Browse entries in the PDBbind-CN Database
HEADER 1DXP_COMPLEX COMPND 1DXP_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 175 ALA PRO ILE THR ALA TYR SER GLN GLN THR ARG GLY LEU SEQRES 2 A 175 LEU GLY CYS ILE ILE THR SER LEU THR GLY ARG ASP LYS SEQRES 3 A 175 ASN GLN VAL ASP GLY GLU VAL GLN VAL LEU SER THR ALA SEQRES 4 A 175 THR GLN SER PHE LEU ALA THR CYS VAL ASN GLY VAL CYS SEQRES 5 A 175 TRP THR VAL TYR HIS GLY ALA GLY SER LYS THR LEU ALA SEQRES 6 A 175 GLY PRO LYS GLY PRO ILE THR GLN MET TYR THR ASN VAL SEQRES 7 A 175 ASP GLN ASP LEU VAL GLY TRP PRO ALA PRO PRO GLY ALA SEQRES 8 A 175 ARG SER MET THR PRO CYS THR CYS GLY SER SER ASP LEU SEQRES 9 A 175 TYR LEU VAL THR ARG HIS ALA ASP VAL ILE PRO VAL ARG SEQRES 10 A 175 ARG ARG GLY ASP SER ARG GLY SER LEU LEU SER PRO ARG SEQRES 11 A 175 PRO VAL SER TYR LEU LYS GLY SER SER GLY GLY PRO LEU SEQRES 12 A 175 LEU CYS PRO SER GLY HIS VAL VAL GLY ILE PHE ARG ALA SEQRES 13 A 175 ALA VAL CYS THR ARG GLY VAL ALA LYS ALA VAL ASP PHE SEQRES 14 A 175 ILE PRO VAL GLU SER MET HET ZN A 1 1 HET GLY A 278 188 ATOM 1 N ALA A 1 18.365 41.063 -1.175 1.00 99.71 N ATOM 2 CA ALA A 1 17.549 41.339 0.041 1.00 94.02 C ATOM 3 C ALA A 1 18.420 41.294 1.294 1.00 88.58 C ATOM 4 O ALA A 1 19.586 40.890 1.296 1.00 89.60 O ATOM 5 CB ALA A 1 16.364 40.391 0.143 1.00 89.79 C ATOM 6 HA ALA A 1 17.142 42.346 -0.045 1.00 0.00 H ATOM 7 HB1 ALA A 1 15.728 40.510 -0.734 1.00 0.00 H ATOM 8 HB2 ALA A 1 16.725 39.364 0.195 1.00 0.00 H ATOM 9 HB3 ALA A 1 15.792 40.622 1.042 1.00 0.00 H ATOM 10 HN3 ALA A 1 18.794 40.119 -1.096 1.00 0.00 H ATOM 11 HN2 ALA A 1 19.114 41.780 -1.259 1.00 0.00 H ATOM 12 HN1 ALA A 1 17.754 41.098 -2.016 1.00 0.00 H ATOM 13 N PRO A 2 17.820 41.716 2.407 1.00 80.63 N ATOM 14 CA PRO A 2 18.519 41.755 3.683 1.00 72.45 C ATOM 15 C PRO A 2 18.336 40.499 4.514 1.00 65.31 C ATOM 16 O PRO A 2 19.050 40.325 5.507 1.00 72.28 O ATOM 17 CB PRO A 2 17.908 42.963 4.384 1.00 67.80 C ATOM 18 CG PRO A 2 16.558 43.126 3.793 1.00 72.93 C ATOM 19 CD PRO A 2 16.581 42.537 2.415 1.00 74.11 C ATOM 20 HA PRO A 2 19.598 41.822 3.542 1.00 0.00 H ATOM 21 HD3 PRO A 2 15.702 41.917 2.242 1.00 0.00 H ATOM 22 HD2 PRO A 2 16.627 43.319 1.658 1.00 0.00 H ATOM 23 HG3 PRO A 2 16.303 44.184 3.739 1.00 0.00 H ATOM 24 HG2 PRO A 2 15.821 42.607 4.405 1.00 0.00 H ATOM 25 HB2 PRO A 2 17.835 42.784 5.457 1.00 0.00 H ATOM 26 HB3 PRO A 2 18.512 43.853 4.205 1.00 0.00 H ATOM 27 N ILE A 3 17.292 39.729 4.221 1.00 47.71 N ATOM 28 CA ILE A 3 17.131 38.448 4.931 1.00 47.54 C ATOM 29 C ILE A 3 17.332 37.330 3.939 1.00 36.73 C ATOM 30 O ILE A 3 17.038 37.589 2.766 1.00 45.34 O ATOM 31 CB ILE A 3 15.755 38.444 5.612 1.00 58.68 C ATOM 32 CG1 ILE A 3 15.934 39.058 7.006 1.00 60.28 C ATOM 33 CG2 ILE A 3 15.136 37.065 5.697 1.00 53.73 C ATOM 34 CD1 ILE A 3 14.663 39.486 7.689 1.00 68.31 C ATOM 35 HA ILE A 3 17.871 38.306 5.719 1.00 0.00 H ATOM 36 HB ILE A 3 15.059 39.029 5.011 1.00 0.00 H ATOM 37 HG12 ILE A 3 16.424 38.319 7.639 1.00 0.00 H ATOM 38 HG13 ILE A 3 16.576 39.934 6.909 1.00 0.00 H ATOM 39 HD11 ILE A 3 14.161 40.239 7.081 1.00 0.00 H ATOM 40 HD12 ILE A 3 14.010 38.622 7.813 1.00 0.00 H ATOM 41 HD13 ILE A 3 14.901 39.906 8.666 1.00 0.00 H ATOM 42 HG21 ILE A 3 15.008 36.663 4.692 1.00 0.00 H ATOM 43 HG22 ILE A 3 15.790 36.409 6.271 1.00 0.00 H ATOM 44 HG23 ILE A 3 14.166 37.133 6.189 1.00 0.00 H ATOM 45 H ILE A 3 16.601 40.026 3.503 1.00 0.00 H ATOM 46 N THR A 4 17.869 36.191 4.333 1.00 34.92 N ATOM 47 CA THR A 4 17.905 35.039 3.421 1.00 42.97 C ATOM 48 C THR A 4 17.078 33.901 4.006 1.00 40.97 C ATOM 49 O THR A 4 16.628 34.014 5.143 1.00 42.00 O ATOM 50 CB THR A 4 19.350 34.611 3.129 1.00 44.54 C ATOM 51 OG1 THR A 4 20.063 34.503 4.362 1.00 42.76 O ATOM 52 CG2 THR A 4 20.092 35.665 2.305 1.00 47.40 C ATOM 53 HA THR A 4 17.466 35.323 2.465 1.00 0.00 H ATOM 54 HB THR A 4 19.305 33.668 2.585 1.00 0.00 H ATOM 55 HG1 THR A 4 19.624 33.827 4.937 1.00 0.00 H ATOM 56 HG23 THR A 4 19.591 35.793 1.345 1.00 0.00 H ATOM 57 HG21 THR A 4 20.093 36.612 2.845 1.00 0.00 H ATOM 58 HG22 THR A 4 21.119 35.339 2.140 1.00 0.00 H ATOM 59 H THR A 4 18.267 36.108 5.290 1.00 0.00 H ATOM 60 N ALA A 5 16.732 32.901 3.214 1.00 38.10 N ATOM 61 CA ALA A 5 15.921 31.798 3.753 1.00 42.42 C ATOM 62 C ALA A 5 16.269 30.530 2.987 1.00 40.31 C ATOM 63 O ALA A 5 16.633 30.688 1.817 1.00 34.30 O ATOM 64 CB ALA A 5 14.474 32.211 3.589 1.00 28.74 C ATOM 65 HA ALA A 5 16.111 31.594 4.807 1.00 0.00 H ATOM 66 HB1 ALA A 5 14.296 33.133 4.142 1.00 0.00 H ATOM 67 HB2 ALA A 5 14.261 32.372 2.532 1.00 0.00 H ATOM 68 HB3 ALA A 5 13.827 31.424 3.975 1.00 0.00 H ATOM 69 H ALA A 5 17.031 32.894 2.218 1.00 0.00 H ATOM 70 N TYR A 6 16.273 29.356 3.604 1.00 34.87 N ATOM 71 CA TYR A 6 16.192 28.157 2.741 1.00 35.41 C ATOM 72 C TYR A 6 15.212 27.128 3.268 1.00 31.32 C ATOM 73 O TYR A 6 14.949 27.115 4.476 1.00 32.60 O ATOM 74 CB TYR A 6 17.593 27.597 2.611 1.00 37.44 C ATOM 75 CG TYR A 6 18.275 27.210 3.902 1.00 32.49 C ATOM 76 CD1 TYR A 6 18.032 25.956 4.445 1.00 34.23 C ATOM 77 CD2 TYR A 6 19.177 28.044 4.550 1.00 30.45 C ATOM 78 CE1 TYR A 6 18.622 25.567 5.637 1.00 27.17 C ATOM 79 CE2 TYR A 6 19.772 27.662 5.735 1.00 29.96 C ATOM 80 CZ TYR A 6 19.511 26.406 6.252 1.00 27.68 C ATOM 81 OH TYR A 6 20.105 25.977 7.419 1.00 35.97 O ATOM 82 HA TYR A 6 15.805 28.434 1.760 1.00 0.00 H ATOM 83 HB3 TYR A 6 18.209 28.351 2.121 1.00 0.00 H ATOM 84 HB2 TYR A 6 17.540 26.708 1.982 1.00 0.00 H ATOM 85 HD2 TYR A 6 19.418 29.014 4.116 1.00 0.00 H ATOM 86 HE2 TYR A 6 20.442 28.344 6.259 1.00 0.00 H ATOM 87 HE1 TYR A 6 18.380 24.601 6.081 1.00 0.00 H ATOM 88 HD1 TYR A 6 17.367 25.266 3.926 1.00 0.00 H ATOM 89 HH TYR A 6 19.797 25.059 7.627 1.00 0.00 H ATOM 90 H TYR A 6 16.330 29.282 4.640 1.00 0.00 H ATOM 91 N SER A 7 14.695 26.247 2.400 1.00 36.47 N ATOM 92 CA SER A 7 13.777 25.209 2.856 1.00 35.37 C ATOM 93 C SER A 7 14.518 23.902 3.139 1.00 37.72 C ATOM 94 O SER A 7 15.569 23.713 2.565 1.00 41.96 O ATOM 95 CB SER A 7 12.665 24.770 1.924 1.00 25.41 C ATOM 96 OG SER A 7 12.777 25.257 0.596 1.00 34.64 O ATOM 97 HA SER A 7 13.336 25.711 3.717 1.00 0.00 H ATOM 98 HB2 SER A 7 11.719 25.120 2.336 1.00 0.00 H ATOM 99 HB3 SER A 7 12.663 23.681 1.887 1.00 0.00 H ATOM 100 HG SER A 7 12.015 24.925 0.058 1.00 0.00 H ATOM 101 H SER A 7 14.950 26.304 1.393 1.00 0.00 H ATOM 102 N GLN A 8 13.897 22.998 3.861 1.00 39.25 N ATOM 103 CA GLN A 8 14.330 21.611 3.914 1.00 35.33 C ATOM 104 C GLN A 8 13.023 20.827 4.058 1.00 33.50 C ATOM 105 O GLN A 8 12.186 21.202 4.867 1.00 36.06 O ATOM 106 CB GLN A 8 15.248 21.269 5.076 1.00 30.04 C ATOM 107 CG GLN A 8 16.582 21.976 5.105 1.00 34.29 C ATOM 108 CD GLN A 8 17.370 21.768 6.380 1.00 36.10 C ATOM 109 OE1 GLN A 8 16.835 21.670 7.486 1.00 37.08 O ATOM 110 NE2 GLN A 8 18.683 21.723 6.250 1.00 26.58 N ATOM 111 HA GLN A 8 14.920 21.377 3.028 1.00 0.00 H ATOM 112 HB2 GLN A 8 14.722 21.514 5.999 1.00 0.00 H ATOM 113 HB3 GLN A 8 15.441 20.197 5.043 1.00 0.00 H ATOM 114 HG2 GLN A 8 17.180 21.611 4.270 1.00 0.00 H ATOM 115 HG3 GLN A 8 16.405 23.045 4.983 1.00 0.00 H ATOM 116 HE22 GLN A 8 19.115 21.808 5.308 1.00 0.00 H ATOM 117 HE21 GLN A 8 19.285 21.603 7.090 1.00 0.00 H ATOM 118 H GLN A 8 13.065 23.285 4.415 1.00 0.00 H ATOM 119 N GLN A 9 12.844 19.830 3.227 1.00 34.94 N ATOM 120 CA GLN A 9 11.557 19.115 3.227 1.00 34.39 C ATOM 121 C GLN A 9 11.648 18.056 4.295 1.00 32.68 C ATOM 122 O GLN A 9 12.768 17.632 4.632 1.00 33.24 O ATOM 123 CB GLN A 9 11.320 18.729 1.783 1.00 23.81 C ATOM 124 CG GLN A 9 10.418 17.536 1.517 1.00 58.32 C ATOM 125 CD GLN A 9 10.532 17.202 0.019 1.00 65.45 C ATOM 126 OE1 GLN A 9 10.941 16.095 -0.360 1.00 44.60 O ATOM 127 NE2 GLN A 9 10.234 18.225 -0.786 1.00 59.67 N ATOM 128 HA GLN A 9 10.657 19.661 3.511 1.00 0.00 H ATOM 129 HB2 GLN A 9 10.879 19.591 1.282 1.00 0.00 H ATOM 130 HB3 GLN A 9 12.291 18.510 1.339 1.00 0.00 H ATOM 131 HG2 GLN A 9 10.740 16.684 2.115 1.00 0.00 H ATOM 132 HG3 GLN A 9 9.387 17.785 1.767 1.00 0.00 H ATOM 133 HE22 GLN A 9 9.896 19.122 -0.383 1.00 0.00 H ATOM 134 HE21 GLN A 9 10.340 18.124 -1.816 1.00 0.00 H ATOM 135 H GLN A 9 13.603 19.547 2.575 1.00 0.00 H ATOM 136 N THR A 10 10.529 17.640 4.904 1.00 34.66 N ATOM 137 CA THR A 10 10.743 16.668 5.996 1.00 34.29 C ATOM 138 C THR A 10 10.006 15.362 5.777 1.00 35.25 C ATOM 139 O THR A 10 10.281 14.450 6.555 1.00 33.34 O ATOM 140 CB THR A 10 10.297 17.174 7.372 1.00 31.26 C ATOM 141 OG1 THR A 10 8.879 17.413 7.259 1.00 44.39 O ATOM 142 CG2 THR A 10 10.970 18.448 7.816 1.00 25.07 C ATOM 143 HA THR A 10 11.823 16.520 5.979 1.00 0.00 H ATOM 144 HB THR A 10 10.566 16.428 8.120 1.00 0.00 H ATOM 145 HG1 THR A 10 8.715 18.090 6.555 1.00 0.00 H ATOM 146 HG23 THR A 10 12.043 18.279 7.905 1.00 0.00 H ATOM 147 HG21 THR A 10 10.784 19.231 7.081 1.00 0.00 H ATOM 148 HG22 THR A 10 10.568 18.752 8.782 1.00 0.00 H ATOM 149 H THR A 10 9.584 17.975 4.629 1.00 0.00 H ATOM 150 N ARG A 11 9.035 15.306 4.893 1.00 36.38 N ATOM 151 CA ARG A 11 8.188 14.135 4.725 1.00 46.75 C ATOM 152 C ARG A 11 7.795 14.187 3.243 1.00 52.74 C ATOM 153 O ARG A 11 7.786 15.360 2.853 1.00 44.17 O ATOM 154 CB ARG A 11 6.856 14.243 5.480 1.00 46.95 C ATOM 155 CG ARG A 11 6.941 14.186 6.979 1.00 57.84 C ATOM 156 CD ARG A 11 5.599 14.129 7.728 1.00 45.84 C ATOM 157 NE ARG A 11 5.984 14.161 9.156 1.00 36.35 N ATOM 158 CZ ARG A 11 6.263 13.003 9.775 1.00 49.62 C ATOM 159 NH1 ARG A 11 6.077 11.857 9.127 1.00 54.88 N ATOM 160 NH2 ARG A 11 6.783 12.968 10.997 1.00 42.57 N ATOM 161 HA ARG A 11 8.717 13.248 5.075 1.00 0.00 H ATOM 162 HB2 ARG A 11 6.394 15.192 5.208 1.00 0.00 H ATOM 163 HB3 ARG A 11 6.218 13.423 5.151 1.00 0.00 H ATOM 164 HG2 ARG A 11 7.511 13.297 7.248 1.00 0.00 H ATOM 165 HG3 ARG A 11 7.475 15.074 7.317 1.00 0.00 H ATOM 166 HD2 ARG A 11 5.062 13.210 7.492 1.00 0.00 H ATOM 167 HD3 ARG A 11 4.977 14.988 7.475 1.00 0.00 H ATOM 168 HE ARG A 11 6.037 15.063 9.670 1.00 0.00 H ATOM 169 HH12 ARG A 11 6.290 10.954 9.596 1.00 0.00 H ATOM 170 HH11 ARG A 11 5.719 11.864 8.151 1.00 0.00 H ATOM 171 HH22 ARG A 11 6.988 12.054 11.449 1.00 0.00 H ATOM 172 HH21 ARG A 11 6.985 13.855 11.502 1.00 0.00 H ATOM 173 H ARG A 11 8.865 16.134 4.288 1.00 0.00 H ATOM 174 N GLY A 12 7.233 13.139 2.678 1.00 58.57 N ATOM 175 CA GLY A 12 6.518 13.329 1.402 1.00 60.93 C ATOM 176 C GLY A 12 5.116 12.743 1.611 1.00 62.87 C ATOM 177 O GLY A 12 4.696 12.745 2.776 1.00 51.02 O ATOM 178 HA3 GLY A 12 7.032 12.803 0.597 1.00 0.00 H ATOM 179 HA2 GLY A 12 6.453 14.389 1.158 1.00 0.00 H ATOM 180 H GLY A 12 7.292 12.200 3.121 1.00 0.00 H ATOM 181 N LEU A 13 4.470 12.241 0.563 1.00 66.75 N ATOM 182 CA LEU A 13 3.110 11.745 0.670 1.00 64.08 C ATOM 183 C LEU A 13 2.847 10.714 1.748 1.00 65.96 C ATOM 184 O LEU A 13 2.145 10.897 2.761 1.00 65.01 O ATOM 185 CB LEU A 13 2.650 11.182 -0.693 1.00 62.88 C ATOM 186 CG LEU A 13 1.618 12.162 -1.298 1.00 66.01 C ATOM 187 CD1 LEU A 13 0.806 11.513 -2.391 1.00 75.55 C ATOM 188 CD2 LEU A 13 0.792 12.619 -0.100 1.00 23.65 C ATOM 189 HA LEU A 13 2.532 12.618 0.973 1.00 0.00 H ATOM 190 HB2 LEU A 13 3.506 11.088 -1.361 1.00 0.00 H ATOM 191 HB3 LEU A 13 2.191 10.203 -0.552 1.00 0.00 H ATOM 192 HG LEU A 13 2.077 13.013 -1.801 1.00 0.00 H ATOM 193 HD21 LEU A 13 0.315 11.755 0.362 1.00 0.00 H ATOM 194 HD22 LEU A 13 1.444 13.106 0.625 1.00 0.00 H ATOM 195 HD23 LEU A 13 0.029 13.322 -0.434 1.00 0.00 H ATOM 196 HD11 LEU A 13 1.472 11.180 -3.187 1.00 0.00 H ATOM 197 HD12 LEU A 13 0.269 10.657 -1.983 1.00 0.00 H ATOM 198 HD13 LEU A 13 0.093 12.235 -2.790 1.00 0.00 H ATOM 199 H LEU A 13 4.952 12.203 -0.358 1.00 0.00 H ATOM 200 N LEU A 14 3.479 9.538 1.610 1.00 66.75 N ATOM 201 CA LEU A 14 3.052 8.442 2.473 1.00 68.05 C ATOM 202 C LEU A 14 3.168 8.877 3.925 1.00 66.40 C ATOM 203 O LEU A 14 2.257 8.662 4.732 1.00 71.05 O ATOM 204 CB LEU A 14 3.625 7.045 2.265 1.00 72.22 C ATOM 205 CG LEU A 14 2.492 6.109 1.765 1.00 94.10 C ATOM 206 CD1 LEU A 14 1.437 5.910 2.848 1.00 77.14 C ATOM 207 CD2 LEU A 14 1.921 6.695 0.475 1.00 80.76 C ATOM 208 HA LEU A 14 2.022 8.275 2.159 1.00 0.00 H ATOM 209 HB2 LEU A 14 4.423 7.083 1.524 1.00 0.00 H ATOM 210 HB3 LEU A 14 4.023 6.668 3.207 1.00 0.00 H ATOM 211 HG LEU A 14 2.882 5.115 1.547 1.00 0.00 H ATOM 212 HD21 LEU A 14 1.524 7.690 0.674 1.00 0.00 H ATOM 213 HD22 LEU A 14 2.711 6.760 -0.274 1.00 0.00 H ATOM 214 HD23 LEU A 14 1.122 6.051 0.107 1.00 0.00 H ATOM 215 HD11 LEU A 14 1.901 5.463 3.727 1.00 0.00 H ATOM 216 HD12 LEU A 14 1.005 6.875 3.114 1.00 0.00 H ATOM 217 HD13 LEU A 14 0.654 5.251 2.474 1.00 0.00 H ATOM 218 H LEU A 14 4.243 9.413 0.915 1.00 0.00 H ATOM 219 N GLY A 15 4.233 9.594 4.242 1.00 60.36 N ATOM 220 CA GLY A 15 4.386 10.126 5.591 1.00 53.99 C ATOM 221 C GLY A 15 3.317 11.183 5.875 1.00 51.55 C ATOM 222 O GLY A 15 2.872 11.344 7.027 1.00 43.45 O ATOM 223 HA3 GLY A 15 5.373 10.578 5.689 1.00 0.00 H ATOM 224 HA2 GLY A 15 4.287 9.313 6.311 1.00 0.00 H ATOM 225 H GLY A 15 4.964 9.779 3.526 1.00 0.00 H ATOM 226 N CYS A 16 2.870 11.891 4.836 1.00 45.91 N ATOM 227 CA CYS A 16 1.877 12.939 5.116 1.00 57.59 C ATOM 228 C CYS A 16 0.540 12.305 5.487 1.00 62.08 C ATOM 229 O CYS A 16 0.169 12.328 6.666 1.00 62.87 O ATOM 230 CB CYS A 16 1.792 13.937 3.974 1.00 46.27 C ATOM 231 SG CYS A 16 0.870 15.427 4.387 1.00 47.51 S ATOM 232 HA CYS A 16 2.195 13.522 5.980 1.00 0.00 H ATOM 233 HB2 CYS A 16 1.304 13.453 3.128 1.00 0.00 H ATOM 234 HB3 CYS A 16 2.805 14.225 3.691 1.00 0.00 H ATOM 235 HG CYS A 16 0.847 16.269 3.294 1.00 0.00 H ATOM 236 H CYS A 16 3.209 11.709 3.870 1.00 0.00 H ATOM 237 N ILE A 17 -0.080 11.593 4.556 1.00 66.91 N ATOM 238 CA ILE A 17 -1.360 10.932 4.772 1.00 68.41 C ATOM 239 C ILE A 17 -1.381 10.106 6.049 1.00 69.65 C ATOM 240 O ILE A 17 -2.344 10.148 6.824 1.00 75.61 O ATOM 241 CB ILE A 17 -1.728 10.056 3.562 1.00 78.27 C ATOM 242 CG1 ILE A 17 -1.917 10.942 2.328 1.00 77.37 C ATOM 243 CG2 ILE A 17 -2.980 9.238 3.835 1.00 90.68 C ATOM 244 CD1 ILE A 17 -1.811 10.191 1.024 1.00 87.51 C ATOM 245 HA ILE A 17 -2.107 11.718 4.886 1.00 0.00 H ATOM 246 HB ILE A 17 -0.914 9.355 3.378 1.00 0.00 H ATOM 247 HG12 ILE A 17 -2.904 11.402 2.382 1.00 0.00 H ATOM 248 HG13 ILE A 17 -1.153 11.720 2.341 1.00 0.00 H ATOM 249 HD11 ILE A 17 -0.825 9.733 0.949 1.00 0.00 H ATOM 250 HD12 ILE A 17 -2.576 9.416 0.989 1.00 0.00 H ATOM 251 HD13 ILE A 17 -1.956 10.883 0.195 1.00 0.00 H ATOM 252 HG21 ILE A 17 -2.809 8.590 4.695 1.00 0.00 H ATOM 253 HG22 ILE A 17 -3.813 9.909 4.045 1.00 0.00 H ATOM 254 HG23 ILE A 17 -3.213 8.630 2.961 1.00 0.00 H ATOM 255 H ILE A 17 0.371 11.502 3.623 1.00 0.00 H ATOM 256 N ILE A 18 -0.314 9.363 6.307 1.00 65.25 N ATOM 257 CA ILE A 18 -0.200 8.594 7.540 1.00 66.69 C ATOM 258 C ILE A 18 -0.161 9.418 8.810 1.00 68.74 C ATOM 259 O ILE A 18 -0.648 8.955 9.850 1.00 67.69 O ATOM 260 CB ILE A 18 1.017 7.649 7.467 1.00 65.38 C ATOM 261 CG1 ILE A 18 0.685 6.512 6.486 1.00 62.91 C ATOM 262 CG2 ILE A 18 1.399 7.060 8.813 1.00 46.60 C ATOM 263 CD1 ILE A 18 1.892 5.702 6.069 1.00 81.67 C ATOM 264 HA ILE A 18 -1.123 8.019 7.608 1.00 0.00 H ATOM 265 HB ILE A 18 1.873 8.234 7.130 1.00 0.00 H ATOM 266 HG12 ILE A 18 -0.032 5.843 6.963 1.00 0.00 H ATOM 267 HG13 ILE A 18 0.236 6.947 5.593 1.00 0.00 H ATOM 268 HD11 ILE A 18 2.615 6.355 5.580 1.00 0.00 H ATOM 269 HD12 ILE A 18 2.347 5.250 6.950 1.00 0.00 H ATOM 270 HD13 ILE A 18 1.581 4.919 5.377 1.00 0.00 H ATOM 271 HG21 ILE A 18 1.648 7.866 9.503 1.00 0.00 H ATOM 272 HG22 ILE A 18 0.560 6.487 9.209 1.00 0.00 H ATOM 273 HG23 ILE A 18 2.262 6.405 8.690 1.00 0.00 H ATOM 274 H ILE A 18 0.460 9.328 5.613 1.00 0.00 H ATOM 275 N THR A 19 0.404 10.609 8.817 1.00 67.42 N ATOM 276 CA THR A 19 0.538 11.442 10.016 1.00 53.78 C ATOM 277 C THR A 19 -0.709 12.274 10.275 1.00 50.29 C ATOM 278 O THR A 19 -1.096 12.673 11.377 1.00 40.25 O ATOM 279 CB THR A 19 1.816 12.284 9.806 1.00 62.60 C ATOM 280 OG1 THR A 19 2.868 11.408 9.332 1.00 55.48 O ATOM 281 CG2 THR A 19 2.395 12.976 11.031 1.00 35.27 C ATOM 282 HA THR A 19 0.635 10.839 10.919 1.00 0.00 H ATOM 283 HB THR A 19 1.501 13.066 9.115 1.00 0.00 H ATOM 284 HG1 THR A 19 2.590 10.994 8.477 1.00 0.00 H ATOM 285 HG23 THR A 19 1.653 13.658 11.446 1.00 0.00 H ATOM 286 HG21 THR A 19 2.661 12.228 11.778 1.00 0.00 H ATOM 287 HG22 THR A 19 3.285 13.536 10.744 1.00 0.00 H ATOM 288 H THR A 19 0.777 10.979 7.919 1.00 0.00 H ATOM 289 N SER A 20 -1.507 12.594 9.258 1.00 46.59 N ATOM 290 CA SER A 20 -2.755 13.332 9.442 1.00 54.63 C ATOM 291 C SER A 20 -3.786 12.421 10.112 1.00 64.02 C ATOM 292 O SER A 20 -4.749 12.792 10.787 1.00 62.47 O ATOM 293 CB SER A 20 -3.313 13.786 8.091 1.00 44.72 C ATOM 294 OG SER A 20 -3.456 12.634 7.255 1.00 68.32 O ATOM 295 HA SER A 20 -2.555 14.206 10.062 1.00 0.00 H ATOM 296 HB2 SER A 20 -2.627 14.495 7.628 1.00 0.00 H ATOM 297 HB3 SER A 20 -4.283 14.261 8.233 1.00 0.00 H ATOM 298 HG SER A 20 -2.572 12.206 7.131 1.00 0.00 H ATOM 299 H SER A 20 -1.232 12.308 8.297 1.00 0.00 H ATOM 300 N LEU A 21 -3.604 11.139 9.777 1.00 71.62 N ATOM 301 CA LEU A 21 -4.529 10.074 10.124 1.00 69.05 C ATOM 302 C LEU A 21 -4.325 9.627 11.564 1.00 67.58 C ATOM 303 O LEU A 21 -5.205 9.189 12.294 1.00 73.77 O ATOM 304 CB LEU A 21 -4.289 8.848 9.243 1.00 53.47 C ATOM 305 CG LEU A 21 -5.305 8.636 8.126 1.00 57.85 C ATOM 306 CD1 LEU A 21 -5.043 7.291 7.477 1.00 77.04 C ATOM 307 CD2 LEU A 21 -6.722 8.722 8.679 1.00 64.70 C ATOM 308 HA LEU A 21 -5.536 10.467 9.982 1.00 0.00 H ATOM 309 HB2 LEU A 21 -3.304 8.949 8.787 1.00 0.00 H ATOM 310 HB3 LEU A 21 -4.303 7.966 9.883 1.00 0.00 H ATOM 311 HG LEU A 21 -5.202 9.417 7.372 1.00 0.00 H ATOM 312 HD21 LEU A 21 -6.861 7.953 9.439 1.00 0.00 H ATOM 313 HD22 LEU A 21 -6.879 9.705 9.122 1.00 0.00 H ATOM 314 HD23 LEU A 21 -7.436 8.569 7.870 1.00 0.00 H ATOM 315 HD11 LEU A 21 -4.033 7.278 7.067 1.00 0.00 H ATOM 316 HD12 LEU A 21 -5.144 6.503 8.223 1.00 0.00 H ATOM 317 HD13 LEU A 21 -5.764 7.129 6.676 1.00 0.00 H ATOM 318 H LEU A 21 -2.751 10.890 9.237 1.00 0.00 H ATOM 319 N THR A 22 -3.087 9.782 11.976 1.00 62.35 N ATOM 320 CA THR A 22 -2.593 9.236 13.240 1.00 55.05 C ATOM 321 C THR A 22 -2.375 10.346 14.252 1.00 50.62 C ATOM 322 O THR A 22 -2.346 10.098 15.460 1.00 39.53 O ATOM 323 CB THR A 22 -1.256 8.559 12.884 1.00 61.79 C ATOM 324 OG1 THR A 22 -0.525 9.428 11.978 1.00 57.28 O ATOM 325 CG2 THR A 22 -1.434 7.200 12.231 1.00 63.10 C ATOM 326 HA THR A 22 -3.300 8.538 13.689 1.00 0.00 H ATOM 327 HB THR A 22 -0.711 8.398 13.814 1.00 0.00 H ATOM 328 HG1 THR A 22 -1.060 9.572 11.158 1.00 0.00 H ATOM 329 HG23 THR A 22 -1.982 6.543 12.906 1.00 0.00 H ATOM 330 HG21 THR A 22 -1.992 7.315 11.302 1.00 0.00 H ATOM 331 HG22 THR A 22 -0.455 6.770 12.018 1.00 0.00 H ATOM 332 H THR A 22 -2.428 10.318 11.376 1.00 0.00 H ATOM 333 N GLY A 23 -1.882 11.483 13.725 1.00 48.63 N ATOM 334 CA GLY A 23 -1.807 12.718 14.496 1.00 45.91 C ATOM 335 C GLY A 23 -0.533 12.813 15.309 1.00 48.15 C ATOM 336 O GLY A 23 -0.348 13.687 16.163 1.00 53.98 O ATOM 337 HA3 GLY A 23 -2.659 12.760 15.174 1.00 0.00 H ATOM 338 HA2 GLY A 23 -1.848 13.563 13.809 1.00 0.00 H ATOM 339 H GLY A 23 -1.546 11.480 12.741 1.00 0.00 H ATOM 340 N ARG A 24 0.363 11.874 15.035 1.00 46.76 N ATOM 341 CA ARG A 24 1.616 11.781 15.817 1.00 48.51 C ATOM 342 C ARG A 24 2.784 12.018 14.874 1.00 47.45 C ATOM 343 O ARG A 24 2.837 11.500 13.756 1.00 44.91 O ATOM 344 CB ARG A 24 1.568 10.459 16.516 1.00 56.02 C ATOM 345 CG ARG A 24 2.598 9.931 17.480 1.00 82.06 C ATOM 346 CD ARG A 24 2.509 8.417 17.362 1.00100.65 C ATOM 347 NE ARG A 24 2.990 7.602 18.456 1.00118.15 N ATOM 348 CZ ARG A 24 3.551 6.415 18.190 1.00127.82 C ATOM 349 NH1 ARG A 24 3.686 5.999 16.936 1.00134.10 N ATOM 350 NH2 ARG A 24 3.988 5.653 19.178 1.00126.59 N ATOM 351 HA ARG A 24 1.741 12.537 16.592 1.00 0.00 H ATOM 352 HB2 ARG A 24 0.631 10.463 17.072 1.00 0.00 H ATOM 353 HB3 ARG A 24 1.513 9.716 15.720 1.00 0.00 H ATOM 354 HG2 ARG A 24 3.594 10.279 17.206 1.00 0.00 H ATOM 355 HG3 ARG A 24 2.370 10.250 18.497 1.00 0.00 H ATOM 356 HD2 ARG A 24 3.076 8.131 16.476 1.00 0.00 H ATOM 357 HD3 ARG A 24 1.458 8.168 17.215 1.00 0.00 H ATOM 358 HE ARG A 24 2.901 7.934 19.438 1.00 0.00 H ATOM 359 HH12 ARG A 24 4.123 5.076 16.738 1.00 0.00 H ATOM 360 HH11 ARG A 24 3.355 6.596 16.152 1.00 0.00 H ATOM 361 HH22 ARG A 24 4.423 4.732 18.971 1.00 0.00 H ATOM 362 HH21 ARG A 24 3.896 5.975 20.163 1.00 0.00 H ATOM 363 H ARG A 24 0.184 11.198 14.265 1.00 0.00 H ATOM 364 N ASP A 25 3.552 13.063 15.169 1.00 54.08 N ATOM 365 CA ASP A 25 4.757 13.407 14.414 1.00 56.95 C ATOM 366 C ASP A 25 5.965 13.295 15.350 1.00 48.74 C ATOM 367 O ASP A 25 6.146 13.989 16.361 1.00 46.69 O ATOM 368 CB ASP A 25 4.684 14.792 13.755 1.00 60.52 C ATOM 369 CG ASP A 25 5.803 15.064 12.764 1.00 73.10 C ATOM 370 OD1 ASP A 25 6.908 14.498 12.959 1.00 84.03 O ATOM 371 OD2 ASP A 25 5.699 15.796 11.752 1.00 69.42 O ATOM 372 HA ASP A 25 4.855 12.703 13.587 1.00 0.00 H ATOM 373 HB2 ASP A 25 3.733 14.872 13.229 1.00 0.00 H ATOM 374 HB3 ASP A 25 4.729 15.548 14.539 1.00 0.00 H ATOM 375 H ASP A 25 3.283 13.664 15.974 1.00 0.00 H ATOM 376 N LYS A 26 6.838 12.366 14.989 1.00 54.35 N ATOM 377 CA LYS A 26 8.030 12.110 15.799 1.00 60.78 C ATOM 378 C LYS A 26 9.184 12.926 15.243 1.00 61.11 C ATOM 379 O LYS A 26 10.172 13.060 15.970 1.00 63.44 O ATOM 380 CB LYS A 26 8.333 10.620 15.942 1.00 80.31 C ATOM 381 CG LYS A 26 7.377 9.933 16.915 1.00 97.73 C ATOM 382 CD LYS A 26 7.608 8.448 17.067 1.00110.48 C ATOM 383 CE LYS A 26 7.061 7.646 15.902 1.00120.83 C ATOM 384 NZ LYS A 26 7.605 8.098 14.592 1.00134.98 N ATOM 385 HA LYS A 26 7.852 12.437 16.823 1.00 0.00 H ATOM 386 HB2 LYS A 26 8.241 10.146 14.965 1.00 0.00 H ATOM 387 HB3 LYS A 26 9.353 10.501 16.307 1.00 0.00 H ATOM 388 HG2 LYS A 26 7.492 10.399 17.894 1.00 0.00 H ATOM 389 HG3 LYS A 26 6.358 10.086 16.559 1.00 0.00 H ATOM 390 HD2 LYS A 26 8.680 8.268 17.141 1.00 0.00 H ATOM 391 HD3 LYS A 26 7.120 8.111 17.982 1.00 0.00 H ATOM 392 HE2 LYS A 26 5.976 7.750 15.885 1.00 0.00 H ATOM 393 HE3 LYS A 26 7.322 6.598 16.046 1.00 0.00 H ATOM 394 HZ1 LYS A 26 7.355 9.096 14.440 1.00 0.00 H ATOM 395 HZ2 LYS A 26 8.640 7.995 14.594 1.00 0.00 H ATOM 396 HZ3 LYS A 26 7.199 7.517 13.831 1.00 0.00 H ATOM 397 H LYS A 26 6.675 11.814 14.123 1.00 0.00 H ATOM 398 N ASN A 27 9.034 13.580 14.094 1.00 55.70 N ATOM 399 CA ASN A 27 10.117 14.343 13.516 1.00 54.29 C ATOM 400 C ASN A 27 10.628 15.452 14.431 1.00 55.41 C ATOM 401 O ASN A 27 9.891 16.072 15.196 1.00 63.82 O ATOM 402 CB ASN A 27 9.763 15.068 12.220 1.00 55.20 C ATOM 403 CG ASN A 27 9.678 14.086 11.069 1.00 41.47 C ATOM 404 OD1 ASN A 27 9.437 14.480 9.932 1.00 36.91 O ATOM 405 ND2 ASN A 27 9.932 12.848 11.458 1.00 54.32 N ATOM 406 HA ASN A 27 10.862 13.566 13.342 1.00 0.00 H ATOM 407 HB2 ASN A 27 8.801 15.566 12.339 1.00 0.00 H ATOM 408 HB3 ASN A 27 10.531 15.810 12.003 1.00 0.00 H ATOM 409 HD22 ASN A 27 10.122 12.647 12.460 1.00 0.00 H ATOM 410 HD21 ASN A 27 9.942 12.076 10.761 1.00 0.00 H ATOM 411 H ASN A 27 8.119 13.541 13.602 1.00 0.00 H ATOM 412 N GLN A 28 11.908 15.735 14.202 1.00 50.73 N ATOM 413 CA GLN A 28 12.477 16.866 14.941 1.00 52.61 C ATOM 414 C GLN A 28 12.059 18.145 14.205 1.00 45.84 C ATOM 415 O GLN A 28 12.125 18.231 12.977 1.00 39.71 O ATOM 416 CB GLN A 28 13.981 16.773 15.116 1.00 68.87 C ATOM 417 CG GLN A 28 14.657 18.117 15.349 1.00 83.95 C ATOM 418 CD GLN A 28 15.175 18.768 14.084 1.00 90.54 C ATOM 419 OE1 GLN A 28 16.394 18.936 13.972 1.00 86.65 O ATOM 420 NE2 GLN A 28 14.360 19.168 13.122 1.00 84.25 N ATOM 421 HA GLN A 28 12.089 16.865 15.960 1.00 0.00 H ATOM 422 HB2 GLN A 28 14.189 16.131 15.972 1.00 0.00 H ATOM 423 HB3 GLN A 28 14.405 16.326 14.217 1.00 0.00 H ATOM 424 HG2 GLN A 28 13.935 18.790 15.811 1.00 0.00 H ATOM 425 HG3 GLN A 28 15.497 17.967 16.027 1.00 0.00 H ATOM 426 HE22 GLN A 28 13.334 19.026 13.217 1.00 0.00 H ATOM 427 HE21 GLN A 28 14.745 19.624 12.270 1.00 0.00 H ATOM 428 H GLN A 28 12.477 15.181 13.531 1.00 0.00 H ATOM 429 N VAL A 29 11.586 19.076 15.013 1.00 34.57 N ATOM 430 CA VAL A 29 11.002 20.288 14.452 1.00 41.25 C ATOM 431 C VAL A 29 12.054 21.394 14.523 1.00 46.35 C ATOM 432 O VAL A 29 12.744 21.472 15.547 1.00 39.75 O ATOM 433 CB VAL A 29 9.698 20.712 15.127 1.00 42.96 C ATOM 434 CG1 VAL A 29 9.328 22.138 14.718 1.00 54.55 C ATOM 435 CG2 VAL A 29 8.614 19.737 14.721 1.00 43.58 C ATOM 436 HA VAL A 29 10.723 20.087 13.418 1.00 0.00 H ATOM 437 HB VAL A 29 9.814 20.700 16.211 1.00 0.00 H ATOM 438 HG11 VAL A 29 10.124 22.819 15.020 1.00 0.00 H ATOM 439 HG12 VAL A 29 9.200 22.183 13.636 1.00 0.00 H ATOM 440 HG13 VAL A 29 8.397 22.425 15.207 1.00 0.00 H ATOM 441 HG21 VAL A 29 8.498 19.755 13.637 1.00 0.00 H ATOM 442 HG22 VAL A 29 8.892 18.733 15.041 1.00 0.00 H ATOM 443 HG23 VAL A 29 7.674 20.023 15.193 1.00 0.00 H ATOM 444 H VAL A 29 11.630 18.945 16.044 1.00 0.00 H ATOM 445 N ASP A 30 12.246 22.068 13.359 1.00 38.86 N ATOM 446 CA ASP A 30 13.240 23.129 13.472 1.00 31.28 C ATOM 447 C ASP A 30 12.732 24.332 12.705 1.00 37.77 C ATOM 448 O ASP A 30 11.836 24.204 11.851 1.00 46.80 O ATOM 449 CB ASP A 30 14.623 22.633 13.015 1.00 37.21 C ATOM 450 CG ASP A 30 15.688 23.655 13.410 1.00 51.83 C ATOM 451 OD1 ASP A 30 15.381 24.597 14.186 1.00 57.98 O ATOM 452 OD2 ASP A 30 16.844 23.538 12.960 1.00 50.45 O ATOM 453 HA ASP A 30 13.379 23.430 14.510 1.00 0.00 H ATOM 454 HB2 ASP A 30 14.842 21.677 13.491 1.00 0.00 H ATOM 455 HB3 ASP A 30 14.624 22.507 11.932 1.00 0.00 H ATOM 456 H ASP A 30 11.737 21.850 12.479 1.00 0.00 H ATOM 457 N GLY A 31 13.231 25.531 12.982 1.00 38.91 N ATOM 458 CA GLY A 31 13.188 26.614 11.997 1.00 33.68 C ATOM 459 C GLY A 31 12.141 27.644 12.375 1.00 37.55 C ATOM 460 O GLY A 31 11.333 27.342 13.266 1.00 39.35 O ATOM 461 HA3 GLY A 31 12.945 26.199 11.019 1.00 0.00 H ATOM 462 HA2 GLY A 31 14.165 27.096 11.953 1.00 0.00 H ATOM 463 H GLY A 31 13.659 25.704 13.914 1.00 0.00 H ATOM 464 N GLU A 32 12.183 28.800 11.716 1.00 30.39 N ATOM 465 CA GLU A 32 11.173 29.789 12.109 1.00 25.58 C ATOM 466 C GLU A 32 9.797 29.650 11.506 1.00 27.68 C ATOM 467 O GLU A 32 8.864 30.299 11.981 1.00 30.20 O ATOM 468 CB GLU A 32 11.614 31.199 11.605 1.00 26.95 C ATOM 469 CG GLU A 32 12.822 31.708 12.315 1.00 32.35 C ATOM 470 CD GLU A 32 14.161 31.137 11.882 1.00 49.33 C ATOM 471 OE1 GLU A 32 14.147 30.347 10.919 1.00 37.22 O ATOM 472 OE2 GLU A 32 15.192 31.493 12.502 1.00 56.97 O ATOM 473 HA GLU A 32 11.109 29.640 13.187 1.00 0.00 H ATOM 474 HB2 GLU A 32 11.835 31.136 10.540 1.00 0.00 H ATOM 475 HB3 GLU A 32 10.794 31.899 11.764 1.00 0.00 H ATOM 476 HG2 GLU A 32 12.861 32.787 12.169 1.00 0.00 H ATOM 477 HG3 GLU A 32 12.698 31.490 13.376 1.00 0.00 H ATOM 478 H GLU A 32 12.885 28.989 10.972 1.00 0.00 H ATOM 479 N VAL A 33 9.659 28.958 10.385 1.00 27.16 N ATOM 480 CA VAL A 33 8.461 28.790 9.596 1.00 25.15 C ATOM 481 C VAL A 33 8.218 27.308 9.283 1.00 26.53 C ATOM 482 O VAL A 33 9.023 26.621 8.649 1.00 35.74 O ATOM 483 CB VAL A 33 8.590 29.500 8.226 1.00 27.87 C ATOM 484 CG1 VAL A 33 7.332 29.423 7.367 1.00 10.15 C ATOM 485 CG2 VAL A 33 8.977 30.960 8.322 1.00 14.34 C ATOM 486 HA VAL A 33 7.645 29.213 10.183 1.00 0.00 H ATOM 487 HB VAL A 33 9.394 28.938 7.751 1.00 0.00 H ATOM 488 HG11 VAL A 33 7.093 28.378 7.168 1.00 0.00 H ATOM 489 HG12 VAL A 33 6.503 29.892 7.897 1.00 0.00 H ATOM 490 HG13 VAL A 33 7.504 29.944 6.425 1.00 0.00 H ATOM 491 HG21 VAL A 33 8.221 31.498 8.894 1.00 0.00 H ATOM 492 HG22 VAL A 33 9.942 31.047 8.822 1.00 0.00 H ATOM 493 HG23 VAL A 33 9.046 31.383 7.320 1.00 0.00 H ATOM 494 H VAL A 33 10.513 28.480 10.032 1.00 0.00 H ATOM 495 N GLN A 34 7.052 26.797 9.625 1.00 22.54 N ATOM 496 CA GLN A 34 6.742 25.376 9.358 1.00 26.23 C ATOM 497 C GLN A 34 6.038 25.343 8.006 1.00 30.98 C ATOM 498 O GLN A 34 5.195 26.225 7.779 1.00 30.52 O ATOM 499 CB GLN A 34 5.873 24.803 10.478 1.00 26.90 C ATOM 500 CG GLN A 34 6.561 24.765 11.875 1.00 31.89 C ATOM 501 CD GLN A 34 7.993 24.337 11.674 1.00 28.53 C ATOM 502 OE1 GLN A 34 8.892 25.124 11.873 1.00 29.88 O ATOM 503 NE2 GLN A 34 8.361 23.155 11.173 1.00 26.07 N ATOM 504 HA GLN A 34 7.640 24.758 9.329 1.00 0.00 H ATOM 505 HB2 GLN A 34 4.974 25.414 10.558 1.00 0.00 H ATOM 506 HB3 GLN A 34 5.596 23.784 10.207 1.00 0.00 H ATOM 507 HG2 GLN A 34 6.530 25.755 12.331 1.00 0.00 H ATOM 508 HG3 GLN A 34 6.048 24.053 12.522 1.00 0.00 H ATOM 509 HE22 GLN A 34 7.644 22.428 10.976 1.00 0.00 H ATOM 510 HE21 GLN A 34 9.364 22.962 10.980 1.00 0.00 H ATOM 511 H GLN A 34 6.342 27.400 10.088 1.00 0.00 H ATOM 512 N VAL A 35 6.397 24.420 7.135 1.00 24.07 N ATOM 513 CA VAL A 35 5.647 24.117 5.933 1.00 18.06 C ATOM 514 C VAL A 35 4.596 23.047 6.270 1.00 30.50 C ATOM 515 O VAL A 35 4.923 21.958 6.743 1.00 28.59 O ATOM 516 CB VAL A 35 6.518 23.648 4.765 1.00 26.36 C ATOM 517 CG1 VAL A 35 5.714 23.554 3.466 1.00 24.79 C ATOM 518 CG2 VAL A 35 7.714 24.566 4.544 1.00 20.82 C ATOM 519 HA VAL A 35 5.177 25.042 5.600 1.00 0.00 H ATOM 520 HB VAL A 35 6.880 22.656 5.035 1.00 0.00 H ATOM 521 HG11 VAL A 35 4.898 22.843 3.596 1.00 0.00 H ATOM 522 HG12 VAL A 35 5.307 24.535 3.221 1.00 0.00 H ATOM 523 HG13 VAL A 35 6.366 23.218 2.660 1.00 0.00 H ATOM 524 HG21 VAL A 35 7.361 25.574 4.325 1.00 0.00 H ATOM 525 HG22 VAL A 35 8.329 24.583 5.444 1.00 0.00 H ATOM 526 HG23 VAL A 35 8.305 24.196 3.706 1.00 0.00 H ATOM 527 H VAL A 35 7.266 23.880 7.321 1.00 0.00 H ATOM 528 N LEU A 36 3.336 23.390 6.011 1.00 29.15 N ATOM 529 CA LEU A 36 2.177 22.600 6.345 1.00 37.31 C ATOM 530 C LEU A 36 1.377 22.078 5.163 1.00 35.93 C ATOM 531 O LEU A 36 1.146 22.772 4.173 1.00 43.25 O ATOM 532 CB LEU A 36 1.211 23.499 7.179 1.00 32.94 C ATOM 533 CG LEU A 36 1.918 24.115 8.386 1.00 34.43 C ATOM 534 CD1 LEU A 36 0.940 24.855 9.284 1.00 41.84 C ATOM 535 CD2 LEU A 36 2.634 23.054 9.220 1.00 35.42 C ATOM 536 HA LEU A 36 2.559 21.728 6.876 1.00 0.00 H ATOM 537 HB2 LEU A 36 0.834 24.300 6.543 1.00 0.00 H ATOM 538 HB3 LEU A 36 0.376 22.892 7.529 1.00 0.00 H ATOM 539 HG LEU A 36 2.650 24.817 7.987 1.00 0.00 H ATOM 540 HD21 LEU A 36 1.907 22.326 9.581 1.00 0.00 H ATOM 541 HD22 LEU A 36 3.379 22.551 8.604 1.00 0.00 H ATOM 542 HD23 LEU A 36 3.124 23.531 10.069 1.00 0.00 H ATOM 543 HD11 LEU A 36 0.462 25.654 8.718 1.00 0.00 H ATOM 544 HD12 LEU A 36 0.182 24.160 9.644 1.00 0.00 H ATOM 545 HD13 LEU A 36 1.477 25.280 10.132 1.00 0.00 H ATOM 546 H LEU A 36 3.175 24.298 5.530 1.00 0.00 H ATOM 547 N SER A 37 0.805 20.898 5.334 1.00 42.21 N ATOM 548 CA SER A 37 -0.101 20.322 4.346 1.00 42.02 C ATOM 549 C SER A 37 -1.256 19.657 5.086 1.00 38.93 C ATOM 550 O SER A 37 -1.085 19.180 6.198 1.00 38.06 O ATOM 551 CB SER A 37 0.588 19.261 3.483 1.00 51.04 C ATOM 552 OG SER A 37 0.029 19.293 2.175 1.00 63.66 O ATOM 553 HA SER A 37 -0.443 21.124 3.692 1.00 0.00 H ATOM 554 HB2 SER A 37 0.434 18.276 3.923 1.00 0.00 H ATOM 555 HB3 SER A 37 1.656 19.471 3.429 1.00 0.00 H ATOM 556 HG SER A 37 0.471 18.609 1.612 1.00 0.00 H ATOM 557 H SER A 37 1.008 20.362 6.202 1.00 0.00 H ATOM 558 N THR A 38 -2.415 19.681 4.467 1.00 42.38 N ATOM 559 CA THR A 38 -3.511 18.778 4.803 1.00 45.39 C ATOM 560 C THR A 38 -3.839 17.939 3.565 1.00 51.08 C ATOM 561 O THR A 38 -3.029 17.902 2.643 1.00 48.46 O ATOM 562 CB THR A 38 -4.736 19.625 5.171 1.00 23.88 C ATOM 563 OG1 THR A 38 -5.116 20.365 3.987 1.00 39.22 O ATOM 564 CG2 THR A 38 -4.396 20.590 6.281 1.00 30.61 C ATOM 565 HA THR A 38 -3.238 18.129 5.635 1.00 0.00 H ATOM 566 HB THR A 38 -5.549 18.986 5.516 1.00 0.00 H ATOM 567 HG1 THR A 38 -5.907 20.925 4.189 1.00 0.00 H ATOM 568 HG23 THR A 38 -4.110 20.031 7.172 1.00 0.00 H ATOM 569 HG21 THR A 38 -3.567 21.225 5.968 1.00 0.00 H ATOM 570 HG22 THR A 38 -5.266 21.208 6.502 1.00 0.00 H ATOM 571 H THR A 38 -2.557 20.374 3.704 1.00 0.00 H ATOM 572 N ALA A 39 -5.050 17.421 3.434 1.00 59.77 N ATOM 573 CA ALA A 39 -5.386 16.528 2.323 1.00 69.27 C ATOM 574 C ALA A 39 -5.416 17.282 0.997 1.00 71.40 C ATOM 575 O ALA A 39 -4.931 16.830 -0.023 1.00 72.28 O ATOM 576 CB ALA A 39 -6.747 15.890 2.585 1.00 73.62 C ATOM 577 HA ALA A 39 -4.619 15.757 2.254 1.00 0.00 H ATOM 578 HB1 ALA A 39 -6.707 15.320 3.513 1.00 0.00 H ATOM 579 HB2 ALA A 39 -7.503 16.671 2.669 1.00 0.00 H ATOM 580 HB3 ALA A 39 -7.000 15.225 1.760 1.00 0.00 H ATOM 581 H ALA A 39 -5.780 17.654 4.137 1.00 0.00 H ATOM 582 N THR A 40 -5.971 18.473 1.057 1.00 73.20 N ATOM 583 CA THR A 40 -6.391 19.273 -0.073 1.00 75.94 C ATOM 584 C THR A 40 -5.491 20.474 -0.322 1.00 71.19 C ATOM 585 O THR A 40 -5.424 20.978 -1.448 1.00 64.23 O ATOM 586 CB THR A 40 -7.850 19.719 0.213 1.00 85.38 C ATOM 587 OG1 THR A 40 -7.953 20.027 1.621 1.00 92.57 O ATOM 588 CG2 THR A 40 -8.815 18.616 -0.179 1.00 92.71 C ATOM 589 HA THR A 40 -6.325 18.678 -0.984 1.00 0.00 H ATOM 590 HB THR A 40 -8.106 20.602 -0.373 1.00 0.00 H ATOM 591 HG1 THR A 40 -8.877 20.315 1.828 1.00 0.00 H ATOM 592 HG23 THR A 40 -8.713 18.407 -1.244 1.00 0.00 H ATOM 593 HG21 THR A 40 -8.587 17.716 0.392 1.00 0.00 H ATOM 594 HG22 THR A 40 -9.835 18.935 0.034 1.00 0.00 H ATOM 595 H THR A 40 -6.122 18.877 2.004 1.00 0.00 H ATOM 596 N GLN A 41 -4.785 20.975 0.693 1.00 69.95 N ATOM 597 CA GLN A 41 -4.015 22.200 0.565 1.00 61.41 C ATOM 598 C GLN A 41 -2.650 22.216 1.255 1.00 55.83 C ATOM 599 O GLN A 41 -2.248 21.354 2.047 1.00 58.19 O ATOM 600 CB GLN A 41 -4.745 23.465 0.999 1.00 53.28 C ATOM 601 CG GLN A 41 -5.992 23.442 1.823 1.00 70.81 C ATOM 602 CD GLN A 41 -6.910 24.638 1.771 1.00 75.12 C ATOM 603 OE1 GLN A 41 -6.814 25.615 1.024 1.00 90.99 O ATOM 604 NE2 GLN A 41 -7.926 24.584 2.623 1.00 88.10 N ATOM 605 HA GLN A 41 -3.862 22.203 -0.514 1.00 0.00 H ATOM 606 HB2 GLN A 41 -4.021 24.051 1.565 1.00 0.00 H ATOM 607 HB3 GLN A 41 -5.001 23.995 0.081 1.00 0.00 H ATOM 608 HG2 GLN A 41 -6.573 22.576 1.505 1.00 0.00 H ATOM 609 HG3 GLN A 41 -5.689 23.313 2.862 1.00 0.00 H ATOM 610 HE22 GLN A 41 -8.026 23.770 3.262 1.00 0.00 H ATOM 611 HE21 GLN A 41 -8.622 25.356 2.652 1.00 0.00 H ATOM 612 H GLN A 41 -4.786 20.473 1.604 1.00 0.00 H ATOM 613 N SER A 42 -2.024 23.349 0.964 1.00 51.09 N ATOM 614 CA SER A 42 -0.647 23.603 1.367 1.00 46.02 C ATOM 615 C SER A 42 -0.414 25.039 1.802 1.00 43.87 C ATOM 616 O SER A 42 -0.934 25.960 1.167 1.00 47.24 O ATOM 617 CB SER A 42 0.290 23.243 0.233 1.00 40.72 C ATOM 618 OG SER A 42 1.288 22.414 0.824 1.00 55.29 O ATOM 619 HA SER A 42 -0.444 22.976 2.235 1.00 0.00 H ATOM 620 HB2 SER A 42 0.740 24.140 -0.192 1.00 0.00 H ATOM 621 HB3 SER A 42 -0.244 22.702 -0.548 1.00 0.00 H ATOM 622 HG SER A 42 1.940 22.140 0.131 1.00 0.00 H ATOM 623 H SER A 42 -2.534 24.081 0.430 1.00 0.00 H ATOM 624 N PHE A 43 0.258 25.260 2.933 1.00 34.67 N ATOM 625 CA PHE A 43 0.276 26.614 3.508 1.00 24.16 C ATOM 626 C PHE A 43 1.425 26.696 4.498 1.00 30.55 C ATOM 627 O PHE A 43 2.151 25.698 4.628 1.00 28.56 O ATOM 628 CB PHE A 43 -1.039 27.020 4.133 1.00 29.59 C ATOM 629 CG PHE A 43 -1.691 26.076 5.110 1.00 44.86 C ATOM 630 CD1 PHE A 43 -2.408 24.983 4.645 1.00 39.25 C ATOM 631 CD2 PHE A 43 -1.599 26.255 6.486 1.00 37.87 C ATOM 632 CE1 PHE A 43 -2.985 24.061 5.504 1.00 37.88 C ATOM 633 CE2 PHE A 43 -2.210 25.378 7.358 1.00 37.84 C ATOM 634 CZ PHE A 43 -2.875 24.257 6.871 1.00 40.25 C ATOM 635 HA PHE A 43 0.427 27.330 2.700 1.00 0.00 H ATOM 636 HB2 PHE A 43 -0.870 27.960 4.657 1.00 0.00 H ATOM 637 HB3 PHE A 43 -1.746 27.181 3.320 1.00 0.00 H ATOM 638 HD2 PHE A 43 -1.036 27.101 6.881 1.00 0.00 H ATOM 639 HE2 PHE A 43 -2.172 25.564 8.431 1.00 0.00 H ATOM 640 HZ PHE A 43 -3.308 23.535 7.563 1.00 0.00 H ATOM 641 HE1 PHE A 43 -3.517 23.195 5.110 1.00 0.00 H ATOM 642 HD1 PHE A 43 -2.521 24.845 3.570 1.00 0.00 H ATOM 643 H PHE A 43 0.764 24.483 3.404 1.00 0.00 H ATOM 644 N LEU A 44 1.531 27.846 5.159 1.00 34.84 N ATOM 645 CA LEU A 44 2.717 28.040 6.021 1.00 34.08 C ATOM 646 C LEU A 44 2.258 28.390 7.438 1.00 36.11 C ATOM 647 O LEU A 44 1.155 28.902 7.673 1.00 37.50 O ATOM 648 CB LEU A 44 3.601 29.107 5.413 1.00 21.75 C ATOM 649 CG LEU A 44 4.319 29.011 4.079 1.00 34.53 C ATOM 650 CD1 LEU A 44 5.052 30.311 3.707 1.00 21.10 C ATOM 651 CD2 LEU A 44 5.391 27.913 4.054 1.00 26.43 C ATOM 652 HA LEU A 44 3.307 27.126 6.088 1.00 0.00 H ATOM 653 HB2 LEU A 44 2.970 29.993 5.336 1.00 0.00 H ATOM 654 HB3 LEU A 44 4.385 29.284 6.149 1.00 0.00 H ATOM 655 HG LEU A 44 3.519 28.791 3.372 1.00 0.00 H ATOM 656 HD21 LEU A 44 6.139 28.120 4.820 1.00 0.00 H ATOM 657 HD22 LEU A 44 4.925 26.947 4.251 1.00 0.00 H ATOM 658 HD23 LEU A 44 5.868 27.895 3.074 1.00 0.00 H ATOM 659 HD11 LEU A 44 4.332 31.127 3.642 1.00 0.00 H ATOM 660 HD12 LEU A 44 5.794 30.540 4.472 1.00 0.00 H ATOM 661 HD13 LEU A 44 5.547 30.185 2.744 1.00 0.00 H ATOM 662 H LEU A 44 0.804 28.584 5.072 1.00 0.00 H ATOM 663 N ALA A 45 3.107 28.098 8.414 1.00 33.26 N ATOM 664 CA ALA A 45 2.992 28.685 9.742 1.00 30.82 C ATOM 665 C ALA A 45 4.304 29.379 10.126 1.00 37.15 C ATOM 666 O ALA A 45 5.436 28.949 9.903 1.00 30.89 O ATOM 667 CB ALA A 45 2.716 27.575 10.736 1.00 28.57 C ATOM 668 HA ALA A 45 2.185 29.417 9.748 1.00 0.00 H ATOM 669 HB1 ALA A 45 1.786 27.073 10.469 1.00 0.00 H ATOM 670 HB2 ALA A 45 3.537 26.858 10.715 1.00 0.00 H ATOM 671 HB3 ALA A 45 2.627 27.999 11.736 1.00 0.00 H ATOM 672 H ALA A 45 3.880 27.428 8.225 1.00 0.00 H ATOM 673 N THR A 46 4.136 30.485 10.810 1.00 33.42 N ATOM 674 CA THR A 46 5.175 31.293 11.369 1.00 29.41 C ATOM 675 C THR A 46 5.160 31.177 12.888 1.00 27.08 C ATOM 676 O THR A 46 4.150 31.363 13.549 1.00 33.41 O ATOM 677 CB THR A 46 4.894 32.779 11.046 1.00 33.08 C ATOM 678 OG1 THR A 46 4.896 32.930 9.622 1.00 42.56 O ATOM 679 CG2 THR A 46 6.018 33.575 11.692 1.00 37.00 C ATOM 680 HA THR A 46 6.128 30.961 10.957 1.00 0.00 H ATOM 681 HB THR A 46 3.932 33.126 11.423 1.00 0.00 H ATOM 682 HG1 THR A 46 4.192 32.355 9.229 1.00 0.00 H ATOM 683 HG23 THR A 46 5.985 33.436 12.773 1.00 0.00 H ATOM 684 HG21 THR A 46 6.976 33.225 11.308 1.00 0.00 H ATOM 685 HG22 THR A 46 5.895 34.632 11.456 1.00 0.00 H ATOM 686 H THR A 46 3.157 30.804 10.960 1.00 0.00 H ATOM 687 N CYS A 47 6.286 30.822 13.454 1.00 33.52 N ATOM 688 CA CYS A 47 6.399 30.762 14.904 1.00 32.81 C ATOM 689 C CYS A 47 6.677 32.127 15.484 1.00 31.43 C ATOM 690 O CYS A 47 7.772 32.663 15.337 1.00 28.51 O ATOM 691 CB CYS A 47 7.437 29.676 15.200 1.00 41.18 C ATOM 692 SG CYS A 47 7.190 28.294 14.024 1.00 58.49 S ATOM 693 HA CYS A 47 5.470 30.482 15.400 1.00 0.00 H ATOM 694 HB2 CYS A 47 7.311 29.316 16.221 1.00 0.00 H ATOM 695 HB3 CYS A 47 8.440 30.085 15.081 1.00 0.00 H ATOM 696 HG CYS A 47 7.348 28.756 12.733 1.00 0.00 H ATOM 697 H CYS A 47 7.107 30.581 12.863 1.00 0.00 H ATOM 698 N VAL A 48 5.667 32.723 16.139 1.00 36.35 N ATOM 699 CA VAL A 48 5.881 33.942 16.930 1.00 37.84 C ATOM 700 C VAL A 48 5.570 33.790 18.415 1.00 44.30 C ATOM 701 O VAL A 48 4.474 33.408 18.859 1.00 45.40 O ATOM 702 CB VAL A 48 4.988 35.085 16.406 1.00 43.50 C ATOM 703 CG1 VAL A 48 5.460 36.427 16.948 1.00 41.70 C ATOM 704 CG2 VAL A 48 4.948 35.125 14.883 1.00 32.68 C ATOM 705 HA VAL A 48 6.944 34.158 16.821 1.00 0.00 H ATOM 706 HB VAL A 48 3.976 34.890 16.762 1.00 0.00 H ATOM 707 HG11 VAL A 48 5.414 36.414 18.037 1.00 0.00 H ATOM 708 HG12 VAL A 48 6.487 36.606 16.628 1.00 0.00 H ATOM 709 HG13 VAL A 48 4.816 37.219 16.566 1.00 0.00 H ATOM 710 HG21 VAL A 48 5.957 35.276 14.498 1.00 0.00 H ATOM 711 HG22 VAL A 48 4.552 34.182 14.506 1.00 0.00 H ATOM 712 HG23 VAL A 48 4.307 35.945 14.559 1.00 0.00 H ATOM 713 H VAL A 48 4.713 32.312 16.085 1.00 0.00 H ATOM 714 N ASN A 49 6.526 34.149 19.273 1.00 48.68 N ATOM 715 CA ASN A 49 6.393 33.926 20.715 1.00 48.31 C ATOM 716 C ASN A 49 5.836 32.563 21.106 1.00 39.94 C ATOM 717 O ASN A 49 4.811 32.552 21.802 1.00 43.73 O ATOM 718 CB ASN A 49 5.426 34.950 21.348 1.00 54.74 C ATOM 719 CG ASN A 49 5.822 36.389 21.056 1.00 71.29 C ATOM 720 OD1 ASN A 49 7.007 36.733 21.145 1.00 56.81 O ATOM 721 ND2 ASN A 49 4.832 37.220 20.702 1.00 48.38 N ATOM 722 HA ASN A 49 7.417 34.016 21.076 1.00 0.00 H ATOM 723 HB2 ASN A 49 4.425 34.776 20.952 1.00 0.00 H ATOM 724 HB3 ASN A 49 5.419 34.802 22.428 1.00 0.00 H ATOM 725 HD22 ASN A 49 3.854 36.870 20.645 1.00 0.00 H ATOM 726 HD21 ASN A 49 5.041 38.215 20.484 1.00 0.00 H ATOM 727 H ASN A 49 7.390 34.600 18.908 1.00 0.00 H ATOM 728 N GLY A 50 6.378 31.454 20.632 1.00 39.10 N ATOM 729 CA GLY A 50 5.894 30.156 21.108 1.00 44.59 C ATOM 730 C GLY A 50 4.535 29.737 20.596 1.00 45.95 C ATOM 731 O GLY A 50 4.005 28.700 21.012 1.00 42.17 O ATOM 732 HA3 GLY A 50 5.845 30.195 22.196 1.00 0.00 H ATOM 733 HA2 GLY A 50 6.615 29.397 20.805 1.00 0.00 H ATOM 734 H GLY A 50 7.141 31.503 19.927 1.00 0.00 H ATOM 735 N VAL A 51 3.954 30.531 19.680 1.00 48.73 N ATOM 736 CA VAL A 51 2.778 30.083 18.930 1.00 41.52 C ATOM 737 C VAL A 51 3.046 30.018 17.428 1.00 37.57 C ATOM 738 O VAL A 51 3.784 30.845 16.891 1.00 41.94 O ATOM 739 CB VAL A 51 1.552 30.937 19.265 1.00 55.35 C ATOM 740 CG1 VAL A 51 0.367 30.573 18.373 1.00 54.86 C ATOM 741 CG2 VAL A 51 1.114 30.724 20.718 1.00 42.84 C ATOM 742 HA VAL A 51 2.557 29.063 19.244 1.00 0.00 H ATOM 743 HB VAL A 51 1.842 31.975 19.104 1.00 0.00 H ATOM 744 HG11 VAL A 51 0.634 30.740 17.330 1.00 0.00 H ATOM 745 HG12 VAL A 51 0.112 29.524 18.520 1.00 0.00 H ATOM 746 HG13 VAL A 51 -0.488 31.196 18.635 1.00 0.00 H ATOM 747 HG21 VAL A 51 0.862 29.675 20.870 1.00 0.00 H ATOM 748 HG22 VAL A 51 1.928 31.004 21.386 1.00 0.00 H ATOM 749 HG23 VAL A 51 0.242 31.343 20.928 1.00 0.00 H ATOM 750 H VAL A 51 4.345 31.478 19.501 1.00 0.00 H ATOM 751 N CYS A 52 2.782 28.873 16.813 1.00 28.81 N ATOM 752 CA CYS A 52 2.726 28.636 15.399 1.00 27.71 C ATOM 753 C CYS A 52 1.405 29.194 14.831 1.00 34.79 C ATOM 754 O CYS A 52 0.311 28.697 15.127 1.00 36.72 O ATOM 755 CB CYS A 52 2.683 27.137 15.037 1.00 40.04 C ATOM 756 SG CYS A 52 4.252 26.249 15.134 1.00 50.25 S ATOM 757 HA CYS A 52 3.621 29.107 14.994 1.00 0.00 H ATOM 758 HB2 CYS A 52 2.315 27.052 14.015 1.00 0.00 H ATOM 759 HB3 CYS A 52 1.983 26.650 15.716 1.00 0.00 H ATOM 760 HG CYS A 52 5.159 26.825 14.268 1.00 0.00 H ATOM 761 H CYS A 52 2.594 28.054 17.425 1.00 0.00 H ATOM 762 N TRP A 53 1.539 30.194 13.982 1.00 32.87 N ATOM 763 CA TRP A 53 0.359 30.934 13.554 1.00 38.08 C ATOM 764 C TRP A 53 0.153 30.652 12.068 1.00 31.97 C ATOM 765 O TRP A 53 1.132 30.688 11.328 1.00 26.39 O ATOM 766 CB TRP A 53 0.598 32.412 13.807 1.00 37.97 C ATOM 767 CG TRP A 53 0.677 32.877 15.223 1.00 45.24 C ATOM 768 CD1 TRP A 53 1.818 33.092 15.935 1.00 37.72 C ATOM 769 CD2 TRP A 53 -0.421 33.202 16.100 1.00 31.41 C ATOM 770 NE1 TRP A 53 1.496 33.540 17.203 1.00 27.45 N ATOM 771 CE2 TRP A 53 0.134 33.621 17.316 1.00 33.05 C ATOM 772 CE3 TRP A 53 -1.814 33.212 15.955 1.00 36.48 C ATOM 773 CZ2 TRP A 53 -0.654 34.026 18.403 1.00 37.20 C ATOM 774 CZ3 TRP A 53 -2.587 33.620 17.034 1.00 47.60 C ATOM 775 CH2 TRP A 53 -2.007 34.011 18.264 1.00 25.46 C ATOM 776 HA TRP A 53 -0.533 30.633 14.104 1.00 0.00 H ATOM 777 HB2 TRP A 53 1.540 32.675 13.326 1.00 0.00 H ATOM 778 HB3 TRP A 53 -0.216 32.958 13.331 1.00 0.00 H ATOM 779 HE1 TRP A 53 2.179 33.777 17.951 1.00 0.00 H ATOM 780 HD1 TRP A 53 2.830 32.935 15.562 1.00 0.00 H ATOM 781 HZ2 TRP A 53 -0.193 34.345 19.338 1.00 0.00 H ATOM 782 HH2 TRP A 53 -2.644 34.300 19.100 1.00 0.00 H ATOM 783 HZ3 TRP A 53 -3.672 33.640 16.930 1.00 0.00 H ATOM 784 HE3 TRP A 53 -2.280 32.907 15.018 1.00 0.00 H ATOM 785 H TRP A 53 2.479 30.452 13.621 1.00 0.00 H ATOM 786 N THR A 54 -1.067 30.414 11.678 1.00 30.18 N ATOM 787 CA THR A 54 -1.424 30.296 10.277 1.00 24.65 C ATOM 788 C THR A 54 -2.844 30.760 9.983 1.00 24.96 C ATOM 789 O THR A 54 -3.587 31.229 10.847 1.00 30.08 O ATOM 790 CB THR A 54 -1.232 28.850 9.805 1.00 31.39 C ATOM 791 OG1 THR A 54 -1.423 28.835 8.383 1.00 37.76 O ATOM 792 CG2 THR A 54 -2.168 27.917 10.545 1.00 40.58 C ATOM 793 HA THR A 54 -0.757 30.958 9.725 1.00 0.00 H ATOM 794 HB THR A 54 -0.229 28.487 10.028 1.00 0.00 H ATOM 795 HG1 THR A 54 -0.758 29.431 7.956 1.00 0.00 H ATOM 796 HG23 THR A 54 -1.969 27.978 11.615 1.00 0.00 H ATOM 797 HG21 THR A 54 -3.200 28.209 10.349 1.00 0.00 H ATOM 798 HG22 THR A 54 -2.006 26.895 10.202 1.00 0.00 H ATOM 799 H THR A 54 -1.811 30.305 12.396 1.00 0.00 H ATOM 800 N VAL A 55 -3.237 30.631 8.725 1.00 23.58 N ATOM 801 CA VAL A 55 -4.484 31.145 8.222 1.00 26.01 C ATOM 802 C VAL A 55 -5.599 30.112 8.415 1.00 31.09 C ATOM 803 O VAL A 55 -5.387 28.941 8.126 1.00 35.34 O ATOM 804 CB VAL A 55 -4.423 31.495 6.722 1.00 30.04 C ATOM 805 CG1 VAL A 55 -3.802 32.853 6.531 1.00 31.57 C ATOM 806 CG2 VAL A 55 -3.737 30.416 5.909 1.00 20.31 C ATOM 807 HA VAL A 55 -4.686 32.056 8.786 1.00 0.00 H ATOM 808 HB VAL A 55 -5.443 31.541 6.340 1.00 0.00 H ATOM 809 HG11 VAL A 55 -4.402 33.601 7.049 1.00 0.00 H ATOM 810 HG12 VAL A 55 -2.791 32.850 6.939 1.00 0.00 H ATOM 811 HG13 VAL A 55 -3.765 33.088 5.467 1.00 0.00 H ATOM 812 HG21 VAL A 55 -2.716 30.286 6.268 1.00 0.00 H ATOM 813 HG22 VAL A 55 -4.284 29.479 6.016 1.00 0.00 H ATOM 814 HG23 VAL A 55 -3.719 30.710 4.859 1.00 0.00 H ATOM 815 H VAL A 55 -2.610 30.130 8.064 1.00 0.00 H ATOM 816 N TYR A 56 -6.754 30.581 8.888 1.00 26.43 N ATOM 817 CA TYR A 56 -7.891 29.729 9.124 1.00 24.10 C ATOM 818 C TYR A 56 -8.478 29.182 7.819 1.00 38.42 C ATOM 819 O TYR A 56 -8.935 28.021 7.802 1.00 47.57 O ATOM 820 CB TYR A 56 -8.974 30.468 9.913 1.00 25.52 C ATOM 821 CG TYR A 56 -10.242 29.665 10.114 1.00 35.54 C ATOM 822 CD1 TYR A 56 -11.287 29.658 9.196 1.00 37.07 C ATOM 823 CD2 TYR A 56 -10.369 28.870 11.248 1.00 45.36 C ATOM 824 CE1 TYR A 56 -12.415 28.888 9.413 1.00 41.04 C ATOM 825 CE2 TYR A 56 -11.485 28.076 11.471 1.00 35.59 C ATOM 826 CZ TYR A 56 -12.492 28.121 10.563 1.00 42.12 C ATOM 827 OH TYR A 56 -13.573 27.297 10.821 1.00 55.37 O ATOM 828 HA TYR A 56 -7.536 28.884 9.713 1.00 0.00 H ATOM 829 HB3 TYR A 56 -9.228 31.382 9.375 1.00 0.00 H ATOM 830 HB2 TYR A 56 -8.571 30.724 10.893 1.00 0.00 H ATOM 831 HD2 TYR A 56 -9.566 28.871 11.985 1.00 0.00 H ATOM 832 HE2 TYR A 56 -11.551 27.435 12.350 1.00 0.00 H ATOM 833 HE1 TYR A 56 -13.231 28.885 8.690 1.00 0.00 H ATOM 834 HD1 TYR A 56 -11.216 30.267 8.295 1.00 0.00 H ATOM 835 HH TYR A 56 -13.974 27.544 11.692 1.00 0.00 H ATOM 836 H TYR A 56 -6.837 31.597 9.094 1.00 0.00 H ATOM 837 N HIS A 57 -8.400 29.914 6.696 1.00 28.31 N ATOM 838 CA HIS A 57 -8.813 29.256 5.463 1.00 34.63 C ATOM 839 C HIS A 57 -7.920 28.086 5.093 1.00 33.34 C ATOM 840 O HIS A 57 -8.306 27.396 4.143 1.00 43.07 O ATOM 841 CB HIS A 57 -8.949 30.220 4.294 1.00 23.98 C ATOM 842 CG HIS A 57 -7.652 30.741 3.774 1.00 45.78 C ATOM 843 ND1 HIS A 57 -7.173 32.020 4.049 1.00 32.35 N ATOM 844 CD2 HIS A 57 -6.753 30.109 2.968 1.00 23.18 C ATOM 845 CE1 HIS A 57 -6.029 32.159 3.398 1.00 39.37 C ATOM 846 NE2 HIS A 57 -5.737 31.027 2.755 1.00 29.08 N ATOM 847 HA HIS A 57 -9.805 28.857 5.674 1.00 0.00 H ATOM 848 HB2 HIS A 57 -9.459 29.702 3.482 1.00 0.00 H ATOM 849 HB3 HIS A 57 -9.552 31.068 4.619 1.00 0.00 H ATOM 850 HD2 HIS A 57 -6.819 29.095 2.574 1.00 0.00 H ATOM 851 HE1 HIS A 57 -5.418 33.062 3.389 1.00 0.00 H ATOM 852 H HIS A 57 -8.063 30.898 6.706 1.00 0.00 H ATOM 853 N GLY A 58 -6.784 27.856 5.730 1.00 32.21 N ATOM 854 CA GLY A 58 -5.977 26.676 5.436 1.00 34.10 C ATOM 855 C GLY A 58 -6.119 25.588 6.490 1.00 40.14 C ATOM 856 O GLY A 58 -6.305 24.412 6.145 1.00 39.02 O ATOM 857 HA3 GLY A 58 -4.930 26.974 5.382 1.00 0.00 H ATOM 858 HA2 GLY A 58 -6.289 26.271 4.473 1.00 0.00 H ATOM 859 H GLY A 58 -6.460 28.529 6.454 1.00 0.00 H ATOM 860 N ALA A 59 -6.144 25.916 7.792 1.00 35.82 N ATOM 861 CA ALA A 59 -6.067 24.807 8.750 1.00 34.01 C ATOM 862 C ALA A 59 -7.449 24.427 9.277 1.00 31.66 C ATOM 863 O ALA A 59 -7.622 23.336 9.830 1.00 32.81 O ATOM 864 CB ALA A 59 -5.100 25.095 9.873 1.00 40.16 C ATOM 865 HA ALA A 59 -5.675 23.945 8.211 1.00 0.00 H ATOM 866 HB1 ALA A 59 -4.104 25.259 9.460 1.00 0.00 H ATOM 867 HB2 ALA A 59 -5.424 25.987 10.410 1.00 0.00 H ATOM 868 HB3 ALA A 59 -5.076 24.247 10.557 1.00 0.00 H ATOM 869 H ALA A 59 -6.214 26.905 8.105 1.00 0.00 H ATOM 870 N GLY A 60 -8.396 25.314 9.019 1.00 24.32 N ATOM 871 CA GLY A 60 -9.755 25.095 9.535 1.00 28.35 C ATOM 872 C GLY A 60 -9.664 25.056 11.061 1.00 34.90 C ATOM 873 O GLY A 60 -8.787 25.727 11.634 1.00 27.48 O ATOM 874 HA3 GLY A 60 -10.148 24.150 9.161 1.00 0.00 H ATOM 875 HA2 GLY A 60 -10.409 25.909 9.221 1.00 0.00 H ATOM 876 H GLY A 60 -8.180 26.161 8.455 1.00 0.00 H ATOM 877 N SER A 61 -10.176 23.943 11.609 1.00 38.72 N ATOM 878 CA SER A 61 -10.151 23.943 13.101 1.00 38.13 C ATOM 879 C SER A 61 -9.307 22.728 13.482 1.00 38.60 C ATOM 880 O SER A 61 -9.477 22.141 14.558 1.00 35.37 O ATOM 881 CB SER A 61 -11.620 23.918 13.544 1.00 37.35 C ATOM 882 OG SER A 61 -12.061 22.643 13.016 1.00 57.84 O ATOM 883 HA SER A 61 -9.703 24.806 13.592 1.00 0.00 H ATOM 884 HB2 SER A 61 -12.181 24.745 13.109 1.00 0.00 H ATOM 885 HB3 SER A 61 -11.709 23.952 14.630 1.00 0.00 H ATOM 886 HG SER A 61 -11.519 21.917 13.415 1.00 0.00 H ATOM 887 H SER A 61 -10.555 23.154 11.047 1.00 0.00 H ATOM 888 N LYS A 62 -8.377 22.339 12.573 1.00 28.40 N ATOM 889 CA LYS A 62 -7.720 21.060 12.759 1.00 24.62 C ATOM 890 C LYS A 62 -6.648 21.140 13.831 1.00 20.98 C ATOM 891 O LYS A 62 -6.120 22.194 14.150 1.00 31.30 O ATOM 892 CB LYS A 62 -7.016 20.535 11.502 1.00 28.71 C ATOM 893 CG LYS A 62 -8.046 20.349 10.402 1.00 18.75 C ATOM 894 CD LYS A 62 -7.318 19.981 9.102 1.00 26.10 C ATOM 895 CE LYS A 62 -8.351 20.125 7.972 1.00 27.51 C ATOM 896 NZ LYS A 62 -8.219 18.977 7.046 1.00 45.14 N ATOM 897 HA LYS A 62 -8.531 20.385 13.034 1.00 0.00 H ATOM 898 HB2 LYS A 62 -6.261 21.252 11.179 1.00 0.00 H ATOM 899 HB3 LYS A 62 -6.538 19.580 11.722 1.00 0.00 H ATOM 900 HG2 LYS A 62 -8.735 19.550 10.676 1.00 0.00 H ATOM 901 HG3 LYS A 62 -8.603 21.275 10.261 1.00 0.00 H ATOM 902 HD2 LYS A 62 -6.479 20.656 8.935 1.00 0.00 H ATOM 903 HD3 LYS A 62 -6.953 18.955 9.151 1.00 0.00 H ATOM 904 HE2 LYS A 62 -8.173 21.054 7.430 1.00 0.00 H ATOM 905 HE3 LYS A 62 -9.355 20.140 8.395 1.00 0.00 H ATOM 906 HZ1 LYS A 62 -7.260 18.966 6.645 1.00 0.00 H ATOM 907 HZ2 LYS A 62 -8.389 18.092 7.566 1.00 0.00 H ATOM 908 HZ3 LYS A 62 -8.916 19.070 6.279 1.00 0.00 H ATOM 909 H LYS A 62 -8.141 22.945 11.761 1.00 0.00 H ATOM 910 N THR A 63 -6.331 19.972 14.377 1.00 28.33 N ATOM 911 CA THR A 63 -5.134 19.799 15.187 1.00 26.40 C ATOM 912 C THR A 63 -3.950 19.756 14.217 1.00 29.48 C ATOM 913 O THR A 63 -4.045 19.675 12.996 1.00 27.01 O ATOM 914 CB THR A 63 -5.223 18.522 16.021 1.00 27.58 C ATOM 915 OG1 THR A 63 -5.253 17.429 15.082 1.00 33.64 O ATOM 916 CG2 THR A 63 -6.479 18.373 16.871 1.00 21.88 C ATOM 917 HA THR A 63 -5.016 20.619 15.896 1.00 0.00 H ATOM 918 HB THR A 63 -4.377 18.544 16.708 1.00 0.00 H ATOM 919 HG1 THR A 63 -4.427 17.441 14.536 1.00 0.00 H ATOM 920 HG23 THR A 63 -6.516 19.176 17.607 1.00 0.00 H ATOM 921 HG21 THR A 63 -7.359 18.426 16.230 1.00 0.00 H ATOM 922 HG22 THR A 63 -6.458 17.411 17.382 1.00 0.00 H ATOM 923 H THR A 63 -6.957 19.156 14.221 1.00 0.00 H ATOM 924 N LEU A 64 -2.775 19.959 14.769 1.00 33.78 N ATOM 925 CA LEU A 64 -1.467 19.913 14.144 1.00 33.30 C ATOM 926 C LEU A 64 -0.785 18.649 14.647 1.00 35.64 C ATOM 927 O LEU A 64 -0.643 18.544 15.879 1.00 42.25 O ATOM 928 CB LEU A 64 -0.614 21.105 14.640 1.00 27.85 C ATOM 929 CG LEU A 64 0.825 21.143 14.074 1.00 49.70 C ATOM 930 CD1 LEU A 64 0.862 21.123 12.551 1.00 26.12 C ATOM 931 CD2 LEU A 64 1.592 22.336 14.643 1.00 39.35 C ATOM 932 HA LEU A 64 -1.565 19.942 13.059 1.00 0.00 H ATOM 933 HB2 LEU A 64 -1.118 22.028 14.352 1.00 0.00 H ATOM 934 HB3 LEU A 64 -0.551 21.050 15.727 1.00 0.00 H ATOM 935 HG LEU A 64 1.323 20.228 14.396 1.00 0.00 H ATOM 936 HD21 LEU A 64 1.079 23.259 14.372 1.00 0.00 H ATOM 937 HD22 LEU A 64 1.640 22.251 15.729 1.00 0.00 H ATOM 938 HD23 LEU A 64 2.602 22.346 14.233 1.00 0.00 H ATOM 939 HD11 LEU A 64 0.386 20.212 12.189 1.00 0.00 H ATOM 940 HD12 LEU A 64 0.329 21.992 12.164 1.00 0.00 H ATOM 941 HD13 LEU A 64 1.898 21.151 12.214 1.00 0.00 H ATOM 942 H LEU A 64 -2.784 20.181 15.785 1.00 0.00 H ATOM 943 N ALA A 65 -0.448 17.704 13.805 1.00 35.33 N ATOM 944 CA ALA A 65 0.291 16.519 14.260 1.00 39.12 C ATOM 945 C ALA A 65 1.484 16.849 15.144 1.00 40.81 C ATOM 946 O ALA A 65 2.365 17.626 14.762 1.00 47.47 O ATOM 947 CB ALA A 65 0.757 15.769 13.016 1.00 39.31 C ATOM 948 HA ALA A 65 -0.374 15.915 14.877 1.00 0.00 H ATOM 949 HB1 ALA A 65 -0.110 15.476 12.424 1.00 0.00 H ATOM 950 HB2 ALA A 65 1.401 16.418 12.422 1.00 0.00 H ATOM 951 HB3 ALA A 65 1.312 14.880 13.316 1.00 0.00 H ATOM 952 H ALA A 65 -0.707 17.794 12.802 1.00 0.00 H ATOM 953 N GLY A 66 1.596 16.240 16.315 1.00 50.04 N ATOM 954 CA GLY A 66 2.670 16.487 17.263 1.00 55.40 C ATOM 955 C GLY A 66 3.407 15.265 17.813 1.00 54.12 C ATOM 956 O GLY A 66 3.218 14.105 17.427 1.00 42.94 O ATOM 957 HA3 GLY A 66 2.243 17.023 18.111 1.00 0.00 H ATOM 958 HA2 GLY A 66 3.406 17.120 16.768 1.00 0.00 H ATOM 959 H GLY A 66 0.870 15.541 16.572 1.00 0.00 H ATOM 960 N PRO A 67 4.310 15.525 18.768 1.00 55.38 N ATOM 961 CA PRO A 67 5.210 14.483 19.265 1.00 63.61 C ATOM 962 C PRO A 67 4.416 13.510 20.126 1.00 67.80 C ATOM 963 O PRO A 67 4.589 12.295 20.044 1.00 72.80 O ATOM 964 CB PRO A 67 6.230 15.181 20.146 1.00 59.58 C ATOM 965 CG PRO A 67 5.967 16.632 20.048 1.00 55.62 C ATOM 966 CD PRO A 67 4.926 16.860 18.984 1.00 51.55 C ATOM 967 HA PRO A 67 5.682 13.941 18.445 1.00 0.00 H ATOM 968 HD3 PRO A 67 4.179 17.578 19.324 1.00 0.00 H ATOM 969 HD2 PRO A 67 5.387 17.224 18.066 1.00 0.00 H ATOM 970 HG3 PRO A 67 6.886 17.155 19.782 1.00 0.00 H ATOM 971 HG2 PRO A 67 5.602 17.005 21.005 1.00 0.00 H ATOM 972 HB2 PRO A 67 6.122 14.850 21.179 1.00 0.00 H ATOM 973 HB3 PRO A 67 7.239 14.959 19.799 1.00 0.00 H ATOM 974 N LYS A 68 3.558 14.150 20.933 1.00 57.27 N ATOM 975 CA LYS A 68 2.640 13.393 21.777 1.00 54.25 C ATOM 976 C LYS A 68 1.209 13.372 21.262 1.00 51.24 C ATOM 977 O LYS A 68 0.271 13.572 22.045 1.00 49.78 O ATOM 978 CB LYS A 68 2.645 14.012 23.180 1.00 50.20 C ATOM 979 CG LYS A 68 4.068 14.130 23.700 1.00 59.15 C ATOM 980 CD LYS A 68 4.149 15.217 24.747 1.00 46.38 C ATOM 981 CE LYS A 68 4.236 14.627 26.147 1.00 71.42 C ATOM 982 NZ LYS A 68 5.096 15.534 26.984 1.00 93.15 N ATOM 983 HA LYS A 68 2.990 12.361 21.780 1.00 0.00 H ATOM 984 HB2 LYS A 68 2.194 15.003 23.137 1.00 0.00 H ATOM 985 HB3 LYS A 68 2.067 13.380 23.854 1.00 0.00 H ATOM 986 HG2 LYS A 68 4.371 13.180 24.141 1.00 0.00 H ATOM 987 HG3 LYS A 68 4.735 14.374 22.873 1.00 0.00 H ATOM 988 HD2 LYS A 68 5.035 15.825 24.561 1.00 0.00 H ATOM 989 HD3 LYS A 68 3.259 15.843 24.679 1.00 0.00 H ATOM 990 HE2 LYS A 68 4.681 13.633 26.102 1.00 0.00 H ATOM 991 HE3 LYS A 68 3.239 14.558 26.582 1.00 0.00 H ATOM 992 HZ1 LYS A 68 6.044 15.597 26.562 1.00 0.00 H ATOM 993 HZ2 LYS A 68 4.667 16.481 27.020 1.00 0.00 H ATOM 994 HZ3 LYS A 68 5.169 15.149 27.947 1.00 0.00 H ATOM 995 H LYS A 68 3.547 15.190 20.957 1.00 0.00 H ATOM 996 N GLY A 69 1.052 13.141 19.962 1.00 46.04 N ATOM 997 CA GLY A 69 -0.308 13.136 19.429 1.00 47.14 C ATOM 998 C GLY A 69 -0.817 14.569 19.228 1.00 46.59 C ATOM 999 O GLY A 69 -0.148 15.563 19.533 1.00 38.32 O ATOM 1000 HA3 GLY A 69 -0.965 12.617 20.128 1.00 0.00 H ATOM 1001 HA2 GLY A 69 -0.315 12.616 18.471 1.00 0.00 H ATOM 1002 H GLY A 69 1.871 12.969 19.345 1.00 0.00 H ATOM 1003 N PRO A 70 -2.031 14.642 18.681 1.00 39.12 N ATOM 1004 CA PRO A 70 -2.426 15.804 17.881 1.00 36.96 C ATOM 1005 C PRO A 70 -2.553 17.030 18.748 1.00 38.57 C ATOM 1006 O PRO A 70 -3.084 16.889 19.848 1.00 44.96 O ATOM 1007 CB PRO A 70 -3.779 15.367 17.328 1.00 40.51 C ATOM 1008 CG PRO A 70 -3.639 13.884 17.181 1.00 41.00 C ATOM 1009 CD PRO A 70 -2.892 13.469 18.427 1.00 27.62 C ATOM 1010 HA PRO A 70 -1.709 16.076 17.106 1.00 0.00 H ATOM 1011 HD3 PRO A 70 -3.576 13.293 19.258 1.00 0.00 H ATOM 1012 HD2 PRO A 70 -2.297 12.573 18.251 1.00 0.00 H ATOM 1013 HG3 PRO A 70 -3.071 13.634 16.285 1.00 0.00 H ATOM 1014 HG2 PRO A 70 -4.616 13.404 17.135 1.00 0.00 H ATOM 1015 HB2 PRO A 70 -4.582 15.615 18.022 1.00 0.00 H ATOM 1016 HB3 PRO A 70 -3.976 15.837 16.364 1.00 0.00 H ATOM 1017 N ILE A 71 -2.146 18.197 18.292 1.00 35.91 N ATOM 1018 CA ILE A 71 -2.153 19.404 19.104 1.00 33.57 C ATOM 1019 C ILE A 71 -3.331 20.332 18.825 1.00 32.88 C ATOM 1020 O ILE A 71 -3.589 20.709 17.678 1.00 45.65 O ATOM 1021 CB ILE A 71 -0.877 20.233 18.827 1.00 36.54 C ATOM 1022 CG1 ILE A 71 0.425 19.453 18.993 1.00 28.67 C ATOM 1023 CG2 ILE A 71 -0.857 21.445 19.743 1.00 34.86 C ATOM 1024 CD1 ILE A 71 1.625 20.231 18.461 1.00 29.08 C ATOM 1025 HA ILE A 71 -2.217 19.052 20.134 1.00 0.00 H ATOM 1026 HB ILE A 71 -0.925 20.526 17.778 1.00 0.00 H ATOM 1027 HG12 ILE A 71 0.580 19.246 20.052 1.00 0.00 H ATOM 1028 HG13 ILE A 71 0.345 18.512 18.448 1.00 0.00 H ATOM 1029 HD11 ILE A 71 1.482 20.436 17.400 1.00 0.00 H ATOM 1030 HD12 ILE A 71 1.717 21.171 19.005 1.00 0.00 H ATOM 1031 HD13 ILE A 71 2.530 19.639 18.599 1.00 0.00 H ATOM 1032 HG21 ILE A 71 -1.739 22.057 19.553 1.00 0.00 H ATOM 1033 HG22 ILE A 71 -0.860 21.114 20.782 1.00 0.00 H ATOM 1034 HG23 ILE A 71 0.042 22.031 19.549 1.00 0.00 H ATOM 1035 H ILE A 71 -1.806 18.258 17.311 1.00 0.00 H ATOM 1036 N THR A 72 -4.047 20.750 19.848 1.00 34.52 N ATOM 1037 CA THR A 72 -5.270 21.521 19.753 1.00 29.68 C ATOM 1038 C THR A 72 -5.010 22.995 19.527 1.00 35.82 C ATOM 1039 O THR A 72 -4.139 23.529 20.209 1.00 37.32 O ATOM 1040 CB THR A 72 -6.081 21.396 21.063 1.00 39.44 C ATOM 1041 OG1 THR A 72 -6.574 20.060 21.137 1.00 32.45 O ATOM 1042 CG2 THR A 72 -7.233 22.384 21.124 1.00 26.03 C ATOM 1043 HA THR A 72 -5.818 21.119 18.901 1.00 0.00 H ATOM 1044 HB THR A 72 -5.432 21.626 21.908 1.00 0.00 H ATOM 1045 HG1 THR A 72 -7.100 19.949 21.969 1.00 0.00 H ATOM 1046 HG23 THR A 72 -6.842 23.400 21.067 1.00 0.00 H ATOM 1047 HG21 THR A 72 -7.908 22.205 20.287 1.00 0.00 H ATOM 1048 HG22 THR A 72 -7.773 22.253 22.062 1.00 0.00 H ATOM 1049 H THR A 72 -3.707 20.507 20.801 1.00 0.00 H ATOM 1050 N GLN A 73 -5.755 23.647 18.631 1.00 36.61 N ATOM 1051 CA GLN A 73 -5.547 25.093 18.515 1.00 34.71 C ATOM 1052 C GLN A 73 -5.707 25.704 19.900 1.00 36.49 C ATOM 1053 O GLN A 73 -6.537 25.257 20.687 1.00 40.43 O ATOM 1054 CB GLN A 73 -6.530 25.697 17.501 1.00 38.16 C ATOM 1055 CG GLN A 73 -6.144 25.315 16.082 1.00 32.95 C ATOM 1056 CD GLN A 73 -7.135 25.733 15.025 1.00 31.73 C ATOM 1057 OE1 GLN A 73 -7.915 26.648 15.269 1.00 25.61 O ATOM 1058 NE2 GLN A 73 -7.090 25.058 13.879 1.00 32.02 N ATOM 1059 HA GLN A 73 -4.545 25.310 18.144 1.00 0.00 H ATOM 1060 HB2 GLN A 73 -7.533 25.326 17.711 1.00 0.00 H ATOM 1061 HB3 GLN A 73 -6.518 26.783 17.595 1.00 0.00 H ATOM 1062 HG2 GLN A 73 -5.186 25.782 15.853 1.00 0.00 H ATOM 1063 HG3 GLN A 73 -6.038 24.231 16.039 1.00 0.00 H ATOM 1064 HE22 GLN A 73 -6.396 24.294 13.753 1.00 0.00 H ATOM 1065 HE21 GLN A 73 -7.749 25.295 13.110 1.00 0.00 H ATOM 1066 H GLN A 73 -6.453 23.150 18.041 1.00 0.00 H ATOM 1067 N MET A 74 -4.910 26.700 20.243 1.00 39.72 N ATOM 1068 CA MET A 74 -5.100 27.527 21.414 1.00 37.56 C ATOM 1069 C MET A 74 -5.632 28.892 20.977 1.00 43.99 C ATOM 1070 O MET A 74 -5.854 29.766 21.808 1.00 43.25 O ATOM 1071 CB MET A 74 -3.801 27.871 22.149 1.00 48.37 C ATOM 1072 CG MET A 74 -2.783 28.477 21.189 1.00 70.93 C ATOM 1073 SD MET A 74 -1.810 29.794 21.936 1.00 97.98 S ATOM 1074 CE MET A 74 -2.972 31.158 21.798 1.00 95.75 C ATOM 1075 HA MET A 74 -5.764 26.954 22.061 1.00 0.00 H ATOM 1076 HB2 MET A 74 -4.017 28.588 22.941 1.00 0.00 H ATOM 1077 HB3 MET A 74 -3.385 26.963 22.586 1.00 0.00 H ATOM 1078 HG2 MET A 74 -3.315 28.883 20.329 1.00 0.00 H ATOM 1079 HG3 MET A 74 -2.106 27.690 20.858 1.00 0.00 H ATOM 1080 HE1 MET A 74 -3.211 31.325 20.748 1.00 0.00 H ATOM 1081 HE2 MET A 74 -3.883 30.915 22.345 1.00 0.00 H ATOM 1082 HE3 MET A 74 -2.524 32.059 22.217 1.00 0.00 H ATOM 1083 H MET A 74 -4.093 26.902 19.632 1.00 0.00 H ATOM 1084 N TYR A 75 -5.728 29.051 19.657 1.00 42.26 N ATOM 1085 CA TYR A 75 -6.270 30.298 19.146 1.00 36.13 C ATOM 1086 C TYR A 75 -6.985 30.036 17.818 1.00 41.33 C ATOM 1087 O TYR A 75 -6.358 29.468 16.917 1.00 32.11 O ATOM 1088 CB TYR A 75 -5.158 31.320 18.982 1.00 44.98 C ATOM 1089 CG TYR A 75 -5.708 32.686 18.611 1.00 53.55 C ATOM 1090 CD1 TYR A 75 -6.009 33.045 17.306 1.00 53.79 C ATOM 1091 CD2 TYR A 75 -5.925 33.613 19.622 1.00 51.37 C ATOM 1092 CE1 TYR A 75 -6.521 34.300 17.008 1.00 51.72 C ATOM 1093 CE2 TYR A 75 -6.441 34.862 19.348 1.00 39.86 C ATOM 1094 CZ TYR A 75 -6.726 35.195 18.040 1.00 49.68 C ATOM 1095 OH TYR A 75 -7.208 36.452 17.779 1.00 49.55 O ATOM 1096 HA TYR A 75 -6.994 30.703 19.853 1.00 0.00 H ATOM 1097 HB3 TYR A 75 -4.481 30.985 18.196 1.00 0.00 H ATOM 1098 HB2 TYR A 75 -4.610 31.401 19.921 1.00 0.00 H ATOM 1099 HD2 TYR A 75 -5.683 33.348 20.651 1.00 0.00 H ATOM 1100 HE2 TYR A 75 -6.621 35.575 20.152 1.00 0.00 H ATOM 1101 HE1 TYR A 75 -6.757 34.574 15.980 1.00 0.00 H ATOM 1102 HD1 TYR A 75 -5.841 32.330 16.501 1.00 0.00 H ATOM 1103 HH TYR A 75 -7.366 36.548 16.806 1.00 0.00 H ATOM 1104 H TYR A 75 -5.422 28.299 19.007 1.00 0.00 H ATOM 1105 N THR A 76 -8.262 30.428 17.738 1.00 28.03 N ATOM 1106 CA THR A 76 -9.042 30.114 16.557 1.00 26.59 C ATOM 1107 C THR A 76 -9.965 31.314 16.314 1.00 38.84 C ATOM 1108 O THR A 76 -10.903 31.504 17.096 1.00 47.02 O ATOM 1109 CB THR A 76 -9.937 28.890 16.755 1.00 27.39 C ATOM 1110 OG1 THR A 76 -9.244 27.792 17.349 1.00 28.74 O ATOM 1111 CG2 THR A 76 -10.524 28.432 15.421 1.00 37.72 C ATOM 1112 HA THR A 76 -8.360 29.905 15.732 1.00 0.00 H ATOM 1113 HB THR A 76 -10.731 29.201 17.434 1.00 0.00 H ATOM 1114 HG1 THR A 76 -8.489 27.526 16.767 1.00 0.00 H ATOM 1115 HG23 THR A 76 -11.057 29.262 14.956 1.00 0.00 H ATOM 1116 HG21 THR A 76 -9.718 28.102 14.765 1.00 0.00 H ATOM 1117 HG22 THR A 76 -11.214 27.606 15.594 1.00 0.00 H ATOM 1118 H THR A 76 -8.694 30.957 18.522 1.00 0.00 H ATOM 1119 N ASN A 77 -9.694 32.093 15.283 1.00 38.79 N ATOM 1120 CA ASN A 77 -10.413 33.337 15.066 1.00 36.92 C ATOM 1121 C ASN A 77 -10.702 33.464 13.572 1.00 33.70 C ATOM 1122 O ASN A 77 -9.974 34.045 12.767 1.00 44.80 O ATOM 1123 CB ASN A 77 -9.679 34.602 15.490 1.00 42.41 C ATOM 1124 CG ASN A 77 -10.605 35.805 15.531 1.00 38.22 C ATOM 1125 OD1 ASN A 77 -10.415 36.728 16.326 1.00 55.07 O ATOM 1126 ND2 ASN A 77 -11.646 35.887 14.715 1.00 48.52 N ATOM 1127 HA ASN A 77 -11.305 33.272 15.689 1.00 0.00 H ATOM 1128 HB2 ASN A 77 -9.255 34.449 16.483 1.00 0.00 H ATOM 1129 HB3 ASN A 77 -8.876 34.799 14.780 1.00 0.00 H ATOM 1130 HD22 ASN A 77 -11.833 35.125 14.033 1.00 0.00 H ATOM 1131 HD21 ASN A 77 -12.276 36.714 14.757 1.00 0.00 H ATOM 1132 H ASN A 77 -8.951 31.811 14.613 1.00 0.00 H ATOM 1133 N VAL A 78 -11.816 32.849 13.255 1.00 32.22 N ATOM 1134 CA VAL A 78 -12.395 32.820 11.922 1.00 43.42 C ATOM 1135 C VAL A 78 -12.507 34.132 11.152 1.00 44.27 C ATOM 1136 O VAL A 78 -12.052 34.143 9.993 1.00 41.10 O ATOM 1137 CB VAL A 78 -13.774 32.135 12.096 1.00 31.13 C ATOM 1138 CG1 VAL A 78 -14.503 31.997 10.787 1.00 23.03 C ATOM 1139 CG2 VAL A 78 -13.460 30.788 12.749 1.00 43.44 C ATOM 1140 HA VAL A 78 -11.700 32.282 11.277 1.00 0.00 H ATOM 1141 HB VAL A 78 -14.452 32.724 12.713 1.00 0.00 H ATOM 1142 HG11 VAL A 78 -14.665 32.985 10.357 1.00 0.00 H ATOM 1143 HG12 VAL A 78 -13.906 31.394 10.102 1.00 0.00 H ATOM 1144 HG13 VAL A 78 -15.464 31.512 10.957 1.00 0.00 H ATOM 1145 HG21 VAL A 78 -12.802 30.214 12.097 1.00 0.00 H ATOM 1146 HG22 VAL A 78 -12.968 30.956 13.707 1.00 0.00 H ATOM 1147 HG23 VAL A 78 -14.387 30.238 12.907 1.00 0.00 H ATOM 1148 H VAL A 78 -12.322 32.346 14.012 1.00 0.00 H ATOM 1149 N ASP A 79 -12.942 35.236 11.735 1.00 45.28 N ATOM 1150 CA ASP A 79 -13.083 36.504 11.032 1.00 48.05 C ATOM 1151 C ASP A 79 -11.684 36.993 10.727 1.00 52.87 C ATOM 1152 O ASP A 79 -11.462 37.380 9.574 1.00 56.56 O ATOM 1153 CB ASP A 79 -13.914 37.584 11.730 1.00 56.50 C ATOM 1154 CG ASP A 79 -15.361 37.067 11.706 1.00 85.74 C ATOM 1155 OD1 ASP A 79 -15.641 36.396 10.669 1.00 83.14 O ATOM 1156 OD2 ASP A 79 -16.140 37.298 12.655 1.00 85.05 O ATOM 1157 HA ASP A 79 -13.667 36.311 10.132 1.00 0.00 H ATOM 1158 HB2 ASP A 79 -13.575 37.722 12.757 1.00 0.00 H ATOM 1159 HB3 ASP A 79 -13.838 38.530 11.194 1.00 0.00 H ATOM 1160 H ASP A 79 -13.195 35.197 12.743 1.00 0.00 H ATOM 1161 N GLN A 80 -10.785 36.945 11.720 1.00 51.82 N ATOM 1162 CA GLN A 80 -9.431 37.378 11.364 1.00 37.11 C ATOM 1163 C GLN A 80 -8.748 36.373 10.448 1.00 33.95 C ATOM 1164 O GLN A 80 -7.567 36.571 10.125 1.00 34.11 O ATOM 1165 CB GLN A 80 -8.684 37.740 12.615 1.00 31.00 C ATOM 1166 CG GLN A 80 -8.342 36.766 13.696 1.00 67.56 C ATOM 1167 CD GLN A 80 -7.896 37.570 14.916 1.00 83.63 C ATOM 1168 OE1 GLN A 80 -7.358 38.667 14.729 1.00 94.19 O ATOM 1169 NE2 GLN A 80 -8.197 37.068 16.101 1.00 51.95 N ATOM 1170 HA GLN A 80 -9.460 38.286 10.762 1.00 0.00 H ATOM 1171 HB2 GLN A 80 -7.734 38.157 12.282 1.00 0.00 H ATOM 1172 HB3 GLN A 80 -9.274 38.521 13.096 1.00 0.00 H ATOM 1173 HG2 GLN A 80 -9.216 36.165 13.946 1.00 0.00 H ATOM 1174 HG3 GLN A 80 -7.535 36.112 13.366 1.00 0.00 H ATOM 1175 HE22 GLN A 80 -8.650 36.135 16.170 1.00 0.00 H ATOM 1176 HE21 GLN A 80 -7.981 37.606 16.964 1.00 0.00 H ATOM 1177 H GLN A 80 -11.031 36.623 12.678 1.00 0.00 H ATOM 1178 N ASP A 81 -9.291 35.195 10.152 1.00 35.45 N ATOM 1179 CA ASP A 81 -8.556 34.218 9.361 1.00 34.63 C ATOM 1180 C ASP A 81 -7.260 33.791 10.045 1.00 27.37 C ATOM 1181 O ASP A 81 -6.298 33.380 9.398 1.00 27.58 O ATOM 1182 CB ASP A 81 -8.188 34.733 7.955 1.00 28.30 C ATOM 1183 CG ASP A 81 -8.038 33.530 7.031 1.00 42.98 C ATOM 1184 OD1 ASP A 81 -8.279 32.391 7.512 1.00 39.83 O ATOM 1185 OD2 ASP A 81 -7.687 33.707 5.851 1.00 29.14 O ATOM 1186 HA ASP A 81 -9.236 33.372 9.268 1.00 0.00 H ATOM 1187 HB2 ASP A 81 -8.976 35.388 7.584 1.00 0.00 H ATOM 1188 HB3 ASP A 81 -7.249 35.285 7.998 1.00 0.00 H ATOM 1189 H ASP A 81 -10.249 34.970 10.489 1.00 0.00 H ATOM 1190 N LEU A 82 -7.263 33.867 11.372 1.00 24.11 N ATOM 1191 CA LEU A 82 -6.106 33.419 12.120 1.00 33.70 C ATOM 1192 C LEU A 82 -6.284 32.199 13.010 1.00 33.47 C ATOM 1193 O LEU A 82 -7.234 32.227 13.787 1.00 34.85 O ATOM 1194 CB LEU A 82 -5.730 34.612 13.014 1.00 18.69 C ATOM 1195 CG LEU A 82 -4.354 34.528 13.696 1.00 27.86 C ATOM 1196 CD1 LEU A 82 -3.245 34.292 12.683 1.00 23.18 C ATOM 1197 CD2 LEU A 82 -4.019 35.828 14.459 1.00 28.38 C ATOM 1198 HA LEU A 82 -5.357 33.103 11.394 1.00 0.00 H ATOM 1199 HB2 LEU A 82 -5.744 35.510 12.397 1.00 0.00 H ATOM 1200 HB3 LEU A 82 -6.486 34.697 13.794 1.00 0.00 H ATOM 1201 HG LEU A 82 -4.412 33.691 14.391 1.00 0.00 H ATOM 1202 HD21 LEU A 82 -4.008 36.665 13.761 1.00 0.00 H ATOM 1203 HD22 LEU A 82 -4.774 36.003 15.225 1.00 0.00 H ATOM 1204 HD23 LEU A 82 -3.040 35.731 14.927 1.00 0.00 H ATOM 1205 HD11 LEU A 82 -3.428 33.355 12.157 1.00 0.00 H ATOM 1206 HD12 LEU A 82 -3.227 35.114 11.968 1.00 0.00 H ATOM 1207 HD13 LEU A 82 -2.287 34.238 13.201 1.00 0.00 H ATOM 1208 H LEU A 82 -8.093 34.247 11.871 1.00 0.00 H ATOM 1209 N VAL A 83 -5.368 31.233 12.991 1.00 35.01 N ATOM 1210 CA VAL A 83 -5.317 30.234 14.037 1.00 26.79 C ATOM 1211 C VAL A 83 -3.861 30.084 14.516 1.00 37.54 C ATOM 1212 O VAL A 83 -2.891 30.464 13.882 1.00 37.21 O ATOM 1213 CB VAL A 83 -5.811 28.856 13.577 1.00 34.05 C ATOM 1214 CG1 VAL A 83 -7.162 28.871 12.891 1.00 27.19 C ATOM 1215 CG2 VAL A 83 -4.754 28.264 12.626 1.00 30.61 C ATOM 1216 HA VAL A 83 -5.976 30.576 14.835 1.00 0.00 H ATOM 1217 HB VAL A 83 -5.946 28.248 14.472 1.00 0.00 H ATOM 1218 HG11 VAL A 83 -7.912 29.265 13.577 1.00 0.00 H ATOM 1219 HG12 VAL A 83 -7.111 29.503 12.004 1.00 0.00 H ATOM 1220 HG13 VAL A 83 -7.432 27.856 12.600 1.00 0.00 H ATOM 1221 HG21 VAL A 83 -4.628 28.925 11.768 1.00 0.00 H ATOM 1222 HG22 VAL A 83 -3.805 28.167 13.154 1.00 0.00 H ATOM 1223 HG23 VAL A 83 -5.083 27.282 12.285 1.00 0.00 H ATOM 1224 H VAL A 83 -4.679 31.196 12.213 1.00 0.00 H ATOM 1225 N GLY A 84 -3.737 29.488 15.697 1.00 36.72 N ATOM 1226 CA GLY A 84 -2.579 29.394 16.524 1.00 32.16 C ATOM 1227 C GLY A 84 -2.542 28.053 17.253 1.00 35.12 C ATOM 1228 O GLY A 84 -3.506 27.653 17.902 1.00 37.64 O ATOM 1229 HA3 GLY A 84 -2.597 30.200 17.258 1.00 0.00 H ATOM 1230 HA2 GLY A 84 -1.688 29.489 15.904 1.00 0.00 H ATOM 1231 H GLY A 84 -4.595 29.031 16.066 1.00 0.00 H ATOM 1232 N TRP A 85 -1.455 27.314 17.120 1.00 30.77 N ATOM 1233 CA TRP A 85 -1.205 26.198 18.036 1.00 29.29 C ATOM 1234 C TRP A 85 0.024 26.544 18.875 1.00 30.89 C ATOM 1235 O TRP A 85 0.890 27.250 18.345 1.00 33.75 O ATOM 1236 CB TRP A 85 -0.873 24.940 17.256 1.00 28.65 C ATOM 1237 CG TRP A 85 -1.865 24.492 16.236 1.00 28.82 C ATOM 1238 CD1 TRP A 85 -3.007 23.759 16.395 1.00 39.79 C ATOM 1239 CD2 TRP A 85 -1.713 24.699 14.825 1.00 32.16 C ATOM 1240 NE1 TRP A 85 -3.571 23.482 15.162 1.00 33.99 N ATOM 1241 CE2 TRP A 85 -2.770 24.028 14.184 1.00 27.70 C ATOM 1242 CE3 TRP A 85 -0.748 25.356 14.044 1.00 25.73 C ATOM 1243 CZ2 TRP A 85 -2.874 23.997 12.794 1.00 31.34 C ATOM 1244 CZ3 TRP A 85 -0.901 25.330 12.678 1.00 26.26 C ATOM 1245 CH2 TRP A 85 -1.975 24.706 12.048 1.00 26.13 C ATOM 1246 HA TRP A 85 -2.091 26.033 18.649 1.00 0.00 H ATOM 1247 HB2 TRP A 85 0.073 25.112 16.742 1.00 0.00 H ATOM 1248 HB3 TRP A 85 -0.752 24.130 17.975 1.00 0.00 H ATOM 1249 HE1 TRP A 85 -4.451 22.951 15.001 1.00 0.00 H ATOM 1250 HD1 TRP A 85 -3.415 23.439 17.354 1.00 0.00 H ATOM 1251 HZ2 TRP A 85 -3.660 23.417 12.310 1.00 0.00 H ATOM 1252 HH2 TRP A 85 -2.098 24.783 10.968 1.00 0.00 H ATOM 1253 HZ3 TRP A 85 -0.148 25.820 12.060 1.00 0.00 H ATOM 1254 HE3 TRP A 85 0.095 25.870 14.506 1.00 0.00 H ATOM 1255 H TRP A 85 -0.774 27.525 16.363 1.00 0.00 H ATOM 1256 N PRO A 86 0.038 26.181 20.153 1.00 32.49 N ATOM 1257 CA PRO A 86 1.303 26.080 20.867 1.00 34.47 C ATOM 1258 C PRO A 86 2.348 25.415 19.971 1.00 39.68 C ATOM 1259 O PRO A 86 2.140 24.290 19.491 1.00 40.48 O ATOM 1260 CB PRO A 86 1.021 25.203 22.089 1.00 34.03 C ATOM 1261 CG PRO A 86 -0.458 25.094 22.164 1.00 39.05 C ATOM 1262 CD PRO A 86 -0.980 25.267 20.752 1.00 34.21 C ATOM 1263 HA PRO A 86 1.688 27.058 21.157 1.00 0.00 H ATOM 1264 HD3 PRO A 86 -1.017 24.314 20.224 1.00 0.00 H ATOM 1265 HD2 PRO A 86 -1.971 25.721 20.749 1.00 0.00 H ATOM 1266 HG3 PRO A 86 -0.860 25.873 22.811 1.00 0.00 H ATOM 1267 HG2 PRO A 86 -0.744 24.117 22.553 1.00 0.00 H ATOM 1268 HB2 PRO A 86 1.470 24.218 21.964 1.00 0.00 H ATOM 1269 HB3 PRO A 86 1.416 25.669 22.992 1.00 0.00 H ATOM 1270 N ALA A 87 3.452 26.125 19.758 1.00 32.77 N ATOM 1271 CA ALA A 87 4.482 25.641 18.846 1.00 47.37 C ATOM 1272 C ALA A 87 5.188 24.426 19.447 1.00 50.74 C ATOM 1273 O ALA A 87 5.519 24.529 20.623 1.00 37.13 O ATOM 1274 CB ALA A 87 5.590 26.673 18.640 1.00 34.77 C ATOM 1275 HA ALA A 87 3.972 25.416 17.909 1.00 0.00 H ATOM 1276 HB1 ALA A 87 5.163 27.584 18.221 1.00 0.00 H ATOM 1277 HB2 ALA A 87 6.059 26.897 19.598 1.00 0.00 H ATOM 1278 HB3 ALA A 87 6.336 26.271 17.954 1.00 0.00 H ATOM 1279 H ALA A 87 3.582 27.034 20.246 1.00 0.00 H ATOM 1280 N PRO A 88 5.431 23.415 18.632 1.00 57.63 N ATOM 1281 CA PRO A 88 6.193 22.243 19.045 1.00 56.67 C ATOM 1282 C PRO A 88 7.604 22.604 19.452 1.00 57.13 C ATOM 1283 O PRO A 88 8.126 23.606 18.951 1.00 56.93 O ATOM 1284 CB PRO A 88 6.191 21.386 17.784 1.00 58.81 C ATOM 1285 CG PRO A 88 5.982 22.337 16.645 1.00 56.66 C ATOM 1286 CD PRO A 88 5.084 23.406 17.187 1.00 53.10 C ATOM 1287 HA PRO A 88 5.769 21.745 19.917 1.00 0.00 H ATOM 1288 HD3 PRO A 88 5.295 24.370 16.725 1.00 0.00 H ATOM 1289 HD2 PRO A 88 4.035 23.154 17.035 1.00 0.00 H ATOM 1290 HG3 PRO A 88 5.509 21.829 15.804 1.00 0.00 H ATOM 1291 HG2 PRO A 88 6.932 22.763 16.322 1.00 0.00 H ATOM 1292 HB2 PRO A 88 7.143 20.867 17.676 1.00 0.00 H ATOM 1293 HB3 PRO A 88 5.383 20.656 17.822 1.00 0.00 H ATOM 1294 N PRO A 89 8.173 21.874 20.410 1.00 58.43 N ATOM 1295 CA PRO A 89 9.577 22.099 20.759 1.00 55.41 C ATOM 1296 C PRO A 89 10.465 21.839 19.540 1.00 53.76 C ATOM 1297 O PRO A 89 10.346 20.821 18.833 1.00 43.55 O ATOM 1298 CB PRO A 89 9.824 21.108 21.879 1.00 54.42 C ATOM 1299 CG PRO A 89 8.966 19.951 21.505 1.00 54.73 C ATOM 1300 CD PRO A 89 7.805 20.465 20.704 1.00 54.01 C ATOM 1301 HA PRO A 89 9.802 23.120 21.068 1.00 0.00 H ATOM 1302 HD3 PRO A 89 7.685 19.894 19.783 1.00 0.00 H ATOM 1303 HD2 PRO A 89 6.882 20.417 21.282 1.00 0.00 H ATOM 1304 HG3 PRO A 89 8.603 19.455 22.405 1.00 0.00 H ATOM 1305 HG2 PRO A 89 9.541 19.243 20.908 1.00 0.00 H ATOM 1306 HB2 PRO A 89 10.874 20.819 21.921 1.00 0.00 H ATOM 1307 HB3 PRO A 89 9.524 21.523 22.841 1.00 0.00 H ATOM 1308 N GLY A 90 11.400 22.791 19.364 1.00 43.12 N ATOM 1309 CA GLY A 90 12.286 22.764 18.218 1.00 40.37 C ATOM 1310 C GLY A 90 12.062 24.016 17.371 1.00 49.62 C ATOM 1311 O GLY A 90 13.002 24.465 16.694 1.00 49.18 O ATOM 1312 HA3 GLY A 90 12.078 21.878 17.619 1.00 0.00 H ATOM 1313 HA2 GLY A 90 13.321 22.736 18.559 1.00 0.00 H ATOM 1314 H GLY A 90 11.488 23.558 20.061 1.00 0.00 H ATOM 1315 N ALA A 91 10.838 24.556 17.419 1.00 43.35 N ATOM 1316 CA ALA A 91 10.537 25.689 16.538 1.00 42.90 C ATOM 1317 C ALA A 91 11.335 26.908 16.981 1.00 42.12 C ATOM 1318 O ALA A 91 11.594 27.141 18.165 1.00 50.20 O ATOM 1319 CB ALA A 91 9.054 26.025 16.483 1.00 40.75 C ATOM 1320 HA ALA A 91 10.826 25.396 15.529 1.00 0.00 H ATOM 1321 HB1 ALA A 91 8.501 25.162 16.113 1.00 0.00 H ATOM 1322 HB2 ALA A 91 8.703 26.281 17.483 1.00 0.00 H ATOM 1323 HB3 ALA A 91 8.899 26.872 15.814 1.00 0.00 H ATOM 1324 H ALA A 91 10.116 24.180 18.067 1.00 0.00 H ATOM 1325 N ARG A 92 11.796 27.644 15.988 1.00 41.47 N ATOM 1326 CA ARG A 92 12.523 28.886 16.263 1.00 49.84 C ATOM 1327 C ARG A 92 11.506 30.004 16.337 1.00 44.87 C ATOM 1328 O ARG A 92 10.849 30.344 15.362 1.00 55.68 O ATOM 1329 CB ARG A 92 13.626 29.120 15.233 1.00 54.45 C ATOM 1330 CG ARG A 92 14.573 27.902 15.228 1.00 59.13 C ATOM 1331 CD ARG A 92 15.684 28.150 14.226 1.00 79.64 C ATOM 1332 NE ARG A 92 16.473 26.952 13.953 1.00 78.09 N ATOM 1333 CZ ARG A 92 17.596 27.018 13.234 1.00 73.86 C ATOM 1334 NH1 ARG A 92 18.018 28.192 12.765 1.00 59.10 N ATOM 1335 NH2 ARG A 92 18.267 25.898 13.024 1.00 66.42 N ATOM 1336 HA ARG A 92 13.047 28.834 17.218 1.00 0.00 H ATOM 1337 HB2 ARG A 92 13.184 29.244 14.245 1.00 0.00 H ATOM 1338 HB3 ARG A 92 14.186 30.018 15.494 1.00 0.00 H ATOM 1339 HG2 ARG A 92 14.999 27.765 16.222 1.00 0.00 H ATOM 1340 HG3 ARG A 92 14.018 27.007 14.946 1.00 0.00 H ATOM 1341 HD2 ARG A 92 16.345 28.921 14.621 1.00 0.00 H ATOM 1342 HD3 ARG A 92 15.241 28.497 13.292 1.00 0.00 H ATOM 1343 HE ARG A 92 16.155 26.034 14.324 1.00 0.00 H ATOM 1344 HH12 ARG A 92 18.893 28.244 12.205 1.00 0.00 H ATOM 1345 HH11 ARG A 92 17.473 29.056 12.959 1.00 0.00 H ATOM 1346 HH22 ARG A 92 19.146 25.915 12.468 1.00 0.00 H ATOM 1347 HH21 ARG A 92 17.916 25.000 13.415 1.00 0.00 H ATOM 1348 H ARG A 92 11.643 27.341 15.005 1.00 0.00 H ATOM 1349 N SER A 93 11.328 30.544 17.531 1.00 48.53 N ATOM 1350 CA SER A 93 10.269 31.530 17.735 1.00 41.71 C ATOM 1351 C SER A 93 10.837 32.898 17.387 1.00 43.33 C ATOM 1352 O SER A 93 11.966 33.250 17.713 1.00 46.59 O ATOM 1353 CB SER A 93 9.764 31.468 19.167 1.00 53.22 C ATOM 1354 OG SER A 93 8.514 32.143 19.244 1.00 71.56 O ATOM 1355 HA SER A 93 9.412 31.325 17.093 1.00 0.00 H ATOM 1356 HB2 SER A 93 10.482 31.950 19.830 1.00 0.00 H ATOM 1357 HB3 SER A 93 9.637 30.427 19.466 1.00 0.00 H ATOM 1358 HG SER A 93 8.178 32.107 20.174 1.00 0.00 H ATOM 1359 H SER A 93 11.941 30.267 18.324 1.00 0.00 H ATOM 1360 N MET A 94 10.108 33.636 16.569 1.00 43.11 N ATOM 1361 CA MET A 94 10.434 34.988 16.187 1.00 41.05 C ATOM 1362 C MET A 94 9.779 36.052 17.060 1.00 42.50 C ATOM 1363 O MET A 94 8.927 35.785 17.902 1.00 41.62 O ATOM 1364 CB MET A 94 9.930 35.205 14.749 1.00 41.79 C ATOM 1365 CG MET A 94 10.427 34.094 13.827 1.00 44.35 C ATOM 1366 SD MET A 94 10.619 34.700 12.145 1.00 44.70 S ATOM 1367 CE MET A 94 9.071 34.641 11.399 1.00 36.64 C ATOM 1368 HA MET A 94 11.513 35.096 16.293 1.00 0.00 H ATOM 1369 HB2 MET A 94 8.840 35.209 14.749 1.00 0.00 H ATOM 1370 HB3 MET A 94 10.296 36.164 14.383 1.00 0.00 H ATOM 1371 HG2 MET A 94 9.707 33.276 13.833 1.00 0.00 H ATOM 1372 HG3 MET A 94 11.389 33.732 14.189 1.00 0.00 H ATOM 1373 HE1 MET A 94 8.709 33.613 11.396 1.00 0.00 H ATOM 1374 HE2 MET A 94 8.377 35.270 11.956 1.00 0.00 H ATOM 1375 HE3 MET A 94 9.149 35.003 10.374 1.00 0.00 H ATOM 1376 H MET A 94 9.243 33.215 16.175 1.00 0.00 H ATOM 1377 N THR A 95 10.084 37.318 16.741 1.00 43.24 N ATOM 1378 CA THR A 95 9.575 38.386 17.596 1.00 42.18 C ATOM 1379 C THR A 95 8.870 39.485 16.815 1.00 44.20 C ATOM 1380 O THR A 95 9.300 39.901 15.743 1.00 42.27 O ATOM 1381 CB THR A 95 10.641 38.955 18.539 1.00 53.23 C ATOM 1382 OG1 THR A 95 10.116 40.180 19.089 1.00 71.54 O ATOM 1383 CG2 THR A 95 11.972 39.238 17.878 1.00 52.68 C ATOM 1384 HA THR A 95 8.820 37.915 18.225 1.00 0.00 H ATOM 1385 HB THR A 95 10.845 38.201 19.299 1.00 0.00 H ATOM 1386 HG1 THR A 95 9.926 40.816 18.354 1.00 0.00 H ATOM 1387 HG23 THR A 95 12.373 38.314 17.461 1.00 0.00 H ATOM 1388 HG21 THR A 95 11.832 39.968 17.081 1.00 0.00 H ATOM 1389 HG22 THR A 95 12.667 39.635 18.618 1.00 0.00 H ATOM 1390 H THR A 95 10.667 37.533 15.907 1.00 0.00 H ATOM 1391 N PRO A 96 7.764 39.956 17.378 1.00 41.17 N ATOM 1392 CA PRO A 96 6.989 41.059 16.850 1.00 45.39 C ATOM 1393 C PRO A 96 7.765 42.308 16.513 1.00 54.31 C ATOM 1394 O PRO A 96 8.563 42.762 17.344 1.00 66.07 O ATOM 1395 CB PRO A 96 5.971 41.388 17.960 1.00 41.25 C ATOM 1396 CG PRO A 96 5.915 40.151 18.802 1.00 38.46 C ATOM 1397 CD PRO A 96 7.324 39.615 18.765 1.00 35.82 C ATOM 1398 HA PRO A 96 6.558 40.750 15.898 1.00 0.00 H ATOM 1399 HD3 PRO A 96 7.952 40.105 19.509 1.00 0.00 H ATOM 1400 HD2 PRO A 96 7.340 38.538 18.930 1.00 0.00 H ATOM 1401 HG3 PRO A 96 5.215 39.429 18.382 1.00 0.00 H ATOM 1402 HG2 PRO A 96 5.619 40.391 19.823 1.00 0.00 H ATOM 1403 HB2 PRO A 96 6.307 42.240 18.550 1.00 0.00 H ATOM 1404 HB3 PRO A 96 4.993 41.607 17.532 1.00 0.00 H ATOM 1405 N CYS A 97 7.507 42.912 15.349 1.00 55.14 N ATOM 1406 CA CYS A 97 8.175 44.163 14.985 1.00 57.64 C ATOM 1407 C CYS A 97 7.726 45.303 15.906 1.00 58.83 C ATOM 1408 O CYS A 97 6.567 45.332 16.303 1.00 58.82 O ATOM 1409 CB CYS A 97 7.943 44.597 13.550 1.00 44.27 C ATOM 1410 SG CYS A 97 7.981 46.354 13.098 1.00 49.84 S ATOM 1411 HA CYS A 97 9.239 43.956 15.099 1.00 0.00 H ATOM 1412 HB2 CYS A 97 6.959 44.223 13.266 1.00 0.00 H ATOM 1413 HB3 CYS A 97 8.706 44.103 12.948 1.00 0.00 H ATOM 1414 HG CYS A 97 7.008 47.030 13.805 1.00 0.00 H ATOM 1415 H CYS A 97 6.822 42.487 14.692 1.00 0.00 H ATOM 1416 N THR A 98 8.657 46.219 16.164 1.00 64.93 N ATOM 1417 CA THR A 98 8.268 47.505 16.729 1.00 76.07 C ATOM 1418 C THR A 98 8.858 48.699 15.979 1.00 78.81 C ATOM 1419 O THR A 98 8.630 49.824 16.431 1.00 81.17 O ATOM 1420 CB THR A 98 8.681 47.698 18.202 1.00 79.39 C ATOM 1421 OG1 THR A 98 9.166 46.511 18.824 1.00 64.73 O ATOM 1422 CG2 THR A 98 7.440 48.165 18.962 1.00 86.89 C ATOM 1423 HA THR A 98 7.182 47.477 16.638 1.00 0.00 H ATOM 1424 HB THR A 98 9.498 48.419 18.226 1.00 0.00 H ATOM 1425 HG1 THR A 98 9.411 46.708 19.763 1.00 0.00 H ATOM 1426 HG23 THR A 98 7.053 49.074 18.500 1.00 0.00 H ATOM 1427 HG21 THR A 98 6.679 47.386 18.926 1.00 0.00 H ATOM 1428 HG22 THR A 98 7.706 48.368 20.000 1.00 0.00 H ATOM 1429 H THR A 98 9.657 46.018 15.963 1.00 0.00 H ATOM 1430 N CYS A 99 9.650 48.509 14.933 1.00 79.45 N ATOM 1431 CA CYS A 99 10.319 49.651 14.319 1.00 76.49 C ATOM 1432 C CYS A 99 9.377 50.404 13.386 1.00 74.08 C ATOM 1433 O CYS A 99 9.757 51.434 12.832 1.00 75.64 O ATOM 1434 CB CYS A 99 11.538 49.166 13.514 1.00 75.67 C ATOM 1435 SG CYS A 99 10.891 48.543 11.956 1.00 59.75 S ATOM 1436 HA CYS A 99 10.636 50.324 15.115 1.00 0.00 H ATOM 1437 HB2 CYS A 99 12.056 48.373 14.053 1.00 0.00 H ATOM 1438 HB3 CYS A 99 12.226 49.992 13.335 1.00 0.00 H ATOM 1439 HG CYS A 99 11.934 48.087 11.176 1.00 0.00 H ATOM 1440 H CYS A 99 9.794 47.552 14.552 1.00 0.00 H ATOM 1441 N GLY A 100 8.204 49.860 13.106 1.00 73.41 N ATOM 1442 CA GLY A 100 7.172 50.493 12.325 1.00 67.67 C ATOM 1443 C GLY A 100 7.548 50.675 10.860 1.00 65.96 C ATOM 1444 O GLY A 100 6.982 51.524 10.173 1.00 67.80 O ATOM 1445 HA3 GLY A 100 6.966 51.474 12.754 1.00 0.00 H ATOM 1446 HA2 GLY A 100 6.273 49.879 12.378 1.00 0.00 H ATOM 1447 H GLY A 100 8.013 48.907 13.476 1.00 0.00 H ATOM 1448 N SER A 101 8.473 49.856 10.381 1.00 58.84 N ATOM 1449 CA SER A 101 9.053 50.070 9.073 1.00 55.64 C ATOM 1450 C SER A 101 8.014 49.749 7.994 1.00 57.07 C ATOM 1451 O SER A 101 7.026 49.044 8.256 1.00 52.14 O ATOM 1452 CB SER A 101 10.321 49.261 8.790 1.00 43.17 C ATOM 1453 OG SER A 101 10.514 49.209 7.377 1.00 54.85 O ATOM 1454 HA SER A 101 9.350 51.119 9.055 1.00 0.00 H ATOM 1455 HB2 SER A 101 10.210 48.251 9.184 1.00 0.00 H ATOM 1456 HB3 SER A 101 11.178 49.742 9.262 1.00 0.00 H ATOM 1457 HG SER A 101 11.332 48.688 7.176 1.00 0.00 H ATOM 1458 H SER A 101 8.787 49.047 10.954 1.00 0.00 H ATOM 1459 N SER A 102 8.280 50.364 6.836 1.00 46.61 N ATOM 1460 CA SER A 102 7.345 50.087 5.744 1.00 50.15 C ATOM 1461 C SER A 102 8.007 49.281 4.640 1.00 50.86 C ATOM 1462 O SER A 102 7.305 48.898 3.710 1.00 50.97 O ATOM 1463 CB SER A 102 6.691 51.360 5.232 1.00 59.75 C ATOM 1464 OG SER A 102 5.375 51.483 5.749 1.00 70.93 O ATOM 1465 HA SER A 102 6.541 49.468 6.141 1.00 0.00 H ATOM 1466 HB2 SER A 102 6.648 51.329 4.143 1.00 0.00 H ATOM 1467 HB3 SER A 102 7.283 52.220 5.547 1.00 0.00 H ATOM 1468 HG SER A 102 4.964 52.316 5.407 1.00 0.00 H ATOM 1469 H SER A 102 9.097 50.997 6.719 1.00 0.00 H ATOM 1470 N ASP A 103 9.310 49.045 4.735 1.00 54.91 N ATOM 1471 CA ASP A 103 9.969 48.071 3.886 1.00 49.94 C ATOM 1472 C ASP A 103 9.782 46.671 4.459 1.00 50.64 C ATOM 1473 O ASP A 103 10.460 46.266 5.410 1.00 47.07 O ATOM 1474 CB ASP A 103 11.468 48.363 3.782 1.00 60.03 C ATOM 1475 CG ASP A 103 11.678 49.818 3.398 1.00 98.19 C ATOM 1476 OD1 ASP A 103 10.947 50.292 2.498 1.00109.36 O ATOM 1477 OD2 ASP A 103 12.545 50.486 3.998 1.00108.01 O ATOM 1478 HA ASP A 103 9.522 48.133 2.894 1.00 0.00 H ATOM 1479 HB2 ASP A 103 11.943 48.169 4.744 1.00 0.00 H ATOM 1480 HB3 ASP A 103 11.912 47.719 3.022 1.00 0.00 H ATOM 1481 H ASP A 103 9.872 49.571 5.435 1.00 0.00 H ATOM 1482 N LEU A 104 8.882 45.903 3.836 1.00 49.38 N ATOM 1483 CA LEU A 104 8.706 44.535 4.313 1.00 46.02 C ATOM 1484 C LEU A 104 9.144 43.530 3.249 1.00 46.06 C ATOM 1485 O LEU A 104 9.349 43.891 2.087 1.00 38.66 O ATOM 1486 CB LEU A 104 7.273 44.258 4.732 1.00 32.65 C ATOM 1487 CG LEU A 104 6.575 45.399 5.467 1.00 31.88 C ATOM 1488 CD1 LEU A 104 5.113 44.980 5.669 1.00 41.76 C ATOM 1489 CD2 LEU A 104 7.302 45.745 6.763 1.00 38.85 C ATOM 1490 HA LEU A 104 9.338 44.421 5.194 1.00 0.00 H ATOM 1491 HB2 LEU A 104 6.697 44.033 3.834 1.00 0.00 H ATOM 1492 HB3 LEU A 104 7.276 43.387 5.387 1.00 0.00 H ATOM 1493 HG LEU A 104 6.597 46.321 4.887 1.00 0.00 H ATOM 1494 HD21 LEU A 104 7.319 44.870 7.413 1.00 0.00 H ATOM 1495 HD22 LEU A 104 8.323 46.050 6.535 1.00 0.00 H ATOM 1496 HD23 LEU A 104 6.781 46.561 7.264 1.00 0.00 H ATOM 1497 HD11 LEU A 104 4.648 44.807 4.698 1.00 0.00 H ATOM 1498 HD12 LEU A 104 5.077 44.064 6.259 1.00 0.00 H ATOM 1499 HD13 LEU A 104 4.578 45.772 6.193 1.00 0.00 H ATOM 1500 H LEU A 104 8.325 46.269 3.037 1.00 0.00 H ATOM 1501 N TYR A 105 9.363 42.345 3.811 1.00 43.38 N ATOM 1502 CA TYR A 105 9.838 41.174 3.114 1.00 45.21 C ATOM 1503 C TYR A 105 8.952 39.957 3.382 1.00 41.76 C ATOM 1504 O TYR A 105 8.907 39.414 4.489 1.00 34.90 O ATOM 1505 CB TYR A 105 11.270 40.721 3.508 1.00 42.43 C ATOM 1506 CG TYR A 105 12.159 41.889 3.108 1.00 37.35 C ATOM 1507 CD1 TYR A 105 12.592 42.007 1.804 1.00 35.13 C ATOM 1508 CD2 TYR A 105 12.368 42.936 4.004 1.00 47.09 C ATOM 1509 CE1 TYR A 105 13.268 43.166 1.411 1.00 41.36 C ATOM 1510 CE2 TYR A 105 13.095 44.057 3.644 1.00 47.13 C ATOM 1511 CZ TYR A 105 13.552 44.150 2.339 1.00 50.54 C ATOM 1512 OH TYR A 105 14.263 45.263 1.947 1.00 57.69 O ATOM 1513 HA TYR A 105 9.822 41.490 2.071 1.00 0.00 H ATOM 1514 HB3 TYR A 105 11.552 39.818 2.967 1.00 0.00 H ATOM 1515 HB2 TYR A 105 11.335 40.536 4.580 1.00 0.00 H ATOM 1516 HD2 TYR A 105 11.950 42.870 5.009 1.00 0.00 H ATOM 1517 HE2 TYR A 105 13.303 44.846 4.367 1.00 0.00 H ATOM 1518 HE1 TYR A 105 13.571 43.294 0.372 1.00 0.00 H ATOM 1519 HD1 TYR A 105 12.409 41.206 1.088 1.00 0.00 H ATOM 1520 HH TYR A 105 14.514 45.174 0.993 1.00 0.00 H ATOM 1521 H TYR A 105 9.178 42.255 4.830 1.00 0.00 H ATOM 1522 N LEU A 106 8.418 39.520 2.238 1.00 32.98 N ATOM 1523 CA LEU A 106 7.594 38.298 2.319 1.00 31.77 C ATOM 1524 C LEU A 106 8.512 37.083 2.096 1.00 32.24 C ATOM 1525 O LEU A 106 9.179 37.018 1.042 1.00 33.25 O ATOM 1526 CB LEU A 106 6.490 38.231 1.297 1.00 43.53 C ATOM 1527 CG LEU A 106 5.470 37.087 1.186 1.00 41.12 C ATOM 1528 CD1 LEU A 106 4.803 36.872 2.532 1.00 37.28 C ATOM 1529 CD2 LEU A 106 4.441 37.499 0.117 1.00 30.64 C ATOM 1530 HA LEU A 106 7.122 38.305 3.302 1.00 0.00 H ATOM 1531 HB2 LEU A 106 5.900 39.136 1.444 1.00 0.00 H ATOM 1532 HB3 LEU A 106 6.986 38.276 0.327 1.00 0.00 H ATOM 1533 HG LEU A 106 5.948 36.150 0.901 1.00 0.00 H ATOM 1534 HD21 LEU A 106 3.951 38.423 0.423 1.00 0.00 H ATOM 1535 HD22 LEU A 106 4.950 37.654 -0.834 1.00 0.00 H ATOM 1536 HD23 LEU A 106 3.697 36.710 0.008 1.00 0.00 H ATOM 1537 HD11 LEU A 106 5.559 36.615 3.274 1.00 0.00 H ATOM 1538 HD12 LEU A 106 4.293 37.787 2.833 1.00 0.00 H ATOM 1539 HD13 LEU A 106 4.080 36.060 2.452 1.00 0.00 H ATOM 1540 H LEU A 106 8.575 40.015 1.337 1.00 0.00 H ATOM 1541 N VAL A 107 8.344 36.130 3.003 1.00 27.19 N ATOM 1542 CA VAL A 107 8.923 34.805 2.818 1.00 34.84 C ATOM 1543 C VAL A 107 7.922 33.745 2.362 1.00 36.24 C ATOM 1544 O VAL A 107 6.849 33.534 2.919 1.00 35.63 O ATOM 1545 CB VAL A 107 9.619 34.275 4.089 1.00 38.80 C ATOM 1546 CG1 VAL A 107 10.300 32.966 3.711 1.00 29.23 C ATOM 1547 CG2 VAL A 107 10.616 35.309 4.630 1.00 26.57 C ATOM 1548 HA VAL A 107 9.654 34.961 2.025 1.00 0.00 H ATOM 1549 HB VAL A 107 8.901 34.099 4.890 1.00 0.00 H ATOM 1550 HG11 VAL A 107 9.551 32.257 3.357 1.00 0.00 H ATOM 1551 HG12 VAL A 107 11.028 33.152 2.921 1.00 0.00 H ATOM 1552 HG13 VAL A 107 10.806 32.556 4.585 1.00 0.00 H ATOM 1553 HG21 VAL A 107 11.372 35.514 3.872 1.00 0.00 H ATOM 1554 HG22 VAL A 107 10.086 36.229 4.875 1.00 0.00 H ATOM 1555 HG23 VAL A 107 11.096 34.915 5.526 1.00 0.00 H ATOM 1556 H VAL A 107 7.790 36.331 3.860 1.00 0.00 H ATOM 1557 N THR A 108 8.233 33.181 1.196 1.00 35.92 N ATOM 1558 CA THR A 108 7.337 32.224 0.548 1.00 34.48 C ATOM 1559 C THR A 108 7.814 30.831 0.911 1.00 29.80 C ATOM 1560 O THR A 108 8.970 30.624 1.262 1.00 40.20 O ATOM 1561 CB THR A 108 7.484 32.354 -0.985 1.00 44.26 C ATOM 1562 OG1 THR A 108 8.854 31.996 -1.280 1.00 36.29 O ATOM 1563 CG2 THR A 108 7.257 33.773 -1.475 1.00 14.71 C ATOM 1564 HA THR A 108 6.308 32.405 0.859 1.00 0.00 H ATOM 1565 HB THR A 108 6.745 31.720 -1.474 1.00 0.00 H ATOM 1566 HG1 THR A 108 9.023 31.068 -0.979 1.00 0.00 H ATOM 1567 HG23 THR A 108 6.229 34.069 -1.264 1.00 0.00 H ATOM 1568 HG21 THR A 108 7.943 34.447 -0.962 1.00 0.00 H ATOM 1569 HG22 THR A 108 7.437 33.818 -2.549 1.00 0.00 H ATOM 1570 H THR A 108 9.133 33.427 0.736 1.00 0.00 H ATOM 1571 N ARG A 109 6.995 29.847 0.759 1.00 28.39 N ATOM 1572 CA ARG A 109 7.044 28.425 0.850 1.00 32.11 C ATOM 1573 C ARG A 109 8.267 27.790 0.218 1.00 34.52 C ATOM 1574 O ARG A 109 8.779 26.775 0.671 1.00 39.90 O ATOM 1575 CB ARG A 109 5.789 27.932 0.064 1.00 41.34 C ATOM 1576 CG ARG A 109 5.740 26.428 -0.051 1.00 45.13 C ATOM 1577 CD ARG A 109 4.556 25.902 -0.843 1.00 56.78 C ATOM 1578 NE ARG A 109 4.276 24.546 -0.370 1.00 51.14 N ATOM 1579 CZ ARG A 109 3.498 24.312 0.687 1.00 65.27 C ATOM 1580 NH1 ARG A 109 2.883 25.275 1.359 1.00 66.56 N ATOM 1581 NH2 ARG A 109 3.389 23.045 1.075 1.00 64.60 N ATOM 1582 HA ARG A 109 7.078 28.144 1.903 1.00 0.00 H ATOM 1583 HB2 ARG A 109 4.893 28.274 0.583 1.00 0.00 H ATOM 1584 HB3 ARG A 109 5.812 28.360 -0.938 1.00 0.00 H ATOM 1585 HG2 ARG A 109 6.655 26.092 -0.540 1.00 0.00 H ATOM 1586 HG3 ARG A 109 5.692 26.009 0.954 1.00 0.00 H ATOM 1587 HD2 ARG A 109 4.798 25.883 -1.906 1.00 0.00 H ATOM 1588 HD3 ARG A 109 3.687 26.540 -0.681 1.00 0.00 H ATOM 1589 HE ARG A 109 4.697 23.740 -0.874 1.00 0.00 H ATOM 1590 HH12 ARG A 109 2.287 25.039 2.178 1.00 0.00 H ATOM 1591 HH11 ARG A 109 2.997 26.267 1.068 1.00 0.00 H ATOM 1592 HH22 ARG A 109 2.796 22.801 1.894 1.00 0.00 H ATOM 1593 HH21 ARG A 109 3.897 22.298 0.560 1.00 0.00 H ATOM 1594 H ARG A 109 6.044 30.180 0.501 1.00 0.00 H ATOM 1595 N HIS A 110 8.713 28.375 -0.877 1.00 39.63 N ATOM 1596 CA HIS A 110 9.985 28.115 -1.514 1.00 44.99 C ATOM 1597 C HIS A 110 11.176 28.820 -0.888 1.00 39.14 C ATOM 1598 O HIS A 110 12.226 28.844 -1.544 1.00 44.11 O ATOM 1599 CB HIS A 110 9.959 28.589 -2.994 1.00 35.15 C ATOM 1600 CG HIS A 110 8.730 28.074 -3.687 1.00 46.27 C ATOM 1601 ND1 HIS A 110 8.401 26.737 -3.599 1.00 39.32 N ATOM 1602 CD2 HIS A 110 7.749 28.681 -4.396 1.00 49.36 C ATOM 1603 CE1 HIS A 110 7.251 26.540 -4.224 1.00 33.35 C ATOM 1604 NE2 HIS A 110 6.852 27.700 -4.737 1.00 47.05 N ATOM 1605 HA HIS A 110 10.112 27.038 -1.401 1.00 0.00 H ATOM 1606 HB2 HIS A 110 9.958 29.679 -3.023 1.00 0.00 H ATOM 1607 HB3 HIS A 110 10.845 28.214 -3.507 1.00 0.00 H ATOM 1608 HD2 HIS A 110 7.685 29.740 -4.646 1.00 0.00 H ATOM 1609 HE1 HIS A 110 6.722 25.590 -4.304 1.00 0.00 H ATOM 1610 H HIS A 110 8.096 29.085 -1.321 1.00 0.00 H ATOM 1611 N ALA A 111 11.042 29.503 0.234 1.00 39.31 N ATOM 1612 CA ALA A 111 12.044 30.412 0.781 1.00 29.72 C ATOM 1613 C ALA A 111 12.582 31.469 -0.170 1.00 36.86 C ATOM 1614 O ALA A 111 13.784 31.769 -0.078 1.00 37.30 O ATOM 1615 CB ALA A 111 13.235 29.603 1.294 1.00 34.04 C ATOM 1616 HA ALA A 111 11.516 30.952 1.567 1.00 0.00 H ATOM 1617 HB1 ALA A 111 12.899 28.918 2.073 1.00 0.00 H ATOM 1618 HB2 ALA A 111 13.668 29.035 0.471 1.00 0.00 H ATOM 1619 HB3 ALA A 111 13.984 30.281 1.703 1.00 0.00 H ATOM 1620 H ALA A 111 10.157 29.384 0.767 1.00 0.00 H ATOM 1621 N ASP A 112 11.864 31.984 -1.162 1.00 34.12 N ATOM 1622 CA ASP A 112 12.183 33.323 -1.643 1.00 38.04 C ATOM 1623 C ASP A 112 11.833 34.414 -0.636 1.00 48.68 C ATOM 1624 O ASP A 112 10.945 34.348 0.213 1.00 51.44 O ATOM 1625 CB ASP A 112 11.425 33.618 -2.934 1.00 40.24 C ATOM 1626 CG ASP A 112 11.681 32.469 -3.901 1.00 44.88 C ATOM 1627 OD1 ASP A 112 12.805 31.934 -3.850 1.00 73.67 O ATOM 1628 OD2 ASP A 112 10.728 32.158 -4.639 1.00 46.30 O ATOM 1629 HA ASP A 112 13.261 33.334 -1.807 1.00 0.00 H ATOM 1630 HB2 ASP A 112 10.358 33.697 -2.727 1.00 0.00 H ATOM 1631 HB3 ASP A 112 11.780 34.553 -3.367 1.00 0.00 H ATOM 1632 H ASP A 112 11.087 31.441 -1.589 1.00 0.00 H ATOM 1633 N VAL A 113 12.586 35.511 -0.715 1.00 46.22 N ATOM 1634 CA VAL A 113 12.389 36.667 0.142 1.00 42.68 C ATOM 1635 C VAL A 113 12.106 37.867 -0.754 1.00 44.49 C ATOM 1636 O VAL A 113 12.992 38.324 -1.489 1.00 47.96 O ATOM 1637 CB VAL A 113 13.662 36.969 0.948 1.00 43.51 C ATOM 1638 CG1 VAL A 113 13.352 38.031 1.988 1.00 40.62 C ATOM 1639 CG2 VAL A 113 14.236 35.719 1.578 1.00 43.25 C ATOM 1640 HA VAL A 113 11.568 36.469 0.831 1.00 0.00 H ATOM 1641 HB VAL A 113 14.428 37.348 0.272 1.00 0.00 H ATOM 1642 HG11 VAL A 113 13.010 38.938 1.489 1.00 0.00 H ATOM 1643 HG12 VAL A 113 12.572 37.666 2.657 1.00 0.00 H ATOM 1644 HG13 VAL A 113 14.252 38.249 2.563 1.00 0.00 H ATOM 1645 HG21 VAL A 113 13.499 35.282 2.251 1.00 0.00 H ATOM 1646 HG22 VAL A 113 14.487 35.002 0.796 1.00 0.00 H ATOM 1647 HG23 VAL A 113 15.135 35.976 2.139 1.00 0.00 H ATOM 1648 H VAL A 113 13.348 35.541 -1.422 1.00 0.00 H ATOM 1649 N ILE A 114 10.871 38.338 -0.769 1.00 41.25 N ATOM 1650 CA ILE A 114 10.485 39.302 -1.792 1.00 40.12 C ATOM 1651 C ILE A 114 9.978 40.559 -1.091 1.00 42.89 C ATOM 1652 O ILE A 114 9.387 40.526 -0.014 1.00 43.04 O ATOM 1653 CB ILE A 114 9.493 38.785 -2.843 1.00 52.07 C ATOM 1654 CG1 ILE A 114 8.135 38.424 -2.252 1.00 44.91 C ATOM 1655 CG2 ILE A 114 10.123 37.595 -3.571 1.00 59.66 C ATOM 1656 CD1 ILE A 114 7.289 37.507 -3.106 1.00 66.85 C ATOM 1657 HA ILE A 114 11.373 39.519 -2.385 1.00 0.00 H ATOM 1658 HB ILE A 114 9.295 39.589 -3.552 1.00 0.00 H ATOM 1659 HG12 ILE A 114 8.303 37.934 -1.293 1.00 0.00 H ATOM 1660 HG13 ILE A 114 7.579 39.348 -2.094 1.00 0.00 H ATOM 1661 HD11 ILE A 114 7.095 37.984 -4.067 1.00 0.00 H ATOM 1662 HD12 ILE A 114 7.820 36.569 -3.265 1.00 0.00 H ATOM 1663 HD13 ILE A 114 6.344 37.310 -2.599 1.00 0.00 H ATOM 1664 HG21 ILE A 114 11.045 37.915 -4.057 1.00 0.00 H ATOM 1665 HG22 ILE A 114 10.345 36.807 -2.852 1.00 0.00 H ATOM 1666 HG23 ILE A 114 9.427 37.219 -4.321 1.00 0.00 H ATOM 1667 H ILE A 114 10.181 38.024 -0.057 1.00 0.00 H ATOM 1668 N PRO A 115 10.403 41.674 -1.656 1.00 47.12 N ATOM 1669 CA PRO A 115 10.161 42.990 -1.104 1.00 41.53 C ATOM 1670 C PRO A 115 8.712 43.422 -1.170 1.00 40.16 C ATOM 1671 O PRO A 115 8.034 43.350 -2.208 1.00 31.78 O ATOM 1672 CB PRO A 115 11.001 43.893 -2.028 1.00 42.19 C ATOM 1673 CG PRO A 115 11.255 43.043 -3.252 1.00 33.85 C ATOM 1674 CD PRO A 115 11.592 41.730 -2.592 1.00 42.21 C ATOM 1675 HA PRO A 115 10.414 43.029 -0.045 1.00 0.00 H ATOM 1676 HD3 PRO A 115 11.605 40.900 -3.299 1.00 0.00 H ATOM 1677 HD2 PRO A 115 12.541 41.765 -2.057 1.00 0.00 H ATOM 1678 HG3 PRO A 115 12.087 43.424 -3.844 1.00 0.00 H ATOM 1679 HG2 PRO A 115 10.369 42.964 -3.882 1.00 0.00 H ATOM 1680 HB2 PRO A 115 10.449 44.795 -2.292 1.00 0.00 H ATOM 1681 HB3 PRO A 115 11.940 44.170 -1.548 1.00 0.00 H ATOM 1682 N VAL A 116 8.224 43.951 -0.033 1.00 33.87 N ATOM 1683 CA VAL A 116 6.859 44.511 -0.047 1.00 28.49 C ATOM 1684 C VAL A 116 6.759 45.895 0.572 1.00 35.01 C ATOM 1685 O VAL A 116 7.382 46.086 1.639 1.00 36.69 O ATOM 1686 CB VAL A 116 5.952 43.538 0.775 1.00 44.80 C ATOM 1687 CG1 VAL A 116 4.584 44.123 1.105 1.00 32.98 C ATOM 1688 CG2 VAL A 116 5.770 42.220 0.018 1.00 33.48 C ATOM 1689 HA VAL A 116 6.551 44.611 -1.088 1.00 0.00 H ATOM 1690 HB VAL A 116 6.466 43.367 1.721 1.00 0.00 H ATOM 1691 HG11 VAL A 116 4.711 45.031 1.694 1.00 0.00 H ATOM 1692 HG12 VAL A 116 4.059 44.360 0.180 1.00 0.00 H ATOM 1693 HG13 VAL A 116 4.007 43.395 1.676 1.00 0.00 H ATOM 1694 HG21 VAL A 116 5.301 42.418 -0.946 1.00 0.00 H ATOM 1695 HG22 VAL A 116 6.743 41.755 -0.139 1.00 0.00 H ATOM 1696 HG23 VAL A 116 5.137 41.552 0.601 1.00 0.00 H ATOM 1697 H VAL A 116 8.796 43.965 0.836 1.00 0.00 H ATOM 1698 N ARG A 117 5.926 46.783 0.028 1.00 33.57 N ATOM 1699 CA ARG A 117 5.785 48.125 0.545 1.00 27.50 C ATOM 1700 C ARG A 117 4.609 48.198 1.516 1.00 33.12 C ATOM 1701 O ARG A 117 3.540 47.917 0.989 1.00 28.73 O ATOM 1702 CB ARG A 117 5.497 49.145 -0.587 1.00 36.76 C ATOM 1703 CG ARG A 117 5.088 50.524 -0.036 1.00 39.78 C ATOM 1704 CD ARG A 117 6.219 51.122 0.780 1.00 31.51 C ATOM 1705 NE ARG A 117 7.374 51.425 0.005 1.00 35.80 N ATOM 1706 CZ ARG A 117 7.652 52.485 -0.754 1.00 53.48 C ATOM 1707 NH1 ARG A 117 6.803 53.495 -0.887 1.00 29.95 N ATOM 1708 NH2 ARG A 117 8.842 52.495 -1.363 1.00 41.01 N ATOM 1709 HA ARG A 117 6.725 48.369 1.040 1.00 0.00 H ATOM 1710 HB2 ARG A 117 6.396 49.261 -1.193 1.00 0.00 H ATOM 1711 HB3 ARG A 117 4.688 48.761 -1.209 1.00 0.00 H ATOM 1712 HG2 ARG A 117 4.854 51.189 -0.868 1.00 0.00 H ATOM 1713 HG3 ARG A 117 4.208 50.412 0.597 1.00 0.00 H ATOM 1714 HD2 ARG A 117 6.500 50.410 1.556 1.00 0.00 H ATOM 1715 HD3 ARG A 117 5.862 52.042 1.244 1.00 0.00 H ATOM 1716 HE ARG A 117 8.122 50.703 0.036 1.00 0.00 H ATOM 1717 HH12 ARG A 117 7.051 54.307 -1.487 1.00 0.00 H ATOM 1718 HH11 ARG A 117 5.889 53.475 -0.391 1.00 0.00 H ATOM 1719 HH22 ARG A 117 9.110 53.298 -1.967 1.00 0.00 H ATOM 1720 HH21 ARG A 117 9.500 51.700 -1.233 1.00 0.00 H ATOM 1721 H ARG A 117 5.359 46.500 -0.796 1.00 0.00 H ATOM 1722 N ARG A 118 4.770 48.453 2.807 1.00 30.39 N ATOM 1723 CA ARG A 118 3.569 48.486 3.628 1.00 31.06 C ATOM 1724 C ARG A 118 2.650 49.586 3.120 1.00 34.35 C ATOM 1725 O ARG A 118 3.028 50.749 3.090 1.00 43.31 O ATOM 1726 CB ARG A 118 3.810 48.795 5.113 1.00 48.07 C ATOM 1727 CG ARG A 118 2.496 48.996 5.865 1.00 55.26 C ATOM 1728 CD ARG A 118 2.005 47.769 6.595 1.00 62.28 C ATOM 1729 NE ARG A 118 2.609 47.635 7.915 1.00 65.16 N ATOM 1730 CZ ARG A 118 1.874 47.436 9.013 1.00 67.48 C ATOM 1731 NH1 ARG A 118 0.555 47.385 8.892 1.00 40.86 N ATOM 1732 NH2 ARG A 118 2.463 47.312 10.196 1.00 63.64 N ATOM 1733 HA ARG A 118 3.149 47.483 3.552 1.00 0.00 H ATOM 1734 HB2 ARG A 118 4.353 47.964 5.564 1.00 0.00 H ATOM 1735 HB3 ARG A 118 4.407 49.704 5.193 1.00 0.00 H ATOM 1736 HG2 ARG A 118 2.638 49.794 6.594 1.00 0.00 H ATOM 1737 HG3 ARG A 118 1.733 49.294 5.146 1.00 0.00 H ATOM 1738 HD2 ARG A 118 2.252 46.887 6.005 1.00 0.00 H ATOM 1739 HD3 ARG A 118 0.923 47.837 6.709 1.00 0.00 H ATOM 1740 HE ARG A 118 3.643 47.696 8.005 1.00 0.00 H ATOM 1741 HH12 ARG A 118 -0.039 47.231 9.732 1.00 0.00 H ATOM 1742 HH11 ARG A 118 0.114 47.499 7.957 1.00 0.00 H ATOM 1743 HH22 ARG A 118 1.889 47.157 11.049 1.00 0.00 H ATOM 1744 HH21 ARG A 118 3.499 47.370 10.270 1.00 0.00 H ATOM 1745 H ARG A 118 5.712 48.622 3.214 1.00 0.00 H ATOM 1746 N ARG A 119 1.413 49.225 2.869 1.00 45.58 N ATOM 1747 CA ARG A 119 0.403 50.185 2.442 1.00 47.82 C ATOM 1748 C ARG A 119 -0.732 50.513 3.388 1.00 55.84 C ATOM 1749 O ARG A 119 -1.272 51.626 3.300 1.00 55.56 O ATOM 1750 CB ARG A 119 -0.137 49.665 1.126 1.00 53.69 C ATOM 1751 CG ARG A 119 0.807 50.213 0.041 1.00 68.98 C ATOM 1752 CD ARG A 119 -0.099 50.632 -1.106 1.00 66.08 C ATOM 1753 NE ARG A 119 0.689 51.277 -2.147 1.00 83.98 N ATOM 1754 CZ ARG A 119 0.151 52.201 -2.935 1.00 81.33 C ATOM 1755 NH1 ARG A 119 -1.118 52.537 -2.761 1.00 75.24 N ATOM 1756 NH2 ARG A 119 0.890 52.772 -3.869 1.00 94.72 N ATOM 1757 HA ARG A 119 0.910 51.148 2.382 1.00 0.00 H ATOM 1758 HB2 ARG A 119 -0.133 48.575 1.118 1.00 0.00 H ATOM 1759 HB3 ARG A 119 -1.153 50.025 0.963 1.00 0.00 H ATOM 1760 HG2 ARG A 119 1.366 51.069 0.418 1.00 0.00 H ATOM 1761 HG3 ARG A 119 1.504 49.441 -0.285 1.00 0.00 H ATOM 1762 HD2 ARG A 119 -0.851 51.329 -0.737 1.00 0.00 H ATOM 1763 HD3 ARG A 119 -0.592 49.752 -1.518 1.00 0.00 H ATOM 1764 HE ARG A 119 1.686 51.011 -2.275 1.00 0.00 H ATOM 1765 HH12 ARG A 119 -1.553 53.259 -3.370 1.00 0.00 H ATOM 1766 HH11 ARG A 119 -1.680 52.079 -2.015 1.00 0.00 H ATOM 1767 HH22 ARG A 119 0.475 53.496 -4.490 1.00 0.00 H ATOM 1768 HH21 ARG A 119 1.886 52.497 -3.984 1.00 0.00 H ATOM 1769 H ARG A 119 1.146 48.226 2.978 1.00 0.00 H ATOM 1770 N GLY A 120 -1.140 49.627 4.278 1.00 61.12 N ATOM 1771 CA GLY A 120 -2.161 49.891 5.293 1.00 51.35 C ATOM 1772 C GLY A 120 -1.953 48.941 6.468 1.00 50.15 C ATOM 1773 O GLY A 120 -0.891 48.313 6.556 1.00 47.59 O ATOM 1774 HA3 GLY A 120 -3.151 49.732 4.865 1.00 0.00 H ATOM 1775 HA2 GLY A 120 -2.076 50.922 5.637 1.00 0.00 H ATOM 1776 H GLY A 120 -0.708 48.681 4.256 1.00 0.00 H ATOM 1777 N ASP A 121 -2.904 48.788 7.387 1.00 56.81 N ATOM 1778 CA ASP A 121 -2.712 47.867 8.513 1.00 57.42 C ATOM 1779 C ASP A 121 -2.406 46.452 7.995 1.00 53.86 C ATOM 1780 O ASP A 121 -1.606 45.699 8.543 1.00 55.37 O ATOM 1781 CB ASP A 121 -3.948 47.738 9.389 1.00 84.66 C ATOM 1782 CG ASP A 121 -4.490 48.900 10.165 1.00 94.05 C ATOM 1783 OD1 ASP A 121 -3.742 49.770 10.658 1.00 95.00 O ATOM 1784 OD2 ASP A 121 -5.736 48.970 10.334 1.00103.27 O ATOM 1785 HA ASP A 121 -1.890 48.283 9.096 1.00 0.00 H ATOM 1786 HB2 ASP A 121 -4.753 47.404 8.735 1.00 0.00 H ATOM 1787 HB3 ASP A 121 -3.727 46.959 10.118 1.00 0.00 H ATOM 1788 H ASP A 121 -3.790 49.326 7.306 1.00 0.00 H ATOM 1789 N SER A 122 -3.121 46.098 6.926 1.00 42.70 N ATOM 1790 CA SER A 122 -3.169 44.711 6.482 1.00 48.78 C ATOM 1791 C SER A 122 -2.999 44.599 4.971 1.00 50.44 C ATOM 1792 O SER A 122 -3.454 43.653 4.315 1.00 44.48 O ATOM 1793 CB SER A 122 -4.541 44.169 6.888 1.00 33.71 C ATOM 1794 OG SER A 122 -5.533 44.747 6.050 1.00 38.80 O ATOM 1795 HA SER A 122 -2.356 44.145 6.937 1.00 0.00 H ATOM 1796 HB2 SER A 122 -4.744 44.428 7.927 1.00 0.00 H ATOM 1797 HB3 SER A 122 -4.554 43.085 6.776 1.00 0.00 H ATOM 1798 HG SER A 122 -5.346 44.510 5.107 1.00 0.00 H ATOM 1799 H SER A 122 -3.652 46.823 6.402 1.00 0.00 H ATOM 1800 N ARG A 123 -2.300 45.613 4.436 1.00 51.36 N ATOM 1801 CA ARG A 123 -1.999 45.548 3.001 1.00 50.77 C ATOM 1802 C ARG A 123 -0.616 46.088 2.653 1.00 51.39 C ATOM 1803 O ARG A 123 -0.050 46.918 3.374 1.00 54.53 O ATOM 1804 CB ARG A 123 -3.154 46.186 2.238 1.00 46.74 C ATOM 1805 CG ARG A 123 -3.128 45.640 0.817 1.00 58.59 C ATOM 1806 CD ARG A 123 -3.544 46.676 -0.199 1.00 71.88 C ATOM 1807 NE ARG A 123 -4.191 45.978 -1.314 1.00 94.44 N ATOM 1808 CZ ARG A 123 -5.370 45.379 -1.220 1.00105.61 C ATOM 1809 NH1 ARG A 123 -6.066 45.385 -0.092 1.00109.54 N ATOM 1810 NH2 ARG A 123 -5.894 44.769 -2.275 1.00123.71 N ATOM 1811 HA ARG A 123 -1.928 44.508 2.684 1.00 0.00 H ATOM 1812 HB2 ARG A 123 -4.100 45.933 2.716 1.00 0.00 H ATOM 1813 HB3 ARG A 123 -3.035 47.269 2.222 1.00 0.00 H ATOM 1814 HG2 ARG A 123 -2.116 45.308 0.586 1.00 0.00 H ATOM 1815 HG3 ARG A 123 -3.810 44.792 0.754 1.00 0.00 H ATOM 1816 HD2 ARG A 123 -2.668 47.216 -0.558 1.00 0.00 H ATOM 1817 HD3 ARG A 123 -4.243 47.380 0.254 1.00 0.00 H ATOM 1818 HE ARG A 123 -3.698 45.951 -2.229 1.00 0.00 H ATOM 1819 HH12 ARG A 123 -6.988 44.907 -0.048 1.00 0.00 H ATOM 1820 HH11 ARG A 123 -5.690 45.868 0.749 1.00 0.00 H ATOM 1821 HH22 ARG A 123 -6.819 44.300 -2.198 1.00 0.00 H ATOM 1822 HH21 ARG A 123 -5.380 44.760 -3.179 1.00 0.00 H ATOM 1823 H ARG A 123 -1.983 46.415 5.017 1.00 0.00 H ATOM 1824 N GLY A 124 0.020 45.527 1.659 1.00 38.83 N ATOM 1825 CA GLY A 124 1.448 45.654 1.365 1.00 36.81 C ATOM 1826 C GLY A 124 1.468 45.411 -0.170 1.00 40.36 C ATOM 1827 O GLY A 124 0.531 44.791 -0.697 1.00 37.57 O ATOM 1828 HA3 GLY A 124 2.033 44.903 1.896 1.00 0.00 H ATOM 1829 HA2 GLY A 124 1.820 46.647 1.617 1.00 0.00 H ATOM 1830 H GLY A 124 -0.542 44.934 1.016 1.00 0.00 H ATOM 1831 N SER A 125 2.272 46.160 -0.890 1.00 44.59 N ATOM 1832 CA SER A 125 2.285 46.002 -2.352 1.00 44.65 C ATOM 1833 C SER A 125 3.630 45.400 -2.736 1.00 41.61 C ATOM 1834 O SER A 125 4.642 45.768 -2.150 1.00 43.75 O ATOM 1835 CB SER A 125 2.004 47.270 -3.145 1.00 50.65 C ATOM 1836 OG SER A 125 3.045 48.220 -3.160 1.00 43.95 O ATOM 1837 HA SER A 125 1.456 45.346 -2.618 1.00 0.00 H ATOM 1838 HB2 SER A 125 1.121 47.745 -2.717 1.00 0.00 H ATOM 1839 HB3 SER A 125 1.796 46.983 -4.176 1.00 0.00 H ATOM 1840 HG SER A 125 2.768 49.003 -3.698 1.00 0.00 H ATOM 1841 H SER A 125 2.893 46.857 -0.431 1.00 0.00 H ATOM 1842 N LEU A 126 3.574 44.426 -3.628 1.00 44.91 N ATOM 1843 CA LEU A 126 4.754 43.856 -4.241 1.00 49.80 C ATOM 1844 C LEU A 126 5.551 44.881 -5.048 1.00 46.58 C ATOM 1845 O LEU A 126 5.001 45.334 -6.050 1.00 49.18 O ATOM 1846 CB LEU A 126 4.348 42.744 -5.209 1.00 58.11 C ATOM 1847 CG LEU A 126 4.123 41.344 -4.644 1.00 66.12 C ATOM 1848 CD1 LEU A 126 2.898 41.261 -3.754 1.00 56.57 C ATOM 1849 CD2 LEU A 126 3.982 40.341 -5.786 1.00 66.11 C ATOM 1850 HA LEU A 126 5.373 43.483 -3.425 1.00 0.00 H ATOM 1851 HB2 LEU A 126 3.418 43.054 -5.686 1.00 0.00 H ATOM 1852 HB3 LEU A 126 5.133 42.667 -5.961 1.00 0.00 H ATOM 1853 HG LEU A 126 4.992 41.107 -4.030 1.00 0.00 H ATOM 1854 HD21 LEU A 126 3.132 40.619 -6.409 1.00 0.00 H ATOM 1855 HD22 LEU A 126 4.892 40.346 -6.386 1.00 0.00 H ATOM 1856 HD23 LEU A 126 3.822 39.344 -5.375 1.00 0.00 H ATOM 1857 HD11 LEU A 126 3.014 41.946 -2.914 1.00 0.00 H ATOM 1858 HD12 LEU A 126 2.014 41.535 -4.329 1.00 0.00 H ATOM 1859 HD13 LEU A 126 2.789 40.242 -3.382 1.00 0.00 H ATOM 1860 H LEU A 126 2.642 44.054 -3.901 1.00 0.00 H ATOM 1861 N LEU A 127 6.795 45.134 -4.677 1.00 42.16 N ATOM 1862 CA LEU A 127 7.617 46.070 -5.443 1.00 46.68 C ATOM 1863 C LEU A 127 7.914 45.598 -6.844 1.00 47.11 C ATOM 1864 O LEU A 127 7.846 46.430 -7.757 1.00 50.58 O ATOM 1865 CB LEU A 127 8.870 46.405 -4.603 1.00 42.99 C ATOM 1866 CG LEU A 127 8.332 47.155 -3.344 1.00 44.06 C ATOM 1867 CD1 LEU A 127 9.407 47.461 -2.347 1.00 25.50 C ATOM 1868 CD2 LEU A 127 7.581 48.403 -3.805 1.00 33.67 C ATOM 1869 HA LEU A 127 7.060 46.991 -5.616 1.00 0.00 H ATOM 1870 HB2 LEU A 127 9.390 45.492 -4.311 1.00 0.00 H ATOM 1871 HB3 LEU A 127 9.549 47.044 -5.167 1.00 0.00 H ATOM 1872 HG LEU A 127 7.642 46.502 -2.809 1.00 0.00 H ATOM 1873 HD21 LEU A 127 8.260 49.049 -4.361 1.00 0.00 H ATOM 1874 HD22 LEU A 127 6.750 48.109 -4.446 1.00 0.00 H ATOM 1875 HD23 LEU A 127 7.199 48.938 -2.935 1.00 0.00 H ATOM 1876 HD11 LEU A 127 9.864 46.531 -2.011 1.00 0.00 H ATOM 1877 HD12 LEU A 127 10.164 48.092 -2.813 1.00 0.00 H ATOM 1878 HD13 LEU A 127 8.972 47.982 -1.494 1.00 0.00 H ATOM 1879 H LEU A 127 7.190 44.665 -3.837 1.00 0.00 H ATOM 1880 N SER A 128 8.184 44.316 -7.052 1.00 46.95 N ATOM 1881 CA SER A 128 7.997 43.758 -8.402 1.00 47.59 C ATOM 1882 C SER A 128 6.989 42.614 -8.403 1.00 51.96 C ATOM 1883 O SER A 128 7.241 41.579 -7.792 1.00 44.05 O ATOM 1884 CB SER A 128 9.360 43.299 -8.896 1.00 49.02 C ATOM 1885 OG SER A 128 10.205 43.373 -7.753 1.00 64.16 O ATOM 1886 HA SER A 128 7.588 44.517 -9.069 1.00 0.00 H ATOM 1887 HB2 SER A 128 9.724 43.956 -9.686 1.00 0.00 H ATOM 1888 HB3 SER A 128 9.309 42.277 -9.270 1.00 0.00 H ATOM 1889 HG SER A 128 11.119 43.086 -8.001 1.00 0.00 H ATOM 1890 H SER A 128 8.522 43.714 -6.274 1.00 0.00 H ATOM 1891 N PRO A 129 5.866 42.850 -9.072 1.00 49.83 N ATOM 1892 CA PRO A 129 4.787 41.910 -9.201 1.00 48.52 C ATOM 1893 C PRO A 129 5.250 40.539 -9.655 1.00 49.39 C ATOM 1894 O PRO A 129 6.273 40.425 -10.319 1.00 48.44 O ATOM 1895 CB PRO A 129 3.871 42.493 -10.272 1.00 49.88 C ATOM 1896 CG PRO A 129 4.182 43.952 -10.188 1.00 57.35 C ATOM 1897 CD PRO A 129 5.683 43.986 -10.020 1.00 52.46 C ATOM 1898 HA PRO A 129 4.304 41.769 -8.234 1.00 0.00 H ATOM 1899 HD3 PRO A 129 6.200 43.812 -10.964 1.00 0.00 H ATOM 1900 HD2 PRO A 129 6.021 44.929 -9.591 1.00 0.00 H ATOM 1901 HG3 PRO A 129 3.684 44.408 -9.332 1.00 0.00 H ATOM 1902 HG2 PRO A 129 3.880 44.468 -11.100 1.00 0.00 H ATOM 1903 HB2 PRO A 129 4.109 42.093 -11.258 1.00 0.00 H ATOM 1904 HB3 PRO A 129 2.823 42.298 -10.046 1.00 0.00 H ATOM 1905 N ARG A 130 4.528 39.528 -9.183 1.00 44.34 N ATOM 1906 CA ARG A 130 4.851 38.157 -9.497 1.00 28.19 C ATOM 1907 C ARG A 130 3.611 37.468 -10.035 1.00 35.35 C ATOM 1908 O ARG A 130 2.503 37.986 -9.886 1.00 45.12 O ATOM 1909 CB ARG A 130 5.423 37.479 -8.253 1.00 39.99 C ATOM 1910 CG ARG A 130 6.941 37.272 -8.339 1.00 33.60 C ATOM 1911 CD ARG A 130 7.639 38.229 -7.434 1.00 51.91 C ATOM 1912 NE ARG A 130 9.059 37.979 -7.170 1.00 60.42 N ATOM 1913 CZ ARG A 130 9.712 38.969 -6.527 1.00 66.87 C ATOM 1914 NH1 ARG A 130 8.992 40.059 -6.219 1.00 40.25 N ATOM 1915 NH2 ARG A 130 10.994 38.940 -6.191 1.00 56.55 N ATOM 1916 HA ARG A 130 5.615 38.097 -10.273 1.00 0.00 H ATOM 1917 HB2 ARG A 130 5.204 38.100 -7.385 1.00 0.00 H ATOM 1918 HB3 ARG A 130 4.944 36.507 -8.133 1.00 0.00 H ATOM 1919 HG2 ARG A 130 7.184 36.252 -8.042 1.00 0.00 H ATOM 1920 HG3 ARG A 130 7.271 37.439 -9.364 1.00 0.00 H ATOM 1921 HD2 ARG A 130 7.119 38.216 -6.476 1.00 0.00 H ATOM 1922 HD3 ARG A 130 7.556 39.221 -7.877 1.00 0.00 H ATOM 1923 HE ARG A 130 9.531 37.098 -7.459 1.00 0.00 H ATOM 1924 HH12 ARG A 130 9.441 40.855 -5.723 1.00 0.00 H ATOM 1925 HH11 ARG A 130 7.985 40.107 -6.476 1.00 0.00 H ATOM 1926 HH22 ARG A 130 11.420 39.749 -5.695 1.00 0.00 H ATOM 1927 HH21 ARG A 130 11.574 38.108 -6.423 1.00 0.00 H ATOM 1928 H ARG A 130 3.710 39.730 -8.573 1.00 0.00 H ATOM 1929 N PRO A 131 3.814 36.309 -10.665 1.00 30.82 N ATOM 1930 CA PRO A 131 2.688 35.460 -11.042 1.00 28.28 C ATOM 1931 C PRO A 131 1.971 35.010 -9.791 1.00 32.45 C ATOM 1932 O PRO A 131 2.725 34.688 -8.859 1.00 37.04 O ATOM 1933 CB PRO A 131 3.390 34.328 -11.788 1.00 34.12 C ATOM 1934 CG PRO A 131 4.641 34.911 -12.373 1.00 22.38 C ATOM 1935 CD PRO A 131 5.084 35.968 -11.374 1.00 24.44 C ATOM 1936 HA PRO A 131 1.915 35.927 -11.653 1.00 0.00 H ATOM 1937 HD3 PRO A 131 5.825 35.568 -10.682 1.00 0.00 H ATOM 1938 HD2 PRO A 131 5.496 36.840 -11.882 1.00 0.00 H ATOM 1939 HG3 PRO A 131 4.437 35.362 -13.344 1.00 0.00 H ATOM 1940 HG2 PRO A 131 5.407 34.143 -12.484 1.00 0.00 H ATOM 1941 HB2 PRO A 131 3.638 33.520 -11.099 1.00 0.00 H ATOM 1942 HB3 PRO A 131 2.747 33.944 -12.580 1.00 0.00 H ATOM 1943 N VAL A 132 0.655 34.888 -9.705 1.00 31.47 N ATOM 1944 CA VAL A 132 0.064 34.444 -8.446 1.00 38.28 C ATOM 1945 C VAL A 132 0.432 33.015 -8.084 1.00 43.97 C ATOM 1946 O VAL A 132 0.703 32.727 -6.901 1.00 48.68 O ATOM 1947 CB VAL A 132 -1.436 34.800 -8.463 1.00 36.43 C ATOM 1948 CG1 VAL A 132 -2.219 33.857 -9.332 1.00 30.32 C ATOM 1949 CG2 VAL A 132 -1.951 34.836 -7.026 1.00 51.06 C ATOM 1950 HA VAL A 132 0.497 34.982 -7.603 1.00 0.00 H ATOM 1951 HB VAL A 132 -1.571 35.787 -8.905 1.00 0.00 H ATOM 1952 HG11 VAL A 132 -1.841 33.908 -10.353 1.00 0.00 H ATOM 1953 HG12 VAL A 132 -2.110 32.841 -8.953 1.00 0.00 H ATOM 1954 HG13 VAL A 132 -3.271 34.141 -9.318 1.00 0.00 H ATOM 1955 HG21 VAL A 132 -1.809 33.858 -6.566 1.00 0.00 H ATOM 1956 HG22 VAL A 132 -1.399 35.588 -6.462 1.00 0.00 H ATOM 1957 HG23 VAL A 132 -3.012 35.087 -7.028 1.00 0.00 H ATOM 1958 H VAL A 132 0.051 35.106 -10.523 1.00 0.00 H ATOM 1959 N SER A 133 0.680 32.093 -8.991 1.00 37.15 N ATOM 1960 CA SER A 133 1.103 30.727 -8.778 1.00 40.34 C ATOM 1961 C SER A 133 2.415 30.551 -8.022 1.00 46.39 C ATOM 1962 O SER A 133 2.836 29.520 -7.481 1.00 53.47 O ATOM 1963 CB SER A 133 1.432 30.193 -10.199 1.00 37.44 C ATOM 1964 OG SER A 133 2.528 31.051 -10.540 1.00 46.71 O ATOM 1965 HA SER A 133 0.315 30.237 -8.206 1.00 0.00 H ATOM 1966 HB2 SER A 133 0.592 30.318 -10.883 1.00 0.00 H ATOM 1967 HB3 SER A 133 1.730 29.145 -10.179 1.00 0.00 H ATOM 1968 HG SER A 133 2.854 30.823 -11.447 1.00 0.00 H ATOM 1969 H SER A 133 0.556 32.383 -9.982 1.00 0.00 H ATOM 1970 N TYR A 134 3.198 31.609 -7.998 1.00 39.87 N ATOM 1971 CA TYR A 134 4.449 31.705 -7.252 1.00 37.44 C ATOM 1972 C TYR A 134 4.318 31.987 -5.759 1.00 43.86 C ATOM 1973 O TYR A 134 5.231 31.902 -4.934 1.00 40.06 O ATOM 1974 CB TYR A 134 5.115 32.930 -7.864 1.00 32.39 C ATOM 1975 CG TYR A 134 6.432 33.330 -7.282 1.00 38.68 C ATOM 1976 CD1 TYR A 134 7.553 32.629 -7.683 1.00 49.91 C ATOM 1977 CD2 TYR A 134 6.588 34.375 -6.394 1.00 42.20 C ATOM 1978 CE1 TYR A 134 8.804 32.956 -7.211 1.00 49.33 C ATOM 1979 CE2 TYR A 134 7.839 34.701 -5.901 1.00 47.78 C ATOM 1980 CZ TYR A 134 8.939 33.989 -6.318 1.00 49.12 C ATOM 1981 OH TYR A 134 10.206 34.299 -5.862 1.00 55.50 O ATOM 1982 HA TYR A 134 4.971 30.751 -7.320 1.00 0.00 H ATOM 1983 HB3 TYR A 134 4.432 33.772 -7.749 1.00 0.00 H ATOM 1984 HB2 TYR A 134 5.268 32.730 -8.925 1.00 0.00 H ATOM 1985 HD2 TYR A 134 5.717 34.949 -6.078 1.00 0.00 H ATOM 1986 HE2 TYR A 134 7.952 35.517 -5.187 1.00 0.00 H ATOM 1987 HE1 TYR A 134 9.680 32.399 -7.544 1.00 0.00 H ATOM 1988 HD1 TYR A 134 7.445 31.803 -8.385 1.00 0.00 H ATOM 1989 HH TYR A 134 10.233 34.206 -4.877 1.00 0.00 H ATOM 1990 H TYR A 134 2.903 32.438 -8.552 1.00 0.00 H ATOM 1991 N LEU A 135 3.132 32.432 -5.372 1.00 44.88 N ATOM 1992 CA LEU A 135 2.830 32.799 -3.995 1.00 45.46 C ATOM 1993 C LEU A 135 1.951 31.652 -3.467 1.00 46.68 C ATOM 1994 O LEU A 135 1.549 31.657 -2.310 1.00 43.20 O ATOM 1995 CB LEU A 135 2.051 34.088 -3.993 1.00 43.46 C ATOM 1996 CG LEU A 135 2.507 35.465 -3.577 1.00 54.61 C ATOM 1997 CD1 LEU A 135 3.949 35.791 -3.887 1.00 46.73 C ATOM 1998 CD2 LEU A 135 1.555 36.447 -4.257 1.00 42.86 C ATOM 1999 HA LEU A 135 3.723 32.942 -3.386 1.00 0.00 H ATOM 2000 HB2 LEU A 135 1.723 34.210 -5.025 1.00 0.00 H ATOM 2001 HB3 LEU A 135 1.188 33.884 -3.360 1.00 0.00 H ATOM 2002 HG LEU A 135 2.473 35.528 -2.489 1.00 0.00 H ATOM 2003 HD21 LEU A 135 1.616 36.321 -5.338 1.00 0.00 H ATOM 2004 HD22 LEU A 135 0.535 36.252 -3.924 1.00 0.00 H ATOM 2005 HD23 LEU A 135 1.836 37.466 -3.992 1.00 0.00 H ATOM 2006 HD11 LEU A 135 4.599 35.082 -3.374 1.00 0.00 H ATOM 2007 HD12 LEU A 135 4.112 35.723 -4.963 1.00 0.00 H ATOM 2008 HD13 LEU A 135 4.173 36.802 -3.547 1.00 0.00 H ATOM 2009 H LEU A 135 2.381 32.524 -6.085 1.00 0.00 H ATOM 2010 N LYS A 136 1.579 30.766 -4.411 1.00 46.32 N ATOM 2011 CA LYS A 136 0.593 29.745 -3.994 1.00 44.49 C ATOM 2012 C LYS A 136 1.298 28.818 -3.025 1.00 33.07 C ATOM 2013 O LYS A 136 2.479 28.488 -3.118 1.00 35.31 O ATOM 2014 CB LYS A 136 -0.164 29.094 -5.134 1.00 64.65 C ATOM 2015 CG LYS A 136 -1.507 29.759 -5.453 1.00 91.85 C ATOM 2016 CD LYS A 136 -2.560 29.464 -4.397 1.00114.76 C ATOM 2017 CE LYS A 136 -3.964 29.848 -4.828 1.00128.55 C ATOM 2018 NZ LYS A 136 -5.005 29.242 -3.948 1.00138.75 N ATOM 2019 HA LYS A 136 -0.243 30.210 -3.472 1.00 0.00 H ATOM 2020 HB2 LYS A 136 0.460 29.135 -6.027 1.00 0.00 H ATOM 2021 HB3 LYS A 136 -0.351 28.053 -4.871 1.00 0.00 H ATOM 2022 HG2 LYS A 136 -1.360 30.837 -5.511 1.00 0.00 H ATOM 2023 HG3 LYS A 136 -1.862 29.390 -6.415 1.00 0.00 H ATOM 2024 HD2 LYS A 136 -2.544 28.396 -4.180 1.00 0.00 H ATOM 2025 HD3 LYS A 136 -2.310 30.020 -3.494 1.00 0.00 H ATOM 2026 HE2 LYS A 136 -4.124 29.506 -5.850 1.00 0.00 H ATOM 2027 HE3 LYS A 136 -4.059 30.933 -4.790 1.00 0.00 H ATOM 2028 HZ1 LYS A 136 -4.926 28.206 -3.983 1.00 0.00 H ATOM 2029 HZ2 LYS A 136 -4.864 29.569 -2.971 1.00 0.00 H ATOM 2030 HZ3 LYS A 136 -5.948 29.531 -4.279 1.00 0.00 H ATOM 2031 H LYS A 136 1.963 30.798 -5.377 1.00 0.00 H ATOM 2032 N GLY A 137 0.607 28.476 -1.943 1.00 24.10 N ATOM 2033 CA GLY A 137 1.122 27.605 -0.920 1.00 22.25 C ATOM 2034 C GLY A 137 1.831 28.370 0.193 1.00 33.88 C ATOM 2035 O GLY A 137 2.199 27.709 1.189 1.00 30.77 O ATOM 2036 HA3 GLY A 137 1.830 26.911 -1.374 1.00 0.00 H ATOM 2037 HA2 GLY A 137 0.293 27.045 -0.487 1.00 0.00 H ATOM 2038 H GLY A 137 -0.354 28.857 -1.830 1.00 0.00 H ATOM 2039 N SER A 138 1.759 29.712 0.162 1.00 26.32 N ATOM 2040 CA SER A 138 2.551 30.558 1.024 1.00 33.64 C ATOM 2041 C SER A 138 1.769 31.293 2.113 1.00 31.80 C ATOM 2042 O SER A 138 2.359 32.015 2.928 1.00 28.22 O ATOM 2043 CB SER A 138 3.228 31.645 0.156 1.00 23.67 C ATOM 2044 OG SER A 138 4.444 31.142 -0.311 1.00 37.36 O ATOM 2045 HA SER A 138 3.249 29.887 1.524 1.00 0.00 H ATOM 2046 HB2 SER A 138 3.405 32.538 0.755 1.00 0.00 H ATOM 2047 HB3 SER A 138 2.585 31.896 -0.687 1.00 0.00 H ATOM 2048 HG SER A 138 4.278 30.330 -0.853 1.00 0.00 H ATOM 2049 H SER A 138 1.105 30.160 -0.511 1.00 0.00 H ATOM 2050 N SER A 139 0.481 31.078 2.122 1.00 24.38 N ATOM 2051 CA SER A 139 -0.378 31.614 3.194 1.00 26.98 C ATOM 2052 C SER A 139 0.061 31.219 4.599 1.00 27.72 C ATOM 2053 O SER A 139 0.288 30.011 4.829 1.00 32.48 O ATOM 2054 CB SER A 139 -1.732 30.908 3.020 1.00 32.20 C ATOM 2055 OG SER A 139 -2.663 31.711 2.367 1.00 41.14 O ATOM 2056 HA SER A 139 -0.368 32.701 3.112 1.00 0.00 H ATOM 2057 HB2 SER A 139 -2.122 30.647 4.004 1.00 0.00 H ATOM 2058 HB3 SER A 139 -1.582 29.999 2.438 1.00 0.00 H ATOM 2059 HG SER A 139 -3.517 31.218 2.277 1.00 0.00 H ATOM 2060 H SER A 139 0.053 30.518 1.358 1.00 0.00 H ATOM 2061 N GLY A 140 0.098 32.129 5.564 1.00 32.16 N ATOM 2062 CA GLY A 140 0.730 31.832 6.863 1.00 25.92 C ATOM 2063 C GLY A 140 2.187 32.246 6.890 1.00 28.72 C ATOM 2064 O GLY A 140 2.830 32.247 7.945 1.00 24.61 O ATOM 2065 HA3 GLY A 140 0.664 30.760 7.050 1.00 0.00 H ATOM 2066 HA2 GLY A 140 0.196 32.370 7.646 1.00 0.00 H ATOM 2067 H GLY A 140 -0.325 33.065 5.402 1.00 0.00 H ATOM 2068 N GLY A 141 2.737 32.644 5.738 1.00 34.29 N ATOM 2069 CA GLY A 141 4.182 32.969 5.676 1.00 30.18 C ATOM 2070 C GLY A 141 4.380 34.370 6.270 1.00 33.75 C ATOM 2071 O GLY A 141 3.451 35.205 6.295 1.00 22.89 O ATOM 2072 HA3 GLY A 141 4.520 32.955 4.640 1.00 0.00 H ATOM 2073 HA2 GLY A 141 4.751 32.239 6.252 1.00 0.00 H ATOM 2074 H GLY A 141 2.150 32.726 4.884 1.00 0.00 H ATOM 2075 N PRO A 142 5.597 34.632 6.732 1.00 28.17 N ATOM 2076 CA PRO A 142 5.867 35.856 7.481 1.00 31.27 C ATOM 2077 C PRO A 142 6.165 37.045 6.569 1.00 35.02 C ATOM 2078 O PRO A 142 6.743 36.905 5.494 1.00 30.88 O ATOM 2079 CB PRO A 142 7.053 35.508 8.364 1.00 22.69 C ATOM 2080 CG PRO A 142 7.765 34.455 7.591 1.00 26.10 C ATOM 2081 CD PRO A 142 6.666 33.634 6.959 1.00 26.88 C ATOM 2082 HA PRO A 142 5.000 36.173 8.060 1.00 0.00 H ATOM 2083 HD3 PRO A 142 6.997 33.193 6.019 1.00 0.00 H ATOM 2084 HD2 PRO A 142 6.330 32.845 7.631 1.00 0.00 H ATOM 2085 HG3 PRO A 142 8.374 33.838 8.252 1.00 0.00 H ATOM 2086 HG2 PRO A 142 8.400 34.902 6.826 1.00 0.00 H ATOM 2087 HB2 PRO A 142 7.692 36.377 8.519 1.00 0.00 H ATOM 2088 HB3 PRO A 142 6.721 35.126 9.329 1.00 0.00 H ATOM 2089 N LEU A 143 5.655 38.212 6.976 1.00 30.10 N ATOM 2090 CA LEU A 143 6.165 39.485 6.492 1.00 33.46 C ATOM 2091 C LEU A 143 7.119 40.064 7.532 1.00 26.81 C ATOM 2092 O LEU A 143 6.845 40.169 8.721 1.00 39.77 O ATOM 2093 CB LEU A 143 5.063 40.487 6.162 1.00 24.62 C ATOM 2094 CG LEU A 143 4.283 40.087 4.902 1.00 44.41 C ATOM 2095 CD1 LEU A 143 2.932 39.475 5.174 1.00 33.98 C ATOM 2096 CD2 LEU A 143 4.200 41.248 3.928 1.00 26.21 C ATOM 2097 HA LEU A 143 6.690 39.296 5.556 1.00 0.00 H ATOM 2098 HB2 LEU A 143 4.371 40.540 7.003 1.00 0.00 H ATOM 2099 HB3 LEU A 143 5.514 41.466 6.002 1.00 0.00 H ATOM 2100 HG LEU A 143 4.856 39.285 4.437 1.00 0.00 H ATOM 2101 HD21 LEU A 143 3.692 42.086 4.406 1.00 0.00 H ATOM 2102 HD22 LEU A 143 5.206 41.550 3.638 1.00 0.00 H ATOM 2103 HD23 LEU A 143 3.643 40.939 3.044 1.00 0.00 H ATOM 2104 HD11 LEU A 143 3.057 38.572 5.771 1.00 0.00 H ATOM 2105 HD12 LEU A 143 2.314 40.189 5.718 1.00 0.00 H ATOM 2106 HD13 LEU A 143 2.452 39.223 4.229 1.00 0.00 H ATOM 2107 H LEU A 143 4.871 38.209 7.659 1.00 0.00 H ATOM 2108 N LEU A 144 8.349 40.232 7.085 1.00 40.63 N ATOM 2109 CA LEU A 144 9.477 40.670 7.868 1.00 42.19 C ATOM 2110 C LEU A 144 9.790 42.149 7.663 1.00 44.37 C ATOM 2111 O LEU A 144 9.812 42.620 6.525 1.00 50.40 O ATOM 2112 CB LEU A 144 10.710 39.842 7.477 1.00 47.64 C ATOM 2113 CG LEU A 144 11.023 38.679 8.424 1.00 53.27 C ATOM 2114 CD1 LEU A 144 9.727 38.169 8.987 1.00 27.32 C ATOM 2115 CD2 LEU A 144 11.790 37.580 7.702 1.00 43.16 C ATOM 2116 HA LEU A 144 9.223 40.528 8.918 1.00 0.00 H ATOM 2117 HB2 LEU A 144 10.544 39.434 6.480 1.00 0.00 H ATOM 2118 HB3 LEU A 144 11.574 40.506 7.457 1.00 0.00 H ATOM 2119 HG LEU A 144 11.662 39.022 9.238 1.00 0.00 H ATOM 2120 HD21 LEU A 144 11.190 37.205 6.873 1.00 0.00 H ATOM 2121 HD22 LEU A 144 12.728 37.984 7.321 1.00 0.00 H ATOM 2122 HD23 LEU A 144 11.999 36.767 8.398 1.00 0.00 H ATOM 2123 HD11 LEU A 144 9.228 38.971 9.531 1.00 0.00 H ATOM 2124 HD12 LEU A 144 9.088 37.828 8.173 1.00 0.00 H ATOM 2125 HD13 LEU A 144 9.928 37.339 9.665 1.00 0.00 H ATOM 2126 H LEU A 144 8.520 40.031 6.079 1.00 0.00 H ATOM 2127 N CYS A 145 10.125 42.839 8.749 1.00 38.12 N ATOM 2128 CA CYS A 145 10.850 44.093 8.588 1.00 31.23 C ATOM 2129 C CYS A 145 12.337 43.797 8.420 1.00 34.90 C ATOM 2130 O CYS A 145 12.825 42.688 8.652 1.00 41.88 O ATOM 2131 CB CYS A 145 10.637 44.969 9.830 1.00 37.76 C ATOM 2132 SG CYS A 145 11.835 44.548 11.115 1.00 52.04 S ATOM 2133 HA CYS A 145 10.482 44.619 7.707 1.00 0.00 H ATOM 2134 HB2 CYS A 145 9.629 44.810 10.213 1.00 0.00 H ATOM 2135 HB3 CYS A 145 10.759 46.017 9.555 1.00 0.00 H ATOM 2136 HG CYS A 145 11.623 45.348 12.219 1.00 0.00 H ATOM 2137 H CYS A 145 9.874 42.490 9.696 1.00 0.00 H ATOM 2138 N PRO A 146 13.092 44.827 8.074 1.00 40.95 N ATOM 2139 CA PRO A 146 14.492 44.725 7.737 1.00 40.61 C ATOM 2140 C PRO A 146 15.371 44.324 8.904 1.00 44.62 C ATOM 2141 O PRO A 146 16.498 43.916 8.619 1.00 54.81 O ATOM 2142 CB PRO A 146 14.870 46.099 7.222 1.00 38.69 C ATOM 2143 CG PRO A 146 13.612 46.887 7.156 1.00 40.62 C ATOM 2144 CD PRO A 146 12.674 46.259 8.153 1.00 42.47 C ATOM 2145 HA PRO A 146 14.647 43.936 7.002 1.00 0.00 H ATOM 2146 HD3 PRO A 146 12.822 46.665 9.154 1.00 0.00 H ATOM 2147 HD2 PRO A 146 11.632 46.389 7.860 1.00 0.00 H ATOM 2148 HG3 PRO A 146 13.187 46.839 6.153 1.00 0.00 H ATOM 2149 HG2 PRO A 146 13.803 47.928 7.419 1.00 0.00 H ATOM 2150 HB2 PRO A 146 15.577 46.575 7.902 1.00 0.00 H ATOM 2151 HB3 PRO A 146 15.317 46.020 6.231 1.00 0.00 H ATOM 2152 N SER A 147 14.928 44.395 10.153 1.00 49.64 N ATOM 2153 CA SER A 147 15.670 43.671 11.187 1.00 55.58 C ATOM 2154 C SER A 147 15.018 42.338 11.506 1.00 59.46 C ATOM 2155 O SER A 147 15.375 41.836 12.584 1.00 63.92 O ATOM 2156 CB SER A 147 15.875 44.448 12.481 1.00 57.84 C ATOM 2157 OG SER A 147 14.943 45.484 12.699 1.00 75.31 O ATOM 2158 HA SER A 147 16.657 43.515 10.752 1.00 0.00 H ATOM 2159 HB2 SER A 147 16.873 44.887 12.460 1.00 0.00 H ATOM 2160 HB3 SER A 147 15.805 43.747 13.313 1.00 0.00 H ATOM 2161 HG SER A 147 15.000 46.139 11.959 1.00 0.00 H ATOM 2162 H SER A 147 14.080 44.948 10.390 1.00 0.00 H ATOM 2163 N GLY A 148 14.043 41.819 10.766 1.00 58.80 N ATOM 2164 CA GLY A 148 13.900 40.346 10.767 1.00 56.23 C ATOM 2165 C GLY A 148 12.803 39.967 11.753 1.00 45.39 C ATOM 2166 O GLY A 148 12.788 38.857 12.266 1.00 46.28 O ATOM 2167 HA3 GLY A 148 14.841 39.885 11.068 1.00 0.00 H ATOM 2168 HA2 GLY A 148 13.632 40.002 9.768 1.00 0.00 H ATOM 2169 H GLY A 148 13.406 42.424 10.209 1.00 0.00 H ATOM 2170 N HIS A 149 12.048 41.001 12.103 1.00 48.46 N ATOM 2171 CA HIS A 149 10.931 40.770 13.039 1.00 51.04 C ATOM 2172 C HIS A 149 9.580 40.714 12.325 1.00 46.96 C ATOM 2173 O HIS A 149 9.302 41.257 11.237 1.00 42.10 O ATOM 2174 CB HIS A 149 11.004 41.820 14.158 1.00 56.53 C ATOM 2175 CG HIS A 149 12.219 41.659 15.031 1.00 85.51 C ATOM 2176 ND1 HIS A 149 12.325 42.283 16.257 1.00 85.67 N ATOM 2177 CD2 HIS A 149 13.370 40.954 14.884 1.00 83.78 C ATOM 2178 CE1 HIS A 149 13.483 41.971 16.806 1.00 90.50 C ATOM 2179 NE2 HIS A 149 14.139 41.162 15.993 1.00 83.58 N ATOM 2180 HA HIS A 149 11.028 39.785 13.496 1.00 0.00 H ATOM 2181 HB2 HIS A 149 11.029 42.811 13.705 1.00 0.00 H ATOM 2182 HB3 HIS A 149 10.113 41.729 14.780 1.00 0.00 H ATOM 2183 HD2 HIS A 149 13.634 40.331 14.030 1.00 0.00 H ATOM 2184 HE1 HIS A 149 13.841 42.323 17.773 1.00 0.00 H ATOM 2185 H HIS A 149 12.239 41.951 11.726 1.00 0.00 H ATOM 2186 N VAL A 150 8.614 40.065 12.994 1.00 38.99 N ATOM 2187 CA VAL A 150 7.325 39.828 12.346 1.00 41.50 C ATOM 2188 C VAL A 150 6.522 41.100 12.315 1.00 36.54 C ATOM 2189 O VAL A 150 6.318 41.665 13.365 1.00 40.83 O ATOM 2190 CB VAL A 150 6.560 38.648 12.963 1.00 31.79 C ATOM 2191 CG1 VAL A 150 5.223 38.353 12.260 1.00 27.31 C ATOM 2192 CG2 VAL A 150 7.567 37.502 12.784 1.00 26.17 C ATOM 2193 HA VAL A 150 7.513 39.529 11.315 1.00 0.00 H ATOM 2194 HB VAL A 150 6.258 38.827 13.995 1.00 0.00 H ATOM 2195 HG11 VAL A 150 4.579 39.230 12.323 1.00 0.00 H ATOM 2196 HG12 VAL A 150 5.410 38.112 11.213 1.00 0.00 H ATOM 2197 HG13 VAL A 150 4.736 37.508 12.747 1.00 0.00 H ATOM 2198 HG21 VAL A 150 7.781 37.370 11.723 1.00 0.00 H ATOM 2199 HG22 VAL A 150 8.488 37.743 13.314 1.00 0.00 H ATOM 2200 HG23 VAL A 150 7.144 36.582 13.188 1.00 0.00 H ATOM 2201 H VAL A 150 8.781 39.733 13.965 1.00 0.00 H ATOM 2202 N VAL A 151 6.073 41.448 11.095 1.00 44.61 N ATOM 2203 CA VAL A 151 5.067 42.520 11.094 1.00 33.31 C ATOM 2204 C VAL A 151 3.718 41.887 10.864 1.00 34.72 C ATOM 2205 O VAL A 151 2.668 42.500 11.104 1.00 37.91 O ATOM 2206 CB VAL A 151 5.440 43.754 10.284 1.00 44.85 C ATOM 2207 CG1 VAL A 151 6.862 43.703 9.733 1.00 51.25 C ATOM 2208 CG2 VAL A 151 4.462 44.137 9.200 1.00 37.65 C ATOM 2209 HA VAL A 151 5.018 43.003 12.070 1.00 0.00 H ATOM 2210 HB VAL A 151 5.387 44.552 11.024 1.00 0.00 H ATOM 2211 HG11 VAL A 151 7.568 43.625 10.560 1.00 0.00 H ATOM 2212 HG12 VAL A 151 6.967 42.836 9.081 1.00 0.00 H ATOM 2213 HG13 VAL A 151 7.063 44.612 9.166 1.00 0.00 H ATOM 2214 HG21 VAL A 151 4.370 43.316 8.488 1.00 0.00 H ATOM 2215 HG22 VAL A 151 3.489 44.343 9.646 1.00 0.00 H ATOM 2216 HG23 VAL A 151 4.823 45.027 8.685 1.00 0.00 H ATOM 2217 H VAL A 151 6.411 40.995 10.222 1.00 0.00 H ATOM 2218 N GLY A 152 3.634 40.586 10.567 1.00 38.70 N ATOM 2219 CA GLY A 152 2.400 39.994 10.036 1.00 35.93 C ATOM 2220 C GLY A 152 2.610 38.675 9.291 1.00 40.68 C ATOM 2221 O GLY A 152 3.738 38.272 8.987 1.00 36.10 O ATOM 2222 HA3 GLY A 152 1.946 40.707 9.348 1.00 0.00 H ATOM 2223 HA2 GLY A 152 1.721 39.812 10.869 1.00 0.00 H ATOM 2224 H GLY A 152 4.464 39.978 10.716 1.00 0.00 H ATOM 2225 N ILE A 153 1.521 37.954 9.013 1.00 36.14 N ATOM 2226 CA ILE A 153 1.567 36.729 8.230 1.00 37.00 C ATOM 2227 C ILE A 153 0.687 36.847 6.977 1.00 31.02 C ATOM 2228 O ILE A 153 -0.334 37.522 6.967 1.00 28.12 O ATOM 2229 CB ILE A 153 1.218 35.436 8.999 1.00 28.84 C ATOM 2230 CG1 ILE A 153 -0.141 35.445 9.649 1.00 21.22 C ATOM 2231 CG2 ILE A 153 2.281 35.232 10.082 1.00 32.41 C ATOM 2232 CD1 ILE A 153 -0.913 34.188 9.905 1.00 22.82 C ATOM 2233 HA ILE A 153 2.616 36.626 7.952 1.00 0.00 H ATOM 2234 HB ILE A 153 1.197 34.627 8.269 1.00 0.00 H ATOM 2235 HG12 ILE A 153 -0.011 35.925 10.619 1.00 0.00 H ATOM 2236 HG13 ILE A 153 -0.775 36.068 9.019 1.00 0.00 H ATOM 2237 HD11 ILE A 153 -1.101 33.680 8.959 1.00 0.00 H ATOM 2238 HD12 ILE A 153 -0.336 33.536 10.561 1.00 0.00 H ATOM 2239 HD13 ILE A 153 -1.862 34.436 10.381 1.00 0.00 H ATOM 2240 HG21 ILE A 153 3.261 35.141 9.614 1.00 0.00 H ATOM 2241 HG22 ILE A 153 2.278 36.087 10.758 1.00 0.00 H ATOM 2242 HG23 ILE A 153 2.058 34.324 10.642 1.00 0.00 H ATOM 2243 H ILE A 153 0.601 38.282 9.371 1.00 0.00 H ATOM 2244 N PHE A 154 1.143 36.162 5.927 1.00 35.71 N ATOM 2245 CA PHE A 154 0.561 36.311 4.598 1.00 26.98 C ATOM 2246 C PHE A 154 -0.804 35.653 4.581 1.00 28.84 C ATOM 2247 O PHE A 154 -0.972 34.519 5.026 1.00 26.24 O ATOM 2248 CB PHE A 154 1.471 35.787 3.484 1.00 36.72 C ATOM 2249 CG PHE A 154 0.857 35.773 2.109 1.00 27.29 C ATOM 2250 CD1 PHE A 154 0.143 36.857 1.655 1.00 34.30 C ATOM 2251 CD2 PHE A 154 0.972 34.678 1.277 1.00 36.05 C ATOM 2252 CE1 PHE A 154 -0.452 36.878 0.420 1.00 43.73 C ATOM 2253 CE2 PHE A 154 0.386 34.689 0.005 1.00 25.80 C ATOM 2254 CZ PHE A 154 -0.353 35.776 -0.408 1.00 37.64 C ATOM 2255 HA PHE A 154 0.449 37.375 4.389 1.00 0.00 H ATOM 2256 HB2 PHE A 154 2.360 36.416 3.450 1.00 0.00 H ATOM 2257 HB3 PHE A 154 1.759 34.766 3.736 1.00 0.00 H ATOM 2258 HD2 PHE A 154 1.522 33.799 1.612 1.00 0.00 H ATOM 2259 HE2 PHE A 154 0.515 33.835 -0.660 1.00 0.00 H ATOM 2260 HZ PHE A 154 -0.854 35.767 -1.376 1.00 0.00 H ATOM 2261 HE1 PHE A 154 -1.001 37.761 0.092 1.00 0.00 H ATOM 2262 HD1 PHE A 154 0.047 37.730 2.300 1.00 0.00 H ATOM 2263 H PHE A 154 1.936 35.503 6.060 1.00 0.00 H ATOM 2264 N ARG A 155 -1.783 36.432 4.111 1.00 26.79 N ATOM 2265 CA ARG A 155 -3.135 35.887 4.027 1.00 34.03 C ATOM 2266 C ARG A 155 -3.543 35.597 2.587 1.00 32.44 C ATOM 2267 O ARG A 155 -3.960 34.463 2.322 1.00 38.96 O ATOM 2268 CB ARG A 155 -4.133 36.871 4.650 1.00 35.15 C ATOM 2269 CG ARG A 155 -5.556 36.357 4.612 1.00 41.46 C ATOM 2270 CD ARG A 155 -6.399 37.186 5.571 1.00 74.02 C ATOM 2271 NE ARG A 155 -7.810 37.082 5.211 1.00 94.86 N ATOM 2272 CZ ARG A 155 -8.392 37.905 4.345 1.00106.06 C ATOM 2273 NH1 ARG A 155 -7.675 38.873 3.792 1.00 95.26 N ATOM 2274 NH2 ARG A 155 -9.679 37.756 4.061 1.00123.46 N ATOM 2275 HA ARG A 155 -3.144 34.945 4.576 1.00 0.00 H ATOM 2276 HB2 ARG A 155 -3.851 37.044 5.689 1.00 0.00 H ATOM 2277 HB3 ARG A 155 -4.086 37.811 4.101 1.00 0.00 H ATOM 2278 HG2 ARG A 155 -5.953 36.449 3.601 1.00 0.00 H ATOM 2279 HG3 ARG A 155 -5.577 35.310 4.916 1.00 0.00 H ATOM 2280 HD2 ARG A 155 -6.088 38.229 5.517 1.00 0.00 H ATOM 2281 HD3 ARG A 155 -6.257 36.818 6.587 1.00 0.00 H ATOM 2282 HE ARG A 155 -8.383 36.333 5.650 1.00 0.00 H ATOM 2283 HH12 ARG A 155 -8.117 39.524 3.113 1.00 0.00 H ATOM 2284 HH11 ARG A 155 -6.670 38.981 4.038 1.00 0.00 H ATOM 2285 HH22 ARG A 155 -10.140 38.397 3.384 1.00 0.00 H ATOM 2286 HH21 ARG A 155 -10.227 36.998 4.515 1.00 0.00 H ATOM 2287 H ARG A 155 -1.586 37.408 3.811 1.00 0.00 H ATOM 2288 N ALA A 156 -3.711 36.681 1.817 1.00 34.18 N ATOM 2289 CA ALA A 156 -4.097 36.456 0.403 1.00 37.11 C ATOM 2290 C ALA A 156 -3.492 37.382 -0.620 1.00 28.17 C ATOM 2291 O ALA A 156 -3.377 38.567 -0.336 1.00 44.48 O ATOM 2292 CB ALA A 156 -5.630 36.628 0.307 1.00 23.71 C ATOM 2293 HA ALA A 156 -3.723 35.461 0.162 1.00 0.00 H ATOM 2294 HB1 ALA A 156 -6.117 35.900 0.956 1.00 0.00 H ATOM 2295 HB2 ALA A 156 -5.902 37.636 0.621 1.00 0.00 H ATOM 2296 HB3 ALA A 156 -5.948 36.469 -0.723 1.00 0.00 H ATOM 2297 H ALA A 156 -3.576 37.640 2.195 1.00 0.00 H ATOM 2298 N ALA A 157 -3.188 36.925 -1.822 1.00 29.20 N ATOM 2299 CA ALA A 157 -2.668 37.732 -2.901 1.00 31.09 C ATOM 2300 C ALA A 157 -3.745 38.653 -3.462 1.00 38.74 C ATOM 2301 O ALA A 157 -4.892 38.189 -3.565 1.00 36.95 O ATOM 2302 CB ALA A 157 -2.259 36.875 -4.100 1.00 26.87 C ATOM 2303 HA ALA A 157 -1.825 38.275 -2.474 1.00 0.00 H ATOM 2304 HB1 ALA A 157 -1.486 36.170 -3.794 1.00 0.00 H ATOM 2305 HB2 ALA A 157 -3.127 36.328 -4.467 1.00 0.00 H ATOM 2306 HB3 ALA A 157 -1.873 37.519 -4.890 1.00 0.00 H ATOM 2307 H ALA A 157 -3.334 35.911 -2.004 1.00 0.00 H ATOM 2308 N VAL A 158 -3.334 39.879 -3.838 1.00 38.41 N ATOM 2309 CA VAL A 158 -4.341 40.618 -4.647 1.00 38.40 C ATOM 2310 C VAL A 158 -3.801 40.689 -6.061 1.00 44.74 C ATOM 2311 O VAL A 158 -2.598 40.837 -6.348 1.00 41.96 O ATOM 2312 CB VAL A 158 -4.922 41.809 -3.915 1.00 52.77 C ATOM 2313 CG1 VAL A 158 -4.120 42.213 -2.680 1.00 37.22 C ATOM 2314 CG2 VAL A 158 -5.159 43.012 -4.798 1.00 29.73 C ATOM 2315 HA VAL A 158 -5.301 40.120 -4.786 1.00 0.00 H ATOM 2316 HB VAL A 158 -5.896 41.454 -3.579 1.00 0.00 H ATOM 2317 HG11 VAL A 158 -4.091 41.379 -1.978 1.00 0.00 H ATOM 2318 HG12 VAL A 158 -3.105 42.475 -2.977 1.00 0.00 H ATOM 2319 HG13 VAL A 158 -4.594 43.072 -2.206 1.00 0.00 H ATOM 2320 HG21 VAL A 158 -4.214 43.331 -5.237 1.00 0.00 H ATOM 2321 HG22 VAL A 158 -5.858 42.747 -5.591 1.00 0.00 H ATOM 2322 HG23 VAL A 158 -5.576 43.823 -4.201 1.00 0.00 H ATOM 2323 H VAL A 158 -2.404 40.271 -3.588 1.00 0.00 H ATOM 2324 N CYS A 159 -4.676 40.184 -6.955 1.00 43.56 N ATOM 2325 CA CYS A 159 -4.186 39.731 -8.266 1.00 46.50 C ATOM 2326 C CYS A 159 -5.160 40.067 -9.373 1.00 53.46 C ATOM 2327 O CYS A 159 -6.374 39.897 -9.264 1.00 62.03 O ATOM 2328 CB CYS A 159 -3.808 38.261 -8.217 1.00 54.08 C ATOM 2329 SG CYS A 159 -4.973 37.093 -7.513 1.00 72.39 S ATOM 2330 HA CYS A 159 -3.275 40.279 -8.506 1.00 0.00 H ATOM 2331 HB2 CYS A 159 -2.888 38.186 -7.637 1.00 0.00 H ATOM 2332 HB3 CYS A 159 -3.617 37.945 -9.242 1.00 0.00 H ATOM 2333 HG CYS A 159 -4.437 35.823 -7.566 1.00 0.00 H ATOM 2334 H CYS A 159 -5.687 40.116 -6.720 1.00 0.00 H ATOM 2335 N THR A 160 -4.665 40.714 -10.430 1.00 57.34 N ATOM 2336 CA THR A 160 -5.429 40.807 -11.661 1.00 58.36 C ATOM 2337 C THR A 160 -4.732 40.011 -12.763 1.00 52.70 C ATOM 2338 O THR A 160 -3.650 40.425 -13.178 1.00 49.20 O ATOM 2339 CB THR A 160 -5.565 42.210 -12.293 1.00 86.65 C ATOM 2340 OG1 THR A 160 -5.661 43.225 -11.295 1.00 87.27 O ATOM 2341 CG2 THR A 160 -6.795 42.258 -13.199 1.00 89.88 C ATOM 2342 HA THR A 160 -6.412 40.452 -11.351 1.00 0.00 H ATOM 2343 HB THR A 160 -4.668 42.399 -12.883 1.00 0.00 H ATOM 2344 HG1 THR A 160 -4.846 43.211 -10.733 1.00 0.00 H ATOM 2345 HG23 THR A 160 -6.716 41.481 -13.959 1.00 0.00 H ATOM 2346 HG21 THR A 160 -7.692 42.093 -12.601 1.00 0.00 H ATOM 2347 HG22 THR A 160 -6.852 43.234 -13.681 1.00 0.00 H ATOM 2348 H THR A 160 -3.725 41.155 -10.371 1.00 0.00 H ATOM 2349 N ARG A 161 -5.442 39.067 -13.362 1.00 53.17 N ATOM 2350 CA ARG A 161 -5.001 38.479 -14.628 1.00 53.29 C ATOM 2351 C ARG A 161 -3.741 37.655 -14.386 1.00 60.43 C ATOM 2352 O ARG A 161 -2.846 37.588 -15.243 1.00 62.11 O ATOM 2353 CB ARG A 161 -4.726 39.595 -15.636 1.00 63.32 C ATOM 2354 CG ARG A 161 -5.941 40.498 -15.843 1.00 71.27 C ATOM 2355 CD ARG A 161 -5.771 41.439 -17.019 1.00 80.59 C ATOM 2356 NE ARG A 161 -6.812 42.451 -17.081 1.00 91.81 N ATOM 2357 CZ ARG A 161 -6.852 43.626 -16.470 1.00100.57 C ATOM 2358 NH1 ARG A 161 -5.880 44.067 -15.683 1.00 90.24 N ATOM 2359 NH2 ARG A 161 -7.910 44.413 -16.648 1.00107.50 N ATOM 2360 HA ARG A 161 -5.778 37.828 -15.029 1.00 0.00 H ATOM 2361 HB2 ARG A 161 -3.896 40.201 -15.272 1.00 0.00 H ATOM 2362 HB3 ARG A 161 -4.455 39.146 -16.592 1.00 0.00 H ATOM 2363 HG2 ARG A 161 -6.816 39.872 -16.019 1.00 0.00 H ATOM 2364 HG3 ARG A 161 -6.095 41.090 -14.941 1.00 0.00 H ATOM 2365 HD2 ARG A 161 -5.796 40.856 -17.939 1.00 0.00 H ATOM 2366 HD3 ARG A 161 -4.805 41.936 -16.931 1.00 0.00 H ATOM 2367 HE ARG A 161 -7.630 42.224 -17.682 1.00 0.00 H ATOM 2368 HH12 ARG A 161 -5.962 44.998 -15.227 1.00 0.00 H ATOM 2369 HH11 ARG A 161 -5.036 43.482 -15.522 1.00 0.00 H ATOM 2370 HH22 ARG A 161 -7.955 45.338 -16.175 1.00 0.00 H ATOM 2371 HH21 ARG A 161 -8.692 44.103 -17.260 1.00 0.00 H ATOM 2372 H ARG A 161 -6.327 38.738 -12.926 1.00 0.00 H ATOM 2373 N GLY A 162 -3.690 37.102 -13.166 1.00 49.82 N ATOM 2374 CA GLY A 162 -2.733 36.043 -12.886 1.00 50.01 C ATOM 2375 C GLY A 162 -1.434 36.635 -12.345 1.00 43.78 C ATOM 2376 O GLY A 162 -0.535 35.853 -12.009 1.00 35.79 O ATOM 2377 HA3 GLY A 162 -2.524 35.494 -13.804 1.00 0.00 H ATOM 2378 HA2 GLY A 162 -3.155 35.363 -12.146 1.00 0.00 H ATOM 2379 H GLY A 162 -4.335 37.430 -12.419 1.00 0.00 H ATOM 2380 N VAL A 163 -1.353 37.964 -12.335 1.00 36.25 N ATOM 2381 CA VAL A 163 -0.154 38.512 -11.695 1.00 43.14 C ATOM 2382 C VAL A 163 -0.615 39.168 -10.384 1.00 43.92 C ATOM 2383 O VAL A 163 -1.656 39.798 -10.242 1.00 37.33 O ATOM 2384 CB VAL A 163 0.778 39.362 -12.551 1.00 49.74 C ATOM 2385 CG1 VAL A 163 0.488 39.373 -14.054 1.00 24.69 C ATOM 2386 CG2 VAL A 163 0.907 40.780 -12.030 1.00 31.56 C ATOM 2387 HA VAL A 163 0.531 37.687 -11.499 1.00 0.00 H ATOM 2388 HB VAL A 163 1.734 38.848 -12.449 1.00 0.00 H ATOM 2389 HG11 VAL A 163 0.561 38.358 -14.444 1.00 0.00 H ATOM 2390 HG12 VAL A 163 -0.517 39.759 -14.226 1.00 0.00 H ATOM 2391 HG13 VAL A 163 1.214 40.010 -14.558 1.00 0.00 H ATOM 2392 HG21 VAL A 163 -0.074 41.255 -12.026 1.00 0.00 H ATOM 2393 HG22 VAL A 163 1.306 40.758 -11.016 1.00 0.00 H ATOM 2394 HG23 VAL A 163 1.582 41.343 -12.675 1.00 0.00 H ATOM 2395 H VAL A 163 -2.088 38.570 -12.752 1.00 0.00 H ATOM 2396 N ALA A 164 0.216 38.927 -9.386 1.00 42.42 N ATOM 2397 CA ALA A 164 0.000 39.367 -8.022 1.00 49.09 C ATOM 2398 C ALA A 164 0.690 40.718 -7.895 1.00 48.56 C ATOM 2399 O ALA A 164 1.910 40.785 -8.102 1.00 42.94 O ATOM 2400 CB ALA A 164 0.613 38.327 -7.078 1.00 34.18 C ATOM 2401 HA ALA A 164 -1.055 39.467 -7.768 1.00 0.00 H ATOM 2402 HB1 ALA A 164 0.132 37.362 -7.241 1.00 0.00 H ATOM 2403 HB2 ALA A 164 1.681 38.241 -7.279 1.00 0.00 H ATOM 2404 HB3 ALA A 164 0.460 38.641 -6.045 1.00 0.00 H ATOM 2405 H ALA A 164 1.081 38.387 -9.592 1.00 0.00 H ATOM 2406 N LYS A 165 -0.066 41.735 -7.514 1.00 51.32 N ATOM 2407 CA LYS A 165 0.506 43.071 -7.343 1.00 50.45 C ATOM 2408 C LYS A 165 0.493 43.499 -5.881 1.00 49.24 C ATOM 2409 O LYS A 165 1.136 44.502 -5.563 1.00 58.67 O ATOM 2410 CB LYS A 165 -0.243 44.087 -8.221 1.00 45.60 C ATOM 2411 CG LYS A 165 0.312 44.250 -9.623 1.00 70.00 C ATOM 2412 CD LYS A 165 -0.773 44.629 -10.630 1.00 82.54 C ATOM 2413 CE LYS A 165 -0.212 44.673 -12.044 1.00 91.06 C ATOM 2414 NZ LYS A 165 -1.096 43.998 -13.035 1.00105.91 N ATOM 2415 HA LYS A 165 1.548 43.037 -7.662 1.00 0.00 H ATOM 2416 HB2 LYS A 165 -1.281 43.764 -8.303 1.00 0.00 H ATOM 2417 HB3 LYS A 165 -0.203 45.057 -7.726 1.00 0.00 H ATOM 2418 HG2 LYS A 165 1.071 45.032 -9.612 1.00 0.00 H ATOM 2419 HG3 LYS A 165 0.767 43.309 -9.933 1.00 0.00 H ATOM 2420 HD2 LYS A 165 -1.574 43.891 -10.587 1.00 0.00 H ATOM 2421 HD3 LYS A 165 -1.171 45.611 -10.373 1.00 0.00 H ATOM 2422 HE2 LYS A 165 0.760 44.179 -12.049 1.00 0.00 H ATOM 2423 HE3 LYS A 165 -0.090 45.715 -12.339 1.00 0.00 H ATOM 2424 HZ1 LYS A 165 -1.213 42.999 -12.769 1.00 0.00 H ATOM 2425 HZ2 LYS A 165 -2.024 44.467 -13.045 1.00 0.00 H ATOM 2426 HZ3 LYS A 165 -0.665 44.058 -13.980 1.00 0.00 H ATOM 2427 H LYS A 165 -1.079 41.583 -7.334 1.00 0.00 H ATOM 2428 N ALA A 166 -0.350 42.931 -5.034 1.00 38.30 N ATOM 2429 CA ALA A 166 -0.390 43.362 -3.636 1.00 49.19 C ATOM 2430 C ALA A 166 -0.670 42.134 -2.776 1.00 44.56 C ATOM 2431 O ALA A 166 -0.946 41.056 -3.308 1.00 46.17 O ATOM 2432 CB ALA A 166 -1.416 44.472 -3.378 1.00 28.53 C ATOM 2433 HA ALA A 166 0.573 43.801 -3.376 1.00 0.00 H ATOM 2434 HB1 ALA A 166 -1.168 45.342 -3.986 1.00 0.00 H ATOM 2435 HB2 ALA A 166 -2.411 44.114 -3.642 1.00 0.00 H ATOM 2436 HB3 ALA A 166 -1.396 44.746 -2.323 1.00 0.00 H ATOM 2437 H ALA A 166 -0.986 42.176 -5.363 1.00 0.00 H ATOM 2438 N VAL A 167 -0.667 42.273 -1.455 1.00 39.95 N ATOM 2439 CA VAL A 167 -0.970 41.127 -0.593 1.00 40.33 C ATOM 2440 C VAL A 167 -1.739 41.537 0.627 1.00 35.35 C ATOM 2441 O VAL A 167 -1.340 42.548 1.176 1.00 41.79 O ATOM 2442 CB VAL A 167 0.300 40.437 -0.087 1.00 45.91 C ATOM 2443 CG1 VAL A 167 0.917 39.716 -1.287 1.00 43.31 C ATOM 2444 CG2 VAL A 167 1.296 41.411 0.550 1.00 42.99 C ATOM 2445 HA VAL A 167 -1.555 40.450 -1.215 1.00 0.00 H ATOM 2446 HB VAL A 167 0.045 39.737 0.709 1.00 0.00 H ATOM 2447 HG11 VAL A 167 0.207 38.986 -1.675 1.00 0.00 H ATOM 2448 HG12 VAL A 167 1.153 40.443 -2.064 1.00 0.00 H ATOM 2449 HG13 VAL A 167 1.829 39.207 -0.974 1.00 0.00 H ATOM 2450 HG21 VAL A 167 1.594 42.157 -0.187 1.00 0.00 H ATOM 2451 HG22 VAL A 167 0.826 41.906 1.400 1.00 0.00 H ATOM 2452 HG23 VAL A 167 2.174 40.861 0.888 1.00 0.00 H ATOM 2453 H VAL A 167 -0.449 43.197 -1.031 1.00 0.00 H ATOM 2454 N ASP A 168 -2.826 40.902 1.023 1.00 45.72 N ATOM 2455 CA ASP A 168 -3.410 41.092 2.350 1.00 35.11 C ATOM 2456 C ASP A 168 -2.649 40.264 3.369 1.00 36.16 C ATOM 2457 O ASP A 168 -2.225 39.154 3.058 1.00 31.61 O ATOM 2458 CB ASP A 168 -4.880 40.598 2.243 1.00 33.30 C ATOM 2459 CG ASP A 168 -5.620 41.619 1.376 1.00 33.93 C ATOM 2460 OD1 ASP A 168 -5.235 42.800 1.508 1.00 41.67 O ATOM 2461 OD2 ASP A 168 -6.529 41.236 0.615 1.00 36.73 O ATOM 2462 HA ASP A 168 -3.363 42.133 2.670 1.00 0.00 H ATOM 2463 HB2 ASP A 168 -4.914 39.613 1.777 1.00 0.00 H ATOM 2464 HB3 ASP A 168 -5.333 40.546 3.233 1.00 0.00 H ATOM 2465 H ASP A 168 -3.285 40.240 0.365 1.00 0.00 H ATOM 2466 N PHE A 169 -2.590 40.761 4.588 1.00 38.73 N ATOM 2467 CA PHE A 169 -1.829 40.096 5.635 1.00 37.89 C ATOM 2468 C PHE A 169 -2.493 40.368 6.981 1.00 42.82 C ATOM 2469 O PHE A 169 -3.239 41.345 7.092 1.00 44.41 O ATOM 2470 CB PHE A 169 -0.388 40.557 5.575 1.00 38.55 C ATOM 2471 CG PHE A 169 0.004 41.902 6.074 1.00 34.95 C ATOM 2472 CD1 PHE A 169 0.050 42.982 5.205 1.00 26.62 C ATOM 2473 CD2 PHE A 169 0.445 42.084 7.379 1.00 43.08 C ATOM 2474 CE1 PHE A 169 0.401 44.241 5.655 1.00 29.92 C ATOM 2475 CE2 PHE A 169 0.862 43.331 7.821 1.00 30.61 C ATOM 2476 CZ PHE A 169 0.818 44.405 6.957 1.00 44.35 C ATOM 2477 HA PHE A 169 -1.821 39.015 5.493 1.00 0.00 H ATOM 2478 HB2 PHE A 169 0.194 39.832 6.144 1.00 0.00 H ATOM 2479 HB3 PHE A 169 -0.092 40.516 4.527 1.00 0.00 H ATOM 2480 HD2 PHE A 169 0.464 41.236 8.064 1.00 0.00 H ATOM 2481 HE2 PHE A 169 1.221 43.461 8.842 1.00 0.00 H ATOM 2482 HZ PHE A 169 1.116 45.393 7.308 1.00 0.00 H ATOM 2483 HE1 PHE A 169 0.348 45.098 4.984 1.00 0.00 H ATOM 2484 HD1 PHE A 169 -0.194 42.836 4.153 1.00 0.00 H ATOM 2485 H PHE A 169 -3.096 41.643 4.805 1.00 0.00 H ATOM 2486 N ILE A 170 -2.268 39.454 7.915 1.00 35.54 N ATOM 2487 CA ILE A 170 -2.811 39.644 9.272 1.00 32.33 C ATOM 2488 C ILE A 170 -1.697 40.302 10.077 1.00 29.87 C ATOM 2489 O ILE A 170 -0.564 39.817 10.206 1.00 29.85 O ATOM 2490 CB ILE A 170 -3.235 38.254 9.753 1.00 29.40 C ATOM 2491 CG1 ILE A 170 -4.315 37.684 8.809 1.00 32.59 C ATOM 2492 CG2 ILE A 170 -3.702 38.197 11.182 1.00 32.87 C ATOM 2493 CD1 ILE A 170 -4.329 36.163 8.920 1.00 49.21 C ATOM 2494 HA ILE A 170 -3.686 40.288 9.355 1.00 0.00 H ATOM 2495 HB ILE A 170 -2.335 37.639 9.724 1.00 0.00 H ATOM 2496 HG12 ILE A 170 -5.291 38.079 9.091 1.00 0.00 H ATOM 2497 HG13 ILE A 170 -4.091 37.972 7.782 1.00 0.00 H ATOM 2498 HD11 ILE A 170 -3.352 35.770 8.637 1.00 0.00 H ATOM 2499 HD12 ILE A 170 -4.554 35.877 9.948 1.00 0.00 H ATOM 2500 HD13 ILE A 170 -5.091 35.758 8.254 1.00 0.00 H ATOM 2501 HG21 ILE A 170 -2.897 38.526 11.839 1.00 0.00 H ATOM 2502 HG22 ILE A 170 -4.565 38.851 11.307 1.00 0.00 H ATOM 2503 HG23 ILE A 170 -3.981 37.173 11.431 1.00 0.00 H ATOM 2504 H ILE A 170 -1.710 38.606 7.691 1.00 0.00 H ATOM 2505 N PRO A 171 -1.927 41.523 10.516 1.00 33.64 N ATOM 2506 CA PRO A 171 -0.940 42.408 11.154 1.00 28.30 C ATOM 2507 C PRO A 171 -0.719 41.810 12.538 1.00 36.34 C ATOM 2508 O PRO A 171 -1.698 41.311 13.111 1.00 45.34 O ATOM 2509 CB PRO A 171 -1.631 43.756 11.266 1.00 24.85 C ATOM 2510 CG PRO A 171 -3.087 43.382 11.306 1.00 32.72 C ATOM 2511 CD PRO A 171 -3.286 42.129 10.483 1.00 29.13 C ATOM 2512 HA PRO A 171 0.007 42.511 10.624 1.00 0.00 H ATOM 2513 HD3 PRO A 171 -4.026 41.469 10.936 1.00 0.00 H ATOM 2514 HD2 PRO A 171 -3.590 42.367 9.464 1.00 0.00 H ATOM 2515 HG3 PRO A 171 -3.686 44.193 10.892 1.00 0.00 H ATOM 2516 HG2 PRO A 171 -3.391 43.197 12.336 1.00 0.00 H ATOM 2517 HB2 PRO A 171 -1.334 44.276 12.177 1.00 0.00 H ATOM 2518 HB3 PRO A 171 -1.410 44.384 10.403 1.00 0.00 H ATOM 2519 N VAL A 172 0.486 41.727 13.032 1.00 37.52 N ATOM 2520 CA VAL A 172 0.937 40.946 14.158 1.00 44.83 C ATOM 2521 C VAL A 172 0.278 41.404 15.452 1.00 57.88 C ATOM 2522 O VAL A 172 0.165 40.657 16.428 1.00 61.87 O ATOM 2523 CB VAL A 172 2.469 41.114 14.339 1.00 49.83 C ATOM 2524 CG1 VAL A 172 2.787 42.465 14.972 1.00 39.11 C ATOM 2525 CG2 VAL A 172 3.089 39.983 15.134 1.00 50.67 C ATOM 2526 HA VAL A 172 0.673 39.908 13.955 1.00 0.00 H ATOM 2527 HB VAL A 172 2.915 41.077 13.345 1.00 0.00 H ATOM 2528 HG11 VAL A 172 2.416 43.263 14.328 1.00 0.00 H ATOM 2529 HG12 VAL A 172 2.305 42.530 15.948 1.00 0.00 H ATOM 2530 HG13 VAL A 172 3.866 42.564 15.091 1.00 0.00 H ATOM 2531 HG21 VAL A 172 2.636 39.946 16.125 1.00 0.00 H ATOM 2532 HG22 VAL A 172 2.914 39.039 14.618 1.00 0.00 H ATOM 2533 HG23 VAL A 172 4.161 40.153 15.229 1.00 0.00 H ATOM 2534 H VAL A 172 1.213 42.296 12.553 1.00 0.00 H ATOM 2535 N GLU A 173 -0.192 42.651 15.459 1.00 55.47 N ATOM 2536 CA GLU A 173 -1.090 43.141 16.488 1.00 58.45 C ATOM 2537 C GLU A 173 -2.265 42.202 16.739 1.00 61.05 C ATOM 2538 O GLU A 173 -2.876 42.177 17.808 1.00 66.01 O ATOM 2539 CB GLU A 173 -1.626 44.517 16.078 1.00 65.89 C ATOM 2540 CG GLU A 173 -0.652 45.667 16.107 1.00 73.15 C ATOM 2541 CD GLU A 173 0.353 45.739 14.977 1.00 75.49 C ATOM 2542 OE1 GLU A 173 0.450 44.813 14.147 1.00 79.58 O ATOM 2543 OE2 GLU A 173 1.104 46.736 14.888 1.00 68.62 O ATOM 2544 HA GLU A 173 -0.518 43.204 17.414 1.00 0.00 H ATOM 2545 HB2 GLU A 173 -2.005 44.432 15.060 1.00 0.00 H ATOM 2546 HB3 GLU A 173 -2.447 44.764 16.751 1.00 0.00 H ATOM 2547 HG2 GLU A 173 -1.231 46.590 16.093 1.00 0.00 H ATOM 2548 HG3 GLU A 173 -0.094 45.604 17.041 1.00 0.00 H ATOM 2549 H GLU A 173 0.096 43.298 14.697 1.00 0.00 H ATOM 2550 N SER A 174 -2.743 41.544 15.689 1.00 65.36 N ATOM 2551 CA SER A 174 -3.829 40.580 15.742 1.00 58.89 C ATOM 2552 C SER A 174 -3.406 39.322 16.501 1.00 53.64 C ATOM 2553 O SER A 174 -4.260 38.606 17.024 1.00 48.11 O ATOM 2554 CB SER A 174 -4.376 40.271 14.350 1.00 61.63 C ATOM 2555 OG SER A 174 -5.059 41.314 13.660 1.00 50.89 O ATOM 2556 HA SER A 174 -4.652 41.027 16.300 1.00 0.00 H ATOM 2557 HB2 SER A 174 -5.071 39.437 14.451 1.00 0.00 H ATOM 2558 HB3 SER A 174 -3.533 39.967 13.729 1.00 0.00 H ATOM 2559 HG SER A 174 -5.359 40.982 12.777 1.00 0.00 H ATOM 2560 H SER A 174 -2.309 41.732 14.763 1.00 0.00 H ATOM 2561 N MET A 175 -2.119 39.053 16.664 1.00 54.36 N ATOM 2562 CA MET A 175 -1.639 37.792 17.204 1.00 65.49 C ATOM 2563 C MET A 175 -1.289 37.898 18.685 1.00 79.88 C ATOM 2564 O MET A 175 -2.255 37.972 19.484 1.00 87.63 O ATOM 2565 CB MET A 175 -0.407 37.310 16.436 1.00 52.41 C ATOM 2566 CG MET A 175 -0.340 37.854 15.015 1.00 71.58 C ATOM 2567 SD MET A 175 0.609 36.781 13.937 1.00 57.85 S ATOM 2568 CE MET A 175 1.926 36.313 15.061 1.00 52.98 C ATOM 2569 HA MET A 175 -2.452 37.074 17.092 1.00 0.00 H ATOM 2570 HB2 MET A 175 0.485 37.631 16.973 1.00 0.00 H ATOM 2571 HB3 MET A 175 -0.430 36.221 16.391 1.00 0.00 H ATOM 2572 HG2 MET A 175 0.128 38.838 15.035 1.00 0.00 H ATOM 2573 HG3 MET A 175 -1.353 37.943 14.622 1.00 0.00 H ATOM 2574 HE1 MET A 175 2.461 37.206 15.384 1.00 0.00 H ATOM 2575 HE2 MET A 175 1.500 35.809 15.929 1.00 0.00 H ATOM 2576 HE3 MET A 175 2.615 35.640 14.551 1.00 0.00 H ATOM 2577 H MET A 175 -1.422 39.776 16.394 1.00 0.00 H TER 2578 MET A 175 HETATM 2579 ZN ZN A 1 10.581 46.103 12.916 1.00 62.11 ZN HETATM 2580 O HOH 2 21.324 41.794 5.285 1.00 74.63 O HETATM 2581 O HOH 3 16.908 37.604 0.403 1.00 59.94 O HETATM 2582 O HOH 4 8.626 22.290 1.402 1.00 46.26 O HETATM 2583 O HOH 5 9.731 22.033 -3.389 1.00 54.51 O HETATM 2584 O HOH 6 17.230 34.014 0.305 1.00 24.91 O HETATM 2585 O HOH 7 16.041 31.765 -0.059 1.00 35.67 O HETATM 2586 O HOH 8 20.149 30.568 1.745 1.00 39.74 O HETATM 2587 O HOH 9 10.269 23.629 -0.097 1.00 53.74 O HETATM 2588 O HOH 10 -8.084 13.197 4.568 1.00 65.68 O HETATM 2589 O HOH 11 15.402 17.894 3.402 1.00 24.93 O HETATM 2590 O HOH 12 5.631 7.430 8.770 1.00 55.76 O HETATM 2591 O HOH 13 12.331 13.392 7.488 1.00 34.11 O HETATM 2592 O HOH 14 7.487 10.943 6.406 1.00 27.40 O HETATM 2593 O HOH 15 7.996 8.978 10.401 1.00 66.20 O HETATM 2594 O HOH 16 10.025 30.084 -8.934 1.00 72.56 O HETATM 2595 O HOH 17 -6.515 13.094 6.976 1.00 71.26 O HETATM 2596 O HOH 18 0.665 9.577 14.091 1.00 49.70 O HETATM 2597 O HOH 19 4.003 9.189 12.034 1.00 54.15 O HETATM 2598 O HOH 20 7.206 5.689 13.381 1.00 57.06 O HETATM 2599 O HOH 21 6.364 10.844 13.211 1.00 40.41 O HETATM 2600 O HOH 22 -6.288 26.257 25.627 1.00 69.15 O HETATM 2601 O HOH 23 15.988 17.170 11.373 1.00 50.82 O HETATM 2602 O HOH 24 20.670 22.613 13.274 1.00 61.73 O HETATM 2603 O HOH 25 17.308 31.112 11.842 1.00 68.02 O HETATM 2604 O HOH 26 11.575 27.471 21.860 1.00100.66 O HETATM 2605 O HOH 27 9.288 30.283 22.725 1.00 56.49 O HETATM 2606 O HOH 28 14.962 35.359 18.421 1.00 98.35 O HETATM 2607 O HOH 29 1.572 17.289 0.660 1.00 55.27 O HETATM 2608 O HOH 30 -1.479 18.683 -1.081 1.00 89.57 O HETATM 2609 O HOH 31 -6.596 16.516 5.489 1.00 68.24 O HETATM 2610 O HOH 32 -10.407 24.101 4.876 1.00 75.12 O HETATM 2611 O HOH 33 -10.539 22.424 2.746 1.00 78.98 O HETATM 2612 O HOH 34 -7.567 22.582 3.961 1.00 50.37 O HETATM 2613 O HOH 35 4.587 27.183 -11.157 1.00 67.24 O HETATM 2614 O HOH 36 7.321 32.226 -11.092 1.00 50.04 O HETATM 2615 O HOH 37 4.864 33.068 25.059 1.00 65.72 O HETATM 2616 O HOH 38 2.326 32.766 24.319 1.00 51.74 O HETATM 2617 O HOH 39 -2.684 33.258 -2.603 1.00 59.48 O HETATM 2618 O HOH 40 -15.053 26.998 13.224 1.00 23.00 O HETATM 2619 O HOH 41 -4.555 29.126 0.322 1.00 64.44 O HETATM 2620 O HOH 42 -1.888 33.272 -16.458 1.00 52.32 O HETATM 2621 O HOH 43 -11.553 22.155 9.408 1.00 33.65 O HETATM 2622 O HOH 44 -8.944 21.937 5.984 1.00 72.16 O HETATM 2623 O HOH 45 4.659 46.906 13.160 1.00 59.78 O HETATM 2624 O HOH 46 3.171 17.375 12.014 1.00 33.34 O HETATM 2625 O HOH 47 -2.192 14.482 22.064 1.00 85.40 O HETATM 2626 O HOH 48 -2.272 10.822 21.362 1.00 65.35 O HETATM 2627 O HOH 49 -2.993 20.271 22.686 1.00 38.98 O HETATM 2628 O HOH 50 -4.917 24.657 23.619 1.00 75.27 O HETATM 2629 O HOH 51 -7.373 25.535 23.301 1.00 72.91 O HETATM 2630 O HOH 52 -8.916 28.487 23.090 1.00 75.95 O HETATM 2631 O HOH 53 -9.628 31.238 19.989 1.00 43.15 O HETATM 2632 O HOH 54 -11.160 33.453 19.219 1.00 55.04 O HETATM 2633 O HOH 55 -13.274 38.692 14.200 1.00 73.40 O HETATM 2634 O HOH 56 -13.293 35.055 7.285 1.00 75.71 O HETATM 2635 O HOH 57 -13.167 32.704 15.622 1.00 43.06 O HETATM 2636 O HOH 58 -17.636 33.698 11.225 1.00 51.49 O HETATM 2637 O HOH 59 -10.547 39.835 8.474 1.00 56.68 O HETATM 2638 O HOH 60 15.659 25.166 17.397 1.00 57.16 O HETATM 2639 O HOH 61 11.892 25.074 20.571 1.00 67.51 O HETATM 2640 O HOH 62 9.268 27.986 20.027 1.00 52.81 O HETATM 2641 O HOH 63 12.791 29.542 20.060 1.00 43.91 O HETATM 2642 O HOH 64 13.899 31.930 20.235 1.00 55.28 O HETATM 2643 O HOH 65 14.714 32.665 16.960 1.00 61.41 O HETATM 2644 O HOH 66 12.323 37.731 15.433 1.00 39.16 O HETATM 2645 O HOH 67 7.977 53.284 16.789 1.00 64.16 O HETATM 2646 O HOH 68 7.517 54.170 13.735 1.00 50.11 O HETATM 2647 O HOH 69 4.627 50.574 12.093 1.00 82.27 O HETATM 2648 O HOH 70 15.424 28.721 -1.654 1.00 65.56 O HETATM 2649 O HOH 71 15.991 32.670 -2.428 1.00 65.78 O HETATM 2650 O HOH 72 8.207 42.457 -4.901 1.00 26.03 O HETATM 2651 O HOH 73 10.529 47.068 0.992 1.00 67.72 O HETATM 2652 O HOH 74 9.483 49.780 0.241 1.00 57.55 O HETATM 2653 O HOH 75 4.253 53.535 -0.610 1.00 37.84 O HETATM 2654 O HOH 76 4.599 48.534 9.705 1.00 53.87 O HETATM 2655 O HOH 77 -3.822 52.632 1.704 1.00 67.45 O HETATM 2656 O HOH 78 1.816 30.976 -13.084 1.00 48.15 O HETATM 2657 O HOH 79 5.244 30.216 -10.369 1.00 70.20 O HETATM 2658 O HOH 80 4.747 30.027 -2.881 1.00 35.30 O HETATM 2659 O HOH 81 -1.612 31.308 -0.889 1.00 43.24 O HETATM 2660 O HOH 82 13.897 47.378 11.160 1.00 63.54 O HETATM 2661 O HOH 83 -7.237 39.425 -5.840 1.00 38.18 O HETATM 2662 O HOH 84 -8.915 39.515 -7.670 1.00 67.50 O HETATM 2663 O HOH 85 -4.144 43.486 -8.361 1.00 64.03 O HETATM 2664 O HOH 86 -3.185 35.943 -17.355 1.00 56.68 O HETATM 2665 O HOH 87 -0.634 33.168 -11.969 1.00 68.96 O HETATM 2666 O HOH 88 -5.811 36.418 -11.530 1.00 55.29 O HETATM 2667 O HOH 89 -1.860 40.711 19.932 1.00 67.86 O HETATM 2668 O HOH 90 2.238 44.759 12.409 1.00 61.32 O HETATM 2669 O HOH 91 11.782 45.713 15.186 1.00 28.30 O HETATM 2670 O HOH 92 -13.980 12.276 8.881 1.00 70.47 O HETATM 2671 O HOH 93 20.549 34.294 12.988 1.00 87.48 O HETATM 2672 O HOH 94 -12.582 14.060 10.355 1.00 77.34 O HETATM 2673 O HOH 95 6.357 17.659 -0.084 1.00 86.22 O HETATM 2674 O HOH 96 22.813 32.096 11.459 1.00 77.11 O HETATM 2675 O HOH 97 -10.747 16.163 10.704 1.00 66.10 O HETATM 2676 O HOH 98 7.805 18.211 2.230 1.00 51.52 O HETATM 2677 O HOH 99 10.688 21.520 11.071 1.00 30.39 O HETATM 2678 O HOH 100 18.686 31.205 6.695 1.00 72.88 O HETATM 2679 O HOH 101 20.550 30.734 10.487 1.00 66.97 O HETATM 2680 O HOH 102 21.057 33.138 9.369 1.00 53.88 O HETATM 2681 N GLY A 103 -8.803 14.615 11.173 1.00 0.24 N HETATM 2682 CA GLY A 103 -7.693 14.760 10.163 1.00 0.05 C HETATM 2683 C GLY A 103 -6.772 15.921 10.554 1.00 0.22 C HETATM 2684 O GLY A 103 -7.206 17.070 10.669 1.00 -0.39 O HETATM 2685 N GLY A 103 -5.535 15.640 10.898 1.00 -0.26 N HETATM 2686 CA GLY A 103 -4.607 16.572 11.524 1.00 0.15 C HETATM 2687 CB GLY A 103 -3.670 15.756 12.404 1.00 0.08 C HETATM 2688 OG GLY A 103 -3.930 15.797 13.782 1.00 -0.39 O HETATM 2689 H10 GLY A 103 -3.867 16.694 14.088 1.00 0.21 H HETATM 2690 H8 GLY A 103 -2.647 16.128 12.243 1.00 0.06 H HETATM 2691 H9 GLY A 103 -3.733 14.707 12.081 1.00 0.06 H HETATM 2692 C GLY A 103 -3.686 17.289 10.515 1.00 0.21 C HETATM 2693 O GLY A 103 -3.369 16.671 9.470 1.00 -0.39 O HETATM 2694 N GLY A 103 -3.374 18.569 10.737 1.00 -0.26 N HETATM 2695 CA GLY A 103 -2.512 19.287 9.787 1.00 0.13 C HETATM 2696 CB GLY A 103 -2.455 20.806 9.941 1.00 -0.01 C HETATM 2697 CG2 GLY A 103 -3.832 21.460 9.803 1.00 -0.06 C HETATM 2698 H17 GLY A 103 -4.523 21.017 10.535 1.00 0.02 H HETATM 2699 H18 GLY A 103 -4.217 21.292 8.786 1.00 0.02 H HETATM 2700 H19 GLY A 103 -3.745 22.541 9.989 1.00 0.02 H HETATM 2701 CG1 GLY A 103 -1.514 21.439 8.914 1.00 -0.06 C HETATM 2702 H14 GLY A 103 -1.498 22.530 9.055 1.00 0.02 H HETATM 2703 H15 GLY A 103 -1.868 21.205 7.899 1.00 0.02 H HETATM 2704 H16 GLY A 103 -0.499 21.037 9.050 1.00 0.02 H HETATM 2705 H13 GLY A 103 -2.069 21.025 10.948 1.00 0.03 H HETATM 2706 C GLY A 103 -1.094 18.728 9.973 1.00 0.20 C HETATM 2707 O GLY A 103 -0.740 18.345 11.083 1.00 -0.39 O HETATM 2708 N GLY A 103 -0.273 18.651 8.930 1.00 -0.26 N HETATM 2709 CA GLY A 103 1.044 18.004 9.085 1.00 0.13 C HETATM 2710 CB GLY A 103 1.124 16.695 8.273 1.00 -0.01 C HETATM 2711 CG2 GLY A 103 -0.151 15.859 8.441 1.00 -0.06 C HETATM 2712 H26 GLY A 103 -1.024 16.457 8.141 1.00 0.02 H HETATM 2713 H27 GLY A 103 -0.257 15.559 9.494 1.00 0.02 H HETATM 2714 H28 GLY A 103 -0.087 14.961 7.808 1.00 0.02 H HETATM 2715 CG1 GLY A 103 2.367 15.913 8.675 1.00 -0.06 C HETATM 2716 H23 GLY A 103 2.418 14.981 8.093 1.00 0.02 H HETATM 2717 H24 GLY A 103 2.318 15.673 9.747 1.00 0.02 H HETATM 2718 H25 GLY A 103 3.263 16.520 8.475 1.00 0.02 H HETATM 2719 H22 GLY A 103 1.216 16.957 7.209 1.00 0.03 H HETATM 2720 C GLY A 103 2.204 18.880 8.636 1.00 0.20 C HETATM 2721 O GLY A 103 2.229 19.506 7.573 1.00 -0.39 O HETATM 2722 N GLY A 103 3.195 19.008 9.507 1.00 -0.26 N HETATM 2723 CA GLY A 103 4.453 19.654 9.148 1.00 0.13 C HETATM 2724 CB GLY A 103 5.321 19.870 10.410 1.00 -0.00 C HETATM 2725 CG2 GLY A 103 6.694 20.356 10.063 1.00 -0.06 C HETATM 2726 H34 GLY A 103 7.194 19.615 9.422 1.00 0.02 H HETATM 2727 H35 GLY A 103 7.277 20.497 10.985 1.00 0.02 H HETATM 2728 H36 GLY A 103 6.619 21.314 9.527 1.00 0.02 H HETATM 2729 CG1 GLY A 103 4.592 20.897 11.314 1.00 -0.05 C HETATM 2730 CD1 GLY A 103 5.428 21.225 12.558 1.00 -0.06 C HETATM 2731 H37 GLY A 103 4.889 21.954 13.180 1.00 0.02 H HETATM 2732 H38 GLY A 103 6.394 21.651 12.249 1.00 0.02 H HETATM 2733 H39 GLY A 103 5.601 20.306 13.137 1.00 0.02 H HETATM 2734 H32 GLY A 103 3.626 20.476 11.630 1.00 0.03 H HETATM 2735 H33 GLY A 103 4.420 21.821 10.742 1.00 0.03 H HETATM 2736 H31 GLY A 103 5.415 18.915 10.948 1.00 0.03 H HETATM 2737 C GLY A 103 5.196 18.821 8.124 1.00 0.20 C HETATM 2738 O GLY A 103 5.840 17.857 8.528 1.00 -0.39 O HETATM 2739 N GLY A 103 5.150 19.150 6.841 1.00 -0.26 N HETATM 2740 CA GLY A 103 5.881 18.420 5.815 1.00 0.13 C HETATM 2741 CB GLY A 103 5.145 18.341 4.450 1.00 -0.01 C HETATM 2742 CG2 GLY A 103 5.074 19.649 3.719 1.00 -0.06 C HETATM 2743 H46 GLY A 103 6.092 20.021 3.533 1.00 0.02 H HETATM 2744 H47 GLY A 103 4.522 20.380 4.328 1.00 0.02 H HETATM 2745 H48 GLY A 103 4.555 19.505 2.760 1.00 0.02 H HETATM 2746 CG1 GLY A 103 3.734 17.823 4.709 1.00 -0.06 C HETATM 2747 H43 GLY A 103 3.187 17.756 3.757 1.00 0.02 H HETATM 2748 H44 GLY A 103 3.209 18.513 5.386 1.00 0.02 H HETATM 2749 H45 GLY A 103 3.788 16.826 5.171 1.00 0.02 H HETATM 2750 H42 GLY A 103 5.681 17.624 3.810 1.00 0.03 H HETATM 2751 C GLY A 103 7.246 19.007 5.498 1.00 0.20 C HETATM 2752 O GLY A 103 7.930 18.490 4.623 1.00 -0.39 O HETATM 2753 N GLY A 103 7.670 20.072 6.162 1.00 -0.27 N HETATM 2754 CA GLY A 103 8.998 20.624 5.928 1.00 0.12 C HETATM 2755 C GLY A 103 9.123 21.968 6.632 1.00 0.20 C HETATM 2756 O GLY A 103 8.136 22.363 7.207 1.00 -0.39 O HETATM 2757 N GLY A 103 10.228 22.683 6.506 1.00 -0.26 N HETATM 2758 CA GLY A 103 10.467 23.909 7.233 1.00 0.13 C HETATM 2759 CB GLY A 103 11.025 23.649 8.619 1.00 -0.01 C HETATM 2760 CG GLY A 103 12.537 23.406 8.700 1.00 -0.02 C HETATM 2761 CD GLY A 103 12.820 21.963 8.308 1.00 0.06 C HETATM 2762 NE GLY A 103 13.997 21.449 8.975 1.00 -0.27 N HETATM 2763 CZ GLY A 103 14.182 20.803 10.111 1.00 0.29 C HETATM 2764 NH2 GLY A 103 15.465 20.514 10.346 1.00 -0.28 N HETATM 2765 H63 GLY A 103 16.189 20.798 9.670 1.00 0.26 H HETATM 2766 H64 GLY A 103 15.730 20.008 11.203 1.00 0.26 H HETATM 2767 NH1 GLY A 103 13.216 20.452 10.963 1.00 -0.28 N HETATM 2768 H61 GLY A 103 13.452 19.948 11.830 1.00 0.26 H HETATM 2769 H62 GLY A 103 12.235 20.685 10.754 1.00 0.26 H HETATM 2770 H60 GLY A 103 14.870 21.623 8.457 1.00 0.26 H HETATM 2771 H58 GLY A 103 12.976 21.913 7.220 1.00 0.07 H HETATM 2772 H59 GLY A 103 11.954 21.342 8.583 1.00 0.07 H HETATM 2773 H56 GLY A 103 12.886 23.586 9.727 1.00 0.03 H HETATM 2774 H57 GLY A 103 13.059 24.086 8.011 1.00 0.03 H HETATM 2775 H54 GLY A 103 10.519 22.760 9.024 1.00 0.03 H HETATM 2776 H55 GLY A 103 10.790 24.522 9.246 1.00 0.03 H HETATM 2777 C GLY A 103 11.399 24.872 6.484 1.00 0.20 C HETATM 2778 O GLY A 103 12.150 24.546 5.569 1.00 -0.39 O HETATM 2779 N GLY A 103 11.311 26.134 6.892 1.00 -0.26 N HETATM 2780 CA GLY A 103 12.061 27.228 6.299 1.00 0.13 C HETATM 2781 CB GLY A 103 11.227 28.281 5.547 1.00 -0.00 C HETATM 2782 CG2 GLY A 103 12.135 29.447 5.168 1.00 -0.06 C HETATM 2783 H70 GLY A 103 12.562 29.890 6.080 1.00 0.02 H HETATM 2784 H71 GLY A 103 11.550 30.207 4.630 1.00 0.02 H HETATM 2785 H72 GLY A 103 12.947 29.084 4.521 1.00 0.02 H HETATM 2786 CG1 GLY A 103 10.626 27.656 4.277 1.00 -0.05 C HETATM 2787 CD1 GLY A 103 9.339 28.337 3.864 1.00 -0.06 C HETATM 2788 H73 GLY A 103 8.947 27.859 2.954 1.00 0.02 H HETATM 2789 H74 GLY A 103 9.535 29.401 3.663 1.00 0.02 H HETATM 2790 H75 GLY A 103 8.600 28.247 4.674 1.00 0.02 H HETATM 2791 H68 GLY A 103 10.419 26.593 4.468 1.00 0.03 H HETATM 2792 H69 GLY A 103 11.354 27.747 3.458 1.00 0.03 H HETATM 2793 H67 GLY A 103 10.415 28.641 6.196 1.00 0.03 H HETATM 2794 C GLY A 103 12.888 27.926 7.377 1.00 0.20 C HETATM 2795 O GLY A 103 12.390 28.374 8.399 1.00 -0.39 O HETATM 2796 N GLY A 103 14.196 27.867 7.162 1.00 -0.26 N HETATM 2797 CA GLY A 103 15.167 28.442 8.084 1.00 0.13 C HETATM 2798 CB GLY A 103 16.443 27.579 8.107 1.00 -0.00 C HETATM 2799 CG2 GLY A 103 17.487 28.189 9.033 1.00 -0.06 C HETATM 2800 H81 GLY A 103 17.710 29.216 8.708 1.00 0.02 H HETATM 2801 H82 GLY A 103 18.406 27.585 8.998 1.00 0.02 H HETATM 2802 H83 GLY A 103 17.099 28.206 10.062 1.00 0.02 H HETATM 2803 CG1 GLY A 103 16.060 26.140 8.476 1.00 -0.05 C HETATM 2804 CD1 GLY A 103 15.314 26.048 9.782 1.00 -0.06 C HETATM 2805 H84 GLY A 103 15.068 24.996 9.991 1.00 0.02 H HETATM 2806 H85 GLY A 103 14.386 26.635 9.716 1.00 0.02 H HETATM 2807 H86 GLY A 103 15.943 26.445 10.592 1.00 0.02 H HETATM 2808 H79 GLY A 103 16.979 25.541 8.554 1.00 0.03 H HETATM 2809 H80 GLY A 103 15.423 25.731 7.678 1.00 0.03 H HETATM 2810 H78 GLY A 103 16.870 27.564 7.093 1.00 0.03 H HETATM 2811 C GLY A 103 15.559 29.872 7.707 1.00 0.20 C HETATM 2812 O GLY A 103 15.954 30.239 6.592 1.00 -0.39 O HETATM 2813 N GLY A 103 15.434 30.754 8.694 1.00 -0.26 N HETATM 2814 CA GLY A 103 15.601 32.184 8.478 1.00 0.13 C HETATM 2815 CB GLY A 103 14.489 32.987 9.153 1.00 -0.01 C HETATM 2816 CG GLY A 103 13.617 33.850 8.243 1.00 -0.04 C HETATM 2817 CD1 GLY A 103 13.260 33.172 6.933 1.00 -0.06 C HETATM 2818 H92 GLY A 103 12.634 33.846 6.330 1.00 0.02 H HETATM 2819 H93 GLY A 103 12.706 32.244 7.139 1.00 0.02 H HETATM 2820 H94 GLY A 103 14.181 32.934 6.380 1.00 0.02 H HETATM 2821 CD2 GLY A 103 12.352 34.239 8.998 1.00 -0.06 C HETATM 2822 H95 GLY A 103 12.626 34.729 9.944 1.00 0.02 H HETATM 2823 H96 GLY A 103 11.759 33.337 9.210 1.00 0.02 H HETATM 2824 H97 GLY A 103 11.758 34.932 8.385 1.00 0.02 H HETATM 2825 H91 GLY A 103 14.178 34.765 8.004 1.00 0.03 H HETATM 2826 H89 GLY A 103 14.960 33.652 9.892 1.00 0.03 H HETATM 2827 H90 GLY A 103 13.829 32.274 9.669 1.00 0.03 H HETATM 2828 C GLY A 103 16.939 32.772 8.912 1.00 0.20 C HETATM 2829 O GLY A 103 17.602 32.452 9.892 1.00 -0.39 O HETATM 2830 N GLY A 103 17.338 33.751 8.104 1.00 -0.26 N HETATM 2831 CA GLY A 103 18.714 34.236 8.100 1.00 0.17 C HETATM 2832 CB GLY A 103 19.451 33.734 6.857 1.00 0.09 C HETATM 2833 OG GLY A 103 20.843 33.926 6.983 1.00 -0.39 O HETATM 2834 H102 GLY A 103 21.160 33.448 7.740 1.00 0.21 H HETATM 2835 H100 GLY A 103 19.090 34.286 5.977 1.00 0.06 H HETATM 2836 H101 GLY A 103 19.246 32.661 6.726 1.00 0.06 H HETATM 2837 C GLY A 103 18.809 35.761 8.109 1.00 0.26 C HETATM 2838 O GLY A 103 18.415 36.339 7.070 1.00 -0.37 O HETATM 2839 O1 GLY A 103 19.281 36.433 9.155 1.00 -0.29 O HETATM 2840 H103 GLY A 103 18.610 37.021 9.481 1.00 0.25 H HETATM 2841 H99 GLY A 103 19.216 33.848 8.999 1.00 0.08 H HETATM 2842 H98 GLY A 103 16.675 34.167 7.481 1.00 0.19 H HETATM 2843 H88 GLY A 103 15.519 32.343 7.393 1.00 0.08 H HETATM 2844 H87 GLY A 103 15.219 30.425 9.613 1.00 0.19 H HETATM 2845 H77 GLY A 103 14.722 28.454 9.090 1.00 0.08 H HETATM 2846 H76 GLY A 103 14.528 27.411 6.336 1.00 0.19 H HETATM 2847 H66 GLY A 103 12.752 26.783 5.568 1.00 0.08 H HETATM 2848 H65 GLY A 103 10.693 26.342 7.650 1.00 0.19 H HETATM 2849 H53 GLY A 103 9.495 24.410 7.351 1.00 0.08 H HETATM 2850 H52 GLY A 103 10.934 22.359 5.876 1.00 0.19 H HETATM 2851 H50 GLY A 103 9.153 20.761 4.848 1.00 0.08 H HETATM 2852 H51 GLY A 103 9.757 19.932 6.322 1.00 0.08 H HETATM 2853 H49 GLY A 103 7.069 20.504 6.835 1.00 0.19 H HETATM 2854 H41 GLY A 103 6.022 17.397 6.194 1.00 0.08 H HETATM 2855 H40 GLY A 103 4.590 19.932 6.566 1.00 0.19 H HETATM 2856 H30 GLY A 103 4.230 20.636 8.705 1.00 0.08 H HETATM 2857 H29 GLY A 103 3.077 18.653 10.434 1.00 0.19 H HETATM 2858 H21 GLY A 103 1.177 17.770 10.152 1.00 0.08 H HETATM 2859 H20 GLY A 103 -0.546 19.029 8.046 1.00 0.19 H HETATM 2860 H12 GLY A 103 -2.867 19.066 8.770 1.00 0.08 H HETATM 2861 H11 GLY A 103 -3.726 19.038 11.547 1.00 0.19 H HETATM 2862 H7 GLY A 103 -5.168 17.311 12.115 1.00 0.08 H HETATM 2863 H6 GLY A 103 -5.205 14.714 10.716 1.00 0.19 H HETATM 2864 H4 GLY A 103 -8.127 14.958 9.172 1.00 0.11 H HETATM 2865 H5 GLY A 103 -7.109 13.829 10.128 1.00 0.11 H HETATM 2866 H1 GLY A 103 -9.402 13.849 10.906 1.00 0.20 H HETATM 2867 H2 GLY A 103 -9.341 15.467 11.206 1.00 0.20 H HETATM 2868 H3 GLY A 103 -8.408 14.432 12.082 1.00 0.20 H CONECT 1 2 10 11 12 CONECT 10 1 CONECT 11 1 CONECT 12 1 CONECT 1410 1409 1414 2579 CONECT 1435 1434 1439 2579 CONECT 2132 2131 2136 2579 CONECT 2579 1410 1435 2132 CONECT 2681 2682 2866 2867 2868 CONECT 2682 2681 2683 2864 2865 CONECT 2683 2682 2684 2685 CONECT 2684 2683 CONECT 2685 2683 2686 2863 CONECT 2686 2685 2687 2692 2862 CONECT 2687 2686 2688 2690 2691 CONECT 2688 2687 2689 CONECT 2689 2688 CONECT 2690 2687 CONECT 2691 2687 CONECT 2692 2686 2693 2694 CONECT 2693 2692 CONECT 2694 2692 2695 2861 CONECT 2695 2694 2696 2706 2860 CONECT 2696 2695 2697 2701 2705 CONECT 2697 2696 2698 2699 2700 CONECT 2698 2697 CONECT 2699 2697 CONECT 2700 2697 CONECT 2701 2696 2702 2703 2704 CONECT 2702 2701 CONECT 2703 2701 CONECT 2704 2701 CONECT 2705 2696 CONECT 2706 2695 2707 2708 CONECT 2707 2706 CONECT 2708 2706 2709 2859 CONECT 2709 2708 2710 2720 2858 CONECT 2710 2709 2711 2715 2719 CONECT 2711 2710 2712 2713 2714 CONECT 2712 2711 CONECT 2713 2711 CONECT 2714 2711 CONECT 2715 2710 2716 2717 2718 CONECT 2716 2715 CONECT 2717 2715 CONECT 2718 2715 CONECT 2719 2710 CONECT 2720 2709 2721 2722 CONECT 2721 2720 CONECT 2722 2720 2723 2857 CONECT 2723 2722 2724 2737 2856 CONECT 2724 2723 2725 2729 2736 CONECT 2725 2724 2726 2727 2728 CONECT 2726 2725 CONECT 2727 2725 CONECT 2728 2725 CONECT 2729 2724 2730 2734 2735 CONECT 2730 2729 2731 2732 2733 CONECT 2731 2730 CONECT 2732 2730 CONECT 2733 2730 CONECT 2734 2729 CONECT 2735 2729 CONECT 2736 2724 CONECT 2737 2723 2738 2739 CONECT 2738 2737 CONECT 2739 2737 2740 2855 CONECT 2740 2739 2741 2751 2854 CONECT 2741 2740 2742 2746 2750 CONECT 2742 2741 2743 2744 2745 CONECT 2743 2742 CONECT 2744 2742 CONECT 2745 2742 CONECT 2746 2741 2747 2748 2749 CONECT 2747 2746 CONECT 2748 2746 CONECT 2749 2746 CONECT 2750 2741 CONECT 2751 2740 2752 2753 CONECT 2752 2751 CONECT 2753 2751 2754 2853 CONECT 2754 2753 2755 2851 2852 CONECT 2755 2754 2756 2757 CONECT 2756 2755 CONECT 2757 2755 2758 2850 CONECT 2758 2757 2759 2777 2849 CONECT 2759 2758 2760 2775 2776 CONECT 2760 2759 2761 2773 2774 CONECT 2761 2760 2762 2771 2772 CONECT 2762 2761 2763 2770 CONECT 2763 2762 2764 2767 CONECT 2764 2763 2765 2766 CONECT 2765 2764 CONECT 2766 2764 CONECT 2767 2763 2768 2769 CONECT 2768 2767 CONECT 2769 2767 CONECT 2770 2762 CONECT 2771 2761 CONECT 2772 2761 CONECT 2773 2760 CONECT 2774 2760 CONECT 2775 2759 CONECT 2776 2759 CONECT 2777 2758 2778 2779 CONECT 2778 2777 CONECT 2779 2777 2780 2848 CONECT 2780 2779 2781 2794 2847 CONECT 2781 2780 2782 2786 2793 CONECT 2782 2781 2783 2784 2785 CONECT 2783 2782 CONECT 2784 2782 CONECT 2785 2782 CONECT 2786 2781 2787 2791 2792 CONECT 2787 2786 2788 2789 2790 CONECT 2788 2787 CONECT 2789 2787 CONECT 2790 2787 CONECT 2791 2786 CONECT 2792 2786 CONECT 2793 2781 CONECT 2794 2780 2795 2796 CONECT 2795 2794 CONECT 2796 2794 2797 2846 CONECT 2797 2796 2798 2811 2845 CONECT 2798 2797 2799 2803 2810 CONECT 2799 2798 2800 2801 2802 CONECT 2800 2799 CONECT 2801 2799 CONECT 2802 2799 CONECT 2803 2798 2804 2808 2809 CONECT 2804 2803 2805 2806 2807 CONECT 2805 2804 CONECT 2806 2804 CONECT 2807 2804 CONECT 2808 2803 CONECT 2809 2803 CONECT 2810 2798 CONECT 2811 2797 2812 2813 CONECT 2812 2811 CONECT 2813 2811 2814 2844 CONECT 2814 2813 2815 2828 2843 CONECT 2815 2814 2816 2826 2827 CONECT 2816 2815 2817 2821 2825 CONECT 2817 2816 2818 2819 2820 CONECT 2818 2817 CONECT 2819 2817 CONECT 2820 2817 CONECT 2821 2816 2822 2823 2824 CONECT 2822 2821 CONECT 2823 2821 CONECT 2824 2821 CONECT 2825 2816 CONECT 2826 2815 CONECT 2827 2815 CONECT 2828 2814 2829 2830 CONECT 2829 2828 CONECT 2830 2828 2831 2842 CONECT 2831 2830 2832 2837 2841 CONECT 2832 2831 2833 2835 2836 CONECT 2833 2832 2834 CONECT 2834 2833 CONECT 2835 2832 CONECT 2836 2832 CONECT 2837 2831 2838 2839 CONECT 2838 2837 CONECT 2839 2837 2840 CONECT 2840 2839 CONECT 2841 2831 CONECT 2842 2830 CONECT 2843 2814 CONECT 2844 2813 CONECT 2845 2797 CONECT 2846 2796 CONECT 2847 2780 CONECT 2848 2779 CONECT 2849 2758 CONECT 2850 2757 CONECT 2851 2754 CONECT 2852 2754 CONECT 2853 2753 CONECT 2854 2740 CONECT 2855 2739 CONECT 2856 2723 CONECT 2857 2722 CONECT 2858 2709 CONECT 2859 2708 CONECT 2860 2695 CONECT 2861 2694 CONECT 2862 2686 CONECT 2863 2685 CONECT 2864 2682 CONECT 2865 2682 CONECT 2866 2681 CONECT 2867 2681 CONECT 2868 2681 MASTER 0 0 0 0 0 0 0 0 2867 1 196 14 END
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Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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PDBbind
16aa, >3OYP_2|Chains... at 100%
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PDBbind
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PDBbind
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
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16-mer
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PDBbind
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PDBbind
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PDBbind
16-mer
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PDBbind
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RCSB PDB
PDBbind
16-mer
2k3w
RCSB PDB
PDBbind
16-mer
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PDBbind
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PDBbind
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PDBbind
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RCSB PDB
PDBbind
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16-mer
2mps
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PDBbind
16-mer
2n1g
RCSB PDB
PDBbind
16-mer
3eht
RCSB PDB
PDBbind
16-mer
3g5v
RCSB PDB
PDBbind
16-mer
3g5y
RCSB PDB
PDBbind
16-mer
3g7l
RCSB PDB
PDBbind
16-mer
3k48
RCSB PDB
PDBbind
16-mer
3nfl
RCSB PDB
PDBbind
16-mer
3oe0
RCSB PDB
PDBbind
16-mer
3tdu
RCSB PDB
PDBbind
16-mer
3twr
RCSB PDB
PDBbind
16-mer
3tws
RCSB PDB
PDBbind
16-mer
3twu
RCSB PDB
PDBbind
16-mer
3twv
RCSB PDB
PDBbind
16-mer
3tww
RCSB PDB
PDBbind
16-mer
3twx
RCSB PDB
PDBbind
16-mer
3v3b
RCSB PDB
PDBbind
16-mer
3zqi
RCSB PDB
PDBbind
16-mer
4a2a
RCSB PDB
PDBbind
16-mer
4a7j
RCSB PDB
PDBbind
16-mer
4edu
RCSB PDB
PDBbind
16-mer
4hs6
RCSB PDB
PDBbind
16-mer
4hs8
RCSB PDB
PDBbind
16-mer
4is6
RCSB PDB
PDBbind
16-mer
4j8r
RCSB PDB
PDBbind
16-mer
4l3o
RCSB PDB
PDBbind
16-mer
4nuf
RCSB PDB
PDBbind
16-mer
4odk
RCSB PDB
PDBbind
16-mer
4odl
RCSB PDB
PDBbind
16-mer
4odm
RCSB PDB
PDBbind
16-mer
4odp
RCSB PDB
PDBbind
16-mer
4odq
RCSB PDB
PDBbind
16-mer
4pz5
RCSB PDB
PDBbind
16-mer
4qq4
RCSB PDB
PDBbind
16-mer
4tzm
RCSB PDB
PDBbind
16-mer
4tzn
RCSB PDB
PDBbind
16-mer
4u2w
RCSB PDB
PDBbind
16-mer
4ud7
RCSB PDB
PDBbind
16-mer
4ue1
RCSB PDB
PDBbind
16-mer
4wci
RCSB PDB
PDBbind
16-mer
4wy7
RCSB PDB
PDBbind
16-mer
4yhp
RCSB PDB
PDBbind
16-mer
4zdu
RCSB PDB
PDBbind
16-mer
5eta
RCSB PDB
PDBbind
16-mer
5hhx
RCSB PDB
PDBbind
16-mer
5iay
RCSB PDB
PDBbind
16-mer
5icx
RCSB PDB
PDBbind
16-mer
5iy4
RCSB PDB
PDBbind
16-mer
5klr
RCSB PDB
PDBbind
16-mer
5klt
RCSB PDB
PDBbind
16-mer
5lvf
RCSB PDB
PDBbind
16-mer
5ly3
RCSB PDB
PDBbind
16-mer
5m9d
RCSB PDB
PDBbind
16-mer
5myk
RCSB PDB
PDBbind
16-mer
5myx
RCSB PDB
PDBbind
16-mer
5nin
RCSB PDB
PDBbind
16-mer
5njx
RCSB PDB
PDBbind
16-mer
5o4y
RCSB PDB
PDBbind
16-mer
5u2j
RCSB PDB
PDBbind
16-mer
5v1y
RCSB PDB
PDBbind
16-mer
5v6y
RCSB PDB
PDBbind
16-mer
5wa4
RCSB PDB
PDBbind
16-mer
5wbl
RCSB PDB
PDBbind
16-mer
5wqd
RCSB PDB
PDBbind
16-mer
5y7w
RCSB PDB
PDBbind
16-mer
6bhi
RCSB PDB
PDBbind
16-mer
6g84
RCSB PDB
PDBbind
16-mer
6g85
RCSB PDB
PDBbind
16-mer
6g86
RCSB PDB
PDBbind
16-mer
6h0b
RCSB PDB
PDBbind
16-mer
6qsz
RCSB PDB
PDBbind
16-mer
6pi7
RCSB PDB
PDBbind
16-mer
6me1
RCSB PDB
PDBbind
16-mer
6d08
RCSB PDB
PDBbind
16-mer
6d07
RCSB PDB
PDBbind
16-mer
5zml
RCSB PDB
PDBbind
16-mer
5w4e
RCSB PDB
PDBbind
16-mer
6tyz
RCSB PDB
PDBbind
16-mer
Entry Information
PDB ID
1dxp
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
HCV NS3 protease
Ligand Name
16-mer
EC.Number
E.C.3.4.22.-
Resolution
2.4(Å)
Affinity (Kd/Ki/IC50)
Ki=27nM
Release Year
2001
Protein/NA Sequence
Check fasta file
Primary Reference
(2000) J.Biol.Chem. Vol. 275: pp. 7152
Ligand Properties
Formula
C
5
5
H
1
0
3
N
1
5
O
1
5
Molecular Weight
1214.500
Exact Mass
1213.780
No. of atoms
188
No. of bonds
187
Polar Surface Area
491.51
LOGP Value
0.40 (
Computed with XLOGP3
)
-0.75 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 15
No. of Hydrogen Bond Acceptors: 15
No. of Rotatable Bonds: 54
No. of Nitrogen and Oxygen Atoms: 30
No. of Rings: 0
Canonical SMILES
CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(C)C)[C@H](CC)C)[C@H](CC)C)CCC[NH+]=C(N)N)C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)C[NH3+])CO)C
InChI String
InChI=1S/C55H101N15O15/c1-15-30(12)42(51(81)63-34(21-26(4)5)46(76)64-36(25-72)54(84)85)70-53(83)43(31(13)16-2)68-45(75)33(19-18-20-59-55(57)58)61-38(74)23-60-48(78)39(27(6)7)66-52(82)44(32(14)17-3)69-50(80)41(29(10)11)67-49(79)40(28(8)9)65-47(77)35(24-71)62-37(73)22-56/h26-36,39-44,71-72H,15-25,56H2,1-14H3,(H,60,78)(H,61,74)(H,62,73)(H,63,81)(H,64,76)(H,65,77)(H,66,82)(H,67,79)(H,68,75)(H,69,80)(H,70,83)(H,84,85)(H4,57,58,59)/p+2/t30-,31-,32-,33-,34-,35-,36-,39-,40-,41-,42-,43-,44-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P26662
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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