Browse entries in the PDBbind-CN Database
HEADER 3SLZ_COMPLEX COMPND 3SLZ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 114 GLU PRO PRO PRO GLU PRO ARG ILE THR LEU LYS VAL GLY SEQRES 2 A 114 GLY GLN PRO VAL THR PHE LEU VAL ASP THR GLY ALA GLN SEQRES 3 A 114 HIS SER VAL LEU THR GLN ASN PRO GLY PRO LEU SER ASP SEQRES 4 A 114 LYS SER ALA TRP VAL GLN GLY ALA THR GLY GLY LYS ARG SEQRES 5 A 114 TYR ARG TRP THR THR ASP ARG LYS VAL HIS LEU ALA THR SEQRES 6 A 114 GLY LYS VAL THR HIS SER PHE LEU HIS VAL PRO ASP CYS SEQRES 7 A 114 PRO TYR PRO LEU LEU GLY ARG ASP LEU LEU THR LYS LEU SEQRES 8 A 114 LYS ALA GLN ILE HIS PHE GLU GLY SER GLY ALA GLN VAL SEQRES 9 A 114 VAL GLY PRO MET GLY GLN PRO LEU GLN VAL SEQRES 1 B 114 GLU PRO PRO PRO GLU PRO ARG ILE THR LEU LYS VAL GLY SEQRES 2 B 114 GLY GLN PRO VAL THR PHE LEU VAL ASP THR GLY ALA GLN SEQRES 3 B 114 HIS SER VAL LEU THR GLN ASN PRO GLY PRO LEU SER ASP SEQRES 4 B 114 LYS SER ALA TRP VAL GLN GLY ALA THR GLY GLY LYS ARG SEQRES 5 B 114 TYR ARG TRP THR THR ASP ARG LYS VAL HIS LEU ALA THR SEQRES 6 B 114 GLY LYS VAL THR HIS SER PHE LEU HIS VAL PRO ASP CYS SEQRES 7 B 114 PRO TYR PRO LEU LEU GLY ARG ASP LEU LEU THR LYS LEU SEQRES 8 B 114 LYS ALA GLN ILE HIS PHE GLU GLY SER GLY ALA GLN VAL SEQRES 9 B 114 VAL GLY PRO MET GLY GLN PRO LEU GLN VAL HET UNN A 436 130 ATOM 1 N GLU A 11 -18.625 -0.745 5.692 1.00 54.61 N ATOM 2 CA GLU A 11 -18.678 -1.778 6.777 1.00 53.57 C ATOM 3 C GLU A 11 -17.835 -3.041 6.511 1.00 47.98 C ATOM 4 O GLU A 11 -16.970 -3.359 7.332 1.00 45.51 O ATOM 5 CB GLU A 11 -20.121 -2.155 7.133 1.00 59.47 C ATOM 6 CG GLU A 11 -20.709 -1.354 8.283 1.00 67.12 C ATOM 7 CD GLU A 11 -21.787 -2.124 9.031 1.00 72.08 C ATOM 8 OE1 GLU A 11 -21.649 -3.365 9.180 1.00 74.32 O ATOM 9 OE2 GLU A 11 -22.772 -1.488 9.475 1.00 74.25 O ATOM 10 HA GLU A 11 -18.214 -1.292 7.635 1.00 0.00 H ATOM 11 HB2 GLU A 11 -20.743 -1.996 6.252 1.00 0.00 H ATOM 12 HB3 GLU A 11 -20.142 -3.210 7.405 1.00 0.00 H ATOM 13 HG2 GLU A 11 -19.910 -1.102 8.980 1.00 0.00 H ATOM 14 HG3 GLU A 11 -21.144 -0.437 7.885 1.00 0.00 H ATOM 15 HN3 GLU A 11 -18.976 -1.158 4.804 1.00 0.00 H ATOM 16 HN2 GLU A 11 -17.643 -0.428 5.564 1.00 0.00 H ATOM 17 HN1 GLU A 11 -19.220 0.066 5.957 1.00 0.00 H ATOM 18 N PRO A 12 -18.089 -3.776 5.393 1.00 42.57 N ATOM 19 CA PRO A 12 -17.221 -4.935 5.114 1.00 35.40 C ATOM 20 C PRO A 12 -15.848 -4.445 4.659 1.00 31.52 C ATOM 21 O PRO A 12 -15.759 -3.519 3.855 1.00 33.40 O ATOM 22 CB PRO A 12 -17.934 -5.660 3.957 1.00 39.75 C ATOM 23 CG PRO A 12 -19.264 -4.958 3.786 1.00 43.60 C ATOM 24 CD PRO A 12 -19.076 -3.575 4.312 1.00 44.60 C ATOM 25 HA PRO A 12 -17.067 -5.577 5.982 1.00 0.00 H ATOM 26 HD3 PRO A 12 -18.687 -2.910 3.541 1.00 0.00 H ATOM 27 HD2 PRO A 12 -20.010 -3.171 4.701 1.00 0.00 H ATOM 28 HG3 PRO A 12 -20.040 -5.475 4.351 1.00 0.00 H ATOM 29 HG2 PRO A 12 -19.543 -4.927 2.733 1.00 0.00 H ATOM 30 HB2 PRO A 12 -17.345 -5.586 3.043 1.00 0.00 H ATOM 31 HB3 PRO A 12 -18.088 -6.710 4.205 1.00 0.00 H ATOM 32 N PRO A 13 -14.768 -5.026 5.196 1.00 20.69 N ATOM 33 CA PRO A 13 -13.460 -4.447 4.836 1.00 18.13 C ATOM 34 C PRO A 13 -13.027 -4.797 3.409 1.00 18.84 C ATOM 35 O PRO A 13 -13.466 -5.798 2.833 1.00 18.23 O ATOM 36 CB PRO A 13 -12.511 -5.099 5.854 1.00 19.11 C ATOM 37 CG PRO A 13 -13.194 -6.410 6.188 1.00 21.44 C ATOM 38 CD PRO A 13 -14.652 -6.115 6.180 1.00 21.75 C ATOM 39 HA PRO A 13 -13.474 -3.357 4.862 1.00 0.00 H ATOM 40 HD3 PRO A 13 -15.226 -6.987 5.868 1.00 0.00 H ATOM 41 HD2 PRO A 13 -14.991 -5.791 7.164 1.00 0.00 H ATOM 42 HG3 PRO A 13 -12.882 -6.762 7.171 1.00 0.00 H ATOM 43 HG2 PRO A 13 -12.954 -7.166 5.440 1.00 0.00 H ATOM 44 HB2 PRO A 13 -11.528 -5.272 5.415 1.00 0.00 H ATOM 45 HB3 PRO A 13 -12.406 -4.477 6.743 1.00 0.00 H ATOM 46 N PRO A 14 -12.175 -3.976 2.799 1.00 16.79 N ATOM 47 CA PRO A 14 -11.544 -4.366 1.545 1.00 15.34 C ATOM 48 C PRO A 14 -10.528 -5.514 1.681 1.00 14.07 C ATOM 49 O PRO A 14 -10.154 -5.849 2.812 1.00 15.43 O ATOM 50 CB PRO A 14 -10.793 -3.094 1.120 1.00 21.14 C ATOM 51 CG PRO A 14 -10.551 -2.386 2.334 1.00 20.01 C ATOM 52 CD PRO A 14 -11.613 -2.722 3.338 1.00 17.57 C ATOM 53 HA PRO A 14 -12.292 -4.731 0.842 1.00 0.00 H ATOM 54 HD3 PRO A 14 -11.185 -2.875 4.329 1.00 0.00 H ATOM 55 HD2 PRO A 14 -12.370 -1.940 3.388 1.00 0.00 H ATOM 56 HG3 PRO A 14 -10.565 -1.314 2.137 1.00 0.00 H ATOM 57 HG2 PRO A 14 -9.576 -2.669 2.730 1.00 0.00 H ATOM 58 HB2 PRO A 14 -9.853 -3.349 0.631 1.00 0.00 H ATOM 59 HB3 PRO A 14 -11.403 -2.497 0.443 1.00 0.00 H ATOM 60 N GLU A 15 -10.098 -6.120 0.572 1.00 13.58 N ATOM 61 CA GLU A 15 -8.969 -7.035 0.569 1.00 15.17 C ATOM 62 C GLU A 15 -7.696 -6.234 0.881 1.00 14.46 C ATOM 63 O GLU A 15 -7.575 -5.072 0.500 1.00 15.42 O ATOM 64 CB GLU A 15 -8.822 -7.731 -0.790 1.00 15.26 C ATOM 65 CG GLU A 15 -10.081 -8.543 -1.174 1.00 18.90 C ATOM 66 CD GLU A 15 -9.889 -9.349 -2.447 1.00 28.05 C ATOM 67 OE1 GLU A 15 -8.957 -9.072 -3.212 1.00 26.37 O ATOM 68 OE2 GLU A 15 -10.681 -10.287 -2.677 1.00 35.73 O ATOM 69 HA GLU A 15 -9.132 -7.806 1.322 1.00 0.00 H ATOM 70 HB2 GLU A 15 -8.646 -6.974 -1.554 1.00 0.00 H ATOM 71 HB3 GLU A 15 -7.968 -8.407 -0.747 1.00 0.00 H ATOM 72 HG2 GLU A 15 -10.318 -9.227 -0.359 1.00 0.00 H ATOM 73 HG3 GLU A 15 -10.912 -7.852 -1.319 1.00 0.00 H ATOM 74 H GLU A 15 -10.590 -5.930 -0.324 1.00 0.00 H ATOM 75 N PRO A 16 -6.714 -6.846 1.529 1.00 12.65 N ATOM 76 CA PRO A 16 -6.771 -8.223 2.053 1.00 11.93 C ATOM 77 C PRO A 16 -7.583 -8.344 3.322 1.00 13.67 C ATOM 78 O PRO A 16 -7.448 -7.513 4.228 1.00 13.58 O ATOM 79 CB PRO A 16 -5.312 -8.549 2.313 1.00 12.40 C ATOM 80 CG PRO A 16 -4.659 -7.193 2.680 1.00 12.98 C ATOM 81 CD PRO A 16 -5.455 -6.162 1.854 1.00 13.97 C ATOM 82 HA PRO A 16 -7.263 -8.902 1.356 1.00 0.00 H ATOM 83 HD3 PRO A 16 -5.645 -5.262 2.439 1.00 0.00 H ATOM 84 HD2 PRO A 16 -4.915 -5.896 0.945 1.00 0.00 H ATOM 85 HG3 PRO A 16 -3.605 -7.182 2.403 1.00 0.00 H ATOM 86 HG2 PRO A 16 -4.755 -6.992 3.747 1.00 0.00 H ATOM 87 HB2 PRO A 16 -5.218 -9.256 3.137 1.00 0.00 H ATOM 88 HB3 PRO A 16 -4.848 -8.969 1.421 1.00 0.00 H ATOM 89 N ARG A 17 -8.435 -9.347 3.408 1.00 13.38 N ATOM 90 CA ARG A 17 -9.285 -9.541 4.558 1.00 12.70 C ATOM 91 C ARG A 17 -9.306 -11.017 4.926 1.00 14.94 C ATOM 92 O ARG A 17 -8.967 -11.869 4.099 1.00 16.96 O ATOM 93 CB ARG A 17 -10.694 -9.015 4.299 1.00 15.78 C ATOM 94 CG ARG A 17 -11.457 -9.742 3.186 1.00 19.31 C ATOM 95 CD ARG A 17 -12.835 -9.134 2.971 1.00 26.09 C ATOM 96 NE ARG A 17 -13.376 -9.639 1.716 1.00 31.15 N ATOM 97 CZ ARG A 17 -13.694 -8.899 0.660 1.00 32.16 C ATOM 98 NH1 ARG A 17 -13.571 -7.574 0.667 1.00 30.01 N ATOM 99 NH2 ARG A 17 -14.166 -9.500 -0.427 1.00 37.14 N ATOM 100 HA ARG A 17 -8.882 -8.973 5.396 1.00 0.00 H ATOM 101 HB2 ARG A 17 -11.267 -9.110 5.221 1.00 0.00 H ATOM 102 HB3 ARG A 17 -10.619 -7.962 4.027 1.00 0.00 H ATOM 103 HG2 ARG A 17 -10.888 -9.669 2.259 1.00 0.00 H ATOM 104 HG3 ARG A 17 -11.570 -10.791 3.460 1.00 0.00 H ATOM 105 HD2 ARG A 17 -12.754 -8.048 2.926 1.00 0.00 H ATOM 106 HD3 ARG A 17 -13.493 -9.414 3.794 1.00 0.00 H ATOM 107 HE ARG A 17 -13.526 -10.665 1.641 1.00 0.00 H ATOM 108 HH12 ARG A 17 -13.829 -7.023 -0.177 1.00 0.00 H ATOM 109 HH11 ARG A 17 -13.217 -7.089 1.516 1.00 0.00 H ATOM 110 HH22 ARG A 17 -14.420 -8.937 -1.264 1.00 0.00 H ATOM 111 HH21 ARG A 17 -14.281 -10.534 -0.441 1.00 0.00 H ATOM 112 H ARG A 17 -8.496 -10.022 2.619 1.00 0.00 H ATOM 113 N ILE A 18 -9.670 -11.292 6.171 1.00 12.58 N ATOM 114 CA ILE A 18 -9.757 -12.687 6.610 1.00 13.87 C ATOM 115 C ILE A 18 -10.805 -12.747 7.696 1.00 14.02 C ATOM 116 O ILE A 18 -10.967 -11.822 8.506 1.00 13.81 O ATOM 117 CB ILE A 18 -8.380 -13.197 7.062 1.00 15.97 C ATOM 118 CG1 ILE A 18 -8.430 -14.692 7.304 1.00 17.69 C ATOM 119 CG2 ILE A 18 -7.898 -12.495 8.343 1.00 15.72 C ATOM 120 CD1 ILE A 18 -7.044 -15.293 7.519 1.00 21.63 C ATOM 121 HA ILE A 18 -10.055 -13.349 5.797 1.00 0.00 H ATOM 122 HB ILE A 18 -7.675 -12.970 6.262 1.00 0.00 H ATOM 123 HG12 ILE A 18 -9.036 -14.884 8.189 1.00 0.00 H ATOM 124 HG13 ILE A 18 -8.890 -15.172 6.440 1.00 0.00 H ATOM 125 HD11 ILE A 18 -6.431 -15.115 6.636 1.00 0.00 H ATOM 126 HD12 ILE A 18 -6.578 -14.826 8.387 1.00 0.00 H ATOM 127 HD13 ILE A 18 -7.137 -16.366 7.688 1.00 0.00 H ATOM 128 HG21 ILE A 18 -7.822 -11.423 8.162 1.00 0.00 H ATOM 129 HG22 ILE A 18 -8.611 -12.679 9.147 1.00 0.00 H ATOM 130 HG23 ILE A 18 -6.921 -12.887 8.625 1.00 0.00 H ATOM 131 H ILE A 18 -9.893 -10.521 6.833 1.00 0.00 H ATOM 132 N THR A 19 -11.568 -13.853 7.727 1.00 14.10 N ATOM 133 CA THR A 19 -12.528 -14.097 8.812 1.00 14.73 C ATOM 134 C THR A 19 -11.966 -15.116 9.778 1.00 15.04 C ATOM 135 O THR A 19 -11.498 -16.163 9.356 1.00 16.15 O ATOM 136 CB THR A 19 -13.895 -14.528 8.246 1.00 15.88 C ATOM 137 OG1 THR A 19 -14.368 -13.515 7.354 1.00 16.00 O ATOM 138 CG2 THR A 19 -14.930 -14.652 9.348 1.00 17.61 C ATOM 139 HA THR A 19 -12.690 -13.170 9.362 1.00 0.00 H ATOM 140 HB THR A 19 -13.762 -15.488 7.748 1.00 0.00 H ATOM 141 HG1 THR A 19 -13.720 -13.400 6.614 1.00 0.00 H ATOM 142 HG23 THR A 19 -14.613 -15.416 10.058 1.00 0.00 H ATOM 143 HG21 THR A 19 -15.028 -13.696 9.862 1.00 0.00 H ATOM 144 HG22 THR A 19 -15.889 -14.933 8.914 1.00 0.00 H ATOM 145 H THR A 19 -11.477 -14.554 6.964 1.00 0.00 H ATOM 146 N LEU A 20 -11.950 -14.752 11.069 1.00 12.55 N ATOM 147 CA LEU A 20 -11.461 -15.637 12.130 1.00 13.78 C ATOM 148 C LEU A 20 -12.505 -15.805 13.180 1.00 13.04 C ATOM 149 O LEU A 20 -13.212 -14.858 13.493 1.00 14.21 O ATOM 150 CB LEU A 20 -10.210 -15.039 12.784 1.00 14.99 C ATOM 151 CG LEU A 20 -9.034 -14.780 11.900 1.00 13.89 C ATOM 152 CD1 LEU A 20 -7.990 -14.051 12.735 1.00 18.03 C ATOM 153 CD2 LEU A 20 -8.430 -16.062 11.370 1.00 17.15 C ATOM 154 HA LEU A 20 -11.222 -16.602 11.684 1.00 0.00 H ATOM 155 HB2 LEU A 20 -10.498 -14.089 13.234 1.00 0.00 H ATOM 156 HB3 LEU A 20 -9.888 -15.727 13.566 1.00 0.00 H ATOM 157 HG LEU A 20 -9.357 -14.191 11.042 1.00 0.00 H ATOM 158 HD21 LEU A 20 -8.099 -16.679 12.206 1.00 0.00 H ATOM 159 HD22 LEU A 20 -9.179 -16.603 10.791 1.00 0.00 H ATOM 160 HD23 LEU A 20 -7.578 -15.825 10.733 1.00 0.00 H ATOM 161 HD11 LEU A 20 -8.409 -13.113 13.100 1.00 0.00 H ATOM 162 HD12 LEU A 20 -7.703 -14.675 13.581 1.00 0.00 H ATOM 163 HD13 LEU A 20 -7.114 -13.845 12.120 1.00 0.00 H ATOM 164 H LEU A 20 -12.298 -13.806 11.327 1.00 0.00 H ATOM 165 N LYS A 21 -12.554 -16.980 13.804 1.00 14.39 N ATOM 166 CA LYS A 21 -13.379 -17.114 14.987 1.00 15.70 C ATOM 167 C LYS A 21 -12.670 -16.485 16.215 1.00 12.70 C ATOM 168 O LYS A 21 -11.538 -16.872 16.552 1.00 13.75 O ATOM 169 CB LYS A 21 -13.675 -18.594 15.255 1.00 15.89 C ATOM 170 CG LYS A 21 -14.707 -18.808 16.356 1.00 20.29 C ATOM 171 CD LYS A 21 -14.977 -20.304 16.606 1.00 29.74 C ATOM 172 CE LYS A 21 -15.441 -21.007 15.337 1.00 33.16 C ATOM 173 NZ LYS A 21 -15.781 -22.436 15.594 1.00 41.82 N ATOM 174 HA LYS A 21 -14.318 -16.587 14.818 1.00 0.00 H ATOM 175 HB2 LYS A 21 -14.049 -19.045 14.336 1.00 0.00 H ATOM 176 HB3 LYS A 21 -12.748 -19.086 15.548 1.00 0.00 H ATOM 177 HG2 LYS A 21 -14.339 -18.357 17.277 1.00 0.00 H ATOM 178 HG3 LYS A 21 -15.640 -18.325 16.064 1.00 0.00 H ATOM 179 HD2 LYS A 21 -14.059 -20.776 16.957 1.00 0.00 H ATOM 180 HD3 LYS A 21 -15.750 -20.402 17.368 1.00 0.00 H ATOM 181 HE2 LYS A 21 -14.644 -20.961 14.595 1.00 0.00 H ATOM 182 HE3 LYS A 21 -16.324 -20.497 14.952 1.00 0.00 H ATOM 183 HZ1 LYS A 21 -14.941 -22.931 15.956 1.00 0.00 H ATOM 184 HZ2 LYS A 21 -16.546 -22.488 16.297 1.00 0.00 H ATOM 185 HZ3 LYS A 21 -16.093 -22.882 14.708 1.00 0.00 H ATOM 186 H LYS A 21 -12.008 -17.790 13.447 1.00 0.00 H ATOM 187 N VAL A 22 -13.320 -15.521 16.849 1.00 14.13 N ATOM 188 CA VAL A 22 -12.802 -14.799 17.965 1.00 14.58 C ATOM 189 C VAL A 22 -13.837 -14.806 19.061 1.00 16.42 C ATOM 190 O VAL A 22 -14.965 -14.309 18.855 1.00 18.35 O ATOM 191 CB VAL A 22 -12.530 -13.321 17.574 1.00 14.27 C ATOM 192 CG1 VAL A 22 -11.987 -12.539 18.788 1.00 15.68 C ATOM 193 CG2 VAL A 22 -11.551 -13.255 16.455 1.00 14.29 C ATOM 194 HA VAL A 22 -11.873 -15.267 18.291 1.00 0.00 H ATOM 195 HB VAL A 22 -13.469 -12.870 17.251 1.00 0.00 H ATOM 196 HG11 VAL A 22 -12.721 -12.566 19.594 1.00 0.00 H ATOM 197 HG12 VAL A 22 -11.057 -12.996 19.126 1.00 0.00 H ATOM 198 HG13 VAL A 22 -11.801 -11.505 18.499 1.00 0.00 H ATOM 199 HG21 VAL A 22 -10.615 -13.720 16.765 1.00 0.00 H ATOM 200 HG22 VAL A 22 -11.953 -13.784 15.591 1.00 0.00 H ATOM 201 HG23 VAL A 22 -11.371 -12.213 16.193 1.00 0.00 H ATOM 202 H VAL A 22 -14.272 -15.274 16.511 1.00 0.00 H ATOM 203 N GLY A 23 -13.525 -15.401 20.199 1.00 17.24 N ATOM 204 CA GLY A 23 -14.527 -15.481 21.279 1.00 20.79 C ATOM 205 C GLY A 23 -15.803 -16.186 20.817 1.00 23.74 C ATOM 206 O GLY A 23 -16.911 -15.830 21.239 1.00 28.61 O ATOM 207 HA3 GLY A 23 -14.779 -14.471 21.603 1.00 0.00 H ATOM 208 HA2 GLY A 23 -14.101 -16.034 22.116 1.00 0.00 H ATOM 209 H GLY A 23 -12.578 -15.811 20.333 1.00 0.00 H ATOM 210 N GLY A 24 -15.638 -17.165 19.946 1.00 21.02 N ATOM 211 CA GLY A 24 -16.764 -18.018 19.502 1.00 25.38 C ATOM 212 C GLY A 24 -17.604 -17.422 18.379 1.00 28.98 C ATOM 213 O GLY A 24 -18.571 -18.062 17.925 1.00 32.45 O ATOM 214 HA3 GLY A 24 -17.416 -18.195 20.358 1.00 0.00 H ATOM 215 HA2 GLY A 24 -16.356 -18.967 19.155 1.00 0.00 H ATOM 216 H GLY A 24 -14.689 -17.342 19.560 1.00 0.00 H ATOM 217 N GLN A 25 -17.251 -16.220 17.911 1.00 22.27 N ATOM 218 CA GLN A 25 -18.000 -15.580 16.812 1.00 23.01 C ATOM 219 C GLN A 25 -17.099 -15.222 15.624 1.00 19.98 C ATOM 220 O GLN A 25 -15.911 -14.910 15.793 1.00 17.86 O ATOM 221 CB GLN A 25 -18.769 -14.353 17.305 1.00 28.29 C ATOM 222 CG GLN A 25 -17.940 -13.179 17.728 1.00 29.68 C ATOM 223 CD GLN A 25 -18.563 -11.867 17.295 1.00 34.01 C ATOM 224 OE1 GLN A 25 -18.204 -11.316 16.258 1.00 32.28 O ATOM 225 NE2 GLN A 25 -19.517 -11.372 18.077 1.00 35.60 N ATOM 226 HA GLN A 25 -18.722 -16.314 16.456 1.00 0.00 H ATOM 227 HB2 GLN A 25 -19.424 -14.024 16.498 1.00 0.00 H ATOM 228 HB3 GLN A 25 -19.372 -14.660 18.159 1.00 0.00 H ATOM 229 HG2 GLN A 25 -17.847 -13.185 18.814 1.00 0.00 H ATOM 230 HG3 GLN A 25 -16.950 -13.265 17.280 1.00 0.00 H ATOM 231 HE22 GLN A 25 -19.789 -11.873 18.947 1.00 0.00 H ATOM 232 HE21 GLN A 25 -19.992 -10.483 17.819 1.00 0.00 H ATOM 233 H GLN A 25 -16.435 -15.728 18.328 1.00 0.00 H ATOM 234 N PRO A 26 -17.646 -15.255 14.398 1.00 18.95 N ATOM 235 CA PRO A 26 -16.791 -14.875 13.250 1.00 19.14 C ATOM 236 C PRO A 26 -16.610 -13.392 13.201 1.00 18.75 C ATOM 237 O PRO A 26 -17.558 -12.617 13.424 1.00 20.81 O ATOM 238 CB PRO A 26 -17.599 -15.329 12.018 1.00 19.43 C ATOM 239 CG PRO A 26 -19.022 -15.484 12.519 1.00 28.82 C ATOM 240 CD PRO A 26 -18.929 -15.848 13.977 1.00 21.67 C ATOM 241 HA PRO A 26 -15.798 -15.322 13.307 1.00 0.00 H ATOM 242 HD3 PRO A 26 -19.759 -15.421 14.539 1.00 0.00 H ATOM 243 HD2 PRO A 26 -18.921 -16.930 14.109 1.00 0.00 H ATOM 244 HG3 PRO A 26 -19.532 -16.273 11.966 1.00 0.00 H ATOM 245 HG2 PRO A 26 -19.567 -14.548 12.399 1.00 0.00 H ATOM 246 HB2 PRO A 26 -17.550 -14.579 11.229 1.00 0.00 H ATOM 247 HB3 PRO A 26 -17.220 -16.278 11.639 1.00 0.00 H ATOM 248 N VAL A 27 -15.357 -12.989 12.984 1.00 14.08 N ATOM 249 CA VAL A 27 -15.031 -11.597 12.821 1.00 15.23 C ATOM 250 C VAL A 27 -14.261 -11.464 11.518 1.00 12.44 C ATOM 251 O VAL A 27 -13.259 -12.150 11.325 1.00 13.39 O ATOM 252 CB VAL A 27 -14.168 -11.079 13.990 1.00 14.64 C ATOM 253 CG1 VAL A 27 -13.754 -9.638 13.715 1.00 15.74 C ATOM 254 CG2 VAL A 27 -14.922 -11.178 15.330 1.00 18.11 C ATOM 255 HA VAL A 27 -15.946 -11.004 12.806 1.00 0.00 H ATOM 256 HB VAL A 27 -13.278 -11.703 14.068 1.00 0.00 H ATOM 257 HG11 VAL A 27 -13.178 -9.597 12.791 1.00 0.00 H ATOM 258 HG12 VAL A 27 -14.645 -9.018 13.617 1.00 0.00 H ATOM 259 HG13 VAL A 27 -13.144 -9.273 14.541 1.00 0.00 H ATOM 260 HG21 VAL A 27 -15.832 -10.580 15.279 1.00 0.00 H ATOM 261 HG22 VAL A 27 -15.180 -12.219 15.524 1.00 0.00 H ATOM 262 HG23 VAL A 27 -14.285 -10.805 16.132 1.00 0.00 H ATOM 263 H VAL A 27 -14.598 -13.698 12.931 1.00 0.00 H ATOM 264 N THR A 28 -14.714 -10.564 10.640 1.00 13.13 N ATOM 265 CA THR A 28 -14.042 -10.329 9.372 1.00 13.85 C ATOM 266 C THR A 28 -13.173 -9.060 9.515 1.00 13.85 C ATOM 267 O THR A 28 -13.672 -7.946 9.731 1.00 16.68 O ATOM 268 CB THR A 28 -15.022 -10.148 8.236 1.00 15.62 C ATOM 269 OG1 THR A 28 -15.803 -11.358 8.176 1.00 17.09 O ATOM 270 CG2 THR A 28 -14.255 -9.996 6.911 1.00 16.80 C ATOM 271 HA THR A 28 -13.430 -11.199 9.134 1.00 0.00 H ATOM 272 HB THR A 28 -15.643 -9.266 8.391 1.00 0.00 H ATOM 273 HG1 THR A 28 -16.464 -11.287 7.442 1.00 0.00 H ATOM 274 HG23 THR A 28 -13.659 -9.084 6.940 1.00 0.00 H ATOM 275 HG21 THR A 28 -13.600 -10.856 6.771 1.00 0.00 H ATOM 276 HG22 THR A 28 -14.965 -9.941 6.086 1.00 0.00 H ATOM 277 H THR A 28 -15.569 -10.018 10.869 1.00 0.00 H ATOM 278 N PHE A 29 -11.870 -9.291 9.446 1.00 11.26 N ATOM 279 CA PHE A 29 -10.844 -8.262 9.648 1.00 12.13 C ATOM 280 C PHE A 29 -10.297 -7.753 8.344 1.00 10.71 C ATOM 281 O PHE A 29 -10.059 -8.543 7.404 1.00 12.59 O ATOM 282 CB PHE A 29 -9.640 -8.884 10.356 1.00 11.65 C ATOM 283 CG PHE A 29 -9.868 -9.274 11.787 1.00 10.99 C ATOM 284 CD1 PHE A 29 -9.677 -8.357 12.840 1.00 11.80 C ATOM 285 CD2 PHE A 29 -10.246 -10.591 12.125 1.00 11.90 C ATOM 286 CE1 PHE A 29 -9.886 -8.729 14.180 1.00 11.21 C ATOM 287 CE2 PHE A 29 -10.416 -10.956 13.458 1.00 12.55 C ATOM 288 CZ PHE A 29 -10.273 -10.019 14.482 1.00 11.62 C ATOM 289 HA PHE A 29 -11.316 -7.459 10.214 1.00 0.00 H ATOM 290 HB2 PHE A 29 -9.350 -9.779 9.805 1.00 0.00 H ATOM 291 HB3 PHE A 29 -8.824 -8.162 10.329 1.00 0.00 H ATOM 292 HD2 PHE A 29 -10.406 -11.327 11.337 1.00 0.00 H ATOM 293 HE2 PHE A 29 -10.664 -11.988 13.705 1.00 0.00 H ATOM 294 HZ PHE A 29 -10.466 -10.305 15.516 1.00 0.00 H ATOM 295 HE1 PHE A 29 -9.743 -8.000 14.978 1.00 0.00 H ATOM 296 HD1 PHE A 29 -9.361 -7.339 12.611 1.00 0.00 H ATOM 297 H PHE A 29 -11.556 -10.260 9.236 1.00 0.00 H ATOM 298 N LEU A 30 -9.963 -6.460 8.277 1.00 10.58 N ATOM 299 CA LEU A 30 -8.960 -5.989 7.307 1.00 11.45 C ATOM 300 C LEU A 30 -7.593 -6.447 7.804 1.00 11.13 C ATOM 301 O LEU A 30 -7.243 -6.176 8.968 1.00 11.69 O ATOM 302 CB LEU A 30 -8.995 -4.452 7.253 1.00 12.63 C ATOM 303 CG LEU A 30 -7.899 -3.817 6.383 1.00 12.74 C ATOM 304 CD1 LEU A 30 -7.967 -4.259 4.949 1.00 14.26 C ATOM 305 CD2 LEU A 30 -8.042 -2.313 6.447 1.00 15.47 C ATOM 306 HA LEU A 30 -9.162 -6.386 6.312 1.00 0.00 H ATOM 307 HB2 LEU A 30 -9.963 -4.147 6.856 1.00 0.00 H ATOM 308 HB3 LEU A 30 -8.885 -4.073 8.269 1.00 0.00 H ATOM 309 HG LEU A 30 -6.935 -4.142 6.774 1.00 0.00 H ATOM 310 HD21 LEU A 30 -9.025 -2.027 6.074 1.00 0.00 H ATOM 311 HD22 LEU A 30 -7.934 -1.983 7.480 1.00 0.00 H ATOM 312 HD23 LEU A 30 -7.270 -1.849 5.833 1.00 0.00 H ATOM 313 HD11 LEU A 30 -7.849 -5.341 4.898 1.00 0.00 H ATOM 314 HD12 LEU A 30 -8.932 -3.977 4.529 1.00 0.00 H ATOM 315 HD13 LEU A 30 -7.169 -3.778 4.384 1.00 0.00 H ATOM 316 H LEU A 30 -10.417 -5.778 8.918 1.00 0.00 H ATOM 317 N VAL A 31 -6.841 -7.161 6.980 1.00 11.04 N ATOM 318 CA VAL A 31 -5.468 -7.542 7.339 1.00 12.23 C ATOM 319 C VAL A 31 -4.629 -6.262 7.157 1.00 12.77 C ATOM 320 O VAL A 31 -4.573 -5.653 6.060 1.00 13.62 O ATOM 321 CB VAL A 31 -4.991 -8.622 6.393 1.00 12.96 C ATOM 322 CG1 VAL A 31 -3.491 -8.827 6.504 1.00 16.66 C ATOM 323 CG2 VAL A 31 -5.738 -9.916 6.643 1.00 15.47 C ATOM 324 HA VAL A 31 -5.391 -7.929 8.355 1.00 0.00 H ATOM 325 HB VAL A 31 -5.203 -8.297 5.374 1.00 0.00 H ATOM 326 HG11 VAL A 31 -2.979 -7.897 6.257 1.00 0.00 H ATOM 327 HG12 VAL A 31 -3.240 -9.121 7.523 1.00 0.00 H ATOM 328 HG13 VAL A 31 -3.180 -9.609 5.812 1.00 0.00 H ATOM 329 HG21 VAL A 31 -5.565 -10.242 7.669 1.00 0.00 H ATOM 330 HG22 VAL A 31 -6.805 -9.754 6.487 1.00 0.00 H ATOM 331 HG23 VAL A 31 -5.380 -10.680 5.953 1.00 0.00 H ATOM 332 H VAL A 31 -7.229 -7.457 6.062 1.00 0.00 H ATOM 333 N ASP A 32 -4.045 -5.822 8.271 1.00 10.99 N ATOM 334 CA ASP A 32 -3.494 -4.478 8.406 1.00 10.22 C ATOM 335 C ASP A 32 -2.077 -4.485 8.912 1.00 11.74 C ATOM 336 O ASP A 32 -1.807 -4.462 10.122 1.00 11.03 O ATOM 337 CB ASP A 32 -4.400 -3.694 9.340 1.00 12.05 C ATOM 338 CG ASP A 32 -4.042 -2.269 9.356 1.00 12.23 C ATOM 339 OD1 ASP A 32 -3.080 -1.817 8.713 1.00 13.36 O ATOM 340 OD2 ASP A 32 -4.764 -1.510 10.067 1.00 18.83 O ATOM 341 HA ASP A 32 -3.457 -4.009 7.423 1.00 0.00 H ATOM 342 HB2 ASP A 32 -5.432 -3.798 9.005 1.00 0.00 H ATOM 343 HB3 ASP A 32 -4.305 -4.096 10.349 1.00 0.00 H ATOM 344 H ASP A 32 -3.979 -6.468 9.083 1.00 0.00 H ATOM 345 N THR A 33 -1.150 -4.456 7.965 1.00 10.65 N ATOM 346 CA THR A 33 0.251 -4.510 8.336 1.00 10.37 C ATOM 347 C THR A 33 0.716 -3.196 8.968 1.00 9.84 C ATOM 348 O THR A 33 1.778 -3.159 9.555 1.00 10.68 O ATOM 349 CB THR A 33 1.159 -4.861 7.149 1.00 8.79 C ATOM 350 OG1 THR A 33 0.971 -3.864 6.120 1.00 9.95 O ATOM 351 CG2 THR A 33 0.806 -6.220 6.583 1.00 11.21 C ATOM 352 HA THR A 33 0.336 -5.308 9.073 1.00 0.00 H ATOM 353 HB THR A 33 2.195 -4.884 7.488 1.00 0.00 H ATOM 354 HG1 THR A 33 1.210 -2.973 6.478 1.00 0.00 H ATOM 355 HG23 THR A 33 0.945 -6.980 7.352 1.00 0.00 H ATOM 356 HG21 THR A 33 -0.234 -6.217 6.257 1.00 0.00 H ATOM 357 HG22 THR A 33 1.454 -6.438 5.734 1.00 0.00 H ATOM 358 H THR A 33 -1.425 -4.395 6.964 1.00 0.00 H ATOM 359 N GLY A 34 -0.124 -2.157 8.880 1.00 10.91 N ATOM 360 CA GLY A 34 0.174 -0.882 9.572 1.00 12.77 C ATOM 361 C GLY A 34 -0.406 -0.757 10.968 1.00 13.42 C ATOM 362 O GLY A 34 -0.318 0.317 11.627 1.00 14.37 O ATOM 363 HA3 GLY A 34 -0.224 -0.068 8.966 1.00 0.00 H ATOM 364 HA2 GLY A 34 1.257 -0.783 9.646 1.00 0.00 H ATOM 365 H GLY A 34 -0.995 -2.246 8.319 1.00 0.00 H ATOM 366 N ALA A 35 -1.015 -1.800 11.480 1.00 10.92 N ATOM 367 CA ALA A 35 -1.585 -1.757 12.822 1.00 11.84 C ATOM 368 C ALA A 35 -0.649 -2.498 13.774 1.00 11.52 C ATOM 369 O ALA A 35 -0.370 -3.701 13.560 1.00 12.48 O ATOM 370 CB ALA A 35 -2.957 -2.360 12.866 1.00 11.91 C ATOM 371 HA ALA A 35 -1.686 -0.715 13.126 1.00 0.00 H ATOM 372 HB1 ALA A 35 -3.617 -1.808 12.196 1.00 0.00 H ATOM 373 HB2 ALA A 35 -2.905 -3.402 12.550 1.00 0.00 H ATOM 374 HB3 ALA A 35 -3.343 -2.307 13.884 1.00 0.00 H ATOM 375 H ALA A 35 -1.093 -2.673 10.919 1.00 0.00 H ATOM 376 N GLN A 36 -0.107 -1.810 14.781 1.00 11.11 N ATOM 377 CA GLN A 36 0.752 -2.465 15.728 1.00 11.06 C ATOM 378 C GLN A 36 -0.010 -3.510 16.538 1.00 13.73 C ATOM 379 O GLN A 36 0.594 -4.509 16.936 1.00 14.50 O ATOM 380 CB GLN A 36 1.339 -1.365 16.622 1.00 13.22 C ATOM 381 CG GLN A 36 2.352 -1.894 17.655 1.00 16.83 C ATOM 382 CD GLN A 36 2.994 -0.773 18.440 1.00 19.43 C ATOM 383 OE1 GLN A 36 2.783 0.407 18.172 1.00 18.74 O ATOM 384 NE2 GLN A 36 3.783 -1.158 19.444 1.00 25.55 N ATOM 385 HA GLN A 36 1.549 -3.009 15.221 1.00 0.00 H ATOM 386 HB2 GLN A 36 1.841 -0.635 15.988 1.00 0.00 H ATOM 387 HB3 GLN A 36 0.522 -0.880 17.156 1.00 0.00 H ATOM 388 HG2 GLN A 36 1.835 -2.559 18.347 1.00 0.00 H ATOM 389 HG3 GLN A 36 3.131 -2.450 17.133 1.00 0.00 H ATOM 390 HE22 GLN A 36 3.930 -2.170 19.631 1.00 0.00 H ATOM 391 HE21 GLN A 36 4.251 -0.446 20.040 1.00 0.00 H ATOM 392 H GLN A 36 -0.308 -0.794 14.881 1.00 0.00 H ATOM 393 N HIS A 37 -1.281 -3.245 16.833 1.00 11.81 N ATOM 394 CA HIS A 37 -2.113 -4.162 17.614 1.00 12.46 C ATOM 395 C HIS A 37 -3.440 -4.289 16.930 1.00 11.90 C ATOM 396 O HIS A 37 -3.857 -3.377 16.210 1.00 12.88 O ATOM 397 CB HIS A 37 -2.300 -3.664 19.058 1.00 15.48 C ATOM 398 CG HIS A 37 -2.597 -4.784 20.002 1.00 14.41 C ATOM 399 ND1 HIS A 37 -1.603 -5.488 20.651 1.00 14.71 N ATOM 400 CD2 HIS A 37 -3.758 -5.418 20.291 1.00 15.38 C ATOM 401 CE1 HIS A 37 -2.155 -6.462 21.358 1.00 16.49 C ATOM 402 NE2 HIS A 37 -3.461 -6.447 21.149 1.00 12.78 N ATOM 403 HA HIS A 37 -1.621 -5.133 17.672 1.00 0.00 H ATOM 404 HB2 HIS A 37 -1.386 -3.165 19.380 1.00 0.00 H ATOM 405 HB3 HIS A 37 -3.127 -2.955 19.082 1.00 0.00 H ATOM 406 HD2 HIS A 37 -4.747 -5.159 19.912 1.00 0.00 H ATOM 407 HE1 HIS A 37 -1.622 -7.160 22.004 1.00 0.00 H ATOM 408 H HIS A 37 -1.698 -2.354 16.496 1.00 0.00 H ATOM 409 N SER A 38 -4.118 -5.407 17.153 1.00 9.55 N ATOM 410 CA SER A 38 -5.381 -5.693 16.486 1.00 9.44 C ATOM 411 C SER A 38 -6.544 -5.046 17.201 1.00 9.27 C ATOM 412 O SER A 38 -6.486 -4.720 18.439 1.00 9.75 O ATOM 413 CB SER A 38 -5.585 -7.217 16.412 1.00 10.45 C ATOM 414 OG SER A 38 -4.574 -7.817 15.596 1.00 10.60 O ATOM 415 HA SER A 38 -5.341 -5.277 15.480 1.00 0.00 H ATOM 416 HB2 SER A 38 -6.565 -7.428 15.984 1.00 0.00 H ATOM 417 HB3 SER A 38 -5.531 -7.636 17.417 1.00 0.00 H ATOM 418 HG SER A 38 -3.683 -7.629 15.985 1.00 0.00 H ATOM 419 H SER A 38 -3.736 -6.102 17.826 1.00 0.00 H ATOM 420 N VAL A 39 -7.592 -4.813 16.416 1.00 9.47 N ATOM 421 CA VAL A 39 -8.671 -3.911 16.852 1.00 8.97 C ATOM 422 C VAL A 39 -10.033 -4.587 16.588 1.00 10.01 C ATOM 423 O VAL A 39 -10.245 -5.158 15.485 1.00 11.43 O ATOM 424 CB VAL A 39 -8.579 -2.610 16.024 1.00 10.58 C ATOM 425 CG1 VAL A 39 -9.847 -1.760 16.102 1.00 12.52 C ATOM 426 CG2 VAL A 39 -7.329 -1.841 16.416 1.00 11.82 C ATOM 427 HA VAL A 39 -8.575 -3.690 17.915 1.00 0.00 H ATOM 428 HB VAL A 39 -8.497 -2.884 14.972 1.00 0.00 H ATOM 429 HG11 VAL A 39 -10.692 -2.335 15.723 1.00 0.00 H ATOM 430 HG12 VAL A 39 -10.032 -1.480 17.139 1.00 0.00 H ATOM 431 HG13 VAL A 39 -9.718 -0.861 15.499 1.00 0.00 H ATOM 432 HG21 VAL A 39 -7.374 -1.593 17.476 1.00 0.00 H ATOM 433 HG22 VAL A 39 -6.450 -2.456 16.223 1.00 0.00 H ATOM 434 HG23 VAL A 39 -7.269 -0.924 15.829 1.00 0.00 H ATOM 435 H VAL A 39 -7.650 -5.273 15.485 1.00 0.00 H ATOM 436 N LEU A 40 -10.940 -4.567 17.590 1.00 10.40 N ATOM 437 CA LEU A 40 -12.371 -4.868 17.389 1.00 11.64 C ATOM 438 C LEU A 40 -13.170 -3.573 17.464 1.00 12.97 C ATOM 439 O LEU A 40 -12.777 -2.642 18.169 1.00 12.97 O ATOM 440 CB LEU A 40 -12.880 -5.877 18.447 1.00 11.74 C ATOM 441 CG LEU A 40 -12.180 -7.244 18.437 1.00 12.09 C ATOM 442 CD1 LEU A 40 -12.681 -8.105 19.578 1.00 14.04 C ATOM 443 CD2 LEU A 40 -12.372 -7.972 17.067 1.00 12.68 C ATOM 444 HA LEU A 40 -12.502 -5.323 16.407 1.00 0.00 H ATOM 445 HB2 LEU A 40 -12.739 -5.433 19.432 1.00 0.00 H ATOM 446 HB3 LEU A 40 -13.943 -6.041 18.273 1.00 0.00 H ATOM 447 HG LEU A 40 -11.112 -7.075 18.574 1.00 0.00 H ATOM 448 HD21 LEU A 40 -13.436 -8.126 16.885 1.00 0.00 H ATOM 449 HD22 LEU A 40 -11.950 -7.360 16.270 1.00 0.00 H ATOM 450 HD23 LEU A 40 -11.864 -8.936 17.095 1.00 0.00 H ATOM 451 HD11 LEU A 40 -12.474 -7.607 20.525 1.00 0.00 H ATOM 452 HD12 LEU A 40 -13.755 -8.256 19.473 1.00 0.00 H ATOM 453 HD13 LEU A 40 -12.173 -9.069 19.554 1.00 0.00 H ATOM 454 H LEU A 40 -10.614 -4.328 18.548 1.00 0.00 H ATOM 455 N THR A 41 -14.273 -3.530 16.721 1.00 16.25 N ATOM 456 CA THR A 41 -15.005 -2.246 16.584 1.00 16.77 C ATOM 457 C THR A 41 -16.417 -2.254 17.114 1.00 21.62 C ATOM 458 O THR A 41 -16.898 -1.203 17.516 1.00 32.35 O ATOM 459 CB THR A 41 -15.089 -1.809 15.113 1.00 18.65 C ATOM 460 OG1 THR A 41 -15.702 -2.865 14.360 1.00 21.10 O ATOM 461 CG2 THR A 41 -13.728 -1.536 14.549 1.00 17.43 C ATOM 462 HA THR A 41 -14.418 -1.555 17.189 1.00 0.00 H ATOM 463 HB THR A 41 -15.675 -0.892 15.052 1.00 0.00 H ATOM 464 HG1 THR A 41 -15.763 -2.598 13.409 1.00 0.00 H ATOM 465 HG23 THR A 41 -13.255 -0.734 15.116 1.00 0.00 H ATOM 466 HG21 THR A 41 -13.120 -2.438 14.617 1.00 0.00 H ATOM 467 HG22 THR A 41 -13.822 -1.238 13.505 1.00 0.00 H ATOM 468 H THR A 41 -14.618 -4.386 16.242 1.00 0.00 H ATOM 469 N GLN A 42 -17.092 -3.397 17.069 1.00 20.43 N ATOM 470 CA GLN A 42 -18.501 -3.468 17.493 1.00 24.25 C ATOM 471 C GLN A 42 -18.649 -4.778 18.250 1.00 25.24 C ATOM 472 O GLN A 42 -17.951 -5.738 17.968 1.00 26.26 O ATOM 473 CB GLN A 42 -19.445 -3.439 16.280 1.00 33.02 C ATOM 474 CG GLN A 42 -19.249 -4.594 15.321 1.00 41.10 C ATOM 475 CD GLN A 42 -20.482 -4.882 14.482 1.00 50.97 C ATOM 476 OE1 GLN A 42 -21.621 -4.628 14.903 1.00 55.63 O ATOM 477 NE2 GLN A 42 -20.261 -5.433 13.287 1.00 53.67 N ATOM 478 HA GLN A 42 -18.765 -2.613 18.116 1.00 0.00 H ATOM 479 HB2 GLN A 42 -20.472 -3.465 16.644 1.00 0.00 H ATOM 480 HB3 GLN A 42 -19.277 -2.509 15.736 1.00 0.00 H ATOM 481 HG2 GLN A 42 -18.422 -4.355 14.653 1.00 0.00 H ATOM 482 HG3 GLN A 42 -19.004 -5.486 15.897 1.00 0.00 H ATOM 483 HE22 GLN A 42 -19.288 -5.628 12.976 1.00 0.00 H ATOM 484 HE21 GLN A 42 -21.062 -5.667 12.666 1.00 0.00 H ATOM 485 H GLN A 42 -16.617 -4.257 16.728 1.00 0.00 H ATOM 486 N ASN A 43 -19.566 -4.828 19.217 1.00 28.90 N ATOM 487 CA ASN A 43 -19.706 -6.045 20.058 1.00 32.00 C ATOM 488 C ASN A 43 -18.388 -6.752 20.465 1.00 28.01 C ATOM 489 O ASN A 43 -18.219 -7.953 20.216 1.00 30.26 O ATOM 490 CB ASN A 43 -20.627 -7.070 19.375 1.00 40.60 C ATOM 491 CG ASN A 43 -22.053 -6.583 19.243 1.00 47.80 C ATOM 492 OD1 ASN A 43 -22.500 -5.696 19.981 1.00 51.25 O ATOM 493 ND2 ASN A 43 -22.784 -7.168 18.300 1.00 52.57 N ATOM 494 HA ASN A 43 -20.135 -5.668 20.986 1.00 0.00 H ATOM 495 HB2 ASN A 43 -20.237 -7.279 18.379 1.00 0.00 H ATOM 496 HB3 ASN A 43 -20.625 -7.987 19.965 1.00 0.00 H ATOM 497 HD22 ASN A 43 -22.366 -7.910 17.703 1.00 0.00 H ATOM 498 HD21 ASN A 43 -23.775 -6.884 18.159 1.00 0.00 H ATOM 499 H ASN A 43 -20.187 -4.010 19.383 1.00 0.00 H ATOM 500 N PRO A 44 -17.454 -6.019 21.120 1.00 22.15 N ATOM 501 CA PRO A 44 -16.143 -6.532 21.476 1.00 20.33 C ATOM 502 C PRO A 44 -16.160 -7.534 22.640 1.00 15.50 C ATOM 503 O PRO A 44 -15.112 -8.065 22.978 1.00 17.85 O ATOM 504 CB PRO A 44 -15.425 -5.266 21.945 1.00 16.99 C ATOM 505 CG PRO A 44 -16.485 -4.405 22.507 1.00 18.49 C ATOM 506 CD PRO A 44 -17.560 -4.597 21.485 1.00 19.52 C ATOM 507 HA PRO A 44 -15.691 -7.070 20.643 1.00 0.00 H ATOM 508 HD3 PRO A 44 -18.540 -4.377 21.907 1.00 0.00 H ATOM 509 HD2 PRO A 44 -17.388 -3.960 20.617 1.00 0.00 H ATOM 510 HG3 PRO A 44 -16.168 -3.364 22.568 1.00 0.00 H ATOM 511 HG2 PRO A 44 -16.801 -4.746 23.493 1.00 0.00 H ATOM 512 HB2 PRO A 44 -14.684 -5.507 22.707 1.00 0.00 H ATOM 513 HB3 PRO A 44 -14.935 -4.771 21.106 1.00 0.00 H ATOM 514 N GLY A 45 -17.316 -7.755 23.228 1.00 17.87 N ATOM 515 CA GLY A 45 -17.383 -8.571 24.456 1.00 16.48 C ATOM 516 C GLY A 45 -16.923 -7.753 25.652 1.00 14.78 C ATOM 517 O GLY A 45 -16.713 -6.538 25.555 1.00 14.87 O ATOM 518 HA3 GLY A 45 -16.738 -9.443 24.346 1.00 0.00 H ATOM 519 HA2 GLY A 45 -18.410 -8.898 24.616 1.00 0.00 H ATOM 520 H GLY A 45 -18.187 -7.353 22.826 1.00 0.00 H ATOM 521 N PRO A 46 -16.764 -8.411 26.795 1.00 13.32 N ATOM 522 CA PRO A 46 -16.387 -7.737 28.012 1.00 12.65 C ATOM 523 C PRO A 46 -15.092 -6.936 27.860 1.00 12.29 C ATOM 524 O PRO A 46 -14.113 -7.402 27.224 1.00 13.10 O ATOM 525 CB PRO A 46 -16.223 -8.899 29.027 1.00 14.68 C ATOM 526 CG PRO A 46 -17.146 -9.947 28.507 1.00 16.84 C ATOM 527 CD PRO A 46 -16.976 -9.861 27.001 1.00 15.90 C ATOM 528 HA PRO A 46 -17.125 -6.996 28.321 1.00 0.00 H ATOM 529 HD3 PRO A 46 -16.114 -10.439 26.666 1.00 0.00 H ATOM 530 HD2 PRO A 46 -17.869 -10.208 26.481 1.00 0.00 H ATOM 531 HG3 PRO A 46 -18.176 -9.736 28.795 1.00 0.00 H ATOM 532 HG2 PRO A 46 -16.862 -10.933 28.875 1.00 0.00 H ATOM 533 HB2 PRO A 46 -15.194 -9.259 29.045 1.00 0.00 H ATOM 534 HB3 PRO A 46 -16.514 -8.585 30.029 1.00 0.00 H ATOM 535 N LEU A 47 -15.037 -5.783 28.476 1.00 11.98 N ATOM 536 CA LEU A 47 -13.873 -4.877 28.399 1.00 11.81 C ATOM 537 C LEU A 47 -13.104 -4.907 29.681 1.00 15.45 C ATOM 538 O LEU A 47 -13.686 -5.018 30.762 1.00 15.24 O ATOM 539 CB LEU A 47 -14.348 -3.456 28.109 1.00 13.22 C ATOM 540 CG LEU A 47 -15.065 -3.356 26.758 1.00 13.84 C ATOM 541 CD1 LEU A 47 -15.592 -1.930 26.594 1.00 21.08 C ATOM 542 CD2 LEU A 47 -14.163 -3.660 25.582 1.00 16.78 C ATOM 543 HA LEU A 47 -13.218 -5.210 27.594 1.00 0.00 H ATOM 544 HB2 LEU A 47 -15.035 -3.147 28.896 1.00 0.00 H ATOM 545 HB3 LEU A 47 -13.485 -2.791 28.100 1.00 0.00 H ATOM 546 HG LEU A 47 -15.865 -4.097 26.761 1.00 0.00 H ATOM 547 HD21 LEU A 47 -13.334 -2.952 25.569 1.00 0.00 H ATOM 548 HD22 LEU A 47 -13.775 -4.674 25.676 1.00 0.00 H ATOM 549 HD23 LEU A 47 -14.732 -3.571 24.657 1.00 0.00 H ATOM 550 HD11 LEU A 47 -16.287 -1.706 27.403 1.00 0.00 H ATOM 551 HD12 LEU A 47 -14.757 -1.230 26.626 1.00 0.00 H ATOM 552 HD13 LEU A 47 -16.106 -1.842 25.637 1.00 0.00 H ATOM 553 H LEU A 47 -15.854 -5.490 29.049 1.00 0.00 H ATOM 554 N SER A 48 -11.793 -4.730 29.606 1.00 14.61 N ATOM 555 CA SER A 48 -10.997 -4.455 30.798 1.00 17.19 C ATOM 556 C SER A 48 -11.033 -2.954 31.109 1.00 18.27 C ATOM 557 O SER A 48 -11.533 -2.161 30.318 1.00 17.38 O ATOM 558 CB SER A 48 -9.563 -4.936 30.592 1.00 23.35 C ATOM 559 OG SER A 48 -8.905 -4.098 29.682 1.00 25.66 O ATOM 560 HA SER A 48 -11.417 -4.994 31.647 1.00 0.00 H ATOM 561 HB2 SER A 48 -9.575 -5.954 30.203 1.00 0.00 H ATOM 562 HB3 SER A 48 -9.035 -4.920 31.546 1.00 0.00 H ATOM 563 HG SER A 48 -9.383 -4.114 28.815 1.00 0.00 H ATOM 564 H SER A 48 -11.322 -4.788 28.680 1.00 0.00 H ATOM 565 N ASP A 49 -10.516 -2.553 32.266 1.00 22.14 N ATOM 566 CA ASP A 49 -10.399 -1.128 32.552 1.00 20.90 C ATOM 567 C ASP A 49 -9.005 -0.623 32.205 1.00 19.57 C ATOM 568 O ASP A 49 -8.708 0.553 32.403 1.00 25.15 O ATOM 569 CB ASP A 49 -10.798 -0.782 33.992 1.00 22.01 C ATOM 570 CG ASP A 49 -12.225 -0.317 34.087 1.00 17.83 C ATOM 571 OD1 ASP A 49 -12.716 0.272 33.109 1.00 27.21 O ATOM 572 OD2 ASP A 49 -12.864 -0.548 35.116 1.00 23.94 O ATOM 573 HA ASP A 49 -11.112 -0.607 31.913 1.00 0.00 H ATOM 574 HB2 ASP A 49 -10.675 -1.669 34.614 1.00 0.00 H ATOM 575 HB3 ASP A 49 -10.145 0.010 34.357 1.00 0.00 H ATOM 576 H ASP A 49 -10.196 -3.253 32.965 1.00 0.00 H ATOM 577 N LYS A 50 -8.176 -1.519 31.664 1.00 20.53 N ATOM 578 CA LYS A 50 -6.870 -1.142 31.127 1.00 20.24 C ATOM 579 C LYS A 50 -7.121 -0.484 29.798 1.00 18.14 C ATOM 580 O LYS A 50 -8.014 -0.882 29.045 1.00 18.21 O ATOM 581 CB LYS A 50 -6.005 -2.356 30.854 1.00 20.34 C ATOM 582 CG LYS A 50 -5.662 -3.213 32.078 1.00 28.64 C ATOM 583 CD LYS A 50 -5.139 -4.575 31.618 1.00 35.08 C ATOM 584 CE LYS A 50 -4.345 -5.280 32.711 1.00 38.19 C ATOM 585 NZ LYS A 50 -3.856 -6.629 32.271 1.00 42.03 N ATOM 586 HA LYS A 50 -6.364 -0.499 31.847 1.00 0.00 H ATOM 587 HB2 LYS A 50 -6.530 -2.988 30.138 1.00 0.00 H ATOM 588 HB3 LYS A 50 -5.070 -2.010 30.414 1.00 0.00 H ATOM 589 HG2 LYS A 50 -4.897 -2.711 32.670 1.00 0.00 H ATOM 590 HG3 LYS A 50 -6.556 -3.353 32.686 1.00 0.00 H ATOM 591 HD2 LYS A 50 -5.986 -5.201 31.338 1.00 0.00 H ATOM 592 HD3 LYS A 50 -4.494 -4.430 30.751 1.00 0.00 H ATOM 593 HE2 LYS A 50 -4.984 -5.405 33.585 1.00 0.00 H ATOM 594 HE3 LYS A 50 -3.486 -4.663 32.976 1.00 0.00 H ATOM 595 HZ1 LYS A 50 -4.670 -7.227 32.023 1.00 0.00 H ATOM 596 HZ2 LYS A 50 -3.239 -6.519 31.441 1.00 0.00 H ATOM 597 HZ3 LYS A 50 -3.321 -7.072 33.045 1.00 0.00 H ATOM 598 H LYS A 50 -8.469 -2.516 31.623 1.00 0.00 H ATOM 599 N SER A 51 -6.316 0.520 29.520 1.00 19.24 N ATOM 600 CA SER A 51 -6.470 1.304 28.290 1.00 21.39 C ATOM 601 C SER A 51 -5.110 1.603 27.707 1.00 20.14 C ATOM 602 O SER A 51 -4.066 1.342 28.331 1.00 20.58 O ATOM 603 CB SER A 51 -7.160 2.620 28.555 1.00 24.11 C ATOM 604 OG SER A 51 -6.497 3.365 29.543 1.00 22.95 O ATOM 605 HA SER A 51 -7.074 0.715 27.599 1.00 0.00 H ATOM 606 HB2 SER A 51 -8.180 2.424 28.885 1.00 0.00 H ATOM 607 HB3 SER A 51 -7.183 3.199 27.632 1.00 0.00 H ATOM 608 HG SER A 51 -5.571 3.552 29.248 1.00 0.00 H ATOM 609 H SER A 51 -5.555 0.762 30.186 1.00 0.00 H ATOM 610 N ALA A 52 -5.148 2.135 26.479 1.00 17.03 N ATOM 611 CA ALA A 52 -3.949 2.488 25.773 1.00 16.03 C ATOM 612 C ALA A 52 -4.188 3.701 24.927 1.00 14.07 C ATOM 613 O ALA A 52 -5.286 3.953 24.459 1.00 15.71 O ATOM 614 CB ALA A 52 -3.472 1.318 24.851 1.00 18.88 C ATOM 615 HA ALA A 52 -3.177 2.694 26.514 1.00 0.00 H ATOM 616 HB1 ALA A 52 -3.272 0.436 25.459 1.00 0.00 H ATOM 617 HB2 ALA A 52 -4.251 1.090 24.123 1.00 0.00 H ATOM 618 HB3 ALA A 52 -2.562 1.616 24.330 1.00 0.00 H ATOM 619 H ALA A 52 -6.070 2.297 26.025 1.00 0.00 H ATOM 620 N TRP A 53 -3.102 4.448 24.750 1.00 15.49 N ATOM 621 CA TRP A 53 -3.103 5.527 23.785 1.00 14.60 C ATOM 622 C TRP A 53 -2.856 5.005 22.365 1.00 14.59 C ATOM 623 O TRP A 53 -1.864 4.328 22.125 1.00 16.87 O ATOM 624 CB TRP A 53 -2.010 6.553 24.125 1.00 17.75 C ATOM 625 CG TRP A 53 -2.206 7.774 23.271 1.00 14.97 C ATOM 626 CD1 TRP A 53 -1.555 8.083 22.100 1.00 18.55 C ATOM 627 CD2 TRP A 53 -3.172 8.807 23.472 1.00 15.78 C ATOM 628 NE1 TRP A 53 -2.056 9.254 21.580 1.00 18.99 N ATOM 629 CE2 TRP A 53 -3.036 9.730 22.400 1.00 17.35 C ATOM 630 CE3 TRP A 53 -4.127 9.061 24.471 1.00 17.95 C ATOM 631 CZ2 TRP A 53 -3.830 10.888 22.304 1.00 20.35 C ATOM 632 CZ3 TRP A 53 -4.919 10.187 24.374 1.00 19.95 C ATOM 633 CH2 TRP A 53 -4.758 11.098 23.293 1.00 22.64 C ATOM 634 HA TRP A 53 -4.085 5.998 23.828 1.00 0.00 H ATOM 635 HB2 TRP A 53 -2.080 6.827 25.178 1.00 0.00 H ATOM 636 HB3 TRP A 53 -1.029 6.122 23.928 1.00 0.00 H ATOM 637 HE1 TRP A 53 -1.737 9.706 20.699 1.00 0.00 H ATOM 638 HD1 TRP A 53 -0.760 7.488 21.650 1.00 0.00 H ATOM 639 HZ2 TRP A 53 -3.713 11.589 21.478 1.00 0.00 H ATOM 640 HH2 TRP A 53 -5.388 11.986 23.249 1.00 0.00 H ATOM 641 HZ3 TRP A 53 -5.676 10.381 25.134 1.00 0.00 H ATOM 642 HE3 TRP A 53 -4.241 8.377 25.312 1.00 0.00 H ATOM 643 H TRP A 53 -2.246 4.256 25.309 1.00 0.00 H ATOM 644 N VAL A 54 -3.790 5.284 21.477 1.00 12.01 N ATOM 645 CA VAL A 54 -3.674 4.862 20.071 1.00 13.29 C ATOM 646 C VAL A 54 -3.340 6.089 19.228 1.00 11.26 C ATOM 647 O VAL A 54 -4.105 7.070 19.217 1.00 12.87 O ATOM 648 CB VAL A 54 -4.946 4.162 19.610 1.00 13.89 C ATOM 649 CG1 VAL A 54 -4.906 3.867 18.096 1.00 15.52 C ATOM 650 CG2 VAL A 54 -5.156 2.851 20.428 1.00 15.32 C ATOM 651 HA VAL A 54 -2.872 4.133 19.956 1.00 0.00 H ATOM 652 HB VAL A 54 -5.790 4.827 19.789 1.00 0.00 H ATOM 653 HG11 VAL A 54 -4.806 4.803 17.547 1.00 0.00 H ATOM 654 HG12 VAL A 54 -4.055 3.223 17.875 1.00 0.00 H ATOM 655 HG13 VAL A 54 -5.828 3.367 17.800 1.00 0.00 H ATOM 656 HG21 VAL A 54 -4.304 2.188 20.275 1.00 0.00 H ATOM 657 HG22 VAL A 54 -5.242 3.095 21.487 1.00 0.00 H ATOM 658 HG23 VAL A 54 -6.068 2.357 20.092 1.00 0.00 H ATOM 659 H VAL A 54 -4.631 5.816 21.778 1.00 0.00 H ATOM 660 N GLN A 55 -2.237 6.018 18.490 1.00 11.64 N ATOM 661 CA GLN A 55 -1.951 7.017 17.461 1.00 11.76 C ATOM 662 C GLN A 55 -2.514 6.519 16.132 1.00 10.20 C ATOM 663 O GLN A 55 -2.063 5.486 15.610 1.00 12.91 O ATOM 664 CB GLN A 55 -0.455 7.265 17.349 1.00 11.85 C ATOM 665 CG GLN A 55 -0.189 8.332 16.243 1.00 13.92 C ATOM 666 CD GLN A 55 1.236 8.672 15.994 1.00 14.23 C ATOM 667 OE1 GLN A 55 1.506 9.809 15.482 1.00 16.97 O ATOM 668 NE2 GLN A 55 2.157 7.801 16.304 1.00 13.02 N ATOM 669 HA GLN A 55 -2.420 7.963 17.730 1.00 0.00 H ATOM 670 HB2 GLN A 55 -0.073 7.627 18.304 1.00 0.00 H ATOM 671 HB3 GLN A 55 0.050 6.335 17.087 1.00 0.00 H ATOM 672 HG2 GLN A 55 -0.611 7.958 15.310 1.00 0.00 H ATOM 673 HG3 GLN A 55 -0.705 9.248 16.532 1.00 0.00 H ATOM 674 HE22 GLN A 55 1.889 6.886 16.720 1.00 0.00 H ATOM 675 HE21 GLN A 55 3.159 8.022 16.135 1.00 0.00 H ATOM 676 H GLN A 55 -1.566 5.239 18.647 1.00 0.00 H ATOM 677 N GLY A 56 -3.458 7.236 15.602 1.00 11.08 N ATOM 678 CA GLY A 56 -3.935 7.016 14.222 1.00 12.46 C ATOM 679 C GLY A 56 -3.325 7.977 13.220 1.00 14.65 C ATOM 680 O GLY A 56 -2.414 8.768 13.557 1.00 16.20 O ATOM 681 HA3 GLY A 56 -5.018 7.139 14.206 1.00 0.00 H ATOM 682 HA2 GLY A 56 -3.681 5.998 13.925 1.00 0.00 H ATOM 683 H GLY A 56 -3.893 7.991 16.169 1.00 0.00 H ATOM 684 N ALA A 57 -3.743 7.882 11.967 1.00 13.49 N ATOM 685 CA ALA A 57 -3.130 8.691 10.898 1.00 14.71 C ATOM 686 C ALA A 57 -3.498 10.145 11.039 1.00 15.79 C ATOM 687 O ALA A 57 -2.775 10.982 10.484 1.00 16.60 O ATOM 688 CB ALA A 57 -3.612 8.135 9.524 1.00 17.02 C ATOM 689 HA ALA A 57 -2.044 8.624 10.968 1.00 0.00 H ATOM 690 HB1 ALA A 57 -3.305 7.093 9.427 1.00 0.00 H ATOM 691 HB2 ALA A 57 -4.698 8.202 9.467 1.00 0.00 H ATOM 692 HB3 ALA A 57 -3.168 8.722 8.720 1.00 0.00 H ATOM 693 H ALA A 57 -4.516 7.226 11.734 1.00 0.00 H ATOM 694 N THR A 58 -4.594 10.457 11.727 1.00 13.65 N ATOM 695 CA THR A 58 -5.139 11.807 11.777 1.00 15.55 C ATOM 696 C THR A 58 -5.165 12.405 13.182 1.00 15.83 C ATOM 697 O THR A 58 -5.598 13.550 13.372 1.00 19.17 O ATOM 698 CB THR A 58 -6.552 11.891 11.175 1.00 15.40 C ATOM 699 OG1 THR A 58 -7.471 11.173 12.051 1.00 17.17 O ATOM 700 CG2 THR A 58 -6.603 11.237 9.786 1.00 17.16 C ATOM 701 HA THR A 58 -4.451 12.396 11.171 1.00 0.00 H ATOM 702 HB THR A 58 -6.828 12.941 11.080 1.00 0.00 H ATOM 703 HG1 THR A 58 -7.188 10.227 12.120 1.00 0.00 H ATOM 704 HG23 THR A 58 -5.922 11.760 9.114 1.00 0.00 H ATOM 705 HG21 THR A 58 -6.305 10.192 9.867 1.00 0.00 H ATOM 706 HG22 THR A 58 -7.619 11.297 9.395 1.00 0.00 H ATOM 707 H THR A 58 -5.083 9.704 12.252 1.00 0.00 H ATOM 708 N GLY A 59 -4.671 11.658 14.152 1.00 12.10 N ATOM 709 CA GLY A 59 -4.697 12.122 15.532 1.00 13.89 C ATOM 710 C GLY A 59 -4.512 10.946 16.458 1.00 14.01 C ATOM 711 O GLY A 59 -3.968 9.928 16.020 1.00 17.06 O ATOM 712 HA3 GLY A 59 -5.655 12.600 15.737 1.00 0.00 H ATOM 713 HA2 GLY A 59 -3.892 12.840 15.690 1.00 0.00 H ATOM 714 H GLY A 59 -4.259 10.729 13.928 1.00 0.00 H ATOM 715 N GLY A 60 -4.920 11.085 17.712 1.00 13.89 N ATOM 716 CA GLY A 60 -4.732 10.031 18.721 1.00 14.15 C ATOM 717 C GLY A 60 -5.834 10.105 19.750 1.00 14.99 C ATOM 718 O GLY A 60 -6.443 11.164 19.933 1.00 16.71 O ATOM 719 HA3 GLY A 60 -3.768 10.167 19.212 1.00 0.00 H ATOM 720 HA2 GLY A 60 -4.756 9.056 18.235 1.00 0.00 H ATOM 721 H GLY A 60 -5.389 11.970 17.992 1.00 0.00 H ATOM 722 N LYS A 61 -6.127 8.998 20.422 1.00 12.96 N ATOM 723 CA LYS A 61 -7.162 8.944 21.466 1.00 14.38 C ATOM 724 C LYS A 61 -6.911 7.711 22.312 1.00 14.40 C ATOM 725 O LYS A 61 -6.231 6.743 21.869 1.00 13.56 O ATOM 726 CB LYS A 61 -8.529 8.869 20.791 1.00 16.83 C ATOM 727 CG LYS A 61 -9.797 8.894 21.629 1.00 24.03 C ATOM 728 CD LYS A 61 -11.021 9.085 20.714 1.00 28.51 C ATOM 729 CE LYS A 61 -12.336 8.771 21.415 1.00 36.64 C ATOM 730 NZ LYS A 61 -12.794 9.873 22.323 1.00 42.41 N ATOM 731 HA LYS A 61 -7.134 9.829 22.102 1.00 0.00 H ATOM 732 HB2 LYS A 61 -8.588 9.715 20.106 1.00 0.00 H ATOM 733 HB3 LYS A 61 -8.547 7.940 20.221 1.00 0.00 H ATOM 734 HG2 LYS A 61 -9.892 7.953 22.170 1.00 0.00 H ATOM 735 HG3 LYS A 61 -9.745 9.718 22.341 1.00 0.00 H ATOM 736 HD2 LYS A 61 -11.045 10.121 20.376 1.00 0.00 H ATOM 737 HD3 LYS A 61 -10.919 8.425 19.853 1.00 0.00 H ATOM 738 HE2 LYS A 61 -12.207 7.864 22.006 1.00 0.00 H ATOM 739 HE3 LYS A 61 -13.102 8.603 20.658 1.00 0.00 H ATOM 740 HZ1 LYS A 61 -12.076 10.037 23.057 1.00 0.00 H ATOM 741 HZ2 LYS A 61 -12.930 10.743 21.769 1.00 0.00 H ATOM 742 HZ3 LYS A 61 -13.693 9.601 22.770 1.00 0.00 H ATOM 743 H LYS A 61 -5.601 8.129 20.200 1.00 0.00 H ATOM 744 N ARG A 62 -7.459 7.734 23.530 1.00 16.21 N ATOM 745 CA ARG A 62 -7.344 6.623 24.450 1.00 17.46 C ATOM 746 C ARG A 62 -8.491 5.633 24.211 1.00 16.12 C ATOM 747 O ARG A 62 -9.636 6.021 24.054 1.00 17.01 O ATOM 748 CB ARG A 62 -7.391 7.154 25.887 1.00 21.11 C ATOM 749 CG ARG A 62 -7.199 6.054 26.928 1.00 26.26 C ATOM 750 CD ARG A 62 -7.550 6.611 28.315 1.00 36.28 C ATOM 751 NE ARG A 62 -8.363 5.647 29.057 1.00 48.25 N ATOM 752 CZ ARG A 62 -9.696 5.596 29.040 1.00 50.04 C ATOM 753 NH1 ARG A 62 -10.410 6.473 28.333 1.00 52.46 N ATOM 754 NH2 ARG A 62 -10.317 4.664 29.746 1.00 50.10 N ATOM 755 HA ARG A 62 -6.398 6.106 24.289 1.00 0.00 H ATOM 756 HB2 ARG A 62 -6.601 7.894 26.012 1.00 0.00 H ATOM 757 HB3 ARG A 62 -8.359 7.627 26.053 1.00 0.00 H ATOM 758 HG2 ARG A 62 -7.852 5.213 26.696 1.00 0.00 H ATOM 759 HG3 ARG A 62 -6.161 5.720 26.920 1.00 0.00 H ATOM 760 HD2 ARG A 62 -8.109 7.540 28.199 1.00 0.00 H ATOM 761 HD3 ARG A 62 -6.631 6.808 28.867 1.00 0.00 H ATOM 762 HE ARG A 62 -7.863 4.948 29.643 1.00 0.00 H ATOM 763 HH12 ARG A 62 -11.449 6.417 28.332 1.00 0.00 H ATOM 764 HH11 ARG A 62 -9.928 7.212 27.783 1.00 0.00 H ATOM 765 HH22 ARG A 62 -11.356 4.614 29.741 1.00 0.00 H ATOM 766 HH21 ARG A 62 -9.766 3.982 30.306 1.00 0.00 H ATOM 767 H ARG A 62 -7.986 8.580 23.827 1.00 0.00 H ATOM 768 N TYR A 63 -8.146 4.348 24.186 1.00 13.67 N ATOM 769 CA TYR A 63 -9.152 3.274 24.009 1.00 12.50 C ATOM 770 C TYR A 63 -8.925 2.166 24.999 1.00 13.88 C ATOM 771 O TYR A 63 -7.812 1.956 25.460 1.00 15.84 O ATOM 772 CB TYR A 63 -9.109 2.692 22.595 1.00 12.60 C ATOM 773 CG TYR A 63 -9.468 3.714 21.569 1.00 12.48 C ATOM 774 CD1 TYR A 63 -10.776 3.995 21.293 1.00 13.10 C ATOM 775 CD2 TYR A 63 -8.483 4.390 20.873 1.00 14.31 C ATOM 776 CE1 TYR A 63 -11.142 4.979 20.326 1.00 14.46 C ATOM 777 CE2 TYR A 63 -8.815 5.370 19.913 1.00 14.17 C ATOM 778 CZ TYR A 63 -10.131 5.632 19.635 1.00 14.34 C ATOM 779 OH TYR A 63 -10.445 6.560 18.658 1.00 15.50 O ATOM 780 HA TYR A 63 -10.131 3.723 24.176 1.00 0.00 H ATOM 781 HB3 TYR A 63 -9.815 1.864 22.532 1.00 0.00 H ATOM 782 HB2 TYR A 63 -8.102 2.326 22.393 1.00 0.00 H ATOM 783 HD2 TYR A 63 -7.435 4.163 21.068 1.00 0.00 H ATOM 784 HE2 TYR A 63 -8.027 5.917 19.395 1.00 0.00 H ATOM 785 HE1 TYR A 63 -12.190 5.212 20.135 1.00 0.00 H ATOM 786 HD1 TYR A 63 -11.559 3.455 21.824 1.00 0.00 H ATOM 787 HH TYR A 63 -11.429 6.634 18.579 1.00 0.00 H ATOM 788 H TYR A 63 -7.144 4.091 24.293 1.00 0.00 H ATOM 789 N ARG A 64 -9.981 1.425 25.291 1.00 14.77 N ATOM 790 CA ARG A 64 -9.867 0.312 26.222 1.00 16.10 C ATOM 791 C ARG A 64 -9.468 -0.999 25.550 1.00 6.45 C ATOM 792 O ARG A 64 -9.766 -1.251 24.389 1.00 7.27 O ATOM 793 CB ARG A 64 -11.205 0.127 26.918 1.00 21.80 C ATOM 794 CG ARG A 64 -11.551 1.302 27.812 1.00 24.20 C ATOM 795 CD ARG A 64 -12.851 1.087 28.514 1.00 27.51 C ATOM 796 NE ARG A 64 -12.846 -0.019 29.463 1.00 25.03 N ATOM 797 CZ ARG A 64 -13.959 -0.409 30.073 1.00 21.59 C ATOM 798 NH1 ARG A 64 -15.074 0.236 29.779 1.00 28.00 N ATOM 799 NH2 ARG A 64 -13.965 -1.424 30.938 1.00 16.16 N ATOM 800 HA ARG A 64 -9.074 0.558 26.929 1.00 0.00 H ATOM 801 HB2 ARG A 64 -11.983 0.019 26.162 1.00 0.00 H ATOM 802 HB3 ARG A 64 -11.163 -0.777 27.526 1.00 0.00 H ATOM 803 HG2 ARG A 64 -10.763 1.427 28.555 1.00 0.00 H ATOM 804 HG3 ARG A 64 -11.621 2.203 27.203 1.00 0.00 H ATOM 805 HD2 ARG A 64 -13.616 0.889 27.763 1.00 0.00 H ATOM 806 HD3 ARG A 64 -13.102 2.000 29.055 1.00 0.00 H ATOM 807 HE ARG A 64 -11.953 -0.512 29.666 1.00 0.00 H ATOM 808 HH12 ARG A 64 -15.968 -0.037 30.234 1.00 0.00 H ATOM 809 HH11 ARG A 64 -15.057 1.017 29.092 1.00 0.00 H ATOM 810 HH22 ARG A 64 -14.852 -1.707 31.401 1.00 0.00 H ATOM 811 HH21 ARG A 64 -13.083 -1.932 31.150 1.00 0.00 H ATOM 812 H ARG A 64 -10.899 1.639 24.852 1.00 0.00 H ATOM 813 N TRP A 65 -8.808 -1.844 26.315 1.00 13.75 N ATOM 814 CA TRP A 65 -8.522 -3.218 25.905 1.00 12.35 C ATOM 815 C TRP A 65 -9.695 -4.131 26.191 1.00 11.40 C ATOM 816 O TRP A 65 -10.356 -3.939 27.245 1.00 13.82 O ATOM 817 CB TRP A 65 -7.323 -3.774 26.694 1.00 13.92 C ATOM 818 CG TRP A 65 -5.985 -3.200 26.340 1.00 12.99 C ATOM 819 CD1 TRP A 65 -5.302 -2.237 27.010 1.00 16.39 C ATOM 820 CD2 TRP A 65 -5.197 -3.580 25.232 1.00 17.01 C ATOM 821 NE1 TRP A 65 -4.087 -1.986 26.357 1.00 16.64 N ATOM 822 CE2 TRP A 65 -4.013 -2.815 25.274 1.00 16.67 C ATOM 823 CE3 TRP A 65 -5.381 -4.495 24.182 1.00 17.39 C ATOM 824 CZ2 TRP A 65 -3.007 -2.928 24.290 1.00 19.40 C ATOM 825 CZ3 TRP A 65 -4.378 -4.622 23.214 1.00 20.64 C ATOM 826 CH2 TRP A 65 -3.214 -3.817 23.267 1.00 20.54 C ATOM 827 HA TRP A 65 -8.313 -3.191 24.835 1.00 0.00 H ATOM 828 HB2 TRP A 65 -7.500 -3.581 27.752 1.00 0.00 H ATOM 829 HB3 TRP A 65 -7.281 -4.850 26.524 1.00 0.00 H ATOM 830 HE1 TRP A 65 -3.369 -1.291 26.646 1.00 0.00 H ATOM 831 HD1 TRP A 65 -5.645 -1.736 27.915 1.00 0.00 H ATOM 832 HZ2 TRP A 65 -2.098 -2.329 24.342 1.00 0.00 H ATOM 833 HH2 TRP A 65 -2.467 -3.906 22.478 1.00 0.00 H ATOM 834 HZ3 TRP A 65 -4.494 -5.349 22.410 1.00 0.00 H ATOM 835 HE3 TRP A 65 -6.289 -5.095 24.122 1.00 0.00 H ATOM 836 H TRP A 65 -8.477 -1.521 27.247 1.00 0.00 H ATOM 837 N THR A 66 -9.989 -5.104 25.341 1.00 10.07 N ATOM 838 CA THR A 66 -10.911 -6.157 25.702 1.00 10.47 C ATOM 839 C THR A 66 -10.244 -7.063 26.740 1.00 12.53 C ATOM 840 O THR A 66 -9.030 -7.040 26.945 1.00 12.68 O ATOM 841 CB THR A 66 -11.337 -6.993 24.486 1.00 10.87 C ATOM 842 OG1 THR A 66 -10.222 -7.800 24.025 1.00 11.48 O ATOM 843 CG2 THR A 66 -11.810 -6.091 23.312 1.00 12.80 C ATOM 844 HA THR A 66 -11.810 -5.697 26.112 1.00 0.00 H ATOM 845 HB THR A 66 -12.165 -7.628 24.800 1.00 0.00 H ATOM 846 HG1 THR A 66 -9.931 -8.406 24.752 1.00 0.00 H ATOM 847 HG23 THR A 66 -12.648 -5.477 23.642 1.00 0.00 H ATOM 848 HG21 THR A 66 -10.989 -5.447 22.996 1.00 0.00 H ATOM 849 HG22 THR A 66 -12.123 -6.718 22.477 1.00 0.00 H ATOM 850 H THR A 66 -9.549 -5.110 24.399 1.00 0.00 H ATOM 851 N THR A 67 -11.062 -7.888 27.379 1.00 13.06 N ATOM 852 CA THR A 67 -10.461 -9.025 28.109 1.00 12.95 C ATOM 853 C THR A 67 -9.984 -10.055 27.070 1.00 12.80 C ATOM 854 O THR A 67 -10.066 -9.850 25.857 1.00 12.18 O ATOM 855 CB THR A 67 -11.442 -9.606 29.120 1.00 14.11 C ATOM 856 OG1 THR A 67 -12.570 -10.093 28.421 1.00 15.22 O ATOM 857 CG2 THR A 67 -11.815 -8.516 30.145 1.00 18.59 C ATOM 858 HA THR A 67 -9.602 -8.698 28.695 1.00 0.00 H ATOM 859 HB THR A 67 -11.000 -10.436 29.671 1.00 0.00 H ATOM 860 HG1 THR A 67 -13.217 -10.474 29.066 1.00 0.00 H ATOM 861 HG23 THR A 67 -10.914 -8.175 30.655 1.00 0.00 H ATOM 862 HG21 THR A 67 -12.281 -7.677 29.628 1.00 0.00 H ATOM 863 HG22 THR A 67 -12.513 -8.928 30.874 1.00 0.00 H ATOM 864 H THR A 67 -12.091 -7.740 27.367 1.00 0.00 H ATOM 865 N ASP A 68 -9.476 -11.188 27.549 1.00 12.37 N ATOM 866 CA ASP A 68 -8.847 -12.175 26.658 1.00 12.38 C ATOM 867 C ASP A 68 -9.848 -12.965 25.842 1.00 11.84 C ATOM 868 O ASP A 68 -10.890 -13.367 26.388 1.00 13.09 O ATOM 869 CB ASP A 68 -8.077 -13.205 27.482 1.00 12.81 C ATOM 870 CG ASP A 68 -6.849 -12.647 28.192 1.00 15.90 C ATOM 871 OD1 ASP A 68 -6.375 -11.544 27.852 1.00 20.41 O ATOM 872 OD2 ASP A 68 -6.362 -13.301 29.125 1.00 15.37 O ATOM 873 HA ASP A 68 -8.205 -11.598 25.992 1.00 0.00 H ATOM 874 HB2 ASP A 68 -8.751 -13.614 28.235 1.00 0.00 H ATOM 875 HB3 ASP A 68 -7.753 -14.004 26.815 1.00 0.00 H ATOM 876 H ASP A 68 -9.525 -11.379 28.570 1.00 0.00 H ATOM 877 N ARG A 69 -9.545 -13.208 24.575 1.00 12.58 N ATOM 878 CA ARG A 69 -10.387 -13.946 23.669 1.00 11.81 C ATOM 879 C ARG A 69 -9.612 -15.097 23.104 1.00 12.99 C ATOM 880 O ARG A 69 -8.419 -14.979 22.836 1.00 13.42 O ATOM 881 CB ARG A 69 -10.767 -13.056 22.450 1.00 13.00 C ATOM 882 CG ARG A 69 -11.544 -11.800 22.805 1.00 13.94 C ATOM 883 CD ARG A 69 -13.000 -12.180 23.170 1.00 14.64 C ATOM 884 NE ARG A 69 -13.635 -10.971 23.673 1.00 14.27 N ATOM 885 CZ ARG A 69 -13.553 -10.546 24.908 1.00 13.93 C ATOM 886 NH1 ARG A 69 -12.982 -11.285 25.852 1.00 15.33 N ATOM 887 NH2 ARG A 69 -14.091 -9.384 25.214 1.00 15.30 N ATOM 888 HA ARG A 69 -11.271 -14.272 24.217 1.00 0.00 H ATOM 889 HB2 ARG A 69 -9.848 -12.757 21.947 1.00 0.00 H ATOM 890 HB3 ARG A 69 -11.375 -13.652 21.769 1.00 0.00 H ATOM 891 HG2 ARG A 69 -11.072 -11.309 23.656 1.00 0.00 H ATOM 892 HG3 ARG A 69 -11.548 -11.122 21.952 1.00 0.00 H ATOM 893 HD2 ARG A 69 -13.005 -12.954 23.937 1.00 0.00 H ATOM 894 HD3 ARG A 69 -13.527 -12.542 22.287 1.00 0.00 H ATOM 895 HE ARG A 69 -14.194 -10.404 23.003 1.00 0.00 H ATOM 896 HH12 ARG A 69 -12.926 -10.930 26.828 1.00 0.00 H ATOM 897 HH11 ARG A 69 -12.590 -12.219 25.615 1.00 0.00 H ATOM 898 HH22 ARG A 69 -14.038 -9.027 26.189 1.00 0.00 H ATOM 899 HH21 ARG A 69 -14.569 -8.823 24.480 1.00 0.00 H ATOM 900 H ARG A 69 -8.642 -12.843 24.212 1.00 0.00 H ATOM 901 N LYS A 70 -10.272 -16.218 22.843 1.00 13.01 N ATOM 902 CA LYS A 70 -9.651 -17.276 22.068 1.00 12.94 C ATOM 903 C LYS A 70 -9.765 -16.917 20.586 1.00 14.83 C ATOM 904 O LYS A 70 -10.846 -16.565 20.115 1.00 16.90 O ATOM 905 CB LYS A 70 -10.301 -18.643 22.377 1.00 16.37 C ATOM 906 CG LYS A 70 -9.777 -19.341 23.644 1.00 24.61 C ATOM 907 CD LYS A 70 -8.346 -19.925 23.301 1.00 29.25 C ATOM 908 CE LYS A 70 -7.320 -20.164 24.459 1.00 34.30 C ATOM 909 NZ LYS A 70 -5.784 -20.141 24.174 1.00 19.26 N ATOM 910 HA LYS A 70 -8.598 -17.366 22.336 1.00 0.00 H ATOM 911 HB2 LYS A 70 -11.374 -18.489 22.495 1.00 0.00 H ATOM 912 HB3 LYS A 70 -10.121 -19.303 21.528 1.00 0.00 H ATOM 913 HG2 LYS A 70 -9.702 -18.624 24.461 1.00 0.00 H ATOM 914 HG3 LYS A 70 -10.451 -20.148 23.931 1.00 0.00 H ATOM 915 HD2 LYS A 70 -8.503 -20.886 22.811 1.00 0.00 H ATOM 916 HD3 LYS A 70 -7.879 -19.233 22.600 1.00 0.00 H ATOM 917 HE2 LYS A 70 -7.545 -21.144 24.879 1.00 0.00 H ATOM 918 HE3 LYS A 70 -7.510 -19.396 25.209 1.00 0.00 H ATOM 919 HZ1 LYS A 70 -5.550 -20.879 23.480 1.00 0.00 H ATOM 920 HZ2 LYS A 70 -5.517 -19.210 23.795 1.00 0.00 H ATOM 921 HZ3 LYS A 70 -5.266 -20.318 25.058 1.00 0.00 H ATOM 922 H LYS A 70 -11.242 -16.339 23.197 1.00 0.00 H ATOM 923 N VAL A 71 -8.669 -16.998 19.861 1.00 11.48 N ATOM 924 CA VAL A 71 -8.608 -16.625 18.457 1.00 12.84 C ATOM 925 C VAL A 71 -8.166 -17.889 17.688 1.00 12.31 C ATOM 926 O VAL A 71 -7.059 -18.432 17.911 1.00 12.87 O ATOM 927 CB VAL A 71 -7.600 -15.463 18.235 1.00 12.11 C ATOM 928 CG1 VAL A 71 -7.532 -15.139 16.744 1.00 14.60 C ATOM 929 CG2 VAL A 71 -7.992 -14.242 19.048 1.00 14.40 C ATOM 930 HA VAL A 71 -9.576 -16.270 18.105 1.00 0.00 H ATOM 931 HB VAL A 71 -6.612 -15.771 18.577 1.00 0.00 H ATOM 932 HG11 VAL A 71 -7.202 -16.022 16.196 1.00 0.00 H ATOM 933 HG12 VAL A 71 -8.520 -14.841 16.393 1.00 0.00 H ATOM 934 HG13 VAL A 71 -6.826 -14.324 16.582 1.00 0.00 H ATOM 935 HG21 VAL A 71 -8.984 -13.908 18.745 1.00 0.00 H ATOM 936 HG22 VAL A 71 -8.002 -14.500 20.107 1.00 0.00 H ATOM 937 HG23 VAL A 71 -7.270 -13.444 18.874 1.00 0.00 H ATOM 938 H VAL A 71 -7.802 -17.347 20.316 1.00 0.00 H ATOM 939 N HIS A 72 -8.997 -18.325 16.756 1.00 12.73 N ATOM 940 CA HIS A 72 -8.745 -19.578 16.050 1.00 13.34 C ATOM 941 C HIS A 72 -7.917 -19.386 14.802 1.00 14.54 C ATOM 942 O HIS A 72 -8.451 -19.360 13.699 1.00 19.11 O ATOM 943 CB HIS A 72 -10.067 -20.293 15.727 1.00 17.36 C ATOM 944 CG HIS A 72 -10.859 -20.698 16.939 1.00 19.86 C ATOM 945 ND1 HIS A 72 -11.155 -22.015 17.232 1.00 27.53 N ATOM 946 CD2 HIS A 72 -11.409 -19.962 17.936 1.00 26.10 C ATOM 947 CE1 HIS A 72 -11.850 -22.067 18.354 1.00 25.65 C ATOM 948 NE2 HIS A 72 -12.002 -20.841 18.816 1.00 26.03 N ATOM 949 HA HIS A 72 -8.159 -20.208 16.719 1.00 0.00 H ATOM 950 HB2 HIS A 72 -10.681 -19.623 15.125 1.00 0.00 H ATOM 951 HB3 HIS A 72 -9.839 -21.190 15.151 1.00 0.00 H ATOM 952 HD2 HIS A 72 -11.386 -18.876 18.025 1.00 0.00 H ATOM 953 HE1 HIS A 72 -12.235 -22.974 18.821 1.00 0.00 H ATOM 954 H HIS A 72 -9.843 -17.767 16.522 1.00 0.00 H ATOM 955 N LEU A 73 -6.613 -19.264 14.969 1.00 14.69 N ATOM 956 CA LEU A 73 -5.709 -19.072 13.851 1.00 14.28 C ATOM 957 C LEU A 73 -5.435 -20.388 13.148 1.00 15.11 C ATOM 958 O LEU A 73 -5.451 -21.456 13.810 1.00 17.98 O ATOM 959 CB LEU A 73 -4.363 -18.522 14.343 1.00 15.86 C ATOM 960 CG LEU A 73 -4.389 -17.171 15.032 1.00 14.25 C ATOM 961 CD1 LEU A 73 -2.998 -16.782 15.367 1.00 15.93 C ATOM 962 CD2 LEU A 73 -4.985 -16.106 14.089 1.00 17.29 C ATOM 963 HA LEU A 73 -6.184 -18.371 13.165 1.00 0.00 H ATOM 964 HB2 LEU A 73 -3.948 -19.244 15.047 1.00 0.00 H ATOM 965 HB3 LEU A 73 -3.704 -18.439 13.479 1.00 0.00 H ATOM 966 HG LEU A 73 -4.999 -17.238 15.933 1.00 0.00 H ATOM 967 HD21 LEU A 73 -4.374 -16.037 13.189 1.00 0.00 H ATOM 968 HD22 LEU A 73 -6.002 -16.390 13.819 1.00 0.00 H ATOM 969 HD23 LEU A 73 -4.998 -15.141 14.595 1.00 0.00 H ATOM 970 HD11 LEU A 73 -2.563 -17.529 16.031 1.00 0.00 H ATOM 971 HD12 LEU A 73 -2.409 -16.721 14.452 1.00 0.00 H ATOM 972 HD13 LEU A 73 -3.003 -15.812 15.863 1.00 0.00 H ATOM 973 H LEU A 73 -6.222 -19.307 15.932 1.00 0.00 H ATOM 974 N ALA A 74 -5.115 -20.335 11.851 1.00 16.57 N ATOM 975 CA ALA A 74 -4.856 -21.561 11.100 1.00 20.36 C ATOM 976 C ALA A 74 -3.674 -22.321 11.680 1.00 19.94 C ATOM 977 O ALA A 74 -3.613 -23.557 11.572 1.00 22.85 O ATOM 978 CB ALA A 74 -4.611 -21.232 9.624 1.00 20.96 C ATOM 979 HA ALA A 74 -5.735 -22.201 11.178 1.00 0.00 H ATOM 980 HB1 ALA A 74 -5.491 -20.739 9.212 1.00 0.00 H ATOM 981 HB2 ALA A 74 -3.749 -20.571 9.539 1.00 0.00 H ATOM 982 HB3 ALA A 74 -4.419 -22.154 9.075 1.00 0.00 H ATOM 983 H ALA A 74 -5.050 -19.414 11.373 1.00 0.00 H ATOM 984 N THR A 75 -2.743 -21.595 12.300 1.00 16.02 N ATOM 985 CA THR A 75 -1.537 -22.149 12.915 1.00 15.74 C ATOM 986 C THR A 75 -1.792 -22.706 14.325 1.00 17.03 C ATOM 987 O THR A 75 -0.869 -23.246 14.959 1.00 17.00 O ATOM 988 CB THR A 75 -0.431 -21.087 13.016 1.00 14.37 C ATOM 989 OG1 THR A 75 -1.040 -19.849 13.439 1.00 15.12 O ATOM 990 CG2 THR A 75 0.180 -20.821 11.652 1.00 18.10 C ATOM 991 HA THR A 75 -1.224 -22.966 12.265 1.00 0.00 H ATOM 992 HB THR A 75 0.333 -21.440 13.709 1.00 0.00 H ATOM 993 HG1 THR A 75 -1.472 -19.979 14.320 1.00 0.00 H ATOM 994 HG23 THR A 75 0.656 -21.730 11.285 1.00 0.00 H ATOM 995 HG21 THR A 75 -0.603 -20.514 10.958 1.00 0.00 H ATOM 996 HG22 THR A 75 0.924 -20.029 11.737 1.00 0.00 H ATOM 997 H THR A 75 -2.884 -20.566 12.350 1.00 0.00 H ATOM 998 N GLY A 76 -3.013 -22.509 14.811 1.00 14.40 N ATOM 999 CA GLY A 76 -3.425 -23.023 16.121 1.00 15.49 C ATOM 1000 C GLY A 76 -4.064 -21.941 16.965 1.00 13.46 C ATOM 1001 O GLY A 76 -3.685 -20.751 16.889 1.00 15.19 O ATOM 1002 HA3 GLY A 76 -2.549 -23.408 16.642 1.00 0.00 H ATOM 1003 HA2 GLY A 76 -4.143 -23.830 15.975 1.00 0.00 H ATOM 1004 H GLY A 76 -3.699 -21.972 14.243 1.00 0.00 H ATOM 1005 N LYS A 77 -5.011 -22.321 17.791 1.00 12.89 N ATOM 1006 CA LYS A 77 -5.719 -21.380 18.632 1.00 13.48 C ATOM 1007 C LYS A 77 -4.812 -20.786 19.690 1.00 12.73 C ATOM 1008 O LYS A 77 -3.977 -21.470 20.251 1.00 12.13 O ATOM 1009 CB LYS A 77 -6.833 -22.168 19.339 1.00 18.99 C ATOM 1010 CG LYS A 77 -7.834 -21.389 20.099 1.00 24.30 C ATOM 1011 CD LYS A 77 -9.063 -22.299 20.380 1.00 28.81 C ATOM 1012 CE LYS A 77 -8.762 -23.610 21.110 1.00 29.46 C ATOM 1013 NZ LYS A 77 -10.053 -24.308 21.531 1.00 31.57 N ATOM 1014 HA LYS A 77 -6.104 -20.564 18.021 1.00 0.00 H ATOM 1015 HB2 LYS A 77 -7.368 -22.735 18.577 1.00 0.00 H ATOM 1016 HB3 LYS A 77 -6.356 -22.858 20.036 1.00 0.00 H ATOM 1017 HG2 LYS A 77 -7.401 -21.055 21.042 1.00 0.00 H ATOM 1018 HG3 LYS A 77 -8.145 -20.522 19.516 1.00 0.00 H ATOM 1019 HD2 LYS A 77 -9.769 -21.732 20.986 1.00 0.00 H ATOM 1020 HD3 LYS A 77 -9.524 -22.546 19.423 1.00 0.00 H ATOM 1021 HE2 LYS A 77 -8.166 -23.396 21.997 1.00 0.00 H ATOM 1022 HE3 LYS A 77 -8.200 -24.268 20.446 1.00 0.00 H ATOM 1023 HZ1 LYS A 77 -10.590 -23.686 22.168 1.00 0.00 H ATOM 1024 HZ2 LYS A 77 -10.623 -24.518 20.687 1.00 0.00 H ATOM 1025 HZ3 LYS A 77 -9.822 -25.194 22.024 1.00 0.00 H ATOM 1026 H LYS A 77 -5.260 -23.329 17.843 1.00 0.00 H ATOM 1027 N VAL A 78 -4.967 -19.489 19.945 1.00 11.50 N ATOM 1028 CA VAL A 78 -4.208 -18.756 20.971 1.00 11.66 C ATOM 1029 C VAL A 78 -5.172 -17.803 21.680 1.00 11.88 C ATOM 1030 O VAL A 78 -6.281 -17.566 21.201 1.00 12.83 O ATOM 1031 CB VAL A 78 -3.016 -17.928 20.373 1.00 10.76 C ATOM 1032 CG1 VAL A 78 -1.974 -18.831 19.705 1.00 14.80 C ATOM 1033 CG2 VAL A 78 -3.483 -16.873 19.382 1.00 14.58 C ATOM 1034 HA VAL A 78 -3.776 -19.485 21.657 1.00 0.00 H ATOM 1035 HB VAL A 78 -2.553 -17.421 21.220 1.00 0.00 H ATOM 1036 HG11 VAL A 78 -1.572 -19.527 20.442 1.00 0.00 H ATOM 1037 HG12 VAL A 78 -2.444 -19.389 18.895 1.00 0.00 H ATOM 1038 HG13 VAL A 78 -1.167 -18.218 19.305 1.00 0.00 H ATOM 1039 HG21 VAL A 78 -4.005 -17.357 18.557 1.00 0.00 H ATOM 1040 HG22 VAL A 78 -4.158 -16.179 19.883 1.00 0.00 H ATOM 1041 HG23 VAL A 78 -2.620 -16.329 18.998 1.00 0.00 H ATOM 1042 H VAL A 78 -5.667 -18.961 19.385 1.00 0.00 H ATOM 1043 N THR A 79 -4.740 -17.258 22.799 1.00 11.50 N ATOM 1044 CA THR A 79 -5.458 -16.191 23.505 1.00 10.57 C ATOM 1045 C THR A 79 -4.894 -14.836 23.074 1.00 12.09 C ATOM 1046 O THR A 79 -3.687 -14.676 22.963 1.00 13.65 O ATOM 1047 CB THR A 79 -5.242 -16.333 24.982 1.00 12.89 C ATOM 1048 OG1 THR A 79 -5.778 -17.602 25.351 1.00 13.85 O ATOM 1049 CG2 THR A 79 -5.981 -15.214 25.741 1.00 14.27 C ATOM 1050 HA THR A 79 -6.520 -16.259 23.270 1.00 0.00 H ATOM 1051 HB THR A 79 -4.183 -16.260 25.230 1.00 0.00 H ATOM 1052 HG1 THR A 79 -5.657 -17.740 26.324 1.00 0.00 H ATOM 1053 HG23 THR A 79 -5.567 -14.247 25.454 1.00 0.00 H ATOM 1054 HG21 THR A 79 -7.041 -15.245 25.490 1.00 0.00 H ATOM 1055 HG22 THR A 79 -5.856 -15.361 26.814 1.00 0.00 H ATOM 1056 H THR A 79 -3.845 -17.601 23.202 1.00 0.00 H ATOM 1057 N HIS A 80 -5.781 -13.870 22.815 1.00 11.88 N ATOM 1058 CA HIS A 80 -5.354 -12.512 22.474 1.00 12.40 C ATOM 1059 C HIS A 80 -6.338 -11.510 23.004 1.00 12.16 C ATOM 1060 O HIS A 80 -7.536 -11.800 23.111 1.00 13.42 O ATOM 1061 CB HIS A 80 -5.254 -12.451 20.946 1.00 12.55 C ATOM 1062 CG HIS A 80 -4.407 -11.338 20.451 1.00 16.42 C ATOM 1063 ND1 HIS A 80 -3.037 -11.376 20.548 1.00 17.81 N ATOM 1064 CD2 HIS A 80 -4.733 -10.137 19.919 1.00 17.33 C ATOM 1065 CE1 HIS A 80 -2.543 -10.241 20.057 1.00 18.01 C ATOM 1066 NE2 HIS A 80 -3.550 -9.480 19.678 1.00 16.44 N ATOM 1067 HA HIS A 80 -4.390 -12.271 22.923 1.00 0.00 H ATOM 1068 HB2 HIS A 80 -4.832 -13.391 20.590 1.00 0.00 H ATOM 1069 HB3 HIS A 80 -6.258 -12.328 20.539 1.00 0.00 H ATOM 1070 HD2 HIS A 80 -5.738 -9.764 19.720 1.00 0.00 H ATOM 1071 HE1 HIS A 80 -1.486 -9.985 19.981 1.00 0.00 H ATOM 1072 H HIS A 80 -6.797 -14.088 22.857 1.00 0.00 H ATOM 1073 N SER A 81 -5.852 -10.335 23.342 1.00 13.21 N ATOM 1074 CA SER A 81 -6.721 -9.201 23.724 1.00 12.95 C ATOM 1075 C SER A 81 -6.610 -8.136 22.638 1.00 11.94 C ATOM 1076 O SER A 81 -5.577 -7.967 22.005 1.00 14.36 O ATOM 1077 CB SER A 81 -6.336 -8.659 25.086 1.00 14.79 C ATOM 1078 OG SER A 81 -5.015 -8.298 25.120 1.00 10.11 O ATOM 1079 HA SER A 81 -7.757 -9.529 23.805 1.00 0.00 H ATOM 1080 HB2 SER A 81 -6.514 -9.427 25.838 1.00 0.00 H ATOM 1081 HB3 SER A 81 -6.949 -7.786 25.308 1.00 0.00 H ATOM 1082 HG SER A 81 -4.793 -7.949 26.019 1.00 0.00 H ATOM 1083 H SER A 81 -4.821 -10.199 23.340 1.00 0.00 H ATOM 1084 N PHE A 82 -7.703 -7.459 22.408 1.00 10.11 N ATOM 1085 CA PHE A 82 -7.850 -6.477 21.325 1.00 10.06 C ATOM 1086 C PHE A 82 -8.067 -5.094 21.847 1.00 12.53 C ATOM 1087 O PHE A 82 -8.658 -4.914 22.921 1.00 12.57 O ATOM 1088 CB PHE A 82 -9.052 -6.860 20.455 1.00 10.36 C ATOM 1089 CG PHE A 82 -8.863 -8.158 19.706 1.00 9.56 C ATOM 1090 CD1 PHE A 82 -8.472 -8.158 18.393 1.00 10.04 C ATOM 1091 CD2 PHE A 82 -9.080 -9.380 20.335 1.00 11.51 C ATOM 1092 CE1 PHE A 82 -8.275 -9.380 17.656 1.00 10.60 C ATOM 1093 CE2 PHE A 82 -8.887 -10.575 19.652 1.00 12.32 C ATOM 1094 CZ PHE A 82 -8.487 -10.596 18.308 1.00 11.18 C ATOM 1095 HA PHE A 82 -6.926 -6.485 20.747 1.00 0.00 H ATOM 1096 HB2 PHE A 82 -9.927 -6.956 21.098 1.00 0.00 H ATOM 1097 HB3 PHE A 82 -9.221 -6.064 19.730 1.00 0.00 H ATOM 1098 HD2 PHE A 82 -9.405 -9.400 21.375 1.00 0.00 H ATOM 1099 HE2 PHE A 82 -9.050 -11.518 20.173 1.00 0.00 H ATOM 1100 HZ PHE A 82 -8.345 -11.541 17.784 1.00 0.00 H ATOM 1101 HE1 PHE A 82 -7.967 -9.356 16.611 1.00 0.00 H ATOM 1102 HD1 PHE A 82 -8.305 -7.205 17.891 1.00 0.00 H ATOM 1103 H PHE A 82 -8.520 -7.625 23.030 1.00 0.00 H ATOM 1104 N LEU A 83 -7.690 -4.085 21.075 1.00 10.40 N ATOM 1105 CA LEU A 83 -8.141 -2.719 21.364 1.00 11.34 C ATOM 1106 C LEU A 83 -9.561 -2.577 20.869 1.00 10.57 C ATOM 1107 O LEU A 83 -9.871 -2.977 19.752 1.00 10.47 O ATOM 1108 CB LEU A 83 -7.237 -1.726 20.638 1.00 10.93 C ATOM 1109 CG LEU A 83 -5.799 -1.687 21.130 1.00 16.07 C ATOM 1110 CD1 LEU A 83 -4.923 -1.000 20.084 1.00 17.70 C ATOM 1111 CD2 LEU A 83 -5.684 -0.987 22.501 1.00 18.08 C ATOM 1112 HA LEU A 83 -8.098 -2.519 22.435 1.00 0.00 H ATOM 1113 HB2 LEU A 83 -7.226 -1.989 19.580 1.00 0.00 H ATOM 1114 HB3 LEU A 83 -7.663 -0.730 20.759 1.00 0.00 H ATOM 1115 HG LEU A 83 -5.452 -2.711 21.270 1.00 0.00 H ATOM 1116 HD21 LEU A 83 -6.046 0.038 22.416 1.00 0.00 H ATOM 1117 HD22 LEU A 83 -6.284 -1.526 23.234 1.00 0.00 H ATOM 1118 HD23 LEU A 83 -4.641 -0.980 22.818 1.00 0.00 H ATOM 1119 HD11 LEU A 83 -4.973 -1.556 19.148 1.00 0.00 H ATOM 1120 HD12 LEU A 83 -5.281 0.017 19.923 1.00 0.00 H ATOM 1121 HD13 LEU A 83 -3.892 -0.972 20.437 1.00 0.00 H ATOM 1122 H LEU A 83 -7.070 -4.263 20.259 1.00 0.00 H ATOM 1123 N HIS A 84 -10.435 -1.980 21.691 1.00 10.49 N ATOM 1124 CA HIS A 84 -11.783 -1.666 21.225 1.00 10.60 C ATOM 1125 C HIS A 84 -11.790 -0.227 20.724 1.00 11.44 C ATOM 1126 O HIS A 84 -11.708 0.713 21.506 1.00 12.19 O ATOM 1127 CB HIS A 84 -12.788 -1.809 22.375 1.00 13.16 C ATOM 1128 CG HIS A 84 -14.171 -1.460 21.984 1.00 12.11 C ATOM 1129 ND1 HIS A 84 -15.039 -0.768 22.822 1.00 16.51 N ATOM 1130 CD2 HIS A 84 -14.837 -1.698 20.847 1.00 12.58 C ATOM 1131 CE1 HIS A 84 -16.189 -0.609 22.192 1.00 15.77 C ATOM 1132 NE2 HIS A 84 -16.094 -1.146 20.986 1.00 16.61 N ATOM 1133 HA HIS A 84 -12.067 -2.352 20.427 1.00 0.00 H ATOM 1134 HB2 HIS A 84 -12.775 -2.843 22.721 1.00 0.00 H ATOM 1135 HB3 HIS A 84 -12.481 -1.152 23.188 1.00 0.00 H ATOM 1136 HD2 HIS A 84 -14.457 -2.229 19.974 1.00 0.00 H ATOM 1137 HE1 HIS A 84 -17.072 -0.116 22.599 1.00 0.00 H ATOM 1138 H HIS A 84 -10.153 -1.740 22.663 1.00 0.00 H ATOM 1139 N VAL A 85 -11.903 -0.106 19.406 1.00 11.54 N ATOM 1140 CA VAL A 85 -11.809 1.214 18.769 1.00 12.93 C ATOM 1141 C VAL A 85 -13.081 1.426 17.984 1.00 14.93 C ATOM 1142 O VAL A 85 -13.146 1.158 16.801 1.00 14.73 O ATOM 1143 CB VAL A 85 -10.530 1.360 17.912 1.00 11.59 C ATOM 1144 CG1 VAL A 85 -10.394 2.826 17.411 1.00 13.24 C ATOM 1145 CG2 VAL A 85 -9.277 0.989 18.708 1.00 13.55 C ATOM 1146 HA VAL A 85 -11.715 1.996 19.523 1.00 0.00 H ATOM 1147 HB VAL A 85 -10.619 0.679 17.066 1.00 0.00 H ATOM 1148 HG11 VAL A 85 -11.264 3.084 16.807 1.00 0.00 H ATOM 1149 HG12 VAL A 85 -10.332 3.497 18.268 1.00 0.00 H ATOM 1150 HG13 VAL A 85 -9.491 2.920 16.808 1.00 0.00 H ATOM 1151 HG21 VAL A 85 -9.190 1.646 19.574 1.00 0.00 H ATOM 1152 HG22 VAL A 85 -9.353 -0.046 19.042 1.00 0.00 H ATOM 1153 HG23 VAL A 85 -8.398 1.104 18.074 1.00 0.00 H ATOM 1154 H VAL A 85 -12.059 -0.952 18.821 1.00 0.00 H ATOM 1155 N PRO A 86 -14.142 1.888 18.649 1.00 15.45 N ATOM 1156 CA PRO A 86 -15.395 2.041 17.932 1.00 20.21 C ATOM 1157 C PRO A 86 -15.342 3.147 16.843 1.00 17.42 C ATOM 1158 O PRO A 86 -16.214 3.162 15.978 1.00 21.98 O ATOM 1159 CB PRO A 86 -16.408 2.372 19.044 1.00 21.33 C ATOM 1160 CG PRO A 86 -15.618 2.862 20.154 1.00 20.91 C ATOM 1161 CD PRO A 86 -14.237 2.270 20.066 1.00 14.82 C ATOM 1162 HA PRO A 86 -15.656 1.144 17.370 1.00 0.00 H ATOM 1163 HD3 PRO A 86 -13.476 3.005 20.328 1.00 0.00 H ATOM 1164 HD2 PRO A 86 -14.139 1.400 20.716 1.00 0.00 H ATOM 1165 HG3 PRO A 86 -16.084 2.567 21.094 1.00 0.00 H ATOM 1166 HG2 PRO A 86 -15.554 3.949 20.107 1.00 0.00 H ATOM 1167 HB2 PRO A 86 -17.108 3.137 18.707 1.00 0.00 H ATOM 1168 HB3 PRO A 86 -16.961 1.479 19.335 1.00 0.00 H ATOM 1169 N ASP A 87 -14.318 4.014 16.845 1.00 16.89 N ATOM 1170 CA ASP A 87 -14.160 5.002 15.771 1.00 17.79 C ATOM 1171 C ASP A 87 -13.684 4.421 14.448 1.00 22.05 C ATOM 1172 O ASP A 87 -13.684 5.112 13.426 1.00 22.61 O ATOM 1173 CB ASP A 87 -13.195 6.073 16.225 1.00 19.51 C ATOM 1174 CG ASP A 87 -13.728 6.873 17.422 1.00 22.70 C ATOM 1175 OD1 ASP A 87 -14.900 7.318 17.350 1.00 30.22 O ATOM 1176 OD2 ASP A 87 -13.016 7.069 18.434 1.00 21.49 O ATOM 1177 HA ASP A 87 -15.153 5.410 15.580 1.00 0.00 H ATOM 1178 HB2 ASP A 87 -12.256 5.600 16.511 1.00 0.00 H ATOM 1179 HB3 ASP A 87 -13.018 6.759 15.396 1.00 0.00 H ATOM 1180 H ASP A 87 -13.625 3.986 17.620 1.00 0.00 H ATOM 1181 N CYS A 88 -13.199 3.180 14.475 1.00 18.18 N ATOM 1182 CA CYS A 88 -12.793 2.451 13.274 1.00 22.97 C ATOM 1183 C CYS A 88 -13.984 1.736 12.605 1.00 17.11 C ATOM 1184 O CYS A 88 -14.822 1.207 13.278 1.00 22.70 O ATOM 1185 CB CYS A 88 -11.830 1.387 13.782 1.00 18.61 C ATOM 1186 SG CYS A 88 -10.607 0.912 12.573 1.00 18.45 S ATOM 1187 HA CYS A 88 -12.366 3.130 12.536 1.00 0.00 H ATOM 1188 HB2 CYS A 88 -12.405 0.503 14.060 1.00 0.00 H ATOM 1189 HB3 CYS A 88 -11.316 1.776 14.661 1.00 0.00 H ATOM 1190 HG CYS A 88 -9.779 -0.051 13.113 1.00 0.00 H ATOM 1191 H CYS A 88 -13.105 2.706 15.396 1.00 0.00 H ATOM 1192 N PRO A 89 -14.059 1.686 11.236 1.00 20.72 N ATOM 1193 CA PRO A 89 -15.225 1.146 10.486 1.00 21.26 C ATOM 1194 C PRO A 89 -15.279 -0.368 10.393 1.00 21.15 C ATOM 1195 O PRO A 89 -16.313 -0.956 10.052 1.00 25.62 O ATOM 1196 CB PRO A 89 -15.050 1.729 9.076 1.00 22.65 C ATOM 1197 CG PRO A 89 -13.598 2.061 8.999 1.00 23.39 C ATOM 1198 CD PRO A 89 -13.120 2.389 10.367 1.00 22.71 C ATOM 1199 HA PRO A 89 -16.149 1.419 10.995 1.00 0.00 H ATOM 1200 HD3 PRO A 89 -12.103 2.029 10.521 1.00 0.00 H ATOM 1201 HD2 PRO A 89 -13.155 3.464 10.545 1.00 0.00 H ATOM 1202 HG3 PRO A 89 -13.450 2.918 8.342 1.00 0.00 H ATOM 1203 HG2 PRO A 89 -13.045 1.206 8.610 1.00 0.00 H ATOM 1204 HB2 PRO A 89 -15.321 0.995 8.317 1.00 0.00 H ATOM 1205 HB3 PRO A 89 -15.659 2.624 8.948 1.00 0.00 H ATOM 1206 N TYR A 90 -14.150 -1.021 10.698 1.00 22.72 N ATOM 1207 CA TYR A 90 -14.100 -2.475 10.711 1.00 19.36 C ATOM 1208 C TYR A 90 -12.851 -2.920 11.505 1.00 12.75 C ATOM 1209 O TYR A 90 -11.911 -2.162 11.742 1.00 15.24 O ATOM 1210 CB TYR A 90 -14.094 -3.084 9.283 1.00 19.58 C ATOM 1211 CG TYR A 90 -13.305 -2.239 8.299 1.00 20.41 C ATOM 1212 CD1 TYR A 90 -13.939 -1.619 7.222 1.00 16.00 C ATOM 1213 CD2 TYR A 90 -11.943 -2.049 8.468 1.00 18.87 C ATOM 1214 CE1 TYR A 90 -13.207 -0.819 6.308 1.00 20.68 C ATOM 1215 CE2 TYR A 90 -11.199 -1.259 7.566 1.00 22.28 C ATOM 1216 CZ TYR A 90 -11.840 -0.640 6.515 1.00 20.62 C ATOM 1217 OH TYR A 90 -11.123 0.118 5.597 1.00 18.99 O ATOM 1218 HA TYR A 90 -15.004 -2.846 11.194 1.00 0.00 H ATOM 1219 HB3 TYR A 90 -15.123 -3.163 8.931 1.00 0.00 H ATOM 1220 HB2 TYR A 90 -13.649 -4.078 9.327 1.00 0.00 H ATOM 1221 HD2 TYR A 90 -11.437 -2.518 9.312 1.00 0.00 H ATOM 1222 HE2 TYR A 90 -10.124 -1.139 7.700 1.00 0.00 H ATOM 1223 HE1 TYR A 90 -13.705 -0.352 5.458 1.00 0.00 H ATOM 1224 HD1 TYR A 90 -15.012 -1.751 7.081 1.00 0.00 H ATOM 1225 HH TYR A 90 -11.743 0.484 4.917 1.00 0.00 H ATOM 1226 H TYR A 90 -13.293 -0.479 10.930 1.00 0.00 H ATOM 1227 N PRO A 91 -12.944 -4.163 11.942 1.00 14.29 N ATOM 1228 CA PRO A 91 -11.863 -4.736 12.718 1.00 13.18 C ATOM 1229 C PRO A 91 -10.558 -4.831 11.919 1.00 10.67 C ATOM 1230 O PRO A 91 -10.569 -4.940 10.683 1.00 11.37 O ATOM 1231 CB PRO A 91 -12.401 -6.120 13.045 1.00 13.76 C ATOM 1232 CG PRO A 91 -13.911 -6.055 12.902 1.00 20.17 C ATOM 1233 CD PRO A 91 -14.073 -5.115 11.793 1.00 14.64 C ATOM 1234 HA PRO A 91 -11.605 -4.137 13.592 1.00 0.00 H ATOM 1235 HD3 PRO A 91 -14.015 -5.634 10.836 1.00 0.00 H ATOM 1236 HD2 PRO A 91 -15.028 -4.595 11.866 1.00 0.00 H ATOM 1237 HG3 PRO A 91 -14.379 -5.679 13.812 1.00 0.00 H ATOM 1238 HG2 PRO A 91 -14.328 -7.032 12.657 1.00 0.00 H ATOM 1239 HB2 PRO A 91 -11.990 -6.855 12.352 1.00 0.00 H ATOM 1240 HB3 PRO A 91 -12.133 -6.395 14.065 1.00 0.00 H ATOM 1241 N LEU A 92 -9.444 -4.751 12.648 1.00 9.52 N ATOM 1242 CA LEU A 92 -8.121 -4.756 12.036 1.00 9.84 C ATOM 1243 C LEU A 92 -7.314 -5.882 12.628 1.00 9.94 C ATOM 1244 O LEU A 92 -7.176 -6.013 13.839 1.00 10.17 O ATOM 1245 CB LEU A 92 -7.377 -3.429 12.318 1.00 10.34 C ATOM 1246 CG LEU A 92 -8.169 -2.158 11.956 1.00 10.87 C ATOM 1247 CD1 LEU A 92 -7.358 -0.973 12.436 1.00 12.68 C ATOM 1248 CD2 LEU A 92 -8.482 -2.036 10.479 1.00 13.54 C ATOM 1249 HA LEU A 92 -8.239 -4.879 10.959 1.00 0.00 H ATOM 1250 HB2 LEU A 92 -7.141 -3.391 13.381 1.00 0.00 H ATOM 1251 HB3 LEU A 92 -6.452 -3.429 11.742 1.00 0.00 H ATOM 1252 HG LEU A 92 -9.142 -2.202 12.445 1.00 0.00 H ATOM 1253 HD21 LEU A 92 -7.551 -2.012 9.912 1.00 0.00 H ATOM 1254 HD22 LEU A 92 -9.079 -2.892 10.163 1.00 0.00 H ATOM 1255 HD23 LEU A 92 -9.041 -1.117 10.302 1.00 0.00 H ATOM 1256 HD11 LEU A 92 -7.217 -1.044 13.515 1.00 0.00 H ATOM 1257 HD12 LEU A 92 -6.387 -0.974 11.941 1.00 0.00 H ATOM 1258 HD13 LEU A 92 -7.888 -0.051 12.197 1.00 0.00 H ATOM 1259 H LEU A 92 -9.521 -4.683 13.683 1.00 0.00 H ATOM 1260 N LEU A 93 -6.748 -6.684 11.715 1.00 11.81 N ATOM 1261 CA LEU A 93 -5.828 -7.749 12.119 1.00 11.88 C ATOM 1262 C LEU A 93 -4.427 -7.227 11.914 1.00 10.99 C ATOM 1263 O LEU A 93 -3.949 -7.087 10.780 1.00 12.28 O ATOM 1264 CB LEU A 93 -6.097 -9.059 11.344 1.00 13.41 C ATOM 1265 CG LEU A 93 -5.341 -10.263 11.905 1.00 12.34 C ATOM 1266 CD1 LEU A 93 -6.015 -10.683 13.165 1.00 16.87 C ATOM 1267 CD2 LEU A 93 -5.368 -11.394 10.876 1.00 17.44 C ATOM 1268 HA LEU A 93 -5.973 -8.008 13.168 1.00 0.00 H ATOM 1269 HB2 LEU A 93 -7.165 -9.272 11.385 1.00 0.00 H ATOM 1270 HB3 LEU A 93 -5.796 -8.915 10.306 1.00 0.00 H ATOM 1271 HG LEU A 93 -4.301 -10.011 12.114 1.00 0.00 H ATOM 1272 HD21 LEU A 93 -6.402 -11.672 10.671 1.00 0.00 H ATOM 1273 HD22 LEU A 93 -4.891 -11.057 9.955 1.00 0.00 H ATOM 1274 HD23 LEU A 93 -4.830 -12.256 11.271 1.00 0.00 H ATOM 1275 HD11 LEU A 93 -5.995 -9.859 13.878 1.00 0.00 H ATOM 1276 HD12 LEU A 93 -7.049 -10.954 12.950 1.00 0.00 H ATOM 1277 HD13 LEU A 93 -5.493 -11.543 13.586 1.00 0.00 H ATOM 1278 H LEU A 93 -6.965 -6.548 10.707 1.00 0.00 H ATOM 1279 N GLY A 94 -3.770 -6.923 13.040 1.00 9.80 N ATOM 1280 CA GLY A 94 -2.469 -6.221 12.955 1.00 10.37 C ATOM 1281 C GLY A 94 -1.265 -7.136 13.102 1.00 10.45 C ATOM 1282 O GLY A 94 -1.383 -8.371 13.097 1.00 11.48 O ATOM 1283 HA3 GLY A 94 -2.430 -5.472 13.746 1.00 0.00 H ATOM 1284 HA2 GLY A 94 -2.408 -5.726 11.986 1.00 0.00 H ATOM 1285 H GLY A 94 -4.170 -7.177 13.966 1.00 0.00 H ATOM 1286 N ARG A 95 -0.092 -6.532 13.197 1.00 9.47 N ATOM 1287 CA ARG A 95 1.167 -7.263 13.180 1.00 10.57 C ATOM 1288 C ARG A 95 1.277 -8.200 14.354 1.00 10.61 C ATOM 1289 O ARG A 95 1.982 -9.218 14.224 1.00 12.70 O ATOM 1290 CB ARG A 95 2.348 -6.264 13.163 1.00 10.65 C ATOM 1291 CG ARG A 95 2.372 -5.402 11.894 1.00 10.53 C ATOM 1292 CD ARG A 95 3.713 -4.621 11.820 1.00 12.42 C ATOM 1293 NE ARG A 95 3.947 -3.701 12.935 1.00 13.55 N ATOM 1294 CZ ARG A 95 3.561 -2.437 12.975 1.00 14.30 C ATOM 1295 NH1 ARG A 95 2.840 -1.905 12.001 1.00 13.36 N ATOM 1296 NH2 ARG A 95 3.873 -1.695 14.054 1.00 16.41 N ATOM 1297 HA ARG A 95 1.200 -7.872 12.276 1.00 0.00 H ATOM 1298 HB2 ARG A 95 2.264 -5.608 14.030 1.00 0.00 H ATOM 1299 HB3 ARG A 95 3.281 -6.825 13.223 1.00 0.00 H ATOM 1300 HG2 ARG A 95 2.276 -6.043 11.018 1.00 0.00 H ATOM 1301 HG3 ARG A 95 1.542 -4.696 11.919 1.00 0.00 H ATOM 1302 HD2 ARG A 95 3.719 -4.043 10.896 1.00 0.00 H ATOM 1303 HD3 ARG A 95 4.527 -5.345 11.800 1.00 0.00 H ATOM 1304 HE ARG A 95 4.458 -4.072 13.762 1.00 0.00 H ATOM 1305 HH12 ARG A 95 2.548 -0.908 12.055 1.00 0.00 H ATOM 1306 HH11 ARG A 95 2.565 -2.484 11.182 1.00 0.00 H ATOM 1307 HH22 ARG A 95 3.578 -0.699 14.103 1.00 0.00 H ATOM 1308 HH21 ARG A 95 4.409 -2.118 14.838 1.00 0.00 H ATOM 1309 H ARG A 95 -0.068 -5.496 13.287 1.00 0.00 H ATOM 1310 N ASP A 96 0.644 -7.889 15.480 1.00 10.36 N ATOM 1311 CA ASP A 96 0.647 -8.763 16.664 1.00 12.50 C ATOM 1312 C ASP A 96 0.110 -10.136 16.349 1.00 14.53 C ATOM 1313 O ASP A 96 0.732 -11.139 16.768 1.00 18.72 O ATOM 1314 CB ASP A 96 -0.165 -8.121 17.784 1.00 12.89 C ATOM 1315 CG ASP A 96 -1.592 -7.734 17.400 1.00 10.84 C ATOM 1316 OD1 ASP A 96 -1.952 -7.682 16.216 1.00 12.16 O ATOM 1317 OD2 ASP A 96 -2.336 -7.421 18.348 1.00 13.64 O ATOM 1318 HA ASP A 96 1.681 -8.884 16.988 1.00 0.00 H ATOM 1319 HB2 ASP A 96 -0.216 -8.826 18.613 1.00 0.00 H ATOM 1320 HB3 ASP A 96 0.356 -7.220 18.107 1.00 0.00 H ATOM 1321 H ASP A 96 0.124 -6.989 15.527 1.00 0.00 H ATOM 1322 N LEU A 97 -0.965 -10.232 15.566 1.00 11.21 N ATOM 1323 CA LEU A 97 -1.485 -11.533 15.183 1.00 11.20 C ATOM 1324 C LEU A 97 -0.963 -12.036 13.869 1.00 12.10 C ATOM 1325 O LEU A 97 -0.841 -13.258 13.700 1.00 13.45 O ATOM 1326 CB LEU A 97 -3.015 -11.506 15.207 1.00 13.33 C ATOM 1327 CG LEU A 97 -3.668 -11.598 16.583 1.00 12.55 C ATOM 1328 CD1 LEU A 97 -5.185 -11.335 16.508 1.00 16.01 C ATOM 1329 CD2 LEU A 97 -3.441 -12.977 17.186 1.00 15.11 C ATOM 1330 HA LEU A 97 -1.121 -12.248 15.921 1.00 0.00 H ATOM 1331 HB2 LEU A 97 -3.339 -10.573 14.746 1.00 0.00 H ATOM 1332 HB3 LEU A 97 -3.372 -12.346 14.612 1.00 0.00 H ATOM 1333 HG LEU A 97 -3.208 -10.834 17.210 1.00 0.00 H ATOM 1334 HD21 LEU A 97 -3.877 -13.734 16.534 1.00 0.00 H ATOM 1335 HD22 LEU A 97 -2.371 -13.156 17.287 1.00 0.00 H ATOM 1336 HD23 LEU A 97 -3.913 -13.025 18.167 1.00 0.00 H ATOM 1337 HD11 LEU A 97 -5.360 -10.336 16.109 1.00 0.00 H ATOM 1338 HD12 LEU A 97 -5.649 -12.075 15.855 1.00 0.00 H ATOM 1339 HD13 LEU A 97 -5.615 -11.409 17.507 1.00 0.00 H ATOM 1340 H LEU A 97 -1.435 -9.368 15.227 1.00 0.00 H ATOM 1341 N LEU A 98 -0.559 -11.181 12.927 1.00 12.04 N ATOM 1342 CA LEU A 98 0.062 -11.658 11.703 1.00 12.38 C ATOM 1343 C LEU A 98 1.382 -12.371 11.963 1.00 11.98 C ATOM 1344 O LEU A 98 1.702 -13.355 11.271 1.00 13.19 O ATOM 1345 CB LEU A 98 0.268 -10.471 10.723 1.00 12.01 C ATOM 1346 CG LEU A 98 -1.018 -9.869 10.224 1.00 11.77 C ATOM 1347 CD1 LEU A 98 -0.746 -8.545 9.505 1.00 13.97 C ATOM 1348 CD2 LEU A 98 -1.723 -10.839 9.272 1.00 17.86 C ATOM 1349 HA LEU A 98 -0.609 -12.390 11.255 1.00 0.00 H ATOM 1350 HB2 LEU A 98 0.835 -9.695 11.236 1.00 0.00 H ATOM 1351 HB3 LEU A 98 0.837 -10.828 9.865 1.00 0.00 H ATOM 1352 HG LEU A 98 -1.663 -9.679 11.082 1.00 0.00 H ATOM 1353 HD21 LEU A 98 -1.073 -11.048 8.422 1.00 0.00 H ATOM 1354 HD22 LEU A 98 -1.944 -11.767 9.799 1.00 0.00 H ATOM 1355 HD23 LEU A 98 -2.651 -10.390 8.919 1.00 0.00 H ATOM 1356 HD11 LEU A 98 -0.273 -7.848 10.197 1.00 0.00 H ATOM 1357 HD12 LEU A 98 -0.085 -8.723 8.657 1.00 0.00 H ATOM 1358 HD13 LEU A 98 -1.688 -8.125 9.151 1.00 0.00 H ATOM 1359 H LEU A 98 -0.690 -10.159 13.071 1.00 0.00 H ATOM 1360 N THR A 99 2.089 -11.963 13.002 1.00 11.77 N ATOM 1361 CA THR A 99 3.327 -12.638 13.431 1.00 14.61 C ATOM 1362 C THR A 99 3.000 -14.052 13.938 1.00 15.76 C ATOM 1363 O THR A 99 3.725 -14.996 13.570 1.00 21.88 O ATOM 1364 CB THR A 99 4.122 -11.802 14.427 1.00 15.17 C ATOM 1365 OG1 THR A 99 3.409 -11.531 15.646 1.00 17.72 O ATOM 1366 CG2 THR A 99 4.604 -10.527 13.785 1.00 20.76 C ATOM 1367 HA THR A 99 3.987 -12.746 12.570 1.00 0.00 H ATOM 1368 HB THR A 99 4.985 -12.403 14.714 1.00 0.00 H ATOM 1369 HG1 THR A 99 2.578 -11.034 15.438 1.00 0.00 H ATOM 1370 HG23 THR A 99 5.139 -10.764 12.866 1.00 0.00 H ATOM 1371 HG21 THR A 99 3.749 -9.892 13.555 1.00 0.00 H ATOM 1372 HG22 THR A 99 5.271 -10.006 14.471 1.00 0.00 H ATOM 1373 H THR A 99 1.760 -11.134 13.537 1.00 0.00 H ATOM 1374 N LYS A 100 1.911 -14.225 14.683 1.00 14.45 N ATOM 1375 CA LYS A 100 1.512 -15.562 15.181 1.00 15.17 C ATOM 1376 C LYS A 100 0.997 -16.442 14.040 1.00 15.92 C ATOM 1377 O LYS A 100 1.246 -17.656 14.015 1.00 18.35 O ATOM 1378 CB LYS A 100 0.487 -15.389 16.302 1.00 15.11 C ATOM 1379 CG LYS A 100 1.032 -14.603 17.490 1.00 17.04 C ATOM 1380 CD LYS A 100 -0.006 -14.548 18.645 1.00 20.79 C ATOM 1381 CE LYS A 100 0.339 -13.469 19.707 1.00 29.54 C ATOM 1382 NZ LYS A 100 -0.633 -13.350 20.857 1.00 34.60 N ATOM 1383 HA LYS A 100 2.379 -16.080 15.591 1.00 0.00 H ATOM 1384 HB2 LYS A 100 -0.379 -14.861 15.903 1.00 0.00 H ATOM 1385 HB3 LYS A 100 0.181 -16.376 16.649 1.00 0.00 H ATOM 1386 HG2 LYS A 100 1.941 -15.085 17.850 1.00 0.00 H ATOM 1387 HG3 LYS A 100 1.263 -13.587 17.170 1.00 0.00 H ATOM 1388 HD2 LYS A 100 -0.986 -14.323 18.224 1.00 0.00 H ATOM 1389 HD3 LYS A 100 -0.037 -15.522 19.134 1.00 0.00 H ATOM 1390 HE2 LYS A 100 0.382 -12.504 19.203 1.00 0.00 H ATOM 1391 HE3 LYS A 100 1.320 -13.706 20.120 1.00 0.00 H ATOM 1392 HZ1 LYS A 100 -1.575 -13.108 20.489 1.00 0.00 H ATOM 1393 HZ2 LYS A 100 -0.680 -14.256 21.365 1.00 0.00 H ATOM 1394 HZ3 LYS A 100 -0.311 -12.604 21.506 1.00 0.00 H ATOM 1395 H LYS A 100 1.325 -13.400 14.922 1.00 0.00 H ATOM 1396 N LEU A 101 0.254 -15.885 13.113 1.00 15.02 N ATOM 1397 CA LEU A 101 -0.243 -16.637 11.975 1.00 15.65 C ATOM 1398 C LEU A 101 0.852 -16.934 10.943 1.00 15.29 C ATOM 1399 O LEU A 101 0.669 -17.839 10.119 1.00 18.17 O ATOM 1400 CB LEU A 101 -1.388 -15.827 11.338 1.00 17.43 C ATOM 1401 CG LEU A 101 -2.129 -16.364 10.112 1.00 17.29 C ATOM 1402 CD1 LEU A 101 -2.790 -17.745 10.421 1.00 19.64 C ATOM 1403 CD2 LEU A 101 -3.194 -15.378 9.626 1.00 18.89 C ATOM 1404 HA LEU A 101 -0.600 -17.607 12.320 1.00 0.00 H ATOM 1405 HB2 LEU A 101 -2.137 -15.679 12.116 1.00 0.00 H ATOM 1406 HB3 LEU A 101 -0.968 -14.863 11.052 1.00 0.00 H ATOM 1407 HG LEU A 101 -1.391 -16.493 9.320 1.00 0.00 H ATOM 1408 HD21 LEU A 101 -3.919 -15.207 10.422 1.00 0.00 H ATOM 1409 HD22 LEU A 101 -2.718 -14.435 9.357 1.00 0.00 H ATOM 1410 HD23 LEU A 101 -3.700 -15.792 8.754 1.00 0.00 H ATOM 1411 HD11 LEU A 101 -2.018 -18.460 10.706 1.00 0.00 H ATOM 1412 HD12 LEU A 101 -3.501 -17.631 11.239 1.00 0.00 H ATOM 1413 HD13 LEU A 101 -3.310 -18.104 9.533 1.00 0.00 H ATOM 1414 H LEU A 101 0.014 -14.876 13.196 1.00 0.00 H ATOM 1415 N LYS A 102 1.960 -16.191 10.996 1.00 17.40 N ATOM 1416 CA LYS A 102 3.052 -16.288 10.025 1.00 16.91 C ATOM 1417 C LYS A 102 2.471 -16.187 8.616 1.00 17.05 C ATOM 1418 O LYS A 102 2.810 -16.931 7.708 1.00 17.99 O ATOM 1419 CB LYS A 102 3.880 -17.582 10.223 1.00 22.85 C ATOM 1420 CG LYS A 102 4.483 -17.760 11.627 1.00 29.72 C ATOM 1421 CD LYS A 102 5.789 -17.036 11.834 1.00 36.01 C ATOM 1422 CE LYS A 102 6.204 -17.083 13.315 1.00 39.12 C ATOM 1423 NZ LYS A 102 6.210 -18.471 13.860 1.00 43.70 N ATOM 1424 HA LYS A 102 3.747 -15.462 10.180 1.00 0.00 H ATOM 1425 HB2 LYS A 102 3.230 -18.434 10.024 1.00 0.00 H ATOM 1426 HB3 LYS A 102 4.698 -17.574 9.502 1.00 0.00 H ATOM 1427 HG2 LYS A 102 3.765 -17.387 12.358 1.00 0.00 H ATOM 1428 HG3 LYS A 102 4.651 -18.824 11.795 1.00 0.00 H ATOM 1429 HD2 LYS A 102 6.562 -17.511 11.230 1.00 0.00 H ATOM 1430 HD3 LYS A 102 5.676 -15.997 11.526 1.00 0.00 H ATOM 1431 HE2 LYS A 102 5.503 -16.482 13.894 1.00 0.00 H ATOM 1432 HE3 LYS A 102 7.206 -16.664 13.412 1.00 0.00 H ATOM 1433 HZ1 LYS A 102 5.256 -18.878 13.780 1.00 0.00 H ATOM 1434 HZ2 LYS A 102 6.882 -19.052 13.319 1.00 0.00 H ATOM 1435 HZ3 LYS A 102 6.496 -18.448 14.860 1.00 0.00 H ATOM 1436 H LYS A 102 2.053 -15.504 11.771 1.00 0.00 H ATOM 1437 N ALA A 103 1.561 -15.224 8.430 1.00 14.10 N ATOM 1438 CA ALA A 103 0.860 -15.037 7.176 1.00 16.24 C ATOM 1439 C ALA A 103 1.720 -14.486 6.041 1.00 13.91 C ATOM 1440 O ALA A 103 2.706 -13.786 6.287 1.00 14.95 O ATOM 1441 CB ALA A 103 -0.302 -14.102 7.369 1.00 19.11 C ATOM 1442 HA ALA A 103 0.539 -16.036 6.883 1.00 0.00 H ATOM 1443 HB1 ALA A 103 -0.988 -14.524 8.104 1.00 0.00 H ATOM 1444 HB2 ALA A 103 0.064 -13.138 7.723 1.00 0.00 H ATOM 1445 HB3 ALA A 103 -0.821 -13.969 6.420 1.00 0.00 H ATOM 1446 H ALA A 103 1.348 -14.582 9.220 1.00 0.00 H ATOM 1447 N GLN A 104 1.310 -14.794 4.825 1.00 16.94 N ATOM 1448 CA GLN A 104 1.828 -14.072 3.654 1.00 16.35 C ATOM 1449 C GLN A 104 0.628 -13.416 3.032 1.00 18.31 C ATOM 1450 O GLN A 104 -0.466 -13.942 3.036 1.00 20.64 O ATOM 1451 CB GLN A 104 2.460 -15.024 2.625 1.00 22.72 C ATOM 1452 CG GLN A 104 3.248 -16.156 3.226 1.00 22.08 C ATOM 1453 CD GLN A 104 3.748 -17.144 2.218 1.00 28.09 C ATOM 1454 OE1 GLN A 104 3.654 -16.926 1.036 1.00 25.49 O ATOM 1455 NE2 GLN A 104 4.302 -18.229 2.697 1.00 30.26 N ATOM 1456 HA GLN A 104 2.603 -13.367 3.954 1.00 0.00 H ATOM 1457 HB2 GLN A 104 1.661 -15.449 2.018 1.00 0.00 H ATOM 1458 HB3 GLN A 104 3.128 -14.444 1.989 1.00 0.00 H ATOM 1459 HG2 GLN A 104 4.106 -15.737 3.752 1.00 0.00 H ATOM 1460 HG3 GLN A 104 2.609 -16.682 3.936 1.00 0.00 H ATOM 1461 HE22 GLN A 104 4.360 -18.373 3.725 1.00 0.00 H ATOM 1462 HE21 GLN A 104 4.684 -18.947 2.049 1.00 0.00 H ATOM 1463 H GLN A 104 0.613 -15.555 4.694 1.00 0.00 H ATOM 1464 N ILE A 105 0.858 -12.241 2.466 1.00 14.25 N ATOM 1465 CA ILE A 105 -0.178 -11.452 1.825 1.00 14.56 C ATOM 1466 C ILE A 105 0.306 -11.210 0.414 1.00 13.60 C ATOM 1467 O ILE A 105 1.404 -10.658 0.217 1.00 16.20 O ATOM 1468 CB ILE A 105 -0.407 -10.117 2.553 1.00 14.49 C ATOM 1469 CG1 ILE A 105 -0.712 -10.374 4.038 1.00 16.71 C ATOM 1470 CG2 ILE A 105 -1.511 -9.360 1.889 1.00 14.84 C ATOM 1471 CD1 ILE A 105 -0.235 -9.350 4.964 1.00 19.35 C ATOM 1472 HA ILE A 105 -1.134 -11.975 1.845 1.00 0.00 H ATOM 1473 HB ILE A 105 0.497 -9.511 2.498 1.00 0.00 H ATOM 1474 HG12 ILE A 105 -1.793 -10.452 4.151 1.00 0.00 H ATOM 1475 HG13 ILE A 105 -0.250 -11.321 4.317 1.00 0.00 H ATOM 1476 HD11 ILE A 105 0.849 -9.264 4.882 1.00 0.00 H ATOM 1477 HD12 ILE A 105 -0.696 -8.394 4.716 1.00 0.00 H ATOM 1478 HD13 ILE A 105 -0.503 -9.630 5.983 1.00 0.00 H ATOM 1479 HG21 ILE A 105 -1.242 -9.163 0.851 1.00 0.00 H ATOM 1480 HG22 ILE A 105 -2.426 -9.951 1.923 1.00 0.00 H ATOM 1481 HG23 ILE A 105 -1.667 -8.416 2.410 1.00 0.00 H ATOM 1482 H ILE A 105 1.828 -11.866 2.482 1.00 0.00 H ATOM 1483 N HIS A 106 -0.514 -11.593 -0.541 1.00 16.10 N ATOM 1484 CA HIS A 106 -0.117 -11.547 -1.956 1.00 16.06 C ATOM 1485 C HIS A 106 -0.980 -10.602 -2.740 1.00 16.28 C ATOM 1486 O HIS A 106 -2.185 -10.793 -2.820 1.00 20.54 O ATOM 1487 CB HIS A 106 -0.231 -12.974 -2.557 1.00 17.94 C ATOM 1488 CG HIS A 106 0.784 -13.933 -2.037 1.00 20.47 C ATOM 1489 ND1 HIS A 106 1.707 -14.537 -2.861 1.00 26.52 N ATOM 1490 CD2 HIS A 106 1.019 -14.415 -0.794 1.00 26.59 C ATOM 1491 CE1 HIS A 106 2.467 -15.351 -2.148 1.00 26.37 C ATOM 1492 NE2 HIS A 106 2.077 -15.295 -0.887 1.00 23.19 N ATOM 1493 HA HIS A 106 0.911 -11.188 -2.015 1.00 0.00 H ATOM 1494 HB2 HIS A 106 -1.222 -13.365 -2.327 1.00 0.00 H ATOM 1495 HB3 HIS A 106 -0.112 -12.901 -3.638 1.00 0.00 H ATOM 1496 HD2 HIS A 106 0.473 -14.156 0.113 1.00 0.00 H ATOM 1497 HE1 HIS A 106 3.279 -15.965 -2.536 1.00 0.00 H ATOM 1498 H HIS A 106 -1.463 -11.936 -0.290 1.00 0.00 H ATOM 1499 N PHE A 107 -0.370 -9.599 -3.358 1.00 15.57 N ATOM 1500 CA PHE A 107 -1.130 -8.669 -4.192 1.00 17.60 C ATOM 1501 C PHE A 107 -1.158 -9.221 -5.612 1.00 25.79 C ATOM 1502 O PHE A 107 -0.117 -9.520 -6.172 1.00 25.90 O ATOM 1503 CB PHE A 107 -0.576 -7.221 -4.063 1.00 16.48 C ATOM 1504 CG PHE A 107 -1.036 -6.537 -2.801 1.00 15.98 C ATOM 1505 CD1 PHE A 107 -2.109 -5.667 -2.851 1.00 14.91 C ATOM 1506 CD2 PHE A 107 -0.474 -6.849 -1.576 1.00 15.21 C ATOM 1507 CE1 PHE A 107 -2.594 -5.053 -1.674 1.00 14.44 C ATOM 1508 CE2 PHE A 107 -0.938 -6.261 -0.393 1.00 15.59 C ATOM 1509 CZ PHE A 107 -1.997 -5.382 -0.439 1.00 14.83 C ATOM 1510 HA PHE A 107 -2.164 -8.588 -3.856 1.00 0.00 H ATOM 1511 HB2 PHE A 107 0.513 -7.262 -4.062 1.00 0.00 H ATOM 1512 HB3 PHE A 107 -0.915 -6.639 -4.920 1.00 0.00 H ATOM 1513 HD2 PHE A 107 0.346 -7.566 -1.531 1.00 0.00 H ATOM 1514 HE2 PHE A 107 -0.463 -6.498 0.559 1.00 0.00 H ATOM 1515 HZ PHE A 107 -2.375 -4.939 0.482 1.00 0.00 H ATOM 1516 HE1 PHE A 107 -3.415 -4.338 -1.720 1.00 0.00 H ATOM 1517 HD1 PHE A 107 -2.586 -5.452 -3.807 1.00 0.00 H ATOM 1518 H PHE A 107 0.657 -9.473 -3.248 1.00 0.00 H ATOM 1519 N GLU A 108 -2.363 -9.491 -6.111 1.00 32.62 N ATOM 1520 CA GLU A 108 -2.541 -10.081 -7.462 1.00 38.92 C ATOM 1521 C GLU A 108 -3.865 -9.644 -8.068 1.00 38.32 C ATOM 1522 O GLU A 108 -4.893 -9.614 -7.382 1.00 38.91 O ATOM 1523 CB GLU A 108 -2.471 -11.622 -7.445 1.00 43.58 C ATOM 1524 CG GLU A 108 -1.104 -12.255 -7.114 1.00 49.59 C ATOM 1525 CD GLU A 108 0.030 -11.839 -8.059 1.00 55.28 C ATOM 1526 OE1 GLU A 108 1.207 -11.889 -7.626 1.00 56.82 O ATOM 1527 OE2 GLU A 108 -0.246 -11.462 -9.226 1.00 57.12 O ATOM 1528 HA GLU A 108 -1.716 -9.714 -8.072 1.00 0.00 H ATOM 1529 HB2 GLU A 108 -3.187 -11.976 -6.703 1.00 0.00 H ATOM 1530 HB3 GLU A 108 -2.768 -11.976 -8.432 1.00 0.00 H ATOM 1531 HG2 GLU A 108 -0.829 -11.963 -6.101 1.00 0.00 H ATOM 1532 HG3 GLU A 108 -1.209 -13.339 -7.162 1.00 0.00 H ATOM 1533 H GLU A 108 -3.205 -9.282 -5.537 1.00 0.00 H ATOM 1534 N GLY A 109 -3.848 -9.324 -9.357 1.00 38.94 N ATOM 1535 CA GLY A 109 -4.987 -8.654 -9.971 1.00 43.80 C ATOM 1536 C GLY A 109 -5.189 -7.312 -9.290 1.00 45.74 C ATOM 1537 O GLY A 109 -4.214 -6.582 -9.045 1.00 45.02 O ATOM 1538 HA3 GLY A 109 -5.881 -9.265 -9.850 1.00 0.00 H ATOM 1539 HA2 GLY A 109 -4.794 -8.501 -11.033 1.00 0.00 H ATOM 1540 H GLY A 109 -3.014 -9.554 -9.934 1.00 0.00 H ATOM 1541 N SER A 110 -6.445 -7.003 -8.966 1.00 42.55 N ATOM 1542 CA SER A 110 -6.803 -5.736 -8.315 1.00 45.44 C ATOM 1543 C SER A 110 -6.939 -5.879 -6.796 1.00 42.72 C ATOM 1544 O SER A 110 -7.150 -4.895 -6.080 1.00 44.95 O ATOM 1545 CB SER A 110 -8.102 -5.167 -8.905 1.00 49.44 C ATOM 1546 OG SER A 110 -9.209 -6.031 -8.672 1.00 51.99 O ATOM 1547 HA SER A 110 -5.985 -5.043 -8.510 1.00 0.00 H ATOM 1548 HB2 SER A 110 -7.975 -5.037 -9.980 1.00 0.00 H ATOM 1549 HB3 SER A 110 -8.305 -4.200 -8.445 1.00 0.00 H ATOM 1550 HG SER A 110 -10.026 -5.633 -9.065 1.00 0.00 H ATOM 1551 H SER A 110 -7.200 -7.685 -9.182 1.00 0.00 H ATOM 1552 N GLY A 111 -6.806 -7.109 -6.316 1.00 37.23 N ATOM 1553 CA GLY A 111 -6.985 -7.397 -4.907 1.00 33.09 C ATOM 1554 C GLY A 111 -5.779 -8.050 -4.275 1.00 27.67 C ATOM 1555 O GLY A 111 -4.626 -7.822 -4.678 1.00 29.12 O ATOM 1556 HA3 GLY A 111 -7.839 -8.065 -4.795 1.00 0.00 H ATOM 1557 HA2 GLY A 111 -7.186 -6.462 -4.385 1.00 0.00 H ATOM 1558 H GLY A 111 -6.568 -7.885 -6.966 1.00 0.00 H ATOM 1559 N ALA A 112 -6.050 -8.879 -3.282 1.00 22.43 N ATOM 1560 CA ALA A 112 -4.986 -9.331 -2.412 1.00 16.83 C ATOM 1561 C ALA A 112 -5.495 -10.531 -1.686 1.00 20.58 C ATOM 1562 O ALA A 112 -6.633 -10.563 -1.283 1.00 21.42 O ATOM 1563 CB ALA A 112 -4.628 -8.228 -1.428 1.00 20.56 C ATOM 1564 HA ALA A 112 -4.089 -9.580 -2.979 1.00 0.00 H ATOM 1565 HB1 ALA A 112 -4.298 -7.346 -1.977 1.00 0.00 H ATOM 1566 HB2 ALA A 112 -5.504 -7.978 -0.830 1.00 0.00 H ATOM 1567 HB3 ALA A 112 -3.826 -8.572 -0.774 1.00 0.00 H ATOM 1568 H ALA A 112 -7.025 -9.205 -3.126 1.00 0.00 H ATOM 1569 N GLN A 113 -4.621 -11.510 -1.512 1.00 18.14 N ATOM 1570 CA GLN A 113 -5.029 -12.705 -0.795 1.00 23.30 C ATOM 1571 C GLN A 113 -4.079 -13.057 0.318 1.00 20.77 C ATOM 1572 O GLN A 113 -2.899 -12.732 0.290 1.00 19.63 O ATOM 1573 CB GLN A 113 -5.288 -13.925 -1.694 1.00 32.94 C ATOM 1574 CG GLN A 113 -4.356 -14.090 -2.865 1.00 42.02 C ATOM 1575 CD GLN A 113 -4.861 -13.379 -4.116 1.00 47.05 C ATOM 1576 OE1 GLN A 113 -4.088 -13.100 -5.036 1.00 50.85 O ATOM 1577 NE2 GLN A 113 -6.158 -13.076 -4.150 1.00 49.17 N ATOM 1578 HA GLN A 113 -5.991 -12.440 -0.356 1.00 0.00 H ATOM 1579 HB2 GLN A 113 -5.208 -14.819 -1.075 1.00 0.00 H ATOM 1580 HB3 GLN A 113 -6.303 -13.843 -2.084 1.00 0.00 H ATOM 1581 HG2 GLN A 113 -3.382 -13.680 -2.598 1.00 0.00 H ATOM 1582 HG3 GLN A 113 -4.253 -15.153 -3.084 1.00 0.00 H ATOM 1583 HE22 GLN A 113 -6.773 -13.331 -3.351 1.00 0.00 H ATOM 1584 HE21 GLN A 113 -6.556 -12.585 -4.976 1.00 0.00 H ATOM 1585 H GLN A 113 -3.654 -11.424 -1.884 1.00 0.00 H ATOM 1586 N VAL A 114 -4.630 -13.780 1.280 1.00 19.90 N ATOM 1587 CA VAL A 114 -3.906 -14.181 2.475 1.00 21.82 C ATOM 1588 C VAL A 114 -3.628 -15.696 2.401 1.00 19.55 C ATOM 1589 O VAL A 114 -4.559 -16.481 2.125 1.00 21.55 O ATOM 1590 CB VAL A 114 -4.714 -13.798 3.698 1.00 21.84 C ATOM 1591 CG1 VAL A 114 -3.965 -14.161 4.977 1.00 22.48 C ATOM 1592 CG2 VAL A 114 -5.075 -12.280 3.656 1.00 20.97 C ATOM 1593 HA VAL A 114 -2.946 -13.669 2.546 1.00 0.00 H ATOM 1594 HB VAL A 114 -5.645 -14.364 3.693 1.00 0.00 H ATOM 1595 HG11 VAL A 114 -3.783 -15.236 4.997 1.00 0.00 H ATOM 1596 HG12 VAL A 114 -3.014 -13.630 5.003 1.00 0.00 H ATOM 1597 HG13 VAL A 114 -4.565 -13.876 5.841 1.00 0.00 H ATOM 1598 HG21 VAL A 114 -4.159 -11.690 3.636 1.00 0.00 H ATOM 1599 HG22 VAL A 114 -5.662 -12.072 2.762 1.00 0.00 H ATOM 1600 HG23 VAL A 114 -5.655 -12.021 4.542 1.00 0.00 H ATOM 1601 H VAL A 114 -5.622 -14.073 1.177 1.00 0.00 H ATOM 1602 N VAL A 115 -2.366 -16.058 2.647 1.00 19.58 N ATOM 1603 CA VAL A 115 -1.898 -17.452 2.652 1.00 23.34 C ATOM 1604 C VAL A 115 -1.117 -17.756 3.954 1.00 21.85 C ATOM 1605 O VAL A 115 -0.652 -16.857 4.644 1.00 19.98 O ATOM 1606 CB VAL A 115 -1.077 -17.830 1.369 1.00 31.56 C ATOM 1607 CG1 VAL A 115 -1.734 -17.320 0.081 1.00 29.11 C ATOM 1608 CG2 VAL A 115 0.338 -17.361 1.459 1.00 36.19 C ATOM 1609 HA VAL A 115 -2.782 -18.089 2.627 1.00 0.00 H ATOM 1610 HB VAL A 115 -1.072 -18.919 1.323 1.00 0.00 H ATOM 1611 HG11 VAL A 115 -2.728 -17.756 -0.015 1.00 0.00 H ATOM 1612 HG12 VAL A 115 -1.814 -16.234 0.121 1.00 0.00 H ATOM 1613 HG13 VAL A 115 -1.125 -17.609 -0.775 1.00 0.00 H ATOM 1614 HG21 VAL A 115 0.354 -16.277 1.569 1.00 0.00 H ATOM 1615 HG22 VAL A 115 0.818 -17.822 2.322 1.00 0.00 H ATOM 1616 HG23 VAL A 115 0.871 -17.643 0.551 1.00 0.00 H ATOM 1617 H VAL A 115 -1.673 -15.309 2.847 1.00 0.00 H ATOM 1618 N GLY A 116 -1.001 -19.027 4.330 1.00 20.36 N ATOM 1619 CA GLY A 116 -0.376 -19.391 5.597 1.00 21.01 C ATOM 1620 C GLY A 116 1.121 -19.590 5.453 1.00 22.35 C ATOM 1621 O GLY A 116 1.681 -19.412 4.356 1.00 24.18 O ATOM 1622 HA3 GLY A 116 -0.822 -20.318 5.957 1.00 0.00 H ATOM 1623 HA2 GLY A 116 -0.558 -18.597 6.321 1.00 0.00 H ATOM 1624 H GLY A 116 -1.364 -19.777 3.707 1.00 0.00 H ATOM 1625 N PRO A 117 1.792 -19.994 6.545 1.00 22.97 N ATOM 1626 CA PRO A 117 3.267 -19.971 6.547 1.00 25.16 C ATOM 1627 C PRO A 117 3.879 -20.941 5.569 1.00 35.12 C ATOM 1628 O PRO A 117 5.030 -20.751 5.160 1.00 39.77 O ATOM 1629 CB PRO A 117 3.653 -20.385 7.976 1.00 24.83 C ATOM 1630 CG PRO A 117 2.369 -20.851 8.649 1.00 21.17 C ATOM 1631 CD PRO A 117 1.237 -20.176 7.895 1.00 23.74 C ATOM 1632 HA PRO A 117 3.630 -18.987 6.251 1.00 0.00 H ATOM 1633 HD3 PRO A 117 0.351 -20.810 7.871 1.00 0.00 H ATOM 1634 HD2 PRO A 117 0.984 -19.217 8.346 1.00 0.00 H ATOM 1635 HG3 PRO A 117 2.359 -20.551 9.697 1.00 0.00 H ATOM 1636 HG2 PRO A 117 2.277 -21.935 8.582 1.00 0.00 H ATOM 1637 HB2 PRO A 117 4.381 -21.195 7.950 1.00 0.00 H ATOM 1638 HB3 PRO A 117 4.075 -19.536 8.514 1.00 0.00 H ATOM 1639 N MET A 118 3.109 -21.959 5.197 1.00 34.51 N ATOM 1640 CA MET A 118 3.595 -22.979 4.284 1.00 39.42 C ATOM 1641 C MET A 118 2.935 -22.867 2.907 1.00 40.81 C ATOM 1642 O MET A 118 2.887 -23.831 2.134 1.00 44.39 O ATOM 1643 CB MET A 118 3.417 -24.359 4.909 1.00 37.23 C ATOM 1644 CG MET A 118 4.275 -24.546 6.167 1.00 37.06 C ATOM 1645 SD MET A 118 3.828 -26.052 7.033 1.00 33.45 S ATOM 1646 CE MET A 118 2.044 -25.911 6.987 1.00 38.37 C ATOM 1647 HA MET A 118 4.661 -22.823 4.116 1.00 0.00 H ATOM 1648 HB2 MET A 118 2.369 -24.490 5.177 1.00 0.00 H ATOM 1649 HB3 MET A 118 3.700 -25.115 4.176 1.00 0.00 H ATOM 1650 HG2 MET A 118 4.125 -23.695 6.831 1.00 0.00 H ATOM 1651 HG3 MET A 118 5.325 -24.599 5.878 1.00 0.00 H ATOM 1652 HE1 MET A 118 1.740 -24.997 7.497 1.00 0.00 H ATOM 1653 HE2 MET A 118 1.710 -25.878 5.950 1.00 0.00 H ATOM 1654 HE3 MET A 118 1.600 -26.772 7.486 1.00 0.00 H ATOM 1655 H MET A 118 2.139 -22.026 5.567 1.00 0.00 H ATOM 1656 N GLY A 119 2.442 -21.666 2.615 1.00 40.67 N ATOM 1657 CA GLY A 119 1.893 -21.337 1.306 1.00 37.75 C ATOM 1658 C GLY A 119 0.486 -21.831 1.022 1.00 32.99 C ATOM 1659 O GLY A 119 0.023 -21.703 -0.103 1.00 36.91 O ATOM 1660 HA3 GLY A 119 2.554 -21.764 0.552 1.00 0.00 H ATOM 1661 HA2 GLY A 119 1.889 -20.251 1.211 1.00 0.00 H ATOM 1662 H GLY A 119 2.449 -20.932 3.352 1.00 0.00 H ATOM 1663 N GLN A 120 -0.187 -22.412 2.009 1.00 36.38 N ATOM 1664 CA GLN A 120 -1.569 -22.850 1.832 1.00 37.41 C ATOM 1665 C GLN A 120 -2.475 -21.617 1.747 1.00 37.39 C ATOM 1666 O GLN A 120 -2.357 -20.733 2.572 1.00 29.15 O ATOM 1667 CB GLN A 120 -1.999 -23.775 2.992 1.00 41.53 C ATOM 1668 CG GLN A 120 -2.347 -23.069 4.341 1.00 41.87 C ATOM 1669 CD GLN A 120 -1.187 -22.934 5.335 1.00 44.42 C ATOM 1670 OE1 GLN A 120 -1.398 -23.037 6.545 1.00 49.40 O ATOM 1671 NE2 GLN A 120 0.031 -22.697 4.837 1.00 37.98 N ATOM 1672 HA GLN A 120 -1.656 -23.422 0.908 1.00 0.00 H ATOM 1673 HB2 GLN A 120 -2.881 -24.328 2.668 1.00 0.00 H ATOM 1674 HB3 GLN A 120 -1.183 -24.473 3.182 1.00 0.00 H ATOM 1675 HG2 GLN A 120 -2.711 -22.068 4.112 1.00 0.00 H ATOM 1676 HG3 GLN A 120 -3.139 -23.641 4.825 1.00 0.00 H ATOM 1677 HE22 GLN A 120 0.166 -22.617 3.809 1.00 0.00 H ATOM 1678 HE21 GLN A 120 0.843 -22.593 5.478 1.00 0.00 H ATOM 1679 H GLN A 120 0.280 -22.558 2.927 1.00 0.00 H ATOM 1680 N PRO A 121 -3.362 -21.525 0.735 1.00 36.16 N ATOM 1681 CA PRO A 121 -4.268 -20.368 0.805 1.00 35.33 C ATOM 1682 C PRO A 121 -5.128 -20.460 2.058 1.00 34.51 C ATOM 1683 O PRO A 121 -5.506 -21.566 2.464 1.00 30.35 O ATOM 1684 CB PRO A 121 -5.133 -20.516 -0.458 1.00 37.80 C ATOM 1685 CG PRO A 121 -4.293 -21.365 -1.395 1.00 39.80 C ATOM 1686 CD PRO A 121 -3.599 -22.340 -0.473 1.00 39.14 C ATOM 1687 HA PRO A 121 -3.749 -19.411 0.852 1.00 0.00 H ATOM 1688 HD3 PRO A 121 -4.237 -23.196 -0.252 1.00 0.00 H ATOM 1689 HD2 PRO A 121 -2.660 -22.689 -0.903 1.00 0.00 H ATOM 1690 HG3 PRO A 121 -3.567 -20.752 -1.930 1.00 0.00 H ATOM 1691 HG2 PRO A 121 -4.923 -21.890 -2.113 1.00 0.00 H ATOM 1692 HB2 PRO A 121 -6.074 -21.014 -0.225 1.00 0.00 H ATOM 1693 HB3 PRO A 121 -5.339 -19.542 -0.901 1.00 0.00 H ATOM 1694 N LEU A 122 -5.413 -19.317 2.682 1.00 30.32 N ATOM 1695 CA LEU A 122 -6.291 -19.271 3.853 1.00 27.20 C ATOM 1696 C LEU A 122 -7.685 -18.807 3.491 1.00 30.77 C ATOM 1697 O LEU A 122 -8.493 -18.499 4.372 1.00 34.33 O ATOM 1698 CB LEU A 122 -5.713 -18.382 4.967 1.00 26.09 C ATOM 1699 CG LEU A 122 -4.365 -18.878 5.507 1.00 26.23 C ATOM 1700 CD1 LEU A 122 -3.830 -17.889 6.523 1.00 24.78 C ATOM 1701 CD2 LEU A 122 -4.439 -20.296 6.103 1.00 28.28 C ATOM 1702 HA LEU A 122 -6.356 -20.292 4.229 1.00 0.00 H ATOM 1703 HB2 LEU A 122 -5.577 -17.376 4.571 1.00 0.00 H ATOM 1704 HB3 LEU A 122 -6.426 -18.353 5.791 1.00 0.00 H ATOM 1705 HG LEU A 122 -3.679 -18.944 4.663 1.00 0.00 H ATOM 1706 HD21 LEU A 122 -5.150 -20.305 6.929 1.00 0.00 H ATOM 1707 HD22 LEU A 122 -4.765 -20.996 5.333 1.00 0.00 H ATOM 1708 HD23 LEU A 122 -3.454 -20.588 6.467 1.00 0.00 H ATOM 1709 HD11 LEU A 122 -3.695 -16.918 6.047 1.00 0.00 H ATOM 1710 HD12 LEU A 122 -4.539 -17.796 7.346 1.00 0.00 H ATOM 1711 HD13 LEU A 122 -2.873 -18.244 6.905 1.00 0.00 H ATOM 1712 H LEU A 122 -4.999 -18.431 2.327 1.00 0.00 H ATOM 1713 N GLN A 123 -7.966 -18.777 2.187 1.00 25.89 N ATOM 1714 CA GLN A 123 -9.262 -18.301 1.709 1.00 26.85 C ATOM 1715 C GLN A 123 -9.413 -18.555 0.223 1.00 27.68 C ATOM 1716 O GLN A 123 -8.492 -19.083 -0.430 1.00 29.09 O ATOM 1717 CB GLN A 123 -9.415 -16.806 2.019 1.00 25.11 C ATOM 1718 CG GLN A 123 -8.258 -15.994 1.449 1.00 28.36 C ATOM 1719 CD GLN A 123 -8.238 -14.553 1.876 1.00 31.01 C ATOM 1720 OE1 GLN A 123 -7.472 -13.773 1.320 1.00 25.75 O ATOM 1721 NE2 GLN A 123 -9.076 -14.182 2.852 1.00 35.74 N ATOM 1722 HA GLN A 123 -10.049 -18.851 2.226 1.00 0.00 H ATOM 1723 HB2 GLN A 123 -10.348 -16.448 1.583 1.00 0.00 H ATOM 1724 HB3 GLN A 123 -9.445 -16.670 3.100 1.00 0.00 H ATOM 1725 HG2 GLN A 123 -7.325 -16.458 1.770 1.00 0.00 H ATOM 1726 HG3 GLN A 123 -8.322 -16.026 0.361 1.00 0.00 H ATOM 1727 HE22 GLN A 123 -9.706 -14.883 3.291 1.00 0.00 H ATOM 1728 HE21 GLN A 123 -9.097 -13.192 3.171 1.00 0.00 H ATOM 1729 H GLN A 123 -7.253 -19.097 1.501 1.00 0.00 H ATOM 1730 N VAL A 124 -10.608 -18.203 -0.261 1.00 32.72 N ATOM 1731 CA VAL A 124 -10.982 -17.949 -1.677 1.00 38.26 C ATOM 1732 C VAL A 124 -12.107 -18.820 -2.210 1.00 43.24 C ATOM 1733 O VAL A 124 -13.204 -18.800 -1.661 1.00 41.96 O ATOM 1734 CB VAL A 124 -9.799 -17.755 -2.670 1.00 38.08 C ATOM 1735 CG1 VAL A 124 -10.299 -17.755 -4.075 1.00 45.51 C ATOM 1736 CG2 VAL A 124 -9.166 -16.422 -2.424 1.00 38.83 C ATOM 1737 HA VAL A 124 -11.418 -16.952 -1.619 1.00 0.00 H ATOM 1738 HB VAL A 124 -9.087 -18.567 -2.522 1.00 0.00 H ATOM 1739 HG11 VAL A 124 -10.789 -18.706 -4.285 1.00 0.00 H ATOM 1740 HG12 VAL A 124 -11.012 -16.941 -4.206 1.00 0.00 H ATOM 1741 HG13 VAL A 124 -9.460 -17.618 -4.758 1.00 0.00 H ATOM 1742 HG21 VAL A 124 -9.906 -15.636 -2.577 1.00 0.00 H ATOM 1743 HG22 VAL A 124 -8.796 -16.380 -1.400 1.00 0.00 H ATOM 1744 HG23 VAL A 124 -8.337 -16.282 -3.117 1.00 0.00 H ATOM 1745 H VAL A 124 -11.369 -18.093 0.439 1.00 0.00 H TER 1746 VAL A 124 ATOM 1747 N GLU B 11 15.740 6.932 12.333 1.00 47.51 N ATOM 1748 CA GLU B 11 14.845 5.891 12.913 1.00 44.59 C ATOM 1749 C GLU B 11 13.844 5.392 11.858 1.00 37.22 C ATOM 1750 O GLU B 11 13.012 6.165 11.386 1.00 35.62 O ATOM 1751 CB GLU B 11 14.117 6.458 14.134 1.00 53.50 C ATOM 1752 CG GLU B 11 13.066 5.525 14.722 1.00 60.68 C ATOM 1753 CD GLU B 11 12.334 6.128 15.904 1.00 64.86 C ATOM 1754 OE1 GLU B 11 12.156 5.405 16.910 1.00 67.68 O ATOM 1755 OE2 GLU B 11 11.937 7.315 15.828 1.00 66.42 O ATOM 1756 HA GLU B 11 15.447 5.039 13.230 1.00 0.00 H ATOM 1757 HB2 GLU B 11 14.857 6.670 14.906 1.00 0.00 H ATOM 1758 HB3 GLU B 11 13.625 7.385 13.839 1.00 0.00 H ATOM 1759 HG2 GLU B 11 12.338 5.288 13.946 1.00 0.00 H ATOM 1760 HG3 GLU B 11 13.558 4.609 15.048 1.00 0.00 H ATOM 1761 HN3 GLU B 11 15.167 7.735 12.003 1.00 0.00 H ATOM 1762 HN2 GLU B 11 16.266 6.528 11.532 1.00 0.00 H ATOM 1763 HN1 GLU B 11 16.409 7.257 13.060 1.00 0.00 H ATOM 1764 N PRO B 12 13.936 4.099 11.473 1.00 31.34 N ATOM 1765 CA PRO B 12 13.044 3.639 10.409 1.00 28.51 C ATOM 1766 C PRO B 12 11.655 3.264 10.923 1.00 23.34 C ATOM 1767 O PRO B 12 11.479 2.984 12.116 1.00 24.09 O ATOM 1768 CB PRO B 12 13.769 2.396 9.880 1.00 30.03 C ATOM 1769 CG PRO B 12 14.438 1.834 11.071 1.00 32.31 C ATOM 1770 CD PRO B 12 14.815 3.018 11.959 1.00 33.27 C ATOM 1771 HA PRO B 12 12.863 4.411 9.661 1.00 0.00 H ATOM 1772 HD3 PRO B 12 14.620 2.797 13.008 1.00 0.00 H ATOM 1773 HD2 PRO B 12 15.865 3.282 11.834 1.00 0.00 H ATOM 1774 HG3 PRO B 12 15.332 1.285 10.776 1.00 0.00 H ATOM 1775 HG2 PRO B 12 13.761 1.165 11.603 1.00 0.00 H ATOM 1776 HB2 PRO B 12 13.059 1.682 9.462 1.00 0.00 H ATOM 1777 HB3 PRO B 12 14.499 2.669 9.118 1.00 0.00 H ATOM 1778 N PRO B 13 10.658 3.257 10.024 1.00 18.20 N ATOM 1779 CA PRO B 13 9.379 2.673 10.425 1.00 15.93 C ATOM 1780 C PRO B 13 9.548 1.214 10.766 1.00 17.02 C ATOM 1781 O PRO B 13 10.571 0.615 10.406 1.00 17.80 O ATOM 1782 CB PRO B 13 8.506 2.782 9.155 1.00 15.34 C ATOM 1783 CG PRO B 13 9.250 3.658 8.218 1.00 23.98 C ATOM 1784 CD PRO B 13 10.714 3.599 8.596 1.00 20.64 C ATOM 1785 HA PRO B 13 8.956 3.172 11.297 1.00 0.00 H ATOM 1786 HD3 PRO B 13 11.238 2.831 8.027 1.00 0.00 H ATOM 1787 HD2 PRO B 13 11.201 4.561 8.440 1.00 0.00 H ATOM 1788 HG3 PRO B 13 8.886 4.682 8.299 1.00 0.00 H ATOM 1789 HG2 PRO B 13 9.116 3.306 7.195 1.00 0.00 H ATOM 1790 HB2 PRO B 13 8.355 1.797 8.713 1.00 0.00 H ATOM 1791 HB3 PRO B 13 7.539 3.222 9.397 1.00 0.00 H ATOM 1792 N PRO B 14 8.557 0.613 11.417 1.00 15.06 N ATOM 1793 CA PRO B 14 8.643 -0.817 11.649 1.00 14.77 C ATOM 1794 C PRO B 14 8.596 -1.623 10.377 1.00 15.31 C ATOM 1795 O PRO B 14 8.165 -1.157 9.349 1.00 15.50 O ATOM 1796 CB PRO B 14 7.404 -1.145 12.501 1.00 19.45 C ATOM 1797 CG PRO B 14 6.581 0.094 12.552 1.00 19.38 C ATOM 1798 CD PRO B 14 7.289 1.215 11.863 1.00 17.80 C ATOM 1799 HA PRO B 14 9.591 -1.068 12.126 1.00 0.00 H ATOM 1800 HD3 PRO B 14 6.710 1.575 11.013 1.00 0.00 H ATOM 1801 HD2 PRO B 14 7.472 2.040 12.552 1.00 0.00 H ATOM 1802 HG3 PRO B 14 6.404 0.366 13.593 1.00 0.00 H ATOM 1803 HG2 PRO B 14 5.627 -0.087 12.057 1.00 0.00 H ATOM 1804 HB2 PRO B 14 6.836 -1.955 12.043 1.00 0.00 H ATOM 1805 HB3 PRO B 14 7.706 -1.438 13.507 1.00 0.00 H ATOM 1806 N GLU B 15 9.045 -2.860 10.482 1.00 14.83 N ATOM 1807 CA GLU B 15 8.778 -3.821 9.419 1.00 12.72 C ATOM 1808 C GLU B 15 7.285 -4.151 9.386 1.00 12.56 C ATOM 1809 O GLU B 15 6.606 -4.111 10.414 1.00 14.49 O ATOM 1810 CB GLU B 15 9.564 -5.142 9.588 1.00 13.40 C ATOM 1811 CG GLU B 15 11.069 -4.908 9.566 1.00 16.12 C ATOM 1812 CD GLU B 15 11.850 -6.198 9.723 1.00 25.30 C ATOM 1813 OE1 GLU B 15 13.052 -6.193 9.384 1.00 30.85 O ATOM 1814 OE2 GLU B 15 11.272 -7.207 10.149 1.00 21.48 O ATOM 1815 HA GLU B 15 9.102 -3.354 8.489 1.00 0.00 H ATOM 1816 HB2 GLU B 15 9.291 -5.597 10.540 1.00 0.00 H ATOM 1817 HB3 GLU B 15 9.299 -5.818 8.775 1.00 0.00 H ATOM 1818 HG2 GLU B 15 11.339 -4.447 8.616 1.00 0.00 H ATOM 1819 HG3 GLU B 15 11.332 -4.236 10.383 1.00 0.00 H ATOM 1820 H GLU B 15 9.588 -3.148 11.321 1.00 0.00 H ATOM 1821 N PRO B 16 6.749 -4.483 8.224 1.00 10.80 N ATOM 1822 CA PRO B 16 7.430 -4.542 6.897 1.00 11.67 C ATOM 1823 C PRO B 16 7.674 -3.153 6.371 1.00 12.22 C ATOM 1824 O PRO B 16 6.740 -2.315 6.426 1.00 12.25 O ATOM 1825 CB PRO B 16 6.426 -5.278 6.021 1.00 12.19 C ATOM 1826 CG PRO B 16 5.048 -5.004 6.672 1.00 11.27 C ATOM 1827 CD PRO B 16 5.321 -4.875 8.150 1.00 12.16 C ATOM 1828 HA PRO B 16 8.404 -5.031 6.934 1.00 0.00 H ATOM 1829 HD3 PRO B 16 4.686 -4.109 8.595 1.00 0.00 H ATOM 1830 HD2 PRO B 16 5.154 -5.824 8.659 1.00 0.00 H ATOM 1831 HG3 PRO B 16 4.364 -5.831 6.481 1.00 0.00 H ATOM 1832 HG2 PRO B 16 4.618 -4.082 6.281 1.00 0.00 H ATOM 1833 HB2 PRO B 16 6.452 -4.893 5.002 1.00 0.00 H ATOM 1834 HB3 PRO B 16 6.639 -6.347 6.009 1.00 0.00 H ATOM 1835 N ARG B 17 8.854 -2.912 5.804 1.00 12.56 N ATOM 1836 CA ARG B 17 9.175 -1.602 5.221 1.00 11.81 C ATOM 1837 C ARG B 17 9.873 -1.752 3.916 1.00 13.74 C ATOM 1838 O ARG B 17 10.374 -2.825 3.554 1.00 15.52 O ATOM 1839 CB ARG B 17 9.988 -0.766 6.214 1.00 14.52 C ATOM 1840 CG ARG B 17 11.340 -1.385 6.566 1.00 18.77 C ATOM 1841 CD ARG B 17 11.974 -0.551 7.658 1.00 22.90 C ATOM 1842 NE ARG B 17 13.164 -1.221 8.146 1.00 28.17 N ATOM 1843 CZ ARG B 17 13.359 -1.656 9.390 1.00 22.27 C ATOM 1844 NH1 ARG B 17 12.518 -1.440 10.394 1.00 20.78 N ATOM 1845 NH2 ARG B 17 14.509 -2.259 9.652 1.00 27.50 N ATOM 1846 HA ARG B 17 8.245 -1.070 5.021 1.00 0.00 H ATOM 1847 HB2 ARG B 17 10.161 0.217 5.777 1.00 0.00 H ATOM 1848 HB3 ARG B 17 9.408 -0.658 7.131 1.00 0.00 H ATOM 1849 HG2 ARG B 17 11.198 -2.407 6.918 1.00 0.00 H ATOM 1850 HG3 ARG B 17 11.983 -1.391 5.686 1.00 0.00 H ATOM 1851 HD2 ARG B 17 11.266 -0.424 8.477 1.00 0.00 H ATOM 1852 HD3 ARG B 17 12.244 0.427 7.259 1.00 0.00 H ATOM 1853 HE ARG B 17 13.934 -1.376 7.464 1.00 0.00 H ATOM 1854 HH12 ARG B 17 12.734 -1.810 11.342 1.00 0.00 H ATOM 1855 HH11 ARG B 17 11.643 -0.901 10.233 1.00 0.00 H ATOM 1856 HH22 ARG B 17 14.703 -2.614 10.610 1.00 0.00 H ATOM 1857 HH21 ARG B 17 15.217 -2.377 8.900 1.00 0.00 H ATOM 1858 H ARG B 17 9.566 -3.669 5.773 1.00 0.00 H ATOM 1859 N ILE B 18 9.867 -0.679 3.140 1.00 13.04 N ATOM 1860 CA ILE B 18 10.532 -0.683 1.828 1.00 13.73 C ATOM 1861 C ILE B 18 10.946 0.736 1.458 1.00 14.04 C ATOM 1862 O ILE B 18 10.269 1.676 1.820 1.00 13.62 O ATOM 1863 CB ILE B 18 9.617 -1.238 0.704 1.00 18.24 C ATOM 1864 CG1 ILE B 18 10.404 -1.509 -0.585 1.00 20.72 C ATOM 1865 CG2 ILE B 18 8.412 -0.351 0.515 1.00 18.27 C ATOM 1866 CD1 ILE B 18 9.534 -2.101 -1.685 1.00 28.31 C ATOM 1867 HA ILE B 18 11.402 -1.334 1.913 1.00 0.00 H ATOM 1868 HB ILE B 18 9.233 -2.211 1.009 1.00 0.00 H ATOM 1869 HG12 ILE B 18 10.827 -0.570 -0.941 1.00 0.00 H ATOM 1870 HG13 ILE B 18 11.210 -2.208 -0.362 1.00 0.00 H ATOM 1871 HD11 ILE B 18 9.112 -3.046 -1.344 1.00 0.00 H ATOM 1872 HD12 ILE B 18 8.728 -1.406 -1.923 1.00 0.00 H ATOM 1873 HD13 ILE B 18 10.141 -2.273 -2.574 1.00 0.00 H ATOM 1874 HG21 ILE B 18 7.845 -0.308 1.445 1.00 0.00 H ATOM 1875 HG22 ILE B 18 8.740 0.652 0.242 1.00 0.00 H ATOM 1876 HG23 ILE B 18 7.784 -0.758 -0.277 1.00 0.00 H ATOM 1877 H ILE B 18 9.383 0.183 3.464 1.00 0.00 H ATOM 1878 N THR B 19 12.065 0.857 0.757 1.00 16.88 N ATOM 1879 CA THR B 19 12.553 2.155 0.299 1.00 16.19 C ATOM 1880 C THR B 19 12.389 2.258 -1.193 1.00 15.29 C ATOM 1881 O THR B 19 12.872 1.365 -1.940 1.00 18.24 O ATOM 1882 CB THR B 19 14.013 2.323 0.696 1.00 18.39 C ATOM 1883 OG1 THR B 19 14.112 2.211 2.106 1.00 18.08 O ATOM 1884 CG2 THR B 19 14.562 3.693 0.260 1.00 18.04 C ATOM 1885 HA THR B 19 11.974 2.951 0.767 1.00 0.00 H ATOM 1886 HB THR B 19 14.600 1.550 0.200 1.00 0.00 H ATOM 1887 HG1 THR B 19 13.785 1.320 2.389 1.00 0.00 H ATOM 1888 HG23 THR B 19 14.488 3.784 -0.824 1.00 0.00 H ATOM 1889 HG21 THR B 19 13.980 4.484 0.733 1.00 0.00 H ATOM 1890 HG22 THR B 19 15.606 3.778 0.563 1.00 0.00 H ATOM 1891 H THR B 19 12.611 0.002 0.527 1.00 0.00 H ATOM 1892 N LEU B 20 11.683 3.293 -1.639 1.00 15.57 N ATOM 1893 CA LEU B 20 11.459 3.595 -3.058 1.00 17.43 C ATOM 1894 C LEU B 20 11.925 5.003 -3.367 1.00 14.97 C ATOM 1895 O LEU B 20 11.779 5.889 -2.532 1.00 17.05 O ATOM 1896 CB LEU B 20 9.982 3.528 -3.443 1.00 19.67 C ATOM 1897 CG LEU B 20 9.231 2.227 -3.158 1.00 22.13 C ATOM 1898 CD1 LEU B 20 7.804 2.416 -3.548 1.00 24.20 C ATOM 1899 CD2 LEU B 20 9.836 1.093 -3.939 1.00 27.95 C ATOM 1900 HA LEU B 20 12.017 2.846 -3.620 1.00 0.00 H ATOM 1901 HB2 LEU B 20 9.469 4.325 -2.905 1.00 0.00 H ATOM 1902 HB3 LEU B 20 9.916 3.714 -4.515 1.00 0.00 H ATOM 1903 HG LEU B 20 9.300 1.982 -2.098 1.00 0.00 H ATOM 1904 HD21 LEU B 20 9.774 1.314 -5.005 1.00 0.00 H ATOM 1905 HD22 LEU B 20 10.880 0.972 -3.651 1.00 0.00 H ATOM 1906 HD23 LEU B 20 9.290 0.174 -3.725 1.00 0.00 H ATOM 1907 HD11 LEU B 20 7.375 3.232 -2.966 1.00 0.00 H ATOM 1908 HD12 LEU B 20 7.748 2.656 -4.610 1.00 0.00 H ATOM 1909 HD13 LEU B 20 7.250 1.498 -3.352 1.00 0.00 H ATOM 1910 H LEU B 20 11.261 3.932 -0.935 1.00 0.00 H ATOM 1911 N LYS B 21 12.373 5.234 -4.590 1.00 15.81 N ATOM 1912 CA LYS B 21 12.705 6.603 -4.990 1.00 16.50 C ATOM 1913 C LYS B 21 11.431 7.321 -5.406 1.00 16.26 C ATOM 1914 O LYS B 21 10.643 6.812 -6.206 1.00 18.63 O ATOM 1915 CB LYS B 21 13.706 6.590 -6.138 1.00 20.46 C ATOM 1916 CG LYS B 21 15.092 6.219 -5.682 1.00 28.56 C ATOM 1917 CD LYS B 21 16.056 6.068 -6.852 1.00 35.21 C ATOM 1918 CE LYS B 21 16.291 7.379 -7.572 1.00 38.95 C ATOM 1919 NZ LYS B 21 17.117 7.146 -8.805 1.00 44.95 N ATOM 1920 HA LYS B 21 13.159 7.128 -4.150 1.00 0.00 H ATOM 1921 HB2 LYS B 21 13.376 5.866 -6.883 1.00 0.00 H ATOM 1922 HB3 LYS B 21 13.738 7.583 -6.587 1.00 0.00 H ATOM 1923 HG2 LYS B 21 15.464 6.998 -5.017 1.00 0.00 H ATOM 1924 HG3 LYS B 21 15.044 5.274 -5.141 1.00 0.00 H ATOM 1925 HD2 LYS B 21 17.010 5.698 -6.476 1.00 0.00 H ATOM 1926 HD3 LYS B 21 15.641 5.349 -7.558 1.00 0.00 H ATOM 1927 HE2 LYS B 21 16.817 8.066 -6.909 1.00 0.00 H ATOM 1928 HE3 LYS B 21 15.332 7.812 -7.856 1.00 0.00 H ATOM 1929 HZ1 LYS B 21 18.033 6.734 -8.535 1.00 0.00 H ATOM 1930 HZ2 LYS B 21 16.615 6.492 -9.439 1.00 0.00 H ATOM 1931 HZ3 LYS B 21 17.273 8.051 -9.292 1.00 0.00 H ATOM 1932 H LYS B 21 12.489 4.449 -5.262 1.00 0.00 H ATOM 1933 N VAL B 22 11.241 8.487 -4.810 1.00 14.28 N ATOM 1934 CA VAL B 22 10.071 9.325 -5.077 1.00 14.39 C ATOM 1935 C VAL B 22 10.616 10.714 -5.407 1.00 15.64 C ATOM 1936 O VAL B 22 11.349 11.293 -4.615 1.00 13.49 O ATOM 1937 CB VAL B 22 9.131 9.454 -3.833 1.00 15.04 C ATOM 1938 CG1 VAL B 22 7.939 10.363 -4.155 1.00 16.83 C ATOM 1939 CG2 VAL B 22 8.605 8.079 -3.388 1.00 15.46 C ATOM 1940 HA VAL B 22 9.484 8.882 -5.882 1.00 0.00 H ATOM 1941 HB VAL B 22 9.718 9.888 -3.023 1.00 0.00 H ATOM 1942 HG11 VAL B 22 8.303 11.353 -4.430 1.00 0.00 H ATOM 1943 HG12 VAL B 22 7.374 9.939 -4.985 1.00 0.00 H ATOM 1944 HG13 VAL B 22 7.296 10.441 -3.278 1.00 0.00 H ATOM 1945 HG21 VAL B 22 8.043 7.625 -4.204 1.00 0.00 H ATOM 1946 HG22 VAL B 22 9.446 7.438 -3.124 1.00 0.00 H ATOM 1947 HG23 VAL B 22 7.955 8.203 -2.522 1.00 0.00 H ATOM 1948 H VAL B 22 11.950 8.821 -4.126 1.00 0.00 H ATOM 1949 N GLY B 23 10.275 11.236 -6.590 1.00 14.48 N ATOM 1950 CA GLY B 23 10.814 12.539 -7.023 1.00 15.30 C ATOM 1951 C GLY B 23 12.314 12.565 -7.099 1.00 18.65 C ATOM 1952 O GLY B 23 12.938 13.648 -7.041 1.00 19.25 O ATOM 1953 HA3 GLY B 23 10.490 13.301 -6.314 1.00 0.00 H ATOM 1954 HA2 GLY B 23 10.413 12.769 -8.010 1.00 0.00 H ATOM 1955 H GLY B 23 9.622 10.717 -7.212 1.00 0.00 H ATOM 1956 N GLY B 24 12.903 11.389 -7.208 1.00 15.25 N ATOM 1957 CA GLY B 24 14.333 11.283 -7.402 1.00 16.65 C ATOM 1958 C GLY B 24 15.113 10.874 -6.181 1.00 20.09 C ATOM 1959 O GLY B 24 16.289 10.560 -6.292 1.00 20.12 O ATOM 1960 HA3 GLY B 24 14.703 12.255 -7.730 1.00 0.00 H ATOM 1961 HA2 GLY B 24 14.515 10.544 -8.183 1.00 0.00 H ATOM 1962 H GLY B 24 12.329 10.523 -7.154 1.00 0.00 H ATOM 1963 N GLN B 25 14.470 10.798 -5.004 1.00 15.08 N ATOM 1964 CA GLN B 25 15.191 10.510 -3.779 1.00 15.65 C ATOM 1965 C GLN B 25 14.478 9.426 -2.949 1.00 16.75 C ATOM 1966 O GLN B 25 13.254 9.312 -2.998 1.00 14.90 O ATOM 1967 CB GLN B 25 15.349 11.764 -2.938 1.00 14.19 C ATOM 1968 CG GLN B 25 16.283 12.864 -3.564 1.00 13.93 C ATOM 1969 CD GLN B 25 17.671 12.362 -3.796 1.00 16.56 C ATOM 1970 OE1 GLN B 25 18.182 11.552 -3.030 1.00 22.08 O ATOM 1971 NE2 GLN B 25 18.298 12.856 -4.863 1.00 18.40 N ATOM 1972 HA GLN B 25 16.176 10.141 -4.065 1.00 0.00 H ATOM 1973 HB2 GLN B 25 14.361 12.201 -2.791 1.00 0.00 H ATOM 1974 HB3 GLN B 25 15.764 11.475 -1.973 1.00 0.00 H ATOM 1975 HG2 GLN B 25 15.861 13.182 -4.517 1.00 0.00 H ATOM 1976 HG3 GLN B 25 16.327 13.716 -2.885 1.00 0.00 H ATOM 1977 HE22 GLN B 25 17.815 13.541 -5.479 1.00 0.00 H ATOM 1978 HE21 GLN B 25 19.270 12.556 -5.080 1.00 0.00 H ATOM 1979 H GLN B 25 13.441 10.948 -4.971 1.00 0.00 H ATOM 1980 N PRO B 26 15.243 8.640 -2.183 1.00 15.05 N ATOM 1981 CA PRO B 26 14.594 7.520 -1.461 1.00 15.35 C ATOM 1982 C PRO B 26 13.710 7.963 -0.334 1.00 17.04 C ATOM 1983 O PRO B 26 14.013 8.919 0.390 1.00 19.10 O ATOM 1984 CB PRO B 26 15.802 6.722 -0.929 1.00 17.22 C ATOM 1985 CG PRO B 26 17.022 7.659 -1.019 1.00 22.88 C ATOM 1986 CD PRO B 26 16.726 8.527 -2.198 1.00 18.78 C ATOM 1987 HA PRO B 26 13.924 6.954 -2.108 1.00 0.00 H ATOM 1988 HD3 PRO B 26 17.193 9.506 -2.088 1.00 0.00 H ATOM 1989 HD2 PRO B 26 17.072 8.062 -3.121 1.00 0.00 H ATOM 1990 HG3 PRO B 26 17.938 7.089 -1.177 1.00 0.00 H ATOM 1991 HG2 PRO B 26 17.120 8.256 -0.113 1.00 0.00 H ATOM 1992 HB2 PRO B 26 15.631 6.425 0.106 1.00 0.00 H ATOM 1993 HB3 PRO B 26 15.964 5.833 -1.539 1.00 0.00 H ATOM 1994 N VAL B 27 12.588 7.245 -0.200 1.00 13.84 N ATOM 1995 CA VAL B 27 11.667 7.355 0.926 1.00 12.52 C ATOM 1996 C VAL B 27 11.478 5.967 1.505 1.00 11.15 C ATOM 1997 O VAL B 27 11.163 5.038 0.754 1.00 12.21 O ATOM 1998 CB VAL B 27 10.269 7.882 0.490 1.00 14.37 C ATOM 1999 CG1 VAL B 27 9.297 7.992 1.657 1.00 15.98 C ATOM 2000 CG2 VAL B 27 10.368 9.249 -0.153 1.00 16.16 C ATOM 2001 HA VAL B 27 12.088 8.056 1.646 1.00 0.00 H ATOM 2002 HB VAL B 27 9.895 7.150 -0.225 1.00 0.00 H ATOM 2003 HG11 VAL B 27 9.160 7.009 2.108 1.00 0.00 H ATOM 2004 HG12 VAL B 27 9.699 8.681 2.400 1.00 0.00 H ATOM 2005 HG13 VAL B 27 8.338 8.364 1.296 1.00 0.00 H ATOM 2006 HG21 VAL B 27 10.797 9.954 0.559 1.00 0.00 H ATOM 2007 HG22 VAL B 27 11.005 9.189 -1.035 1.00 0.00 H ATOM 2008 HG23 VAL B 27 9.373 9.585 -0.445 1.00 0.00 H ATOM 2009 H VAL B 27 12.357 6.562 -0.950 1.00 0.00 H ATOM 2010 N THR B 28 11.645 5.859 2.821 1.00 12.05 N ATOM 2011 CA THR B 28 11.404 4.569 3.480 1.00 11.17 C ATOM 2012 C THR B 28 10.005 4.565 4.042 1.00 12.13 C ATOM 2013 O THR B 28 9.678 5.359 4.925 1.00 14.45 O ATOM 2014 CB THR B 28 12.443 4.285 4.524 1.00 13.69 C ATOM 2015 OG1 THR B 28 13.736 4.282 3.923 1.00 16.56 O ATOM 2016 CG2 THR B 28 12.229 2.929 5.118 1.00 15.40 C ATOM 2017 HA THR B 28 11.488 3.762 2.752 1.00 0.00 H ATOM 2018 HB THR B 28 12.367 5.053 5.293 1.00 0.00 H ATOM 2019 HG1 THR B 28 13.772 3.582 3.223 1.00 0.00 H ATOM 2020 HG23 THR B 28 11.247 2.891 5.589 1.00 0.00 H ATOM 2021 HG21 THR B 28 12.286 2.176 4.332 1.00 0.00 H ATOM 2022 HG22 THR B 28 12.999 2.735 5.864 1.00 0.00 H ATOM 2023 H THR B 28 11.945 6.684 3.380 1.00 0.00 H ATOM 2024 N PHE B 29 9.180 3.684 3.503 1.00 11.63 N ATOM 2025 CA PHE B 29 7.781 3.564 3.884 1.00 9.93 C ATOM 2026 C PHE B 29 7.518 2.389 4.814 1.00 10.45 C ATOM 2027 O PHE B 29 8.148 1.328 4.670 1.00 11.01 O ATOM 2028 CB PHE B 29 6.938 3.241 2.642 1.00 10.71 C ATOM 2029 CG PHE B 29 6.896 4.318 1.592 1.00 8.92 C ATOM 2030 CD1 PHE B 29 5.876 5.234 1.579 1.00 10.64 C ATOM 2031 CD2 PHE B 29 7.815 4.337 0.544 1.00 10.40 C ATOM 2032 CE1 PHE B 29 5.781 6.176 0.572 1.00 11.23 C ATOM 2033 CE2 PHE B 29 7.743 5.293 -0.446 1.00 10.87 C ATOM 2034 CZ PHE B 29 6.716 6.203 -0.444 1.00 10.89 C ATOM 2035 HA PHE B 29 7.529 4.509 4.366 1.00 0.00 H ATOM 2036 HB2 PHE B 29 7.346 2.340 2.184 1.00 0.00 H ATOM 2037 HB3 PHE B 29 5.916 3.050 2.969 1.00 0.00 H ATOM 2038 HD2 PHE B 29 8.603 3.584 0.507 1.00 0.00 H ATOM 2039 HE2 PHE B 29 8.500 5.326 -1.229 1.00 0.00 H ATOM 2040 HZ PHE B 29 6.639 6.943 -1.240 1.00 0.00 H ATOM 2041 HE1 PHE B 29 4.966 6.900 0.580 1.00 0.00 H ATOM 2042 HD1 PHE B 29 5.130 5.219 2.374 1.00 0.00 H ATOM 2043 H PHE B 29 9.549 3.045 2.770 1.00 0.00 H ATOM 2044 N LEU B 30 6.554 2.533 5.710 1.00 9.94 N ATOM 2045 CA LEU B 30 5.888 1.367 6.308 1.00 9.68 C ATOM 2046 C LEU B 30 4.980 0.788 5.250 1.00 10.48 C ATOM 2047 O LEU B 30 4.150 1.514 4.671 1.00 10.51 O ATOM 2048 CB LEU B 30 5.036 1.817 7.502 1.00 11.10 C ATOM 2049 CG LEU B 30 4.217 0.704 8.133 1.00 12.18 C ATOM 2050 CD1 LEU B 30 5.003 -0.482 8.669 1.00 14.38 C ATOM 2051 CD2 LEU B 30 3.403 1.325 9.285 1.00 13.86 C ATOM 2052 HA LEU B 30 6.620 0.636 6.651 1.00 0.00 H ATOM 2053 HB2 LEU B 30 5.701 2.227 8.262 1.00 0.00 H ATOM 2054 HB3 LEU B 30 4.352 2.595 7.162 1.00 0.00 H ATOM 2055 HG LEU B 30 3.601 0.289 7.335 1.00 0.00 H ATOM 2056 HD21 LEU B 30 4.084 1.759 10.017 1.00 0.00 H ATOM 2057 HD22 LEU B 30 2.750 2.102 8.889 1.00 0.00 H ATOM 2058 HD23 LEU B 30 2.801 0.551 9.762 1.00 0.00 H ATOM 2059 HD11 LEU B 30 5.563 -0.942 7.855 1.00 0.00 H ATOM 2060 HD12 LEU B 30 5.694 -0.140 9.440 1.00 0.00 H ATOM 2061 HD13 LEU B 30 4.313 -1.211 9.095 1.00 0.00 H ATOM 2062 H LEU B 30 6.262 3.489 5.996 1.00 0.00 H ATOM 2063 N VAL B 31 5.122 -0.483 4.927 1.00 9.37 N ATOM 2064 CA VAL B 31 4.267 -1.172 3.985 1.00 9.48 C ATOM 2065 C VAL B 31 2.966 -1.447 4.707 1.00 10.92 C ATOM 2066 O VAL B 31 2.949 -2.118 5.753 1.00 10.82 O ATOM 2067 CB VAL B 31 4.938 -2.464 3.523 1.00 11.34 C ATOM 2068 CG1 VAL B 31 3.930 -3.421 2.875 1.00 16.38 C ATOM 2069 CG2 VAL B 31 6.105 -2.085 2.584 1.00 13.65 C ATOM 2070 HA VAL B 31 4.083 -0.575 3.092 1.00 0.00 H ATOM 2071 HB VAL B 31 5.338 -3.012 4.376 1.00 0.00 H ATOM 2072 HG11 VAL B 31 3.155 -3.674 3.598 1.00 0.00 H ATOM 2073 HG12 VAL B 31 3.477 -2.938 2.009 1.00 0.00 H ATOM 2074 HG13 VAL B 31 4.444 -4.329 2.559 1.00 0.00 H ATOM 2075 HG21 VAL B 31 5.716 -1.534 1.727 1.00 0.00 H ATOM 2076 HG22 VAL B 31 6.817 -1.462 3.125 1.00 0.00 H ATOM 2077 HG23 VAL B 31 6.602 -2.992 2.239 1.00 0.00 H ATOM 2078 H VAL B 31 5.892 -1.020 5.375 1.00 0.00 H ATOM 2079 N ASP B 32 1.873 -0.830 4.226 1.00 9.77 N ATOM 2080 CA ASP B 32 0.641 -0.715 4.984 1.00 9.66 C ATOM 2081 C ASP B 32 -0.549 -1.199 4.187 1.00 10.72 C ATOM 2082 O ASP B 32 -1.181 -0.439 3.429 1.00 10.56 O ATOM 2083 CB ASP B 32 0.454 0.762 5.388 1.00 11.86 C ATOM 2084 CG ASP B 32 -0.689 0.952 6.311 1.00 12.92 C ATOM 2085 OD1 ASP B 32 -1.344 -0.025 6.706 1.00 12.01 O ATOM 2086 OD2 ASP B 32 -0.928 2.128 6.746 1.00 14.82 O ATOM 2087 HA ASP B 32 0.708 -1.344 5.872 1.00 0.00 H ATOM 2088 HB2 ASP B 32 1.363 1.109 5.879 1.00 0.00 H ATOM 2089 HB3 ASP B 32 0.280 1.353 4.488 1.00 0.00 H ATOM 2090 H ASP B 32 1.912 -0.418 3.272 1.00 0.00 H ATOM 2091 N THR B 33 -0.938 -2.438 4.413 1.00 9.95 N ATOM 2092 CA THR B 33 -2.098 -2.997 3.739 1.00 11.15 C ATOM 2093 C THR B 33 -3.403 -2.372 4.206 1.00 10.28 C ATOM 2094 O THR B 33 -4.433 -2.591 3.539 1.00 12.44 O ATOM 2095 CB THR B 33 -2.172 -4.510 3.895 1.00 10.98 C ATOM 2096 OG1 THR B 33 -2.211 -4.848 5.285 1.00 10.61 O ATOM 2097 CG2 THR B 33 -0.955 -5.143 3.242 1.00 13.09 C ATOM 2098 HA THR B 33 -1.967 -2.758 2.684 1.00 0.00 H ATOM 2099 HB THR B 33 -3.075 -4.884 3.413 1.00 0.00 H ATOM 2100 HG1 THR B 33 -3.008 -4.434 5.702 1.00 0.00 H ATOM 2101 HG23 THR B 33 -0.934 -4.880 2.184 1.00 0.00 H ATOM 2102 HG21 THR B 33 -0.051 -4.775 3.727 1.00 0.00 H ATOM 2103 HG22 THR B 33 -1.010 -6.226 3.347 1.00 0.00 H ATOM 2104 H THR B 33 -0.405 -3.026 5.086 1.00 0.00 H ATOM 2105 N GLY B 34 -3.382 -1.628 5.319 1.00 10.36 N ATOM 2106 CA GLY B 34 -4.574 -0.905 5.827 1.00 10.54 C ATOM 2107 C GLY B 34 -4.706 0.498 5.220 1.00 9.74 C ATOM 2108 O GLY B 34 -5.652 1.195 5.616 1.00 12.76 O ATOM 2109 HA3 GLY B 34 -4.493 -0.813 6.910 1.00 0.00 H ATOM 2110 HA2 GLY B 34 -5.466 -1.480 5.578 1.00 0.00 H ATOM 2111 H GLY B 34 -2.491 -1.554 5.851 1.00 0.00 H ATOM 2112 N ALA B 35 -3.805 0.923 4.346 1.00 9.81 N ATOM 2113 CA ALA B 35 -3.894 2.286 3.749 1.00 9.45 C ATOM 2114 C ALA B 35 -4.476 2.126 2.332 1.00 9.86 C ATOM 2115 O ALA B 35 -3.902 1.464 1.470 1.00 11.40 O ATOM 2116 CB ALA B 35 -2.522 2.930 3.689 1.00 10.45 C ATOM 2117 HA ALA B 35 -4.530 2.930 4.356 1.00 0.00 H ATOM 2118 HB1 ALA B 35 -2.115 3.010 4.697 1.00 0.00 H ATOM 2119 HB2 ALA B 35 -1.861 2.317 3.077 1.00 0.00 H ATOM 2120 HB3 ALA B 35 -2.608 3.924 3.250 1.00 0.00 H ATOM 2121 H ALA B 35 -3.023 0.295 4.072 1.00 0.00 H ATOM 2122 N GLN B 36 -5.579 2.845 2.086 1.00 10.65 N ATOM 2123 CA GLN B 36 -6.182 2.821 0.794 1.00 8.72 C ATOM 2124 C GLN B 36 -5.293 3.504 -0.260 1.00 10.70 C ATOM 2125 O GLN B 36 -5.346 3.157 -1.426 1.00 12.16 O ATOM 2126 CB GLN B 36 -7.537 3.532 0.900 1.00 10.85 C ATOM 2127 CG GLN B 36 -8.373 3.555 -0.425 1.00 12.56 C ATOM 2128 CD GLN B 36 -9.706 4.197 -0.163 1.00 12.16 C ATOM 2129 OE1 GLN B 36 -10.242 4.151 0.946 1.00 13.16 O ATOM 2130 NE2 GLN B 36 -10.275 4.800 -1.218 1.00 14.56 N ATOM 2131 HA GLN B 36 -6.313 1.789 0.470 1.00 0.00 H ATOM 2132 HB2 GLN B 36 -8.127 3.026 1.665 1.00 0.00 H ATOM 2133 HB3 GLN B 36 -7.356 4.563 1.205 1.00 0.00 H ATOM 2134 HG2 GLN B 36 -7.837 4.125 -1.184 1.00 0.00 H ATOM 2135 HG3 GLN B 36 -8.523 2.535 -0.778 1.00 0.00 H ATOM 2136 HE22 GLN B 36 -9.785 4.814 -2.135 1.00 0.00 H ATOM 2137 HE21 GLN B 36 -11.206 5.253 -1.118 1.00 0.00 H ATOM 2138 H GLN B 36 -5.998 3.424 2.842 1.00 0.00 H ATOM 2139 N HIS B 37 -4.528 4.522 0.142 1.00 9.66 N ATOM 2140 CA HIS B 37 -3.635 5.197 -0.743 1.00 9.04 C ATOM 2141 C HIS B 37 -2.358 5.562 0.062 1.00 9.14 C ATOM 2142 O HIS B 37 -2.380 5.616 1.302 1.00 10.46 O ATOM 2143 CB HIS B 37 -4.335 6.442 -1.308 1.00 10.62 C ATOM 2144 CG HIS B 37 -3.741 6.945 -2.584 1.00 10.60 C ATOM 2145 ND1 HIS B 37 -4.185 6.553 -3.833 1.00 11.14 N ATOM 2146 CD2 HIS B 37 -2.676 7.756 -2.806 1.00 11.59 C ATOM 2147 CE1 HIS B 37 -3.456 7.127 -4.770 1.00 12.25 C ATOM 2148 NE2 HIS B 37 -2.525 7.870 -4.173 1.00 12.24 N ATOM 2149 HA HIS B 37 -3.351 4.569 -1.588 1.00 0.00 H ATOM 2150 HB2 HIS B 37 -5.381 6.195 -1.490 1.00 0.00 H ATOM 2151 HB3 HIS B 37 -4.275 7.237 -0.565 1.00 0.00 H ATOM 2152 HD2 HIS B 37 -2.055 8.230 -2.046 1.00 0.00 H ATOM 2153 HE1 HIS B 37 -3.591 7.013 -5.846 1.00 0.00 H ATOM 2154 H HIS B 37 -4.585 4.833 1.133 1.00 0.00 H ATOM 2155 N SER B 38 -1.284 5.782 -0.684 1.00 8.45 N ATOM 2156 CA SER B 38 0.019 6.042 -0.091 1.00 8.72 C ATOM 2157 C SER B 38 0.158 7.460 0.422 1.00 9.40 C ATOM 2158 O SER B 38 -0.490 8.420 -0.085 1.00 9.93 O ATOM 2159 CB SER B 38 1.084 5.693 -1.092 1.00 9.85 C ATOM 2160 OG SER B 38 1.102 4.272 -1.335 1.00 10.52 O ATOM 2161 HA SER B 38 0.133 5.412 0.791 1.00 0.00 H ATOM 2162 HB2 SER B 38 2.055 6.004 -0.706 1.00 0.00 H ATOM 2163 HB3 SER B 38 0.882 6.215 -2.028 1.00 0.00 H ATOM 2164 HG SER B 38 0.222 3.988 -1.688 1.00 0.00 H ATOM 2165 H SER B 38 -1.375 5.768 -1.720 1.00 0.00 H ATOM 2166 N VAL B 39 0.986 7.603 1.430 1.00 9.13 N ATOM 2167 CA VAL B 39 1.096 8.797 2.251 1.00 8.91 C ATOM 2168 C VAL B 39 2.536 9.239 2.420 1.00 9.63 C ATOM 2169 O VAL B 39 3.437 8.435 2.737 1.00 9.88 O ATOM 2170 CB VAL B 39 0.525 8.470 3.675 1.00 8.41 C ATOM 2171 CG1 VAL B 39 0.802 9.572 4.710 1.00 9.87 C ATOM 2172 CG2 VAL B 39 -0.989 8.167 3.609 1.00 10.58 C ATOM 2173 HA VAL B 39 0.543 9.597 1.759 1.00 0.00 H ATOM 2174 HB VAL B 39 1.056 7.580 4.013 1.00 0.00 H ATOM 2175 HG11 VAL B 39 1.878 9.711 4.812 1.00 0.00 H ATOM 2176 HG12 VAL B 39 0.344 10.504 4.378 1.00 0.00 H ATOM 2177 HG13 VAL B 39 0.380 9.280 5.672 1.00 0.00 H ATOM 2178 HG21 VAL B 39 -1.515 9.035 3.212 1.00 0.00 H ATOM 2179 HG22 VAL B 39 -1.159 7.309 2.958 1.00 0.00 H ATOM 2180 HG23 VAL B 39 -1.358 7.944 4.610 1.00 0.00 H ATOM 2181 H VAL B 39 1.610 6.803 1.658 1.00 0.00 H ATOM 2182 N LEU B 40 2.758 10.540 2.216 1.00 9.02 N ATOM 2183 CA LEU B 40 3.996 11.231 2.613 1.00 8.63 C ATOM 2184 C LEU B 40 3.704 12.081 3.812 1.00 8.75 C ATOM 2185 O LEU B 40 2.532 12.348 4.088 1.00 10.51 O ATOM 2186 CB LEU B 40 4.569 12.093 1.489 1.00 10.23 C ATOM 2187 CG LEU B 40 4.936 11.314 0.227 1.00 8.24 C ATOM 2188 CD1 LEU B 40 5.441 12.359 -0.842 1.00 12.86 C ATOM 2189 CD2 LEU B 40 6.032 10.319 0.482 1.00 11.93 C ATOM 2190 HA LEU B 40 4.748 10.477 2.846 1.00 0.00 H ATOM 2191 HB2 LEU B 40 3.827 12.846 1.223 1.00 0.00 H ATOM 2192 HB3 LEU B 40 5.468 12.586 1.860 1.00 0.00 H ATOM 2193 HG LEU B 40 4.061 10.763 -0.117 1.00 0.00 H ATOM 2194 HD21 LEU B 40 6.922 10.842 0.832 1.00 0.00 H ATOM 2195 HD22 LEU B 40 5.706 9.607 1.240 1.00 0.00 H ATOM 2196 HD23 LEU B 40 6.261 9.788 -0.442 1.00 0.00 H ATOM 2197 HD11 LEU B 40 4.646 13.075 -1.052 1.00 0.00 H ATOM 2198 HD12 LEU B 40 6.312 12.885 -0.451 1.00 0.00 H ATOM 2199 HD13 LEU B 40 5.713 11.836 -1.759 1.00 0.00 H ATOM 2200 H LEU B 40 2.014 11.097 1.750 1.00 0.00 H ATOM 2201 N THR B 41 4.719 12.461 4.587 1.00 10.20 N ATOM 2202 CA THR B 41 4.482 13.154 5.845 1.00 10.84 C ATOM 2203 C THR B 41 5.298 14.428 6.062 1.00 11.00 C ATOM 2204 O THR B 41 4.937 15.208 6.943 1.00 11.72 O ATOM 2205 CB THR B 41 4.696 12.276 7.076 1.00 10.70 C ATOM 2206 OG1 THR B 41 6.103 12.179 7.389 1.00 12.87 O ATOM 2207 CG2 THR B 41 4.063 10.894 6.917 1.00 12.52 C ATOM 2208 HA THR B 41 3.432 13.427 5.740 1.00 0.00 H ATOM 2209 HB THR B 41 4.189 12.755 7.914 1.00 0.00 H ATOM 2210 HG1 THR B 41 6.223 11.607 8.188 1.00 0.00 H ATOM 2211 HG23 THR B 41 3.004 11.005 6.682 1.00 0.00 H ATOM 2212 HG21 THR B 41 4.561 10.358 6.109 1.00 0.00 H ATOM 2213 HG22 THR B 41 4.173 10.336 7.847 1.00 0.00 H ATOM 2214 H THR B 41 5.695 12.260 4.289 1.00 0.00 H ATOM 2215 N GLN B 42 6.356 14.632 5.286 1.00 11.29 N ATOM 2216 CA GLN B 42 7.280 15.709 5.610 1.00 12.29 C ATOM 2217 C GLN B 42 7.929 16.290 4.372 1.00 10.29 C ATOM 2218 O GLN B 42 8.514 15.555 3.565 1.00 13.16 O ATOM 2219 CB GLN B 42 8.382 15.120 6.512 1.00 13.29 C ATOM 2220 CG GLN B 42 9.389 16.130 6.998 1.00 16.55 C ATOM 2221 CD GLN B 42 10.471 15.524 7.863 1.00 16.13 C ATOM 2222 OE1 GLN B 42 10.632 14.302 7.956 1.00 17.70 O ATOM 2223 NE2 GLN B 42 11.253 16.390 8.491 1.00 17.03 N ATOM 2224 HA GLN B 42 6.728 16.509 6.103 1.00 0.00 H ATOM 2225 HB2 GLN B 42 7.906 14.666 7.381 1.00 0.00 H ATOM 2226 HB3 GLN B 42 8.912 14.353 5.948 1.00 0.00 H ATOM 2227 HG2 GLN B 42 9.858 16.596 6.132 1.00 0.00 H ATOM 2228 HG3 GLN B 42 8.866 16.890 7.579 1.00 0.00 H ATOM 2229 HE22 GLN B 42 11.086 17.411 8.388 1.00 0.00 H ATOM 2230 HE21 GLN B 42 12.034 16.048 9.087 1.00 0.00 H ATOM 2231 H GLN B 42 6.523 14.029 4.455 1.00 0.00 H ATOM 2232 N ASN B 43 7.859 17.626 4.240 1.00 10.55 N ATOM 2233 CA ASN B 43 8.470 18.329 3.087 1.00 12.61 C ATOM 2234 C ASN B 43 8.151 17.590 1.802 1.00 11.57 C ATOM 2235 O ASN B 43 8.998 17.160 1.021 1.00 12.94 O ATOM 2236 CB ASN B 43 9.976 18.507 3.278 1.00 11.52 C ATOM 2237 CG ASN B 43 10.253 19.313 4.508 1.00 11.65 C ATOM 2238 OD1 ASN B 43 9.637 20.389 4.684 1.00 13.75 O ATOM 2239 ND2 ASN B 43 11.091 18.812 5.382 1.00 13.56 N ATOM 2240 HA ASN B 43 8.041 19.329 3.021 1.00 0.00 H ATOM 2241 HB2 ASN B 43 10.444 17.528 3.377 1.00 0.00 H ATOM 2242 HB3 ASN B 43 10.390 19.021 2.411 1.00 0.00 H ATOM 2243 HD22 ASN B 43 11.575 17.913 5.182 1.00 0.00 H ATOM 2244 HD21 ASN B 43 11.272 19.313 6.275 1.00 0.00 H ATOM 2245 H ASN B 43 7.363 18.181 4.966 1.00 0.00 H ATOM 2246 N PRO B 44 6.843 17.465 1.527 1.00 12.60 N ATOM 2247 CA PRO B 44 6.383 16.663 0.457 1.00 16.10 C ATOM 2248 C PRO B 44 6.580 17.170 -1.020 1.00 11.28 C ATOM 2249 O PRO B 44 6.268 16.465 -1.968 1.00 14.06 O ATOM 2250 CB PRO B 44 4.862 16.509 0.788 1.00 12.75 C ATOM 2251 CG PRO B 44 4.546 17.777 1.297 1.00 13.83 C ATOM 2252 CD PRO B 44 5.695 18.039 2.231 1.00 12.38 C ATOM 2253 HA PRO B 44 6.983 15.754 0.423 1.00 0.00 H ATOM 2254 HD3 PRO B 44 5.831 19.108 2.392 1.00 0.00 H ATOM 2255 HD2 PRO B 44 5.539 17.545 3.190 1.00 0.00 H ATOM 2256 HG3 PRO B 44 3.596 17.763 1.832 1.00 0.00 H ATOM 2257 HG2 PRO B 44 4.503 18.523 0.503 1.00 0.00 H ATOM 2258 HB2 PRO B 44 4.282 16.285 -0.107 1.00 0.00 H ATOM 2259 HB3 PRO B 44 4.695 15.730 1.532 1.00 0.00 H ATOM 2260 N GLY B 45 7.021 18.418 -1.181 1.00 12.99 N ATOM 2261 CA GLY B 45 7.146 19.021 -2.504 1.00 12.88 C ATOM 2262 C GLY B 45 5.827 19.670 -2.851 1.00 12.46 C ATOM 2263 O GLY B 45 4.937 19.852 -1.995 1.00 14.65 O ATOM 2264 HA3 GLY B 45 7.385 18.253 -3.239 1.00 0.00 H ATOM 2265 HA2 GLY B 45 7.936 19.772 -2.495 1.00 0.00 H ATOM 2266 H GLY B 45 7.282 18.976 -0.343 1.00 0.00 H ATOM 2267 N PRO B 46 5.696 20.071 -4.115 1.00 13.09 N ATOM 2268 CA PRO B 46 4.533 20.837 -4.540 1.00 13.21 C ATOM 2269 C PRO B 46 3.224 20.066 -4.260 1.00 14.34 C ATOM 2270 O PRO B 46 3.122 18.859 -4.545 1.00 13.35 O ATOM 2271 CB PRO B 46 4.765 20.986 -6.045 1.00 17.46 C ATOM 2272 CG PRO B 46 6.302 20.936 -6.210 1.00 20.13 C ATOM 2273 CD PRO B 46 6.768 19.991 -5.123 1.00 14.83 C ATOM 2274 HA PRO B 46 4.427 21.788 -4.017 1.00 0.00 H ATOM 2275 HD3 PRO B 46 6.868 18.975 -5.506 1.00 0.00 H ATOM 2276 HD2 PRO B 46 7.721 20.316 -4.706 1.00 0.00 H ATOM 2277 HG3 PRO B 46 6.737 21.926 -6.073 1.00 0.00 H ATOM 2278 HG2 PRO B 46 6.572 20.555 -7.195 1.00 0.00 H ATOM 2279 HB2 PRO B 46 4.292 20.169 -6.590 1.00 0.00 H ATOM 2280 HB3 PRO B 46 4.370 21.937 -6.403 1.00 0.00 H ATOM 2281 N LEU B 47 2.249 20.829 -3.780 1.00 15.53 N ATOM 2282 CA LEU B 47 0.911 20.310 -3.452 1.00 13.16 C ATOM 2283 C LEU B 47 -0.086 20.708 -4.524 1.00 15.47 C ATOM 2284 O LEU B 47 -0.008 21.832 -5.061 1.00 18.18 O ATOM 2285 CB LEU B 47 0.455 20.787 -2.102 1.00 15.95 C ATOM 2286 CG LEU B 47 1.361 20.338 -0.943 1.00 16.00 C ATOM 2287 CD1 LEU B 47 0.790 20.821 0.329 1.00 18.20 C ATOM 2288 CD2 LEU B 47 1.540 18.840 -0.871 1.00 16.15 C ATOM 2289 HA LEU B 47 0.971 19.222 -3.416 1.00 0.00 H ATOM 2290 HB2 LEU B 47 0.427 21.877 -2.114 1.00 0.00 H ATOM 2291 HB3 LEU B 47 -0.549 20.401 -1.923 1.00 0.00 H ATOM 2292 HG LEU B 47 2.347 20.766 -1.123 1.00 0.00 H ATOM 2293 HD21 LEU B 47 0.569 18.366 -0.732 1.00 0.00 H ATOM 2294 HD22 LEU B 47 1.990 18.484 -1.798 1.00 0.00 H ATOM 2295 HD23 LEU B 47 2.190 18.593 -0.031 1.00 0.00 H ATOM 2296 HD11 LEU B 47 0.730 21.909 0.309 1.00 0.00 H ATOM 2297 HD12 LEU B 47 -0.208 20.403 0.459 1.00 0.00 H ATOM 2298 HD13 LEU B 47 1.428 20.506 1.155 1.00 0.00 H ATOM 2299 H LEU B 47 2.439 21.840 -3.629 1.00 0.00 H ATOM 2300 N SER B 48 -1.025 19.824 -4.836 1.00 14.47 N ATOM 2301 CA SER B 48 -2.224 20.154 -5.615 1.00 14.80 C ATOM 2302 C SER B 48 -3.103 21.116 -4.822 1.00 17.01 C ATOM 2303 O SER B 48 -2.985 21.260 -3.596 1.00 15.71 O ATOM 2304 CB SER B 48 -2.964 18.855 -5.918 1.00 18.26 C ATOM 2305 OG SER B 48 -4.221 19.059 -6.550 1.00 12.08 O ATOM 2306 HA SER B 48 -1.956 20.644 -6.551 1.00 0.00 H ATOM 2307 HB2 SER B 48 -3.130 18.324 -4.981 1.00 0.00 H ATOM 2308 HB3 SER B 48 -2.341 18.246 -6.574 1.00 0.00 H ATOM 2309 HG SER B 48 -4.650 18.183 -6.720 1.00 0.00 H ATOM 2310 H SER B 48 -0.905 18.844 -4.511 1.00 0.00 H ATOM 2311 N ASP B 49 -4.033 21.765 -5.544 1.00 17.82 N ATOM 2312 CA ASP B 49 -5.090 22.470 -4.823 1.00 18.41 C ATOM 2313 C ASP B 49 -6.142 21.497 -4.279 1.00 17.04 C ATOM 2314 O ASP B 49 -6.950 21.898 -3.442 1.00 20.86 O ATOM 2315 CB ASP B 49 -5.739 23.531 -5.744 1.00 22.46 C ATOM 2316 CG ASP B 49 -4.765 24.650 -6.130 1.00 25.76 C ATOM 2317 OD1 ASP B 49 -3.862 24.994 -5.329 1.00 30.56 O ATOM 2318 OD2 ASP B 49 -4.920 25.188 -7.242 1.00 33.14 O ATOM 2319 HA ASP B 49 -4.644 22.974 -3.966 1.00 0.00 H ATOM 2320 HB2 ASP B 49 -6.085 23.040 -6.653 1.00 0.00 H ATOM 2321 HB3 ASP B 49 -6.590 23.972 -5.224 1.00 0.00 H ATOM 2322 H ASP B 49 -4.001 21.765 -6.584 1.00 0.00 H ATOM 2323 N LYS B 50 -6.099 20.242 -4.732 1.00 14.78 N ATOM 2324 CA LYS B 50 -7.112 19.229 -4.349 1.00 12.36 C ATOM 2325 C LYS B 50 -6.780 18.587 -3.015 1.00 14.68 C ATOM 2326 O LYS B 50 -5.606 18.499 -2.635 1.00 14.33 O ATOM 2327 CB LYS B 50 -7.276 18.152 -5.415 1.00 16.21 C ATOM 2328 CG LYS B 50 -7.844 18.650 -6.781 1.00 20.69 C ATOM 2329 CD LYS B 50 -9.143 19.433 -6.585 1.00 30.36 C ATOM 2330 CE LYS B 50 -9.342 20.532 -7.631 1.00 42.10 C ATOM 2331 NZ LYS B 50 -10.129 20.085 -8.807 1.00 36.62 N ATOM 2332 HA LYS B 50 -8.059 19.761 -4.256 1.00 0.00 H ATOM 2333 HB2 LYS B 50 -6.298 17.707 -5.598 1.00 0.00 H ATOM 2334 HB3 LYS B 50 -7.953 17.392 -5.025 1.00 0.00 H ATOM 2335 HG2 LYS B 50 -7.107 19.296 -7.259 1.00 0.00 H ATOM 2336 HG3 LYS B 50 -8.040 17.789 -7.420 1.00 0.00 H ATOM 2337 HD2 LYS B 50 -9.981 18.738 -6.647 1.00 0.00 H ATOM 2338 HD3 LYS B 50 -9.126 19.893 -5.597 1.00 0.00 H ATOM 2339 HE2 LYS B 50 -8.363 20.864 -7.975 1.00 0.00 H ATOM 2340 HE3 LYS B 50 -9.863 21.367 -7.162 1.00 0.00 H ATOM 2341 HZ1 LYS B 50 -9.638 19.294 -9.271 1.00 0.00 H ATOM 2342 HZ2 LYS B 50 -11.071 19.774 -8.494 1.00 0.00 H ATOM 2343 HZ3 LYS B 50 -10.228 20.874 -9.477 1.00 0.00 H ATOM 2344 H LYS B 50 -5.330 19.966 -5.375 1.00 0.00 H ATOM 2345 N SER B 51 -7.808 18.169 -2.298 1.00 14.41 N ATOM 2346 CA SER B 51 -7.644 17.489 -1.026 1.00 14.70 C ATOM 2347 C SER B 51 -8.524 16.271 -1.023 1.00 12.37 C ATOM 2348 O SER B 51 -9.424 16.078 -1.862 1.00 14.97 O ATOM 2349 CB SER B 51 -7.934 18.432 0.137 1.00 15.24 C ATOM 2350 OG SER B 51 -9.319 18.841 0.106 1.00 14.47 O ATOM 2351 HA SER B 51 -6.611 17.168 -0.896 1.00 0.00 H ATOM 2352 HB2 SER B 51 -7.295 19.312 0.057 1.00 0.00 H ATOM 2353 HB3 SER B 51 -7.729 17.920 1.077 1.00 0.00 H ATOM 2354 HG SER B 51 -9.498 19.452 0.864 1.00 0.00 H ATOM 2355 H SER B 51 -8.770 18.333 -2.658 1.00 0.00 H ATOM 2356 N ALA B 52 -8.257 15.370 -0.062 1.00 11.63 N ATOM 2357 CA ALA B 52 -9.068 14.195 0.216 1.00 11.91 C ATOM 2358 C ALA B 52 -9.476 14.200 1.659 1.00 12.08 C ATOM 2359 O ALA B 52 -8.724 14.613 2.548 1.00 13.81 O ATOM 2360 CB ALA B 52 -8.236 12.893 -0.021 1.00 17.19 C ATOM 2361 HA ALA B 52 -9.937 14.218 -0.442 1.00 0.00 H ATOM 2362 HB1 ALA B 52 -7.904 12.859 -1.059 1.00 0.00 H ATOM 2363 HB2 ALA B 52 -7.369 12.892 0.640 1.00 0.00 H ATOM 2364 HB3 ALA B 52 -8.857 12.023 0.191 1.00 0.00 H ATOM 2365 H ALA B 52 -7.411 15.524 0.524 1.00 0.00 H ATOM 2366 N TRP B 53 -10.649 13.622 1.929 1.00 12.83 N ATOM 2367 CA TRP B 53 -11.023 13.269 3.273 1.00 12.52 C ATOM 2368 C TRP B 53 -10.320 11.948 3.648 1.00 11.85 C ATOM 2369 O TRP B 53 -10.430 10.941 2.937 1.00 13.84 O ATOM 2370 CB TRP B 53 -12.539 13.016 3.334 1.00 12.27 C ATOM 2371 CG TRP B 53 -12.952 12.749 4.681 1.00 13.34 C ATOM 2372 CD1 TRP B 53 -13.031 11.525 5.302 1.00 16.85 C ATOM 2373 CD2 TRP B 53 -13.342 13.709 5.641 1.00 15.57 C ATOM 2374 NE1 TRP B 53 -13.429 11.690 6.611 1.00 16.52 N ATOM 2375 CE2 TRP B 53 -13.614 13.028 6.843 1.00 19.27 C ATOM 2376 CE3 TRP B 53 -13.482 15.108 5.613 1.00 16.96 C ATOM 2377 CZ2 TRP B 53 -14.064 13.697 7.991 1.00 20.59 C ATOM 2378 CZ3 TRP B 53 -13.909 15.757 6.749 1.00 18.98 C ATOM 2379 CH2 TRP B 53 -14.197 15.063 7.917 1.00 21.27 C ATOM 2380 HA TRP B 53 -10.742 14.076 3.950 1.00 0.00 H ATOM 2381 HB2 TRP B 53 -13.065 13.897 2.966 1.00 0.00 H ATOM 2382 HB3 TRP B 53 -12.785 12.159 2.707 1.00 0.00 H ATOM 2383 HE1 TRP B 53 -13.566 10.928 7.305 1.00 0.00 H ATOM 2384 HD1 TRP B 53 -12.812 10.567 4.830 1.00 0.00 H ATOM 2385 HZ2 TRP B 53 -14.299 13.154 8.907 1.00 0.00 H ATOM 2386 HH2 TRP B 53 -14.536 15.614 8.794 1.00 0.00 H ATOM 2387 HZ3 TRP B 53 -14.024 16.841 6.732 1.00 0.00 H ATOM 2388 HE3 TRP B 53 -13.256 15.669 4.706 1.00 0.00 H ATOM 2389 H TRP B 53 -11.308 13.422 1.150 1.00 0.00 H ATOM 2390 N VAL B 54 -9.572 12.002 4.738 1.00 9.91 N ATOM 2391 CA VAL B 54 -8.865 10.797 5.223 1.00 11.42 C ATOM 2392 C VAL B 54 -9.490 10.349 6.529 1.00 10.80 C ATOM 2393 O VAL B 54 -9.590 11.116 7.490 1.00 11.88 O ATOM 2394 CB VAL B 54 -7.355 11.076 5.423 1.00 10.61 C ATOM 2395 CG1 VAL B 54 -6.626 9.833 6.048 1.00 13.69 C ATOM 2396 CG2 VAL B 54 -6.707 11.410 4.111 1.00 12.65 C ATOM 2397 HA VAL B 54 -8.960 10.009 4.476 1.00 0.00 H ATOM 2398 HB VAL B 54 -7.266 11.921 6.106 1.00 0.00 H ATOM 2399 HG11 VAL B 54 -7.069 9.603 7.017 1.00 0.00 H ATOM 2400 HG12 VAL B 54 -6.737 8.976 5.383 1.00 0.00 H ATOM 2401 HG13 VAL B 54 -5.568 10.060 6.176 1.00 0.00 H ATOM 2402 HG21 VAL B 54 -6.826 10.572 3.425 1.00 0.00 H ATOM 2403 HG22 VAL B 54 -7.180 12.297 3.689 1.00 0.00 H ATOM 2404 HG23 VAL B 54 -5.646 11.603 4.270 1.00 0.00 H ATOM 2405 H VAL B 54 -9.481 12.898 5.257 1.00 0.00 H ATOM 2406 N GLN B 55 -9.965 9.110 6.553 1.00 11.71 N ATOM 2407 CA GLN B 55 -10.459 8.504 7.782 1.00 13.43 C ATOM 2408 C GLN B 55 -9.371 7.655 8.390 1.00 11.30 C ATOM 2409 O GLN B 55 -8.910 6.683 7.773 1.00 12.10 O ATOM 2410 CB GLN B 55 -11.703 7.646 7.471 1.00 15.64 C ATOM 2411 CG GLN B 55 -12.578 7.401 8.729 1.00 18.17 C ATOM 2412 CD GLN B 55 -13.358 8.651 9.198 1.00 16.49 C ATOM 2413 OE1 GLN B 55 -13.779 9.489 8.390 1.00 23.07 O ATOM 2414 NE2 GLN B 55 -13.559 8.766 10.502 1.00 18.49 N ATOM 2415 HA GLN B 55 -10.740 9.282 8.492 1.00 0.00 H ATOM 2416 HB2 GLN B 55 -12.304 8.159 6.720 1.00 0.00 H ATOM 2417 HB3 GLN B 55 -11.376 6.683 7.078 1.00 0.00 H ATOM 2418 HG2 GLN B 55 -13.296 6.613 8.501 1.00 0.00 H ATOM 2419 HG3 GLN B 55 -11.929 7.075 9.542 1.00 0.00 H ATOM 2420 HE22 GLN B 55 -13.190 8.042 11.151 1.00 0.00 H ATOM 2421 HE21 GLN B 55 -14.086 9.581 10.877 1.00 0.00 H ATOM 2422 H GLN B 55 -9.985 8.558 5.672 1.00 0.00 H ATOM 2423 N GLY B 56 -8.969 8.003 9.601 1.00 13.10 N ATOM 2424 CA GLY B 56 -8.005 7.213 10.361 1.00 13.07 C ATOM 2425 C GLY B 56 -8.721 6.435 11.450 1.00 15.91 C ATOM 2426 O GLY B 56 -9.944 6.476 11.572 1.00 17.07 O ATOM 2427 HA3 GLY B 56 -7.270 7.878 10.815 1.00 0.00 H ATOM 2428 HA2 GLY B 56 -7.499 6.517 9.692 1.00 0.00 H ATOM 2429 H GLY B 56 -9.353 8.870 10.027 1.00 0.00 H ATOM 2430 N ALA B 57 -7.927 5.744 12.264 1.00 12.92 N ATOM 2431 CA ALA B 57 -8.504 4.887 13.307 1.00 15.81 C ATOM 2432 C ALA B 57 -9.243 5.710 14.343 1.00 15.85 C ATOM 2433 O ALA B 57 -10.185 5.180 14.966 1.00 16.78 O ATOM 2434 CB ALA B 57 -7.417 4.076 13.949 1.00 18.24 C ATOM 2435 HA ALA B 57 -9.227 4.214 12.847 1.00 0.00 H ATOM 2436 HB1 ALA B 57 -6.935 3.455 13.194 1.00 0.00 H ATOM 2437 HB2 ALA B 57 -6.681 4.745 14.395 1.00 0.00 H ATOM 2438 HB3 ALA B 57 -7.848 3.441 14.723 1.00 0.00 H ATOM 2439 H ALA B 57 -6.894 5.811 12.161 1.00 0.00 H ATOM 2440 N THR B 58 -8.891 6.990 14.538 1.00 15.06 N ATOM 2441 CA THR B 58 -9.379 7.793 15.666 1.00 15.70 C ATOM 2442 C THR B 58 -10.233 8.942 15.238 1.00 18.93 C ATOM 2443 O THR B 58 -10.786 9.649 16.074 1.00 21.79 O ATOM 2444 CB THR B 58 -8.220 8.240 16.590 1.00 19.34 C ATOM 2445 OG1 THR B 58 -7.403 9.191 15.907 1.00 19.18 O ATOM 2446 CG2 THR B 58 -7.335 7.051 16.919 1.00 17.96 C ATOM 2447 HA THR B 58 -10.029 7.142 16.250 1.00 0.00 H ATOM 2448 HB THR B 58 -8.649 8.668 17.496 1.00 0.00 H ATOM 2449 HG1 THR B 58 -7.031 8.777 15.088 1.00 0.00 H ATOM 2450 HG23 THR B 58 -7.922 6.297 17.444 1.00 0.00 H ATOM 2451 HG21 THR B 58 -6.939 6.628 15.996 1.00 0.00 H ATOM 2452 HG22 THR B 58 -6.511 7.378 17.553 1.00 0.00 H ATOM 2453 H THR B 58 -8.242 7.434 13.858 1.00 0.00 H ATOM 2454 N GLY B 59 -10.398 9.133 13.931 1.00 15.59 N ATOM 2455 CA GLY B 59 -11.120 10.293 13.444 1.00 17.46 C ATOM 2456 C GLY B 59 -10.793 10.573 11.994 1.00 18.40 C ATOM 2457 O GLY B 59 -10.068 9.825 11.397 1.00 18.65 O ATOM 2458 HA3 GLY B 59 -10.846 11.160 14.044 1.00 0.00 H ATOM 2459 HA2 GLY B 59 -12.191 10.111 13.538 1.00 0.00 H ATOM 2460 H GLY B 59 -10.007 8.446 13.255 1.00 0.00 H ATOM 2461 N GLY B 60 -11.345 11.629 11.429 1.00 15.99 N ATOM 2462 CA GLY B 60 -11.119 11.973 10.014 1.00 16.51 C ATOM 2463 C GLY B 60 -10.970 13.459 9.833 1.00 16.60 C ATOM 2464 O GLY B 60 -11.500 14.253 10.647 1.00 18.11 O ATOM 2465 HA3 GLY B 60 -11.967 11.626 9.423 1.00 0.00 H ATOM 2466 HA2 GLY B 60 -10.211 11.479 9.668 1.00 0.00 H ATOM 2467 H GLY B 60 -11.961 12.240 12.002 1.00 0.00 H ATOM 2468 N LYS B 61 -10.216 13.861 8.812 1.00 13.83 N ATOM 2469 CA LYS B 61 -10.203 15.248 8.314 1.00 16.06 C ATOM 2470 C LYS B 61 -9.490 15.254 6.975 1.00 13.82 C ATOM 2471 O LYS B 61 -9.095 14.204 6.461 1.00 12.48 O ATOM 2472 CB LYS B 61 -9.559 16.202 9.290 1.00 20.62 C ATOM 2473 CG LYS B 61 -8.164 15.762 9.679 1.00 16.49 C ATOM 2474 CD LYS B 61 -7.473 16.802 10.601 1.00 26.49 C ATOM 2475 CE LYS B 61 -7.386 18.184 9.943 1.00 25.16 C ATOM 2476 NZ LYS B 61 -7.399 19.284 10.948 1.00 32.44 N ATOM 2477 HA LYS B 61 -11.228 15.600 8.196 1.00 0.00 H ATOM 2478 HB2 LYS B 61 -9.502 17.189 8.831 1.00 0.00 H ATOM 2479 HB3 LYS B 61 -10.174 16.255 10.188 1.00 0.00 H ATOM 2480 HG2 LYS B 61 -8.227 14.809 10.205 1.00 0.00 H ATOM 2481 HG3 LYS B 61 -7.567 15.638 8.775 1.00 0.00 H ATOM 2482 HD2 LYS B 61 -8.044 16.887 11.526 1.00 0.00 H ATOM 2483 HD3 LYS B 61 -6.465 16.456 10.829 1.00 0.00 H ATOM 2484 HE2 LYS B 61 -8.237 18.309 9.273 1.00 0.00 H ATOM 2485 HE3 LYS B 61 -6.461 18.243 9.369 1.00 0.00 H ATOM 2486 HZ1 LYS B 61 -8.281 19.240 11.497 1.00 0.00 H ATOM 2487 HZ2 LYS B 61 -6.586 19.177 11.588 1.00 0.00 H ATOM 2488 HZ3 LYS B 61 -7.338 20.200 10.459 1.00 0.00 H ATOM 2489 H LYS B 61 -9.606 13.162 8.343 1.00 0.00 H ATOM 2490 N ARG B 62 -9.410 16.416 6.350 1.00 11.83 N ATOM 2491 CA ARG B 62 -8.912 16.521 5.004 1.00 11.31 C ATOM 2492 C ARG B 62 -7.395 16.801 4.998 1.00 9.90 C ATOM 2493 O ARG B 62 -6.878 17.505 5.864 1.00 11.83 O ATOM 2494 CB ARG B 62 -9.692 17.609 4.242 1.00 12.84 C ATOM 2495 CG ARG B 62 -11.209 17.317 4.181 1.00 12.80 C ATOM 2496 CD ARG B 62 -11.873 18.301 3.203 1.00 11.71 C ATOM 2497 NE ARG B 62 -11.557 18.038 1.819 1.00 11.58 N ATOM 2498 CZ ARG B 62 -12.212 17.191 1.023 1.00 10.90 C ATOM 2499 NH1 ARG B 62 -13.334 16.566 1.448 1.00 12.32 N ATOM 2500 NH2 ARG B 62 -11.814 17.076 -0.218 1.00 13.42 N ATOM 2501 HA ARG B 62 -9.065 15.570 4.494 1.00 0.00 H ATOM 2502 HB2 ARG B 62 -9.540 18.565 4.743 1.00 0.00 H ATOM 2503 HB3 ARG B 62 -9.306 17.668 3.224 1.00 0.00 H ATOM 2504 HG2 ARG B 62 -11.371 16.295 3.837 1.00 0.00 H ATOM 2505 HG3 ARG B 62 -11.644 17.438 5.173 1.00 0.00 H ATOM 2506 HD2 ARG B 62 -11.539 19.309 3.448 1.00 0.00 H ATOM 2507 HD3 ARG B 62 -12.954 18.237 3.329 1.00 0.00 H ATOM 2508 HE ARG B 62 -10.751 18.552 1.408 1.00 0.00 H ATOM 2509 HH12 ARG B 62 -13.834 15.908 0.816 1.00 0.00 H ATOM 2510 HH11 ARG B 62 -13.697 16.743 2.406 1.00 0.00 H ATOM 2511 HH22 ARG B 62 -12.304 16.424 -0.863 1.00 0.00 H ATOM 2512 HH21 ARG B 62 -11.007 17.637 -0.559 1.00 0.00 H ATOM 2513 H ARG B 62 -9.715 17.278 6.845 1.00 0.00 H ATOM 2514 N TYR B 63 -6.772 16.266 3.972 1.00 9.94 N ATOM 2515 CA TYR B 63 -5.358 16.468 3.716 1.00 10.18 C ATOM 2516 C TYR B 63 -5.157 16.715 2.258 1.00 11.54 C ATOM 2517 O TYR B 63 -5.929 16.211 1.422 1.00 12.47 O ATOM 2518 CB TYR B 63 -4.573 15.216 4.164 1.00 11.39 C ATOM 2519 CG TYR B 63 -4.627 15.004 5.662 1.00 9.26 C ATOM 2520 CD1 TYR B 63 -3.764 15.671 6.525 1.00 9.51 C ATOM 2521 CD2 TYR B 63 -5.601 14.197 6.225 1.00 9.87 C ATOM 2522 CE1 TYR B 63 -3.796 15.510 7.887 1.00 11.08 C ATOM 2523 CE2 TYR B 63 -5.648 14.001 7.615 1.00 11.19 C ATOM 2524 CZ TYR B 63 -4.749 14.667 8.431 1.00 11.26 C ATOM 2525 OH TYR B 63 -4.797 14.453 9.778 1.00 13.03 O ATOM 2526 HA TYR B 63 -4.994 17.329 4.276 1.00 0.00 H ATOM 2527 HB3 TYR B 63 -3.531 15.330 3.864 1.00 0.00 H ATOM 2528 HB2 TYR B 63 -4.998 14.342 3.671 1.00 0.00 H ATOM 2529 HD2 TYR B 63 -6.337 13.710 5.585 1.00 0.00 H ATOM 2530 HE2 TYR B 63 -6.388 13.328 8.049 1.00 0.00 H ATOM 2531 HE1 TYR B 63 -3.086 16.035 8.527 1.00 0.00 H ATOM 2532 HD1 TYR B 63 -3.028 16.353 6.099 1.00 0.00 H ATOM 2533 HH TYR B 63 -4.098 14.995 10.222 1.00 0.00 H ATOM 2534 H TYR B 63 -7.316 15.672 3.315 1.00 0.00 H ATOM 2535 N ARG B 64 -4.112 17.481 1.927 1.00 11.95 N ATOM 2536 CA ARG B 64 -3.840 17.790 0.535 1.00 11.68 C ATOM 2537 C ARG B 64 -3.175 16.696 -0.265 1.00 10.91 C ATOM 2538 O ARG B 64 -2.416 15.876 0.319 1.00 12.95 O ATOM 2539 CB ARG B 64 -2.870 18.961 0.512 1.00 14.59 C ATOM 2540 CG ARG B 64 -2.960 19.830 -0.720 1.00 21.35 C ATOM 2541 CD ARG B 64 -4.168 20.781 -0.611 1.00 20.36 C ATOM 2542 NE ARG B 64 -3.821 21.896 0.253 1.00 20.46 N ATOM 2543 CZ ARG B 64 -3.071 22.949 -0.119 1.00 20.73 C ATOM 2544 NH1 ARG B 64 -2.621 23.109 -1.353 1.00 22.86 N ATOM 2545 NH2 ARG B 64 -2.812 23.888 0.763 1.00 25.69 N ATOM 2546 HA ARG B 64 -4.814 17.973 0.082 1.00 0.00 H ATOM 2547 HB2 ARG B 64 -3.069 19.585 1.383 1.00 0.00 H ATOM 2548 HB3 ARG B 64 -1.857 18.564 0.575 1.00 0.00 H ATOM 2549 HG2 ARG B 64 -2.046 20.417 -0.815 1.00 0.00 H ATOM 2550 HG3 ARG B 64 -3.077 19.197 -1.600 1.00 0.00 H ATOM 2551 HD2 ARG B 64 -5.018 20.244 -0.190 1.00 0.00 H ATOM 2552 HD3 ARG B 64 -4.429 21.154 -1.601 1.00 0.00 H ATOM 2553 HE ARG B 64 -4.178 21.879 1.230 1.00 0.00 H ATOM 2554 HH12 ARG B 64 -2.044 23.941 -1.592 1.00 0.00 H ATOM 2555 HH11 ARG B 64 -2.844 22.403 -2.083 1.00 0.00 H ATOM 2556 HH22 ARG B 64 -2.234 24.709 0.493 1.00 0.00 H ATOM 2557 HH21 ARG B 64 -3.185 23.810 1.731 1.00 0.00 H ATOM 2558 H ARG B 64 -3.491 17.857 2.671 1.00 0.00 H ATOM 2559 N TRP B 65 -3.515 16.555 -1.513 1.00 11.82 N ATOM 2560 CA TRP B 65 -2.813 15.740 -2.488 1.00 12.33 C ATOM 2561 C TRP B 65 -1.523 16.414 -2.929 1.00 11.41 C ATOM 2562 O TRP B 65 -1.490 17.666 -3.080 1.00 13.92 O ATOM 2563 CB TRP B 65 -3.680 15.491 -3.727 1.00 11.78 C ATOM 2564 CG TRP B 65 -4.821 14.570 -3.501 1.00 10.73 C ATOM 2565 CD1 TRP B 65 -6.163 14.867 -3.434 1.00 12.67 C ATOM 2566 CD2 TRP B 65 -4.727 13.155 -3.390 1.00 11.09 C ATOM 2567 NE1 TRP B 65 -6.889 13.725 -3.247 1.00 14.78 N ATOM 2568 CE2 TRP B 65 -6.029 12.661 -3.228 1.00 13.12 C ATOM 2569 CE3 TRP B 65 -3.629 12.252 -3.378 1.00 12.47 C ATOM 2570 CZ2 TRP B 65 -6.290 11.314 -3.045 1.00 13.84 C ATOM 2571 CZ3 TRP B 65 -3.887 10.897 -3.231 1.00 14.90 C ATOM 2572 CH2 TRP B 65 -5.200 10.440 -3.033 1.00 13.26 C ATOM 2573 HA TRP B 65 -2.586 14.789 -2.006 1.00 0.00 H ATOM 2574 HB2 TRP B 65 -4.076 16.449 -4.064 1.00 0.00 H ATOM 2575 HB3 TRP B 65 -3.047 15.066 -4.506 1.00 0.00 H ATOM 2576 HE1 TRP B 65 -7.922 13.673 -3.137 1.00 0.00 H ATOM 2577 HD1 TRP B 65 -6.585 15.868 -3.518 1.00 0.00 H ATOM 2578 HZ2 TRP B 65 -7.309 10.949 -2.915 1.00 0.00 H ATOM 2579 HH2 TRP B 65 -5.373 9.377 -2.866 1.00 0.00 H ATOM 2580 HZ3 TRP B 65 -3.065 10.182 -3.269 1.00 0.00 H ATOM 2581 HE3 TRP B 65 -2.607 12.616 -3.482 1.00 0.00 H ATOM 2582 H TRP B 65 -4.359 17.068 -1.839 1.00 0.00 H ATOM 2583 N THR B 66 -0.459 15.648 -3.101 1.00 10.53 N ATOM 2584 CA THR B 66 0.690 16.151 -3.825 1.00 11.67 C ATOM 2585 C THR B 66 0.328 16.265 -5.299 1.00 13.53 C ATOM 2586 O THR B 66 -0.615 15.608 -5.813 1.00 14.45 O ATOM 2587 CB THR B 66 1.941 15.272 -3.665 1.00 13.27 C ATOM 2588 OG1 THR B 66 1.756 14.037 -4.386 1.00 12.36 O ATOM 2589 CG2 THR B 66 2.311 15.037 -2.179 1.00 12.73 C ATOM 2590 HA THR B 66 0.941 17.125 -3.405 1.00 0.00 H ATOM 2591 HB THR B 66 2.792 15.800 -4.095 1.00 0.00 H ATOM 2592 HG1 THR B 66 1.611 14.235 -5.345 1.00 0.00 H ATOM 2593 HG23 THR B 66 2.439 15.998 -1.681 1.00 0.00 H ATOM 2594 HG21 THR B 66 1.513 14.477 -1.691 1.00 0.00 H ATOM 2595 HG22 THR B 66 3.240 14.470 -2.123 1.00 0.00 H ATOM 2596 H THR B 66 -0.447 14.682 -2.716 1.00 0.00 H ATOM 2597 N THR B 67 1.102 17.074 -6.008 1.00 14.10 N ATOM 2598 CA THR B 67 1.091 16.948 -7.467 1.00 14.58 C ATOM 2599 C THR B 67 1.744 15.602 -7.827 1.00 17.18 C ATOM 2600 O THR B 67 2.254 14.854 -6.956 1.00 15.73 O ATOM 2601 CB THR B 67 1.801 18.125 -8.152 1.00 16.50 C ATOM 2602 OG1 THR B 67 3.165 18.153 -7.745 1.00 17.23 O ATOM 2603 CG2 THR B 67 1.170 19.480 -7.788 1.00 19.97 C ATOM 2604 HA THR B 67 0.064 16.974 -7.830 1.00 0.00 H ATOM 2605 HB THR B 67 1.706 17.976 -9.228 1.00 0.00 H ATOM 2606 HG1 THR B 67 3.624 18.911 -8.186 1.00 0.00 H ATOM 2607 HG23 THR B 67 0.123 19.484 -8.090 1.00 0.00 H ATOM 2608 HG21 THR B 67 1.240 19.634 -6.711 1.00 0.00 H ATOM 2609 HG22 THR B 67 1.702 20.278 -8.306 1.00 0.00 H ATOM 2610 H THR B 67 1.703 17.782 -5.539 1.00 0.00 H ATOM 2611 N ASP B 68 1.725 15.255 -9.104 1.00 18.57 N ATOM 2612 CA ASP B 68 2.304 14.015 -9.517 1.00 20.08 C ATOM 2613 C ASP B 68 3.821 13.906 -9.214 1.00 16.11 C ATOM 2614 O ASP B 68 4.598 14.871 -9.240 1.00 18.95 O ATOM 2615 CB ASP B 68 2.059 13.834 -11.009 1.00 26.07 C ATOM 2616 CG ASP B 68 0.637 13.365 -11.314 1.00 36.89 C ATOM 2617 OD1 ASP B 68 -0.048 12.835 -10.399 1.00 38.38 O ATOM 2618 OD2 ASP B 68 0.213 13.493 -12.484 1.00 42.63 O ATOM 2619 HA ASP B 68 1.824 13.225 -8.940 1.00 0.00 H ATOM 2620 HB2 ASP B 68 2.228 14.787 -11.510 1.00 0.00 H ATOM 2621 HB3 ASP B 68 2.762 13.094 -11.392 1.00 0.00 H ATOM 2622 H ASP B 68 1.289 15.885 -9.807 1.00 0.00 H ATOM 2623 N ARG B 69 4.225 12.697 -8.865 1.00 16.77 N ATOM 2624 CA ARG B 69 5.618 12.353 -8.616 1.00 16.47 C ATOM 2625 C ARG B 69 6.036 11.177 -9.463 1.00 17.94 C ATOM 2626 O ARG B 69 5.272 10.244 -9.682 1.00 19.72 O ATOM 2627 CB ARG B 69 5.817 11.918 -7.156 1.00 16.86 C ATOM 2628 CG ARG B 69 5.660 13.018 -6.174 1.00 14.87 C ATOM 2629 CD ARG B 69 6.789 14.070 -6.234 1.00 15.39 C ATOM 2630 NE ARG B 69 6.425 15.099 -5.289 1.00 14.56 N ATOM 2631 CZ ARG B 69 5.553 16.082 -5.526 1.00 13.23 C ATOM 2632 NH1 ARG B 69 5.099 16.290 -6.766 1.00 15.23 N ATOM 2633 NH2 ARG B 69 5.201 16.891 -4.561 1.00 13.63 N ATOM 2634 HA ARG B 69 6.208 13.239 -8.850 1.00 0.00 H ATOM 2635 HB2 ARG B 69 5.084 11.145 -6.925 1.00 0.00 H ATOM 2636 HB3 ARG B 69 6.822 11.507 -7.054 1.00 0.00 H ATOM 2637 HG2 ARG B 69 4.712 13.519 -6.367 1.00 0.00 H ATOM 2638 HG3 ARG B 69 5.644 12.587 -5.173 1.00 0.00 H ATOM 2639 HD2 ARG B 69 6.865 14.487 -7.238 1.00 0.00 H ATOM 2640 HD3 ARG B 69 7.742 13.620 -5.956 1.00 0.00 H ATOM 2641 HE ARG B 69 6.876 15.073 -4.352 1.00 0.00 H ATOM 2642 HH12 ARG B 69 4.420 17.056 -6.949 1.00 0.00 H ATOM 2643 HH11 ARG B 69 5.425 15.686 -7.547 1.00 0.00 H ATOM 2644 HH22 ARG B 69 4.522 17.657 -4.746 1.00 0.00 H ATOM 2645 HH21 ARG B 69 5.600 16.769 -3.608 1.00 0.00 H ATOM 2646 H ARG B 69 3.509 11.950 -8.763 1.00 0.00 H ATOM 2647 N LYS B 70 7.272 11.203 -9.942 1.00 18.97 N ATOM 2648 CA LYS B 70 7.863 10.024 -10.514 1.00 18.61 C ATOM 2649 C LYS B 70 8.272 9.056 -9.419 1.00 16.79 C ATOM 2650 O LYS B 70 8.959 9.450 -8.491 1.00 18.38 O ATOM 2651 CB LYS B 70 9.094 10.432 -11.359 1.00 23.32 C ATOM 2652 CG LYS B 70 8.727 11.129 -12.671 1.00 33.80 C ATOM 2653 CD LYS B 70 9.896 11.122 -13.670 1.00 44.45 C ATOM 2654 CE LYS B 70 9.379 11.007 -15.118 1.00 47.63 C ATOM 2655 NZ LYS B 70 10.354 10.305 -16.027 1.00 51.48 N ATOM 2656 HA LYS B 70 7.134 9.527 -11.154 1.00 0.00 H ATOM 2657 HB2 LYS B 70 9.710 11.110 -10.768 1.00 0.00 H ATOM 2658 HB3 LYS B 70 9.666 9.534 -11.593 1.00 0.00 H ATOM 2659 HG2 LYS B 70 7.877 10.614 -13.119 1.00 0.00 H ATOM 2660 HG3 LYS B 70 8.452 12.162 -12.457 1.00 0.00 H ATOM 2661 HD2 LYS B 70 10.462 12.048 -13.565 1.00 0.00 H ATOM 2662 HD3 LYS B 70 10.546 10.274 -13.454 1.00 0.00 H ATOM 2663 HE2 LYS B 70 9.200 12.010 -15.506 1.00 0.00 H ATOM 2664 HE3 LYS B 70 8.443 10.449 -15.112 1.00 0.00 H ATOM 2665 HZ1 LYS B 70 11.249 10.834 -16.048 1.00 0.00 H ATOM 2666 HZ2 LYS B 70 10.527 9.343 -15.671 1.00 0.00 H ATOM 2667 HZ3 LYS B 70 9.957 10.255 -16.987 1.00 0.00 H ATOM 2668 H LYS B 70 7.820 12.086 -9.903 1.00 0.00 H ATOM 2669 N VAL B 71 7.801 7.821 -9.497 1.00 16.51 N ATOM 2670 CA VAL B 71 8.095 6.806 -8.488 1.00 16.98 C ATOM 2671 C VAL B 71 8.743 5.634 -9.197 1.00 22.07 C ATOM 2672 O VAL B 71 8.198 5.126 -10.164 1.00 20.81 O ATOM 2673 CB VAL B 71 6.782 6.345 -7.740 1.00 17.95 C ATOM 2674 CG1 VAL B 71 7.094 5.332 -6.665 1.00 18.04 C ATOM 2675 CG2 VAL B 71 6.034 7.554 -7.109 1.00 18.37 C ATOM 2676 HA VAL B 71 8.763 7.216 -7.731 1.00 0.00 H ATOM 2677 HB VAL B 71 6.136 5.883 -8.487 1.00 0.00 H ATOM 2678 HG11 VAL B 71 7.563 4.458 -7.116 1.00 0.00 H ATOM 2679 HG12 VAL B 71 7.773 5.775 -5.936 1.00 0.00 H ATOM 2680 HG13 VAL B 71 6.170 5.035 -6.169 1.00 0.00 H ATOM 2681 HG21 VAL B 71 6.687 8.048 -6.390 1.00 0.00 H ATOM 2682 HG22 VAL B 71 5.757 8.258 -7.894 1.00 0.00 H ATOM 2683 HG23 VAL B 71 5.136 7.200 -6.603 1.00 0.00 H ATOM 2684 H VAL B 71 7.200 7.564 -10.306 1.00 0.00 H ATOM 2685 N HIS B 72 9.908 5.233 -8.708 1.00 19.02 N ATOM 2686 CA HIS B 72 10.645 4.103 -9.291 1.00 21.30 C ATOM 2687 C HIS B 72 10.145 2.822 -8.648 1.00 20.22 C ATOM 2688 O HIS B 72 10.370 2.588 -7.469 1.00 28.74 O ATOM 2689 CB HIS B 72 12.152 4.280 -9.059 1.00 23.07 C ATOM 2690 CG HIS B 72 12.818 5.208 -10.029 1.00 34.69 C ATOM 2691 ND1 HIS B 72 12.580 6.567 -10.048 1.00 36.29 N ATOM 2692 CD2 HIS B 72 13.745 4.975 -10.991 1.00 36.04 C ATOM 2693 CE1 HIS B 72 13.315 7.128 -10.995 1.00 35.98 C ATOM 2694 NE2 HIS B 72 14.032 6.184 -11.580 1.00 38.62 N ATOM 2695 HA HIS B 72 10.478 4.058 -10.367 1.00 0.00 H ATOM 2696 HB2 HIS B 72 12.299 4.673 -8.053 1.00 0.00 H ATOM 2697 HB3 HIS B 72 12.628 3.303 -9.139 1.00 0.00 H ATOM 2698 HD2 HIS B 72 14.181 4.010 -11.249 1.00 0.00 H ATOM 2699 HE1 HIS B 72 13.327 8.188 -11.249 1.00 0.00 H ATOM 2700 H HIS B 72 10.312 5.732 -7.889 1.00 0.00 H ATOM 2701 N LEU B 73 9.440 2.018 -9.431 1.00 22.67 N ATOM 2702 CA LEU B 73 9.074 0.673 -8.968 1.00 25.88 C ATOM 2703 C LEU B 73 10.078 -0.356 -9.532 1.00 31.69 C ATOM 2704 O LEU B 73 11.110 0.030 -10.098 1.00 34.09 O ATOM 2705 CB LEU B 73 7.617 0.349 -9.351 1.00 25.46 C ATOM 2706 CG LEU B 73 6.567 1.380 -8.886 1.00 25.57 C ATOM 2707 CD1 LEU B 73 5.159 0.960 -9.305 1.00 29.84 C ATOM 2708 CD2 LEU B 73 6.636 1.646 -7.410 1.00 24.32 C ATOM 2709 HA LEU B 73 9.128 0.627 -7.880 1.00 0.00 H ATOM 2710 HB2 LEU B 73 7.562 0.279 -10.437 1.00 0.00 H ATOM 2711 HB3 LEU B 73 7.360 -0.615 -8.912 1.00 0.00 H ATOM 2712 HG LEU B 73 6.806 2.319 -9.386 1.00 0.00 H ATOM 2713 HD21 LEU B 73 6.459 0.718 -6.866 1.00 0.00 H ATOM 2714 HD22 LEU B 73 7.623 2.034 -7.158 1.00 0.00 H ATOM 2715 HD23 LEU B 73 5.876 2.378 -7.138 1.00 0.00 H ATOM 2716 HD11 LEU B 73 5.113 0.881 -10.391 1.00 0.00 H ATOM 2717 HD12 LEU B 73 4.921 -0.006 -8.859 1.00 0.00 H ATOM 2718 HD13 LEU B 73 4.442 1.706 -8.963 1.00 0.00 H ATOM 2719 H LEU B 73 9.145 2.340 -10.375 1.00 0.00 H ATOM 2720 N ALA B 74 9.793 -1.649 -9.378 1.00 31.77 N ATOM 2721 CA ALA B 74 10.726 -2.700 -9.819 1.00 38.42 C ATOM 2722 C ALA B 74 10.800 -2.778 -11.339 1.00 42.06 C ATOM 2723 O ALA B 74 11.892 -2.793 -11.917 1.00 48.28 O ATOM 2724 CB ALA B 74 10.333 -4.060 -9.225 1.00 36.70 C ATOM 2725 HA ALA B 74 11.718 -2.436 -9.452 1.00 0.00 H ATOM 2726 HB1 ALA B 74 10.358 -4.001 -8.137 1.00 0.00 H ATOM 2727 HB2 ALA B 74 9.327 -4.321 -9.553 1.00 0.00 H ATOM 2728 HB3 ALA B 74 11.036 -4.820 -9.565 1.00 0.00 H ATOM 2729 H ALA B 74 8.892 -1.922 -8.937 1.00 0.00 H ATOM 2730 N THR B 75 9.633 -2.820 -11.973 1.00 47.91 N ATOM 2731 CA THR B 75 9.529 -2.830 -13.421 1.00 51.58 C ATOM 2732 C THR B 75 8.929 -1.498 -13.869 1.00 50.76 C ATOM 2733 O THR B 75 7.715 -1.387 -14.103 1.00 54.15 O ATOM 2734 CB THR B 75 8.698 -4.038 -13.942 1.00 54.14 C ATOM 2735 OG1 THR B 75 9.166 -5.247 -13.331 1.00 57.61 O ATOM 2736 CG2 THR B 75 8.823 -4.172 -15.462 1.00 55.81 C ATOM 2737 HA THR B 75 10.524 -2.949 -13.851 1.00 0.00 H ATOM 2738 HB THR B 75 7.653 -3.866 -13.685 1.00 0.00 H ATOM 2739 HG1 THR B 75 8.634 -6.012 -13.666 1.00 0.00 H ATOM 2740 HG23 THR B 75 8.469 -3.257 -15.936 1.00 0.00 H ATOM 2741 HG21 THR B 75 9.867 -4.339 -15.726 1.00 0.00 H ATOM 2742 HG22 THR B 75 8.221 -5.015 -15.802 1.00 0.00 H ATOM 2743 H THR B 75 8.759 -2.847 -11.409 1.00 0.00 H ATOM 2744 N GLY B 76 9.795 -0.488 -13.930 1.00 45.24 N ATOM 2745 CA GLY B 76 9.479 0.815 -14.507 1.00 39.73 C ATOM 2746 C GLY B 76 9.242 1.940 -13.508 1.00 35.98 C ATOM 2747 O GLY B 76 9.077 1.700 -12.313 1.00 35.22 O ATOM 2748 HA3 GLY B 76 8.577 0.705 -15.108 1.00 0.00 H ATOM 2749 HA2 GLY B 76 10.309 1.107 -15.150 1.00 0.00 H ATOM 2750 H GLY B 76 10.750 -0.636 -13.545 1.00 0.00 H ATOM 2751 N LYS B 77 9.258 3.167 -14.025 1.00 37.76 N ATOM 2752 CA LYS B 77 8.759 4.335 -13.317 1.00 33.10 C ATOM 2753 C LYS B 77 7.258 4.443 -13.524 1.00 33.39 C ATOM 2754 O LYS B 77 6.714 3.966 -14.525 1.00 35.86 O ATOM 2755 CB LYS B 77 9.427 5.611 -13.827 1.00 39.35 C ATOM 2756 CG LYS B 77 10.764 5.933 -13.180 1.00 44.33 C ATOM 2757 CD LYS B 77 11.943 5.348 -13.969 1.00 50.16 C ATOM 2758 CE LYS B 77 12.195 6.086 -15.298 1.00 54.10 C ATOM 2759 NZ LYS B 77 12.406 7.559 -15.126 1.00 56.83 N ATOM 2760 HA LYS B 77 8.989 4.221 -12.258 1.00 0.00 H ATOM 2761 HB2 LYS B 77 9.586 5.505 -14.900 1.00 0.00 H ATOM 2762 HB3 LYS B 77 8.751 6.445 -13.642 1.00 0.00 H ATOM 2763 HG2 LYS B 77 10.878 7.016 -13.128 1.00 0.00 H ATOM 2764 HG3 LYS B 77 10.776 5.519 -12.172 1.00 0.00 H ATOM 2765 HD2 LYS B 77 12.842 5.417 -13.356 1.00 0.00 H ATOM 2766 HD3 LYS B 77 11.732 4.301 -14.186 1.00 0.00 H ATOM 2767 HE2 LYS B 77 11.333 5.933 -15.948 1.00 0.00 H ATOM 2768 HE3 LYS B 77 13.082 5.661 -15.767 1.00 0.00 H ATOM 2769 HZ1 LYS B 77 11.562 7.980 -14.688 1.00 0.00 H ATOM 2770 HZ2 LYS B 77 13.232 7.721 -14.515 1.00 0.00 H ATOM 2771 HZ3 LYS B 77 12.570 7.995 -16.056 1.00 0.00 H ATOM 2772 H LYS B 77 9.646 3.296 -14.981 1.00 0.00 H ATOM 2773 N VAL B 78 6.584 5.071 -12.568 1.00 24.76 N ATOM 2774 CA VAL B 78 5.173 5.377 -12.678 1.00 27.12 C ATOM 2775 C VAL B 78 5.032 6.835 -12.232 1.00 23.49 C ATOM 2776 O VAL B 78 5.944 7.387 -11.567 1.00 23.71 O ATOM 2777 CB VAL B 78 4.324 4.416 -11.811 1.00 28.45 C ATOM 2778 CG1 VAL B 78 4.589 4.619 -10.300 1.00 26.15 C ATOM 2779 CG2 VAL B 78 2.855 4.541 -12.104 1.00 35.56 C ATOM 2780 HA VAL B 78 4.806 5.245 -13.696 1.00 0.00 H ATOM 2781 HB VAL B 78 4.635 3.406 -12.079 1.00 0.00 H ATOM 2782 HG11 VAL B 78 5.642 4.432 -10.089 1.00 0.00 H ATOM 2783 HG12 VAL B 78 4.338 5.643 -10.023 1.00 0.00 H ATOM 2784 HG13 VAL B 78 3.973 3.925 -9.728 1.00 0.00 H ATOM 2785 HG21 VAL B 78 2.530 5.561 -11.899 1.00 0.00 H ATOM 2786 HG22 VAL B 78 2.673 4.304 -13.152 1.00 0.00 H ATOM 2787 HG23 VAL B 78 2.300 3.848 -11.472 1.00 0.00 H ATOM 2788 H VAL B 78 7.090 5.355 -11.705 1.00 0.00 H ATOM 2789 N THR B 79 3.947 7.478 -12.654 1.00 22.63 N ATOM 2790 CA THR B 79 3.579 8.793 -12.146 1.00 21.61 C ATOM 2791 C THR B 79 2.456 8.544 -11.134 1.00 22.82 C ATOM 2792 O THR B 79 1.468 7.881 -11.446 1.00 25.69 O ATOM 2793 CB THR B 79 3.153 9.766 -13.289 1.00 25.50 C ATOM 2794 OG1 THR B 79 1.857 9.404 -13.764 1.00 26.31 O ATOM 2795 CG2 THR B 79 4.148 9.733 -14.442 1.00 27.88 C ATOM 2796 HA THR B 79 4.426 9.289 -11.673 1.00 0.00 H ATOM 2797 HB THR B 79 3.133 10.779 -12.887 1.00 0.00 H ATOM 2798 HG1 THR B 79 1.206 9.463 -13.020 1.00 0.00 H ATOM 2799 HG23 THR B 79 5.136 10.010 -14.075 1.00 0.00 H ATOM 2800 HG21 THR B 79 4.183 8.727 -14.861 1.00 0.00 H ATOM 2801 HG22 THR B 79 3.834 10.438 -15.212 1.00 0.00 H ATOM 2802 H THR B 79 3.342 7.028 -13.370 1.00 0.00 H ATOM 2803 N HIS B 80 2.622 9.047 -9.912 1.00 19.88 N ATOM 2804 CA HIS B 80 1.672 8.755 -8.832 1.00 18.24 C ATOM 2805 C HIS B 80 1.592 9.945 -7.915 1.00 14.21 C ATOM 2806 O HIS B 80 2.583 10.677 -7.729 1.00 19.71 O ATOM 2807 CB HIS B 80 2.170 7.544 -8.031 1.00 18.11 C ATOM 2808 CG HIS B 80 1.088 6.826 -7.279 1.00 17.36 C ATOM 2809 ND1 HIS B 80 0.167 6.003 -7.896 1.00 19.69 N ATOM 2810 CD2 HIS B 80 0.832 6.758 -5.953 1.00 15.62 C ATOM 2811 CE1 HIS B 80 -0.625 5.476 -6.975 1.00 20.10 C ATOM 2812 NE2 HIS B 80 -0.267 5.952 -5.797 1.00 16.35 N ATOM 2813 HA HIS B 80 0.690 8.540 -9.255 1.00 0.00 H ATOM 2814 HB2 HIS B 80 2.632 6.840 -8.724 1.00 0.00 H ATOM 2815 HB3 HIS B 80 2.915 7.889 -7.315 1.00 0.00 H ATOM 2816 HD2 HIS B 80 1.393 7.250 -5.159 1.00 0.00 H ATOM 2817 HE1 HIS B 80 -1.435 4.770 -7.158 1.00 0.00 H ATOM 2818 H HIS B 80 3.441 9.659 -9.719 1.00 0.00 H ATOM 2819 N SER B 81 0.440 10.126 -7.294 1.00 16.35 N ATOM 2820 CA SER B 81 0.277 11.180 -6.318 1.00 15.21 C ATOM 2821 C SER B 81 0.113 10.579 -4.927 1.00 12.72 C ATOM 2822 O SER B 81 -0.281 9.406 -4.774 1.00 15.46 O ATOM 2823 CB SER B 81 -0.935 12.038 -6.637 1.00 16.67 C ATOM 2824 OG SER B 81 -2.090 11.231 -6.605 1.00 18.68 O ATOM 2825 HA SER B 81 1.168 11.807 -6.349 1.00 0.00 H ATOM 2826 HB2 SER B 81 -0.822 12.476 -7.629 1.00 0.00 H ATOM 2827 HB3 SER B 81 -1.024 12.834 -5.898 1.00 0.00 H ATOM 2828 HG SER B 81 -2.884 11.785 -6.812 1.00 0.00 H ATOM 2829 H SER B 81 -0.362 9.500 -7.511 1.00 0.00 H ATOM 2830 N PHE B 82 0.435 11.382 -3.933 1.00 9.94 N ATOM 2831 CA PHE B 82 0.387 10.935 -2.530 1.00 8.95 C ATOM 2832 C PHE B 82 -0.440 11.841 -1.693 1.00 11.13 C ATOM 2833 O PHE B 82 -0.553 13.040 -1.977 1.00 10.28 O ATOM 2834 CB PHE B 82 1.813 10.935 -1.915 1.00 10.09 C ATOM 2835 CG PHE B 82 2.735 9.928 -2.557 1.00 9.94 C ATOM 2836 CD1 PHE B 82 2.932 8.697 -1.943 1.00 11.10 C ATOM 2837 CD2 PHE B 82 3.395 10.204 -3.754 1.00 11.45 C ATOM 2838 CE1 PHE B 82 3.771 7.735 -2.518 1.00 11.07 C ATOM 2839 CE2 PHE B 82 4.236 9.234 -4.360 1.00 12.13 C ATOM 2840 CZ PHE B 82 4.421 8.027 -3.744 1.00 12.63 C ATOM 2841 HA PHE B 82 -0.045 9.934 -2.538 1.00 0.00 H ATOM 2842 HB2 PHE B 82 2.244 11.928 -2.038 1.00 0.00 H ATOM 2843 HB3 PHE B 82 1.733 10.704 -0.853 1.00 0.00 H ATOM 2844 HD2 PHE B 82 3.264 11.176 -4.230 1.00 0.00 H ATOM 2845 HE2 PHE B 82 4.730 9.449 -5.308 1.00 0.00 H ATOM 2846 HZ PHE B 82 5.074 7.283 -4.200 1.00 0.00 H ATOM 2847 HE1 PHE B 82 3.923 6.773 -2.029 1.00 0.00 H ATOM 2848 HD1 PHE B 82 2.427 8.478 -1.002 1.00 0.00 H ATOM 2849 H PHE B 82 0.731 12.356 -4.144 1.00 0.00 H ATOM 2850 N LEU B 83 -1.040 11.335 -0.631 1.00 9.28 N ATOM 2851 CA LEU B 83 -1.607 12.190 0.409 1.00 8.84 C ATOM 2852 C LEU B 83 -0.531 12.778 1.244 1.00 11.83 C ATOM 2853 O LEU B 83 0.360 12.007 1.690 1.00 12.11 O ATOM 2854 CB LEU B 83 -2.513 11.341 1.319 1.00 11.66 C ATOM 2855 CG LEU B 83 -3.680 10.689 0.607 1.00 13.79 C ATOM 2856 CD1 LEU B 83 -4.244 9.567 1.533 1.00 15.80 C ATOM 2857 CD2 LEU B 83 -4.727 11.746 0.340 1.00 17.17 C ATOM 2858 HA LEU B 83 -2.174 12.989 -0.068 1.00 0.00 H ATOM 2859 HB2 LEU B 83 -1.905 10.555 1.768 1.00 0.00 H ATOM 2860 HB3 LEU B 83 -2.909 11.986 2.104 1.00 0.00 H ATOM 2861 HG LEU B 83 -3.376 10.249 -0.343 1.00 0.00 H ATOM 2862 HD21 LEU B 83 -5.059 12.174 1.286 1.00 0.00 H ATOM 2863 HD22 LEU B 83 -4.299 12.530 -0.285 1.00 0.00 H ATOM 2864 HD23 LEU B 83 -5.576 11.294 -0.173 1.00 0.00 H ATOM 2865 HD11 LEU B 83 -3.463 8.832 1.728 1.00 0.00 H ATOM 2866 HD12 LEU B 83 -4.574 10.006 2.474 1.00 0.00 H ATOM 2867 HD13 LEU B 83 -5.087 9.082 1.041 1.00 0.00 H ATOM 2868 H LEU B 83 -1.111 10.302 -0.533 1.00 0.00 H ATOM 2869 N HIS B 84 -0.594 14.052 1.585 1.00 10.28 N ATOM 2870 CA HIS B 84 0.353 14.604 2.497 1.00 9.77 C ATOM 2871 C HIS B 84 -0.323 14.638 3.848 1.00 8.88 C ATOM 2872 O HIS B 84 -1.238 15.445 4.076 1.00 10.39 O ATOM 2873 CB HIS B 84 0.767 16.029 2.063 1.00 10.48 C ATOM 2874 CG HIS B 84 1.611 16.700 3.087 1.00 10.13 C ATOM 2875 ND1 HIS B 84 2.654 16.069 3.743 1.00 12.17 N ATOM 2876 CD2 HIS B 84 1.550 17.956 3.592 1.00 12.93 C ATOM 2877 CE1 HIS B 84 3.203 16.908 4.603 1.00 12.87 C ATOM 2878 NE2 HIS B 84 2.540 18.056 4.534 1.00 13.72 N ATOM 2879 HA HIS B 84 1.262 14.004 2.525 1.00 0.00 H ATOM 2880 HB2 HIS B 84 1.329 15.964 1.131 1.00 0.00 H ATOM 2881 HB3 HIS B 84 -0.132 16.624 1.903 1.00 0.00 H ATOM 2882 HD2 HIS B 84 0.847 18.738 3.304 1.00 0.00 H ATOM 2883 HE1 HIS B 84 4.051 16.695 5.254 1.00 0.00 H ATOM 2884 H HIS B 84 -1.340 14.657 1.186 1.00 0.00 H ATOM 2885 N VAL B 85 0.114 13.801 4.801 1.00 8.75 N ATOM 2886 CA VAL B 85 -0.546 13.650 6.085 1.00 8.39 C ATOM 2887 C VAL B 85 0.497 13.883 7.185 1.00 10.69 C ATOM 2888 O VAL B 85 1.144 12.932 7.669 1.00 10.22 O ATOM 2889 CB VAL B 85 -1.231 12.258 6.256 1.00 9.26 C ATOM 2890 CG1 VAL B 85 -2.042 12.255 7.537 1.00 10.44 C ATOM 2891 CG2 VAL B 85 -2.163 11.906 5.055 1.00 11.08 C ATOM 2892 HA VAL B 85 -1.349 14.384 6.152 1.00 0.00 H ATOM 2893 HB VAL B 85 -0.444 11.504 6.295 1.00 0.00 H ATOM 2894 HG11 VAL B 85 -1.382 12.445 8.384 1.00 0.00 H ATOM 2895 HG12 VAL B 85 -2.803 13.034 7.486 1.00 0.00 H ATOM 2896 HG13 VAL B 85 -2.522 11.284 7.659 1.00 0.00 H ATOM 2897 HG21 VAL B 85 -2.945 12.660 4.971 1.00 0.00 H ATOM 2898 HG22 VAL B 85 -1.577 11.884 4.136 1.00 0.00 H ATOM 2899 HG23 VAL B 85 -2.615 10.928 5.222 1.00 0.00 H ATOM 2900 H VAL B 85 0.965 13.234 4.611 1.00 0.00 H ATOM 2901 N PRO B 86 0.685 15.139 7.620 1.00 9.35 N ATOM 2902 CA PRO B 86 1.746 15.408 8.589 1.00 9.92 C ATOM 2903 C PRO B 86 1.425 14.884 9.977 1.00 11.73 C ATOM 2904 O PRO B 86 2.307 14.832 10.836 1.00 13.05 O ATOM 2905 CB PRO B 86 1.862 16.940 8.563 1.00 13.47 C ATOM 2906 CG PRO B 86 0.572 17.437 7.932 1.00 14.58 C ATOM 2907 CD PRO B 86 0.091 16.350 7.011 1.00 12.20 C ATOM 2908 HA PRO B 86 2.678 14.902 8.335 1.00 0.00 H ATOM 2909 HD3 PRO B 86 -0.997 16.294 7.000 1.00 0.00 H ATOM 2910 HD2 PRO B 86 0.456 16.502 5.995 1.00 0.00 H ATOM 2911 HG3 PRO B 86 0.758 18.352 7.369 1.00 0.00 H ATOM 2912 HG2 PRO B 86 -0.173 17.632 8.704 1.00 0.00 H ATOM 2913 HB2 PRO B 86 1.966 17.331 9.575 1.00 0.00 H ATOM 2914 HB3 PRO B 86 2.721 17.247 7.966 1.00 0.00 H ATOM 2915 N ASP B 87 0.197 14.409 10.203 1.00 10.04 N ATOM 2916 CA ASP B 87 -0.165 13.779 11.479 1.00 10.26 C ATOM 2917 C ASP B 87 0.279 12.319 11.551 1.00 10.96 C ATOM 2918 O ASP B 87 0.197 11.694 12.627 1.00 13.60 O ATOM 2919 CB ASP B 87 -1.687 13.897 11.723 1.00 11.55 C ATOM 2920 CG ASP B 87 -2.120 15.333 11.895 1.00 14.32 C ATOM 2921 OD1 ASP B 87 -1.471 15.997 12.732 1.00 17.52 O ATOM 2922 OD2 ASP B 87 -3.045 15.773 11.197 1.00 15.84 O ATOM 2923 HA ASP B 87 0.366 14.313 12.267 1.00 0.00 H ATOM 2924 HB2 ASP B 87 -2.215 13.469 10.871 1.00 0.00 H ATOM 2925 HB3 ASP B 87 -1.944 13.341 12.625 1.00 0.00 H ATOM 2926 H ASP B 87 -0.522 14.488 9.455 1.00 0.00 H ATOM 2927 N CYS B 88 0.778 11.776 10.424 1.00 9.65 N ATOM 2928 CA CYS B 88 1.250 10.403 10.423 1.00 9.92 C ATOM 2929 C CYS B 88 2.718 10.362 10.781 1.00 12.10 C ATOM 2930 O CYS B 88 3.462 11.237 10.386 1.00 12.10 O ATOM 2931 CB CYS B 88 1.061 9.857 9.022 1.00 12.17 C ATOM 2932 SG CYS B 88 -0.412 9.059 8.692 1.00 11.05 S ATOM 2933 HA CYS B 88 0.697 9.811 11.152 1.00 0.00 H ATOM 2934 HB2 CYS B 88 1.868 9.149 8.833 1.00 0.00 H ATOM 2935 HB3 CYS B 88 1.144 10.694 8.329 1.00 0.00 H ATOM 2936 HG CYS B 88 -1.462 9.932 8.895 1.00 0.00 H ATOM 2937 H CYS B 88 0.825 12.342 9.552 1.00 0.00 H ATOM 2938 N PRO B 89 3.165 9.375 11.566 1.00 10.62 N ATOM 2939 CA PRO B 89 4.569 9.358 12.000 1.00 11.21 C ATOM 2940 C PRO B 89 5.591 8.989 10.940 1.00 12.26 C ATOM 2941 O PRO B 89 6.741 9.318 11.049 1.00 13.57 O ATOM 2942 CB PRO B 89 4.566 8.324 13.154 1.00 11.93 C ATOM 2943 CG PRO B 89 3.427 7.422 12.816 1.00 14.70 C ATOM 2944 CD PRO B 89 2.356 8.318 12.181 1.00 13.60 C ATOM 2945 HA PRO B 89 4.887 10.363 12.278 1.00 0.00 H ATOM 2946 HD3 PRO B 89 1.778 7.775 11.433 1.00 0.00 H ATOM 2947 HD2 PRO B 89 1.681 8.724 12.935 1.00 0.00 H ATOM 2948 HG3 PRO B 89 3.039 6.947 13.717 1.00 0.00 H ATOM 2949 HG2 PRO B 89 3.747 6.655 12.111 1.00 0.00 H ATOM 2950 HB2 PRO B 89 5.505 7.771 13.184 1.00 0.00 H ATOM 2951 HB3 PRO B 89 4.403 8.813 14.114 1.00 0.00 H ATOM 2952 N TYR B 90 5.158 8.269 9.914 1.00 13.49 N ATOM 2953 CA TYR B 90 6.067 7.955 8.817 1.00 15.84 C ATOM 2954 C TYR B 90 5.245 7.746 7.554 1.00 9.74 C ATOM 2955 O TYR B 90 4.014 7.540 7.607 1.00 11.07 O ATOM 2956 CB TYR B 90 7.001 6.739 9.068 1.00 17.42 C ATOM 2957 CG TYR B 90 6.344 5.757 9.983 1.00 15.32 C ATOM 2958 CD1 TYR B 90 6.831 5.576 11.279 1.00 14.80 C ATOM 2959 CD2 TYR B 90 5.187 5.120 9.595 1.00 18.70 C ATOM 2960 CE1 TYR B 90 6.145 4.701 12.225 1.00 17.81 C ATOM 2961 CE2 TYR B 90 4.513 4.269 10.465 1.00 16.92 C ATOM 2962 CZ TYR B 90 4.997 4.053 11.748 1.00 16.48 C ATOM 2963 OH TYR B 90 4.341 3.181 12.543 1.00 19.46 O ATOM 2964 HA TYR B 90 6.744 8.803 8.717 1.00 0.00 H ATOM 2965 HB3 TYR B 90 7.930 7.087 9.521 1.00 0.00 H ATOM 2966 HB2 TYR B 90 7.221 6.253 8.118 1.00 0.00 H ATOM 2967 HD2 TYR B 90 4.793 5.285 8.592 1.00 0.00 H ATOM 2968 HE2 TYR B 90 3.601 3.770 10.138 1.00 0.00 H ATOM 2969 HE1 TYR B 90 6.505 4.560 13.244 1.00 0.00 H ATOM 2970 HD1 TYR B 90 7.737 6.096 11.589 1.00 0.00 H ATOM 2971 HH TYR B 90 4.796 3.129 13.421 1.00 0.00 H ATOM 2972 H TYR B 90 4.175 7.930 9.892 1.00 0.00 H ATOM 2973 N PRO B 91 5.931 7.734 6.425 1.00 8.92 N ATOM 2974 CA PRO B 91 5.250 7.498 5.150 1.00 9.48 C ATOM 2975 C PRO B 91 4.685 6.120 5.107 1.00 9.27 C ATOM 2976 O PRO B 91 5.266 5.171 5.690 1.00 9.57 O ATOM 2977 CB PRO B 91 6.330 7.682 4.073 1.00 11.55 C ATOM 2978 CG PRO B 91 7.532 8.200 4.812 1.00 17.08 C ATOM 2979 CD PRO B 91 7.383 7.988 6.258 1.00 12.32 C ATOM 2980 HA PRO B 91 4.414 8.181 5.001 1.00 0.00 H ATOM 2981 HD3 PRO B 91 7.969 7.130 6.588 1.00 0.00 H ATOM 2982 HD2 PRO B 91 7.690 8.873 6.815 1.00 0.00 H ATOM 2983 HG3 PRO B 91 7.641 9.267 4.616 1.00 0.00 H ATOM 2984 HG2 PRO B 91 8.421 7.675 4.463 1.00 0.00 H ATOM 2985 HB2 PRO B 91 6.557 6.731 3.591 1.00 0.00 H ATOM 2986 HB3 PRO B 91 6.003 8.400 3.321 1.00 0.00 H ATOM 2987 N LEU B 92 3.599 5.972 4.344 1.00 8.48 N ATOM 2988 CA LEU B 92 2.854 4.681 4.287 1.00 8.89 C ATOM 2989 C LEU B 92 2.753 4.291 2.836 1.00 9.17 C ATOM 2990 O LEU B 92 2.307 5.086 1.979 1.00 9.62 O ATOM 2991 CB LEU B 92 1.452 4.833 4.852 1.00 9.47 C ATOM 2992 CG LEU B 92 1.372 5.387 6.259 1.00 10.37 C ATOM 2993 CD1 LEU B 92 -0.084 5.624 6.645 1.00 11.85 C ATOM 2994 CD2 LEU B 92 2.077 4.498 7.295 1.00 11.33 C ATOM 2995 HA LEU B 92 3.377 3.928 4.877 1.00 0.00 H ATOM 2996 HB2 LEU B 92 0.896 5.502 4.195 1.00 0.00 H ATOM 2997 HB3 LEU B 92 0.981 3.850 4.851 1.00 0.00 H ATOM 2998 HG LEU B 92 1.906 6.337 6.261 1.00 0.00 H ATOM 2999 HD21 LEU B 92 1.614 3.511 7.300 1.00 0.00 H ATOM 3000 HD22 LEU B 92 3.131 4.405 7.035 1.00 0.00 H ATOM 3001 HD23 LEU B 92 1.984 4.950 8.283 1.00 0.00 H ATOM 3002 HD11 LEU B 92 -0.531 6.337 5.952 1.00 0.00 H ATOM 3003 HD12 LEU B 92 -0.629 4.681 6.599 1.00 0.00 H ATOM 3004 HD13 LEU B 92 -0.130 6.022 7.659 1.00 0.00 H ATOM 3005 H LEU B 92 3.265 6.776 3.776 1.00 0.00 H ATOM 3006 N LEU B 93 3.152 3.051 2.510 1.00 8.80 N ATOM 3007 CA LEU B 93 2.992 2.538 1.151 1.00 11.02 C ATOM 3008 C LEU B 93 1.769 1.647 1.170 1.00 10.62 C ATOM 3009 O LEU B 93 1.752 0.585 1.808 1.00 10.73 O ATOM 3010 CB LEU B 93 4.260 1.853 0.647 1.00 11.38 C ATOM 3011 CG LEU B 93 4.160 1.467 -0.827 1.00 12.08 C ATOM 3012 CD1 LEU B 93 5.480 1.629 -1.521 1.00 19.35 C ATOM 3013 CD2 LEU B 93 3.658 0.044 -0.903 1.00 13.25 C ATOM 3014 HA LEU B 93 2.837 3.343 0.433 1.00 0.00 H ATOM 3015 HB2 LEU B 93 5.102 2.533 0.776 1.00 0.00 H ATOM 3016 HB3 LEU B 93 4.430 0.951 1.236 1.00 0.00 H ATOM 3017 HG LEU B 93 3.463 2.128 -1.342 1.00 0.00 H ATOM 3018 HD21 LEU B 93 4.357 -0.614 -0.387 1.00 0.00 H ATOM 3019 HD22 LEU B 93 2.679 -0.020 -0.429 1.00 0.00 H ATOM 3020 HD23 LEU B 93 3.578 -0.256 -1.948 1.00 0.00 H ATOM 3021 HD11 LEU B 93 5.799 2.669 -1.454 1.00 0.00 H ATOM 3022 HD12 LEU B 93 6.221 0.989 -1.043 1.00 0.00 H ATOM 3023 HD13 LEU B 93 5.375 1.346 -2.568 1.00 0.00 H ATOM 3024 H LEU B 93 3.582 2.445 3.237 1.00 0.00 H ATOM 3025 N GLY B 94 0.704 2.147 0.539 1.00 9.28 N ATOM 3026 CA GLY B 94 -0.585 1.515 0.677 1.00 10.20 C ATOM 3027 C GLY B 94 -0.939 0.565 -0.462 1.00 10.66 C ATOM 3028 O GLY B 94 -0.099 0.199 -1.313 1.00 10.88 O ATOM 3029 HA3 GLY B 94 -1.346 2.295 0.722 1.00 0.00 H ATOM 3030 HA2 GLY B 94 -0.591 0.950 1.609 1.00 0.00 H ATOM 3031 H GLY B 94 0.804 2.995 -0.054 1.00 0.00 H ATOM 3032 N ARG B 95 -2.214 0.202 -0.477 1.00 10.37 N ATOM 3033 CA ARG B 95 -2.710 -0.826 -1.429 1.00 10.06 C ATOM 3034 C ARG B 95 -2.641 -0.308 -2.848 1.00 11.53 C ATOM 3035 O ARG B 95 -2.531 -1.140 -3.794 1.00 13.86 O ATOM 3036 CB ARG B 95 -4.134 -1.204 -1.090 1.00 12.03 C ATOM 3037 CG ARG B 95 -4.266 -1.884 0.302 1.00 12.37 C ATOM 3038 CD ARG B 95 -5.625 -2.491 0.536 1.00 11.42 C ATOM 3039 NE ARG B 95 -6.710 -1.487 0.501 1.00 11.86 N ATOM 3040 CZ ARG B 95 -7.191 -0.816 1.544 1.00 11.95 C ATOM 3041 NH1 ARG B 95 -6.706 -0.993 2.768 1.00 13.11 N ATOM 3042 NH2 ARG B 95 -8.211 0.046 1.388 1.00 15.28 N ATOM 3043 HA ARG B 95 -2.076 -1.709 -1.346 1.00 0.00 H ATOM 3044 HB2 ARG B 95 -4.744 -0.301 -1.095 1.00 0.00 H ATOM 3045 HB3 ARG B 95 -4.501 -1.893 -1.850 1.00 0.00 H ATOM 3046 HG2 ARG B 95 -3.516 -2.672 0.376 1.00 0.00 H ATOM 3047 HG3 ARG B 95 -4.082 -1.136 1.073 1.00 0.00 H ATOM 3048 HD2 ARG B 95 -5.628 -2.975 1.513 1.00 0.00 H ATOM 3049 HD3 ARG B 95 -5.813 -3.236 -0.237 1.00 0.00 H ATOM 3050 HE ARG B 95 -7.137 -1.287 -0.426 1.00 0.00 H ATOM 3051 HH12 ARG B 95 -7.100 -0.455 3.566 1.00 0.00 H ATOM 3052 HH11 ARG B 95 -5.932 -1.669 2.928 1.00 0.00 H ATOM 3053 HH22 ARG B 95 -8.582 0.567 2.208 1.00 0.00 H ATOM 3054 HH21 ARG B 95 -8.629 0.192 0.447 1.00 0.00 H ATOM 3055 H ARG B 95 -2.879 0.644 0.189 1.00 0.00 H ATOM 3056 N ASP B 96 -2.714 1.012 -3.064 1.00 10.77 N ATOM 3057 CA ASP B 96 -2.522 1.600 -4.357 1.00 11.96 C ATOM 3058 C ASP B 96 -1.200 1.136 -4.961 1.00 13.61 C ATOM 3059 O ASP B 96 -1.172 0.657 -6.119 1.00 18.38 O ATOM 3060 CB ASP B 96 -2.636 3.122 -4.258 1.00 12.01 C ATOM 3061 CG ASP B 96 -1.604 3.755 -3.299 1.00 12.28 C ATOM 3062 OD1 ASP B 96 -1.161 3.117 -2.320 1.00 11.70 O ATOM 3063 OD2 ASP B 96 -1.340 4.944 -3.508 1.00 12.34 O ATOM 3064 HA ASP B 96 -3.306 1.266 -5.037 1.00 0.00 H ATOM 3065 HB2 ASP B 96 -2.489 3.545 -5.252 1.00 0.00 H ATOM 3066 HB3 ASP B 96 -3.636 3.371 -3.903 1.00 0.00 H ATOM 3067 H ASP B 96 -2.919 1.637 -2.259 1.00 0.00 H ATOM 3068 N LEU B 97 -0.104 1.235 -4.243 1.00 12.11 N ATOM 3069 CA LEU B 97 1.189 0.933 -4.822 1.00 12.04 C ATOM 3070 C LEU B 97 1.553 -0.528 -4.624 1.00 14.48 C ATOM 3071 O LEU B 97 2.351 -1.094 -5.416 1.00 14.55 O ATOM 3072 CB LEU B 97 2.302 1.886 -4.304 1.00 12.42 C ATOM 3073 CG LEU B 97 2.215 3.290 -4.888 1.00 13.86 C ATOM 3074 CD1 LEU B 97 3.247 4.214 -4.232 1.00 19.96 C ATOM 3075 CD2 LEU B 97 2.404 3.260 -6.372 1.00 18.29 C ATOM 3076 HA LEU B 97 1.110 1.107 -5.895 1.00 0.00 H ATOM 3077 HB2 LEU B 97 2.220 1.957 -3.219 1.00 0.00 H ATOM 3078 HB3 LEU B 97 3.271 1.461 -4.567 1.00 0.00 H ATOM 3079 HG LEU B 97 1.220 3.684 -4.679 1.00 0.00 H ATOM 3080 HD21 LEU B 97 3.384 2.842 -6.604 1.00 0.00 H ATOM 3081 HD22 LEU B 97 1.628 2.642 -6.823 1.00 0.00 H ATOM 3082 HD23 LEU B 97 2.338 4.274 -6.766 1.00 0.00 H ATOM 3083 HD11 LEU B 97 3.057 4.265 -3.160 1.00 0.00 H ATOM 3084 HD12 LEU B 97 4.248 3.820 -4.407 1.00 0.00 H ATOM 3085 HD13 LEU B 97 3.167 5.211 -4.664 1.00 0.00 H ATOM 3086 H LEU B 97 -0.165 1.533 -3.249 1.00 0.00 H ATOM 3087 N LEU B 98 1.006 -1.187 -3.619 1.00 12.45 N ATOM 3088 CA LEU B 98 1.249 -2.635 -3.471 1.00 12.12 C ATOM 3089 C LEU B 98 0.658 -3.386 -4.647 1.00 14.77 C ATOM 3090 O LEU B 98 1.274 -4.366 -5.115 1.00 13.83 O ATOM 3091 CB LEU B 98 0.675 -3.128 -2.155 1.00 14.49 C ATOM 3092 CG LEU B 98 1.414 -2.632 -0.907 1.00 13.14 C ATOM 3093 CD1 LEU B 98 0.628 -2.835 0.379 1.00 14.20 C ATOM 3094 CD2 LEU B 98 2.802 -3.345 -0.790 1.00 19.23 C ATOM 3095 HA LEU B 98 2.323 -2.820 -3.460 1.00 0.00 H ATOM 3096 HB2 LEU B 98 -0.361 -2.796 -2.091 1.00 0.00 H ATOM 3097 HB3 LEU B 98 0.706 -4.218 -2.158 1.00 0.00 H ATOM 3098 HG LEU B 98 1.546 -1.557 -1.032 1.00 0.00 H ATOM 3099 HD21 LEU B 98 2.651 -4.422 -0.714 1.00 0.00 H ATOM 3100 HD22 LEU B 98 3.399 -3.122 -1.674 1.00 0.00 H ATOM 3101 HD23 LEU B 98 3.320 -2.986 0.100 1.00 0.00 H ATOM 3102 HD11 LEU B 98 -0.314 -2.291 0.317 1.00 0.00 H ATOM 3103 HD12 LEU B 98 0.427 -3.897 0.517 1.00 0.00 H ATOM 3104 HD13 LEU B 98 1.210 -2.462 1.222 1.00 0.00 H ATOM 3105 H LEU B 98 0.405 -0.687 -2.933 1.00 0.00 H ATOM 3106 N THR B 99 -0.471 -2.911 -5.174 1.00 13.53 N ATOM 3107 CA THR B 99 -1.049 -3.515 -6.383 1.00 13.85 C ATOM 3108 C THR B 99 -0.126 -3.296 -7.570 1.00 17.64 C ATOM 3109 O THR B 99 0.096 -4.250 -8.355 1.00 18.74 O ATOM 3110 CB THR B 99 -2.367 -2.903 -6.676 1.00 16.01 C ATOM 3111 OG1 THR B 99 -3.297 -3.329 -5.684 1.00 17.61 O ATOM 3112 CG2 THR B 99 -2.894 -3.392 -8.067 1.00 20.57 C ATOM 3113 HA THR B 99 -1.172 -4.584 -6.210 1.00 0.00 H ATOM 3114 HB THR B 99 -2.261 -1.818 -6.682 1.00 0.00 H ATOM 3115 HG1 THR B 99 -3.371 -4.316 -5.705 1.00 0.00 H ATOM 3116 HG23 THR B 99 -2.200 -3.079 -8.847 1.00 0.00 H ATOM 3117 HG21 THR B 99 -2.972 -4.479 -8.063 1.00 0.00 H ATOM 3118 HG22 THR B 99 -3.875 -2.957 -8.256 1.00 0.00 H ATOM 3119 H THR B 99 -0.948 -2.104 -4.724 1.00 0.00 H ATOM 3120 N LYS B 100 0.444 -2.108 -7.713 1.00 17.86 N ATOM 3121 CA LYS B 100 1.345 -1.877 -8.872 1.00 16.50 C ATOM 3122 C LYS B 100 2.626 -2.679 -8.774 1.00 20.60 C ATOM 3123 O LYS B 100 3.185 -3.099 -9.795 1.00 24.32 O ATOM 3124 CB LYS B 100 1.642 -0.389 -9.014 1.00 21.28 C ATOM 3125 CG LYS B 100 0.374 0.426 -9.272 1.00 23.12 C ATOM 3126 CD LYS B 100 0.695 1.879 -9.593 1.00 27.77 C ATOM 3127 CE LYS B 100 -0.559 2.700 -9.758 1.00 31.66 C ATOM 3128 NZ LYS B 100 -1.259 2.474 -11.050 1.00 40.83 N ATOM 3129 HA LYS B 100 0.828 -2.224 -9.767 1.00 0.00 H ATOM 3130 HB2 LYS B 100 2.108 -0.034 -8.095 1.00 0.00 H ATOM 3131 HB3 LYS B 100 2.329 -0.245 -9.848 1.00 0.00 H ATOM 3132 HG2 LYS B 100 -0.163 -0.012 -10.114 1.00 0.00 H ATOM 3133 HG3 LYS B 100 -0.256 0.391 -8.383 1.00 0.00 H ATOM 3134 HD2 LYS B 100 1.289 2.298 -8.781 1.00 0.00 H ATOM 3135 HD3 LYS B 100 1.269 1.919 -10.519 1.00 0.00 H ATOM 3136 HE2 LYS B 100 -0.291 3.754 -9.692 1.00 0.00 H ATOM 3137 HE3 LYS B 100 -1.243 2.449 -8.948 1.00 0.00 H ATOM 3138 HZ1 LYS B 100 -0.623 2.720 -11.835 1.00 0.00 H ATOM 3139 HZ2 LYS B 100 -1.533 1.473 -11.124 1.00 0.00 H ATOM 3140 HZ3 LYS B 100 -2.109 3.071 -11.091 1.00 0.00 H ATOM 3141 H LYS B 100 0.264 -1.349 -7.025 1.00 0.00 H ATOM 3142 N LEU B 101 3.125 -2.888 -7.561 1.00 18.70 N ATOM 3143 CA LEU B 101 4.325 -3.689 -7.335 1.00 17.59 C ATOM 3144 C LEU B 101 4.067 -5.191 -7.408 1.00 18.11 C ATOM 3145 O LEU B 101 5.022 -5.975 -7.464 1.00 20.56 O ATOM 3146 CB LEU B 101 4.912 -3.369 -5.947 1.00 21.68 C ATOM 3147 CG LEU B 101 5.631 -2.043 -5.832 1.00 17.67 C ATOM 3148 CD1 LEU B 101 5.730 -1.588 -4.379 1.00 20.54 C ATOM 3149 CD2 LEU B 101 7.022 -2.043 -6.507 1.00 25.19 C ATOM 3150 HA LEU B 101 5.021 -3.428 -8.132 1.00 0.00 H ATOM 3151 HB2 LEU B 101 4.093 -3.370 -5.228 1.00 0.00 H ATOM 3152 HB3 LEU B 101 5.620 -4.158 -5.692 1.00 0.00 H ATOM 3153 HG LEU B 101 5.022 -1.323 -6.379 1.00 0.00 H ATOM 3154 HD21 LEU B 101 7.651 -2.801 -6.040 1.00 0.00 H ATOM 3155 HD22 LEU B 101 6.910 -2.266 -7.568 1.00 0.00 H ATOM 3156 HD23 LEU B 101 7.482 -1.062 -6.387 1.00 0.00 H ATOM 3157 HD11 LEU B 101 4.728 -1.476 -3.966 1.00 0.00 H ATOM 3158 HD12 LEU B 101 6.281 -2.332 -3.803 1.00 0.00 H ATOM 3159 HD13 LEU B 101 6.252 -0.632 -4.334 1.00 0.00 H ATOM 3160 H LEU B 101 2.643 -2.466 -6.742 1.00 0.00 H ATOM 3161 N LYS B 102 2.802 -5.571 -7.331 1.00 17.80 N ATOM 3162 CA LYS B 102 2.398 -6.976 -7.140 1.00 18.47 C ATOM 3163 C LYS B 102 3.212 -7.596 -6.010 1.00 22.88 C ATOM 3164 O LYS B 102 3.772 -8.705 -6.112 1.00 21.10 O ATOM 3165 CB LYS B 102 2.556 -7.781 -8.459 1.00 25.31 C ATOM 3166 CG LYS B 102 1.753 -7.232 -9.648 1.00 29.97 C ATOM 3167 CD LYS B 102 0.243 -7.413 -9.457 1.00 38.35 C ATOM 3168 CE LYS B 102 -0.569 -6.844 -10.630 1.00 42.25 C ATOM 3169 NZ LYS B 102 -0.501 -5.358 -10.787 1.00 45.67 N ATOM 3170 HA LYS B 102 1.344 -7.008 -6.865 1.00 0.00 H ATOM 3171 HB2 LYS B 102 3.611 -7.781 -8.733 1.00 0.00 H ATOM 3172 HB3 LYS B 102 2.231 -8.805 -8.273 1.00 0.00 H ATOM 3173 HG2 LYS B 102 1.969 -6.169 -9.757 1.00 0.00 H ATOM 3174 HG3 LYS B 102 2.059 -7.759 -10.552 1.00 0.00 H ATOM 3175 HD2 LYS B 102 0.027 -8.477 -9.365 1.00 0.00 H ATOM 3176 HD3 LYS B 102 -0.058 -6.902 -8.542 1.00 0.00 H ATOM 3177 HE2 LYS B 102 -1.613 -7.121 -10.484 1.00 0.00 H ATOM 3178 HE3 LYS B 102 -0.199 -7.298 -11.549 1.00 0.00 H ATOM 3179 HZ1 LYS B 102 -0.864 -4.903 -9.925 1.00 0.00 H ATOM 3180 HZ2 LYS B 102 0.487 -5.072 -10.942 1.00 0.00 H ATOM 3181 HZ3 LYS B 102 -1.079 -5.070 -11.602 1.00 0.00 H ATOM 3182 H LYS B 102 2.060 -4.847 -7.409 1.00 0.00 H ATOM 3183 N ALA B 103 3.291 -6.878 -4.897 1.00 16.84 N ATOM 3184 CA ALA B 103 4.125 -7.255 -3.782 1.00 17.54 C ATOM 3185 C ALA B 103 3.525 -8.430 -3.025 1.00 15.13 C ATOM 3186 O ALA B 103 2.299 -8.660 -3.062 1.00 17.47 O ATOM 3187 CB ALA B 103 4.303 -6.038 -2.842 1.00 17.32 C ATOM 3188 HA ALA B 103 5.099 -7.567 -4.159 1.00 0.00 H ATOM 3189 HB1 ALA B 103 4.773 -5.222 -3.391 1.00 0.00 H ATOM 3190 HB2 ALA B 103 3.328 -5.717 -2.477 1.00 0.00 H ATOM 3191 HB3 ALA B 103 4.933 -6.321 -1.999 1.00 0.00 H ATOM 3192 H ALA B 103 2.728 -6.007 -4.825 1.00 0.00 H ATOM 3193 N GLN B 104 4.432 -9.151 -2.383 1.00 14.50 N ATOM 3194 CA GLN B 104 4.065 -10.138 -1.352 1.00 15.39 C ATOM 3195 C GLN B 104 4.684 -9.680 -0.051 1.00 15.66 C ATOM 3196 O GLN B 104 5.821 -9.223 0.006 1.00 16.13 O ATOM 3197 CB GLN B 104 4.653 -11.536 -1.654 1.00 19.41 C ATOM 3198 CG GLN B 104 4.316 -12.109 -3.037 1.00 20.61 C ATOM 3199 CD GLN B 104 4.952 -13.479 -3.241 1.00 23.94 C ATOM 3200 OE1 GLN B 104 5.652 -13.983 -2.383 1.00 24.55 O ATOM 3201 NE2 GLN B 104 4.706 -14.072 -4.399 1.00 30.25 N ATOM 3202 HA GLN B 104 2.978 -10.210 -1.316 1.00 0.00 H ATOM 3203 HB2 GLN B 104 5.738 -11.469 -1.573 1.00 0.00 H ATOM 3204 HB3 GLN B 104 4.276 -12.229 -0.902 1.00 0.00 H ATOM 3205 HG2 GLN B 104 3.234 -12.203 -3.128 1.00 0.00 H ATOM 3206 HG3 GLN B 104 4.686 -11.428 -3.803 1.00 0.00 H ATOM 3207 HE22 GLN B 104 4.101 -13.605 -5.104 1.00 0.00 H ATOM 3208 HE21 GLN B 104 5.117 -15.005 -4.603 1.00 0.00 H ATOM 3209 H GLN B 104 5.437 -9.016 -2.614 1.00 0.00 H ATOM 3210 N ILE B 105 3.921 -9.816 1.034 1.00 14.87 N ATOM 3211 CA ILE B 105 4.423 -9.515 2.341 1.00 15.04 C ATOM 3212 C ILE B 105 4.429 -10.814 3.159 1.00 12.09 C ATOM 3213 O ILE B 105 3.392 -11.487 3.244 1.00 14.99 O ATOM 3214 CB ILE B 105 3.534 -8.448 3.044 1.00 14.59 C ATOM 3215 CG1 ILE B 105 3.418 -7.191 2.182 1.00 13.84 C ATOM 3216 CG2 ILE B 105 4.023 -8.181 4.414 1.00 16.41 C ATOM 3217 CD1 ILE B 105 2.111 -6.512 2.397 1.00 18.71 C ATOM 3218 HA ILE B 105 5.431 -9.108 2.262 1.00 0.00 H ATOM 3219 HB ILE B 105 2.522 -8.837 3.153 1.00 0.00 H ATOM 3220 HG12 ILE B 105 4.223 -6.504 2.443 1.00 0.00 H ATOM 3221 HG13 ILE B 105 3.506 -7.470 1.132 1.00 0.00 H ATOM 3222 HD11 ILE B 105 1.302 -7.193 2.133 1.00 0.00 H ATOM 3223 HD12 ILE B 105 2.019 -6.226 3.445 1.00 0.00 H ATOM 3224 HD13 ILE B 105 2.058 -5.622 1.770 1.00 0.00 H ATOM 3225 HG21 ILE B 105 3.994 -9.103 4.995 1.00 0.00 H ATOM 3226 HG22 ILE B 105 5.047 -7.812 4.367 1.00 0.00 H ATOM 3227 HG23 ILE B 105 3.387 -7.432 4.886 1.00 0.00 H ATOM 3228 H ILE B 105 2.941 -10.148 0.929 1.00 0.00 H ATOM 3229 N HIS B 106 5.581 -11.117 3.738 1.00 13.33 N ATOM 3230 CA HIS B 106 5.790 -12.393 4.451 1.00 14.33 C ATOM 3231 C HIS B 106 6.123 -12.166 5.901 1.00 14.10 C ATOM 3232 O HIS B 106 7.091 -11.480 6.204 1.00 19.05 O ATOM 3233 CB HIS B 106 6.963 -13.148 3.789 1.00 18.01 C ATOM 3234 CG HIS B 106 6.671 -13.625 2.405 1.00 17.41 C ATOM 3235 ND1 HIS B 106 6.608 -14.964 2.089 1.00 23.00 N ATOM 3236 CD2 HIS B 106 6.395 -12.954 1.258 1.00 19.25 C ATOM 3237 CE1 HIS B 106 6.327 -15.098 0.804 1.00 22.97 C ATOM 3238 NE2 HIS B 106 6.207 -13.897 0.269 1.00 20.68 N ATOM 3239 HA HIS B 106 4.868 -12.971 4.394 1.00 0.00 H ATOM 3240 HB2 HIS B 106 7.822 -12.479 3.748 1.00 0.00 H ATOM 3241 HB3 HIS B 106 7.207 -14.013 4.406 1.00 0.00 H ATOM 3242 HD2 HIS B 106 6.333 -11.872 1.140 1.00 0.00 H ATOM 3243 HE1 HIS B 106 6.213 -16.044 0.274 1.00 0.00 H ATOM 3244 H HIS B 106 6.364 -10.434 3.689 1.00 0.00 H ATOM 3245 N PHE B 107 5.342 -12.776 6.811 1.00 14.79 N ATOM 3246 CA PHE B 107 5.641 -12.756 8.237 1.00 15.55 C ATOM 3247 C PHE B 107 6.222 -14.109 8.747 1.00 18.14 C ATOM 3248 O PHE B 107 6.597 -14.196 9.908 1.00 29.14 O ATOM 3249 CB PHE B 107 4.368 -12.485 9.054 1.00 15.34 C ATOM 3250 CG PHE B 107 3.904 -11.063 8.987 1.00 13.37 C ATOM 3251 CD1 PHE B 107 4.189 -10.196 10.019 1.00 13.89 C ATOM 3252 CD2 PHE B 107 3.168 -10.619 7.885 1.00 14.20 C ATOM 3253 CE1 PHE B 107 3.773 -8.843 9.992 1.00 13.14 C ATOM 3254 CE2 PHE B 107 2.737 -9.282 7.848 1.00 14.48 C ATOM 3255 CZ PHE B 107 3.072 -8.390 8.895 1.00 14.01 C ATOM 3256 HA PHE B 107 6.380 -11.966 8.371 1.00 0.00 H ATOM 3257 HB2 PHE B 107 3.572 -13.126 8.675 1.00 0.00 H ATOM 3258 HB3 PHE B 107 4.568 -12.734 10.096 1.00 0.00 H ATOM 3259 HD2 PHE B 107 2.932 -11.299 7.067 1.00 0.00 H ATOM 3260 HE2 PHE B 107 2.140 -8.929 7.007 1.00 0.00 H ATOM 3261 HZ PHE B 107 2.775 -7.343 8.834 1.00 0.00 H ATOM 3262 HE1 PHE B 107 4.002 -8.174 10.821 1.00 0.00 H ATOM 3263 HD1 PHE B 107 4.750 -10.561 10.879 1.00 0.00 H ATOM 3264 H PHE B 107 4.493 -13.281 6.484 1.00 0.00 H ATOM 3265 N GLU B 108 6.225 -15.122 7.902 1.00 22.21 N ATOM 3266 CA GLU B 108 6.675 -16.494 8.250 1.00 28.81 C ATOM 3267 C GLU B 108 8.200 -16.655 8.300 1.00 36.36 C ATOM 3268 O GLU B 108 8.709 -17.687 8.781 1.00 35.63 O ATOM 3269 CB GLU B 108 6.074 -17.503 7.261 1.00 28.73 C ATOM 3270 CG GLU B 108 6.879 -17.698 5.981 1.00 29.74 C ATOM 3271 CD GLU B 108 6.659 -16.605 4.947 1.00 32.15 C ATOM 3272 OE1 GLU B 108 5.849 -15.664 5.190 1.00 27.61 O ATOM 3273 OE2 GLU B 108 7.318 -16.697 3.892 1.00 30.30 O ATOM 3274 HA GLU B 108 6.317 -16.687 9.261 1.00 0.00 H ATOM 3275 HB2 GLU B 108 5.997 -18.467 7.764 1.00 0.00 H ATOM 3276 HB3 GLU B 108 5.078 -17.157 6.986 1.00 0.00 H ATOM 3277 HG2 GLU B 108 7.938 -17.719 6.240 1.00 0.00 H ATOM 3278 HG3 GLU B 108 6.596 -18.653 5.538 1.00 0.00 H ATOM 3279 H GLU B 108 5.892 -14.949 6.932 1.00 0.00 H ATOM 3280 N GLY B 109 8.923 -15.663 7.778 1.00 33.82 N ATOM 3281 CA GLY B 109 10.380 -15.621 7.919 1.00 40.43 C ATOM 3282 C GLY B 109 10.775 -14.777 9.121 1.00 40.50 C ATOM 3283 O GLY B 109 9.945 -14.529 10.017 1.00 38.71 O ATOM 3284 HA3 GLY B 109 10.816 -15.189 7.018 1.00 0.00 H ATOM 3285 HA2 GLY B 109 10.757 -16.635 8.053 1.00 0.00 H ATOM 3286 H GLY B 109 8.441 -14.902 7.259 1.00 0.00 H ATOM 3287 N SER B 110 12.031 -14.315 9.140 1.00 41.05 N ATOM 3288 CA SER B 110 12.526 -13.428 10.204 1.00 42.61 C ATOM 3289 C SER B 110 11.973 -12.016 9.994 1.00 39.32 C ATOM 3290 O SER B 110 12.226 -11.403 8.953 1.00 38.90 O ATOM 3291 CB SER B 110 14.062 -13.388 10.210 1.00 46.20 C ATOM 3292 OG SER B 110 14.615 -14.682 10.006 1.00 52.40 O ATOM 3293 HA SER B 110 12.187 -13.815 11.165 1.00 0.00 H ATOM 3294 HB2 SER B 110 14.403 -13.003 11.171 1.00 0.00 H ATOM 3295 HB3 SER B 110 14.403 -12.727 9.414 1.00 0.00 H ATOM 3296 HG SER B 110 14.313 -15.035 9.132 1.00 0.00 H ATOM 3297 H SER B 110 12.680 -14.593 8.376 1.00 0.00 H ATOM 3298 N GLY B 111 11.221 -11.519 10.978 1.00 36.03 N ATOM 3299 CA GLY B 111 10.554 -10.209 10.879 1.00 33.88 C ATOM 3300 C GLY B 111 9.398 -10.227 9.891 1.00 26.25 C ATOM 3301 O GLY B 111 8.727 -11.267 9.706 1.00 25.93 O ATOM 3302 HA3 GLY B 111 11.283 -9.467 10.553 1.00 0.00 H ATOM 3303 HA2 GLY B 111 10.172 -9.934 11.862 1.00 0.00 H ATOM 3304 H GLY B 111 11.101 -12.077 11.847 1.00 0.00 H ATOM 3305 N ALA B 112 9.131 -9.089 9.255 1.00 17.99 N ATOM 3306 CA ALA B 112 8.255 -9.101 8.102 1.00 14.93 C ATOM 3307 C ALA B 112 9.009 -8.527 6.925 1.00 15.36 C ATOM 3308 O ALA B 112 9.699 -7.520 7.059 1.00 18.23 O ATOM 3309 CB ALA B 112 6.972 -8.319 8.349 1.00 16.54 C ATOM 3310 HA ALA B 112 7.957 -10.129 7.897 1.00 0.00 H ATOM 3311 HB1 ALA B 112 6.435 -8.760 9.189 1.00 0.00 H ATOM 3312 HB2 ALA B 112 7.218 -7.282 8.578 1.00 0.00 H ATOM 3313 HB3 ALA B 112 6.347 -8.357 7.456 1.00 0.00 H ATOM 3314 H ALA B 112 9.549 -8.196 9.584 1.00 0.00 H ATOM 3315 N GLN B 113 8.868 -9.209 5.794 1.00 15.73 N ATOM 3316 CA GLN B 113 9.655 -8.934 4.595 1.00 18.86 C ATOM 3317 C GLN B 113 8.748 -8.689 3.450 1.00 17.33 C ATOM 3318 O GLN B 113 7.660 -9.255 3.347 1.00 17.34 O ATOM 3319 CB GLN B 113 10.557 -10.132 4.254 1.00 23.16 C ATOM 3320 CG GLN B 113 11.623 -10.379 5.322 1.00 23.94 C ATOM 3321 CD GLN B 113 12.321 -11.713 5.185 1.00 33.71 C ATOM 3322 OE1 GLN B 113 12.304 -12.539 6.109 1.00 37.14 O ATOM 3323 NE2 GLN B 113 12.941 -11.938 4.031 1.00 27.75 N ATOM 3324 HA GLN B 113 10.273 -8.057 4.785 1.00 0.00 H ATOM 3325 HB2 GLN B 113 9.937 -11.024 4.165 1.00 0.00 H ATOM 3326 HB3 GLN B 113 11.052 -9.939 3.302 1.00 0.00 H ATOM 3327 HG2 GLN B 113 12.371 -9.590 5.251 1.00 0.00 H ATOM 3328 HG3 GLN B 113 11.146 -10.339 6.301 1.00 0.00 H ATOM 3329 HE22 GLN B 113 12.928 -11.214 3.284 1.00 0.00 H ATOM 3330 HE21 GLN B 113 13.439 -12.838 3.875 1.00 0.00 H ATOM 3331 H GLN B 113 8.165 -9.974 5.761 1.00 0.00 H ATOM 3332 N VAL B 114 9.199 -7.857 2.506 1.00 18.40 N ATOM 3333 CA VAL B 114 8.382 -7.488 1.363 1.00 16.78 C ATOM 3334 C VAL B 114 9.195 -7.873 0.134 1.00 16.85 C ATOM 3335 O VAL B 114 10.368 -7.515 0.025 1.00 20.94 O ATOM 3336 CB VAL B 114 8.097 -5.952 1.313 1.00 20.13 C ATOM 3337 CG1 VAL B 114 7.116 -5.657 0.179 1.00 21.37 C ATOM 3338 CG2 VAL B 114 7.584 -5.500 2.671 1.00 22.81 C ATOM 3339 HA VAL B 114 7.416 -7.991 1.418 1.00 0.00 H ATOM 3340 HB VAL B 114 9.007 -5.390 1.104 1.00 0.00 H ATOM 3341 HG11 VAL B 114 7.549 -5.979 -0.768 1.00 0.00 H ATOM 3342 HG12 VAL B 114 6.185 -6.196 0.356 1.00 0.00 H ATOM 3343 HG13 VAL B 114 6.916 -4.586 0.143 1.00 0.00 H ATOM 3344 HG21 VAL B 114 6.666 -6.038 2.908 1.00 0.00 H ATOM 3345 HG22 VAL B 114 8.337 -5.711 3.431 1.00 0.00 H ATOM 3346 HG23 VAL B 114 7.383 -4.429 2.644 1.00 0.00 H ATOM 3347 H VAL B 114 10.158 -7.464 2.592 1.00 0.00 H ATOM 3348 N VAL B 115 8.542 -8.632 -0.726 1.00 16.25 N ATOM 3349 CA VAL B 115 9.168 -9.124 -1.965 1.00 18.28 C ATOM 3350 C VAL B 115 8.253 -8.890 -3.143 1.00 16.52 C ATOM 3351 O VAL B 115 7.082 -8.508 -2.994 1.00 18.86 O ATOM 3352 CB VAL B 115 9.594 -10.596 -1.855 1.00 17.49 C ATOM 3353 CG1 VAL B 115 10.712 -10.743 -0.802 1.00 22.70 C ATOM 3354 CG2 VAL B 115 8.386 -11.509 -1.587 1.00 19.89 C ATOM 3355 HA VAL B 115 10.083 -8.554 -2.126 1.00 0.00 H ATOM 3356 HB VAL B 115 10.005 -10.923 -2.810 1.00 0.00 H ATOM 3357 HG11 VAL B 115 11.571 -10.141 -1.099 1.00 0.00 H ATOM 3358 HG12 VAL B 115 10.345 -10.401 0.166 1.00 0.00 H ATOM 3359 HG13 VAL B 115 11.007 -11.790 -0.731 1.00 0.00 H ATOM 3360 HG21 VAL B 115 7.910 -11.214 -0.652 1.00 0.00 H ATOM 3361 HG22 VAL B 115 7.672 -11.414 -2.405 1.00 0.00 H ATOM 3362 HG23 VAL B 115 8.723 -12.543 -1.515 1.00 0.00 H ATOM 3363 H VAL B 115 7.555 -8.890 -0.523 1.00 0.00 H ATOM 3364 N GLY B 116 8.771 -9.148 -4.355 1.00 17.71 N ATOM 3365 CA GLY B 116 7.962 -9.020 -5.550 1.00 20.40 C ATOM 3366 C GLY B 116 7.088 -10.220 -5.879 1.00 19.21 C ATOM 3367 O GLY B 116 7.009 -11.179 -5.094 1.00 20.34 O ATOM 3368 HA3 GLY B 116 8.632 -8.851 -6.393 1.00 0.00 H ATOM 3369 HA2 GLY B 116 7.312 -8.154 -5.425 1.00 0.00 H ATOM 3370 H GLY B 116 9.765 -9.443 -4.437 1.00 0.00 H ATOM 3371 N PRO B 117 6.422 -10.171 -7.046 1.00 20.90 N ATOM 3372 CA PRO B 117 5.424 -11.172 -7.421 1.00 20.16 C ATOM 3373 C PRO B 117 5.949 -12.591 -7.535 1.00 25.15 C ATOM 3374 O PRO B 117 5.168 -13.532 -7.415 1.00 26.75 O ATOM 3375 CB PRO B 117 4.919 -10.679 -8.775 1.00 25.40 C ATOM 3376 CG PRO B 117 5.969 -9.801 -9.280 1.00 25.01 C ATOM 3377 CD PRO B 117 6.511 -9.111 -8.057 1.00 22.17 C ATOM 3378 HA PRO B 117 4.660 -11.251 -6.648 1.00 0.00 H ATOM 3379 HD3 PRO B 117 7.542 -8.791 -8.206 1.00 0.00 H ATOM 3380 HD2 PRO B 117 5.901 -8.250 -7.784 1.00 0.00 H ATOM 3381 HG3 PRO B 117 5.559 -9.075 -9.982 1.00 0.00 H ATOM 3382 HG2 PRO B 117 6.750 -10.380 -9.773 1.00 0.00 H ATOM 3383 HB2 PRO B 117 4.763 -11.518 -9.453 1.00 0.00 H ATOM 3384 HB3 PRO B 117 3.985 -10.130 -8.658 1.00 0.00 H ATOM 3385 N MET B 118 7.252 -12.746 -7.721 1.00 26.82 N ATOM 3386 CA MET B 118 7.825 -14.094 -7.713 1.00 31.06 C ATOM 3387 C MET B 118 8.816 -14.326 -6.599 1.00 35.08 C ATOM 3388 O MET B 118 9.711 -15.163 -6.709 1.00 33.16 O ATOM 3389 CB MET B 118 8.425 -14.409 -9.061 1.00 29.74 C ATOM 3390 CG MET B 118 7.353 -14.592 -10.100 1.00 28.32 C ATOM 3391 SD MET B 118 8.136 -14.586 -11.675 1.00 28.26 S ATOM 3392 CE MET B 118 8.578 -12.860 -11.707 1.00 32.10 C ATOM 3393 HA MET B 118 7.005 -14.784 -7.514 1.00 0.00 H ATOM 3394 HB2 MET B 118 9.077 -13.589 -9.362 1.00 0.00 H ATOM 3395 HB3 MET B 118 9.009 -15.326 -8.986 1.00 0.00 H ATOM 3396 HG2 MET B 118 6.632 -13.776 -10.039 1.00 0.00 H ATOM 3397 HG3 MET B 118 6.840 -15.541 -9.943 1.00 0.00 H ATOM 3398 HE1 MET B 118 7.675 -12.254 -11.637 1.00 0.00 H ATOM 3399 HE2 MET B 118 9.232 -12.638 -10.864 1.00 0.00 H ATOM 3400 HE3 MET B 118 9.096 -12.636 -12.640 1.00 0.00 H ATOM 3401 H MET B 118 7.862 -11.918 -7.871 1.00 0.00 H ATOM 3402 N GLY B 119 8.653 -13.590 -5.512 1.00 25.90 N ATOM 3403 CA GLY B 119 9.384 -13.906 -4.293 1.00 28.99 C ATOM 3404 C GLY B 119 10.709 -13.179 -4.244 1.00 23.22 C ATOM 3405 O GLY B 119 11.466 -13.324 -3.282 1.00 28.50 O ATOM 3406 HA3 GLY B 119 9.566 -14.980 -4.256 1.00 0.00 H ATOM 3407 HA2 GLY B 119 8.784 -13.611 -3.432 1.00 0.00 H ATOM 3408 H GLY B 119 7.999 -12.781 -5.528 1.00 0.00 H ATOM 3409 N GLN B 120 10.935 -12.359 -5.263 1.00 31.86 N ATOM 3410 CA GLN B 120 12.187 -11.643 -5.441 1.00 37.85 C ATOM 3411 C GLN B 120 12.218 -10.367 -4.621 1.00 36.74 C ATOM 3412 O GLN B 120 11.290 -9.572 -4.702 1.00 30.19 O ATOM 3413 CB GLN B 120 12.371 -11.314 -6.930 1.00 43.38 C ATOM 3414 CG GLN B 120 11.097 -11.551 -7.778 1.00 50.82 C ATOM 3415 CD GLN B 120 10.360 -10.278 -8.159 1.00 53.65 C ATOM 3416 OE1 GLN B 120 10.724 -9.171 -7.749 1.00 57.13 O ATOM 3417 NE2 GLN B 120 9.324 -10.430 -8.972 1.00 54.31 N ATOM 3418 HA GLN B 120 13.002 -12.279 -5.095 1.00 0.00 H ATOM 3419 HB2 GLN B 120 12.655 -10.265 -7.019 1.00 0.00 H ATOM 3420 HB3 GLN B 120 13.170 -11.940 -7.326 1.00 0.00 H ATOM 3421 HG2 GLN B 120 11.386 -12.067 -8.694 1.00 0.00 H ATOM 3422 HG3 GLN B 120 10.417 -12.182 -7.206 1.00 0.00 H ATOM 3423 HE22 GLN B 120 9.051 -11.380 -9.294 1.00 0.00 H ATOM 3424 HE21 GLN B 120 8.785 -9.599 -9.288 1.00 0.00 H ATOM 3425 H GLN B 120 10.181 -12.223 -5.966 1.00 0.00 H ATOM 3426 N PRO B 121 13.292 -10.158 -3.837 1.00 39.24 N ATOM 3427 CA PRO B 121 13.518 -8.836 -3.287 1.00 44.24 C ATOM 3428 C PRO B 121 13.392 -7.866 -4.445 1.00 47.30 C ATOM 3429 O PRO B 121 14.048 -8.036 -5.486 1.00 51.31 O ATOM 3430 CB PRO B 121 14.961 -8.912 -2.783 1.00 45.88 C ATOM 3431 CG PRO B 121 15.102 -10.337 -2.381 1.00 45.11 C ATOM 3432 CD PRO B 121 14.329 -11.111 -3.407 1.00 41.46 C ATOM 3433 HA PRO B 121 12.835 -8.524 -2.497 1.00 0.00 H ATOM 3434 HD3 PRO B 121 14.967 -11.398 -4.243 1.00 0.00 H ATOM 3435 HD2 PRO B 121 13.882 -12.004 -2.969 1.00 0.00 H ATOM 3436 HG3 PRO B 121 14.686 -10.497 -1.387 1.00 0.00 H ATOM 3437 HG2 PRO B 121 16.151 -10.635 -2.387 1.00 0.00 H ATOM 3438 HB2 PRO B 121 15.666 -8.656 -3.574 1.00 0.00 H ATOM 3439 HB3 PRO B 121 15.114 -8.248 -1.932 1.00 0.00 H ATOM 3440 N LEU B 122 12.491 -6.910 -4.284 1.00 45.07 N ATOM 3441 CA LEU B 122 12.161 -5.965 -5.329 1.00 44.56 C ATOM 3442 C LEU B 122 13.405 -5.193 -5.772 1.00 48.39 C ATOM 3443 O LEU B 122 13.951 -4.384 -5.017 1.00 48.21 O ATOM 3444 CB LEU B 122 11.032 -5.030 -4.855 1.00 40.80 C ATOM 3445 CG LEU B 122 9.654 -5.710 -4.756 1.00 37.55 C ATOM 3446 CD1 LEU B 122 8.794 -5.150 -3.642 1.00 36.32 C ATOM 3447 CD2 LEU B 122 8.910 -5.636 -6.081 1.00 34.40 C ATOM 3448 HA LEU B 122 11.797 -6.506 -6.202 1.00 0.00 H ATOM 3449 HB2 LEU B 122 11.296 -4.646 -3.870 1.00 0.00 H ATOM 3450 HB3 LEU B 122 10.955 -4.201 -5.559 1.00 0.00 H ATOM 3451 HG LEU B 122 9.851 -6.754 -4.513 1.00 0.00 H ATOM 3452 HD21 LEU B 122 8.765 -4.592 -6.357 1.00 0.00 H ATOM 3453 HD22 LEU B 122 9.493 -6.139 -6.852 1.00 0.00 H ATOM 3454 HD23 LEU B 122 7.941 -6.124 -5.980 1.00 0.00 H ATOM 3455 HD11 LEU B 122 9.301 -5.290 -2.688 1.00 0.00 H ATOM 3456 HD12 LEU B 122 8.627 -4.087 -3.813 1.00 0.00 H ATOM 3457 HD13 LEU B 122 7.837 -5.672 -3.626 1.00 0.00 H ATOM 3458 H LEU B 122 12.001 -6.835 -3.370 1.00 0.00 H ATOM 3459 N GLN B 123 13.872 -5.496 -6.983 1.00 50.70 N ATOM 3460 CA GLN B 123 14.924 -4.723 -7.638 1.00 55.15 C ATOM 3461 C GLN B 123 14.315 -3.399 -8.098 1.00 56.39 C ATOM 3462 O GLN B 123 13.873 -3.251 -9.246 1.00 54.60 O ATOM 3463 CB GLN B 123 15.520 -5.503 -8.810 1.00 56.60 C ATOM 3464 CG GLN B 123 16.361 -6.702 -8.392 1.00 60.01 C ATOM 3465 CD GLN B 123 17.099 -7.341 -9.563 1.00 61.86 C ATOM 3466 OE1 GLN B 123 16.657 -7.265 -10.713 1.00 64.08 O ATOM 3467 NE2 GLN B 123 18.230 -7.974 -9.270 1.00 60.50 N ATOM 3468 HA GLN B 123 15.741 -4.529 -6.944 1.00 0.00 H ATOM 3469 HB2 GLN B 123 14.702 -5.859 -9.436 1.00 0.00 H ATOM 3470 HB3 GLN B 123 16.150 -4.826 -9.387 1.00 0.00 H ATOM 3471 HG2 GLN B 123 17.094 -6.374 -7.655 1.00 0.00 H ATOM 3472 HG3 GLN B 123 15.706 -7.449 -7.944 1.00 0.00 H ATOM 3473 HE22 GLN B 123 18.564 -8.013 -8.286 1.00 0.00 H ATOM 3474 HE21 GLN B 123 18.781 -8.431 -10.025 1.00 0.00 H ATOM 3475 H GLN B 123 13.471 -6.316 -7.482 1.00 0.00 H ATOM 3476 N VAL B 124 14.310 -2.445 -7.170 1.00 59.24 N ATOM 3477 CA VAL B 124 13.447 -1.265 -7.219 1.00 61.23 C ATOM 3478 C VAL B 124 14.208 0.051 -7.439 1.00 63.14 C ATOM 3479 O VAL B 124 15.351 0.216 -7.000 1.00 63.71 O ATOM 3480 CB VAL B 124 12.571 -1.212 -5.927 1.00 61.39 C ATOM 3481 CG1 VAL B 124 12.886 0.004 -5.068 1.00 60.82 C ATOM 3482 CG2 VAL B 124 11.089 -1.330 -6.259 1.00 60.21 C ATOM 3483 HA VAL B 124 12.807 -1.368 -8.095 1.00 0.00 H ATOM 3484 HB VAL B 124 12.830 -2.080 -5.320 1.00 0.00 H ATOM 3485 HG11 VAL B 124 13.933 -0.027 -4.767 1.00 0.00 H ATOM 3486 HG12 VAL B 124 12.699 0.911 -5.642 1.00 0.00 H ATOM 3487 HG13 VAL B 124 12.251 -0.004 -4.182 1.00 0.00 H ATOM 3488 HG21 VAL B 124 10.797 -0.507 -6.911 1.00 0.00 H ATOM 3489 HG22 VAL B 124 10.906 -2.278 -6.765 1.00 0.00 H ATOM 3490 HG23 VAL B 124 10.507 -1.290 -5.338 1.00 0.00 H ATOM 3491 H VAL B 124 14.958 -2.544 -6.362 1.00 0.00 H TER 3492 VAL B 124 HETATM 3493 O HOH 1 3.616 -18.688 -1.588 1.00 49.33 O HETATM 3494 O HOH 2 -5.294 5.503 11.356 1.00 11.92 O HETATM 3495 O HOH 3 1.158 -19.934 17.987 1.00 23.51 O HETATM 3496 O HOH 4 -12.599 -1.661 36.737 1.00 24.29 O HETATM 3497 O HOH 5 1.144 -10.102 20.381 1.00 40.63 O HETATM 3498 O HOH 6 -6.243 -18.311 10.152 1.00 24.60 O HETATM 3499 O HOH 7 -10.949 -19.055 12.617 1.00 18.57 O HETATM 3500 O HOH 8 -1.104 -19.920 16.250 1.00 18.50 O HETATM 3501 O HOH 9 -12.514 1.037 3.589 1.00 24.51 O HETATM 3502 O HOH 10 2.467 0.863 12.792 1.00 14.42 O HETATM 3503 O HOH 11 5.128 7.603 16.765 1.00 33.75 O HETATM 3504 O HOH 12 -8.208 -11.122 1.015 1.00 19.01 O HETATM 3505 O HOH 13 -15.679 -6.031 15.984 1.00 24.62 O HETATM 3506 O HOH 14 -0.502 3.648 25.881 1.00 31.44 O HETATM 3507 O HOH 15 -13.707 -20.462 21.058 1.00 45.18 O HETATM 3508 O HOH 16 -12.446 1.924 23.830 1.00 16.31 O HETATM 3509 O HOH 17 -12.965 -16.625 24.054 1.00 18.81 O HETATM 3510 O HOH 18 -5.705 -3.733 -3.541 1.00 31.21 O HETATM 3511 O HOH 19 -5.582 -11.397 31.082 1.00 46.99 O HETATM 3512 O HOH 20 -10.921 -18.984 9.901 1.00 30.14 O HETATM 3513 O HOH 21 4.331 2.241 19.314 1.00 22.70 O HETATM 3514 O HOH 22 -8.378 -20.963 11.130 1.00 51.77 O HETATM 3515 O HOH 23 -14.669 0.987 24.926 1.00 24.17 O HETATM 3516 O HOH 24 1.435 -22.179 15.970 1.00 23.21 O HETATM 3517 O HOH 25 -13.815 -11.896 29.922 1.00 20.96 O HETATM 3518 O HOH 26 -16.173 -6.866 9.613 1.00 25.65 O HETATM 3519 O HOH 27 -15.864 -10.896 18.841 1.00 51.89 O HETATM 3520 O HOH 28 6.864 -22.323 7.110 1.00 43.59 O HETATM 3521 O HOH 29 -18.469 2.964 14.746 1.00 63.64 O HETATM 3522 O HOH 30 -8.265 12.721 21.996 1.00 44.97 O HETATM 3523 O HOH 31 -13.244 -18.388 19.522 1.00 33.32 O HETATM 3524 O HOH 32 -17.003 -8.904 11.305 1.00 25.19 O HETATM 3525 O HOH 33 -8.219 -3.937 -1.825 1.00 25.87 O HETATM 3526 O HOH 34 3.802 3.322 17.356 1.00 29.50 O HETATM 3527 O HOH 35 -13.115 -12.988 4.943 1.00 30.38 O HETATM 3528 O HOH 36 -13.151 -23.398 15.416 1.00 65.65 O HETATM 3529 O HOH 37 -4.716 1.358 31.846 1.00 39.25 O HETATM 3530 O HOH 38 -7.706 -22.631 15.248 1.00 32.87 O HETATM 3531 O HOH 39 -17.186 0.387 31.028 1.00 27.66 O HETATM 3532 O HOH 40 -16.705 -2.368 31.073 1.00 19.45 O HETATM 3533 O HOH 41 -12.378 -21.751 13.231 1.00 39.10 O HETATM 3534 O HOH 42 1.827 -11.483 -5.131 1.00 32.80 O HETATM 3535 O HOH 43 -3.551 -6.205 -6.316 1.00 30.44 O HETATM 3536 O HOH 44 -11.310 -16.040 5.808 1.00 25.38 O HETATM 3537 O HOH 45 -11.953 -22.179 22.470 1.00 36.30 O HETATM 3538 O HOH 46 -14.125 -14.422 25.460 1.00 27.22 O HETATM 3539 O HOH 47 -14.369 -14.397 28.575 1.00 28.19 O HETATM 3540 O HOH 48 -19.771 -16.781 22.425 1.00 50.58 O HETATM 3541 O HOH 49 4.326 0.721 15.577 1.00 28.41 O HETATM 3542 O HOH 50 -15.083 -10.411 21.188 1.00 29.94 O HETATM 3543 O HOH 51 -8.669 10.265 24.455 1.00 26.09 O HETATM 3544 O HOH 52 2.506 -7.646 20.269 1.00 43.36 O HETATM 3545 O HOH 53 -3.439 -12.739 28.267 1.00 34.12 O HETATM 3546 O HOH 54 -1.655 -12.821 23.822 1.00 39.13 O HETATM 3547 O HOH 55 -0.924 -15.497 22.372 1.00 29.18 O HETATM 3548 O HOH 56 2.702 3.373 20.618 1.00 33.88 O HETATM 3549 O HOH 57 3.015 -5.692 17.311 1.00 29.48 O HETATM 3550 O HOH 58 -17.766 -11.965 9.818 1.00 35.10 O HETATM 3551 O HOH 59 -25.450 -6.127 20.499 1.00 32.84 O HETATM 3552 O HOH 60 -20.183 -6.390 23.483 1.00 33.48 O HETATM 3553 O HOH 61 1.186 -3.935 24.199 1.00 50.84 O HETATM 3554 O HOH 62 5.034 -4.687 15.364 1.00 34.80 O HETATM 3555 O HOH 63 2.737 -11.156 18.561 1.00 28.78 O HETATM 3556 O HOH 64 5.106 0.737 21.236 1.00 38.15 O HETATM 3557 O HOH 65 -17.145 -4.403 9.719 1.00 34.56 O HETATM 3558 O HOH 66 -4.728 -6.752 27.418 1.00 43.07 O HETATM 3559 O HOH 67 -1.693 -0.564 27.281 1.00 32.10 O HETATM 3560 O HOH 68 2.027 -13.766 -5.537 1.00 32.87 O HETATM 3561 O HOH 69 2.630 -19.359 15.595 1.00 26.97 O HETATM 3562 O HOH 70 -11.163 -5.129 -2.111 1.00 32.25 O HETATM 3563 O HOH 71 -11.809 -15.008 3.773 1.00 33.99 O HETATM 3564 O HOH 72 -17.270 0.446 13.260 1.00 42.99 O HETATM 3565 O HOH 73 -20.338 -2.491 20.987 1.00 46.81 O HETATM 3566 O HOH 74 -2.523 -5.091 27.674 1.00 54.95 O HETATM 3567 O HOH 75 -17.048 -6.775 13.744 1.00 36.57 O HETATM 3568 O HOH 76 -18.605 0.674 16.610 1.00 42.56 O HETATM 3569 O HOH 77 -7.142 13.450 17.934 1.00 46.52 O HETATM 3570 O HOH 78 -5.593 15.588 15.107 1.00 40.45 O HETATM 3571 O HOH 79 5.882 -7.865 12.742 1.00 41.95 O HETATM 3572 O HOH 80 4.040 -4.338 19.788 1.00 40.02 O HETATM 3573 O HOH 81 -17.804 -7.938 7.114 1.00 33.23 O HETATM 3574 O HOH 82 -4.999 14.108 18.339 1.00 36.79 O HETATM 3575 O HOH 83 -8.672 12.890 13.969 1.00 32.60 O HETATM 3576 O HOH 84 -14.045 3.475 29.163 1.00 50.88 O HETATM 3577 O HOH 85 -11.085 -12.057 0.038 1.00 35.35 O HETATM 3578 O HOH 86 5.814 -2.350 16.168 1.00 34.34 O HETATM 3579 O HOH 87 -8.678 -13.793 -1.207 1.00 53.27 O HETATM 3580 O HOH 88 -3.994 4.661 28.748 1.00 48.95 O HETATM 3581 O HOH 89 -18.863 -2.017 23.636 1.00 35.87 O HETATM 3582 O HOH 90 -0.258 -23.752 8.835 1.00 56.29 O HETATM 3583 O HOH 91 5.323 -20.415 0.583 1.00 47.56 O HETATM 3584 O HOH 92 -18.747 -0.300 20.170 1.00 39.79 O HETATM 3585 O HOH 93 -17.650 -1.985 12.788 1.00 46.84 O HETATM 3586 O HOH 94 -12.758 -17.702 1.601 1.00 47.93 O HETATM 3587 O HOH 95 -9.653 -23.846 14.398 1.00 52.35 O HETATM 3588 O HOH 96 -6.952 -6.667 33.838 1.00 65.52 O HETATM 3589 O HOH 97 4.470 -13.157 18.840 1.00 45.11 O HETATM 3590 O HOH 98 -18.092 0.712 28.062 1.00 36.76 O HETATM 3591 O HOH 99 -11.237 -14.568 -0.665 1.00 58.76 O HETATM 3592 O HOH 100 -12.458 6.064 23.841 1.00 48.56 O HETATM 3593 O HOH 101 -9.402 -4.128 -11.606 1.00 41.12 O HETATM 3594 O HOH 102 -18.598 -9.040 15.725 1.00 50.21 O HETATM 3595 O HOH 103 2.989 5.602 17.480 1.00 43.00 O HETATM 3596 O HOH 104 -5.291 -3.405 -10.264 1.00105.73 O HETATM 3597 O HOH 105 6.568 1.365 18.532 1.00 40.04 O HETATM 3598 O HOH 106 -8.366 -10.735 31.782 1.00 38.87 O HETATM 3599 O HOH 107 -14.195 3.008 3.891 1.00 36.58 O HETATM 3600 O HOH 108 -4.618 -6.510 19.952 1.00 19.42 O HETATM 3601 O HOH 109 1.094 -5.080 20.591 1.00 22.80 O HETATM 3602 O HOH 110 -1.342 -7.565 20.833 1.00 48.27 O HETATM 3603 O HOH 111 8.810 13.654 -9.463 1.00 22.96 O HETATM 3604 O HOH 112 -14.173 20.201 1.157 1.00 14.40 O HETATM 3605 O HOH 113 7.838 14.392 -2.837 1.00 13.37 O HETATM 3606 O HOH 114 13.899 -14.275 -6.819 1.00 34.43 O HETATM 3607 O HOH 115 -11.485 12.423 -0.712 1.00 27.29 O HETATM 3608 O HOH 116 -1.228 11.150 14.724 1.00 15.80 O HETATM 3609 O HOH 117 11.856 9.001 -8.378 1.00 21.18 O HETATM 3610 O HOH 118 -2.111 18.056 3.862 1.00 13.69 O HETATM 3611 O HOH 119 -8.316 0.688 4.380 1.00 16.44 O HETATM 3612 O HOH 120 10.693 -5.264 5.896 1.00 17.84 O HETATM 3613 O HOH 121 -4.120 12.986 -7.218 1.00 31.29 O HETATM 3614 O HOH 122 8.529 13.539 1.423 1.00 17.09 O HETATM 3615 O HOH 123 7.893 20.452 0.534 1.00 24.38 O HETATM 3616 O HOH 124 12.661 10.591 -10.905 1.00 45.85 O HETATM 3617 O HOH 125 12.648 2.882 -6.158 1.00 27.80 O HETATM 3618 O HOH 126 13.034 -9.144 8.187 1.00 47.78 O HETATM 3619 O HOH 127 -12.373 7.234 12.350 1.00 26.45 O HETATM 3620 O HOH 128 -2.260 15.222 -7.887 1.00 30.07 O HETATM 3621 O HOH 129 -11.443 21.031 1.708 1.00 16.67 O HETATM 3622 O HOH 130 0.121 5.578 -10.645 1.00 40.00 O HETATM 3623 O HOH 131 4.609 19.661 -9.418 1.00 30.14 O HETATM 3624 O HOH 132 2.775 23.584 -2.937 1.00 29.30 O HETATM 3625 O HOH 133 9.410 9.585 9.945 1.00 30.04 O HETATM 3626 O HOH 134 0.174 16.627 -11.055 1.00 36.74 O HETATM 3627 O HOH 135 12.061 -15.038 -7.794 1.00 23.22 O HETATM 3628 O HOH 136 -4.120 3.951 -7.196 1.00 30.15 O HETATM 3629 O HOH 137 8.336 -14.808 12.893 1.00 43.67 O HETATM 3630 O HOH 138 18.099 13.889 -7.304 1.00 31.90 O HETATM 3631 O HOH 139 13.674 -1.529 0.414 1.00 32.52 O HETATM 3632 O HOH 140 15.907 7.983 -12.916 1.00 89.45 O HETATM 3633 O HOH 141 -8.792 23.428 -9.769 1.00 44.17 O HETATM 3634 O HOH 142 13.182 11.603 0.719 1.00 25.84 O HETATM 3635 O HOH 143 -13.433 12.857 13.225 1.00 42.78 O HETATM 3636 O HOH 144 15.926 2.829 -3.492 1.00 47.19 O HETATM 3637 O HOH 145 20.196 9.646 -3.490 1.00 34.49 O HETATM 3638 O HOH 146 12.638 8.144 4.356 1.00 27.94 O HETATM 3639 O HOH 147 16.287 9.618 -10.489 1.00 44.44 O HETATM 3640 O HOH 148 -3.575 0.877 -7.568 1.00 29.35 O HETATM 3641 O HOH 149 10.987 7.183 6.617 1.00 25.48 O HETATM 3642 O HOH 150 -7.788 -1.270 -2.120 1.00 25.94 O HETATM 3643 O HOH 151 -9.200 -0.357 -1.372 1.00 37.15 O HETATM 3644 O HOH 152 4.852 21.430 0.281 1.00 33.84 O HETATM 3645 O HOH 153 -8.222 11.760 16.364 1.00 29.14 O HETATM 3646 O HOH 154 7.056 -5.662 -9.108 1.00 31.36 O HETATM 3647 O HOH 155 7.213 -5.336 12.751 1.00 28.47 O HETATM 3648 O HOH 156 13.397 -4.913 6.631 1.00 35.67 O HETATM 3649 O HOH 157 11.916 -6.345 -1.726 1.00 36.88 O HETATM 3650 O HOH 158 9.232 -12.839 7.140 1.00 30.68 O HETATM 3651 O HOH 159 6.994 -12.095 12.154 1.00 36.11 O HETATM 3652 O HOH 160 10.417 6.626 11.253 1.00 37.48 O HETATM 3653 O HOH 161 12.225 -6.909 -9.017 1.00 36.95 O HETATM 3654 O HOH 162 7.144 -16.753 -5.326 1.00 49.95 O HETATM 3655 O HOH 163 15.461 11.202 0.636 1.00 29.13 O HETATM 3656 O HOH 164 11.670 -6.410 3.364 1.00 28.14 O HETATM 3657 O HOH 165 -12.839 6.507 -1.166 1.00 26.94 O HETATM 3658 O HOH 166 10.088 -3.693 13.084 1.00 34.45 O HETATM 3659 O HOH 167 20.872 13.665 -6.669 1.00 31.87 O HETATM 3660 O HOH 168 14.006 -0.210 3.510 1.00 31.16 O HETATM 3661 O HOH 169 13.504 -3.603 12.566 1.00 49.46 O HETATM 3662 O HOH 170 -0.734 20.476 3.644 1.00 51.02 O HETATM 3663 O HOH 171 17.496 11.982 -8.779 1.00 35.73 O HETATM 3664 O HOH 172 -14.352 8.570 13.806 1.00 46.19 O HETATM 3665 O HOH 173 13.227 6.378 7.946 1.00 41.51 O HETATM 3666 O HOH 174 -4.361 4.787 -9.607 1.00 34.85 O HETATM 3667 O HOH 175 7.655 22.660 -2.343 1.00 53.87 O HETATM 3668 O HOH 176 4.662 -17.159 -4.559 1.00 42.48 O HETATM 3669 O HOH 177 5.326 2.989 15.030 1.00 33.50 O HETATM 3670 O HOH 178 6.985 -2.777 -10.630 1.00 43.67 O HETATM 3671 O HOH 179 14.930 6.713 3.463 1.00 39.57 O HETATM 3672 O HOH 180 9.273 3.308 -16.920 1.00 46.39 O HETATM 3673 O HOH 181 14.125 -11.092 1.481 1.00 49.91 O HETATM 3674 O HOH 182 -5.873 4.717 -5.155 1.00 15.73 O HETATM 3675 O HOH 183 -4.683 16.352 -7.442 1.00 40.93 O HETATM 3676 O HOH 184 12.052 -4.163 1.849 1.00 36.69 O HETATM 3677 O HOH 185 -1.945 15.223 15.469 1.00 28.28 O HETATM 3678 O HOH 186 -13.878 8.512 -2.140 1.00 41.57 O HETATM 3679 O HOH 187 -1.525 24.227 -4.653 1.00 37.58 O HETATM 3680 O HOH 188 -14.515 7.460 3.077 1.00 42.39 O HETATM 3681 O HOH 189 -16.124 4.742 11.452 1.00 46.30 O HETATM 3682 O HOH 190 8.790 -9.799 13.289 1.00 62.26 O HETATM 3683 O HOH 191 0.411 9.906 -16.410 1.00 49.12 O HETATM 3684 O HOH 192 1.603 23.408 -7.292 1.00 38.67 O HETATM 3685 O HOH 193 9.489 11.573 7.774 1.00 39.82 O HETATM 3686 O HOH 194 14.073 -8.909 0.264 1.00 70.44 O HETATM 3687 O HOH 195 14.527 3.329 16.374 1.00 60.14 O HETATM 3688 O HOH 196 -3.602 21.885 -8.566 1.00 38.37 O HETATM 3689 O HOH 197 13.754 -15.024 6.666 1.00 51.56 O HETATM 3690 O HOH 198 -0.526 9.843 -13.161 1.00 53.57 O HETATM 3691 O HOH 199 -2.785 3.089 -8.151 1.00 43.76 O HETATM 3692 O HOH 200 9.468 -7.347 -9.364 1.00 53.28 O HETATM 3693 O HOH 201 16.152 -14.463 4.492 1.00 47.32 O HETATM 3694 O HOH 202 -6.272 14.067 -7.069 1.00 47.65 O HETATM 3695 O HOH 203 -2.864 18.494 10.443 1.00 39.22 O HETATM 3696 O HOH 204 -9.760 13.068 -3.108 1.00 20.69 O HETATM 3697 O HOH 205 -10.430 16.115 -4.637 1.00 21.48 O HETATM 3698 O HOH 206 -10.432 18.669 -3.646 1.00 28.09 O HETATM 3699 O HOH 207 -6.768 8.825 13.333 1.00 16.89 O HETATM 3700 C31 UNN A 208 -0.255 2.482 18.319 1.00 0.32 C HETATM 3701 O8 UNN A 208 -1.073 3.360 18.502 1.00 -0.38 O HETATM 3702 O9 UNN A 208 0.050 1.738 19.396 1.00 -0.25 O HETATM 3703 CA UNN A 208 -0.968 1.067 20.175 1.00 0.11 C HETATM 3704 C UNN A 208 -0.404 0.434 21.410 1.00 -0.01 C HETATM 3705 C13 UNN A 208 -1.259 -0.013 22.411 1.00 -0.06 C HETATM 3706 C14 UNN A 208 -0.713 -0.599 23.568 1.00 -0.07 C HETATM 3707 C15 UNN A 208 0.668 -0.745 23.742 1.00 -0.07 C HETATM 3708 C16 UNN A 208 1.527 -0.295 22.737 1.00 -0.07 C HETATM 3709 C17 UNN A 208 0.969 0.281 21.600 1.00 -0.06 C HETATM 3710 H7 UNN A 208 1.637 0.629 20.820 1.00 0.06 H HETATM 3711 H6 UNN A 208 2.602 -0.392 22.840 1.00 0.06 H HETATM 3712 H5 UNN A 208 1.065 -1.200 24.642 1.00 0.06 H HETATM 3713 H4 UNN A 208 -1.381 -0.947 24.347 1.00 0.06 H HETATM 3714 H3 UNN A 208 -2.333 0.089 22.302 1.00 0.06 H HETATM 3715 H1 UNN A 208 -1.431 0.285 19.555 1.00 0.08 H HETATM 3716 H2 UNN A 208 -1.732 1.802 20.470 1.00 0.08 H HETATM 3717 N4 UNN A 208 0.548 2.368 17.272 1.00 -0.24 N HETATM 3718 C18 UNN A 208 0.356 3.044 16.139 1.00 0.13 C HETATM 3719 C19 UNN A 208 -0.484 2.211 15.205 1.00 0.20 C HETATM 3720 O4 UNN A 208 -0.009 1.067 14.812 1.00 -0.39 O HETATM 3721 N2 UNN A 208 -1.629 2.668 14.837 1.00 -0.26 N HETATM 3722 C10 UNN A 208 -2.620 2.003 14.003 1.00 0.13 C HETATM 3723 C11 UNN A 208 -2.802 2.818 12.766 1.00 0.20 C HETATM 3724 O2 UNN A 208 -3.716 3.724 12.837 1.00 -0.39 O HETATM 3725 N1 UNN A 208 -2.143 2.590 11.646 1.00 -0.28 N HETATM 3726 C1 UNN A 208 -2.337 3.428 10.423 1.00 0.08 C HETATM 3727 C2 UNN A 208 -2.573 2.542 9.243 1.00 0.11 C HETATM 3728 O1 UNN A 208 -1.382 1.816 9.023 1.00 -0.39 O HETATM 3729 H23 UNN A 208 -1.497 1.240 8.276 1.00 0.21 H HETATM 3730 C52 UNN A 208 -3.723 1.632 9.365 1.00 0.11 C HETATM 3731 C51 UNN A 208 -5.070 2.309 9.213 1.00 0.08 C HETATM 3732 N51 UNN A 208 -5.321 2.983 7.945 1.00 -0.28 N HETATM 3733 C61 UNN A 208 -5.637 4.185 7.734 1.00 0.20 C HETATM 3734 C60 UNN A 208 -5.848 4.722 6.324 1.00 0.13 C HETATM 3735 N52 UNN A 208 -7.235 5.072 6.103 1.00 -0.26 N HETATM 3736 C69 UNN A 208 -7.935 4.636 5.135 1.00 0.20 C HETATM 3737 C68 UNN A 208 -9.353 4.890 4.828 1.00 0.13 C HETATM 3738 N54 UNN A 208 -9.470 5.386 3.689 1.00 -0.24 N HETATM 3739 C81 UNN A 208 -9.562 6.662 3.400 1.00 0.32 C HETATM 3740 O58 UNN A 208 -9.397 7.516 4.292 1.00 -0.38 O HETATM 3741 O59 UNN A 208 -9.539 7.009 2.143 1.00 -0.25 O HETATM 3742 CA5 UNN A 208 -8.593 8.003 1.659 1.00 0.11 C HETATM 3743 C50 UNN A 208 -8.622 8.280 0.184 1.00 -0.01 C HETATM 3744 C63 UNN A 208 -9.449 9.254 -0.395 1.00 -0.06 C HETATM 3745 C64 UNN A 208 -9.446 9.457 -1.780 1.00 -0.07 C HETATM 3746 C65 UNN A 208 -8.614 8.667 -2.586 1.00 -0.07 C HETATM 3747 C66 UNN A 208 -7.798 7.684 -2.024 1.00 -0.07 C HETATM 3748 C67 UNN A 208 -7.808 7.502 -0.642 1.00 -0.06 C HETATM 3749 H64 UNN A 208 -7.173 6.743 -0.201 1.00 0.06 H HETATM 3750 H63 UNN A 208 -7.165 7.070 -2.654 1.00 0.06 H HETATM 3751 H62 UNN A 208 -8.604 8.822 -3.659 1.00 0.06 H HETATM 3752 H61 UNN A 208 -10.080 10.216 -2.224 1.00 0.06 H HETATM 3753 H60 UNN A 208 -10.095 9.854 0.235 1.00 0.06 H HETATM 3754 H58 UNN A 208 -7.581 7.657 1.916 1.00 0.08 H HETATM 3755 H59 UNN A 208 -8.801 8.948 2.182 1.00 0.08 H HETATM 3756 H53 UNN A 208 -9.496 4.747 2.920 1.00 0.19 H HETATM 3757 C70 UNN A 208 -10.341 3.756 5.094 1.00 -0.02 C HETATM 3758 H55 UNN A 208 -10.185 3.365 6.110 1.00 0.03 H HETATM 3759 H56 UNN A 208 -10.180 2.950 4.362 1.00 0.03 H HETATM 3760 H57 UNN A 208 -11.369 4.136 5.001 1.00 0.03 H HETATM 3761 H54 UNN A 208 -9.655 5.683 5.529 1.00 0.08 H HETATM 3762 O54 UNN A 208 -7.342 3.782 4.313 1.00 -0.39 O HETATM 3763 H44 UNN A 208 -7.670 5.696 6.752 1.00 0.19 H HETATM 3764 C62 UNN A 208 -4.974 5.934 5.981 1.00 -0.01 C HETATM 3765 CG6 UNN A 208 -3.509 5.844 6.432 1.00 -0.06 C HETATM 3766 H47 UNN A 208 -2.978 6.761 6.137 1.00 0.02 H HETATM 3767 H48 UNN A 208 -3.032 4.974 5.957 1.00 0.02 H HETATM 3768 H49 UNN A 208 -3.468 5.733 7.526 1.00 0.02 H HETATM 3769 CG5 UNN A 208 -5.084 6.492 4.534 1.00 -0.06 C HETATM 3770 H50 UNN A 208 -6.143 6.544 4.241 1.00 0.02 H HETATM 3771 H51 UNN A 208 -4.545 5.828 3.843 1.00 0.02 H HETATM 3772 H52 UNN A 208 -4.643 7.499 4.495 1.00 0.02 H HETATM 3773 H46 UNN A 208 -5.400 6.733 6.606 1.00 0.03 H HETATM 3774 H45 UNN A 208 -5.583 3.914 5.627 1.00 0.08 H HETATM 3775 O52 UNN A 208 -5.720 5.045 8.734 1.00 -0.39 O HETATM 3776 H33 UNN A 208 -5.230 2.412 7.129 1.00 0.19 H HETATM 3777 C53 UNN A 208 -6.045 1.175 9.381 1.00 0.01 C HETATM 3778 C54 UNN A 208 -7.382 1.723 9.208 1.00 -0.04 C HETATM 3779 C55 UNN A 208 -8.145 1.301 8.132 1.00 -0.06 C HETATM 3780 C56 UNN A 208 -9.420 1.854 7.972 1.00 -0.07 C HETATM 3781 C57 UNN A 208 -9.909 2.835 8.844 1.00 -0.07 C HETATM 3782 C58 UNN A 208 -9.128 3.264 9.925 1.00 -0.07 C HETATM 3783 C59 UNN A 208 -7.859 2.699 10.090 1.00 -0.06 C HETATM 3784 H40 UNN A 208 -7.235 3.023 10.915 1.00 0.06 H HETATM 3785 H42 UNN A 208 -9.497 4.014 10.615 1.00 0.06 H HETATM 3786 H43 UNN A 208 -10.892 3.262 8.682 1.00 0.06 H HETATM 3787 H41 UNN A 208 -10.045 1.515 7.153 1.00 0.06 H HETATM 3788 H39 UNN A 208 -7.765 0.564 7.434 1.00 0.06 H HETATM 3789 H37 UNN A 208 -5.945 0.738 10.386 1.00 0.04 H HETATM 3790 H38 UNN A 208 -5.855 0.400 8.624 1.00 0.04 H HETATM 3791 H34 UNN A 208 -5.194 3.048 10.019 1.00 0.06 H HETATM 3792 O51 UNN A 208 -3.444 0.671 8.361 1.00 -0.39 O HETATM 3793 H36 UNN A 208 -2.588 0.289 8.518 1.00 0.21 H HETATM 3794 H35 UNN A 208 -3.709 1.149 10.353 1.00 0.06 H HETATM 3795 H22 UNN A 208 -2.760 3.186 8.371 1.00 0.06 H HETATM 3796 C3 UNN A 208 -1.145 4.320 10.021 1.00 0.01 C HETATM 3797 C4 UNN A 208 -0.424 4.826 11.202 1.00 -0.04 C HETATM 3798 C5 UNN A 208 -1.005 5.893 11.892 1.00 -0.06 C HETATM 3799 C6 UNN A 208 -0.380 6.393 13.020 1.00 -0.07 C HETATM 3800 C7 UNN A 208 0.819 5.814 13.427 1.00 -0.07 C HETATM 3801 C8 UNN A 208 1.417 4.758 12.721 1.00 -0.07 C HETATM 3802 C9 UNN A 208 0.787 4.242 11.592 1.00 -0.06 C HETATM 3803 H29 UNN A 208 1.218 3.418 11.035 1.00 0.06 H HETATM 3804 H31 UNN A 208 2.364 4.347 13.053 1.00 0.06 H HETATM 3805 H32 UNN A 208 1.307 6.191 14.319 1.00 0.06 H HETATM 3806 H30 UNN A 208 -0.814 7.217 13.575 1.00 0.06 H HETATM 3807 H28 UNN A 208 -1.937 6.325 11.546 1.00 0.06 H HETATM 3808 H26 UNN A 208 -1.519 5.175 9.438 1.00 0.04 H HETATM 3809 H27 UNN A 208 -0.450 3.731 9.404 1.00 0.04 H HETATM 3810 H24 UNN A 208 -3.214 4.070 10.592 1.00 0.06 H HETATM 3811 H25 UNN A 208 -1.492 1.831 11.614 1.00 0.19 H HETATM 3812 C12 UNN A 208 -3.875 1.702 14.800 1.00 -0.01 C HETATM 3813 CG2 UNN A 208 -3.612 0.880 16.080 1.00 -0.06 C HETATM 3814 H16 UNN A 208 -4.563 0.702 16.603 1.00 0.02 H HETATM 3815 H17 UNN A 208 -2.930 1.437 16.739 1.00 0.02 H HETATM 3816 H18 UNN A 208 -3.156 -0.084 15.810 1.00 0.02 H HETATM 3817 CG1 UNN A 208 -4.924 0.999 13.924 1.00 -0.06 C HETATM 3818 H19 UNN A 208 -5.102 1.594 13.016 1.00 0.02 H HETATM 3819 H20 UNN A 208 -5.864 0.898 14.487 1.00 0.02 H HETATM 3820 H21 UNN A 208 -4.557 0.001 13.642 1.00 0.02 H HETATM 3821 H15 UNN A 208 -4.296 2.668 15.116 1.00 0.03 H HETATM 3822 H14 UNN A 208 -2.208 1.032 13.691 1.00 0.08 H HETATM 3823 H13 UNN A 208 -1.865 3.584 15.161 1.00 0.19 H HETATM 3824 C20 UNN A 208 1.723 3.196 15.535 1.00 -0.02 C HETATM 3825 H10 UNN A 208 1.646 3.749 14.588 1.00 0.03 H HETATM 3826 H11 UNN A 208 2.152 2.201 15.345 1.00 0.03 H HETATM 3827 H12 UNN A 208 2.372 3.748 16.230 1.00 0.03 H HETATM 3828 H9 UNN A 208 -0.116 4.020 16.326 1.00 0.08 H HETATM 3829 H8 UNN A 208 1.331 1.749 17.334 1.00 0.19 H CONECT 1 2 15 16 17 CONECT 15 1 CONECT 16 1 CONECT 17 1 CONECT 1747 1748 1761 1762 1763 CONECT 1761 1747 CONECT 1762 1747 CONECT 1763 1747 CONECT 3700 3701 3702 3717 CONECT 3701 3700 CONECT 3702 3700 3703 CONECT 3703 3702 3704 3715 3716 CONECT 3704 3703 3705 3709 CONECT 3705 3704 3706 3714 CONECT 3706 3705 3707 3713 CONECT 3707 3706 3708 3712 CONECT 3708 3707 3709 3711 CONECT 3709 3704 3708 3710 CONECT 3710 3709 CONECT 3711 3708 CONECT 3712 3707 CONECT 3713 3706 CONECT 3714 3705 CONECT 3715 3703 CONECT 3716 3703 CONECT 3717 3700 3718 3829 CONECT 3718 3717 3719 3824 3828 CONECT 3719 3718 3720 3721 CONECT 3720 3719 CONECT 3721 3719 3722 3823 CONECT 3722 3721 3723 3812 3822 CONECT 3723 3722 3724 3725 CONECT 3724 3723 CONECT 3725 3723 3726 3811 CONECT 3726 3725 3727 3796 3810 CONECT 3727 3726 3728 3730 3795 CONECT 3728 3727 3729 CONECT 3729 3728 CONECT 3730 3727 3731 3792 3794 CONECT 3731 3730 3732 3777 3791 CONECT 3732 3731 3733 3776 CONECT 3733 3732 3734 3775 CONECT 3734 3733 3735 3764 3774 CONECT 3735 3734 3736 3763 CONECT 3736 3735 3737 3762 CONECT 3737 3736 3738 3757 3761 CONECT 3738 3737 3739 3756 CONECT 3739 3738 3740 3741 CONECT 3740 3739 CONECT 3741 3739 3742 CONECT 3742 3741 3743 3754 3755 CONECT 3743 3742 3744 3748 CONECT 3744 3743 3745 3753 CONECT 3745 3744 3746 3752 CONECT 3746 3745 3747 3751 CONECT 3747 3746 3748 3750 CONECT 3748 3743 3747 3749 CONECT 3749 3748 CONECT 3750 3747 CONECT 3751 3746 CONECT 3752 3745 CONECT 3753 3744 CONECT 3754 3742 CONECT 3755 3742 CONECT 3756 3738 CONECT 3757 3737 3758 3759 3760 CONECT 3758 3757 CONECT 3759 3757 CONECT 3760 3757 CONECT 3761 3737 CONECT 3762 3736 CONECT 3763 3735 CONECT 3764 3734 3765 3769 3773 CONECT 3765 3764 3766 3767 3768 CONECT 3766 3765 CONECT 3767 3765 CONECT 3768 3765 CONECT 3769 3764 3770 3771 3772 CONECT 3770 3769 CONECT 3771 3769 CONECT 3772 3769 CONECT 3773 3764 CONECT 3774 3734 CONECT 3775 3733 CONECT 3776 3732 CONECT 3777 3731 3778 3789 3790 CONECT 3778 3777 3779 3783 CONECT 3779 3778 3780 3788 CONECT 3780 3779 3781 3787 CONECT 3781 3780 3782 3786 CONECT 3782 3781 3783 3785 CONECT 3783 3778 3782 3784 CONECT 3784 3783 CONECT 3785 3782 CONECT 3786 3781 CONECT 3787 3780 CONECT 3788 3779 CONECT 3789 3777 CONECT 3790 3777 CONECT 3791 3731 CONECT 3792 3730 3793 CONECT 3793 3792 CONECT 3794 3730 CONECT 3795 3727 CONECT 3796 3726 3797 3808 3809 CONECT 3797 3796 3798 3802 CONECT 3798 3797 3799 3807 CONECT 3799 3798 3800 3806 CONECT 3800 3799 3801 3805 CONECT 3801 3800 3802 3804 CONECT 3802 3797 3801 3803 CONECT 3803 3802 CONECT 3804 3801 CONECT 3805 3800 CONECT 3806 3799 CONECT 3807 3798 CONECT 3808 3796 CONECT 3809 3796 CONECT 3810 3726 CONECT 3811 3725 CONECT 3812 3722 3813 3817 3821 CONECT 3813 3812 3814 3815 3816 CONECT 3814 3813 CONECT 3815 3813 CONECT 3816 3813 CONECT 3817 3812 3818 3819 3820 CONECT 3818 3817 CONECT 3819 3817 CONECT 3820 3817 CONECT 3821 3812 CONECT 3822 3722 CONECT 3823 3721 CONECT 3824 3718 3825 3826 3827 CONECT 3825 3824 CONECT 3826 3824 CONECT 3827 3824 CONECT 3828 3718 CONECT 3829 3717 MASTER 0 0 0 0 0 0 0 0 3827 2 138 18 END
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Related entries of code: 3slz
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3sm1
RCSB PDB
PDBbind
132aa, >3SM1_1|Chains... at 100%
3sm2
RCSB PDB
PDBbind
132aa, >3SM2_1|Chains... at 100%
4exh
RCSB PDB
PDBbind
132aa, >4EXH_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1b11
RCSB PDB
PDBbind
3TL
2az8
RCSB PDB
PDBbind
3TL
2az9
RCSB PDB
PDBbind
3TL
2azb
RCSB PDB
PDBbind
3TL
2azc
RCSB PDB
PDBbind
3TL
2hah
RCSB PDB
PDBbind
3TL
2p3a
RCSB PDB
PDBbind
3TL
2p3b
RCSB PDB
PDBbind
3TL
2p3c
RCSB PDB
PDBbind
3TL
2p3d
RCSB PDB
PDBbind
3TL
3kfn
RCSB PDB
PDBbind
3TL
3tlh
RCSB PDB
PDBbind
3TL
5fiv
RCSB PDB
PDBbind
3TL
6fiv
RCSB PDB
PDBbind
3TL
Entry Information
PDB ID
3slz
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
xenotropic murine leukemia virus-related (XMVR) virus protease
Ligand Name
3TL
EC.Number
E.C.-.-.-.-
Resolution
1.4(Å)
Affinity (Kd/Ki/IC50)
Ki=102nM
Release Year
2011
Protein/NA Sequence
Check fasta file
Primary Reference
(2011) Febs J. Vol. 278: pp. 4413-4424
Ligand Properties
Formula
C
5
0
H
6
4
N
6
O
1
0
Molecular Weight
909.077
Exact Mass
908.468
No. of atoms
130
No. of bonds
133
Polar Surface Area
233.52
LOGP Value
6.38 (
Computed with XLOGP3
)
6.42 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 8
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 33
No. of Nitrogen and Oxygen Atoms: 16
No. of Rings: 4
Canonical SMILES
O[C@@H]([C@@H]([C@H](Cc1ccccc1)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C)O)[C@H](Cc1ccccc1)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C
InChI String
InChI=1S/C50H64N6O10/c1-31(2)41(55-45(59)33(5)51-49(63)65-29-37-23-15-9-16-24-37)47(61)53-39(27-35-19-11-7-12-20-35)43(57)44(58)40(28-36-21-13-8-14-22-36)54-48(62)42(32(3)4)56-46(60)34(6)52-50(64)66-30-38-25-17-10-18-26-38/h7-26,31-34,39-44,57-58H,27-30H2,1-6H3,(H,51,63)(H,52,64)(H,53,61)(H,54,62)(H,55,59)(H,56,60)/t33-,34-,39-,40-,41-,42-,43+,44+/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q9E7M1
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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