Browse entries in the PDBbind-CN Database
HEADER 3F8C_COMPLEX COMPND 3F8C_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 68 GLU ILE PRO LYS GLU MET LEU ARG ALA GLN THR ASN VAL SEQRES 2 A 68 ILE LEU LEU ASN VAL LEU LYS GLN GLY ASP ASN TYR VAL SEQRES 3 A 68 TYR GLY ILE ILE LYS GLN VAL LYS GLU ALA SER ASN GLY SEQRES 4 A 68 GLU MET GLU LEU ASN GLU ALA THR LEU TYR THR ILE PHE SEQRES 5 A 68 LYS ARG LEU GLU LYS ASP GLY ILE ILE SER SER TYR TRP SEQRES 6 A 68 GLY ASP GLU SEQRES 1 A 35 GLY ARG ARG LYS TYR TYR ARG LEU THR GLU ILE GLY HIS SEQRES 2 A 35 GLU ASN MET ARG LEU ALA PHE GLU SER TRP SER ARG VAL SEQRES 3 A 35 ASP LYS ILE ILE GLU ASN LEU GLU ALA SEQRES 1 B 68 GLU ILE PRO LYS GLU MET LEU ARG ALA GLN THR ASN VAL SEQRES 2 B 68 ILE LEU LEU ASN VAL LEU LYS GLN GLY ASP ASN TYR VAL SEQRES 3 B 68 TYR GLY ILE ILE LYS GLN VAL LYS GLU ALA SER ASN GLY SEQRES 4 B 68 GLU MET GLU LEU ASN GLU ALA THR LEU TYR THR ILE PHE SEQRES 5 B 68 LYS ARG LEU GLU LYS ASP GLY ILE ILE SER SER TYR TRP SEQRES 6 B 68 GLY ASP GLU SEQRES 1 B 35 GLY ARG ARG LYS TYR TYR ARG LEU THR GLU ILE GLY HIS SEQRES 2 B 35 GLU ASN MET ARG LEU ALA PHE GLU SER TRP SER ARG VAL SEQRES 3 B 35 ASP LYS ILE ILE GLU ASN LEU GLU ALA HET HT A 1 63 ATOM 1 N GLU A 3 5.644 -15.494 3.306 1.00 32.06 N ATOM 2 CA GLU A 3 4.284 -15.526 3.915 1.00 25.59 C ATOM 3 C GLU A 3 3.464 -14.295 3.521 1.00 25.62 C ATOM 4 O GLU A 3 2.697 -13.769 4.332 1.00 25.90 O ATOM 5 CB GLU A 3 4.383 -15.617 5.436 1.00 23.54 C ATOM 6 CG GLU A 3 5.439 -16.568 5.933 1.00 20.09 C ATOM 7 CD GLU A 3 5.818 -16.299 7.372 1.00 23.24 C ATOM 8 OE1 GLU A 3 5.972 -15.111 7.725 1.00 21.59 O ATOM 9 OE2 GLU A 3 5.965 -17.273 8.154 1.00 25.45 O ATOM 10 HA GLU A 3 3.774 -16.411 3.534 1.00 0.00 H ATOM 11 HB2 GLU A 3 4.608 -14.623 5.824 1.00 0.00 H ATOM 12 HB3 GLU A 3 3.418 -15.946 5.822 1.00 0.00 H ATOM 13 HG2 GLU A 3 5.060 -17.587 5.854 1.00 0.00 H ATOM 14 HG3 GLU A 3 6.327 -16.463 5.310 1.00 0.00 H ATOM 15 HN3 GLU A 3 6.148 -14.644 3.631 1.00 0.00 H ATOM 16 HN2 GLU A 3 5.558 -15.473 2.270 1.00 0.00 H ATOM 17 HN1 GLU A 3 6.172 -16.343 3.594 1.00 0.00 H ATOM 18 N ILE A 4 3.654 -13.819 2.287 1.00 21.37 N ATOM 19 CA ILE A 4 2.749 -12.823 1.704 1.00 21.77 C ATOM 20 C ILE A 4 1.536 -13.533 1.098 1.00 19.49 C ATOM 21 O ILE A 4 1.689 -14.433 0.265 1.00 15.12 O ATOM 22 CB ILE A 4 3.445 -11.958 0.606 1.00 21.20 C ATOM 23 CG1 ILE A 4 4.573 -11.128 1.212 1.00 25.84 C ATOM 24 CG2 ILE A 4 2.443 -11.045 -0.074 1.00 18.79 C ATOM 25 CD1 ILE A 4 5.200 -10.163 0.253 1.00 29.77 C ATOM 26 HA ILE A 4 2.441 -12.151 2.505 1.00 0.00 H ATOM 27 HB ILE A 4 3.865 -12.634 -0.139 1.00 0.00 H ATOM 28 HG12 ILE A 4 4.170 -10.564 2.053 1.00 0.00 H ATOM 29 HG13 ILE A 4 5.346 -11.808 1.569 1.00 0.00 H ATOM 30 HD11 ILE A 4 5.620 -10.712 -0.590 1.00 0.00 H ATOM 31 HD12 ILE A 4 4.443 -9.466 -0.106 1.00 0.00 H ATOM 32 HD13 ILE A 4 5.992 -9.612 0.760 1.00 0.00 H ATOM 33 HG21 ILE A 4 1.664 -11.647 -0.541 1.00 0.00 H ATOM 34 HG22 ILE A 4 1.997 -10.382 0.667 1.00 0.00 H ATOM 35 HG23 ILE A 4 2.951 -10.452 -0.835 1.00 0.00 H ATOM 36 H ILE A 4 4.461 -14.162 1.728 1.00 0.00 H ATOM 37 N PRO A 5 0.325 -13.155 1.545 1.00 20.92 N ATOM 38 CA PRO A 5 -0.905 -13.788 1.067 1.00 22.03 C ATOM 39 C PRO A 5 -1.026 -13.742 -0.456 1.00 19.23 C ATOM 40 O PRO A 5 -0.689 -12.728 -1.082 1.00 19.81 O ATOM 41 CB PRO A 5 -2.005 -12.947 1.722 1.00 24.31 C ATOM 42 CG PRO A 5 -1.375 -12.456 2.994 1.00 22.66 C ATOM 43 CD PRO A 5 0.065 -12.190 2.634 1.00 23.50 C ATOM 44 HA PRO A 5 -0.950 -14.847 1.321 1.00 0.00 H ATOM 45 HD3 PRO A 5 0.199 -11.165 2.289 1.00 0.00 H ATOM 46 HD2 PRO A 5 0.721 -12.374 3.485 1.00 0.00 H ATOM 47 HG3 PRO A 5 -1.442 -13.215 3.774 1.00 0.00 H ATOM 48 HG2 PRO A 5 -1.861 -11.542 3.335 1.00 0.00 H ATOM 49 HB2 PRO A 5 -2.288 -12.112 1.082 1.00 0.00 H ATOM 50 HB3 PRO A 5 -2.884 -13.555 1.934 1.00 0.00 H ATOM 51 N LYS A 6 -1.509 -14.839 -1.037 1.00 17.02 N ATOM 52 CA LYS A 6 -1.658 -14.956 -2.479 1.00 18.21 C ATOM 53 C LYS A 6 -2.536 -13.832 -3.031 1.00 13.23 C ATOM 54 O LYS A 6 -2.315 -13.346 -4.141 1.00 19.51 O ATOM 55 CB LYS A 6 -2.247 -16.320 -2.830 1.00 21.61 C ATOM 56 CG LYS A 6 -1.971 -16.789 -4.258 1.00 28.45 C ATOM 57 CD LYS A 6 -2.398 -18.262 -4.434 1.00 26.89 C ATOM 58 CE LYS A 6 -3.891 -18.439 -4.146 1.00 23.74 C ATOM 59 NZ LYS A 6 -4.208 -19.784 -3.627 1.00 19.67 N ATOM 60 HA LYS A 6 -0.674 -14.866 -2.939 1.00 0.00 H ATOM 61 HB2 LYS A 6 -1.829 -17.057 -2.144 1.00 0.00 H ATOM 62 HB3 LYS A 6 -3.327 -16.269 -2.692 1.00 0.00 H ATOM 63 HG2 LYS A 6 -2.532 -16.167 -4.955 1.00 0.00 H ATOM 64 HG3 LYS A 6 -0.905 -16.697 -4.467 1.00 0.00 H ATOM 65 HD2 LYS A 6 -2.193 -18.573 -5.458 1.00 0.00 H ATOM 66 HD3 LYS A 6 -1.826 -18.884 -3.746 1.00 0.00 H ATOM 67 HE2 LYS A 6 -4.447 -18.280 -5.070 1.00 0.00 H ATOM 68 HE3 LYS A 6 -4.196 -17.698 -3.407 1.00 0.00 H ATOM 69 HZ1 LYS A 6 -3.928 -20.500 -4.328 1.00 0.00 H ATOM 70 HZ2 LYS A 6 -3.688 -19.944 -2.741 1.00 0.00 H ATOM 71 HZ3 LYS A 6 -5.230 -19.853 -3.448 1.00 0.00 H ATOM 72 H LYS A 6 -1.790 -15.641 -0.438 1.00 0.00 H ATOM 73 N GLU A 7 -3.516 -13.408 -2.239 1.00 10.23 N ATOM 74 CA GLU A 7 -4.406 -12.321 -2.633 1.00 13.60 C ATOM 75 C GLU A 7 -3.709 -10.949 -2.595 1.00 15.77 C ATOM 76 O GLU A 7 -4.088 -10.035 -3.335 1.00 14.86 O ATOM 77 CB GLU A 7 -5.669 -12.313 -1.769 1.00 19.57 C ATOM 78 CG GLU A 7 -5.402 -12.204 -0.273 1.00 25.88 C ATOM 79 CD GLU A 7 -5.331 -13.565 0.428 1.00 28.22 C ATOM 80 OE1 GLU A 7 -5.217 -14.599 -0.266 1.00 25.18 O ATOM 81 OE2 GLU A 7 -5.398 -13.591 1.681 1.00 28.07 O ATOM 82 HA GLU A 7 -4.692 -12.504 -3.669 1.00 0.00 H ATOM 83 HB2 GLU A 7 -6.284 -11.464 -2.069 1.00 0.00 H ATOM 84 HB3 GLU A 7 -6.215 -13.238 -1.953 1.00 0.00 H ATOM 85 HG2 GLU A 7 -4.453 -11.689 -0.127 1.00 0.00 H ATOM 86 HG3 GLU A 7 -6.204 -11.622 0.181 1.00 0.00 H ATOM 87 H GLU A 7 -3.652 -13.863 -1.314 1.00 0.00 H ATOM 88 N MET A 8 -2.671 -10.811 -1.765 1.00 12.68 N ATOM 89 CA MET A 8 -1.877 -9.572 -1.759 1.00 13.86 C ATOM 90 C MET A 8 -0.938 -9.485 -2.982 1.00 17.17 C ATOM 91 O MET A 8 -0.714 -8.393 -3.541 1.00 20.47 O ATOM 92 CB MET A 8 -1.076 -9.433 -0.459 1.00 14.95 C ATOM 93 CG MET A 8 -0.369 -8.092 -0.322 1.00 11.75 C ATOM 94 SD MET A 8 0.614 -7.943 1.187 1.00 9.42 S ATOM 95 CE MET A 8 -0.678 -7.821 2.413 1.00 13.11 C ATOM 96 HA MET A 8 -2.582 -8.743 -1.821 1.00 0.00 H ATOM 97 HB2 MET A 8 -1.759 -9.551 0.382 1.00 0.00 H ATOM 98 HB3 MET A 8 -0.326 -10.223 -0.429 1.00 0.00 H ATOM 99 HG2 MET A 8 -1.122 -7.304 -0.322 1.00 0.00 H ATOM 100 HG3 MET A 8 0.292 -7.962 -1.179 1.00 0.00 H ATOM 101 HE1 MET A 8 -1.294 -6.947 2.204 1.00 0.00 H ATOM 102 HE2 MET A 8 -1.295 -8.719 2.379 1.00 0.00 H ATOM 103 HE3 MET A 8 -0.231 -7.723 3.402 1.00 0.00 H ATOM 104 H MET A 8 -2.422 -11.586 -1.118 1.00 0.00 H ATOM 105 N LEU A 9 -0.372 -10.627 -3.376 1.00 16.01 N ATOM 106 CA LEU A 9 0.477 -10.693 -4.576 1.00 21.30 C ATOM 107 C LEU A 9 -0.348 -10.378 -5.829 1.00 21.18 C ATOM 108 O LEU A 9 0.101 -9.647 -6.728 1.00 15.68 O ATOM 109 CB LEU A 9 1.130 -12.077 -4.698 1.00 13.66 C ATOM 110 CG LEU A 9 1.967 -12.460 -3.473 1.00 17.88 C ATOM 111 CD1 LEU A 9 2.238 -13.936 -3.437 1.00 16.03 C ATOM 112 CD2 LEU A 9 3.264 -11.672 -3.443 1.00 18.45 C ATOM 113 HA LEU A 9 1.267 -9.947 -4.483 1.00 0.00 H ATOM 114 HB2 LEU A 9 0.344 -12.821 -4.827 1.00 0.00 H ATOM 115 HB3 LEU A 9 1.778 -12.079 -5.575 1.00 0.00 H ATOM 116 HG LEU A 9 1.391 -12.208 -2.583 1.00 0.00 H ATOM 117 HD21 LEU A 9 3.838 -11.886 -4.344 1.00 0.00 H ATOM 118 HD22 LEU A 9 3.039 -10.606 -3.398 1.00 0.00 H ATOM 119 HD23 LEU A 9 3.842 -11.960 -2.565 1.00 0.00 H ATOM 120 HD11 LEU A 9 1.293 -14.477 -3.394 1.00 0.00 H ATOM 121 HD12 LEU A 9 2.784 -14.226 -4.335 1.00 0.00 H ATOM 122 HD13 LEU A 9 2.834 -14.173 -2.556 1.00 0.00 H ATOM 123 H LEU A 9 -0.535 -11.492 -2.822 1.00 0.00 H ATOM 124 N ARG A 10 -1.553 -10.931 -5.872 1.00 14.90 N ATOM 125 CA ARG A 10 -2.504 -10.635 -6.917 1.00 18.16 C ATOM 126 C ARG A 10 -2.810 -9.144 -6.961 1.00 21.78 C ATOM 127 O ARG A 10 -2.856 -8.550 -8.036 1.00 20.47 O ATOM 128 CB ARG A 10 -3.789 -11.428 -6.685 1.00 26.59 C ATOM 129 CG ARG A 10 -4.853 -11.248 -7.759 1.00 37.19 C ATOM 130 CD ARG A 10 -5.963 -12.286 -7.581 1.00 47.01 C ATOM 131 NE ARG A 10 -5.424 -13.654 -7.504 1.00 51.55 N ATOM 132 CZ ARG A 10 -5.454 -14.426 -6.415 1.00 51.30 C ATOM 133 NH1 ARG A 10 -4.933 -15.650 -6.456 1.00 50.23 N ATOM 134 NH2 ARG A 10 -6.013 -13.985 -5.291 1.00 51.49 N ATOM 135 HA ARG A 10 -2.071 -10.923 -7.875 1.00 0.00 H ATOM 136 HB2 ARG A 10 -3.531 -12.486 -6.637 1.00 0.00 H ATOM 137 HB3 ARG A 10 -4.213 -11.115 -5.731 1.00 0.00 H ATOM 138 HG2 ARG A 10 -5.279 -10.248 -7.681 1.00 0.00 H ATOM 139 HG3 ARG A 10 -4.398 -11.372 -8.742 1.00 0.00 H ATOM 140 HD2 ARG A 10 -6.645 -12.222 -8.429 1.00 0.00 H ATOM 141 HD3 ARG A 10 -6.506 -12.068 -6.662 1.00 0.00 H ATOM 142 HE ARG A 10 -4.987 -14.048 -8.362 1.00 0.00 H ATOM 143 HH12 ARG A 10 -4.955 -16.253 -5.609 1.00 0.00 H ATOM 144 HH11 ARG A 10 -4.504 -16.003 -7.335 1.00 0.00 H ATOM 145 HH22 ARG A 10 -6.032 -14.592 -4.447 1.00 0.00 H ATOM 146 HH21 ARG A 10 -6.430 -13.033 -5.257 1.00 0.00 H ATOM 147 H ARG A 10 -1.823 -11.603 -5.125 1.00 0.00 H ATOM 148 N ALA A 11 -3.021 -8.539 -5.785 1.00 12.24 N ATOM 149 CA ALA A 11 -3.343 -7.119 -5.701 1.00 15.94 C ATOM 150 C ALA A 11 -2.167 -6.285 -6.220 1.00 20.93 C ATOM 151 O ALA A 11 -2.358 -5.299 -6.914 1.00 20.49 O ATOM 152 CB ALA A 11 -3.693 -6.721 -4.242 1.00 14.37 C ATOM 153 HA ALA A 11 -4.216 -6.921 -6.323 1.00 0.00 H ATOM 154 HB1 ALA A 11 -4.554 -7.299 -3.906 1.00 0.00 H ATOM 155 HB2 ALA A 11 -2.840 -6.928 -3.596 1.00 0.00 H ATOM 156 HB3 ALA A 11 -3.930 -5.658 -4.204 1.00 0.00 H ATOM 157 H ALA A 11 -2.954 -9.096 -4.909 1.00 0.00 H ATOM 158 N GLN A 12 -0.948 -6.690 -5.861 1.00 21.29 N ATOM 159 CA GLN A 12 0.257 -5.961 -6.264 1.00 20.63 C ATOM 160 C GLN A 12 0.435 -6.019 -7.795 1.00 23.66 C ATOM 161 O GLN A 12 0.756 -5.016 -8.441 1.00 19.37 O ATOM 162 CB GLN A 12 1.489 -6.538 -5.547 1.00 15.63 C ATOM 163 CG GLN A 12 1.515 -6.230 -4.059 1.00 16.37 C ATOM 164 CD GLN A 12 2.543 -7.018 -3.329 1.00 11.28 C ATOM 165 OE1 GLN A 12 3.062 -8.014 -3.855 1.00 15.47 O ATOM 166 NE2 GLN A 12 2.853 -6.603 -2.069 1.00 4.52 N ATOM 167 HA GLN A 12 0.149 -4.915 -5.975 1.00 0.00 H ATOM 168 HB2 GLN A 12 1.491 -7.620 -5.677 1.00 0.00 H ATOM 169 HB3 GLN A 12 2.385 -6.117 -6.004 1.00 0.00 H ATOM 170 HG2 GLN A 12 1.728 -5.169 -3.926 1.00 0.00 H ATOM 171 HG3 GLN A 12 0.536 -6.458 -3.638 1.00 0.00 H ATOM 172 HE22 GLN A 12 2.391 -5.761 -1.670 1.00 0.00 H ATOM 173 HE21 GLN A 12 3.552 -7.128 -1.506 1.00 0.00 H ATOM 174 H GLN A 12 -0.850 -7.547 -5.279 1.00 0.00 H ATOM 175 N THR A 13 0.215 -7.201 -8.355 1.00 17.33 N ATOM 176 CA THR A 13 0.238 -7.391 -9.782 1.00 22.98 C ATOM 177 C THR A 13 -0.789 -6.495 -10.478 1.00 22.14 C ATOM 178 O THR A 13 -0.482 -5.879 -11.491 1.00 22.26 O ATOM 179 CB THR A 13 -0.032 -8.854 -10.139 1.00 20.21 C ATOM 180 OG1 THR A 13 1.044 -9.664 -9.649 1.00 21.58 O ATOM 181 CG2 THR A 13 -0.172 -9.041 -11.674 1.00 23.39 C ATOM 182 HA THR A 13 1.233 -7.116 -10.131 1.00 0.00 H ATOM 183 HB THR A 13 -0.971 -9.157 -9.675 1.00 0.00 H ATOM 184 HG1 THR A 13 1.107 -9.567 -8.666 1.00 0.00 H ATOM 185 HG23 THR A 13 -0.991 -8.423 -12.041 1.00 0.00 H ATOM 186 HG21 THR A 13 0.756 -8.743 -12.161 1.00 0.00 H ATOM 187 HG22 THR A 13 -0.379 -10.088 -11.894 1.00 0.00 H ATOM 188 H THR A 13 0.019 -8.018 -7.743 1.00 0.00 H ATOM 189 N ASN A 14 -2.010 -6.464 -9.948 1.00 22.07 N ATOM 190 CA ASN A 14 -3.057 -5.573 -10.460 1.00 23.56 C ATOM 191 C ASN A 14 -2.620 -4.116 -10.464 1.00 28.11 C ATOM 192 O ASN A 14 -2.812 -3.401 -11.445 1.00 18.66 O ATOM 193 CB ASN A 14 -4.308 -5.683 -9.603 1.00 23.48 C ATOM 194 CG ASN A 14 -5.218 -6.751 -10.066 1.00 30.51 C ATOM 195 OD1 ASN A 14 -5.028 -7.311 -11.127 1.00 27.99 O ATOM 196 ND2 ASN A 14 -6.230 -7.049 -9.271 1.00 36.47 N ATOM 197 HA ASN A 14 -3.258 -5.886 -11.485 1.00 0.00 H ATOM 198 HB2 ASN A 14 -4.011 -5.897 -8.576 1.00 0.00 H ATOM 199 HB3 ASN A 14 -4.839 -4.732 -9.636 1.00 0.00 H ATOM 200 HD22 ASN A 14 -6.352 -6.542 -8.371 1.00 0.00 H ATOM 201 HD21 ASN A 14 -6.905 -7.791 -9.545 1.00 0.00 H ATOM 202 H ASN A 14 -2.228 -7.090 -9.147 1.00 0.00 H ATOM 203 N VAL A 15 -2.081 -3.671 -9.328 1.00 22.51 N ATOM 204 CA VAL A 15 -1.664 -2.295 -9.165 1.00 22.08 C ATOM 205 C VAL A 15 -0.552 -1.928 -10.158 1.00 28.94 C ATOM 206 O VAL A 15 -0.518 -0.819 -10.695 1.00 27.43 O ATOM 207 CB VAL A 15 -1.196 -2.046 -7.723 1.00 24.90 C ATOM 208 CG1 VAL A 15 -0.456 -0.718 -7.607 1.00 24.47 C ATOM 209 CG2 VAL A 15 -2.423 -2.120 -6.739 1.00 21.03 C ATOM 210 HA VAL A 15 -2.523 -1.657 -9.373 1.00 0.00 H ATOM 211 HB VAL A 15 -0.490 -2.827 -7.443 1.00 0.00 H ATOM 212 HG11 VAL A 15 0.417 -0.732 -8.260 1.00 0.00 H ATOM 213 HG12 VAL A 15 -1.120 0.094 -7.903 1.00 0.00 H ATOM 214 HG13 VAL A 15 -0.137 -0.570 -6.575 1.00 0.00 H ATOM 215 HG21 VAL A 15 -3.155 -1.361 -7.015 1.00 0.00 H ATOM 216 HG22 VAL A 15 -2.880 -3.108 -6.803 1.00 0.00 H ATOM 217 HG23 VAL A 15 -2.081 -1.942 -5.720 1.00 0.00 H ATOM 218 H VAL A 15 -1.957 -4.333 -8.536 1.00 0.00 H ATOM 219 N ILE A 16 0.353 -2.864 -10.403 1.00 24.35 N ATOM 220 CA ILE A 16 1.427 -2.629 -11.349 1.00 26.56 C ATOM 221 C ILE A 16 0.872 -2.482 -12.771 1.00 26.64 C ATOM 222 O ILE A 16 1.174 -1.522 -13.463 1.00 32.07 O ATOM 223 CB ILE A 16 2.461 -3.745 -11.302 1.00 19.61 C ATOM 224 CG1 ILE A 16 3.268 -3.648 -9.988 1.00 21.85 C ATOM 225 CG2 ILE A 16 3.381 -3.667 -12.505 1.00 20.88 C ATOM 226 CD1 ILE A 16 4.183 -4.832 -9.744 1.00 21.16 C ATOM 227 HA ILE A 16 1.919 -1.699 -11.065 1.00 0.00 H ATOM 228 HB ILE A 16 1.950 -4.707 -11.332 1.00 0.00 H ATOM 229 HG12 ILE A 16 3.877 -2.744 -10.024 1.00 0.00 H ATOM 230 HG13 ILE A 16 2.566 -3.579 -9.157 1.00 0.00 H ATOM 231 HD11 ILE A 16 3.589 -5.744 -9.693 1.00 0.00 H ATOM 232 HD12 ILE A 16 4.901 -4.909 -10.561 1.00 0.00 H ATOM 233 HD13 ILE A 16 4.715 -4.691 -8.803 1.00 0.00 H ATOM 234 HG21 ILE A 16 2.793 -3.766 -13.417 1.00 0.00 H ATOM 235 HG22 ILE A 16 3.896 -2.706 -12.506 1.00 0.00 H ATOM 236 HG23 ILE A 16 4.113 -4.473 -12.454 1.00 0.00 H ATOM 237 H ILE A 16 0.293 -3.778 -9.911 1.00 0.00 H ATOM 238 N LEU A 17 0.044 -3.433 -13.180 1.00 20.32 N ATOM 239 CA LEU A 17 -0.593 -3.392 -14.496 1.00 22.81 C ATOM 240 C LEU A 17 -1.437 -2.115 -14.708 1.00 21.96 C ATOM 241 O LEU A 17 -1.392 -1.532 -15.759 1.00 16.24 O ATOM 242 CB LEU A 17 -1.450 -4.639 -14.715 1.00 13.64 C ATOM 243 CG LEU A 17 -0.658 -5.936 -14.907 1.00 15.55 C ATOM 244 CD1 LEU A 17 -1.562 -7.155 -14.781 1.00 9.02 C ATOM 245 CD2 LEU A 17 0.042 -5.921 -16.272 1.00 10.77 C ATOM 246 HA LEU A 17 0.208 -3.371 -15.235 1.00 0.00 H ATOM 247 HB2 LEU A 17 -2.098 -4.762 -13.847 1.00 0.00 H ATOM 248 HB3 LEU A 17 -2.061 -4.479 -15.604 1.00 0.00 H ATOM 249 HG LEU A 17 0.096 -6.001 -14.122 1.00 0.00 H ATOM 250 HD21 LEU A 17 -0.705 -5.834 -17.061 1.00 0.00 H ATOM 251 HD22 LEU A 17 0.723 -5.072 -16.320 1.00 0.00 H ATOM 252 HD23 LEU A 17 0.603 -6.846 -16.401 1.00 0.00 H ATOM 253 HD11 LEU A 17 -2.017 -7.167 -13.791 1.00 0.00 H ATOM 254 HD12 LEU A 17 -2.342 -7.107 -15.540 1.00 0.00 H ATOM 255 HD13 LEU A 17 -0.971 -8.060 -14.922 1.00 0.00 H ATOM 256 H LEU A 17 -0.159 -4.232 -12.546 1.00 0.00 H ATOM 257 N LEU A 18 -2.215 -1.717 -13.698 1.00 16.40 N ATOM 258 CA LEU A 18 -3.037 -0.520 -13.809 1.00 21.65 C ATOM 259 C LEU A 18 -2.163 0.719 -13.941 1.00 26.06 C ATOM 260 O LEU A 18 -2.549 1.689 -14.597 1.00 18.44 O ATOM 261 CB LEU A 18 -3.992 -0.386 -12.614 1.00 11.46 C ATOM 262 CG LEU A 18 -5.090 -1.462 -12.587 1.00 12.11 C ATOM 263 CD1 LEU A 18 -5.850 -1.398 -11.270 1.00 9.13 C ATOM 264 CD2 LEU A 18 -6.044 -1.291 -13.750 1.00 5.52 C ATOM 265 HA LEU A 18 -3.643 -0.613 -14.710 1.00 0.00 H ATOM 266 HB2 LEU A 18 -3.410 -0.463 -11.696 1.00 0.00 H ATOM 267 HB3 LEU A 18 -4.468 0.593 -12.660 1.00 0.00 H ATOM 268 HG LEU A 18 -4.615 -2.439 -12.678 1.00 0.00 H ATOM 269 HD21 LEU A 18 -6.514 -0.309 -13.692 1.00 0.00 H ATOM 270 HD22 LEU A 18 -5.492 -1.376 -14.686 1.00 0.00 H ATOM 271 HD23 LEU A 18 -6.810 -2.065 -13.707 1.00 0.00 H ATOM 272 HD11 LEU A 18 -5.159 -1.569 -10.445 1.00 0.00 H ATOM 273 HD12 LEU A 18 -6.308 -0.415 -11.164 1.00 0.00 H ATOM 274 HD13 LEU A 18 -6.625 -2.164 -11.262 1.00 0.00 H ATOM 275 H LEU A 18 -2.234 -2.271 -12.818 1.00 0.00 H ATOM 276 N ASN A 19 -0.976 0.680 -13.343 1.00 21.64 N ATOM 277 CA ASN A 19 -0.030 1.778 -13.510 1.00 21.22 C ATOM 278 C ASN A 19 0.658 1.796 -14.862 1.00 18.54 C ATOM 279 O ASN A 19 1.072 2.842 -15.339 1.00 22.47 O ATOM 280 CB ASN A 19 0.977 1.840 -12.366 1.00 18.26 C ATOM 281 CG ASN A 19 0.437 2.585 -11.175 1.00 20.51 C ATOM 282 OD1 ASN A 19 0.498 3.811 -11.117 1.00 17.41 O ATOM 283 ND2 ASN A 19 -0.140 1.850 -10.228 1.00 17.00 N ATOM 284 HA ASN A 19 -0.633 2.685 -13.475 1.00 0.00 H ATOM 285 HB2 ASN A 19 1.226 0.824 -12.061 1.00 0.00 H ATOM 286 HB3 ASN A 19 1.878 2.344 -12.717 1.00 0.00 H ATOM 287 HD22 ASN A 19 -0.169 0.814 -10.319 1.00 0.00 H ATOM 288 HD21 ASN A 19 -0.562 2.311 -9.397 1.00 0.00 H ATOM 289 H ASN A 19 -0.721 -0.138 -12.753 1.00 0.00 H ATOM 290 N VAL A 20 0.767 0.651 -15.496 1.00 17.40 N ATOM 291 CA VAL A 20 1.259 0.646 -16.855 1.00 14.53 C ATOM 292 C VAL A 20 0.241 1.385 -17.726 1.00 16.24 C ATOM 293 O VAL A 20 0.584 2.277 -18.493 1.00 24.63 O ATOM 294 CB VAL A 20 1.447 -0.764 -17.382 1.00 12.82 C ATOM 295 CG1 VAL A 20 1.808 -0.725 -18.888 1.00 10.76 C ATOM 296 CG2 VAL A 20 2.532 -1.485 -16.582 1.00 20.29 C ATOM 297 HA VAL A 20 2.233 1.135 -16.881 1.00 0.00 H ATOM 298 HB VAL A 20 0.513 -1.315 -17.266 1.00 0.00 H ATOM 299 HG11 VAL A 20 1.003 -0.240 -19.441 1.00 0.00 H ATOM 300 HG12 VAL A 20 2.733 -0.165 -19.024 1.00 0.00 H ATOM 301 HG13 VAL A 20 1.940 -1.743 -19.255 1.00 0.00 H ATOM 302 HG21 VAL A 20 3.472 -0.940 -16.674 1.00 0.00 H ATOM 303 HG22 VAL A 20 2.238 -1.531 -15.533 1.00 0.00 H ATOM 304 HG23 VAL A 20 2.657 -2.496 -16.970 1.00 0.00 H ATOM 305 H VAL A 20 0.503 -0.239 -15.027 1.00 0.00 H ATOM 306 N LEU A 21 -1.015 1.011 -17.571 1.00 13.65 N ATOM 307 CA LEU A 21 -2.124 1.636 -18.293 1.00 18.95 C ATOM 308 C LEU A 21 -2.285 3.161 -17.975 1.00 20.76 C ATOM 309 O LEU A 21 -2.668 3.968 -18.843 1.00 20.34 O ATOM 310 CB LEU A 21 -3.415 0.874 -17.977 1.00 15.53 C ATOM 311 CG LEU A 21 -3.789 -0.219 -18.985 1.00 22.84 C ATOM 312 CD1 LEU A 21 -2.598 -0.966 -19.488 1.00 22.64 C ATOM 313 CD2 LEU A 21 -4.848 -1.141 -18.424 1.00 14.25 C ATOM 314 HA LEU A 21 -1.902 1.578 -19.359 1.00 0.00 H ATOM 315 HB2 LEU A 21 -3.301 0.407 -16.999 1.00 0.00 H ATOM 316 HB3 LEU A 21 -4.232 1.594 -17.941 1.00 0.00 H ATOM 317 HG LEU A 21 -4.218 0.280 -19.854 1.00 0.00 H ATOM 318 HD21 LEU A 21 -4.471 -1.616 -17.518 1.00 0.00 H ATOM 319 HD22 LEU A 21 -5.742 -0.564 -18.188 1.00 0.00 H ATOM 320 HD23 LEU A 21 -5.091 -1.905 -19.163 1.00 0.00 H ATOM 321 HD11 LEU A 21 -1.918 -0.272 -19.982 1.00 0.00 H ATOM 322 HD12 LEU A 21 -2.089 -1.442 -18.650 1.00 0.00 H ATOM 323 HD13 LEU A 21 -2.921 -1.727 -20.198 1.00 0.00 H ATOM 324 H LEU A 21 -1.226 0.239 -16.907 1.00 0.00 H ATOM 325 N LYS A 22 -2.011 3.528 -16.736 1.00 19.48 N ATOM 326 CA LYS A 22 -2.052 4.908 -16.328 1.00 22.74 C ATOM 327 C LYS A 22 -1.048 5.733 -17.143 1.00 26.61 C ATOM 328 O LYS A 22 -1.315 6.878 -17.483 1.00 22.13 O ATOM 329 CB LYS A 22 -1.749 5.017 -14.835 1.00 25.60 C ATOM 330 CG LYS A 22 -1.706 6.404 -14.322 1.00 27.46 C ATOM 331 CD LYS A 22 -1.550 6.412 -12.824 1.00 35.59 C ATOM 332 CE LYS A 22 -2.225 7.616 -12.223 1.00 37.77 C ATOM 333 NZ LYS A 22 -2.373 7.470 -10.758 1.00 45.61 N ATOM 334 HA LYS A 22 -3.051 5.304 -16.512 1.00 0.00 H ATOM 335 HB2 LYS A 22 -2.521 4.475 -14.289 1.00 0.00 H ATOM 336 HB3 LYS A 22 -0.780 4.554 -14.648 1.00 0.00 H ATOM 337 HG2 LYS A 22 -0.862 6.927 -14.773 1.00 0.00 H ATOM 338 HG3 LYS A 22 -2.632 6.913 -14.589 1.00 0.00 H ATOM 339 HD2 LYS A 22 -1.999 5.508 -12.413 1.00 0.00 H ATOM 340 HD3 LYS A 22 -0.489 6.435 -12.575 1.00 0.00 H ATOM 341 HE2 LYS A 22 -3.212 7.731 -12.671 1.00 0.00 H ATOM 342 HE3 LYS A 22 -1.626 8.502 -12.434 1.00 0.00 H ATOM 343 HZ1 LYS A 22 -2.948 6.628 -10.551 1.00 0.00 H ATOM 344 HZ2 LYS A 22 -1.433 7.365 -10.325 1.00 0.00 H ATOM 345 HZ3 LYS A 22 -2.841 8.315 -10.372 1.00 0.00 H ATOM 346 H LYS A 22 -1.759 2.801 -16.037 1.00 0.00 H ATOM 347 N GLN A 23 0.100 5.129 -17.465 1.00 24.19 N ATOM 348 CA GLN A 23 1.127 5.793 -18.265 1.00 21.44 C ATOM 349 C GLN A 23 0.677 5.978 -19.715 1.00 27.16 C ATOM 350 O GLN A 23 1.092 6.918 -20.379 1.00 27.59 O ATOM 351 CB GLN A 23 2.444 5.004 -18.238 1.00 21.93 C ATOM 352 CG GLN A 23 2.963 4.689 -16.848 1.00 28.11 C ATOM 353 CD GLN A 23 2.770 5.837 -15.889 1.00 31.76 C ATOM 354 OE1 GLN A 23 3.180 6.967 -16.162 1.00 37.55 O ATOM 355 NE2 GLN A 23 2.135 5.561 -14.761 1.00 33.80 N ATOM 356 HA GLN A 23 1.288 6.775 -17.821 1.00 0.00 H ATOM 357 HB2 GLN A 23 2.287 4.062 -18.764 1.00 0.00 H ATOM 358 HB3 GLN A 23 3.202 5.589 -18.760 1.00 0.00 H ATOM 359 HG2 GLN A 23 2.431 3.819 -16.464 1.00 0.00 H ATOM 360 HG3 GLN A 23 4.027 4.463 -16.914 1.00 0.00 H ATOM 361 HE22 GLN A 23 1.807 4.592 -14.573 1.00 0.00 H ATOM 362 HE21 GLN A 23 1.964 6.313 -14.063 1.00 0.00 H ATOM 363 H GLN A 23 0.268 4.157 -17.136 1.00 0.00 H ATOM 364 N GLY A 24 -0.165 5.071 -20.208 1.00 23.69 N ATOM 365 CA GLY A 24 -0.730 5.217 -21.569 1.00 20.08 C ATOM 366 C GLY A 24 -1.421 3.941 -22.005 1.00 19.76 C ATOM 367 O GLY A 24 -1.099 2.849 -21.511 1.00 20.26 O ATOM 368 HA3 GLY A 24 0.075 5.444 -22.268 1.00 0.00 H ATOM 369 HA2 GLY A 24 -1.452 6.033 -21.571 1.00 0.00 H ATOM 370 H GLY A 24 -0.429 4.249 -19.629 1.00 0.00 H ATOM 371 N ASP A 25 -2.390 4.075 -22.906 1.00 15.76 N ATOM 372 CA ASP A 25 -3.101 2.912 -23.467 1.00 19.62 C ATOM 373 C ASP A 25 -2.071 2.014 -24.087 1.00 17.98 C ATOM 374 O ASP A 25 -1.105 2.489 -24.642 1.00 16.88 O ATOM 375 CB ASP A 25 -4.108 3.358 -24.523 1.00 12.86 C ATOM 376 CG ASP A 25 -5.202 4.221 -23.948 1.00 15.68 C ATOM 377 OD1 ASP A 25 -5.100 4.578 -22.741 1.00 12.62 O ATOM 378 OD2 ASP A 25 -6.175 4.538 -24.686 1.00 14.80 O ATOM 379 HA ASP A 25 -3.651 2.390 -22.684 1.00 0.00 H ATOM 380 HB2 ASP A 25 -3.582 3.925 -25.291 1.00 0.00 H ATOM 381 HB3 ASP A 25 -4.560 2.473 -24.972 1.00 0.00 H ATOM 382 H ASP A 25 -2.654 5.029 -23.224 1.00 0.00 H ATOM 383 N ASN A 26 -2.247 0.710 -23.967 1.00 17.94 N ATOM 384 CA ASN A 26 -1.175 -0.183 -24.359 1.00 20.38 C ATOM 385 C ASN A 26 -1.695 -1.585 -24.744 1.00 19.33 C ATOM 386 O ASN A 26 -2.758 -2.000 -24.312 1.00 18.26 O ATOM 387 CB ASN A 26 -0.099 -0.239 -23.236 1.00 17.28 C ATOM 388 CG ASN A 26 1.338 -0.497 -23.782 1.00 27.39 C ATOM 389 OD1 ASN A 26 1.513 -0.919 -24.922 1.00 23.62 O ATOM 390 ND2 ASN A 26 2.358 -0.247 -22.938 1.00 24.54 N ATOM 391 HA ASN A 26 -0.708 0.215 -25.260 1.00 0.00 H ATOM 392 HB2 ASN A 26 -0.103 0.712 -22.703 1.00 0.00 H ATOM 393 HB3 ASN A 26 -0.358 -1.042 -22.546 1.00 0.00 H ATOM 394 HD22 ASN A 26 2.165 0.110 -21.980 1.00 0.00 H ATOM 395 HD21 ASN A 26 3.338 -0.411 -23.244 1.00 0.00 H ATOM 396 H ASN A 26 -3.142 0.330 -23.597 1.00 0.00 H ATOM 397 N TYR A 27 -0.960 -2.275 -25.602 1.00 16.26 N ATOM 398 CA TYR A 27 -1.368 -3.591 -26.033 1.00 21.36 C ATOM 399 C TYR A 27 -0.544 -4.621 -25.261 1.00 19.92 C ATOM 400 O TYR A 27 0.444 -4.265 -24.589 1.00 19.65 O ATOM 401 CB TYR A 27 -1.176 -3.745 -27.542 1.00 19.39 C ATOM 402 CG TYR A 27 0.220 -3.492 -27.967 1.00 27.12 C ATOM 403 CD1 TYR A 27 0.729 -2.200 -27.991 1.00 31.79 C ATOM 404 CD2 TYR A 27 1.063 -4.545 -28.319 1.00 27.12 C ATOM 405 CE1 TYR A 27 2.026 -1.953 -28.368 1.00 34.57 C ATOM 406 CE2 TYR A 27 2.369 -4.310 -28.693 1.00 29.61 C ATOM 407 CZ TYR A 27 2.847 -3.009 -28.717 1.00 32.52 C ATOM 408 OH TYR A 27 4.143 -2.760 -29.087 1.00 39.26 O ATOM 409 HA TYR A 27 -2.428 -3.744 -25.828 1.00 0.00 H ATOM 410 HB3 TYR A 27 -1.830 -3.037 -28.052 1.00 0.00 H ATOM 411 HB2 TYR A 27 -1.449 -4.761 -27.827 1.00 0.00 H ATOM 412 HD2 TYR A 27 0.685 -5.567 -28.298 1.00 0.00 H ATOM 413 HE2 TYR A 27 3.020 -5.140 -28.967 1.00 0.00 H ATOM 414 HE1 TYR A 27 2.406 -0.932 -28.392 1.00 0.00 H ATOM 415 HD1 TYR A 27 0.087 -1.367 -27.705 1.00 0.00 H ATOM 416 HH TYR A 27 4.315 -1.786 -29.048 1.00 0.00 H ATOM 417 H TYR A 27 -0.078 -1.864 -25.970 1.00 0.00 H ATOM 418 N VAL A 28 -0.954 -5.884 -25.340 1.00 17.66 N ATOM 419 CA VAL A 28 -0.479 -6.919 -24.395 1.00 20.00 C ATOM 420 C VAL A 28 1.053 -7.102 -24.329 1.00 19.88 C ATOM 421 O VAL A 28 1.637 -7.154 -23.239 1.00 20.57 O ATOM 422 CB VAL A 28 -1.173 -8.276 -24.654 1.00 23.64 C ATOM 423 CG1 VAL A 28 -0.422 -9.405 -23.944 1.00 16.82 C ATOM 424 CG2 VAL A 28 -2.630 -8.203 -24.179 1.00 23.08 C ATOM 425 HA VAL A 28 -0.764 -6.538 -23.415 1.00 0.00 H ATOM 426 HB VAL A 28 -1.162 -8.489 -25.723 1.00 0.00 H ATOM 427 HG11 VAL A 28 0.600 -9.452 -24.319 1.00 0.00 H ATOM 428 HG12 VAL A 28 -0.408 -9.212 -22.871 1.00 0.00 H ATOM 429 HG13 VAL A 28 -0.925 -10.352 -24.138 1.00 0.00 H ATOM 430 HG21 VAL A 28 -2.652 -7.980 -23.112 1.00 0.00 H ATOM 431 HG22 VAL A 28 -3.150 -7.417 -24.727 1.00 0.00 H ATOM 432 HG23 VAL A 28 -3.119 -9.160 -24.362 1.00 0.00 H ATOM 433 H VAL A 28 -1.627 -6.151 -26.086 1.00 0.00 H ATOM 434 N TYR A 29 1.682 -7.214 -25.489 1.00 18.07 N ATOM 435 CA TYR A 29 3.118 -7.362 -25.569 1.00 23.25 C ATOM 436 C TYR A 29 3.837 -6.125 -24.998 1.00 23.83 C ATOM 437 O TYR A 29 4.839 -6.259 -24.288 1.00 20.04 O ATOM 438 CB TYR A 29 3.550 -7.618 -27.024 1.00 29.89 C ATOM 439 CG TYR A 29 5.058 -7.662 -27.234 1.00 44.03 C ATOM 440 CD1 TYR A 29 5.695 -8.847 -27.617 1.00 52.24 C ATOM 441 CD2 TYR A 29 5.850 -6.514 -27.055 1.00 46.87 C ATOM 442 CE1 TYR A 29 7.078 -8.894 -27.816 1.00 53.70 C ATOM 443 CE2 TYR A 29 7.233 -6.554 -27.246 1.00 48.03 C ATOM 444 CZ TYR A 29 7.838 -7.749 -27.627 1.00 52.91 C ATOM 445 OH TYR A 29 9.198 -7.799 -27.824 1.00 58.38 O ATOM 446 HA TYR A 29 3.404 -8.223 -24.964 1.00 0.00 H ATOM 447 HB3 TYR A 29 3.142 -6.822 -27.646 1.00 0.00 H ATOM 448 HB2 TYR A 29 3.133 -8.574 -27.340 1.00 0.00 H ATOM 449 HD2 TYR A 29 5.377 -5.577 -26.762 1.00 0.00 H ATOM 450 HE2 TYR A 29 7.834 -5.657 -27.098 1.00 0.00 H ATOM 451 HE1 TYR A 29 7.557 -9.826 -28.118 1.00 0.00 H ATOM 452 HD1 TYR A 29 5.102 -9.750 -27.763 1.00 0.00 H ATOM 453 HH TYR A 29 9.458 -8.717 -28.089 1.00 0.00 H ATOM 454 H TYR A 29 1.127 -7.195 -26.368 1.00 0.00 H ATOM 455 N GLY A 30 3.333 -4.927 -25.326 1.00 16.82 N ATOM 456 CA GLY A 30 3.882 -3.686 -24.779 1.00 12.85 C ATOM 457 C GLY A 30 3.859 -3.690 -23.260 1.00 13.99 C ATOM 458 O GLY A 30 4.849 -3.380 -22.614 1.00 18.53 O ATOM 459 HA3 GLY A 30 3.289 -2.846 -25.140 1.00 0.00 H ATOM 460 HA2 GLY A 30 4.912 -3.574 -25.118 1.00 0.00 H ATOM 461 H GLY A 30 2.531 -4.878 -25.986 1.00 0.00 H ATOM 462 N ILE A 31 2.726 -4.082 -22.695 1.00 15.96 N ATOM 463 CA ILE A 31 2.540 -4.059 -21.231 1.00 20.44 C ATOM 464 C ILE A 31 3.496 -5.050 -20.577 1.00 18.59 C ATOM 465 O ILE A 31 4.191 -4.725 -19.621 1.00 19.61 O ATOM 466 CB ILE A 31 1.093 -4.448 -20.878 1.00 19.23 C ATOM 467 CG1 ILE A 31 0.108 -3.416 -21.448 1.00 16.15 C ATOM 468 CG2 ILE A 31 0.917 -4.630 -19.365 1.00 17.61 C ATOM 469 CD1 ILE A 31 -1.307 -3.934 -21.524 1.00 18.50 C ATOM 470 HA ILE A 31 2.745 -3.053 -20.866 1.00 0.00 H ATOM 471 HB ILE A 31 0.873 -5.411 -21.339 1.00 0.00 H ATOM 472 HG12 ILE A 31 0.121 -2.533 -20.810 1.00 0.00 H ATOM 473 HG13 ILE A 31 0.433 -3.142 -22.452 1.00 0.00 H ATOM 474 HD11 ILE A 31 -1.337 -4.813 -22.168 1.00 0.00 H ATOM 475 HD12 ILE A 31 -1.648 -4.203 -20.524 1.00 0.00 H ATOM 476 HD13 ILE A 31 -1.955 -3.159 -21.934 1.00 0.00 H ATOM 477 HG21 ILE A 31 1.583 -5.418 -19.015 1.00 0.00 H ATOM 478 HG22 ILE A 31 1.159 -3.696 -18.857 1.00 0.00 H ATOM 479 HG23 ILE A 31 -0.116 -4.904 -19.151 1.00 0.00 H ATOM 480 H ILE A 31 1.948 -4.415 -23.299 1.00 0.00 H ATOM 481 N ILE A 32 3.534 -6.263 -21.135 1.00 20.27 N ATOM 482 CA ILE A 32 4.379 -7.337 -20.624 1.00 16.34 C ATOM 483 C ILE A 32 5.859 -6.925 -20.653 1.00 20.93 C ATOM 484 O ILE A 32 6.590 -7.132 -19.688 1.00 22.43 O ATOM 485 CB ILE A 32 4.169 -8.652 -21.438 1.00 18.19 C ATOM 486 CG1 ILE A 32 2.819 -9.297 -21.084 1.00 12.10 C ATOM 487 CG2 ILE A 32 5.355 -9.649 -21.216 1.00 15.52 C ATOM 488 CD1 ILE A 32 2.517 -10.577 -21.890 1.00 17.52 C ATOM 489 HA ILE A 32 4.089 -7.525 -19.590 1.00 0.00 H ATOM 490 HB ILE A 32 4.152 -8.398 -22.498 1.00 0.00 H ATOM 491 HG12 ILE A 32 2.825 -9.550 -20.024 1.00 0.00 H ATOM 492 HG13 ILE A 32 2.029 -8.572 -21.279 1.00 0.00 H ATOM 493 HD11 ILE A 32 2.496 -10.339 -22.953 1.00 0.00 H ATOM 494 HD12 ILE A 32 3.293 -11.318 -21.697 1.00 0.00 H ATOM 495 HD13 ILE A 32 1.549 -10.976 -21.587 1.00 0.00 H ATOM 496 HG21 ILE A 32 6.285 -9.183 -21.540 1.00 0.00 H ATOM 497 HG22 ILE A 32 5.423 -9.901 -20.158 1.00 0.00 H ATOM 498 HG23 ILE A 32 5.180 -10.555 -21.796 1.00 0.00 H ATOM 499 H ILE A 32 2.938 -6.449 -21.967 1.00 0.00 H ATOM 500 N LYS A 33 6.284 -6.346 -21.768 1.00 17.69 N ATOM 501 CA LYS A 33 7.643 -5.864 -21.910 1.00 20.26 C ATOM 502 C LYS A 33 7.943 -4.781 -20.878 1.00 17.29 C ATOM 503 O LYS A 33 8.968 -4.810 -20.213 1.00 18.39 O ATOM 504 CB LYS A 33 7.854 -5.322 -23.322 1.00 25.79 C ATOM 505 CG LYS A 33 9.219 -4.666 -23.549 1.00 31.80 C ATOM 506 CD LYS A 33 9.238 -3.900 -24.886 1.00 37.64 C ATOM 507 CE LYS A 33 10.659 -3.658 -25.387 1.00 44.63 C ATOM 508 NZ LYS A 33 11.445 -2.803 -24.453 1.00 49.49 N ATOM 509 HA LYS A 33 8.328 -6.695 -21.739 1.00 0.00 H ATOM 510 HB2 LYS A 33 7.752 -6.149 -24.024 1.00 0.00 H ATOM 511 HB3 LYS A 33 7.081 -4.580 -23.522 1.00 0.00 H ATOM 512 HG2 LYS A 33 9.422 -3.971 -22.735 1.00 0.00 H ATOM 513 HG3 LYS A 33 9.989 -5.437 -23.567 1.00 0.00 H ATOM 514 HD2 LYS A 33 8.696 -4.481 -25.632 1.00 0.00 H ATOM 515 HD3 LYS A 33 8.745 -2.938 -24.748 1.00 0.00 H ATOM 516 HE2 LYS A 33 10.610 -3.166 -26.358 1.00 0.00 H ATOM 517 HE3 LYS A 33 11.163 -4.619 -25.493 1.00 0.00 H ATOM 518 HZ1 LYS A 33 10.975 -1.881 -24.351 1.00 0.00 H ATOM 519 HZ2 LYS A 33 11.503 -3.268 -23.525 1.00 0.00 H ATOM 520 HZ3 LYS A 33 12.403 -2.665 -24.834 1.00 0.00 H ATOM 521 H LYS A 33 5.623 -6.235 -22.563 1.00 0.00 H ATOM 522 N GLN A 34 7.023 -3.838 -20.741 1.00 22.22 N ATOM 523 CA GLN A 34 7.170 -2.746 -19.785 1.00 25.95 C ATOM 524 C GLN A 34 7.241 -3.241 -18.318 1.00 24.47 C ATOM 525 O GLN A 34 8.045 -2.753 -17.530 1.00 19.70 O ATOM 526 CB GLN A 34 6.016 -1.772 -19.948 1.00 32.88 C ATOM 527 CG GLN A 34 6.351 -0.346 -19.605 1.00 46.67 C ATOM 528 CD GLN A 34 5.482 0.645 -20.361 1.00 47.84 C ATOM 529 OE1 GLN A 34 5.470 0.656 -21.593 1.00 42.95 O ATOM 530 NE2 GLN A 34 4.748 1.487 -19.622 1.00 48.51 N ATOM 531 HA GLN A 34 8.117 -2.250 -19.999 1.00 0.00 H ATOM 532 HB2 GLN A 34 5.687 -1.804 -20.987 1.00 0.00 H ATOM 533 HB3 GLN A 34 5.202 -2.096 -19.300 1.00 0.00 H ATOM 534 HG2 GLN A 34 6.204 -0.198 -18.535 1.00 0.00 H ATOM 535 HG3 GLN A 34 7.395 -0.160 -19.856 1.00 0.00 H ATOM 536 HE22 GLN A 34 4.791 1.440 -18.584 1.00 0.00 H ATOM 537 HE21 GLN A 34 4.135 2.187 -20.086 1.00 0.00 H ATOM 538 H GLN A 34 6.169 -3.877 -21.333 1.00 0.00 H ATOM 539 N VAL A 35 6.395 -4.196 -17.952 1.00 19.40 N ATOM 540 CA VAL A 35 6.452 -4.733 -16.587 1.00 22.68 C ATOM 541 C VAL A 35 7.785 -5.472 -16.338 1.00 24.50 C ATOM 542 O VAL A 35 8.369 -5.383 -15.243 1.00 21.22 O ATOM 543 CB VAL A 35 5.286 -5.675 -16.287 1.00 20.51 C ATOM 544 CG1 VAL A 35 5.500 -6.362 -14.928 1.00 20.29 C ATOM 545 CG2 VAL A 35 3.986 -4.904 -16.296 1.00 22.30 C ATOM 546 HA VAL A 35 6.380 -3.878 -15.915 1.00 0.00 H ATOM 547 HB VAL A 35 5.239 -6.444 -17.058 1.00 0.00 H ATOM 548 HG11 VAL A 35 6.427 -6.935 -14.954 1.00 0.00 H ATOM 549 HG12 VAL A 35 5.561 -5.606 -14.146 1.00 0.00 H ATOM 550 HG13 VAL A 35 4.664 -7.031 -14.725 1.00 0.00 H ATOM 551 HG21 VAL A 35 4.023 -4.123 -15.536 1.00 0.00 H ATOM 552 HG22 VAL A 35 3.840 -4.452 -17.277 1.00 0.00 H ATOM 553 HG23 VAL A 35 3.161 -5.583 -16.081 1.00 0.00 H ATOM 554 H VAL A 35 5.695 -4.562 -18.629 1.00 0.00 H ATOM 555 N LYS A 36 8.268 -6.190 -17.359 1.00 24.26 N ATOM 556 CA LYS A 36 9.501 -6.957 -17.218 1.00 18.02 C ATOM 557 C LYS A 36 10.691 -6.044 -16.993 1.00 22.38 C ATOM 558 O LYS A 36 11.536 -6.296 -16.101 1.00 15.37 O ATOM 559 CB LYS A 36 9.744 -7.846 -18.428 1.00 15.51 C ATOM 560 CG LYS A 36 11.102 -8.527 -18.374 1.00 20.29 C ATOM 561 CD LYS A 36 11.311 -9.524 -19.499 1.00 23.93 C ATOM 562 CE LYS A 36 12.729 -10.094 -19.424 1.00 30.43 C ATOM 563 NZ LYS A 36 12.965 -11.218 -20.380 1.00 37.29 N ATOM 564 HA LYS A 36 9.384 -7.596 -16.343 1.00 0.00 H ATOM 565 HB2 LYS A 36 8.968 -8.611 -18.464 1.00 0.00 H ATOM 566 HB3 LYS A 36 9.692 -7.235 -19.329 1.00 0.00 H ATOM 567 HG2 LYS A 36 11.877 -7.763 -18.438 1.00 0.00 H ATOM 568 HG3 LYS A 36 11.190 -9.053 -17.423 1.00 0.00 H ATOM 569 HD2 LYS A 36 10.589 -10.335 -19.404 1.00 0.00 H ATOM 570 HD3 LYS A 36 11.171 -9.024 -20.458 1.00 0.00 H ATOM 571 HE2 LYS A 36 12.903 -10.458 -18.411 1.00 0.00 H ATOM 572 HE3 LYS A 36 13.436 -9.295 -19.648 1.00 0.00 H ATOM 573 HZ1 LYS A 36 12.304 -11.993 -20.172 1.00 0.00 H ATOM 574 HZ2 LYS A 36 12.813 -10.882 -21.352 1.00 0.00 H ATOM 575 HZ3 LYS A 36 13.943 -11.558 -20.279 1.00 0.00 H ATOM 576 H LYS A 36 7.758 -6.201 -18.265 1.00 0.00 H ATOM 577 N GLU A 37 10.765 -4.977 -17.783 1.00 17.88 N ATOM 578 CA GLU A 37 11.859 -4.002 -17.641 1.00 22.04 C ATOM 579 C GLU A 37 11.772 -3.247 -16.313 1.00 20.92 C ATOM 580 O GLU A 37 12.724 -3.234 -15.535 1.00 19.03 O ATOM 581 CB GLU A 37 11.860 -3.030 -18.814 1.00 19.47 C ATOM 582 CG GLU A 37 11.888 -3.732 -20.151 1.00 32.98 C ATOM 583 CD GLU A 37 12.138 -2.790 -21.300 1.00 43.36 C ATOM 584 OE1 GLU A 37 11.585 -1.658 -21.275 1.00 48.62 O ATOM 585 OE2 GLU A 37 12.878 -3.183 -22.238 1.00 45.98 O ATOM 586 HA GLU A 37 12.799 -4.554 -17.643 1.00 0.00 H ATOM 587 HB2 GLU A 37 10.960 -2.417 -18.760 1.00 0.00 H ATOM 588 HB3 GLU A 37 12.739 -2.390 -18.737 1.00 0.00 H ATOM 589 HG2 GLU A 37 12.680 -4.480 -20.135 1.00 0.00 H ATOM 590 HG3 GLU A 37 10.928 -4.224 -20.306 1.00 0.00 H ATOM 591 H GLU A 37 10.039 -4.829 -18.513 1.00 0.00 H ATOM 592 N ALA A 38 10.614 -2.639 -16.055 1.00 18.99 N ATOM 593 CA ALA A 38 10.375 -1.907 -14.795 1.00 17.54 C ATOM 594 C ALA A 38 10.630 -2.757 -13.514 1.00 15.76 C ATOM 595 O ALA A 38 11.009 -2.225 -12.488 1.00 15.51 O ATOM 596 CB ALA A 38 8.964 -1.330 -14.781 1.00 17.95 C ATOM 597 HA ALA A 38 11.106 -1.099 -14.768 1.00 0.00 H ATOM 598 HB1 ALA A 38 8.845 -0.645 -15.620 1.00 0.00 H ATOM 599 HB2 ALA A 38 8.240 -2.141 -14.866 1.00 0.00 H ATOM 600 HB3 ALA A 38 8.802 -0.793 -13.846 1.00 0.00 H ATOM 601 H ALA A 38 9.854 -2.682 -16.764 1.00 0.00 H ATOM 602 N SER A 39 10.401 -4.066 -13.591 1.00 15.34 N ATOM 603 CA SER A 39 10.619 -4.938 -12.438 1.00 16.94 C ATOM 604 C SER A 39 12.025 -5.580 -12.448 1.00 17.01 C ATOM 605 O SER A 39 12.319 -6.457 -11.637 1.00 16.05 O ATOM 606 CB SER A 39 9.556 -6.039 -12.399 1.00 19.31 C ATOM 607 OG SER A 39 9.780 -6.964 -13.444 1.00 17.25 O ATOM 608 HA SER A 39 10.542 -4.315 -11.547 1.00 0.00 H ATOM 609 HB2 SER A 39 8.569 -5.592 -12.517 1.00 0.00 H ATOM 610 HB3 SER A 39 9.607 -6.557 -11.441 1.00 0.00 H ATOM 611 HG SER A 39 9.732 -6.495 -14.314 1.00 0.00 H ATOM 612 H SER A 39 10.062 -4.475 -14.485 1.00 0.00 H ATOM 613 N ASN A 40 12.870 -5.160 -13.389 1.00 19.12 N ATOM 614 CA ASN A 40 14.221 -5.722 -13.516 1.00 17.04 C ATOM 615 C ASN A 40 14.217 -7.230 -13.780 1.00 16.50 C ATOM 616 O ASN A 40 15.077 -7.964 -13.277 1.00 9.63 O ATOM 617 CB ASN A 40 15.034 -5.419 -12.265 1.00 14.71 C ATOM 618 CG ASN A 40 15.165 -3.941 -12.014 1.00 22.79 C ATOM 619 OD1 ASN A 40 14.768 -3.442 -10.963 1.00 27.11 O ATOM 620 ND2 ASN A 40 15.702 -3.216 -12.998 1.00 23.65 N ATOM 621 HA ASN A 40 14.679 -5.246 -14.383 1.00 0.00 H ATOM 622 HB2 ASN A 40 14.543 -5.878 -11.407 1.00 0.00 H ATOM 623 HB3 ASN A 40 16.031 -5.845 -12.382 1.00 0.00 H ATOM 624 HD22 ASN A 40 16.024 -3.681 -13.870 1.00 0.00 H ATOM 625 HD21 ASN A 40 15.798 -2.186 -12.892 1.00 0.00 H ATOM 626 H ASN A 40 12.566 -4.416 -14.049 1.00 0.00 H ATOM 627 N GLY A 41 13.250 -7.685 -14.567 1.00 15.11 N ATOM 628 CA GLY A 41 13.149 -9.091 -14.905 1.00 22.93 C ATOM 629 C GLY A 41 12.413 -9.905 -13.855 1.00 25.37 C ATOM 630 O GLY A 41 12.078 -11.070 -14.084 1.00 29.71 O ATOM 631 HA3 GLY A 41 14.155 -9.495 -15.015 1.00 0.00 H ATOM 632 HA2 GLY A 41 12.617 -9.183 -15.852 1.00 0.00 H ATOM 633 H GLY A 41 12.549 -7.018 -14.950 1.00 0.00 H ATOM 634 N GLU A 42 12.144 -9.290 -12.709 1.00 20.30 N ATOM 635 CA GLU A 42 11.482 -9.987 -11.611 1.00 27.70 C ATOM 636 C GLU A 42 10.053 -10.383 -11.955 1.00 31.93 C ATOM 637 O GLU A 42 9.517 -11.352 -11.406 1.00 30.04 O ATOM 638 CB GLU A 42 11.474 -9.130 -10.349 1.00 30.78 C ATOM 639 CG GLU A 42 12.839 -8.943 -9.714 1.00 34.89 C ATOM 640 CD GLU A 42 12.811 -7.915 -8.592 1.00 37.94 C ATOM 641 OE1 GLU A 42 11.703 -7.436 -8.254 1.00 41.33 O ATOM 642 OE2 GLU A 42 13.893 -7.580 -8.060 1.00 41.94 O ATOM 643 HA GLU A 42 12.055 -10.897 -11.434 1.00 0.00 H ATOM 644 HB2 GLU A 42 11.079 -8.147 -10.606 1.00 0.00 H ATOM 645 HB3 GLU A 42 10.819 -9.604 -9.618 1.00 0.00 H ATOM 646 HG2 GLU A 42 13.172 -9.898 -9.308 1.00 0.00 H ATOM 647 HG3 GLU A 42 13.541 -8.610 -10.479 1.00 0.00 H ATOM 648 H GLU A 42 12.411 -8.292 -12.592 1.00 0.00 H ATOM 649 N MET A 43 9.422 -9.633 -12.840 1.00 29.91 N ATOM 650 CA MET A 43 8.023 -9.896 -13.149 1.00 28.40 C ATOM 651 C MET A 43 7.803 -10.134 -14.644 1.00 28.44 C ATOM 652 O MET A 43 7.686 -9.194 -15.430 1.00 30.08 O ATOM 653 CB MET A 43 7.145 -8.764 -12.629 1.00 30.07 C ATOM 654 CG MET A 43 5.703 -9.069 -12.666 1.00 40.64 C ATOM 655 SD MET A 43 4.771 -7.976 -11.596 1.00 45.67 S ATOM 656 CE MET A 43 3.294 -7.788 -12.569 1.00 44.34 C ATOM 657 HA MET A 43 7.735 -10.816 -12.641 1.00 0.00 H ATOM 658 HB2 MET A 43 7.427 -8.556 -11.597 1.00 0.00 H ATOM 659 HB3 MET A 43 7.326 -7.879 -13.239 1.00 0.00 H ATOM 660 HG2 MET A 43 5.550 -10.098 -12.341 1.00 0.00 H ATOM 661 HG3 MET A 43 5.343 -8.955 -13.689 1.00 0.00 H ATOM 662 HE1 MET A 43 3.550 -7.353 -13.535 1.00 0.00 H ATOM 663 HE2 MET A 43 2.833 -8.764 -12.719 1.00 0.00 H ATOM 664 HE3 MET A 43 2.598 -7.132 -12.047 1.00 0.00 H ATOM 665 H MET A 43 9.923 -8.856 -13.316 1.00 0.00 H ATOM 666 N GLU A 44 7.761 -11.401 -15.025 1.00 24.28 N ATOM 667 CA GLU A 44 7.609 -11.770 -16.408 1.00 26.89 C ATOM 668 C GLU A 44 6.262 -12.492 -16.585 1.00 29.05 C ATOM 669 O GLU A 44 6.149 -13.693 -16.331 1.00 32.63 O ATOM 670 CB GLU A 44 8.772 -12.680 -16.831 1.00 32.44 C ATOM 671 CG GLU A 44 9.207 -12.511 -18.280 1.00 43.49 C ATOM 672 CD GLU A 44 10.400 -13.401 -18.649 1.00 50.08 C ATOM 673 OE1 GLU A 44 11.273 -13.638 -17.775 1.00 47.73 O ATOM 674 OE2 GLU A 44 10.464 -13.858 -19.816 1.00 56.05 O ATOM 675 HA GLU A 44 7.623 -10.881 -17.038 1.00 0.00 H ATOM 676 HB2 GLU A 44 9.627 -12.462 -16.190 1.00 0.00 H ATOM 677 HB3 GLU A 44 8.465 -13.716 -16.685 1.00 0.00 H ATOM 678 HG2 GLU A 44 8.368 -12.766 -18.928 1.00 0.00 H ATOM 679 HG3 GLU A 44 9.486 -11.470 -18.441 1.00 0.00 H ATOM 680 H GLU A 44 7.840 -12.149 -14.307 1.00 0.00 H ATOM 681 N LEU A 45 5.241 -11.742 -16.986 1.00 21.35 N ATOM 682 CA LEU A 45 3.882 -12.277 -17.094 1.00 19.20 C ATOM 683 C LEU A 45 3.695 -12.935 -18.429 1.00 20.05 C ATOM 684 O LEU A 45 4.202 -12.452 -19.435 1.00 23.22 O ATOM 685 CB LEU A 45 2.859 -11.134 -16.957 1.00 19.74 C ATOM 686 CG LEU A 45 3.108 -10.259 -15.732 1.00 28.06 C ATOM 687 CD1 LEU A 45 2.371 -8.910 -15.806 1.00 26.27 C ATOM 688 CD2 LEU A 45 2.754 -11.041 -14.444 1.00 27.98 C ATOM 689 HA LEU A 45 3.730 -13.008 -16.300 1.00 0.00 H ATOM 690 HB2 LEU A 45 2.914 -10.509 -17.848 1.00 0.00 H ATOM 691 HB3 LEU A 45 1.862 -11.567 -16.879 1.00 0.00 H ATOM 692 HG LEU A 45 4.170 -10.013 -15.709 1.00 0.00 H ATOM 693 HD21 LEU A 45 1.703 -11.329 -14.473 1.00 0.00 H ATOM 694 HD22 LEU A 45 3.375 -11.934 -14.380 1.00 0.00 H ATOM 695 HD23 LEU A 45 2.935 -10.408 -13.575 1.00 0.00 H ATOM 696 HD11 LEU A 45 2.709 -8.360 -16.684 1.00 0.00 H ATOM 697 HD12 LEU A 45 1.298 -9.087 -15.878 1.00 0.00 H ATOM 698 HD13 LEU A 45 2.585 -8.331 -14.908 1.00 0.00 H ATOM 699 H LEU A 45 5.412 -10.746 -17.230 1.00 0.00 H ATOM 700 N ASN A 46 2.940 -14.017 -18.477 1.00 20.42 N ATOM 701 CA ASN A 46 2.541 -14.497 -19.769 1.00 25.41 C ATOM 702 C ASN A 46 1.201 -13.921 -20.222 1.00 24.81 C ATOM 703 O ASN A 46 0.405 -13.438 -19.415 1.00 23.48 O ATOM 704 CB ASN A 46 2.623 -16.024 -19.897 1.00 36.62 C ATOM 705 CG ASN A 46 1.783 -16.738 -18.896 1.00 41.55 C ATOM 706 OD1 ASN A 46 0.678 -16.317 -18.587 1.00 47.90 O ATOM 707 ND2 ASN A 46 2.291 -17.859 -18.393 1.00 43.88 N ATOM 708 HA ASN A 46 3.280 -14.114 -20.473 1.00 0.00 H ATOM 709 HB2 ASN A 46 2.290 -16.307 -20.896 1.00 0.00 H ATOM 710 HB3 ASN A 46 3.661 -16.329 -19.761 1.00 0.00 H ATOM 711 HD22 ASN A 46 3.236 -18.179 -18.686 1.00 0.00 H ATOM 712 HD21 ASN A 46 1.743 -18.416 -17.707 1.00 0.00 H ATOM 713 H ASN A 46 2.644 -14.505 -17.608 1.00 0.00 H ATOM 714 N GLU A 47 1.003 -13.937 -21.526 1.00 21.45 N ATOM 715 CA GLU A 47 -0.152 -13.353 -22.165 1.00 20.35 C ATOM 716 C GLU A 47 -1.464 -13.881 -21.558 1.00 16.30 C ATOM 717 O GLU A 47 -2.409 -13.125 -21.359 1.00 14.90 O ATOM 718 CB GLU A 47 -0.099 -13.691 -23.658 1.00 20.14 C ATOM 719 CG GLU A 47 -0.836 -12.767 -24.525 1.00 31.65 C ATOM 720 CD GLU A 47 -0.939 -13.288 -25.938 1.00 34.74 C ATOM 721 OE1 GLU A 47 -0.292 -14.305 -26.235 1.00 32.05 O ATOM 722 OE2 GLU A 47 -1.672 -12.682 -26.745 1.00 36.86 O ATOM 723 HA GLU A 47 -0.132 -12.274 -22.012 1.00 0.00 H ATOM 724 HB2 GLU A 47 0.946 -13.688 -23.970 1.00 0.00 H ATOM 725 HB3 GLU A 47 -0.515 -14.689 -23.795 1.00 0.00 H ATOM 726 HG2 GLU A 47 -1.841 -12.632 -24.124 1.00 0.00 H ATOM 727 HG3 GLU A 47 -0.319 -11.807 -24.539 1.00 0.00 H ATOM 728 H GLU A 47 1.718 -14.395 -22.126 1.00 0.00 H ATOM 729 N ALA A 48 -1.515 -15.188 -21.289 1.00 4.95 N ATOM 730 CA ALA A 48 -2.714 -15.814 -20.747 1.00 8.06 C ATOM 731 C ALA A 48 -3.036 -15.260 -19.364 1.00 11.00 C ATOM 732 O ALA A 48 -4.202 -15.038 -19.023 1.00 10.52 O ATOM 733 CB ALA A 48 -2.543 -17.351 -20.695 1.00 5.61 C ATOM 734 HA ALA A 48 -3.551 -15.582 -21.406 1.00 0.00 H ATOM 735 HB1 ALA A 48 -2.368 -17.730 -21.702 1.00 0.00 H ATOM 736 HB2 ALA A 48 -1.693 -17.599 -20.059 1.00 0.00 H ATOM 737 HB3 ALA A 48 -3.448 -17.802 -20.288 1.00 0.00 H ATOM 738 H ALA A 48 -0.676 -15.775 -21.471 1.00 0.00 H ATOM 739 N THR A 49 -1.995 -15.020 -18.573 1.00 12.20 N ATOM 740 CA THR A 49 -2.159 -14.433 -17.235 1.00 10.96 C ATOM 741 C THR A 49 -2.791 -13.052 -17.314 1.00 8.62 C ATOM 742 O THR A 49 -3.710 -12.734 -16.554 1.00 10.83 O ATOM 743 CB THR A 49 -0.798 -14.356 -16.475 1.00 14.26 C ATOM 744 OG1 THR A 49 -0.271 -15.684 -16.295 1.00 17.03 O ATOM 745 CG2 THR A 49 -0.973 -13.698 -15.111 1.00 19.47 C ATOM 746 HA THR A 49 -2.827 -15.089 -16.677 1.00 0.00 H ATOM 747 HB THR A 49 -0.108 -13.756 -17.067 1.00 0.00 H ATOM 748 HG1 THR A 49 -0.131 -16.105 -17.180 1.00 0.00 H ATOM 749 HG23 THR A 49 -1.372 -12.692 -15.243 1.00 0.00 H ATOM 750 HG21 THR A 49 -1.664 -14.289 -14.510 1.00 0.00 H ATOM 751 HG22 THR A 49 -0.007 -13.644 -14.608 1.00 0.00 H ATOM 752 H THR A 49 -1.039 -15.254 -18.910 1.00 0.00 H ATOM 753 N LEU A 50 -2.321 -12.227 -18.248 1.00 9.61 N ATOM 754 CA LEU A 50 -2.914 -10.906 -18.443 1.00 11.04 C ATOM 755 C LEU A 50 -4.371 -10.987 -18.843 1.00 10.17 C ATOM 756 O LEU A 50 -5.179 -10.175 -18.414 1.00 15.52 O ATOM 757 CB LEU A 50 -2.150 -10.109 -19.505 1.00 19.90 C ATOM 758 CG LEU A 50 -1.366 -8.924 -18.991 1.00 26.30 C ATOM 759 CD1 LEU A 50 -0.135 -9.425 -18.252 1.00 32.09 C ATOM 760 CD2 LEU A 50 -0.978 -8.039 -20.144 1.00 21.96 C ATOM 761 HA LEU A 50 -2.846 -10.396 -17.482 1.00 0.00 H ATOM 762 HB2 LEU A 50 -1.451 -10.787 -19.996 1.00 0.00 H ATOM 763 HB3 LEU A 50 -2.872 -9.743 -20.235 1.00 0.00 H ATOM 764 HG LEU A 50 -1.976 -8.340 -18.301 1.00 0.00 H ATOM 765 HD21 LEU A 50 -0.364 -8.605 -20.844 1.00 0.00 H ATOM 766 HD22 LEU A 50 -1.878 -7.688 -20.650 1.00 0.00 H ATOM 767 HD23 LEU A 50 -0.413 -7.185 -19.771 1.00 0.00 H ATOM 768 HD11 LEU A 50 -0.445 -10.051 -17.415 1.00 0.00 H ATOM 769 HD12 LEU A 50 0.484 -10.008 -18.934 1.00 0.00 H ATOM 770 HD13 LEU A 50 0.435 -8.574 -17.879 1.00 0.00 H ATOM 771 H LEU A 50 -1.524 -12.526 -18.845 1.00 0.00 H ATOM 772 N TYR A 51 -4.711 -11.934 -19.717 1.00 11.33 N ATOM 773 CA TYR A 51 -6.111 -12.053 -20.144 1.00 10.14 C ATOM 774 C TYR A 51 -7.022 -12.367 -18.979 1.00 11.02 C ATOM 775 O TYR A 51 -8.098 -11.765 -18.833 1.00 11.85 O ATOM 776 CB TYR A 51 -6.263 -13.082 -21.270 1.00 7.70 C ATOM 777 CG TYR A 51 -5.544 -12.651 -22.512 1.00 11.78 C ATOM 778 CD1 TYR A 51 -5.614 -11.332 -22.942 1.00 20.18 C ATOM 779 CD2 TYR A 51 -4.779 -13.534 -23.240 1.00 11.31 C ATOM 780 CE1 TYR A 51 -4.943 -10.903 -24.072 1.00 21.62 C ATOM 781 CE2 TYR A 51 -4.103 -13.117 -24.376 1.00 18.61 C ATOM 782 CZ TYR A 51 -4.197 -11.783 -24.778 1.00 18.57 C ATOM 783 OH TYR A 51 -3.548 -11.345 -25.894 1.00 25.38 O ATOM 784 HA TYR A 51 -6.416 -11.085 -20.541 1.00 0.00 H ATOM 785 HB3 TYR A 51 -7.322 -13.203 -21.498 1.00 0.00 H ATOM 786 HB2 TYR A 51 -5.853 -14.035 -20.936 1.00 0.00 H ATOM 787 HD2 TYR A 51 -4.704 -14.573 -22.919 1.00 0.00 H ATOM 788 HE2 TYR A 51 -3.504 -13.824 -24.950 1.00 0.00 H ATOM 789 HE1 TYR A 51 -5.015 -9.863 -24.392 1.00 0.00 H ATOM 790 HD1 TYR A 51 -6.212 -10.618 -22.375 1.00 0.00 H ATOM 791 HH TYR A 51 -2.574 -11.488 -25.786 1.00 0.00 H ATOM 792 H TYR A 51 -3.991 -12.583 -20.093 1.00 0.00 H ATOM 793 N THR A 52 -6.598 -13.297 -18.136 1.00 3.67 N ATOM 794 CA THR A 52 -7.377 -13.635 -16.945 1.00 6.36 C ATOM 795 C THR A 52 -7.581 -12.353 -16.100 1.00 8.57 C ATOM 796 O THR A 52 -8.716 -11.978 -15.764 1.00 3.75 O ATOM 797 CB THR A 52 -6.679 -14.719 -16.112 1.00 2.00 C ATOM 798 OG1 THR A 52 -6.617 -15.935 -16.868 1.00 6.98 O ATOM 799 CG2 THR A 52 -7.440 -14.974 -14.780 1.00 7.64 C ATOM 800 HA THR A 52 -8.343 -14.033 -17.254 1.00 0.00 H ATOM 801 HB THR A 52 -5.672 -14.377 -15.873 1.00 0.00 H ATOM 802 HG1 THR A 52 -6.107 -15.778 -17.702 1.00 0.00 H ATOM 803 HG23 THR A 52 -7.486 -14.048 -14.206 1.00 0.00 H ATOM 804 HG21 THR A 52 -8.451 -15.317 -15.000 1.00 0.00 H ATOM 805 HG22 THR A 52 -6.915 -15.735 -14.203 1.00 0.00 H ATOM 806 H THR A 52 -5.702 -13.792 -18.323 1.00 0.00 H ATOM 807 N ILE A 53 -6.484 -11.653 -15.823 1.00 9.34 N ATOM 808 CA ILE A 53 -6.550 -10.434 -15.024 1.00 5.51 C ATOM 809 C ILE A 53 -7.421 -9.346 -15.672 1.00 12.08 C ATOM 810 O ILE A 53 -8.241 -8.738 -15.009 1.00 13.94 O ATOM 811 CB ILE A 53 -5.148 -9.880 -14.732 1.00 9.75 C ATOM 812 CG1 ILE A 53 -4.384 -10.850 -13.836 1.00 7.14 C ATOM 813 CG2 ILE A 53 -5.253 -8.488 -14.086 1.00 7.69 C ATOM 814 CD1 ILE A 53 -2.835 -10.578 -13.725 1.00 11.82 C ATOM 815 HA ILE A 53 -7.023 -10.716 -14.083 1.00 0.00 H ATOM 816 HB ILE A 53 -4.598 -9.775 -15.667 1.00 0.00 H ATOM 817 HG12 ILE A 53 -4.810 -10.792 -12.834 1.00 0.00 H ATOM 818 HG13 ILE A 53 -4.523 -11.856 -14.231 1.00 0.00 H ATOM 819 HD11 ILE A 53 -2.384 -10.646 -14.715 1.00 0.00 H ATOM 820 HD12 ILE A 53 -2.671 -9.581 -13.317 1.00 0.00 H ATOM 821 HD13 ILE A 53 -2.383 -11.320 -13.067 1.00 0.00 H ATOM 822 HG21 ILE A 53 -5.771 -7.811 -14.766 1.00 0.00 H ATOM 823 HG22 ILE A 53 -5.810 -8.563 -13.152 1.00 0.00 H ATOM 824 HG23 ILE A 53 -4.252 -8.106 -13.884 1.00 0.00 H ATOM 825 H ILE A 53 -5.564 -11.980 -16.182 1.00 0.00 H ATOM 826 N PHE A 54 -7.229 -9.111 -16.975 1.00 12.15 N ATOM 827 CA PHE A 54 -7.940 -8.023 -17.697 1.00 8.56 C ATOM 828 C PHE A 54 -9.422 -8.301 -17.912 1.00 13.18 C ATOM 829 O PHE A 54 -10.223 -7.370 -17.990 1.00 15.58 O ATOM 830 CB PHE A 54 -7.270 -7.764 -19.068 1.00 14.15 C ATOM 831 CG PHE A 54 -6.006 -6.927 -18.981 1.00 11.72 C ATOM 832 CD1 PHE A 54 -5.506 -6.537 -17.751 1.00 8.24 C ATOM 833 CD2 PHE A 54 -5.329 -6.540 -20.131 1.00 15.81 C ATOM 834 CE1 PHE A 54 -4.368 -5.756 -17.661 1.00 15.40 C ATOM 835 CE2 PHE A 54 -4.176 -5.770 -20.051 1.00 11.58 C ATOM 836 CZ PHE A 54 -3.693 -5.382 -18.814 1.00 14.49 C ATOM 837 HA PHE A 54 -7.867 -7.142 -17.059 1.00 0.00 H ATOM 838 HB2 PHE A 54 -7.016 -8.725 -19.515 1.00 0.00 H ATOM 839 HB3 PHE A 54 -7.984 -7.245 -19.708 1.00 0.00 H ATOM 840 HD2 PHE A 54 -5.707 -6.844 -21.107 1.00 0.00 H ATOM 841 HE2 PHE A 54 -3.653 -5.472 -20.960 1.00 0.00 H ATOM 842 HZ PHE A 54 -2.784 -4.784 -18.745 1.00 0.00 H ATOM 843 HE1 PHE A 54 -4.002 -5.435 -16.686 1.00 0.00 H ATOM 844 HD1 PHE A 54 -6.016 -6.850 -16.840 1.00 0.00 H ATOM 845 H PHE A 54 -6.560 -9.709 -17.500 1.00 0.00 H ATOM 846 N LYS A 55 -9.788 -9.581 -18.062 1.00 6.09 N ATOM 847 CA LYS A 55 -11.198 -9.956 -18.228 1.00 8.16 C ATOM 848 C LYS A 55 -11.983 -9.515 -16.986 1.00 11.03 C ATOM 849 O LYS A 55 -13.092 -8.961 -17.075 1.00 13.68 O ATOM 850 CB LYS A 55 -11.340 -11.500 -18.436 1.00 9.85 C ATOM 851 CG LYS A 55 -12.801 -12.006 -18.397 1.00 6.69 C ATOM 852 CD LYS A 55 -12.864 -13.511 -18.240 1.00 15.12 C ATOM 853 CE LYS A 55 -14.067 -13.934 -17.417 1.00 28.20 C ATOM 854 NZ LYS A 55 -15.329 -13.366 -17.945 1.00 30.74 N ATOM 855 HA LYS A 55 -11.598 -9.459 -19.112 1.00 0.00 H ATOM 856 HB2 LYS A 55 -10.913 -11.757 -19.406 1.00 0.00 H ATOM 857 HB3 LYS A 55 -10.780 -12.005 -17.649 1.00 0.00 H ATOM 858 HG2 LYS A 55 -13.315 -11.540 -17.556 1.00 0.00 H ATOM 859 HG3 LYS A 55 -13.298 -11.725 -19.326 1.00 0.00 H ATOM 860 HD2 LYS A 55 -12.931 -13.968 -19.227 1.00 0.00 H ATOM 861 HD3 LYS A 55 -11.956 -13.854 -17.743 1.00 0.00 H ATOM 862 HE2 LYS A 55 -13.929 -13.593 -16.391 1.00 0.00 H ATOM 863 HE3 LYS A 55 -14.138 -15.022 -17.430 1.00 0.00 H ATOM 864 HZ1 LYS A 55 -15.274 -12.328 -17.930 1.00 0.00 H ATOM 865 HZ2 LYS A 55 -15.473 -13.692 -18.922 1.00 0.00 H ATOM 866 HZ3 LYS A 55 -16.124 -13.681 -17.353 1.00 0.00 H ATOM 867 H LYS A 55 -9.060 -10.323 -18.061 1.00 0.00 H ATOM 868 N ARG A 56 -11.391 -9.753 -15.834 1.00 6.11 N ATOM 869 CA ARG A 56 -11.997 -9.385 -14.562 1.00 5.28 C ATOM 870 C ARG A 56 -12.005 -7.838 -14.362 1.00 11.99 C ATOM 871 O ARG A 56 -13.017 -7.263 -13.935 1.00 3.30 O ATOM 872 CB ARG A 56 -11.260 -10.114 -13.427 1.00 11.51 C ATOM 873 CG ARG A 56 -11.415 -9.511 -12.034 1.00 20.07 C ATOM 874 CD ARG A 56 -12.778 -9.739 -11.471 1.00 25.33 C ATOM 875 NE ARG A 56 -12.922 -9.053 -10.191 1.00 40.67 N ATOM 876 CZ ARG A 56 -14.013 -9.097 -9.431 1.00 46.39 C ATOM 877 NH1 ARG A 56 -15.069 -9.802 -9.823 1.00 51.60 N ATOM 878 NH2 ARG A 56 -14.052 -8.432 -8.275 1.00 46.65 N ATOM 879 HA ARG A 56 -13.042 -9.696 -14.554 1.00 0.00 H ATOM 880 HB2 ARG A 56 -11.632 -11.138 -13.391 1.00 0.00 H ATOM 881 HB3 ARG A 56 -10.198 -10.123 -13.671 1.00 0.00 H ATOM 882 HG2 ARG A 56 -10.680 -9.966 -11.370 1.00 0.00 H ATOM 883 HG3 ARG A 56 -11.234 -8.438 -12.093 1.00 0.00 H ATOM 884 HD2 ARG A 56 -12.932 -10.808 -11.325 1.00 0.00 H ATOM 885 HD3 ARG A 56 -13.523 -9.358 -12.169 1.00 0.00 H ATOM 886 HE ARG A 56 -12.116 -8.491 -9.849 1.00 0.00 H ATOM 887 HH12 ARG A 56 -15.922 -9.836 -9.228 1.00 0.00 H ATOM 888 HH11 ARG A 56 -15.043 -10.320 -10.725 1.00 0.00 H ATOM 889 HH22 ARG A 56 -14.906 -8.468 -7.683 1.00 0.00 H ATOM 890 HH21 ARG A 56 -13.228 -7.877 -7.966 1.00 0.00 H ATOM 891 H ARG A 56 -10.461 -10.219 -15.833 1.00 0.00 H ATOM 892 N LEU A 57 -10.890 -7.168 -14.706 1.00 8.06 N ATOM 893 CA LEU A 57 -10.810 -5.692 -14.560 1.00 10.28 C ATOM 894 C LEU A 57 -11.803 -5.030 -15.479 1.00 10.84 C ATOM 895 O LEU A 57 -12.395 -4.018 -15.146 1.00 10.60 O ATOM 896 CB LEU A 57 -9.391 -5.187 -14.872 1.00 2.56 C ATOM 897 CG LEU A 57 -8.348 -5.501 -13.816 1.00 4.81 C ATOM 898 CD1 LEU A 57 -6.993 -4.997 -14.282 1.00 7.74 C ATOM 899 CD2 LEU A 57 -8.764 -4.810 -12.497 1.00 2.64 C ATOM 900 HA LEU A 57 -11.047 -5.436 -13.527 1.00 0.00 H ATOM 901 HB2 LEU A 57 -9.070 -5.641 -15.810 1.00 0.00 H ATOM 902 HB3 LEU A 57 -9.436 -4.104 -14.991 1.00 0.00 H ATOM 903 HG LEU A 57 -8.278 -6.576 -13.653 1.00 0.00 H ATOM 904 HD21 LEU A 57 -8.822 -3.733 -12.655 1.00 0.00 H ATOM 905 HD22 LEU A 57 -9.738 -5.186 -12.183 1.00 0.00 H ATOM 906 HD23 LEU A 57 -8.024 -5.026 -11.726 1.00 0.00 H ATOM 907 HD11 LEU A 57 -6.726 -5.489 -15.217 1.00 0.00 H ATOM 908 HD12 LEU A 57 -7.042 -3.919 -14.438 1.00 0.00 H ATOM 909 HD13 LEU A 57 -6.243 -5.222 -13.524 1.00 0.00 H ATOM 910 H LEU A 57 -10.072 -7.691 -15.079 1.00 0.00 H ATOM 911 N GLU A 58 -11.961 -5.593 -16.663 1.00 11.35 N ATOM 912 CA GLU A 58 -12.942 -5.086 -17.616 1.00 16.20 C ATOM 913 C GLU A 58 -14.393 -5.355 -17.159 1.00 16.49 C ATOM 914 O GLU A 58 -15.261 -4.472 -17.219 1.00 13.02 O ATOM 915 CB GLU A 58 -12.700 -5.692 -18.995 1.00 21.39 C ATOM 916 CG GLU A 58 -13.684 -5.218 -20.047 1.00 40.17 C ATOM 917 CD GLU A 58 -13.071 -5.202 -21.453 1.00 51.31 C ATOM 918 OE1 GLU A 58 -12.005 -5.854 -21.648 1.00 49.15 O ATOM 919 OE2 GLU A 58 -13.650 -4.528 -22.356 1.00 57.16 O ATOM 920 HA GLU A 58 -12.815 -4.005 -17.669 1.00 0.00 H ATOM 921 HB2 GLU A 58 -11.694 -5.424 -19.318 1.00 0.00 H ATOM 922 HB3 GLU A 58 -12.777 -6.776 -18.914 1.00 0.00 H ATOM 923 HG2 GLU A 58 -14.546 -5.886 -20.048 1.00 0.00 H ATOM 924 HG3 GLU A 58 -14.008 -4.209 -19.794 1.00 0.00 H ATOM 925 H GLU A 58 -11.375 -6.413 -16.921 1.00 0.00 H ATOM 926 N LYS A 59 -14.656 -6.558 -16.692 1.00 9.75 N ATOM 927 CA LYS A 59 -15.977 -6.845 -16.125 1.00 8.62 C ATOM 928 C LYS A 59 -16.297 -5.841 -15.005 1.00 8.26 C ATOM 929 O LYS A 59 -17.452 -5.443 -14.814 1.00 6.26 O ATOM 930 CB LYS A 59 -16.030 -8.275 -15.590 1.00 13.42 C ATOM 931 CG LYS A 59 -17.404 -8.748 -15.202 1.00 21.49 C ATOM 932 CD LYS A 59 -17.343 -10.172 -14.665 1.00 30.41 C ATOM 933 CE LYS A 59 -16.371 -10.267 -13.479 1.00 37.35 C ATOM 934 NZ LYS A 59 -16.705 -9.275 -12.389 1.00 38.21 N ATOM 935 HA LYS A 59 -16.725 -6.746 -16.911 1.00 0.00 H ATOM 936 HB2 LYS A 59 -15.646 -8.942 -16.362 1.00 0.00 H ATOM 937 HB3 LYS A 59 -15.389 -8.333 -14.710 1.00 0.00 H ATOM 938 HG2 LYS A 59 -17.806 -8.090 -14.432 1.00 0.00 H ATOM 939 HG3 LYS A 59 -18.054 -8.721 -16.077 1.00 0.00 H ATOM 940 HD2 LYS A 59 -18.338 -10.473 -14.337 1.00 0.00 H ATOM 941 HD3 LYS A 59 -17.006 -10.839 -15.458 1.00 0.00 H ATOM 942 HE2 LYS A 59 -15.360 -10.070 -13.836 1.00 0.00 H ATOM 943 HE3 LYS A 59 -16.419 -11.274 -13.065 1.00 0.00 H ATOM 944 HZ1 LYS A 59 -16.655 -8.310 -12.773 1.00 0.00 H ATOM 945 HZ2 LYS A 59 -17.666 -9.460 -12.037 1.00 0.00 H ATOM 946 HZ3 LYS A 59 -16.023 -9.375 -11.610 1.00 0.00 H ATOM 947 H LYS A 59 -13.929 -7.301 -16.725 1.00 0.00 H ATOM 948 N ASP A 60 -15.267 -5.431 -14.272 1.00 8.35 N ATOM 949 CA ASP A 60 -15.449 -4.519 -13.138 1.00 9.29 C ATOM 950 C ASP A 60 -15.472 -3.066 -13.550 1.00 8.89 C ATOM 951 O ASP A 60 -15.600 -2.206 -12.724 1.00 5.94 O ATOM 952 CB ASP A 60 -14.367 -4.734 -12.113 1.00 11.70 C ATOM 953 CG ASP A 60 -14.562 -6.025 -11.326 1.00 21.36 C ATOM 954 OD1 ASP A 60 -15.712 -6.520 -11.271 1.00 18.65 O ATOM 955 OD2 ASP A 60 -13.566 -6.543 -10.771 1.00 24.57 O ATOM 956 HA ASP A 60 -16.423 -4.751 -12.708 1.00 0.00 H ATOM 957 HB2 ASP A 60 -13.405 -4.776 -12.623 1.00 0.00 H ATOM 958 HB3 ASP A 60 -14.372 -3.895 -11.417 1.00 0.00 H ATOM 959 H ASP A 60 -14.311 -5.764 -14.508 1.00 0.00 H ATOM 960 N GLY A 61 -15.320 -2.807 -14.839 1.00 10.05 N ATOM 961 CA GLY A 61 -15.438 -1.450 -15.364 1.00 12.57 C ATOM 962 C GLY A 61 -14.196 -0.628 -15.117 1.00 12.58 C ATOM 963 O GLY A 61 -14.234 0.592 -15.200 1.00 10.10 O ATOM 964 HA3 GLY A 61 -16.284 -0.960 -14.882 1.00 0.00 H ATOM 965 HA2 GLY A 61 -15.615 -1.504 -16.438 1.00 0.00 H ATOM 966 H GLY A 61 -15.112 -3.588 -15.493 1.00 0.00 H ATOM 967 N ILE A 62 -13.082 -1.303 -14.825 1.00 10.41 N ATOM 968 CA ILE A 62 -11.825 -0.599 -14.447 1.00 11.45 C ATOM 969 C ILE A 62 -10.969 -0.264 -15.696 1.00 13.04 C ATOM 970 O ILE A 62 -10.287 0.756 -15.737 1.00 11.66 O ATOM 971 CB ILE A 62 -10.989 -1.421 -13.422 1.00 2.49 C ATOM 972 CG1 ILE A 62 -11.806 -1.670 -12.160 1.00 6.63 C ATOM 973 CG2 ILE A 62 -9.665 -0.672 -13.034 1.00 3.13 C ATOM 974 CD1 ILE A 62 -12.239 -0.403 -11.484 1.00 2.25 C ATOM 975 HA ILE A 62 -12.117 0.336 -13.969 1.00 0.00 H ATOM 976 HB ILE A 62 -10.730 -2.370 -13.892 1.00 0.00 H ATOM 977 HG12 ILE A 62 -12.694 -2.242 -12.428 1.00 0.00 H ATOM 978 HG13 ILE A 62 -11.200 -2.247 -11.462 1.00 0.00 H ATOM 979 HD11 ILE A 62 -11.359 0.175 -11.202 1.00 0.00 H ATOM 980 HD12 ILE A 62 -12.855 0.180 -12.169 1.00 0.00 H ATOM 981 HD13 ILE A 62 -12.816 -0.647 -10.592 1.00 0.00 H ATOM 982 HG21 ILE A 62 -9.062 -0.516 -13.928 1.00 0.00 H ATOM 983 HG22 ILE A 62 -9.911 0.291 -12.588 1.00 0.00 H ATOM 984 HG23 ILE A 62 -9.106 -1.273 -12.317 1.00 0.00 H ATOM 985 H ILE A 62 -13.092 -2.342 -14.862 1.00 0.00 H ATOM 986 N ILE A 63 -11.015 -1.153 -16.689 1.00 15.05 N ATOM 987 CA ILE A 63 -10.331 -0.954 -17.963 1.00 10.97 C ATOM 988 C ILE A 63 -11.307 -1.301 -19.080 1.00 11.79 C ATOM 989 O ILE A 63 -12.376 -1.887 -18.824 1.00 14.41 O ATOM 990 CB ILE A 63 -9.095 -1.877 -18.109 1.00 9.90 C ATOM 991 CG1 ILE A 63 -9.527 -3.347 -18.188 1.00 13.17 C ATOM 992 CG2 ILE A 63 -8.117 -1.663 -16.977 1.00 5.16 C ATOM 993 CD1 ILE A 63 -8.385 -4.294 -18.506 1.00 11.74 C ATOM 994 HA ILE A 63 -9.995 0.082 -18.012 1.00 0.00 H ATOM 995 HB ILE A 63 -8.588 -1.618 -19.038 1.00 0.00 H ATOM 996 HG12 ILE A 63 -9.957 -3.633 -17.228 1.00 0.00 H ATOM 997 HG13 ILE A 63 -10.284 -3.444 -18.967 1.00 0.00 H ATOM 998 HD11 ILE A 63 -7.951 -4.027 -19.470 1.00 0.00 H ATOM 999 HD12 ILE A 63 -7.624 -4.217 -17.730 1.00 0.00 H ATOM 1000 HD13 ILE A 63 -8.762 -5.316 -18.546 1.00 0.00 H ATOM 1001 HG21 ILE A 63 -7.780 -0.626 -16.981 1.00 0.00 H ATOM 1002 HG22 ILE A 63 -8.607 -1.884 -16.029 1.00 0.00 H ATOM 1003 HG23 ILE A 63 -7.261 -2.325 -17.108 1.00 0.00 H ATOM 1004 H ILE A 63 -11.562 -2.026 -16.550 1.00 0.00 H ATOM 1005 N SER A 64 -10.986 -0.880 -20.307 1.00 9.65 N ATOM 1006 CA SER A 64 -11.701 -1.369 -21.497 1.00 12.61 C ATOM 1007 C SER A 64 -10.685 -1.541 -22.606 1.00 8.98 C ATOM 1008 O SER A 64 -9.498 -1.277 -22.404 1.00 13.96 O ATOM 1009 CB SER A 64 -12.825 -0.413 -21.927 1.00 14.44 C ATOM 1010 OG SER A 64 -12.298 0.784 -22.536 1.00 17.50 O ATOM 1011 HA SER A 64 -12.182 -2.319 -21.266 1.00 0.00 H ATOM 1012 HB2 SER A 64 -13.410 -0.136 -21.050 1.00 0.00 H ATOM 1013 HB3 SER A 64 -13.468 -0.922 -22.645 1.00 0.00 H ATOM 1014 HG SER A 64 -11.770 0.540 -23.337 1.00 0.00 H ATOM 1015 H SER A 64 -10.215 -0.192 -20.424 1.00 0.00 H ATOM 1016 N SER A 65 -11.146 -1.989 -23.776 1.00 9.68 N ATOM 1017 CA SER A 65 -10.255 -2.274 -24.900 1.00 16.58 C ATOM 1018 C SER A 65 -10.854 -1.763 -26.208 1.00 13.64 C ATOM 1019 O SER A 65 -12.064 -1.577 -26.322 1.00 8.58 O ATOM 1020 CB SER A 65 -9.990 -3.782 -25.008 1.00 19.39 C ATOM 1021 OG SER A 65 -11.208 -4.499 -25.121 1.00 19.10 O ATOM 1022 HA SER A 65 -9.312 -1.759 -24.720 1.00 0.00 H ATOM 1023 HB2 SER A 65 -9.459 -4.117 -24.117 1.00 0.00 H ATOM 1024 HB3 SER A 65 -9.378 -3.976 -25.889 1.00 0.00 H ATOM 1025 HG SER A 65 -11.014 -5.467 -25.189 1.00 0.00 H ATOM 1026 H SER A 65 -12.169 -2.140 -23.891 1.00 0.00 H ATOM 1027 N TYR A 66 -10.002 -1.530 -27.190 1.00 7.99 N ATOM 1028 CA TYR A 66 -10.459 -1.083 -28.487 1.00 5.17 C ATOM 1029 C TYR A 66 -9.352 -1.371 -29.449 1.00 2.00 C ATOM 1030 O TYR A 66 -8.234 -1.646 -29.029 1.00 5.99 O ATOM 1031 CB TYR A 66 -10.772 0.432 -28.458 1.00 4.99 C ATOM 1032 CG TYR A 66 -9.580 1.284 -28.137 1.00 2.00 C ATOM 1033 CD1 TYR A 66 -9.161 1.451 -26.826 1.00 2.00 C ATOM 1034 CD2 TYR A 66 -8.861 1.922 -29.145 1.00 2.59 C ATOM 1035 CE1 TYR A 66 -8.075 2.208 -26.527 1.00 2.18 C ATOM 1036 CE2 TYR A 66 -7.771 2.679 -28.854 1.00 2.00 C ATOM 1037 CZ TYR A 66 -7.384 2.832 -27.527 1.00 3.45 C ATOM 1038 OH TYR A 66 -6.281 3.617 -27.206 1.00 3.98 O ATOM 1039 HA TYR A 66 -11.376 -1.595 -28.779 1.00 0.00 H ATOM 1040 HB3 TYR A 66 -11.538 0.612 -27.704 1.00 0.00 H ATOM 1041 HB2 TYR A 66 -11.152 0.725 -29.437 1.00 0.00 H ATOM 1042 HD2 TYR A 66 -9.177 1.812 -30.182 1.00 0.00 H ATOM 1043 HE2 TYR A 66 -7.206 3.161 -29.652 1.00 0.00 H ATOM 1044 HE1 TYR A 66 -7.755 2.318 -25.491 1.00 0.00 H ATOM 1045 HD1 TYR A 66 -9.713 0.966 -26.021 1.00 0.00 H ATOM 1046 HH TYR A 66 -6.150 3.615 -26.225 1.00 0.00 H ATOM 1047 H TYR A 66 -8.984 -1.671 -27.028 1.00 0.00 H ATOM 1048 N TRP A 67 -9.650 -1.305 -30.744 1.00 3.61 N ATOM 1049 CA TRP A 67 -8.664 -1.601 -31.798 1.00 3.30 C ATOM 1050 C TRP A 67 -7.803 -0.390 -32.191 1.00 9.41 C ATOM 1051 O TRP A 67 -8.312 0.711 -32.348 1.00 7.60 O ATOM 1052 CB TRP A 67 -9.376 -2.160 -33.043 1.00 11.65 C ATOM 1053 CG TRP A 67 -9.849 -3.526 -32.833 1.00 22.13 C ATOM 1054 CD1 TRP A 67 -11.121 -3.919 -32.565 1.00 25.42 C ATOM 1055 CD2 TRP A 67 -9.041 -4.710 -32.789 1.00 26.42 C ATOM 1056 NE1 TRP A 67 -11.164 -5.277 -32.378 1.00 30.49 N ATOM 1057 CE2 TRP A 67 -9.894 -5.784 -32.508 1.00 32.22 C ATOM 1058 CE3 TRP A 67 -7.672 -4.961 -32.972 1.00 24.10 C ATOM 1059 CZ2 TRP A 67 -9.431 -7.096 -32.409 1.00 32.35 C ATOM 1060 CZ3 TRP A 67 -7.218 -6.257 -32.879 1.00 27.85 C ATOM 1061 CH2 TRP A 67 -8.091 -7.309 -32.596 1.00 30.34 C ATOM 1062 HA TRP A 67 -7.984 -2.345 -31.383 1.00 0.00 H ATOM 1063 HB2 TRP A 67 -10.229 -1.523 -33.277 1.00 0.00 H ATOM 1064 HB3 TRP A 67 -8.679 -2.153 -33.881 1.00 0.00 H ATOM 1065 HE1 TRP A 67 -12.019 -5.832 -32.171 1.00 0.00 H ATOM 1066 HD1 TRP A 67 -11.982 -3.253 -32.507 1.00 0.00 H ATOM 1067 HZ2 TRP A 67 -10.110 -7.920 -32.191 1.00 0.00 H ATOM 1068 HH2 TRP A 67 -7.697 -8.323 -32.522 1.00 0.00 H ATOM 1069 HZ3 TRP A 67 -6.159 -6.466 -33.029 1.00 0.00 H ATOM 1070 HE3 TRP A 67 -6.981 -4.145 -33.184 1.00 0.00 H ATOM 1071 H TRP A 67 -10.615 -1.034 -31.023 1.00 0.00 H ATOM 1072 N GLY A 68 -6.500 -0.615 -32.351 1.00 2.00 N ATOM 1073 CA GLY A 68 -5.602 0.390 -32.894 1.00 12.94 C ATOM 1074 C GLY A 68 -5.698 0.417 -34.409 1.00 19.94 C ATOM 1075 O GLY A 68 -6.728 0.047 -34.970 1.00 25.00 O ATOM 1076 HA3 GLY A 68 -4.579 0.154 -32.602 1.00 0.00 H ATOM 1077 HA2 GLY A 68 -5.875 1.368 -32.498 1.00 0.00 H ATOM 1078 H GLY A 68 -6.112 -1.541 -32.078 1.00 0.00 H ATOM 1079 N ASP A 69 -4.628 0.855 -35.078 1.00 31.11 N ATOM 1080 CA ASP A 69 -4.626 0.937 -36.558 1.00 35.39 C ATOM 1081 C ASP A 69 -3.301 0.539 -37.218 1.00 37.74 C ATOM 1082 O ASP A 69 -2.352 0.124 -36.550 1.00 36.84 O ATOM 1083 CB ASP A 69 -5.042 2.335 -37.030 1.00 39.15 C ATOM 1084 CG ASP A 69 -6.541 2.459 -37.237 1.00 41.34 C ATOM 1085 OD1 ASP A 69 -7.233 1.409 -37.252 1.00 39.87 O ATOM 1086 OD2 ASP A 69 -7.028 3.605 -37.390 1.00 41.72 O ATOM 1087 HA ASP A 69 -5.359 0.197 -36.880 1.00 0.00 H ATOM 1088 HB2 ASP A 69 -4.731 3.064 -36.281 1.00 0.00 H ATOM 1089 HB3 ASP A 69 -4.540 2.549 -37.974 1.00 0.00 H ATOM 1090 H ASP A 69 -3.780 1.144 -34.550 1.00 0.00 H ATOM 1091 N GLU A 70 -3.258 0.671 -38.542 1.00 42.97 N ATOM 1092 CA GLU A 70 -2.050 0.399 -39.317 1.00 46.90 C ATOM 1093 C GLU A 70 -2.096 -0.978 -39.974 1.00 49.71 C ATOM 1094 O GLU A 70 -3.098 -1.688 -39.882 1.00 53.34 O ATOM 1095 CB GLU A 70 -0.802 0.526 -38.440 1.00 48.27 C ATOM 1096 CG GLU A 70 0.497 0.497 -39.220 1.00 47.98 C ATOM 1097 CD GLU A 70 0.508 1.500 -40.360 1.00 49.29 C ATOM 1098 OE1 GLU A 70 -0.045 2.606 -40.188 1.00 50.81 O ATOM 1099 OE2 GLU A 70 1.063 1.179 -41.429 1.00 47.82 O ATOM 1100 HA GLU A 70 -2.001 1.145 -40.110 1.00 0.00 H ATOM 1101 HB2 GLU A 70 -0.857 1.470 -37.898 1.00 0.00 H ATOM 1102 HB3 GLU A 70 -0.795 -0.300 -37.729 1.00 0.00 H ATOM 1103 HG2 GLU A 70 1.319 0.728 -38.542 1.00 0.00 H ATOM 1104 HG3 GLU A 70 0.637 -0.503 -39.631 1.00 0.00 H ATOM 1105 H GLU A 70 -4.116 0.979 -39.043 1.00 0.00 H TER 1106 GLU A 70 ATOM 1107 N GLY A 74 -2.068 -4.725 -39.787 1.00 29.40 N ATOM 1108 CA GLY A 74 -2.864 -5.530 -38.866 1.00 25.42 C ATOM 1109 C GLY A 74 -3.047 -4.854 -37.517 1.00 29.76 C ATOM 1110 O GLY A 74 -2.083 -4.639 -36.788 1.00 31.62 O ATOM 1111 HA3 GLY A 74 -2.364 -6.486 -38.714 1.00 0.00 H ATOM 1112 HA2 GLY A 74 -3.845 -5.701 -39.308 1.00 0.00 H ATOM 1113 HN3 GLY A 74 -1.126 -4.562 -39.378 1.00 0.00 H ATOM 1114 HN2 GLY A 74 -2.541 -3.812 -39.945 1.00 0.00 H ATOM 1115 HN1 GLY A 74 -1.972 -5.229 -40.692 1.00 0.00 H ATOM 1116 N ARG A 75 -4.293 -4.539 -37.181 1.00 27.18 N ATOM 1117 CA ARG A 75 -4.612 -3.794 -35.967 1.00 25.81 C ATOM 1118 C ARG A 75 -4.199 -4.525 -34.673 1.00 26.50 C ATOM 1119 O ARG A 75 -4.205 -5.757 -34.615 1.00 27.30 O ATOM 1120 CB ARG A 75 -6.104 -3.493 -35.935 1.00 25.98 C ATOM 1121 CG ARG A 75 -6.673 -3.146 -37.295 1.00 30.46 C ATOM 1122 CD ARG A 75 -8.140 -3.488 -37.374 1.00 34.82 C ATOM 1123 NE ARG A 75 -8.989 -2.432 -36.829 1.00 39.93 N ATOM 1124 CZ ARG A 75 -10.284 -2.583 -36.556 1.00 43.91 C ATOM 1125 NH1 ARG A 75 -10.873 -3.763 -36.761 1.00 46.32 N ATOM 1126 NH2 ARG A 75 -10.993 -1.563 -36.069 1.00 42.36 N ATOM 1127 HA ARG A 75 -4.033 -2.871 -36.000 1.00 0.00 H ATOM 1128 HB2 ARG A 75 -6.626 -4.371 -35.554 1.00 0.00 H ATOM 1129 HB3 ARG A 75 -6.273 -2.651 -35.263 1.00 0.00 H ATOM 1130 HG2 ARG A 75 -6.546 -2.078 -37.472 1.00 0.00 H ATOM 1131 HG3 ARG A 75 -6.135 -3.706 -38.060 1.00 0.00 H ATOM 1132 HD2 ARG A 75 -8.317 -4.405 -36.811 1.00 0.00 H ATOM 1133 HD3 ARG A 75 -8.407 -3.647 -38.419 1.00 0.00 H ATOM 1134 HE ARG A 75 -8.556 -1.505 -36.643 1.00 0.00 H ATOM 1135 HH12 ARG A 75 -11.884 -3.883 -36.549 1.00 0.00 H ATOM 1136 HH11 ARG A 75 -10.321 -4.562 -37.133 1.00 0.00 H ATOM 1137 HH22 ARG A 75 -12.004 -1.686 -35.858 1.00 0.00 H ATOM 1138 HH21 ARG A 75 -10.535 -0.645 -35.901 1.00 0.00 H ATOM 1139 H ARG A 75 -5.070 -4.834 -37.806 1.00 0.00 H ATOM 1140 N ARG A 76 -3.842 -3.746 -33.642 1.00 22.74 N ATOM 1141 CA ARG A 76 -3.585 -4.282 -32.299 1.00 14.68 C ATOM 1142 C ARG A 76 -4.717 -3.910 -31.382 1.00 13.07 C ATOM 1143 O ARG A 76 -5.436 -2.933 -31.623 1.00 17.09 O ATOM 1144 CB ARG A 76 -2.288 -3.723 -31.729 1.00 19.33 C ATOM 1145 CG ARG A 76 -1.054 -4.321 -32.293 1.00 23.66 C ATOM 1146 CD ARG A 76 0.148 -3.516 -31.892 1.00 32.26 C ATOM 1147 NE ARG A 76 1.374 -4.059 -32.468 1.00 47.73 N ATOM 1148 CZ ARG A 76 2.566 -3.473 -32.382 1.00 53.97 C ATOM 1149 NH1 ARG A 76 2.695 -2.312 -31.743 1.00 56.32 N ATOM 1150 NH2 ARG A 76 3.631 -4.046 -32.938 1.00 55.74 N ATOM 1151 HA ARG A 76 -3.501 -5.366 -32.376 1.00 0.00 H ATOM 1152 HB2 ARG A 76 -2.266 -2.651 -31.924 1.00 0.00 H ATOM 1153 HB3 ARG A 76 -2.288 -3.895 -30.653 1.00 0.00 H ATOM 1154 HG2 ARG A 76 -0.945 -5.339 -31.920 1.00 0.00 H ATOM 1155 HG3 ARG A 76 -1.128 -4.339 -33.380 1.00 0.00 H ATOM 1156 HD2 ARG A 76 0.233 -3.524 -30.805 1.00 0.00 H ATOM 1157 HD3 ARG A 76 0.019 -2.490 -32.237 1.00 0.00 H ATOM 1158 HE ARG A 76 1.312 -4.963 -32.979 1.00 0.00 H ATOM 1159 HH12 ARG A 76 3.627 -1.856 -31.677 1.00 0.00 H ATOM 1160 HH11 ARG A 76 1.864 -1.862 -31.310 1.00 0.00 H ATOM 1161 HH22 ARG A 76 4.562 -3.588 -32.871 1.00 0.00 H ATOM 1162 HH21 ARG A 76 3.532 -4.952 -33.440 1.00 0.00 H ATOM 1163 H ARG A 76 -3.743 -2.723 -33.799 1.00 0.00 H ATOM 1164 N LYS A 77 -4.870 -4.660 -30.309 1.00 9.99 N ATOM 1165 CA LYS A 77 -5.902 -4.376 -29.348 1.00 18.09 C ATOM 1166 C LYS A 77 -5.275 -3.616 -28.213 1.00 22.00 C ATOM 1167 O LYS A 77 -4.295 -4.083 -27.618 1.00 15.39 O ATOM 1168 CB LYS A 77 -6.534 -5.670 -28.832 1.00 15.65 C ATOM 1169 CG LYS A 77 -7.826 -5.474 -28.053 1.00 16.97 C ATOM 1170 CD LYS A 77 -8.238 -6.758 -27.360 1.00 28.10 C ATOM 1171 CE LYS A 77 -9.763 -6.834 -27.153 1.00 36.68 C ATOM 1172 NZ LYS A 77 -10.512 -6.544 -28.427 1.00 36.98 N ATOM 1173 HA LYS A 77 -6.692 -3.787 -29.813 1.00 0.00 H ATOM 1174 HB2 LYS A 77 -6.746 -6.311 -29.688 1.00 0.00 H ATOM 1175 HB3 LYS A 77 -5.814 -6.164 -28.179 1.00 0.00 H ATOM 1176 HG2 LYS A 77 -7.678 -4.696 -27.305 1.00 0.00 H ATOM 1177 HG3 LYS A 77 -8.615 -5.170 -28.740 1.00 0.00 H ATOM 1178 HD2 LYS A 77 -7.922 -7.605 -27.969 1.00 0.00 H ATOM 1179 HD3 LYS A 77 -7.747 -6.808 -26.388 1.00 0.00 H ATOM 1180 HE2 LYS A 77 -10.054 -6.104 -26.397 1.00 0.00 H ATOM 1181 HE3 LYS A 77 -10.024 -7.835 -26.809 1.00 0.00 H ATOM 1182 HZ1 LYS A 77 -10.273 -5.588 -28.758 1.00 0.00 H ATOM 1183 HZ2 LYS A 77 -10.244 -7.240 -29.152 1.00 0.00 H ATOM 1184 HZ3 LYS A 77 -11.535 -6.605 -28.248 1.00 0.00 H ATOM 1185 H LYS A 77 -4.235 -5.469 -30.155 1.00 0.00 H ATOM 1186 N TYR A 78 -5.823 -2.426 -27.932 1.00 14.78 N ATOM 1187 CA TYR A 78 -5.349 -1.573 -26.849 1.00 11.93 C ATOM 1188 C TYR A 78 -6.242 -1.670 -25.648 1.00 15.04 C ATOM 1189 O TYR A 78 -7.477 -1.833 -25.755 1.00 12.98 O ATOM 1190 CB TYR A 78 -5.233 -0.106 -27.298 1.00 8.17 C ATOM 1191 CG TYR A 78 -4.071 0.105 -28.178 1.00 8.20 C ATOM 1192 CD1 TYR A 78 -2.867 0.567 -27.669 1.00 8.81 C ATOM 1193 CD2 TYR A 78 -4.134 -0.229 -29.518 1.00 13.13 C ATOM 1194 CE1 TYR A 78 -1.758 0.729 -28.492 1.00 11.79 C ATOM 1195 CE2 TYR A 78 -3.042 -0.077 -30.347 1.00 16.61 C ATOM 1196 CZ TYR A 78 -1.852 0.396 -29.826 1.00 15.42 C ATOM 1197 OH TYR A 78 -0.766 0.545 -30.656 1.00 23.12 O ATOM 1198 HA TYR A 78 -4.356 -1.930 -26.574 1.00 0.00 H ATOM 1199 HB3 TYR A 78 -5.128 0.526 -26.416 1.00 0.00 H ATOM 1200 HB2 TYR A 78 -6.139 0.171 -27.837 1.00 0.00 H ATOM 1201 HD2 TYR A 78 -5.065 -0.620 -29.928 1.00 0.00 H ATOM 1202 HE2 TYR A 78 -3.117 -0.328 -31.405 1.00 0.00 H ATOM 1203 HE1 TYR A 78 -0.823 1.116 -28.086 1.00 0.00 H ATOM 1204 HD1 TYR A 78 -2.789 0.807 -26.609 1.00 0.00 H ATOM 1205 HH TYR A 78 0.001 0.890 -30.135 1.00 0.00 H ATOM 1206 H TYR A 78 -6.621 -2.097 -28.512 1.00 0.00 H ATOM 1207 N TYR A 79 -5.611 -1.635 -24.490 1.00 14.79 N ATOM 1208 CA TYR A 79 -6.324 -1.584 -23.260 1.00 13.86 C ATOM 1209 C TYR A 79 -6.171 -0.212 -22.693 1.00 16.77 C ATOM 1210 O TYR A 79 -5.119 0.420 -22.829 1.00 10.41 O ATOM 1211 CB TYR A 79 -5.808 -2.647 -22.306 1.00 15.69 C ATOM 1212 CG TYR A 79 -6.174 -4.026 -22.759 1.00 15.06 C ATOM 1213 CD1 TYR A 79 -7.385 -4.603 -22.378 1.00 15.12 C ATOM 1214 CD2 TYR A 79 -5.340 -4.742 -23.624 1.00 15.15 C ATOM 1215 CE1 TYR A 79 -7.747 -5.882 -22.819 1.00 18.88 C ATOM 1216 CE2 TYR A 79 -5.685 -6.008 -24.064 1.00 20.46 C ATOM 1217 CZ TYR A 79 -6.891 -6.574 -23.661 1.00 22.61 C ATOM 1218 OH TYR A 79 -7.221 -7.836 -24.082 1.00 26.56 O ATOM 1219 HA TYR A 79 -7.382 -1.790 -23.421 1.00 0.00 H ATOM 1220 HB3 TYR A 79 -6.237 -2.474 -21.319 1.00 0.00 H ATOM 1221 HB2 TYR A 79 -4.722 -2.571 -22.247 1.00 0.00 H ATOM 1222 HD2 TYR A 79 -4.403 -4.296 -23.957 1.00 0.00 H ATOM 1223 HE2 TYR A 79 -5.015 -6.560 -24.723 1.00 0.00 H ATOM 1224 HE1 TYR A 79 -8.690 -6.328 -22.504 1.00 0.00 H ATOM 1225 HD1 TYR A 79 -8.061 -4.049 -21.726 1.00 0.00 H ATOM 1226 HH TYR A 79 -8.103 -8.087 -23.709 1.00 0.00 H ATOM 1227 H TYR A 79 -4.571 -1.645 -24.476 1.00 0.00 H ATOM 1228 N ARG A 80 -7.239 0.266 -22.086 1.00 18.90 N ATOM 1229 CA ARG A 80 -7.321 1.628 -21.623 1.00 17.92 C ATOM 1230 C ARG A 80 -7.848 1.582 -20.177 1.00 17.02 C ATOM 1231 O ARG A 80 -8.799 0.847 -19.883 1.00 10.35 O ATOM 1232 CB ARG A 80 -8.344 2.353 -22.491 1.00 13.46 C ATOM 1233 CG ARG A 80 -8.093 3.782 -22.688 1.00 37.43 C ATOM 1234 CD ARG A 80 -9.300 4.384 -23.388 1.00 34.50 C ATOM 1235 NE ARG A 80 -10.486 3.745 -22.885 1.00 25.63 N ATOM 1236 CZ ARG A 80 -11.295 4.276 -21.982 1.00 18.69 C ATOM 1237 NH1 ARG A 80 -11.083 5.500 -21.523 1.00 12.14 N ATOM 1238 NH2 ARG A 80 -12.337 3.589 -21.559 1.00 13.94 N ATOM 1239 HA ARG A 80 -6.356 2.132 -21.672 1.00 0.00 H ATOM 1240 HB2 ARG A 80 -8.356 1.874 -23.470 1.00 0.00 H ATOM 1241 HB3 ARG A 80 -9.322 2.244 -22.023 1.00 0.00 H ATOM 1242 HG2 ARG A 80 -7.945 4.267 -21.723 1.00 0.00 H ATOM 1243 HG3 ARG A 80 -7.203 3.919 -23.302 1.00 0.00 H ATOM 1244 HD2 ARG A 80 -9.222 4.220 -24.463 1.00 0.00 H ATOM 1245 HD3 ARG A 80 -9.346 5.454 -23.187 1.00 0.00 H ATOM 1246 HE ARG A 80 -10.724 2.803 -23.255 1.00 0.00 H ATOM 1247 HH12 ARG A 80 -11.725 5.908 -20.813 1.00 0.00 H ATOM 1248 HH11 ARG A 80 -10.275 6.054 -21.872 1.00 0.00 H ATOM 1249 HH22 ARG A 80 -12.977 3.999 -20.850 1.00 0.00 H ATOM 1250 HH21 ARG A 80 -12.519 2.636 -21.935 1.00 0.00 H ATOM 1251 H ARG A 80 -8.053 -0.364 -21.936 1.00 0.00 H ATOM 1252 N LEU A 81 -7.271 2.384 -19.295 1.00 9.49 N ATOM 1253 CA LEU A 81 -7.859 2.594 -17.966 1.00 13.82 C ATOM 1254 C LEU A 81 -9.140 3.443 -18.147 1.00 9.53 C ATOM 1255 O LEU A 81 -9.129 4.426 -18.872 1.00 18.69 O ATOM 1256 CB LEU A 81 -6.839 3.331 -17.075 1.00 13.57 C ATOM 1257 CG LEU A 81 -6.850 3.256 -15.542 1.00 20.95 C ATOM 1258 CD1 LEU A 81 -6.947 1.844 -15.011 1.00 19.13 C ATOM 1259 CD2 LEU A 81 -5.587 3.912 -15.052 1.00 18.75 C ATOM 1260 HA LEU A 81 -8.110 1.646 -17.490 1.00 0.00 H ATOM 1261 HB2 LEU A 81 -5.857 2.973 -17.385 1.00 0.00 H ATOM 1262 HB3 LEU A 81 -6.934 4.388 -17.323 1.00 0.00 H ATOM 1263 HG LEU A 81 -7.740 3.767 -15.176 1.00 0.00 H ATOM 1264 HD21 LEU A 81 -4.724 3.382 -15.455 1.00 0.00 H ATOM 1265 HD22 LEU A 81 -5.566 4.950 -15.384 1.00 0.00 H ATOM 1266 HD23 LEU A 81 -5.560 3.877 -13.963 1.00 0.00 H ATOM 1267 HD11 LEU A 81 -7.869 1.385 -15.369 1.00 0.00 H ATOM 1268 HD12 LEU A 81 -6.092 1.266 -15.362 1.00 0.00 H ATOM 1269 HD13 LEU A 81 -6.950 1.866 -13.921 1.00 0.00 H ATOM 1270 H LEU A 81 -6.388 2.872 -19.547 1.00 0.00 H ATOM 1271 N THR A 82 -10.246 3.060 -17.526 1.00 12.76 N ATOM 1272 CA THR A 82 -11.452 3.886 -17.670 1.00 11.88 C ATOM 1273 C THR A 82 -11.379 5.081 -16.732 1.00 12.45 C ATOM 1274 O THR A 82 -10.486 5.161 -15.892 1.00 12.96 O ATOM 1275 CB THR A 82 -12.737 3.102 -17.398 1.00 13.96 C ATOM 1276 OG1 THR A 82 -12.751 2.676 -16.029 1.00 6.75 O ATOM 1277 CG2 THR A 82 -12.834 1.872 -18.343 1.00 10.84 C ATOM 1278 HA THR A 82 -11.486 4.222 -18.706 1.00 0.00 H ATOM 1279 HB THR A 82 -13.596 3.746 -17.587 1.00 0.00 H ATOM 1280 HG1 THR A 82 -13.582 2.168 -15.851 1.00 0.00 H ATOM 1281 HG23 THR A 82 -12.822 2.210 -19.379 1.00 0.00 H ATOM 1282 HG21 THR A 82 -11.986 1.211 -18.165 1.00 0.00 H ATOM 1283 HG22 THR A 82 -13.762 1.335 -18.145 1.00 0.00 H ATOM 1284 H THR A 82 -10.260 2.194 -16.950 1.00 0.00 H ATOM 1285 N GLU A 83 -12.322 6.007 -16.876 1.00 8.00 N ATOM 1286 CA GLU A 83 -12.427 7.127 -15.955 1.00 19.44 C ATOM 1287 C GLU A 83 -12.742 6.639 -14.540 1.00 19.82 C ATOM 1288 O GLU A 83 -12.164 7.135 -13.559 1.00 16.12 O ATOM 1289 CB GLU A 83 -13.484 8.136 -16.436 1.00 17.51 C ATOM 1290 CG GLU A 83 -12.909 9.242 -17.328 1.00 25.72 C ATOM 1291 CD GLU A 83 -13.609 9.335 -18.666 1.00 30.42 C ATOM 1292 OE1 GLU A 83 -13.381 8.432 -19.499 1.00 32.52 O ATOM 1293 OE2 GLU A 83 -14.374 10.313 -18.895 1.00 25.81 O ATOM 1294 HA GLU A 83 -11.463 7.636 -15.930 1.00 0.00 H ATOM 1295 HB2 GLU A 83 -14.245 7.597 -17.001 1.00 0.00 H ATOM 1296 HB3 GLU A 83 -13.942 8.600 -15.562 1.00 0.00 H ATOM 1297 HG2 GLU A 83 -13.014 10.196 -16.812 1.00 0.00 H ATOM 1298 HG3 GLU A 83 -11.852 9.038 -17.500 1.00 0.00 H ATOM 1299 H GLU A 83 -12.998 5.929 -17.663 1.00 0.00 H ATOM 1300 N ILE A 84 -13.650 5.663 -14.432 1.00 19.40 N ATOM 1301 CA ILE A 84 -13.891 4.991 -13.132 1.00 15.38 C ATOM 1302 C ILE A 84 -12.611 4.313 -12.646 1.00 13.42 C ATOM 1303 O ILE A 84 -12.287 4.358 -11.457 1.00 15.95 O ATOM 1304 CB ILE A 84 -15.039 3.947 -13.213 1.00 16.02 C ATOM 1305 CG1 ILE A 84 -16.389 4.651 -13.300 1.00 19.90 C ATOM 1306 CG2 ILE A 84 -15.017 3.033 -12.007 1.00 15.13 C ATOM 1307 CD1 ILE A 84 -16.776 5.390 -12.009 1.00 26.84 C ATOM 1308 HA ILE A 84 -14.195 5.761 -12.423 1.00 0.00 H ATOM 1309 HB ILE A 84 -14.890 3.347 -14.111 1.00 0.00 H ATOM 1310 HG12 ILE A 84 -16.350 5.375 -14.114 1.00 0.00 H ATOM 1311 HG13 ILE A 84 -17.155 3.905 -13.515 1.00 0.00 H ATOM 1312 HD11 ILE A 84 -16.830 4.677 -11.186 1.00 0.00 H ATOM 1313 HD12 ILE A 84 -16.025 6.148 -11.786 1.00 0.00 H ATOM 1314 HD13 ILE A 84 -17.747 5.867 -12.142 1.00 0.00 H ATOM 1315 HG21 ILE A 84 -14.063 2.507 -11.969 1.00 0.00 H ATOM 1316 HG22 ILE A 84 -15.142 3.626 -11.101 1.00 0.00 H ATOM 1317 HG23 ILE A 84 -15.829 2.311 -12.085 1.00 0.00 H ATOM 1318 H ILE A 84 -14.194 5.372 -15.270 1.00 0.00 H ATOM 1319 N GLY A 85 -11.872 3.705 -13.571 1.00 10.45 N ATOM 1320 CA GLY A 85 -10.621 3.046 -13.214 1.00 13.02 C ATOM 1321 C GLY A 85 -9.631 4.038 -12.599 1.00 19.33 C ATOM 1322 O GLY A 85 -9.036 3.764 -11.555 1.00 14.39 O ATOM 1323 HA3 GLY A 85 -10.179 2.611 -14.110 1.00 0.00 H ATOM 1324 HA2 GLY A 85 -10.828 2.256 -12.492 1.00 0.00 H ATOM 1325 H GLY A 85 -12.191 3.700 -14.561 1.00 0.00 H ATOM 1326 N HIS A 86 -9.472 5.203 -13.258 1.00 17.48 N ATOM 1327 CA HIS A 86 -8.597 6.286 -12.776 1.00 18.58 C ATOM 1328 C HIS A 86 -9.001 6.791 -11.390 1.00 16.26 C ATOM 1329 O HIS A 86 -8.153 7.072 -10.556 1.00 17.41 O ATOM 1330 CB HIS A 86 -8.634 7.478 -13.743 1.00 11.70 C ATOM 1331 CG HIS A 86 -7.644 7.392 -14.853 1.00 18.19 C ATOM 1332 ND1 HIS A 86 -8.008 7.099 -16.154 1.00 20.10 N ATOM 1333 CD2 HIS A 86 -6.309 7.624 -14.878 1.00 15.56 C ATOM 1334 CE1 HIS A 86 -6.933 7.121 -16.926 1.00 16.02 C ATOM 1335 NE2 HIS A 86 -5.890 7.439 -16.178 1.00 23.09 N ATOM 1336 HA HIS A 86 -7.594 5.864 -12.718 1.00 0.00 H ATOM 1337 HB2 HIS A 86 -9.632 7.536 -14.178 1.00 0.00 H ATOM 1338 HB3 HIS A 86 -8.434 8.386 -13.175 1.00 0.00 H ATOM 1339 HD2 HIS A 86 -5.684 7.904 -14.030 1.00 0.00 H ATOM 1340 HE1 HIS A 86 -6.911 6.913 -17.996 1.00 0.00 H ATOM 1341 H HIS A 86 -9.991 5.344 -14.148 1.00 0.00 H ATOM 1342 N GLU A 87 -10.304 6.975 -11.183 1.00 15.89 N ATOM 1343 CA GLU A 87 -10.806 7.474 -9.915 1.00 15.91 C ATOM 1344 C GLU A 87 -10.547 6.496 -8.756 1.00 18.53 C ATOM 1345 O GLU A 87 -10.093 6.900 -7.673 1.00 17.78 O ATOM 1346 CB GLU A 87 -12.292 7.801 -10.019 1.00 21.94 C ATOM 1347 CG GLU A 87 -12.793 8.652 -8.885 1.00 34.32 C ATOM 1348 CD GLU A 87 -12.007 9.967 -8.748 1.00 43.17 C ATOM 1349 OE1 GLU A 87 -11.468 10.471 -9.778 1.00 47.59 O ATOM 1350 OE2 GLU A 87 -11.938 10.494 -7.619 1.00 41.46 O ATOM 1351 HA GLU A 87 -10.256 8.388 -9.690 1.00 0.00 H ATOM 1352 HB2 GLU A 87 -12.465 8.333 -10.954 1.00 0.00 H ATOM 1353 HB3 GLU A 87 -12.853 6.866 -10.025 1.00 0.00 H ATOM 1354 HG2 GLU A 87 -13.843 8.888 -9.061 1.00 0.00 H ATOM 1355 HG3 GLU A 87 -12.699 8.089 -7.956 1.00 0.00 H ATOM 1356 H GLU A 87 -10.976 6.757 -11.946 1.00 0.00 H ATOM 1357 N ASN A 88 -10.825 5.213 -8.988 1.00 19.26 N ATOM 1358 CA ASN A 88 -10.533 4.173 -7.991 1.00 16.07 C ATOM 1359 C ASN A 88 -9.081 4.133 -7.614 1.00 12.97 C ATOM 1360 O ASN A 88 -8.746 4.021 -6.442 1.00 17.15 O ATOM 1361 CB ASN A 88 -10.981 2.803 -8.487 1.00 16.40 C ATOM 1362 CG ASN A 88 -12.463 2.635 -8.417 1.00 23.76 C ATOM 1363 OD1 ASN A 88 -13.143 3.412 -7.757 1.00 34.96 O ATOM 1364 ND2 ASN A 88 -12.988 1.625 -9.104 1.00 30.65 N ATOM 1365 HA ASN A 88 -11.098 4.432 -7.096 1.00 0.00 H ATOM 1366 HB2 ASN A 88 -10.662 2.683 -9.522 1.00 0.00 H ATOM 1367 HB3 ASN A 88 -10.511 2.036 -7.872 1.00 0.00 H ATOM 1368 HD22 ASN A 88 -12.370 0.991 -9.650 1.00 0.00 H ATOM 1369 HD21 ASN A 88 -14.016 1.469 -9.095 1.00 0.00 H ATOM 1370 H ASN A 88 -11.258 4.942 -9.894 1.00 0.00 H ATOM 1371 N MET A 89 -8.202 4.205 -8.611 1.00 14.05 N ATOM 1372 CA MET A 89 -6.760 4.298 -8.335 1.00 17.12 C ATOM 1373 C MET A 89 -6.422 5.545 -7.537 1.00 21.60 C ATOM 1374 O MET A 89 -5.586 5.508 -6.624 1.00 18.89 O ATOM 1375 CB MET A 89 -5.966 4.323 -9.621 1.00 16.85 C ATOM 1376 CG MET A 89 -5.984 3.030 -10.387 1.00 18.93 C ATOM 1377 SD MET A 89 -4.803 3.141 -11.743 1.00 35.08 S ATOM 1378 CE MET A 89 -3.271 2.716 -10.857 1.00 30.92 C ATOM 1379 HA MET A 89 -6.496 3.416 -7.751 1.00 0.00 H ATOM 1380 HB2 MET A 89 -6.377 5.104 -10.261 1.00 0.00 H ATOM 1381 HB3 MET A 89 -4.930 4.561 -9.378 1.00 0.00 H ATOM 1382 HG2 MET A 89 -6.983 2.854 -10.785 1.00 0.00 H ATOM 1383 HG3 MET A 89 -5.707 2.209 -9.726 1.00 0.00 H ATOM 1384 HE1 MET A 89 -3.101 3.439 -10.059 1.00 0.00 H ATOM 1385 HE2 MET A 89 -3.365 1.718 -10.430 1.00 0.00 H ATOM 1386 HE3 MET A 89 -2.432 2.737 -11.553 1.00 0.00 H ATOM 1387 H MET A 89 -8.538 4.195 -9.595 1.00 0.00 H ATOM 1388 N ARG A 90 -7.028 6.670 -7.913 1.00 18.68 N ATOM 1389 CA ARG A 90 -6.770 7.923 -7.207 1.00 20.00 C ATOM 1390 C ARG A 90 -7.157 7.803 -5.727 1.00 16.60 C ATOM 1391 O ARG A 90 -6.385 8.167 -4.850 1.00 21.19 O ATOM 1392 CB ARG A 90 -7.521 9.096 -7.859 1.00 11.51 C ATOM 1393 CG ARG A 90 -7.136 10.455 -7.258 1.00 19.80 C ATOM 1394 CD ARG A 90 -7.875 11.631 -7.925 1.00 23.41 C ATOM 1395 NE ARG A 90 -9.223 11.784 -7.394 1.00 30.03 N ATOM 1396 CZ ARG A 90 -9.496 12.055 -6.116 1.00 36.68 C ATOM 1397 NH1 ARG A 90 -8.503 12.202 -5.235 1.00 38.99 N ATOM 1398 NH2 ARG A 90 -10.760 12.176 -5.715 1.00 39.04 N ATOM 1399 HA ARG A 90 -5.701 8.125 -7.274 1.00 0.00 H ATOM 1400 HB2 ARG A 90 -7.291 9.108 -8.924 1.00 0.00 H ATOM 1401 HB3 ARG A 90 -8.592 8.944 -7.721 1.00 0.00 H ATOM 1402 HG2 ARG A 90 -7.379 10.448 -6.195 1.00 0.00 H ATOM 1403 HG3 ARG A 90 -6.063 10.601 -7.383 1.00 0.00 H ATOM 1404 HD2 ARG A 90 -7.935 11.449 -8.998 1.00 0.00 H ATOM 1405 HD3 ARG A 90 -7.316 12.549 -7.744 1.00 0.00 H ATOM 1406 HE ARG A 90 -10.022 11.675 -8.051 1.00 0.00 H ATOM 1407 HH12 ARG A 90 -8.718 12.413 -4.240 1.00 0.00 H ATOM 1408 HH11 ARG A 90 -7.515 12.105 -5.544 1.00 0.00 H ATOM 1409 HH22 ARG A 90 -10.972 12.387 -4.719 1.00 0.00 H ATOM 1410 HH21 ARG A 90 -11.536 12.059 -6.398 1.00 0.00 H ATOM 1411 H ARG A 90 -7.690 6.656 -8.715 1.00 0.00 H ATOM 1412 N LEU A 91 -8.353 7.279 -5.467 1.00 12.66 N ATOM 1413 CA LEU A 91 -8.852 7.147 -4.108 1.00 16.40 C ATOM 1414 C LEU A 91 -8.032 6.148 -3.304 1.00 20.24 C ATOM 1415 O LEU A 91 -7.734 6.391 -2.134 1.00 17.84 O ATOM 1416 CB LEU A 91 -10.328 6.733 -4.108 1.00 18.38 C ATOM 1417 CG LEU A 91 -11.311 7.791 -4.589 1.00 23.65 C ATOM 1418 CD1 LEU A 91 -12.661 7.161 -4.896 1.00 26.50 C ATOM 1419 CD2 LEU A 91 -11.452 8.907 -3.546 1.00 26.78 C ATOM 1420 HA LEU A 91 -8.758 8.123 -3.633 1.00 0.00 H ATOM 1421 HB2 LEU A 91 -10.431 5.861 -4.754 1.00 0.00 H ATOM 1422 HB3 LEU A 91 -10.600 6.462 -3.088 1.00 0.00 H ATOM 1423 HG LEU A 91 -10.925 8.233 -5.508 1.00 0.00 H ATOM 1424 HD21 LEU A 91 -11.816 8.484 -2.610 1.00 0.00 H ATOM 1425 HD22 LEU A 91 -10.481 9.374 -3.382 1.00 0.00 H ATOM 1426 HD23 LEU A 91 -12.159 9.654 -3.908 1.00 0.00 H ATOM 1427 HD11 LEU A 91 -12.540 6.408 -5.675 1.00 0.00 H ATOM 1428 HD12 LEU A 91 -13.056 6.693 -3.994 1.00 0.00 H ATOM 1429 HD13 LEU A 91 -13.351 7.932 -5.238 1.00 0.00 H ATOM 1430 H LEU A 91 -8.946 6.955 -6.257 1.00 0.00 H ATOM 1431 N ALA A 92 -7.688 5.011 -3.922 1.00 15.19 N ATOM 1432 CA ALA A 92 -6.812 4.028 -3.277 1.00 18.93 C ATOM 1433 C ALA A 92 -5.463 4.660 -2.942 1.00 20.24 C ATOM 1434 O ALA A 92 -4.938 4.484 -1.852 1.00 22.31 O ATOM 1435 CB ALA A 92 -6.618 2.790 -4.175 1.00 15.98 C ATOM 1436 HA ALA A 92 -7.287 3.704 -2.351 1.00 0.00 H ATOM 1437 HB1 ALA A 92 -7.586 2.326 -4.366 1.00 0.00 H ATOM 1438 HB2 ALA A 92 -6.167 3.095 -5.120 1.00 0.00 H ATOM 1439 HB3 ALA A 92 -5.964 2.077 -3.673 1.00 0.00 H ATOM 1440 H ALA A 92 -8.049 4.821 -4.879 1.00 0.00 H ATOM 1441 N PHE A 93 -4.901 5.385 -3.892 1.00 16.66 N ATOM 1442 CA PHE A 93 -3.601 6.021 -3.688 1.00 19.35 C ATOM 1443 C PHE A 93 -3.669 7.074 -2.583 1.00 18.78 C ATOM 1444 O PHE A 93 -2.784 7.165 -1.735 1.00 15.89 O ATOM 1445 CB PHE A 93 -3.138 6.685 -4.972 1.00 19.53 C ATOM 1446 CG PHE A 93 -1.857 7.431 -4.829 1.00 22.36 C ATOM 1447 CD1 PHE A 93 -0.647 6.749 -4.791 1.00 21.34 C ATOM 1448 CD2 PHE A 93 -1.852 8.823 -4.720 1.00 19.01 C ATOM 1449 CE1 PHE A 93 0.554 7.442 -4.650 1.00 25.72 C ATOM 1450 CE2 PHE A 93 -0.654 9.525 -4.575 1.00 20.50 C ATOM 1451 CZ PHE A 93 0.546 8.841 -4.543 1.00 21.64 C ATOM 1452 HA PHE A 93 -2.895 5.245 -3.394 1.00 0.00 H ATOM 1453 HB2 PHE A 93 -3.005 5.914 -5.731 1.00 0.00 H ATOM 1454 HB3 PHE A 93 -3.909 7.383 -5.297 1.00 0.00 H ATOM 1455 HD2 PHE A 93 -2.795 9.368 -4.748 1.00 0.00 H ATOM 1456 HE2 PHE A 93 -0.665 10.611 -4.487 1.00 0.00 H ATOM 1457 HZ PHE A 93 1.484 9.386 -4.435 1.00 0.00 H ATOM 1458 HE1 PHE A 93 1.498 6.898 -4.623 1.00 0.00 H ATOM 1459 HD1 PHE A 93 -0.637 5.662 -4.872 1.00 0.00 H ATOM 1460 H PHE A 93 -5.392 5.505 -4.801 1.00 0.00 H ATOM 1461 N GLU A 94 -4.720 7.879 -2.626 1.00 19.16 N ATOM 1462 CA GLU A 94 -4.952 8.944 -1.655 1.00 18.49 C ATOM 1463 C GLU A 94 -5.088 8.356 -0.255 1.00 15.78 C ATOM 1464 O GLU A 94 -4.502 8.854 0.694 1.00 14.15 O ATOM 1465 CB GLU A 94 -6.245 9.672 -2.017 1.00 25.70 C ATOM 1466 CG GLU A 94 -6.228 11.143 -1.771 1.00 46.49 C ATOM 1467 CD GLU A 94 -5.379 11.873 -2.780 1.00 55.33 C ATOM 1468 OE1 GLU A 94 -4.973 11.237 -3.786 1.00 54.98 O ATOM 1469 OE2 GLU A 94 -5.109 13.081 -2.567 1.00 61.66 O ATOM 1470 HA GLU A 94 -4.110 9.636 -1.672 1.00 0.00 H ATOM 1471 HB2 GLU A 94 -6.441 9.508 -3.077 1.00 0.00 H ATOM 1472 HB3 GLU A 94 -7.054 9.239 -1.428 1.00 0.00 H ATOM 1473 HG2 GLU A 94 -7.248 11.522 -1.829 1.00 0.00 H ATOM 1474 HG3 GLU A 94 -5.829 11.329 -0.774 1.00 0.00 H ATOM 1475 H GLU A 94 -5.414 7.746 -3.389 1.00 0.00 H ATOM 1476 N SER A 95 -5.885 7.301 -0.122 1.00 12.87 N ATOM 1477 CA SER A 95 -6.168 6.767 1.209 1.00 16.70 C ATOM 1478 C SER A 95 -4.938 6.054 1.801 1.00 15.47 C ATOM 1479 O SER A 95 -4.627 6.224 2.967 1.00 19.49 O ATOM 1480 CB SER A 95 -7.437 5.890 1.218 1.00 14.53 C ATOM 1481 OG SER A 95 -7.326 4.793 0.337 1.00 15.88 O ATOM 1482 HA SER A 95 -6.382 7.609 1.867 1.00 0.00 H ATOM 1483 HB2 SER A 95 -8.289 6.499 0.916 1.00 0.00 H ATOM 1484 HB3 SER A 95 -7.599 5.515 2.229 1.00 0.00 H ATOM 1485 HG SER A 95 -7.185 5.125 -0.585 1.00 0.00 H ATOM 1486 H SER A 95 -6.306 6.856 -0.963 1.00 0.00 H ATOM 1487 N TRP A 96 -4.192 5.334 0.964 1.00 15.16 N ATOM 1488 CA TRP A 96 -2.952 4.696 1.420 1.00 13.05 C ATOM 1489 C TRP A 96 -1.806 5.683 1.727 1.00 13.10 C ATOM 1490 O TRP A 96 -0.943 5.391 2.543 1.00 15.55 O ATOM 1491 CB TRP A 96 -2.489 3.606 0.443 1.00 16.34 C ATOM 1492 CG TRP A 96 -3.270 2.328 0.574 1.00 11.35 C ATOM 1493 CD1 TRP A 96 -4.169 1.841 -0.305 1.00 14.98 C ATOM 1494 CD2 TRP A 96 -3.208 1.375 1.667 1.00 12.09 C ATOM 1495 NE1 TRP A 96 -4.680 0.639 0.152 1.00 12.55 N ATOM 1496 CE2 TRP A 96 -4.103 0.336 1.361 1.00 13.54 C ATOM 1497 CE3 TRP A 96 -2.460 1.298 2.855 1.00 10.08 C ATOM 1498 CZ2 TRP A 96 -4.288 -0.779 2.204 1.00 11.11 C ATOM 1499 CZ3 TRP A 96 -2.650 0.201 3.699 1.00 11.81 C ATOM 1500 CH2 TRP A 96 -3.561 -0.819 3.370 1.00 13.27 C ATOM 1501 HA TRP A 96 -3.205 4.232 2.373 1.00 0.00 H ATOM 1502 HB2 TRP A 96 -2.603 3.980 -0.574 1.00 0.00 H ATOM 1503 HB3 TRP A 96 -1.438 3.392 0.634 1.00 0.00 H ATOM 1504 HE1 TRP A 96 -5.388 0.058 -0.341 1.00 0.00 H ATOM 1505 HD1 TRP A 96 -4.452 2.324 -1.240 1.00 0.00 H ATOM 1506 HZ2 TRP A 96 -4.981 -1.578 1.941 1.00 0.00 H ATOM 1507 HH2 TRP A 96 -3.693 -1.658 4.053 1.00 0.00 H ATOM 1508 HZ3 TRP A 96 -2.083 0.134 4.628 1.00 0.00 H ATOM 1509 HE3 TRP A 96 -1.745 2.080 3.113 1.00 0.00 H ATOM 1510 H TRP A 96 -4.493 5.223 -0.025 1.00 0.00 H ATOM 1511 N SER A 97 -1.805 6.848 1.080 1.00 15.65 N ATOM 1512 CA SER A 97 -0.841 7.908 1.440 1.00 16.27 C ATOM 1513 C SER A 97 -1.167 8.495 2.820 1.00 14.10 C ATOM 1514 O SER A 97 -0.260 8.812 3.608 1.00 14.64 O ATOM 1515 CB SER A 97 -0.828 9.024 0.393 1.00 15.33 C ATOM 1516 OG SER A 97 -0.367 8.530 -0.837 1.00 29.96 O ATOM 1517 HA SER A 97 0.149 7.452 1.473 1.00 0.00 H ATOM 1518 HB2 SER A 97 -0.170 9.825 0.729 1.00 0.00 H ATOM 1519 HB3 SER A 97 -1.838 9.413 0.269 1.00 0.00 H ATOM 1520 HG SER A 97 -0.965 7.804 -1.145 1.00 0.00 H ATOM 1521 H SER A 97 -2.489 7.013 0.314 1.00 0.00 H ATOM 1522 N ARG A 98 -2.457 8.654 3.101 1.00 8.44 N ATOM 1523 CA ARG A 98 -2.891 9.094 4.421 1.00 13.55 C ATOM 1524 C ARG A 98 -2.513 8.066 5.497 1.00 14.63 C ATOM 1525 O ARG A 98 -2.056 8.424 6.590 1.00 15.77 O ATOM 1526 CB ARG A 98 -4.391 9.345 4.446 1.00 12.26 C ATOM 1527 CG ARG A 98 -4.888 9.907 5.800 1.00 13.79 C ATOM 1528 CD ARG A 98 -4.479 11.420 6.016 1.00 16.97 C ATOM 1529 NE ARG A 98 -4.928 11.886 7.325 1.00 22.99 N ATOM 1530 CZ ARG A 98 -4.130 12.353 8.285 1.00 22.94 C ATOM 1531 NH1 ARG A 98 -2.829 12.491 8.068 1.00 22.57 N ATOM 1532 NH2 ARG A 98 -4.645 12.722 9.453 1.00 15.60 N ATOM 1533 HA ARG A 98 -2.378 10.030 4.640 1.00 0.00 H ATOM 1534 HB2 ARG A 98 -4.637 10.061 3.661 1.00 0.00 H ATOM 1535 HB3 ARG A 98 -4.904 8.403 4.251 1.00 0.00 H ATOM 1536 HG2 ARG A 98 -5.975 9.830 5.833 1.00 0.00 H ATOM 1537 HG3 ARG A 98 -4.459 9.310 6.605 1.00 0.00 H ATOM 1538 HD2 ARG A 98 -4.939 12.031 5.239 1.00 0.00 H ATOM 1539 HD3 ARG A 98 -3.395 11.512 5.954 1.00 0.00 H ATOM 1540 HE ARG A 98 -5.948 11.851 7.523 1.00 0.00 H ATOM 1541 HH12 ARG A 98 -2.212 12.856 8.821 1.00 0.00 H ATOM 1542 HH11 ARG A 98 -2.426 12.234 7.144 1.00 0.00 H ATOM 1543 HH22 ARG A 98 -4.024 13.087 10.203 1.00 0.00 H ATOM 1544 HH21 ARG A 98 -5.669 12.646 9.617 1.00 0.00 H ATOM 1545 H ARG A 98 -3.168 8.461 2.367 1.00 0.00 H ATOM 1546 N VAL A 99 -2.717 6.792 5.195 1.00 15.91 N ATOM 1547 CA VAL A 99 -2.249 5.737 6.089 1.00 15.84 C ATOM 1548 C VAL A 99 -0.748 5.914 6.358 1.00 13.53 C ATOM 1549 O VAL A 99 -0.309 5.864 7.503 1.00 10.05 O ATOM 1550 CB VAL A 99 -2.551 4.337 5.523 1.00 12.35 C ATOM 1551 CG1 VAL A 99 -1.772 3.261 6.282 1.00 11.57 C ATOM 1552 CG2 VAL A 99 -4.021 4.070 5.605 1.00 15.92 C ATOM 1553 HA VAL A 99 -2.789 5.820 7.032 1.00 0.00 H ATOM 1554 HB VAL A 99 -2.236 4.306 4.480 1.00 0.00 H ATOM 1555 HG11 VAL A 99 -0.703 3.454 6.189 1.00 0.00 H ATOM 1556 HG12 VAL A 99 -2.056 3.283 7.334 1.00 0.00 H ATOM 1557 HG13 VAL A 99 -2.004 2.282 5.862 1.00 0.00 H ATOM 1558 HG21 VAL A 99 -4.340 4.117 6.646 1.00 0.00 H ATOM 1559 HG22 VAL A 99 -4.558 4.820 5.025 1.00 0.00 H ATOM 1560 HG23 VAL A 99 -4.232 3.079 5.204 1.00 0.00 H ATOM 1561 H VAL A 99 -3.213 6.542 4.316 1.00 0.00 H ATOM 1562 N ASP A 100 0.028 6.146 5.295 1.00 11.94 N ATOM 1563 CA ASP A 100 1.464 6.413 5.429 1.00 14.87 C ATOM 1564 C ASP A 100 1.744 7.612 6.335 1.00 13.63 C ATOM 1565 O ASP A 100 2.701 7.606 7.116 1.00 8.12 O ATOM 1566 CB ASP A 100 2.086 6.698 4.052 1.00 21.61 C ATOM 1567 CG ASP A 100 2.264 5.457 3.229 1.00 30.83 C ATOM 1568 OD1 ASP A 100 2.456 4.375 3.823 1.00 36.99 O ATOM 1569 OD2 ASP A 100 2.219 5.558 1.981 1.00 33.83 O ATOM 1570 HA ASP A 100 1.907 5.522 5.875 1.00 0.00 H ATOM 1571 HB2 ASP A 100 1.436 7.385 3.511 1.00 0.00 H ATOM 1572 HB3 ASP A 100 3.061 7.162 4.199 1.00 0.00 H ATOM 1573 H ASP A 100 -0.398 6.137 4.346 1.00 0.00 H ATOM 1574 N LYS A 101 0.950 8.667 6.175 1.00 14.07 N ATOM 1575 CA LYS A 101 1.144 9.880 6.959 1.00 17.78 C ATOM 1576 C LYS A 101 0.851 9.597 8.423 1.00 16.54 C ATOM 1577 O LYS A 101 1.558 10.075 9.316 1.00 8.86 O ATOM 1578 CB LYS A 101 0.244 11.000 6.438 1.00 20.95 C ATOM 1579 CG LYS A 101 0.500 11.346 4.984 1.00 34.86 C ATOM 1580 CD LYS A 101 -0.613 12.223 4.397 1.00 42.45 C ATOM 1581 CE LYS A 101 -0.400 12.463 2.897 1.00 37.73 C ATOM 1582 NZ LYS A 101 -1.704 12.534 2.196 1.00 37.27 N ATOM 1583 HA LYS A 101 2.180 10.204 6.863 1.00 0.00 H ATOM 1584 HB2 LYS A 101 -0.795 10.686 6.542 1.00 0.00 H ATOM 1585 HB3 LYS A 101 0.415 11.891 7.042 1.00 0.00 H ATOM 1586 HG2 LYS A 101 1.446 11.882 4.911 1.00 0.00 H ATOM 1587 HG3 LYS A 101 0.562 10.423 4.408 1.00 0.00 H ATOM 1588 HD2 LYS A 101 -1.572 11.727 4.545 1.00 0.00 H ATOM 1589 HD3 LYS A 101 -0.619 13.183 4.913 1.00 0.00 H ATOM 1590 HE2 LYS A 101 0.188 11.644 2.482 1.00 0.00 H ATOM 1591 HE3 LYS A 101 0.136 13.401 2.755 1.00 0.00 H ATOM 1592 HZ1 LYS A 101 -2.216 11.638 2.327 1.00 0.00 H ATOM 1593 HZ2 LYS A 101 -2.265 13.316 2.589 1.00 0.00 H ATOM 1594 HZ3 LYS A 101 -1.542 12.697 1.182 1.00 0.00 H ATOM 1595 H LYS A 101 0.178 8.626 5.479 1.00 0.00 H ATOM 1596 N ILE A 102 -0.190 8.809 8.663 1.00 13.35 N ATOM 1597 CA ILE A 102 -0.592 8.461 10.017 1.00 11.04 C ATOM 1598 C ILE A 102 0.469 7.595 10.724 1.00 13.30 C ATOM 1599 O ILE A 102 0.802 7.831 11.888 1.00 14.03 O ATOM 1600 CB ILE A 102 -1.976 7.778 10.026 1.00 14.47 C ATOM 1601 CG1 ILE A 102 -3.071 8.811 9.671 1.00 12.11 C ATOM 1602 CG2 ILE A 102 -2.239 7.065 11.407 1.00 8.83 C ATOM 1603 CD1 ILE A 102 -4.492 8.199 9.401 1.00 16.99 C ATOM 1604 HA ILE A 102 -0.674 9.389 10.583 1.00 0.00 H ATOM 1605 HB ILE A 102 -2.002 6.997 9.266 1.00 0.00 H ATOM 1606 HG12 ILE A 102 -3.156 9.514 10.500 1.00 0.00 H ATOM 1607 HG13 ILE A 102 -2.756 9.345 8.775 1.00 0.00 H ATOM 1608 HD11 ILE A 102 -4.433 7.503 8.564 1.00 0.00 H ATOM 1609 HD12 ILE A 102 -4.834 7.671 10.291 1.00 0.00 H ATOM 1610 HD13 ILE A 102 -5.191 9.000 9.161 1.00 0.00 H ATOM 1611 HG21 ILE A 102 -1.472 6.309 11.576 1.00 0.00 H ATOM 1612 HG22 ILE A 102 -2.206 7.804 12.208 1.00 0.00 H ATOM 1613 HG23 ILE A 102 -3.220 6.591 11.389 1.00 0.00 H ATOM 1614 H ILE A 102 -0.733 8.430 7.861 1.00 0.00 H ATOM 1615 N ILE A 103 1.023 6.626 10.006 1.00 15.79 N ATOM 1616 CA ILE A 103 2.163 5.830 10.521 1.00 13.94 C ATOM 1617 C ILE A 103 3.364 6.739 10.835 1.00 13.12 C ATOM 1618 O ILE A 103 3.924 6.705 11.929 1.00 12.11 O ATOM 1619 CB ILE A 103 2.592 4.778 9.499 1.00 11.79 C ATOM 1620 CG1 ILE A 103 1.522 3.701 9.362 1.00 8.51 C ATOM 1621 CG2 ILE A 103 3.970 4.186 9.849 1.00 10.35 C ATOM 1622 CD1 ILE A 103 1.738 2.801 8.121 1.00 14.53 C ATOM 1623 HA ILE A 103 1.834 5.336 11.435 1.00 0.00 H ATOM 1624 HB ILE A 103 2.698 5.263 8.528 1.00 0.00 H ATOM 1625 HG12 ILE A 103 1.540 3.075 10.254 1.00 0.00 H ATOM 1626 HG13 ILE A 103 0.549 4.184 9.278 1.00 0.00 H ATOM 1627 HD11 ILE A 103 1.713 3.414 7.220 1.00 0.00 H ATOM 1628 HD12 ILE A 103 2.705 2.305 8.198 1.00 0.00 H ATOM 1629 HD13 ILE A 103 0.947 2.053 8.074 1.00 0.00 H ATOM 1630 HG21 ILE A 103 4.714 4.983 9.860 1.00 0.00 H ATOM 1631 HG22 ILE A 103 3.923 3.717 10.832 1.00 0.00 H ATOM 1632 HG23 ILE A 103 4.245 3.441 9.102 1.00 0.00 H ATOM 1633 H ILE A 103 0.648 6.420 9.058 1.00 0.00 H ATOM 1634 N GLU A 104 3.749 7.547 9.862 1.00 11.10 N ATOM 1635 CA GLU A 104 4.813 8.538 10.065 1.00 11.28 C ATOM 1636 C GLU A 104 4.608 9.260 11.400 1.00 12.12 C ATOM 1637 O GLU A 104 5.511 9.324 12.224 1.00 10.45 O ATOM 1638 CB GLU A 104 4.812 9.523 8.901 1.00 18.04 C ATOM 1639 CG GLU A 104 5.803 10.673 8.993 1.00 26.95 C ATOM 1640 CD GLU A 104 5.789 11.531 7.721 1.00 27.70 C ATOM 1641 OE1 GLU A 104 5.497 10.979 6.630 1.00 24.07 O ATOM 1642 OE2 GLU A 104 6.055 12.741 7.816 1.00 31.17 O ATOM 1643 HA GLU A 104 5.782 8.039 10.099 1.00 0.00 H ATOM 1644 HB2 GLU A 104 5.034 8.964 7.992 1.00 0.00 H ATOM 1645 HB3 GLU A 104 3.812 9.951 8.828 1.00 0.00 H ATOM 1646 HG2 GLU A 104 5.541 11.299 9.846 1.00 0.00 H ATOM 1647 HG3 GLU A 104 6.805 10.267 9.136 1.00 0.00 H ATOM 1648 H GLU A 104 3.288 7.479 8.932 1.00 0.00 H ATOM 1649 N ASN A 105 3.396 9.765 11.619 1.00 14.23 N ATOM 1650 CA ASN A 105 3.052 10.440 12.873 1.00 15.56 C ATOM 1651 C ASN A 105 3.247 9.557 14.088 1.00 16.87 C ATOM 1652 O ASN A 105 3.713 10.010 15.127 1.00 15.64 O ATOM 1653 CB ASN A 105 1.614 10.931 12.828 1.00 13.97 C ATOM 1654 CG ASN A 105 1.449 12.126 11.946 1.00 17.12 C ATOM 1655 OD1 ASN A 105 2.434 12.749 11.534 1.00 16.52 O ATOM 1656 ND2 ASN A 105 0.207 12.465 11.637 1.00 13.02 N ATOM 1657 HA ASN A 105 3.734 11.284 12.971 1.00 0.00 H ATOM 1658 HB2 ASN A 105 0.981 10.127 12.452 1.00 0.00 H ATOM 1659 HB3 ASN A 105 1.302 11.195 13.838 1.00 0.00 H ATOM 1660 HD22 ASN A 105 -0.591 11.910 12.008 1.00 0.00 H ATOM 1661 HD21 ASN A 105 0.029 13.286 11.024 1.00 0.00 H ATOM 1662 H ASN A 105 2.672 9.678 10.878 1.00 0.00 H ATOM 1663 N LEU A 106 2.850 8.301 13.960 1.00 15.76 N ATOM 1664 CA LEU A 106 3.069 7.321 15.001 1.00 18.34 C ATOM 1665 C LEU A 106 4.555 7.203 15.306 1.00 21.89 C ATOM 1666 O LEU A 106 4.950 7.040 16.462 1.00 23.00 O ATOM 1667 CB LEU A 106 2.511 5.945 14.567 1.00 15.88 C ATOM 1668 CG LEU A 106 0.991 5.799 14.593 1.00 15.84 C ATOM 1669 CD1 LEU A 106 0.566 4.363 14.139 1.00 16.87 C ATOM 1670 CD2 LEU A 106 0.472 6.118 15.997 1.00 13.78 C ATOM 1671 HA LEU A 106 2.547 7.647 15.901 1.00 0.00 H ATOM 1672 HB2 LEU A 106 2.847 5.755 13.548 1.00 0.00 H ATOM 1673 HB3 LEU A 106 2.930 5.190 15.233 1.00 0.00 H ATOM 1674 HG LEU A 106 0.548 6.505 13.891 1.00 0.00 H ATOM 1675 HD21 LEU A 106 0.916 5.427 16.713 1.00 0.00 H ATOM 1676 HD22 LEU A 106 0.744 7.140 16.260 1.00 0.00 H ATOM 1677 HD23 LEU A 106 -0.613 6.013 16.014 1.00 0.00 H ATOM 1678 HD11 LEU A 106 0.921 4.184 13.124 1.00 0.00 H ATOM 1679 HD12 LEU A 106 1.003 3.626 14.813 1.00 0.00 H ATOM 1680 HD13 LEU A 106 -0.521 4.282 14.165 1.00 0.00 H ATOM 1681 H LEU A 106 2.367 8.010 13.086 1.00 0.00 H ATOM 1682 N GLU A 107 5.377 7.285 14.258 1.00 26.04 N ATOM 1683 CA GLU A 107 6.837 7.143 14.395 1.00 29.68 C ATOM 1684 C GLU A 107 7.550 8.456 14.786 1.00 31.61 C ATOM 1685 O GLU A 107 8.773 8.526 14.777 1.00 36.44 O ATOM 1686 CB GLU A 107 7.443 6.576 13.106 1.00 27.85 C ATOM 1687 CG GLU A 107 6.932 5.189 12.752 1.00 32.72 C ATOM 1688 CD GLU A 107 7.369 4.729 11.371 1.00 36.80 C ATOM 1689 OE1 GLU A 107 7.586 5.592 10.493 1.00 41.74 O ATOM 1690 OE2 GLU A 107 7.478 3.500 11.157 1.00 35.95 O ATOM 1691 HA GLU A 107 6.999 6.446 15.217 1.00 0.00 H ATOM 1692 HB2 GLU A 107 7.202 7.252 12.285 1.00 0.00 H ATOM 1693 HB3 GLU A 107 8.525 6.524 13.227 1.00 0.00 H ATOM 1694 HG2 GLU A 107 7.309 4.481 13.490 1.00 0.00 H ATOM 1695 HG3 GLU A 107 5.843 5.201 12.786 1.00 0.00 H ATOM 1696 H GLU A 107 4.974 7.455 13.314 1.00 0.00 H ATOM 1697 N ALA A 108 6.781 9.484 15.127 1.00 27.90 N ATOM 1698 CA ALA A 108 7.368 10.753 15.550 1.00 32.70 C ATOM 1699 C ALA A 108 7.209 10.954 17.059 1.00 34.95 C ATOM 1700 O ALA A 108 8.119 10.651 17.837 1.00 42.06 O ATOM 1701 CB ALA A 108 6.752 11.926 14.770 1.00 18.45 C ATOM 1702 HA ALA A 108 8.435 10.723 15.328 1.00 0.00 H ATOM 1703 HB1 ALA A 108 6.938 11.790 13.705 1.00 0.00 H ATOM 1704 HB2 ALA A 108 5.678 11.957 14.952 1.00 0.00 H ATOM 1705 HB3 ALA A 108 7.205 12.860 15.103 1.00 0.00 H ATOM 1706 H ALA A 108 5.746 9.384 15.092 1.00 0.00 H TER 1707 ALA A 108 ATOM 1708 N GLU B 3 -15.494 5.644 -3.306 1.00 32.06 N ATOM 1709 CA GLU B 3 -15.526 4.284 -3.915 1.00 25.59 C ATOM 1710 C GLU B 3 -14.295 3.464 -3.521 1.00 25.62 C ATOM 1711 O GLU B 3 -13.769 2.697 -4.332 1.00 25.90 O ATOM 1712 CB GLU B 3 -15.617 4.383 -5.436 1.00 23.54 C ATOM 1713 CG GLU B 3 -16.568 5.439 -5.933 1.00 20.09 C ATOM 1714 CD GLU B 3 -16.299 5.818 -7.372 1.00 23.24 C ATOM 1715 OE1 GLU B 3 -15.111 5.972 -7.725 1.00 21.59 O ATOM 1716 OE2 GLU B 3 -17.273 5.965 -8.154 1.00 25.45 O ATOM 1717 HA GLU B 3 -16.411 3.774 -3.534 1.00 0.00 H ATOM 1718 HB2 GLU B 3 -14.623 4.608 -5.824 1.00 0.00 H ATOM 1719 HB3 GLU B 3 -15.946 3.418 -5.822 1.00 0.00 H ATOM 1720 HG2 GLU B 3 -17.587 5.060 -5.854 1.00 0.00 H ATOM 1721 HG3 GLU B 3 -16.463 6.327 -5.310 1.00 0.00 H ATOM 1722 HN3 GLU B 3 -14.644 6.148 -3.631 1.00 0.00 H ATOM 1723 HN2 GLU B 3 -15.473 5.558 -2.270 1.00 0.00 H ATOM 1724 HN1 GLU B 3 -16.343 6.172 -3.594 1.00 0.00 H ATOM 1725 N ILE B 4 -13.819 3.654 -2.287 1.00 21.37 N ATOM 1726 CA ILE B 4 -12.823 2.749 -1.704 1.00 21.77 C ATOM 1727 C ILE B 4 -13.533 1.536 -1.098 1.00 19.49 C ATOM 1728 O ILE B 4 -14.433 1.689 -0.265 1.00 15.12 O ATOM 1729 CB ILE B 4 -11.958 3.445 -0.606 1.00 21.20 C ATOM 1730 CG1 ILE B 4 -11.128 4.573 -1.212 1.00 25.84 C ATOM 1731 CG2 ILE B 4 -11.045 2.443 0.074 1.00 18.79 C ATOM 1732 CD1 ILE B 4 -10.163 5.200 -0.253 1.00 29.77 C ATOM 1733 HA ILE B 4 -12.151 2.441 -2.505 1.00 0.00 H ATOM 1734 HB ILE B 4 -12.634 3.865 0.139 1.00 0.00 H ATOM 1735 HG12 ILE B 4 -10.564 4.170 -2.053 1.00 0.00 H ATOM 1736 HG13 ILE B 4 -11.808 5.346 -1.569 1.00 0.00 H ATOM 1737 HD11 ILE B 4 -10.712 5.620 0.590 1.00 0.00 H ATOM 1738 HD12 ILE B 4 -9.466 4.443 0.106 1.00 0.00 H ATOM 1739 HD13 ILE B 4 -9.612 5.992 -0.760 1.00 0.00 H ATOM 1740 HG21 ILE B 4 -11.647 1.664 0.541 1.00 0.00 H ATOM 1741 HG22 ILE B 4 -10.382 1.997 -0.667 1.00 0.00 H ATOM 1742 HG23 ILE B 4 -10.452 2.951 0.835 1.00 0.00 H ATOM 1743 H ILE B 4 -14.162 4.461 -1.728 1.00 0.00 H ATOM 1744 N PRO B 5 -13.155 0.325 -1.545 1.00 20.92 N ATOM 1745 CA PRO B 5 -13.788 -0.905 -1.067 1.00 22.03 C ATOM 1746 C PRO B 5 -13.742 -1.026 0.456 1.00 19.23 C ATOM 1747 O PRO B 5 -12.728 -0.689 1.082 1.00 19.81 O ATOM 1748 CB PRO B 5 -12.947 -2.005 -1.722 1.00 24.31 C ATOM 1749 CG PRO B 5 -12.456 -1.375 -2.994 1.00 22.66 C ATOM 1750 CD PRO B 5 -12.190 0.065 -2.634 1.00 23.50 C ATOM 1751 HA PRO B 5 -14.847 -0.950 -1.321 1.00 0.00 H ATOM 1752 HD3 PRO B 5 -11.165 0.199 -2.289 1.00 0.00 H ATOM 1753 HD2 PRO B 5 -12.374 0.721 -3.485 1.00 0.00 H ATOM 1754 HG3 PRO B 5 -13.215 -1.442 -3.774 1.00 0.00 H ATOM 1755 HG2 PRO B 5 -11.542 -1.861 -3.335 1.00 0.00 H ATOM 1756 HB2 PRO B 5 -12.112 -2.288 -1.082 1.00 0.00 H ATOM 1757 HB3 PRO B 5 -13.555 -2.884 -1.934 1.00 0.00 H ATOM 1758 N LYS B 6 -14.839 -1.509 1.037 1.00 17.02 N ATOM 1759 CA LYS B 6 -14.956 -1.658 2.479 1.00 18.21 C ATOM 1760 C LYS B 6 -13.832 -2.536 3.031 1.00 13.23 C ATOM 1761 O LYS B 6 -13.346 -2.315 4.141 1.00 19.51 O ATOM 1762 CB LYS B 6 -16.320 -2.247 2.830 1.00 21.61 C ATOM 1763 CG LYS B 6 -16.789 -1.971 4.258 1.00 28.45 C ATOM 1764 CD LYS B 6 -18.262 -2.398 4.434 1.00 26.89 C ATOM 1765 CE LYS B 6 -18.439 -3.891 4.146 1.00 23.74 C ATOM 1766 NZ LYS B 6 -19.784 -4.208 3.627 1.00 19.67 N ATOM 1767 HA LYS B 6 -14.866 -0.674 2.939 1.00 0.00 H ATOM 1768 HB2 LYS B 6 -17.057 -1.829 2.144 1.00 0.00 H ATOM 1769 HB3 LYS B 6 -16.269 -3.327 2.692 1.00 0.00 H ATOM 1770 HG2 LYS B 6 -16.167 -2.532 4.955 1.00 0.00 H ATOM 1771 HG3 LYS B 6 -16.697 -0.905 4.467 1.00 0.00 H ATOM 1772 HD2 LYS B 6 -18.573 -2.193 5.458 1.00 0.00 H ATOM 1773 HD3 LYS B 6 -18.884 -1.826 3.746 1.00 0.00 H ATOM 1774 HE2 LYS B 6 -18.280 -4.447 5.070 1.00 0.00 H ATOM 1775 HE3 LYS B 6 -17.698 -4.196 3.407 1.00 0.00 H ATOM 1776 HZ1 LYS B 6 -20.500 -3.928 4.328 1.00 0.00 H ATOM 1777 HZ2 LYS B 6 -19.944 -3.688 2.741 1.00 0.00 H ATOM 1778 HZ3 LYS B 6 -19.853 -5.230 3.448 1.00 0.00 H ATOM 1779 H LYS B 6 -15.641 -1.790 0.438 1.00 0.00 H ATOM 1780 N GLU B 7 -13.408 -3.516 2.239 1.00 10.23 N ATOM 1781 CA GLU B 7 -12.321 -4.406 2.633 1.00 13.60 C ATOM 1782 C GLU B 7 -10.949 -3.709 2.595 1.00 15.77 C ATOM 1783 O GLU B 7 -10.035 -4.088 3.335 1.00 14.86 O ATOM 1784 CB GLU B 7 -12.313 -5.669 1.769 1.00 19.57 C ATOM 1785 CG GLU B 7 -12.204 -5.402 0.273 1.00 25.88 C ATOM 1786 CD GLU B 7 -13.565 -5.331 -0.428 1.00 28.22 C ATOM 1787 OE1 GLU B 7 -14.599 -5.217 0.266 1.00 25.18 O ATOM 1788 OE2 GLU B 7 -13.591 -5.398 -1.681 1.00 28.07 O ATOM 1789 HA GLU B 7 -12.504 -4.692 3.669 1.00 0.00 H ATOM 1790 HB2 GLU B 7 -11.464 -6.284 2.069 1.00 0.00 H ATOM 1791 HB3 GLU B 7 -13.238 -6.215 1.953 1.00 0.00 H ATOM 1792 HG2 GLU B 7 -11.689 -4.453 0.127 1.00 0.00 H ATOM 1793 HG3 GLU B 7 -11.622 -6.204 -0.181 1.00 0.00 H ATOM 1794 H GLU B 7 -13.863 -3.652 1.314 1.00 0.00 H ATOM 1795 N MET B 8 -10.811 -2.671 1.765 1.00 12.68 N ATOM 1796 CA MET B 8 -9.572 -1.877 1.759 1.00 13.86 C ATOM 1797 C MET B 8 -9.485 -0.938 2.982 1.00 17.17 C ATOM 1798 O MET B 8 -8.393 -0.714 3.541 1.00 20.47 O ATOM 1799 CB MET B 8 -9.433 -1.076 0.459 1.00 14.95 C ATOM 1800 CG MET B 8 -8.092 -0.369 0.322 1.00 11.75 C ATOM 1801 SD MET B 8 -7.943 0.614 -1.187 1.00 9.42 S ATOM 1802 CE MET B 8 -7.821 -0.678 -2.413 1.00 13.11 C ATOM 1803 HA MET B 8 -8.743 -2.582 1.821 1.00 0.00 H ATOM 1804 HB2 MET B 8 -9.551 -1.759 -0.382 1.00 0.00 H ATOM 1805 HB3 MET B 8 -10.223 -0.326 0.429 1.00 0.00 H ATOM 1806 HG2 MET B 8 -7.304 -1.122 0.322 1.00 0.00 H ATOM 1807 HG3 MET B 8 -7.962 0.292 1.179 1.00 0.00 H ATOM 1808 HE1 MET B 8 -6.947 -1.294 -2.204 1.00 0.00 H ATOM 1809 HE2 MET B 8 -8.719 -1.295 -2.379 1.00 0.00 H ATOM 1810 HE3 MET B 8 -7.723 -0.231 -3.402 1.00 0.00 H ATOM 1811 H MET B 8 -11.586 -2.422 1.118 1.00 0.00 H ATOM 1812 N LEU B 9 -10.627 -0.372 3.376 1.00 16.01 N ATOM 1813 CA LEU B 9 -10.693 0.477 4.576 1.00 21.30 C ATOM 1814 C LEU B 9 -10.378 -0.348 5.829 1.00 21.18 C ATOM 1815 O LEU B 9 -9.647 0.101 6.728 1.00 15.68 O ATOM 1816 CB LEU B 9 -12.077 1.130 4.698 1.00 13.66 C ATOM 1817 CG LEU B 9 -12.460 1.967 3.473 1.00 17.88 C ATOM 1818 CD1 LEU B 9 -13.936 2.238 3.437 1.00 16.03 C ATOM 1819 CD2 LEU B 9 -11.672 3.264 3.443 1.00 18.45 C ATOM 1820 HA LEU B 9 -9.947 1.267 4.483 1.00 0.00 H ATOM 1821 HB2 LEU B 9 -12.821 0.344 4.827 1.00 0.00 H ATOM 1822 HB3 LEU B 9 -12.079 1.778 5.575 1.00 0.00 H ATOM 1823 HG LEU B 9 -12.208 1.391 2.583 1.00 0.00 H ATOM 1824 HD21 LEU B 9 -11.886 3.838 4.344 1.00 0.00 H ATOM 1825 HD22 LEU B 9 -10.606 3.039 3.398 1.00 0.00 H ATOM 1826 HD23 LEU B 9 -11.960 3.842 2.565 1.00 0.00 H ATOM 1827 HD11 LEU B 9 -14.477 1.293 3.394 1.00 0.00 H ATOM 1828 HD12 LEU B 9 -14.226 2.784 4.335 1.00 0.00 H ATOM 1829 HD13 LEU B 9 -14.173 2.834 2.556 1.00 0.00 H ATOM 1830 H LEU B 9 -11.492 -0.535 2.822 1.00 0.00 H ATOM 1831 N ARG B 10 -10.931 -1.553 5.872 1.00 14.90 N ATOM 1832 CA ARG B 10 -10.635 -2.504 6.917 1.00 18.16 C ATOM 1833 C ARG B 10 -9.144 -2.810 6.961 1.00 21.78 C ATOM 1834 O ARG B 10 -8.550 -2.856 8.036 1.00 20.47 O ATOM 1835 CB ARG B 10 -11.428 -3.789 6.685 1.00 26.59 C ATOM 1836 CG ARG B 10 -11.248 -4.853 7.759 1.00 37.19 C ATOM 1837 CD ARG B 10 -12.286 -5.963 7.581 1.00 47.01 C ATOM 1838 NE ARG B 10 -13.654 -5.424 7.504 1.00 51.55 N ATOM 1839 CZ ARG B 10 -14.426 -5.454 6.415 1.00 51.30 C ATOM 1840 NH1 ARG B 10 -15.650 -4.933 6.456 1.00 50.23 N ATOM 1841 NH2 ARG B 10 -13.985 -6.013 5.291 1.00 51.49 N ATOM 1842 HA ARG B 10 -10.923 -2.071 7.875 1.00 0.00 H ATOM 1843 HB2 ARG B 10 -12.486 -3.531 6.637 1.00 0.00 H ATOM 1844 HB3 ARG B 10 -11.115 -4.213 5.731 1.00 0.00 H ATOM 1845 HG2 ARG B 10 -10.248 -5.279 7.681 1.00 0.00 H ATOM 1846 HG3 ARG B 10 -11.372 -4.398 8.742 1.00 0.00 H ATOM 1847 HD2 ARG B 10 -12.222 -6.645 8.429 1.00 0.00 H ATOM 1848 HD3 ARG B 10 -12.068 -6.506 6.662 1.00 0.00 H ATOM 1849 HE ARG B 10 -14.048 -4.987 8.362 1.00 0.00 H ATOM 1850 HH12 ARG B 10 -16.253 -4.955 5.609 1.00 0.00 H ATOM 1851 HH11 ARG B 10 -16.003 -4.504 7.335 1.00 0.00 H ATOM 1852 HH22 ARG B 10 -14.592 -6.032 4.447 1.00 0.00 H ATOM 1853 HH21 ARG B 10 -13.033 -6.430 5.257 1.00 0.00 H ATOM 1854 H ARG B 10 -11.603 -1.823 5.125 1.00 0.00 H ATOM 1855 N ALA B 11 -8.539 -3.021 5.785 1.00 12.24 N ATOM 1856 CA ALA B 11 -7.119 -3.343 5.701 1.00 15.94 C ATOM 1857 C ALA B 11 -6.285 -2.167 6.220 1.00 20.93 C ATOM 1858 O ALA B 11 -5.299 -2.358 6.914 1.00 20.49 O ATOM 1859 CB ALA B 11 -6.721 -3.693 4.242 1.00 14.37 C ATOM 1860 HA ALA B 11 -6.921 -4.216 6.323 1.00 0.00 H ATOM 1861 HB1 ALA B 11 -7.299 -4.554 3.906 1.00 0.00 H ATOM 1862 HB2 ALA B 11 -6.928 -2.840 3.596 1.00 0.00 H ATOM 1863 HB3 ALA B 11 -5.658 -3.930 4.204 1.00 0.00 H ATOM 1864 H ALA B 11 -9.096 -2.954 4.909 1.00 0.00 H ATOM 1865 N GLN B 12 -6.690 -0.948 5.861 1.00 21.29 N ATOM 1866 CA GLN B 12 -5.961 0.257 6.264 1.00 20.63 C ATOM 1867 C GLN B 12 -6.019 0.435 7.795 1.00 23.66 C ATOM 1868 O GLN B 12 -5.016 0.756 8.441 1.00 19.37 O ATOM 1869 CB GLN B 12 -6.538 1.489 5.547 1.00 15.63 C ATOM 1870 CG GLN B 12 -6.230 1.515 4.059 1.00 16.37 C ATOM 1871 CD GLN B 12 -7.018 2.543 3.329 1.00 11.28 C ATOM 1872 OE1 GLN B 12 -8.014 3.062 3.855 1.00 15.47 O ATOM 1873 NE2 GLN B 12 -6.603 2.853 2.069 1.00 4.52 N ATOM 1874 HA GLN B 12 -4.915 0.149 5.975 1.00 0.00 H ATOM 1875 HB2 GLN B 12 -7.620 1.491 5.677 1.00 0.00 H ATOM 1876 HB3 GLN B 12 -6.117 2.385 6.004 1.00 0.00 H ATOM 1877 HG2 GLN B 12 -5.169 1.728 3.926 1.00 0.00 H ATOM 1878 HG3 GLN B 12 -6.458 0.536 3.638 1.00 0.00 H ATOM 1879 HE22 GLN B 12 -5.761 2.391 1.670 1.00 0.00 H ATOM 1880 HE21 GLN B 12 -7.128 3.552 1.506 1.00 0.00 H ATOM 1881 H GLN B 12 -7.547 -0.850 5.279 1.00 0.00 H ATOM 1882 N THR B 13 -7.201 0.215 8.355 1.00 17.33 N ATOM 1883 CA THR B 13 -7.391 0.238 9.782 1.00 22.98 C ATOM 1884 C THR B 13 -6.495 -0.789 10.478 1.00 22.14 C ATOM 1885 O THR B 13 -5.879 -0.482 11.491 1.00 22.26 O ATOM 1886 CB THR B 13 -8.854 -0.032 10.139 1.00 20.21 C ATOM 1887 OG1 THR B 13 -9.664 1.044 9.649 1.00 21.58 O ATOM 1888 CG2 THR B 13 -9.041 -0.172 11.674 1.00 23.39 C ATOM 1889 HA THR B 13 -7.116 1.233 10.131 1.00 0.00 H ATOM 1890 HB THR B 13 -9.157 -0.971 9.675 1.00 0.00 H ATOM 1891 HG1 THR B 13 -9.567 1.107 8.666 1.00 0.00 H ATOM 1892 HG23 THR B 13 -8.423 -0.991 12.041 1.00 0.00 H ATOM 1893 HG21 THR B 13 -8.743 0.756 12.161 1.00 0.00 H ATOM 1894 HG22 THR B 13 -10.088 -0.379 11.894 1.00 0.00 H ATOM 1895 H THR B 13 -8.018 0.019 7.743 1.00 0.00 H ATOM 1896 N ASN B 14 -6.464 -2.010 9.948 1.00 22.07 N ATOM 1897 CA ASN B 14 -5.573 -3.057 10.460 1.00 23.56 C ATOM 1898 C ASN B 14 -4.116 -2.620 10.464 1.00 28.11 C ATOM 1899 O ASN B 14 -3.401 -2.812 11.445 1.00 18.66 O ATOM 1900 CB ASN B 14 -5.683 -4.308 9.603 1.00 23.48 C ATOM 1901 CG ASN B 14 -6.751 -5.218 10.066 1.00 30.51 C ATOM 1902 OD1 ASN B 14 -7.311 -5.028 11.127 1.00 27.99 O ATOM 1903 ND2 ASN B 14 -7.049 -6.230 9.271 1.00 36.47 N ATOM 1904 HA ASN B 14 -5.886 -3.258 11.485 1.00 0.00 H ATOM 1905 HB2 ASN B 14 -5.897 -4.011 8.576 1.00 0.00 H ATOM 1906 HB3 ASN B 14 -4.732 -4.839 9.636 1.00 0.00 H ATOM 1907 HD22 ASN B 14 -6.542 -6.352 8.371 1.00 0.00 H ATOM 1908 HD21 ASN B 14 -7.791 -6.905 9.545 1.00 0.00 H ATOM 1909 H ASN B 14 -7.090 -2.228 9.147 1.00 0.00 H ATOM 1910 N VAL B 15 -3.671 -2.081 9.328 1.00 22.51 N ATOM 1911 CA VAL B 15 -2.295 -1.664 9.165 1.00 22.08 C ATOM 1912 C VAL B 15 -1.928 -0.552 10.158 1.00 28.94 C ATOM 1913 O VAL B 15 -0.819 -0.518 10.695 1.00 27.43 O ATOM 1914 CB VAL B 15 -2.046 -1.196 7.723 1.00 24.90 C ATOM 1915 CG1 VAL B 15 -0.718 -0.456 7.607 1.00 24.47 C ATOM 1916 CG2 VAL B 15 -2.120 -2.423 6.739 1.00 21.03 C ATOM 1917 HA VAL B 15 -1.657 -2.523 9.373 1.00 0.00 H ATOM 1918 HB VAL B 15 -2.827 -0.490 7.443 1.00 0.00 H ATOM 1919 HG11 VAL B 15 -0.732 0.417 8.260 1.00 0.00 H ATOM 1920 HG12 VAL B 15 0.094 -1.120 7.903 1.00 0.00 H ATOM 1921 HG13 VAL B 15 -0.570 -0.137 6.575 1.00 0.00 H ATOM 1922 HG21 VAL B 15 -1.361 -3.155 7.015 1.00 0.00 H ATOM 1923 HG22 VAL B 15 -3.108 -2.880 6.803 1.00 0.00 H ATOM 1924 HG23 VAL B 15 -1.942 -2.081 5.720 1.00 0.00 H ATOM 1925 H VAL B 15 -4.333 -1.957 8.536 1.00 0.00 H ATOM 1926 N ILE B 16 -2.864 0.353 10.403 1.00 24.35 N ATOM 1927 CA ILE B 16 -2.629 1.427 11.349 1.00 26.56 C ATOM 1928 C ILE B 16 -2.482 0.872 12.771 1.00 26.64 C ATOM 1929 O ILE B 16 -1.522 1.174 13.463 1.00 32.07 O ATOM 1930 CB ILE B 16 -3.745 2.461 11.302 1.00 19.61 C ATOM 1931 CG1 ILE B 16 -3.648 3.268 9.988 1.00 21.85 C ATOM 1932 CG2 ILE B 16 -3.667 3.381 12.505 1.00 20.88 C ATOM 1933 CD1 ILE B 16 -4.832 4.183 9.744 1.00 21.16 C ATOM 1934 HA ILE B 16 -1.699 1.919 11.065 1.00 0.00 H ATOM 1935 HB ILE B 16 -4.707 1.950 11.332 1.00 0.00 H ATOM 1936 HG12 ILE B 16 -2.744 3.877 10.024 1.00 0.00 H ATOM 1937 HG13 ILE B 16 -3.579 2.566 9.157 1.00 0.00 H ATOM 1938 HD11 ILE B 16 -5.744 3.589 9.693 1.00 0.00 H ATOM 1939 HD12 ILE B 16 -4.909 4.901 10.561 1.00 0.00 H ATOM 1940 HD13 ILE B 16 -4.691 4.715 8.803 1.00 0.00 H ATOM 1941 HG21 ILE B 16 -3.766 2.793 13.417 1.00 0.00 H ATOM 1942 HG22 ILE B 16 -2.706 3.896 12.506 1.00 0.00 H ATOM 1943 HG23 ILE B 16 -4.473 4.113 12.454 1.00 0.00 H ATOM 1944 H ILE B 16 -3.778 0.293 9.911 1.00 0.00 H ATOM 1945 N LEU B 17 -3.433 0.044 13.180 1.00 20.32 N ATOM 1946 CA LEU B 17 -3.392 -0.593 14.496 1.00 22.81 C ATOM 1947 C LEU B 17 -2.115 -1.437 14.708 1.00 21.96 C ATOM 1948 O LEU B 17 -1.532 -1.392 15.759 1.00 16.24 O ATOM 1949 CB LEU B 17 -4.639 -1.450 14.715 1.00 13.64 C ATOM 1950 CG LEU B 17 -5.936 -0.658 14.907 1.00 15.55 C ATOM 1951 CD1 LEU B 17 -7.155 -1.562 14.781 1.00 9.02 C ATOM 1952 CD2 LEU B 17 -5.921 0.042 16.272 1.00 10.77 C ATOM 1953 HA LEU B 17 -3.371 0.208 15.235 1.00 0.00 H ATOM 1954 HB2 LEU B 17 -4.762 -2.098 13.847 1.00 0.00 H ATOM 1955 HB3 LEU B 17 -4.479 -2.061 15.604 1.00 0.00 H ATOM 1956 HG LEU B 17 -6.001 0.096 14.122 1.00 0.00 H ATOM 1957 HD21 LEU B 17 -5.834 -0.705 17.061 1.00 0.00 H ATOM 1958 HD22 LEU B 17 -5.072 0.723 16.320 1.00 0.00 H ATOM 1959 HD23 LEU B 17 -6.846 0.603 16.401 1.00 0.00 H ATOM 1960 HD11 LEU B 17 -7.167 -2.017 13.791 1.00 0.00 H ATOM 1961 HD12 LEU B 17 -7.107 -2.342 15.540 1.00 0.00 H ATOM 1962 HD13 LEU B 17 -8.060 -0.971 14.922 1.00 0.00 H ATOM 1963 H LEU B 17 -4.232 -0.159 12.546 1.00 0.00 H ATOM 1964 N LEU B 18 -1.717 -2.215 13.698 1.00 16.40 N ATOM 1965 CA LEU B 18 -0.520 -3.037 13.809 1.00 21.65 C ATOM 1966 C LEU B 18 0.719 -2.163 13.941 1.00 26.06 C ATOM 1967 O LEU B 18 1.689 -2.549 14.597 1.00 18.44 O ATOM 1968 CB LEU B 18 -0.386 -3.992 12.614 1.00 11.46 C ATOM 1969 CG LEU B 18 -1.462 -5.090 12.587 1.00 12.11 C ATOM 1970 CD1 LEU B 18 -1.398 -5.850 11.270 1.00 9.13 C ATOM 1971 CD2 LEU B 18 -1.291 -6.044 13.750 1.00 5.52 C ATOM 1972 HA LEU B 18 -0.613 -3.643 14.710 1.00 0.00 H ATOM 1973 HB2 LEU B 18 -0.463 -3.410 11.696 1.00 0.00 H ATOM 1974 HB3 LEU B 18 0.593 -4.468 12.660 1.00 0.00 H ATOM 1975 HG LEU B 18 -2.439 -4.615 12.678 1.00 0.00 H ATOM 1976 HD21 LEU B 18 -0.309 -6.514 13.692 1.00 0.00 H ATOM 1977 HD22 LEU B 18 -1.376 -5.492 14.686 1.00 0.00 H ATOM 1978 HD23 LEU B 18 -2.065 -6.810 13.707 1.00 0.00 H ATOM 1979 HD11 LEU B 18 -1.569 -5.159 10.445 1.00 0.00 H ATOM 1980 HD12 LEU B 18 -0.415 -6.308 11.164 1.00 0.00 H ATOM 1981 HD13 LEU B 18 -2.164 -6.625 11.262 1.00 0.00 H ATOM 1982 H LEU B 18 -2.271 -2.234 12.818 1.00 0.00 H ATOM 1983 N ASN B 19 0.680 -0.976 13.343 1.00 21.64 N ATOM 1984 CA ASN B 19 1.778 -0.030 13.510 1.00 21.22 C ATOM 1985 C ASN B 19 1.796 0.658 14.862 1.00 18.54 C ATOM 1986 O ASN B 19 2.842 1.072 15.339 1.00 22.47 O ATOM 1987 CB ASN B 19 1.840 0.977 12.366 1.00 18.26 C ATOM 1988 CG ASN B 19 2.585 0.437 11.175 1.00 20.51 C ATOM 1989 OD1 ASN B 19 3.811 0.498 11.117 1.00 17.41 O ATOM 1990 ND2 ASN B 19 1.850 -0.140 10.228 1.00 17.00 N ATOM 1991 HA ASN B 19 2.685 -0.633 13.475 1.00 0.00 H ATOM 1992 HB2 ASN B 19 0.824 1.226 12.061 1.00 0.00 H ATOM 1993 HB3 ASN B 19 2.344 1.878 12.717 1.00 0.00 H ATOM 1994 HD22 ASN B 19 0.814 -0.169 10.319 1.00 0.00 H ATOM 1995 HD21 ASN B 19 2.311 -0.562 9.397 1.00 0.00 H ATOM 1996 H ASN B 19 -0.138 -0.721 12.753 1.00 0.00 H ATOM 1997 N VAL B 20 0.651 0.767 15.496 1.00 17.40 N ATOM 1998 CA VAL B 20 0.646 1.259 16.855 1.00 14.53 C ATOM 1999 C VAL B 20 1.385 0.241 17.726 1.00 16.24 C ATOM 2000 O VAL B 20 2.277 0.584 18.493 1.00 24.63 O ATOM 2001 CB VAL B 20 -0.764 1.447 17.382 1.00 12.82 C ATOM 2002 CG1 VAL B 20 -0.725 1.808 18.888 1.00 10.76 C ATOM 2003 CG2 VAL B 20 -1.485 2.532 16.582 1.00 20.29 C ATOM 2004 HA VAL B 20 1.135 2.233 16.881 1.00 0.00 H ATOM 2005 HB VAL B 20 -1.315 0.513 17.266 1.00 0.00 H ATOM 2006 HG11 VAL B 20 -0.240 1.003 19.441 1.00 0.00 H ATOM 2007 HG12 VAL B 20 -0.165 2.733 19.024 1.00 0.00 H ATOM 2008 HG13 VAL B 20 -1.743 1.940 19.255 1.00 0.00 H ATOM 2009 HG21 VAL B 20 -0.940 3.472 16.674 1.00 0.00 H ATOM 2010 HG22 VAL B 20 -1.531 2.238 15.533 1.00 0.00 H ATOM 2011 HG23 VAL B 20 -2.496 2.657 16.970 1.00 0.00 H ATOM 2012 H VAL B 20 -0.239 0.503 15.027 1.00 0.00 H ATOM 2013 N LEU B 21 1.011 -1.015 17.571 1.00 13.65 N ATOM 2014 CA LEU B 21 1.636 -2.124 18.293 1.00 18.95 C ATOM 2015 C LEU B 21 3.161 -2.285 17.975 1.00 20.76 C ATOM 2016 O LEU B 21 3.968 -2.668 18.843 1.00 20.34 O ATOM 2017 CB LEU B 21 0.874 -3.415 17.977 1.00 15.53 C ATOM 2018 CG LEU B 21 -0.219 -3.789 18.985 1.00 22.84 C ATOM 2019 CD1 LEU B 21 -0.966 -2.598 19.488 1.00 22.64 C ATOM 2020 CD2 LEU B 21 -1.141 -4.848 18.424 1.00 14.25 C ATOM 2021 HA LEU B 21 1.578 -1.902 19.359 1.00 0.00 H ATOM 2022 HB2 LEU B 21 0.407 -3.301 16.999 1.00 0.00 H ATOM 2023 HB3 LEU B 21 1.594 -4.232 17.941 1.00 0.00 H ATOM 2024 HG LEU B 21 0.280 -4.218 19.854 1.00 0.00 H ATOM 2025 HD21 LEU B 21 -1.616 -4.471 17.518 1.00 0.00 H ATOM 2026 HD22 LEU B 21 -0.564 -5.742 18.188 1.00 0.00 H ATOM 2027 HD23 LEU B 21 -1.905 -5.091 19.163 1.00 0.00 H ATOM 2028 HD11 LEU B 21 -0.272 -1.918 19.982 1.00 0.00 H ATOM 2029 HD12 LEU B 21 -1.442 -2.089 18.650 1.00 0.00 H ATOM 2030 HD13 LEU B 21 -1.727 -2.921 20.198 1.00 0.00 H ATOM 2031 H LEU B 21 0.239 -1.226 16.907 1.00 0.00 H ATOM 2032 N LYS B 22 3.528 -2.011 16.736 1.00 19.48 N ATOM 2033 CA LYS B 22 4.908 -2.052 16.328 1.00 22.74 C ATOM 2034 C LYS B 22 5.733 -1.048 17.143 1.00 26.61 C ATOM 2035 O LYS B 22 6.878 -1.315 17.483 1.00 22.13 O ATOM 2036 CB LYS B 22 5.017 -1.749 14.835 1.00 25.60 C ATOM 2037 CG LYS B 22 6.404 -1.706 14.322 1.00 27.46 C ATOM 2038 CD LYS B 22 6.412 -1.550 12.824 1.00 35.59 C ATOM 2039 CE LYS B 22 7.616 -2.225 12.223 1.00 37.77 C ATOM 2040 NZ LYS B 22 7.470 -2.373 10.758 1.00 45.61 N ATOM 2041 HA LYS B 22 5.304 -3.051 16.512 1.00 0.00 H ATOM 2042 HB2 LYS B 22 4.475 -2.521 14.289 1.00 0.00 H ATOM 2043 HB3 LYS B 22 4.554 -0.780 14.648 1.00 0.00 H ATOM 2044 HG2 LYS B 22 6.927 -0.862 14.773 1.00 0.00 H ATOM 2045 HG3 LYS B 22 6.913 -2.632 14.589 1.00 0.00 H ATOM 2046 HD2 LYS B 22 5.508 -1.999 12.413 1.00 0.00 H ATOM 2047 HD3 LYS B 22 6.435 -0.489 12.575 1.00 0.00 H ATOM 2048 HE2 LYS B 22 7.731 -3.212 12.671 1.00 0.00 H ATOM 2049 HE3 LYS B 22 8.502 -1.626 12.434 1.00 0.00 H ATOM 2050 HZ1 LYS B 22 6.628 -2.948 10.551 1.00 0.00 H ATOM 2051 HZ2 LYS B 22 7.365 -1.433 10.325 1.00 0.00 H ATOM 2052 HZ3 LYS B 22 8.315 -2.841 10.372 1.00 0.00 H ATOM 2053 H LYS B 22 2.801 -1.759 16.037 1.00 0.00 H ATOM 2054 N GLN B 23 5.129 0.100 17.465 1.00 24.19 N ATOM 2055 CA GLN B 23 5.793 1.127 18.265 1.00 21.44 C ATOM 2056 C GLN B 23 5.978 0.677 19.715 1.00 27.16 C ATOM 2057 O GLN B 23 6.918 1.092 20.379 1.00 27.59 O ATOM 2058 CB GLN B 23 5.004 2.444 18.238 1.00 21.93 C ATOM 2059 CG GLN B 23 4.689 2.963 16.848 1.00 28.11 C ATOM 2060 CD GLN B 23 5.837 2.770 15.889 1.00 31.76 C ATOM 2061 OE1 GLN B 23 6.967 3.180 16.162 1.00 37.55 O ATOM 2062 NE2 GLN B 23 5.561 2.135 14.761 1.00 33.80 N ATOM 2063 HA GLN B 23 6.775 1.288 17.821 1.00 0.00 H ATOM 2064 HB2 GLN B 23 4.062 2.287 18.764 1.00 0.00 H ATOM 2065 HB3 GLN B 23 5.589 3.202 18.760 1.00 0.00 H ATOM 2066 HG2 GLN B 23 3.819 2.431 16.464 1.00 0.00 H ATOM 2067 HG3 GLN B 23 4.463 4.027 16.914 1.00 0.00 H ATOM 2068 HE22 GLN B 23 4.592 1.807 14.573 1.00 0.00 H ATOM 2069 HE21 GLN B 23 6.313 1.964 14.063 1.00 0.00 H ATOM 2070 H GLN B 23 4.157 0.268 17.136 1.00 0.00 H ATOM 2071 N GLY B 24 5.071 -0.165 20.208 1.00 23.69 N ATOM 2072 CA GLY B 24 5.217 -0.730 21.569 1.00 20.08 C ATOM 2073 C GLY B 24 3.941 -1.421 22.005 1.00 19.76 C ATOM 2074 O GLY B 24 2.849 -1.099 21.511 1.00 20.26 O ATOM 2075 HA3 GLY B 24 5.444 0.075 22.268 1.00 0.00 H ATOM 2076 HA2 GLY B 24 6.033 -1.452 21.571 1.00 0.00 H ATOM 2077 H GLY B 24 4.249 -0.429 19.629 1.00 0.00 H ATOM 2078 N ASP B 25 4.075 -2.390 22.906 1.00 15.76 N ATOM 2079 CA ASP B 25 2.912 -3.101 23.467 1.00 19.62 C ATOM 2080 C ASP B 25 2.014 -2.071 24.087 1.00 17.98 C ATOM 2081 O ASP B 25 2.489 -1.105 24.642 1.00 16.88 O ATOM 2082 CB ASP B 25 3.358 -4.108 24.523 1.00 12.86 C ATOM 2083 CG ASP B 25 4.221 -5.202 23.948 1.00 15.68 C ATOM 2084 OD1 ASP B 25 4.578 -5.100 22.741 1.00 12.62 O ATOM 2085 OD2 ASP B 25 4.538 -6.175 24.686 1.00 14.80 O ATOM 2086 HA ASP B 25 2.390 -3.651 22.684 1.00 0.00 H ATOM 2087 HB2 ASP B 25 3.925 -3.582 25.291 1.00 0.00 H ATOM 2088 HB3 ASP B 25 2.473 -4.560 24.972 1.00 0.00 H ATOM 2089 H ASP B 25 5.029 -2.654 23.224 1.00 0.00 H ATOM 2090 N ASN B 26 0.710 -2.247 23.967 1.00 17.94 N ATOM 2091 CA ASN B 26 -0.183 -1.175 24.359 1.00 20.38 C ATOM 2092 C ASN B 26 -1.585 -1.695 24.744 1.00 19.33 C ATOM 2093 O ASN B 26 -2.000 -2.758 24.312 1.00 18.26 O ATOM 2094 CB ASN B 26 -0.239 -0.099 23.236 1.00 17.28 C ATOM 2095 CG ASN B 26 -0.497 1.338 23.782 1.00 27.39 C ATOM 2096 OD1 ASN B 26 -0.919 1.513 24.922 1.00 23.62 O ATOM 2097 ND2 ASN B 26 -0.247 2.358 22.938 1.00 24.54 N ATOM 2098 HA ASN B 26 0.215 -0.708 25.260 1.00 0.00 H ATOM 2099 HB2 ASN B 26 0.712 -0.103 22.703 1.00 0.00 H ATOM 2100 HB3 ASN B 26 -1.042 -0.358 22.546 1.00 0.00 H ATOM 2101 HD22 ASN B 26 0.110 2.165 21.980 1.00 0.00 H ATOM 2102 HD21 ASN B 26 -0.411 3.338 23.244 1.00 0.00 H ATOM 2103 H ASN B 26 0.330 -3.142 23.597 1.00 0.00 H ATOM 2104 N TYR B 27 -2.275 -0.960 25.602 1.00 16.26 N ATOM 2105 CA TYR B 27 -3.591 -1.368 26.033 1.00 21.36 C ATOM 2106 C TYR B 27 -4.621 -0.544 25.261 1.00 19.92 C ATOM 2107 O TYR B 27 -4.265 0.444 24.589 1.00 19.65 O ATOM 2108 CB TYR B 27 -3.745 -1.176 27.542 1.00 19.39 C ATOM 2109 CG TYR B 27 -3.492 0.220 27.967 1.00 27.12 C ATOM 2110 CD1 TYR B 27 -2.200 0.729 27.991 1.00 31.79 C ATOM 2111 CD2 TYR B 27 -4.545 1.063 28.319 1.00 27.12 C ATOM 2112 CE1 TYR B 27 -1.953 2.026 28.368 1.00 34.57 C ATOM 2113 CE2 TYR B 27 -4.310 2.369 28.693 1.00 29.61 C ATOM 2114 CZ TYR B 27 -3.009 2.847 28.717 1.00 32.52 C ATOM 2115 OH TYR B 27 -2.760 4.143 29.087 1.00 39.26 O ATOM 2116 HA TYR B 27 -3.744 -2.428 25.828 1.00 0.00 H ATOM 2117 HB3 TYR B 27 -3.037 -1.830 28.052 1.00 0.00 H ATOM 2118 HB2 TYR B 27 -4.761 -1.449 27.827 1.00 0.00 H ATOM 2119 HD2 TYR B 27 -5.567 0.685 28.298 1.00 0.00 H ATOM 2120 HE2 TYR B 27 -5.140 3.020 28.967 1.00 0.00 H ATOM 2121 HE1 TYR B 27 -0.932 2.406 28.392 1.00 0.00 H ATOM 2122 HD1 TYR B 27 -1.367 0.087 27.705 1.00 0.00 H ATOM 2123 HH TYR B 27 -1.786 4.315 29.048 1.00 0.00 H ATOM 2124 H TYR B 27 -1.864 -0.078 25.970 1.00 0.00 H ATOM 2125 N VAL B 28 -5.884 -0.954 25.340 1.00 17.66 N ATOM 2126 CA VAL B 28 -6.919 -0.479 24.395 1.00 20.00 C ATOM 2127 C VAL B 28 -7.102 1.053 24.329 1.00 19.88 C ATOM 2128 O VAL B 28 -7.154 1.637 23.239 1.00 20.57 O ATOM 2129 CB VAL B 28 -8.276 -1.173 24.654 1.00 23.64 C ATOM 2130 CG1 VAL B 28 -9.405 -0.422 23.944 1.00 16.82 C ATOM 2131 CG2 VAL B 28 -8.203 -2.630 24.179 1.00 23.08 C ATOM 2132 HA VAL B 28 -6.538 -0.764 23.415 1.00 0.00 H ATOM 2133 HB VAL B 28 -8.489 -1.162 25.723 1.00 0.00 H ATOM 2134 HG11 VAL B 28 -9.452 0.600 24.319 1.00 0.00 H ATOM 2135 HG12 VAL B 28 -9.212 -0.408 22.871 1.00 0.00 H ATOM 2136 HG13 VAL B 28 -10.352 -0.925 24.138 1.00 0.00 H ATOM 2137 HG21 VAL B 28 -7.980 -2.652 23.112 1.00 0.00 H ATOM 2138 HG22 VAL B 28 -7.417 -3.150 24.727 1.00 0.00 H ATOM 2139 HG23 VAL B 28 -9.160 -3.119 24.362 1.00 0.00 H ATOM 2140 H VAL B 28 -6.151 -1.627 26.086 1.00 0.00 H ATOM 2141 N TYR B 29 -7.214 1.682 25.489 1.00 18.07 N ATOM 2142 CA TYR B 29 -7.362 3.118 25.569 1.00 23.25 C ATOM 2143 C TYR B 29 -6.125 3.837 24.998 1.00 23.83 C ATOM 2144 O TYR B 29 -6.259 4.839 24.288 1.00 20.04 O ATOM 2145 CB TYR B 29 -7.618 3.550 27.024 1.00 29.89 C ATOM 2146 CG TYR B 29 -7.662 5.058 27.234 1.00 44.03 C ATOM 2147 CD1 TYR B 29 -8.847 5.695 27.617 1.00 52.24 C ATOM 2148 CD2 TYR B 29 -6.514 5.850 27.055 1.00 46.87 C ATOM 2149 CE1 TYR B 29 -8.894 7.078 27.816 1.00 53.70 C ATOM 2150 CE2 TYR B 29 -6.554 7.233 27.246 1.00 48.03 C ATOM 2151 CZ TYR B 29 -7.749 7.838 27.627 1.00 52.91 C ATOM 2152 OH TYR B 29 -7.799 9.198 27.824 1.00 58.38 O ATOM 2153 HA TYR B 29 -8.223 3.404 24.964 1.00 0.00 H ATOM 2154 HB3 TYR B 29 -6.822 3.142 27.646 1.00 0.00 H ATOM 2155 HB2 TYR B 29 -8.574 3.133 27.340 1.00 0.00 H ATOM 2156 HD2 TYR B 29 -5.577 5.377 26.762 1.00 0.00 H ATOM 2157 HE2 TYR B 29 -5.657 7.834 27.098 1.00 0.00 H ATOM 2158 HE1 TYR B 29 -9.826 7.557 28.118 1.00 0.00 H ATOM 2159 HD1 TYR B 29 -9.750 5.102 27.763 1.00 0.00 H ATOM 2160 HH TYR B 29 -8.717 9.458 28.089 1.00 0.00 H ATOM 2161 H TYR B 29 -7.195 1.127 26.368 1.00 0.00 H ATOM 2162 N GLY B 30 -4.927 3.333 25.326 1.00 16.82 N ATOM 2163 CA GLY B 30 -3.686 3.882 24.779 1.00 12.85 C ATOM 2164 C GLY B 30 -3.690 3.859 23.260 1.00 13.99 C ATOM 2165 O GLY B 30 -3.380 4.849 22.614 1.00 18.53 O ATOM 2166 HA3 GLY B 30 -2.846 3.289 25.140 1.00 0.00 H ATOM 2167 HA2 GLY B 30 -3.574 4.912 25.118 1.00 0.00 H ATOM 2168 H GLY B 30 -4.878 2.531 25.986 1.00 0.00 H ATOM 2169 N ILE B 31 -4.082 2.726 22.695 1.00 15.96 N ATOM 2170 CA ILE B 31 -4.059 2.540 21.231 1.00 20.44 C ATOM 2171 C ILE B 31 -5.050 3.496 20.577 1.00 18.59 C ATOM 2172 O ILE B 31 -4.725 4.191 19.621 1.00 19.61 O ATOM 2173 CB ILE B 31 -4.448 1.093 20.878 1.00 19.23 C ATOM 2174 CG1 ILE B 31 -3.416 0.108 21.448 1.00 16.15 C ATOM 2175 CG2 ILE B 31 -4.630 0.917 19.365 1.00 17.61 C ATOM 2176 CD1 ILE B 31 -3.934 -1.307 21.524 1.00 18.50 C ATOM 2177 HA ILE B 31 -3.053 2.745 20.866 1.00 0.00 H ATOM 2178 HB ILE B 31 -5.411 0.873 21.339 1.00 0.00 H ATOM 2179 HG12 ILE B 31 -2.533 0.121 20.810 1.00 0.00 H ATOM 2180 HG13 ILE B 31 -3.142 0.433 22.452 1.00 0.00 H ATOM 2181 HD11 ILE B 31 -4.813 -1.337 22.168 1.00 0.00 H ATOM 2182 HD12 ILE B 31 -4.203 -1.648 20.524 1.00 0.00 H ATOM 2183 HD13 ILE B 31 -3.159 -1.955 21.934 1.00 0.00 H ATOM 2184 HG21 ILE B 31 -5.418 1.583 19.015 1.00 0.00 H ATOM 2185 HG22 ILE B 31 -3.696 1.159 18.857 1.00 0.00 H ATOM 2186 HG23 ILE B 31 -4.904 -0.116 19.151 1.00 0.00 H ATOM 2187 H ILE B 31 -4.415 1.948 23.299 1.00 0.00 H ATOM 2188 N ILE B 32 -6.263 3.534 21.135 1.00 20.27 N ATOM 2189 CA ILE B 32 -7.337 4.379 20.624 1.00 16.34 C ATOM 2190 C ILE B 32 -6.925 5.859 20.653 1.00 20.93 C ATOM 2191 O ILE B 32 -7.132 6.590 19.688 1.00 22.43 O ATOM 2192 CB ILE B 32 -8.652 4.169 21.438 1.00 18.19 C ATOM 2193 CG1 ILE B 32 -9.297 2.819 21.084 1.00 12.10 C ATOM 2194 CG2 ILE B 32 -9.649 5.355 21.216 1.00 15.52 C ATOM 2195 CD1 ILE B 32 -10.577 2.517 21.890 1.00 17.52 C ATOM 2196 HA ILE B 32 -7.525 4.089 19.590 1.00 0.00 H ATOM 2197 HB ILE B 32 -8.398 4.152 22.498 1.00 0.00 H ATOM 2198 HG12 ILE B 32 -9.550 2.825 20.024 1.00 0.00 H ATOM 2199 HG13 ILE B 32 -8.572 2.029 21.279 1.00 0.00 H ATOM 2200 HD11 ILE B 32 -10.339 2.496 22.953 1.00 0.00 H ATOM 2201 HD12 ILE B 32 -11.318 3.293 21.697 1.00 0.00 H ATOM 2202 HD13 ILE B 32 -10.976 1.549 21.587 1.00 0.00 H ATOM 2203 HG21 ILE B 32 -9.183 6.285 21.540 1.00 0.00 H ATOM 2204 HG22 ILE B 32 -9.901 5.423 20.158 1.00 0.00 H ATOM 2205 HG23 ILE B 32 -10.555 5.180 21.796 1.00 0.00 H ATOM 2206 H ILE B 32 -6.449 2.938 21.967 1.00 0.00 H ATOM 2207 N LYS B 33 -6.346 6.284 21.768 1.00 17.69 N ATOM 2208 CA LYS B 33 -5.864 7.643 21.910 1.00 20.26 C ATOM 2209 C LYS B 33 -4.781 7.943 20.878 1.00 17.29 C ATOM 2210 O LYS B 33 -4.810 8.968 20.213 1.00 18.39 O ATOM 2211 CB LYS B 33 -5.322 7.854 23.322 1.00 25.79 C ATOM 2212 CG LYS B 33 -4.666 9.219 23.549 1.00 31.80 C ATOM 2213 CD LYS B 33 -3.900 9.238 24.886 1.00 37.64 C ATOM 2214 CE LYS B 33 -3.658 10.659 25.387 1.00 44.63 C ATOM 2215 NZ LYS B 33 -2.803 11.445 24.453 1.00 49.49 N ATOM 2216 HA LYS B 33 -6.695 8.328 21.739 1.00 0.00 H ATOM 2217 HB2 LYS B 33 -6.149 7.752 24.024 1.00 0.00 H ATOM 2218 HB3 LYS B 33 -4.580 7.081 23.522 1.00 0.00 H ATOM 2219 HG2 LYS B 33 -3.971 9.422 22.735 1.00 0.00 H ATOM 2220 HG3 LYS B 33 -5.437 9.989 23.567 1.00 0.00 H ATOM 2221 HD2 LYS B 33 -4.481 8.696 25.632 1.00 0.00 H ATOM 2222 HD3 LYS B 33 -2.938 8.745 24.748 1.00 0.00 H ATOM 2223 HE2 LYS B 33 -3.166 10.610 26.358 1.00 0.00 H ATOM 2224 HE3 LYS B 33 -4.619 11.163 25.493 1.00 0.00 H ATOM 2225 HZ1 LYS B 33 -1.881 10.975 24.351 1.00 0.00 H ATOM 2226 HZ2 LYS B 33 -3.268 11.503 23.525 1.00 0.00 H ATOM 2227 HZ3 LYS B 33 -2.665 12.403 24.834 1.00 0.00 H ATOM 2228 H LYS B 33 -6.235 5.623 22.563 1.00 0.00 H ATOM 2229 N GLN B 34 -3.838 7.023 20.741 1.00 22.22 N ATOM 2230 CA GLN B 34 -2.746 7.170 19.785 1.00 25.95 C ATOM 2231 C GLN B 34 -3.241 7.241 18.318 1.00 24.47 C ATOM 2232 O GLN B 34 -2.753 8.045 17.530 1.00 19.70 O ATOM 2233 CB GLN B 34 -1.772 6.016 19.948 1.00 32.88 C ATOM 2234 CG GLN B 34 -0.346 6.351 19.605 1.00 46.67 C ATOM 2235 CD GLN B 34 0.645 5.482 20.361 1.00 47.84 C ATOM 2236 OE1 GLN B 34 0.656 5.470 21.593 1.00 42.95 O ATOM 2237 NE2 GLN B 34 1.487 4.748 19.622 1.00 48.51 N ATOM 2238 HA GLN B 34 -2.250 8.117 19.999 1.00 0.00 H ATOM 2239 HB2 GLN B 34 -1.804 5.687 20.987 1.00 0.00 H ATOM 2240 HB3 GLN B 34 -2.096 5.202 19.300 1.00 0.00 H ATOM 2241 HG2 GLN B 34 -0.198 6.204 18.535 1.00 0.00 H ATOM 2242 HG3 GLN B 34 -0.160 7.395 19.856 1.00 0.00 H ATOM 2243 HE22 GLN B 34 1.440 4.791 18.584 1.00 0.00 H ATOM 2244 HE21 GLN B 34 2.187 4.135 20.086 1.00 0.00 H ATOM 2245 H GLN B 34 -3.877 6.169 21.333 1.00 0.00 H ATOM 2246 N VAL B 35 -4.196 6.395 17.952 1.00 19.40 N ATOM 2247 CA VAL B 35 -4.733 6.452 16.587 1.00 22.68 C ATOM 2248 C VAL B 35 -5.472 7.785 16.338 1.00 24.50 C ATOM 2249 O VAL B 35 -5.383 8.369 15.243 1.00 21.22 O ATOM 2250 CB VAL B 35 -5.675 5.286 16.287 1.00 20.51 C ATOM 2251 CG1 VAL B 35 -6.362 5.500 14.928 1.00 20.29 C ATOM 2252 CG2 VAL B 35 -4.904 3.986 16.296 1.00 22.30 C ATOM 2253 HA VAL B 35 -3.878 6.380 15.915 1.00 0.00 H ATOM 2254 HB VAL B 35 -6.444 5.239 17.058 1.00 0.00 H ATOM 2255 HG11 VAL B 35 -6.935 6.427 14.954 1.00 0.00 H ATOM 2256 HG12 VAL B 35 -5.606 5.561 14.146 1.00 0.00 H ATOM 2257 HG13 VAL B 35 -7.031 4.664 14.725 1.00 0.00 H ATOM 2258 HG21 VAL B 35 -4.123 4.023 15.536 1.00 0.00 H ATOM 2259 HG22 VAL B 35 -4.452 3.840 17.277 1.00 0.00 H ATOM 2260 HG23 VAL B 35 -5.583 3.161 16.081 1.00 0.00 H ATOM 2261 H VAL B 35 -4.562 5.695 18.629 1.00 0.00 H ATOM 2262 N LYS B 36 -6.190 8.268 17.359 1.00 24.26 N ATOM 2263 CA LYS B 36 -6.957 9.501 17.218 1.00 18.02 C ATOM 2264 C LYS B 36 -6.044 10.691 16.993 1.00 22.38 C ATOM 2265 O LYS B 36 -6.296 11.536 16.101 1.00 15.37 O ATOM 2266 CB LYS B 36 -7.846 9.744 18.428 1.00 15.51 C ATOM 2267 CG LYS B 36 -8.527 11.102 18.374 1.00 20.29 C ATOM 2268 CD LYS B 36 -9.524 11.311 19.499 1.00 23.93 C ATOM 2269 CE LYS B 36 -10.094 12.729 19.424 1.00 30.43 C ATOM 2270 NZ LYS B 36 -11.218 12.965 20.380 1.00 37.29 N ATOM 2271 HA LYS B 36 -7.596 9.384 16.343 1.00 0.00 H ATOM 2272 HB2 LYS B 36 -8.611 8.968 18.464 1.00 0.00 H ATOM 2273 HB3 LYS B 36 -7.235 9.692 19.329 1.00 0.00 H ATOM 2274 HG2 LYS B 36 -7.763 11.877 18.438 1.00 0.00 H ATOM 2275 HG3 LYS B 36 -9.053 11.190 17.423 1.00 0.00 H ATOM 2276 HD2 LYS B 36 -10.335 10.589 19.404 1.00 0.00 H ATOM 2277 HD3 LYS B 36 -9.024 11.171 20.458 1.00 0.00 H ATOM 2278 HE2 LYS B 36 -10.458 12.903 18.411 1.00 0.00 H ATOM 2279 HE3 LYS B 36 -9.295 13.436 19.648 1.00 0.00 H ATOM 2280 HZ1 LYS B 36 -11.993 12.304 20.172 1.00 0.00 H ATOM 2281 HZ2 LYS B 36 -10.882 12.813 21.352 1.00 0.00 H ATOM 2282 HZ3 LYS B 36 -11.558 13.943 20.279 1.00 0.00 H ATOM 2283 H LYS B 36 -6.201 7.758 18.265 1.00 0.00 H ATOM 2284 N GLU B 37 -4.977 10.765 17.783 1.00 17.88 N ATOM 2285 CA GLU B 37 -4.002 11.859 17.641 1.00 22.04 C ATOM 2286 C GLU B 37 -3.247 11.772 16.313 1.00 20.92 C ATOM 2287 O GLU B 37 -3.234 12.724 15.535 1.00 19.03 O ATOM 2288 CB GLU B 37 -3.030 11.860 18.814 1.00 19.47 C ATOM 2289 CG GLU B 37 -3.732 11.888 20.151 1.00 32.98 C ATOM 2290 CD GLU B 37 -2.790 12.138 21.300 1.00 43.36 C ATOM 2291 OE1 GLU B 37 -1.658 11.585 21.275 1.00 48.62 O ATOM 2292 OE2 GLU B 37 -3.183 12.878 22.238 1.00 45.98 O ATOM 2293 HA GLU B 37 -4.554 12.799 17.643 1.00 0.00 H ATOM 2294 HB2 GLU B 37 -2.417 10.960 18.760 1.00 0.00 H ATOM 2295 HB3 GLU B 37 -2.390 12.739 18.737 1.00 0.00 H ATOM 2296 HG2 GLU B 37 -4.480 12.680 20.135 1.00 0.00 H ATOM 2297 HG3 GLU B 37 -4.224 10.928 20.306 1.00 0.00 H ATOM 2298 H GLU B 37 -4.829 10.039 18.513 1.00 0.00 H ATOM 2299 N ALA B 38 -2.639 10.614 16.055 1.00 18.99 N ATOM 2300 CA ALA B 38 -1.907 10.375 14.795 1.00 17.54 C ATOM 2301 C ALA B 38 -2.757 10.630 13.514 1.00 15.76 C ATOM 2302 O ALA B 38 -2.225 11.009 12.488 1.00 15.51 O ATOM 2303 CB ALA B 38 -1.330 8.964 14.781 1.00 17.95 C ATOM 2304 HA ALA B 38 -1.099 11.106 14.768 1.00 0.00 H ATOM 2305 HB1 ALA B 38 -0.645 8.845 15.620 1.00 0.00 H ATOM 2306 HB2 ALA B 38 -2.141 8.240 14.866 1.00 0.00 H ATOM 2307 HB3 ALA B 38 -0.793 8.802 13.846 1.00 0.00 H ATOM 2308 H ALA B 38 -2.682 9.854 16.764 1.00 0.00 H ATOM 2309 N SER B 39 -4.066 10.401 13.591 1.00 15.34 N ATOM 2310 CA SER B 39 -4.938 10.619 12.438 1.00 16.94 C ATOM 2311 C SER B 39 -5.580 12.025 12.448 1.00 17.01 C ATOM 2312 O SER B 39 -6.457 12.319 11.637 1.00 16.05 O ATOM 2313 CB SER B 39 -6.039 9.556 12.399 1.00 19.31 C ATOM 2314 OG SER B 39 -6.964 9.780 13.444 1.00 17.25 O ATOM 2315 HA SER B 39 -4.315 10.542 11.547 1.00 0.00 H ATOM 2316 HB2 SER B 39 -5.592 8.569 12.517 1.00 0.00 H ATOM 2317 HB3 SER B 39 -6.557 9.607 11.441 1.00 0.00 H ATOM 2318 HG SER B 39 -6.495 9.732 14.314 1.00 0.00 H ATOM 2319 H SER B 39 -4.475 10.062 14.485 1.00 0.00 H ATOM 2320 N ASN B 40 -5.160 12.870 13.389 1.00 19.12 N ATOM 2321 CA ASN B 40 -5.722 14.221 13.516 1.00 17.04 C ATOM 2322 C ASN B 40 -7.230 14.217 13.780 1.00 16.50 C ATOM 2323 O ASN B 40 -7.964 15.077 13.277 1.00 9.63 O ATOM 2324 CB ASN B 40 -5.419 15.034 12.265 1.00 14.71 C ATOM 2325 CG ASN B 40 -3.941 15.165 12.014 1.00 22.79 C ATOM 2326 OD1 ASN B 40 -3.442 14.768 10.963 1.00 27.11 O ATOM 2327 ND2 ASN B 40 -3.216 15.702 12.998 1.00 23.65 N ATOM 2328 HA ASN B 40 -5.246 14.679 14.383 1.00 0.00 H ATOM 2329 HB2 ASN B 40 -5.878 14.543 11.407 1.00 0.00 H ATOM 2330 HB3 ASN B 40 -5.845 16.031 12.382 1.00 0.00 H ATOM 2331 HD22 ASN B 40 -3.681 16.024 13.870 1.00 0.00 H ATOM 2332 HD21 ASN B 40 -2.186 15.798 12.892 1.00 0.00 H ATOM 2333 H ASN B 40 -4.416 12.566 14.049 1.00 0.00 H ATOM 2334 N GLY B 41 -7.685 13.250 14.567 1.00 15.11 N ATOM 2335 CA GLY B 41 -9.091 13.149 14.905 1.00 22.93 C ATOM 2336 C GLY B 41 -9.905 12.413 13.855 1.00 25.37 C ATOM 2337 O GLY B 41 -11.070 12.078 14.084 1.00 29.71 O ATOM 2338 HA3 GLY B 41 -9.495 14.155 15.015 1.00 0.00 H ATOM 2339 HA2 GLY B 41 -9.183 12.617 15.852 1.00 0.00 H ATOM 2340 H GLY B 41 -7.018 12.549 14.950 1.00 0.00 H ATOM 2341 N GLU B 42 -9.290 12.144 12.709 1.00 20.30 N ATOM 2342 CA GLU B 42 -9.987 11.482 11.611 1.00 27.70 C ATOM 2343 C GLU B 42 -10.383 10.053 11.955 1.00 31.93 C ATOM 2344 O GLU B 42 -11.352 9.517 11.406 1.00 30.04 O ATOM 2345 CB GLU B 42 -9.130 11.474 10.349 1.00 30.78 C ATOM 2346 CG GLU B 42 -8.943 12.839 9.714 1.00 34.89 C ATOM 2347 CD GLU B 42 -7.915 12.811 8.592 1.00 37.94 C ATOM 2348 OE1 GLU B 42 -7.436 11.703 8.254 1.00 41.33 O ATOM 2349 OE2 GLU B 42 -7.580 13.893 8.060 1.00 41.94 O ATOM 2350 HA GLU B 42 -10.897 12.055 11.434 1.00 0.00 H ATOM 2351 HB2 GLU B 42 -8.147 11.079 10.606 1.00 0.00 H ATOM 2352 HB3 GLU B 42 -9.604 10.819 9.618 1.00 0.00 H ATOM 2353 HG2 GLU B 42 -9.898 13.172 9.308 1.00 0.00 H ATOM 2354 HG3 GLU B 42 -8.610 13.541 10.479 1.00 0.00 H ATOM 2355 H GLU B 42 -8.292 12.411 12.592 1.00 0.00 H ATOM 2356 N MET B 43 -9.633 9.422 12.840 1.00 29.91 N ATOM 2357 CA MET B 43 -9.896 8.023 13.149 1.00 28.40 C ATOM 2358 C MET B 43 -10.134 7.803 14.644 1.00 28.44 C ATOM 2359 O MET B 43 -9.194 7.686 15.430 1.00 30.08 O ATOM 2360 CB MET B 43 -8.764 7.145 12.629 1.00 30.07 C ATOM 2361 CG MET B 43 -9.069 5.703 12.666 1.00 40.64 C ATOM 2362 SD MET B 43 -7.976 4.771 11.596 1.00 45.67 S ATOM 2363 CE MET B 43 -7.788 3.294 12.569 1.00 44.34 C ATOM 2364 HA MET B 43 -10.816 7.735 12.641 1.00 0.00 H ATOM 2365 HB2 MET B 43 -8.556 7.427 11.597 1.00 0.00 H ATOM 2366 HB3 MET B 43 -7.879 7.326 13.239 1.00 0.00 H ATOM 2367 HG2 MET B 43 -10.098 5.550 12.341 1.00 0.00 H ATOM 2368 HG3 MET B 43 -8.955 5.343 13.689 1.00 0.00 H ATOM 2369 HE1 MET B 43 -7.353 3.550 13.535 1.00 0.00 H ATOM 2370 HE2 MET B 43 -8.764 2.833 12.719 1.00 0.00 H ATOM 2371 HE3 MET B 43 -7.132 2.598 12.047 1.00 0.00 H ATOM 2372 H MET B 43 -8.856 9.923 13.316 1.00 0.00 H ATOM 2373 N GLU B 44 -11.401 7.761 15.025 1.00 24.28 N ATOM 2374 CA GLU B 44 -11.770 7.609 16.408 1.00 26.89 C ATOM 2375 C GLU B 44 -12.492 6.262 16.585 1.00 29.05 C ATOM 2376 O GLU B 44 -13.693 6.149 16.331 1.00 32.63 O ATOM 2377 CB GLU B 44 -12.680 8.772 16.831 1.00 32.44 C ATOM 2378 CG GLU B 44 -12.511 9.207 18.280 1.00 43.49 C ATOM 2379 CD GLU B 44 -13.401 10.400 18.649 1.00 50.08 C ATOM 2380 OE1 GLU B 44 -13.638 11.273 17.775 1.00 47.73 O ATOM 2381 OE2 GLU B 44 -13.858 10.464 19.816 1.00 56.05 O ATOM 2382 HA GLU B 44 -10.881 7.623 17.038 1.00 0.00 H ATOM 2383 HB2 GLU B 44 -12.462 9.627 16.190 1.00 0.00 H ATOM 2384 HB3 GLU B 44 -13.716 8.465 16.685 1.00 0.00 H ATOM 2385 HG2 GLU B 44 -12.766 8.368 18.928 1.00 0.00 H ATOM 2386 HG3 GLU B 44 -11.470 9.486 18.441 1.00 0.00 H ATOM 2387 H GLU B 44 -12.149 7.840 14.307 1.00 0.00 H ATOM 2388 N LEU B 45 -11.742 5.241 16.986 1.00 21.35 N ATOM 2389 CA LEU B 45 -12.277 3.882 17.094 1.00 19.20 C ATOM 2390 C LEU B 45 -12.935 3.695 18.429 1.00 20.05 C ATOM 2391 O LEU B 45 -12.452 4.202 19.435 1.00 23.22 O ATOM 2392 CB LEU B 45 -11.134 2.859 16.957 1.00 19.74 C ATOM 2393 CG LEU B 45 -10.259 3.108 15.732 1.00 28.06 C ATOM 2394 CD1 LEU B 45 -8.910 2.371 15.806 1.00 26.27 C ATOM 2395 CD2 LEU B 45 -11.041 2.754 14.444 1.00 27.98 C ATOM 2396 HA LEU B 45 -13.008 3.730 16.300 1.00 0.00 H ATOM 2397 HB2 LEU B 45 -10.509 2.914 17.848 1.00 0.00 H ATOM 2398 HB3 LEU B 45 -11.567 1.862 16.879 1.00 0.00 H ATOM 2399 HG LEU B 45 -10.013 4.170 15.709 1.00 0.00 H ATOM 2400 HD21 LEU B 45 -11.329 1.703 14.473 1.00 0.00 H ATOM 2401 HD22 LEU B 45 -11.934 3.375 14.380 1.00 0.00 H ATOM 2402 HD23 LEU B 45 -10.408 2.935 13.575 1.00 0.00 H ATOM 2403 HD11 LEU B 45 -8.360 2.709 16.684 1.00 0.00 H ATOM 2404 HD12 LEU B 45 -9.087 1.298 15.878 1.00 0.00 H ATOM 2405 HD13 LEU B 45 -8.331 2.585 14.908 1.00 0.00 H ATOM 2406 H LEU B 45 -10.746 5.412 17.230 1.00 0.00 H ATOM 2407 N ASN B 46 -14.017 2.940 18.477 1.00 20.42 N ATOM 2408 CA ASN B 46 -14.497 2.541 19.769 1.00 25.41 C ATOM 2409 C ASN B 46 -13.921 1.201 20.222 1.00 24.81 C ATOM 2410 O ASN B 46 -13.438 0.405 19.415 1.00 23.48 O ATOM 2411 CB ASN B 46 -16.024 2.623 19.897 1.00 36.62 C ATOM 2412 CG ASN B 46 -16.738 1.783 18.896 1.00 41.55 C ATOM 2413 OD1 ASN B 46 -16.317 0.678 18.587 1.00 47.90 O ATOM 2414 ND2 ASN B 46 -17.859 2.291 18.393 1.00 43.88 N ATOM 2415 HA ASN B 46 -14.114 3.280 20.473 1.00 0.00 H ATOM 2416 HB2 ASN B 46 -16.307 2.290 20.896 1.00 0.00 H ATOM 2417 HB3 ASN B 46 -16.329 3.661 19.761 1.00 0.00 H ATOM 2418 HD22 ASN B 46 -18.179 3.236 18.686 1.00 0.00 H ATOM 2419 HD21 ASN B 46 -18.416 1.743 17.707 1.00 0.00 H ATOM 2420 H ASN B 46 -14.505 2.644 17.608 1.00 0.00 H ATOM 2421 N GLU B 47 -13.937 1.003 21.526 1.00 21.45 N ATOM 2422 CA GLU B 47 -13.353 -0.152 22.165 1.00 20.35 C ATOM 2423 C GLU B 47 -13.881 -1.464 21.558 1.00 16.30 C ATOM 2424 O GLU B 47 -13.125 -2.409 21.359 1.00 14.90 O ATOM 2425 CB GLU B 47 -13.691 -0.099 23.658 1.00 20.14 C ATOM 2426 CG GLU B 47 -12.767 -0.836 24.525 1.00 31.65 C ATOM 2427 CD GLU B 47 -13.288 -0.939 25.938 1.00 34.74 C ATOM 2428 OE1 GLU B 47 -14.305 -0.292 26.235 1.00 32.05 O ATOM 2429 OE2 GLU B 47 -12.682 -1.672 26.745 1.00 36.86 O ATOM 2430 HA GLU B 47 -12.274 -0.132 22.012 1.00 0.00 H ATOM 2431 HB2 GLU B 47 -13.688 0.946 23.970 1.00 0.00 H ATOM 2432 HB3 GLU B 47 -14.689 -0.515 23.795 1.00 0.00 H ATOM 2433 HG2 GLU B 47 -12.632 -1.841 24.124 1.00 0.00 H ATOM 2434 HG3 GLU B 47 -11.807 -0.319 24.539 1.00 0.00 H ATOM 2435 H GLU B 47 -14.395 1.718 22.126 1.00 0.00 H ATOM 2436 N ALA B 48 -15.188 -1.515 21.289 1.00 4.95 N ATOM 2437 CA ALA B 48 -15.814 -2.714 20.747 1.00 8.06 C ATOM 2438 C ALA B 48 -15.260 -3.036 19.364 1.00 11.00 C ATOM 2439 O ALA B 48 -15.038 -4.202 19.023 1.00 10.52 O ATOM 2440 CB ALA B 48 -17.351 -2.543 20.695 1.00 5.61 C ATOM 2441 HA ALA B 48 -15.582 -3.551 21.406 1.00 0.00 H ATOM 2442 HB1 ALA B 48 -17.730 -2.368 21.702 1.00 0.00 H ATOM 2443 HB2 ALA B 48 -17.599 -1.693 20.059 1.00 0.00 H ATOM 2444 HB3 ALA B 48 -17.802 -3.448 20.288 1.00 0.00 H ATOM 2445 H ALA B 48 -15.775 -0.676 21.471 1.00 0.00 H ATOM 2446 N THR B 49 -15.020 -1.995 18.573 1.00 12.20 N ATOM 2447 CA THR B 49 -14.433 -2.159 17.235 1.00 10.96 C ATOM 2448 C THR B 49 -13.052 -2.791 17.314 1.00 8.62 C ATOM 2449 O THR B 49 -12.734 -3.710 16.554 1.00 10.83 O ATOM 2450 CB THR B 49 -14.356 -0.798 16.475 1.00 14.26 C ATOM 2451 OG1 THR B 49 -15.684 -0.271 16.295 1.00 17.03 O ATOM 2452 CG2 THR B 49 -13.698 -0.973 15.111 1.00 19.47 C ATOM 2453 HA THR B 49 -15.089 -2.827 16.677 1.00 0.00 H ATOM 2454 HB THR B 49 -13.756 -0.108 17.067 1.00 0.00 H ATOM 2455 HG1 THR B 49 -16.105 -0.131 17.180 1.00 0.00 H ATOM 2456 HG23 THR B 49 -12.692 -1.372 15.243 1.00 0.00 H ATOM 2457 HG21 THR B 49 -14.289 -1.664 14.510 1.00 0.00 H ATOM 2458 HG22 THR B 49 -13.644 -0.007 14.608 1.00 0.00 H ATOM 2459 H THR B 49 -15.254 -1.039 18.910 1.00 0.00 H ATOM 2460 N LEU B 50 -12.227 -2.321 18.248 1.00 9.61 N ATOM 2461 CA LEU B 50 -10.906 -2.914 18.443 1.00 11.04 C ATOM 2462 C LEU B 50 -10.987 -4.371 18.843 1.00 10.17 C ATOM 2463 O LEU B 50 -10.175 -5.179 18.414 1.00 15.52 O ATOM 2464 CB LEU B 50 -10.109 -2.150 19.505 1.00 19.90 C ATOM 2465 CG LEU B 50 -8.924 -1.366 18.991 1.00 26.30 C ATOM 2466 CD1 LEU B 50 -9.425 -0.135 18.252 1.00 32.09 C ATOM 2467 CD2 LEU B 50 -8.039 -0.978 20.144 1.00 21.96 C ATOM 2468 HA LEU B 50 -10.396 -2.846 17.482 1.00 0.00 H ATOM 2469 HB2 LEU B 50 -10.787 -1.451 19.996 1.00 0.00 H ATOM 2470 HB3 LEU B 50 -9.743 -2.872 20.235 1.00 0.00 H ATOM 2471 HG LEU B 50 -8.340 -1.976 18.301 1.00 0.00 H ATOM 2472 HD21 LEU B 50 -8.605 -0.364 20.844 1.00 0.00 H ATOM 2473 HD22 LEU B 50 -7.688 -1.878 20.650 1.00 0.00 H ATOM 2474 HD23 LEU B 50 -7.185 -0.413 19.771 1.00 0.00 H ATOM 2475 HD11 LEU B 50 -10.051 -0.445 17.415 1.00 0.00 H ATOM 2476 HD12 LEU B 50 -10.008 0.484 18.934 1.00 0.00 H ATOM 2477 HD13 LEU B 50 -8.574 0.435 17.879 1.00 0.00 H ATOM 2478 H LEU B 50 -12.526 -1.524 18.845 1.00 0.00 H ATOM 2479 N TYR B 51 -11.934 -4.711 19.717 1.00 11.33 N ATOM 2480 CA TYR B 51 -12.053 -6.111 20.144 1.00 10.14 C ATOM 2481 C TYR B 51 -12.367 -7.022 18.979 1.00 11.02 C ATOM 2482 O TYR B 51 -11.765 -8.098 18.833 1.00 11.85 O ATOM 2483 CB TYR B 51 -13.082 -6.263 21.270 1.00 7.70 C ATOM 2484 CG TYR B 51 -12.651 -5.544 22.512 1.00 11.78 C ATOM 2485 CD1 TYR B 51 -11.332 -5.614 22.942 1.00 20.18 C ATOM 2486 CD2 TYR B 51 -13.534 -4.779 23.240 1.00 11.31 C ATOM 2487 CE1 TYR B 51 -10.903 -4.943 24.072 1.00 21.62 C ATOM 2488 CE2 TYR B 51 -13.117 -4.103 24.376 1.00 18.61 C ATOM 2489 CZ TYR B 51 -11.783 -4.197 24.778 1.00 18.57 C ATOM 2490 OH TYR B 51 -11.345 -3.548 25.894 1.00 25.38 O ATOM 2491 HA TYR B 51 -11.085 -6.416 20.541 1.00 0.00 H ATOM 2492 HB3 TYR B 51 -13.203 -7.322 21.498 1.00 0.00 H ATOM 2493 HB2 TYR B 51 -14.035 -5.853 20.936 1.00 0.00 H ATOM 2494 HD2 TYR B 51 -14.573 -4.704 22.919 1.00 0.00 H ATOM 2495 HE2 TYR B 51 -13.824 -3.504 24.950 1.00 0.00 H ATOM 2496 HE1 TYR B 51 -9.863 -5.015 24.392 1.00 0.00 H ATOM 2497 HD1 TYR B 51 -10.618 -6.212 22.375 1.00 0.00 H ATOM 2498 HH TYR B 51 -11.488 -2.574 25.786 1.00 0.00 H ATOM 2499 H TYR B 51 -12.583 -3.991 20.093 1.00 0.00 H ATOM 2500 N THR B 52 -13.297 -6.598 18.136 1.00 3.67 N ATOM 2501 CA THR B 52 -13.635 -7.377 16.945 1.00 6.36 C ATOM 2502 C THR B 52 -12.353 -7.581 16.100 1.00 8.57 C ATOM 2503 O THR B 52 -11.978 -8.716 15.764 1.00 3.75 O ATOM 2504 CB THR B 52 -14.719 -6.679 16.112 1.00 2.00 C ATOM 2505 OG1 THR B 52 -15.935 -6.617 16.868 1.00 6.98 O ATOM 2506 CG2 THR B 52 -14.974 -7.440 14.780 1.00 7.64 C ATOM 2507 HA THR B 52 -14.033 -8.343 17.254 1.00 0.00 H ATOM 2508 HB THR B 52 -14.377 -5.672 15.873 1.00 0.00 H ATOM 2509 HG1 THR B 52 -15.778 -6.107 17.702 1.00 0.00 H ATOM 2510 HG23 THR B 52 -14.048 -7.486 14.206 1.00 0.00 H ATOM 2511 HG21 THR B 52 -15.317 -8.451 15.000 1.00 0.00 H ATOM 2512 HG22 THR B 52 -15.735 -6.915 14.203 1.00 0.00 H ATOM 2513 H THR B 52 -13.792 -5.702 18.323 1.00 0.00 H ATOM 2514 N ILE B 53 -11.653 -6.484 15.823 1.00 9.34 N ATOM 2515 CA ILE B 53 -10.434 -6.550 15.024 1.00 5.51 C ATOM 2516 C ILE B 53 -9.346 -7.421 15.672 1.00 12.08 C ATOM 2517 O ILE B 53 -8.738 -8.241 15.009 1.00 13.94 O ATOM 2518 CB ILE B 53 -9.880 -5.148 14.732 1.00 9.75 C ATOM 2519 CG1 ILE B 53 -10.850 -4.384 13.836 1.00 7.14 C ATOM 2520 CG2 ILE B 53 -8.488 -5.253 14.086 1.00 7.69 C ATOM 2521 CD1 ILE B 53 -10.578 -2.835 13.725 1.00 11.82 C ATOM 2522 HA ILE B 53 -10.716 -7.023 14.083 1.00 0.00 H ATOM 2523 HB ILE B 53 -9.775 -4.598 15.667 1.00 0.00 H ATOM 2524 HG12 ILE B 53 -10.792 -4.810 12.834 1.00 0.00 H ATOM 2525 HG13 ILE B 53 -11.856 -4.523 14.231 1.00 0.00 H ATOM 2526 HD11 ILE B 53 -10.646 -2.384 14.715 1.00 0.00 H ATOM 2527 HD12 ILE B 53 -9.581 -2.671 13.317 1.00 0.00 H ATOM 2528 HD13 ILE B 53 -11.320 -2.383 13.067 1.00 0.00 H ATOM 2529 HG21 ILE B 53 -7.811 -5.771 14.766 1.00 0.00 H ATOM 2530 HG22 ILE B 53 -8.563 -5.810 13.152 1.00 0.00 H ATOM 2531 HG23 ILE B 53 -8.106 -4.252 13.884 1.00 0.00 H ATOM 2532 H ILE B 53 -11.980 -5.564 16.182 1.00 0.00 H ATOM 2533 N PHE B 54 -9.111 -7.229 16.975 1.00 12.15 N ATOM 2534 CA PHE B 54 -8.023 -7.940 17.697 1.00 8.56 C ATOM 2535 C PHE B 54 -8.301 -9.422 17.912 1.00 13.18 C ATOM 2536 O PHE B 54 -7.370 -10.223 17.990 1.00 15.58 O ATOM 2537 CB PHE B 54 -7.764 -7.270 19.068 1.00 14.15 C ATOM 2538 CG PHE B 54 -6.927 -6.006 18.981 1.00 11.72 C ATOM 2539 CD1 PHE B 54 -6.537 -5.506 17.751 1.00 8.24 C ATOM 2540 CD2 PHE B 54 -6.540 -5.329 20.131 1.00 15.81 C ATOM 2541 CE1 PHE B 54 -5.756 -4.368 17.661 1.00 15.40 C ATOM 2542 CE2 PHE B 54 -5.770 -4.176 20.051 1.00 11.58 C ATOM 2543 CZ PHE B 54 -5.382 -3.693 18.814 1.00 14.49 C ATOM 2544 HA PHE B 54 -7.142 -7.867 17.059 1.00 0.00 H ATOM 2545 HB2 PHE B 54 -8.725 -7.016 19.515 1.00 0.00 H ATOM 2546 HB3 PHE B 54 -7.245 -7.984 19.708 1.00 0.00 H ATOM 2547 HD2 PHE B 54 -6.844 -5.707 21.107 1.00 0.00 H ATOM 2548 HE2 PHE B 54 -5.472 -3.653 20.960 1.00 0.00 H ATOM 2549 HZ PHE B 54 -4.784 -2.784 18.745 1.00 0.00 H ATOM 2550 HE1 PHE B 54 -5.435 -4.002 16.686 1.00 0.00 H ATOM 2551 HD1 PHE B 54 -6.850 -6.016 16.840 1.00 0.00 H ATOM 2552 H PHE B 54 -9.709 -6.560 17.500 1.00 0.00 H ATOM 2553 N LYS B 55 -9.581 -9.788 18.062 1.00 6.09 N ATOM 2554 CA LYS B 55 -9.956 -11.198 18.228 1.00 8.16 C ATOM 2555 C LYS B 55 -9.515 -11.983 16.986 1.00 11.03 C ATOM 2556 O LYS B 55 -8.961 -13.092 17.075 1.00 13.68 O ATOM 2557 CB LYS B 55 -11.500 -11.340 18.436 1.00 9.85 C ATOM 2558 CG LYS B 55 -12.006 -12.801 18.397 1.00 6.69 C ATOM 2559 CD LYS B 55 -13.511 -12.864 18.240 1.00 15.12 C ATOM 2560 CE LYS B 55 -13.934 -14.067 17.417 1.00 28.20 C ATOM 2561 NZ LYS B 55 -13.366 -15.329 17.945 1.00 30.74 N ATOM 2562 HA LYS B 55 -9.459 -11.598 19.112 1.00 0.00 H ATOM 2563 HB2 LYS B 55 -11.757 -10.913 19.406 1.00 0.00 H ATOM 2564 HB3 LYS B 55 -12.005 -10.780 17.649 1.00 0.00 H ATOM 2565 HG2 LYS B 55 -11.540 -13.315 17.556 1.00 0.00 H ATOM 2566 HG3 LYS B 55 -11.725 -13.298 19.326 1.00 0.00 H ATOM 2567 HD2 LYS B 55 -13.968 -12.931 19.227 1.00 0.00 H ATOM 2568 HD3 LYS B 55 -13.854 -11.956 17.743 1.00 0.00 H ATOM 2569 HE2 LYS B 55 -13.593 -13.929 16.391 1.00 0.00 H ATOM 2570 HE3 LYS B 55 -15.022 -14.138 17.430 1.00 0.00 H ATOM 2571 HZ1 LYS B 55 -12.328 -15.274 17.930 1.00 0.00 H ATOM 2572 HZ2 LYS B 55 -13.692 -15.473 18.922 1.00 0.00 H ATOM 2573 HZ3 LYS B 55 -13.681 -16.124 17.353 1.00 0.00 H ATOM 2574 H LYS B 55 -10.323 -9.060 18.061 1.00 0.00 H ATOM 2575 N ARG B 56 -9.753 -11.391 15.834 1.00 6.11 N ATOM 2576 CA ARG B 56 -9.385 -11.997 14.562 1.00 5.28 C ATOM 2577 C ARG B 56 -7.838 -12.005 14.362 1.00 11.99 C ATOM 2578 O ARG B 56 -7.263 -13.017 13.935 1.00 3.30 O ATOM 2579 CB ARG B 56 -10.114 -11.260 13.427 1.00 11.51 C ATOM 2580 CG ARG B 56 -9.511 -11.415 12.034 1.00 20.07 C ATOM 2581 CD ARG B 56 -9.739 -12.778 11.471 1.00 25.33 C ATOM 2582 NE ARG B 56 -9.053 -12.922 10.191 1.00 40.67 N ATOM 2583 CZ ARG B 56 -9.097 -14.013 9.431 1.00 46.39 C ATOM 2584 NH1 ARG B 56 -9.802 -15.069 9.823 1.00 51.60 N ATOM 2585 NH2 ARG B 56 -8.432 -14.052 8.275 1.00 46.65 N ATOM 2586 HA ARG B 56 -9.696 -13.042 14.554 1.00 0.00 H ATOM 2587 HB2 ARG B 56 -11.138 -11.632 13.391 1.00 0.00 H ATOM 2588 HB3 ARG B 56 -10.123 -10.198 13.671 1.00 0.00 H ATOM 2589 HG2 ARG B 56 -9.966 -10.680 11.370 1.00 0.00 H ATOM 2590 HG3 ARG B 56 -8.438 -11.234 12.093 1.00 0.00 H ATOM 2591 HD2 ARG B 56 -10.808 -12.932 11.325 1.00 0.00 H ATOM 2592 HD3 ARG B 56 -9.358 -13.523 12.169 1.00 0.00 H ATOM 2593 HE ARG B 56 -8.491 -12.116 9.849 1.00 0.00 H ATOM 2594 HH12 ARG B 56 -9.836 -15.922 9.228 1.00 0.00 H ATOM 2595 HH11 ARG B 56 -10.320 -15.043 10.725 1.00 0.00 H ATOM 2596 HH22 ARG B 56 -8.468 -14.906 7.683 1.00 0.00 H ATOM 2597 HH21 ARG B 56 -7.877 -13.228 7.966 1.00 0.00 H ATOM 2598 H ARG B 56 -10.219 -10.461 15.833 1.00 0.00 H ATOM 2599 N LEU B 57 -7.168 -10.890 14.706 1.00 8.06 N ATOM 2600 CA LEU B 57 -5.692 -10.810 14.560 1.00 10.28 C ATOM 2601 C LEU B 57 -5.030 -11.803 15.479 1.00 10.84 C ATOM 2602 O LEU B 57 -4.018 -12.395 15.146 1.00 10.60 O ATOM 2603 CB LEU B 57 -5.187 -9.391 14.872 1.00 2.56 C ATOM 2604 CG LEU B 57 -5.501 -8.348 13.816 1.00 4.81 C ATOM 2605 CD1 LEU B 57 -4.997 -6.993 14.282 1.00 7.74 C ATOM 2606 CD2 LEU B 57 -4.810 -8.764 12.497 1.00 2.64 C ATOM 2607 HA LEU B 57 -5.436 -11.047 13.527 1.00 0.00 H ATOM 2608 HB2 LEU B 57 -5.641 -9.070 15.810 1.00 0.00 H ATOM 2609 HB3 LEU B 57 -4.104 -9.436 14.991 1.00 0.00 H ATOM 2610 HG LEU B 57 -6.576 -8.278 13.653 1.00 0.00 H ATOM 2611 HD21 LEU B 57 -3.733 -8.822 12.655 1.00 0.00 H ATOM 2612 HD22 LEU B 57 -5.186 -9.738 12.183 1.00 0.00 H ATOM 2613 HD23 LEU B 57 -5.026 -8.024 11.726 1.00 0.00 H ATOM 2614 HD11 LEU B 57 -5.489 -6.726 15.217 1.00 0.00 H ATOM 2615 HD12 LEU B 57 -3.919 -7.042 14.438 1.00 0.00 H ATOM 2616 HD13 LEU B 57 -5.222 -6.243 13.524 1.00 0.00 H ATOM 2617 H LEU B 57 -7.691 -10.072 15.079 1.00 0.00 H ATOM 2618 N GLU B 58 -5.593 -11.961 16.663 1.00 11.35 N ATOM 2619 CA GLU B 58 -5.086 -12.942 17.616 1.00 16.20 C ATOM 2620 C GLU B 58 -5.355 -14.393 17.159 1.00 16.49 C ATOM 2621 O GLU B 58 -4.472 -15.261 17.219 1.00 13.02 O ATOM 2622 CB GLU B 58 -5.692 -12.700 18.995 1.00 21.39 C ATOM 2623 CG GLU B 58 -5.218 -13.684 20.047 1.00 40.17 C ATOM 2624 CD GLU B 58 -5.202 -13.071 21.453 1.00 51.31 C ATOM 2625 OE1 GLU B 58 -5.854 -12.005 21.648 1.00 49.15 O ATOM 2626 OE2 GLU B 58 -4.528 -13.650 22.356 1.00 57.16 O ATOM 2627 HA GLU B 58 -4.005 -12.815 17.669 1.00 0.00 H ATOM 2628 HB2 GLU B 58 -5.424 -11.694 19.318 1.00 0.00 H ATOM 2629 HB3 GLU B 58 -6.776 -12.777 18.914 1.00 0.00 H ATOM 2630 HG2 GLU B 58 -5.886 -14.546 20.048 1.00 0.00 H ATOM 2631 HG3 GLU B 58 -4.209 -14.008 19.794 1.00 0.00 H ATOM 2632 H GLU B 58 -6.413 -11.375 16.921 1.00 0.00 H ATOM 2633 N LYS B 59 -6.558 -14.656 16.692 1.00 9.75 N ATOM 2634 CA LYS B 59 -6.845 -15.977 16.125 1.00 8.62 C ATOM 2635 C LYS B 59 -5.841 -16.297 15.005 1.00 8.26 C ATOM 2636 O LYS B 59 -5.443 -17.452 14.814 1.00 6.26 O ATOM 2637 CB LYS B 59 -8.275 -16.030 15.590 1.00 13.42 C ATOM 2638 CG LYS B 59 -8.748 -17.404 15.202 1.00 21.49 C ATOM 2639 CD LYS B 59 -10.172 -17.343 14.665 1.00 30.41 C ATOM 2640 CE LYS B 59 -10.267 -16.371 13.479 1.00 37.35 C ATOM 2641 NZ LYS B 59 -9.275 -16.705 12.389 1.00 38.21 N ATOM 2642 HA LYS B 59 -6.746 -16.725 16.911 1.00 0.00 H ATOM 2643 HB2 LYS B 59 -8.942 -15.646 16.362 1.00 0.00 H ATOM 2644 HB3 LYS B 59 -8.333 -15.389 14.710 1.00 0.00 H ATOM 2645 HG2 LYS B 59 -8.090 -17.806 14.432 1.00 0.00 H ATOM 2646 HG3 LYS B 59 -8.721 -18.054 16.077 1.00 0.00 H ATOM 2647 HD2 LYS B 59 -10.473 -18.338 14.337 1.00 0.00 H ATOM 2648 HD3 LYS B 59 -10.839 -17.006 15.458 1.00 0.00 H ATOM 2649 HE2 LYS B 59 -10.070 -15.360 13.836 1.00 0.00 H ATOM 2650 HE3 LYS B 59 -11.274 -16.419 13.065 1.00 0.00 H ATOM 2651 HZ1 LYS B 59 -8.310 -16.655 12.773 1.00 0.00 H ATOM 2652 HZ2 LYS B 59 -9.460 -17.666 12.037 1.00 0.00 H ATOM 2653 HZ3 LYS B 59 -9.375 -16.023 11.610 1.00 0.00 H ATOM 2654 H LYS B 59 -7.301 -13.929 16.725 1.00 0.00 H ATOM 2655 N ASP B 60 -5.431 -15.267 14.272 1.00 8.35 N ATOM 2656 CA ASP B 60 -4.519 -15.449 13.138 1.00 9.29 C ATOM 2657 C ASP B 60 -3.066 -15.472 13.550 1.00 8.89 C ATOM 2658 O ASP B 60 -2.206 -15.600 12.724 1.00 5.94 O ATOM 2659 CB ASP B 60 -4.734 -14.367 12.113 1.00 11.70 C ATOM 2660 CG ASP B 60 -6.025 -14.562 11.326 1.00 21.36 C ATOM 2661 OD1 ASP B 60 -6.520 -15.712 11.271 1.00 18.65 O ATOM 2662 OD2 ASP B 60 -6.543 -13.566 10.771 1.00 24.57 O ATOM 2663 HA ASP B 60 -4.751 -16.423 12.708 1.00 0.00 H ATOM 2664 HB2 ASP B 60 -4.776 -13.405 12.623 1.00 0.00 H ATOM 2665 HB3 ASP B 60 -3.895 -14.372 11.417 1.00 0.00 H ATOM 2666 H ASP B 60 -5.764 -14.311 14.508 1.00 0.00 H ATOM 2667 N GLY B 61 -2.807 -15.320 14.839 1.00 10.05 N ATOM 2668 CA GLY B 61 -1.450 -15.438 15.364 1.00 12.57 C ATOM 2669 C GLY B 61 -0.628 -14.196 15.117 1.00 12.58 C ATOM 2670 O GLY B 61 0.592 -14.234 15.200 1.00 10.10 O ATOM 2671 HA3 GLY B 61 -0.960 -16.284 14.882 1.00 0.00 H ATOM 2672 HA2 GLY B 61 -1.504 -15.615 16.438 1.00 0.00 H ATOM 2673 H GLY B 61 -3.588 -15.112 15.493 1.00 0.00 H ATOM 2674 N ILE B 62 -1.303 -13.082 14.825 1.00 10.41 N ATOM 2675 CA ILE B 62 -0.599 -11.825 14.447 1.00 11.45 C ATOM 2676 C ILE B 62 -0.264 -10.969 15.696 1.00 13.04 C ATOM 2677 O ILE B 62 0.756 -10.287 15.737 1.00 11.66 O ATOM 2678 CB ILE B 62 -1.421 -10.989 13.422 1.00 2.49 C ATOM 2679 CG1 ILE B 62 -1.670 -11.806 12.160 1.00 6.63 C ATOM 2680 CG2 ILE B 62 -0.672 -9.665 13.034 1.00 3.13 C ATOM 2681 CD1 ILE B 62 -0.403 -12.239 11.484 1.00 2.25 C ATOM 2682 HA ILE B 62 0.336 -12.117 13.969 1.00 0.00 H ATOM 2683 HB ILE B 62 -2.370 -10.730 13.892 1.00 0.00 H ATOM 2684 HG12 ILE B 62 -2.242 -12.694 12.428 1.00 0.00 H ATOM 2685 HG13 ILE B 62 -2.247 -11.200 11.462 1.00 0.00 H ATOM 2686 HD11 ILE B 62 0.175 -11.359 11.202 1.00 0.00 H ATOM 2687 HD12 ILE B 62 0.180 -12.855 12.169 1.00 0.00 H ATOM 2688 HD13 ILE B 62 -0.647 -12.816 10.592 1.00 0.00 H ATOM 2689 HG21 ILE B 62 -0.516 -9.062 13.928 1.00 0.00 H ATOM 2690 HG22 ILE B 62 0.291 -9.911 12.588 1.00 0.00 H ATOM 2691 HG23 ILE B 62 -1.273 -9.106 12.317 1.00 0.00 H ATOM 2692 H ILE B 62 -2.342 -13.092 14.862 1.00 0.00 H ATOM 2693 N ILE B 63 -1.153 -11.015 16.689 1.00 15.05 N ATOM 2694 CA ILE B 63 -0.954 -10.331 17.963 1.00 10.97 C ATOM 2695 C ILE B 63 -1.301 -11.307 19.080 1.00 11.79 C ATOM 2696 O ILE B 63 -1.887 -12.376 18.824 1.00 14.41 O ATOM 2697 CB ILE B 63 -1.877 -9.095 18.109 1.00 9.90 C ATOM 2698 CG1 ILE B 63 -3.347 -9.527 18.188 1.00 13.17 C ATOM 2699 CG2 ILE B 63 -1.663 -8.117 16.977 1.00 5.16 C ATOM 2700 CD1 ILE B 63 -4.294 -8.385 18.506 1.00 11.74 C ATOM 2701 HA ILE B 63 0.082 -9.995 18.012 1.00 0.00 H ATOM 2702 HB ILE B 63 -1.618 -8.588 19.038 1.00 0.00 H ATOM 2703 HG12 ILE B 63 -3.633 -9.957 17.228 1.00 0.00 H ATOM 2704 HG13 ILE B 63 -3.444 -10.284 18.967 1.00 0.00 H ATOM 2705 HD11 ILE B 63 -4.027 -7.951 19.470 1.00 0.00 H ATOM 2706 HD12 ILE B 63 -4.217 -7.624 17.730 1.00 0.00 H ATOM 2707 HD13 ILE B 63 -5.316 -8.762 18.546 1.00 0.00 H ATOM 2708 HG21 ILE B 63 -0.626 -7.780 16.981 1.00 0.00 H ATOM 2709 HG22 ILE B 63 -1.884 -8.607 16.029 1.00 0.00 H ATOM 2710 HG23 ILE B 63 -2.325 -7.261 17.108 1.00 0.00 H ATOM 2711 H ILE B 63 -2.026 -11.562 16.550 1.00 0.00 H ATOM 2712 N SER B 64 -0.880 -10.986 20.307 1.00 9.65 N ATOM 2713 CA SER B 64 -1.369 -11.701 21.497 1.00 12.61 C ATOM 2714 C SER B 64 -1.541 -10.685 22.606 1.00 8.98 C ATOM 2715 O SER B 64 -1.277 -9.498 22.404 1.00 13.96 O ATOM 2716 CB SER B 64 -0.413 -12.825 21.927 1.00 14.44 C ATOM 2717 OG SER B 64 0.784 -12.298 22.536 1.00 17.50 O ATOM 2718 HA SER B 64 -2.319 -12.182 21.266 1.00 0.00 H ATOM 2719 HB2 SER B 64 -0.136 -13.410 21.050 1.00 0.00 H ATOM 2720 HB3 SER B 64 -0.922 -13.468 22.645 1.00 0.00 H ATOM 2721 HG SER B 64 0.540 -11.770 23.337 1.00 0.00 H ATOM 2722 H SER B 64 -0.192 -10.215 20.424 1.00 0.00 H ATOM 2723 N SER B 65 -1.989 -11.146 23.776 1.00 9.68 N ATOM 2724 CA SER B 65 -2.274 -10.255 24.900 1.00 16.58 C ATOM 2725 C SER B 65 -1.763 -10.854 26.208 1.00 13.64 C ATOM 2726 O SER B 65 -1.577 -12.064 26.322 1.00 8.58 O ATOM 2727 CB SER B 65 -3.782 -9.990 25.008 1.00 19.39 C ATOM 2728 OG SER B 65 -4.499 -11.208 25.121 1.00 19.10 O ATOM 2729 HA SER B 65 -1.759 -9.312 24.720 1.00 0.00 H ATOM 2730 HB2 SER B 65 -4.117 -9.459 24.117 1.00 0.00 H ATOM 2731 HB3 SER B 65 -3.976 -9.378 25.889 1.00 0.00 H ATOM 2732 HG SER B 65 -5.467 -11.014 25.189 1.00 0.00 H ATOM 2733 H SER B 65 -2.140 -12.169 23.891 1.00 0.00 H ATOM 2734 N TYR B 66 -1.530 -10.002 27.190 1.00 7.99 N ATOM 2735 CA TYR B 66 -1.083 -10.459 28.487 1.00 5.17 C ATOM 2736 C TYR B 66 -1.371 -9.352 29.449 1.00 2.00 C ATOM 2737 O TYR B 66 -1.646 -8.234 29.029 1.00 5.99 O ATOM 2738 CB TYR B 66 0.432 -10.772 28.458 1.00 4.99 C ATOM 2739 CG TYR B 66 1.284 -9.580 28.137 1.00 2.00 C ATOM 2740 CD1 TYR B 66 1.451 -9.161 26.826 1.00 2.00 C ATOM 2741 CD2 TYR B 66 1.922 -8.861 29.145 1.00 2.59 C ATOM 2742 CE1 TYR B 66 2.208 -8.075 26.527 1.00 2.18 C ATOM 2743 CE2 TYR B 66 2.679 -7.771 28.854 1.00 2.00 C ATOM 2744 CZ TYR B 66 2.832 -7.384 27.527 1.00 3.45 C ATOM 2745 OH TYR B 66 3.617 -6.281 27.206 1.00 3.98 O ATOM 2746 HA TYR B 66 -1.595 -11.376 28.779 1.00 0.00 H ATOM 2747 HB3 TYR B 66 0.612 -11.538 27.704 1.00 0.00 H ATOM 2748 HB2 TYR B 66 0.725 -11.152 29.437 1.00 0.00 H ATOM 2749 HD2 TYR B 66 1.812 -9.177 30.182 1.00 0.00 H ATOM 2750 HE2 TYR B 66 3.161 -7.206 29.652 1.00 0.00 H ATOM 2751 HE1 TYR B 66 2.318 -7.755 25.491 1.00 0.00 H ATOM 2752 HD1 TYR B 66 0.966 -9.713 26.021 1.00 0.00 H ATOM 2753 HH TYR B 66 3.615 -6.150 26.225 1.00 0.00 H ATOM 2754 H TYR B 66 -1.671 -8.984 27.028 1.00 0.00 H ATOM 2755 N TRP B 67 -1.305 -9.650 30.744 1.00 3.61 N ATOM 2756 CA TRP B 67 -1.601 -8.664 31.798 1.00 3.30 C ATOM 2757 C TRP B 67 -0.390 -7.803 32.191 1.00 9.41 C ATOM 2758 O TRP B 67 0.711 -8.312 32.348 1.00 7.60 O ATOM 2759 CB TRP B 67 -2.160 -9.376 33.043 1.00 11.65 C ATOM 2760 CG TRP B 67 -3.526 -9.849 32.833 1.00 22.13 C ATOM 2761 CD1 TRP B 67 -3.919 -11.121 32.565 1.00 25.42 C ATOM 2762 CD2 TRP B 67 -4.710 -9.041 32.789 1.00 26.42 C ATOM 2763 NE1 TRP B 67 -5.277 -11.164 32.378 1.00 30.49 N ATOM 2764 CE2 TRP B 67 -5.784 -9.894 32.508 1.00 32.22 C ATOM 2765 CE3 TRP B 67 -4.961 -7.672 32.972 1.00 24.10 C ATOM 2766 CZ2 TRP B 67 -7.096 -9.431 32.409 1.00 32.35 C ATOM 2767 CZ3 TRP B 67 -6.257 -7.218 32.879 1.00 27.85 C ATOM 2768 CH2 TRP B 67 -7.309 -8.091 32.596 1.00 30.34 C ATOM 2769 HA TRP B 67 -2.345 -7.984 31.383 1.00 0.00 H ATOM 2770 HB2 TRP B 67 -1.523 -10.229 33.277 1.00 0.00 H ATOM 2771 HB3 TRP B 67 -2.153 -8.679 33.881 1.00 0.00 H ATOM 2772 HE1 TRP B 67 -5.832 -12.019 32.171 1.00 0.00 H ATOM 2773 HD1 TRP B 67 -3.253 -11.982 32.507 1.00 0.00 H ATOM 2774 HZ2 TRP B 67 -7.920 -10.110 32.191 1.00 0.00 H ATOM 2775 HH2 TRP B 67 -8.323 -7.697 32.522 1.00 0.00 H ATOM 2776 HZ3 TRP B 67 -6.466 -6.159 33.029 1.00 0.00 H ATOM 2777 HE3 TRP B 67 -4.145 -6.981 33.184 1.00 0.00 H ATOM 2778 H TRP B 67 -1.034 -10.615 31.023 1.00 0.00 H ATOM 2779 N GLY B 68 -0.615 -6.500 32.351 1.00 2.00 N ATOM 2780 CA GLY B 68 0.390 -5.602 32.894 1.00 12.94 C ATOM 2781 C GLY B 68 0.417 -5.698 34.409 1.00 19.94 C ATOM 2782 O GLY B 68 0.047 -6.728 34.970 1.00 25.00 O ATOM 2783 HA3 GLY B 68 0.154 -4.579 32.602 1.00 0.00 H ATOM 2784 HA2 GLY B 68 1.368 -5.875 32.498 1.00 0.00 H ATOM 2785 H GLY B 68 -1.541 -6.112 32.078 1.00 0.00 H ATOM 2786 N ASP B 69 0.855 -4.628 35.078 1.00 31.11 N ATOM 2787 CA ASP B 69 0.937 -4.626 36.558 1.00 35.39 C ATOM 2788 C ASP B 69 0.539 -3.301 37.218 1.00 37.74 C ATOM 2789 O ASP B 69 0.124 -2.352 36.550 1.00 36.84 O ATOM 2790 CB ASP B 69 2.335 -5.042 37.030 1.00 39.15 C ATOM 2791 CG ASP B 69 2.459 -6.541 37.237 1.00 41.34 C ATOM 2792 OD1 ASP B 69 1.409 -7.233 37.252 1.00 39.87 O ATOM 2793 OD2 ASP B 69 3.605 -7.028 37.390 1.00 41.72 O ATOM 2794 HA ASP B 69 0.197 -5.359 36.880 1.00 0.00 H ATOM 2795 HB2 ASP B 69 3.064 -4.731 36.281 1.00 0.00 H ATOM 2796 HB3 ASP B 69 2.549 -4.540 37.974 1.00 0.00 H ATOM 2797 H ASP B 69 1.144 -3.780 34.550 1.00 0.00 H ATOM 2798 N GLU B 70 0.671 -3.258 38.542 1.00 42.97 N ATOM 2799 CA GLU B 70 0.399 -2.050 39.317 1.00 46.90 C ATOM 2800 C GLU B 70 -0.978 -2.096 39.974 1.00 49.71 C ATOM 2801 O GLU B 70 -1.688 -3.098 39.882 1.00 53.34 O ATOM 2802 CB GLU B 70 0.526 -0.802 38.440 1.00 48.27 C ATOM 2803 CG GLU B 70 0.497 0.497 39.220 1.00 47.98 C ATOM 2804 CD GLU B 70 1.500 0.508 40.360 1.00 49.29 C ATOM 2805 OE1 GLU B 70 2.606 -0.045 40.188 1.00 50.81 O ATOM 2806 OE2 GLU B 70 1.179 1.063 41.429 1.00 47.82 O ATOM 2807 HA GLU B 70 1.145 -2.001 40.110 1.00 0.00 H ATOM 2808 HB2 GLU B 70 1.470 -0.857 37.898 1.00 0.00 H ATOM 2809 HB3 GLU B 70 -0.300 -0.795 37.729 1.00 0.00 H ATOM 2810 HG2 GLU B 70 0.728 1.319 38.542 1.00 0.00 H ATOM 2811 HG3 GLU B 70 -0.503 0.637 39.631 1.00 0.00 H ATOM 2812 H GLU B 70 0.979 -4.116 39.043 1.00 0.00 H TER 2813 GLU B 70 ATOM 2814 N GLY B 74 -4.725 -2.068 39.787 1.00 29.40 N ATOM 2815 CA GLY B 74 -5.530 -2.864 38.866 1.00 25.42 C ATOM 2816 C GLY B 74 -4.854 -3.047 37.517 1.00 29.76 C ATOM 2817 O GLY B 74 -4.639 -2.083 36.788 1.00 31.62 O ATOM 2818 HA3 GLY B 74 -6.486 -2.364 38.714 1.00 0.00 H ATOM 2819 HA2 GLY B 74 -5.701 -3.845 39.308 1.00 0.00 H ATOM 2820 HN3 GLY B 74 -4.562 -1.126 39.378 1.00 0.00 H ATOM 2821 HN2 GLY B 74 -3.812 -2.541 39.945 1.00 0.00 H ATOM 2822 HN1 GLY B 74 -5.229 -1.972 40.692 1.00 0.00 H ATOM 2823 N ARG B 75 -4.539 -4.293 37.181 1.00 27.18 N ATOM 2824 CA ARG B 75 -3.794 -4.612 35.967 1.00 25.81 C ATOM 2825 C ARG B 75 -4.525 -4.199 34.673 1.00 26.50 C ATOM 2826 O ARG B 75 -5.757 -4.205 34.615 1.00 27.30 O ATOM 2827 CB ARG B 75 -3.493 -6.104 35.935 1.00 25.98 C ATOM 2828 CG ARG B 75 -3.146 -6.673 37.295 1.00 30.46 C ATOM 2829 CD ARG B 75 -3.488 -8.140 37.374 1.00 34.82 C ATOM 2830 NE ARG B 75 -2.432 -8.989 36.829 1.00 39.93 N ATOM 2831 CZ ARG B 75 -2.583 -10.284 36.556 1.00 43.91 C ATOM 2832 NH1 ARG B 75 -3.763 -10.873 36.761 1.00 46.32 N ATOM 2833 NH2 ARG B 75 -1.563 -10.993 36.069 1.00 42.36 N ATOM 2834 HA ARG B 75 -2.871 -4.033 36.000 1.00 0.00 H ATOM 2835 HB2 ARG B 75 -4.371 -6.626 35.554 1.00 0.00 H ATOM 2836 HB3 ARG B 75 -2.651 -6.273 35.263 1.00 0.00 H ATOM 2837 HG2 ARG B 75 -2.078 -6.546 37.472 1.00 0.00 H ATOM 2838 HG3 ARG B 75 -3.706 -6.135 38.060 1.00 0.00 H ATOM 2839 HD2 ARG B 75 -4.405 -8.317 36.811 1.00 0.00 H ATOM 2840 HD3 ARG B 75 -3.647 -8.407 38.419 1.00 0.00 H ATOM 2841 HE ARG B 75 -1.505 -8.556 36.643 1.00 0.00 H ATOM 2842 HH12 ARG B 75 -3.883 -11.884 36.549 1.00 0.00 H ATOM 2843 HH11 ARG B 75 -4.562 -10.321 37.133 1.00 0.00 H ATOM 2844 HH22 ARG B 75 -1.686 -12.004 35.858 1.00 0.00 H ATOM 2845 HH21 ARG B 75 -0.645 -10.535 35.901 1.00 0.00 H ATOM 2846 H ARG B 75 -4.834 -5.070 37.806 1.00 0.00 H ATOM 2847 N ARG B 76 -3.746 -3.842 33.642 1.00 22.74 N ATOM 2848 CA ARG B 76 -4.282 -3.585 32.299 1.00 14.68 C ATOM 2849 C ARG B 76 -3.910 -4.717 31.382 1.00 13.07 C ATOM 2850 O ARG B 76 -2.933 -5.436 31.623 1.00 17.09 O ATOM 2851 CB ARG B 76 -3.723 -2.288 31.729 1.00 19.33 C ATOM 2852 CG ARG B 76 -4.321 -1.054 32.293 1.00 23.66 C ATOM 2853 CD ARG B 76 -3.516 0.148 31.892 1.00 32.26 C ATOM 2854 NE ARG B 76 -4.059 1.374 32.468 1.00 47.73 N ATOM 2855 CZ ARG B 76 -3.473 2.566 32.382 1.00 53.97 C ATOM 2856 NH1 ARG B 76 -2.312 2.695 31.743 1.00 56.32 N ATOM 2857 NH2 ARG B 76 -4.046 3.631 32.938 1.00 55.74 N ATOM 2858 HA ARG B 76 -5.366 -3.501 32.376 1.00 0.00 H ATOM 2859 HB2 ARG B 76 -2.651 -2.266 31.924 1.00 0.00 H ATOM 2860 HB3 ARG B 76 -3.895 -2.288 30.653 1.00 0.00 H ATOM 2861 HG2 ARG B 76 -5.339 -0.945 31.920 1.00 0.00 H ATOM 2862 HG3 ARG B 76 -4.339 -1.128 33.380 1.00 0.00 H ATOM 2863 HD2 ARG B 76 -3.524 0.233 30.805 1.00 0.00 H ATOM 2864 HD3 ARG B 76 -2.490 0.019 32.237 1.00 0.00 H ATOM 2865 HE ARG B 76 -4.963 1.312 32.979 1.00 0.00 H ATOM 2866 HH12 ARG B 76 -1.856 3.627 31.677 1.00 0.00 H ATOM 2867 HH11 ARG B 76 -1.862 1.864 31.310 1.00 0.00 H ATOM 2868 HH22 ARG B 76 -3.588 4.562 32.871 1.00 0.00 H ATOM 2869 HH21 ARG B 76 -4.952 3.532 33.440 1.00 0.00 H ATOM 2870 H ARG B 76 -2.723 -3.743 33.799 1.00 0.00 H ATOM 2871 N LYS B 77 -4.660 -4.870 30.309 1.00 9.99 N ATOM 2872 CA LYS B 77 -4.376 -5.902 29.348 1.00 18.09 C ATOM 2873 C LYS B 77 -3.616 -5.275 28.213 1.00 22.00 C ATOM 2874 O LYS B 77 -4.083 -4.295 27.618 1.00 15.39 O ATOM 2875 CB LYS B 77 -5.670 -6.534 28.832 1.00 15.65 C ATOM 2876 CG LYS B 77 -5.474 -7.826 28.053 1.00 16.97 C ATOM 2877 CD LYS B 77 -6.758 -8.238 27.360 1.00 28.10 C ATOM 2878 CE LYS B 77 -6.834 -9.763 27.153 1.00 36.68 C ATOM 2879 NZ LYS B 77 -6.544 -10.512 28.427 1.00 36.98 N ATOM 2880 HA LYS B 77 -3.787 -6.692 29.813 1.00 0.00 H ATOM 2881 HB2 LYS B 77 -6.311 -6.746 29.688 1.00 0.00 H ATOM 2882 HB3 LYS B 77 -6.164 -5.814 28.179 1.00 0.00 H ATOM 2883 HG2 LYS B 77 -4.696 -7.678 27.305 1.00 0.00 H ATOM 2884 HG3 LYS B 77 -5.170 -8.615 28.740 1.00 0.00 H ATOM 2885 HD2 LYS B 77 -7.605 -7.922 27.969 1.00 0.00 H ATOM 2886 HD3 LYS B 77 -6.808 -7.747 26.388 1.00 0.00 H ATOM 2887 HE2 LYS B 77 -6.104 -10.054 26.397 1.00 0.00 H ATOM 2888 HE3 LYS B 77 -7.835 -10.024 26.809 1.00 0.00 H ATOM 2889 HZ1 LYS B 77 -5.588 -10.273 28.758 1.00 0.00 H ATOM 2890 HZ2 LYS B 77 -7.240 -10.244 29.152 1.00 0.00 H ATOM 2891 HZ3 LYS B 77 -6.605 -11.535 28.248 1.00 0.00 H ATOM 2892 H LYS B 77 -5.469 -4.235 30.155 1.00 0.00 H ATOM 2893 N TYR B 78 -2.426 -5.823 27.932 1.00 14.78 N ATOM 2894 CA TYR B 78 -1.573 -5.349 26.849 1.00 11.93 C ATOM 2895 C TYR B 78 -1.670 -6.242 25.648 1.00 15.04 C ATOM 2896 O TYR B 78 -1.833 -7.477 25.755 1.00 12.98 O ATOM 2897 CB TYR B 78 -0.106 -5.233 27.298 1.00 8.17 C ATOM 2898 CG TYR B 78 0.105 -4.071 28.178 1.00 8.20 C ATOM 2899 CD1 TYR B 78 0.567 -2.867 27.669 1.00 8.81 C ATOM 2900 CD2 TYR B 78 -0.229 -4.134 29.518 1.00 13.13 C ATOM 2901 CE1 TYR B 78 0.729 -1.758 28.492 1.00 11.79 C ATOM 2902 CE2 TYR B 78 -0.077 -3.042 30.347 1.00 16.61 C ATOM 2903 CZ TYR B 78 0.396 -1.852 29.826 1.00 15.42 C ATOM 2904 OH TYR B 78 0.545 -0.766 30.656 1.00 23.12 O ATOM 2905 HA TYR B 78 -1.930 -4.356 26.574 1.00 0.00 H ATOM 2906 HB3 TYR B 78 0.526 -5.128 26.416 1.00 0.00 H ATOM 2907 HB2 TYR B 78 0.171 -6.139 27.837 1.00 0.00 H ATOM 2908 HD2 TYR B 78 -0.620 -5.065 29.928 1.00 0.00 H ATOM 2909 HE2 TYR B 78 -0.328 -3.117 31.405 1.00 0.00 H ATOM 2910 HE1 TYR B 78 1.116 -0.823 28.086 1.00 0.00 H ATOM 2911 HD1 TYR B 78 0.807 -2.789 26.609 1.00 0.00 H ATOM 2912 HH TYR B 78 0.890 0.001 30.135 1.00 0.00 H ATOM 2913 H TYR B 78 -2.097 -6.621 28.512 1.00 0.00 H ATOM 2914 N TYR B 79 -1.635 -5.611 24.490 1.00 14.79 N ATOM 2915 CA TYR B 79 -1.584 -6.324 23.260 1.00 13.86 C ATOM 2916 C TYR B 79 -0.212 -6.171 22.693 1.00 16.77 C ATOM 2917 O TYR B 79 0.420 -5.119 22.829 1.00 10.41 O ATOM 2918 CB TYR B 79 -2.647 -5.808 22.306 1.00 15.69 C ATOM 2919 CG TYR B 79 -4.026 -6.174 22.759 1.00 15.06 C ATOM 2920 CD1 TYR B 79 -4.603 -7.385 22.378 1.00 15.12 C ATOM 2921 CD2 TYR B 79 -4.742 -5.340 23.624 1.00 15.15 C ATOM 2922 CE1 TYR B 79 -5.882 -7.747 22.819 1.00 18.88 C ATOM 2923 CE2 TYR B 79 -6.008 -5.685 24.064 1.00 20.46 C ATOM 2924 CZ TYR B 79 -6.574 -6.891 23.661 1.00 22.61 C ATOM 2925 OH TYR B 79 -7.836 -7.221 24.082 1.00 26.56 O ATOM 2926 HA TYR B 79 -1.790 -7.382 23.421 1.00 0.00 H ATOM 2927 HB3 TYR B 79 -2.474 -6.237 21.319 1.00 0.00 H ATOM 2928 HB2 TYR B 79 -2.571 -4.722 22.247 1.00 0.00 H ATOM 2929 HD2 TYR B 79 -4.296 -4.403 23.957 1.00 0.00 H ATOM 2930 HE2 TYR B 79 -6.560 -5.015 24.723 1.00 0.00 H ATOM 2931 HE1 TYR B 79 -6.328 -8.690 22.504 1.00 0.00 H ATOM 2932 HD1 TYR B 79 -4.049 -8.061 21.726 1.00 0.00 H ATOM 2933 HH TYR B 79 -8.087 -8.103 23.709 1.00 0.00 H ATOM 2934 H TYR B 79 -1.645 -4.571 24.476 1.00 0.00 H ATOM 2935 N ARG B 80 0.266 -7.239 22.086 1.00 18.90 N ATOM 2936 CA ARG B 80 1.628 -7.321 21.623 1.00 17.92 C ATOM 2937 C ARG B 80 1.582 -7.848 20.177 1.00 17.02 C ATOM 2938 O ARG B 80 0.847 -8.799 19.883 1.00 10.35 O ATOM 2939 CB ARG B 80 2.353 -8.344 22.491 1.00 13.46 C ATOM 2940 CG ARG B 80 3.782 -8.093 22.688 1.00 37.43 C ATOM 2941 CD ARG B 80 4.384 -9.300 23.388 1.00 34.50 C ATOM 2942 NE ARG B 80 3.745 -10.486 22.885 1.00 25.63 N ATOM 2943 CZ ARG B 80 4.276 -11.295 21.982 1.00 18.69 C ATOM 2944 NH1 ARG B 80 5.500 -11.083 21.523 1.00 12.14 N ATOM 2945 NH2 ARG B 80 3.589 -12.337 21.559 1.00 13.94 N ATOM 2946 HA ARG B 80 2.132 -6.356 21.672 1.00 0.00 H ATOM 2947 HB2 ARG B 80 1.874 -8.356 23.470 1.00 0.00 H ATOM 2948 HB3 ARG B 80 2.244 -9.322 22.023 1.00 0.00 H ATOM 2949 HG2 ARG B 80 4.267 -7.945 21.723 1.00 0.00 H ATOM 2950 HG3 ARG B 80 3.919 -7.203 23.302 1.00 0.00 H ATOM 2951 HD2 ARG B 80 4.220 -9.222 24.463 1.00 0.00 H ATOM 2952 HD3 ARG B 80 5.454 -9.346 23.187 1.00 0.00 H ATOM 2953 HE ARG B 80 2.803 -10.724 23.255 1.00 0.00 H ATOM 2954 HH12 ARG B 80 5.908 -11.725 20.813 1.00 0.00 H ATOM 2955 HH11 ARG B 80 6.054 -10.275 21.872 1.00 0.00 H ATOM 2956 HH22 ARG B 80 3.999 -12.977 20.850 1.00 0.00 H ATOM 2957 HH21 ARG B 80 2.636 -12.519 21.935 1.00 0.00 H ATOM 2958 H ARG B 80 -0.364 -8.053 21.936 1.00 0.00 H ATOM 2959 N LEU B 81 2.384 -7.271 19.295 1.00 9.49 N ATOM 2960 CA LEU B 81 2.594 -7.859 17.966 1.00 13.82 C ATOM 2961 C LEU B 81 3.443 -9.140 18.147 1.00 9.53 C ATOM 2962 O LEU B 81 4.426 -9.129 18.872 1.00 18.69 O ATOM 2963 CB LEU B 81 3.331 -6.839 17.075 1.00 13.57 C ATOM 2964 CG LEU B 81 3.256 -6.850 15.542 1.00 20.95 C ATOM 2965 CD1 LEU B 81 1.844 -6.947 15.011 1.00 19.13 C ATOM 2966 CD2 LEU B 81 3.912 -5.587 15.052 1.00 18.75 C ATOM 2967 HA LEU B 81 1.646 -8.110 17.490 1.00 0.00 H ATOM 2968 HB2 LEU B 81 2.973 -5.857 17.385 1.00 0.00 H ATOM 2969 HB3 LEU B 81 4.388 -6.934 17.323 1.00 0.00 H ATOM 2970 HG LEU B 81 3.767 -7.740 15.176 1.00 0.00 H ATOM 2971 HD21 LEU B 81 3.382 -4.724 15.455 1.00 0.00 H ATOM 2972 HD22 LEU B 81 4.950 -5.566 15.384 1.00 0.00 H ATOM 2973 HD23 LEU B 81 3.877 -5.560 13.963 1.00 0.00 H ATOM 2974 HD11 LEU B 81 1.385 -7.869 15.369 1.00 0.00 H ATOM 2975 HD12 LEU B 81 1.266 -6.092 15.362 1.00 0.00 H ATOM 2976 HD13 LEU B 81 1.866 -6.950 13.921 1.00 0.00 H ATOM 2977 H LEU B 81 2.872 -6.388 19.547 1.00 0.00 H ATOM 2978 N THR B 82 3.060 -10.246 17.526 1.00 12.76 N ATOM 2979 CA THR B 82 3.886 -11.452 17.670 1.00 11.88 C ATOM 2980 C THR B 82 5.081 -11.379 16.732 1.00 12.45 C ATOM 2981 O THR B 82 5.161 -10.486 15.892 1.00 12.96 O ATOM 2982 CB THR B 82 3.102 -12.737 17.398 1.00 13.96 C ATOM 2983 OG1 THR B 82 2.676 -12.751 16.029 1.00 6.75 O ATOM 2984 CG2 THR B 82 1.872 -12.834 18.343 1.00 10.84 C ATOM 2985 HA THR B 82 4.222 -11.486 18.706 1.00 0.00 H ATOM 2986 HB THR B 82 3.746 -13.596 17.587 1.00 0.00 H ATOM 2987 HG1 THR B 82 2.168 -13.582 15.851 1.00 0.00 H ATOM 2988 HG23 THR B 82 2.210 -12.822 19.379 1.00 0.00 H ATOM 2989 HG21 THR B 82 1.211 -11.986 18.165 1.00 0.00 H ATOM 2990 HG22 THR B 82 1.335 -13.762 18.145 1.00 0.00 H ATOM 2991 H THR B 82 2.194 -10.260 16.950 1.00 0.00 H ATOM 2992 N GLU B 83 6.007 -12.322 16.876 1.00 8.00 N ATOM 2993 CA GLU B 83 7.127 -12.427 15.955 1.00 19.44 C ATOM 2994 C GLU B 83 6.639 -12.742 14.540 1.00 19.82 C ATOM 2995 O GLU B 83 7.135 -12.164 13.559 1.00 16.12 O ATOM 2996 CB GLU B 83 8.136 -13.484 16.436 1.00 17.51 C ATOM 2997 CG GLU B 83 9.242 -12.909 17.328 1.00 25.72 C ATOM 2998 CD GLU B 83 9.335 -13.609 18.666 1.00 30.42 C ATOM 2999 OE1 GLU B 83 8.432 -13.381 19.499 1.00 32.52 O ATOM 3000 OE2 GLU B 83 10.313 -14.374 18.895 1.00 25.81 O ATOM 3001 HA GLU B 83 7.636 -11.463 15.930 1.00 0.00 H ATOM 3002 HB2 GLU B 83 7.597 -14.245 17.001 1.00 0.00 H ATOM 3003 HB3 GLU B 83 8.600 -13.942 15.562 1.00 0.00 H ATOM 3004 HG2 GLU B 83 10.196 -13.014 16.812 1.00 0.00 H ATOM 3005 HG3 GLU B 83 9.038 -11.852 17.500 1.00 0.00 H ATOM 3006 H GLU B 83 5.929 -12.998 17.663 1.00 0.00 H ATOM 3007 N ILE B 84 5.663 -13.650 14.432 1.00 19.40 N ATOM 3008 CA ILE B 84 4.991 -13.891 13.132 1.00 15.38 C ATOM 3009 C ILE B 84 4.313 -12.611 12.646 1.00 13.42 C ATOM 3010 O ILE B 84 4.358 -12.287 11.457 1.00 15.95 O ATOM 3011 CB ILE B 84 3.947 -15.039 13.213 1.00 16.02 C ATOM 3012 CG1 ILE B 84 4.651 -16.389 13.300 1.00 19.90 C ATOM 3013 CG2 ILE B 84 3.033 -15.017 12.007 1.00 15.13 C ATOM 3014 CD1 ILE B 84 5.390 -16.776 12.009 1.00 26.84 C ATOM 3015 HA ILE B 84 5.761 -14.195 12.423 1.00 0.00 H ATOM 3016 HB ILE B 84 3.347 -14.890 14.111 1.00 0.00 H ATOM 3017 HG12 ILE B 84 5.375 -16.350 14.114 1.00 0.00 H ATOM 3018 HG13 ILE B 84 3.905 -17.155 13.515 1.00 0.00 H ATOM 3019 HD11 ILE B 84 4.677 -16.830 11.186 1.00 0.00 H ATOM 3020 HD12 ILE B 84 6.148 -16.025 11.786 1.00 0.00 H ATOM 3021 HD13 ILE B 84 5.867 -17.747 12.142 1.00 0.00 H ATOM 3022 HG21 ILE B 84 2.507 -14.063 11.969 1.00 0.00 H ATOM 3023 HG22 ILE B 84 3.626 -15.142 11.101 1.00 0.00 H ATOM 3024 HG23 ILE B 84 2.311 -15.829 12.085 1.00 0.00 H ATOM 3025 H ILE B 84 5.372 -14.194 15.270 1.00 0.00 H ATOM 3026 N GLY B 85 3.705 -11.872 13.571 1.00 10.45 N ATOM 3027 CA GLY B 85 3.046 -10.621 13.214 1.00 13.02 C ATOM 3028 C GLY B 85 4.038 -9.631 12.599 1.00 19.33 C ATOM 3029 O GLY B 85 3.764 -9.036 11.555 1.00 14.39 O ATOM 3030 HA3 GLY B 85 2.611 -10.179 14.110 1.00 0.00 H ATOM 3031 HA2 GLY B 85 2.256 -10.828 12.492 1.00 0.00 H ATOM 3032 H GLY B 85 3.700 -12.191 14.561 1.00 0.00 H ATOM 3033 N HIS B 86 5.203 -9.472 13.258 1.00 17.48 N ATOM 3034 CA HIS B 86 6.286 -8.597 12.776 1.00 18.58 C ATOM 3035 C HIS B 86 6.791 -9.001 11.390 1.00 16.26 C ATOM 3036 O HIS B 86 7.072 -8.153 10.556 1.00 17.41 O ATOM 3037 CB HIS B 86 7.478 -8.634 13.743 1.00 11.70 C ATOM 3038 CG HIS B 86 7.392 -7.644 14.853 1.00 18.19 C ATOM 3039 ND1 HIS B 86 7.099 -8.008 16.154 1.00 20.10 N ATOM 3040 CD2 HIS B 86 7.624 -6.309 14.878 1.00 15.56 C ATOM 3041 CE1 HIS B 86 7.121 -6.933 16.926 1.00 16.02 C ATOM 3042 NE2 HIS B 86 7.439 -5.890 16.178 1.00 23.09 N ATOM 3043 HA HIS B 86 5.864 -7.594 12.718 1.00 0.00 H ATOM 3044 HB2 HIS B 86 7.536 -9.632 14.178 1.00 0.00 H ATOM 3045 HB3 HIS B 86 8.386 -8.434 13.175 1.00 0.00 H ATOM 3046 HD2 HIS B 86 7.904 -5.684 14.030 1.00 0.00 H ATOM 3047 HE1 HIS B 86 6.913 -6.911 17.996 1.00 0.00 H ATOM 3048 H HIS B 86 5.344 -9.991 14.148 1.00 0.00 H ATOM 3049 N GLU B 87 6.975 -10.304 11.183 1.00 15.89 N ATOM 3050 CA GLU B 87 7.474 -10.806 9.915 1.00 15.91 C ATOM 3051 C GLU B 87 6.496 -10.547 8.756 1.00 18.53 C ATOM 3052 O GLU B 87 6.900 -10.093 7.673 1.00 17.78 O ATOM 3053 CB GLU B 87 7.801 -12.292 10.019 1.00 21.94 C ATOM 3054 CG GLU B 87 8.652 -12.793 8.885 1.00 34.32 C ATOM 3055 CD GLU B 87 9.967 -12.007 8.748 1.00 43.17 C ATOM 3056 OE1 GLU B 87 10.471 -11.468 9.778 1.00 47.59 O ATOM 3057 OE2 GLU B 87 10.494 -11.938 7.619 1.00 41.46 O ATOM 3058 HA GLU B 87 8.388 -10.256 9.690 1.00 0.00 H ATOM 3059 HB2 GLU B 87 8.333 -12.465 10.954 1.00 0.00 H ATOM 3060 HB3 GLU B 87 6.866 -12.853 10.025 1.00 0.00 H ATOM 3061 HG2 GLU B 87 8.888 -13.843 9.061 1.00 0.00 H ATOM 3062 HG3 GLU B 87 8.089 -12.699 7.956 1.00 0.00 H ATOM 3063 H GLU B 87 6.757 -10.976 11.946 1.00 0.00 H ATOM 3064 N ASN B 88 5.213 -10.825 8.988 1.00 19.26 N ATOM 3065 CA ASN B 88 4.173 -10.533 7.991 1.00 16.07 C ATOM 3066 C ASN B 88 4.133 -9.081 7.614 1.00 12.97 C ATOM 3067 O ASN B 88 4.021 -8.746 6.442 1.00 17.15 O ATOM 3068 CB ASN B 88 2.803 -10.981 8.487 1.00 16.40 C ATOM 3069 CG ASN B 88 2.635 -12.463 8.417 1.00 23.76 C ATOM 3070 OD1 ASN B 88 3.412 -13.143 7.757 1.00 34.96 O ATOM 3071 ND2 ASN B 88 1.625 -12.988 9.104 1.00 30.65 N ATOM 3072 HA ASN B 88 4.432 -11.098 7.096 1.00 0.00 H ATOM 3073 HB2 ASN B 88 2.683 -10.662 9.522 1.00 0.00 H ATOM 3074 HB3 ASN B 88 2.036 -10.511 7.872 1.00 0.00 H ATOM 3075 HD22 ASN B 88 0.991 -12.370 9.650 1.00 0.00 H ATOM 3076 HD21 ASN B 88 1.469 -14.016 9.095 1.00 0.00 H ATOM 3077 H ASN B 88 4.942 -11.258 9.894 1.00 0.00 H ATOM 3078 N MET B 89 4.205 -8.202 8.611 1.00 14.05 N ATOM 3079 CA MET B 89 4.298 -6.760 8.335 1.00 17.12 C ATOM 3080 C MET B 89 5.545 -6.422 7.537 1.00 21.60 C ATOM 3081 O MET B 89 5.508 -5.586 6.624 1.00 18.89 O ATOM 3082 CB MET B 89 4.323 -5.966 9.621 1.00 16.85 C ATOM 3083 CG MET B 89 3.030 -5.984 10.387 1.00 18.93 C ATOM 3084 SD MET B 89 3.141 -4.803 11.743 1.00 35.08 S ATOM 3085 CE MET B 89 2.716 -3.271 10.857 1.00 30.92 C ATOM 3086 HA MET B 89 3.416 -6.496 7.751 1.00 0.00 H ATOM 3087 HB2 MET B 89 5.104 -6.377 10.261 1.00 0.00 H ATOM 3088 HB3 MET B 89 4.561 -4.930 9.378 1.00 0.00 H ATOM 3089 HG2 MET B 89 2.854 -6.983 10.785 1.00 0.00 H ATOM 3090 HG3 MET B 89 2.209 -5.707 9.726 1.00 0.00 H ATOM 3091 HE1 MET B 89 3.439 -3.101 10.059 1.00 0.00 H ATOM 3092 HE2 MET B 89 1.718 -3.365 10.430 1.00 0.00 H ATOM 3093 HE3 MET B 89 2.737 -2.432 11.553 1.00 0.00 H ATOM 3094 H MET B 89 4.195 -8.538 9.595 1.00 0.00 H ATOM 3095 N ARG B 90 6.670 -7.028 7.913 1.00 18.68 N ATOM 3096 CA ARG B 90 7.923 -6.770 7.207 1.00 20.00 C ATOM 3097 C ARG B 90 7.803 -7.157 5.727 1.00 16.60 C ATOM 3098 O ARG B 90 8.167 -6.385 4.850 1.00 21.19 O ATOM 3099 CB ARG B 90 9.096 -7.521 7.859 1.00 11.51 C ATOM 3100 CG ARG B 90 10.455 -7.136 7.258 1.00 19.80 C ATOM 3101 CD ARG B 90 11.631 -7.875 7.925 1.00 23.41 C ATOM 3102 NE ARG B 90 11.784 -9.223 7.394 1.00 30.03 N ATOM 3103 CZ ARG B 90 12.055 -9.496 6.116 1.00 36.68 C ATOM 3104 NH1 ARG B 90 12.202 -8.503 5.235 1.00 38.99 N ATOM 3105 NH2 ARG B 90 12.176 -10.760 5.715 1.00 39.04 N ATOM 3106 HA ARG B 90 8.125 -5.701 7.274 1.00 0.00 H ATOM 3107 HB2 ARG B 90 9.108 -7.291 8.924 1.00 0.00 H ATOM 3108 HB3 ARG B 90 8.944 -8.592 7.721 1.00 0.00 H ATOM 3109 HG2 ARG B 90 10.448 -7.379 6.195 1.00 0.00 H ATOM 3110 HG3 ARG B 90 10.601 -6.063 7.383 1.00 0.00 H ATOM 3111 HD2 ARG B 90 11.449 -7.935 8.998 1.00 0.00 H ATOM 3112 HD3 ARG B 90 12.549 -7.316 7.744 1.00 0.00 H ATOM 3113 HE ARG B 90 11.675 -10.022 8.051 1.00 0.00 H ATOM 3114 HH12 ARG B 90 12.413 -8.718 4.240 1.00 0.00 H ATOM 3115 HH11 ARG B 90 12.105 -7.515 5.544 1.00 0.00 H ATOM 3116 HH22 ARG B 90 12.387 -10.972 4.719 1.00 0.00 H ATOM 3117 HH21 ARG B 90 12.059 -11.536 6.398 1.00 0.00 H ATOM 3118 H ARG B 90 6.656 -7.690 8.715 1.00 0.00 H ATOM 3119 N LEU B 91 7.279 -8.353 5.467 1.00 12.66 N ATOM 3120 CA LEU B 91 7.147 -8.852 4.108 1.00 16.40 C ATOM 3121 C LEU B 91 6.148 -8.032 3.304 1.00 20.24 C ATOM 3122 O LEU B 91 6.391 -7.734 2.134 1.00 17.84 O ATOM 3123 CB LEU B 91 6.733 -10.328 4.108 1.00 18.38 C ATOM 3124 CG LEU B 91 7.791 -11.311 4.589 1.00 23.65 C ATOM 3125 CD1 LEU B 91 7.161 -12.661 4.896 1.00 26.50 C ATOM 3126 CD2 LEU B 91 8.907 -11.452 3.546 1.00 26.78 C ATOM 3127 HA LEU B 91 8.123 -8.758 3.633 1.00 0.00 H ATOM 3128 HB2 LEU B 91 5.861 -10.431 4.754 1.00 0.00 H ATOM 3129 HB3 LEU B 91 6.462 -10.600 3.088 1.00 0.00 H ATOM 3130 HG LEU B 91 8.233 -10.925 5.508 1.00 0.00 H ATOM 3131 HD21 LEU B 91 8.484 -11.816 2.610 1.00 0.00 H ATOM 3132 HD22 LEU B 91 9.374 -10.481 3.382 1.00 0.00 H ATOM 3133 HD23 LEU B 91 9.654 -12.159 3.908 1.00 0.00 H ATOM 3134 HD11 LEU B 91 6.408 -12.540 5.675 1.00 0.00 H ATOM 3135 HD12 LEU B 91 6.693 -13.056 3.994 1.00 0.00 H ATOM 3136 HD13 LEU B 91 7.932 -13.351 5.238 1.00 0.00 H ATOM 3137 H LEU B 91 6.955 -8.946 6.257 1.00 0.00 H ATOM 3138 N ALA B 92 5.011 -7.688 3.922 1.00 15.19 N ATOM 3139 CA ALA B 92 4.028 -6.812 3.277 1.00 18.93 C ATOM 3140 C ALA B 92 4.660 -5.463 2.942 1.00 20.24 C ATOM 3141 O ALA B 92 4.484 -4.938 1.852 1.00 22.31 O ATOM 3142 CB ALA B 92 2.790 -6.618 4.175 1.00 15.98 C ATOM 3143 HA ALA B 92 3.704 -7.287 2.351 1.00 0.00 H ATOM 3144 HB1 ALA B 92 2.326 -7.586 4.366 1.00 0.00 H ATOM 3145 HB2 ALA B 92 3.095 -6.167 5.120 1.00 0.00 H ATOM 3146 HB3 ALA B 92 2.077 -5.964 3.673 1.00 0.00 H ATOM 3147 H ALA B 92 4.821 -8.049 4.879 1.00 0.00 H ATOM 3148 N PHE B 93 5.385 -4.901 3.892 1.00 16.66 N ATOM 3149 CA PHE B 93 6.021 -3.601 3.688 1.00 19.35 C ATOM 3150 C PHE B 93 7.074 -3.669 2.583 1.00 18.78 C ATOM 3151 O PHE B 93 7.165 -2.784 1.735 1.00 15.89 O ATOM 3152 CB PHE B 93 6.685 -3.138 4.972 1.00 19.53 C ATOM 3153 CG PHE B 93 7.431 -1.857 4.829 1.00 22.36 C ATOM 3154 CD1 PHE B 93 6.749 -0.647 4.791 1.00 21.34 C ATOM 3155 CD2 PHE B 93 8.823 -1.852 4.720 1.00 19.01 C ATOM 3156 CE1 PHE B 93 7.442 0.554 4.650 1.00 25.72 C ATOM 3157 CE2 PHE B 93 9.525 -0.654 4.575 1.00 20.50 C ATOM 3158 CZ PHE B 93 8.841 0.546 4.543 1.00 21.64 C ATOM 3159 HA PHE B 93 5.245 -2.895 3.394 1.00 0.00 H ATOM 3160 HB2 PHE B 93 5.914 -3.005 5.731 1.00 0.00 H ATOM 3161 HB3 PHE B 93 7.383 -3.909 5.297 1.00 0.00 H ATOM 3162 HD2 PHE B 93 9.368 -2.795 4.748 1.00 0.00 H ATOM 3163 HE2 PHE B 93 10.611 -0.665 4.487 1.00 0.00 H ATOM 3164 HZ PHE B 93 9.386 1.484 4.435 1.00 0.00 H ATOM 3165 HE1 PHE B 93 6.898 1.498 4.623 1.00 0.00 H ATOM 3166 HD1 PHE B 93 5.662 -0.637 4.872 1.00 0.00 H ATOM 3167 H PHE B 93 5.505 -5.392 4.801 1.00 0.00 H ATOM 3168 N GLU B 94 7.879 -4.720 2.626 1.00 19.16 N ATOM 3169 CA GLU B 94 8.944 -4.952 1.655 1.00 18.49 C ATOM 3170 C GLU B 94 8.356 -5.088 0.255 1.00 15.78 C ATOM 3171 O GLU B 94 8.854 -4.502 -0.694 1.00 14.15 O ATOM 3172 CB GLU B 94 9.672 -6.245 2.017 1.00 25.70 C ATOM 3173 CG GLU B 94 11.143 -6.228 1.771 1.00 46.49 C ATOM 3174 CD GLU B 94 11.873 -5.379 2.780 1.00 55.33 C ATOM 3175 OE1 GLU B 94 11.237 -4.973 3.786 1.00 54.98 O ATOM 3176 OE2 GLU B 94 13.081 -5.109 2.567 1.00 61.66 O ATOM 3177 HA GLU B 94 9.636 -4.110 1.672 1.00 0.00 H ATOM 3178 HB2 GLU B 94 9.508 -6.441 3.077 1.00 0.00 H ATOM 3179 HB3 GLU B 94 9.239 -7.054 1.428 1.00 0.00 H ATOM 3180 HG2 GLU B 94 11.522 -7.248 1.829 1.00 0.00 H ATOM 3181 HG3 GLU B 94 11.329 -5.829 0.774 1.00 0.00 H ATOM 3182 H GLU B 94 7.746 -5.414 3.389 1.00 0.00 H ATOM 3183 N SER B 95 7.301 -5.885 0.122 1.00 12.87 N ATOM 3184 CA SER B 95 6.767 -6.168 -1.209 1.00 16.70 C ATOM 3185 C SER B 95 6.054 -4.938 -1.801 1.00 15.47 C ATOM 3186 O SER B 95 6.224 -4.627 -2.967 1.00 19.49 O ATOM 3187 CB SER B 95 5.890 -7.437 -1.218 1.00 14.53 C ATOM 3188 OG SER B 95 4.793 -7.326 -0.337 1.00 15.88 O ATOM 3189 HA SER B 95 7.609 -6.382 -1.867 1.00 0.00 H ATOM 3190 HB2 SER B 95 6.499 -8.289 -0.916 1.00 0.00 H ATOM 3191 HB3 SER B 95 5.515 -7.599 -2.229 1.00 0.00 H ATOM 3192 HG SER B 95 5.125 -7.185 0.585 1.00 0.00 H ATOM 3193 H SER B 95 6.856 -6.306 0.963 1.00 0.00 H ATOM 3194 N TRP B 96 5.334 -4.192 -0.964 1.00 15.16 N ATOM 3195 CA TRP B 96 4.696 -2.952 -1.420 1.00 13.05 C ATOM 3196 C TRP B 96 5.683 -1.806 -1.727 1.00 13.10 C ATOM 3197 O TRP B 96 5.391 -0.943 -2.543 1.00 15.55 O ATOM 3198 CB TRP B 96 3.606 -2.489 -0.443 1.00 16.34 C ATOM 3199 CG TRP B 96 2.328 -3.270 -0.574 1.00 11.35 C ATOM 3200 CD1 TRP B 96 1.841 -4.169 0.305 1.00 14.98 C ATOM 3201 CD2 TRP B 96 1.375 -3.208 -1.667 1.00 12.09 C ATOM 3202 NE1 TRP B 96 0.639 -4.680 -0.152 1.00 12.55 N ATOM 3203 CE2 TRP B 96 0.336 -4.103 -1.361 1.00 13.54 C ATOM 3204 CE3 TRP B 96 1.298 -2.460 -2.855 1.00 10.08 C ATOM 3205 CZ2 TRP B 96 -0.779 -4.288 -2.204 1.00 11.11 C ATOM 3206 CZ3 TRP B 96 0.201 -2.650 -3.699 1.00 11.81 C ATOM 3207 CH2 TRP B 96 -0.819 -3.561 -3.370 1.00 13.27 C ATOM 3208 HA TRP B 96 4.232 -3.205 -2.373 1.00 0.00 H ATOM 3209 HB2 TRP B 96 3.980 -2.603 0.574 1.00 0.00 H ATOM 3210 HB3 TRP B 96 3.392 -1.438 -0.634 1.00 0.00 H ATOM 3211 HE1 TRP B 96 0.058 -5.388 0.341 1.00 0.00 H ATOM 3212 HD1 TRP B 96 2.324 -4.452 1.240 1.00 0.00 H ATOM 3213 HZ2 TRP B 96 -1.578 -4.981 -1.941 1.00 0.00 H ATOM 3214 HH2 TRP B 96 -1.658 -3.693 -4.053 1.00 0.00 H ATOM 3215 HZ3 TRP B 96 0.134 -2.083 -4.628 1.00 0.00 H ATOM 3216 HE3 TRP B 96 2.080 -1.745 -3.113 1.00 0.00 H ATOM 3217 H TRP B 96 5.223 -4.493 0.025 1.00 0.00 H ATOM 3218 N SER B 97 6.848 -1.805 -1.080 1.00 15.65 N ATOM 3219 CA SER B 97 7.908 -0.841 -1.440 1.00 16.27 C ATOM 3220 C SER B 97 8.495 -1.167 -2.820 1.00 14.10 C ATOM 3221 O SER B 97 8.812 -0.260 -3.608 1.00 14.64 O ATOM 3222 CB SER B 97 9.024 -0.828 -0.393 1.00 15.33 C ATOM 3223 OG SER B 97 8.530 -0.367 0.837 1.00 29.96 O ATOM 3224 HA SER B 97 7.452 0.149 -1.473 1.00 0.00 H ATOM 3225 HB2 SER B 97 9.825 -0.170 -0.729 1.00 0.00 H ATOM 3226 HB3 SER B 97 9.413 -1.838 -0.269 1.00 0.00 H ATOM 3227 HG SER B 97 7.804 -0.965 1.145 1.00 0.00 H ATOM 3228 H SER B 97 7.013 -2.489 -0.314 1.00 0.00 H ATOM 3229 N ARG B 98 8.654 -2.457 -3.101 1.00 8.44 N ATOM 3230 CA ARG B 98 9.094 -2.891 -4.421 1.00 13.55 C ATOM 3231 C ARG B 98 8.066 -2.513 -5.497 1.00 14.63 C ATOM 3232 O ARG B 98 8.424 -2.056 -6.590 1.00 15.77 O ATOM 3233 CB ARG B 98 9.345 -4.391 -4.446 1.00 12.26 C ATOM 3234 CG ARG B 98 9.907 -4.888 -5.800 1.00 13.79 C ATOM 3235 CD ARG B 98 11.420 -4.479 -6.016 1.00 16.97 C ATOM 3236 NE ARG B 98 11.886 -4.928 -7.325 1.00 22.99 N ATOM 3237 CZ ARG B 98 12.353 -4.130 -8.285 1.00 22.94 C ATOM 3238 NH1 ARG B 98 12.491 -2.829 -8.068 1.00 22.57 N ATOM 3239 NH2 ARG B 98 12.722 -4.645 -9.453 1.00 15.60 N ATOM 3240 HA ARG B 98 10.030 -2.378 -4.640 1.00 0.00 H ATOM 3241 HB2 ARG B 98 10.061 -4.637 -3.661 1.00 0.00 H ATOM 3242 HB3 ARG B 98 8.403 -4.904 -4.251 1.00 0.00 H ATOM 3243 HG2 ARG B 98 9.830 -5.975 -5.833 1.00 0.00 H ATOM 3244 HG3 ARG B 98 9.310 -4.459 -6.605 1.00 0.00 H ATOM 3245 HD2 ARG B 98 12.031 -4.939 -5.239 1.00 0.00 H ATOM 3246 HD3 ARG B 98 11.512 -3.395 -5.954 1.00 0.00 H ATOM 3247 HE ARG B 98 11.851 -5.948 -7.523 1.00 0.00 H ATOM 3248 HH12 ARG B 98 12.856 -2.212 -8.821 1.00 0.00 H ATOM 3249 HH11 ARG B 98 12.234 -2.426 -7.144 1.00 0.00 H ATOM 3250 HH22 ARG B 98 13.087 -4.024 -10.203 1.00 0.00 H ATOM 3251 HH21 ARG B 98 12.646 -5.669 -9.617 1.00 0.00 H ATOM 3252 H ARG B 98 8.461 -3.168 -2.367 1.00 0.00 H ATOM 3253 N VAL B 99 6.792 -2.717 -5.195 1.00 15.91 N ATOM 3254 CA VAL B 99 5.737 -2.249 -6.089 1.00 15.84 C ATOM 3255 C VAL B 99 5.914 -0.748 -6.358 1.00 13.53 C ATOM 3256 O VAL B 99 5.864 -0.309 -7.503 1.00 10.05 O ATOM 3257 CB VAL B 99 4.337 -2.551 -5.523 1.00 12.35 C ATOM 3258 CG1 VAL B 99 3.261 -1.772 -6.282 1.00 11.57 C ATOM 3259 CG2 VAL B 99 4.070 -4.021 -5.605 1.00 15.92 C ATOM 3260 HA VAL B 99 5.820 -2.789 -7.032 1.00 0.00 H ATOM 3261 HB VAL B 99 4.306 -2.236 -4.480 1.00 0.00 H ATOM 3262 HG11 VAL B 99 3.454 -0.703 -6.189 1.00 0.00 H ATOM 3263 HG12 VAL B 99 3.283 -2.056 -7.334 1.00 0.00 H ATOM 3264 HG13 VAL B 99 2.282 -2.004 -5.862 1.00 0.00 H ATOM 3265 HG21 VAL B 99 4.117 -4.340 -6.646 1.00 0.00 H ATOM 3266 HG22 VAL B 99 4.820 -4.558 -5.025 1.00 0.00 H ATOM 3267 HG23 VAL B 99 3.079 -4.232 -5.204 1.00 0.00 H ATOM 3268 H VAL B 99 6.542 -3.213 -4.316 1.00 0.00 H ATOM 3269 N ASP B 100 6.146 0.028 -5.295 1.00 11.94 N ATOM 3270 CA ASP B 100 6.413 1.464 -5.429 1.00 14.87 C ATOM 3271 C ASP B 100 7.612 1.744 -6.335 1.00 13.63 C ATOM 3272 O ASP B 100 7.606 2.701 -7.116 1.00 8.12 O ATOM 3273 CB ASP B 100 6.698 2.086 -4.052 1.00 21.61 C ATOM 3274 CG ASP B 100 5.457 2.264 -3.229 1.00 30.83 C ATOM 3275 OD1 ASP B 100 4.375 2.456 -3.823 1.00 36.99 O ATOM 3276 OD2 ASP B 100 5.558 2.219 -1.981 1.00 33.83 O ATOM 3277 HA ASP B 100 5.522 1.907 -5.875 1.00 0.00 H ATOM 3278 HB2 ASP B 100 7.385 1.436 -3.511 1.00 0.00 H ATOM 3279 HB3 ASP B 100 7.162 3.061 -4.199 1.00 0.00 H ATOM 3280 H ASP B 100 6.137 -0.398 -4.346 1.00 0.00 H ATOM 3281 N LYS B 101 8.667 0.950 -6.175 1.00 14.07 N ATOM 3282 CA LYS B 101 9.880 1.144 -6.959 1.00 17.78 C ATOM 3283 C LYS B 101 9.597 0.851 -8.423 1.00 16.54 C ATOM 3284 O LYS B 101 10.075 1.558 -9.316 1.00 8.86 O ATOM 3285 CB LYS B 101 11.000 0.244 -6.438 1.00 20.95 C ATOM 3286 CG LYS B 101 11.346 0.500 -4.984 1.00 34.86 C ATOM 3287 CD LYS B 101 12.223 -0.613 -4.397 1.00 42.45 C ATOM 3288 CE LYS B 101 12.463 -0.400 -2.897 1.00 37.73 C ATOM 3289 NZ LYS B 101 12.534 -1.704 -2.196 1.00 37.27 N ATOM 3290 HA LYS B 101 10.204 2.180 -6.863 1.00 0.00 H ATOM 3291 HB2 LYS B 101 10.686 -0.795 -6.542 1.00 0.00 H ATOM 3292 HB3 LYS B 101 11.891 0.415 -7.042 1.00 0.00 H ATOM 3293 HG2 LYS B 101 11.882 1.446 -4.911 1.00 0.00 H ATOM 3294 HG3 LYS B 101 10.423 0.562 -4.408 1.00 0.00 H ATOM 3295 HD2 LYS B 101 11.727 -1.572 -4.545 1.00 0.00 H ATOM 3296 HD3 LYS B 101 13.183 -0.619 -4.913 1.00 0.00 H ATOM 3297 HE2 LYS B 101 11.644 0.188 -2.482 1.00 0.00 H ATOM 3298 HE3 LYS B 101 13.401 0.136 -2.755 1.00 0.00 H ATOM 3299 HZ1 LYS B 101 11.638 -2.216 -2.327 1.00 0.00 H ATOM 3300 HZ2 LYS B 101 13.316 -2.265 -2.589 1.00 0.00 H ATOM 3301 HZ3 LYS B 101 12.697 -1.542 -1.182 1.00 0.00 H ATOM 3302 H LYS B 101 8.626 0.178 -5.479 1.00 0.00 H ATOM 3303 N ILE B 102 8.809 -0.190 -8.663 1.00 13.35 N ATOM 3304 CA ILE B 102 8.461 -0.592 -10.017 1.00 11.04 C ATOM 3305 C ILE B 102 7.595 0.469 -10.724 1.00 13.30 C ATOM 3306 O ILE B 102 7.831 0.802 -11.888 1.00 14.03 O ATOM 3307 CB ILE B 102 7.778 -1.976 -10.026 1.00 14.47 C ATOM 3308 CG1 ILE B 102 8.811 -3.071 -9.671 1.00 12.11 C ATOM 3309 CG2 ILE B 102 7.065 -2.239 -11.407 1.00 8.83 C ATOM 3310 CD1 ILE B 102 8.199 -4.492 -9.401 1.00 16.99 C ATOM 3311 HA ILE B 102 9.389 -0.674 -10.583 1.00 0.00 H ATOM 3312 HB ILE B 102 6.997 -2.002 -9.266 1.00 0.00 H ATOM 3313 HG12 ILE B 102 9.514 -3.156 -10.500 1.00 0.00 H ATOM 3314 HG13 ILE B 102 9.345 -2.756 -8.775 1.00 0.00 H ATOM 3315 HD11 ILE B 102 7.503 -4.433 -8.564 1.00 0.00 H ATOM 3316 HD12 ILE B 102 7.671 -4.834 -10.291 1.00 0.00 H ATOM 3317 HD13 ILE B 102 9.000 -5.191 -9.161 1.00 0.00 H ATOM 3318 HG21 ILE B 102 6.309 -1.472 -11.576 1.00 0.00 H ATOM 3319 HG22 ILE B 102 7.804 -2.206 -12.208 1.00 0.00 H ATOM 3320 HG23 ILE B 102 6.591 -3.220 -11.389 1.00 0.00 H ATOM 3321 H ILE B 102 8.430 -0.733 -7.861 1.00 0.00 H ATOM 3322 N ILE B 103 6.626 1.023 -10.006 1.00 15.79 N ATOM 3323 CA ILE B 103 5.830 2.163 -10.521 1.00 13.94 C ATOM 3324 C ILE B 103 6.739 3.364 -10.835 1.00 13.12 C ATOM 3325 O ILE B 103 6.705 3.924 -11.929 1.00 12.11 O ATOM 3326 CB ILE B 103 4.778 2.592 -9.499 1.00 11.79 C ATOM 3327 CG1 ILE B 103 3.701 1.522 -9.362 1.00 8.51 C ATOM 3328 CG2 ILE B 103 4.186 3.970 -9.849 1.00 10.35 C ATOM 3329 CD1 ILE B 103 2.801 1.738 -8.121 1.00 14.53 C ATOM 3330 HA ILE B 103 5.336 1.834 -11.435 1.00 0.00 H ATOM 3331 HB ILE B 103 5.263 2.698 -8.528 1.00 0.00 H ATOM 3332 HG12 ILE B 103 3.075 1.540 -10.254 1.00 0.00 H ATOM 3333 HG13 ILE B 103 4.184 0.549 -9.278 1.00 0.00 H ATOM 3334 HD11 ILE B 103 3.414 1.713 -7.220 1.00 0.00 H ATOM 3335 HD12 ILE B 103 2.305 2.705 -8.198 1.00 0.00 H ATOM 3336 HD13 ILE B 103 2.053 0.947 -8.074 1.00 0.00 H ATOM 3337 HG21 ILE B 103 4.983 4.714 -9.860 1.00 0.00 H ATOM 3338 HG22 ILE B 103 3.717 3.923 -10.832 1.00 0.00 H ATOM 3339 HG23 ILE B 103 3.441 4.245 -9.102 1.00 0.00 H ATOM 3340 H ILE B 103 6.420 0.648 -9.058 1.00 0.00 H ATOM 3341 N GLU B 104 7.547 3.749 -9.862 1.00 11.10 N ATOM 3342 CA GLU B 104 8.538 4.813 -10.065 1.00 11.28 C ATOM 3343 C GLU B 104 9.260 4.608 -11.400 1.00 12.12 C ATOM 3344 O GLU B 104 9.324 5.511 -12.224 1.00 10.45 O ATOM 3345 CB GLU B 104 9.523 4.812 -8.901 1.00 18.04 C ATOM 3346 CG GLU B 104 10.673 5.803 -8.993 1.00 26.95 C ATOM 3347 CD GLU B 104 11.531 5.789 -7.721 1.00 27.70 C ATOM 3348 OE1 GLU B 104 10.979 5.497 -6.630 1.00 24.07 O ATOM 3349 OE2 GLU B 104 12.741 6.055 -7.816 1.00 31.17 O ATOM 3350 HA GLU B 104 8.039 5.782 -10.099 1.00 0.00 H ATOM 3351 HB2 GLU B 104 8.964 5.034 -7.992 1.00 0.00 H ATOM 3352 HB3 GLU B 104 9.951 3.812 -8.828 1.00 0.00 H ATOM 3353 HG2 GLU B 104 11.299 5.541 -9.846 1.00 0.00 H ATOM 3354 HG3 GLU B 104 10.267 6.805 -9.136 1.00 0.00 H ATOM 3355 H GLU B 104 7.479 3.288 -8.932 1.00 0.00 H ATOM 3356 N ASN B 105 9.765 3.396 -11.619 1.00 14.23 N ATOM 3357 CA ASN B 105 10.440 3.052 -12.873 1.00 15.56 C ATOM 3358 C ASN B 105 9.557 3.247 -14.088 1.00 16.87 C ATOM 3359 O ASN B 105 10.010 3.713 -15.127 1.00 15.64 O ATOM 3360 CB ASN B 105 10.931 1.614 -12.828 1.00 13.97 C ATOM 3361 CG ASN B 105 12.126 1.449 -11.946 1.00 17.12 C ATOM 3362 OD1 ASN B 105 12.749 2.434 -11.534 1.00 16.52 O ATOM 3363 ND2 ASN B 105 12.465 0.207 -11.637 1.00 13.02 N ATOM 3364 HA ASN B 105 11.284 3.734 -12.971 1.00 0.00 H ATOM 3365 HB2 ASN B 105 10.127 0.981 -12.452 1.00 0.00 H ATOM 3366 HB3 ASN B 105 11.195 1.302 -13.838 1.00 0.00 H ATOM 3367 HD22 ASN B 105 11.910 -0.591 -12.008 1.00 0.00 H ATOM 3368 HD21 ASN B 105 13.286 0.029 -11.024 1.00 0.00 H ATOM 3369 H ASN B 105 9.678 2.672 -10.878 1.00 0.00 H ATOM 3370 N LEU B 106 8.301 2.850 -13.960 1.00 15.76 N ATOM 3371 CA LEU B 106 7.321 3.069 -15.001 1.00 18.34 C ATOM 3372 C LEU B 106 7.203 4.555 -15.306 1.00 21.89 C ATOM 3373 O LEU B 106 7.040 4.950 -16.462 1.00 23.00 O ATOM 3374 CB LEU B 106 5.945 2.511 -14.567 1.00 15.88 C ATOM 3375 CG LEU B 106 5.799 0.991 -14.593 1.00 15.84 C ATOM 3376 CD1 LEU B 106 4.363 0.566 -14.139 1.00 16.87 C ATOM 3377 CD2 LEU B 106 6.118 0.472 -15.997 1.00 13.78 C ATOM 3378 HA LEU B 106 7.647 2.547 -15.901 1.00 0.00 H ATOM 3379 HB2 LEU B 106 5.755 2.847 -13.548 1.00 0.00 H ATOM 3380 HB3 LEU B 106 5.190 2.930 -15.233 1.00 0.00 H ATOM 3381 HG LEU B 106 6.505 0.548 -13.891 1.00 0.00 H ATOM 3382 HD21 LEU B 106 5.427 0.916 -16.713 1.00 0.00 H ATOM 3383 HD22 LEU B 106 7.140 0.744 -16.260 1.00 0.00 H ATOM 3384 HD23 LEU B 106 6.013 -0.613 -16.014 1.00 0.00 H ATOM 3385 HD11 LEU B 106 4.184 0.921 -13.124 1.00 0.00 H ATOM 3386 HD12 LEU B 106 3.626 1.003 -14.813 1.00 0.00 H ATOM 3387 HD13 LEU B 106 4.282 -0.521 -14.165 1.00 0.00 H ATOM 3388 H LEU B 106 8.010 2.367 -13.086 1.00 0.00 H ATOM 3389 N GLU B 107 7.285 5.377 -14.258 1.00 26.04 N ATOM 3390 CA GLU B 107 7.143 6.837 -14.395 1.00 29.68 C ATOM 3391 C GLU B 107 8.456 7.550 -14.786 1.00 31.61 C ATOM 3392 O GLU B 107 8.526 8.773 -14.777 1.00 36.44 O ATOM 3393 CB GLU B 107 6.576 7.443 -13.106 1.00 27.85 C ATOM 3394 CG GLU B 107 5.189 6.932 -12.752 1.00 32.72 C ATOM 3395 CD GLU B 107 4.729 7.369 -11.371 1.00 36.80 C ATOM 3396 OE1 GLU B 107 5.592 7.586 -10.493 1.00 41.74 O ATOM 3397 OE2 GLU B 107 3.500 7.478 -11.157 1.00 35.95 O ATOM 3398 HA GLU B 107 6.446 6.999 -15.217 1.00 0.00 H ATOM 3399 HB2 GLU B 107 7.252 7.202 -12.285 1.00 0.00 H ATOM 3400 HB3 GLU B 107 6.524 8.525 -13.227 1.00 0.00 H ATOM 3401 HG2 GLU B 107 4.481 7.309 -13.490 1.00 0.00 H ATOM 3402 HG3 GLU B 107 5.201 5.843 -12.786 1.00 0.00 H ATOM 3403 H GLU B 107 7.455 4.974 -13.314 1.00 0.00 H ATOM 3404 N ALA B 108 9.484 6.781 -15.127 1.00 27.90 N ATOM 3405 CA ALA B 108 10.753 7.368 -15.550 1.00 32.70 C ATOM 3406 C ALA B 108 10.954 7.209 -17.059 1.00 34.95 C ATOM 3407 O ALA B 108 10.651 8.119 -17.837 1.00 42.06 O ATOM 3408 CB ALA B 108 11.926 6.752 -14.770 1.00 18.45 C ATOM 3409 HA ALA B 108 10.723 8.435 -15.328 1.00 0.00 H ATOM 3410 HB1 ALA B 108 11.790 6.938 -13.705 1.00 0.00 H ATOM 3411 HB2 ALA B 108 11.957 5.678 -14.952 1.00 0.00 H ATOM 3412 HB3 ALA B 108 12.860 7.205 -15.103 1.00 0.00 H ATOM 3413 H ALA B 108 9.384 5.746 -15.092 1.00 0.00 H TER 3414 ALA B 108 HETATM 3415 O HOH 1 -10.404 2.432 -4.881 1.00 28.52 O HETATM 3416 O HOH 2 -3.161 -6.516 -27.010 1.00 13.43 O HETATM 3417 O HOH 3 -4.973 3.930 -20.235 1.00 8.23 O HETATM 3418 O HOH 4 -15.489 4.839 -16.575 1.00 12.88 O HETATM 3419 O HOH 5 6.063 -8.947 -17.624 1.00 13.81 O HETATM 3420 O HOH 6 -14.899 -1.864 -18.762 1.00 23.91 O HETATM 3421 O HOH 7 -12.314 -0.539 -31.318 1.00 2.47 O HETATM 3422 O HOH 8 -8.279 6.068 -24.939 1.00 17.81 O HETATM 3423 O HOH 9 -13.270 0.570 -25.069 1.00 11.59 O HETATM 3424 O HOH 10 1.639 2.305 -21.057 1.00 10.44 O HETATM 3425 O HOH 11 -14.858 -8.766 -19.324 1.00 19.18 O HETATM 3426 O HOH 12 -14.085 5.543 -19.622 1.00 15.39 O HETATM 3427 O HOH 13 -1.444 -17.226 -24.782 1.00 18.82 O HETATM 3428 O HOH 14 0.002 5.407 -1.725 1.00 28.59 O HETATM 3429 O HOH 15 -4.480 6.939 -19.281 1.00 42.72 O HETATM 3430 O HOH 16 -3.436 -5.855 -0.625 1.00 3.14 O HETATM 3431 O HOH 17 -4.598 -3.703 -1.907 1.00 2.00 O HETATM 3432 O HOH 18 6.461 -8.632 -24.423 1.00 30.70 O HETATM 3433 O HOH 19 -19.218 -5.119 -17.231 1.00 23.07 O HETATM 3434 O HOH 20 -10.046 -0.298 -5.725 1.00 38.10 O HETATM 3435 O HOH 21 -6.679 -4.128 -3.963 1.00 27.56 O HETATM 3436 O HOH 22 -11.563 9.772 -13.052 1.00 15.32 O HETATM 3437 O HOH 23 -16.291 1.794 -16.315 1.00 14.77 O HETATM 3438 O HOH 24 -4.613 -8.554 -27.168 1.00 23.36 O HETATM 3439 O HOH 25 -1.233 3.223 -7.624 1.00 30.74 O HETATM 3440 O HOH 26 0.371 -17.154 -22.670 1.00 19.19 O HETATM 3441 O HOH 27 2.432 -10.404 4.881 1.00 28.52 O HETATM 3442 O HOH 28 -6.516 -3.161 27.010 1.00 13.43 O HETATM 3443 O HOH 29 3.930 -4.973 20.235 1.00 8.23 O HETATM 3444 O HOH 30 4.839 -15.489 16.575 1.00 12.88 O HETATM 3445 O HOH 31 -8.947 6.063 17.624 1.00 13.81 O HETATM 3446 O HOH 32 -1.864 -14.899 18.762 1.00 23.91 O HETATM 3447 O HOH 33 -0.539 -12.314 31.318 1.00 2.47 O HETATM 3448 O HOH 34 6.068 -8.279 24.939 1.00 17.81 O HETATM 3449 O HOH 35 0.570 -13.270 25.069 1.00 11.59 O HETATM 3450 O HOH 36 2.305 1.639 21.057 1.00 10.44 O HETATM 3451 O HOH 37 -8.766 -14.858 19.324 1.00 19.18 O HETATM 3452 O HOH 38 5.543 -14.085 19.622 1.00 15.39 O HETATM 3453 O HOH 39 -17.226 -1.444 24.782 1.00 18.82 O HETATM 3454 O HOH 40 5.407 0.002 1.725 1.00 28.59 O HETATM 3455 O HOH 41 6.939 -4.480 19.281 1.00 42.72 O HETATM 3456 O HOH 42 -8.632 6.461 24.423 1.00 30.70 O HETATM 3457 O HOH 43 -5.119 -19.218 17.231 1.00 23.07 O HETATM 3458 O HOH 44 -0.298 -10.046 5.725 1.00 38.10 O HETATM 3459 O HOH 45 -4.128 -6.679 3.963 1.00 27.56 O HETATM 3460 O HOH 46 9.772 -11.563 13.052 1.00 15.32 O HETATM 3461 O HOH 47 1.794 -16.291 16.315 1.00 14.77 O HETATM 3462 O HOH 48 -8.554 -4.613 27.168 1.00 23.36 O HETATM 3463 O HOH 49 3.223 -1.233 7.624 1.00 30.74 O HETATM 3464 O HOH 50 -17.154 0.371 22.670 1.00 19.19 O HETATM 3465 C1 HT A 1 0.484 -5.548 6.557 1.00 0.10 C HETATM 3466 O1 HT A 1 0.722 -6.342 7.643 1.00 -0.31 O HETATM 3467 C26 HT A 1 0.012 -7.584 7.528 1.00 0.07 C HETATM 3468 C27 HT A 1 -0.173 -8.191 8.925 1.00 -0.04 C HETATM 3469 H27 HT A 1 -0.717 -9.143 8.842 1.00 0.03 H HETATM 3470 H28 HT A 1 -0.747 -7.495 9.554 1.00 0.03 H HETATM 3471 H29 HT A 1 0.812 -8.370 9.380 1.00 0.03 H HETATM 3472 H25 HT A 1 0.586 -8.279 6.898 1.00 0.06 H HETATM 3473 H26 HT A 1 -0.973 -7.404 7.072 1.00 0.06 H HETATM 3474 C2 HT A 1 -0.465 -5.934 5.617 1.00 -0.03 C HETATM 3475 C3 HT A 1 -0.722 -5.137 4.503 1.00 -0.05 C HETATM 3476 C4 HT A 1 -0.026 -3.947 4.327 1.00 0.02 C HETATM 3477 C5 HT A 1 0.930 -3.547 5.276 1.00 -0.05 C HETATM 3478 C6 HT A 1 1.183 -4.350 6.393 1.00 -0.03 C HETATM 3479 H4 HT A 1 1.918 -4.044 7.128 1.00 0.06 H HETATM 3480 H3 HT A 1 1.471 -2.617 5.143 1.00 0.06 H HETATM 3481 C7 HT A 1 -0.302 -3.156 3.208 1.00 0.13 C HETATM 3482 N1 HT A 1 -1.275 -3.398 2.306 1.00 -0.31 N HETATM 3483 C8 HT A 1 -1.243 -2.446 1.379 1.00 0.04 C HETATM 3484 C9 HT A 1 -0.201 -1.571 1.739 1.00 0.09 C HETATM 3485 N2 HT A 1 0.347 -2.034 2.862 1.00 -0.25 N HETATM 3486 H5 HT A 1 1.131 -1.606 3.374 1.00 0.23 H HETATM 3487 C10 HT A 1 0.083 -0.456 0.960 1.00 -0.03 C HETATM 3488 C11 HT A 1 -0.673 -0.216 -0.179 1.00 -0.06 C HETATM 3489 C12 HT A 1 -1.720 -1.075 -0.544 1.00 0.02 C HETATM 3490 C13 HT A 1 -2.016 -2.218 0.224 1.00 -0.04 C HETATM 3491 H8 HT A 1 -2.810 -2.898 -0.064 1.00 0.06 H HETATM 3492 C14 HT A 1 -2.434 -0.791 -1.712 1.00 0.13 C HETATM 3493 N3 HT A 1 -3.322 -1.599 -2.311 1.00 -0.26 N HETATM 3494 C15 HT A 1 -3.774 -0.984 -3.410 1.00 0.07 C HETATM 3495 C16 HT A 1 -3.117 0.245 -3.495 1.00 0.02 C HETATM 3496 N4 HT A 1 -2.301 0.331 -2.447 1.00 -0.32 N HETATM 3497 C17 HT A 1 -3.378 1.111 -4.557 1.00 -0.07 C HETATM 3498 C18 HT A 1 -4.308 0.750 -5.541 1.00 -0.06 C HETATM 3499 C19 HT A 1 -4.983 -0.471 -5.461 1.00 0.03 C HETATM 3500 C20 HT A 1 -4.705 -1.350 -4.394 1.00 -0.02 C HETATM 3501 H12 HT A 1 -5.210 -2.307 -4.334 1.00 0.04 H HETATM 3502 N5 HT A 1 -5.854 -0.828 -6.438 1.00 -0.30 N HETATM 3503 C21 HT A 1 -6.991 0.096 -6.614 1.00 0.07 C HETATM 3504 C22 HT A 1 -7.824 -0.352 -7.843 1.00 -0.01 C HETATM 3505 N6 HT A 1 -8.272 -1.761 -7.692 1.00 0.24 N HETATM 3506 C23 HT A 1 -7.116 -2.650 -7.469 1.00 -0.01 C HETATM 3507 C24 HT A 1 -6.359 -2.187 -6.214 1.00 0.07 C HETATM 3508 H20 HT A 1 -7.040 -2.190 -5.350 1.00 0.06 H HETATM 3509 H21 HT A 1 -5.516 -2.867 -6.019 1.00 0.06 H HETATM 3510 H18 HT A 1 -6.446 -2.608 -8.340 1.00 0.08 H HETATM 3511 H19 HT A 1 -7.468 -3.683 -7.327 1.00 0.08 H HETATM 3512 C25 HT A 1 -8.983 -2.217 -8.896 1.00 -0.04 C HETATM 3513 H22 HT A 1 -9.850 -1.565 -9.079 1.00 0.08 H HETATM 3514 H23 HT A 1 -9.327 -3.252 -8.749 1.00 0.08 H HETATM 3515 H24 HT A 1 -8.304 -2.175 -9.761 1.00 0.08 H HETATM 3516 H17 HT A 1 -8.893 -1.820 -6.900 1.00 0.20 H HETATM 3517 H15 HT A 1 -7.206 -0.265 -8.749 1.00 0.08 H HETATM 3518 H16 HT A 1 -8.706 0.299 -7.937 1.00 0.08 H HETATM 3519 H13 HT A 1 -6.614 1.117 -6.777 1.00 0.06 H HETATM 3520 H14 HT A 1 -7.623 0.077 -5.714 1.00 0.06 H HETATM 3521 H11 HT A 1 -4.505 1.422 -6.369 1.00 0.05 H HETATM 3522 H10 HT A 1 -2.862 2.062 -4.621 1.00 0.05 H HETATM 3523 H9 HT A 1 -3.607 -2.532 -1.981 1.00 0.23 H HETATM 3524 H7 HT A 1 -0.451 0.648 -0.795 1.00 0.06 H HETATM 3525 H6 HT A 1 0.885 0.218 1.238 1.00 0.06 H HETATM 3526 H2 HT A 1 -1.464 -5.445 3.775 1.00 0.06 H HETATM 3527 H1 HT A 1 -1.009 -6.862 5.752 1.00 0.06 H CONECT 1 2 15 16 17 CONECT 15 1 CONECT 16 1 CONECT 17 1 CONECT 1107 1108 1113 1114 1115 CONECT 1113 1107 CONECT 1114 1107 CONECT 1115 1107 CONECT 1708 1709 1722 1723 1724 CONECT 1722 1708 CONECT 1723 1708 CONECT 1724 1708 CONECT 2814 2815 2820 2821 2822 CONECT 2820 2814 CONECT 2821 2814 CONECT 2822 2814 CONECT 3465 3466 3474 3478 CONECT 3466 3465 3467 CONECT 3467 3466 3468 3472 3473 CONECT 3468 3467 3469 3470 3471 CONECT 3469 3468 CONECT 3470 3468 CONECT 3471 3468 CONECT 3472 3467 CONECT 3473 3467 CONECT 3474 3465 3475 3527 CONECT 3475 3474 3476 3526 CONECT 3476 3475 3477 3481 CONECT 3477 3476 3478 3480 CONECT 3478 3465 3477 3479 CONECT 3479 3478 CONECT 3480 3477 CONECT 3481 3476 3482 3485 CONECT 3482 3481 3483 CONECT 3483 3482 3484 3490 CONECT 3484 3483 3485 3487 CONECT 3485 3481 3484 3486 CONECT 3486 3485 CONECT 3487 3484 3488 3525 CONECT 3488 3487 3489 3524 CONECT 3489 3488 3490 3492 CONECT 3490 3483 3489 3491 CONECT 3491 3490 CONECT 3492 3489 3493 3496 CONECT 3493 3492 3494 3523 CONECT 3494 3493 3495 3500 CONECT 3495 3494 3496 3497 CONECT 3496 3492 3495 CONECT 3497 3495 3498 3522 CONECT 3498 3497 3499 3521 CONECT 3499 3498 3500 3502 CONECT 3500 3494 3499 3501 CONECT 3501 3500 CONECT 3502 3499 3503 3507 CONECT 3503 3502 3504 3519 3520 CONECT 3504 3503 3505 3517 3518 CONECT 3505 3504 3506 3512 3516 CONECT 3506 3505 3507 3510 3511 CONECT 3507 3502 3506 3508 3509 CONECT 3508 3507 CONECT 3509 3507 CONECT 3510 3506 CONECT 3511 3506 CONECT 3512 3505 3513 3514 3515 CONECT 3513 3512 CONECT 3514 3512 CONECT 3515 3512 CONECT 3516 3505 CONECT 3517 3504 CONECT 3518 3504 CONECT 3519 3503 CONECT 3520 3503 CONECT 3521 3498 CONECT 3522 3497 CONECT 3523 3493 CONECT 3524 3488 CONECT 3525 3487 CONECT 3526 3475 CONECT 3527 3474 MASTER 0 0 0 0 0 0 0 0 3523 4 79 18 END
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Related entries of code: 3f8c
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3f8f
RCSB PDB
PDBbind
126aa, >3F8F_1|Chains... at 100%
4zzd
RCSB PDB
PDBbind
116aa, >4ZZD_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
3f8c
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
LmrR
Ligand Name
HT1
EC.Number
E.C.-.-.-.-
Resolution
2.2(Å)
Affinity (Kd/Ki/IC50)
Kd=21nM
Release Year
2008
Protein/NA Sequence
Check fasta file
Primary Reference
(2008) Embo J.
Ligand Properties
Formula
C
2
7
H
2
9
N
6
O
Molecular Weight
453.559
Exact Mass
453.240
No. of atoms
63
No. of bonds
68
Polar Surface Area
74.27
LOGP Value
4.65 (
Computed with XLOGP3
)
5.14 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 6
Canonical SMILES
CCOc1ccc(cc1)c1[nH]c2c(n1)cc(cc2)c1nc2c([nH]1)cc(cc2)N1CC[NH+](CC1)C
InChI String
InChI=1S/C27H28N6O/c1-3-34-21-8-4-18(5-9-21)26-28-22-10-6-19(16-24(22)30-26)27-29-23-11-7-20(17-25(23)31-27)33-14-12-32(2)13-15-33/h4-11,16-17H,3,12-15H2,1-2H3,(H,28,30)(H,29,31)/p+1
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):
A2RI36
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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