Browse entries in the PDBbind-CN Database
HEADER 3T0X_COMPLEX COMPND 3T0X_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 111 PCA PRO VAL LEU THR GLN SER PRO SER VAL SER GLY THR SEQRES 2 A 111 PRO GLY GLN LYS VAL THR ILE PHE CYS SER GLY SER SER SEQRES 3 A 111 SER ASN VAL GLU ASP ASN SER VAL TYR TRP TYR GLN GLN SEQRES 4 A 111 PHE PRO GLY THR THR PRO LYS VAL LEU ILE TYR ASN ASP SEQRES 5 A 111 ASP ARG ARG PRO SER GLY VAL PRO ASP ARG PHE SER GLY SEQRES 6 A 111 SER LYS SER GLY THR SER ALA SER LEU ALA ILE SER GLY SEQRES 7 A 111 LEU ARG SER GLU ASP GLU ALA ASP TYR TYR CYS LEU SER SEQRES 8 A 111 TRP ASP ASP SER LEU ASN GLY TRP VAL PHE GLY GLY GLY SEQRES 9 A 111 THR LYS VAL THR VAL LEU ASP SEQRES 1 B 109 PCA PRO VAL LEU THR GLN SER PRO SER VAL SER GLY THR SEQRES 2 B 109 PRO GLY GLN LYS VAL THR ILE PHE CYS SER GLY SER SER SEQRES 3 B 109 SER ASN VAL GLU ASP ASN SER VAL TYR TRP TYR GLN GLN SEQRES 4 B 109 PHE PRO GLY THR THR PRO LYS VAL LEU ILE TYR ASN ASP SEQRES 5 B 109 ASP ARG ARG PRO SER GLY VAL PRO ASP ARG PHE SER GLY SEQRES 6 B 109 SER LYS SER GLY THR SER ALA SER LEU ALA ILE SER GLY SEQRES 7 B 109 LEU ARG SER GLU ASP GLU ALA ASP TYR TYR CYS LEU SER SEQRES 8 B 109 TRP ASP ASP SER LEU ASN GLY TRP VAL PHE GLY GLY GLY SEQRES 9 B 109 THR LYS VAL THR VAL HET PCA A 1 13 HET PCA B 1 13 HET DIW A 357 61 SSBOND 1 CYS A 23 CYS A 88 SSBOND 2 CYS B 23 CYS B 88 HETATM 1 N PCA A 1 8.327 3.312 -19.568 1.00 80.18 N HETATM 2 CA PCA A 1 9.284 4.412 -19.476 1.00 74.46 C HETATM 3 C PCA A 1 10.180 4.328 -18.240 1.00 69.27 C HETATM 4 O PCA A 1 9.744 3.865 -17.180 1.00 58.14 O HETATM 5 CB PCA A 1 8.555 5.758 -19.489 1.00 76.48 C HETATM 6 CG PCA A 1 7.090 5.468 -19.226 1.00 84.48 C HETATM 7 CD PCA A 1 7.051 3.964 -19.252 1.00 89.28 C HETATM 8 OE PCA A 1 6.005 3.357 -19.028 1.00101.26 O HETATM 9 HG2 PCA A 1 6.457 5.893 -20.005 1.00 0.00 H HETATM 10 HG1 PCA A 1 6.779 5.855 -18.256 1.00 0.00 H HETATM 11 HB2 PCA A 1 8.674 6.240 -20.460 1.00 0.00 H HETATM 12 HB1 PCA A 1 8.954 6.408 -18.711 1.00 0.00 H HETATM 13 HA PCA A 1 9.930 4.327 -20.350 1.00 0.00 H ATOM 14 N PRO A 2 11.433 4.798 -18.368 1.00 58.01 N ATOM 15 CA PRO A 2 12.340 4.858 -17.213 1.00 45.96 C ATOM 16 C PRO A 2 11.749 5.799 -16.175 1.00 35.99 C ATOM 17 O PRO A 2 11.218 6.849 -16.540 1.00 40.44 O ATOM 18 CB PRO A 2 13.632 5.466 -17.795 1.00 31.82 C ATOM 19 CG PRO A 2 13.477 5.395 -19.294 1.00 52.41 C ATOM 20 CD PRO A 2 12.007 5.430 -19.568 1.00 53.83 C ATOM 21 HA PRO A 2 12.507 3.892 -16.736 1.00 0.00 H ATOM 22 HD3 PRO A 2 11.653 6.455 -19.679 1.00 0.00 H ATOM 23 HD2 PRO A 2 11.762 4.863 -20.466 1.00 0.00 H ATOM 24 HG3 PRO A 2 13.910 4.470 -19.675 1.00 0.00 H ATOM 25 HG2 PRO A 2 13.969 6.246 -19.765 1.00 0.00 H ATOM 26 HB2 PRO A 2 13.744 6.501 -17.473 1.00 0.00 H ATOM 27 HB3 PRO A 2 14.501 4.891 -17.475 1.00 0.00 H ATOM 28 N VAL A 3 11.818 5.427 -14.903 1.00 38.98 N ATOM 29 CA VAL A 3 11.245 6.257 -13.848 1.00 32.20 C ATOM 30 C VAL A 3 12.145 7.460 -13.532 1.00 32.52 C ATOM 31 O VAL A 3 11.677 8.495 -13.067 1.00 37.17 O ATOM 32 CB VAL A 3 10.977 5.419 -12.572 1.00 30.55 C ATOM 33 CG1 VAL A 3 10.569 6.306 -11.409 1.00 37.86 C ATOM 34 CG2 VAL A 3 9.910 4.342 -12.848 1.00 38.50 C ATOM 35 HA VAL A 3 10.292 6.642 -14.210 1.00 0.00 H ATOM 36 HB VAL A 3 11.904 4.918 -12.294 1.00 0.00 H ATOM 37 HG11 VAL A 3 11.368 7.017 -11.198 1.00 0.00 H ATOM 38 HG12 VAL A 3 9.659 6.847 -11.668 1.00 0.00 H ATOM 39 HG13 VAL A 3 10.388 5.689 -10.529 1.00 0.00 H ATOM 40 HG21 VAL A 3 8.982 4.823 -13.158 1.00 0.00 H ATOM 41 HG22 VAL A 3 10.260 3.680 -13.640 1.00 0.00 H ATOM 42 HG23 VAL A 3 9.736 3.764 -11.940 1.00 0.00 H ATOM 43 H VAL A 3 12.287 4.532 -14.655 1.00 0.00 H ATOM 44 N LEU A 4 13.444 7.321 -13.775 1.00 27.33 N ATOM 45 CA LEU A 4 14.348 8.443 -13.579 1.00 20.27 C ATOM 46 C LEU A 4 14.593 9.134 -14.920 1.00 27.15 C ATOM 47 O LEU A 4 14.581 8.504 -15.981 1.00 28.29 O ATOM 48 CB LEU A 4 15.660 7.987 -12.929 1.00 16.96 C ATOM 49 CG LEU A 4 15.565 7.152 -11.651 1.00 21.30 C ATOM 50 CD1 LEU A 4 16.968 6.783 -11.174 1.00 16.77 C ATOM 51 CD2 LEU A 4 14.791 7.871 -10.528 1.00 15.34 C ATOM 52 HA LEU A 4 13.891 9.159 -12.896 1.00 0.00 H ATOM 53 HB2 LEU A 4 16.201 7.394 -13.667 1.00 0.00 H ATOM 54 HB3 LEU A 4 16.235 8.882 -12.692 1.00 0.00 H ATOM 55 HG LEU A 4 15.004 6.249 -11.891 1.00 0.00 H ATOM 56 HD21 LEU A 4 15.296 8.805 -10.281 1.00 0.00 H ATOM 57 HD22 LEU A 4 13.777 8.083 -10.866 1.00 0.00 H ATOM 58 HD23 LEU A 4 14.755 7.232 -9.646 1.00 0.00 H ATOM 59 HD11 LEU A 4 17.473 6.205 -11.948 1.00 0.00 H ATOM 60 HD12 LEU A 4 17.533 7.693 -10.971 1.00 0.00 H ATOM 61 HD13 LEU A 4 16.896 6.188 -10.263 1.00 0.00 H ATOM 62 H LEU A 4 13.815 6.408 -14.106 1.00 0.00 H ATOM 63 N THR A 5 14.806 10.441 -14.864 1.00 23.60 N ATOM 64 CA THR A 5 14.962 11.255 -16.055 1.00 28.94 C ATOM 65 C THR A 5 16.418 11.626 -16.299 1.00 24.16 C ATOM 66 O THR A 5 17.019 12.367 -15.518 1.00 20.85 O ATOM 67 CB THR A 5 14.115 12.556 -15.928 1.00 36.93 C ATOM 68 OG1 THR A 5 12.734 12.209 -15.782 1.00 40.07 O ATOM 69 CG2 THR A 5 14.292 13.452 -17.150 1.00 35.66 C ATOM 70 HA THR A 5 14.614 10.664 -16.902 1.00 0.00 H ATOM 71 HB THR A 5 14.457 13.106 -15.052 1.00 0.00 H ATOM 72 HG1 THR A 5 12.618 11.657 -14.969 1.00 0.00 H ATOM 73 HG23 THR A 5 15.345 13.714 -17.258 1.00 0.00 H ATOM 74 HG21 THR A 5 13.956 12.921 -18.040 1.00 0.00 H ATOM 75 HG22 THR A 5 13.702 14.359 -17.022 1.00 0.00 H ATOM 76 H THR A 5 14.863 10.900 -13.932 1.00 0.00 H ATOM 77 N GLN A 6 16.985 11.087 -17.369 1.00 24.17 N ATOM 78 CA GLN A 6 18.273 11.537 -17.872 1.00 27.61 C ATOM 79 C GLN A 6 18.101 12.102 -19.281 1.00 40.79 C ATOM 80 O GLN A 6 17.372 11.525 -20.094 1.00 54.14 O ATOM 81 CB GLN A 6 19.232 10.358 -17.976 1.00 24.83 C ATOM 82 CG GLN A 6 19.577 9.646 -16.678 1.00 15.85 C ATOM 83 CD GLN A 6 20.546 8.475 -16.941 1.00 16.62 C ATOM 84 OE1 GLN A 6 20.154 7.311 -16.924 1.00 19.93 O ATOM 85 NE2 GLN A 6 21.798 8.798 -17.210 1.00 15.20 N ATOM 86 HA GLN A 6 18.663 12.292 -17.190 1.00 0.00 H ATOM 87 HB2 GLN A 6 18.784 9.625 -18.647 1.00 0.00 H ATOM 88 HB3 GLN A 6 20.162 10.725 -18.410 1.00 0.00 H ATOM 89 HG2 GLN A 6 20.047 10.354 -15.995 1.00 0.00 H ATOM 90 HG3 GLN A 6 18.663 9.260 -16.227 1.00 0.00 H ATOM 91 HE22 GLN A 6 22.088 9.797 -17.214 1.00 0.00 H ATOM 92 HE21 GLN A 6 22.494 8.054 -17.418 1.00 0.00 H ATOM 93 H GLN A 6 16.493 10.317 -17.865 1.00 0.00 H ATOM 94 N SER A 7 18.806 13.182 -19.601 1.00 42.72 N ATOM 95 CA SER A 7 18.821 13.687 -20.975 1.00 48.04 C ATOM 96 C SER A 7 19.420 12.619 -21.892 1.00 51.78 C ATOM 97 O SER A 7 20.470 12.062 -21.581 1.00 40.34 O ATOM 98 CB SER A 7 19.627 14.981 -21.055 1.00 42.83 C ATOM 99 OG SER A 7 19.493 15.602 -22.321 1.00 60.42 O ATOM 100 HA SER A 7 17.803 13.906 -21.296 1.00 0.00 H ATOM 101 HB2 SER A 7 20.679 14.754 -20.882 1.00 0.00 H ATOM 102 HB3 SER A 7 19.273 15.667 -20.285 1.00 0.00 H ATOM 103 HG SER A 7 19.818 14.987 -23.025 1.00 0.00 H ATOM 104 H SER A 7 19.354 13.674 -18.867 1.00 0.00 H ATOM 105 N PRO A 8 18.759 12.331 -23.032 1.00 49.77 N ATOM 106 CA PRO A 8 19.177 11.202 -23.878 1.00 44.29 C ATOM 107 C PRO A 8 20.573 11.325 -24.496 1.00 39.46 C ATOM 108 O PRO A 8 21.186 10.276 -24.738 1.00 32.14 O ATOM 109 CB PRO A 8 18.101 11.162 -24.976 1.00 51.51 C ATOM 110 CG PRO A 8 17.535 12.543 -25.008 1.00 60.14 C ATOM 111 CD PRO A 8 17.581 13.026 -23.584 1.00 57.09 C ATOM 112 HA PRO A 8 19.257 10.295 -23.279 1.00 0.00 H ATOM 113 HD3 PRO A 8 17.709 14.108 -23.541 1.00 0.00 H ATOM 114 HD2 PRO A 8 16.675 12.747 -23.047 1.00 0.00 H ATOM 115 HG3 PRO A 8 16.508 12.526 -25.373 1.00 0.00 H ATOM 116 HG2 PRO A 8 18.136 13.187 -25.649 1.00 0.00 H ATOM 117 HB2 PRO A 8 18.544 10.906 -25.939 1.00 0.00 H ATOM 118 HB3 PRO A 8 17.327 10.435 -24.729 1.00 0.00 H ATOM 119 N SER A 9 21.078 12.540 -24.734 1.00 35.15 N ATOM 120 CA SER A 9 22.374 12.669 -25.414 1.00 35.30 C ATOM 121 C SER A 9 23.168 13.966 -25.179 1.00 33.10 C ATOM 122 O SER A 9 22.618 15.063 -25.159 1.00 39.77 O ATOM 123 CB SER A 9 22.175 12.463 -26.912 1.00 43.18 C ATOM 124 OG SER A 9 21.338 13.477 -27.438 1.00 54.44 O ATOM 125 HA SER A 9 22.993 11.897 -24.957 1.00 0.00 H ATOM 126 HB2 SER A 9 21.714 11.490 -27.084 1.00 0.00 H ATOM 127 HB3 SER A 9 23.143 12.499 -27.412 1.00 0.00 H ATOM 128 HG SER A 9 21.756 14.361 -27.285 1.00 0.00 H ATOM 129 H SER A 9 20.556 13.390 -24.439 1.00 0.00 H ATOM 130 N VAL A 11 24.479 13.824 -25.054 1.00 29.32 N ATOM 131 CA VAL A 11 25.359 14.945 -24.771 1.00 37.23 C ATOM 132 C VAL A 11 26.590 14.817 -25.631 1.00 38.28 C ATOM 133 O VAL A 11 27.102 13.717 -25.819 1.00 41.24 O ATOM 134 CB VAL A 11 25.853 14.907 -23.310 1.00 35.60 C ATOM 135 CG1 VAL A 11 26.625 16.154 -22.996 1.00 42.25 C ATOM 136 CG2 VAL A 11 24.694 14.765 -22.368 1.00 32.91 C ATOM 137 HA VAL A 11 24.805 15.864 -24.960 1.00 0.00 H ATOM 138 HB VAL A 11 26.508 14.045 -23.186 1.00 0.00 H ATOM 139 HG11 VAL A 11 27.484 16.226 -23.663 1.00 0.00 H ATOM 140 HG12 VAL A 11 25.982 17.023 -23.135 1.00 0.00 H ATOM 141 HG13 VAL A 11 26.969 16.116 -21.962 1.00 0.00 H ATOM 142 HG21 VAL A 11 24.020 15.612 -22.493 1.00 0.00 H ATOM 143 HG22 VAL A 11 24.161 13.840 -22.587 1.00 0.00 H ATOM 144 HG23 VAL A 11 25.062 14.740 -21.342 1.00 0.00 H ATOM 145 H VAL A 11 24.893 12.876 -25.162 1.00 0.00 H ATOM 146 N SER A 12 27.078 15.937 -26.146 1.00 37.06 N ATOM 147 CA SER A 12 28.316 15.937 -26.916 1.00 40.23 C ATOM 148 C SER A 12 29.355 16.813 -26.238 1.00 49.23 C ATOM 149 O SER A 12 29.020 17.714 -25.458 1.00 47.87 O ATOM 150 CB SER A 12 28.075 16.440 -28.339 1.00 47.22 C ATOM 151 OG SER A 12 27.142 15.624 -29.017 1.00 46.15 O ATOM 152 HA SER A 12 28.681 14.911 -26.965 1.00 0.00 H ATOM 153 HB2 SER A 12 29.019 16.431 -28.885 1.00 0.00 H ATOM 154 HB3 SER A 12 27.691 17.459 -28.296 1.00 0.00 H ATOM 155 HG SER A 12 27.006 15.972 -29.934 1.00 0.00 H ATOM 156 H SER A 12 26.569 16.832 -25.998 1.00 0.00 H ATOM 157 N GLY A 13 30.619 16.544 -26.536 1.00 34.14 N ATOM 158 CA GLY A 13 31.706 17.374 -26.059 1.00 37.93 C ATOM 159 C GLY A 13 32.978 17.013 -26.792 1.00 46.80 C ATOM 160 O GLY A 13 33.032 16.002 -27.488 1.00 43.77 O ATOM 161 HA3 GLY A 13 31.844 17.212 -24.990 1.00 0.00 H ATOM 162 HA2 GLY A 13 31.468 18.422 -26.239 1.00 0.00 H ATOM 163 H GLY A 13 30.835 15.716 -27.127 1.00 0.00 H ATOM 164 N THR A 14 34.007 17.835 -26.640 1.00 43.17 N ATOM 165 CA THR A 14 35.294 17.541 -27.256 1.00 48.42 C ATOM 166 C THR A 14 36.290 17.123 -26.187 1.00 40.83 C ATOM 167 O THR A 14 36.109 17.435 -25.009 1.00 38.84 O ATOM 168 CB THR A 14 35.843 18.750 -28.051 1.00 55.58 C ATOM 169 OG1 THR A 14 36.187 19.813 -27.150 1.00 54.82 O ATOM 170 CG2 THR A 14 34.806 19.241 -29.044 1.00 57.20 C ATOM 171 HA THR A 14 35.148 16.724 -27.963 1.00 0.00 H ATOM 172 HB THR A 14 36.734 18.434 -28.594 1.00 0.00 H ATOM 173 HG1 THR A 14 36.537 20.582 -27.667 1.00 0.00 H ATOM 174 HG23 THR A 14 34.547 18.432 -29.727 1.00 0.00 H ATOM 175 HG21 THR A 14 33.915 19.564 -28.506 1.00 0.00 H ATOM 176 HG22 THR A 14 35.214 20.079 -29.610 1.00 0.00 H ATOM 177 H THR A 14 33.894 18.700 -26.074 1.00 0.00 H ATOM 178 N PRO A 15 37.352 16.417 -26.593 1.00 48.42 N ATOM 179 CA PRO A 15 38.347 15.949 -25.625 1.00 39.89 C ATOM 180 C PRO A 15 38.826 17.089 -24.727 1.00 42.05 C ATOM 181 O PRO A 15 39.053 18.198 -25.212 1.00 45.36 O ATOM 182 CB PRO A 15 39.481 15.438 -26.518 1.00 50.35 C ATOM 183 CG PRO A 15 38.798 15.055 -27.798 1.00 48.86 C ATOM 184 CD PRO A 15 37.691 16.037 -27.977 1.00 55.14 C ATOM 185 HA PRO A 15 37.959 15.191 -24.945 1.00 0.00 H ATOM 186 HD3 PRO A 15 38.024 16.902 -28.550 1.00 0.00 H ATOM 187 HD2 PRO A 15 36.838 15.578 -28.477 1.00 0.00 H ATOM 188 HG3 PRO A 15 38.400 14.043 -27.728 1.00 0.00 H ATOM 189 HG2 PRO A 15 39.496 15.113 -28.633 1.00 0.00 H ATOM 190 HB2 PRO A 15 40.219 16.221 -26.693 1.00 0.00 H ATOM 191 HB3 PRO A 15 39.970 14.574 -26.067 1.00 0.00 H ATOM 192 N GLY A 16 38.959 16.821 -23.431 1.00 44.17 N ATOM 193 CA GLY A 16 39.388 17.835 -22.485 1.00 44.00 C ATOM 194 C GLY A 16 38.251 18.625 -21.844 1.00 29.83 C ATOM 195 O GLY A 16 38.426 19.217 -20.787 1.00 35.51 O ATOM 196 HA3 GLY A 16 40.037 18.537 -23.009 1.00 0.00 H ATOM 197 HA2 GLY A 16 39.951 17.344 -21.691 1.00 0.00 H ATOM 198 H GLY A 16 38.751 15.862 -23.087 1.00 0.00 H ATOM 199 N GLN A 17 37.090 18.657 -22.480 1.00 35.77 N ATOM 200 CA GLN A 17 35.963 19.381 -21.899 1.00 34.34 C ATOM 201 C GLN A 17 35.442 18.691 -20.640 1.00 37.09 C ATOM 202 O GLN A 17 35.421 17.462 -20.563 1.00 29.55 O ATOM 203 CB GLN A 17 34.826 19.504 -22.901 1.00 37.66 C ATOM 204 CG GLN A 17 35.116 20.469 -24.018 1.00 53.45 C ATOM 205 CD GLN A 17 33.862 20.999 -24.649 1.00 53.67 C ATOM 206 OE1 GLN A 17 33.002 20.236 -25.081 1.00 48.61 O ATOM 207 NE2 GLN A 17 33.740 22.324 -24.696 1.00 63.55 N ATOM 208 HA GLN A 17 36.326 20.374 -21.633 1.00 0.00 H ATOM 209 HB2 GLN A 17 34.638 18.521 -23.333 1.00 0.00 H ATOM 210 HB3 GLN A 17 33.935 19.844 -22.373 1.00 0.00 H ATOM 211 HG2 GLN A 17 35.689 21.306 -23.619 1.00 0.00 H ATOM 212 HG3 GLN A 17 35.704 19.958 -24.780 1.00 0.00 H ATOM 213 HE22 GLN A 17 34.496 22.930 -24.317 1.00 0.00 H ATOM 214 HE21 GLN A 17 32.889 22.753 -25.112 1.00 0.00 H ATOM 215 H GLN A 17 36.981 18.168 -23.391 1.00 0.00 H ATOM 216 N LYS A 18 35.030 19.493 -19.661 1.00 39.19 N ATOM 217 CA LYS A 18 34.395 18.984 -18.455 1.00 33.31 C ATOM 218 C LYS A 18 32.888 18.998 -18.663 1.00 32.10 C ATOM 219 O LYS A 18 32.287 20.039 -18.916 1.00 32.94 O ATOM 220 CB LYS A 18 34.795 19.823 -17.245 1.00 33.18 C ATOM 221 CG LYS A 18 36.292 19.901 -17.042 1.00 38.22 C ATOM 222 CD LYS A 18 36.663 20.892 -15.953 1.00 48.21 C ATOM 223 CE LYS A 18 38.162 20.882 -15.693 1.00 64.53 C ATOM 224 NZ LYS A 18 38.565 21.871 -14.648 1.00 73.49 N ATOM 225 HA LYS A 18 34.723 17.963 -18.261 1.00 0.00 H ATOM 226 HB2 LYS A 18 34.411 20.834 -17.382 1.00 0.00 H ATOM 227 HB3 LYS A 18 34.347 19.383 -16.354 1.00 0.00 H ATOM 228 HG2 LYS A 18 36.662 18.915 -16.763 1.00 0.00 H ATOM 229 HG3 LYS A 18 36.759 20.212 -17.976 1.00 0.00 H ATOM 230 HD2 LYS A 18 36.362 21.892 -16.264 1.00 0.00 H ATOM 231 HD3 LYS A 18 36.140 20.625 -15.035 1.00 0.00 H ATOM 232 HE2 LYS A 18 38.680 21.122 -16.621 1.00 0.00 H ATOM 233 HE3 LYS A 18 38.454 19.885 -15.363 1.00 0.00 H ATOM 234 HZ1 LYS A 18 38.298 22.828 -14.957 1.00 0.00 H ATOM 235 HZ2 LYS A 18 38.082 21.646 -13.755 1.00 0.00 H ATOM 236 HZ3 LYS A 18 39.594 21.825 -14.508 1.00 0.00 H ATOM 237 H LYS A 18 35.167 20.519 -19.762 1.00 0.00 H ATOM 238 N VAL A 19 32.282 17.822 -18.582 1.00 34.07 N ATOM 239 CA VAL A 19 30.857 17.685 -18.811 1.00 26.86 C ATOM 240 C VAL A 19 30.213 16.958 -17.626 1.00 25.47 C ATOM 241 O VAL A 19 30.776 16.011 -17.090 1.00 27.17 O ATOM 242 CB VAL A 19 30.598 16.941 -20.137 1.00 36.46 C ATOM 243 CG1 VAL A 19 29.137 16.690 -20.333 1.00 33.68 C ATOM 244 CG2 VAL A 19 31.158 17.747 -21.300 1.00 42.39 C ATOM 245 HA VAL A 19 30.405 18.673 -18.893 1.00 0.00 H ATOM 246 HB VAL A 19 31.102 15.976 -20.096 1.00 0.00 H ATOM 247 HG11 VAL A 19 28.761 16.082 -19.511 1.00 0.00 H ATOM 248 HG12 VAL A 19 28.606 17.642 -20.356 1.00 0.00 H ATOM 249 HG13 VAL A 19 28.983 16.164 -21.275 1.00 0.00 H ATOM 250 HG21 VAL A 19 30.671 18.722 -21.333 1.00 0.00 H ATOM 251 HG22 VAL A 19 32.231 17.880 -21.165 1.00 0.00 H ATOM 252 HG23 VAL A 19 30.971 17.215 -22.233 1.00 0.00 H ATOM 253 H VAL A 19 32.842 16.977 -18.349 1.00 0.00 H ATOM 254 N THR A 20 29.041 17.414 -17.212 1.00 25.92 N ATOM 255 CA THR A 20 28.322 16.786 -16.118 1.00 24.69 C ATOM 256 C THR A 20 26.965 16.360 -16.613 1.00 24.94 C ATOM 257 O THR A 20 26.270 17.138 -17.273 1.00 24.06 O ATOM 258 CB THR A 20 28.150 17.760 -14.928 1.00 23.37 C ATOM 259 OG1 THR A 20 29.442 18.175 -14.492 1.00 20.88 O ATOM 260 CG2 THR A 20 27.420 17.072 -13.756 1.00 17.30 C ATOM 261 HA THR A 20 28.894 15.925 -15.772 1.00 0.00 H ATOM 262 HB THR A 20 27.556 18.615 -15.251 1.00 0.00 H ATOM 263 HG1 THR A 20 29.347 18.800 -13.730 1.00 0.00 H ATOM 264 HG23 THR A 20 26.431 16.752 -14.083 1.00 0.00 H ATOM 265 HG21 THR A 20 27.995 16.205 -13.431 1.00 0.00 H ATOM 266 HG22 THR A 20 27.321 17.775 -12.929 1.00 0.00 H ATOM 267 H THR A 20 28.625 18.243 -17.682 1.00 0.00 H ATOM 268 N ILE A 21 26.589 15.119 -16.309 1.00 19.68 N ATOM 269 CA ILE A 21 25.270 14.632 -16.666 1.00 24.33 C ATOM 270 C ILE A 21 24.385 14.390 -15.440 1.00 23.16 C ATOM 271 O ILE A 21 24.869 14.098 -14.335 1.00 20.59 O ATOM 272 CB ILE A 21 25.350 13.385 -17.576 1.00 32.56 C ATOM 273 CG1 ILE A 21 26.197 12.299 -16.931 1.00 23.16 C ATOM 274 CG2 ILE A 21 25.986 13.756 -18.891 1.00 30.58 C ATOM 275 CD1 ILE A 21 26.443 11.103 -17.847 1.00 32.11 C ATOM 276 HA ILE A 21 24.789 15.423 -17.242 1.00 0.00 H ATOM 277 HB ILE A 21 24.336 13.015 -17.729 1.00 0.00 H ATOM 278 HG12 ILE A 21 27.160 12.729 -16.656 1.00 0.00 H ATOM 279 HG13 ILE A 21 25.687 11.949 -16.034 1.00 0.00 H ATOM 280 HD11 ILE A 21 25.488 10.656 -18.123 1.00 0.00 H ATOM 281 HD12 ILE A 21 26.963 11.436 -18.745 1.00 0.00 H ATOM 282 HD13 ILE A 21 27.053 10.366 -17.325 1.00 0.00 H ATOM 283 HG21 ILE A 21 25.385 14.523 -19.380 1.00 0.00 H ATOM 284 HG22 ILE A 21 26.991 14.139 -18.712 1.00 0.00 H ATOM 285 HG23 ILE A 21 26.040 12.874 -19.529 1.00 0.00 H ATOM 286 H ILE A 21 27.250 14.491 -15.809 1.00 0.00 H ATOM 287 N PHE A 22 23.083 14.511 -15.649 1.00 17.11 N ATOM 288 CA PHE A 22 22.148 14.643 -14.550 1.00 20.12 C ATOM 289 C PHE A 22 21.108 13.539 -14.562 1.00 22.41 C ATOM 290 O PHE A 22 20.728 13.010 -15.615 1.00 22.44 O ATOM 291 CB PHE A 22 21.457 16.029 -14.597 1.00 24.90 C ATOM 292 CG PHE A 22 22.386 17.186 -14.308 1.00 25.51 C ATOM 293 CD1 PHE A 22 22.439 17.746 -13.038 1.00 23.35 C ATOM 294 CD2 PHE A 22 23.218 17.705 -15.309 1.00 24.66 C ATOM 295 CE1 PHE A 22 23.296 18.820 -12.769 1.00 28.88 C ATOM 296 CE2 PHE A 22 24.078 18.769 -15.053 1.00 25.69 C ATOM 297 CZ PHE A 22 24.118 19.335 -13.775 1.00 23.22 C ATOM 298 HA PHE A 22 22.714 14.555 -13.623 1.00 0.00 H ATOM 299 HB2 PHE A 22 21.034 16.168 -15.592 1.00 0.00 H ATOM 300 HB3 PHE A 22 20.656 16.039 -13.858 1.00 0.00 H ATOM 301 HD2 PHE A 22 23.191 17.267 -16.307 1.00 0.00 H ATOM 302 HE2 PHE A 22 24.717 19.159 -15.845 1.00 0.00 H ATOM 303 HZ PHE A 22 24.785 20.171 -13.565 1.00 0.00 H ATOM 304 HE1 PHE A 22 23.322 19.256 -11.771 1.00 0.00 H ATOM 305 HD1 PHE A 22 21.808 17.346 -12.244 1.00 0.00 H ATOM 306 H PHE A 22 22.723 14.511 -16.625 1.00 0.00 H ATOM 307 N CYS A 23 20.631 13.208 -13.370 1.00 22.43 N ATOM 308 CA CYS A 23 19.691 12.114 -13.177 1.00 18.76 C ATOM 309 C CYS A 23 18.653 12.595 -12.169 1.00 24.42 C ATOM 310 O CYS A 23 18.920 12.653 -10.965 1.00 22.74 O ATOM 311 CB CYS A 23 20.442 10.882 -12.645 1.00 15.09 C ATOM 312 SG CYS A 23 19.409 9.528 -12.029 1.00 21.87 S ATOM 313 HA CYS A 23 19.206 11.830 -14.111 1.00 0.00 H ATOM 314 HB2 CYS A 23 21.085 11.210 -11.828 1.00 0.00 H ATOM 315 HB3 CYS A 23 21.057 10.491 -13.455 1.00 0.00 H ATOM 316 H CYS A 23 20.941 13.752 -12.540 1.00 0.00 H ATOM 317 N SER A 24 17.468 12.940 -12.657 1.00 18.87 N ATOM 318 CA SER A 24 16.436 13.531 -11.815 1.00 22.79 C ATOM 319 C SER A 24 15.439 12.482 -11.353 1.00 28.94 C ATOM 320 O SER A 24 14.956 11.688 -12.148 1.00 29.56 O ATOM 321 CB SER A 24 15.706 14.635 -12.582 1.00 28.93 C ATOM 322 OG SER A 24 16.615 15.405 -13.350 1.00 37.93 O ATOM 323 HA SER A 24 16.919 13.956 -10.935 1.00 0.00 H ATOM 324 HB2 SER A 24 15.197 15.287 -11.872 1.00 0.00 H ATOM 325 HB3 SER A 24 14.971 14.182 -13.247 1.00 0.00 H ATOM 326 HG SER A 24 17.282 15.822 -12.749 1.00 0.00 H ATOM 327 H SER A 24 17.271 12.785 -13.666 1.00 0.00 H ATOM 328 N GLY A 25 15.135 12.479 -10.061 1.00 20.64 N ATOM 329 CA GLY A 25 14.166 11.539 -9.518 1.00 18.37 C ATOM 330 C GLY A 25 13.182 12.251 -8.606 1.00 25.70 C ATOM 331 O GLY A 25 12.818 13.397 -8.851 1.00 30.07 O ATOM 332 HA3 GLY A 25 14.691 10.772 -8.949 1.00 0.00 H ATOM 333 HA2 GLY A 25 13.621 11.072 -10.338 1.00 0.00 H ATOM 334 H GLY A 25 15.597 13.160 -9.426 1.00 0.00 H ATOM 335 N SER A 26 12.757 11.577 -7.548 1.00 26.61 N ATOM 336 CA SER A 26 11.789 12.161 -6.635 1.00 28.13 C ATOM 337 C SER A 26 12.203 11.852 -5.221 1.00 32.52 C ATOM 338 O SER A 26 13.214 11.181 -4.992 1.00 27.70 O ATOM 339 CB SER A 26 10.407 11.558 -6.879 1.00 25.78 C ATOM 340 OG SER A 26 10.405 10.208 -6.461 1.00 33.42 O ATOM 341 HA SER A 26 11.750 13.238 -6.798 1.00 0.00 H ATOM 342 HB2 SER A 26 10.169 11.611 -7.941 1.00 0.00 H ATOM 343 HB3 SER A 26 9.661 12.116 -6.313 1.00 0.00 H ATOM 344 HG SER A 26 9.510 9.816 -6.619 1.00 0.00 H ATOM 345 H SER A 26 13.120 10.619 -7.369 1.00 0.00 H ATOM 346 N SER A 27 11.391 12.303 -4.268 1.00 22.81 N ATOM 347 CA SER A 27 11.613 11.984 -2.869 1.00 33.23 C ATOM 348 C SER A 27 11.626 10.476 -2.614 1.00 27.09 C ATOM 349 O SER A 27 12.262 10.021 -1.677 1.00 32.50 O ATOM 350 CB SER A 27 10.553 12.665 -1.975 1.00 36.80 C ATOM 351 OG SER A 27 9.268 12.096 -2.169 1.00 39.20 O ATOM 352 HA SER A 27 12.599 12.370 -2.610 1.00 0.00 H ATOM 353 HB2 SER A 27 10.512 13.726 -2.220 1.00 0.00 H ATOM 354 HB3 SER A 27 10.840 12.545 -0.930 1.00 0.00 H ATOM 355 HG SER A 27 8.614 12.553 -1.583 1.00 0.00 H ATOM 356 H SER A 27 10.579 12.897 -4.531 1.00 0.00 H ATOM 357 N SER A 27A 10.924 9.691 -3.425 1.00 32.02 N ATOM 358 CA SER A 27A 10.851 8.259 -3.118 1.00 32.68 C ATOM 359 C SER A 27A 11.982 7.421 -3.724 1.00 27.90 C ATOM 360 O SER A 27A 12.078 6.230 -3.463 1.00 29.51 O ATOM 361 CB SER A 27A 9.489 7.662 -3.490 1.00 42.18 C ATOM 362 OG SER A 27A 9.181 7.914 -4.841 1.00 41.17 O ATOM 363 HA SER A 27A 10.979 8.208 -2.037 1.00 0.00 H ATOM 364 HB2 SER A 27A 8.720 8.107 -2.859 1.00 0.00 H ATOM 365 HB3 SER A 27A 9.514 6.585 -3.324 1.00 0.00 H ATOM 366 HG SER A 27A 9.153 8.892 -4.995 1.00 0.00 H ATOM 367 H SER A 27A 10.438 10.083 -4.257 1.00 0.00 H ATOM 368 N ASN A 27B 12.826 8.059 -4.528 1.00 34.09 N ATOM 369 CA ASN A 27B 14.024 7.413 -5.050 1.00 34.58 C ATOM 370 C ASN A 27B 15.281 8.239 -4.797 1.00 28.19 C ATOM 371 O ASN A 27B 15.852 8.200 -3.708 1.00 27.32 O ATOM 372 CB ASN A 27B 13.873 7.131 -6.546 1.00 22.65 C ATOM 373 CG ASN A 27B 13.218 8.277 -7.292 1.00 27.11 C ATOM 374 OD1 ASN A 27B 13.750 9.386 -7.339 1.00 25.47 O ATOM 375 ND2 ASN A 27B 12.057 8.014 -7.880 1.00 28.55 N ATOM 376 HA ASN A 27B 14.138 6.470 -4.515 1.00 0.00 H ATOM 377 HB2 ASN A 27B 14.862 6.958 -6.970 1.00 0.00 H ATOM 378 HB3 ASN A 27B 13.263 6.237 -6.673 1.00 0.00 H ATOM 379 HD22 ASN A 27B 11.645 7.062 -7.814 1.00 0.00 H ATOM 380 HD21 ASN A 27B 11.560 8.760 -8.407 1.00 0.00 H ATOM 381 H ASN A 27B 12.627 9.045 -4.792 1.00 0.00 H ATOM 382 N VAL A 28 15.807 8.829 -5.814 1.00 24.56 N ATOM 383 CA VAL A 28 17.061 9.496 -5.735 1.00 16.38 C ATOM 384 C VAL A 28 17.300 10.194 -4.388 1.00 29.23 C ATOM 385 O VAL A 28 18.351 10.116 -3.845 1.00 23.68 O ATOM 386 CB VAL A 28 17.157 10.427 -6.918 1.00 22.57 C ATOM 387 CG1 VAL A 28 18.068 11.498 -6.687 1.00 28.97 C ATOM 388 CG2 VAL A 28 17.465 9.657 -8.146 1.00 24.16 C ATOM 389 HA VAL A 28 17.866 8.763 -5.780 1.00 0.00 H ATOM 390 HB VAL A 28 16.188 10.904 -7.064 1.00 0.00 H ATOM 391 HG11 VAL A 28 17.735 12.077 -5.826 1.00 0.00 H ATOM 392 HG12 VAL A 28 19.061 11.093 -6.492 1.00 0.00 H ATOM 393 HG13 VAL A 28 18.102 12.140 -7.567 1.00 0.00 H ATOM 394 HG21 VAL A 28 18.415 9.138 -8.019 1.00 0.00 H ATOM 395 HG22 VAL A 28 16.673 8.929 -8.325 1.00 0.00 H ATOM 396 HG23 VAL A 28 17.532 10.339 -8.994 1.00 0.00 H ATOM 397 H VAL A 28 15.299 8.817 -6.721 1.00 0.00 H ATOM 398 N GLU A 29 16.290 10.858 -3.848 1.00 21.16 N ATOM 399 CA GLU A 29 16.514 11.803 -2.770 1.00 25.20 C ATOM 400 C GLU A 29 16.936 11.038 -1.557 1.00 27.56 C ATOM 401 O GLU A 29 17.790 11.426 -0.853 1.00 28.52 O ATOM 402 CB GLU A 29 15.283 12.631 -2.499 1.00 30.02 C ATOM 403 CG GLU A 29 15.536 13.832 -1.647 1.00 33.56 C ATOM 404 CD GLU A 29 14.462 14.880 -1.772 1.00 33.32 C ATOM 405 OE1 GLU A 29 13.313 14.542 -1.874 1.00 42.17 O ATOM 406 OE2 GLU A 29 14.788 16.019 -1.749 1.00 36.94 O ATOM 407 HA GLU A 29 17.299 12.504 -3.053 1.00 0.00 H ATOM 408 HB2 GLU A 29 14.878 12.966 -3.454 1.00 0.00 H ATOM 409 HB3 GLU A 29 14.550 12.001 -1.996 1.00 0.00 H ATOM 410 HG2 GLU A 29 15.592 13.514 -0.606 1.00 0.00 H ATOM 411 HG3 GLU A 29 16.488 14.273 -1.942 1.00 0.00 H ATOM 412 H GLU A 29 15.324 10.700 -4.201 1.00 0.00 H ATOM 413 N ASP A 30 16.372 9.857 -1.480 1.00 61.63 N ATOM 414 CA ASP A 30 16.123 9.025 -0.325 1.00 63.26 C ATOM 415 C ASP A 30 17.179 7.926 -0.190 1.00 60.56 C ATOM 416 O ASP A 30 17.505 7.535 0.905 1.00 60.65 O ATOM 417 CB ASP A 30 14.776 8.335 -0.564 1.00 67.75 C ATOM 418 CG ASP A 30 14.285 7.533 0.635 1.00 71.24 C ATOM 419 OD1 ASP A 30 13.259 6.869 0.565 1.00 70.24 O ATOM 420 OD2 ASP A 30 14.938 7.569 1.671 1.00 74.26 O ATOM 421 HA ASP A 30 16.140 9.640 0.575 1.00 0.00 H ATOM 422 HB2 ASP A 30 14.033 9.098 -0.797 1.00 0.00 H ATOM 423 HB3 ASP A 30 14.880 7.659 -1.413 1.00 0.00 H ATOM 424 H ASP A 30 16.056 9.459 -2.387 1.00 0.00 H ATOM 425 N ASN A 31 17.686 7.451 -1.316 1.00 26.72 N ATOM 426 CA ASN A 31 18.222 6.107 -1.488 1.00 31.65 C ATOM 427 C ASN A 31 19.571 6.225 -2.187 1.00 22.95 C ATOM 428 O ASN A 31 19.792 7.169 -2.828 1.00 21.55 O ATOM 429 CB ASN A 31 17.297 5.254 -2.348 1.00 29.52 C ATOM 430 CG ASN A 31 16.112 4.739 -1.600 1.00 44.15 C ATOM 431 OD1 ASN A 31 16.250 3.965 -0.711 1.00 54.42 O ATOM 432 ND2 ASN A 31 14.971 5.143 -1.974 1.00 36.55 N ATOM 433 HA ASN A 31 18.319 5.632 -0.512 1.00 0.00 H ATOM 434 HB2 ASN A 31 16.944 5.858 -3.184 1.00 0.00 H ATOM 435 HB3 ASN A 31 17.863 4.404 -2.729 1.00 0.00 H ATOM 436 HD22 ASN A 31 14.891 5.822 -2.758 1.00 0.00 H ATOM 437 HD21 ASN A 31 14.114 4.795 -1.497 1.00 0.00 H ATOM 438 H ASN A 31 17.703 8.085 -2.140 1.00 0.00 H ATOM 439 N SER A 32 20.454 5.262 -2.010 1.00 26.91 N ATOM 440 CA SER A 32 21.756 5.243 -2.663 1.00 25.04 C ATOM 441 C SER A 32 21.595 5.284 -4.173 1.00 19.01 C ATOM 442 O SER A 32 20.765 4.559 -4.718 1.00 20.37 O ATOM 443 CB SER A 32 22.534 3.980 -2.264 1.00 22.54 C ATOM 444 OG SER A 32 22.792 3.987 -0.872 1.00 33.55 O ATOM 445 HA SER A 32 22.312 6.124 -2.341 1.00 0.00 H ATOM 446 HB2 SER A 32 23.479 3.952 -2.806 1.00 0.00 H ATOM 447 HB3 SER A 32 21.945 3.098 -2.517 1.00 0.00 H ATOM 448 HG SER A 32 23.293 3.169 -0.626 1.00 0.00 H ATOM 449 H SER A 32 20.209 4.477 -1.373 1.00 0.00 H ATOM 450 N VAL A 33 22.390 6.123 -4.841 1.00 19.72 N ATOM 451 CA VAL A 33 22.397 6.197 -6.307 1.00 18.43 C ATOM 452 C VAL A 33 23.656 5.549 -6.876 1.00 15.46 C ATOM 453 O VAL A 33 24.767 5.759 -6.363 1.00 15.75 O ATOM 454 CB VAL A 33 22.300 7.658 -6.786 1.00 16.50 C ATOM 455 CG1 VAL A 33 22.392 7.756 -8.317 1.00 14.71 C ATOM 456 CG2 VAL A 33 20.979 8.278 -6.262 1.00 21.69 C ATOM 457 HA VAL A 33 21.525 5.652 -6.670 1.00 0.00 H ATOM 458 HB VAL A 33 23.144 8.219 -6.384 1.00 0.00 H ATOM 459 HG11 VAL A 33 23.346 7.346 -8.649 1.00 0.00 H ATOM 460 HG12 VAL A 33 21.576 7.190 -8.766 1.00 0.00 H ATOM 461 HG13 VAL A 33 22.320 8.801 -8.618 1.00 0.00 H ATOM 462 HG21 VAL A 33 20.134 7.708 -6.648 1.00 0.00 H ATOM 463 HG22 VAL A 33 20.972 8.248 -5.172 1.00 0.00 H ATOM 464 HG23 VAL A 33 20.906 9.312 -6.599 1.00 0.00 H ATOM 465 H VAL A 33 23.027 6.746 -4.304 1.00 0.00 H ATOM 466 N TYR A 34 23.481 4.770 -7.938 1.00 15.99 N ATOM 467 CA TYR A 34 24.601 4.100 -8.592 1.00 15.16 C ATOM 468 C TYR A 34 24.653 4.585 -10.024 1.00 14.55 C ATOM 469 O TYR A 34 23.607 4.835 -10.631 1.00 15.96 O ATOM 470 CB TYR A 34 24.412 2.568 -8.574 1.00 14.80 C ATOM 471 CG TYR A 34 24.105 2.008 -7.192 1.00 17.93 C ATOM 472 CD1 TYR A 34 25.123 1.502 -6.377 1.00 19.69 C ATOM 473 CD2 TYR A 34 22.808 2.001 -6.705 1.00 20.27 C ATOM 474 CE1 TYR A 34 24.847 1.010 -5.109 1.00 20.68 C ATOM 475 CE2 TYR A 34 22.516 1.502 -5.420 1.00 24.26 C ATOM 476 CZ TYR A 34 23.544 1.008 -4.638 1.00 24.63 C ATOM 477 OH TYR A 34 23.273 0.512 -3.375 1.00 29.22 O ATOM 478 HA TYR A 34 25.527 4.330 -8.065 1.00 0.00 H ATOM 479 HB3 TYR A 34 25.328 2.103 -8.939 1.00 0.00 H ATOM 480 HB2 TYR A 34 23.587 2.314 -9.240 1.00 0.00 H ATOM 481 HD2 TYR A 34 22.000 2.388 -7.326 1.00 0.00 H ATOM 482 HE2 TYR A 34 21.492 1.505 -5.047 1.00 0.00 H ATOM 483 HE1 TYR A 34 25.654 0.626 -4.485 1.00 0.00 H ATOM 484 HD1 TYR A 34 26.149 1.494 -6.744 1.00 0.00 H ATOM 485 HH TYR A 34 24.115 0.202 -2.956 1.00 0.00 H ATOM 486 H TYR A 34 22.521 4.634 -8.313 1.00 0.00 H ATOM 487 N TRP A 35 25.860 4.725 -10.553 1.00 13.49 N ATOM 488 CA TRP A 35 26.048 5.049 -11.969 1.00 14.00 C ATOM 489 C TRP A 35 26.845 3.960 -12.640 1.00 17.32 C ATOM 490 O TRP A 35 27.838 3.493 -12.080 1.00 17.43 O ATOM 491 CB TRP A 35 26.844 6.351 -12.134 1.00 11.03 C ATOM 492 CG TRP A 35 26.129 7.555 -11.683 1.00 15.10 C ATOM 493 CD1 TRP A 35 26.053 8.053 -10.401 1.00 20.34 C ATOM 494 CD2 TRP A 35 25.406 8.450 -12.512 1.00 19.36 C ATOM 495 NE1 TRP A 35 25.309 9.205 -10.391 1.00 17.12 N ATOM 496 CE2 TRP A 35 24.913 9.481 -11.679 1.00 23.99 C ATOM 497 CE3 TRP A 35 25.126 8.487 -13.891 1.00 22.77 C ATOM 498 CZ2 TRP A 35 24.142 10.537 -12.183 1.00 20.06 C ATOM 499 CZ3 TRP A 35 24.366 9.539 -14.391 1.00 21.22 C ATOM 500 CH2 TRP A 35 23.885 10.549 -13.536 1.00 24.62 C ATOM 501 HA TRP A 35 25.059 5.152 -12.415 1.00 0.00 H ATOM 502 HB2 TRP A 35 27.765 6.264 -11.558 1.00 0.00 H ATOM 503 HB3 TRP A 35 27.087 6.472 -13.190 1.00 0.00 H ATOM 504 HE1 TRP A 35 25.082 9.774 -9.551 1.00 0.00 H ATOM 505 HD1 TRP A 35 26.515 7.599 -9.525 1.00 0.00 H ATOM 506 HZ2 TRP A 35 23.760 11.320 -11.528 1.00 0.00 H ATOM 507 HH2 TRP A 35 23.293 11.362 -13.956 1.00 0.00 H ATOM 508 HZ3 TRP A 35 24.140 9.582 -15.456 1.00 0.00 H ATOM 509 HE3 TRP A 35 25.498 7.706 -14.554 1.00 0.00 H ATOM 510 H TRP A 35 26.696 4.602 -9.947 1.00 0.00 H ATOM 511 N TYR A 36 26.485 3.629 -13.879 1.00 12.45 N ATOM 512 CA TYR A 36 27.319 2.732 -14.648 1.00 15.04 C ATOM 513 C TYR A 36 27.525 3.163 -16.100 1.00 19.99 C ATOM 514 O TYR A 36 26.726 3.908 -16.674 1.00 18.04 O ATOM 515 CB TYR A 36 26.826 1.270 -14.550 1.00 16.04 C ATOM 516 CG TYR A 36 25.476 0.934 -15.191 1.00 15.85 C ATOM 517 CD1 TYR A 36 24.346 0.753 -14.402 1.00 17.43 C ATOM 518 CD2 TYR A 36 25.355 0.715 -16.567 1.00 19.81 C ATOM 519 CE1 TYR A 36 23.109 0.405 -14.966 1.00 19.67 C ATOM 520 CE2 TYR A 36 24.124 0.368 -17.142 1.00 19.33 C ATOM 521 CZ TYR A 36 23.008 0.216 -16.324 1.00 23.73 C ATOM 522 OH TYR A 36 21.775 -0.124 -16.847 1.00 26.46 O ATOM 523 HA TYR A 36 28.306 2.788 -14.188 1.00 0.00 H ATOM 524 HB3 TYR A 36 26.757 1.019 -13.492 1.00 0.00 H ATOM 525 HB2 TYR A 36 27.578 0.639 -15.023 1.00 0.00 H ATOM 526 HD2 TYR A 36 26.234 0.816 -17.204 1.00 0.00 H ATOM 527 HE2 TYR A 36 24.042 0.219 -18.219 1.00 0.00 H ATOM 528 HE1 TYR A 36 22.232 0.285 -14.330 1.00 0.00 H ATOM 529 HD1 TYR A 36 24.422 0.884 -13.323 1.00 0.00 H ATOM 530 HH TYR A 36 21.842 -0.999 -17.306 1.00 0.00 H ATOM 531 H TYR A 36 25.610 4.013 -14.290 1.00 0.00 H ATOM 532 N GLN A 37 28.620 2.681 -16.669 1.00 11.94 N ATOM 533 CA GLN A 37 29.023 3.013 -18.020 1.00 18.02 C ATOM 534 C GLN A 37 28.816 1.783 -18.894 1.00 23.91 C ATOM 535 O GLN A 37 29.325 0.713 -18.576 1.00 21.73 O ATOM 536 CB GLN A 37 30.497 3.353 -18.003 1.00 18.77 C ATOM 537 CG GLN A 37 31.077 3.678 -19.374 1.00 26.92 C ATOM 538 CD GLN A 37 32.583 3.807 -19.325 1.00 35.89 C ATOM 539 OE1 GLN A 37 33.283 2.892 -18.870 1.00 29.05 O ATOM 540 NE2 GLN A 37 33.094 4.952 -19.775 1.00 32.87 N ATOM 541 HA GLN A 37 28.444 3.853 -18.403 1.00 0.00 H ATOM 542 HB2 GLN A 37 30.641 4.218 -17.356 1.00 0.00 H ATOM 543 HB3 GLN A 37 31.040 2.501 -17.595 1.00 0.00 H ATOM 544 HG2 GLN A 37 30.812 2.881 -20.068 1.00 0.00 H ATOM 545 HG3 GLN A 37 30.652 4.619 -19.724 1.00 0.00 H ATOM 546 HE22 GLN A 37 32.465 5.691 -20.148 1.00 0.00 H ATOM 547 HE21 GLN A 37 34.122 5.107 -19.753 1.00 0.00 H ATOM 548 H GLN A 37 29.219 2.033 -16.119 1.00 0.00 H ATOM 549 N GLN A 38 28.079 1.927 -19.984 1.00 18.38 N ATOM 550 CA GLN A 38 27.822 0.782 -20.844 1.00 22.80 C ATOM 551 C GLN A 38 28.254 1.065 -22.271 1.00 27.65 C ATOM 552 O GLN A 38 27.770 2.011 -22.890 1.00 22.56 O ATOM 553 CB GLN A 38 26.341 0.414 -20.844 1.00 22.62 C ATOM 554 CG GLN A 38 26.062 -0.924 -21.550 1.00 24.52 C ATOM 555 CD GLN A 38 24.616 -1.310 -21.506 1.00 31.83 C ATOM 556 OE1 GLN A 38 24.199 -2.281 -22.142 1.00 46.21 O ATOM 557 NE2 GLN A 38 23.826 -0.554 -20.760 1.00 30.66 N ATOM 558 HA GLN A 38 28.401 -0.051 -20.447 1.00 0.00 H ATOM 559 HB2 GLN A 38 25.999 0.342 -19.811 1.00 0.00 H ATOM 560 HB3 GLN A 38 25.786 1.201 -21.355 1.00 0.00 H ATOM 561 HG2 GLN A 38 26.369 -0.839 -22.592 1.00 0.00 H ATOM 562 HG3 GLN A 38 26.647 -1.704 -21.063 1.00 0.00 H ATOM 563 HE22 GLN A 38 24.221 0.256 -20.240 1.00 0.00 H ATOM 564 HE21 GLN A 38 22.811 -0.770 -20.694 1.00 0.00 H ATOM 565 H GLN A 38 27.684 2.858 -20.226 1.00 0.00 H ATOM 566 N PHE A 39 29.174 0.249 -22.779 1.00 23.28 N ATOM 567 CA PHE A 39 29.507 0.249 -24.202 1.00 29.06 C ATOM 568 C PHE A 39 28.596 -0.750 -24.905 1.00 31.72 C ATOM 569 O PHE A 39 28.078 -1.681 -24.278 1.00 27.82 O ATOM 570 CB PHE A 39 30.972 -0.137 -24.424 1.00 32.07 C ATOM 571 CG PHE A 39 31.961 0.832 -23.815 1.00 34.24 C ATOM 572 CD1 PHE A 39 32.266 2.023 -24.448 1.00 33.88 C ATOM 573 CD2 PHE A 39 32.596 0.536 -22.626 1.00 33.93 C ATOM 574 CE1 PHE A 39 33.179 2.907 -23.906 1.00 36.50 C ATOM 575 CE2 PHE A 39 33.513 1.420 -22.069 1.00 39.41 C ATOM 576 CZ PHE A 39 33.803 2.611 -22.713 1.00 34.46 C ATOM 577 HA PHE A 39 29.362 1.250 -24.607 1.00 0.00 H ATOM 578 HB2 PHE A 39 31.139 -1.120 -23.983 1.00 0.00 H ATOM 579 HB3 PHE A 39 31.155 -0.186 -25.497 1.00 0.00 H ATOM 580 HD2 PHE A 39 32.376 -0.403 -22.117 1.00 0.00 H ATOM 581 HE2 PHE A 39 34.003 1.176 -21.126 1.00 0.00 H ATOM 582 HZ PHE A 39 34.519 3.309 -22.280 1.00 0.00 H ATOM 583 HE1 PHE A 39 33.406 3.840 -24.422 1.00 0.00 H ATOM 584 HD1 PHE A 39 31.778 2.269 -25.391 1.00 0.00 H ATOM 585 H PHE A 39 29.671 -0.408 -22.145 1.00 0.00 H ATOM 586 N PRO A 40 28.385 -0.566 -26.211 1.00 24.14 N ATOM 587 CA PRO A 40 27.524 -1.529 -26.900 1.00 26.73 C ATOM 588 C PRO A 40 28.057 -2.956 -26.748 1.00 24.91 C ATOM 589 O PRO A 40 29.256 -3.186 -26.905 1.00 33.14 O ATOM 590 CB PRO A 40 27.604 -1.077 -28.360 1.00 34.94 C ATOM 591 CG PRO A 40 27.901 0.383 -28.274 1.00 34.97 C ATOM 592 CD PRO A 40 28.826 0.523 -27.098 1.00 33.05 C ATOM 593 HA PRO A 40 26.508 -1.551 -26.505 1.00 0.00 H ATOM 594 HD3 PRO A 40 29.866 0.391 -27.397 1.00 0.00 H ATOM 595 HD2 PRO A 40 28.708 1.494 -26.618 1.00 0.00 H ATOM 596 HG3 PRO A 40 26.985 0.952 -28.112 1.00 0.00 H ATOM 597 HG2 PRO A 40 28.386 0.730 -29.187 1.00 0.00 H ATOM 598 HB2 PRO A 40 28.401 -1.604 -28.885 1.00 0.00 H ATOM 599 HB3 PRO A 40 26.657 -1.250 -28.871 1.00 0.00 H ATOM 600 N GLY A 41 27.173 -3.888 -26.419 1.00 29.48 N ATOM 601 CA GLY A 41 27.504 -5.299 -26.416 1.00 37.72 C ATOM 602 C GLY A 41 28.382 -5.796 -25.279 1.00 40.95 C ATOM 603 O GLY A 41 28.727 -6.982 -25.250 1.00 38.59 O ATOM 604 HA3 GLY A 41 28.019 -5.519 -27.351 1.00 0.00 H ATOM 605 HA2 GLY A 41 26.568 -5.857 -26.378 1.00 0.00 H ATOM 606 H GLY A 41 26.210 -3.597 -26.154 1.00 0.00 H ATOM 607 N THR A 42 28.764 -4.927 -24.345 1.00 32.63 N ATOM 608 CA THR A 42 29.537 -5.421 -23.207 1.00 29.12 C ATOM 609 C THR A 42 28.924 -5.132 -21.846 1.00 30.00 C ATOM 610 O THR A 42 28.017 -4.308 -21.714 1.00 20.67 O ATOM 611 CB THR A 42 31.014 -4.962 -23.217 1.00 35.09 C ATOM 612 OG1 THR A 42 31.082 -3.535 -23.294 1.00 35.78 O ATOM 613 CG2 THR A 42 31.774 -5.588 -24.393 1.00 42.03 C ATOM 614 HA THR A 42 29.507 -6.501 -23.351 1.00 0.00 H ATOM 615 HB THR A 42 31.483 -5.295 -22.291 1.00 0.00 H ATOM 616 HG1 THR A 42 30.623 -3.141 -22.510 1.00 0.00 H ATOM 617 HG23 THR A 42 31.716 -6.674 -24.325 1.00 0.00 H ATOM 618 HG21 THR A 42 31.327 -5.257 -25.330 1.00 0.00 H ATOM 619 HG22 THR A 42 32.818 -5.276 -24.357 1.00 0.00 H ATOM 620 H THR A 42 28.518 -3.920 -24.423 1.00 0.00 H ATOM 621 N THR A 43 29.443 -5.842 -20.849 1.00 28.14 N ATOM 622 CA THR A 43 29.002 -5.736 -19.477 1.00 24.25 C ATOM 623 C THR A 43 29.274 -4.311 -18.981 1.00 24.58 C ATOM 624 O THR A 43 30.341 -3.757 -19.234 1.00 24.28 O ATOM 625 CB THR A 43 29.784 -6.738 -18.597 1.00 28.19 C ATOM 626 OG1 THR A 43 29.504 -8.076 -19.029 1.00 34.81 O ATOM 627 CG2 THR A 43 29.383 -6.606 -17.128 1.00 26.70 C ATOM 628 HA THR A 43 27.937 -5.960 -19.416 1.00 0.00 H ATOM 629 HB THR A 43 30.847 -6.519 -18.697 1.00 0.00 H ATOM 630 HG1 THR A 43 30.006 -8.716 -18.464 1.00 0.00 H ATOM 631 HG23 THR A 43 29.591 -5.592 -16.786 1.00 0.00 H ATOM 632 HG21 THR A 43 28.318 -6.815 -17.023 1.00 0.00 H ATOM 633 HG22 THR A 43 29.955 -7.317 -16.531 1.00 0.00 H ATOM 634 H THR A 43 30.209 -6.511 -21.069 1.00 0.00 H ATOM 635 N PRO A 44 28.305 -3.718 -18.274 1.00 22.75 N ATOM 636 CA PRO A 44 28.484 -2.395 -17.668 1.00 24.20 C ATOM 637 C PRO A 44 29.677 -2.362 -16.719 1.00 23.14 C ATOM 638 O PRO A 44 30.071 -3.392 -16.161 1.00 21.76 O ATOM 639 CB PRO A 44 27.179 -2.202 -16.876 1.00 23.80 C ATOM 640 CG PRO A 44 26.179 -2.983 -17.640 1.00 25.53 C ATOM 641 CD PRO A 44 26.926 -4.206 -18.124 1.00 19.58 C ATOM 642 HA PRO A 44 28.677 -1.620 -18.410 1.00 0.00 H ATOM 643 HD3 PRO A 44 26.873 -5.012 -17.392 1.00 0.00 H ATOM 644 HD2 PRO A 44 26.529 -4.556 -19.077 1.00 0.00 H ATOM 645 HG3 PRO A 44 25.803 -2.404 -18.484 1.00 0.00 H ATOM 646 HG2 PRO A 44 25.346 -3.271 -16.999 1.00 0.00 H ATOM 647 HB2 PRO A 44 27.280 -2.588 -15.862 1.00 0.00 H ATOM 648 HB3 PRO A 44 26.901 -1.149 -16.837 1.00 0.00 H ATOM 649 N LYS A 45 30.260 -1.182 -16.563 1.00 23.95 N ATOM 650 CA LYS A 45 31.239 -0.951 -15.522 1.00 20.24 C ATOM 651 C LYS A 45 30.636 0.030 -14.517 1.00 22.60 C ATOM 652 O LYS A 45 30.217 1.123 -14.898 1.00 18.56 O ATOM 653 CB LYS A 45 32.498 -0.327 -16.125 1.00 29.99 C ATOM 654 CG LYS A 45 33.459 0.243 -15.081 1.00 36.67 C ATOM 655 CD LYS A 45 34.666 0.905 -15.745 1.00 48.07 C ATOM 656 CE LYS A 45 35.611 -0.135 -16.321 1.00 52.77 C ATOM 657 NZ LYS A 45 36.778 0.512 -16.979 1.00 66.99 N ATOM 658 HA LYS A 45 31.501 -1.893 -15.040 1.00 0.00 H ATOM 659 HB2 LYS A 45 33.023 -1.093 -16.695 1.00 0.00 H ATOM 660 HB3 LYS A 45 32.197 0.480 -16.793 1.00 0.00 H ATOM 661 HG2 LYS A 45 32.933 0.984 -14.480 1.00 0.00 H ATOM 662 HG3 LYS A 45 33.806 -0.565 -14.437 1.00 0.00 H ATOM 663 HD2 LYS A 45 34.319 1.555 -16.548 1.00 0.00 H ATOM 664 HD3 LYS A 45 35.199 1.499 -15.003 1.00 0.00 H ATOM 665 HE2 LYS A 45 35.075 -0.736 -17.056 1.00 0.00 H ATOM 666 HE3 LYS A 45 35.967 -0.779 -15.516 1.00 0.00 H ATOM 667 HZ1 LYS A 45 36.444 1.124 -17.751 1.00 0.00 H ATOM 668 HZ2 LYS A 45 37.295 1.083 -16.281 1.00 0.00 H ATOM 669 HZ3 LYS A 45 37.408 -0.221 -17.364 1.00 0.00 H ATOM 670 H LYS A 45 30.008 -0.403 -17.204 1.00 0.00 H ATOM 671 N VAL A 46 30.589 -0.347 -13.246 1.00 18.81 N ATOM 672 CA VAL A 46 30.093 0.565 -12.215 1.00 17.92 C ATOM 673 C VAL A 46 31.103 1.687 -12.006 1.00 19.63 C ATOM 674 O VAL A 46 32.269 1.423 -11.725 1.00 24.14 O ATOM 675 CB VAL A 46 29.869 -0.152 -10.872 1.00 18.04 C ATOM 676 CG1 VAL A 46 29.441 0.851 -9.815 1.00 15.44 C ATOM 677 CG2 VAL A 46 28.816 -1.243 -11.040 1.00 21.11 C ATOM 678 HA VAL A 46 29.136 0.960 -12.556 1.00 0.00 H ATOM 679 HB VAL A 46 30.801 -0.616 -10.549 1.00 0.00 H ATOM 680 HG11 VAL A 46 30.219 1.605 -9.695 1.00 0.00 H ATOM 681 HG12 VAL A 46 28.513 1.331 -10.126 1.00 0.00 H ATOM 682 HG13 VAL A 46 29.285 0.335 -8.868 1.00 0.00 H ATOM 683 HG21 VAL A 46 27.879 -0.794 -11.371 1.00 0.00 H ATOM 684 HG22 VAL A 46 29.157 -1.964 -11.783 1.00 0.00 H ATOM 685 HG23 VAL A 46 28.662 -1.747 -10.086 1.00 0.00 H ATOM 686 H VAL A 46 30.908 -1.300 -12.980 1.00 0.00 H ATOM 687 N LEU A 47 30.653 2.935 -12.141 1.00 15.70 N ATOM 688 CA LEU A 47 31.522 4.105 -11.969 1.00 17.99 C ATOM 689 C LEU A 47 31.379 4.697 -10.572 1.00 23.28 C ATOM 690 O LEU A 47 32.334 5.227 -10.025 1.00 20.23 O ATOM 691 CB LEU A 47 31.161 5.194 -12.979 1.00 21.41 C ATOM 692 CG LEU A 47 31.285 4.872 -14.466 1.00 23.52 C ATOM 693 CD1 LEU A 47 30.891 6.091 -15.313 1.00 25.35 C ATOM 694 CD2 LEU A 47 32.687 4.424 -14.792 1.00 29.54 C ATOM 695 HA LEU A 47 32.547 3.768 -12.123 1.00 0.00 H ATOM 696 HB2 LEU A 47 30.124 5.474 -12.795 1.00 0.00 H ATOM 697 HB3 LEU A 47 31.808 6.048 -12.778 1.00 0.00 H ATOM 698 HG LEU A 47 30.602 4.056 -14.704 1.00 0.00 H ATOM 699 HD21 LEU A 47 33.389 5.219 -14.541 1.00 0.00 H ATOM 700 HD22 LEU A 47 32.925 3.531 -14.214 1.00 0.00 H ATOM 701 HD23 LEU A 47 32.757 4.199 -15.856 1.00 0.00 H ATOM 702 HD11 LEU A 47 29.859 6.366 -15.094 1.00 0.00 H ATOM 703 HD12 LEU A 47 31.550 6.926 -15.074 1.00 0.00 H ATOM 704 HD13 LEU A 47 30.985 5.843 -16.370 1.00 0.00 H ATOM 705 H LEU A 47 29.651 3.084 -12.376 1.00 0.00 H ATOM 706 N ILE A 48 30.168 4.621 -10.018 1.00 19.98 N ATOM 707 CA ILE A 48 29.835 5.294 -8.765 1.00 18.74 C ATOM 708 C ILE A 48 28.825 4.459 -8.007 1.00 21.22 C ATOM 709 O ILE A 48 27.840 4.023 -8.581 1.00 16.85 O ATOM 710 CB ILE A 48 29.212 6.721 -9.030 1.00 16.91 C ATOM 711 CG1 ILE A 48 30.227 7.655 -9.680 1.00 17.58 C ATOM 712 CG2 ILE A 48 28.693 7.335 -7.733 1.00 19.95 C ATOM 713 CD1 ILE A 48 31.320 8.124 -8.717 1.00 24.27 C ATOM 714 HA ILE A 48 30.752 5.414 -8.188 1.00 0.00 H ATOM 715 HB ILE A 48 28.376 6.592 -9.717 1.00 0.00 H ATOM 716 HG12 ILE A 48 30.699 7.130 -10.510 1.00 0.00 H ATOM 717 HG13 ILE A 48 29.699 8.531 -10.058 1.00 0.00 H ATOM 718 HD11 ILE A 48 30.864 8.661 -7.885 1.00 0.00 H ATOM 719 HD12 ILE A 48 31.864 7.259 -8.338 1.00 0.00 H ATOM 720 HD13 ILE A 48 32.008 8.785 -9.244 1.00 0.00 H ATOM 721 HG21 ILE A 48 27.925 6.689 -7.309 1.00 0.00 H ATOM 722 HG22 ILE A 48 29.516 7.436 -7.026 1.00 0.00 H ATOM 723 HG23 ILE A 48 28.269 8.317 -7.942 1.00 0.00 H ATOM 724 H ILE A 48 29.433 4.062 -10.496 1.00 0.00 H ATOM 725 N TYR A 49 29.061 4.226 -6.716 1.00 15.37 N ATOM 726 CA TYR A 49 28.055 3.594 -5.876 1.00 18.44 C ATOM 727 C TYR A 49 27.816 4.454 -4.626 1.00 19.38 C ATOM 728 O TYR A 49 28.658 5.265 -4.270 1.00 18.82 O ATOM 729 CB TYR A 49 28.490 2.173 -5.496 1.00 18.67 C ATOM 730 CG TYR A 49 29.737 2.146 -4.650 1.00 22.38 C ATOM 731 CD1 TYR A 49 30.997 2.190 -5.231 1.00 24.13 C ATOM 732 CD2 TYR A 49 29.652 2.077 -3.262 1.00 28.78 C ATOM 733 CE1 TYR A 49 32.146 2.176 -4.452 1.00 28.35 C ATOM 734 CE2 TYR A 49 30.790 2.065 -2.477 1.00 32.53 C ATOM 735 CZ TYR A 49 32.035 2.106 -3.073 1.00 33.92 C ATOM 736 OH TYR A 49 33.180 2.090 -2.289 1.00 34.44 O ATOM 737 HA TYR A 49 27.119 3.516 -6.429 1.00 0.00 H ATOM 738 HB3 TYR A 49 28.678 1.611 -6.411 1.00 0.00 H ATOM 739 HB2 TYR A 49 27.682 1.699 -4.939 1.00 0.00 H ATOM 740 HD2 TYR A 49 28.672 2.032 -2.786 1.00 0.00 H ATOM 741 HE2 TYR A 49 30.705 2.023 -1.391 1.00 0.00 H ATOM 742 HE1 TYR A 49 33.128 2.220 -4.922 1.00 0.00 H ATOM 743 HD1 TYR A 49 31.086 2.236 -6.316 1.00 0.00 H ATOM 744 HH TYR A 49 33.979 2.124 -2.873 1.00 0.00 H ATOM 745 H TYR A 49 29.976 4.499 -6.304 1.00 0.00 H ATOM 746 N ASN A 50 26.660 4.302 -3.992 1.00 17.94 N ATOM 747 CA ASN A 50 26.366 5.045 -2.771 1.00 21.99 C ATOM 748 C ASN A 50 26.541 6.551 -2.966 1.00 22.51 C ATOM 749 O ASN A 50 27.196 7.214 -2.164 1.00 22.91 O ATOM 750 CB ASN A 50 27.267 4.539 -1.625 1.00 26.59 C ATOM 751 CG ASN A 50 26.957 3.089 -1.239 1.00 31.07 C ATOM 752 OD1 ASN A 50 26.055 2.471 -1.809 1.00 28.14 O ATOM 753 ND2 ASN A 50 27.690 2.549 -0.259 1.00 31.93 N ATOM 754 HA ASN A 50 25.321 4.873 -2.514 1.00 0.00 H ATOM 755 HB2 ASN A 50 28.308 4.603 -1.943 1.00 0.00 H ATOM 756 HB3 ASN A 50 27.115 5.174 -0.753 1.00 0.00 H ATOM 757 HD22 ASN A 50 28.442 3.106 0.195 1.00 0.00 H ATOM 758 HD21 ASN A 50 27.508 1.572 0.049 1.00 0.00 H ATOM 759 H ASN A 50 25.952 3.642 -4.372 1.00 0.00 H ATOM 760 N ASP A 51 25.995 7.070 -4.062 1.00 18.73 N ATOM 761 CA ASP A 51 25.996 8.508 -4.372 1.00 20.32 C ATOM 762 C ASP A 51 27.313 9.070 -4.899 1.00 17.72 C ATOM 763 O ASP A 51 27.314 9.809 -5.892 1.00 17.81 O ATOM 764 CB ASP A 51 25.573 9.362 -3.162 1.00 21.65 C ATOM 765 CG ASP A 51 24.146 9.113 -2.716 1.00 25.42 C ATOM 766 OD1 ASP A 51 23.346 8.518 -3.466 1.00 24.68 O ATOM 767 OD2 ASP A 51 23.804 9.537 -1.589 1.00 30.96 O ATOM 768 HA ASP A 51 25.267 8.576 -5.179 1.00 0.00 H ATOM 769 HB2 ASP A 51 26.239 9.136 -2.330 1.00 0.00 H ATOM 770 HB3 ASP A 51 25.673 10.414 -3.430 1.00 0.00 H ATOM 771 H ASP A 51 25.542 6.423 -4.738 1.00 0.00 H ATOM 772 N ASP A 52 28.420 8.780 -4.213 1.00 15.67 N ATOM 773 CA ASP A 52 29.661 9.528 -4.440 1.00 21.73 C ATOM 774 C ASP A 52 30.943 8.700 -4.345 1.00 19.61 C ATOM 775 O ASP A 52 32.043 9.246 -4.434 1.00 23.11 O ATOM 776 CB ASP A 52 29.756 10.721 -3.462 1.00 19.68 C ATOM 777 CG ASP A 52 29.695 10.295 -1.993 1.00 27.96 C ATOM 778 OD1 ASP A 52 29.763 9.088 -1.695 1.00 23.58 O ATOM 779 OD2 ASP A 52 29.588 11.181 -1.120 1.00 28.32 O ATOM 780 HA ASP A 52 29.596 9.868 -5.474 1.00 0.00 H ATOM 781 HB2 ASP A 52 30.700 11.239 -3.635 1.00 0.00 H ATOM 782 HB3 ASP A 52 28.928 11.401 -3.662 1.00 0.00 H ATOM 783 H ASP A 52 28.403 8.015 -3.509 1.00 0.00 H ATOM 784 N ARG A 53 30.800 7.389 -4.189 1.00 20.55 N ATOM 785 CA ARG A 53 31.963 6.512 -4.046 1.00 27.04 C ATOM 786 C ARG A 53 32.418 5.941 -5.390 1.00 26.98 C ATOM 787 O ARG A 53 31.615 5.384 -6.142 1.00 19.97 O ATOM 788 CB ARG A 53 31.656 5.365 -3.076 1.00 24.79 C ATOM 789 CG ARG A 53 30.995 5.787 -1.782 1.00 29.72 C ATOM 790 CD ARG A 53 31.956 6.541 -0.869 1.00 45.46 C ATOM 791 NE ARG A 53 33.207 5.807 -0.674 1.00 56.95 N ATOM 792 CZ ARG A 53 33.361 4.781 0.163 1.00 66.89 C ATOM 793 NH1 ARG A 53 32.334 4.348 0.891 1.00 62.19 N ATOM 794 NH2 ARG A 53 34.543 4.182 0.268 1.00 64.34 N ATOM 795 HA ARG A 53 32.775 7.120 -3.646 1.00 0.00 H ATOM 796 HB2 ARG A 53 30.994 4.661 -3.581 1.00 0.00 H ATOM 797 HB3 ARG A 53 32.594 4.868 -2.831 1.00 0.00 H ATOM 798 HG2 ARG A 53 30.149 6.434 -2.013 1.00 0.00 H ATOM 799 HG3 ARG A 53 30.640 4.898 -1.262 1.00 0.00 H ATOM 800 HD2 ARG A 53 31.479 6.690 0.100 1.00 0.00 H ATOM 801 HD3 ARG A 53 32.181 7.510 -1.315 1.00 0.00 H ATOM 802 HE ARG A 53 34.035 6.107 -1.228 1.00 0.00 H ATOM 803 HH12 ARG A 53 32.459 3.547 1.543 1.00 0.00 H ATOM 804 HH11 ARG A 53 31.406 4.811 0.808 1.00 0.00 H ATOM 805 HH22 ARG A 53 34.664 3.381 0.921 1.00 0.00 H ATOM 806 HH21 ARG A 53 35.347 4.514 -0.303 1.00 0.00 H ATOM 807 H ARG A 53 29.845 6.978 -4.168 1.00 0.00 H ATOM 808 N ARG A 54 33.711 6.072 -5.674 1.00 15.84 N ATOM 809 CA ARG A 54 34.286 5.616 -6.931 1.00 19.97 C ATOM 810 C ARG A 54 35.134 4.376 -6.677 1.00 29.04 C ATOM 811 O ARG A 54 36.088 4.430 -5.881 1.00 28.54 O ATOM 812 CB ARG A 54 35.136 6.719 -7.561 1.00 17.84 C ATOM 813 CG ARG A 54 35.761 6.350 -8.889 1.00 20.52 C ATOM 814 CD ARG A 54 36.544 7.520 -9.471 1.00 27.90 C ATOM 815 NE ARG A 54 37.560 8.016 -8.539 1.00 32.36 N ATOM 816 CZ ARG A 54 37.801 9.303 -8.283 1.00 38.85 C ATOM 817 NH1 ARG A 54 37.096 10.262 -8.873 1.00 28.60 N ATOM 818 NH2 ARG A 54 38.757 9.637 -7.423 1.00 42.77 N ATOM 819 HA ARG A 54 33.482 5.368 -7.624 1.00 0.00 H ATOM 820 HB2 ARG A 54 34.502 7.592 -7.714 1.00 0.00 H ATOM 821 HB3 ARG A 54 35.937 6.971 -6.866 1.00 0.00 H ATOM 822 HG2 ARG A 54 36.436 5.507 -8.743 1.00 0.00 H ATOM 823 HG3 ARG A 54 34.973 6.066 -9.587 1.00 0.00 H ATOM 824 HD2 ARG A 54 35.851 8.329 -9.700 1.00 0.00 H ATOM 825 HD3 ARG A 54 37.036 7.194 -10.388 1.00 0.00 H ATOM 826 HE ARG A 54 38.138 7.311 -8.039 1.00 0.00 H ATOM 827 HH12 ARG A 54 37.297 11.260 -8.662 1.00 0.00 H ATOM 828 HH11 ARG A 54 36.343 10.015 -9.546 1.00 0.00 H ATOM 829 HH22 ARG A 54 38.948 10.639 -7.221 1.00 0.00 H ATOM 830 HH21 ARG A 54 39.315 8.896 -6.952 1.00 0.00 H ATOM 831 H ARG A 54 34.335 6.517 -4.971 1.00 0.00 H ATOM 832 N PRO A 55 34.765 3.246 -7.318 1.00 22.73 N ATOM 833 CA PRO A 55 35.538 2.003 -7.181 1.00 27.51 C ATOM 834 C PRO A 55 36.988 2.235 -7.579 1.00 32.09 C ATOM 835 O PRO A 55 37.272 3.043 -8.468 1.00 33.04 O ATOM 836 CB PRO A 55 34.878 1.062 -8.193 1.00 23.99 C ATOM 837 CG PRO A 55 33.478 1.533 -8.290 1.00 22.71 C ATOM 838 CD PRO A 55 33.565 3.060 -8.160 1.00 21.31 C ATOM 839 HA PRO A 55 35.542 1.618 -6.161 1.00 0.00 H ATOM 840 HD3 PRO A 55 33.691 3.531 -9.135 1.00 0.00 H ATOM 841 HD2 PRO A 55 32.677 3.465 -7.674 1.00 0.00 H ATOM 842 HG3 PRO A 55 32.875 1.113 -7.485 1.00 0.00 H ATOM 843 HG2 PRO A 55 33.045 1.254 -9.250 1.00 0.00 H ATOM 844 HB2 PRO A 55 35.374 1.130 -9.161 1.00 0.00 H ATOM 845 HB3 PRO A 55 34.913 0.032 -7.839 1.00 0.00 H ATOM 846 N SER A 56 37.915 1.553 -6.920 1.00 34.25 N ATOM 847 CA SER A 56 39.297 1.638 -7.352 1.00 44.69 C ATOM 848 C SER A 56 39.347 1.034 -8.746 1.00 37.95 C ATOM 849 O SER A 56 38.745 -0.015 -8.998 1.00 47.75 O ATOM 850 CB SER A 56 40.206 0.861 -6.409 1.00 55.97 C ATOM 851 OG SER A 56 39.902 -0.516 -6.431 1.00 52.59 O ATOM 852 HA SER A 56 39.643 2.672 -7.352 1.00 0.00 H ATOM 853 HB2 SER A 56 40.074 1.239 -5.395 1.00 0.00 H ATOM 854 HB3 SER A 56 41.242 1.002 -6.716 1.00 0.00 H ATOM 855 HG SER A 56 40.025 -0.865 -7.349 1.00 0.00 H ATOM 856 H SER A 56 37.654 0.964 -6.103 1.00 0.00 H ATOM 857 N GLY A 57 40.036 1.691 -9.665 1.00 38.14 N ATOM 858 CA GLY A 57 40.079 1.173 -11.019 1.00 46.21 C ATOM 859 C GLY A 57 39.301 2.035 -11.995 1.00 40.55 C ATOM 860 O GLY A 57 39.592 2.038 -13.190 1.00 40.78 O ATOM 861 HA3 GLY A 57 39.654 0.169 -11.023 1.00 0.00 H ATOM 862 HA2 GLY A 57 41.119 1.128 -11.344 1.00 0.00 H ATOM 863 H GLY A 57 40.540 2.567 -9.420 1.00 0.00 H ATOM 864 N VAL A 58 38.309 2.765 -11.492 1.00 30.62 N ATOM 865 CA VAL A 58 37.633 3.759 -12.306 1.00 31.47 C ATOM 866 C VAL A 58 38.545 4.999 -12.361 1.00 33.53 C ATOM 867 O VAL A 58 39.057 5.431 -11.335 1.00 29.16 O ATOM 868 CB VAL A 58 36.246 4.087 -11.731 1.00 24.56 C ATOM 869 CG1 VAL A 58 35.564 5.202 -12.535 1.00 16.75 C ATOM 870 CG2 VAL A 58 35.381 2.835 -11.736 1.00 23.43 C ATOM 871 HA VAL A 58 37.459 3.385 -13.315 1.00 0.00 H ATOM 872 HB VAL A 58 36.371 4.439 -10.707 1.00 0.00 H ATOM 873 HG11 VAL A 58 36.178 6.102 -12.500 1.00 0.00 H ATOM 874 HG12 VAL A 58 35.446 4.882 -13.570 1.00 0.00 H ATOM 875 HG13 VAL A 58 34.585 5.412 -12.104 1.00 0.00 H ATOM 876 HG21 VAL A 58 35.273 2.474 -12.759 1.00 0.00 H ATOM 877 HG22 VAL A 58 35.854 2.066 -11.125 1.00 0.00 H ATOM 878 HG23 VAL A 58 34.399 3.072 -11.328 1.00 0.00 H ATOM 879 H VAL A 58 38.015 2.622 -10.505 1.00 0.00 H ATOM 880 N PRO A 59 38.767 5.545 -13.568 1.00 28.67 N ATOM 881 CA PRO A 59 39.628 6.718 -13.757 1.00 32.61 C ATOM 882 C PRO A 59 39.153 7.894 -12.909 1.00 36.81 C ATOM 883 O PRO A 59 37.945 8.090 -12.720 1.00 23.39 O ATOM 884 CB PRO A 59 39.460 7.048 -15.243 1.00 36.71 C ATOM 885 CG PRO A 59 39.105 5.749 -15.886 1.00 38.85 C ATOM 886 CD PRO A 59 38.272 5.010 -14.851 1.00 28.49 C ATOM 887 HA PRO A 59 40.660 6.527 -13.464 1.00 0.00 H ATOM 888 HD3 PRO A 59 37.211 5.223 -14.979 1.00 0.00 H ATOM 889 HD2 PRO A 59 38.435 3.934 -14.914 1.00 0.00 H ATOM 890 HG3 PRO A 59 40.004 5.183 -16.129 1.00 0.00 H ATOM 891 HG2 PRO A 59 38.527 5.917 -16.795 1.00 0.00 H ATOM 892 HB2 PRO A 59 38.663 7.778 -15.387 1.00 0.00 H ATOM 893 HB3 PRO A 59 40.389 7.440 -15.657 1.00 0.00 H ATOM 894 N ASP A 60 40.103 8.680 -12.417 1.00 32.27 N ATOM 895 CA ASP A 60 39.802 9.745 -11.461 1.00 37.69 C ATOM 896 C ASP A 60 39.020 10.901 -12.067 1.00 27.60 C ATOM 897 O ASP A 60 38.566 11.786 -11.341 1.00 30.47 O ATOM 898 CB ASP A 60 41.087 10.274 -10.797 1.00 44.00 C ATOM 899 CG ASP A 60 41.590 9.364 -9.676 1.00 59.04 C ATOM 900 OD1 ASP A 60 40.880 8.389 -9.331 1.00 53.14 O ATOM 901 OD2 ASP A 60 42.692 9.629 -9.132 1.00 63.14 O ATOM 902 HA ASP A 60 39.162 9.289 -10.706 1.00 0.00 H ATOM 903 HB2 ASP A 60 41.865 10.354 -11.557 1.00 0.00 H ATOM 904 HB3 ASP A 60 40.884 11.261 -10.381 1.00 0.00 H ATOM 905 H ASP A 60 41.087 8.535 -12.719 1.00 0.00 H ATOM 906 N ARG A 61 38.859 10.912 -13.386 1.00 24.76 N ATOM 907 CA ARG A 61 38.083 11.976 -14.006 1.00 25.41 C ATOM 908 C ARG A 61 36.575 11.838 -13.791 1.00 20.39 C ATOM 909 O ARG A 61 35.827 12.762 -14.112 1.00 21.55 O ATOM 910 CB ARG A 61 38.393 12.111 -15.503 1.00 28.45 C ATOM 911 CG ARG A 61 37.916 10.959 -16.364 1.00 30.39 C ATOM 912 CD ARG A 61 38.308 11.225 -17.810 1.00 35.66 C ATOM 913 NE ARG A 61 38.195 10.040 -18.648 1.00 38.16 N ATOM 914 CZ ARG A 61 39.102 9.070 -18.699 1.00 47.58 C ATOM 915 NH1 ARG A 61 40.201 9.132 -17.944 1.00 44.45 N ATOM 916 NH2 ARG A 61 38.905 8.030 -19.501 1.00 41.95 N ATOM 917 HA ARG A 61 38.395 12.888 -13.497 1.00 0.00 H ATOM 918 HB2 ARG A 61 37.919 13.023 -15.866 1.00 0.00 H ATOM 919 HB3 ARG A 61 39.474 12.194 -15.618 1.00 0.00 H ATOM 920 HG2 ARG A 61 38.379 10.032 -16.024 1.00 0.00 H ATOM 921 HG3 ARG A 61 36.832 10.871 -16.289 1.00 0.00 H ATOM 922 HD2 ARG A 61 39.341 11.572 -17.834 1.00 0.00 H ATOM 923 HD3 ARG A 61 37.656 12.000 -18.212 1.00 0.00 H ATOM 924 HE ARG A 61 37.349 9.946 -19.246 1.00 0.00 H ATOM 925 HH12 ARG A 61 40.907 8.369 -17.989 1.00 0.00 H ATOM 926 HH11 ARG A 61 40.352 9.943 -17.311 1.00 0.00 H ATOM 927 HH22 ARG A 61 39.610 7.267 -19.546 1.00 0.00 H ATOM 928 HH21 ARG A 61 38.045 7.978 -20.084 1.00 0.00 H ATOM 929 H ARG A 61 39.285 10.165 -13.971 1.00 0.00 H ATOM 930 N PHE A 62 36.133 10.691 -13.274 1.00 28.62 N ATOM 931 CA PHE A 62 34.708 10.455 -12.974 1.00 23.70 C ATOM 932 C PHE A 62 34.399 10.725 -11.504 1.00 17.57 C ATOM 933 O PHE A 62 35.098 10.237 -10.642 1.00 20.29 O ATOM 934 CB PHE A 62 34.325 9.001 -13.291 1.00 20.15 C ATOM 935 CG PHE A 62 34.384 8.660 -14.765 1.00 21.99 C ATOM 936 CD1 PHE A 62 33.338 8.991 -15.603 1.00 23.87 C ATOM 937 CD2 PHE A 62 35.490 8.018 -15.301 1.00 29.08 C ATOM 938 CE1 PHE A 62 33.388 8.682 -16.963 1.00 25.70 C ATOM 939 CE2 PHE A 62 35.553 7.706 -16.653 1.00 33.70 C ATOM 940 CZ PHE A 62 34.498 8.038 -17.489 1.00 27.53 C ATOM 941 HA PHE A 62 34.131 11.139 -13.596 1.00 0.00 H ATOM 942 HB2 PHE A 62 35.009 8.341 -12.758 1.00 0.00 H ATOM 943 HB3 PHE A 62 33.308 8.829 -12.939 1.00 0.00 H ATOM 944 HD2 PHE A 62 36.324 7.754 -14.651 1.00 0.00 H ATOM 945 HE2 PHE A 62 36.431 7.201 -17.056 1.00 0.00 H ATOM 946 HZ PHE A 62 34.541 7.795 -18.551 1.00 0.00 H ATOM 947 HE1 PHE A 62 32.554 8.947 -17.613 1.00 0.00 H ATOM 948 HD1 PHE A 62 32.463 9.499 -15.198 1.00 0.00 H ATOM 949 H PHE A 62 36.818 9.935 -13.075 1.00 0.00 H ATOM 950 N SER A 63 33.359 11.506 -11.220 1.00 20.70 N ATOM 951 CA SER A 63 32.926 11.693 -9.844 1.00 21.56 C ATOM 952 C SER A 63 31.419 11.902 -9.789 1.00 19.56 C ATOM 953 O SER A 63 30.807 12.387 -10.750 1.00 22.11 O ATOM 954 CB SER A 63 33.647 12.889 -9.201 1.00 27.07 C ATOM 955 OG SER A 63 33.334 14.080 -9.890 1.00 26.71 O ATOM 956 HA SER A 63 33.181 10.794 -9.282 1.00 0.00 H ATOM 957 HB2 SER A 63 34.724 12.723 -9.240 1.00 0.00 H ATOM 958 HB3 SER A 63 33.333 12.982 -8.161 1.00 0.00 H ATOM 959 HG SER A 63 33.621 13.999 -10.834 1.00 0.00 H ATOM 960 H SER A 63 32.851 11.987 -11.990 1.00 0.00 H ATOM 961 N GLY A 64 30.822 11.566 -8.656 1.00 20.10 N ATOM 962 CA GLY A 64 29.381 11.656 -8.524 1.00 15.64 C ATOM 963 C GLY A 64 28.943 12.347 -7.245 1.00 25.90 C ATOM 964 O GLY A 64 29.659 12.351 -6.244 1.00 19.46 O ATOM 965 HA3 GLY A 64 28.968 10.647 -8.533 1.00 0.00 H ATOM 966 HA2 GLY A 64 28.989 12.216 -9.373 1.00 0.00 H ATOM 967 H GLY A 64 31.393 11.234 -7.852 1.00 0.00 H ATOM 968 N SER A 65 27.755 12.936 -7.264 1.00 16.99 N ATOM 969 CA SER A 65 27.208 13.492 -6.034 1.00 21.46 C ATOM 970 C SER A 65 25.717 13.628 -6.201 1.00 27.29 C ATOM 971 O SER A 65 25.167 13.315 -7.262 1.00 23.36 O ATOM 972 CB SER A 65 27.833 14.854 -5.723 1.00 27.10 C ATOM 973 OG SER A 65 27.410 15.828 -6.659 1.00 27.82 O ATOM 974 HA SER A 65 27.436 12.828 -5.200 1.00 0.00 H ATOM 975 HB2 SER A 65 28.919 14.767 -5.764 1.00 0.00 H ATOM 976 HB3 SER A 65 27.532 15.165 -4.723 1.00 0.00 H ATOM 977 HG SER A 65 27.826 16.699 -6.438 1.00 0.00 H ATOM 978 H SER A 65 27.217 13.001 -8.152 1.00 0.00 H ATOM 979 N LYS A 66 25.057 14.086 -5.150 1.00 19.52 N ATOM 980 CA LYS A 66 23.610 14.097 -5.135 1.00 24.71 C ATOM 981 C LYS A 66 23.169 15.393 -4.486 1.00 38.84 C ATOM 982 O LYS A 66 23.679 15.773 -3.435 1.00 32.74 O ATOM 983 CB LYS A 66 23.084 12.889 -4.363 1.00 32.21 C ATOM 984 CG LYS A 66 21.647 12.533 -4.671 1.00 33.00 C ATOM 985 CD LYS A 66 21.319 11.150 -4.172 1.00 31.79 C ATOM 986 CE LYS A 66 21.285 11.076 -2.665 1.00 31.40 C ATOM 987 NZ LYS A 66 20.840 9.728 -2.221 1.00 28.02 N ATOM 988 HA LYS A 66 23.211 14.035 -6.147 1.00 0.00 H ATOM 989 HB2 LYS A 66 23.709 12.029 -4.606 1.00 0.00 H ATOM 990 HB3 LYS A 66 23.162 13.104 -3.297 1.00 0.00 H ATOM 991 HG2 LYS A 66 20.988 13.254 -4.186 1.00 0.00 H ATOM 992 HG3 LYS A 66 21.493 12.570 -5.749 1.00 0.00 H ATOM 993 HD2 LYS A 66 20.342 10.860 -4.559 1.00 0.00 H ATOM 994 HD3 LYS A 66 22.075 10.456 -4.540 1.00 0.00 H ATOM 995 HE2 LYS A 66 20.592 11.827 -2.284 1.00 0.00 H ATOM 996 HE3 LYS A 66 22.283 11.272 -2.273 1.00 0.00 H ATOM 997 HZ1 LYS A 66 19.887 9.540 -2.591 1.00 0.00 H ATOM 998 HZ2 LYS A 66 21.501 9.010 -2.581 1.00 0.00 H ATOM 999 HZ3 LYS A 66 20.822 9.695 -1.182 1.00 0.00 H ATOM 1000 H LYS A 66 25.583 14.442 -4.326 1.00 0.00 H ATOM 1001 N SER A 67 22.246 16.078 -5.148 1.00 31.07 N ATOM 1002 CA SER A 67 21.743 17.362 -4.704 1.00 33.55 C ATOM 1003 C SER A 67 20.219 17.283 -4.711 1.00 26.13 C ATOM 1004 O SER A 67 19.573 17.582 -5.720 1.00 28.56 O ATOM 1005 CB SER A 67 22.256 18.449 -5.657 1.00 42.14 C ATOM 1006 OG SER A 67 21.705 19.729 -5.393 1.00 44.05 O ATOM 1007 HA SER A 67 22.085 17.609 -3.699 1.00 0.00 H ATOM 1008 HB2 SER A 67 21.999 18.165 -6.677 1.00 0.00 H ATOM 1009 HB3 SER A 67 23.340 18.511 -5.560 1.00 0.00 H ATOM 1010 HG SER A 67 20.720 19.689 -5.487 1.00 0.00 H ATOM 1011 H SER A 67 21.865 15.674 -6.028 1.00 0.00 H ATOM 1012 N GLY A 68 19.650 16.853 -3.591 1.00 28.76 N ATOM 1013 CA GLY A 68 18.205 16.771 -3.439 1.00 30.32 C ATOM 1014 C GLY A 68 17.589 15.658 -4.271 1.00 26.63 C ATOM 1015 O GLY A 68 17.912 14.484 -4.067 1.00 29.87 O ATOM 1016 HA3 GLY A 68 17.767 17.720 -3.748 1.00 0.00 H ATOM 1017 HA2 GLY A 68 17.974 16.590 -2.389 1.00 0.00 H ATOM 1018 H GLY A 68 20.257 16.565 -2.797 1.00 0.00 H ATOM 1019 N THR A 69 16.726 16.017 -5.225 1.00 20.98 N ATOM 1020 CA THR A 69 16.088 15.014 -6.092 1.00 21.66 C ATOM 1021 C THR A 69 16.914 14.755 -7.353 1.00 19.44 C ATOM 1022 O THR A 69 16.459 14.087 -8.283 1.00 21.66 O ATOM 1023 CB THR A 69 14.654 15.434 -6.523 1.00 26.19 C ATOM 1024 OG1 THR A 69 14.709 16.711 -7.167 1.00 26.21 O ATOM 1025 CG2 THR A 69 13.709 15.519 -5.329 1.00 26.98 C ATOM 1026 HA THR A 69 16.028 14.103 -5.496 1.00 0.00 H ATOM 1027 HB THR A 69 14.272 14.675 -7.206 1.00 0.00 H ATOM 1028 HG1 THR A 69 13.797 16.980 -7.442 1.00 0.00 H ATOM 1029 HG23 THR A 69 13.663 14.549 -4.834 1.00 0.00 H ATOM 1030 HG21 THR A 69 14.077 16.269 -4.629 1.00 0.00 H ATOM 1031 HG22 THR A 69 12.714 15.800 -5.674 1.00 0.00 H ATOM 1032 H THR A 69 16.501 17.024 -5.357 1.00 0.00 H ATOM 1033 N SER A 70 18.129 15.280 -7.391 1.00 21.56 N ATOM 1034 CA SER A 70 18.946 15.188 -8.595 1.00 21.19 C ATOM 1035 C SER A 70 20.335 14.624 -8.293 1.00 24.32 C ATOM 1036 O SER A 70 21.043 15.125 -7.422 1.00 28.97 O ATOM 1037 CB SER A 70 19.060 16.568 -9.243 1.00 26.89 C ATOM 1038 OG SER A 70 19.846 16.537 -10.420 1.00 24.98 O ATOM 1039 HA SER A 70 18.459 14.500 -9.286 1.00 0.00 H ATOM 1040 HB2 SER A 70 19.518 17.255 -8.531 1.00 0.00 H ATOM 1041 HB3 SER A 70 18.061 16.922 -9.496 1.00 0.00 H ATOM 1042 HG SER A 70 19.433 15.920 -11.075 1.00 0.00 H ATOM 1043 H SER A 70 18.505 15.764 -6.551 1.00 0.00 H ATOM 1044 N ALA A 71 20.719 13.566 -8.995 1.00 23.10 N ATOM 1045 CA ALA A 71 22.080 13.068 -8.900 1.00 20.36 C ATOM 1046 C ALA A 71 22.854 13.531 -10.126 1.00 15.75 C ATOM 1047 O ALA A 71 22.265 13.768 -11.183 1.00 19.44 O ATOM 1048 CB ALA A 71 22.096 11.537 -8.787 1.00 17.78 C ATOM 1049 HA ALA A 71 22.552 13.463 -8.000 1.00 0.00 H ATOM 1050 HB1 ALA A 71 21.548 11.234 -7.895 1.00 0.00 H ATOM 1051 HB2 ALA A 71 21.624 11.104 -9.669 1.00 0.00 H ATOM 1052 HB3 ALA A 71 23.127 11.190 -8.717 1.00 0.00 H ATOM 1053 H ALA A 71 20.039 13.088 -9.620 1.00 0.00 H ATOM 1054 N SER A 72 24.167 13.664 -10.001 1.00 17.66 N ATOM 1055 CA SER A 72 24.977 14.011 -11.165 1.00 19.13 C ATOM 1056 C SER A 72 26.310 13.267 -11.248 1.00 20.75 C ATOM 1057 O SER A 72 26.879 12.856 -10.234 1.00 17.58 O ATOM 1058 CB SER A 72 25.186 15.526 -11.271 1.00 22.97 C ATOM 1059 OG SER A 72 25.887 16.005 -10.136 1.00 26.39 O ATOM 1060 HA SER A 72 24.398 13.674 -12.025 1.00 0.00 H ATOM 1061 HB2 SER A 72 24.216 16.020 -11.330 1.00 0.00 H ATOM 1062 HB3 SER A 72 25.761 15.748 -12.170 1.00 0.00 H ATOM 1063 HG SER A 72 26.015 16.983 -10.217 1.00 0.00 H ATOM 1064 H SER A 72 24.619 13.521 -9.075 1.00 0.00 H ATOM 1065 N LEU A 73 26.781 13.088 -12.481 1.00 16.33 N ATOM 1066 CA LEU A 73 28.050 12.418 -12.770 1.00 20.37 C ATOM 1067 C LEU A 73 28.898 13.380 -13.586 1.00 21.04 C ATOM 1068 O LEU A 73 28.514 13.766 -14.688 1.00 23.73 O ATOM 1069 CB LEU A 73 27.839 11.137 -13.587 1.00 14.69 C ATOM 1070 CG LEU A 73 29.126 10.407 -13.991 1.00 18.59 C ATOM 1071 CD1 LEU A 73 29.761 9.687 -12.798 1.00 17.80 C ATOM 1072 CD2 LEU A 73 28.858 9.403 -15.131 1.00 24.07 C ATOM 1073 HA LEU A 73 28.531 12.143 -11.831 1.00 0.00 H ATOM 1074 HB2 LEU A 73 27.234 10.452 -12.993 1.00 0.00 H ATOM 1075 HB3 LEU A 73 27.300 11.401 -14.497 1.00 0.00 H ATOM 1076 HG LEU A 73 29.827 11.163 -14.346 1.00 0.00 H ATOM 1077 HD21 LEU A 73 28.127 8.666 -14.800 1.00 0.00 H ATOM 1078 HD22 LEU A 73 28.471 9.936 -15.999 1.00 0.00 H ATOM 1079 HD23 LEU A 73 29.788 8.900 -15.397 1.00 0.00 H ATOM 1080 HD11 LEU A 73 30.005 10.415 -12.024 1.00 0.00 H ATOM 1081 HD12 LEU A 73 29.058 8.954 -12.401 1.00 0.00 H ATOM 1082 HD13 LEU A 73 30.670 9.181 -13.123 1.00 0.00 H ATOM 1083 H LEU A 73 26.218 13.443 -13.280 1.00 0.00 H ATOM 1084 N ALA A 74 30.035 13.777 -13.034 1.00 15.97 N ATOM 1085 CA ALA A 74 30.930 14.692 -13.713 1.00 23.76 C ATOM 1086 C ALA A 74 32.069 13.939 -14.396 1.00 29.33 C ATOM 1087 O ALA A 74 32.684 13.058 -13.809 1.00 26.34 O ATOM 1088 CB ALA A 74 31.488 15.709 -12.720 1.00 17.55 C ATOM 1089 HA ALA A 74 30.364 15.218 -14.482 1.00 0.00 H ATOM 1090 HB1 ALA A 74 30.666 16.272 -12.278 1.00 0.00 H ATOM 1091 HB2 ALA A 74 32.035 15.186 -11.936 1.00 0.00 H ATOM 1092 HB3 ALA A 74 32.159 16.392 -13.240 1.00 0.00 H ATOM 1093 H ALA A 74 30.291 13.423 -12.090 1.00 0.00 H ATOM 1094 N ILE A 75 32.356 14.305 -15.641 1.00 19.41 N ATOM 1095 CA ILE A 75 33.517 13.771 -16.337 1.00 24.96 C ATOM 1096 C ILE A 75 34.445 14.949 -16.579 1.00 30.39 C ATOM 1097 O ILE A 75 34.156 15.803 -17.412 1.00 28.92 O ATOM 1098 CB ILE A 75 33.120 13.129 -17.679 1.00 28.45 C ATOM 1099 CG1 ILE A 75 32.000 12.098 -17.470 1.00 20.74 C ATOM 1100 CG2 ILE A 75 34.330 12.503 -18.334 1.00 31.85 C ATOM 1101 CD1 ILE A 75 31.440 11.538 -18.768 1.00 30.14 C ATOM 1102 HA ILE A 75 33.995 12.992 -15.743 1.00 0.00 H ATOM 1103 HB ILE A 75 32.738 13.903 -18.345 1.00 0.00 H ATOM 1104 HG12 ILE A 75 32.397 11.272 -16.881 1.00 0.00 H ATOM 1105 HG13 ILE A 75 31.188 12.576 -16.922 1.00 0.00 H ATOM 1106 HD11 ILE A 75 31.028 12.351 -19.365 1.00 0.00 H ATOM 1107 HD12 ILE A 75 32.238 11.045 -19.324 1.00 0.00 H ATOM 1108 HD13 ILE A 75 30.654 10.817 -18.542 1.00 0.00 H ATOM 1109 HG21 ILE A 75 35.083 13.271 -18.513 1.00 0.00 H ATOM 1110 HG22 ILE A 75 34.741 11.736 -17.678 1.00 0.00 H ATOM 1111 HG23 ILE A 75 34.036 12.052 -19.282 1.00 0.00 H ATOM 1112 H ILE A 75 31.739 14.986 -16.127 1.00 0.00 H ATOM 1113 N SER A 76 35.530 15.015 -15.815 1.00 27.93 N ATOM 1114 CA SER A 76 36.400 16.191 -15.812 1.00 38.27 C ATOM 1115 C SER A 76 37.541 16.034 -16.792 1.00 36.25 C ATOM 1116 O SER A 76 38.645 15.659 -16.411 1.00 43.82 O ATOM 1117 CB SER A 76 36.976 16.430 -14.417 1.00 34.87 C ATOM 1118 OG SER A 76 35.931 16.634 -13.483 1.00 44.97 O ATOM 1119 HA SER A 76 35.791 17.044 -16.110 1.00 0.00 H ATOM 1120 HB2 SER A 76 37.617 17.311 -14.438 1.00 0.00 H ATOM 1121 HB3 SER A 76 37.563 15.562 -14.116 1.00 0.00 H ATOM 1122 HG SER A 76 35.349 15.833 -13.461 1.00 0.00 H ATOM 1123 H SER A 76 35.767 14.209 -15.202 1.00 0.00 H ATOM 1124 N GLY A 77 37.276 16.312 -18.058 1.00 33.58 N ATOM 1125 CA GLY A 77 38.295 16.122 -19.072 1.00 38.05 C ATOM 1126 C GLY A 77 37.965 14.896 -19.890 1.00 30.48 C ATOM 1127 O GLY A 77 38.565 13.836 -19.737 1.00 35.91 O ATOM 1128 HA3 GLY A 77 39.265 15.990 -18.593 1.00 0.00 H ATOM 1129 HA2 GLY A 77 38.329 16.996 -19.723 1.00 0.00 H ATOM 1130 H GLY A 77 36.336 16.667 -18.326 1.00 0.00 H ATOM 1131 N LEU A 78 36.988 15.074 -20.760 1.00 33.04 N ATOM 1132 CA LEU A 78 36.468 14.041 -21.634 1.00 34.66 C ATOM 1133 C LEU A 78 37.579 13.415 -22.495 1.00 47.72 C ATOM 1134 O LEU A 78 38.396 14.135 -23.068 1.00 49.28 O ATOM 1135 CB LEU A 78 35.427 14.706 -22.524 1.00 30.56 C ATOM 1136 CG LEU A 78 34.158 14.039 -23.020 1.00 37.04 C ATOM 1137 CD1 LEU A 78 33.445 13.277 -21.905 1.00 25.17 C ATOM 1138 CD2 LEU A 78 33.270 15.126 -23.603 1.00 35.81 C ATOM 1139 HA LEU A 78 36.036 13.232 -21.045 1.00 0.00 H ATOM 1140 HB2 LEU A 78 35.098 15.590 -21.977 1.00 0.00 H ATOM 1141 HB3 LEU A 78 35.964 15.014 -23.421 1.00 0.00 H ATOM 1142 HG LEU A 78 34.401 13.298 -23.781 1.00 0.00 H ATOM 1143 HD21 LEU A 78 33.039 15.859 -22.830 1.00 0.00 H ATOM 1144 HD22 LEU A 78 33.790 15.616 -24.426 1.00 0.00 H ATOM 1145 HD23 LEU A 78 32.346 14.680 -23.970 1.00 0.00 H ATOM 1146 HD11 LEU A 78 34.107 12.505 -21.513 1.00 0.00 H ATOM 1147 HD12 LEU A 78 33.179 13.969 -21.106 1.00 0.00 H ATOM 1148 HD13 LEU A 78 32.542 12.815 -22.303 1.00 0.00 H ATOM 1149 H LEU A 78 36.562 16.021 -20.823 1.00 0.00 H ATOM 1150 N ARG A 79 37.618 12.083 -22.566 1.00 31.93 N ATOM 1151 CA ARG A 79 38.497 11.378 -23.512 1.00 39.92 C ATOM 1152 C ARG A 79 37.663 10.641 -24.559 1.00 41.28 C ATOM 1153 O ARG A 79 36.501 10.331 -24.311 1.00 32.33 O ATOM 1154 CB ARG A 79 39.383 10.376 -22.784 1.00 38.90 C ATOM 1155 CG ARG A 79 40.305 10.978 -21.754 1.00 46.28 C ATOM 1156 CD ARG A 79 41.381 9.968 -21.388 1.00 59.02 C ATOM 1157 NE ARG A 79 42.244 10.450 -20.317 1.00 67.33 N ATOM 1158 CZ ARG A 79 43.249 9.753 -19.799 1.00 77.68 C ATOM 1159 NH1 ARG A 79 43.524 8.534 -20.256 1.00 85.39 N ATOM 1160 NH2 ARG A 79 43.981 10.275 -18.823 1.00 75.84 N ATOM 1161 HA ARG A 79 39.127 12.120 -24.001 1.00 0.00 H ATOM 1162 HB2 ARG A 79 38.738 9.655 -22.282 1.00 0.00 H ATOM 1163 HB3 ARG A 79 39.993 9.861 -23.526 1.00 0.00 H ATOM 1164 HG2 ARG A 79 40.771 11.875 -22.162 1.00 0.00 H ATOM 1165 HG3 ARG A 79 39.734 11.240 -20.863 1.00 0.00 H ATOM 1166 HD2 ARG A 79 41.991 9.769 -22.269 1.00 0.00 H ATOM 1167 HD3 ARG A 79 40.901 9.044 -21.064 1.00 0.00 H ATOM 1168 HE ARG A 79 42.061 11.400 -19.934 1.00 0.00 H ATOM 1169 HH12 ARG A 79 44.312 7.991 -19.848 1.00 0.00 H ATOM 1170 HH11 ARG A 79 42.951 8.124 -21.021 1.00 0.00 H ATOM 1171 HH22 ARG A 79 44.768 9.731 -18.416 1.00 0.00 H ATOM 1172 HH21 ARG A 79 43.767 11.228 -18.465 1.00 0.00 H ATOM 1173 H ARG A 79 37.008 11.526 -21.933 1.00 0.00 H ATOM 1174 N SER A 80 38.241 10.339 -25.726 1.00 39.88 N ATOM 1175 CA SER A 80 37.491 9.646 -26.776 1.00 40.52 C ATOM 1176 C SER A 80 36.947 8.305 -26.287 1.00 27.94 C ATOM 1177 O SER A 80 35.861 7.889 -26.681 1.00 31.13 O ATOM 1178 CB SER A 80 38.339 9.457 -28.042 1.00 49.98 C ATOM 1179 OG SER A 80 39.617 8.935 -27.726 1.00 49.14 O ATOM 1180 HA SER A 80 36.641 10.279 -27.031 1.00 0.00 H ATOM 1181 HB2 SER A 80 38.460 10.421 -28.537 1.00 0.00 H ATOM 1182 HB3 SER A 80 37.828 8.767 -28.713 1.00 0.00 H ATOM 1183 HG SER A 80 40.142 8.823 -28.558 1.00 0.00 H ATOM 1184 H SER A 80 39.234 10.599 -25.890 1.00 0.00 H ATOM 1185 N GLU A 81 37.703 7.641 -25.421 1.00 33.05 N ATOM 1186 CA GLU A 81 37.299 6.337 -24.895 1.00 36.17 C ATOM 1187 C GLU A 81 36.078 6.415 -23.960 1.00 34.40 C ATOM 1188 O GLU A 81 35.514 5.384 -23.591 1.00 28.09 O ATOM 1189 CB GLU A 81 38.467 5.670 -24.162 1.00 40.15 C ATOM 1190 CG GLU A 81 38.656 6.170 -22.737 1.00 45.01 C ATOM 1191 CD GLU A 81 40.072 5.987 -22.218 1.00 56.14 C ATOM 1192 OE1 GLU A 81 41.012 6.021 -23.039 1.00 68.34 O ATOM 1193 OE2 GLU A 81 40.248 5.813 -20.987 1.00 54.31 O ATOM 1194 HA GLU A 81 37.008 5.736 -25.756 1.00 0.00 H ATOM 1195 HB2 GLU A 81 38.286 4.596 -24.130 1.00 0.00 H ATOM 1196 HB3 GLU A 81 39.382 5.866 -24.721 1.00 0.00 H ATOM 1197 HG2 GLU A 81 38.411 7.232 -22.707 1.00 0.00 H ATOM 1198 HG3 GLU A 81 37.975 5.623 -22.085 1.00 0.00 H ATOM 1199 H GLU A 81 38.603 8.058 -25.109 1.00 0.00 H ATOM 1200 N ASP A 82 35.679 7.631 -23.575 1.00 40.93 N ATOM 1201 CA ASP A 82 34.499 7.835 -22.731 1.00 34.47 C ATOM 1202 C ASP A 82 33.186 7.830 -23.521 1.00 32.63 C ATOM 1203 O ASP A 82 32.097 7.947 -22.939 1.00 26.40 O ATOM 1204 CB ASP A 82 34.595 9.164 -21.979 1.00 27.13 C ATOM 1205 CG ASP A 82 35.811 9.248 -21.087 1.00 34.23 C ATOM 1206 OD1 ASP A 82 36.262 8.209 -20.553 1.00 32.66 O ATOM 1207 OD2 ASP A 82 36.312 10.375 -20.910 1.00 31.30 O ATOM 1208 HA ASP A 82 34.486 6.995 -22.037 1.00 0.00 H ATOM 1209 HB2 ASP A 82 34.641 9.974 -22.707 1.00 0.00 H ATOM 1210 HB3 ASP A 82 33.703 9.281 -21.364 1.00 0.00 H ATOM 1211 H ASP A 82 36.225 8.460 -23.885 1.00 0.00 H ATOM 1212 N GLU A 83 33.266 7.724 -24.841 1.00 24.13 N ATOM 1213 CA GLU A 83 32.042 7.633 -25.617 1.00 23.60 C ATOM 1214 C GLU A 83 31.292 6.339 -25.271 1.00 25.48 C ATOM 1215 O GLU A 83 31.761 5.237 -25.551 1.00 31.60 O ATOM 1216 CB GLU A 83 32.335 7.739 -27.120 1.00 42.85 C ATOM 1217 CG GLU A 83 31.091 7.671 -27.990 1.00 34.27 C ATOM 1218 CD GLU A 83 31.321 8.213 -29.397 1.00 53.32 C ATOM 1219 OE1 GLU A 83 32.129 9.154 -29.558 1.00 50.93 O ATOM 1220 OE2 GLU A 83 30.689 7.694 -30.339 1.00 53.73 O ATOM 1221 HA GLU A 83 31.398 8.473 -25.358 1.00 0.00 H ATOM 1222 HB2 GLU A 83 32.835 8.689 -27.307 1.00 0.00 H ATOM 1223 HB3 GLU A 83 32.997 6.920 -27.401 1.00 0.00 H ATOM 1224 HG2 GLU A 83 30.775 6.631 -28.065 1.00 0.00 H ATOM 1225 HG3 GLU A 83 30.302 8.256 -27.516 1.00 0.00 H ATOM 1226 H GLU A 83 34.192 7.706 -25.313 1.00 0.00 H ATOM 1227 N ALA A 84 30.129 6.484 -24.640 1.00 33.84 N ATOM 1228 CA ALA A 84 29.388 5.343 -24.100 1.00 28.43 C ATOM 1229 C ALA A 84 28.036 5.805 -23.588 1.00 28.65 C ATOM 1230 O ALA A 84 27.726 6.997 -23.625 1.00 24.64 O ATOM 1231 CB ALA A 84 30.161 4.691 -22.976 1.00 26.82 C ATOM 1232 HA ALA A 84 29.246 4.613 -24.897 1.00 0.00 H ATOM 1233 HB1 ALA A 84 31.123 4.342 -23.353 1.00 0.00 H ATOM 1234 HB2 ALA A 84 30.323 5.417 -22.179 1.00 0.00 H ATOM 1235 HB3 ALA A 84 29.593 3.845 -22.589 1.00 0.00 H ATOM 1236 H ALA A 84 29.734 7.439 -24.527 1.00 0.00 H ATOM 1237 N ASP A 85 27.239 4.858 -23.104 1.00 24.97 N ATOM 1238 CA ASP A 85 25.941 5.182 -22.538 1.00 24.22 C ATOM 1239 C ASP A 85 26.023 5.129 -21.008 1.00 21.36 C ATOM 1240 O ASP A 85 26.477 4.141 -20.444 1.00 23.01 O ATOM 1241 CB ASP A 85 24.891 4.199 -23.037 1.00 30.59 C ATOM 1242 CG ASP A 85 23.503 4.764 -22.968 1.00 33.09 C ATOM 1243 OD1 ASP A 85 23.353 5.877 -22.419 1.00 30.93 O ATOM 1244 OD2 ASP A 85 22.561 4.099 -23.450 1.00 31.89 O ATOM 1245 HA ASP A 85 25.655 6.186 -22.850 1.00 0.00 H ATOM 1246 HB2 ASP A 85 25.114 3.943 -24.073 1.00 0.00 H ATOM 1247 HB3 ASP A 85 24.934 3.299 -22.424 1.00 0.00 H ATOM 1248 H ASP A 85 27.551 3.866 -23.131 1.00 0.00 H ATOM 1249 N TYR A 86 25.573 6.184 -20.339 1.00 21.06 N ATOM 1250 CA TYR A 86 25.740 6.257 -18.882 1.00 18.78 C ATOM 1251 C TYR A 86 24.393 6.215 -18.197 1.00 16.78 C ATOM 1252 O TYR A 86 23.518 7.010 -18.519 1.00 19.78 O ATOM 1253 CB TYR A 86 26.493 7.529 -18.492 1.00 17.41 C ATOM 1254 CG TYR A 86 27.915 7.581 -19.003 1.00 18.31 C ATOM 1255 CD1 TYR A 86 28.193 7.974 -20.303 1.00 25.11 C ATOM 1256 CD2 TYR A 86 28.982 7.227 -18.178 1.00 19.89 C ATOM 1257 CE1 TYR A 86 29.499 8.013 -20.774 1.00 26.03 C ATOM 1258 CE2 TYR A 86 30.289 7.259 -18.641 1.00 25.40 C ATOM 1259 CZ TYR A 86 30.543 7.659 -19.937 1.00 23.51 C ATOM 1260 OH TYR A 86 31.850 7.688 -20.397 1.00 29.83 O ATOM 1261 HA TYR A 86 26.324 5.396 -18.558 1.00 0.00 H ATOM 1262 HB3 TYR A 86 26.516 7.594 -17.404 1.00 0.00 H ATOM 1263 HB2 TYR A 86 25.952 8.385 -18.895 1.00 0.00 H ATOM 1264 HD2 TYR A 86 28.785 6.920 -17.151 1.00 0.00 H ATOM 1265 HE2 TYR A 86 31.110 6.970 -17.985 1.00 0.00 H ATOM 1266 HE1 TYR A 86 29.701 8.321 -21.800 1.00 0.00 H ATOM 1267 HD1 TYR A 86 27.375 8.257 -20.965 1.00 0.00 H ATOM 1268 HH TYR A 86 31.861 7.995 -21.338 1.00 0.00 H ATOM 1269 H TYR A 86 25.102 6.959 -20.847 1.00 0.00 H ATOM 1270 N TYR A 87 24.232 5.288 -17.253 1.00 17.46 N ATOM 1271 CA TYR A 87 22.962 5.081 -16.566 1.00 17.87 C ATOM 1272 C TYR A 87 23.052 5.370 -15.068 1.00 14.94 C ATOM 1273 O TYR A 87 24.061 5.057 -14.432 1.00 11.92 O ATOM 1274 CB TYR A 87 22.484 3.632 -16.713 1.00 18.54 C ATOM 1275 CG TYR A 87 22.021 3.264 -18.108 1.00 23.58 C ATOM 1276 CD1 TYR A 87 22.945 2.971 -19.110 1.00 26.77 C ATOM 1277 CD2 TYR A 87 20.670 3.207 -18.426 1.00 26.74 C ATOM 1278 CE1 TYR A 87 22.533 2.633 -20.402 1.00 26.38 C ATOM 1279 CE2 TYR A 87 20.252 2.854 -19.719 1.00 33.29 C ATOM 1280 CZ TYR A 87 21.192 2.582 -20.695 1.00 35.93 C ATOM 1281 OH TYR A 87 20.792 2.244 -21.977 1.00 40.68 O ATOM 1282 HA TYR A 87 22.264 5.775 -17.033 1.00 0.00 H ATOM 1283 HB3 TYR A 87 21.653 3.475 -16.025 1.00 0.00 H ATOM 1284 HB2 TYR A 87 23.308 2.972 -16.442 1.00 0.00 H ATOM 1285 HD2 TYR A 87 19.926 3.439 -17.663 1.00 0.00 H ATOM 1286 HE2 TYR A 87 19.189 2.795 -19.952 1.00 0.00 H ATOM 1287 HE1 TYR A 87 23.271 2.411 -21.173 1.00 0.00 H ATOM 1288 HD1 TYR A 87 24.010 3.006 -18.881 1.00 0.00 H ATOM 1289 HH TYR A 87 21.591 2.084 -22.539 1.00 0.00 H ATOM 1290 H TYR A 87 25.043 4.689 -16.996 1.00 0.00 H ATOM 1291 N CYS A 88 21.972 5.910 -14.513 1.00 14.26 N ATOM 1292 CA CYS A 88 21.814 6.011 -13.064 1.00 15.92 C ATOM 1293 C CYS A 88 20.696 5.073 -12.639 1.00 16.68 C ATOM 1294 O CYS A 88 19.836 4.720 -13.449 1.00 19.09 O ATOM 1295 CB CYS A 88 21.445 7.443 -12.644 1.00 16.07 C ATOM 1296 SG CYS A 88 19.898 8.068 -13.396 1.00 22.63 S ATOM 1297 HA CYS A 88 22.757 5.744 -12.587 1.00 0.00 H ATOM 1298 HB2 CYS A 88 22.260 8.106 -12.935 1.00 0.00 H ATOM 1299 HB3 CYS A 88 21.332 7.463 -11.560 1.00 0.00 H ATOM 1300 H CYS A 88 21.216 6.272 -15.129 1.00 0.00 H ATOM 1301 N LEU A 89 20.707 4.683 -11.366 1.00 17.56 N ATOM 1302 CA LEU A 89 19.668 3.834 -10.796 1.00 18.88 C ATOM 1303 C LEU A 89 19.630 4.009 -9.280 1.00 20.21 C ATOM 1304 O LEU A 89 20.627 4.387 -8.670 1.00 16.34 O ATOM 1305 CB LEU A 89 19.921 2.349 -11.127 1.00 18.21 C ATOM 1306 CG LEU A 89 21.108 1.670 -10.441 1.00 17.29 C ATOM 1307 CD1 LEU A 89 20.696 0.661 -9.338 1.00 17.39 C ATOM 1308 CD2 LEU A 89 22.008 0.971 -11.506 1.00 14.22 C ATOM 1309 HA LEU A 89 18.714 4.132 -11.230 1.00 0.00 H ATOM 1310 HB2 LEU A 89 19.023 1.795 -10.853 1.00 0.00 H ATOM 1311 HB3 LEU A 89 20.078 2.275 -12.203 1.00 0.00 H ATOM 1312 HG LEU A 89 21.667 2.458 -9.936 1.00 0.00 H ATOM 1313 HD21 LEU A 89 21.423 0.221 -12.039 1.00 0.00 H ATOM 1314 HD22 LEU A 89 22.377 1.715 -12.212 1.00 0.00 H ATOM 1315 HD23 LEU A 89 22.850 0.490 -11.009 1.00 0.00 H ATOM 1316 HD11 LEU A 89 20.128 1.180 -8.566 1.00 0.00 H ATOM 1317 HD12 LEU A 89 20.081 -0.125 -9.777 1.00 0.00 H ATOM 1318 HD13 LEU A 89 21.591 0.221 -8.898 1.00 0.00 H ATOM 1319 H LEU A 89 21.487 4.996 -10.754 1.00 0.00 H ATOM 1320 N SER A 90 18.478 3.746 -8.682 1.00 17.51 N ATOM 1321 CA SER A 90 18.382 3.646 -7.231 1.00 17.92 C ATOM 1322 C SER A 90 17.172 2.808 -6.898 1.00 25.12 C ATOM 1323 O SER A 90 16.374 2.501 -7.780 1.00 25.66 O ATOM 1324 CB SER A 90 18.214 5.027 -6.574 1.00 21.01 C ATOM 1325 OG SER A 90 16.872 5.489 -6.665 1.00 25.93 O ATOM 1326 HA SER A 90 19.301 3.199 -6.853 1.00 0.00 H ATOM 1327 HB2 SER A 90 18.869 5.740 -7.075 1.00 0.00 H ATOM 1328 HB3 SER A 90 18.494 4.956 -5.523 1.00 0.00 H ATOM 1329 HG SER A 90 16.272 4.849 -6.207 1.00 0.00 H ATOM 1330 H SER A 90 17.624 3.608 -9.260 1.00 0.00 H ATOM 1331 N TRP A 91 17.031 2.457 -5.620 1.00 15.25 N ATOM 1332 CA TRP A 91 15.800 1.869 -5.109 1.00 23.52 C ATOM 1333 C TRP A 91 14.692 2.913 -5.160 1.00 31.73 C ATOM 1334 O TRP A 91 14.962 4.096 -5.025 1.00 28.25 O ATOM 1335 CB TRP A 91 16.009 1.453 -3.661 1.00 28.90 C ATOM 1336 CG TRP A 91 14.873 0.671 -3.091 1.00 37.54 C ATOM 1337 CD1 TRP A 91 13.963 1.094 -2.151 1.00 49.83 C ATOM 1338 CD2 TRP A 91 14.514 -0.680 -3.412 1.00 40.25 C ATOM 1339 NE1 TRP A 91 13.065 0.081 -1.869 1.00 49.52 N ATOM 1340 CE2 TRP A 91 13.387 -1.017 -2.629 1.00 52.35 C ATOM 1341 CE3 TRP A 91 15.046 -1.644 -4.281 1.00 35.49 C ATOM 1342 CZ2 TRP A 91 12.781 -2.265 -2.696 1.00 57.29 C ATOM 1343 CZ3 TRP A 91 14.443 -2.879 -4.344 1.00 40.98 C ATOM 1344 CH2 TRP A 91 13.323 -3.183 -3.555 1.00 51.27 C ATOM 1345 HA TRP A 91 15.529 1.003 -5.712 1.00 0.00 H ATOM 1346 HB2 TRP A 91 16.910 0.842 -3.605 1.00 0.00 H ATOM 1347 HB3 TRP A 91 16.143 2.353 -3.060 1.00 0.00 H ATOM 1348 HE1 TRP A 91 12.277 0.141 -1.193 1.00 0.00 H ATOM 1349 HD1 TRP A 91 13.951 2.084 -1.695 1.00 0.00 H ATOM 1350 HZ2 TRP A 91 11.908 -2.504 -2.089 1.00 0.00 H ATOM 1351 HH2 TRP A 91 12.874 -4.174 -3.628 1.00 0.00 H ATOM 1352 HZ3 TRP A 91 14.843 -3.635 -5.019 1.00 0.00 H ATOM 1353 HE3 TRP A 91 15.919 -1.419 -4.894 1.00 0.00 H ATOM 1354 H TRP A 91 17.826 2.608 -4.966 1.00 0.00 H ATOM 1355 N ASP A 92 13.456 2.464 -5.354 1.00 29.41 N ATOM 1356 CA ASP A 92 12.297 3.342 -5.255 1.00 28.61 C ATOM 1357 C ASP A 92 11.347 2.878 -4.156 1.00 43.35 C ATOM 1358 O ASP A 92 10.875 1.741 -4.169 1.00 38.27 O ATOM 1359 CB ASP A 92 11.560 3.411 -6.594 1.00 24.29 C ATOM 1360 CG ASP A 92 10.408 4.397 -6.575 1.00 35.80 C ATOM 1361 OD1 ASP A 92 9.463 4.193 -5.784 1.00 43.39 O ATOM 1362 OD2 ASP A 92 10.448 5.375 -7.351 1.00 28.99 O ATOM 1363 HA ASP A 92 12.655 4.339 -4.998 1.00 0.00 H ATOM 1364 HB2 ASP A 92 12.267 3.714 -7.367 1.00 0.00 H ATOM 1365 HB3 ASP A 92 11.169 2.421 -6.829 1.00 0.00 H ATOM 1366 H ASP A 92 13.312 1.460 -5.582 1.00 0.00 H ATOM 1367 N ASP A 93 11.069 3.766 -3.207 1.00 36.65 N ATOM 1368 CA ASP A 93 10.316 3.401 -2.013 1.00 42.28 C ATOM 1369 C ASP A 93 8.865 3.079 -2.353 1.00 47.75 C ATOM 1370 O ASP A 93 8.239 2.236 -1.711 1.00 54.40 O ATOM 1371 CB ASP A 93 10.377 4.525 -0.977 1.00 42.96 C ATOM 1372 CG ASP A 93 11.739 4.640 -0.321 1.00 43.72 C ATOM 1373 OD1 ASP A 93 12.567 3.723 -0.502 1.00 52.99 O ATOM 1374 OD2 ASP A 93 11.981 5.648 0.376 1.00 49.82 O ATOM 1375 HA ASP A 93 10.773 2.506 -1.591 1.00 0.00 H ATOM 1376 HB2 ASP A 93 10.146 5.469 -1.471 1.00 0.00 H ATOM 1377 HB3 ASP A 93 9.633 4.329 -0.205 1.00 0.00 H ATOM 1378 H ASP A 93 11.397 4.747 -3.319 1.00 0.00 H ATOM 1379 N SER A 94 8.336 3.756 -3.367 1.00 51.73 N ATOM 1380 CA SER A 94 6.905 3.728 -3.643 1.00 62.02 C ATOM 1381 C SER A 94 6.555 2.621 -4.632 1.00 61.49 C ATOM 1382 O SER A 94 5.423 2.139 -4.665 1.00 68.37 O ATOM 1383 CB SER A 94 6.437 5.082 -4.182 1.00 54.65 C ATOM 1384 OG SER A 94 5.446 4.918 -5.181 1.00 78.85 O ATOM 1385 HA SER A 94 6.389 3.522 -2.705 1.00 0.00 H ATOM 1386 HB2 SER A 94 7.290 5.610 -4.609 1.00 0.00 H ATOM 1387 HB3 SER A 94 6.023 5.668 -3.362 1.00 0.00 H ATOM 1388 HG SER A 94 4.667 4.443 -4.797 1.00 0.00 H ATOM 1389 H SER A 94 8.959 4.320 -3.979 1.00 0.00 H ATOM 1390 N LEU A 95 7.535 2.223 -5.437 1.00 47.20 N ATOM 1391 CA LEU A 95 7.368 1.100 -6.347 1.00 44.68 C ATOM 1392 C LEU A 95 7.969 -0.177 -5.776 1.00 45.34 C ATOM 1393 O LEU A 95 7.809 -1.257 -6.338 1.00 52.25 O ATOM 1394 CB LEU A 95 8.017 1.422 -7.692 1.00 40.86 C ATOM 1395 CG LEU A 95 7.422 2.636 -8.407 1.00 41.06 C ATOM 1396 CD1 LEU A 95 8.198 2.974 -9.675 1.00 38.09 C ATOM 1397 CD2 LEU A 95 5.959 2.396 -8.723 1.00 46.13 C ATOM 1398 HA LEU A 95 6.299 0.935 -6.484 1.00 0.00 H ATOM 1399 HB2 LEU A 95 9.077 1.612 -7.523 1.00 0.00 H ATOM 1400 HB3 LEU A 95 7.904 0.554 -8.342 1.00 0.00 H ATOM 1401 HG LEU A 95 7.501 3.492 -7.736 1.00 0.00 H ATOM 1402 HD21 LEU A 95 5.866 1.522 -9.368 1.00 0.00 H ATOM 1403 HD22 LEU A 95 5.412 2.225 -7.796 1.00 0.00 H ATOM 1404 HD23 LEU A 95 5.550 3.269 -9.232 1.00 0.00 H ATOM 1405 HD11 LEU A 95 9.233 3.198 -9.417 1.00 0.00 H ATOM 1406 HD12 LEU A 95 8.168 2.123 -10.356 1.00 0.00 H ATOM 1407 HD13 LEU A 95 7.746 3.842 -10.156 1.00 0.00 H ATOM 1408 H LEU A 95 8.444 2.727 -5.416 1.00 0.00 H ATOM 1409 N ASN A 95A 8.659 -0.040 -4.651 1.00 37.63 N ATOM 1410 CA ASN A 95A 9.365 -1.146 -4.017 1.00 41.98 C ATOM 1411 C ASN A 95A 10.208 -2.025 -4.954 1.00 45.75 C ATOM 1412 O ASN A 95A 10.051 -3.248 -4.981 1.00 43.98 O ATOM 1413 CB ASN A 95A 8.394 -2.009 -3.220 1.00 56.22 C ATOM 1414 CG ASN A 95A 8.978 -2.454 -1.909 1.00 69.66 C ATOM 1415 OD1 ASN A 95A 9.291 -3.633 -1.721 1.00 80.17 O ATOM 1416 ND2 ASN A 95A 9.154 -1.504 -0.991 1.00 68.07 N ATOM 1417 HA ASN A 95A 10.089 -0.667 -3.358 1.00 0.00 H ATOM 1418 HB2 ASN A 95A 7.490 -1.432 -3.025 1.00 0.00 H ATOM 1419 HB3 ASN A 95A 8.141 -2.890 -3.810 1.00 0.00 H ATOM 1420 HD22 ASN A 95A 8.874 -0.524 -1.197 1.00 0.00 H ATOM 1421 HD21 ASN A 95A 9.571 -1.743 -0.069 1.00 0.00 H ATOM 1422 H ASN A 95A 8.698 0.897 -4.202 1.00 0.00 H ATOM 1423 N GLY A 95B 11.113 -1.393 -5.698 1.00 37.57 N ATOM 1424 CA GLY A 95B 12.045 -2.084 -6.578 1.00 36.39 C ATOM 1425 C GLY A 95B 13.003 -1.082 -7.226 1.00 31.42 C ATOM 1426 O GLY A 95B 12.894 0.128 -6.985 1.00 26.89 O ATOM 1427 HA3 GLY A 95B 11.487 -2.604 -7.357 1.00 0.00 H ATOM 1428 HA2 GLY A 95B 12.618 -2.808 -5.999 1.00 0.00 H ATOM 1429 H GLY A 95B 11.157 -0.355 -5.648 1.00 0.00 H ATOM 1430 N TRP A 96 13.932 -1.571 -8.051 1.00 34.29 N ATOM 1431 CA TRP A 96 14.936 -0.701 -8.687 1.00 26.50 C ATOM 1432 C TRP A 96 14.327 0.140 -9.794 1.00 32.28 C ATOM 1433 O TRP A 96 13.494 -0.342 -10.565 1.00 33.22 O ATOM 1434 CB TRP A 96 16.132 -1.519 -9.215 1.00 22.99 C ATOM 1435 CG TRP A 96 16.690 -2.384 -8.156 1.00 26.76 C ATOM 1436 CD1 TRP A 96 16.509 -3.737 -8.015 1.00 30.76 C ATOM 1437 CD2 TRP A 96 17.481 -1.966 -7.035 1.00 20.49 C ATOM 1438 NE1 TRP A 96 17.148 -4.182 -6.879 1.00 26.95 N ATOM 1439 CE2 TRP A 96 17.743 -3.112 -6.257 1.00 26.53 C ATOM 1440 CE3 TRP A 96 17.989 -0.733 -6.618 1.00 22.59 C ATOM 1441 CZ2 TRP A 96 18.508 -3.064 -5.089 1.00 27.97 C ATOM 1442 CZ3 TRP A 96 18.744 -0.685 -5.451 1.00 19.08 C ATOM 1443 CH2 TRP A 96 18.991 -1.842 -4.698 1.00 26.45 C ATOM 1444 HA TRP A 96 15.305 -0.021 -7.919 1.00 0.00 H ATOM 1445 HB2 TRP A 96 15.800 -2.141 -10.046 1.00 0.00 H ATOM 1446 HB3 TRP A 96 16.907 -0.835 -9.562 1.00 0.00 H ATOM 1447 HE1 TRP A 96 17.175 -5.167 -6.547 1.00 0.00 H ATOM 1448 HD1 TRP A 96 15.943 -4.367 -8.701 1.00 0.00 H ATOM 1449 HZ2 TRP A 96 18.713 -3.965 -4.510 1.00 0.00 H ATOM 1450 HH2 TRP A 96 19.579 -1.768 -3.783 1.00 0.00 H ATOM 1451 HZ3 TRP A 96 19.151 0.269 -5.116 1.00 0.00 H ATOM 1452 HE3 TRP A 96 17.798 0.172 -7.195 1.00 0.00 H ATOM 1453 H TRP A 96 13.947 -2.592 -8.249 1.00 0.00 H ATOM 1454 N VAL A 97 14.734 1.407 -9.874 1.00 26.88 N ATOM 1455 CA VAL A 97 14.326 2.259 -10.986 1.00 25.42 C ATOM 1456 C VAL A 97 15.577 2.786 -11.688 1.00 21.53 C ATOM 1457 O VAL A 97 16.619 2.921 -11.063 1.00 20.63 O ATOM 1458 CB VAL A 97 13.419 3.421 -10.530 1.00 29.65 C ATOM 1459 CG1 VAL A 97 12.085 2.890 -10.008 1.00 34.70 C ATOM 1460 CG2 VAL A 97 14.122 4.274 -9.474 1.00 21.75 C ATOM 1461 HA VAL A 97 13.734 1.663 -11.680 1.00 0.00 H ATOM 1462 HB VAL A 97 13.215 4.056 -11.392 1.00 0.00 H ATOM 1463 HG11 VAL A 97 11.580 2.338 -10.801 1.00 0.00 H ATOM 1464 HG12 VAL A 97 12.265 2.229 -9.160 1.00 0.00 H ATOM 1465 HG13 VAL A 97 11.461 3.726 -9.692 1.00 0.00 H ATOM 1466 HG21 VAL A 97 14.363 3.655 -8.610 1.00 0.00 H ATOM 1467 HG22 VAL A 97 15.039 4.687 -9.894 1.00 0.00 H ATOM 1468 HG23 VAL A 97 13.463 5.087 -9.168 1.00 0.00 H ATOM 1469 H VAL A 97 15.352 1.794 -9.132 1.00 0.00 H ATOM 1470 N PHE A 98 15.473 3.067 -12.984 1.00 25.81 N ATOM 1471 CA PHE A 98 16.631 3.412 -13.807 1.00 22.85 C ATOM 1472 C PHE A 98 16.345 4.652 -14.634 1.00 22.91 C ATOM 1473 O PHE A 98 15.195 4.944 -14.947 1.00 27.95 O ATOM 1474 CB PHE A 98 16.949 2.267 -14.784 1.00 27.42 C ATOM 1475 CG PHE A 98 17.268 0.961 -14.112 1.00 22.31 C ATOM 1476 CD1 PHE A 98 18.586 0.562 -13.933 1.00 17.69 C ATOM 1477 CD2 PHE A 98 16.255 0.145 -13.642 1.00 29.34 C ATOM 1478 CE1 PHE A 98 18.886 -0.630 -13.297 1.00 20.80 C ATOM 1479 CE2 PHE A 98 16.545 -1.053 -13.012 1.00 28.76 C ATOM 1480 CZ PHE A 98 17.865 -1.441 -12.835 1.00 24.93 C ATOM 1481 HA PHE A 98 17.472 3.589 -13.136 1.00 0.00 H ATOM 1482 HB2 PHE A 98 16.084 2.118 -15.431 1.00 0.00 H ATOM 1483 HB3 PHE A 98 17.807 2.560 -15.389 1.00 0.00 H ATOM 1484 HD2 PHE A 98 15.216 0.449 -13.769 1.00 0.00 H ATOM 1485 HE2 PHE A 98 15.737 -1.691 -12.655 1.00 0.00 H ATOM 1486 HZ PHE A 98 18.097 -2.381 -12.334 1.00 0.00 H ATOM 1487 HE1 PHE A 98 19.925 -0.929 -13.160 1.00 0.00 H ATOM 1488 HD1 PHE A 98 19.394 1.196 -14.298 1.00 0.00 H ATOM 1489 H PHE A 98 14.533 3.040 -13.428 1.00 0.00 H ATOM 1490 N GLY A 99 17.395 5.373 -15.006 1.00 17.50 N ATOM 1491 CA GLY A 99 17.254 6.410 -16.007 1.00 21.94 C ATOM 1492 C GLY A 99 17.252 5.716 -17.353 1.00 25.58 C ATOM 1493 O GLY A 99 17.481 4.518 -17.418 1.00 20.93 O ATOM 1494 HA3 GLY A 99 18.088 7.109 -15.945 1.00 0.00 H ATOM 1495 HA2 GLY A 99 16.318 6.950 -15.861 1.00 0.00 H ATOM 1496 H GLY A 99 18.325 5.192 -14.576 1.00 0.00 H ATOM 1497 N GLY A 100 16.984 6.457 -18.419 1.00 20.56 N ATOM 1498 CA GLY A 100 16.972 5.878 -19.750 1.00 25.11 C ATOM 1499 C GLY A 100 18.348 5.849 -20.378 1.00 22.96 C ATOM 1500 O GLY A 100 18.519 5.370 -21.490 1.00 25.45 O ATOM 1501 HA3 GLY A 100 16.310 6.469 -20.383 1.00 0.00 H ATOM 1502 HA2 GLY A 100 16.595 4.857 -19.685 1.00 0.00 H ATOM 1503 H GLY A 100 16.779 7.470 -18.300 1.00 0.00 H ATOM 1504 N GLY A 101 19.342 6.360 -19.660 1.00 21.52 N ATOM 1505 CA GLY A 101 20.702 6.409 -20.162 1.00 19.27 C ATOM 1506 C GLY A 101 21.000 7.713 -20.881 1.00 21.42 C ATOM 1507 O GLY A 101 20.160 8.223 -21.612 1.00 24.55 O ATOM 1508 HA3 GLY A 101 20.850 5.582 -20.857 1.00 0.00 H ATOM 1509 HA2 GLY A 101 21.390 6.305 -19.323 1.00 0.00 H ATOM 1510 H GLY A 101 19.139 6.735 -18.712 1.00 0.00 H ATOM 1511 N THR A 102 22.198 8.248 -20.668 1.00 18.09 N ATOM 1512 CA THR A 102 22.701 9.392 -21.428 1.00 23.05 C ATOM 1513 C THR A 102 23.886 8.973 -22.306 1.00 30.40 C ATOM 1514 O THR A 102 24.957 8.627 -21.799 1.00 22.80 O ATOM 1515 CB THR A 102 23.159 10.558 -20.498 1.00 24.52 C ATOM 1516 OG1 THR A 102 22.052 11.025 -19.717 1.00 19.79 O ATOM 1517 CG2 THR A 102 23.723 11.713 -21.315 1.00 24.08 C ATOM 1518 HA THR A 102 21.876 9.744 -22.048 1.00 0.00 H ATOM 1519 HB THR A 102 23.940 10.180 -19.838 1.00 0.00 H ATOM 1520 HG1 THR A 102 21.338 11.350 -20.320 1.00 0.00 H ATOM 1521 HG23 THR A 102 24.565 11.359 -21.909 1.00 0.00 H ATOM 1522 HG21 THR A 102 22.948 12.101 -21.976 1.00 0.00 H ATOM 1523 HG22 THR A 102 24.058 12.503 -20.642 1.00 0.00 H ATOM 1524 H THR A 102 22.803 7.836 -19.930 1.00 0.00 H ATOM 1525 N LYS A 103 23.697 9.019 -23.625 1.00 22.99 N ATOM 1526 CA LYS A 103 24.771 8.694 -24.557 1.00 26.95 C ATOM 1527 C LYS A 103 25.671 9.884 -24.730 1.00 24.62 C ATOM 1528 O LYS A 103 25.224 10.980 -25.078 1.00 30.70 O ATOM 1529 CB LYS A 103 24.222 8.248 -25.915 1.00 29.65 C ATOM 1530 CG LYS A 103 23.475 6.932 -25.853 1.00 35.65 C ATOM 1531 CD LYS A 103 23.007 6.486 -27.230 1.00 36.57 C ATOM 1532 CE LYS A 103 22.356 5.114 -27.141 1.00 49.29 C ATOM 1533 NZ LYS A 103 21.764 4.683 -28.439 1.00 63.34 N ATOM 1534 HA LYS A 103 25.340 7.863 -24.140 1.00 0.00 H ATOM 1535 HB2 LYS A 103 23.542 9.016 -26.283 1.00 0.00 H ATOM 1536 HB3 LYS A 103 25.056 8.141 -26.608 1.00 0.00 H ATOM 1537 HG2 LYS A 103 24.135 6.170 -25.440 1.00 0.00 H ATOM 1538 HG3 LYS A 103 22.606 7.049 -25.205 1.00 0.00 H ATOM 1539 HD2 LYS A 103 22.284 7.204 -27.616 1.00 0.00 H ATOM 1540 HD3 LYS A 103 23.863 6.437 -27.904 1.00 0.00 H ATOM 1541 HE2 LYS A 103 21.567 5.148 -26.390 1.00 0.00 H ATOM 1542 HE3 LYS A 103 23.110 4.387 -26.841 1.00 0.00 H ATOM 1543 HZ1 LYS A 103 21.037 5.367 -28.731 1.00 0.00 H ATOM 1544 HZ2 LYS A 103 22.511 4.639 -29.162 1.00 0.00 H ATOM 1545 HZ3 LYS A 103 21.333 3.743 -28.327 1.00 0.00 H ATOM 1546 H LYS A 103 22.765 9.292 -23.997 1.00 0.00 H ATOM 1547 N VAL A 104 26.950 9.659 -24.485 1.00 21.40 N ATOM 1548 CA VAL A 104 27.924 10.719 -24.576 1.00 27.22 C ATOM 1549 C VAL A 104 28.730 10.503 -25.840 1.00 36.53 C ATOM 1550 O VAL A 104 29.306 9.440 -26.045 1.00 35.44 O ATOM 1551 CB VAL A 104 28.863 10.744 -23.361 1.00 24.25 C ATOM 1552 CG1 VAL A 104 29.957 11.752 -23.573 1.00 29.37 C ATOM 1553 CG2 VAL A 104 28.069 11.065 -22.089 1.00 18.65 C ATOM 1554 HA VAL A 104 27.403 11.676 -24.598 1.00 0.00 H ATOM 1555 HB VAL A 104 29.319 9.761 -23.244 1.00 0.00 H ATOM 1556 HG11 VAL A 104 30.529 11.484 -24.462 1.00 0.00 H ATOM 1557 HG12 VAL A 104 29.518 12.741 -23.706 1.00 0.00 H ATOM 1558 HG13 VAL A 104 30.616 11.760 -22.704 1.00 0.00 H ATOM 1559 HG21 VAL A 104 27.594 12.040 -22.195 1.00 0.00 H ATOM 1560 HG22 VAL A 104 27.306 10.302 -21.937 1.00 0.00 H ATOM 1561 HG23 VAL A 104 28.745 11.080 -21.234 1.00 0.00 H ATOM 1562 H VAL A 104 27.259 8.702 -24.222 1.00 0.00 H ATOM 1563 N THR A 105 28.734 11.511 -26.700 1.00 26.03 N ATOM 1564 CA THR A 105 29.553 11.478 -27.898 1.00 35.50 C ATOM 1565 C THR A 105 30.727 12.421 -27.735 1.00 41.10 C ATOM 1566 O THR A 105 30.557 13.581 -27.366 1.00 43.63 O ATOM 1567 CB THR A 105 28.747 11.902 -29.124 1.00 41.54 C ATOM 1568 OG1 THR A 105 27.641 11.011 -29.292 1.00 33.66 O ATOM 1569 CG2 THR A 105 29.633 11.892 -30.381 1.00 47.41 C ATOM 1570 HA THR A 105 29.904 10.456 -28.042 1.00 0.00 H ATOM 1571 HB THR A 105 28.377 12.917 -28.976 1.00 0.00 H ATOM 1572 HG1 THR A 105 27.065 11.046 -28.487 1.00 0.00 H ATOM 1573 HG23 THR A 105 30.471 12.575 -30.239 1.00 0.00 H ATOM 1574 HG21 THR A 105 30.009 10.883 -30.551 1.00 0.00 H ATOM 1575 HG22 THR A 105 29.045 12.211 -31.241 1.00 0.00 H ATOM 1576 H THR A 105 28.138 12.343 -26.513 1.00 0.00 H ATOM 1577 N VAL A 106 31.923 11.917 -27.996 1.00 35.86 N ATOM 1578 CA VAL A 106 33.108 12.755 -27.999 1.00 41.45 C ATOM 1579 C VAL A 106 33.475 13.151 -29.432 1.00 59.46 C ATOM 1580 O VAL A 106 33.914 12.315 -30.222 1.00 61.27 O ATOM 1581 CB VAL A 106 34.272 12.024 -27.370 1.00 40.35 C ATOM 1582 CG1 VAL A 106 35.463 12.955 -27.253 1.00 47.64 C ATOM 1583 CG2 VAL A 106 33.862 11.475 -25.997 1.00 36.77 C ATOM 1584 HA VAL A 106 32.892 13.653 -27.420 1.00 0.00 H ATOM 1585 HB VAL A 106 34.558 11.183 -28.002 1.00 0.00 H ATOM 1586 HG11 VAL A 106 35.750 13.303 -28.246 1.00 0.00 H ATOM 1587 HG12 VAL A 106 35.195 13.809 -26.631 1.00 0.00 H ATOM 1588 HG13 VAL A 106 36.297 12.420 -26.799 1.00 0.00 H ATOM 1589 HG21 VAL A 106 33.563 12.301 -25.351 1.00 0.00 H ATOM 1590 HG22 VAL A 106 33.026 10.786 -26.118 1.00 0.00 H ATOM 1591 HG23 VAL A 106 34.706 10.950 -25.550 1.00 0.00 H ATOM 1592 H VAL A 106 32.015 10.902 -28.203 1.00 0.00 H ATOM 1593 N LEU A 106A 33.285 14.428 -29.758 1.00 51.54 N ATOM 1594 CA LEU A 106A 33.511 14.950 -31.106 1.00 57.42 C ATOM 1595 C LEU A 106A 34.929 15.457 -31.322 1.00 72.43 C ATOM 1596 O LEU A 106A 35.901 14.883 -30.828 1.00 78.66 O ATOM 1597 CB LEU A 106A 32.571 16.123 -31.360 1.00 56.27 C ATOM 1598 CG LEU A 106A 31.074 15.860 -31.415 1.00 52.03 C ATOM 1599 CD1 LEU A 106A 30.334 17.187 -31.457 1.00 50.01 C ATOM 1600 CD2 LEU A 106A 30.736 15.003 -32.621 1.00 50.10 C ATOM 1601 HA LEU A 106A 33.332 14.119 -31.788 1.00 0.00 H ATOM 1602 HB2 LEU A 106A 32.741 16.849 -30.565 1.00 0.00 H ATOM 1603 HB3 LEU A 106A 32.855 16.561 -32.317 1.00 0.00 H ATOM 1604 HG LEU A 106A 30.763 15.315 -30.524 1.00 0.00 H ATOM 1605 HD21 LEU A 106A 31.041 15.521 -33.530 1.00 0.00 H ATOM 1606 HD22 LEU A 106A 31.263 14.052 -32.549 1.00 0.00 H ATOM 1607 HD23 LEU A 106A 29.661 14.823 -32.647 1.00 0.00 H ATOM 1608 HD11 LEU A 106A 30.572 17.763 -30.563 1.00 0.00 H ATOM 1609 HD12 LEU A 106A 30.641 17.745 -32.342 1.00 0.00 H ATOM 1610 HD13 LEU A 106A 29.261 17.002 -31.496 1.00 0.00 H ATOM 1611 H LEU A 106A 32.961 15.085 -29.020 1.00 0.00 H ATOM 1612 N ASP A 107 35.018 16.543 -32.088 1.00 78.44 N ATOM 1613 CA ASP A 107 36.247 17.315 -32.265 1.00 86.39 C ATOM 1614 C ASP A 107 36.048 18.424 -33.302 1.00 86.80 C ATOM 1615 O ASP A 107 34.947 18.962 -33.458 1.00 72.80 O ATOM 1616 CB ASP A 107 37.425 16.421 -32.665 1.00 94.46 C ATOM 1617 CG ASP A 107 38.764 16.974 -32.192 1.00 98.43 C ATOM 1618 OD1 ASP A 107 38.889 18.213 -32.063 1.00 96.16 O ATOM 1619 OD2 ASP A 107 39.687 16.169 -31.943 1.00 95.64 O ATOM 1620 HA ASP A 107 36.484 17.771 -31.304 1.00 0.00 H ATOM 1621 HB2 ASP A 107 37.280 15.434 -32.227 1.00 0.00 H ATOM 1622 HB3 ASP A 107 37.446 16.335 -33.751 1.00 0.00 H ATOM 1623 H ASP A 107 34.164 16.860 -32.589 1.00 0.00 H TER 1624 ASP A 107 HETATM 1625 N PCA B 1 8.958 -13.057 -14.876 1.00 64.07 N HETATM 1626 CA PCA B 1 9.445 -13.796 -13.714 1.00 61.22 C HETATM 1627 C PCA B 1 10.956 -13.644 -13.562 1.00 54.23 C HETATM 1628 O PCA B 1 11.673 -13.430 -14.544 1.00 49.73 O HETATM 1629 CB PCA B 1 9.057 -15.272 -13.815 1.00 64.94 C HETATM 1630 CG PCA B 1 8.641 -15.512 -15.257 1.00 68.06 C HETATM 1631 CD PCA B 1 8.650 -14.120 -15.840 1.00 66.88 C HETATM 1632 OE PCA B 1 8.407 -13.921 -17.033 1.00 77.50 O HETATM 1633 HG2 PCA B 1 7.647 -15.955 -15.311 1.00 0.00 H HETATM 1634 HG1 PCA B 1 9.354 -16.158 -15.770 1.00 0.00 H HETATM 1635 HB2 PCA B 1 8.228 -15.490 -13.142 1.00 0.00 H HETATM 1636 HB1 PCA B 1 9.907 -15.904 -13.558 1.00 0.00 H HETATM 1637 HA PCA B 1 8.975 -13.376 -12.825 1.00 0.00 H ATOM 1638 N PRO B 2 11.450 -13.763 -12.325 1.00 40.89 N ATOM 1639 CA PRO B 2 12.888 -13.623 -12.084 1.00 37.67 C ATOM 1640 C PRO B 2 13.678 -14.648 -12.899 1.00 28.75 C ATOM 1641 O PRO B 2 13.286 -15.816 -13.001 1.00 27.28 O ATOM 1642 CB PRO B 2 13.030 -13.929 -10.592 1.00 31.83 C ATOM 1643 CG PRO B 2 11.649 -13.747 -10.022 1.00 50.05 C ATOM 1644 CD PRO B 2 10.706 -14.122 -11.107 1.00 52.69 C ATOM 1645 HA PRO B 2 13.267 -12.641 -12.367 1.00 0.00 H ATOM 1646 HD3 PRO B 2 10.483 -15.189 -11.083 1.00 0.00 H ATOM 1647 HD2 PRO B 2 9.777 -13.557 -11.033 1.00 0.00 H ATOM 1648 HG3 PRO B 2 11.494 -12.709 -9.727 1.00 0.00 H ATOM 1649 HG2 PRO B 2 11.508 -14.394 -9.156 1.00 0.00 H ATOM 1650 HB2 PRO B 2 13.375 -14.952 -10.442 1.00 0.00 H ATOM 1651 HB3 PRO B 2 13.732 -13.238 -10.124 1.00 0.00 H ATOM 1652 N VAL B 3 14.797 -14.210 -13.455 1.00 25.54 N ATOM 1653 CA VAL B 3 15.609 -15.080 -14.283 1.00 22.77 C ATOM 1654 C VAL B 3 16.521 -15.961 -13.427 1.00 20.02 C ATOM 1655 O VAL B 3 16.869 -17.057 -13.837 1.00 23.95 O ATOM 1656 CB VAL B 3 16.418 -14.256 -15.334 1.00 22.20 C ATOM 1657 CG1 VAL B 3 17.502 -15.106 -16.019 1.00 19.43 C ATOM 1658 CG2 VAL B 3 15.477 -13.622 -16.349 1.00 20.13 C ATOM 1659 HA VAL B 3 14.942 -15.744 -14.833 1.00 0.00 H ATOM 1660 HB VAL B 3 16.938 -13.457 -14.806 1.00 0.00 H ATOM 1661 HG11 VAL B 3 18.198 -15.479 -15.268 1.00 0.00 H ATOM 1662 HG12 VAL B 3 17.033 -15.946 -16.531 1.00 0.00 H ATOM 1663 HG13 VAL B 3 18.040 -14.493 -16.742 1.00 0.00 H ATOM 1664 HG21 VAL B 3 14.919 -14.404 -16.863 1.00 0.00 H ATOM 1665 HG22 VAL B 3 14.783 -12.958 -15.834 1.00 0.00 H ATOM 1666 HG23 VAL B 3 16.058 -13.052 -17.074 1.00 0.00 H ATOM 1667 H VAL B 3 15.098 -13.227 -13.295 1.00 0.00 H ATOM 1668 N LEU B 4 16.922 -15.490 -12.247 1.00 19.38 N ATOM 1669 CA LEU B 4 17.747 -16.308 -11.358 1.00 17.94 C ATOM 1670 C LEU B 4 16.836 -17.055 -10.397 1.00 25.41 C ATOM 1671 O LEU B 4 15.780 -16.556 -10.032 1.00 26.36 O ATOM 1672 CB LEU B 4 18.762 -15.454 -10.578 1.00 16.58 C ATOM 1673 CG LEU B 4 19.678 -14.596 -11.461 1.00 18.20 C ATOM 1674 CD1 LEU B 4 20.605 -13.748 -10.580 1.00 15.90 C ATOM 1675 CD2 LEU B 4 20.487 -15.489 -12.433 1.00 14.09 C ATOM 1676 HA LEU B 4 18.318 -17.014 -11.961 1.00 0.00 H ATOM 1677 HB2 LEU B 4 18.210 -14.790 -9.913 1.00 0.00 H ATOM 1678 HB3 LEU B 4 19.387 -16.122 -9.986 1.00 0.00 H ATOM 1679 HG LEU B 4 19.067 -13.923 -12.063 1.00 0.00 H ATOM 1680 HD21 LEU B 4 21.098 -16.186 -11.860 1.00 0.00 H ATOM 1681 HD22 LEU B 4 19.800 -16.045 -13.070 1.00 0.00 H ATOM 1682 HD23 LEU B 4 21.130 -14.862 -13.050 1.00 0.00 H ATOM 1683 HD11 LEU B 4 20.005 -13.098 -9.944 1.00 0.00 H ATOM 1684 HD12 LEU B 4 21.214 -14.404 -9.959 1.00 0.00 H ATOM 1685 HD13 LEU B 4 21.252 -13.142 -11.214 1.00 0.00 H ATOM 1686 H LEU B 4 16.646 -14.531 -11.955 1.00 0.00 H ATOM 1687 N THR B 5 17.250 -18.243 -9.976 1.00 18.33 N ATOM 1688 CA THR B 5 16.381 -19.095 -9.189 1.00 22.62 C ATOM 1689 C THR B 5 16.755 -19.071 -7.718 1.00 22.48 C ATOM 1690 O THR B 5 17.870 -19.440 -7.359 1.00 24.97 O ATOM 1691 CB THR B 5 16.417 -20.559 -9.708 1.00 19.50 C ATOM 1692 OG1 THR B 5 15.900 -20.599 -11.042 1.00 21.50 O ATOM 1693 CG2 THR B 5 15.562 -21.466 -8.810 1.00 28.30 C ATOM 1694 HA THR B 5 15.370 -18.701 -9.296 1.00 0.00 H ATOM 1695 HB THR B 5 17.448 -20.914 -9.693 1.00 0.00 H ATOM 1696 HG1 THR B 5 16.455 -20.025 -11.627 1.00 0.00 H ATOM 1697 HG23 THR B 5 15.952 -21.439 -7.792 1.00 0.00 H ATOM 1698 HG21 THR B 5 14.531 -21.112 -8.815 1.00 0.00 H ATOM 1699 HG22 THR B 5 15.599 -22.488 -9.188 1.00 0.00 H ATOM 1700 H THR B 5 18.209 -18.567 -10.213 1.00 0.00 H ATOM 1701 N GLN B 6 15.810 -18.643 -6.875 1.00 17.35 N ATOM 1702 CA GLN B 6 15.978 -18.673 -5.420 1.00 21.46 C ATOM 1703 C GLN B 6 14.801 -19.364 -4.739 1.00 22.23 C ATOM 1704 O GLN B 6 13.675 -19.283 -5.216 1.00 32.16 O ATOM 1705 CB GLN B 6 16.062 -17.246 -4.832 1.00 23.22 C ATOM 1706 CG GLN B 6 17.305 -16.462 -5.223 1.00 25.66 C ATOM 1707 CD GLN B 6 17.376 -15.127 -4.494 1.00 22.56 C ATOM 1708 OE1 GLN B 6 17.090 -14.092 -5.074 1.00 21.38 O ATOM 1709 NE2 GLN B 6 17.712 -15.159 -3.205 1.00 28.34 N ATOM 1710 HA GLN B 6 16.903 -19.219 -5.235 1.00 0.00 H ATOM 1711 HB2 GLN B 6 15.189 -16.688 -5.172 1.00 0.00 H ATOM 1712 HB3 GLN B 6 16.040 -17.326 -3.745 1.00 0.00 H ATOM 1713 HG2 GLN B 6 18.188 -17.050 -4.973 1.00 0.00 H ATOM 1714 HG3 GLN B 6 17.285 -16.278 -6.297 1.00 0.00 H ATOM 1715 HE22 GLN B 6 17.948 -16.065 -2.752 1.00 0.00 H ATOM 1716 HE21 GLN B 6 17.738 -14.278 -2.652 1.00 0.00 H ATOM 1717 H GLN B 6 14.920 -18.274 -7.268 1.00 0.00 H ATOM 1718 N SER B 7 15.073 -20.036 -3.631 1.00 16.72 N ATOM 1719 CA SER B 7 13.995 -20.542 -2.771 1.00 29.95 C ATOM 1720 C SER B 7 13.134 -19.374 -2.301 1.00 36.56 C ATOM 1721 O SER B 7 13.665 -18.443 -1.704 1.00 39.09 O ATOM 1722 CB SER B 7 14.581 -21.254 -1.551 1.00 31.54 C ATOM 1723 OG SER B 7 13.533 -21.767 -0.726 1.00 41.50 O ATOM 1724 HA SER B 7 13.390 -21.248 -3.341 1.00 0.00 H ATOM 1725 HB2 SER B 7 15.180 -20.548 -0.975 1.00 0.00 H ATOM 1726 HB3 SER B 7 15.213 -22.077 -1.884 1.00 0.00 H ATOM 1727 HG SER B 7 12.959 -21.020 -0.421 1.00 0.00 H ATOM 1728 H SER B 7 16.064 -20.208 -3.366 1.00 0.00 H ATOM 1729 N PRO B 8 11.810 -19.414 -2.573 1.00 33.31 N ATOM 1730 CA PRO B 8 10.895 -18.312 -2.235 1.00 46.88 C ATOM 1731 C PRO B 8 10.925 -17.964 -0.749 1.00 51.26 C ATOM 1732 O PRO B 8 10.719 -16.799 -0.375 1.00 50.00 O ATOM 1733 CB PRO B 8 9.517 -18.866 -2.615 1.00 47.70 C ATOM 1734 CG PRO B 8 9.792 -19.942 -3.587 1.00 44.20 C ATOM 1735 CD PRO B 8 11.087 -20.553 -3.155 1.00 35.25 C ATOM 1736 HA PRO B 8 11.164 -17.391 -2.753 1.00 0.00 H ATOM 1737 HD3 PRO B 8 10.924 -21.335 -2.413 1.00 0.00 H ATOM 1738 HD2 PRO B 8 11.628 -20.968 -4.005 1.00 0.00 H ATOM 1739 HG3 PRO B 8 9.881 -19.533 -4.593 1.00 0.00 H ATOM 1740 HG2 PRO B 8 8.995 -20.685 -3.568 1.00 0.00 H ATOM 1741 HB2 PRO B 8 9.008 -19.264 -1.737 1.00 0.00 H ATOM 1742 HB3 PRO B 8 8.903 -18.088 -3.068 1.00 0.00 H ATOM 1743 N SER B 9 11.176 -18.967 0.088 1.00 34.17 N ATOM 1744 CA SER B 9 11.322 -18.741 1.527 1.00 48.39 C ATOM 1745 C SER B 9 12.194 -19.794 2.202 1.00 50.09 C ATOM 1746 O SER B 9 12.502 -20.835 1.616 1.00 39.94 O ATOM 1747 CB SER B 9 9.950 -18.642 2.221 1.00 57.50 C ATOM 1748 OG SER B 9 9.110 -19.745 1.914 1.00 59.33 O ATOM 1749 HA SER B 9 11.834 -17.785 1.637 1.00 0.00 H ATOM 1750 HB2 SER B 9 9.458 -17.725 1.896 1.00 0.00 H ATOM 1751 HB3 SER B 9 10.104 -18.608 3.300 1.00 0.00 H ATOM 1752 HG SER B 9 8.243 -19.638 2.380 1.00 0.00 H ATOM 1753 H SER B 9 11.271 -19.932 -0.288 1.00 0.00 H ATOM 1754 N VAL B 11 12.597 -19.507 3.437 1.00 42.99 N ATOM 1755 CA VAL B 11 13.414 -20.426 4.228 1.00 51.38 C ATOM 1756 C VAL B 11 13.361 -20.079 5.722 1.00 63.87 C ATOM 1757 O VAL B 11 14.037 -19.159 6.182 1.00 57.23 O ATOM 1758 CB VAL B 11 14.893 -20.468 3.748 1.00 41.08 C ATOM 1759 CG1 VAL B 11 15.612 -19.149 4.018 1.00 33.37 C ATOM 1760 CG2 VAL B 11 15.640 -21.608 4.414 1.00 37.11 C ATOM 1761 HA VAL B 11 12.986 -21.417 4.080 1.00 0.00 H ATOM 1762 HB VAL B 11 14.878 -20.631 2.670 1.00 0.00 H ATOM 1763 HG11 VAL B 11 15.102 -18.344 3.489 1.00 0.00 H ATOM 1764 HG12 VAL B 11 15.604 -18.945 5.089 1.00 0.00 H ATOM 1765 HG13 VAL B 11 16.642 -19.220 3.668 1.00 0.00 H ATOM 1766 HG21 VAL B 11 15.623 -21.469 5.495 1.00 0.00 H ATOM 1767 HG22 VAL B 11 15.159 -22.553 4.160 1.00 0.00 H ATOM 1768 HG23 VAL B 11 16.672 -21.618 4.064 1.00 0.00 H ATOM 1769 H VAL B 11 12.321 -18.596 3.855 1.00 0.00 H ATOM 1770 N SER B 12 12.556 -20.824 6.477 1.00 52.95 N ATOM 1771 CA SER B 12 12.433 -20.588 7.915 1.00 53.05 C ATOM 1772 C SER B 12 13.649 -21.070 8.717 1.00 54.65 C ATOM 1773 O SER B 12 14.387 -21.964 8.297 1.00 53.63 O ATOM 1774 CB SER B 12 11.136 -21.193 8.462 1.00 65.07 C ATOM 1775 OG SER B 12 10.012 -20.402 8.106 1.00 67.02 O ATOM 1776 HA SER B 12 12.396 -19.506 8.044 1.00 0.00 H ATOM 1777 HB2 SER B 12 11.201 -21.251 9.549 1.00 0.00 H ATOM 1778 HB3 SER B 12 11.010 -22.195 8.053 1.00 0.00 H ATOM 1779 HG SER B 12 9.190 -20.815 8.472 1.00 0.00 H ATOM 1780 H SER B 12 12.005 -21.588 6.036 1.00 0.00 H ATOM 1781 N GLY B 13 13.858 -20.456 9.877 1.00108.33 N ATOM 1782 CA GLY B 13 14.999 -20.774 10.714 1.00110.20 C ATOM 1783 C GLY B 13 14.799 -20.305 12.143 1.00125.58 C ATOM 1784 O GLY B 13 13.834 -19.608 12.461 1.00133.19 O ATOM 1785 HA3 GLY B 13 15.884 -20.288 10.304 1.00 0.00 H ATOM 1786 HA2 GLY B 13 15.146 -21.854 10.714 1.00 0.00 H ATOM 1787 H GLY B 13 13.186 -19.728 10.193 1.00 0.00 H ATOM 1788 N THR B 14 15.713 -20.699 13.017 1.00 54.11 N ATOM 1789 CA THR B 14 15.665 -20.258 14.400 1.00 62.53 C ATOM 1790 C THR B 14 17.055 -19.838 14.847 1.00 69.49 C ATOM 1791 O THR B 14 18.051 -20.476 14.490 1.00 65.40 O ATOM 1792 CB THR B 14 15.103 -21.351 15.329 1.00 69.85 C ATOM 1793 OG1 THR B 14 15.819 -22.576 15.117 1.00 64.62 O ATOM 1794 CG2 THR B 14 13.634 -21.574 15.042 1.00 64.21 C ATOM 1795 HA THR B 14 14.990 -19.405 14.464 1.00 0.00 H ATOM 1796 HB THR B 14 15.221 -21.030 16.364 1.00 0.00 H ATOM 1797 HG1 THR B 14 16.778 -22.435 15.316 1.00 0.00 H ATOM 1798 HG23 THR B 14 13.088 -20.644 15.203 1.00 0.00 H ATOM 1799 HG21 THR B 14 13.512 -21.894 14.007 1.00 0.00 H ATOM 1800 HG22 THR B 14 13.247 -22.344 15.710 1.00 0.00 H ATOM 1801 H THR B 14 16.477 -21.334 12.708 1.00 0.00 H ATOM 1802 N PRO B 15 17.120 -18.757 15.638 1.00107.12 N ATOM 1803 CA PRO B 15 18.361 -18.101 16.070 1.00101.74 C ATOM 1804 C PRO B 15 19.482 -19.078 16.433 1.00101.51 C ATOM 1805 O PRO B 15 19.229 -20.151 16.987 1.00 99.19 O ATOM 1806 CB PRO B 15 17.923 -17.273 17.292 1.00110.78 C ATOM 1807 CG PRO B 15 16.467 -17.640 17.550 1.00114.03 C ATOM 1808 CD PRO B 15 15.932 -18.147 16.259 1.00104.01 C ATOM 1809 HA PRO B 15 18.794 -17.505 15.267 1.00 0.00 H ATOM 1810 HD3 PRO B 15 15.148 -18.887 16.421 1.00 0.00 H ATOM 1811 HD2 PRO B 15 15.542 -17.333 15.648 1.00 0.00 H ATOM 1812 HG3 PRO B 15 15.907 -16.762 17.873 1.00 0.00 H ATOM 1813 HG2 PRO B 15 16.402 -18.413 18.316 1.00 0.00 H ATOM 1814 HB2 PRO B 15 18.536 -17.523 18.158 1.00 0.00 H ATOM 1815 HB3 PRO B 15 18.013 -16.208 17.080 1.00 0.00 H ATOM 1816 N GLY B 16 20.713 -18.698 16.103 1.00 72.68 N ATOM 1817 CA GLY B 16 21.868 -19.536 16.353 1.00 72.58 C ATOM 1818 C GLY B 16 22.418 -20.203 15.104 1.00 69.34 C ATOM 1819 O GLY B 16 23.624 -20.157 14.843 1.00 70.79 O ATOM 1820 HA3 GLY B 16 21.583 -20.313 17.062 1.00 0.00 H ATOM 1821 HA2 GLY B 16 22.654 -18.919 16.789 1.00 0.00 H ATOM 1822 H GLY B 16 20.851 -17.771 15.652 1.00 0.00 H ATOM 1823 N GLN B 17 21.536 -20.819 14.324 1.00 89.33 N ATOM 1824 CA GLN B 17 21.965 -21.669 13.208 1.00 93.60 C ATOM 1825 C GLN B 17 22.434 -20.913 11.953 1.00 83.85 C ATOM 1826 O GLN B 17 22.064 -19.754 11.728 1.00 75.03 O ATOM 1827 CB GLN B 17 20.875 -22.692 12.858 1.00 87.40 C ATOM 1828 CG GLN B 17 19.479 -22.098 12.711 1.00 86.68 C ATOM 1829 CD GLN B 17 18.395 -23.161 12.630 1.00 93.08 C ATOM 1830 OE1 GLN B 17 18.652 -24.347 12.853 1.00101.98 O ATOM 1831 NE2 GLN B 17 17.178 -22.741 12.307 1.00 78.24 N ATOM 1832 HA GLN B 17 22.855 -22.185 13.569 1.00 0.00 H ATOM 1833 HB2 GLN B 17 21.144 -23.169 11.915 1.00 0.00 H ATOM 1834 HB3 GLN B 17 20.845 -23.443 13.648 1.00 0.00 H ATOM 1835 HG2 GLN B 17 19.279 -21.460 13.572 1.00 0.00 H ATOM 1836 HG3 GLN B 17 19.449 -21.499 11.801 1.00 0.00 H ATOM 1837 HE22 GLN B 17 17.007 -21.731 12.127 1.00 0.00 H ATOM 1838 HE21 GLN B 17 16.395 -23.422 12.233 1.00 0.00 H ATOM 1839 H GLN B 17 20.520 -20.696 14.509 1.00 0.00 H ATOM 1840 N LYS B 18 23.256 -21.594 11.153 1.00 88.63 N ATOM 1841 CA LYS B 18 23.825 -21.046 9.919 1.00 79.22 C ATOM 1842 C LYS B 18 23.033 -21.468 8.688 1.00 72.02 C ATOM 1843 O LYS B 18 23.055 -22.638 8.298 1.00 66.24 O ATOM 1844 CB LYS B 18 25.275 -21.505 9.754 1.00 75.04 C ATOM 1845 CG LYS B 18 25.761 -21.496 8.317 1.00 60.37 C ATOM 1846 CD LYS B 18 27.179 -22.003 8.220 1.00 62.50 C ATOM 1847 CE LYS B 18 27.701 -21.875 6.811 1.00 60.03 C ATOM 1848 NZ LYS B 18 29.142 -22.238 6.718 1.00 68.19 N ATOM 1849 HA LYS B 18 23.780 -19.960 10.003 1.00 0.00 H ATOM 1850 HB2 LYS B 18 25.914 -20.842 10.337 1.00 0.00 H ATOM 1851 HB3 LYS B 18 25.360 -22.521 10.139 1.00 0.00 H ATOM 1852 HG2 LYS B 18 25.112 -22.135 7.717 1.00 0.00 H ATOM 1853 HG3 LYS B 18 25.720 -20.477 7.933 1.00 0.00 H ATOM 1854 HD2 LYS B 18 27.813 -21.422 8.890 1.00 0.00 H ATOM 1855 HD3 LYS B 18 27.204 -23.052 8.516 1.00 0.00 H ATOM 1856 HE2 LYS B 18 27.575 -20.844 6.480 1.00 0.00 H ATOM 1857 HE3 LYS B 18 27.128 -22.536 6.161 1.00 0.00 H ATOM 1858 HZ1 LYS B 18 29.697 -21.607 7.330 1.00 0.00 H ATOM 1859 HZ2 LYS B 18 29.271 -23.223 7.026 1.00 0.00 H ATOM 1860 HZ3 LYS B 18 29.461 -22.136 5.733 1.00 0.00 H ATOM 1861 H LYS B 18 23.507 -22.567 11.420 1.00 0.00 H ATOM 1862 N VAL B 19 22.345 -20.511 8.073 1.00 79.17 N ATOM 1863 CA VAL B 19 21.548 -20.787 6.887 1.00 74.45 C ATOM 1864 C VAL B 19 22.326 -20.477 5.609 1.00 68.69 C ATOM 1865 O VAL B 19 23.333 -19.764 5.634 1.00 58.32 O ATOM 1866 CB VAL B 19 20.251 -19.965 6.882 1.00 69.43 C ATOM 1867 CG1 VAL B 19 19.541 -20.087 8.222 1.00 77.77 C ATOM 1868 CG2 VAL B 19 20.551 -18.510 6.559 1.00 68.39 C ATOM 1869 HA VAL B 19 21.305 -21.849 6.915 1.00 0.00 H ATOM 1870 HB VAL B 19 19.590 -20.358 6.110 1.00 0.00 H ATOM 1871 HG11 VAL B 19 19.298 -21.133 8.409 1.00 0.00 H ATOM 1872 HG12 VAL B 19 20.194 -19.717 9.013 1.00 0.00 H ATOM 1873 HG13 VAL B 19 18.624 -19.498 8.201 1.00 0.00 H ATOM 1874 HG21 VAL B 19 21.228 -18.104 7.311 1.00 0.00 H ATOM 1875 HG22 VAL B 19 21.018 -18.446 5.576 1.00 0.00 H ATOM 1876 HG23 VAL B 19 19.622 -17.940 6.559 1.00 0.00 H ATOM 1877 H VAL B 19 22.377 -19.542 8.449 1.00 0.00 H ATOM 1878 N THR B 20 21.857 -21.018 4.490 1.00 70.03 N ATOM 1879 CA THR B 20 22.454 -20.704 3.198 1.00 54.33 C ATOM 1880 C THR B 20 21.388 -20.475 2.134 1.00 52.10 C ATOM 1881 O THR B 20 20.509 -21.313 1.910 1.00 45.71 O ATOM 1882 CB THR B 20 23.465 -21.766 2.750 1.00 52.99 C ATOM 1883 OG1 THR B 20 24.591 -21.755 3.638 1.00 56.65 O ATOM 1884 CG2 THR B 20 23.951 -21.470 1.341 1.00 45.48 C ATOM 1885 HA THR B 20 23.007 -19.773 3.326 1.00 0.00 H ATOM 1886 HB THR B 20 22.979 -22.742 2.767 1.00 0.00 H ATOM 1887 HG1 THR B 20 25.244 -22.441 3.349 1.00 0.00 H ATOM 1888 HG23 THR B 20 23.103 -21.476 0.657 1.00 0.00 H ATOM 1889 HG21 THR B 20 24.429 -20.490 1.321 1.00 0.00 H ATOM 1890 HG22 THR B 20 24.669 -22.232 1.038 1.00 0.00 H ATOM 1891 H THR B 20 21.052 -21.675 4.537 1.00 0.00 H ATOM 1892 N ILE B 21 21.471 -19.309 1.501 1.00 64.51 N ATOM 1893 CA ILE B 21 20.551 -18.908 0.452 1.00 47.72 C ATOM 1894 C ILE B 21 21.215 -19.157 -0.901 1.00 39.66 C ATOM 1895 O ILE B 21 22.356 -18.747 -1.117 1.00 34.49 O ATOM 1896 CB ILE B 21 20.213 -17.422 0.596 1.00 48.52 C ATOM 1897 CG1 ILE B 21 19.557 -17.170 1.956 1.00 58.57 C ATOM 1898 CG2 ILE B 21 19.302 -16.958 -0.517 1.00 32.50 C ATOM 1899 CD1 ILE B 21 20.031 -15.907 2.625 1.00 52.76 C ATOM 1900 HA ILE B 21 19.630 -19.486 0.527 1.00 0.00 H ATOM 1901 HB ILE B 21 21.139 -16.851 0.530 1.00 0.00 H ATOM 1902 HG12 ILE B 21 18.479 -17.101 1.812 1.00 0.00 H ATOM 1903 HG13 ILE B 21 19.782 -18.013 2.610 1.00 0.00 H ATOM 1904 HD11 ILE B 21 21.107 -15.965 2.786 1.00 0.00 H ATOM 1905 HD12 ILE B 21 19.803 -15.052 1.988 1.00 0.00 H ATOM 1906 HD13 ILE B 21 19.524 -15.793 3.583 1.00 0.00 H ATOM 1907 HG21 ILE B 21 19.796 -17.111 -1.477 1.00 0.00 H ATOM 1908 HG22 ILE B 21 18.375 -17.530 -0.488 1.00 0.00 H ATOM 1909 HG23 ILE B 21 19.081 -15.899 -0.386 1.00 0.00 H ATOM 1910 H ILE B 21 22.231 -18.653 1.770 1.00 0.00 H ATOM 1911 N PHE B 22 20.507 -19.840 -1.799 1.00 48.22 N ATOM 1912 CA PHE B 22 21.078 -20.207 -3.097 1.00 41.19 C ATOM 1913 C PHE B 22 20.519 -19.355 -4.227 1.00 25.20 C ATOM 1914 O PHE B 22 19.430 -18.787 -4.115 1.00 29.23 O ATOM 1915 CB PHE B 22 20.871 -21.702 -3.393 1.00 40.68 C ATOM 1916 CG PHE B 22 21.784 -22.611 -2.603 1.00 49.18 C ATOM 1917 CD1 PHE B 22 23.077 -22.859 -3.033 1.00 44.84 C ATOM 1918 CD2 PHE B 22 21.348 -23.212 -1.424 1.00 57.72 C ATOM 1919 CE1 PHE B 22 23.930 -23.696 -2.309 1.00 63.38 C ATOM 1920 CE2 PHE B 22 22.190 -24.039 -0.698 1.00 63.01 C ATOM 1921 CZ PHE B 22 23.486 -24.284 -1.144 1.00 63.11 C ATOM 1922 HA PHE B 22 22.149 -20.013 -3.038 1.00 0.00 H ATOM 1923 HB2 PHE B 22 19.839 -21.960 -3.156 1.00 0.00 H ATOM 1924 HB3 PHE B 22 21.052 -21.871 -4.455 1.00 0.00 H ATOM 1925 HD2 PHE B 22 20.334 -23.030 -1.069 1.00 0.00 H ATOM 1926 HE2 PHE B 22 21.837 -24.499 0.225 1.00 0.00 H ATOM 1927 HZ PHE B 22 24.147 -24.938 -0.575 1.00 0.00 H ATOM 1928 HE1 PHE B 22 24.943 -23.883 -2.664 1.00 0.00 H ATOM 1929 HD1 PHE B 22 23.435 -22.394 -3.951 1.00 0.00 H ATOM 1930 H PHE B 22 19.530 -20.118 -1.574 1.00 0.00 H ATOM 1931 N CYS B 23 21.281 -19.263 -5.316 1.00 43.06 N ATOM 1932 CA CYS B 23 20.936 -18.404 -6.453 1.00 30.46 C ATOM 1933 C CYS B 23 21.500 -19.023 -7.732 1.00 25.11 C ATOM 1934 O CYS B 23 22.670 -18.845 -8.027 1.00 25.79 O ATOM 1935 CB CYS B 23 21.569 -17.021 -6.263 1.00 31.36 C ATOM 1936 SG CYS B 23 21.410 -15.873 -7.657 1.00 23.46 S ATOM 1937 HA CYS B 23 19.852 -18.310 -6.520 1.00 0.00 H ATOM 1938 HB2 CYS B 23 22.632 -17.165 -6.069 1.00 0.00 H ATOM 1939 HB3 CYS B 23 21.102 -16.557 -5.394 1.00 0.00 H ATOM 1940 H CYS B 23 22.156 -19.823 -5.361 1.00 0.00 H ATOM 1941 N SER B 24 20.690 -19.746 -8.493 1.00 22.74 N ATOM 1942 CA SER B 24 21.249 -20.403 -9.675 1.00 27.21 C ATOM 1943 C SER B 24 20.816 -19.718 -10.964 1.00 17.45 C ATOM 1944 O SER B 24 19.680 -19.242 -11.109 1.00 15.50 O ATOM 1945 CB SER B 24 20.900 -21.894 -9.708 1.00 25.24 C ATOM 1946 OG SER B 24 19.516 -22.038 -9.858 1.00 32.00 O ATOM 1947 HA SER B 24 22.333 -20.313 -9.602 1.00 0.00 H ATOM 1948 HB2 SER B 24 21.217 -22.364 -8.777 1.00 0.00 H ATOM 1949 HB3 SER B 24 21.410 -22.370 -10.546 1.00 0.00 H ATOM 1950 HG SER B 24 19.231 -21.610 -10.704 1.00 0.00 H ATOM 1951 H SER B 24 19.682 -19.844 -8.256 1.00 0.00 H ATOM 1952 N GLY B 25 21.749 -19.659 -11.908 1.00 22.03 N ATOM 1953 CA GLY B 25 21.482 -19.007 -13.168 1.00 16.60 C ATOM 1954 C GLY B 25 22.117 -19.768 -14.321 1.00 26.09 C ATOM 1955 O GLY B 25 21.986 -20.990 -14.442 1.00 21.94 O ATOM 1956 HA3 GLY B 25 21.890 -17.996 -13.140 1.00 0.00 H ATOM 1957 HA2 GLY B 25 20.404 -18.959 -13.323 1.00 0.00 H ATOM 1958 H GLY B 25 22.681 -20.087 -11.737 1.00 0.00 H ATOM 1959 N SER B 26 22.821 -19.042 -15.176 1.00 19.24 N ATOM 1960 CA SER B 26 23.371 -19.640 -16.379 1.00 19.70 C ATOM 1961 C SER B 26 24.792 -19.154 -16.608 1.00 25.08 C ATOM 1962 O SER B 26 25.334 -18.362 -15.817 1.00 17.26 O ATOM 1963 CB SER B 26 22.483 -19.283 -17.567 1.00 19.88 C ATOM 1964 OG SER B 26 22.605 -17.900 -17.864 1.00 27.99 O ATOM 1965 HA SER B 26 23.400 -20.724 -16.266 1.00 0.00 H ATOM 1966 HB2 SER B 26 21.445 -19.510 -17.324 1.00 0.00 H ATOM 1967 HB3 SER B 26 22.788 -19.868 -18.435 1.00 0.00 H ATOM 1968 HG SER B 26 22.026 -17.677 -18.635 1.00 0.00 H ATOM 1969 H SER B 26 22.982 -18.033 -14.984 1.00 0.00 H ATOM 1970 N SER B 27 25.398 -19.609 -17.703 1.00 15.86 N ATOM 1971 CA SER B 27 26.758 -19.186 -18.002 1.00 21.67 C ATOM 1972 C SER B 27 26.806 -17.692 -18.305 1.00 17.34 C ATOM 1973 O SER B 27 27.820 -17.037 -18.027 1.00 21.00 O ATOM 1974 CB SER B 27 27.347 -19.986 -19.170 1.00 26.07 C ATOM 1975 OG SER B 27 26.442 -19.999 -20.261 1.00 34.17 O ATOM 1976 HA SER B 27 27.365 -19.382 -17.118 1.00 0.00 H ATOM 1977 HB2 SER B 27 27.536 -21.010 -18.847 1.00 0.00 H ATOM 1978 HB3 SER B 27 28.284 -19.527 -19.485 1.00 0.00 H ATOM 1979 HG SER B 27 26.834 -20.518 -21.007 1.00 0.00 H ATOM 1980 H SER B 27 24.902 -20.263 -18.341 1.00 0.00 H ATOM 1981 N SER B 27A 25.732 -17.156 -18.884 1.00 17.36 N ATOM 1982 CA SER B 27A 25.741 -15.745 -19.299 1.00 23.58 C ATOM 1983 C SER B 27A 25.419 -14.752 -18.181 1.00 19.45 C ATOM 1984 O SER B 27A 25.640 -13.554 -18.340 1.00 18.22 O ATOM 1985 CB SER B 27A 24.823 -15.503 -20.496 1.00 20.83 C ATOM 1986 OG SER B 27A 23.468 -15.769 -20.166 1.00 22.19 O ATOM 1987 HA SER B 27A 26.774 -15.553 -19.589 1.00 0.00 H ATOM 1988 HB2 SER B 27A 25.125 -16.157 -21.314 1.00 0.00 H ATOM 1989 HB3 SER B 27A 24.915 -14.463 -20.811 1.00 0.00 H ATOM 1990 HG SER B 27A 23.187 -15.174 -19.426 1.00 0.00 H ATOM 1991 H SER B 27A 24.885 -17.737 -19.043 1.00 0.00 H ATOM 1992 N ASN B 27B 24.901 -15.231 -17.051 1.00 20.41 N ATOM 1993 CA ASN B 27B 24.772 -14.344 -15.895 1.00 16.15 C ATOM 1994 C ASN B 27B 25.725 -14.685 -14.730 1.00 20.60 C ATOM 1995 O ASN B 27B 26.837 -14.153 -14.633 1.00 24.98 O ATOM 1996 CB ASN B 27B 23.287 -14.157 -15.468 1.00 12.90 C ATOM 1997 CG ASN B 27B 22.501 -15.482 -15.367 1.00 18.80 C ATOM 1998 OD1 ASN B 27B 22.856 -16.360 -14.597 1.00 17.98 O ATOM 1999 ND2 ASN B 27B 21.399 -15.588 -16.116 1.00 14.54 N ATOM 2000 HA ASN B 27B 25.116 -13.364 -16.226 1.00 0.00 H ATOM 2001 HB2 ASN B 27B 23.267 -13.669 -14.493 1.00 0.00 H ATOM 2002 HB3 ASN B 27B 22.795 -13.519 -16.202 1.00 0.00 H ATOM 2003 HD22 ASN B 27B 21.132 -14.816 -16.760 1.00 0.00 H ATOM 2004 HD21 ASN B 27B 20.809 -16.442 -16.055 1.00 0.00 H ATOM 2005 H ASN B 27B 24.592 -16.222 -16.992 1.00 0.00 H ATOM 2006 N VAL B 28 25.306 -15.584 -13.851 1.00 18.80 N ATOM 2007 CA VAL B 28 26.096 -15.891 -12.668 1.00 16.61 C ATOM 2008 C VAL B 28 27.549 -16.297 -12.960 1.00 22.50 C ATOM 2009 O VAL B 28 28.461 -15.869 -12.265 1.00 31.49 O ATOM 2010 CB VAL B 28 25.400 -16.976 -11.804 1.00 22.96 C ATOM 2011 CG1 VAL B 28 26.339 -17.466 -10.689 1.00 27.04 C ATOM 2012 CG2 VAL B 28 24.118 -16.418 -11.207 1.00 22.43 C ATOM 2013 HA VAL B 28 26.153 -14.955 -12.113 1.00 0.00 H ATOM 2014 HB VAL B 28 25.155 -17.826 -12.441 1.00 0.00 H ATOM 2015 HG11 VAL B 28 27.238 -17.892 -11.134 1.00 0.00 H ATOM 2016 HG12 VAL B 28 26.611 -16.626 -10.050 1.00 0.00 H ATOM 2017 HG13 VAL B 28 25.831 -18.226 -10.096 1.00 0.00 H ATOM 2018 HG21 VAL B 28 24.354 -15.557 -10.582 1.00 0.00 H ATOM 2019 HG22 VAL B 28 23.448 -16.112 -12.010 1.00 0.00 H ATOM 2020 HG23 VAL B 28 23.636 -17.186 -10.602 1.00 0.00 H ATOM 2021 H VAL B 28 24.403 -16.075 -14.008 1.00 0.00 H ATOM 2022 N GLU B 29 27.765 -17.126 -13.976 1.00 20.40 N ATOM 2023 CA GLU B 29 29.106 -17.646 -14.212 1.00 30.24 C ATOM 2024 C GLU B 29 30.054 -16.578 -14.762 1.00 32.57 C ATOM 2025 O GLU B 29 31.174 -16.433 -14.281 1.00 37.41 O ATOM 2026 CB GLU B 29 29.100 -18.845 -15.157 1.00 24.98 C ATOM 2027 CG GLU B 29 30.439 -19.571 -15.092 1.00 40.23 C ATOM 2028 CD GLU B 29 30.410 -20.944 -15.703 1.00 47.45 C ATOM 2029 OE1 GLU B 29 29.505 -21.226 -16.520 1.00 40.44 O ATOM 2030 OE2 GLU B 29 31.305 -21.745 -15.354 1.00 61.93 O ATOM 2031 HA GLU B 29 29.470 -17.968 -13.236 1.00 0.00 H ATOM 2032 HB2 GLU B 29 28.304 -19.530 -14.866 1.00 0.00 H ATOM 2033 HB3 GLU B 29 28.926 -18.500 -16.176 1.00 0.00 H ATOM 2034 HG2 GLU B 29 31.181 -18.974 -15.622 1.00 0.00 H ATOM 2035 HG3 GLU B 29 30.730 -19.665 -14.046 1.00 0.00 H ATOM 2036 H GLU B 29 26.980 -17.403 -14.600 1.00 0.00 H ATOM 2037 N ASP B 30 29.578 -15.818 -15.744 1.00 22.15 N ATOM 2038 CA ASP B 30 30.416 -14.840 -16.441 1.00 26.26 C ATOM 2039 C ASP B 30 30.379 -13.418 -15.870 1.00 29.43 C ATOM 2040 O ASP B 30 31.136 -12.564 -16.309 1.00 27.18 O ATOM 2041 CB ASP B 30 30.081 -14.816 -17.934 1.00 25.95 C ATOM 2042 CG ASP B 30 30.678 -16.001 -18.679 1.00 32.88 C ATOM 2043 OD1 ASP B 30 31.405 -16.785 -18.039 1.00 38.26 O ATOM 2044 OD2 ASP B 30 30.418 -16.151 -19.887 1.00 29.60 O ATOM 2045 HA ASP B 30 31.438 -15.185 -16.282 1.00 0.00 H ATOM 2046 HB2 ASP B 30 28.997 -14.838 -18.051 1.00 0.00 H ATOM 2047 HB3 ASP B 30 30.473 -13.896 -18.367 1.00 0.00 H ATOM 2048 H ASP B 30 28.582 -15.921 -16.025 1.00 0.00 H ATOM 2049 N ASN B 31 29.529 -13.169 -14.879 1.00 25.94 N ATOM 2050 CA ASN B 31 29.375 -11.816 -14.342 1.00 25.93 C ATOM 2051 C ASN B 31 29.384 -11.743 -12.825 1.00 27.35 C ATOM 2052 O ASN B 31 29.093 -12.729 -12.143 1.00 29.03 O ATOM 2053 CB ASN B 31 28.095 -11.175 -14.889 1.00 15.90 C ATOM 2054 CG ASN B 31 28.236 -10.768 -16.330 1.00 20.96 C ATOM 2055 OD1 ASN B 31 28.899 -9.790 -16.635 1.00 22.82 O ATOM 2056 ND2 ASN B 31 27.630 -11.527 -17.228 1.00 21.06 N ATOM 2057 HA ASN B 31 30.252 -11.261 -14.675 1.00 0.00 H ATOM 2058 HB2 ASN B 31 27.279 -11.892 -14.805 1.00 0.00 H ATOM 2059 HB3 ASN B 31 27.863 -10.291 -14.295 1.00 0.00 H ATOM 2060 HD22 ASN B 31 27.075 -12.352 -16.922 1.00 0.00 H ATOM 2061 HD21 ASN B 31 27.709 -11.299 -18.240 1.00 0.00 H ATOM 2062 H ASN B 31 28.965 -13.946 -14.479 1.00 0.00 H ATOM 2063 N SER B 32 29.701 -10.562 -12.300 1.00 25.75 N ATOM 2064 CA SER B 32 29.703 -10.335 -10.859 1.00 25.77 C ATOM 2065 C SER B 32 28.333 -10.514 -10.246 1.00 24.95 C ATOM 2066 O SER B 32 27.345 -9.998 -10.755 1.00 16.78 O ATOM 2067 CB SER B 32 30.204 -8.929 -10.536 1.00 34.33 C ATOM 2068 OG SER B 32 31.527 -8.757 -10.991 1.00 40.54 O ATOM 2069 HA SER B 32 30.372 -11.081 -10.431 1.00 0.00 H ATOM 2070 HB2 SER B 32 30.173 -8.776 -9.457 1.00 0.00 H ATOM 2071 HB3 SER B 32 29.559 -8.198 -11.024 1.00 0.00 H ATOM 2072 HG SER B 32 31.833 -7.841 -10.773 1.00 0.00 H ATOM 2073 H SER B 32 29.955 -9.778 -12.935 1.00 0.00 H ATOM 2074 N VAL B 33 28.275 -11.238 -9.135 1.00 26.74 N ATOM 2075 CA VAL B 33 27.016 -11.429 -8.435 1.00 23.30 C ATOM 2076 C VAL B 33 26.952 -10.502 -7.220 1.00 22.47 C ATOM 2077 O VAL B 33 27.943 -10.316 -6.523 1.00 31.03 O ATOM 2078 CB VAL B 33 26.830 -12.903 -8.037 1.00 21.98 C ATOM 2079 CG1 VAL B 33 25.585 -13.084 -7.159 1.00 23.13 C ATOM 2080 CG2 VAL B 33 26.764 -13.768 -9.290 1.00 18.85 C ATOM 2081 HA VAL B 33 26.194 -11.171 -9.103 1.00 0.00 H ATOM 2082 HB VAL B 33 27.687 -13.221 -7.443 1.00 0.00 H ATOM 2083 HG11 VAL B 33 25.691 -12.488 -6.253 1.00 0.00 H ATOM 2084 HG12 VAL B 33 24.703 -12.756 -7.709 1.00 0.00 H ATOM 2085 HG13 VAL B 33 25.479 -14.136 -6.893 1.00 0.00 H ATOM 2086 HG21 VAL B 33 25.923 -13.450 -9.906 1.00 0.00 H ATOM 2087 HG22 VAL B 33 27.690 -13.659 -9.854 1.00 0.00 H ATOM 2088 HG23 VAL B 33 26.632 -14.811 -9.003 1.00 0.00 H ATOM 2089 H VAL B 33 29.142 -11.674 -8.761 1.00 0.00 H ATOM 2090 N TYR B 34 25.795 -9.898 -6.988 1.00 18.49 N ATOM 2091 CA TYR B 34 25.617 -9.010 -5.839 1.00 23.59 C ATOM 2092 C TYR B 34 24.472 -9.554 -5.031 1.00 25.37 C ATOM 2093 O TYR B 34 23.554 -10.155 -5.589 1.00 21.97 O ATOM 2094 CB TYR B 34 25.261 -7.577 -6.270 1.00 24.72 C ATOM 2095 CG TYR B 34 26.251 -6.938 -7.201 1.00 21.26 C ATOM 2096 CD1 TYR B 34 27.171 -5.983 -6.743 1.00 25.71 C ATOM 2097 CD2 TYR B 34 26.268 -7.273 -8.544 1.00 18.66 C ATOM 2098 CE1 TYR B 34 28.078 -5.389 -7.617 1.00 22.92 C ATOM 2099 CE2 TYR B 34 27.173 -6.695 -9.416 1.00 22.10 C ATOM 2100 CZ TYR B 34 28.071 -5.756 -8.953 1.00 22.66 C ATOM 2101 OH TYR B 34 28.949 -5.196 -9.861 1.00 25.77 O ATOM 2102 HA TYR B 34 26.549 -8.970 -5.274 1.00 0.00 H ATOM 2103 HB3 TYR B 34 25.190 -6.960 -5.374 1.00 0.00 H ATOM 2104 HB2 TYR B 34 24.292 -7.603 -6.769 1.00 0.00 H ATOM 2105 HD2 TYR B 34 25.555 -8.006 -8.921 1.00 0.00 H ATOM 2106 HE2 TYR B 34 27.176 -6.981 -10.468 1.00 0.00 H ATOM 2107 HE1 TYR B 34 28.786 -4.644 -7.254 1.00 0.00 H ATOM 2108 HD1 TYR B 34 27.176 -5.702 -5.690 1.00 0.00 H ATOM 2109 HH TYR B 34 29.531 -4.544 -9.396 1.00 0.00 H ATOM 2110 H TYR B 34 24.998 -10.059 -7.636 1.00 0.00 H ATOM 2111 N TRP B 35 24.516 -9.316 -3.722 1.00 22.65 N ATOM 2112 CA TRP B 35 23.446 -9.700 -2.811 1.00 26.08 C ATOM 2113 C TRP B 35 22.949 -8.497 -2.015 1.00 29.27 C ATOM 2114 O TRP B 35 23.743 -7.695 -1.535 1.00 34.72 O ATOM 2115 CB TRP B 35 23.965 -10.749 -1.827 1.00 32.98 C ATOM 2116 CG TRP B 35 24.247 -12.084 -2.430 1.00 22.35 C ATOM 2117 CD1 TRP B 35 25.429 -12.517 -2.962 1.00 21.27 C ATOM 2118 CD2 TRP B 35 23.331 -13.177 -2.536 1.00 21.45 C ATOM 2119 NE1 TRP B 35 25.299 -13.821 -3.399 1.00 27.24 N ATOM 2120 CE2 TRP B 35 24.026 -14.247 -3.139 1.00 26.47 C ATOM 2121 CE3 TRP B 35 22.003 -13.361 -2.156 1.00 29.04 C ATOM 2122 CZ2 TRP B 35 23.419 -15.482 -3.391 1.00 29.44 C ATOM 2123 CZ3 TRP B 35 21.401 -14.589 -2.409 1.00 35.33 C ATOM 2124 CH2 TRP B 35 22.111 -15.630 -3.015 1.00 31.66 C ATOM 2125 HA TRP B 35 22.624 -10.102 -3.404 1.00 0.00 H ATOM 2126 HB2 TRP B 35 24.888 -10.374 -1.386 1.00 0.00 H ATOM 2127 HB3 TRP B 35 23.217 -10.881 -1.045 1.00 0.00 H ATOM 2128 HE1 TRP B 35 26.046 -14.386 -3.851 1.00 0.00 H ATOM 2129 HD1 TRP B 35 26.339 -11.922 -3.031 1.00 0.00 H ATOM 2130 HZ2 TRP B 35 23.966 -16.295 -3.868 1.00 0.00 H ATOM 2131 HH2 TRP B 35 21.611 -16.582 -3.192 1.00 0.00 H ATOM 2132 HZ3 TRP B 35 20.358 -14.742 -2.130 1.00 0.00 H ATOM 2133 HE3 TRP B 35 21.447 -12.559 -1.670 1.00 0.00 H ATOM 2134 H TRP B 35 25.351 -8.834 -3.332 1.00 0.00 H ATOM 2135 N TYR B 36 21.638 -8.376 -1.865 1.00 30.28 N ATOM 2136 CA TYR B 36 21.087 -7.347 -1.003 1.00 40.81 C ATOM 2137 C TYR B 36 19.999 -7.876 -0.090 1.00 53.52 C ATOM 2138 O TYR B 36 19.396 -8.920 -0.360 1.00 41.97 O ATOM 2139 CB TYR B 36 20.602 -6.119 -1.790 1.00 36.59 C ATOM 2140 CG TYR B 36 19.431 -6.311 -2.731 1.00 30.55 C ATOM 2141 CD1 TYR B 36 19.642 -6.610 -4.070 1.00 24.14 C ATOM 2142 CD2 TYR B 36 18.124 -6.133 -2.297 1.00 28.83 C ATOM 2143 CE1 TYR B 36 18.595 -6.759 -4.937 1.00 24.90 C ATOM 2144 CE2 TYR B 36 17.071 -6.276 -3.155 1.00 35.15 C ATOM 2145 CZ TYR B 36 17.310 -6.587 -4.480 1.00 29.73 C ATOM 2146 OH TYR B 36 16.265 -6.737 -5.356 1.00 31.21 O ATOM 2147 HA TYR B 36 21.911 -7.020 -0.368 1.00 0.00 H ATOM 2148 HB3 TYR B 36 21.442 -5.758 -2.383 1.00 0.00 H ATOM 2149 HB2 TYR B 36 20.317 -5.357 -1.064 1.00 0.00 H ATOM 2150 HD2 TYR B 36 17.935 -5.875 -1.255 1.00 0.00 H ATOM 2151 HE2 TYR B 36 16.050 -6.146 -2.797 1.00 0.00 H ATOM 2152 HE1 TYR B 36 18.778 -7.012 -5.981 1.00 0.00 H ATOM 2153 HD1 TYR B 36 20.661 -6.728 -4.437 1.00 0.00 H ATOM 2154 HH TYR B 36 15.676 -7.469 -5.043 1.00 0.00 H ATOM 2155 H TYR B 36 20.999 -9.024 -2.369 1.00 0.00 H ATOM 2156 N GLN B 37 19.765 -7.134 0.993 1.00 29.05 N ATOM 2157 CA GLN B 37 18.815 -7.510 2.032 1.00 38.71 C ATOM 2158 C GLN B 37 17.747 -6.438 2.141 1.00 48.61 C ATOM 2159 O GLN B 37 18.070 -5.256 2.224 1.00 50.84 O ATOM 2160 CB GLN B 37 19.563 -7.656 3.358 1.00 53.07 C ATOM 2161 CG GLN B 37 18.714 -7.566 4.619 1.00 58.15 C ATOM 2162 CD GLN B 37 19.581 -7.437 5.863 1.00 70.17 C ATOM 2163 OE1 GLN B 37 20.219 -6.409 6.081 1.00 70.70 O ATOM 2164 NE2 GLN B 37 19.631 -8.491 6.668 1.00 70.05 N ATOM 2165 HA GLN B 37 18.338 -8.459 1.786 1.00 0.00 H ATOM 2166 HB2 GLN B 37 20.057 -8.628 3.357 1.00 0.00 H ATOM 2167 HB3 GLN B 37 20.315 -6.868 3.405 1.00 0.00 H ATOM 2168 HG2 GLN B 37 18.063 -6.694 4.548 1.00 0.00 H ATOM 2169 HG3 GLN B 37 18.105 -8.466 4.702 1.00 0.00 H ATOM 2170 HE22 GLN B 37 19.075 -9.341 6.446 1.00 0.00 H ATOM 2171 HE21 GLN B 37 20.226 -8.466 7.520 1.00 0.00 H ATOM 2172 H GLN B 37 20.287 -6.241 1.102 1.00 0.00 H ATOM 2173 N GLN B 38 16.481 -6.843 2.118 1.00 37.31 N ATOM 2174 CA GLN B 38 15.380 -5.890 2.199 1.00 53.10 C ATOM 2175 C GLN B 38 14.413 -6.154 3.360 1.00 73.27 C ATOM 2176 O GLN B 38 13.611 -7.089 3.308 1.00 75.26 O ATOM 2177 CB GLN B 38 14.592 -5.867 0.892 1.00 45.10 C ATOM 2178 CG GLN B 38 13.497 -4.831 0.895 1.00 52.91 C ATOM 2179 CD GLN B 38 12.370 -5.188 -0.029 1.00 58.19 C ATOM 2180 OE1 GLN B 38 12.454 -6.159 -0.775 1.00 62.99 O ATOM 2181 NE2 GLN B 38 11.296 -4.412 0.017 1.00 72.37 N ATOM 2182 HA GLN B 38 15.847 -4.923 2.384 1.00 0.00 H ATOM 2183 HB2 GLN B 38 15.278 -5.648 0.074 1.00 0.00 H ATOM 2184 HB3 GLN B 38 14.144 -6.849 0.736 1.00 0.00 H ATOM 2185 HG2 GLN B 38 13.104 -4.739 1.908 1.00 0.00 H ATOM 2186 HG3 GLN B 38 13.918 -3.875 0.582 1.00 0.00 H ATOM 2187 HE22 GLN B 38 11.269 -3.599 0.665 1.00 0.00 H ATOM 2188 HE21 GLN B 38 10.480 -4.616 -0.595 1.00 0.00 H ATOM 2189 H GLN B 38 16.272 -7.859 2.041 1.00 0.00 H ATOM 2190 N PHE B 39 14.485 -5.322 4.399 1.00 54.75 N ATOM 2191 CA PHE B 39 13.489 -5.337 5.468 1.00 61.16 C ATOM 2192 C PHE B 39 12.207 -4.692 4.965 1.00 67.40 C ATOM 2193 O PHE B 39 12.242 -3.875 4.048 1.00 67.56 O ATOM 2194 CB PHE B 39 13.989 -4.573 6.690 1.00 73.01 C ATOM 2195 CG PHE B 39 15.143 -5.226 7.385 1.00 69.63 C ATOM 2196 CD1 PHE B 39 14.936 -6.296 8.236 1.00 72.34 C ATOM 2197 CD2 PHE B 39 16.433 -4.762 7.199 1.00 64.48 C ATOM 2198 CE1 PHE B 39 15.994 -6.895 8.883 1.00 76.77 C ATOM 2199 CE2 PHE B 39 17.499 -5.359 7.842 1.00 64.05 C ATOM 2200 CZ PHE B 39 17.280 -6.427 8.688 1.00 65.88 C ATOM 2201 HA PHE B 39 13.305 -6.372 5.757 1.00 0.00 H ATOM 2202 HB2 PHE B 39 14.299 -3.578 6.370 1.00 0.00 H ATOM 2203 HB3 PHE B 39 13.166 -4.484 7.400 1.00 0.00 H ATOM 2204 HD2 PHE B 39 16.610 -3.915 6.537 1.00 0.00 H ATOM 2205 HE2 PHE B 39 18.511 -4.988 7.682 1.00 0.00 H ATOM 2206 HZ PHE B 39 18.118 -6.900 9.200 1.00 0.00 H ATOM 2207 HE1 PHE B 39 15.817 -7.739 9.550 1.00 0.00 H ATOM 2208 HD1 PHE B 39 13.925 -6.669 8.396 1.00 0.00 H ATOM 2209 H PHE B 39 15.272 -4.644 4.450 1.00 0.00 H ATOM 2210 N PRO B 40 11.064 -5.054 5.564 1.00118.72 N ATOM 2211 CA PRO B 40 9.781 -4.489 5.125 1.00123.44 C ATOM 2212 C PRO B 40 9.741 -2.968 5.287 1.00129.75 C ATOM 2213 O PRO B 40 9.953 -2.467 6.392 1.00136.46 O ATOM 2214 CB PRO B 40 8.769 -5.154 6.065 1.00138.57 C ATOM 2215 CG PRO B 40 9.437 -6.428 6.500 1.00136.11 C ATOM 2216 CD PRO B 40 10.895 -6.080 6.608 1.00125.99 C ATOM 2217 HA PRO B 40 9.587 -4.671 4.068 1.00 0.00 H ATOM 2218 HD3 PRO B 40 11.132 -5.680 7.594 1.00 0.00 H ATOM 2219 HD2 PRO B 40 11.522 -6.949 6.410 1.00 0.00 H ATOM 2220 HG3 PRO B 40 9.283 -7.214 5.761 1.00 0.00 H ATOM 2221 HG2 PRO B 40 9.048 -6.756 7.464 1.00 0.00 H ATOM 2222 HB2 PRO B 40 8.563 -4.515 6.923 1.00 0.00 H ATOM 2223 HB3 PRO B 40 7.838 -5.367 5.540 1.00 0.00 H ATOM 2224 N GLY B 41 9.485 -2.249 4.196 1.00107.51 N ATOM 2225 CA GLY B 41 9.407 -0.797 4.233 1.00104.48 C ATOM 2226 C GLY B 41 10.730 -0.110 4.524 1.00101.88 C ATOM 2227 O GLY B 41 10.761 1.013 5.026 1.00109.28 O ATOM 2228 HA3 GLY B 41 8.696 -0.512 5.008 1.00 0.00 H ATOM 2229 HA2 GLY B 41 9.046 -0.449 3.265 1.00 0.00 H ATOM 2230 H GLY B 41 9.337 -2.740 3.291 1.00 0.00 H ATOM 2231 N THR B 42 11.829 -0.785 4.203 1.00 99.84 N ATOM 2232 CA THR B 42 13.163 -0.239 4.427 1.00 88.62 C ATOM 2233 C THR B 42 14.005 -0.357 3.159 1.00 79.70 C ATOM 2234 O THR B 42 13.857 -1.317 2.401 1.00 76.16 O ATOM 2235 CB THR B 42 13.882 -0.983 5.563 1.00 90.83 C ATOM 2236 OG1 THR B 42 13.019 -1.068 6.703 1.00105.54 O ATOM 2237 CG2 THR B 42 15.167 -0.268 5.948 1.00 88.68 C ATOM 2238 HA THR B 42 13.045 0.809 4.701 1.00 0.00 H ATOM 2239 HB THR B 42 14.134 -1.985 5.216 1.00 0.00 H ATOM 2240 HG1 THR B 42 12.196 -1.559 6.456 1.00 0.00 H ATOM 2241 HG23 THR B 42 15.821 -0.205 5.078 1.00 0.00 H ATOM 2242 HG21 THR B 42 14.931 0.736 6.300 1.00 0.00 H ATOM 2243 HG22 THR B 42 15.667 -0.824 6.741 1.00 0.00 H ATOM 2244 H THR B 42 11.735 -1.730 3.780 1.00 0.00 H ATOM 2245 N THR B 43 14.884 0.617 2.935 1.00 75.72 N ATOM 2246 CA THR B 43 15.788 0.606 1.789 1.00 66.00 C ATOM 2247 C THR B 43 16.761 -0.558 1.879 1.00 63.57 C ATOM 2248 O THR B 43 17.319 -0.818 2.940 1.00 67.18 O ATOM 2249 CB THR B 43 16.604 1.907 1.710 1.00 64.05 C ATOM 2250 OG1 THR B 43 15.721 3.006 1.459 1.00 73.91 O ATOM 2251 CG2 THR B 43 17.653 1.826 0.606 1.00 53.06 C ATOM 2252 HA THR B 43 15.168 0.507 0.898 1.00 0.00 H ATOM 2253 HB THR B 43 17.119 2.054 2.660 1.00 0.00 H ATOM 2254 HG1 THR B 43 15.248 2.859 0.602 1.00 0.00 H ATOM 2255 HG23 THR B 43 18.322 0.988 0.803 1.00 0.00 H ATOM 2256 HG21 THR B 43 17.158 1.680 -0.354 1.00 0.00 H ATOM 2257 HG22 THR B 43 18.227 2.753 0.583 1.00 0.00 H ATOM 2258 H THR B 43 14.928 1.415 3.601 1.00 0.00 H ATOM 2259 N PRO B 44 16.964 -1.267 0.760 1.00 62.78 N ATOM 2260 CA PRO B 44 17.854 -2.430 0.727 1.00 45.42 C ATOM 2261 C PRO B 44 19.312 -2.086 1.008 1.00 47.26 C ATOM 2262 O PRO B 44 19.812 -1.041 0.600 1.00 46.70 O ATOM 2263 CB PRO B 44 17.715 -2.925 -0.712 1.00 43.16 C ATOM 2264 CG PRO B 44 16.367 -2.461 -1.136 1.00 43.40 C ATOM 2265 CD PRO B 44 16.214 -1.117 -0.498 1.00 54.29 C ATOM 2266 HA PRO B 44 17.585 -3.156 1.494 1.00 0.00 H ATOM 2267 HD3 PRO B 44 16.645 -0.334 -1.122 1.00 0.00 H ATOM 2268 HD2 PRO B 44 15.165 -0.890 -0.306 1.00 0.00 H ATOM 2269 HG3 PRO B 44 15.595 -3.145 -0.783 1.00 0.00 H ATOM 2270 HG2 PRO B 44 16.311 -2.381 -2.222 1.00 0.00 H ATOM 2271 HB2 PRO B 44 18.489 -2.492 -1.345 1.00 0.00 H ATOM 2272 HB3 PRO B 44 17.780 -4.012 -0.754 1.00 0.00 H ATOM 2273 N LYS B 45 19.989 -2.985 1.704 1.00 43.02 N ATOM 2274 CA LYS B 45 21.418 -2.871 1.916 1.00 38.81 C ATOM 2275 C LYS B 45 22.158 -3.955 1.144 1.00 34.73 C ATOM 2276 O LYS B 45 21.808 -5.137 1.224 1.00 29.49 O ATOM 2277 CB LYS B 45 21.739 -2.986 3.406 1.00 50.23 C ATOM 2278 CG LYS B 45 23.230 -2.961 3.710 1.00 58.30 C ATOM 2279 CD LYS B 45 23.504 -2.927 5.211 1.00 71.88 C ATOM 2280 CE LYS B 45 25.016 -2.924 5.509 1.00 91.25 C ATOM 2281 NZ LYS B 45 25.753 -1.686 5.062 1.00 72.52 N ATOM 2282 HA LYS B 45 21.745 -1.896 1.554 1.00 0.00 H ATOM 2283 HB2 LYS B 45 21.267 -2.153 3.926 1.00 0.00 H ATOM 2284 HB3 LYS B 45 21.327 -3.925 3.776 1.00 0.00 H ATOM 2285 HG2 LYS B 45 23.691 -3.854 3.287 1.00 0.00 H ATOM 2286 HG3 LYS B 45 23.669 -2.075 3.251 1.00 0.00 H ATOM 2287 HD2 LYS B 45 23.058 -2.026 5.633 1.00 0.00 H ATOM 2288 HD3 LYS B 45 23.053 -3.805 5.674 1.00 0.00 H ATOM 2289 HE2 LYS B 45 25.461 -3.783 5.006 1.00 0.00 H ATOM 2290 HE3 LYS B 45 25.149 -3.026 6.586 1.00 0.00 H ATOM 2291 HZ1 LYS B 45 25.652 -1.577 4.033 1.00 0.00 H ATOM 2292 HZ2 LYS B 45 25.353 -0.854 5.541 1.00 0.00 H ATOM 2293 HZ3 LYS B 45 26.760 -1.777 5.305 1.00 0.00 H ATOM 2294 H LYS B 45 19.481 -3.796 2.110 1.00 0.00 H ATOM 2295 N VAL B 46 23.181 -3.555 0.395 1.00 37.84 N ATOM 2296 CA VAL B 46 24.051 -4.520 -0.272 1.00 36.30 C ATOM 2297 C VAL B 46 24.952 -5.223 0.741 1.00 49.95 C ATOM 2298 O VAL B 46 25.706 -4.576 1.463 1.00 44.48 O ATOM 2299 CB VAL B 46 24.937 -3.852 -1.339 1.00 25.84 C ATOM 2300 CG1 VAL B 46 25.903 -4.861 -1.942 1.00 26.38 C ATOM 2301 CG2 VAL B 46 24.067 -3.217 -2.415 1.00 23.32 C ATOM 2302 HA VAL B 46 23.400 -5.245 -0.760 1.00 0.00 H ATOM 2303 HB VAL B 46 25.528 -3.067 -0.866 1.00 0.00 H ATOM 2304 HG11 VAL B 46 26.541 -5.266 -1.156 1.00 0.00 H ATOM 2305 HG12 VAL B 46 25.339 -5.669 -2.407 1.00 0.00 H ATOM 2306 HG13 VAL B 46 26.519 -4.368 -2.694 1.00 0.00 H ATOM 2307 HG21 VAL B 46 23.455 -3.986 -2.886 1.00 0.00 H ATOM 2308 HG22 VAL B 46 23.422 -2.465 -1.962 1.00 0.00 H ATOM 2309 HG23 VAL B 46 24.704 -2.747 -3.165 1.00 0.00 H ATOM 2310 H VAL B 46 23.365 -2.538 0.282 1.00 0.00 H ATOM 2311 N LEU B 47 24.874 -6.549 0.785 1.00 33.87 N ATOM 2312 CA LEU B 47 25.683 -7.330 1.711 1.00 37.46 C ATOM 2313 C LEU B 47 26.903 -7.899 1.008 1.00 40.46 C ATOM 2314 O LEU B 47 27.918 -8.183 1.635 1.00 49.19 O ATOM 2315 CB LEU B 47 24.838 -8.454 2.310 1.00 42.57 C ATOM 2316 CG LEU B 47 23.575 -7.988 3.027 1.00 45.92 C ATOM 2317 CD1 LEU B 47 22.726 -9.176 3.468 1.00 52.36 C ATOM 2318 CD2 LEU B 47 23.940 -7.119 4.219 1.00 57.69 C ATOM 2319 HA LEU B 47 26.029 -6.678 2.513 1.00 0.00 H ATOM 2320 HB2 LEU B 47 24.543 -9.125 1.503 1.00 0.00 H ATOM 2321 HB3 LEU B 47 25.454 -8.998 3.026 1.00 0.00 H ATOM 2322 HG LEU B 47 22.983 -7.395 2.329 1.00 0.00 H ATOM 2323 HD21 LEU B 47 24.553 -7.694 4.912 1.00 0.00 H ATOM 2324 HD22 LEU B 47 24.498 -6.248 3.875 1.00 0.00 H ATOM 2325 HD23 LEU B 47 23.029 -6.793 4.722 1.00 0.00 H ATOM 2326 HD11 LEU B 47 22.437 -9.759 2.594 1.00 0.00 H ATOM 2327 HD12 LEU B 47 23.304 -9.801 4.148 1.00 0.00 H ATOM 2328 HD13 LEU B 47 21.832 -8.814 3.976 1.00 0.00 H ATOM 2329 H LEU B 47 24.220 -7.041 0.143 1.00 0.00 H ATOM 2330 N ILE B 48 26.803 -8.069 -0.308 1.00 39.68 N ATOM 2331 CA ILE B 48 27.880 -8.667 -1.071 1.00 36.51 C ATOM 2332 C ILE B 48 27.978 -8.047 -2.465 1.00 30.33 C ATOM 2333 O ILE B 48 26.963 -7.855 -3.126 1.00 26.73 O ATOM 2334 CB ILE B 48 27.642 -10.187 -1.243 1.00 35.70 C ATOM 2335 CG1 ILE B 48 27.647 -10.902 0.117 1.00 43.89 C ATOM 2336 CG2 ILE B 48 28.697 -10.781 -2.153 1.00 29.85 C ATOM 2337 CD1 ILE B 48 29.034 -11.137 0.667 1.00 52.91 C ATOM 2338 HA ILE B 48 28.803 -8.486 -0.521 1.00 0.00 H ATOM 2339 HB ILE B 48 26.661 -10.330 -1.697 1.00 0.00 H ATOM 2340 HG12 ILE B 48 27.091 -10.293 0.830 1.00 0.00 H ATOM 2341 HG13 ILE B 48 27.153 -11.867 0.002 1.00 0.00 H ATOM 2342 HD11 ILE B 48 29.600 -11.755 -0.030 1.00 0.00 H ATOM 2343 HD12 ILE B 48 29.538 -10.180 0.798 1.00 0.00 H ATOM 2344 HD13 ILE B 48 28.961 -11.645 1.628 1.00 0.00 H ATOM 2345 HG21 ILE B 48 28.647 -10.298 -3.129 1.00 0.00 H ATOM 2346 HG22 ILE B 48 29.683 -10.620 -1.717 1.00 0.00 H ATOM 2347 HG23 ILE B 48 28.518 -11.850 -2.265 1.00 0.00 H ATOM 2348 H ILE B 48 25.936 -7.767 -0.798 1.00 0.00 H ATOM 2349 N TYR B 49 29.199 -7.762 -2.904 1.00 24.19 N ATOM 2350 CA TYR B 49 29.456 -7.343 -4.274 1.00 26.75 C ATOM 2351 C TYR B 49 30.582 -8.197 -4.853 1.00 30.94 C ATOM 2352 O TYR B 49 31.319 -8.849 -4.111 1.00 36.00 O ATOM 2353 CB TYR B 49 29.788 -5.844 -4.349 1.00 23.86 C ATOM 2354 CG TYR B 49 31.112 -5.472 -3.706 1.00 38.20 C ATOM 2355 CD1 TYR B 49 31.182 -5.143 -2.358 1.00 39.60 C ATOM 2356 CD2 TYR B 49 32.287 -5.463 -4.447 1.00 37.13 C ATOM 2357 CE1 TYR B 49 32.384 -4.811 -1.767 1.00 52.82 C ATOM 2358 CE2 TYR B 49 33.501 -5.133 -3.866 1.00 47.87 C ATOM 2359 CZ TYR B 49 33.542 -4.804 -2.525 1.00 53.50 C ATOM 2360 OH TYR B 49 34.746 -4.483 -1.942 1.00 61.78 O ATOM 2361 HA TYR B 49 28.555 -7.492 -4.869 1.00 0.00 H ATOM 2362 HB3 TYR B 49 28.995 -5.291 -3.846 1.00 0.00 H ATOM 2363 HB2 TYR B 49 29.822 -5.552 -5.399 1.00 0.00 H ATOM 2364 HD2 TYR B 49 32.253 -5.720 -5.506 1.00 0.00 H ATOM 2365 HE2 TYR B 49 34.414 -5.133 -4.461 1.00 0.00 H ATOM 2366 HE1 TYR B 49 32.421 -4.555 -0.708 1.00 0.00 H ATOM 2367 HD1 TYR B 49 30.272 -5.147 -1.757 1.00 0.00 H ATOM 2368 HH TYR B 49 34.603 -4.274 -0.985 1.00 0.00 H ATOM 2369 H TYR B 49 30.000 -7.841 -2.245 1.00 0.00 H ATOM 2370 N ASN B 50 30.701 -8.209 -6.177 1.00 27.81 N ATOM 2371 CA ASN B 50 31.687 -9.045 -6.861 1.00 32.13 C ATOM 2372 C ASN B 50 31.792 -10.481 -6.305 1.00 39.76 C ATOM 2373 O ASN B 50 32.895 -10.979 -6.070 1.00 43.68 O ATOM 2374 CB ASN B 50 33.069 -8.370 -6.853 1.00 42.66 C ATOM 2375 CG ASN B 50 33.064 -7.002 -7.539 1.00 45.25 C ATOM 2376 OD1 ASN B 50 32.014 -6.483 -7.916 1.00 35.02 O ATOM 2377 ND2 ASN B 50 34.245 -6.409 -7.684 1.00 48.52 N ATOM 2378 HA ASN B 50 31.328 -9.143 -7.885 1.00 0.00 H ATOM 2379 HB2 ASN B 50 33.388 -8.240 -5.819 1.00 0.00 H ATOM 2380 HB3 ASN B 50 33.776 -9.017 -7.371 1.00 0.00 H ATOM 2381 HD22 ASN B 50 35.109 -6.883 -7.351 1.00 0.00 H ATOM 2382 HD21 ASN B 50 34.305 -5.471 -8.130 1.00 0.00 H ATOM 2383 H ASN B 50 30.073 -7.605 -6.744 1.00 0.00 H ATOM 2384 N ASP B 51 30.645 -11.123 -6.068 1.00 31.85 N ATOM 2385 CA ASP B 51 30.596 -12.556 -5.741 1.00 35.38 C ATOM 2386 C ASP B 51 30.833 -12.874 -4.263 1.00 43.75 C ATOM 2387 O ASP B 51 30.097 -13.657 -3.652 1.00 40.90 O ATOM 2388 CB ASP B 51 31.624 -13.343 -6.565 1.00 38.23 C ATOM 2389 CG ASP B 51 31.449 -13.178 -8.064 1.00 40.28 C ATOM 2390 OD1 ASP B 51 30.298 -13.043 -8.549 1.00 30.22 O ATOM 2391 OD2 ASP B 51 32.482 -13.209 -8.768 1.00 37.52 O ATOM 2392 HA ASP B 51 29.578 -12.857 -5.986 1.00 0.00 H ATOM 2393 HB2 ASP B 51 32.622 -12.998 -6.293 1.00 0.00 H ATOM 2394 HB3 ASP B 51 31.527 -14.401 -6.320 1.00 0.00 H ATOM 2395 H ASP B 51 29.753 -10.590 -6.117 1.00 0.00 H ATOM 2396 N ASP B 52 31.866 -12.274 -3.684 1.00 33.27 N ATOM 2397 CA ASP B 52 32.306 -12.698 -2.357 1.00 40.46 C ATOM 2398 C ASP B 52 32.885 -11.582 -1.491 1.00 50.09 C ATOM 2399 O ASP B 52 33.446 -11.859 -0.430 1.00 54.84 O ATOM 2400 CB ASP B 52 33.344 -13.818 -2.497 1.00 38.82 C ATOM 2401 CG ASP B 52 34.527 -13.403 -3.347 1.00 54.52 C ATOM 2402 OD1 ASP B 52 34.739 -12.180 -3.510 1.00 48.38 O ATOM 2403 OD2 ASP B 52 35.251 -14.292 -3.849 1.00 57.10 O ATOM 2404 HA ASP B 52 31.409 -13.044 -1.843 1.00 0.00 H ATOM 2405 HB2 ASP B 52 33.703 -14.089 -1.504 1.00 0.00 H ATOM 2406 HB3 ASP B 52 32.867 -14.683 -2.958 1.00 0.00 H ATOM 2407 H ASP B 52 32.362 -11.503 -4.175 1.00 0.00 H ATOM 2408 N ARG B 53 32.753 -10.331 -1.932 1.00 42.39 N ATOM 2409 CA ARG B 53 33.294 -9.205 -1.175 1.00 43.45 C ATOM 2410 C ARG B 53 32.217 -8.501 -0.355 1.00 40.76 C ATOM 2411 O ARG B 53 31.102 -8.282 -0.823 1.00 36.41 O ATOM 2412 CB ARG B 53 34.016 -8.217 -2.098 1.00 41.11 C ATOM 2413 CG ARG B 53 35.101 -8.854 -2.956 1.00 48.46 C ATOM 2414 CD ARG B 53 35.860 -7.810 -3.765 1.00 49.72 C ATOM 2415 NE ARG B 53 36.359 -8.349 -5.028 1.00 52.42 N ATOM 2416 CZ ARG B 53 36.962 -7.625 -5.965 1.00 50.65 C ATOM 2417 NH1 ARG B 53 37.149 -6.324 -5.782 1.00 51.92 N ATOM 2418 NH2 ARG B 53 37.378 -8.199 -7.088 1.00 46.14 N ATOM 2419 HA ARG B 53 34.023 -9.609 -0.473 1.00 0.00 H ATOM 2420 HB2 ARG B 53 33.278 -7.762 -2.759 1.00 0.00 H ATOM 2421 HB3 ARG B 53 34.475 -7.444 -1.482 1.00 0.00 H ATOM 2422 HG2 ARG B 53 35.803 -9.379 -2.308 1.00 0.00 H ATOM 2423 HG3 ARG B 53 34.639 -9.565 -3.641 1.00 0.00 H ATOM 2424 HD2 ARG B 53 36.705 -7.455 -3.176 1.00 0.00 H ATOM 2425 HD3 ARG B 53 35.191 -6.976 -3.978 1.00 0.00 H ATOM 2426 HE ARG B 53 36.234 -9.366 -5.205 1.00 0.00 H ATOM 2427 HH12 ARG B 53 37.621 -5.758 -6.516 1.00 0.00 H ATOM 2428 HH11 ARG B 53 36.824 -5.870 -4.905 1.00 0.00 H ATOM 2429 HH22 ARG B 53 37.850 -7.629 -7.819 1.00 0.00 H ATOM 2430 HH21 ARG B 53 37.232 -9.218 -7.236 1.00 0.00 H ATOM 2431 H ARG B 53 32.257 -10.154 -2.829 1.00 0.00 H ATOM 2432 N ARG B 54 32.557 -8.156 0.883 1.00 38.21 N ATOM 2433 CA ARG B 54 31.616 -7.466 1.769 1.00 40.62 C ATOM 2434 C ARG B 54 31.857 -5.954 1.770 1.00 45.31 C ATOM 2435 O ARG B 54 33.003 -5.502 1.852 1.00 53.24 O ATOM 2436 CB ARG B 54 31.728 -7.993 3.207 1.00 57.44 C ATOM 2437 CG ARG B 54 31.096 -9.362 3.449 1.00 61.93 C ATOM 2438 CD ARG B 54 31.230 -9.796 4.912 1.00 78.53 C ATOM 2439 NE ARG B 54 32.620 -10.078 5.270 1.00 86.92 N ATOM 2440 CZ ARG B 54 33.204 -11.267 5.137 1.00 96.46 C ATOM 2441 NH1 ARG B 54 32.521 -12.302 4.661 1.00 83.81 N ATOM 2442 NH2 ARG B 54 34.477 -11.423 5.484 1.00102.48 N ATOM 2443 HA ARG B 54 30.615 -7.665 1.388 1.00 0.00 H ATOM 2444 HB2 ARG B 54 32.786 -8.060 3.460 1.00 0.00 H ATOM 2445 HB3 ARG B 54 31.242 -7.275 3.868 1.00 0.00 H ATOM 2446 HG2 ARG B 54 30.038 -9.314 3.190 1.00 0.00 H ATOM 2447 HG3 ARG B 54 31.591 -10.097 2.815 1.00 0.00 H ATOM 2448 HD2 ARG B 54 30.635 -10.696 5.069 1.00 0.00 H ATOM 2449 HD3 ARG B 54 30.855 -8.998 5.553 1.00 0.00 H ATOM 2450 HE ARG B 54 33.190 -9.298 5.654 1.00 0.00 H ATOM 2451 HH12 ARG B 54 32.983 -13.228 4.560 1.00 0.00 H ATOM 2452 HH11 ARG B 54 31.524 -12.186 4.390 1.00 0.00 H ATOM 2453 HH22 ARG B 54 34.934 -12.351 5.381 1.00 0.00 H ATOM 2454 HH21 ARG B 54 35.016 -10.617 5.859 1.00 0.00 H ATOM 2455 H ARG B 54 33.511 -8.381 1.230 1.00 0.00 H ATOM 2456 N PRO B 55 30.779 -5.161 1.677 1.00 39.09 N ATOM 2457 CA PRO B 55 30.999 -3.723 1.829 1.00 49.40 C ATOM 2458 C PRO B 55 31.500 -3.479 3.242 1.00 65.04 C ATOM 2459 O PRO B 55 31.119 -4.232 4.142 1.00 58.41 O ATOM 2460 CB PRO B 55 29.592 -3.138 1.675 1.00 44.02 C ATOM 2461 CG PRO B 55 28.820 -4.182 0.903 1.00 34.73 C ATOM 2462 CD PRO B 55 29.365 -5.480 1.427 1.00 36.32 C ATOM 2463 HA PRO B 55 31.715 -3.296 1.126 1.00 0.00 H ATOM 2464 HD3 PRO B 55 28.860 -5.776 2.347 1.00 0.00 H ATOM 2465 HD2 PRO B 55 29.266 -6.275 0.688 1.00 0.00 H ATOM 2466 HG3 PRO B 55 29.000 -4.087 -0.168 1.00 0.00 H ATOM 2467 HG2 PRO B 55 27.751 -4.101 1.099 1.00 0.00 H ATOM 2468 HB2 PRO B 55 29.138 -2.968 2.651 1.00 0.00 H ATOM 2469 HB3 PRO B 55 29.625 -2.199 1.123 1.00 0.00 H ATOM 2470 N SER B 56 32.338 -2.469 3.450 1.00 51.34 N ATOM 2471 CA SER B 56 32.685 -2.118 4.819 1.00 54.54 C ATOM 2472 C SER B 56 31.380 -1.892 5.584 1.00 53.01 C ATOM 2473 O SER B 56 30.424 -1.322 5.050 1.00 46.71 O ATOM 2474 CB SER B 56 33.626 -0.901 4.881 1.00 59.79 C ATOM 2475 OG SER B 56 33.211 0.148 4.018 1.00 62.22 O ATOM 2476 HA SER B 56 33.244 -2.929 5.285 1.00 0.00 H ATOM 2477 HB2 SER B 56 34.628 -1.218 4.591 1.00 0.00 H ATOM 2478 HB3 SER B 56 33.647 -0.526 5.904 1.00 0.00 H ATOM 2479 HG SER B 56 33.844 0.905 4.092 1.00 0.00 H ATOM 2480 H SER B 56 32.738 -1.939 2.650 1.00 0.00 H ATOM 2481 N GLY B 57 31.319 -2.378 6.820 1.00 50.28 N ATOM 2482 CA GLY B 57 30.133 -2.188 7.637 1.00 49.92 C ATOM 2483 C GLY B 57 29.185 -3.371 7.595 1.00 59.26 C ATOM 2484 O GLY B 57 28.108 -3.351 8.198 1.00 58.39 O ATOM 2485 HA3 GLY B 57 29.603 -1.305 7.279 1.00 0.00 H ATOM 2486 HA2 GLY B 57 30.445 -2.029 8.669 1.00 0.00 H ATOM 2487 H GLY B 57 32.131 -2.901 7.207 1.00 0.00 H ATOM 2488 N VAL B 58 29.588 -4.413 6.876 1.00 52.81 N ATOM 2489 CA VAL B 58 28.831 -5.658 6.839 1.00 62.04 C ATOM 2490 C VAL B 58 29.559 -6.769 7.588 1.00 62.39 C ATOM 2491 O VAL B 58 30.718 -7.067 7.302 1.00 59.24 O ATOM 2492 CB VAL B 58 28.566 -6.115 5.392 1.00 44.25 C ATOM 2493 CG1 VAL B 58 27.930 -7.497 5.381 1.00 40.98 C ATOM 2494 CG2 VAL B 58 27.683 -5.108 4.671 1.00 34.00 C ATOM 2495 HA VAL B 58 27.877 -5.460 7.328 1.00 0.00 H ATOM 2496 HB VAL B 58 29.518 -6.173 4.864 1.00 0.00 H ATOM 2497 HG11 VAL B 58 28.602 -8.208 5.861 1.00 0.00 H ATOM 2498 HG12 VAL B 58 26.985 -7.465 5.923 1.00 0.00 H ATOM 2499 HG13 VAL B 58 27.750 -7.804 4.351 1.00 0.00 H ATOM 2500 HG21 VAL B 58 26.732 -5.020 5.196 1.00 0.00 H ATOM 2501 HG22 VAL B 58 28.181 -4.138 4.652 1.00 0.00 H ATOM 2502 HG23 VAL B 58 27.506 -5.447 3.650 1.00 0.00 H ATOM 2503 H VAL B 58 30.467 -4.338 6.325 1.00 0.00 H ATOM 2504 N PRO B 59 28.870 -7.379 8.548 1.00 55.68 N ATOM 2505 CA PRO B 59 29.499 -8.350 9.448 1.00 63.25 C ATOM 2506 C PRO B 59 30.108 -9.520 8.683 1.00 68.39 C ATOM 2507 O PRO B 59 29.447 -10.108 7.827 1.00 62.14 O ATOM 2508 CB PRO B 59 28.327 -8.835 10.304 1.00 66.51 C ATOM 2509 CG PRO B 59 27.378 -7.690 10.314 1.00 63.33 C ATOM 2510 CD PRO B 59 27.496 -7.047 8.961 1.00 52.33 C ATOM 2511 HA PRO B 59 30.318 -7.916 10.021 1.00 0.00 H ATOM 2512 HD3 PRO B 59 26.767 -7.463 8.265 1.00 0.00 H ATOM 2513 HD2 PRO B 59 27.358 -5.968 9.028 1.00 0.00 H ATOM 2514 HG3 PRO B 59 27.647 -6.980 11.096 1.00 0.00 H ATOM 2515 HG2 PRO B 59 26.360 -8.042 10.480 1.00 0.00 H ATOM 2516 HB2 PRO B 59 27.864 -9.716 9.861 1.00 0.00 H ATOM 2517 HB3 PRO B 59 28.659 -9.070 11.315 1.00 0.00 H ATOM 2518 N ASP B 60 31.357 -9.850 8.994 1.00 81.01 N ATOM 2519 CA ASP B 60 32.007 -11.020 8.415 1.00 86.49 C ATOM 2520 C ASP B 60 31.102 -12.245 8.482 1.00 77.07 C ATOM 2521 O ASP B 60 31.482 -13.334 8.053 1.00 78.27 O ATOM 2522 CB ASP B 60 33.331 -11.305 9.127 1.00100.34 C ATOM 2523 CG ASP B 60 33.134 -11.791 10.550 1.00118.58 C ATOM 2524 OD1 ASP B 60 31.992 -11.720 11.051 1.00112.19 O ATOM 2525 OD2 ASP B 60 34.121 -12.243 11.167 1.00129.63 O ATOM 2526 HA ASP B 60 32.208 -10.803 7.366 1.00 0.00 H ATOM 2527 HB2 ASP B 60 33.871 -12.069 8.568 1.00 0.00 H ATOM 2528 HB3 ASP B 60 33.920 -10.388 9.149 1.00 0.00 H ATOM 2529 H ASP B 60 31.885 -9.259 9.668 1.00 0.00 H ATOM 2530 N ARG B 61 29.902 -12.058 9.023 1.00 61.88 N ATOM 2531 CA ARG B 61 29.024 -13.177 9.344 1.00 68.61 C ATOM 2532 C ARG B 61 28.007 -13.417 8.233 1.00 56.64 C ATOM 2533 O ARG B 61 27.281 -14.411 8.247 1.00 47.51 O ATOM 2534 CB ARG B 61 28.304 -12.930 10.671 1.00 72.33 C ATOM 2535 CG ARG B 61 27.344 -14.038 11.073 1.00 69.85 C ATOM 2536 CD ARG B 61 26.493 -13.626 12.263 1.00 71.87 C ATOM 2537 NE ARG B 61 26.048 -12.239 12.164 1.00 75.43 N ATOM 2538 CZ ARG B 61 24.875 -11.865 11.664 1.00 68.62 C ATOM 2539 NH1 ARG B 61 24.022 -12.776 11.215 1.00 76.37 N ATOM 2540 NH2 ARG B 61 24.553 -10.580 11.613 1.00 72.09 N ATOM 2541 HA ARG B 61 29.643 -14.069 9.438 1.00 0.00 H ATOM 2542 HB2 ARG B 61 29.055 -12.827 11.454 1.00 0.00 H ATOM 2543 HB3 ARG B 61 27.739 -12.002 10.587 1.00 0.00 H ATOM 2544 HG2 ARG B 61 26.691 -14.265 10.231 1.00 0.00 H ATOM 2545 HG3 ARG B 61 27.917 -14.927 11.337 1.00 0.00 H ATOM 2546 HD2 ARG B 61 27.081 -13.743 13.173 1.00 0.00 H ATOM 2547 HD3 ARG B 61 25.618 -14.274 12.311 1.00 0.00 H ATOM 2548 HE ARG B 61 26.690 -11.496 12.507 1.00 0.00 H ATOM 2549 HH12 ARG B 61 23.104 -12.481 10.824 1.00 0.00 H ATOM 2550 HH11 ARG B 61 24.271 -13.785 11.254 1.00 0.00 H ATOM 2551 HH22 ARG B 61 23.634 -10.289 11.221 1.00 0.00 H ATOM 2552 HH21 ARG B 61 25.219 -9.863 11.965 1.00 0.00 H ATOM 2553 H ARG B 61 29.581 -11.089 9.222 1.00 0.00 H ATOM 2554 N PHE B 62 27.961 -12.500 7.272 1.00 75.18 N ATOM 2555 CA PHE B 62 27.558 -12.836 5.912 1.00 57.93 C ATOM 2556 C PHE B 62 28.769 -13.155 5.041 1.00 51.77 C ATOM 2557 O PHE B 62 29.727 -12.384 4.986 1.00 57.07 O ATOM 2558 CB PHE B 62 26.753 -11.691 5.293 1.00 44.25 C ATOM 2559 CG PHE B 62 25.554 -11.287 6.102 1.00 47.22 C ATOM 2560 CD1 PHE B 62 24.284 -11.703 5.739 1.00 44.03 C ATOM 2561 CD2 PHE B 62 25.697 -10.491 7.227 1.00 69.34 C ATOM 2562 CE1 PHE B 62 23.179 -11.333 6.481 1.00 50.97 C ATOM 2563 CE2 PHE B 62 24.595 -10.118 7.973 1.00 68.23 C ATOM 2564 CZ PHE B 62 23.335 -10.539 7.600 1.00 62.23 C ATOM 2565 HA PHE B 62 26.929 -13.725 5.961 1.00 0.00 H ATOM 2566 HB2 PHE B 62 27.408 -10.825 5.192 1.00 0.00 H ATOM 2567 HB3 PHE B 62 26.412 -12.004 4.306 1.00 0.00 H ATOM 2568 HD2 PHE B 62 26.690 -10.155 7.527 1.00 0.00 H ATOM 2569 HE2 PHE B 62 24.721 -9.491 8.856 1.00 0.00 H ATOM 2570 HZ PHE B 62 22.465 -10.246 8.187 1.00 0.00 H ATOM 2571 HE1 PHE B 62 22.185 -11.667 6.184 1.00 0.00 H ATOM 2572 HD1 PHE B 62 24.155 -12.330 4.857 1.00 0.00 H ATOM 2573 H PHE B 62 28.219 -11.518 7.496 1.00 0.00 H ATOM 2574 N SER B 63 28.720 -14.297 4.363 1.00 53.85 N ATOM 2575 CA SER B 63 29.663 -14.594 3.292 1.00 49.34 C ATOM 2576 C SER B 63 28.941 -15.066 2.035 1.00 44.64 C ATOM 2577 O SER B 63 27.890 -15.703 2.114 1.00 38.05 O ATOM 2578 CB SER B 63 30.674 -15.649 3.746 1.00 59.44 C ATOM 2579 OG SER B 63 30.068 -16.927 3.844 1.00 64.69 O ATOM 2580 HA SER B 63 30.195 -13.673 3.052 1.00 0.00 H ATOM 2581 HB2 SER B 63 31.070 -15.367 4.721 1.00 0.00 H ATOM 2582 HB3 SER B 63 31.489 -15.696 3.024 1.00 0.00 H ATOM 2583 HG SER B 63 29.710 -17.190 2.959 1.00 0.00 H ATOM 2584 H SER B 63 27.989 -14.997 4.603 1.00 0.00 H ATOM 2585 N GLY B 64 29.510 -14.749 0.877 1.00 41.39 N ATOM 2586 CA GLY B 64 28.947 -15.174 -0.391 1.00 35.57 C ATOM 2587 C GLY B 64 30.005 -15.867 -1.208 1.00 30.09 C ATOM 2588 O GLY B 64 31.188 -15.667 -0.972 1.00 41.73 O ATOM 2589 HA3 GLY B 64 28.581 -14.304 -0.935 1.00 0.00 H ATOM 2590 HA2 GLY B 64 28.121 -15.861 -0.209 1.00 0.00 H ATOM 2591 H GLY B 64 30.382 -14.182 0.879 1.00 0.00 H ATOM 2592 N SER B 65 29.583 -16.691 -2.165 1.00 41.32 N ATOM 2593 CA SER B 65 30.502 -17.297 -3.120 1.00 39.85 C ATOM 2594 C SER B 65 29.729 -17.855 -4.302 1.00 31.04 C ATOM 2595 O SER B 65 28.510 -17.796 -4.333 1.00 32.15 O ATOM 2596 CB SER B 65 31.340 -18.406 -2.467 1.00 64.58 C ATOM 2597 OG SER B 65 30.549 -19.534 -2.134 1.00 52.55 O ATOM 2598 HA SER B 65 31.185 -16.522 -3.468 1.00 0.00 H ATOM 2599 HB2 SER B 65 31.798 -18.015 -1.559 1.00 0.00 H ATOM 2600 HB3 SER B 65 32.121 -18.715 -3.162 1.00 0.00 H ATOM 2601 HG SER B 65 29.841 -19.263 -1.498 1.00 0.00 H ATOM 2602 H SER B 65 28.568 -16.908 -2.233 1.00 0.00 H ATOM 2603 N LYS B 66 30.439 -18.395 -5.280 1.00 45.16 N ATOM 2604 CA LYS B 66 29.765 -19.032 -6.398 1.00 45.32 C ATOM 2605 C LYS B 66 30.615 -20.130 -7.004 1.00 40.22 C ATOM 2606 O LYS B 66 31.838 -20.124 -6.874 1.00 54.09 O ATOM 2607 CB LYS B 66 29.353 -17.999 -7.460 1.00 37.49 C ATOM 2608 CG LYS B 66 30.472 -17.476 -8.337 1.00 39.29 C ATOM 2609 CD LYS B 66 29.962 -16.321 -9.224 1.00 34.53 C ATOM 2610 CE LYS B 66 31.036 -15.826 -10.173 1.00 38.52 C ATOM 2611 NZ LYS B 66 30.587 -14.632 -10.959 1.00 23.79 N ATOM 2612 HA LYS B 66 28.856 -19.495 -6.013 1.00 0.00 H ATOM 2613 HB2 LYS B 66 28.609 -18.463 -8.107 1.00 0.00 H ATOM 2614 HB3 LYS B 66 28.906 -17.149 -6.945 1.00 0.00 H ATOM 2615 HG2 LYS B 66 31.284 -17.114 -7.707 1.00 0.00 H ATOM 2616 HG3 LYS B 66 30.839 -18.283 -8.972 1.00 0.00 H ATOM 2617 HD2 LYS B 66 29.110 -16.672 -9.806 1.00 0.00 H ATOM 2618 HD3 LYS B 66 29.648 -15.496 -8.584 1.00 0.00 H ATOM 2619 HE2 LYS B 66 31.290 -16.628 -10.866 1.00 0.00 H ATOM 2620 HE3 LYS B 66 31.919 -15.554 -9.594 1.00 0.00 H ATOM 2621 HZ1 LYS B 66 29.749 -14.883 -11.521 1.00 0.00 H ATOM 2622 HZ2 LYS B 66 30.349 -13.858 -10.306 1.00 0.00 H ATOM 2623 HZ3 LYS B 66 31.353 -14.328 -11.594 1.00 0.00 H ATOM 2624 H LYS B 66 31.478 -18.363 -5.248 1.00 0.00 H ATOM 2625 N SER B 67 29.949 -21.079 -7.648 1.00 38.30 N ATOM 2626 CA SER B 67 30.612 -22.171 -8.352 1.00 40.28 C ATOM 2627 C SER B 67 29.796 -22.492 -9.595 1.00 34.84 C ATOM 2628 O SER B 67 28.579 -22.669 -9.512 1.00 31.18 O ATOM 2629 CB SER B 67 30.700 -23.409 -7.449 1.00 48.32 C ATOM 2630 OG SER B 67 31.321 -24.502 -8.121 1.00 60.11 O ATOM 2631 HA SER B 67 31.625 -21.879 -8.628 1.00 0.00 H ATOM 2632 HB2 SER B 67 29.694 -23.702 -7.150 1.00 0.00 H ATOM 2633 HB3 SER B 67 31.283 -23.160 -6.562 1.00 0.00 H ATOM 2634 HG SER B 67 31.362 -25.282 -7.512 1.00 0.00 H ATOM 2635 H SER B 67 28.910 -21.043 -7.651 1.00 0.00 H ATOM 2636 N GLY B 68 30.452 -22.568 -10.743 1.00 32.32 N ATOM 2637 CA GLY B 68 29.734 -22.809 -11.978 1.00 36.93 C ATOM 2638 C GLY B 68 28.654 -21.746 -12.126 1.00 31.06 C ATOM 2639 O GLY B 68 28.939 -20.557 -12.004 1.00 33.24 O ATOM 2640 HA3 GLY B 68 29.276 -23.798 -11.950 1.00 0.00 H ATOM 2641 HA2 GLY B 68 30.423 -22.753 -12.821 1.00 0.00 H ATOM 2642 H GLY B 68 31.486 -22.454 -10.758 1.00 0.00 H ATOM 2643 N THR B 69 27.413 -22.164 -12.351 1.00 35.07 N ATOM 2644 CA THR B 69 26.341 -21.208 -12.612 1.00 26.30 C ATOM 2645 C THR B 69 25.466 -20.906 -11.389 1.00 28.62 C ATOM 2646 O THR B 69 24.336 -20.457 -11.527 1.00 20.26 O ATOM 2647 CB THR B 69 25.447 -21.685 -13.754 1.00 23.80 C ATOM 2648 OG1 THR B 69 24.791 -22.888 -13.365 1.00 27.74 O ATOM 2649 CG2 THR B 69 26.281 -21.975 -14.996 1.00 22.51 C ATOM 2650 HA THR B 69 26.848 -20.283 -12.886 1.00 0.00 H ATOM 2651 HB THR B 69 24.720 -20.904 -13.977 1.00 0.00 H ATOM 2652 HG1 THR B 69 24.240 -22.717 -12.561 1.00 0.00 H ATOM 2653 HG23 THR B 69 26.792 -21.065 -15.310 1.00 0.00 H ATOM 2654 HG21 THR B 69 27.017 -22.745 -14.766 1.00 0.00 H ATOM 2655 HG22 THR B 69 25.629 -22.322 -15.797 1.00 0.00 H ATOM 2656 H THR B 69 27.203 -23.183 -12.341 1.00 0.00 H ATOM 2657 N SER B 70 25.959 -21.160 -10.186 1.00 21.35 N ATOM 2658 CA SER B 70 25.123 -20.820 -9.035 1.00 28.65 C ATOM 2659 C SER B 70 25.909 -20.142 -7.931 1.00 27.31 C ATOM 2660 O SER B 70 27.101 -20.382 -7.759 1.00 36.77 O ATOM 2661 CB SER B 70 24.339 -22.036 -8.505 1.00 31.44 C ATOM 2662 OG SER B 70 25.108 -22.798 -7.595 1.00 39.74 O ATOM 2663 HA SER B 70 24.391 -20.097 -9.395 1.00 0.00 H ATOM 2664 HB2 SER B 70 24.057 -22.669 -9.346 1.00 0.00 H ATOM 2665 HB3 SER B 70 23.440 -21.684 -8.000 1.00 0.00 H ATOM 2666 HG SER B 70 25.924 -23.127 -8.049 1.00 0.00 H ATOM 2667 H SER B 70 26.901 -21.583 -10.065 1.00 0.00 H ATOM 2668 N ALA B 71 25.223 -19.283 -7.193 1.00 24.53 N ATOM 2669 CA ALA B 71 25.859 -18.503 -6.148 1.00 31.21 C ATOM 2670 C ALA B 71 25.117 -18.737 -4.855 1.00 29.96 C ATOM 2671 O ALA B 71 23.965 -19.157 -4.860 1.00 29.27 O ATOM 2672 CB ALA B 71 25.842 -17.003 -6.512 1.00 23.89 C ATOM 2673 HA ALA B 71 26.899 -18.811 -6.038 1.00 0.00 H ATOM 2674 HB1 ALA B 71 26.381 -16.851 -7.447 1.00 0.00 H ATOM 2675 HB2 ALA B 71 24.811 -16.670 -6.627 1.00 0.00 H ATOM 2676 HB3 ALA B 71 26.323 -16.432 -5.718 1.00 0.00 H ATOM 2677 H ALA B 71 24.204 -19.165 -7.366 1.00 0.00 H ATOM 2678 N SER B 72 25.772 -18.462 -3.736 1.00 26.92 N ATOM 2679 CA SER B 72 25.086 -18.573 -2.464 1.00 34.55 C ATOM 2680 C SER B 72 25.586 -17.531 -1.484 1.00 32.24 C ATOM 2681 O SER B 72 26.714 -17.056 -1.591 1.00 35.95 O ATOM 2682 CB SER B 72 25.238 -19.980 -1.872 1.00 37.61 C ATOM 2683 OG SER B 72 26.600 -20.308 -1.701 1.00 44.48 O ATOM 2684 HA SER B 72 24.026 -18.393 -2.646 1.00 0.00 H ATOM 2685 HB2 SER B 72 24.778 -20.703 -2.546 1.00 0.00 H ATOM 2686 HB3 SER B 72 24.737 -20.017 -0.905 1.00 0.00 H ATOM 2687 HG SER B 72 27.021 -19.656 -1.087 1.00 0.00 H ATOM 2688 H SER B 72 26.769 -18.169 -3.770 1.00 0.00 H ATOM 2689 N LEU B 73 24.709 -17.186 -0.547 1.00 29.60 N ATOM 2690 CA LEU B 73 25.005 -16.297 0.559 1.00 33.44 C ATOM 2691 C LEU B 73 24.771 -17.099 1.838 1.00 47.35 C ATOM 2692 O LEU B 73 23.632 -17.462 2.141 1.00 42.76 O ATOM 2693 CB LEU B 73 24.037 -15.120 0.556 1.00 29.08 C ATOM 2694 CG LEU B 73 24.101 -14.159 1.752 1.00 35.20 C ATOM 2695 CD1 LEU B 73 25.378 -13.343 1.686 1.00 37.53 C ATOM 2696 CD2 LEU B 73 22.876 -13.250 1.813 1.00 31.91 C ATOM 2697 HA LEU B 73 26.025 -15.921 0.485 1.00 0.00 H ATOM 2698 HB2 LEU B 73 24.231 -14.537 -0.345 1.00 0.00 H ATOM 2699 HB3 LEU B 73 23.026 -15.526 0.514 1.00 0.00 H ATOM 2700 HG LEU B 73 24.104 -14.752 2.666 1.00 0.00 H ATOM 2701 HD21 LEU B 73 22.819 -12.658 0.900 1.00 0.00 H ATOM 2702 HD22 LEU B 73 21.977 -13.859 1.910 1.00 0.00 H ATOM 2703 HD23 LEU B 73 22.960 -12.586 2.673 1.00 0.00 H ATOM 2704 HD11 LEU B 73 26.237 -14.013 1.714 1.00 0.00 H ATOM 2705 HD12 LEU B 73 25.393 -12.769 0.760 1.00 0.00 H ATOM 2706 HD13 LEU B 73 25.418 -12.663 2.537 1.00 0.00 H ATOM 2707 H LEU B 73 23.748 -17.579 -0.611 1.00 0.00 H ATOM 2708 N ALA B 74 25.842 -17.374 2.575 1.00 31.20 N ATOM 2709 CA ALA B 74 25.729 -18.034 3.880 1.00 46.38 C ATOM 2710 C ALA B 74 25.569 -17.023 5.026 1.00 54.43 C ATOM 2711 O ALA B 74 26.423 -16.152 5.208 1.00 51.82 O ATOM 2712 CB ALA B 74 26.943 -18.911 4.120 1.00 48.36 C ATOM 2713 HA ALA B 74 24.830 -18.650 3.863 1.00 0.00 H ATOM 2714 HB1 ALA B 74 27.004 -19.667 3.337 1.00 0.00 H ATOM 2715 HB2 ALA B 74 27.843 -18.296 4.103 1.00 0.00 H ATOM 2716 HB3 ALA B 74 26.852 -19.398 5.091 1.00 0.00 H ATOM 2717 H ALA B 74 26.784 -17.115 2.218 1.00 0.00 H ATOM 2718 N ILE B 75 24.478 -17.144 5.786 1.00 60.50 N ATOM 2719 CA ILE B 75 24.240 -16.316 6.976 1.00 67.04 C ATOM 2720 C ILE B 75 24.539 -17.067 8.289 1.00 83.66 C ATOM 2721 O ILE B 75 23.636 -17.660 8.885 1.00 82.56 O ATOM 2722 CB ILE B 75 22.776 -15.812 7.037 1.00 55.38 C ATOM 2723 CG1 ILE B 75 22.347 -15.199 5.708 1.00 54.33 C ATOM 2724 CG2 ILE B 75 22.594 -14.794 8.165 1.00 71.13 C ATOM 2725 CD1 ILE B 75 20.996 -14.536 5.768 1.00 42.49 C ATOM 2726 HA ILE B 75 24.924 -15.473 6.882 1.00 0.00 H ATOM 2727 HB ILE B 75 22.142 -16.675 7.239 1.00 0.00 H ATOM 2728 HG12 ILE B 75 23.086 -14.453 5.416 1.00 0.00 H ATOM 2729 HG13 ILE B 75 22.313 -15.988 4.957 1.00 0.00 H ATOM 2730 HD11 ILE B 75 20.243 -15.273 6.049 1.00 0.00 H ATOM 2731 HD12 ILE B 75 21.018 -13.736 6.508 1.00 0.00 H ATOM 2732 HD13 ILE B 75 20.752 -14.121 4.790 1.00 0.00 H ATOM 2733 HG21 ILE B 75 22.844 -15.261 9.118 1.00 0.00 H ATOM 2734 HG22 ILE B 75 23.251 -13.942 7.993 1.00 0.00 H ATOM 2735 HG23 ILE B 75 21.558 -14.457 8.185 1.00 0.00 H ATOM 2736 H ILE B 75 23.766 -17.855 5.524 1.00 0.00 H ATOM 2737 N SER B 76 25.794 -17.028 8.740 1.00 70.32 N ATOM 2738 CA SER B 76 26.209 -17.714 9.972 1.00 79.10 C ATOM 2739 C SER B 76 25.743 -17.014 11.252 1.00 89.90 C ATOM 2740 O SER B 76 26.090 -15.862 11.496 1.00 90.77 O ATOM 2741 CB SER B 76 27.733 -17.853 10.020 1.00 82.75 C ATOM 2742 OG SER B 76 28.222 -18.616 8.934 1.00 86.48 O ATOM 2743 HA SER B 76 25.729 -18.692 9.938 1.00 0.00 H ATOM 2744 HB2 SER B 76 28.014 -18.343 10.952 1.00 0.00 H ATOM 2745 HB3 SER B 76 28.180 -16.860 9.984 1.00 0.00 H ATOM 2746 HG SER B 76 29.208 -18.685 8.998 1.00 0.00 H ATOM 2747 H SER B 76 26.504 -16.493 8.201 1.00 0.00 H ATOM 2748 N GLY B 77 24.971 -17.720 12.075 1.00 76.71 N ATOM 2749 CA GLY B 77 24.553 -17.199 13.364 1.00 65.82 C ATOM 2750 C GLY B 77 23.337 -16.300 13.290 1.00 68.49 C ATOM 2751 O GLY B 77 23.433 -15.100 13.535 1.00 72.60 O ATOM 2752 HA3 GLY B 77 25.378 -16.628 13.789 1.00 0.00 H ATOM 2753 HA2 GLY B 77 24.321 -18.040 14.017 1.00 0.00 H ATOM 2754 H GLY B 77 24.659 -18.669 11.787 1.00 0.00 H ATOM 2755 N LEU B 78 22.189 -16.887 12.972 1.00 68.24 N ATOM 2756 CA LEU B 78 20.954 -16.133 12.744 1.00 68.97 C ATOM 2757 C LEU B 78 20.608 -15.096 13.832 1.00 77.50 C ATOM 2758 O LEU B 78 21.250 -15.041 14.879 1.00 83.61 O ATOM 2759 CB LEU B 78 19.783 -17.103 12.553 1.00 67.86 C ATOM 2760 CG LEU B 78 18.735 -16.743 11.503 1.00 66.57 C ATOM 2761 CD1 LEU B 78 19.402 -16.638 10.144 1.00 56.11 C ATOM 2762 CD2 LEU B 78 17.602 -17.767 11.476 1.00 65.80 C ATOM 2763 HA LEU B 78 21.132 -15.550 11.841 1.00 0.00 H ATOM 2764 HB2 LEU B 78 20.202 -18.071 12.278 1.00 0.00 H ATOM 2765 HB3 LEU B 78 19.270 -17.189 13.511 1.00 0.00 H ATOM 2766 HG LEU B 78 18.293 -15.781 11.762 1.00 0.00 H ATOM 2767 HD21 LEU B 78 18.008 -18.750 11.239 1.00 0.00 H ATOM 2768 HD22 LEU B 78 17.119 -17.798 12.453 1.00 0.00 H ATOM 2769 HD23 LEU B 78 16.873 -17.481 10.718 1.00 0.00 H ATOM 2770 HD11 LEU B 78 20.169 -15.864 10.176 1.00 0.00 H ATOM 2771 HD12 LEU B 78 19.860 -17.594 9.891 1.00 0.00 H ATOM 2772 HD13 LEU B 78 18.655 -16.381 9.393 1.00 0.00 H ATOM 2773 H LEU B 78 22.166 -17.923 12.881 1.00 0.00 H ATOM 2774 N ARG B 79 19.592 -14.276 13.553 1.00 59.93 N ATOM 2775 CA ARG B 79 19.050 -13.295 14.494 1.00 66.02 C ATOM 2776 C ARG B 79 17.669 -12.870 14.023 1.00 68.22 C ATOM 2777 O ARG B 79 17.440 -12.748 12.825 1.00 62.12 O ATOM 2778 CB ARG B 79 19.924 -12.045 14.556 1.00 69.45 C ATOM 2779 CG ARG B 79 21.130 -12.140 15.468 1.00 78.76 C ATOM 2780 CD ARG B 79 21.621 -10.749 15.848 1.00 81.18 C ATOM 2781 NE ARG B 79 20.553 -9.958 16.456 1.00 90.73 N ATOM 2782 CZ ARG B 79 20.723 -8.753 16.992 1.00 99.56 C ATOM 2783 NH1 ARG B 79 21.925 -8.190 17.000 1.00 94.62 N ATOM 2784 NH2 ARG B 79 19.689 -8.111 17.526 1.00104.91 N ATOM 2785 HA ARG B 79 19.013 -13.758 15.480 1.00 0.00 H ATOM 2786 HB2 ARG B 79 20.280 -11.833 13.548 1.00 0.00 H ATOM 2787 HB3 ARG B 79 19.304 -11.218 14.902 1.00 0.00 H ATOM 2788 HG2 ARG B 79 20.855 -12.683 16.372 1.00 0.00 H ATOM 2789 HG3 ARG B 79 21.928 -12.675 14.953 1.00 0.00 H ATOM 2790 HD2 ARG B 79 21.975 -10.240 14.952 1.00 0.00 H ATOM 2791 HD3 ARG B 79 22.442 -10.844 16.559 1.00 0.00 H ATOM 2792 HE ARG B 79 19.596 -10.365 16.470 1.00 0.00 H ATOM 2793 HH12 ARG B 79 22.055 -7.247 17.420 1.00 0.00 H ATOM 2794 HH11 ARG B 79 22.737 -8.691 16.586 1.00 0.00 H ATOM 2795 HH22 ARG B 79 19.822 -7.169 17.945 1.00 0.00 H ATOM 2796 HH21 ARG B 79 18.747 -8.551 17.525 1.00 0.00 H ATOM 2797 H ARG B 79 19.159 -14.338 12.609 1.00 0.00 H ATOM 2798 N SER B 80 16.749 -12.628 14.950 1.00 62.89 N ATOM 2799 CA SER B 80 15.442 -12.081 14.576 1.00 69.54 C ATOM 2800 C SER B 80 15.645 -10.839 13.715 1.00 66.08 C ATOM 2801 O SER B 80 14.753 -10.405 12.980 1.00 56.05 O ATOM 2802 CB SER B 80 14.628 -11.717 15.820 1.00 85.31 C ATOM 2803 OG SER B 80 14.178 -12.873 16.502 1.00 99.89 O ATOM 2804 HA SER B 80 14.893 -12.837 14.015 1.00 0.00 H ATOM 2805 HB2 SER B 80 13.764 -11.125 15.518 1.00 0.00 H ATOM 2806 HB3 SER B 80 15.252 -11.129 16.493 1.00 0.00 H ATOM 2807 HG SER B 80 13.657 -12.603 17.299 1.00 0.00 H ATOM 2808 H SER B 80 16.958 -12.828 15.949 1.00 0.00 H ATOM 2809 N GLU B 81 16.842 -10.276 13.838 1.00 98.44 N ATOM 2810 CA GLU B 81 17.259 -9.089 13.112 1.00 96.49 C ATOM 2811 C GLU B 81 17.428 -9.404 11.625 1.00 84.56 C ATOM 2812 O GLU B 81 17.158 -8.563 10.772 1.00 78.27 O ATOM 2813 CB GLU B 81 18.581 -8.600 13.708 1.00 96.80 C ATOM 2814 CG GLU B 81 19.126 -7.310 13.146 1.00 91.66 C ATOM 2815 CD GLU B 81 20.477 -6.973 13.748 1.00103.68 C ATOM 2816 OE1 GLU B 81 21.383 -7.837 13.707 1.00 95.68 O ATOM 2817 OE2 GLU B 81 20.628 -5.851 14.282 1.00116.99 O ATOM 2818 HA GLU B 81 16.500 -8.312 13.204 1.00 0.00 H ATOM 2819 HB2 GLU B 81 18.432 -8.461 14.779 1.00 0.00 H ATOM 2820 HB3 GLU B 81 19.328 -9.377 13.544 1.00 0.00 H ATOM 2821 HG2 GLU B 81 19.233 -7.410 12.066 1.00 0.00 H ATOM 2822 HG3 GLU B 81 18.427 -6.503 13.367 1.00 0.00 H ATOM 2823 H GLU B 81 17.522 -10.711 14.494 1.00 0.00 H ATOM 2824 N ASP B 82 17.860 -10.629 11.330 1.00 82.11 N ATOM 2825 CA ASP B 82 18.121 -11.074 9.961 1.00 65.47 C ATOM 2826 C ASP B 82 16.856 -11.483 9.199 1.00 66.21 C ATOM 2827 O ASP B 82 16.931 -12.120 8.149 1.00 63.15 O ATOM 2828 CB ASP B 82 19.136 -12.221 9.973 1.00 56.39 C ATOM 2829 CG ASP B 82 20.438 -11.831 10.652 1.00 65.67 C ATOM 2830 OD1 ASP B 82 20.613 -10.622 10.894 1.00 74.69 O ATOM 2831 OD2 ASP B 82 21.286 -12.711 10.938 1.00 55.04 O ATOM 2832 HA ASP B 82 18.531 -10.219 9.424 1.00 0.00 H ATOM 2833 HB2 ASP B 82 18.702 -13.068 10.505 1.00 0.00 H ATOM 2834 HB3 ASP B 82 19.350 -12.511 8.944 1.00 0.00 H ATOM 2835 H ASP B 82 18.019 -11.300 12.109 1.00 0.00 H ATOM 2836 N GLU B 83 15.697 -11.091 9.715 1.00 54.73 N ATOM 2837 CA GLU B 83 14.423 -11.473 9.118 1.00 53.46 C ATOM 2838 C GLU B 83 14.027 -10.523 7.994 1.00 63.94 C ATOM 2839 O GLU B 83 13.198 -9.622 8.181 1.00 60.49 O ATOM 2840 CB GLU B 83 13.325 -11.535 10.188 1.00 73.18 C ATOM 2841 CG GLU B 83 11.998 -12.131 9.726 1.00 70.76 C ATOM 2842 CD GLU B 83 11.287 -12.901 10.836 1.00 91.01 C ATOM 2843 OE1 GLU B 83 11.959 -13.283 11.821 1.00 95.77 O ATOM 2844 OE2 GLU B 83 10.060 -13.128 10.729 1.00 84.57 O ATOM 2845 HA GLU B 83 14.542 -12.466 8.684 1.00 0.00 H ATOM 2846 HB2 GLU B 83 13.695 -12.139 11.017 1.00 0.00 H ATOM 2847 HB3 GLU B 83 13.136 -10.520 10.536 1.00 0.00 H ATOM 2848 HG2 GLU B 83 11.349 -11.322 9.390 1.00 0.00 H ATOM 2849 HG3 GLU B 83 12.190 -12.811 8.896 1.00 0.00 H ATOM 2850 H GLU B 83 15.698 -10.496 10.568 1.00 0.00 H ATOM 2851 N ALA B 84 14.627 -10.734 6.825 1.00 71.76 N ATOM 2852 CA ALA B 84 14.350 -9.903 5.656 1.00 59.97 C ATOM 2853 C ALA B 84 14.230 -10.773 4.414 1.00 52.94 C ATOM 2854 O ALA B 84 14.327 -12.001 4.502 1.00 46.14 O ATOM 2855 CB ALA B 84 15.453 -8.876 5.472 1.00 58.95 C ATOM 2856 HA ALA B 84 13.406 -9.380 5.811 1.00 0.00 H ATOM 2857 HB1 ALA B 84 15.509 -8.242 6.357 1.00 0.00 H ATOM 2858 HB2 ALA B 84 16.405 -9.388 5.330 1.00 0.00 H ATOM 2859 HB3 ALA B 84 15.235 -8.263 4.598 1.00 0.00 H ATOM 2860 H ALA B 84 15.312 -11.512 6.741 1.00 0.00 H ATOM 2861 N ASP B 85 14.019 -10.129 3.267 1.00 55.40 N ATOM 2862 CA ASP B 85 13.989 -10.807 1.970 1.00 44.24 C ATOM 2863 C ASP B 85 15.338 -10.615 1.264 1.00 45.73 C ATOM 2864 O ASP B 85 15.756 -9.483 1.020 1.00 41.17 O ATOM 2865 CB ASP B 85 12.840 -10.248 1.125 1.00 41.82 C ATOM 2866 CG ASP B 85 12.443 -11.167 -0.016 1.00 39.47 C ATOM 2867 OD1 ASP B 85 13.208 -12.112 -0.318 1.00 33.96 O ATOM 2868 OD2 ASP B 85 11.366 -10.934 -0.619 1.00 38.57 O ATOM 2869 HA ASP B 85 13.822 -11.875 2.111 1.00 0.00 H ATOM 2870 HB2 ASP B 85 11.974 -10.100 1.770 1.00 0.00 H ATOM 2871 HB3 ASP B 85 13.149 -9.289 0.708 1.00 0.00 H ATOM 2872 H ASP B 85 13.869 -9.100 3.294 1.00 0.00 H ATOM 2873 N TYR B 86 16.027 -11.716 0.952 1.00 47.81 N ATOM 2874 CA TYR B 86 17.392 -11.652 0.413 1.00 39.28 C ATOM 2875 C TYR B 86 17.457 -11.939 -1.093 1.00 32.13 C ATOM 2876 O TYR B 86 16.864 -12.905 -1.569 1.00 22.14 O ATOM 2877 CB TYR B 86 18.307 -12.618 1.155 1.00 34.19 C ATOM 2878 CG TYR B 86 18.502 -12.268 2.599 1.00 47.24 C ATOM 2879 CD1 TYR B 86 17.452 -12.374 3.509 1.00 59.43 C ATOM 2880 CD2 TYR B 86 19.735 -11.833 3.063 1.00 48.28 C ATOM 2881 CE1 TYR B 86 17.628 -12.042 4.853 1.00 67.45 C ATOM 2882 CE2 TYR B 86 19.922 -11.504 4.400 1.00 66.52 C ATOM 2883 CZ TYR B 86 18.867 -11.612 5.288 1.00 68.23 C ATOM 2884 OH TYR B 86 19.067 -11.280 6.606 1.00 78.67 O ATOM 2885 HA TYR B 86 17.731 -10.627 0.564 1.00 0.00 H ATOM 2886 HB3 TYR B 86 19.281 -12.617 0.665 1.00 0.00 H ATOM 2887 HB2 TYR B 86 17.874 -13.617 1.097 1.00 0.00 H ATOM 2888 HD2 TYR B 86 20.570 -11.748 2.368 1.00 0.00 H ATOM 2889 HE2 TYR B 86 20.897 -11.162 4.748 1.00 0.00 H ATOM 2890 HE1 TYR B 86 16.796 -12.121 5.553 1.00 0.00 H ATOM 2891 HD1 TYR B 86 16.478 -12.722 3.166 1.00 0.00 H ATOM 2892 HH TYR B 86 18.224 -11.409 7.109 1.00 0.00 H ATOM 2893 H TYR B 86 15.584 -12.646 1.095 1.00 0.00 H ATOM 2894 N TYR B 87 18.189 -11.101 -1.825 1.00 37.46 N ATOM 2895 CA TYR B 87 18.154 -11.109 -3.292 1.00 28.49 C ATOM 2896 C TYR B 87 19.534 -11.188 -3.930 1.00 21.17 C ATOM 2897 O TYR B 87 20.479 -10.558 -3.461 1.00 25.32 O ATOM 2898 CB TYR B 87 17.491 -9.838 -3.815 1.00 29.35 C ATOM 2899 CG TYR B 87 15.998 -9.743 -3.666 1.00 32.08 C ATOM 2900 CD1 TYR B 87 15.415 -9.275 -2.484 1.00 45.74 C ATOM 2901 CD2 TYR B 87 15.165 -10.067 -4.722 1.00 30.15 C ATOM 2902 CE1 TYR B 87 14.028 -9.164 -2.367 1.00 45.80 C ATOM 2903 CE2 TYR B 87 13.792 -9.957 -4.619 1.00 38.74 C ATOM 2904 CZ TYR B 87 13.227 -9.504 -3.446 1.00 46.73 C ATOM 2905 OH TYR B 87 11.855 -9.410 -3.379 1.00 55.99 O ATOM 2906 HA TYR B 87 17.591 -12.002 -3.562 1.00 0.00 H ATOM 2907 HB3 TYR B 87 17.723 -9.758 -4.877 1.00 0.00 H ATOM 2908 HB2 TYR B 87 17.930 -8.994 -3.284 1.00 0.00 H ATOM 2909 HD2 TYR B 87 15.602 -10.417 -5.657 1.00 0.00 H ATOM 2910 HE2 TYR B 87 13.157 -10.228 -5.463 1.00 0.00 H ATOM 2911 HE1 TYR B 87 13.580 -8.814 -1.437 1.00 0.00 H ATOM 2912 HD1 TYR B 87 16.051 -8.994 -1.644 1.00 0.00 H ATOM 2913 HH TYR B 87 11.457 -10.304 -3.527 1.00 0.00 H ATOM 2914 H TYR B 87 18.806 -10.418 -1.341 1.00 0.00 H ATOM 2915 N CYS B 88 19.645 -11.953 -5.019 1.00 30.22 N ATOM 2916 CA CYS B 88 20.857 -11.937 -5.832 1.00 21.33 C ATOM 2917 C CYS B 88 20.546 -11.222 -7.125 1.00 15.87 C ATOM 2918 O CYS B 88 19.377 -11.159 -7.543 1.00 16.83 O ATOM 2919 CB CYS B 88 21.366 -13.363 -6.110 1.00 29.00 C ATOM 2920 SG CYS B 88 20.159 -14.410 -6.963 1.00 25.24 S ATOM 2921 HA CYS B 88 21.649 -11.417 -5.293 1.00 0.00 H ATOM 2922 HB2 CYS B 88 21.617 -13.831 -5.158 1.00 0.00 H ATOM 2923 HB3 CYS B 88 22.261 -13.295 -6.728 1.00 0.00 H ATOM 2924 H CYS B 88 18.854 -12.571 -5.292 1.00 0.00 H ATOM 2925 N LEU B 89 21.589 -10.684 -7.763 1.00 21.78 N ATOM 2926 CA LEU B 89 21.443 -10.043 -9.073 1.00 18.33 C ATOM 2927 C LEU B 89 22.767 -10.115 -9.813 1.00 14.03 C ATOM 2928 O LEU B 89 23.824 -10.258 -9.198 1.00 21.65 O ATOM 2929 CB LEU B 89 21.007 -8.579 -8.925 1.00 18.35 C ATOM 2930 CG LEU B 89 22.021 -7.504 -8.491 1.00 21.66 C ATOM 2931 CD1 LEU B 89 22.593 -6.786 -9.675 1.00 23.02 C ATOM 2932 CD2 LEU B 89 21.322 -6.484 -7.602 1.00 28.80 C ATOM 2933 HA LEU B 89 20.672 -10.569 -9.637 1.00 0.00 H ATOM 2934 HB2 LEU B 89 20.618 -8.269 -9.895 1.00 0.00 H ATOM 2935 HB3 LEU B 89 20.202 -8.565 -8.190 1.00 0.00 H ATOM 2936 HG LEU B 89 22.830 -8.000 -7.954 1.00 0.00 H ATOM 2937 HD21 LEU B 89 20.509 -6.017 -8.157 1.00 0.00 H ATOM 2938 HD22 LEU B 89 20.921 -6.986 -6.721 1.00 0.00 H ATOM 2939 HD23 LEU B 89 22.038 -5.722 -7.293 1.00 0.00 H ATOM 2940 HD11 LEU B 89 23.101 -7.502 -10.322 1.00 0.00 H ATOM 2941 HD12 LEU B 89 21.788 -6.302 -10.228 1.00 0.00 H ATOM 2942 HD13 LEU B 89 23.305 -6.034 -9.334 1.00 0.00 H ATOM 2943 H LEU B 89 22.529 -10.721 -7.319 1.00 0.00 H ATOM 2944 N SER B 90 22.715 -10.022 -11.134 1.00 21.27 N ATOM 2945 CA SER B 90 23.925 -9.862 -11.925 1.00 16.62 C ATOM 2946 C SER B 90 23.535 -9.401 -13.326 1.00 15.22 C ATOM 2947 O SER B 90 22.362 -9.417 -13.685 1.00 16.32 O ATOM 2948 CB SER B 90 24.697 -11.182 -12.048 1.00 20.66 C ATOM 2949 OG SER B 90 24.173 -11.973 -13.111 1.00 22.49 O ATOM 2950 HA SER B 90 24.564 -9.132 -11.428 1.00 0.00 H ATOM 2951 HB2 SER B 90 24.611 -11.736 -11.113 1.00 0.00 H ATOM 2952 HB3 SER B 90 25.747 -10.966 -12.246 1.00 0.00 H ATOM 2953 HG SER B 90 24.253 -11.474 -13.962 1.00 0.00 H ATOM 2954 H SER B 90 21.793 -10.064 -11.613 1.00 0.00 H ATOM 2955 N TRP B 91 24.528 -8.996 -14.108 1.00 10.39 N ATOM 2956 CA TRP B 91 24.316 -8.704 -15.517 1.00 13.36 C ATOM 2957 C TRP B 91 24.144 -10.024 -16.245 1.00 14.92 C ATOM 2958 O TRP B 91 24.664 -11.038 -15.797 1.00 17.43 O ATOM 2959 CB TRP B 91 25.534 -7.974 -16.078 1.00 16.84 C ATOM 2960 CG TRP B 91 25.355 -7.556 -17.491 1.00 16.86 C ATOM 2961 CD1 TRP B 91 25.896 -8.153 -18.596 1.00 19.25 C ATOM 2962 CD2 TRP B 91 24.568 -6.455 -17.971 1.00 16.09 C ATOM 2963 NE1 TRP B 91 25.493 -7.488 -19.736 1.00 20.96 N ATOM 2964 CE2 TRP B 91 24.670 -6.446 -19.377 1.00 20.53 C ATOM 2965 CE3 TRP B 91 23.783 -5.473 -17.343 1.00 14.72 C ATOM 2966 CZ2 TRP B 91 24.034 -5.482 -20.175 1.00 23.09 C ATOM 2967 CZ3 TRP B 91 23.147 -4.518 -18.140 1.00 18.83 C ATOM 2968 CH2 TRP B 91 23.277 -4.534 -19.534 1.00 22.10 C ATOM 2969 HA TRP B 91 23.435 -8.075 -15.646 1.00 0.00 H ATOM 2970 HB2 TRP B 91 25.717 -7.086 -15.473 1.00 0.00 H ATOM 2971 HB3 TRP B 91 26.396 -8.638 -16.018 1.00 0.00 H ATOM 2972 HE1 TRP B 91 25.767 -7.735 -20.708 1.00 0.00 H ATOM 2973 HD1 TRP B 91 26.549 -9.025 -18.579 1.00 0.00 H ATOM 2974 HZ2 TRP B 91 24.137 -5.486 -21.260 1.00 0.00 H ATOM 2975 HH2 TRP B 91 22.764 -3.775 -20.124 1.00 0.00 H ATOM 2976 HZ3 TRP B 91 22.539 -3.746 -17.668 1.00 0.00 H ATOM 2977 HE3 TRP B 91 23.673 -5.457 -16.259 1.00 0.00 H ATOM 2978 H TRP B 91 25.480 -8.885 -13.704 1.00 0.00 H ATOM 2979 N ASP B 92 23.416 -10.021 -17.358 1.00 13.15 N ATOM 2980 CA ASP B 92 23.256 -11.227 -18.160 1.00 15.36 C ATOM 2981 C ASP B 92 23.659 -10.891 -19.583 1.00 19.85 C ATOM 2982 O ASP B 92 23.041 -10.028 -20.201 1.00 19.48 O ATOM 2983 CB ASP B 92 21.800 -11.694 -18.107 1.00 10.37 C ATOM 2984 CG ASP B 92 21.568 -12.981 -18.868 1.00 20.40 C ATOM 2985 OD1 ASP B 92 22.035 -13.098 -20.024 1.00 21.68 O ATOM 2986 OD2 ASP B 92 20.911 -13.886 -18.314 1.00 21.99 O ATOM 2987 HA ASP B 92 23.881 -12.034 -17.777 1.00 0.00 H ATOM 2988 HB2 ASP B 92 21.522 -11.851 -17.065 1.00 0.00 H ATOM 2989 HB3 ASP B 92 21.169 -10.916 -18.537 1.00 0.00 H ATOM 2990 H ASP B 92 22.952 -9.141 -17.662 1.00 0.00 H ATOM 2991 N ASP B 93 24.683 -11.566 -20.111 1.00 16.76 N ATOM 2992 CA ASP B 93 25.209 -11.230 -21.448 1.00 24.81 C ATOM 2993 C ASP B 93 24.240 -11.489 -22.572 1.00 31.27 C ATOM 2994 O ASP B 93 24.276 -10.794 -23.591 1.00 37.15 O ATOM 2995 CB ASP B 93 26.457 -12.038 -21.799 1.00 31.90 C ATOM 2996 CG ASP B 93 27.570 -11.834 -20.846 1.00 30.28 C ATOM 2997 OD1 ASP B 93 27.641 -10.759 -20.209 1.00 33.38 O ATOM 2998 OD2 ASP B 93 28.383 -12.769 -20.727 1.00 33.56 O ATOM 2999 HA ASP B 93 25.419 -10.163 -21.368 1.00 0.00 H ATOM 3000 HB2 ASP B 93 26.195 -13.096 -21.805 1.00 0.00 H ATOM 3001 HB3 ASP B 93 26.793 -11.743 -22.793 1.00 0.00 H ATOM 3002 H ASP B 93 25.117 -12.342 -19.571 1.00 0.00 H ATOM 3003 N SER B 94 23.406 -12.513 -22.426 1.00 30.44 N ATOM 3004 CA SER B 94 22.517 -12.891 -23.526 1.00 34.46 C ATOM 3005 C SER B 94 21.307 -11.973 -23.621 1.00 35.81 C ATOM 3006 O SER B 94 20.819 -11.684 -24.713 1.00 37.62 O ATOM 3007 CB SER B 94 22.065 -14.345 -23.392 1.00 28.46 C ATOM 3008 OG SER B 94 23.173 -15.210 -23.536 1.00 44.18 O ATOM 3009 HA SER B 94 23.090 -12.785 -24.447 1.00 0.00 H ATOM 3010 HB2 SER B 94 21.330 -14.568 -24.165 1.00 0.00 H ATOM 3011 HB3 SER B 94 21.615 -14.495 -22.411 1.00 0.00 H ATOM 3012 HG SER B 94 22.871 -16.149 -23.448 1.00 0.00 H ATOM 3013 H SER B 94 23.385 -13.045 -21.532 1.00 0.00 H ATOM 3014 N LEU B 95 20.821 -11.526 -22.467 1.00 28.12 N ATOM 3015 CA LEU B 95 19.684 -10.615 -22.423 1.00 21.18 C ATOM 3016 C LEU B 95 20.136 -9.158 -22.507 1.00 24.85 C ATOM 3017 O LEU B 95 19.314 -8.262 -22.672 1.00 27.09 O ATOM 3018 CB LEU B 95 18.871 -10.837 -21.146 1.00 22.11 C ATOM 3019 CG LEU B 95 18.277 -12.240 -21.008 1.00 31.38 C ATOM 3020 CD1 LEU B 95 17.736 -12.454 -19.609 1.00 34.59 C ATOM 3021 CD2 LEU B 95 17.187 -12.492 -22.064 1.00 31.85 C ATOM 3022 HA LEU B 95 19.056 -10.827 -23.288 1.00 0.00 H ATOM 3023 HB2 LEU B 95 19.523 -10.658 -20.291 1.00 0.00 H ATOM 3024 HB3 LEU B 95 18.052 -10.118 -21.134 1.00 0.00 H ATOM 3025 HG LEU B 95 19.075 -12.962 -21.181 1.00 0.00 H ATOM 3026 HD21 LEU B 95 16.387 -11.762 -21.940 1.00 0.00 H ATOM 3027 HD22 LEU B 95 17.618 -12.394 -23.060 1.00 0.00 H ATOM 3028 HD23 LEU B 95 16.786 -13.498 -21.938 1.00 0.00 H ATOM 3029 HD11 LEU B 95 18.544 -12.339 -18.887 1.00 0.00 H ATOM 3030 HD12 LEU B 95 16.958 -11.718 -19.405 1.00 0.00 H ATOM 3031 HD13 LEU B 95 17.318 -13.458 -19.532 1.00 0.00 H ATOM 3032 H LEU B 95 21.262 -11.833 -21.576 1.00 0.00 H ATOM 3033 N ASN B 95A 21.441 -8.926 -22.392 1.00 24.73 N ATOM 3034 CA ASN B 95A 21.964 -7.554 -22.328 1.00 30.66 C ATOM 3035 C ASN B 95A 21.166 -6.683 -21.341 1.00 27.01 C ATOM 3036 O ASN B 95A 20.700 -5.597 -21.664 1.00 27.00 O ATOM 3037 CB ASN B 95A 21.982 -6.929 -23.731 1.00 38.78 C ATOM 3038 CG ASN B 95A 23.046 -5.848 -23.884 1.00 52.80 C ATOM 3039 OD1 ASN B 95A 22.727 -4.669 -24.072 1.00 58.44 O ATOM 3040 ND2 ASN B 95A 24.319 -6.247 -23.814 1.00 51.78 N ATOM 3041 HA ASN B 95A 22.987 -7.600 -21.954 1.00 0.00 H ATOM 3042 HB2 ASN B 95A 22.177 -7.715 -24.460 1.00 0.00 H ATOM 3043 HB3 ASN B 95A 21.005 -6.487 -23.928 1.00 0.00 H ATOM 3044 HD22 ASN B 95A 24.541 -7.250 -23.654 1.00 0.00 H ATOM 3045 HD21 ASN B 95A 25.088 -5.554 -23.919 1.00 0.00 H ATOM 3046 H ASN B 95A 22.101 -9.728 -22.347 1.00 0.00 H ATOM 3047 N GLY B 95B 21.006 -7.170 -20.121 1.00 21.44 N ATOM 3048 CA GLY B 95B 20.283 -6.427 -19.109 1.00 19.09 C ATOM 3049 C GLY B 95B 20.521 -7.085 -17.769 1.00 19.45 C ATOM 3050 O GLY B 95B 21.164 -8.143 -17.715 1.00 15.90 O ATOM 3051 HA3 GLY B 95B 19.217 -6.434 -19.338 1.00 0.00 H ATOM 3052 HA2 GLY B 95B 20.641 -5.398 -19.082 1.00 0.00 H ATOM 3053 H GLY B 95B 21.406 -8.101 -19.885 1.00 0.00 H ATOM 3054 N TRP B 96 20.022 -6.470 -16.701 1.00 13.32 N ATOM 3055 CA TRP B 96 20.192 -7.018 -15.352 1.00 13.82 C ATOM 3056 C TRP B 96 19.193 -8.137 -15.116 1.00 18.64 C ATOM 3057 O TRP B 96 18.078 -8.074 -15.610 1.00 20.74 O ATOM 3058 CB TRP B 96 19.987 -5.920 -14.311 1.00 21.79 C ATOM 3059 CG TRP B 96 20.942 -4.763 -14.498 1.00 18.45 C ATOM 3060 CD1 TRP B 96 20.668 -3.556 -15.072 1.00 15.56 C ATOM 3061 CD2 TRP B 96 22.316 -4.727 -14.119 1.00 21.51 C ATOM 3062 NE1 TRP B 96 21.790 -2.777 -15.083 1.00 17.41 N ATOM 3063 CE2 TRP B 96 22.822 -3.473 -14.500 1.00 17.37 C ATOM 3064 CE3 TRP B 96 23.182 -5.649 -13.506 1.00 21.61 C ATOM 3065 CZ2 TRP B 96 24.144 -3.100 -14.276 1.00 15.83 C ATOM 3066 CZ3 TRP B 96 24.501 -5.283 -13.286 1.00 21.04 C ATOM 3067 CH2 TRP B 96 24.970 -4.018 -13.668 1.00 17.56 C ATOM 3068 HA TRP B 96 21.203 -7.414 -15.260 1.00 0.00 H ATOM 3069 HB2 TRP B 96 18.966 -5.548 -14.391 1.00 0.00 H ATOM 3070 HB3 TRP B 96 20.141 -6.345 -13.319 1.00 0.00 H ATOM 3071 HE1 TRP B 96 21.853 -1.814 -15.470 1.00 0.00 H ATOM 3072 HD1 TRP B 96 19.696 -3.257 -15.464 1.00 0.00 H ATOM 3073 HZ2 TRP B 96 24.512 -2.117 -14.571 1.00 0.00 H ATOM 3074 HH2 TRP B 96 26.011 -3.756 -13.479 1.00 0.00 H ATOM 3075 HZ3 TRP B 96 25.182 -5.988 -12.810 1.00 0.00 H ATOM 3076 HE3 TRP B 96 22.823 -6.634 -13.209 1.00 0.00 H ATOM 3077 H TRP B 96 19.499 -5.580 -16.826 1.00 0.00 H ATOM 3078 N VAL B 97 19.594 -9.158 -14.363 1.00 14.01 N ATOM 3079 CA VAL B 97 18.676 -10.214 -13.967 1.00 16.01 C ATOM 3080 C VAL B 97 18.727 -10.385 -12.464 1.00 19.54 C ATOM 3081 O VAL B 97 19.741 -10.075 -11.829 1.00 17.67 O ATOM 3082 CB VAL B 97 18.996 -11.580 -14.648 1.00 18.67 C ATOM 3083 CG1 VAL B 97 18.665 -11.526 -16.146 1.00 19.14 C ATOM 3084 CG2 VAL B 97 20.454 -11.987 -14.391 1.00 16.68 C ATOM 3085 HA VAL B 97 17.680 -9.913 -14.292 1.00 0.00 H ATOM 3086 HB VAL B 97 18.365 -12.351 -14.205 1.00 0.00 H ATOM 3087 HG11 VAL B 97 17.605 -11.306 -16.275 1.00 0.00 H ATOM 3088 HG12 VAL B 97 19.260 -10.746 -16.620 1.00 0.00 H ATOM 3089 HG13 VAL B 97 18.895 -12.489 -16.603 1.00 0.00 H ATOM 3090 HG21 VAL B 97 21.120 -11.226 -14.798 1.00 0.00 H ATOM 3091 HG22 VAL B 97 20.620 -12.081 -13.318 1.00 0.00 H ATOM 3092 HG23 VAL B 97 20.654 -12.943 -14.876 1.00 0.00 H ATOM 3093 H VAL B 97 20.585 -9.202 -14.051 1.00 0.00 H ATOM 3094 N PHE B 98 17.627 -10.885 -11.907 1.00 18.19 N ATOM 3095 CA PHE B 98 17.454 -10.973 -10.460 1.00 22.80 C ATOM 3096 C PHE B 98 16.839 -12.303 -10.032 1.00 19.90 C ATOM 3097 O PHE B 98 16.058 -12.911 -10.767 1.00 21.61 O ATOM 3098 CB PHE B 98 16.500 -9.866 -9.988 1.00 23.31 C ATOM 3099 CG PHE B 98 16.924 -8.480 -10.383 1.00 21.46 C ATOM 3100 CD1 PHE B 98 17.652 -7.691 -9.504 1.00 22.66 C ATOM 3101 CD2 PHE B 98 16.584 -7.963 -11.627 1.00 20.34 C ATOM 3102 CE1 PHE B 98 18.050 -6.397 -9.869 1.00 25.53 C ATOM 3103 CE2 PHE B 98 16.970 -6.673 -12.006 1.00 22.32 C ATOM 3104 CZ PHE B 98 17.709 -5.889 -11.116 1.00 22.33 C ATOM 3105 HA PHE B 98 18.446 -10.874 -10.018 1.00 0.00 H ATOM 3106 HB2 PHE B 98 15.515 -10.058 -10.415 1.00 0.00 H ATOM 3107 HB3 PHE B 98 16.438 -9.908 -8.901 1.00 0.00 H ATOM 3108 HD2 PHE B 98 16.006 -8.574 -12.320 1.00 0.00 H ATOM 3109 HE2 PHE B 98 16.697 -6.283 -12.986 1.00 0.00 H ATOM 3110 HZ PHE B 98 18.017 -4.882 -11.399 1.00 0.00 H ATOM 3111 HE1 PHE B 98 18.628 -5.789 -9.173 1.00 0.00 H ATOM 3112 HD1 PHE B 98 17.917 -8.081 -8.521 1.00 0.00 H ATOM 3113 H PHE B 98 16.863 -11.225 -12.525 1.00 0.00 H ATOM 3114 N GLY B 99 17.158 -12.713 -8.814 1.00 18.70 N ATOM 3115 CA GLY B 99 16.428 -13.777 -8.144 1.00 24.76 C ATOM 3116 C GLY B 99 15.091 -13.251 -7.644 1.00 32.47 C ATOM 3117 O GLY B 99 14.874 -12.039 -7.601 1.00 29.05 O ATOM 3118 HA3 GLY B 99 17.013 -14.141 -7.299 1.00 0.00 H ATOM 3119 HA2 GLY B 99 16.256 -14.595 -8.844 1.00 0.00 H ATOM 3120 H GLY B 99 17.955 -12.260 -8.322 1.00 0.00 H ATOM 3121 N GLY B 100 14.189 -14.157 -7.277 1.00 25.24 N ATOM 3122 CA GLY B 100 12.862 -13.769 -6.837 1.00 29.50 C ATOM 3123 C GLY B 100 12.847 -13.361 -5.376 1.00 39.13 C ATOM 3124 O GLY B 100 11.822 -12.889 -4.867 1.00 46.62 O ATOM 3125 HA3 GLY B 100 12.184 -14.612 -6.975 1.00 0.00 H ATOM 3126 HA2 GLY B 100 12.522 -12.928 -7.441 1.00 0.00 H ATOM 3127 H GLY B 100 14.440 -15.166 -7.306 1.00 0.00 H ATOM 3128 N GLY B 101 13.990 -13.533 -4.716 1.00 17.89 N ATOM 3129 CA GLY B 101 14.141 -13.215 -3.305 1.00 27.97 C ATOM 3130 C GLY B 101 13.832 -14.410 -2.419 1.00 36.08 C ATOM 3131 O GLY B 101 12.889 -15.149 -2.699 1.00 41.51 O ATOM 3132 HA3 GLY B 101 13.460 -12.403 -3.052 1.00 0.00 H ATOM 3133 HA2 GLY B 101 15.168 -12.897 -3.123 1.00 0.00 H ATOM 3134 H GLY B 101 14.810 -13.911 -5.232 1.00 0.00 H ATOM 3135 N THR B 102 14.639 -14.604 -1.378 1.00 24.64 N ATOM 3136 CA THR B 102 14.395 -15.629 -0.369 1.00 35.47 C ATOM 3137 C THR B 102 13.990 -14.960 0.968 1.00 47.86 C ATOM 3138 O THR B 102 14.856 -14.489 1.717 1.00 45.65 O ATOM 3139 CB THR B 102 15.644 -16.516 -0.133 1.00 33.61 C ATOM 3140 OG1 THR B 102 15.984 -17.252 -1.326 1.00 27.80 O ATOM 3141 CG2 THR B 102 15.387 -17.511 0.990 1.00 46.10 C ATOM 3142 HA THR B 102 13.590 -16.265 -0.736 1.00 0.00 H ATOM 3143 HB THR B 102 16.468 -15.856 0.137 1.00 0.00 H ATOM 3144 HG1 THR B 102 15.224 -17.832 -1.582 1.00 0.00 H ATOM 3145 HG23 THR B 102 15.128 -16.970 1.900 1.00 0.00 H ATOM 3146 HG21 THR B 102 14.564 -18.168 0.710 1.00 0.00 H ATOM 3147 HG22 THR B 102 16.285 -18.104 1.161 1.00 0.00 H ATOM 3148 H THR B 102 15.479 -13.999 -1.280 1.00 0.00 H ATOM 3149 N LYS B 103 12.685 -14.915 1.251 1.00 31.42 N ATOM 3150 CA LYS B 103 12.172 -14.394 2.537 1.00 43.21 C ATOM 3151 C LYS B 103 12.605 -15.266 3.705 1.00 45.21 C ATOM 3152 O LYS B 103 12.105 -16.372 3.870 1.00 53.44 O ATOM 3153 CB LYS B 103 10.645 -14.299 2.527 1.00 46.54 C ATOM 3154 CG LYS B 103 10.075 -13.266 1.560 1.00 53.75 C ATOM 3155 CD LYS B 103 8.591 -13.021 1.810 1.00 66.80 C ATOM 3156 CE LYS B 103 8.037 -11.981 0.843 1.00 66.24 C ATOM 3157 NZ LYS B 103 6.642 -11.566 1.176 1.00 77.57 N ATOM 3158 HA LYS B 103 12.595 -13.397 2.661 1.00 0.00 H ATOM 3159 HB2 LYS B 103 10.246 -15.276 2.254 1.00 0.00 H ATOM 3160 HB3 LYS B 103 10.314 -14.041 3.533 1.00 0.00 H ATOM 3161 HG2 LYS B 103 10.615 -12.327 1.686 1.00 0.00 H ATOM 3162 HG3 LYS B 103 10.207 -13.626 0.540 1.00 0.00 H ATOM 3163 HD2 LYS B 103 8.048 -13.957 1.677 1.00 0.00 H ATOM 3164 HD3 LYS B 103 8.455 -12.666 2.832 1.00 0.00 H ATOM 3165 HE2 LYS B 103 8.045 -12.401 -0.163 1.00 0.00 H ATOM 3166 HE3 LYS B 103 8.679 -11.101 0.873 1.00 0.00 H ATOM 3167 HZ1 LYS B 103 6.017 -12.397 1.142 1.00 0.00 H ATOM 3168 HZ2 LYS B 103 6.623 -11.155 2.131 1.00 0.00 H ATOM 3169 HZ3 LYS B 103 6.318 -10.859 0.486 1.00 0.00 H ATOM 3170 H LYS B 103 12.006 -15.258 0.542 1.00 0.00 H ATOM 3171 N VAL B 104 13.549 -14.786 4.504 1.00 38.16 N ATOM 3172 CA VAL B 104 13.983 -15.532 5.678 1.00 45.48 C ATOM 3173 C VAL B 104 13.064 -15.283 6.890 1.00 69.97 C ATOM 3174 O VAL B 104 12.724 -14.133 7.205 1.00 66.32 O ATOM 3175 CB VAL B 104 15.437 -15.206 6.044 1.00 42.27 C ATOM 3176 CG1 VAL B 104 15.840 -15.904 7.342 1.00 46.50 C ATOM 3177 CG2 VAL B 104 16.356 -15.612 4.914 1.00 31.33 C ATOM 3178 HA VAL B 104 13.919 -16.588 5.417 1.00 0.00 H ATOM 3179 HB VAL B 104 15.524 -14.131 6.200 1.00 0.00 H ATOM 3180 HG11 VAL B 104 15.190 -15.569 8.150 1.00 0.00 H ATOM 3181 HG12 VAL B 104 15.742 -16.983 7.219 1.00 0.00 H ATOM 3182 HG13 VAL B 104 16.875 -15.657 7.580 1.00 0.00 H ATOM 3183 HG21 VAL B 104 16.261 -16.683 4.737 1.00 0.00 H ATOM 3184 HG22 VAL B 104 16.081 -15.067 4.011 1.00 0.00 H ATOM 3185 HG23 VAL B 104 17.386 -15.377 5.183 1.00 0.00 H ATOM 3186 H VAL B 104 13.985 -13.866 4.290 1.00 0.00 H ATOM 3187 N THR B 105 12.656 -16.368 7.550 1.00 47.24 N ATOM 3188 CA THR B 105 11.818 -16.291 8.752 1.00 57.62 C ATOM 3189 C THR B 105 12.550 -16.877 9.949 1.00 60.14 C ATOM 3190 O THR B 105 13.116 -17.960 9.858 1.00 52.13 O ATOM 3191 CB THR B 105 10.483 -17.048 8.587 1.00 64.14 C ATOM 3192 OG1 THR B 105 9.571 -16.269 7.803 1.00 57.22 O ATOM 3193 CG2 THR B 105 9.852 -17.299 9.949 1.00 84.50 C ATOM 3194 HA THR B 105 11.604 -15.234 8.910 1.00 0.00 H ATOM 3195 HB THR B 105 10.686 -17.997 8.091 1.00 0.00 H ATOM 3196 HG1 THR B 105 9.964 -16.103 6.910 1.00 0.00 H ATOM 3197 HG23 THR B 105 10.533 -17.891 10.560 1.00 0.00 H ATOM 3198 HG21 THR B 105 9.658 -16.345 10.440 1.00 0.00 H ATOM 3199 HG22 THR B 105 8.914 -17.840 9.820 1.00 0.00 H ATOM 3200 H THR B 105 12.943 -17.304 7.199 1.00 0.00 H ATOM 3201 N VAL B 106 12.536 -16.162 11.071 1.00 72.14 N ATOM 3202 CA VAL B 106 13.243 -16.615 12.267 1.00 76.13 C ATOM 3203 C VAL B 106 12.293 -17.133 13.352 1.00 82.61 C ATOM 3204 O VAL B 106 11.192 -16.610 13.535 1.00 89.00 O ATOM 3205 CB VAL B 106 14.136 -15.506 12.858 1.00 70.47 C ATOM 3206 CG1 VAL B 106 15.362 -16.124 13.514 1.00 71.33 C ATOM 3207 CG2 VAL B 106 14.550 -14.521 11.775 1.00 60.23 C ATOM 3208 HA VAL B 106 13.871 -17.443 11.940 1.00 0.00 H ATOM 3209 HB VAL B 106 13.569 -14.962 13.613 1.00 0.00 H ATOM 3210 HG11 VAL B 106 15.046 -16.796 14.312 1.00 0.00 H ATOM 3211 HG12 VAL B 106 15.928 -16.684 12.769 1.00 0.00 H ATOM 3212 HG13 VAL B 106 15.988 -15.334 13.929 1.00 0.00 H ATOM 3213 HG21 VAL B 106 15.106 -15.048 10.999 1.00 0.00 H ATOM 3214 HG22 VAL B 106 13.660 -14.066 11.340 1.00 0.00 H ATOM 3215 HG23 VAL B 106 15.180 -13.746 12.212 1.00 0.00 H ATOM 3216 H VAL B 106 12.012 -15.264 11.097 1.00 0.00 H TER 3217 VAL B 106 HETATM 3218 O HOH 1 22.277 15.248 -18.421 1.00 31.83 O HETATM 3219 O HOH 2 15.839 4.889 -22.925 1.00 44.55 O HETATM 3220 O HOH 3 36.106 2.308 -3.329 1.00 46.33 O HETATM 3221 O HOH 4 39.211 5.545 -8.295 1.00 42.12 O HETATM 3222 O HOH 5 42.327 3.973 -13.533 1.00 47.07 O HETATM 3223 O HOH 6 21.886 0.712 -23.666 1.00 44.00 O HETATM 3224 O HOH 7 14.194 -1.037 -16.668 1.00 47.38 O HETATM 3225 O HOH 8 19.337 17.566 0.146 1.00 33.45 O HETATM 3226 O HOH 9 13.877 1.527 -16.737 1.00 37.07 O HETATM 3227 O HOH 10 27.534 7.205 -27.265 1.00 42.09 O HETATM 3228 O HOH 11 23.176 9.814 -29.330 1.00 41.04 O HETATM 3229 O HOH 12 19.360 2.481 -3.628 1.00 25.14 O HETATM 3230 O HOH 13 32.820 18.601 -10.471 1.00 49.03 O HETATM 3231 O HOH 14 23.766 19.170 -2.430 1.00 32.98 O HETATM 3232 O HOH 15 15.933 15.406 -20.494 1.00 51.79 O HETATM 3233 O HOH 16 15.352 2.451 -21.003 1.00 47.78 O HETATM 3234 O HOH 17 25.279 -0.175 -1.853 1.00 27.19 O HETATM 3235 O HOH 18 35.568 6.880 -3.263 1.00 28.59 O HETATM 3236 O HOH 19 24.469 17.836 -19.435 1.00 30.96 O HETATM 3237 O HOH 20 32.247 18.233 -15.518 1.00 33.34 O HETATM 3238 O HOH 21 16.138 2.417 -18.560 1.00 30.66 O HETATM 3239 O HOH 22 20.446 0.514 -2.443 1.00 29.92 O HETATM 3240 O HOH 23 19.843 14.482 -17.870 1.00 38.02 O HETATM 3241 O HOH 24 21.652 14.296 -22.967 1.00 39.51 O HETATM 3242 O HOH 25 41.086 7.694 -24.729 1.00 46.45 O HETATM 3243 O HOH 26 42.037 6.511 -18.152 1.00 42.68 O HETATM 3244 O HOH 27 13.058 2.543 -14.303 1.00 29.86 O HETATM 3245 O HOH 28 29.664 19.282 -12.040 1.00 35.73 O HETATM 3246 O HOH 29 22.758 7.941 0.487 1.00 43.41 O HETATM 3247 O HOH 30 17.741 15.203 -15.840 1.00 39.25 O HETATM 3248 O HOH 31 20.123 9.071 0.305 1.00 42.76 O HETATM 3249 O HOH 32 16.683 10.394 2.531 1.00 30.36 O HETATM 3250 O HOH 33 34.694 14.598 -12.226 1.00 23.55 O HETATM 3251 O HOH 34 17.560 8.786 -21.488 1.00 25.98 O HETATM 3252 O HOH 35 25.518 10.480 -7.901 1.00 19.96 O HETATM 3253 O HOH 36 26.553 13.248 -2.624 1.00 21.82 O HETATM 3254 O HOH 37 31.857 -2.752 -12.391 1.00 26.80 O HETATM 3255 O HOH 38 43.095 8.095 -13.375 1.00 37.97 O HETATM 3256 O HOH 39 18.265 -4.319 -17.505 1.00 30.58 O HETATM 3257 O HOH 40 21.843 -1.110 -19.395 1.00 24.57 O HETATM 3258 O HOH 41 33.233 -4.131 -19.159 1.00 42.97 O HETATM 3259 O HOH 42 15.688 8.949 -18.538 1.00 24.98 O HETATM 3260 O HOH 43 37.282 14.128 -10.926 1.00 35.43 O HETATM 3261 O HOH 44 30.289 -1.851 -21.146 1.00 28.71 O HETATM 3262 O HOH 45 35.046 22.480 -20.005 1.00 42.50 O HETATM 3263 O HOH 46 32.833 -4.726 -16.134 1.00 41.57 O HETATM 3264 O HOH 47 27.640 -0.057 1.311 1.00 36.01 O HETATM 3265 O HOH 48 20.091 5.309 -23.632 1.00 25.97 O HETATM 3266 O HOH 49 10.946 9.425 -10.170 1.00 31.61 O HETATM 3267 O HOH 50 32.777 10.781 -6.438 1.00 22.11 O HETATM 3268 O HOH 51 19.724 7.634 -25.081 1.00 35.31 O HETATM 3269 O HOH 52 24.578 3.158 -29.317 1.00 45.27 O HETATM 3270 O HOH 53 25.436 11.584 -27.993 1.00 33.37 O HETATM 3271 O HOH 54 31.740 13.653 -5.313 1.00 25.29 O HETATM 3272 O HOH 55 29.566 4.341 1.258 1.00 45.57 O HETATM 3273 O HOH 56 11.087 9.176 -18.323 1.00 49.81 O HETATM 3274 O HOH 57 33.941 4.205 -27.451 1.00 46.63 O HETATM 3275 O HOH 58 18.619 16.999 -12.731 1.00 35.89 O HETATM 3276 O HOH 59 24.352 6.103 -0.212 1.00 32.47 O HETATM 3277 O HOH 60 20.859 19.304 -2.110 1.00 34.06 O HETATM 3278 O HOH 61 38.018 16.779 -10.352 1.00 45.25 O HETATM 3279 O HOH 62 22.810 11.548 -17.273 1.00 27.45 O HETATM 3280 O HOH 63 11.892 11.153 -13.283 1.00 38.08 O HETATM 3281 O HOH 64 32.946 12.932 -2.794 1.00 32.17 O HETATM 3282 O HOH 65 14.727 12.381 -20.884 1.00 48.36 O HETATM 3283 O HOH 66 23.104 1.799 0.498 1.00 41.96 O HETATM 3284 O HOH 67 41.719 14.273 -23.345 1.00 44.69 O HETATM 3285 O HOH 68 10.833 0.196 0.286 1.00 49.14 O HETATM 3286 O HOH 69 19.080 3.538 -25.641 1.00 41.68 O HETATM 3287 O HOH 70 25.977 -4.218 -23.314 1.00 40.62 O HETATM 3288 O HOH 71 20.079 8.495 -27.958 1.00 47.95 O HETATM 3289 O HOH 72 30.176 3.698 -27.212 1.00 35.63 O HETATM 3290 O HOH 73 33.403 10.258 -1.979 1.00 33.01 O HETATM 3291 O HOH 74 35.130 8.360 -1.175 1.00 42.08 O HETATM 3292 O HOH 75 32.056 9.523 0.808 1.00 39.07 O HETATM 3293 O HOH 76 33.774 16.557 -8.281 1.00 46.63 O HETATM 3294 O HOH 77 8.238 9.096 -7.582 1.00 46.57 O HETATM 3295 O HOH 78 8.168 6.696 -7.824 1.00 46.40 O HETATM 3296 O HOH 79 34.219 -2.818 -23.145 1.00 45.38 O HETATM 3297 O HOH 80 27.638 4.593 -26.962 1.00 39.89 O HETATM 3298 O HOH 81 19.320 14.065 -1.835 1.00 33.50 O HETATM 3299 O HOH 82 37.454 20.851 -33.084 1.00 66.55 O HETATM 3300 O HOH 83 27.183 -8.328 -12.945 1.00 19.29 O HETATM 3301 O HOH 84 12.033 -19.964 -7.145 1.00 39.05 O HETATM 3302 O HOH 85 15.183 -11.084 -13.568 1.00 19.73 O HETATM 3303 O HOH 86 20.543 -16.361 -19.201 1.00 31.19 O HETATM 3304 O HOH 87 28.356 -5.699 -12.754 1.00 30.11 O HETATM 3305 O HOH 88 16.946 -8.851 16.845 1.00 53.11 O HETATM 3306 O HOH 89 27.786 -14.853 -4.710 1.00 25.91 O HETATM 3307 O HOH 90 13.144 -10.025 -12.000 1.00 32.84 O HETATM 3308 O HOH 91 31.108 -4.211 -8.912 1.00 32.21 O HETATM 3309 O HOH 92 33.746 -13.465 -18.361 1.00 37.73 O HETATM 3310 O HOH 93 33.753 -0.794 -11.195 1.00 28.94 O HETATM 3311 O HOH 94 33.317 -22.486 -11.307 1.00 47.94 O HETATM 3312 O HOH 95 33.296 -17.780 -4.739 1.00 45.02 O HETATM 3313 O HOH 96 23.794 -12.965 15.217 1.00 54.92 O HETATM 3314 O HOH 97 29.983 -8.404 -14.459 1.00 31.25 O HETATM 3315 O HOH 98 31.280 -19.329 -11.299 1.00 34.55 O HETATM 3316 O HOH 99 33.301 -10.913 -9.892 1.00 41.64 O HETATM 3317 O HOH 100 20.098 -2.758 -20.531 1.00 35.69 O HETATM 3318 O HOH 101 19.504 -17.871 -15.583 1.00 25.27 O HETATM 3319 O HOH 102 17.647 -19.641 -1.987 1.00 30.80 O HETATM 3320 O HOH 103 24.213 -2.986 -26.206 1.00 44.81 O HETATM 3321 O HOH 104 26.826 -24.867 -9.289 1.00 30.81 O HETATM 3322 O HOH 105 26.233 -7.789 -22.597 1.00 31.97 O HETATM 3323 O HOH 106 10.464 -12.257 -2.632 1.00 33.15 O HETATM 3324 O HOH 107 9.464 -17.005 4.957 1.00 45.99 O HETATM 3325 O HOH 108 36.424 -1.057 -11.639 1.00 37.94 O HETATM 3326 O HOH 109 24.126 -0.770 0.610 1.00 26.42 O HETATM 3327 O HOH 110 13.768 -16.834 -8.073 1.00 26.27 O HETATM 3328 O HOH 111 28.479 -19.027 0.605 1.00 40.44 O HETATM 3329 O HOH 112 11.376 -17.854 -12.033 1.00 39.55 O HETATM 3330 O HOH 113 16.907 -22.919 8.296 1.00 47.70 O HETATM 3331 O HOH 114 34.745 3.233 3.836 1.00 49.35 O HETATM 3332 O HOH 115 25.823 -1.670 2.361 1.00 37.98 O HETATM 3333 O HOH 116 9.893 -19.169 13.673 1.00 59.75 O HETATM 3334 O HOH 117 18.133 -3.525 5.040 1.00 52.44 O HETATM 3335 O HOH 118 24.445 -7.815 13.625 1.00 59.30 O HETATM 3336 O HOH 119 12.108 -16.497 -4.991 1.00 28.58 O HETATM 3337 O HOH 120 15.332 -9.117 -15.567 1.00 34.46 O HETATM 3338 O HOH 121 15.864 -3.311 3.829 1.00 52.70 O HETATM 3339 O HOH 122 25.749 -9.585 -25.575 1.00 38.81 O HETATM 3340 O HOH 123 17.631 -19.987 -13.050 1.00 37.00 O HETATM 3341 O HOH 124 36.029 -11.191 -6.565 1.00 45.87 O HETATM 3342 O HOH 125 17.376 -5.478 -22.432 1.00 56.31 O HETATM 3343 O HOH 126 13.686 -6.415 -4.383 1.00 37.19 O HETATM 3344 O HOH 127 11.755 -18.690 15.883 1.00 60.79 O HETATM 3345 O HOH 128 32.147 -13.452 1.513 1.00 40.50 O HETATM 3346 O HOH 129 9.286 -12.181 -6.137 1.00 48.07 O HETATM 3347 O HOH 130 34.816 -8.092 5.889 1.00 59.59 O HETATM 3348 O HOH 131 12.902 -10.418 -9.039 1.00 39.91 O HETATM 3349 O HOH 132 18.179 -21.583 -0.266 1.00 45.13 O HETATM 3350 O HOH 133 9.786 -14.798 -1.623 1.00 37.41 O HETATM 3351 O HOH 134 28.686 -23.499 -17.753 1.00 33.65 O HETATM 3352 O HOH 135 32.405 -6.103 -11.362 1.00 50.21 O HETATM 3353 O HOH 136 10.447 -10.696 -12.752 1.00 49.01 O HETATM 3354 C DIW A 137 20.678 -2.890 -8.681 1.00 0.05 C HETATM 3355 C3 DIW A 137 22.043 -2.725 -8.430 1.00 0.15 C HETATM 3356 C2 DIW A 137 22.936 -2.741 -9.487 1.00 0.03 C HETATM 3357 C9 DIW A 137 24.352 -2.542 -9.031 1.00 0.05 C HETATM 3358 C8 DIW A 137 24.067 -2.444 -7.568 1.00 0.13 C HETATM 3359 N7 DIW A 137 22.753 -2.544 -7.281 1.00 -0.26 N HETATM 3360 C29 DIW A 137 22.168 -2.466 -5.916 1.00 0.05 C HETATM 3361 H24 DIW A 137 21.076 -2.579 -5.978 1.00 0.06 H HETATM 3362 H25 DIW A 137 22.411 -1.491 -5.468 1.00 0.06 H HETATM 3363 H26 DIW A 137 22.585 -3.270 -5.292 1.00 0.06 H HETATM 3364 C10 DIW A 137 25.113 -2.226 -6.509 1.00 0.12 C HETATM 3365 C11 DIW A 137 26.402 -2.136 -6.842 1.00 0.10 C HETATM 3366 C12 DIW A 137 27.167 -1.926 -5.745 1.00 0.11 C HETATM 3367 C13 DIW A 137 28.658 -1.821 -5.662 1.00 0.06 C HETATM 3368 C14 DIW A 137 29.311 -1.727 -4.422 1.00 0.04 C HETATM 3369 C15 DIW A 137 30.710 -1.680 -4.355 1.00 0.05 C HETATM 3370 N16 DIW A 137 31.451 -1.722 -5.486 1.00 -0.35 N HETATM 3371 C17 DIW A 137 30.836 -1.853 -6.674 1.00 0.01 C HETATM 3372 C18 DIW A 137 29.450 -1.907 -6.796 1.00 0.00 C HETATM 3373 H7 DIW A 137 28.993 -2.016 -7.773 1.00 0.08 H HETATM 3374 H6 DIW A 137 31.442 -1.919 -7.571 1.00 0.09 H HETATM 3375 C23 DIW A 137 32.931 -1.720 -5.472 1.00 0.01 C HETATM 3376 C24 DIW A 137 33.648 -0.574 -4.768 1.00 -0.02 C HETATM 3377 C25 DIW A 137 34.790 -1.063 -3.862 1.00 0.03 C HETATM 3378 S26 DIW A 137 36.195 -1.481 -4.671 1.00 -0.19 S HETATM 3379 O30 DIW A 137 37.157 -2.032 -3.699 1.00 -0.48 O HETATM 3380 O31 DIW A 137 36.800 -0.298 -5.319 1.00 -0.48 O HETATM 3381 O32 DIW A 137 35.940 -2.508 -5.697 1.00 -0.48 O HETATM 3382 H16 DIW A 137 34.436 -1.947 -3.311 1.00 0.05 H HETATM 3383 H17 DIW A 137 35.031 -0.260 -3.150 1.00 0.05 H HETATM 3384 H14 DIW A 137 32.919 -0.027 -4.152 1.00 0.03 H HETATM 3385 H15 DIW A 137 34.066 0.101 -5.529 1.00 0.03 H HETATM 3386 H12 DIW A 137 33.266 -1.718 -6.520 1.00 0.04 H HETATM 3387 H13 DIW A 137 33.253 -2.653 -4.986 1.00 0.04 H HETATM 3388 C19 DIW A 137 31.330 -1.558 -3.112 1.00 -0.03 C HETATM 3389 C20 DIW A 137 30.588 -1.480 -1.936 1.00 -0.04 C HETATM 3390 C21 DIW A 137 29.199 -1.533 -2.001 1.00 -0.04 C HETATM 3391 C22 DIW A 137 28.571 -1.652 -3.242 1.00 -0.03 C HETATM 3392 H11 DIW A 137 27.489 -1.687 -3.289 1.00 0.07 H HETATM 3393 H10 DIW A 137 28.608 -1.482 -1.093 1.00 0.07 H HETATM 3394 H9 DIW A 137 31.088 -1.379 -0.979 1.00 0.07 H HETATM 3395 H8 DIW A 137 32.412 -1.523 -3.060 1.00 0.07 H HETATM 3396 H4 DIW A 137 26.909 -2.751 -5.065 1.00 0.12 H HETATM 3397 H5 DIW A 137 26.799 -0.977 -5.327 1.00 0.12 H HETATM 3398 H3 DIW A 137 26.786 -2.220 -7.857 1.00 0.20 H HETATM 3399 H2 DIW A 137 24.817 -2.141 -5.465 1.00 0.15 H HETATM 3400 C27 DIW A 137 25.308 -3.680 -9.384 1.00 -0.07 C HETATM 3401 H18 DIW A 137 25.474 -3.695 -10.471 1.00 0.01 H HETATM 3402 H19 DIW A 137 24.871 -4.638 -9.066 1.00 0.01 H HETATM 3403 H20 DIW A 137 26.267 -3.526 -8.869 1.00 0.01 H HETATM 3404 C28 DIW A 137 24.850 -1.173 -9.516 1.00 -0.07 C HETATM 3405 H21 DIW A 137 24.123 -0.397 -9.234 1.00 0.01 H HETATM 3406 H22 DIW A 137 24.962 -1.190 -10.610 1.00 0.01 H HETATM 3407 H23 DIW A 137 25.822 -0.951 -9.052 1.00 0.01 H HETATM 3408 C32 DIW A 137 22.464 -2.920 -10.799 1.00 0.01 C HETATM 3409 C31 DIW A 137 21.094 -3.084 -11.044 1.00 0.02 C HETATM 3410 C30 DIW A 137 20.193 -3.070 -9.980 1.00 0.03 C HETATM 3411 H27 DIW A 137 19.131 -3.197 -10.157 1.00 0.10 H HETATM 3412 H28 DIW A 137 20.736 -3.221 -12.058 1.00 0.11 H HETATM 3413 H29 DIW A 137 23.164 -2.931 -11.626 1.00 0.11 H HETATM 3414 H1 DIW A 137 19.981 -2.878 -7.851 1.00 0.12 H CONECT 1 2 7 CONECT 2 1 3 5 13 CONECT 3 2 4 14 CONECT 4 3 CONECT 5 2 6 11 12 CONECT 6 5 7 9 10 CONECT 7 1 6 8 CONECT 8 7 CONECT 9 6 CONECT 10 6 CONECT 11 5 CONECT 12 5 CONECT 13 2 CONECT 312 311 1296 CONECT 1296 312 1295 CONECT 1625 1626 1631 CONECT 1626 1625 1627 1629 1637 CONECT 1627 1626 1628 1638 CONECT 1628 1627 CONECT 1629 1626 1630 1635 1636 CONECT 1630 1629 1631 1633 1634 CONECT 1631 1625 1630 1632 CONECT 1632 1631 CONECT 1633 1630 CONECT 1634 1630 CONECT 1635 1629 CONECT 1636 1629 CONECT 1637 1626 CONECT 1936 1935 2920 CONECT 2920 1936 2919 CONECT 3354 3355 3410 3414 CONECT 3355 3354 3356 3359 CONECT 3356 3355 3357 3408 CONECT 3357 3356 3358 3400 3404 CONECT 3358 3357 3359 3364 CONECT 3359 3355 3358 3360 CONECT 3360 3359 3361 3362 3363 CONECT 3361 3360 CONECT 3362 3360 CONECT 3363 3360 CONECT 3364 3358 3365 3399 CONECT 3365 3364 3366 3398 CONECT 3366 3365 3367 3396 3397 CONECT 3367 3366 3368 3372 CONECT 3368 3367 3369 3391 CONECT 3369 3368 3370 3388 CONECT 3370 3369 3371 3375 CONECT 3371 3370 3372 3374 CONECT 3372 3367 3371 3373 CONECT 3373 3372 CONECT 3374 3371 CONECT 3375 3370 3376 3386 3387 CONECT 3376 3375 3377 3384 3385 CONECT 3377 3376 3378 3382 3383 CONECT 3378 3377 3379 3380 3381 CONECT 3379 3378 CONECT 3380 3378 CONECT 3381 3378 CONECT 3382 3377 CONECT 3383 3377 CONECT 3384 3376 CONECT 3385 3376 CONECT 3386 3375 CONECT 3387 3375 CONECT 3388 3369 3389 3395 CONECT 3389 3388 3390 3394 CONECT 3390 3389 3391 3393 CONECT 3391 3368 3390 3392 CONECT 3392 3391 CONECT 3393 3390 CONECT 3394 3389 CONECT 3395 3388 CONECT 3396 3366 CONECT 3397 3366 CONECT 3398 3365 CONECT 3399 3364 CONECT 3400 3357 3401 3402 3403 CONECT 3401 3400 CONECT 3402 3400 CONECT 3403 3400 CONECT 3404 3357 3405 3406 3407 CONECT 3405 3404 CONECT 3406 3404 CONECT 3407 3404 CONECT 3408 3356 3409 3413 CONECT 3409 3408 3410 3412 CONECT 3410 3354 3409 3411 CONECT 3411 3410 CONECT 3412 3409 CONECT 3413 3408 CONECT 3414 3354 MASTER 0 0 0 0 0 0 0 0 3412 2 91 18 END
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Structure:
Ligand 2D
Ligand 3D
Protein
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Related entries of code: 3t0x
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3t0w
RCSB PDB
PDBbind
123aa, >3T0W_1|Chains... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
3t0w
RCSB PDB
PDBbind
DIW
Entry Information
PDB ID
3t0x
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Immunoglobulin variable lambda domain M8VLA4(S55P)
Ligand Name
DIW
EC.Number
E.C.-.-.-.-
Resolution
1.96(Å)
Affinity (Kd/Ki/IC50)
Kd=10nM
Release Year
2012
Protein/NA Sequence
Check fasta file
Primary Reference
(2012) Biochemistry Vol. 51: pp. 2471-2485
Ligand Properties
Formula
C
2
6
H
3
2
N
2
O
3
S
Molecular Weight
452.609
Exact Mass
452.213
No. of atoms
64
No. of bonds
67
Polar Surface Area
102.23
LOGP Value
4.23 (
Computed with XLOGP3
)
5.50 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 4
Canonical SMILES
C[N]1=C(/C=C/Cc2cc[n+](c3c2cccc3)CCCS(O)(O)O)C(c2c1cccc2)(C)C
InChI String
InChI=1S/C26H31N2O3S/c1-26(2)22-12-5-7-14-24(22)27(3)25(26)15-8-10-20-16-18-28(17-9-19-32(29,30)31)23-13-6-4-11-21(20)23/h4-8,11-16,18H,9-10,17,19H2,1-3H3,(H2-,29,30,31)/p+1/b15-8+
Links to External Databases
RCSB PDB
The mother database
PDBsum
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Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
No matched UniProt accession number (AC) found!
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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