer
6jjm
RCSB PDB
PDBbind
4-mer
6hop
RCSB PDB
PDBbind
4-mer
Entry Information
PDB ID
5f90
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
C. grayanus lectin (CGL)
Ligand Name
4-mer
EC.Number
E.C.-.-.-.-
Resolution
1.64(Å)
Affinity (Kd/Ki/IC50)
Kd=14uM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) J.Am.Chem.Soc. Vol. 138: pp. 4787-4795
Ligand Properties
Formula
C
2
1
H
3
8
O
1
6
Molecular Weight
546.517
Exact Mass
546.216
No. of atoms
75
No. of bonds
77
Polar Surface Area
257.68
LOGP Value
-5.45 (
Computed with XLOGP3
)
-6.14 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 10
No. of Hydrogen Bond Acceptors: 10
No. of Rotatable Bonds: 20
No. of Nitrogen and Oxygen Atoms: 16
No. of Rings: 3
Canonical SMILES
CCCO[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O[C@@H]1O[C@H](CO)[C@@H]([C@@H]([C@H]1O)O)O[C@H]1O[C@H](CO)[C@@H]([C@@H]([C@H]1O)O)O
InChI String
InChI=1S/C21H38O16/c1-2-3-32-19-15(30)12(27)17(8(5-23)34-19)37-21-16(31)13(28)18(9(6-24)35-21)36-20-14(29)11(26)10(25)7(4-22)33-20/h7-31H,2-6H2,1H3/t7-,8-,9-,10+,11+,12-,13-,14-,15-,16-,17-,18+,19-,20-,21+/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
H2FH31
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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