Browse entries in the PDBbind-CN Database
HEADER 4XUC_COMPLEX COMPND 4XUC_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 218 ASN LEU LEU ALA GLY ASP THR LYS GLU GLN ARG ILE LEU SEQRES 2 A 218 ASN HIS VAL LEU GLN HIS ALA GLU PRO GLY ASN ALA GLN SEQRES 3 A 218 SER VAL LEU GLU ALA ILE ASP THR TYR CYS GLU GLN LYS SEQRES 4 A 218 GLU TRP ALA MET ASN VAL GLY ASP LYS LYS GLY LYS ILE SEQRES 5 A 218 VAL ASP ALA VAL ILE GLN GLU HIS GLN PRO SER VAL LEU SEQRES 6 A 218 LEU GLU LEU GLY ALA TYR CYS GLY TYR SER ALA VAL ARG SEQRES 7 A 218 MET ALA ARG LEU LEU SER PRO GLY ALA ARG LEU ILE THR SEQRES 8 A 218 ILE GLU ILE ASN PRO ASP CYS ALA ALA ILE THR GLN ARG SEQRES 9 A 218 MET VAL ASP PHE ALA GLY VAL LYS ASP LYS VAL THR LEU SEQRES 10 A 218 VAL VAL GLY ALA SER GLN ASP ILE ILE PRO GLN LEU LYS SEQRES 11 A 218 LYS LYS TYR ASP VAL ASP THR LEU ASP MET VAL PHE LEU SEQRES 12 A 218 ASP HIS TRP LYS ASP ARG TYR LEU PRO ASP THR LEU LEU SEQRES 13 A 218 LEU GLU GLU CYS GLY LEU LEU ARG LYS GLY THR VAL LEU SEQRES 14 A 218 LEU ALA ASP ASN VAL ILE CYS PRO GLY ALA PRO ASP PHE SEQRES 15 A 218 LEU ALA HIS VAL ARG GLY SER SER CYS PHE GLU CYS THR SEQRES 16 A 218 HIS TYR GLN SER PHE LEU GLU TYR ARG GLU VAL VAL ASP SEQRES 17 A 218 GLY LEU GLU LYS ALA ILE TYR LYS GLY PRO HET MG A 1 1 HET UNN A 511 35 ATOM 1 N ASN A 48 12.787 23.703 -20.438 1.00 30.79 N ATOM 2 CA ASN A 48 13.072 23.600 -21.898 1.00 30.46 C ATOM 3 C ASN A 48 12.696 22.210 -22.466 1.00 29.30 C ATOM 4 O ASN A 48 12.006 21.431 -21.810 1.00 28.98 O ATOM 5 CB ASN A 48 14.535 23.989 -22.184 1.00 30.99 C ATOM 6 CG ASN A 48 14.924 25.348 -21.564 1.00 33.45 C ATOM 7 OD1 ASN A 48 14.091 26.253 -21.434 1.00 35.52 O ATOM 8 ND2 ASN A 48 16.194 25.489 -21.196 1.00 33.81 N ATOM 9 HD22 ASN A 48 16.863 24.702 -21.323 1.00 0.00 H ATOM 10 HD21 ASN A 48 16.519 26.386 -20.781 1.00 0.00 H ATOM 11 HN3 ASN A 48 13.337 22.983 -19.927 1.00 0.00 H ATOM 12 HN2 ASN A 48 11.772 23.548 -20.272 1.00 0.00 H ATOM 13 HN1 ASN A 48 13.054 24.650 -20.100 1.00 0.00 H ATOM 14 N LEU A 49 13.133 21.906 -23.683 1.00 27.87 N ATOM 15 CA LEU A 49 12.637 20.724 -24.386 1.00 27.08 C ATOM 16 C LEU A 49 13.266 19.434 -23.871 1.00 27.13 C ATOM 17 O LEU A 49 14.362 19.435 -23.301 1.00 28.04 O ATOM 18 CB LEU A 49 12.834 20.845 -25.909 1.00 27.02 C ATOM 19 CG LEU A 49 12.131 21.989 -26.651 1.00 25.57 C ATOM 20 CD1 LEU A 49 12.562 22.006 -28.122 1.00 26.56 C ATOM 21 CD2 LEU A 49 10.624 21.920 -26.563 1.00 24.96 C ATOM 22 H LEU A 49 13.838 22.517 -24.142 1.00 0.00 H ATOM 23 N LEU A 50 12.553 18.340 -24.073 1.00 26.72 N ATOM 24 CA LEU A 50 13.073 17.017 -23.795 1.00 26.55 C ATOM 25 C LEU A 50 13.616 16.431 -25.096 1.00 26.63 C ATOM 26 O LEU A 50 13.508 17.063 -26.144 1.00 25.93 O ATOM 27 CB LEU A 50 11.965 16.146 -23.217 1.00 26.40 C ATOM 28 CG LEU A 50 11.401 16.686 -21.898 1.00 25.78 C ATOM 29 CD1 LEU A 50 10.434 15.669 -21.343 1.00 23.84 C ATOM 30 CD2 LEU A 50 12.513 16.965 -20.891 1.00 26.51 C ATOM 31 H LEU A 50 11.586 18.432 -24.444 1.00 0.00 H ATOM 32 N ALA A 51 14.192 15.233 -25.029 1.00 27.08 N ATOM 33 CA ALA A 51 14.906 14.672 -26.187 1.00 27.67 C ATOM 34 C ALA A 51 13.984 14.370 -27.364 1.00 28.12 C ATOM 35 O ALA A 51 14.393 14.495 -28.529 1.00 28.51 O ATOM 36 CB ALA A 51 15.720 13.419 -25.784 1.00 27.66 C ATOM 37 H ALA A 51 14.137 14.686 -24.146 1.00 0.00 H ATOM 38 N GLY A 52 12.744 13.981 -27.066 1.00 27.69 N ATOM 39 CA GLY A 52 11.793 13.591 -28.091 1.00 28.00 C ATOM 40 C GLY A 52 11.960 12.144 -28.523 1.00 27.99 C ATOM 41 O GLY A 52 11.477 11.756 -29.580 1.00 28.61 O ATOM 42 H GLY A 52 12.449 13.956 -26.069 1.00 0.00 H ATOM 43 N ASP A 53 12.631 11.353 -27.689 1.00 28.28 N ATOM 44 CA ASP A 53 12.799 9.901 -27.905 1.00 28.88 C ATOM 45 C ASP A 53 11.522 9.079 -27.784 1.00 28.16 C ATOM 46 O ASP A 53 11.387 8.029 -28.426 1.00 28.58 O ATOM 47 CB ASP A 53 13.813 9.332 -26.912 1.00 29.73 C ATOM 48 CG ASP A 53 15.170 9.958 -27.049 1.00 31.16 C ATOM 49 OD1 ASP A 53 15.524 10.368 -28.179 1.00 33.31 O ATOM 50 OD2 ASP A 53 15.879 10.053 -26.022 1.00 34.50 O ATOM 51 H ASP A 53 13.059 11.779 -26.842 1.00 0.00 H ATOM 52 N THR A 54 10.599 9.537 -26.936 1.00 26.12 N ATOM 53 CA THR A 54 9.359 8.819 -26.707 1.00 24.06 C ATOM 54 C THR A 54 8.186 9.654 -27.170 1.00 23.25 C ATOM 55 O THR A 54 8.290 10.886 -27.274 1.00 22.79 O ATOM 56 CB THR A 54 9.153 8.522 -25.205 1.00 24.34 C ATOM 57 OG1 THR A 54 9.004 9.757 -24.488 1.00 20.86 O ATOM 58 CG2 THR A 54 10.353 7.783 -24.643 1.00 24.33 C ATOM 59 HG1 THR A 54 8.872 9.565 -23.526 1.00 0.00 H ATOM 60 H THR A 54 10.772 10.428 -26.428 1.00 0.00 H ATOM 61 N LYS A 55 7.064 8.985 -27.398 1.00 21.59 N ATOM 62 CA LYS A 55 5.835 9.643 -27.781 1.00 21.66 C ATOM 63 C LYS A 55 5.494 10.715 -26.742 1.00 21.02 C ATOM 64 O LYS A 55 5.070 11.816 -27.089 1.00 19.87 O ATOM 65 CB LYS A 55 4.708 8.617 -27.853 1.00 21.67 C ATOM 66 CG LYS A 55 3.407 9.165 -28.355 1.00 22.13 C ATOM 67 CD LYS A 55 2.337 8.094 -28.386 1.00 24.90 C ATOM 68 CE LYS A 55 2.682 6.883 -29.271 1.00 26.09 C ATOM 69 NZ LYS A 55 1.450 6.117 -29.614 1.00 20.69 N ATOM 70 HZ1 LYS A 55 0.999 5.779 -28.740 1.00 0.00 H ATOM 71 HZ2 LYS A 55 0.791 6.735 -30.129 1.00 0.00 H ATOM 72 HZ3 LYS A 55 1.704 5.304 -30.211 1.00 0.00 H ATOM 73 H LYS A 55 7.068 7.950 -27.298 1.00 0.00 H ATOM 74 N GLU A 56 5.699 10.380 -25.470 1.00 20.32 N ATOM 75 CA GLU A 56 5.340 11.285 -24.367 1.00 19.96 C ATOM 76 C GLU A 56 6.176 12.561 -24.391 1.00 19.24 C ATOM 77 O GLU A 56 5.627 13.652 -24.246 1.00 18.90 O ATOM 78 CB GLU A 56 5.461 10.568 -23.016 1.00 19.35 C ATOM 79 CG GLU A 56 4.470 9.412 -22.897 1.00 20.63 C ATOM 80 CD GLU A 56 4.902 8.172 -23.675 1.00 18.96 C ATOM 81 OE1 GLU A 56 6.125 7.949 -23.729 1.00 20.48 O ATOM 82 OE2 GLU A 56 4.031 7.455 -24.228 1.00 22.78 O ATOM 83 H GLU A 56 6.123 9.456 -25.251 1.00 0.00 H ATOM 84 N GLN A 57 7.495 12.431 -24.589 1.00 18.89 N ATOM 85 CA GLN A 57 8.356 13.607 -24.722 1.00 19.22 C ATOM 86 C GLN A 57 7.967 14.457 -25.914 1.00 18.00 C ATOM 87 O GLN A 57 7.981 15.690 -25.832 1.00 17.69 O ATOM 88 CB GLN A 57 9.833 13.226 -24.847 1.00 19.27 C ATOM 89 CG GLN A 57 10.464 12.603 -23.595 1.00 21.67 C ATOM 90 CD GLN A 57 11.880 12.109 -23.849 1.00 22.90 C ATOM 91 OE1 GLN A 57 12.410 12.249 -24.950 1.00 27.52 O ATOM 92 NE2 GLN A 57 12.495 11.528 -22.832 1.00 26.16 N ATOM 93 HE22 GLN A 57 12.009 11.430 -21.918 1.00 0.00 H ATOM 94 HE21 GLN A 57 13.464 11.169 -22.947 1.00 0.00 H ATOM 95 H GLN A 57 7.913 11.481 -24.649 1.00 0.00 H ATOM 96 N ARG A 58 7.649 13.816 -27.037 1.00 17.86 N ATOM 97 CA ARG A 58 7.269 14.555 -28.254 1.00 17.87 C ATOM 98 C ARG A 58 5.945 15.295 -28.068 1.00 18.02 C ATOM 99 O ARG A 58 5.751 16.400 -28.601 1.00 17.63 O ATOM 100 CB ARG A 58 7.176 13.605 -29.453 1.00 17.74 C ATOM 101 CG ARG A 58 8.522 12.985 -29.789 1.00 18.94 C ATOM 102 CD ARG A 58 8.488 12.173 -31.077 1.00 18.26 C ATOM 103 NE ARG A 58 7.681 10.949 -31.036 1.00 20.80 N ATOM 104 CZ ARG A 58 8.139 9.733 -30.704 1.00 21.15 C ATOM 105 NH1 ARG A 58 9.398 9.551 -30.334 1.00 21.08 N ATOM 106 NH2 ARG A 58 7.316 8.686 -30.741 1.00 21.41 N ATOM 107 HE ARG A 58 6.674 11.030 -31.284 1.00 0.00 H ATOM 108 HH12 ARG A 58 9.733 8.600 -30.080 1.00 0.00 H ATOM 109 HH11 ARG A 58 10.051 10.359 -30.297 1.00 0.00 H ATOM 110 HH22 ARG A 58 7.665 7.741 -30.485 1.00 0.00 H ATOM 111 HH21 ARG A 58 6.324 8.814 -31.026 1.00 0.00 H ATOM 112 H ARG A 58 7.669 12.776 -27.056 1.00 0.00 H ATOM 113 N ILE A 59 5.040 14.694 -27.293 1.00 17.17 N ATOM 114 CA ILE A 59 3.774 15.353 -26.982 1.00 15.90 C ATOM 115 C ILE A 59 4.057 16.587 -26.104 1.00 15.65 C ATOM 116 O ILE A 59 3.556 17.670 -26.407 1.00 15.22 O ATOM 117 CB ILE A 59 2.735 14.418 -26.299 1.00 15.37 C ATOM 118 CG1 ILE A 59 2.166 13.386 -27.295 1.00 16.20 C ATOM 119 CG2 ILE A 59 1.554 15.244 -25.700 1.00 14.01 C ATOM 120 CD1 ILE A 59 1.240 12.307 -26.642 1.00 16.01 C ATOM 121 H ILE A 59 5.238 13.749 -26.907 1.00 0.00 H ATOM 122 N LEU A 60 4.854 16.439 -25.044 1.00 14.40 N ATOM 123 CA LEU A 60 5.201 17.611 -24.244 1.00 15.09 C ATOM 124 C LEU A 60 5.923 18.661 -25.090 1.00 15.81 C ATOM 125 O LEU A 60 5.587 19.851 -25.016 1.00 15.67 O ATOM 126 CB LEU A 60 6.053 17.250 -23.021 1.00 14.63 C ATOM 127 CG LEU A 60 6.464 18.399 -22.089 1.00 15.25 C ATOM 128 CD1 LEU A 60 5.211 19.076 -21.454 1.00 16.83 C ATOM 129 CD2 LEU A 60 7.411 17.839 -21.033 1.00 15.98 C ATOM 130 H LEU A 60 5.224 15.501 -24.790 1.00 0.00 H ATOM 131 N ASN A 61 6.902 18.227 -25.892 1.00 15.42 N ATOM 132 CA ASN A 61 7.672 19.156 -26.725 1.00 16.40 C ATOM 133 C ASN A 61 6.796 19.995 -27.645 1.00 16.33 C ATOM 134 O ASN A 61 7.047 21.200 -27.791 1.00 17.00 O ATOM 135 CB ASN A 61 8.762 18.431 -27.531 1.00 16.55 C ATOM 136 CG ASN A 61 9.979 18.082 -26.697 1.00 16.78 C ATOM 137 OD1 ASN A 61 10.128 18.502 -25.536 1.00 18.12 O ATOM 138 ND2 ASN A 61 10.878 17.289 -27.293 1.00 20.17 N ATOM 139 HD22 ASN A 61 10.716 16.959 -28.266 1.00 0.00 H ATOM 140 HD21 ASN A 61 11.738 17.003 -26.783 1.00 0.00 H ATOM 141 H ASN A 61 7.121 17.211 -25.925 1.00 0.00 H ATOM 142 N HIS A 62 5.776 19.361 -28.226 1.00 15.40 N ATOM 143 CA HIS A 62 4.808 20.007 -29.107 1.00 15.85 C ATOM 144 C HIS A 62 4.026 21.064 -28.339 1.00 15.87 C ATOM 145 O HIS A 62 3.804 22.161 -28.828 1.00 15.46 O ATOM 146 CB HIS A 62 3.827 18.999 -29.709 1.00 16.31 C ATOM 147 CG HIS A 62 2.753 19.644 -30.534 1.00 16.72 C ATOM 148 ND1 HIS A 62 2.998 20.183 -31.779 1.00 17.34 N ATOM 149 CD2 HIS A 62 1.455 19.909 -30.258 1.00 19.42 C ATOM 150 CE1 HIS A 62 1.884 20.710 -32.251 1.00 17.66 C ATOM 151 NE2 HIS A 62 0.932 20.560 -31.346 1.00 19.32 N ATOM 152 H HIS A 62 5.664 18.344 -28.040 1.00 0.00 H ATOM 153 N VAL A 63 3.593 20.724 -27.130 1.00 15.16 N ATOM 154 CA VAL A 63 2.916 21.724 -26.308 1.00 15.56 C ATOM 155 C VAL A 63 3.832 22.907 -25.994 1.00 15.21 C ATOM 156 O VAL A 63 3.437 24.063 -26.170 1.00 16.70 O ATOM 157 CB VAL A 63 2.379 21.101 -25.023 1.00 15.13 C ATOM 158 CG1 VAL A 63 1.899 22.178 -24.080 1.00 13.92 C ATOM 159 CG2 VAL A 63 1.238 20.149 -25.367 1.00 15.86 C ATOM 160 H VAL A 63 3.734 19.757 -26.773 1.00 0.00 H ATOM 161 N LEU A 64 5.041 22.630 -25.538 1.00 15.57 N ATOM 162 CA LEU A 64 5.987 23.672 -25.140 1.00 15.91 C ATOM 163 C LEU A 64 6.321 24.617 -26.314 1.00 16.53 C ATOM 164 O LEU A 64 6.582 25.796 -26.117 1.00 16.15 O ATOM 165 CB LEU A 64 7.288 23.041 -24.667 1.00 16.26 C ATOM 166 CG LEU A 64 7.287 22.290 -23.333 1.00 16.90 C ATOM 167 CD1 LEU A 64 8.677 21.737 -23.088 1.00 15.64 C ATOM 168 CD2 LEU A 64 6.859 23.253 -22.195 1.00 17.63 C ATOM 169 H LEU A 64 5.330 21.634 -25.459 1.00 0.00 H ATOM 170 N GLN A 65 6.308 24.067 -27.524 1.00 16.55 N ATOM 171 CA GLN A 65 6.651 24.842 -28.739 1.00 16.63 C ATOM 172 C GLN A 65 5.459 25.500 -29.418 1.00 17.55 C ATOM 173 O GLN A 65 5.617 26.500 -30.139 1.00 17.86 O ATOM 174 CB GLN A 65 7.368 23.927 -29.744 1.00 15.08 C ATOM 175 CG GLN A 65 8.782 23.588 -29.354 1.00 16.06 C ATOM 176 CD GLN A 65 9.546 22.969 -30.501 1.00 18.89 C ATOM 177 OE1 GLN A 65 9.087 21.981 -31.102 1.00 17.98 O ATOM 178 NE2 GLN A 65 10.723 23.543 -30.819 1.00 17.25 N ATOM 179 HE22 GLN A 65 11.061 24.368 -30.284 1.00 0.00 H ATOM 180 HE21 GLN A 65 11.294 23.161 -31.600 1.00 0.00 H ATOM 181 H GLN A 65 6.050 23.064 -27.620 1.00 0.00 H ATOM 182 N HIS A 66 4.266 24.970 -29.174 1.00 18.24 N ATOM 183 CA HIS A 66 3.106 25.231 -30.019 1.00 19.24 C ATOM 184 C HIS A 66 1.826 25.619 -29.283 1.00 20.25 C ATOM 185 O HIS A 66 0.797 25.790 -29.931 1.00 23.09 O ATOM 186 CB HIS A 66 2.840 23.983 -30.886 1.00 19.60 C ATOM 187 CG HIS A 66 2.283 24.282 -32.243 1.00 21.03 C ATOM 188 ND1 HIS A 66 3.076 24.386 -33.371 1.00 21.26 N ATOM 189 CD2 HIS A 66 1.012 24.499 -32.656 1.00 21.13 C ATOM 190 CE1 HIS A 66 2.316 24.635 -34.418 1.00 21.55 C ATOM 191 NE2 HIS A 66 1.057 24.715 -34.011 1.00 24.62 N ATOM 192 H HIS A 66 4.155 24.346 -28.350 1.00 0.00 H ATOM 193 N ALA A 67 1.858 25.711 -27.948 1.00 19.27 N ATOM 194 CA ALA A 67 0.692 26.139 -27.173 1.00 19.44 C ATOM 195 C ALA A 67 1.052 27.402 -26.425 1.00 19.25 C ATOM 196 O ALA A 67 2.223 27.717 -26.240 1.00 19.63 O ATOM 197 CB ALA A 67 0.247 25.059 -26.172 1.00 19.87 C ATOM 198 H ALA A 67 2.737 25.471 -27.447 1.00 0.00 H ATOM 199 N GLU A 68 0.029 28.123 -25.995 1.00 19.42 N ATOM 200 CA GLU A 68 0.231 29.359 -25.274 1.00 18.43 C ATOM 201 C GLU A 68 0.521 29.050 -23.802 1.00 17.96 C ATOM 202 O GLU A 68 -0.304 28.429 -23.156 1.00 17.35 O ATOM 203 CB GLU A 68 -1.034 30.185 -25.379 1.00 19.08 C ATOM 204 CG GLU A 68 -0.939 31.488 -24.596 1.00 22.04 C ATOM 205 CD GLU A 68 -2.201 32.285 -24.715 1.00 24.05 C ATOM 206 OE1 GLU A 68 -2.920 32.093 -25.716 1.00 25.98 O ATOM 207 OE2 GLU A 68 -2.481 33.079 -23.803 1.00 26.40 O ATOM 208 H GLU A 68 -0.940 27.793 -26.180 1.00 0.00 H ATOM 209 N PRO A 69 1.677 29.474 -23.286 1.00 17.84 N ATOM 210 CA PRO A 69 2.003 29.199 -21.883 1.00 17.79 C ATOM 211 C PRO A 69 0.941 29.795 -20.981 1.00 18.01 C ATOM 212 O PRO A 69 0.525 30.933 -21.201 1.00 18.11 O ATOM 213 CB PRO A 69 3.326 29.934 -21.673 1.00 17.70 C ATOM 214 CG PRO A 69 3.905 30.081 -23.028 1.00 19.06 C ATOM 215 CD PRO A 69 2.753 30.235 -23.960 1.00 17.32 C ATOM 216 N GLY A 70 0.474 29.021 -20.004 1.00 18.51 N ATOM 217 CA GLY A 70 -0.571 29.499 -19.062 1.00 17.68 C ATOM 218 C GLY A 70 -2.007 29.404 -19.534 1.00 17.86 C ATOM 219 O GLY A 70 -2.936 29.742 -18.784 1.00 17.99 O ATOM 220 H GLY A 70 0.850 28.057 -19.897 1.00 0.00 H ATOM 221 N ASN A 71 -2.204 28.942 -20.763 1.00 16.40 N ATOM 222 CA ASN A 71 -3.526 28.812 -21.331 1.00 17.47 C ATOM 223 C ASN A 71 -3.866 27.317 -21.393 1.00 16.76 C ATOM 224 O ASN A 71 -3.383 26.609 -22.264 1.00 15.85 O ATOM 225 CB ASN A 71 -3.555 29.472 -22.725 1.00 17.48 C ATOM 226 CG ASN A 71 -4.945 29.545 -23.325 1.00 19.86 C ATOM 227 OD1 ASN A 71 -5.725 28.601 -23.267 1.00 17.11 O ATOM 228 ND2 ASN A 71 -5.252 30.688 -23.947 1.00 25.64 N ATOM 229 HD22 ASN A 71 -4.563 31.466 -23.975 1.00 0.00 H ATOM 230 HD21 ASN A 71 -6.180 30.799 -24.403 1.00 0.00 H ATOM 231 H ASN A 71 -1.381 28.665 -21.335 1.00 0.00 H ATOM 232 N ALA A 72 -4.683 26.845 -20.455 1.00 17.18 N ATOM 233 CA ALA A 72 -5.043 25.420 -20.410 1.00 16.97 C ATOM 234 C ALA A 72 -5.803 24.960 -21.655 1.00 17.73 C ATOM 235 O ALA A 72 -5.568 23.846 -22.151 1.00 17.25 O ATOM 236 CB ALA A 72 -5.845 25.093 -19.120 1.00 16.36 C ATOM 237 H ALA A 72 -5.073 27.494 -19.742 1.00 0.00 H ATOM 238 N GLN A 73 -6.709 25.799 -22.159 1.00 17.84 N ATOM 239 CA GLN A 73 -7.438 25.473 -23.398 1.00 19.62 C ATOM 240 C GLN A 73 -6.487 25.293 -24.581 1.00 18.61 C ATOM 241 O GLN A 73 -6.642 24.351 -25.368 1.00 18.59 O ATOM 242 CB GLN A 73 -8.505 26.544 -23.714 1.00 20.26 C ATOM 243 CG GLN A 73 -9.404 26.245 -24.936 1.00 24.20 C ATOM 244 CD GLN A 73 -10.251 24.965 -24.808 1.00 31.69 C ATOM 245 OE1 GLN A 73 -10.596 24.518 -23.702 1.00 34.23 O ATOM 246 NE2 GLN A 73 -10.601 24.380 -25.955 1.00 35.18 N ATOM 247 HE22 GLN A 73 -10.292 24.786 -26.861 1.00 0.00 H ATOM 248 HE21 GLN A 73 -11.183 23.518 -25.943 1.00 0.00 H ATOM 249 H GLN A 73 -6.904 26.696 -21.671 1.00 0.00 H ATOM 250 N SER A 74 -5.491 26.169 -24.701 1.00 18.63 N ATOM 251 CA SER A 74 -4.500 26.074 -25.771 1.00 17.87 C ATOM 252 C SER A 74 -3.696 24.773 -25.644 1.00 17.70 C ATOM 253 O SER A 74 -3.393 24.105 -26.643 1.00 16.41 O ATOM 254 CB SER A 74 -3.554 27.268 -25.724 1.00 18.84 C ATOM 255 OG SER A 74 -2.586 27.218 -26.765 1.00 18.59 O ATOM 256 HG SER A 74 -3.046 27.220 -27.642 1.00 0.00 H ATOM 257 H SER A 74 -5.416 26.945 -24.012 1.00 0.00 H ATOM 258 N VAL A 75 -3.336 24.435 -24.404 1.00 15.99 N ATOM 259 CA VAL A 75 -2.650 23.166 -24.136 1.00 15.87 C ATOM 260 C VAL A 75 -3.487 21.965 -24.592 1.00 15.35 C ATOM 261 O VAL A 75 -2.953 21.101 -25.288 1.00 16.22 O ATOM 262 CB VAL A 75 -2.187 23.044 -22.654 1.00 15.15 C ATOM 263 CG1 VAL A 75 -1.708 21.590 -22.303 1.00 15.20 C ATOM 264 CG2 VAL A 75 -1.073 24.035 -22.403 1.00 15.02 C ATOM 265 H VAL A 75 -3.545 25.081 -23.616 1.00 0.00 H ATOM 266 N LEU A 76 -4.760 21.902 -24.194 1.00 14.92 N ATOM 267 CA LEU A 76 -5.624 20.766 -24.559 1.00 15.61 C ATOM 268 C LEU A 76 -5.715 20.652 -26.081 1.00 16.34 C ATOM 269 O LEU A 76 -5.583 19.565 -26.642 1.00 15.80 O ATOM 270 CB LEU A 76 -7.028 20.910 -23.992 1.00 16.06 C ATOM 271 CG LEU A 76 -7.162 20.962 -22.467 1.00 17.24 C ATOM 272 CD1 LEU A 76 -8.616 21.248 -22.101 1.00 21.06 C ATOM 273 CD2 LEU A 76 -6.644 19.648 -21.833 1.00 22.02 C ATOM 274 H LEU A 76 -5.150 22.672 -23.614 1.00 0.00 H ATOM 275 N GLU A 77 -5.888 21.798 -26.730 1.00 16.45 N ATOM 276 CA GLU A 77 -6.056 21.828 -28.185 1.00 18.28 C ATOM 277 C GLU A 77 -4.806 21.324 -28.886 1.00 16.86 C ATOM 278 O GLU A 77 -4.913 20.614 -29.898 1.00 18.00 O ATOM 279 CB GLU A 77 -6.480 23.226 -28.666 1.00 17.79 C ATOM 280 CG GLU A 77 -7.964 23.460 -28.419 1.00 20.74 C ATOM 281 CD GLU A 77 -8.439 24.899 -28.593 1.00 22.62 C ATOM 282 OE1 GLU A 77 -7.615 25.787 -28.886 1.00 28.60 O ATOM 283 OE2 GLU A 77 -9.659 25.120 -28.428 1.00 28.98 O ATOM 284 H GLU A 77 -5.904 22.690 -26.196 1.00 0.00 H ATOM 285 N ALA A 78 -3.644 21.665 -28.337 1.00 16.42 N ATOM 286 CA ALA A 78 -2.350 21.308 -28.933 1.00 16.30 C ATOM 287 C ALA A 78 -2.108 19.805 -28.798 1.00 17.05 C ATOM 288 O ALA A 78 -1.622 19.149 -29.725 1.00 15.97 O ATOM 289 CB ALA A 78 -1.239 22.081 -28.303 1.00 16.53 C ATOM 290 H ALA A 78 -3.652 22.207 -27.449 1.00 0.00 H ATOM 291 N ILE A 79 -2.466 19.258 -27.637 1.00 16.34 N ATOM 292 CA ILE A 79 -2.351 17.811 -27.454 1.00 16.60 C ATOM 293 C ILE A 79 -3.287 17.055 -28.398 1.00 16.86 C ATOM 294 O ILE A 79 -2.865 16.103 -29.065 1.00 17.16 O ATOM 295 CB ILE A 79 -2.600 17.400 -25.977 1.00 15.86 C ATOM 296 CG1 ILE A 79 -1.508 18.011 -25.104 1.00 15.75 C ATOM 297 CG2 ILE A 79 -2.610 15.833 -25.850 1.00 16.77 C ATOM 298 CD1 ILE A 79 -1.727 17.856 -23.595 1.00 16.66 C ATOM 299 H ILE A 79 -2.825 19.856 -26.866 1.00 0.00 H ATOM 300 N ASP A 80 -4.545 17.489 -28.458 1.00 16.10 N ATOM 301 CA ASP A 80 -5.544 16.816 -29.262 1.00 17.51 C ATOM 302 C ASP A 80 -5.209 16.912 -30.743 1.00 17.89 C ATOM 303 O ASP A 80 -5.376 15.955 -31.459 1.00 17.99 O ATOM 304 CB ASP A 80 -6.939 17.353 -29.003 1.00 17.54 C ATOM 305 CG ASP A 80 -7.516 16.871 -27.688 1.00 17.12 C ATOM 306 OD1 ASP A 80 -7.206 15.735 -27.248 1.00 18.13 O ATOM 307 OD2 ASP A 80 -8.315 17.626 -27.114 1.00 16.06 O ATOM 308 H ASP A 80 -4.817 18.333 -27.914 1.00 0.00 H ATOM 309 N THR A 81 -4.696 18.061 -31.176 1.00 18.75 N ATOM 310 CA THR A 81 -4.321 18.219 -32.590 1.00 19.91 C ATOM 311 C THR A 81 -3.164 17.297 -32.951 1.00 19.34 C ATOM 312 O THR A 81 -3.229 16.591 -33.962 1.00 21.53 O ATOM 313 CB THR A 81 -3.983 19.694 -32.938 1.00 19.49 C ATOM 314 OG1 THR A 81 -5.098 20.511 -32.596 1.00 21.38 O ATOM 315 CG2 THR A 81 -3.739 19.835 -34.446 1.00 21.42 C ATOM 316 HG1 THR A 81 -5.282 20.427 -31.627 1.00 0.00 H ATOM 317 H THR A 81 -4.560 18.850 -30.513 1.00 0.00 H ATOM 318 N TYR A 82 -2.121 17.291 -32.136 1.00 19.59 N ATOM 319 CA TYR A 82 -0.944 16.449 -32.362 1.00 19.88 C ATOM 320 C TYR A 82 -1.314 14.960 -32.418 1.00 20.54 C ATOM 321 O TYR A 82 -0.840 14.189 -33.276 1.00 20.58 O ATOM 322 CB TYR A 82 0.085 16.659 -31.252 1.00 19.98 C ATOM 323 CG TYR A 82 1.372 15.879 -31.476 1.00 20.47 C ATOM 324 CD1 TYR A 82 2.385 16.393 -32.284 1.00 20.73 C ATOM 325 CD2 TYR A 82 1.557 14.614 -30.912 1.00 19.27 C ATOM 326 CE1 TYR A 82 3.567 15.672 -32.504 1.00 21.69 C ATOM 327 CE2 TYR A 82 2.722 13.881 -31.130 1.00 20.46 C ATOM 328 CZ TYR A 82 3.720 14.412 -31.929 1.00 22.03 C ATOM 329 OH TYR A 82 4.880 13.694 -32.155 1.00 22.55 O ATOM 330 HH TYR A 82 4.655 12.834 -32.592 1.00 0.00 H ATOM 331 H TYR A 82 -2.138 17.910 -31.300 1.00 0.00 H ATOM 332 N CYS A 83 -2.141 14.549 -31.470 1.00 20.78 N ATOM 333 CA CYS A 83 -2.536 13.154 -31.388 1.00 21.30 C ATOM 334 C CYS A 83 -3.524 12.731 -32.479 1.00 22.10 C ATOM 335 O CYS A 83 -3.574 11.556 -32.842 1.00 23.44 O ATOM 336 CB CYS A 83 -3.074 12.855 -29.985 1.00 19.83 C ATOM 337 SG CYS A 83 -1.829 13.013 -28.745 1.00 18.72 S ATOM 338 H CYS A 83 -2.511 15.231 -30.778 1.00 0.00 H ATOM 339 N GLU A 84 -4.318 13.667 -32.988 1.00 22.96 N ATOM 340 CA GLU A 84 -5.202 13.399 -34.129 1.00 24.30 C ATOM 341 C GLU A 84 -4.383 13.278 -35.400 1.00 24.81 C ATOM 342 O GLU A 84 -4.720 12.492 -36.291 1.00 25.43 O ATOM 343 CB GLU A 84 -6.194 14.538 -34.357 1.00 24.08 C ATOM 344 CG GLU A 84 -7.463 14.492 -33.520 1.00 28.07 C ATOM 345 CD GLU A 84 -8.561 13.571 -34.072 1.00 33.81 C ATOM 346 OE1 GLU A 84 -8.448 13.069 -35.219 1.00 36.84 O ATOM 347 OE2 GLU A 84 -9.566 13.360 -33.345 1.00 36.02 O ATOM 348 H GLU A 84 -4.313 14.617 -32.566 1.00 0.00 H ATOM 349 N GLN A 85 -3.319 14.069 -35.483 1.00 25.11 N ATOM 350 CA GLN A 85 -2.597 14.237 -36.735 1.00 26.16 C ATOM 351 C GLN A 85 -1.326 13.420 -36.836 1.00 25.75 C ATOM 352 O GLN A 85 -0.983 12.954 -37.931 1.00 26.12 O ATOM 353 CB GLN A 85 -2.253 15.713 -36.970 1.00 25.83 C ATOM 354 CG GLN A 85 -3.414 16.608 -37.304 1.00 27.25 C ATOM 355 CD GLN A 85 -2.950 18.034 -37.585 1.00 28.85 C ATOM 356 OE1 GLN A 85 -1.771 18.357 -37.424 1.00 33.78 O ATOM 357 NE2 GLN A 85 -3.868 18.886 -38.022 1.00 32.80 N ATOM 358 HE22 GLN A 85 -4.852 18.573 -38.144 1.00 0.00 H ATOM 359 HE21 GLN A 85 -3.604 19.867 -38.243 1.00 0.00 H ATOM 360 H GLN A 85 -2.996 14.578 -34.636 1.00 0.00 H ATOM 361 N LYS A 86 -0.613 13.277 -35.723 1.00 24.78 N ATOM 362 CA LYS A 86 0.740 12.723 -35.747 1.00 24.59 C ATOM 363 C LYS A 86 0.880 11.364 -35.080 1.00 24.52 C ATOM 364 O LYS A 86 1.354 10.422 -35.711 1.00 25.05 O ATOM 365 CB LYS A 86 1.757 13.704 -35.157 1.00 24.55 C ATOM 366 CG LYS A 86 1.770 15.057 -35.818 1.00 26.35 C ATOM 367 CD LYS A 86 2.536 14.984 -37.124 1.00 28.76 C ATOM 368 CE LYS A 86 3.012 16.345 -37.564 1.00 33.56 C ATOM 369 NZ LYS A 86 3.753 16.220 -38.865 1.00 36.19 N ATOM 370 HZ1 LYS A 86 4.571 15.590 -38.738 1.00 0.00 H ATOM 371 HZ2 LYS A 86 3.118 15.824 -39.587 1.00 0.00 H ATOM 372 HZ3 LYS A 86 4.081 17.159 -39.167 1.00 0.00 H ATOM 373 H LYS A 86 -1.027 13.566 -34.814 1.00 0.00 H ATOM 374 N GLU A 87 0.503 11.263 -33.804 1.00 23.47 N ATOM 375 CA GLU A 87 0.709 10.020 -33.052 1.00 22.20 C ATOM 376 C GLU A 87 -0.466 9.804 -32.127 1.00 21.42 C ATOM 377 O GLU A 87 -0.732 10.645 -31.255 1.00 21.01 O ATOM 378 CB GLU A 87 1.971 10.082 -32.195 1.00 22.40 C ATOM 379 CG GLU A 87 3.253 10.484 -32.881 1.00 23.38 C ATOM 380 CD GLU A 87 4.451 10.273 -32.009 1.00 24.27 C ATOM 381 OE1 GLU A 87 4.850 9.099 -31.821 1.00 26.44 O ATOM 382 OE2 GLU A 87 5.017 11.267 -31.504 1.00 23.65 O ATOM 383 H GLU A 87 0.057 12.077 -33.336 1.00 0.00 H ATOM 384 N TRP A 88 -1.177 8.687 -32.292 1.00 19.73 N ATOM 385 CA TRP A 88 -2.275 8.393 -31.386 1.00 17.94 C ATOM 386 C TRP A 88 -1.725 8.350 -29.966 1.00 17.30 C ATOM 387 O TRP A 88 -0.584 7.925 -29.735 1.00 16.63 O ATOM 388 CB TRP A 88 -2.939 7.042 -31.732 1.00 18.58 C ATOM 389 CG TRP A 88 -4.162 6.780 -30.881 1.00 16.32 C ATOM 390 CD1 TRP A 88 -5.431 7.161 -31.146 1.00 16.65 C ATOM 391 CD2 TRP A 88 -4.188 6.134 -29.604 1.00 16.60 C ATOM 392 NE1 TRP A 88 -6.269 6.769 -30.130 1.00 15.70 N ATOM 393 CE2 TRP A 88 -5.530 6.142 -29.162 1.00 17.63 C ATOM 394 CE3 TRP A 88 -3.211 5.536 -28.797 1.00 16.12 C ATOM 395 CZ2 TRP A 88 -5.929 5.578 -27.920 1.00 16.06 C ATOM 396 CZ3 TRP A 88 -3.604 4.976 -27.551 1.00 17.31 C ATOM 397 CH2 TRP A 88 -4.945 5.006 -27.141 1.00 16.36 C ATOM 398 HE1 TRP A 88 -7.297 6.923 -30.101 1.00 0.00 H ATOM 399 H TRP A 88 -0.947 8.030 -33.065 1.00 0.00 H ATOM 400 N ALA A 89 -2.526 8.790 -28.996 1.00 17.41 N ATOM 401 CA ALA A 89 -2.117 8.555 -27.607 1.00 16.02 C ATOM 402 C ALA A 89 -3.333 8.423 -26.704 1.00 15.40 C ATOM 403 O ALA A 89 -4.429 8.849 -27.059 1.00 14.94 O ATOM 404 CB ALA A 89 -1.165 9.646 -27.119 1.00 16.79 C ATOM 405 H ALA A 89 -3.414 9.285 -29.217 1.00 0.00 H ATOM 406 N MET A 90 -3.148 7.801 -25.545 1.00 14.91 N ATOM 407 CA MET A 90 -4.305 7.374 -24.735 1.00 16.12 C ATOM 408 C MET A 90 -4.883 8.466 -23.816 1.00 16.14 C ATOM 409 O MET A 90 -5.376 8.178 -22.698 1.00 16.14 O ATOM 410 CB MET A 90 -3.974 6.089 -23.949 1.00 15.44 C ATOM 411 CG MET A 90 -2.767 6.183 -23.024 1.00 17.26 C ATOM 412 SD MET A 90 -2.311 4.601 -22.256 1.00 17.73 S ATOM 413 CE MET A 90 -0.683 4.947 -21.637 1.00 16.12 C ATOM 414 H MET A 90 -2.183 7.614 -25.207 1.00 0.00 H ATOM 415 N ASN A 91 -4.877 9.711 -24.294 1.00 15.60 N ATOM 416 CA ASN A 91 -5.600 10.802 -23.599 1.00 15.69 C ATOM 417 C ASN A 91 -7.083 10.600 -23.710 1.00 15.68 C ATOM 418 O ASN A 91 -7.547 10.027 -24.683 1.00 15.88 O ATOM 419 CB ASN A 91 -5.257 12.168 -24.201 1.00 15.04 C ATOM 420 CG ASN A 91 -3.769 12.344 -24.415 1.00 15.58 C ATOM 421 OD1 ASN A 91 -2.970 12.188 -23.489 1.00 15.28 O ATOM 422 ND2 ASN A 91 -3.383 12.641 -25.649 1.00 17.87 N ATOM 423 HD22 ASN A 91 -4.092 12.764 -26.400 1.00 0.00 H ATOM 424 HD21 ASN A 91 -2.372 12.751 -25.865 1.00 0.00 H ATOM 425 H ASN A 91 -4.356 9.920 -25.170 1.00 0.00 H ATOM 426 N VAL A 92 -7.859 11.076 -22.734 1.00 14.94 N ATOM 427 CA VAL A 92 -9.328 10.912 -22.842 1.00 15.40 C ATOM 428 C VAL A 92 -9.869 11.661 -24.103 1.00 16.01 C ATOM 429 O VAL A 92 -10.876 11.278 -24.680 1.00 16.28 O ATOM 430 CB VAL A 92 -10.030 11.316 -21.509 1.00 15.63 C ATOM 431 CG1 VAL A 92 -9.830 12.844 -21.227 1.00 13.37 C ATOM 432 CG2 VAL A 92 -11.525 10.873 -21.473 1.00 15.55 C ATOM 433 H VAL A 92 -7.440 11.554 -21.911 1.00 0.00 H ATOM 434 N GLY A 93 -9.152 12.704 -24.529 1.00 16.96 N ATOM 435 CA GLY A 93 -9.414 13.382 -25.803 1.00 17.95 C ATOM 436 C GLY A 93 -10.547 14.376 -25.735 1.00 18.93 C ATOM 437 O GLY A 93 -11.187 14.532 -24.695 1.00 18.51 O ATOM 438 H GLY A 93 -8.374 13.050 -23.932 1.00 0.00 H ATOM 439 N ASP A 94 -10.829 15.053 -26.847 1.00 19.54 N ATOM 440 CA ASP A 94 -11.809 16.147 -26.806 1.00 20.90 C ATOM 441 C ASP A 94 -13.285 15.753 -26.676 1.00 20.05 C ATOM 442 O ASP A 94 -13.997 16.419 -25.940 1.00 20.81 O ATOM 443 CB ASP A 94 -11.619 17.166 -27.946 1.00 21.77 C ATOM 444 CG ASP A 94 -12.366 18.478 -27.674 1.00 26.36 C ATOM 445 OD1 ASP A 94 -12.058 19.195 -26.675 1.00 28.36 O ATOM 446 OD2 ASP A 94 -13.289 18.780 -28.453 1.00 31.48 O ATOM 447 H ASP A 94 -10.357 14.808 -27.741 1.00 0.00 H ATOM 448 N LYS A 95 -13.757 14.711 -27.379 1.00 20.12 N ATOM 449 CA LYS A 95 -15.184 14.354 -27.305 1.00 19.88 C ATOM 450 C LYS A 95 -15.572 13.794 -25.936 1.00 18.93 C ATOM 451 O LYS A 95 -16.562 14.220 -25.340 1.00 18.27 O ATOM 452 CB LYS A 95 -15.603 13.372 -28.400 1.00 20.91 C ATOM 453 CG LYS A 95 -15.475 13.940 -29.816 1.00 24.69 C ATOM 454 CD LYS A 95 -15.969 12.943 -30.854 1.00 29.68 C ATOM 455 CE LYS A 95 -15.494 13.339 -32.262 1.00 33.54 C ATOM 456 NZ LYS A 95 -15.723 12.196 -33.227 1.00 35.78 N ATOM 457 HZ1 LYS A 95 -15.190 11.362 -32.908 1.00 0.00 H ATOM 458 HZ2 LYS A 95 -16.737 11.969 -33.259 1.00 0.00 H ATOM 459 HZ3 LYS A 95 -15.399 12.474 -34.175 1.00 0.00 H ATOM 460 H LYS A 95 -13.113 14.155 -27.977 1.00 0.00 H ATOM 461 N LYS A 96 -14.800 12.832 -25.445 1.00 18.02 N ATOM 462 CA LYS A 96 -15.067 12.286 -24.117 1.00 17.66 C ATOM 463 C LYS A 96 -14.717 13.320 -23.058 1.00 17.49 C ATOM 464 O LYS A 96 -15.358 13.390 -22.002 1.00 17.47 O ATOM 465 CB LYS A 96 -14.316 10.976 -23.888 1.00 16.57 C ATOM 466 CG LYS A 96 -14.912 9.807 -24.686 1.00 17.96 C ATOM 467 CD LYS A 96 -14.297 8.473 -24.318 1.00 15.99 C ATOM 468 CE LYS A 96 -12.825 8.411 -24.693 1.00 16.16 C ATOM 469 NZ LYS A 96 -12.168 7.180 -24.161 1.00 14.45 N ATOM 470 HZ1 LYS A 96 -12.242 7.170 -23.124 1.00 0.00 H ATOM 471 HZ2 LYS A 96 -12.641 6.340 -24.552 1.00 0.00 H ATOM 472 HZ3 LYS A 96 -11.166 7.176 -24.439 1.00 0.00 H ATOM 473 H LYS A 96 -14.004 12.467 -26.007 1.00 0.00 H ATOM 474 N GLY A 97 -13.701 14.126 -23.356 1.00 17.69 N ATOM 475 CA GLY A 97 -13.314 15.265 -22.510 1.00 17.96 C ATOM 476 C GLY A 97 -14.502 16.185 -22.274 1.00 18.25 C ATOM 477 O GLY A 97 -14.696 16.667 -21.163 1.00 18.29 O ATOM 478 H GLY A 97 -13.158 13.943 -24.224 1.00 0.00 H ATOM 479 N LYS A 98 -15.324 16.415 -23.301 1.00 17.20 N ATOM 480 CA LYS A 98 -16.503 17.242 -23.113 1.00 18.25 C ATOM 481 C LYS A 98 -17.469 16.667 -22.088 1.00 16.72 C ATOM 482 O LYS A 98 -18.127 17.417 -21.368 1.00 17.14 O ATOM 483 CB LYS A 98 -17.214 17.492 -24.440 1.00 18.62 C ATOM 484 CG LYS A 98 -16.494 18.532 -25.225 1.00 22.33 C ATOM 485 CD LYS A 98 -17.063 18.686 -26.614 1.00 28.75 C ATOM 486 CE LYS A 98 -16.263 19.753 -27.329 1.00 31.38 C ATOM 487 NZ LYS A 98 -16.236 19.505 -28.791 1.00 36.27 N ATOM 488 HZ1 LYS A 98 -15.800 18.579 -28.976 1.00 0.00 H ATOM 489 HZ2 LYS A 98 -17.208 19.512 -29.161 1.00 0.00 H ATOM 490 HZ3 LYS A 98 -15.681 20.251 -29.258 1.00 0.00 H ATOM 491 H LYS A 98 -15.120 16.003 -24.234 1.00 0.00 H ATOM 492 N ILE A 99 -17.531 15.338 -22.026 1.00 15.62 N ATOM 493 CA ILE A 99 -18.393 14.635 -21.081 1.00 16.05 C ATOM 494 C ILE A 99 -17.839 14.805 -19.683 1.00 15.94 C ATOM 495 O ILE A 99 -18.580 15.146 -18.759 1.00 16.35 O ATOM 496 CB ILE A 99 -18.575 13.135 -21.456 1.00 15.96 C ATOM 497 CG1 ILE A 99 -19.405 13.038 -22.752 1.00 16.46 C ATOM 498 CG2 ILE A 99 -19.281 12.358 -20.326 1.00 16.98 C ATOM 499 CD1 ILE A 99 -19.357 11.689 -23.426 1.00 18.36 C ATOM 500 H ILE A 99 -16.942 14.779 -22.676 1.00 0.00 H ATOM 501 N VAL A 100 -16.532 14.593 -19.530 1.00 14.96 N ATOM 502 CA VAL A 100 -15.874 14.846 -18.237 1.00 15.29 C ATOM 503 C VAL A 100 -16.138 16.281 -17.755 1.00 15.61 C ATOM 504 O VAL A 100 -16.487 16.506 -16.583 1.00 15.57 O ATOM 505 CB VAL A 100 -14.355 14.624 -18.353 1.00 14.87 C ATOM 506 CG1 VAL A 100 -13.655 14.985 -17.029 1.00 16.24 C ATOM 507 CG2 VAL A 100 -14.046 13.147 -18.743 1.00 12.77 C ATOM 508 H VAL A 100 -15.970 14.245 -20.333 1.00 0.00 H ATOM 509 N ASP A 101 -15.949 17.244 -18.662 1.00 15.59 N ATOM 510 CA ASP A 101 -16.282 18.656 -18.391 1.00 16.15 C ATOM 511 C ASP A 101 -17.687 18.816 -17.798 1.00 16.01 C ATOM 512 O ASP A 101 -17.856 19.468 -16.764 1.00 15.70 O ATOM 513 CB ASP A 101 -16.231 19.456 -19.685 1.00 16.93 C ATOM 514 CG ASP A 101 -14.825 19.729 -20.174 1.00 16.23 C ATOM 515 OD1 ASP A 101 -13.819 19.247 -19.610 1.00 16.52 O ATOM 516 OD2 ASP A 101 -14.735 20.466 -21.181 1.00 18.93 O ATOM 517 H ASP A 101 -15.554 16.990 -19.590 1.00 0.00 H ATOM 518 N ALA A 102 -18.690 18.261 -18.495 1.00 16.04 N ATOM 519 CA ALA A 102 -20.110 18.302 -18.084 1.00 16.44 C ATOM 520 C ALA A 102 -20.381 17.712 -16.694 1.00 16.73 C ATOM 521 O ALA A 102 -21.167 18.263 -15.910 1.00 16.76 O ATOM 522 CB ALA A 102 -20.976 17.589 -19.122 1.00 14.95 C ATOM 523 H ALA A 102 -18.454 17.771 -19.381 1.00 0.00 H ATOM 524 N VAL A 103 -19.736 16.586 -16.398 1.00 16.10 N ATOM 525 CA VAL A 103 -19.866 15.952 -15.096 1.00 15.42 C ATOM 526 C VAL A 103 -19.343 16.877 -14.010 1.00 15.78 C ATOM 527 O VAL A 103 -20.008 17.059 -12.988 1.00 15.60 O ATOM 528 CB VAL A 103 -19.151 14.571 -15.055 1.00 15.48 C ATOM 529 CG1 VAL A 103 -19.200 13.953 -13.671 1.00 14.70 C ATOM 530 CG2 VAL A 103 -19.819 13.642 -16.067 1.00 15.62 C ATOM 531 H VAL A 103 -19.124 16.149 -17.116 1.00 0.00 H ATOM 532 N ILE A 104 -18.174 17.473 -14.242 1.00 15.88 N ATOM 533 CA ILE A 104 -17.587 18.431 -13.286 1.00 16.14 C ATOM 534 C ILE A 104 -18.487 19.671 -13.140 1.00 16.57 C ATOM 535 O ILE A 104 -18.714 20.144 -12.031 1.00 16.12 O ATOM 536 CB ILE A 104 -16.116 18.793 -13.681 1.00 15.67 C ATOM 537 CG1 ILE A 104 -15.196 17.588 -13.419 1.00 16.95 C ATOM 538 CG2 ILE A 104 -15.598 20.034 -12.908 1.00 15.94 C ATOM 539 CD1 ILE A 104 -13.774 17.750 -13.972 1.00 16.13 C ATOM 540 H ILE A 104 -17.662 17.257 -15.121 1.00 0.00 H ATOM 541 N GLN A 105 -18.985 20.190 -14.263 1.00 16.84 N ATOM 542 CA GLN A 105 -19.853 21.366 -14.255 1.00 19.39 C ATOM 543 C GLN A 105 -21.132 21.113 -13.464 1.00 19.26 C ATOM 544 O GLN A 105 -21.558 21.979 -12.685 1.00 20.21 O ATOM 545 CB GLN A 105 -20.114 21.859 -15.701 1.00 19.36 C ATOM 546 CG GLN A 105 -18.867 22.556 -16.255 1.00 21.50 C ATOM 547 CD GLN A 105 -18.827 22.711 -17.792 1.00 22.82 C ATOM 548 OE1 GLN A 105 -19.580 22.069 -18.537 1.00 27.09 O ATOM 549 NE2 GLN A 105 -17.916 23.552 -18.261 1.00 25.09 N ATOM 550 HE22 GLN A 105 -17.302 24.073 -17.603 1.00 0.00 H ATOM 551 HE21 GLN A 105 -17.815 23.691 -19.287 1.00 0.00 H ATOM 552 H GLN A 105 -18.748 19.744 -15.172 1.00 0.00 H ATOM 553 N GLU A 106 -21.722 19.925 -13.627 1.00 18.53 N ATOM 554 CA GLU A 106 -22.952 19.585 -12.911 1.00 19.01 C ATOM 555 C GLU A 106 -22.718 19.400 -11.404 1.00 18.89 C ATOM 556 O GLU A 106 -23.450 19.944 -10.572 1.00 17.93 O ATOM 557 CB GLU A 106 -23.572 18.311 -13.462 1.00 18.87 C ATOM 558 CG GLU A 106 -24.795 17.873 -12.651 1.00 21.46 C ATOM 559 CD GLU A 106 -25.563 16.757 -13.315 1.00 24.63 C ATOM 560 OE1 GLU A 106 -25.244 16.421 -14.471 1.00 27.66 O ATOM 561 OE2 GLU A 106 -26.467 16.210 -12.662 1.00 24.03 O ATOM 562 H GLU A 106 -21.299 19.230 -14.274 1.00 0.00 H ATOM 563 N HIS A 107 -21.697 18.630 -11.065 1.00 18.07 N ATOM 564 CA HIS A 107 -21.519 18.186 -9.665 1.00 17.66 C ATOM 565 C HIS A 107 -20.597 19.068 -8.851 1.00 17.21 C ATOM 566 O HIS A 107 -20.596 18.998 -7.615 1.00 17.63 O ATOM 567 CB HIS A 107 -21.073 16.728 -9.634 1.00 17.32 C ATOM 568 CG HIS A 107 -22.114 15.786 -10.159 1.00 17.38 C ATOM 569 ND1 HIS A 107 -23.246 15.466 -9.446 1.00 15.02 N ATOM 570 CD2 HIS A 107 -22.210 15.121 -11.334 1.00 17.15 C ATOM 571 CE1 HIS A 107 -23.982 14.619 -10.139 1.00 14.77 C ATOM 572 NE2 HIS A 107 -23.382 14.401 -11.297 1.00 16.93 N ATOM 573 H HIS A 107 -21.013 18.334 -11.790 1.00 0.00 H ATOM 574 N GLN A 108 -19.872 19.949 -9.534 1.00 17.80 N ATOM 575 CA GLN A 108 -18.997 20.942 -8.875 1.00 18.60 C ATOM 576 C GLN A 108 -18.096 20.360 -7.774 1.00 18.00 C ATOM 577 O GLN A 108 -18.096 20.824 -6.637 1.00 17.66 O ATOM 578 CB GLN A 108 -19.816 22.111 -8.321 1.00 19.41 C ATOM 579 CG GLN A 108 -20.836 22.675 -9.304 1.00 22.83 C ATOM 580 CD GLN A 108 -21.501 23.916 -8.764 1.00 26.55 C ATOM 581 OE1 GLN A 108 -21.296 25.002 -9.283 1.00 31.97 O ATOM 582 NE2 GLN A 108 -22.264 23.771 -7.687 1.00 29.89 N ATOM 583 HE22 GLN A 108 -22.412 22.826 -7.278 1.00 0.00 H ATOM 584 HE21 GLN A 108 -22.714 24.602 -7.253 1.00 0.00 H ATOM 585 H GLN A 108 -19.922 19.939 -10.573 1.00 0.00 H ATOM 586 N PRO A 109 -17.292 19.349 -8.113 1.00 17.23 N ATOM 587 CA PRO A 109 -16.435 18.781 -7.073 1.00 16.31 C ATOM 588 C PRO A 109 -15.342 19.777 -6.668 1.00 16.86 C ATOM 589 O PRO A 109 -14.905 20.607 -7.495 1.00 17.78 O ATOM 590 CB PRO A 109 -15.811 17.578 -7.783 1.00 15.95 C ATOM 591 CG PRO A 109 -15.724 18.069 -9.247 1.00 14.92 C ATOM 592 CD PRO A 109 -17.073 18.711 -9.421 1.00 17.58 C ATOM 593 N SER A 110 -14.914 19.683 -5.413 1.00 16.47 N ATOM 594 CA SER A 110 -13.783 20.449 -4.904 1.00 17.10 C ATOM 595 C SER A 110 -12.607 19.557 -4.532 1.00 15.70 C ATOM 596 O SER A 110 -11.477 20.033 -4.419 1.00 16.53 O ATOM 597 CB SER A 110 -14.229 21.213 -3.650 1.00 17.27 C ATOM 598 OG SER A 110 -15.062 22.270 -4.075 1.00 21.95 O ATOM 599 HG SER A 110 -15.846 21.899 -4.553 1.00 0.00 H ATOM 600 H SER A 110 -15.407 19.035 -4.766 1.00 0.00 H ATOM 601 N VAL A 111 -12.879 18.286 -4.274 1.00 14.31 N ATOM 602 CA VAL A 111 -11.831 17.328 -3.978 1.00 13.76 C ATOM 603 C VAL A 111 -11.970 16.197 -5.001 1.00 13.37 C ATOM 604 O VAL A 111 -12.925 15.428 -4.960 1.00 12.42 O ATOM 605 CB VAL A 111 -11.945 16.790 -2.544 1.00 13.88 C ATOM 606 CG1 VAL A 111 -10.876 15.722 -2.263 1.00 14.80 C ATOM 607 CG2 VAL A 111 -11.843 17.957 -1.567 1.00 15.36 C ATOM 608 H VAL A 111 -13.869 17.967 -4.284 1.00 0.00 H ATOM 609 N LEU A 112 -11.010 16.140 -5.922 1.00 12.76 N ATOM 610 CA LEU A 112 -11.058 15.195 -7.020 1.00 13.04 C ATOM 611 C LEU A 112 -9.863 14.287 -6.979 1.00 13.36 C ATOM 612 O LEU A 112 -8.762 14.724 -6.627 1.00 13.17 O ATOM 613 CB LEU A 112 -11.062 15.923 -8.370 1.00 13.80 C ATOM 614 CG LEU A 112 -12.246 16.810 -8.721 1.00 17.70 C ATOM 615 CD1 LEU A 112 -12.136 18.185 -8.045 1.00 18.70 C ATOM 616 CD2 LEU A 112 -12.249 16.937 -10.253 1.00 17.81 C ATOM 617 H LEU A 112 -10.203 16.792 -5.852 1.00 0.00 H ATOM 618 N LEU A 113 -10.089 13.021 -7.326 1.00 12.00 N ATOM 619 CA LEU A 113 -8.997 12.067 -7.463 1.00 12.01 C ATOM 620 C LEU A 113 -8.963 11.514 -8.892 1.00 11.54 C ATOM 621 O LEU A 113 -10.009 11.103 -9.411 1.00 11.23 O ATOM 622 CB LEU A 113 -9.195 10.905 -6.494 1.00 11.32 C ATOM 623 CG LEU A 113 -8.183 9.752 -6.564 1.00 12.21 C ATOM 624 CD1 LEU A 113 -6.767 10.247 -6.231 1.00 11.86 C ATOM 625 CD2 LEU A 113 -8.607 8.638 -5.621 1.00 11.40 C ATOM 626 H LEU A 113 -11.065 12.707 -7.503 1.00 0.00 H ATOM 627 N GLU A 114 -7.777 11.467 -9.502 1.00 10.66 N ATOM 628 CA GLU A 114 -7.633 10.861 -10.830 1.00 11.65 C ATOM 629 C GLU A 114 -6.696 9.655 -10.723 1.00 11.08 C ATOM 630 O GLU A 114 -5.645 9.738 -10.123 1.00 11.96 O ATOM 631 CB GLU A 114 -7.107 11.883 -11.851 1.00 11.66 C ATOM 632 CG GLU A 114 -6.613 11.230 -13.167 1.00 12.89 C ATOM 633 CD GLU A 114 -6.154 12.275 -14.151 1.00 13.42 C ATOM 634 OE1 GLU A 114 -5.007 12.761 -14.047 1.00 12.37 O ATOM 635 OE2 GLU A 114 -6.973 12.628 -14.991 1.00 17.38 O ATOM 636 H GLU A 114 -6.942 11.866 -9.028 1.00 0.00 H ATOM 637 N LEU A 115 -7.087 8.534 -11.320 1.00 11.34 N ATOM 638 CA LEU A 115 -6.253 7.332 -11.339 1.00 11.32 C ATOM 639 C LEU A 115 -5.785 7.186 -12.782 1.00 12.09 C ATOM 640 O LEU A 115 -6.593 6.917 -13.675 1.00 12.52 O ATOM 641 CB LEU A 115 -7.065 6.119 -10.888 1.00 12.00 C ATOM 642 CG LEU A 115 -7.667 6.235 -9.469 1.00 11.05 C ATOM 643 CD1 LEU A 115 -8.399 4.947 -9.129 1.00 12.69 C ATOM 644 CD2 LEU A 115 -6.580 6.514 -8.412 1.00 10.61 C ATOM 645 H LEU A 115 -8.015 8.510 -11.789 1.00 0.00 H ATOM 646 N GLY A 116 -4.501 7.466 -12.984 1.00 12.06 N ATOM 647 CA GLY A 116 -3.817 7.385 -14.292 1.00 12.32 C ATOM 648 C GLY A 116 -3.717 8.754 -14.937 1.00 12.78 C ATOM 649 O GLY A 116 -4.709 9.264 -15.490 1.00 14.29 O ATOM 650 H GLY A 116 -3.937 7.764 -12.162 1.00 0.00 H ATOM 651 N ALA A 117 -2.523 9.356 -14.867 1.00 12.85 N ATOM 652 CA ALA A 117 -2.290 10.746 -15.319 1.00 11.77 C ATOM 653 C ALA A 117 -1.739 10.791 -16.740 1.00 12.84 C ATOM 654 O ALA A 117 -2.100 11.661 -17.533 1.00 11.97 O ATOM 655 CB ALA A 117 -1.296 11.435 -14.378 1.00 12.20 C ATOM 656 H ALA A 117 -1.721 8.821 -14.476 1.00 0.00 H ATOM 657 N TYR A 118 -0.835 9.848 -17.024 1.00 13.03 N ATOM 658 CA TYR A 118 -0.120 9.769 -18.297 1.00 13.03 C ATOM 659 C TYR A 118 0.671 11.045 -18.586 1.00 13.42 C ATOM 660 O TYR A 118 1.731 11.233 -17.972 1.00 12.50 O ATOM 661 CB TYR A 118 -1.066 9.392 -19.420 1.00 13.53 C ATOM 662 CG TYR A 118 -0.401 9.082 -20.740 1.00 15.44 C ATOM 663 CD1 TYR A 118 0.768 8.330 -20.803 1.00 16.20 C ATOM 664 CD2 TYR A 118 -0.978 9.525 -21.905 1.00 16.23 C ATOM 665 CE1 TYR A 118 1.374 8.041 -22.068 1.00 17.33 C ATOM 666 CE2 TYR A 118 -0.420 9.247 -23.143 1.00 18.69 C ATOM 667 CZ TYR A 118 0.749 8.512 -23.213 1.00 17.45 C ATOM 668 OH TYR A 118 1.254 8.279 -24.468 1.00 17.24 O ATOM 669 HH TYR A 118 0.588 7.779 -25.003 1.00 0.00 H ATOM 670 H TYR A 118 -0.629 9.131 -16.299 1.00 0.00 H ATOM 671 N CYS A 119 0.228 11.867 -19.549 1.00 13.40 N ATOM 672 CA CYS A 119 0.932 13.115 -19.857 1.00 14.23 C ATOM 673 C CYS A 119 0.277 14.362 -19.277 1.00 14.61 C ATOM 674 O CYS A 119 0.802 15.476 -19.481 1.00 14.27 O ATOM 675 CB CYS A 119 1.089 13.318 -21.364 1.00 14.26 C ATOM 676 SG CYS A 119 2.140 12.059 -22.148 1.00 18.07 S ATOM 677 H CYS A 119 -0.627 11.615 -20.085 1.00 0.00 H ATOM 678 N GLY A 120 -0.842 14.177 -18.577 1.00 13.39 N ATOM 679 CA GLY A 120 -1.495 15.254 -17.829 1.00 14.04 C ATOM 680 C GLY A 120 -2.667 15.913 -18.540 1.00 13.77 C ATOM 681 O GLY A 120 -3.187 16.934 -18.059 1.00 14.12 O ATOM 682 H GLY A 120 -1.269 13.229 -18.561 1.00 0.00 H ATOM 683 N TYR A 121 -3.078 15.362 -19.693 1.00 13.64 N ATOM 684 CA TYR A 121 -4.201 15.910 -20.470 1.00 13.29 C ATOM 685 C TYR A 121 -5.484 16.026 -19.645 1.00 13.01 C ATOM 686 O TYR A 121 -6.059 17.101 -19.542 1.00 13.14 O ATOM 687 CB TYR A 121 -4.452 15.100 -21.753 1.00 13.48 C ATOM 688 CG TYR A 121 -5.622 15.583 -22.575 1.00 14.31 C ATOM 689 CD1 TYR A 121 -5.446 16.505 -23.629 1.00 14.19 C ATOM 690 CD2 TYR A 121 -6.910 15.120 -22.308 1.00 13.59 C ATOM 691 CE1 TYR A 121 -6.535 16.936 -24.372 1.00 14.48 C ATOM 692 CE2 TYR A 121 -8.007 15.528 -23.061 1.00 14.68 C ATOM 693 CZ TYR A 121 -7.804 16.455 -24.088 1.00 15.01 C ATOM 694 OH TYR A 121 -8.890 16.865 -24.809 1.00 15.79 O ATOM 695 HH TYR A 121 -8.601 17.516 -25.497 1.00 0.00 H ATOM 696 H TYR A 121 -2.585 14.518 -20.050 1.00 0.00 H ATOM 697 N SER A 122 -5.927 14.921 -19.054 1.00 12.49 N ATOM 698 CA SER A 122 -7.145 14.977 -18.254 1.00 12.53 C ATOM 699 C SER A 122 -6.941 15.782 -16.981 1.00 12.70 C ATOM 700 O SER A 122 -7.892 16.423 -16.503 1.00 12.85 O ATOM 701 CB SER A 122 -7.689 13.576 -17.963 1.00 12.62 C ATOM 702 OG SER A 122 -6.680 12.792 -17.337 1.00 12.74 O ATOM 703 HG SER A 122 -6.408 13.223 -16.488 1.00 0.00 H ATOM 704 H SER A 122 -5.410 14.025 -19.161 1.00 0.00 H ATOM 705 N ALA A 123 -5.728 15.779 -16.425 1.00 12.46 N ATOM 706 CA ALA A 123 -5.492 16.575 -15.222 1.00 12.40 C ATOM 707 C ALA A 123 -5.674 18.072 -15.565 1.00 13.31 C ATOM 708 O ALA A 123 -6.326 18.835 -14.826 1.00 11.02 O ATOM 709 CB ALA A 123 -4.086 16.289 -14.619 1.00 12.40 C ATOM 710 H ALA A 123 -4.959 15.217 -16.843 1.00 0.00 H ATOM 711 N VAL A 124 -5.120 18.492 -16.701 1.00 13.57 N ATOM 712 CA VAL A 124 -5.291 19.888 -17.119 1.00 14.24 C ATOM 713 C VAL A 124 -6.752 20.181 -17.421 1.00 14.62 C ATOM 714 O VAL A 124 -7.305 21.214 -17.007 1.00 14.22 O ATOM 715 CB VAL A 124 -4.408 20.221 -18.352 1.00 14.20 C ATOM 716 CG1 VAL A 124 -4.882 21.563 -18.987 1.00 15.06 C ATOM 717 CG2 VAL A 124 -2.940 20.275 -17.933 1.00 16.48 C ATOM 718 H VAL A 124 -4.569 17.834 -17.289 1.00 0.00 H ATOM 719 N ARG A 125 -7.380 19.244 -18.133 1.00 14.51 N ATOM 720 CA ARG A 125 -8.761 19.349 -18.527 1.00 15.47 C ATOM 721 C ARG A 125 -9.689 19.534 -17.326 1.00 15.38 C ATOM 722 O ARG A 125 -10.543 20.406 -17.341 1.00 15.14 O ATOM 723 CB ARG A 125 -9.181 18.115 -19.318 1.00 15.99 C ATOM 724 CG ARG A 125 -10.600 18.200 -19.793 1.00 20.67 C ATOM 725 CD ARG A 125 -10.710 17.770 -21.240 1.00 21.90 C ATOM 726 NE ARG A 125 -11.900 18.380 -21.797 1.00 22.71 N ATOM 727 CZ ARG A 125 -12.058 18.765 -23.050 1.00 24.18 C ATOM 728 NH1 ARG A 125 -11.082 18.614 -23.937 1.00 25.31 N ATOM 729 NH2 ARG A 125 -13.210 19.310 -23.406 1.00 25.96 N ATOM 730 HE ARG A 125 -12.702 18.528 -21.152 1.00 0.00 H ATOM 731 HH12 ARG A 125 -11.221 18.922 -24.921 1.00 0.00 H ATOM 732 HH11 ARG A 125 -10.178 18.188 -23.648 1.00 0.00 H ATOM 733 HH22 ARG A 125 -13.357 19.621 -24.388 1.00 0.00 H ATOM 734 HH21 ARG A 125 -13.968 19.428 -22.704 1.00 0.00 H ATOM 735 H ARG A 125 -6.847 18.397 -18.417 1.00 0.00 H ATOM 736 N MET A 126 -9.504 18.728 -16.289 1.00 14.20 N ATOM 737 CA MET A 126 -10.328 18.865 -15.103 1.00 15.16 C ATOM 738 C MET A 126 -9.932 20.071 -14.261 1.00 14.91 C ATOM 739 O MET A 126 -10.800 20.790 -13.768 1.00 15.82 O ATOM 740 CB MET A 126 -10.273 17.581 -14.275 1.00 15.33 C ATOM 741 CG MET A 126 -10.872 16.382 -15.050 1.00 15.92 C ATOM 742 SD MET A 126 -11.126 14.930 -14.021 1.00 16.83 S ATOM 743 CE MET A 126 -9.428 14.435 -13.731 1.00 16.06 C ATOM 744 H MET A 126 -8.766 17.996 -16.326 1.00 0.00 H ATOM 745 N ALA A 127 -8.631 20.316 -14.106 1.00 14.77 N ATOM 746 CA ALA A 127 -8.202 21.384 -13.184 1.00 14.97 C ATOM 747 C ALA A 127 -8.627 22.763 -13.672 1.00 15.81 C ATOM 748 O ALA A 127 -8.981 23.625 -12.857 1.00 16.30 O ATOM 749 CB ALA A 127 -6.712 21.351 -12.946 1.00 14.48 C ATOM 750 H ALA A 127 -7.926 19.760 -14.630 1.00 0.00 H ATOM 751 N ARG A 128 -8.601 22.971 -14.990 1.00 15.50 N ATOM 752 CA ARG A 128 -9.002 24.269 -15.582 1.00 16.81 C ATOM 753 C ARG A 128 -10.422 24.708 -15.208 1.00 17.24 C ATOM 754 O ARG A 128 -10.749 25.899 -15.285 1.00 17.70 O ATOM 755 CB ARG A 128 -8.854 24.236 -17.097 1.00 16.74 C ATOM 756 CG ARG A 128 -10.029 23.658 -17.844 1.00 16.35 C ATOM 757 CD ARG A 128 -9.684 23.532 -19.330 1.00 16.23 C ATOM 758 NE ARG A 128 -10.877 23.542 -20.181 1.00 17.21 N ATOM 759 CZ ARG A 128 -11.795 22.579 -20.243 1.00 20.34 C ATOM 760 NH1 ARG A 128 -11.698 21.487 -19.486 1.00 17.09 N ATOM 761 NH2 ARG A 128 -12.829 22.705 -21.078 1.00 19.70 N ATOM 762 HE ARG A 128 -11.019 24.373 -20.789 1.00 0.00 H ATOM 763 HH12 ARG A 128 -12.424 20.745 -19.548 1.00 0.00 H ATOM 764 HH11 ARG A 128 -10.896 21.376 -18.833 1.00 0.00 H ATOM 765 HH22 ARG A 128 -13.549 21.956 -21.131 1.00 0.00 H ATOM 766 HH21 ARG A 128 -12.915 23.552 -21.676 1.00 0.00 H ATOM 767 H ARG A 128 -8.291 22.202 -15.618 1.00 0.00 H ATOM 768 N LEU A 129 -11.250 23.736 -14.844 1.00 17.43 N ATOM 769 CA LEU A 129 -12.653 23.959 -14.497 1.00 18.30 C ATOM 770 C LEU A 129 -12.883 24.206 -13.016 1.00 19.33 C ATOM 771 O LEU A 129 -13.990 24.574 -12.619 1.00 20.11 O ATOM 772 CB LEU A 129 -13.490 22.763 -14.937 1.00 18.15 C ATOM 773 CG LEU A 129 -13.520 22.495 -16.442 1.00 19.17 C ATOM 774 CD1 LEU A 129 -14.287 21.191 -16.673 1.00 22.60 C ATOM 775 CD2 LEU A 129 -14.149 23.653 -17.202 1.00 23.49 C ATOM 776 H LEU A 129 -10.881 22.764 -14.804 1.00 0.00 H ATOM 777 N LEU A 130 -11.857 24.001 -12.196 1.00 20.02 N ATOM 778 CA LEU A 130 -12.044 24.005 -10.737 1.00 20.97 C ATOM 779 C LEU A 130 -12.096 25.396 -10.136 1.00 21.84 C ATOM 780 O LEU A 130 -11.464 26.313 -10.647 1.00 21.70 O ATOM 781 CB LEU A 130 -10.955 23.170 -10.068 1.00 20.66 C ATOM 782 CG LEU A 130 -10.940 21.687 -10.478 1.00 19.90 C ATOM 783 CD1 LEU A 130 -9.986 20.938 -9.578 1.00 18.45 C ATOM 784 CD2 LEU A 130 -12.311 21.063 -10.419 1.00 21.28 C ATOM 785 H LEU A 130 -10.909 23.836 -12.591 1.00 0.00 H ATOM 786 N SER A 131 -12.858 25.545 -9.057 1.00 22.77 N ATOM 787 CA SER A 131 -12.936 26.827 -8.352 1.00 24.40 C ATOM 788 C SER A 131 -11.683 27.047 -7.509 1.00 24.61 C ATOM 789 O SER A 131 -10.946 26.098 -7.226 1.00 23.94 O ATOM 790 CB SER A 131 -14.167 26.850 -7.459 1.00 24.26 C ATOM 791 OG SER A 131 -15.325 26.615 -8.227 1.00 30.03 O ATOM 792 HG SER A 131 -15.256 25.729 -8.664 1.00 0.00 H ATOM 793 H SER A 131 -13.409 24.736 -8.706 1.00 0.00 H ATOM 794 N PRO A 132 -11.405 28.313 -7.129 1.00 25.68 N ATOM 795 CA PRO A 132 -10.342 28.559 -6.150 1.00 25.49 C ATOM 796 C PRO A 132 -10.454 27.659 -4.918 1.00 24.91 C ATOM 797 O PRO A 132 -11.540 27.468 -4.377 1.00 25.51 O ATOM 798 CB PRO A 132 -10.569 30.027 -5.768 1.00 25.79 C ATOM 799 CG PRO A 132 -11.132 30.627 -7.001 1.00 26.03 C ATOM 800 CD PRO A 132 -12.012 29.575 -7.609 1.00 26.09 C ATOM 801 N GLY A 133 -9.336 27.079 -4.508 1.00 24.85 N ATOM 802 CA GLY A 133 -9.319 26.185 -3.352 1.00 24.33 C ATOM 803 C GLY A 133 -9.703 24.725 -3.624 1.00 24.10 C ATOM 804 O GLY A 133 -9.664 23.898 -2.708 1.00 24.80 O ATOM 805 H GLY A 133 -8.450 27.264 -5.020 1.00 0.00 H ATOM 806 N ALA A 134 -10.091 24.400 -4.860 1.00 22.57 N ATOM 807 CA ALA A 134 -10.327 22.996 -5.224 1.00 20.75 C ATOM 808 C ALA A 134 -8.978 22.307 -5.452 1.00 19.66 C ATOM 809 O ALA A 134 -7.956 22.973 -5.676 1.00 19.09 O ATOM 810 CB ALA A 134 -11.268 22.880 -6.446 1.00 20.81 C ATOM 811 H ALA A 134 -10.227 25.147 -5.571 1.00 0.00 H ATOM 812 N ARG A 135 -8.959 20.980 -5.316 1.00 17.93 N ATOM 813 CA ARG A 135 -7.719 20.213 -5.333 1.00 17.87 C ATOM 814 C ARG A 135 -7.968 18.979 -6.192 1.00 17.31 C ATOM 815 O ARG A 135 -8.951 18.268 -5.971 1.00 16.70 O ATOM 816 CB ARG A 135 -7.341 19.747 -3.926 1.00 17.77 C ATOM 817 CG ARG A 135 -7.345 20.822 -2.800 1.00 21.30 C ATOM 818 CD ARG A 135 -6.126 21.773 -2.763 1.00 26.13 C ATOM 819 NE ARG A 135 -4.945 21.245 -3.458 1.00 25.57 N ATOM 820 CZ ARG A 135 -3.962 22.007 -3.943 1.00 26.43 C ATOM 821 NH1 ARG A 135 -3.984 23.327 -3.759 1.00 25.54 N ATOM 822 NH2 ARG A 135 -2.958 21.444 -4.613 1.00 23.08 N ATOM 823 HE ARG A 135 -4.870 20.215 -3.580 1.00 0.00 H ATOM 824 HH12 ARG A 135 -3.217 23.918 -4.138 1.00 0.00 H ATOM 825 HH11 ARG A 135 -4.769 23.766 -3.236 1.00 0.00 H ATOM 826 HH22 ARG A 135 -2.190 22.034 -4.992 1.00 0.00 H ATOM 827 HH21 ARG A 135 -2.942 20.414 -4.757 1.00 0.00 H ATOM 828 H ARG A 135 -9.860 20.475 -5.194 1.00 0.00 H ATOM 829 N LEU A 136 -7.098 18.743 -7.174 1.00 15.78 N ATOM 830 CA LEU A 136 -7.106 17.488 -7.909 1.00 14.49 C ATOM 831 C LEU A 136 -5.873 16.715 -7.473 1.00 13.96 C ATOM 832 O LEU A 136 -4.758 17.226 -7.610 1.00 14.76 O ATOM 833 CB LEU A 136 -7.034 17.725 -9.426 1.00 14.22 C ATOM 834 CG LEU A 136 -6.778 16.456 -10.265 1.00 14.99 C ATOM 835 CD1 LEU A 136 -7.909 15.416 -10.067 1.00 17.55 C ATOM 836 CD2 LEU A 136 -6.635 16.838 -11.744 1.00 15.56 C ATOM 837 H LEU A 136 -6.398 19.472 -7.420 1.00 0.00 H ATOM 838 N ILE A 137 -6.069 15.515 -6.919 1.00 12.55 N ATOM 839 CA ILE A 137 -4.954 14.602 -6.640 1.00 12.74 C ATOM 840 C ILE A 137 -4.954 13.624 -7.805 1.00 12.58 C ATOM 841 O ILE A 137 -5.994 13.059 -8.142 1.00 12.96 O ATOM 842 CB ILE A 137 -5.141 13.848 -5.297 1.00 12.47 C ATOM 843 CG1 ILE A 137 -5.121 14.867 -4.146 1.00 12.40 C ATOM 844 CG2 ILE A 137 -4.054 12.755 -5.090 1.00 12.08 C ATOM 845 CD1 ILE A 137 -5.587 14.308 -2.802 1.00 14.02 C ATOM 846 H ILE A 137 -7.037 15.220 -6.679 1.00 0.00 H ATOM 847 N THR A 138 -3.801 13.486 -8.454 1.00 12.42 N ATOM 848 CA THR A 138 -3.653 12.515 -9.543 1.00 12.77 C ATOM 849 C THR A 138 -2.510 11.538 -9.296 1.00 12.05 C ATOM 850 O THR A 138 -1.395 11.929 -8.892 1.00 12.10 O ATOM 851 CB THR A 138 -3.526 13.182 -10.959 1.00 12.52 C ATOM 852 OG1 THR A 138 -3.399 12.155 -11.949 1.00 13.42 O ATOM 853 CG2 THR A 138 -2.355 14.126 -11.071 1.00 13.47 C ATOM 854 HG1 THR A 138 -3.319 12.570 -12.844 1.00 0.00 H ATOM 855 H THR A 138 -2.989 14.078 -8.184 1.00 0.00 H ATOM 856 N ILE A 139 -2.798 10.254 -9.546 1.00 12.79 N ATOM 857 CA ILE A 139 -1.862 9.182 -9.206 1.00 13.03 C ATOM 858 C ILE A 139 -1.358 8.584 -10.505 1.00 12.32 C ATOM 859 O ILE A 139 -2.170 8.240 -11.378 1.00 13.69 O ATOM 860 CB ILE A 139 -2.529 8.070 -8.325 1.00 13.18 C ATOM 861 CG1 ILE A 139 -3.120 8.713 -7.069 1.00 13.00 C ATOM 862 CG2 ILE A 139 -1.473 7.008 -7.964 1.00 13.56 C ATOM 863 CD1 ILE A 139 -3.962 7.783 -6.181 1.00 15.37 C ATOM 864 H ILE A 139 -3.707 10.014 -9.991 1.00 0.00 H ATOM 865 N GLU A 140 -0.033 8.459 -10.620 1.00 13.02 N ATOM 866 CA GLU A 140 0.600 7.902 -11.813 1.00 13.80 C ATOM 867 C GLU A 140 1.766 6.975 -11.417 1.00 13.91 C ATOM 868 O GLU A 140 2.672 7.384 -10.702 1.00 13.54 O ATOM 869 CB GLU A 140 1.087 9.038 -12.720 1.00 13.96 C ATOM 870 CG GLU A 140 1.939 8.587 -13.915 1.00 14.27 C ATOM 871 CD GLU A 140 1.250 7.551 -14.777 1.00 13.34 C ATOM 872 OE1 GLU A 140 0.116 7.802 -15.234 1.00 13.12 O ATOM 873 OE2 GLU A 140 1.845 6.481 -15.019 1.00 14.50 O ATOM 874 H GLU A 140 0.570 8.770 -9.832 1.00 0.00 H ATOM 875 N ILE A 141 1.741 5.739 -11.904 1.00 14.93 N ATOM 876 CA ILE A 141 2.698 4.724 -11.469 1.00 15.52 C ATOM 877 C ILE A 141 4.071 4.866 -12.159 1.00 15.88 C ATOM 878 O ILE A 141 5.101 4.503 -11.592 1.00 15.98 O ATOM 879 CB ILE A 141 2.113 3.291 -11.674 1.00 16.11 C ATOM 880 CG1 ILE A 141 2.955 2.231 -10.949 1.00 15.60 C ATOM 881 CG2 ILE A 141 1.908 2.968 -13.181 1.00 16.57 C ATOM 882 CD1 ILE A 141 2.208 0.856 -10.884 1.00 16.53 C ATOM 883 H ILE A 141 1.022 5.488 -12.612 1.00 0.00 H ATOM 884 N ASN A 142 4.057 5.386 -13.380 1.00 16.78 N ATOM 885 CA ASN A 142 5.269 5.499 -14.179 1.00 17.62 C ATOM 886 C ASN A 142 5.940 6.846 -13.946 1.00 17.76 C ATOM 887 O ASN A 142 5.366 7.889 -14.272 1.00 17.95 O ATOM 888 CB ASN A 142 4.921 5.290 -15.657 1.00 17.73 C ATOM 889 CG ASN A 142 6.143 5.369 -16.570 1.00 21.47 C ATOM 890 OD1 ASN A 142 6.722 6.436 -16.767 1.00 25.21 O ATOM 891 ND2 ASN A 142 6.515 4.240 -17.152 1.00 24.92 N ATOM 892 HD22 ASN A 142 5.997 3.359 -16.957 1.00 0.00 H ATOM 893 HD21 ASN A 142 7.325 4.233 -17.804 1.00 0.00 H ATOM 894 H ASN A 142 3.156 5.722 -13.777 1.00 0.00 H ATOM 895 N PRO A 143 7.158 6.832 -13.375 1.00 18.32 N ATOM 896 CA PRO A 143 7.875 8.059 -13.000 1.00 18.55 C ATOM 897 C PRO A 143 8.168 8.971 -14.194 1.00 18.61 C ATOM 898 O PRO A 143 8.104 10.178 -14.049 1.00 17.88 O ATOM 899 CB PRO A 143 9.169 7.542 -12.353 1.00 19.31 C ATOM 900 CG PRO A 143 8.857 6.121 -11.964 1.00 20.11 C ATOM 901 CD PRO A 143 7.900 5.620 -12.989 1.00 19.26 C ATOM 902 N ASP A 144 8.463 8.400 -15.361 1.00 18.75 N ATOM 903 CA ASP A 144 8.663 9.229 -16.564 1.00 19.23 C ATOM 904 C ASP A 144 7.407 9.967 -16.999 1.00 19.09 C ATOM 905 O ASP A 144 7.454 11.159 -17.329 1.00 19.05 O ATOM 906 CB ASP A 144 9.201 8.383 -17.701 1.00 19.42 C ATOM 907 CG ASP A 144 10.569 7.830 -17.398 1.00 23.44 C ATOM 908 OD1 ASP A 144 11.287 8.403 -16.559 1.00 26.33 O ATOM 909 OD2 ASP A 144 10.928 6.813 -18.008 1.00 27.74 O ATOM 910 H ASP A 144 8.553 7.366 -15.424 1.00 0.00 H ATOM 911 N CYS A 145 6.281 9.263 -16.970 1.00 19.36 N ATOM 912 CA CYS A 145 4.994 9.874 -17.263 1.00 20.11 C ATOM 913 C CYS A 145 4.674 10.957 -16.231 1.00 19.39 C ATOM 914 O CYS A 145 4.242 12.067 -16.587 1.00 19.23 O ATOM 915 CB CYS A 145 3.901 8.817 -17.285 1.00 20.52 C ATOM 916 SG CYS A 145 3.944 7.893 -18.806 1.00 26.48 S ATOM 917 H CYS A 145 6.321 8.251 -16.732 1.00 0.00 H ATOM 918 N ALA A 146 4.884 10.635 -14.956 1.00 17.37 N ATOM 919 CA ALA A 146 4.610 11.609 -13.890 1.00 16.57 C ATOM 920 C ALA A 146 5.415 12.908 -14.110 1.00 15.89 C ATOM 921 O ALA A 146 4.890 14.005 -13.963 1.00 15.95 O ATOM 922 CB ALA A 146 4.909 10.996 -12.530 1.00 16.33 C ATOM 923 H ALA A 146 5.244 9.690 -14.713 1.00 0.00 H ATOM 924 N ALA A 147 6.683 12.778 -14.495 1.00 16.32 N ATOM 925 CA ALA A 147 7.532 13.950 -14.735 1.00 16.19 C ATOM 926 C ALA A 147 6.949 14.810 -15.874 1.00 16.32 C ATOM 927 O ALA A 147 6.923 16.042 -15.760 1.00 15.97 O ATOM 928 CB ALA A 147 8.969 13.541 -15.026 1.00 17.17 C ATOM 929 H ALA A 147 7.080 11.826 -14.628 1.00 0.00 H ATOM 930 N ILE A 148 6.449 14.166 -16.934 1.00 16.12 N ATOM 931 CA ILE A 148 5.815 14.875 -18.045 1.00 16.24 C ATOM 932 C ILE A 148 4.544 15.573 -17.561 1.00 16.37 C ATOM 933 O ILE A 148 4.285 16.755 -17.871 1.00 14.87 O ATOM 934 CB ILE A 148 5.436 13.894 -19.203 1.00 17.47 C ATOM 935 CG1 ILE A 148 6.650 13.130 -19.757 1.00 19.65 C ATOM 936 CG2 ILE A 148 4.686 14.600 -20.318 1.00 17.39 C ATOM 937 CD1 ILE A 148 7.631 13.950 -20.475 1.00 23.80 C ATOM 938 H ILE A 148 6.513 13.129 -16.969 1.00 0.00 H ATOM 939 N THR A 149 3.748 14.835 -16.784 1.00 14.58 N ATOM 940 CA THR A 149 2.488 15.368 -16.273 1.00 13.55 C ATOM 941 C THR A 149 2.720 16.644 -15.478 1.00 12.97 C ATOM 942 O THR A 149 1.943 17.591 -15.623 1.00 13.29 O ATOM 943 CB THR A 149 1.752 14.332 -15.399 1.00 13.15 C ATOM 944 OG1 THR A 149 1.231 13.314 -16.251 1.00 14.01 O ATOM 945 CG2 THR A 149 0.555 14.973 -14.641 1.00 12.70 C ATOM 946 HG1 THR A 149 1.976 12.880 -16.738 1.00 0.00 H ATOM 947 H THR A 149 4.030 13.864 -16.539 1.00 0.00 H ATOM 948 N GLN A 150 3.750 16.664 -14.625 1.00 12.94 N ATOM 949 CA GLN A 150 4.013 17.853 -13.808 1.00 14.04 C ATOM 950 C GLN A 150 4.404 19.004 -14.719 1.00 14.43 C ATOM 951 O GLN A 150 3.980 20.135 -14.488 1.00 13.70 O ATOM 952 CB GLN A 150 5.086 17.613 -12.740 1.00 14.25 C ATOM 953 CG GLN A 150 5.204 18.771 -11.708 1.00 13.74 C ATOM 954 CD GLN A 150 3.933 18.944 -10.867 1.00 14.81 C ATOM 955 OE1 GLN A 150 3.208 19.967 -10.988 1.00 16.46 O ATOM 956 NE2 GLN A 150 3.649 17.958 -10.027 1.00 8.82 N ATOM 957 HE22 GLN A 150 4.278 17.133 -9.962 1.00 0.00 H ATOM 958 HE21 GLN A 150 2.797 18.010 -9.433 1.00 0.00 H ATOM 959 H GLN A 150 4.368 15.832 -14.541 1.00 0.00 H ATOM 960 N ARG A 151 5.182 18.717 -15.765 1.00 14.41 N ATOM 961 CA ARG A 151 5.554 19.794 -16.684 1.00 15.40 C ATOM 962 C ARG A 151 4.356 20.313 -17.426 1.00 13.92 C ATOM 963 O ARG A 151 4.250 21.531 -17.663 1.00 14.12 O ATOM 964 CB ARG A 151 6.657 19.371 -17.640 1.00 16.20 C ATOM 965 CG ARG A 151 7.929 19.089 -16.844 1.00 20.43 C ATOM 966 CD ARG A 151 9.160 19.617 -17.490 1.00 27.58 C ATOM 967 NE ARG A 151 8.995 20.828 -18.299 1.00 29.80 N ATOM 968 CZ ARG A 151 9.860 21.147 -19.258 1.00 31.62 C ATOM 969 NH1 ARG A 151 10.899 20.348 -19.472 1.00 31.30 N ATOM 970 NH2 ARG A 151 9.703 22.242 -19.990 1.00 31.15 N ATOM 971 HE ARG A 151 8.183 21.452 -18.119 1.00 0.00 H ATOM 972 HH12 ARG A 151 11.587 20.578 -20.217 1.00 0.00 H ATOM 973 HH11 ARG A 151 11.024 19.492 -18.895 1.00 0.00 H ATOM 974 HH22 ARG A 151 10.391 22.473 -20.735 1.00 0.00 H ATOM 975 HH21 ARG A 151 8.892 22.870 -19.819 1.00 0.00 H ATOM 976 H ARG A 151 5.518 17.746 -15.924 1.00 0.00 H ATOM 977 N MET A 152 3.473 19.398 -17.814 1.00 13.24 N ATOM 978 CA MET A 152 2.256 19.750 -18.536 1.00 13.11 C ATOM 979 C MET A 152 1.352 20.628 -17.653 1.00 13.52 C ATOM 980 O MET A 152 0.834 21.668 -18.087 1.00 12.16 O ATOM 981 CB MET A 152 1.496 18.496 -18.988 1.00 12.90 C ATOM 982 CG MET A 152 0.432 18.740 -20.040 1.00 13.77 C ATOM 983 SD MET A 152 1.212 19.161 -21.645 1.00 15.16 S ATOM 984 CE MET A 152 1.779 17.541 -22.180 1.00 14.78 C ATOM 985 H MET A 152 3.656 18.398 -17.595 1.00 0.00 H ATOM 986 N VAL A 153 1.176 20.200 -16.414 1.00 13.18 N ATOM 987 CA VAL A 153 0.351 20.938 -15.441 1.00 13.76 C ATOM 988 C VAL A 153 0.878 22.344 -15.189 1.00 13.64 C ATOM 989 O VAL A 153 0.113 23.339 -15.161 1.00 13.92 O ATOM 990 CB VAL A 153 0.250 20.061 -14.146 1.00 14.62 C ATOM 991 CG1 VAL A 153 0.030 20.854 -12.891 1.00 16.14 C ATOM 992 CG2 VAL A 153 -0.840 18.987 -14.359 1.00 12.84 C ATOM 993 H VAL A 153 1.634 19.315 -16.117 1.00 0.00 H ATOM 994 N ASP A 154 2.189 22.437 -15.011 1.00 14.03 N ATOM 995 CA ASP A 154 2.834 23.721 -14.737 1.00 14.29 C ATOM 996 C ASP A 154 2.623 24.645 -15.930 1.00 14.93 C ATOM 997 O ASP A 154 2.162 25.781 -15.774 1.00 14.33 O ATOM 998 CB ASP A 154 4.319 23.505 -14.466 1.00 14.68 C ATOM 999 CG ASP A 154 4.590 22.828 -13.125 1.00 17.26 C ATOM 1000 OD1 ASP A 154 3.647 22.534 -12.367 1.00 19.13 O ATOM 1001 OD2 ASP A 154 5.768 22.589 -12.831 1.00 21.92 O ATOM 1002 H ASP A 154 2.772 21.577 -15.068 1.00 0.00 H ATOM 1003 N PHE A 155 2.914 24.125 -17.122 1.00 14.51 N ATOM 1004 CA PHE A 155 2.822 24.916 -18.355 1.00 14.33 C ATOM 1005 C PHE A 155 1.413 25.434 -18.589 1.00 15.18 C ATOM 1006 O PHE A 155 1.233 26.572 -19.004 1.00 15.55 O ATOM 1007 CB PHE A 155 3.266 24.079 -19.555 1.00 14.48 C ATOM 1008 CG PHE A 155 3.351 24.872 -20.842 1.00 13.65 C ATOM 1009 CD1 PHE A 155 4.466 25.660 -21.108 1.00 15.77 C ATOM 1010 CD2 PHE A 155 2.333 24.815 -21.775 1.00 15.53 C ATOM 1011 CE1 PHE A 155 4.537 26.401 -22.317 1.00 15.51 C ATOM 1012 CE2 PHE A 155 2.399 25.561 -22.972 1.00 14.88 C ATOM 1013 CZ PHE A 155 3.512 26.332 -23.234 1.00 14.33 C ATOM 1014 H PHE A 155 3.215 23.131 -17.180 1.00 0.00 H ATOM 1015 N ALA A 156 0.415 24.586 -18.335 1.00 14.11 N ATOM 1016 CA ALA A 156 -0.982 24.952 -18.538 1.00 14.52 C ATOM 1017 C ALA A 156 -1.520 25.966 -17.507 1.00 14.42 C ATOM 1018 O ALA A 156 -2.647 26.440 -17.633 1.00 16.18 O ATOM 1019 CB ALA A 156 -1.855 23.695 -18.575 1.00 14.77 C ATOM 1020 H ALA A 156 0.640 23.634 -17.981 1.00 0.00 H ATOM 1021 N GLY A 157 -0.730 26.288 -16.489 1.00 14.56 N ATOM 1022 CA GLY A 157 -1.135 27.327 -15.522 1.00 14.37 C ATOM 1023 C GLY A 157 -1.989 26.811 -14.373 1.00 14.84 C ATOM 1024 O GLY A 157 -2.595 27.600 -13.661 1.00 15.52 O ATOM 1025 H GLY A 157 0.183 25.803 -16.372 1.00 0.00 H ATOM 1026 N VAL A 158 -2.028 25.489 -14.177 1.00 15.00 N ATOM 1027 CA VAL A 158 -2.955 24.889 -13.197 1.00 15.12 C ATOM 1028 C VAL A 158 -2.227 24.180 -12.043 1.00 14.81 C ATOM 1029 O VAL A 158 -2.842 23.430 -11.271 1.00 14.35 O ATOM 1030 CB VAL A 158 -3.990 23.939 -13.832 1.00 15.93 C ATOM 1031 CG1 VAL A 158 -4.980 24.723 -14.761 1.00 16.34 C ATOM 1032 CG2 VAL A 158 -3.301 22.730 -14.548 1.00 15.53 C ATOM 1033 H VAL A 158 -1.394 24.872 -14.725 1.00 0.00 H ATOM 1034 N LYS A 159 -0.933 24.451 -11.922 1.00 14.02 N ATOM 1035 CA LYS A 159 -0.056 23.829 -10.912 1.00 15.43 C ATOM 1036 C LYS A 159 -0.658 23.867 -9.496 1.00 14.53 C ATOM 1037 O LYS A 159 -0.556 22.900 -8.744 1.00 13.98 O ATOM 1038 CB LYS A 159 1.278 24.577 -10.906 1.00 15.95 C ATOM 1039 CG LYS A 159 2.245 24.211 -9.841 1.00 20.54 C ATOM 1040 CD LYS A 159 3.533 25.009 -9.992 1.00 24.45 C ATOM 1041 CE LYS A 159 4.667 24.316 -9.250 1.00 28.28 C ATOM 1042 NZ LYS A 159 4.946 22.957 -9.872 1.00 30.53 N ATOM 1043 HZ1 LYS A 159 4.090 22.369 -9.815 1.00 0.00 H ATOM 1044 HZ2 LYS A 159 5.216 23.082 -10.869 1.00 0.00 H ATOM 1045 HZ3 LYS A 159 5.722 22.494 -9.357 1.00 0.00 H ATOM 1046 H LYS A 159 -0.514 25.141 -12.577 1.00 0.00 H ATOM 1047 N ASP A 160 -1.251 25.003 -9.133 1.00 15.47 N ATOM 1048 CA ASP A 160 -1.728 25.187 -7.769 1.00 15.75 C ATOM 1049 C ASP A 160 -2.907 24.307 -7.403 1.00 16.35 C ATOM 1050 O ASP A 160 -3.162 24.110 -6.221 1.00 17.48 O ATOM 1051 CB ASP A 160 -2.087 26.659 -7.516 1.00 15.64 C ATOM 1052 CG ASP A 160 -0.855 27.538 -7.355 1.00 21.11 C ATOM 1053 OD1 ASP A 160 0.289 27.029 -7.529 1.00 24.55 O ATOM 1054 OD2 ASP A 160 -1.050 28.747 -7.080 1.00 26.56 O ATOM 1055 H ASP A 160 -1.375 25.765 -9.830 1.00 0.00 H ATOM 1056 N LYS A 161 -3.611 23.788 -8.411 1.00 16.01 N ATOM 1057 CA LYS A 161 -4.801 22.936 -8.207 1.00 16.02 C ATOM 1058 C LYS A 161 -4.472 21.448 -8.142 1.00 14.71 C ATOM 1059 O LYS A 161 -5.340 20.648 -7.823 1.00 15.95 O ATOM 1060 CB LYS A 161 -5.788 23.101 -9.369 1.00 16.65 C ATOM 1061 CG LYS A 161 -6.212 24.535 -9.704 1.00 21.02 C ATOM 1062 CD LYS A 161 -7.276 25.014 -8.724 1.00 25.78 C ATOM 1063 CE LYS A 161 -7.944 26.322 -9.170 1.00 27.76 C ATOM 1064 NZ LYS A 161 -6.974 27.450 -9.064 1.00 29.71 N ATOM 1065 HZ1 LYS A 161 -6.660 27.544 -8.077 1.00 0.00 H ATOM 1066 HZ2 LYS A 161 -6.153 27.258 -9.673 1.00 0.00 H ATOM 1067 HZ3 LYS A 161 -7.435 28.331 -9.368 1.00 0.00 H ATOM 1068 H LYS A 161 -3.308 23.993 -9.385 1.00 0.00 H ATOM 1069 N VAL A 162 -3.244 21.085 -8.491 1.00 13.14 N ATOM 1070 CA VAL A 162 -2.872 19.682 -8.731 1.00 11.37 C ATOM 1071 C VAL A 162 -1.847 19.162 -7.736 1.00 11.13 C ATOM 1072 O VAL A 162 -0.802 19.800 -7.486 1.00 11.86 O ATOM 1073 CB VAL A 162 -2.314 19.489 -10.195 1.00 11.71 C ATOM 1074 CG1 VAL A 162 -1.839 18.060 -10.437 1.00 12.87 C ATOM 1075 CG2 VAL A 162 -3.373 19.900 -11.225 1.00 12.10 C ATOM 1076 H VAL A 162 -2.517 21.821 -8.599 1.00 0.00 H ATOM 1077 N THR A 163 -2.157 17.997 -7.178 1.00 10.46 N ATOM 1078 CA THR A 163 -1.203 17.219 -6.417 1.00 10.83 C ATOM 1079 C THR A 163 -0.934 15.882 -7.117 1.00 10.87 C ATOM 1080 O THR A 163 -1.755 14.978 -7.089 1.00 10.64 O ATOM 1081 CB THR A 163 -1.690 16.990 -4.963 1.00 10.58 C ATOM 1082 OG1 THR A 163 -1.973 18.262 -4.348 1.00 10.85 O ATOM 1083 CG2 THR A 163 -0.617 16.246 -4.171 1.00 10.48 C ATOM 1084 HG1 THR A 163 -2.284 18.116 -3.419 1.00 0.00 H ATOM 1085 H THR A 163 -3.123 17.630 -7.293 1.00 0.00 H ATOM 1086 N LEU A 164 0.231 15.789 -7.763 1.00 11.61 N ATOM 1087 CA LEU A 164 0.629 14.603 -8.495 1.00 11.98 C ATOM 1088 C LEU A 164 1.381 13.685 -7.564 1.00 12.53 C ATOM 1089 O LEU A 164 2.302 14.125 -6.887 1.00 12.90 O ATOM 1090 CB LEU A 164 1.550 15.002 -9.638 1.00 12.84 C ATOM 1091 CG LEU A 164 2.264 13.858 -10.370 1.00 12.49 C ATOM 1092 CD1 LEU A 164 1.257 12.983 -11.156 1.00 13.59 C ATOM 1093 CD2 LEU A 164 3.301 14.492 -11.284 1.00 12.36 C ATOM 1094 H LEU A 164 0.880 16.601 -7.740 1.00 0.00 H ATOM 1095 N VAL A 165 0.961 12.421 -7.506 1.00 12.15 N ATOM 1096 CA VAL A 165 1.557 11.413 -6.653 1.00 12.12 C ATOM 1097 C VAL A 165 2.082 10.270 -7.518 1.00 13.00 C ATOM 1098 O VAL A 165 1.316 9.598 -8.210 1.00 13.36 O ATOM 1099 CB VAL A 165 0.518 10.815 -5.646 1.00 11.68 C ATOM 1100 CG1 VAL A 165 1.217 9.808 -4.704 1.00 11.45 C ATOM 1101 CG2 VAL A 165 -0.161 11.929 -4.854 1.00 10.54 C ATOM 1102 H VAL A 165 0.160 12.143 -8.108 1.00 0.00 H ATOM 1103 N VAL A 166 3.390 10.068 -7.476 1.00 14.03 N ATOM 1104 CA VAL A 166 4.018 8.947 -8.195 1.00 14.81 C ATOM 1105 C VAL A 166 3.839 7.706 -7.353 1.00 14.62 C ATOM 1106 O VAL A 166 4.211 7.694 -6.176 1.00 16.53 O ATOM 1107 CB VAL A 166 5.529 9.173 -8.443 1.00 15.75 C ATOM 1108 CG1 VAL A 166 6.073 8.079 -9.341 1.00 16.28 C ATOM 1109 CG2 VAL A 166 5.769 10.533 -9.091 1.00 16.22 C ATOM 1110 H VAL A 166 3.987 10.716 -6.923 1.00 0.00 H ATOM 1111 N GLY A 167 3.257 6.669 -7.941 1.00 14.86 N ATOM 1112 CA GLY A 167 3.025 5.423 -7.206 1.00 14.88 C ATOM 1113 C GLY A 167 1.842 4.659 -7.758 1.00 14.60 C ATOM 1114 O GLY A 167 1.145 5.160 -8.648 1.00 15.04 O ATOM 1115 H GLY A 167 2.962 6.741 -8.936 1.00 0.00 H ATOM 1116 N ALA A 168 1.640 3.443 -7.254 1.00 13.80 N ATOM 1117 CA ALA A 168 0.552 2.577 -7.694 1.00 13.56 C ATOM 1118 C ALA A 168 -0.677 2.969 -6.897 1.00 12.42 C ATOM 1119 O ALA A 168 -0.589 3.173 -5.674 1.00 12.44 O ATOM 1120 CB ALA A 168 0.880 1.127 -7.404 1.00 13.55 C ATOM 1121 H ALA A 168 2.285 3.096 -6.516 1.00 0.00 H ATOM 1122 N SER A 169 -1.803 3.058 -7.584 1.00 12.71 N ATOM 1123 CA SER A 169 -3.058 3.439 -6.929 1.00 12.84 C ATOM 1124 C SER A 169 -3.341 2.585 -5.688 1.00 13.26 C ATOM 1125 O SER A 169 -3.785 3.101 -4.666 1.00 13.13 O ATOM 1126 CB SER A 169 -4.205 3.313 -7.945 1.00 12.61 C ATOM 1127 OG SER A 169 -4.295 1.992 -8.428 1.00 13.31 O ATOM 1128 HG SER A 169 -5.038 1.930 -9.080 1.00 0.00 H ATOM 1129 H SER A 169 -1.798 2.855 -8.604 1.00 0.00 H ATOM 1130 N GLN A 170 -3.069 1.279 -5.754 1.00 13.30 N ATOM 1131 CA GLN A 170 -3.407 0.421 -4.611 1.00 14.88 C ATOM 1132 C GLN A 170 -2.551 0.710 -3.378 1.00 15.12 C ATOM 1133 O GLN A 170 -2.980 0.431 -2.260 1.00 15.87 O ATOM 1134 CB GLN A 170 -3.393 -1.080 -4.971 1.00 15.12 C ATOM 1135 CG GLN A 170 -2.031 -1.646 -5.317 1.00 17.56 C ATOM 1136 CD GLN A 170 -1.619 -1.455 -6.776 1.00 20.52 C ATOM 1137 OE1 GLN A 170 -2.254 -0.732 -7.551 1.00 18.15 O ATOM 1138 NE2 GLN A 170 -0.540 -2.134 -7.160 1.00 24.60 N ATOM 1139 HE22 GLN A 170 -0.032 -2.732 -6.478 1.00 0.00 H ATOM 1140 HE21 GLN A 170 -0.205 -2.066 -8.142 1.00 0.00 H ATOM 1141 H GLN A 170 -2.624 0.875 -6.603 1.00 0.00 H ATOM 1142 N ASP A 171 -1.355 1.282 -3.584 1.00 15.03 N ATOM 1143 CA ASP A 171 -0.448 1.680 -2.499 1.00 15.54 C ATOM 1144 C ASP A 171 -0.797 3.074 -1.974 1.00 15.04 C ATOM 1145 O ASP A 171 -0.658 3.349 -0.793 1.00 14.82 O ATOM 1146 CB ASP A 171 1.017 1.669 -2.961 1.00 17.16 C ATOM 1147 CG ASP A 171 1.508 0.266 -3.340 1.00 18.10 C ATOM 1148 OD1 ASP A 171 0.981 -0.721 -2.802 1.00 19.97 O ATOM 1149 OD2 ASP A 171 2.400 0.146 -4.196 1.00 21.87 O ATOM 1150 H ASP A 171 -1.054 1.453 -4.565 1.00 0.00 H ATOM 1151 N ILE A 172 -1.250 3.955 -2.858 1.00 13.52 N ATOM 1152 CA ILE A 172 -1.431 5.346 -2.482 1.00 12.69 C ATOM 1153 C ILE A 172 -2.810 5.553 -1.845 1.00 12.62 C ATOM 1154 O ILE A 172 -2.968 6.309 -0.909 1.00 12.98 O ATOM 1155 CB ILE A 172 -1.267 6.271 -3.691 1.00 12.89 C ATOM 1156 CG1 ILE A 172 0.192 6.212 -4.202 1.00 14.38 C ATOM 1157 CG2 ILE A 172 -1.671 7.686 -3.340 1.00 13.46 C ATOM 1158 CD1 ILE A 172 1.240 6.533 -3.132 1.00 18.74 C ATOM 1159 H ILE A 172 -1.477 3.647 -3.825 1.00 0.00 H ATOM 1160 N ILE A 173 -3.795 4.855 -2.367 1.00 11.80 N ATOM 1161 CA ILE A 173 -5.143 5.095 -1.912 1.00 11.93 C ATOM 1162 C ILE A 173 -5.452 4.911 -0.405 1.00 12.47 C ATOM 1163 O ILE A 173 -5.958 5.857 0.212 1.00 12.34 O ATOM 1164 CB ILE A 173 -6.169 4.200 -2.704 1.00 11.81 C ATOM 1165 CG1 ILE A 173 -6.487 4.797 -4.076 1.00 12.27 C ATOM 1166 CG2 ILE A 173 -7.498 4.034 -1.926 1.00 11.86 C ATOM 1167 CD1 ILE A 173 -7.121 3.815 -5.069 1.00 10.57 C ATOM 1168 H ILE A 173 -3.605 4.140 -3.098 1.00 0.00 H ATOM 1169 N PRO A 174 -4.954 3.844 0.249 1.00 13.50 N ATOM 1170 CA PRO A 174 -4.721 3.791 1.706 1.00 14.60 C ATOM 1171 C PRO A 174 -4.065 4.880 2.474 1.00 14.97 C ATOM 1172 O PRO A 174 -4.308 4.983 3.681 1.00 14.67 O ATOM 1173 CB PRO A 174 -4.062 2.426 1.930 1.00 14.40 C ATOM 1174 CG PRO A 174 -4.439 1.606 0.652 1.00 14.17 C ATOM 1175 CD PRO A 174 -4.350 2.658 -0.404 1.00 13.10 C ATOM 1176 N GLN A 175 -3.274 5.700 1.785 1.00 14.83 N ATOM 1177 CA GLN A 175 -2.527 6.776 2.427 1.00 15.44 C ATOM 1178 C GLN A 175 -3.229 8.125 2.278 1.00 14.10 C ATOM 1179 O GLN A 175 -2.800 9.127 2.879 1.00 13.45 O ATOM 1180 CB GLN A 175 -1.149 6.871 1.767 1.00 15.83 C ATOM 1181 CG GLN A 175 -0.330 5.588 1.756 1.00 17.41 C ATOM 1182 CD GLN A 175 0.975 5.766 0.949 1.00 19.20 C ATOM 1183 OE1 GLN A 175 1.084 6.669 0.133 1.00 23.80 O ATOM 1184 NE2 GLN A 175 1.950 4.908 1.189 1.00 24.44 N ATOM 1185 HE22 GLN A 175 1.817 4.153 1.892 1.00 0.00 H ATOM 1186 HE21 GLN A 175 2.851 4.987 0.675 1.00 0.00 H ATOM 1187 H GLN A 175 -3.186 5.569 0.757 1.00 0.00 H ATOM 1188 N LEU A 176 -4.281 8.195 1.447 1.00 12.55 N ATOM 1189 CA LEU A 176 -4.831 9.516 1.104 1.00 12.56 C ATOM 1190 C LEU A 176 -5.305 10.287 2.322 1.00 12.81 C ATOM 1191 O LEU A 176 -5.068 11.476 2.416 1.00 12.39 O ATOM 1192 CB LEU A 176 -5.994 9.422 0.085 1.00 13.71 C ATOM 1193 CG LEU A 176 -5.508 8.989 -1.297 1.00 12.75 C ATOM 1194 CD1 LEU A 176 -6.657 8.643 -2.218 1.00 13.83 C ATOM 1195 CD2 LEU A 176 -4.656 10.095 -1.939 1.00 14.03 C ATOM 1196 H LEU A 176 -4.701 7.329 1.052 1.00 0.00 H ATOM 1197 N LYS A 177 -5.965 9.608 3.255 1.00 12.78 N ATOM 1198 CA LYS A 177 -6.490 10.316 4.409 1.00 13.58 C ATOM 1199 C LYS A 177 -5.341 10.869 5.278 1.00 14.35 C ATOM 1200 O LYS A 177 -5.291 12.068 5.539 1.00 15.08 O ATOM 1201 CB LYS A 177 -7.425 9.415 5.236 1.00 13.79 C ATOM 1202 CG LYS A 177 -8.766 9.140 4.528 1.00 15.21 C ATOM 1203 CD LYS A 177 -9.891 8.850 5.511 1.00 20.13 C ATOM 1204 CE LYS A 177 -11.158 8.444 4.751 1.00 20.08 C ATOM 1205 NZ LYS A 177 -12.384 8.905 5.450 1.00 19.42 N ATOM 1206 HZ1 LYS A 177 -12.420 8.482 6.400 1.00 0.00 H ATOM 1207 HZ2 LYS A 177 -12.366 9.942 5.531 1.00 0.00 H ATOM 1208 HZ3 LYS A 177 -13.222 8.613 4.907 1.00 0.00 H ATOM 1209 H LYS A 177 -6.104 8.582 3.160 1.00 0.00 H ATOM 1210 N LYS A 178 -4.448 9.984 5.684 1.00 14.75 N ATOM 1211 CA LYS A 178 -3.417 10.278 6.717 1.00 17.37 C ATOM 1212 C LYS A 178 -2.247 11.115 6.152 1.00 16.64 C ATOM 1213 O LYS A 178 -1.739 12.041 6.809 1.00 16.90 O ATOM 1214 CB LYS A 178 -2.866 8.978 7.280 1.00 17.10 C ATOM 1215 CG LYS A 178 -3.762 8.206 8.254 1.00 21.91 C ATOM 1216 CD LYS A 178 -3.238 6.757 8.418 1.00 21.95 C ATOM 1217 CE LYS A 178 -3.900 6.055 9.618 1.00 28.83 C ATOM 1218 NZ LYS A 178 -3.283 4.696 9.846 1.00 33.95 N ATOM 1219 HZ1 LYS A 178 -3.415 4.110 8.997 1.00 0.00 H ATOM 1220 HZ2 LYS A 178 -2.267 4.806 10.038 1.00 0.00 H ATOM 1221 HZ3 LYS A 178 -3.743 4.240 10.659 1.00 0.00 H ATOM 1222 H LYS A 178 -4.466 9.034 5.261 1.00 0.00 H ATOM 1223 N LYS A 179 -1.841 10.794 4.925 1.00 16.21 N ATOM 1224 CA LYS A 179 -0.715 11.477 4.259 1.00 16.14 C ATOM 1225 C LYS A 179 -1.111 12.684 3.406 1.00 15.18 C ATOM 1226 O LYS A 179 -0.354 13.648 3.322 1.00 15.16 O ATOM 1227 CB LYS A 179 0.094 10.506 3.383 1.00 15.98 C ATOM 1228 CG LYS A 179 0.790 9.398 4.138 1.00 19.46 C ATOM 1229 CD LYS A 179 1.827 8.698 3.254 1.00 21.51 C ATOM 1230 CE LYS A 179 3.129 9.499 3.178 1.00 24.48 C ATOM 1231 NZ LYS A 179 4.015 8.968 2.088 1.00 26.63 N ATOM 1232 HZ1 LYS A 179 4.243 7.972 2.282 1.00 0.00 H ATOM 1233 HZ2 LYS A 179 3.521 9.040 1.176 1.00 0.00 H ATOM 1234 HZ3 LYS A 179 4.892 9.525 2.054 1.00 0.00 H ATOM 1235 H LYS A 179 -2.336 10.033 4.417 1.00 0.00 H ATOM 1236 N TYR A 180 -2.270 12.623 2.746 1.00 13.59 N ATOM 1237 CA TYR A 180 -2.683 13.659 1.790 1.00 13.36 C ATOM 1238 C TYR A 180 -3.874 14.522 2.256 1.00 13.05 C ATOM 1239 O TYR A 180 -4.421 15.304 1.476 1.00 14.03 O ATOM 1240 CB TYR A 180 -2.925 13.035 0.395 1.00 13.81 C ATOM 1241 CG TYR A 180 -1.655 12.416 -0.165 1.00 13.97 C ATOM 1242 CD1 TYR A 180 -0.741 13.191 -0.883 1.00 16.58 C ATOM 1243 CD2 TYR A 180 -1.323 11.084 0.110 1.00 15.58 C ATOM 1244 CE1 TYR A 180 0.455 12.646 -1.348 1.00 16.23 C ATOM 1245 CE2 TYR A 180 -0.121 10.521 -0.374 1.00 17.59 C ATOM 1246 CZ TYR A 180 0.761 11.320 -1.097 1.00 17.29 C ATOM 1247 OH TYR A 180 1.959 10.754 -1.567 1.00 18.85 O ATOM 1248 HH TYR A 180 2.476 11.440 -2.059 1.00 0.00 H ATOM 1249 H TYR A 180 -2.902 11.814 2.914 1.00 0.00 H ATOM 1250 N ASP A 181 -4.220 14.402 3.540 1.00 13.63 N ATOM 1251 CA ASP A 181 -5.208 15.297 4.195 1.00 14.05 C ATOM 1252 C ASP A 181 -6.566 15.255 3.491 1.00 13.83 C ATOM 1253 O ASP A 181 -7.220 16.289 3.307 1.00 15.99 O ATOM 1254 CB ASP A 181 -4.692 16.734 4.240 1.00 13.68 C ATOM 1255 CG ASP A 181 -5.525 17.653 5.124 1.00 15.82 C ATOM 1256 OD1 ASP A 181 -5.872 17.253 6.272 1.00 14.31 O ATOM 1257 OD2 ASP A 181 -5.801 18.779 4.667 1.00 18.22 O ATOM 1258 H ASP A 181 -3.779 13.649 4.106 1.00 0.00 H ATOM 1259 N VAL A 182 -6.955 14.069 3.055 1.00 13.75 N ATOM 1260 CA VAL A 182 -8.273 13.862 2.446 1.00 13.56 C ATOM 1261 C VAL A 182 -9.253 13.391 3.520 1.00 13.79 C ATOM 1262 O VAL A 182 -8.899 12.544 4.350 1.00 14.28 O ATOM 1263 CB VAL A 182 -8.205 12.821 1.312 1.00 12.85 C ATOM 1264 CG1 VAL A 182 -9.606 12.501 0.751 1.00 11.85 C ATOM 1265 CG2 VAL A 182 -7.281 13.364 0.166 1.00 14.08 C ATOM 1266 H VAL A 182 -6.308 13.260 3.146 1.00 0.00 H ATOM 1267 N ASP A 183 -10.460 13.970 3.489 1.00 14.76 N ATOM 1268 CA ASP A 183 -11.610 13.469 4.256 1.00 14.95 C ATOM 1269 C ASP A 183 -12.341 12.431 3.357 1.00 14.54 C ATOM 1270 O ASP A 183 -12.086 11.233 3.466 1.00 14.61 O ATOM 1271 CB ASP A 183 -12.499 14.645 4.693 1.00 16.43 C ATOM 1272 CG ASP A 183 -13.861 14.205 5.213 1.00 19.31 C ATOM 1273 OD1 ASP A 183 -13.963 13.056 5.702 1.00 20.40 O ATOM 1274 OD2 ASP A 183 -14.810 15.037 5.152 1.00 22.85 O ATOM 1275 H ASP A 183 -10.590 14.813 2.895 1.00 0.00 H ATOM 1276 N THR A 184 -13.191 12.876 2.451 1.00 14.50 N ATOM 1277 CA THR A 184 -13.751 11.946 1.446 1.00 15.12 C ATOM 1278 C THR A 184 -13.607 12.596 0.090 1.00 15.17 C ATOM 1279 O THR A 184 -13.229 13.741 0.014 1.00 17.79 O ATOM 1280 CB THR A 184 -15.236 11.640 1.716 1.00 15.34 C ATOM 1281 OG1 THR A 184 -15.982 12.852 1.683 1.00 17.76 O ATOM 1282 CG2 THR A 184 -15.413 10.949 3.070 1.00 16.91 C ATOM 1283 HG1 THR A 184 -15.639 13.468 2.378 1.00 0.00 H ATOM 1284 H THR A 184 -13.467 13.879 2.444 1.00 0.00 H ATOM 1285 N LEU A 185 -13.871 11.860 -0.986 1.00 14.12 N ATOM 1286 CA LEU A 185 -13.709 12.381 -2.318 1.00 14.37 C ATOM 1287 C LEU A 185 -15.035 12.862 -2.897 1.00 14.04 C ATOM 1288 O LEU A 185 -16.072 12.246 -2.681 1.00 14.97 O ATOM 1289 CB LEU A 185 -13.098 11.332 -3.229 1.00 13.60 C ATOM 1290 CG LEU A 185 -11.764 10.792 -2.722 1.00 15.31 C ATOM 1291 CD1 LEU A 185 -11.434 9.508 -3.473 1.00 13.74 C ATOM 1292 CD2 LEU A 185 -10.686 11.855 -2.887 1.00 14.05 C ATOM 1293 H LEU A 185 -14.203 10.882 -0.862 1.00 0.00 H ATOM 1294 N ASP A 186 -14.984 13.967 -3.611 1.00 13.78 N ATOM 1295 CA ASP A 186 -16.163 14.491 -4.284 1.00 13.82 C ATOM 1296 C ASP A 186 -16.349 13.772 -5.598 1.00 13.53 C ATOM 1297 O ASP A 186 -17.477 13.465 -6.003 1.00 14.07 O ATOM 1298 CB ASP A 186 -16.011 15.984 -4.567 1.00 13.16 C ATOM 1299 CG ASP A 186 -16.061 16.812 -3.320 1.00 17.07 C ATOM 1300 OD1 ASP A 186 -16.444 16.266 -2.255 1.00 14.96 O ATOM 1301 OD2 ASP A 186 -15.721 18.004 -3.438 1.00 19.57 O ATOM 1302 H ASP A 186 -14.081 14.477 -3.696 1.00 0.00 H ATOM 1303 N MET A 187 -15.236 13.547 -6.293 1.00 13.56 N ATOM 1304 CA MET A 187 -15.284 12.883 -7.579 1.00 13.29 C ATOM 1305 C MET A 187 -13.994 12.069 -7.821 1.00 13.33 C ATOM 1306 O MET A 187 -12.897 12.474 -7.405 1.00 13.01 O ATOM 1307 CB MET A 187 -15.495 13.924 -8.679 1.00 13.65 C ATOM 1308 CG MET A 187 -15.349 13.380 -10.104 1.00 12.28 C ATOM 1309 SD MET A 187 -15.854 14.598 -11.327 1.00 17.23 S ATOM 1310 CE MET A 187 -15.186 13.803 -12.804 1.00 15.50 C ATOM 1311 H MET A 187 -14.320 13.852 -5.907 1.00 0.00 H ATOM 1312 N VAL A 188 -14.135 10.930 -8.502 1.00 12.51 N ATOM 1313 CA VAL A 188 -12.956 10.114 -8.909 1.00 11.79 C ATOM 1314 C VAL A 188 -13.047 9.883 -10.395 1.00 11.86 C ATOM 1315 O VAL A 188 -14.095 9.461 -10.862 1.00 11.23 O ATOM 1316 CB VAL A 188 -12.965 8.752 -8.226 1.00 11.78 C ATOM 1317 CG1 VAL A 188 -11.725 7.925 -8.641 1.00 12.91 C ATOM 1318 CG2 VAL A 188 -13.032 8.907 -6.700 1.00 14.03 C ATOM 1319 H VAL A 188 -15.090 10.604 -8.755 1.00 0.00 H ATOM 1320 N PHE A 189 -11.978 10.196 -11.133 1.00 10.68 N ATOM 1321 CA PHE A 189 -11.870 9.835 -12.557 1.00 10.97 C ATOM 1322 C PHE A 189 -10.960 8.588 -12.695 1.00 11.43 C ATOM 1323 O PHE A 189 -9.775 8.636 -12.341 1.00 12.44 O ATOM 1324 CB PHE A 189 -11.332 11.021 -13.377 1.00 10.98 C ATOM 1325 CG PHE A 189 -11.248 10.755 -14.870 1.00 11.37 C ATOM 1326 CD1 PHE A 189 -12.372 10.316 -15.574 1.00 11.24 C ATOM 1327 CD2 PHE A 189 -10.059 10.947 -15.559 1.00 13.09 C ATOM 1328 CE1 PHE A 189 -12.295 10.033 -16.950 1.00 13.20 C ATOM 1329 CE2 PHE A 189 -9.984 10.699 -16.939 1.00 14.23 C ATOM 1330 CZ PHE A 189 -11.097 10.239 -17.632 1.00 10.40 C ATOM 1331 H PHE A 189 -11.194 10.713 -10.686 1.00 0.00 H ATOM 1332 N LEU A 190 -11.525 7.469 -13.169 1.00 11.92 N ATOM 1333 CA LEU A 190 -10.771 6.233 -13.315 1.00 12.31 C ATOM 1334 C LEU A 190 -10.416 6.091 -14.783 1.00 11.72 C ATOM 1335 O LEU A 190 -11.315 5.969 -15.604 1.00 11.41 O ATOM 1336 CB LEU A 190 -11.608 5.016 -12.890 1.00 12.14 C ATOM 1337 CG LEU A 190 -12.070 4.887 -11.425 1.00 13.26 C ATOM 1338 CD1 LEU A 190 -13.385 5.637 -11.259 1.00 12.52 C ATOM 1339 CD2 LEU A 190 -12.257 3.393 -11.076 1.00 13.96 C ATOM 1340 H LEU A 190 -12.529 7.484 -13.440 1.00 0.00 H ATOM 1341 N ASP A 191 -9.119 6.100 -15.082 1.00 12.01 N ATOM 1342 CA ASP A 191 -8.635 5.997 -16.453 1.00 12.47 C ATOM 1343 C ASP A 191 -7.230 5.376 -16.447 1.00 13.50 C ATOM 1344 O ASP A 191 -6.358 5.784 -17.209 1.00 14.04 O ATOM 1345 CB ASP A 191 -8.609 7.385 -17.088 1.00 11.78 C ATOM 1346 CG ASP A 191 -8.379 7.345 -18.586 1.00 13.42 C ATOM 1347 OD1 ASP A 191 -8.690 6.315 -19.227 1.00 12.16 O ATOM 1348 OD2 ASP A 191 -7.880 8.341 -19.110 1.00 13.73 O ATOM 1349 H ASP A 191 -8.427 6.183 -14.310 1.00 0.00 H ATOM 1350 N HIS A 192 -7.014 4.410 -15.550 1.00 13.82 N ATOM 1351 CA HIS A 192 -5.754 3.646 -15.462 1.00 13.86 C ATOM 1352 C HIS A 192 -5.942 2.247 -16.077 1.00 14.63 C ATOM 1353 O HIS A 192 -6.788 2.090 -16.975 1.00 14.63 O ATOM 1354 CB HIS A 192 -5.221 3.612 -14.018 1.00 14.03 C ATOM 1355 CG HIS A 192 -6.183 3.065 -13.003 1.00 13.45 C ATOM 1356 ND1 HIS A 192 -7.554 3.177 -13.116 1.00 15.04 N ATOM 1357 CD2 HIS A 192 -5.954 2.464 -11.805 1.00 13.71 C ATOM 1358 CE1 HIS A 192 -8.130 2.638 -12.054 1.00 14.45 C ATOM 1359 NE2 HIS A 192 -7.182 2.217 -11.233 1.00 14.13 N ATOM 1360 H HIS A 192 -7.774 4.184 -14.877 1.00 0.00 H ATOM 1361 N TRP A 193 -5.171 1.239 -15.648 1.00 14.36 N ATOM 1362 CA TRP A 193 -5.381 -0.095 -16.259 1.00 15.10 C ATOM 1363 C TRP A 193 -6.773 -0.638 -15.915 1.00 14.57 C ATOM 1364 O TRP A 193 -7.212 -0.579 -14.761 1.00 13.99 O ATOM 1365 CB TRP A 193 -4.264 -1.058 -15.922 1.00 16.81 C ATOM 1366 CG TRP A 193 -2.873 -0.609 -16.393 1.00 18.82 C ATOM 1367 CD1 TRP A 193 -1.720 -0.753 -15.690 1.00 20.21 C ATOM 1368 CD2 TRP A 193 -2.504 0.047 -17.635 1.00 21.08 C ATOM 1369 NE1 TRP A 193 -0.665 -0.227 -16.392 1.00 21.72 N ATOM 1370 CE2 TRP A 193 -1.109 0.270 -17.585 1.00 20.01 C ATOM 1371 CE3 TRP A 193 -3.217 0.490 -18.766 1.00 23.47 C ATOM 1372 CZ2 TRP A 193 -0.384 0.893 -18.644 1.00 22.23 C ATOM 1373 CZ3 TRP A 193 -2.494 1.146 -19.827 1.00 22.11 C ATOM 1374 CH2 TRP A 193 -1.094 1.323 -19.751 1.00 21.25 C ATOM 1375 HE1 TRP A 193 0.322 -0.209 -16.066 1.00 0.00 H ATOM 1376 H TRP A 193 -4.451 1.387 -14.912 1.00 0.00 H ATOM 1377 N LYS A 194 -7.489 -1.120 -16.928 1.00 13.25 N ATOM 1378 CA LYS A 194 -8.920 -1.320 -16.796 1.00 13.42 C ATOM 1379 C LYS A 194 -9.285 -2.456 -15.858 1.00 13.29 C ATOM 1380 O LYS A 194 -10.410 -2.478 -15.338 1.00 14.02 O ATOM 1381 CB LYS A 194 -9.585 -1.508 -18.157 1.00 13.35 C ATOM 1382 CG LYS A 194 -9.070 -0.531 -19.255 1.00 15.58 C ATOM 1383 CD LYS A 194 -9.239 0.941 -18.836 1.00 13.15 C ATOM 1384 CE LYS A 194 -8.395 1.894 -19.703 1.00 12.14 C ATOM 1385 NZ LYS A 194 -8.325 3.236 -19.039 1.00 12.64 N ATOM 1386 HZ1 LYS A 194 -9.286 3.620 -18.933 1.00 0.00 H ATOM 1387 HZ2 LYS A 194 -7.885 3.135 -18.102 1.00 0.00 H ATOM 1388 HZ3 LYS A 194 -7.755 3.881 -19.623 1.00 0.00 H ATOM 1389 H LYS A 194 -7.017 -1.356 -17.824 1.00 0.00 H ATOM 1390 N ASP A 195 -8.358 -3.392 -15.657 1.00 13.28 N ATOM 1391 CA ASP A 195 -8.565 -4.489 -14.707 1.00 14.65 C ATOM 1392 C ASP A 195 -8.440 -4.028 -13.248 1.00 14.13 C ATOM 1393 O ASP A 195 -8.669 -4.811 -12.318 1.00 13.91 O ATOM 1394 CB ASP A 195 -7.623 -5.694 -15.014 1.00 15.10 C ATOM 1395 CG ASP A 195 -6.149 -5.354 -14.942 1.00 18.87 C ATOM 1396 OD1 ASP A 195 -5.750 -4.232 -15.332 1.00 19.08 O ATOM 1397 OD2 ASP A 195 -5.364 -6.250 -14.539 1.00 19.62 O ATOM 1398 H ASP A 195 -7.465 -3.343 -16.188 1.00 0.00 H ATOM 1399 N ARG A 196 -8.053 -2.762 -13.065 1.00 13.85 N ATOM 1400 CA ARG A 196 -7.871 -2.206 -11.728 1.00 13.75 C ATOM 1401 C ARG A 196 -9.062 -1.320 -11.316 1.00 13.51 C ATOM 1402 O ARG A 196 -9.141 -0.899 -10.169 1.00 12.64 O ATOM 1403 CB ARG A 196 -6.555 -1.442 -11.605 1.00 14.02 C ATOM 1404 CG ARG A 196 -5.248 -2.219 -11.917 1.00 14.99 C ATOM 1405 CD ARG A 196 -5.168 -3.619 -11.263 1.00 18.04 C ATOM 1406 NE ARG A 196 -5.270 -3.567 -9.799 1.00 18.58 N ATOM 1407 CZ ARG A 196 -5.453 -4.621 -8.998 1.00 19.32 C ATOM 1408 NH1 ARG A 196 -5.562 -5.848 -9.491 1.00 17.17 N ATOM 1409 NH2 ARG A 196 -5.544 -4.444 -7.683 1.00 19.30 N ATOM 1410 HE ARG A 196 -5.194 -2.633 -9.348 1.00 0.00 H ATOM 1411 HH12 ARG A 196 -5.704 -6.655 -8.851 1.00 0.00 H ATOM 1412 HH11 ARG A 196 -5.505 -6.003 -10.518 1.00 0.00 H ATOM 1413 HH22 ARG A 196 -5.686 -5.262 -7.057 1.00 0.00 H ATOM 1414 HH21 ARG A 196 -5.473 -3.488 -7.281 1.00 0.00 H ATOM 1415 H ARG A 196 -7.878 -2.159 -13.894 1.00 0.00 H ATOM 1416 N TYR A 197 -9.971 -1.045 -12.245 1.00 13.54 N ATOM 1417 CA TYR A 197 -11.190 -0.268 -11.938 1.00 12.96 C ATOM 1418 C TYR A 197 -11.974 -0.855 -10.752 1.00 13.48 C ATOM 1419 O TYR A 197 -12.249 -0.154 -9.783 1.00 13.64 O ATOM 1420 CB TYR A 197 -12.114 -0.220 -13.124 1.00 13.63 C ATOM 1421 CG TYR A 197 -11.730 0.763 -14.216 1.00 13.10 C ATOM 1422 CD1 TYR A 197 -10.416 1.229 -14.351 1.00 11.81 C ATOM 1423 CD2 TYR A 197 -12.686 1.186 -15.131 1.00 13.15 C ATOM 1424 CE1 TYR A 197 -10.070 2.133 -15.396 1.00 12.93 C ATOM 1425 CE2 TYR A 197 -12.359 2.060 -16.178 1.00 13.44 C ATOM 1426 CZ TYR A 197 -11.054 2.520 -16.294 1.00 11.78 C ATOM 1427 OH TYR A 197 -10.764 3.397 -17.308 1.00 13.79 O ATOM 1428 HH TYR A 197 -11.315 4.213 -17.205 1.00 0.00 H ATOM 1429 H TYR A 197 -9.820 -1.386 -13.216 1.00 0.00 H ATOM 1430 N LEU A 198 -12.311 -2.136 -10.843 1.00 12.75 N ATOM 1431 CA LEU A 198 -13.027 -2.809 -9.737 1.00 13.03 C ATOM 1432 C LEU A 198 -12.230 -2.865 -8.404 1.00 12.91 C ATOM 1433 O LEU A 198 -12.709 -2.341 -7.385 1.00 14.24 O ATOM 1434 CB LEU A 198 -13.511 -4.193 -10.169 1.00 12.80 C ATOM 1435 CG LEU A 198 -14.284 -4.920 -9.053 1.00 14.05 C ATOM 1436 CD1 LEU A 198 -15.433 -4.067 -8.558 1.00 14.54 C ATOM 1437 CD2 LEU A 198 -14.774 -6.278 -9.544 1.00 16.60 C ATOM 1438 H LEU A 198 -12.069 -2.672 -11.701 1.00 0.00 H ATOM 1439 N PRO A 199 -11.019 -3.461 -8.389 1.00 13.75 N ATOM 1440 CA PRO A 199 -10.329 -3.513 -7.082 1.00 13.20 C ATOM 1441 C PRO A 199 -10.096 -2.131 -6.466 1.00 13.72 C ATOM 1442 O PRO A 199 -10.223 -1.970 -5.232 1.00 12.90 O ATOM 1443 CB PRO A 199 -8.992 -4.199 -7.395 1.00 14.89 C ATOM 1444 CG PRO A 199 -8.866 -4.166 -8.877 1.00 13.60 C ATOM 1445 CD PRO A 199 -10.245 -4.140 -9.445 1.00 14.06 C ATOM 1446 N ASP A 200 -9.796 -1.128 -7.296 1.00 12.85 N ATOM 1447 CA ASP A 200 -9.608 0.228 -6.750 1.00 13.19 C ATOM 1448 C ASP A 200 -10.886 0.875 -6.219 1.00 13.09 C ATOM 1449 O ASP A 200 -10.837 1.564 -5.197 1.00 13.01 O ATOM 1450 CB ASP A 200 -8.877 1.145 -7.738 1.00 13.47 C ATOM 1451 CG ASP A 200 -7.369 0.851 -7.814 1.00 13.95 C ATOM 1452 OD1 ASP A 200 -6.850 0.016 -7.046 1.00 15.48 O ATOM 1453 OD2 ASP A 200 -6.686 1.463 -8.667 1.00 17.94 O ATOM 1454 H ASP A 200 -9.696 -1.302 -8.316 1.00 0.00 H ATOM 1455 N THR A 201 -12.022 0.620 -6.879 1.00 12.95 N ATOM 1456 CA THR A 201 -13.317 1.118 -6.424 1.00 13.31 C ATOM 1457 C THR A 201 -13.667 0.472 -5.064 1.00 13.49 C ATOM 1458 O THR A 201 -14.115 1.153 -4.138 1.00 13.71 O ATOM 1459 CB THR A 201 -14.411 0.824 -7.470 1.00 13.32 C ATOM 1460 OG1 THR A 201 -14.117 1.567 -8.656 1.00 12.77 O ATOM 1461 CG2 THR A 201 -15.799 1.268 -6.948 1.00 14.31 C ATOM 1462 HG1 THR A 201 -13.232 1.292 -9.005 1.00 0.00 H ATOM 1463 H THR A 201 -11.981 0.047 -7.746 1.00 0.00 H ATOM 1464 N LEU A 202 -13.423 -0.829 -4.950 1.00 13.24 N ATOM 1465 CA LEU A 202 -13.668 -1.532 -3.673 1.00 13.00 C ATOM 1466 C LEU A 202 -12.716 -1.005 -2.616 1.00 13.36 C ATOM 1467 O LEU A 202 -13.090 -0.835 -1.438 1.00 13.27 O ATOM 1468 CB LEU A 202 -13.470 -3.041 -3.857 1.00 13.67 C ATOM 1469 CG LEU A 202 -14.482 -3.738 -4.776 1.00 13.79 C ATOM 1470 CD1 LEU A 202 -14.163 -5.212 -4.870 1.00 15.99 C ATOM 1471 CD2 LEU A 202 -15.925 -3.556 -4.274 1.00 17.91 C ATOM 1472 H LEU A 202 -13.056 -1.358 -5.767 1.00 0.00 H ATOM 1473 N LEU A 203 -11.468 -0.756 -3.015 1.00 12.48 N ATOM 1474 CA LEU A 203 -10.467 -0.225 -2.070 1.00 12.80 C ATOM 1475 C LEU A 203 -10.840 1.175 -1.586 1.00 12.92 C ATOM 1476 O LEU A 203 -10.730 1.459 -0.384 1.00 13.17 O ATOM 1477 CB LEU A 203 -9.054 -0.233 -2.688 1.00 12.30 C ATOM 1478 CG LEU A 203 -7.873 0.172 -1.779 1.00 12.56 C ATOM 1479 CD1 LEU A 203 -7.737 -0.775 -0.590 1.00 14.19 C ATOM 1480 CD2 LEU A 203 -6.580 0.225 -2.611 1.00 13.38 C ATOM 1481 H LEU A 203 -11.198 -0.938 -4.003 1.00 0.00 H ATOM 1482 N LEU A 204 -11.320 2.037 -2.493 1.00 12.76 N ATOM 1483 CA LEU A 204 -11.713 3.395 -2.124 1.00 12.55 C ATOM 1484 C LEU A 204 -12.834 3.323 -1.088 1.00 13.71 C ATOM 1485 O LEU A 204 -12.830 4.049 -0.095 1.00 13.57 O ATOM 1486 CB LEU A 204 -12.202 4.166 -3.343 1.00 12.46 C ATOM 1487 CG LEU A 204 -11.125 4.644 -4.336 1.00 9.47 C ATOM 1488 CD1 LEU A 204 -11.817 5.070 -5.627 1.00 11.74 C ATOM 1489 CD2 LEU A 204 -10.310 5.797 -3.751 1.00 12.57 C ATOM 1490 H LEU A 204 -11.415 1.732 -3.483 1.00 0.00 H ATOM 1491 N GLU A 205 -13.771 2.408 -1.320 1.00 13.64 N ATOM 1492 CA GLU A 205 -14.873 2.189 -0.373 1.00 14.86 C ATOM 1493 C GLU A 205 -14.359 1.666 0.975 1.00 15.10 C ATOM 1494 O GLU A 205 -14.744 2.162 2.051 1.00 15.68 O ATOM 1495 CB GLU A 205 -15.902 1.213 -0.973 1.00 14.57 C ATOM 1496 CG GLU A 205 -17.176 1.127 -0.123 1.00 16.29 C ATOM 1497 CD GLU A 205 -18.237 0.241 -0.758 1.00 17.89 C ATOM 1498 OE1 GLU A 205 -17.869 -0.669 -1.522 1.00 18.06 O ATOM 1499 OE2 GLU A 205 -19.436 0.471 -0.473 1.00 20.28 O ATOM 1500 H GLU A 205 -13.723 1.837 -2.188 1.00 0.00 H ATOM 1501 N GLU A 206 -13.481 0.668 0.915 1.00 15.70 N ATOM 1502 CA GLU A 206 -12.897 0.068 2.120 1.00 16.80 C ATOM 1503 C GLU A 206 -12.169 1.097 2.983 1.00 16.83 C ATOM 1504 O GLU A 206 -12.203 1.025 4.233 1.00 17.71 O ATOM 1505 CB GLU A 206 -11.935 -1.048 1.709 1.00 17.50 C ATOM 1506 CG GLU A 206 -11.352 -1.849 2.845 1.00 21.81 C ATOM 1507 CD GLU A 206 -10.075 -2.598 2.430 1.00 29.49 C ATOM 1508 OE1 GLU A 206 -9.112 -2.634 3.229 1.00 34.97 O ATOM 1509 OE2 GLU A 206 -10.015 -3.127 1.294 1.00 31.21 O ATOM 1510 H GLU A 206 -13.199 0.301 -0.017 1.00 0.00 H ATOM 1511 N CYS A 207 -11.516 2.054 2.319 1.00 15.54 N ATOM 1512 CA CYS A 207 -10.702 3.075 2.985 1.00 15.76 C ATOM 1513 C CYS A 207 -11.512 4.279 3.474 1.00 15.52 C ATOM 1514 O CYS A 207 -10.954 5.259 4.011 1.00 15.99 O ATOM 1515 CB CYS A 207 -9.549 3.515 2.047 1.00 15.38 C ATOM 1516 SG CYS A 207 -8.334 2.227 1.795 1.00 15.95 S ATOM 1517 H CYS A 207 -11.588 2.076 1.282 1.00 0.00 H ATOM 1518 N GLY A 208 -12.834 4.220 3.315 1.00 14.31 N ATOM 1519 CA GLY A 208 -13.693 5.314 3.770 1.00 14.49 C ATOM 1520 C GLY A 208 -13.566 6.609 2.996 1.00 13.73 C ATOM 1521 O GLY A 208 -13.893 7.682 3.519 1.00 13.69 O ATOM 1522 H GLY A 208 -13.260 3.386 2.862 1.00 0.00 H ATOM 1523 N LEU A 209 -13.146 6.518 1.730 1.00 12.19 N ATOM 1524 CA LEU A 209 -12.948 7.698 0.882 1.00 12.13 C ATOM 1525 C LEU A 209 -14.183 8.099 0.081 1.00 12.90 C ATOM 1526 O LEU A 209 -14.231 9.196 -0.530 1.00 13.35 O ATOM 1527 CB LEU A 209 -11.777 7.466 -0.072 1.00 11.93 C ATOM 1528 CG LEU A 209 -10.436 7.475 0.699 1.00 10.89 C ATOM 1529 CD1 LEU A 209 -9.372 6.735 -0.085 1.00 12.17 C ATOM 1530 CD2 LEU A 209 -9.964 8.919 0.955 1.00 11.41 C ATOM 1531 H LEU A 209 -12.953 5.577 1.332 1.00 0.00 H ATOM 1532 N LEU A 210 -15.172 7.212 0.088 1.00 12.75 N ATOM 1533 CA LEU A 210 -16.412 7.452 -0.627 1.00 12.93 C ATOM 1534 C LEU A 210 -17.485 7.842 0.386 1.00 13.15 C ATOM 1535 O LEU A 210 -17.500 7.312 1.496 1.00 13.73 O ATOM 1536 CB LEU A 210 -16.840 6.183 -1.348 1.00 13.93 C ATOM 1537 CG LEU A 210 -15.853 5.591 -2.367 1.00 13.92 C ATOM 1538 CD1 LEU A 210 -16.535 4.404 -3.057 1.00 14.47 C ATOM 1539 CD2 LEU A 210 -15.486 6.622 -3.376 1.00 14.56 C ATOM 1540 H LEU A 210 -15.055 6.325 0.618 1.00 0.00 H ATOM 1541 N ARG A 211 -18.346 8.774 -0.008 1.00 13.09 N ATOM 1542 CA ARG A 211 -19.474 9.220 0.820 1.00 13.69 C ATOM 1543 C ARG A 211 -20.714 9.214 -0.041 1.00 12.85 C ATOM 1544 O ARG A 211 -20.615 9.221 -1.259 1.00 12.57 O ATOM 1545 CB ARG A 211 -19.245 10.645 1.366 1.00 14.06 C ATOM 1546 CG ARG A 211 -18.850 11.652 0.314 1.00 15.57 C ATOM 1547 CD ARG A 211 -19.203 13.076 0.724 1.00 15.69 C ATOM 1548 NE ARG A 211 -18.733 14.063 -0.259 1.00 19.29 N ATOM 1549 CZ ARG A 211 -19.435 14.412 -1.328 1.00 15.84 C ATOM 1550 NH1 ARG A 211 -20.596 13.815 -1.552 1.00 19.37 N ATOM 1551 NH2 ARG A 211 -18.988 15.316 -2.176 1.00 16.44 N ATOM 1552 HE ARG A 211 -17.805 14.509 -0.109 1.00 0.00 H ATOM 1553 HH12 ARG A 211 -21.162 14.074 -2.385 1.00 0.00 H ATOM 1554 HH11 ARG A 211 -20.942 13.087 -0.895 1.00 0.00 H ATOM 1555 HH22 ARG A 211 -19.556 15.574 -3.008 1.00 0.00 H ATOM 1556 HH21 ARG A 211 -18.067 15.771 -2.013 1.00 0.00 H ATOM 1557 H ARG A 211 -18.215 9.207 -0.944 1.00 0.00 H ATOM 1558 N LYS A 212 -21.892 9.247 0.589 1.00 14.32 N ATOM 1559 CA LYS A 212 -23.123 9.594 -0.138 1.00 14.39 C ATOM 1560 C LYS A 212 -22.897 10.796 -1.066 1.00 13.95 C ATOM 1561 O LYS A 212 -22.601 11.919 -0.618 1.00 14.66 O ATOM 1562 CB LYS A 212 -24.259 9.905 0.875 1.00 14.89 C ATOM 1563 CG LYS A 212 -25.550 10.435 0.243 1.00 15.37 C ATOM 1564 CD LYS A 212 -26.606 10.654 1.331 1.00 16.89 C ATOM 1565 CE LYS A 212 -27.944 11.194 0.787 1.00 21.49 C ATOM 1566 NZ LYS A 212 -28.049 11.209 -0.715 1.00 23.45 N ATOM 1567 HZ1 LYS A 212 -27.298 11.811 -1.108 1.00 0.00 H ATOM 1568 HZ2 LYS A 212 -27.944 10.240 -1.078 1.00 0.00 H ATOM 1569 HZ3 LYS A 212 -28.978 11.586 -0.993 1.00 0.00 H ATOM 1570 H LYS A 212 -21.939 9.025 1.604 1.00 0.00 H ATOM 1571 N GLY A 213 -23.027 10.570 -2.369 1.00 13.21 N ATOM 1572 CA GLY A 213 -22.882 11.642 -3.323 1.00 12.46 C ATOM 1573 C GLY A 213 -21.574 11.690 -4.094 1.00 12.28 C ATOM 1574 O GLY A 213 -21.446 12.476 -5.053 1.00 11.60 O ATOM 1575 H GLY A 213 -23.236 9.608 -2.705 1.00 0.00 H ATOM 1576 N THR A 214 -20.598 10.879 -3.675 1.00 11.81 N ATOM 1577 CA THR A 214 -19.309 10.816 -4.392 1.00 12.16 C ATOM 1578 C THR A 214 -19.574 10.337 -5.821 1.00 11.85 C ATOM 1579 O THR A 214 -20.286 9.354 -6.033 1.00 12.86 O ATOM 1580 CB THR A 214 -18.294 9.850 -3.743 1.00 11.57 C ATOM 1581 OG1 THR A 214 -17.916 10.344 -2.459 1.00 12.54 O ATOM 1582 CG2 THR A 214 -16.973 9.740 -4.605 1.00 11.17 C ATOM 1583 HG1 THR A 214 -17.502 11.238 -2.559 1.00 0.00 H ATOM 1584 H THR A 214 -20.748 10.285 -2.834 1.00 0.00 H ATOM 1585 N VAL A 215 -18.992 11.042 -6.780 1.00 12.41 N ATOM 1586 CA VAL A 215 -19.205 10.742 -8.202 1.00 12.27 C ATOM 1587 C VAL A 215 -17.997 9.958 -8.728 1.00 13.16 C ATOM 1588 O VAL A 215 -16.876 10.461 -8.678 1.00 14.27 O ATOM 1589 CB VAL A 215 -19.320 12.028 -9.008 1.00 12.91 C ATOM 1590 CG1 VAL A 215 -19.465 11.728 -10.549 1.00 13.54 C ATOM 1591 CG2 VAL A 215 -20.461 12.893 -8.481 1.00 13.36 C ATOM 1592 H VAL A 215 -18.366 11.830 -6.518 1.00 0.00 H ATOM 1593 N LEU A 216 -18.211 8.723 -9.177 1.00 12.54 N ATOM 1594 CA LEU A 216 -17.163 7.997 -9.930 1.00 13.18 C ATOM 1595 C LEU A 216 -17.398 8.189 -11.436 1.00 13.60 C ATOM 1596 O LEU A 216 -18.540 8.118 -11.866 1.00 14.96 O ATOM 1597 CB LEU A 216 -17.201 6.501 -9.615 1.00 13.64 C ATOM 1598 CG LEU A 216 -17.036 6.071 -8.162 1.00 15.80 C ATOM 1599 CD1 LEU A 216 -16.823 4.540 -8.122 1.00 16.78 C ATOM 1600 CD2 LEU A 216 -15.907 6.752 -7.512 1.00 15.49 C ATOM 1601 H LEU A 216 -19.126 8.262 -8.997 1.00 0.00 H ATOM 1602 N LEU A 217 -16.346 8.439 -12.219 1.00 12.70 N ATOM 1603 CA LEU A 217 -16.503 8.511 -13.670 1.00 12.64 C ATOM 1604 C LEU A 217 -15.398 7.674 -14.286 1.00 12.73 C ATOM 1605 O LEU A 217 -14.232 7.934 -14.030 1.00 13.17 O ATOM 1606 CB LEU A 217 -16.423 9.967 -14.165 1.00 11.77 C ATOM 1607 CG LEU A 217 -16.613 10.187 -15.680 1.00 13.31 C ATOM 1608 CD1 LEU A 217 -18.021 9.787 -16.151 1.00 14.07 C ATOM 1609 CD2 LEU A 217 -16.301 11.643 -16.097 1.00 12.76 C ATOM 1610 H LEU A 217 -15.408 8.584 -11.793 1.00 0.00 H ATOM 1611 N ALA A 218 -15.765 6.662 -15.077 1.00 13.12 N ATOM 1612 CA ALA A 218 -14.778 5.713 -15.586 1.00 13.62 C ATOM 1613 C ALA A 218 -14.706 5.805 -17.099 1.00 13.38 C ATOM 1614 O ALA A 218 -15.736 5.703 -17.772 1.00 13.46 O ATOM 1615 CB ALA A 218 -15.161 4.260 -15.174 1.00 12.86 C ATOM 1616 H ALA A 218 -16.766 6.548 -15.334 1.00 0.00 H ATOM 1617 N ASP A 219 -13.514 6.024 -17.624 1.00 14.19 N ATOM 1618 CA ASP A 219 -13.330 6.034 -19.082 1.00 13.72 C ATOM 1619 C ASP A 219 -13.293 4.588 -19.575 1.00 13.78 C ATOM 1620 O ASP A 219 -13.007 3.686 -18.802 1.00 14.38 O ATOM 1621 CB ASP A 219 -11.995 6.711 -19.426 1.00 13.36 C ATOM 1622 CG ASP A 219 -11.844 6.982 -20.923 1.00 13.79 C ATOM 1623 OD1 ASP A 219 -12.885 7.088 -21.594 1.00 14.96 O ATOM 1624 OD2 ASP A 219 -10.682 7.059 -21.390 1.00 14.20 O ATOM 1625 H ASP A 219 -12.699 6.191 -17.000 1.00 0.00 H ATOM 1626 N ASN A 220 -13.590 4.380 -20.864 1.00 13.06 N ATOM 1627 CA ASN A 220 -13.307 3.103 -21.539 1.00 13.67 C ATOM 1628 C ASN A 220 -14.122 1.915 -21.058 1.00 13.82 C ATOM 1629 O ASN A 220 -13.612 0.792 -21.027 1.00 14.09 O ATOM 1630 CB ASN A 220 -11.836 2.752 -21.415 1.00 13.53 C ATOM 1631 CG ASN A 220 -10.936 3.875 -21.874 1.00 14.35 C ATOM 1632 OD1 ASN A 220 -10.118 4.380 -21.110 1.00 12.19 O ATOM 1633 ND2 ASN A 220 -11.097 4.295 -23.132 1.00 12.24 N ATOM 1634 HD22 ASN A 220 -11.802 3.839 -23.746 1.00 0.00 H ATOM 1635 HD21 ASN A 220 -10.518 5.078 -23.497 1.00 0.00 H ATOM 1636 H ASN A 220 -14.036 5.147 -21.407 1.00 0.00 H ATOM 1637 N VAL A 221 -15.374 2.143 -20.705 1.00 14.90 N ATOM 1638 CA VAL A 221 -16.220 1.014 -20.298 1.00 15.74 C ATOM 1639 C VAL A 221 -16.735 0.212 -21.518 1.00 16.94 C ATOM 1640 O VAL A 221 -17.369 -0.846 -21.346 1.00 17.19 O ATOM 1641 CB VAL A 221 -17.349 1.405 -19.292 1.00 15.40 C ATOM 1642 CG1 VAL A 221 -16.730 2.020 -18.024 1.00 14.80 C ATOM 1643 CG2 VAL A 221 -18.352 2.375 -19.926 1.00 15.95 C ATOM 1644 H VAL A 221 -15.756 3.110 -20.715 1.00 0.00 H ATOM 1645 N ILE A 222 -16.415 0.694 -22.723 1.00 17.03 N ATOM 1646 CA ILE A 222 -16.712 -0.038 -23.971 1.00 18.03 C ATOM 1647 C ILE A 222 -15.428 -0.490 -24.627 1.00 18.71 C ATOM 1648 O ILE A 222 -15.248 -1.697 -24.859 1.00 18.12 O ATOM 1649 CB ILE A 222 -17.618 0.764 -24.922 1.00 18.36 C ATOM 1650 CG1 ILE A 222 -18.987 1.000 -24.263 1.00 19.11 C ATOM 1651 CG2 ILE A 222 -17.826 0.023 -26.254 1.00 18.40 C ATOM 1652 CD1 ILE A 222 -19.862 1.995 -24.993 1.00 22.01 C ATOM 1653 H ILE A 222 -15.940 1.617 -22.784 1.00 0.00 H ATOM 1654 N CYS A 223 -14.532 0.462 -24.913 1.00 17.98 N ATOM 1655 CA CYS A 223 -13.215 0.152 -25.501 1.00 18.14 C ATOM 1656 C CYS A 223 -12.069 0.416 -24.514 1.00 18.00 C ATOM 1657 O CYS A 223 -11.727 1.577 -24.263 1.00 18.48 O ATOM 1658 CB CYS A 223 -13.010 0.962 -26.790 1.00 17.90 C ATOM 1659 SG CYS A 223 -11.435 0.688 -27.560 1.00 19.88 S ATOM 1660 H CYS A 223 -14.772 1.454 -24.714 1.00 0.00 H ATOM 1661 N PRO A 224 -11.452 -0.653 -23.961 1.00 17.37 N ATOM 1662 CA PRO A 224 -11.718 -2.080 -24.262 1.00 17.43 C ATOM 1663 C PRO A 224 -12.779 -2.709 -23.366 1.00 17.44 C ATOM 1664 O PRO A 224 -13.226 -3.827 -23.637 1.00 18.81 O ATOM 1665 CB PRO A 224 -10.370 -2.727 -23.983 1.00 17.40 C ATOM 1666 CG PRO A 224 -9.847 -1.918 -22.790 1.00 16.23 C ATOM 1667 CD PRO A 224 -10.343 -0.503 -22.999 1.00 16.74 C ATOM 1668 N GLY A 225 -13.157 -2.007 -22.300 1.00 17.00 N ATOM 1669 CA GLY A 225 -14.126 -2.526 -21.349 1.00 15.85 C ATOM 1670 C GLY A 225 -13.560 -2.797 -19.962 1.00 15.33 C ATOM 1671 O GLY A 225 -12.373 -3.032 -19.775 1.00 14.47 O ATOM 1672 H GLY A 225 -12.749 -1.063 -22.144 1.00 0.00 H ATOM 1673 N ALA A 226 -14.434 -2.730 -18.969 1.00 15.23 N ATOM 1674 CA ALA A 226 -14.065 -3.127 -17.616 1.00 15.53 C ATOM 1675 C ALA A 226 -15.313 -3.797 -17.039 1.00 15.92 C ATOM 1676 O ALA A 226 -15.997 -3.220 -16.176 1.00 15.30 O ATOM 1677 CB ALA A 226 -13.660 -1.917 -16.790 1.00 14.71 C ATOM 1678 H ALA A 226 -15.398 -2.389 -19.158 1.00 0.00 H ATOM 1679 N PRO A 227 -15.641 -5.004 -17.553 1.00 16.70 N ATOM 1680 CA PRO A 227 -16.952 -5.593 -17.287 1.00 16.84 C ATOM 1681 C PRO A 227 -17.210 -5.911 -15.802 1.00 16.66 C ATOM 1682 O PRO A 227 -18.356 -5.813 -15.353 1.00 16.26 O ATOM 1683 CB PRO A 227 -16.949 -6.878 -18.135 1.00 17.36 C ATOM 1684 CG PRO A 227 -15.501 -7.211 -18.322 1.00 17.51 C ATOM 1685 CD PRO A 227 -14.798 -5.874 -18.405 1.00 17.48 C ATOM 1686 N ASP A 228 -16.176 -6.284 -15.058 1.00 16.36 N ATOM 1687 CA ASP A 228 -16.373 -6.605 -13.641 1.00 16.47 C ATOM 1688 C ASP A 228 -16.740 -5.380 -12.809 1.00 16.37 C ATOM 1689 O ASP A 228 -17.617 -5.439 -11.938 1.00 16.46 O ATOM 1690 CB ASP A 228 -15.183 -7.368 -13.065 1.00 16.53 C ATOM 1691 CG ASP A 228 -13.853 -6.610 -13.157 1.00 18.77 C ATOM 1692 OD1 ASP A 228 -13.697 -5.660 -13.985 1.00 21.16 O ATOM 1693 OD2 ASP A 228 -12.954 -7.013 -12.387 1.00 20.42 O ATOM 1694 H ASP A 228 -15.227 -6.348 -15.480 1.00 0.00 H ATOM 1695 N PHE A 229 -16.093 -4.271 -13.122 1.00 15.87 N ATOM 1696 CA PHE A 229 -16.419 -2.974 -12.547 1.00 15.75 C ATOM 1697 C PHE A 229 -17.835 -2.591 -12.930 1.00 16.67 C ATOM 1698 O PHE A 229 -18.649 -2.187 -12.097 1.00 15.97 O ATOM 1699 CB PHE A 229 -15.423 -1.916 -13.067 1.00 15.76 C ATOM 1700 CG PHE A 229 -15.867 -0.504 -12.821 1.00 13.86 C ATOM 1701 CD1 PHE A 229 -15.636 0.099 -11.596 1.00 14.10 C ATOM 1702 CD2 PHE A 229 -16.567 0.209 -13.802 1.00 14.23 C ATOM 1703 CE1 PHE A 229 -16.070 1.412 -11.347 1.00 13.80 C ATOM 1704 CE2 PHE A 229 -16.983 1.514 -13.567 1.00 14.22 C ATOM 1705 CZ PHE A 229 -16.726 2.115 -12.304 1.00 14.18 C ATOM 1706 H PHE A 229 -15.316 -4.327 -13.810 1.00 0.00 H ATOM 1707 N LEU A 230 -18.137 -2.700 -14.218 1.00 17.51 N ATOM 1708 CA LEU A 230 -19.430 -2.271 -14.706 1.00 18.47 C ATOM 1709 C LEU A 230 -20.556 -3.076 -14.060 1.00 18.96 C ATOM 1710 O LEU A 230 -21.555 -2.501 -13.640 1.00 19.63 O ATOM 1711 CB LEU A 230 -19.472 -2.382 -16.226 1.00 19.00 C ATOM 1712 CG LEU A 230 -20.332 -1.398 -17.010 1.00 19.89 C ATOM 1713 CD1 LEU A 230 -20.061 0.064 -16.647 1.00 21.13 C ATOM 1714 CD2 LEU A 230 -20.110 -1.622 -18.497 1.00 18.39 C ATOM 1715 H LEU A 230 -17.440 -3.096 -14.880 1.00 0.00 H ATOM 1716 N ALA A 231 -20.370 -4.396 -13.977 1.00 19.49 N ATOM 1717 CA ALA A 231 -21.332 -5.303 -13.333 1.00 19.85 C ATOM 1718 C ALA A 231 -21.533 -4.909 -11.878 1.00 20.25 C ATOM 1719 O ALA A 231 -22.673 -4.842 -11.397 1.00 20.11 O ATOM 1720 CB ALA A 231 -20.846 -6.753 -13.437 1.00 20.64 C ATOM 1721 H ALA A 231 -19.504 -4.801 -14.387 1.00 0.00 H ATOM 1722 N HIS A 232 -20.430 -4.600 -11.195 1.00 19.29 N ATOM 1723 CA HIS A 232 -20.500 -4.221 -9.786 1.00 19.66 C ATOM 1724 C HIS A 232 -21.288 -2.935 -9.535 1.00 18.80 C ATOM 1725 O HIS A 232 -22.202 -2.916 -8.701 1.00 19.51 O ATOM 1726 CB HIS A 232 -19.109 -4.092 -9.171 1.00 20.13 C ATOM 1727 CG HIS A 232 -19.151 -3.746 -7.720 1.00 21.83 C ATOM 1728 ND1 HIS A 232 -19.539 -4.654 -6.759 1.00 25.21 N ATOM 1729 CD2 HIS A 232 -18.913 -2.586 -7.072 1.00 22.66 C ATOM 1730 CE1 HIS A 232 -19.510 -4.070 -5.573 1.00 25.15 C ATOM 1731 NE2 HIS A 232 -19.123 -2.820 -5.735 1.00 23.59 N ATOM 1732 H HIS A 232 -19.507 -4.629 -11.672 1.00 0.00 H ATOM 1733 N VAL A 233 -20.948 -1.863 -10.246 1.00 17.96 N ATOM 1734 CA VAL A 233 -21.622 -0.572 -10.009 1.00 17.96 C ATOM 1735 C VAL A 233 -23.081 -0.606 -10.486 1.00 18.15 C ATOM 1736 O VAL A 233 -23.977 -0.070 -9.812 1.00 16.65 O ATOM 1737 CB VAL A 233 -20.833 0.671 -10.542 1.00 17.55 C ATOM 1738 CG1 VAL A 233 -19.525 0.862 -9.748 1.00 16.56 C ATOM 1739 CG2 VAL A 233 -20.563 0.585 -12.058 1.00 16.65 C ATOM 1740 H VAL A 233 -20.205 -1.935 -10.971 1.00 0.00 H ATOM 1741 N ARG A 234 -23.339 -1.249 -11.627 1.00 19.04 N ATOM 1742 CA ARG A 234 -24.720 -1.302 -12.136 1.00 19.59 C ATOM 1743 C ARG A 234 -25.604 -2.198 -11.267 1.00 20.18 C ATOM 1744 O ARG A 234 -26.752 -1.849 -10.992 1.00 22.21 O ATOM 1745 CB ARG A 234 -24.758 -1.741 -13.606 1.00 19.02 C ATOM 1746 CG ARG A 234 -24.265 -0.659 -14.531 1.00 19.18 C ATOM 1747 CD ARG A 234 -24.291 -1.131 -15.955 1.00 21.27 C ATOM 1748 NE ARG A 234 -23.814 -0.109 -16.875 1.00 20.49 N ATOM 1749 CZ ARG A 234 -23.685 -0.308 -18.183 1.00 22.30 C ATOM 1750 NH1 ARG A 234 -24.016 -1.493 -18.692 1.00 20.81 N ATOM 1751 NH2 ARG A 234 -23.227 0.661 -18.973 1.00 21.17 N ATOM 1752 HE ARG A 234 -23.561 0.823 -16.490 1.00 0.00 H ATOM 1753 HH12 ARG A 234 -23.921 -1.665 -19.713 1.00 0.00 H ATOM 1754 HH11 ARG A 234 -24.369 -2.246 -18.068 1.00 0.00 H ATOM 1755 HH22 ARG A 234 -23.129 0.496 -19.995 1.00 0.00 H ATOM 1756 HH21 ARG A 234 -22.967 1.583 -18.568 1.00 0.00 H ATOM 1757 H ARG A 234 -22.569 -1.710 -12.153 1.00 0.00 H ATOM 1758 N GLY A 235 -25.050 -3.320 -10.818 1.00 20.51 N ATOM 1759 CA GLY A 235 -25.765 -4.320 -10.014 1.00 21.32 C ATOM 1760 C GLY A 235 -25.957 -3.946 -8.554 1.00 21.39 C ATOM 1761 O GLY A 235 -26.883 -4.434 -7.893 1.00 22.36 O ATOM 1762 H GLY A 235 -24.052 -3.500 -11.049 1.00 0.00 H ATOM 1763 N SER A 236 -25.116 -3.051 -8.049 1.00 21.01 N ATOM 1764 CA SER A 236 -25.145 -2.692 -6.629 1.00 21.33 C ATOM 1765 C SER A 236 -26.120 -1.558 -6.317 1.00 21.51 C ATOM 1766 O SER A 236 -26.157 -0.541 -7.012 1.00 21.36 O ATOM 1767 CB SER A 236 -23.743 -2.300 -6.161 1.00 21.40 C ATOM 1768 OG SER A 236 -23.794 -1.766 -4.845 1.00 21.66 O ATOM 1769 HG SER A 236 -22.881 -1.517 -4.556 1.00 0.00 H ATOM 1770 H SER A 236 -24.422 -2.595 -8.675 1.00 0.00 H ATOM 1771 N SER A 237 -26.903 -1.719 -5.253 1.00 21.47 N ATOM 1772 CA SER A 237 -27.793 -0.632 -4.838 1.00 22.05 C ATOM 1773 C SER A 237 -26.995 0.537 -4.234 1.00 21.84 C ATOM 1774 O SER A 237 -27.552 1.610 -3.949 1.00 23.30 O ATOM 1775 CB SER A 237 -28.836 -1.127 -3.837 1.00 22.16 C ATOM 1776 OG SER A 237 -28.214 -1.519 -2.629 1.00 24.23 O ATOM 1777 HG SER A 237 -27.571 -2.249 -2.812 1.00 0.00 H ATOM 1778 H SER A 237 -26.883 -2.611 -4.719 1.00 0.00 H ATOM 1779 N CYS A 238 -25.698 0.325 -4.030 1.00 21.64 N ATOM 1780 CA CYS A 238 -24.811 1.363 -3.514 1.00 21.47 C ATOM 1781 C CYS A 238 -24.395 2.401 -4.557 1.00 20.09 C ATOM 1782 O CYS A 238 -23.801 3.419 -4.207 1.00 17.97 O ATOM 1783 CB CYS A 238 -23.556 0.725 -2.919 1.00 22.00 C ATOM 1784 SG CYS A 238 -23.861 -0.127 -1.380 1.00 29.06 S ATOM 1785 H CYS A 238 -25.302 -0.612 -4.245 1.00 0.00 H ATOM 1786 N PHE A 239 -24.710 2.155 -5.825 1.00 18.75 N ATOM 1787 CA PHE A 239 -24.328 3.091 -6.877 1.00 18.77 C ATOM 1788 C PHE A 239 -25.525 3.344 -7.760 1.00 19.13 C ATOM 1789 O PHE A 239 -26.286 2.414 -8.032 1.00 20.37 O ATOM 1790 CB PHE A 239 -23.204 2.505 -7.735 1.00 18.12 C ATOM 1791 CG PHE A 239 -21.883 2.393 -7.019 1.00 18.63 C ATOM 1792 CD1 PHE A 239 -21.014 3.487 -6.959 1.00 18.81 C ATOM 1793 CD2 PHE A 239 -21.511 1.194 -6.402 1.00 18.88 C ATOM 1794 CE1 PHE A 239 -19.787 3.380 -6.323 1.00 16.43 C ATOM 1795 CE2 PHE A 239 -20.288 1.078 -5.738 1.00 19.81 C ATOM 1796 CZ PHE A 239 -19.421 2.189 -5.701 1.00 18.26 C ATOM 1797 H PHE A 239 -25.232 1.289 -6.069 1.00 0.00 H ATOM 1798 N GLU A 240 -25.714 4.588 -8.181 1.00 19.01 N ATOM 1799 CA GLU A 240 -26.683 4.891 -9.233 1.00 19.80 C ATOM 1800 C GLU A 240 -25.905 5.246 -10.478 1.00 18.98 C ATOM 1801 O GLU A 240 -25.137 6.197 -10.465 1.00 18.55 O ATOM 1802 CB GLU A 240 -27.577 6.068 -8.850 1.00 20.69 C ATOM 1803 CG GLU A 240 -28.663 6.356 -9.903 1.00 25.20 C ATOM 1804 CD GLU A 240 -29.849 7.148 -9.341 1.00 31.91 C ATOM 1805 OE1 GLU A 240 -29.764 7.637 -8.187 1.00 34.35 O ATOM 1806 OE2 GLU A 240 -30.872 7.281 -10.058 1.00 35.95 O ATOM 1807 H GLU A 240 -25.163 5.361 -7.755 1.00 0.00 H ATOM 1808 N CYS A 241 -26.129 4.506 -11.563 1.00 18.89 N ATOM 1809 CA CYS A 241 -25.274 4.636 -12.746 1.00 18.72 C ATOM 1810 C CYS A 241 -25.930 5.328 -13.927 1.00 19.46 C ATOM 1811 O CYS A 241 -27.137 5.212 -14.140 1.00 19.25 O ATOM 1812 CB CYS A 241 -24.741 3.270 -13.171 1.00 18.61 C ATOM 1813 SG CYS A 241 -23.744 2.478 -11.903 1.00 18.88 S ATOM 1814 H CYS A 241 -26.919 3.829 -11.570 1.00 0.00 H ATOM 1815 N THR A 242 -25.114 6.042 -14.692 1.00 19.61 N ATOM 1816 CA THR A 242 -25.547 6.687 -15.928 1.00 19.63 C ATOM 1817 C THR A 242 -24.493 6.362 -16.986 1.00 20.13 C ATOM 1818 O THR A 242 -23.304 6.475 -16.709 1.00 19.74 O ATOM 1819 CB THR A 242 -25.612 8.224 -15.749 1.00 19.86 C ATOM 1820 OG1 THR A 242 -26.555 8.546 -14.725 1.00 20.22 O ATOM 1821 CG2 THR A 242 -26.038 8.901 -17.047 1.00 21.45 C ATOM 1822 HG1 THR A 242 -26.595 9.529 -14.612 1.00 0.00 H ATOM 1823 H THR A 242 -24.122 6.147 -14.398 1.00 0.00 H ATOM 1824 N HIS A 243 -24.918 5.964 -18.194 1.00 19.38 N ATOM 1825 CA HIS A 243 -23.955 5.641 -19.250 1.00 19.88 C ATOM 1826 C HIS A 243 -23.837 6.744 -20.294 1.00 20.42 C ATOM 1827 O HIS A 243 -24.847 7.262 -20.784 1.00 20.31 O ATOM 1828 CB HIS A 243 -24.327 4.316 -19.937 1.00 19.70 C ATOM 1829 CG HIS A 243 -23.319 3.869 -20.952 1.00 19.88 C ATOM 1830 ND1 HIS A 243 -22.040 3.494 -20.612 1.00 19.69 N ATOM 1831 CD2 HIS A 243 -23.410 3.734 -22.299 1.00 21.21 C ATOM 1832 CE1 HIS A 243 -21.377 3.158 -21.710 1.00 22.46 C ATOM 1833 NE2 HIS A 243 -22.188 3.299 -22.747 1.00 22.57 N ATOM 1834 H HIS A 243 -25.938 5.884 -18.383 1.00 0.00 H ATOM 1835 N TYR A 244 -22.613 7.092 -20.657 1.00 20.88 N ATOM 1836 CA TYR A 244 -22.422 8.109 -21.682 1.00 21.55 C ATOM 1837 C TYR A 244 -21.698 7.512 -22.870 1.00 21.66 C ATOM 1838 O TYR A 244 -20.485 7.333 -22.835 1.00 21.18 O ATOM 1839 CB TYR A 244 -21.632 9.284 -21.139 1.00 22.22 C ATOM 1840 CG TYR A 244 -22.243 9.932 -19.935 1.00 22.08 C ATOM 1841 CD1 TYR A 244 -21.620 9.846 -18.698 1.00 25.12 C ATOM 1842 CD2 TYR A 244 -23.433 10.638 -20.030 1.00 23.37 C ATOM 1843 CE1 TYR A 244 -22.172 10.452 -17.575 1.00 23.43 C ATOM 1844 CE2 TYR A 244 -23.993 11.255 -18.919 1.00 24.13 C ATOM 1845 CZ TYR A 244 -23.343 11.149 -17.694 1.00 23.65 C ATOM 1846 OH TYR A 244 -23.872 11.742 -16.588 1.00 25.11 O ATOM 1847 HH TYR A 244 -23.286 11.568 -15.809 1.00 0.00 H ATOM 1848 H TYR A 244 -21.789 6.640 -20.211 1.00 0.00 H ATOM 1849 N GLN A 245 -22.444 7.205 -23.925 1.00 21.93 N ATOM 1850 CA GLN A 245 -21.802 6.691 -25.131 1.00 22.31 C ATOM 1851 C GLN A 245 -21.113 7.817 -25.884 1.00 22.25 C ATOM 1852 O GLN A 245 -21.627 8.932 -25.955 1.00 23.54 O ATOM 1853 CB GLN A 245 -22.794 5.981 -26.040 1.00 22.61 C ATOM 1854 CG GLN A 245 -22.089 5.220 -27.166 1.00 25.23 C ATOM 1855 CD GLN A 245 -23.028 4.402 -28.018 1.00 27.92 C ATOM 1856 OE1 GLN A 245 -23.076 4.572 -29.232 1.00 29.56 O ATOM 1857 NE2 GLN A 245 -23.773 3.502 -27.389 1.00 28.56 N ATOM 1858 HE22 GLN A 245 -23.698 3.394 -26.357 1.00 0.00 H ATOM 1859 HE21 GLN A 245 -24.432 2.905 -27.928 1.00 0.00 H ATOM 1860 H GLN A 245 -23.476 7.330 -23.892 1.00 0.00 H ATOM 1861 N SER A 246 -19.950 7.519 -26.444 1.00 21.91 N ATOM 1862 CA SER A 246 -19.178 8.507 -27.175 1.00 22.18 C ATOM 1863 C SER A 246 -18.259 7.784 -28.154 1.00 22.25 C ATOM 1864 O SER A 246 -18.662 6.785 -28.766 1.00 22.72 O ATOM 1865 CB SER A 246 -18.402 9.405 -26.188 1.00 22.06 C ATOM 1866 OG SER A 246 -17.644 10.423 -26.834 1.00 22.27 O ATOM 1867 HG SER A 246 -18.252 11.005 -27.355 1.00 0.00 H ATOM 1868 H SER A 246 -19.580 6.551 -26.357 1.00 0.00 H ATOM 1869 N PHE A 247 -17.045 8.298 -28.309 1.00 22.50 N ATOM 1870 CA PHE A 247 -16.031 7.733 -29.205 1.00 22.94 C ATOM 1871 C PHE A 247 -14.675 7.676 -28.558 1.00 22.00 C ATOM 1872 O PHE A 247 -14.325 8.557 -27.769 1.00 21.88 O ATOM 1873 CB PHE A 247 -15.917 8.542 -30.489 1.00 23.47 C ATOM 1874 CG PHE A 247 -17.201 8.647 -31.228 1.00 25.05 C ATOM 1875 CD1 PHE A 247 -17.567 7.666 -32.146 1.00 26.53 C ATOM 1876 CD2 PHE A 247 -18.071 9.711 -30.974 1.00 26.72 C ATOM 1877 CE1 PHE A 247 -18.784 7.751 -32.824 1.00 28.59 C ATOM 1878 CE2 PHE A 247 -19.283 9.807 -31.632 1.00 27.86 C ATOM 1879 CZ PHE A 247 -19.640 8.831 -32.569 1.00 27.62 C ATOM 1880 H PHE A 247 -16.799 9.149 -27.764 1.00 0.00 H ATOM 1881 N LEU A 248 -13.908 6.648 -28.925 1.00 20.42 N ATOM 1882 CA LEU A 248 -12.527 6.524 -28.520 1.00 20.03 C ATOM 1883 C LEU A 248 -11.734 7.730 -29.012 1.00 19.37 C ATOM 1884 O LEU A 248 -11.934 8.205 -30.146 1.00 19.64 O ATOM 1885 CB LEU A 248 -11.916 5.237 -29.075 1.00 19.40 C ATOM 1886 CG LEU A 248 -10.424 5.002 -28.868 1.00 19.21 C ATOM 1887 CD1 LEU A 248 -10.087 4.562 -27.417 1.00 16.80 C ATOM 1888 CD2 LEU A 248 -9.965 3.947 -29.867 1.00 19.76 C ATOM 1889 H LEU A 248 -14.321 5.907 -29.526 1.00 0.00 H ATOM 1890 N GLU A 249 -10.864 8.232 -28.143 1.00 18.23 N ATOM 1891 CA GLU A 249 -10.037 9.381 -28.463 1.00 18.07 C ATOM 1892 C GLU A 249 -9.401 9.229 -29.839 1.00 18.12 C ATOM 1893 O GLU A 249 -8.788 8.205 -30.144 1.00 17.38 O ATOM 1894 CB GLU A 249 -8.959 9.656 -27.401 1.00 16.82 C ATOM 1895 CG GLU A 249 -7.993 8.491 -27.076 1.00 15.97 C ATOM 1896 CD GLU A 249 -8.497 7.622 -25.908 1.00 14.26 C ATOM 1897 OE1 GLU A 249 -9.716 7.608 -25.651 1.00 14.15 O ATOM 1898 OE2 GLU A 249 -7.669 6.956 -25.270 1.00 15.65 O ATOM 1899 H GLU A 249 -10.773 7.789 -27.206 1.00 0.00 H ATOM 1900 N TYR A 250 -9.563 10.268 -30.654 1.00 18.79 N ATOM 1901 CA TYR A 250 -8.883 10.393 -31.970 1.00 19.67 C ATOM 1902 C TYR A 250 -9.316 9.365 -33.003 1.00 20.90 C ATOM 1903 O TYR A 250 -8.694 9.258 -34.064 1.00 22.20 O ATOM 1904 CB TYR A 250 -7.350 10.401 -31.831 1.00 18.74 C ATOM 1905 CG TYR A 250 -6.914 11.223 -30.639 1.00 18.68 C ATOM 1906 CD1 TYR A 250 -7.235 12.581 -30.560 1.00 18.07 C ATOM 1907 CD2 TYR A 250 -6.244 10.631 -29.568 1.00 18.44 C ATOM 1908 CE1 TYR A 250 -6.876 13.342 -29.445 1.00 17.33 C ATOM 1909 CE2 TYR A 250 -5.899 11.370 -28.438 1.00 18.84 C ATOM 1910 CZ TYR A 250 -6.204 12.729 -28.395 1.00 18.04 C ATOM 1911 OH TYR A 250 -5.849 13.466 -27.293 1.00 18.51 O ATOM 1912 HH TYR A 250 -6.135 14.405 -27.419 1.00 0.00 H ATOM 1913 H TYR A 250 -10.200 11.034 -30.354 1.00 0.00 H ATOM 1914 N ARG A 251 -10.385 8.634 -32.711 1.00 22.45 N ATOM 1915 CA ARG A 251 -10.853 7.568 -33.597 1.00 23.06 C ATOM 1916 C ARG A 251 -12.364 7.602 -33.739 1.00 24.01 C ATOM 1917 O ARG A 251 -13.046 8.355 -33.054 1.00 23.77 O ATOM 1918 CB ARG A 251 -10.352 6.196 -33.109 1.00 22.99 C ATOM 1919 CG ARG A 251 -8.823 6.041 -33.052 1.00 21.82 C ATOM 1920 CD ARG A 251 -8.232 5.975 -34.473 1.00 23.01 C ATOM 1921 NE ARG A 251 -6.827 5.590 -34.528 1.00 21.37 N ATOM 1922 CZ ARG A 251 -5.800 6.436 -34.661 1.00 22.50 C ATOM 1923 NH1 ARG A 251 -5.992 7.748 -34.708 1.00 20.71 N ATOM 1924 NH2 ARG A 251 -4.562 5.959 -34.715 1.00 22.23 N ATOM 1925 HE ARG A 251 -6.606 4.576 -34.458 1.00 0.00 H ATOM 1926 HH12 ARG A 251 -5.180 8.389 -34.812 1.00 0.00 H ATOM 1927 HH11 ARG A 251 -6.955 8.135 -34.641 1.00 0.00 H ATOM 1928 HH22 ARG A 251 -3.758 6.610 -34.818 1.00 0.00 H ATOM 1929 HH21 ARG A 251 -4.397 4.934 -34.654 1.00 0.00 H ATOM 1930 H ARG A 251 -10.903 8.824 -31.830 1.00 0.00 H ATOM 1931 N GLU A 252 -12.884 6.795 -34.665 1.00 24.85 N ATOM 1932 CA GLU A 252 -14.316 6.681 -34.883 1.00 25.57 C ATOM 1933 C GLU A 252 -14.903 5.468 -34.170 1.00 25.32 C ATOM 1934 O GLU A 252 -16.090 5.174 -34.304 1.00 25.06 O ATOM 1935 CB GLU A 252 -14.613 6.577 -36.378 1.00 26.72 C ATOM 1936 CG GLU A 252 -14.522 7.898 -37.120 1.00 31.30 C ATOM 1937 CD GLU A 252 -14.669 7.703 -38.617 1.00 38.48 C ATOM 1938 OE1 GLU A 252 -13.621 7.645 -39.311 1.00 42.31 O ATOM 1939 OE2 GLU A 252 -15.828 7.576 -39.090 1.00 40.87 O ATOM 1940 H GLU A 252 -12.241 6.227 -35.252 1.00 0.00 H ATOM 1941 N VAL A 253 -14.070 4.784 -33.396 1.00 24.13 N ATOM 1942 CA VAL A 253 -14.471 3.600 -32.666 1.00 23.56 C ATOM 1943 C VAL A 253 -15.394 4.029 -31.539 1.00 23.47 C ATOM 1944 O VAL A 253 -15.092 4.987 -30.845 1.00 23.15 O ATOM 1945 CB VAL A 253 -13.228 2.915 -32.087 1.00 24.00 C ATOM 1946 CG1 VAL A 253 -13.596 1.683 -31.234 1.00 24.34 C ATOM 1947 CG2 VAL A 253 -12.256 2.542 -33.220 1.00 23.53 C ATOM 1948 H VAL A 253 -13.087 5.113 -33.310 1.00 0.00 H ATOM 1949 N VAL A 254 -16.515 3.326 -31.373 1.00 21.85 N ATOM 1950 CA VAL A 254 -17.439 3.595 -30.277 1.00 21.18 C ATOM 1951 C VAL A 254 -16.759 3.342 -28.920 1.00 20.23 C ATOM 1952 O VAL A 254 -16.009 2.386 -28.743 1.00 20.00 O ATOM 1953 CB VAL A 254 -18.724 2.769 -30.424 1.00 21.21 C ATOM 1954 CG1 VAL A 254 -19.607 2.860 -29.158 1.00 21.61 C ATOM 1955 CG2 VAL A 254 -19.508 3.244 -31.676 1.00 21.66 C ATOM 1956 H VAL A 254 -16.737 2.564 -32.045 1.00 0.00 H ATOM 1957 N ASP A 255 -16.986 4.254 -27.988 1.00 19.80 N ATOM 1958 CA ASP A 255 -16.539 4.064 -26.612 1.00 18.53 C ATOM 1959 C ASP A 255 -17.611 4.650 -25.686 1.00 18.61 C ATOM 1960 O ASP A 255 -18.688 5.077 -26.135 1.00 18.33 O ATOM 1961 CB ASP A 255 -15.150 4.678 -26.391 1.00 18.46 C ATOM 1962 CG ASP A 255 -14.398 4.074 -25.178 1.00 18.13 C ATOM 1963 OD1 ASP A 255 -14.939 3.178 -24.479 1.00 17.20 O ATOM 1964 OD2 ASP A 255 -13.256 4.495 -24.921 1.00 17.08 O ATOM 1965 H ASP A 255 -17.494 5.125 -28.242 1.00 0.00 H ATOM 1966 N GLY A 256 -17.351 4.645 -24.377 1.00 18.22 N ATOM 1967 CA GLY A 256 -18.282 5.251 -23.455 1.00 17.10 C ATOM 1968 C GLY A 256 -17.642 5.365 -22.086 1.00 16.44 C ATOM 1969 O GLY A 256 -16.619 4.732 -21.812 1.00 15.37 O ATOM 1970 H GLY A 256 -16.478 4.205 -24.021 1.00 0.00 H ATOM 1971 N LEU A 257 -18.253 6.195 -21.253 1.00 16.67 N ATOM 1972 CA LEU A 257 -17.858 6.331 -19.852 1.00 15.51 C ATOM 1973 C LEU A 257 -19.064 5.944 -19.024 1.00 16.38 C ATOM 1974 O LEU A 257 -20.190 5.957 -19.513 1.00 17.07 O ATOM 1975 CB LEU A 257 -17.453 7.779 -19.535 1.00 14.91 C ATOM 1976 CG LEU A 257 -16.358 8.354 -20.441 1.00 15.59 C ATOM 1977 CD1 LEU A 257 -17.017 9.233 -21.501 1.00 17.57 C ATOM 1978 CD2 LEU A 257 -15.327 9.130 -19.647 1.00 15.26 C ATOM 1979 H LEU A 257 -19.043 6.771 -21.609 1.00 0.00 H ATOM 1980 N GLU A 258 -18.827 5.595 -17.767 1.00 15.62 N ATOM 1981 CA GLU A 258 -19.922 5.313 -16.859 1.00 15.16 C ATOM 1982 C GLU A 258 -19.762 6.263 -15.688 1.00 15.36 C ATOM 1983 O GLU A 258 -18.659 6.379 -15.114 1.00 14.22 O ATOM 1984 CB GLU A 258 -19.861 3.856 -16.377 1.00 15.48 C ATOM 1985 CG GLU A 258 -21.117 3.365 -15.673 1.00 14.40 C ATOM 1986 CD GLU A 258 -22.223 2.977 -16.661 1.00 17.01 C ATOM 1987 OE1 GLU A 258 -21.941 2.981 -17.872 1.00 19.15 O ATOM 1988 OE2 GLU A 258 -23.359 2.672 -16.223 1.00 17.03 O ATOM 1989 H GLU A 258 -17.846 5.523 -17.429 1.00 0.00 H ATOM 1990 N LYS A 259 -20.861 6.926 -15.331 1.00 15.87 N ATOM 1991 CA LYS A 259 -20.883 7.690 -14.076 1.00 15.64 C ATOM 1992 C LYS A 259 -21.584 6.825 -13.046 1.00 15.13 C ATOM 1993 O LYS A 259 -22.653 6.296 -13.307 1.00 16.31 O ATOM 1994 CB LYS A 259 -21.587 9.041 -14.250 1.00 15.24 C ATOM 1995 CG LYS A 259 -21.705 9.860 -12.934 1.00 13.53 C ATOM 1996 CD LYS A 259 -22.256 11.285 -13.164 1.00 16.39 C ATOM 1997 CE LYS A 259 -23.792 11.317 -13.286 1.00 16.43 C ATOM 1998 NZ LYS A 259 -24.240 12.725 -13.542 1.00 14.82 N ATOM 1999 HZ1 LYS A 259 -23.940 13.332 -12.752 1.00 0.00 H ATOM 2000 HZ2 LYS A 259 -23.813 13.068 -14.426 1.00 0.00 H ATOM 2001 HZ3 LYS A 259 -25.276 12.748 -13.625 1.00 0.00 H ATOM 2002 H LYS A 259 -21.703 6.903 -15.941 1.00 0.00 H ATOM 2003 N ALA A 260 -20.974 6.653 -11.891 1.00 14.24 N ATOM 2004 CA ALA A 260 -21.608 5.942 -10.787 1.00 13.90 C ATOM 2005 C ALA A 260 -21.544 6.838 -9.555 1.00 14.17 C ATOM 2006 O ALA A 260 -20.452 7.161 -9.075 1.00 14.94 O ATOM 2007 CB ALA A 260 -20.910 4.598 -10.523 1.00 12.85 C ATOM 2008 H ALA A 260 -20.015 7.034 -11.763 1.00 0.00 H ATOM 2009 N ILE A 261 -22.713 7.208 -9.057 1.00 13.84 N ATOM 2010 CA ILE A 261 -22.853 8.004 -7.830 1.00 14.21 C ATOM 2011 C ILE A 261 -23.029 7.071 -6.658 1.00 14.78 C ATOM 2012 O ILE A 261 -23.951 6.231 -6.626 1.00 13.95 O ATOM 2013 CB ILE A 261 -24.069 8.934 -7.847 1.00 14.63 C ATOM 2014 CG1 ILE A 261 -24.176 9.758 -9.139 1.00 15.81 C ATOM 2015 CG2 ILE A 261 -24.069 9.859 -6.578 1.00 14.06 C ATOM 2016 CD1 ILE A 261 -23.007 10.681 -9.392 1.00 17.84 C ATOM 2017 H ILE A 261 -23.577 6.921 -9.560 1.00 0.00 H ATOM 2018 N TYR A 262 -22.148 7.215 -5.675 1.00 14.35 N ATOM 2019 CA TYR A 262 -22.225 6.405 -4.487 1.00 15.33 C ATOM 2020 C TYR A 262 -23.392 6.854 -3.611 1.00 16.13 C ATOM 2021 O TYR A 262 -23.570 8.048 -3.356 1.00 15.86 O ATOM 2022 CB TYR A 262 -20.925 6.508 -3.719 1.00 15.07 C ATOM 2023 CG TYR A 262 -20.769 5.512 -2.617 1.00 14.79 C ATOM 2024 CD1 TYR A 262 -20.747 4.131 -2.885 1.00 13.47 C ATOM 2025 CD2 TYR A 262 -20.568 5.944 -1.310 1.00 13.74 C ATOM 2026 CE1 TYR A 262 -20.559 3.213 -1.862 1.00 17.37 C ATOM 2027 CE2 TYR A 262 -20.376 5.032 -0.280 1.00 16.69 C ATOM 2028 CZ TYR A 262 -20.377 3.673 -0.570 1.00 15.50 C ATOM 2029 OH TYR A 262 -20.187 2.777 0.448 1.00 16.76 O ATOM 2030 HH TYR A 262 -20.214 1.856 0.085 1.00 0.00 H ATOM 2031 H TYR A 262 -21.391 7.923 -5.764 1.00 0.00 H ATOM 2032 N LYS A 263 -24.178 5.878 -3.168 1.00 17.46 N ATOM 2033 CA LYS A 263 -25.401 6.149 -2.397 1.00 19.32 C ATOM 2034 C LYS A 263 -25.160 6.105 -0.886 1.00 20.63 C ATOM 2035 O LYS A 263 -26.036 6.495 -0.088 1.00 21.27 O ATOM 2036 CB LYS A 263 -26.491 5.135 -2.764 1.00 19.48 C ATOM 2037 CG LYS A 263 -26.829 5.067 -4.245 1.00 21.63 C ATOM 2038 CD LYS A 263 -27.206 6.415 -4.839 1.00 24.62 C ATOM 2039 CE LYS A 263 -28.687 6.522 -5.113 1.00 25.52 C ATOM 2040 NZ LYS A 263 -29.021 7.860 -5.676 1.00 23.46 N ATOM 2041 HZ1 LYS A 263 -28.749 8.599 -4.996 1.00 0.00 H ATOM 2042 HZ2 LYS A 263 -28.502 7.999 -6.567 1.00 0.00 H ATOM 2043 HZ3 LYS A 263 -30.044 7.913 -5.857 1.00 0.00 H ATOM 2044 H LYS A 263 -23.920 4.892 -3.373 1.00 0.00 H ATOM 2045 N GLY A 264 -23.967 5.665 -0.498 1.00 21.21 N ATOM 2046 CA GLY A 264 -23.674 5.297 0.886 1.00 22.07 C ATOM 2047 C GLY A 264 -23.631 3.778 0.992 1.00 22.85 C ATOM 2048 O GLY A 264 -24.155 3.071 0.114 1.00 22.54 O ATOM 2049 H GLY A 264 -23.212 5.579 -1.208 1.00 0.00 H ATOM 2050 N PRO A 265 -23.017 3.255 2.070 1.00 23.10 N ATOM 2051 CA PRO A 265 -22.883 1.802 2.299 1.00 23.59 C ATOM 2052 C PRO A 265 -24.215 1.118 2.641 1.00 24.16 C ATOM 2053 O PRO A 265 -25.125 1.807 3.144 1.00 24.15 O ATOM 2054 CB PRO A 265 -21.925 1.729 3.488 1.00 23.33 C ATOM 2055 CG PRO A 265 -22.076 3.002 4.189 1.00 22.71 C ATOM 2056 CD PRO A 265 -22.381 4.047 3.149 1.00 23.25 C TER 2057 PRO A 265 HETATM 2058 MG MG A 1 -8.873 6.145 -21.248 1.00 13.35 MG HETATM 2059 O HOH 2 6.485 21.261 -9.510 1.00 42.92 O HETATM 2060 O HOH 3 0.075 30.241 -5.632 1.00 41.73 O HETATM 2061 O HOH 4 7.394 22.240 -14.538 1.00 36.16 O HETATM 2062 O HOH 5 -6.016 19.309 2.284 1.00 32.30 O HETATM 2063 O HOH 6 -17.545 22.038 -3.998 1.00 29.11 O HETATM 2064 O HOH 7 -4.378 19.175 -4.757 1.00 42.76 O HETATM 2065 O HOH 8 -28.403 7.149 -0.711 1.00 29.01 O HETATM 2066 O HOH 9 -12.186 -6.032 -15.987 1.00 26.41 O HETATM 2067 O HOH 10 -16.978 14.311 3.507 1.00 22.63 O HETATM 2068 O HOH 11 -6.426 -5.585 -31.321 1.00 19.42 O HETATM 2069 O HOH 12 -3.078 28.718 -28.758 1.00 30.61 O HETATM 2070 O HOH 13 2.886 8.350 -0.526 1.00 33.34 O HETATM 2071 O HOH 14 0.416 4.356 -31.966 1.00 31.79 O HETATM 2072 O HOH 15 -16.004 11.635 6.396 1.00 17.73 O HETATM 2073 O HOH 16 4.808 28.106 -26.327 1.00 17.06 O HETATM 2074 O HOH 17 -6.064 19.047 8.194 1.00 36.67 O HETATM 2075 O HOH 18 3.713 12.096 -3.007 1.00 27.51 O HETATM 2076 O HOH 19 -20.590 24.428 -12.922 1.00 42.50 O HETATM 2077 O HOH 20 -0.633 33.317 -21.895 1.00 29.23 O HETATM 2078 O HOH 21 -1.638 26.855 -30.208 1.00 30.01 O HETATM 2079 O HOH 22 2.340 25.680 -6.456 1.00 26.65 O HETATM 2080 O HOH 23 -16.177 -0.166 -29.558 1.00 29.70 O HETATM 2081 O HOH 24 -16.225 15.291 0.586 1.00 29.00 O HETATM 2082 O HOH 25 -16.666 -3.899 -24.233 1.00 35.40 O HETATM 2083 O HOH 26 1.461 -0.206 -14.738 1.00 50.45 O HETATM 2084 O HOH 27 0.317 19.441 -3.544 1.00 14.59 O HETATM 2085 O HOH 28 5.743 16.501 -9.143 1.00 16.32 O HETATM 2086 O HOH 29 -6.416 25.116 -5.083 1.00 36.74 O HETATM 2087 O HOH 30 -23.630 13.681 -6.102 1.00 15.54 O HETATM 2088 O HOH 31 -2.184 30.259 -14.001 1.00 33.45 O HETATM 2089 O HOH 32 -5.513 13.253 7.978 1.00 22.34 O HETATM 2090 O HOH 33 5.400 20.002 -33.077 1.00 19.82 O HETATM 2091 O HOH 34 -0.537 6.487 -25.515 1.00 15.77 O HETATM 2092 O HOH 35 0.890 26.391 -13.423 1.00 15.78 O HETATM 2093 O HOH 36 -4.900 7.042 5.406 1.00 15.43 O HETATM 2094 O HOH 37 -11.926 -3.681 -13.186 1.00 15.11 O HETATM 2095 O HOH 38 -14.362 17.759 4.830 1.00 23.98 O HETATM 2096 O HOH 39 7.400 19.798 -31.447 1.00 22.16 O HETATM 2097 O HOH 40 5.061 9.515 -4.242 1.00 26.45 O HETATM 2098 O HOH 41 -11.350 15.805 1.585 1.00 21.45 O HETATM 2099 O HOH 42 -5.913 -7.308 -12.015 1.00 22.59 O HETATM 2100 O HOH 43 -19.754 14.751 -5.001 1.00 14.29 O HETATM 2101 O HOH 44 -0.369 21.878 -5.592 1.00 17.52 O HETATM 2102 O HOH 45 3.191 16.000 -4.987 1.00 17.83 O HETATM 2103 O HOH 46 5.533 28.883 -28.623 1.00 30.53 O HETATM 2104 O HOH 47 -18.919 17.093 -6.353 1.00 18.14 O HETATM 2105 O HOH 48 -9.600 17.629 4.078 1.00 33.84 O HETATM 2106 O HOH 49 7.310 6.143 -27.587 1.00 41.11 O HETATM 2107 O HOH 50 4.886 12.884 -6.969 1.00 23.39 O HETATM 2108 O HOH 51 -30.917 11.147 -0.700 1.00 24.96 O HETATM 2109 O HOH 52 -4.523 33.290 -21.798 1.00 37.04 O HETATM 2110 O HOH 53 -27.680 5.210 -18.466 1.00 37.75 O HETATM 2111 O HOH 54 -2.125 31.150 -16.393 1.00 25.09 O HETATM 2112 O HOH 55 -23.070 10.645 -24.127 1.00 36.87 O HETATM 2113 O HOH 56 -8.575 -3.532 -29.599 1.00 32.88 O HETATM 2114 O HOH 57 -2.718 -7.106 -13.701 1.00 32.15 O HETATM 2115 O HOH 58 -15.461 18.040 -0.173 1.00 42.68 O HETATM 2116 O HOH 59 -3.982 15.602 7.768 1.00 20.02 O HETATM 2117 O HOH 60 -1.832 -1.192 -12.635 1.00 37.63 O HETATM 2118 O HOH 61 -25.360 7.635 -24.009 1.00 30.36 O HETATM 2119 O HOH 62 -19.443 5.912 3.309 1.00 31.85 O HETATM 2120 O HOH 63 -15.324 9.163 6.175 1.00 27.59 O HETATM 2121 O HOH 64 5.000 5.294 1.118 1.00 38.24 O HETATM 2122 O HOH 65 -26.997 17.411 -9.876 1.00 32.78 O HETATM 2123 O HOH 66 -11.118 -1.455 -32.179 1.00 47.90 O HETATM 2124 O HOH 67 -8.839 16.280 6.593 1.00 44.59 O HETATM 2125 O HOH 68 2.242 4.730 -19.166 1.00 38.47 O HETATM 2126 O HOH 69 -5.891 24.846 -1.681 1.00 41.38 O HETATM 2127 O HOH 70 10.332 25.507 -21.442 1.00 48.26 O HETATM 2128 O HOH 71 -27.228 2.105 -0.304 1.00 41.93 O HETATM 2129 O HOH 72 -11.880 6.617 7.730 1.00 42.30 O HETATM 2130 O HOH 73 -29.709 7.751 -13.991 1.00 31.24 O HETATM 2131 O HOH 74 5.317 4.707 -20.296 1.00 45.64 O HETATM 2132 O HOH 75 -29.492 5.694 -16.563 1.00 53.64 O HETATM 2133 O HOH 76 -20.531 24.408 -4.747 1.00 51.37 O HETATM 2134 O HOH 77 -28.044 0.227 2.074 1.00 49.34 O HETATM 2135 O HOH 78 1.866 23.322 -6.104 1.00 34.19 O HETATM 2136 O HOH 79 14.487 8.519 -22.802 1.00 49.48 O HETATM 2137 O HOH 80 -31.051 8.774 -2.832 1.00 47.24 O HETATM 2138 O HOH 81 -0.312 21.368 -34.985 1.00 39.63 O HETATM 2139 O HOH 82 2.442 18.831 -35.342 1.00 35.21 O HETATM 2140 O HOH 83 -15.267 3.852 6.296 1.00 45.24 O HETATM 2141 O HOH 84 7.385 7.967 0.416 1.00 39.42 O HETATM 2142 O HOH 85 -26.588 12.152 -10.475 1.00 42.73 O HETATM 2143 O HOH 86 -30.962 8.730 0.222 1.00 33.89 O HETATM 2144 O HOH 87 -15.560 14.560 9.022 1.00 18.23 O HETATM 2145 O HOH 88 -8.632 -8.774 -12.628 1.00 34.00 O HETATM 2146 O HOH 89 -27.549 9.673 -10.795 1.00 22.00 O HETATM 2147 O HOH 90 -23.261 -5.165 -20.082 1.00 49.62 O HETATM 2148 O HOH 91 -16.372 -5.779 -21.412 1.00 35.93 O HETATM 2149 O HOH 92 19.211 27.630 -19.572 1.00 34.04 O HETATM 2150 O HOH 93 -12.629 -8.621 -16.555 1.00 39.20 O HETATM 2151 O HOH 94 -34.009 9.812 -9.474 1.00 28.52 O HETATM 2152 O HOH 95 -18.271 1.675 4.274 1.00 42.75 O HETATM 2153 O HOH 96 -26.669 11.032 -21.176 1.00 57.59 O HETATM 2154 O HOH 97 -27.660 19.859 -10.581 1.00 46.18 O HETATM 2155 O HOH 98 2.477 18.614 -5.095 1.00 15.77 O HETATM 2156 O HOH 99 -13.582 11.152 9.489 1.00 21.28 O HETATM 2157 O HOH 100 5.045 18.049 -34.859 1.00 42.42 O HETATM 2158 O HOH 101 9.005 18.874 -34.053 1.00 39.96 O HETATM 2159 O HOH 102 12.030 11.418 -12.852 1.00 50.13 O HETATM 2160 O HOH 103 9.889 23.327 -14.839 1.00 51.42 O HETATM 2161 O HOH 104 -8.249 23.461 1.448 1.00 40.85 O HETATM 2162 O HOH 105 8.600 20.058 -10.573 1.00 50.27 O HETATM 2163 O HOH 106 -27.946 11.925 -18.465 1.00 44.46 O HETATM 2164 O HOH 107 -8.263 15.951 9.929 1.00 42.36 O HETATM 2165 O HOH 108 16.471 20.564 -27.188 1.00 37.79 O HETATM 2166 O HOH 109 -7.972 7.976 -21.590 1.00 14.29 O HETATM 2167 O HOH 110 -16.024 4.736 1.638 1.00 15.28 O HETATM 2168 O HOH 111 1.157 20.763 -9.091 1.00 14.39 O HETATM 2169 O HOH 112 -2.295 12.569 -20.921 1.00 13.65 O HETATM 2170 O HOH 113 -3.810 13.632 -16.426 1.00 14.93 O HETATM 2171 O HOH 114 -9.864 -3.996 -3.507 1.00 19.02 O HETATM 2172 O HOH 115 -23.121 14.755 -15.272 1.00 21.34 O HETATM 2173 O HOH 116 -25.446 8.421 -12.198 1.00 19.53 O HETATM 2174 O HOH 117 -26.294 0.259 -9.335 1.00 15.83 O HETATM 2175 O HOH 118 -4.714 -1.276 -8.431 1.00 14.85 O HETATM 2176 O HOH 119 -17.118 -2.674 -19.462 1.00 23.72 O HETATM 2177 O HOH 120 -6.918 6.888 2.700 1.00 14.11 O HETATM 2178 O HOH 121 -6.517 -2.307 -5.765 1.00 21.87 O HETATM 2179 O HOH 122 3.440 2.342 -5.344 1.00 16.94 O HETATM 2180 O HOH 123 8.697 17.246 -13.910 1.00 18.16 O HETATM 2181 O HOH 124 -9.050 20.138 -27.749 1.00 21.24 O HETATM 2182 O HOH 125 1.931 18.169 -7.906 1.00 13.09 O HETATM 2183 O HOH 126 7.357 17.122 -30.667 1.00 20.31 O HETATM 2184 O HOH 127 -18.367 3.709 2.431 1.00 15.97 O HETATM 2185 O HOH 128 -12.324 11.753 -26.829 1.00 21.89 O HETATM 2186 O HOH 129 -0.018 6.551 -33.861 1.00 23.10 O HETATM 2187 O HOH 130 -10.555 21.212 -1.952 1.00 19.67 O HETATM 2188 O HOH 131 10.200 16.664 -30.089 1.00 28.49 O HETATM 2189 O HOH 132 -1.598 27.465 -10.760 1.00 20.47 O HETATM 2190 O HOH 133 -27.405 1.668 -11.339 1.00 25.79 O HETATM 2191 O HOH 134 -1.232 21.715 -32.426 1.00 21.56 O HETATM 2192 O HOH 135 -3.696 9.502 -34.510 1.00 22.45 O HETATM 2193 O HOH 136 -0.221 1.757 1.299 1.00 22.33 O HETATM 2194 O HOH 137 -3.288 25.012 -29.167 1.00 19.97 O HETATM 2195 O HOH 138 -10.369 -6.786 -11.912 1.00 20.65 O HETATM 2196 O HOH 139 -6.873 6.369 7.029 1.00 25.99 O HETATM 2197 O HOH 140 -23.082 20.019 -16.955 1.00 25.34 O HETATM 2198 O HOH 141 -5.039 28.019 -17.388 1.00 26.54 O HETATM 2199 O HOH 142 9.177 9.423 -21.793 1.00 28.16 O HETATM 2200 O HOH 143 -18.872 14.693 -26.536 1.00 23.37 O HETATM 2201 O HOH 144 -14.438 23.367 -8.377 1.00 32.88 O HETATM 2202 O HOH 145 -10.407 -6.447 -4.799 1.00 26.13 O HETATM 2203 O HOH 146 -11.711 -6.808 -7.122 1.00 18.13 O HETATM 2204 O HOH 147 -8.241 5.403 4.675 1.00 19.39 O HETATM 2205 O HOH 148 5.684 3.966 -9.005 1.00 22.32 O HETATM 2206 O HOH 149 -7.951 28.238 -20.864 1.00 27.57 O HETATM 2207 O HOH 150 -23.739 15.263 -17.631 1.00 32.30 O HETATM 2208 O HOH 151 -3.796 -1.909 -1.244 1.00 21.89 O HETATM 2209 O HOH 152 -25.928 2.590 -16.889 1.00 23.56 O HETATM 2210 O HOH 153 14.678 14.033 -22.402 1.00 27.77 O HETATM 2211 O HOH 154 10.064 11.972 -18.210 1.00 29.06 O HETATM 2212 O HOH 155 -21.046 6.657 -30.153 1.00 28.30 O HETATM 2213 O HOH 156 0.423 -1.038 -0.004 1.00 39.02 O HETATM 2214 O HOH 157 7.096 15.389 -32.724 1.00 21.78 O HETATM 2215 O HOH 158 -18.466 -7.524 -10.700 1.00 26.26 O HETATM 2216 O HOH 159 -15.466 -2.201 -0.535 1.00 26.57 O HETATM 2217 O HOH 160 -0.032 18.630 -35.090 1.00 27.39 O HETATM 2218 O HOH 161 -10.888 -3.600 -0.994 1.00 27.25 O HETATM 2219 O HOH 162 -16.450 23.247 -10.144 1.00 44.57 O HETATM 2220 O HOH 163 7.534 13.536 -11.184 1.00 27.47 O HETATM 2221 O HOH 164 -20.327 -6.046 -17.231 1.00 28.45 O HETATM 2222 O HOH 165 -12.494 11.369 6.817 1.00 24.13 O HETATM 2223 O HOH 166 8.905 11.231 -11.702 1.00 25.96 O HETATM 2224 O HOH 167 -6.981 -3.758 -3.503 1.00 34.34 O HETATM 2225 O HOH 168 -8.498 26.302 -12.320 1.00 33.39 O HETATM 2226 O HOH 169 -23.231 2.246 -25.155 1.00 29.09 O HETATM 2227 O HOH 170 -16.733 21.578 -22.450 1.00 31.71 O HETATM 2228 O HOH 171 -13.258 -9.532 -11.276 1.00 26.42 O HETATM 2229 O HOH 172 -13.793 -8.415 -6.715 1.00 33.64 O HETATM 2230 O HOH 173 -13.090 10.814 -31.436 1.00 28.62 O HETATM 2231 O HOH 174 12.942 23.276 -17.824 1.00 48.68 O HETATM 2232 O HOH 175 -19.649 -1.875 -3.144 1.00 32.56 O HETATM 2233 O HOH 176 -2.923 23.689 -31.706 1.00 32.41 O HETATM 2234 O HOH 177 -23.250 -0.187 -21.743 1.00 42.94 O HETATM 2235 O HOH 178 -22.825 -5.064 -16.422 1.00 39.78 O HETATM 2236 O HOH 179 11.485 17.985 -17.444 1.00 41.70 O HETATM 2237 O HOH 180 -9.735 -7.863 -9.079 1.00 26.57 O HETATM 2238 O HOH 181 -16.992 0.904 -32.943 1.00 30.11 O HETATM 2239 O HOH 182 5.045 1.753 -7.585 1.00 28.36 O HETATM 2240 O HOH 183 3.483 21.592 -7.982 1.00 27.79 O HETATM 2241 O HOH 184 -7.165 28.263 -27.639 1.00 43.71 O HETATM 2242 O HOH 185 4.364 4.072 -3.325 1.00 34.75 O HETATM 2243 O HOH 186 -18.610 -4.673 -20.250 1.00 40.68 O HETATM 2244 O HOH 187 -4.730 2.987 -34.486 1.00 34.55 O HETATM 2245 O HOH 188 -10.251 15.035 -29.757 1.00 44.31 O HETATM 2246 O HOH 189 -24.694 -6.243 -12.733 1.00 33.79 O HETATM 2247 O HOH 190 -17.217 7.965 3.908 1.00 28.63 O HETATM 2248 O HOH 191 1.631 -2.191 -9.241 1.00 38.27 O HETATM 2249 O HOH 192 -3.051 7.914 -36.342 1.00 36.82 O HETATM 2250 O HOH 193 -19.199 20.020 -22.058 1.00 27.23 O HETATM 2251 O HOH 194 -27.384 0.787 -13.913 1.00 40.84 O HETATM 2252 O HOH 195 -26.594 -4.281 -3.869 1.00 38.78 O HETATM 2253 O HOH 196 -6.449 29.003 -18.951 1.00 38.87 O HETATM 2254 O HOH 197 -6.284 -6.091 -5.429 1.00 40.63 O HETATM 2255 O HOH 198 -9.997 27.660 -30.124 1.00 47.88 O HETATM 2256 O HOH 199 -6.981 10.573 -35.946 1.00 36.67 O HETATM 2257 O HOH 200 14.657 21.966 -19.587 1.00 44.68 O HETATM 2258 O HOH 201 -15.877 -1.473 2.107 1.00 32.63 O HETATM 2259 O HOH 202 -28.478 -6.273 -8.628 1.00 36.66 O HETATM 2260 O HOH 203 -28.781 0.199 -8.689 1.00 39.94 O HETATM 2261 O HOH 204 -11.322 25.953 -21.576 1.00 36.50 O HETATM 2262 O HOH 205 -9.573 12.305 6.899 1.00 35.61 O HETATM 2263 O HOH 206 -19.427 12.324 -27.743 1.00 27.98 O HETATM 2264 O HOH 207 5.056 7.837 -1.918 1.00 31.02 O HETATM 2265 O HOH 208 -9.313 20.542 -30.372 1.00 44.24 O HETATM 2266 O HOH 209 8.636 19.892 -13.308 1.00 33.62 O HETATM 2267 O HOH 210 3.985 6.963 -33.134 1.00 35.63 O HETATM 2268 O HOH 211 -25.021 -3.975 -17.558 1.00 34.42 O HETATM 2269 O HOH 212 14.513 18.317 -28.232 1.00 31.57 O HETATM 2270 O HOH 213 11.789 11.534 -16.253 1.00 40.49 O HETATM 2271 O HOH 214 5.954 5.769 -4.965 1.00 36.69 O HETATM 2272 O HOH 215 -15.402 1.684 4.663 1.00 34.18 O HETATM 2273 O HOH 216 -27.161 15.203 -15.833 1.00 34.99 O HETATM 2274 O HOH 217 10.717 10.929 -20.485 1.00 47.50 O HETATM 2275 O HOH 218 8.871 15.937 -11.732 1.00 29.68 O HETATM 2276 O HOH 219 5.695 1.930 -15.326 1.00 33.13 O HETATM 2277 O HOH 220 10.292 6.970 -30.978 1.00 43.92 O HETATM 2278 O HOH 221 -11.246 4.720 -36.418 1.00 45.69 O HETATM 2279 O HOH 222 13.785 13.813 -19.824 1.00 34.21 O HETATM 2280 O HOH 223 -7.441 -7.910 -7.961 1.00 36.68 O HETATM 2281 O HOH 224 0.781 -3.255 -4.131 1.00 39.09 O HETATM 2282 O HOH 225 -11.868 2.435 6.588 1.00 39.71 O HETATM 2283 O HOH 226 -14.336 15.843 2.128 1.00 39.43 O HETATM 2284 O HOH 227 -23.093 -5.921 -7.786 1.00 49.01 O HETATM 2285 O HOH 228 -26.721 13.581 -12.754 1.00 39.32 O HETATM 2286 O HOH 229 -13.311 24.835 -3.778 1.00 48.12 O HETATM 2287 O HOH 230 -1.693 9.212 -37.956 1.00 45.35 O HETATM 2288 O HOH 231 3.344 -1.994 -5.708 1.00 39.07 O HETATM 2289 O HOH 232 -12.968 17.908 2.479 1.00 35.83 O HETATM 2290 O HOH 233 -29.392 -2.268 -7.378 1.00 41.15 O HETATM 2291 O HOH 234 -8.713 2.424 -35.452 1.00 47.28 O HETATM 2292 O HOH 235 -6.965 8.493 -38.047 1.00 41.28 O HETATM 2293 O HOH 236 -8.911 29.830 -22.551 1.00 45.13 O HETATM 2294 O HOH 237 7.411 6.159 -19.954 1.00 36.72 O HETATM 2295 O HOH 238 -27.261 -4.974 -12.967 1.00 49.93 O HETATM 2296 O HOH 239 -20.555 -8.743 -17.046 1.00 41.70 O HETATM 2297 O HOH 240 -21.231 -1.102 0.679 1.00 48.14 O HETATM 2298 O HOH 241 11.387 16.612 -14.892 1.00 44.84 O HETATM 2299 O HOH 242 -18.524 -9.672 -12.905 1.00 41.89 O HETATM 2300 O HOH 243 4.500 -0.712 -8.363 1.00 49.14 O HETATM 2301 O HOH 244 -27.403 11.199 -14.334 1.00 42.36 O HETATM 2302 O HOH 245 2.890 2.431 -16.667 1.00 39.12 O HETATM 2303 O HOH 246 4.581 -1.250 -3.600 1.00 40.08 O HETATM 2304 O HOH 247 -29.292 2.999 -14.623 1.00 49.54 O HETATM 2305 O HOH 248 -6.799 -1.199 3.282 1.00 47.39 O HETATM 2306 O HOH 249 -13.070 -5.515 -0.648 1.00 44.23 O HETATM 2307 O HOH 250 -27.078 0.628 -19.057 1.00 43.28 O HETATM 2308 O HOH 251 16.847 14.506 -29.578 1.00 42.89 O HETATM 2309 O HOH 252 15.361 11.229 -23.153 1.00 41.50 O HETATM 2310 O HOH 253 -28.020 3.051 -20.391 1.00 43.11 O HETATM 2311 O HOH 254 -19.906 -2.272 -21.987 1.00 44.90 O HETATM 2312 O HOH 255 15.522 24.509 -17.841 1.00 54.83 O HETATM 2313 O HOH 256 6.640 1.876 -12.641 1.00 41.76 O HETATM 2314 O HOH 257 1.867 11.583 -39.220 1.00 53.97 O HETATM 2315 O HOH 258 1.014 28.644 -9.791 1.00 49.52 O HETATM 2316 O HOH 259 -13.152 10.608 -28.993 1.00 38.45 O HETATM 2317 O HOH 260 -11.131 12.560 -29.767 1.00 41.91 O HETATM 2318 O HOH 261 13.129 22.813 -15.272 1.00 52.50 O HETATM 2319 O HOH 262 -22.374 9.034 -29.509 1.00 41.83 O HETATM 2320 O HOH 263 -7.921 8.072 8.749 1.00 42.26 O HETATM 2321 O HOH 264 11.252 14.486 -17.696 1.00 37.74 O HETATM 2322 O HOH 265 -27.027 -3.863 -15.409 1.00 47.16 O HETATM 2323 O HOH 266 -9.902 8.105 -37.361 1.00 44.90 O HETATM 2324 O HOH 267 -17.748 -9.481 -15.365 1.00 40.74 O HETATM 2325 O HOH 268 -26.032 1.744 -21.440 1.00 46.90 O HETATM 2326 O HOH 269 -26.043 1.384 -24.076 1.00 47.43 O HETATM 2327 O HOH 270 -10.030 -2.480 5.768 1.00 47.84 O HETATM 2328 O HOH 271 -19.005 -9.367 -19.995 1.00 46.48 O HETATM 2329 O HOH 272 -21.097 15.638 -24.923 1.00 35.27 O HETATM 2330 O HOH 273 -9.290 10.248 9.138 1.00 47.26 O HETATM 2331 O HOH 274 -8.127 -7.828 -5.358 1.00 51.00 O HETATM 2332 O HOH 275 -6.300 5.623 -38.297 1.00 53.91 O HETATM 2333 O HOH 276 -5.656 25.791 -30.637 1.00 38.90 O HETATM 2334 O HOH 277 -14.617 21.486 -25.003 1.00 54.46 O HETATM 2335 O HOH 278 -22.265 0.220 -26.862 1.00 39.87 O HETATM 2336 O HOH 279 -21.559 16.417 -22.429 1.00 35.40 O HETATM 2337 O HOH 280 -15.121 1.127 -35.663 1.00 58.05 O HETATM 2338 O HOH 281 9.066 4.594 -18.526 1.00 47.30 O HETATM 2339 O HOH 282 -29.173 -2.204 -9.825 1.00 47.60 O HETATM 2340 O HOH 283 -11.035 27.848 -12.794 1.00 48.19 O HETATM 2341 O HOH 284 -24.758 17.776 -17.438 1.00 45.78 O HETATM 2342 O HOH 285 -14.694 -11.257 -12.927 1.00 48.17 O HETATM 2343 O HOH 286 -17.872 -7.450 -6.783 1.00 63.08 O HETATM 2344 O HOH 287 -11.333 11.022 -35.643 1.00 46.90 O HETATM 2345 O HOH 288 -23.461 18.088 -21.599 1.00 53.10 O HETATM 2346 O HOH 289 -25.160 -3.922 -0.357 1.00 56.97 O HETATM 2347 O HOH 290 -14.693 -10.113 -15.788 1.00 46.40 O HETATM 2348 O HOH 291 -23.067 14.847 -20.679 1.00 54.44 O HETATM 2349 O HOH 292 -18.641 16.398 -28.844 1.00 46.40 O HETATM 2350 C UNN A 293 -7.999 4.367 -23.379 1.00 0.10 C HETATM 2351 C1 UNN A 293 -8.018 3.503 -24.486 1.00 0.04 C HETATM 2352 N UNN A 293 -7.267 2.363 -24.539 1.00 -0.27 N HETATM 2353 C2 UNN A 293 -6.511 2.055 -23.450 1.00 0.02 C HETATM 2354 C3 UNN A 293 -6.422 2.853 -22.296 1.00 -0.04 C HETATM 2355 C4 UNN A 293 -7.208 4.013 -22.270 1.00 0.12 C HETATM 2356 O UNN A 293 -7.185 4.798 -21.200 1.00 -0.37 O HETATM 2357 H5 UNN A 293 -7.767 5.536 -21.338 1.00 0.21 H HETATM 2358 H4 UNN A 293 -8.047 3.443 -21.846 1.00 0.08 H HETATM 2359 H3 UNN A 293 -5.774 2.583 -21.463 1.00 0.04 H HETATM 2360 H2 UNN A 293 -5.937 1.130 -23.474 1.00 0.08 H HETATM 2361 C6 UNN A 293 -7.355 1.544 -25.607 1.00 0.06 C HETATM 2362 C7 UNN A 293 -7.352 1.982 -26.937 1.00 -0.03 C HETATM 2363 C8 UNN A 293 -7.490 1.108 -28.008 1.00 -0.03 C HETATM 2364 C9 UNN A 293 -7.654 -0.250 -27.727 1.00 -0.07 C HETATM 2365 C10 UNN A 293 -7.700 -0.737 -26.420 1.00 -0.07 C HETATM 2366 C11 UNN A 293 -7.558 0.172 -25.378 1.00 -0.04 C HETATM 2367 H10 UNN A 293 -7.605 -0.188 -24.357 1.00 0.05 H HETATM 2368 H9 UNN A 293 -7.842 -1.793 -26.223 1.00 0.06 H HETATM 2369 H8 UNN A 293 -7.749 -0.948 -28.551 1.00 0.05 H HETATM 2370 C12 UNN A 293 -7.475 1.601 -29.412 1.00 -0.02 C HETATM 2371 C13 UNN A 293 -8.360 1.029 -30.338 1.00 -0.05 C HETATM 2372 C14 UNN A 293 -8.413 1.466 -31.660 1.00 -0.06 C HETATM 2373 C15 UNN A 293 -7.566 2.494 -32.055 1.00 -0.06 C HETATM 2374 C16 UNN A 293 -6.679 3.070 -31.153 1.00 -0.06 C HETATM 2375 C17 UNN A 293 -6.630 2.623 -29.819 1.00 -0.05 C HETATM 2376 H15 UNN A 293 -5.938 3.073 -29.116 1.00 0.06 H HETATM 2377 H14 UNN A 293 -6.021 3.868 -31.479 1.00 0.06 H HETATM 2378 H13 UNN A 293 -7.597 2.851 -33.078 1.00 0.06 H HETATM 2379 H12 UNN A 293 -9.101 1.014 -32.365 1.00 0.06 H HETATM 2380 H11 UNN A 293 -9.018 0.229 -30.018 1.00 0.06 H HETATM 2381 H7 UNN A 293 -7.238 3.041 -27.138 1.00 0.05 H HETATM 2382 H1 UNN A 293 -8.655 3.751 -25.334 1.00 0.05 H HETATM 2383 O5 UNN A 293 -8.742 5.505 -23.364 1.00 -0.34 O HETATM 2384 H6 UNN A 293 -9.364 5.466 -22.647 1.00 0.24 H CONECT 1 2 11 12 13 CONECT 11 1 CONECT 12 1 CONECT 13 1 CONECT 1347 1346 2058 CONECT 1624 1622 2058 CONECT 1632 1631 2058 CONECT 2058 1347 1624 1632 CONECT 2350 2351 2355 2383 CONECT 2351 2350 2352 2382 CONECT 2352 2351 2353 2361 CONECT 2353 2352 2354 2360 CONECT 2354 2353 2355 2359 CONECT 2355 2350 2354 2356 2358 CONECT 2356 2355 2357 CONECT 2357 2356 CONECT 2358 2355 CONECT 2359 2354 CONECT 2360 2353 CONECT 2361 2352 2362 2366 CONECT 2362 2361 2363 2381 CONECT 2363 2362 2364 2370 CONECT 2364 2363 2365 2369 CONECT 2365 2364 2366 2368 CONECT 2366 2361 2365 2367 CONECT 2367 2366 CONECT 2368 2365 CONECT 2369 2364 CONECT 2370 2363 2371 2375 CONECT 2371 2370 2372 2380 CONECT 2372 2371 2373 2379 CONECT 2373 2372 2374 2378 CONECT 2374 2373 2375 2377 CONECT 2375 2370 2374 2376 CONECT 2376 2375 CONECT 2377 2374 CONECT 2378 2373 CONECT 2379 2372 CONECT 2380 2371 CONECT 2381 2362 CONECT 2382 2351 CONECT 2383 2350 2384 CONECT 2384 2383 MASTER 0 0 0 0 0 0 0 0 2383 1 43 17 END
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Related entries of code: 4xuc
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4xue
RCSB PDB
PDBbind
215aa, >4XUE_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4xuc
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Human soluble form Catechol O-methyltransferase
Ligand Name
43G
EC.Number
E.C.2.1.1.6
Resolution
1.8(Å)
Affinity (Kd/Ki/IC50)
IC50=1100nM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Acs Med.Chem.Lett. Vol. 6: pp. 318-323
Ligand Properties
Formula
C
1
7
H
1
5
NO
2
Molecular Weight
265.306
Exact Mass
265.110
No. of atoms
35
No. of bonds
37
Polar Surface Area
43.7
LOGP Value
2.78 (
Computed with XLOGP3
)
3.51 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 3
Canonical SMILES
OC1=CN(C=C[C@H]1O)c1cccc(c1)c1ccccc1
InChI String
InChI=1S/C17H15NO2/c19-16-9-10-18(12-17(16)20)15-8-4-7-14(11-15)13-5-2-1-3-6-13/h1-12,16,19-20H/t16-/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):
P21964
Entrez Gene ID
NCBI Entrez Gene ID:
1312
ASD
Information of known allosteric effects of PDB entries
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