USER MOD reduce.3.24.130724 H: found=0, std=0, add=783, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 781 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 46 TYR OH : rot -140:sc= 1.02 USER MOD Set 1.2: A 71 LYS NZ :NH3+ -146:sc= 1.24 (180deg=-0.0206) USER MOD Single : A 4 LYS NZ :NH3+ -151:sc= 0.895 (180deg=-0.292) USER MOD Single : A 7 HIS : no HD1:sc= -0.322 X(o=-0.32,f=-0.12) USER MOD Single : A 9 HIS :FLIP no HD1:sc= -0.123 F(o=-0.71,f=-0.12) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 GLN :FLIP amide:sc= -0.0582 F(o=-1.1,f=-0.058) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 HIS : no HE2:sc= -3.66! C(o=-3.7!,f=-4.5!) USER MOD Single : A 20 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 21 LYS NZ :NH3+ -166:sc= -0.0517 (180deg=-0.265) USER MOD Single : A 24 GLN : amide:sc=-0.00591 K(o=-0.0059,f=-2.3!) USER MOD Single : A 29 THR OG1 : rot -120:sc= -0.329 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl 180:sc= -5.54! (180deg=-5.54!) USER MOD Single : A 42 ASN :FLIP amide:sc= 0 F(o=-1.5!,f=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 162:sc= -0.0386 (180deg=-0.241) USER MOD Single : A 54 MET CE :methyl 163:sc= -1.5 (180deg=-2.32!) USER MOD Single : A 55 TYR OH : rot 180:sc= -0.505 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= 0.918 K(o=0.92,f=-0.018) USER MOD Single : A 60 SER OG : rot 180:sc= 0.316 USER MOD Single : A 64 TYR OH : rot 57:sc= 1.02 USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= -1.68! C(o=-1.7!,f=-1.2!) USER MOD Single : A 77 LYS NZ :NH3+ -145:sc= -3.3! (180deg=-5.12!) USER MOD Single : A 82 LYS NZ :NH3+ 154:sc= -0.561 (180deg=-1.5) USER MOD Single : B 116 THR OG1 : rot 180:sc= 0 USER MOD Single : B 117 SER OG : rot -91:sc= 0.712 USER MOD Single : B 141 MET CE :methyl 164:sc= -0.0525 (180deg=-0.376) USER MOD Single : B 143 SER OG : rot 180:sc= 0 USER MOD Single : B 147 SER OG : rot 10:sc= 1.07 USER MOD ----------------------------------------------------------------- ATOM 50 N LYS A 4 -19.300 4.870 10.458 1.00 0.00 N ATOM 51 CA LYS A 4 -19.283 5.493 9.187 1.00 0.00 C ATOM 52 C LYS A 4 -19.953 4.590 8.183 1.00 0.00 C ATOM 53 O LYS A 4 -19.419 3.545 7.815 1.00 0.00 O ATOM 54 CB LYS A 4 -17.848 5.917 8.798 1.00 0.00 C ATOM 55 CG LYS A 4 -16.756 4.859 8.999 1.00 0.00 C ATOM 56 CD LYS A 4 -15.375 5.418 8.655 1.00 0.00 C ATOM 57 CE LYS A 4 -14.879 6.453 9.649 1.00 0.00 C ATOM 58 NZ LYS A 4 -13.660 7.115 9.165 1.00 0.00 N ATOM 0 HA LYS A 4 -19.855 6.421 9.211 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -17.850 6.214 7.749 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -17.582 6.800 9.379 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -16.765 4.515 10.033 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -16.966 3.992 8.373 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -14.660 4.597 8.609 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -15.410 5.866 7.662 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -15.656 7.198 9.821 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -14.679 5.974 10.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -13.083 7.416 9.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -13.114 6.452 8.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -13.919 7.946 8.596 1.00 0.00 H new ATOM 72 N GLY A 5 -21.147 4.998 7.779 1.00 0.00 N ATOM 73 CA GLY A 5 -22.035 4.211 6.930 1.00 0.00 C ATOM 74 C GLY A 5 -21.421 3.724 5.636 1.00 0.00 C ATOM 75 O GLY A 5 -21.834 2.684 5.104 1.00 0.00 O ATOM 0 H GLY A 5 -21.536 5.905 8.037 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -22.383 3.347 7.497 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -22.913 4.812 6.694 1.00 0.00 H new ATOM 79 N TRP A 6 -20.426 4.430 5.149 1.00 0.00 N ATOM 80 CA TRP A 6 -19.764 4.079 3.907 1.00 0.00 C ATOM 81 C TRP A 6 -18.983 2.762 3.980 1.00 0.00 C ATOM 82 O TRP A 6 -18.458 2.305 2.969 1.00 0.00 O ATOM 83 CB TRP A 6 -18.861 5.208 3.412 1.00 0.00 C ATOM 84 CG TRP A 6 -17.707 5.552 4.297 1.00 0.00 C ATOM 85 CD1 TRP A 6 -17.692 6.493 5.268 1.00 0.00 C ATOM 86 CD2 TRP A 6 -16.392 4.975 4.276 1.00 0.00 C ATOM 87 NE1 TRP A 6 -16.454 6.567 5.830 1.00 0.00 N ATOM 88 CE2 TRP A 6 -15.638 5.635 5.244 1.00 0.00 C ATOM 89 CE3 TRP A 6 -15.787 3.971 3.527 1.00 0.00 C ATOM 90 CZ2 TRP A 6 -14.304 5.325 5.483 1.00 0.00 C ATOM 91 CZ3 TRP A 6 -14.466 3.664 3.767 1.00 0.00 C ATOM 92 CH2 TRP A 6 -13.740 4.340 4.736 1.00 0.00 C ATOM 0 H TRP A 6 -20.051 5.264 5.600 1.00 0.00 H new ATOM 0 HA TRP A 6 -20.566 3.927 3.185 1.00 0.00 H new ATOM 0 HB2 TRP A 6 -18.473 4.934 2.431 1.00 0.00 H new ATOM 0 HB3 TRP A 6 -19.470 6.102 3.276 1.00 0.00 H new ATOM 0 HD1 TRP A 6 -18.539 7.098 5.556 1.00 0.00 H new ATOM 0 HE1 TRP A 6 -16.178 7.213 6.569 1.00 0.00 H new ATOM 0 HE3 TRP A 6 -16.344 3.441 2.769 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 -13.735 5.849 6.237 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 -13.988 2.885 3.192 1.00 0.00 H new ATOM 0 HH2 TRP A 6 -12.705 4.078 4.900 1.00 0.00 H new ATOM 103 N HIS A 7 -18.913 2.150 5.153 1.00 0.00 N ATOM 104 CA HIS A 7 -18.201 0.875 5.314 1.00 0.00 C ATOM 105 C HIS A 7 -18.878 -0.243 4.503 1.00 0.00 C ATOM 106 O HIS A 7 -18.254 -1.236 4.153 1.00 0.00 O ATOM 107 CB HIS A 7 -18.065 0.474 6.811 1.00 0.00 C ATOM 108 CG HIS A 7 -19.344 0.076 7.532 1.00 0.00 C ATOM 109 ND1 HIS A 7 -19.480 -1.093 8.244 1.00 0.00 N ATOM 110 CD2 HIS A 7 -20.523 0.729 7.677 1.00 0.00 C ATOM 111 CE1 HIS A 7 -20.698 -1.117 8.785 1.00 0.00 C ATOM 112 NE2 HIS A 7 -21.377 -0.027 8.471 1.00 0.00 N ATOM 0 H HIS A 7 -19.336 2.508 6.009 1.00 0.00 H new ATOM 0 HA HIS A 7 -17.193 1.015 4.922 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -17.364 -0.358 6.878 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -17.618 1.311 7.348 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -20.762 1.689 7.243 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -21.079 -1.920 9.398 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -22.328 0.210 8.753 1.00 0.00 H new ATOM 120 N GLU A 8 -20.140 -0.050 4.182 1.00 0.00 N ATOM 121 CA GLU A 8 -20.895 -1.013 3.388 1.00 0.00 C ATOM 122 C GLU A 8 -20.746 -0.701 1.913 1.00 0.00 C ATOM 123 O GLU A 8 -21.305 -1.373 1.050 1.00 0.00 O ATOM 124 CB GLU A 8 -22.355 -0.964 3.779 1.00 0.00 C ATOM 125 CG GLU A 8 -22.591 -1.288 5.230 1.00 0.00 C ATOM 126 CD GLU A 8 -22.182 -2.702 5.582 1.00 0.00 C ATOM 127 OE1 GLU A 8 -21.014 -2.940 5.898 1.00 0.00 O ATOM 128 OE2 GLU A 8 -23.032 -3.605 5.528 1.00 0.00 O ATOM 0 H GLU A 8 -20.675 0.773 4.460 1.00 0.00 H new ATOM 0 HA GLU A 8 -20.506 -2.013 3.578 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -22.748 0.030 3.567 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -22.914 -1.667 3.161 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -22.033 -0.587 5.851 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -23.647 -1.150 5.463 1.00 0.00 H new ATOM 135 N HIS A 9 -19.997 0.329 1.635 1.00 0.00 N ATOM 136 CA HIS A 9 -19.773 0.776 0.285 1.00 0.00 C ATOM 137 C HIS A 9 -18.362 0.409 -0.140 1.00 0.00 C ATOM 138 O HIS A 9 -17.891 0.802 -1.216 1.00 0.00 O ATOM 139 CB HIS A 9 -19.961 2.298 0.182 1.00 0.00 C ATOM 140 CG HIS A 9 -21.371 2.789 0.425 1.00 0.00 C ATOM 141 ND1 HIS A 9 -22.154 2.686 1.535 1.00 0.00 N flip ATOM 142 CD2 HIS A 9 -22.117 3.496 -0.491 1.00 0.00 C flip ATOM 143 CE1 HIS A 9 -23.366 3.320 1.304 1.00 0.00 C flip ATOM 144 NE2 HIS A 9 -23.294 3.790 0.073 1.00 0.00 N flip ATOM 0 H HIS A 9 -19.520 0.888 2.343 1.00 0.00 H new ATOM 0 HA HIS A 9 -20.496 0.290 -0.371 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -19.297 2.780 0.899 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -19.647 2.621 -0.810 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -21.807 3.766 -1.490 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -24.196 3.410 1.989 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -24.040 4.310 -0.389 1.00 0.00 H new ATOM 152 N VAL A 10 -17.700 -0.327 0.705 1.00 0.00 N ATOM 153 CA VAL A 10 -16.344 -0.743 0.493 1.00 0.00 C ATOM 154 C VAL A 10 -16.214 -2.222 0.864 1.00 0.00 C ATOM 155 O VAL A 10 -16.383 -2.621 2.023 1.00 0.00 O ATOM 156 CB VAL A 10 -15.362 0.184 1.291 1.00 0.00 C ATOM 157 CG1 VAL A 10 -15.670 0.261 2.769 1.00 0.00 C ATOM 158 CG2 VAL A 10 -13.907 -0.150 1.030 1.00 0.00 C ATOM 0 H VAL A 10 -18.098 -0.663 1.582 1.00 0.00 H new ATOM 0 HA VAL A 10 -16.070 -0.643 -0.557 1.00 0.00 H new ATOM 0 HB VAL A 10 -15.534 1.187 0.900 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -14.951 0.919 3.257 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -16.677 0.655 2.911 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -15.605 -0.735 3.207 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -13.271 0.521 1.607 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -13.711 -1.180 1.327 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -13.691 -0.031 -0.032 1.00 0.00 H new ATOM 168 N THR A 11 -16.004 -3.030 -0.129 1.00 0.00 N ATOM 169 CA THR A 11 -15.957 -4.454 0.051 1.00 0.00 C ATOM 170 C THR A 11 -14.583 -4.893 0.553 1.00 0.00 C ATOM 171 O THR A 11 -13.566 -4.230 0.274 1.00 0.00 O ATOM 172 CB THR A 11 -16.251 -5.146 -1.285 1.00 0.00 C ATOM 173 OG1 THR A 11 -17.374 -4.496 -1.892 1.00 0.00 O ATOM 174 CG2 THR A 11 -16.623 -6.591 -1.058 1.00 0.00 C ATOM 0 H THR A 11 -15.860 -2.723 -1.091 1.00 0.00 H new ATOM 0 HA THR A 11 -16.706 -4.734 0.792 1.00 0.00 H new ATOM 0 HB THR A 11 -15.365 -5.091 -1.917 1.00 0.00 H new ATOM 0 HG1 THR A 11 -17.576 -4.925 -2.750 1.00 0.00 H new ATOM 0 HG21 THR A 11 -16.829 -7.069 -2.016 1.00 0.00 H new ATOM 0 HG22 THR A 11 -15.798 -7.106 -0.566 1.00 0.00 H new ATOM 0 HG23 THR A 11 -17.511 -6.643 -0.428 1.00 0.00 H new ATOM 182 N GLN A 12 -14.555 -6.016 1.271 1.00 0.00 N ATOM 183 CA GLN A 12 -13.323 -6.596 1.787 1.00 0.00 C ATOM 184 C GLN A 12 -12.339 -6.851 0.647 1.00 0.00 C ATOM 185 O GLN A 12 -11.156 -6.615 0.788 1.00 0.00 O ATOM 186 CB GLN A 12 -13.612 -7.883 2.604 1.00 0.00 C ATOM 187 CG GLN A 12 -12.368 -8.564 3.192 1.00 0.00 C ATOM 188 CD GLN A 12 -11.982 -9.891 2.515 1.00 0.00 C ATOM 189 OE1 GLN A 12 -12.313 -10.067 1.256 1.00 0.00 O flip ATOM 190 NE2 GLN A 12 -11.404 -10.771 3.151 1.00 0.00 N flip ATOM 0 H GLN A 12 -15.392 -6.548 1.510 1.00 0.00 H new ATOM 0 HA GLN A 12 -12.861 -5.884 2.471 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -14.292 -7.635 3.419 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -14.130 -8.596 1.962 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -11.525 -7.876 3.120 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -12.539 -8.749 4.253 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -11.156 -10.615 4.128 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -11.173 -11.657 2.702 1.00 0.00 H new ATOM 199 N ASP A 13 -12.852 -7.280 -0.500 1.00 0.00 N ATOM 200 CA ASP A 13 -11.999 -7.504 -1.675 1.00 0.00 C ATOM 201 C ASP A 13 -11.345 -6.238 -2.179 1.00 0.00 C ATOM 202 O ASP A 13 -10.199 -6.264 -2.589 1.00 0.00 O ATOM 203 CB ASP A 13 -12.707 -8.228 -2.828 1.00 0.00 C ATOM 204 CG ASP A 13 -12.813 -9.717 -2.620 1.00 0.00 C ATOM 205 OD1 ASP A 13 -11.784 -10.409 -2.682 1.00 0.00 O ATOM 206 OD2 ASP A 13 -13.930 -10.226 -2.377 1.00 0.00 O ATOM 0 H ASP A 13 -13.841 -7.479 -0.647 1.00 0.00 H new ATOM 0 HA ASP A 13 -11.217 -8.169 -1.309 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -13.707 -7.813 -2.949 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -12.167 -8.035 -3.755 1.00 0.00 H new ATOM 211 N LEU A 14 -12.040 -5.113 -2.061 1.00 0.00 N ATOM 212 CA LEU A 14 -11.527 -3.854 -2.590 1.00 0.00 C ATOM 213 C LEU A 14 -10.374 -3.436 -1.729 1.00 0.00 C ATOM 214 O LEU A 14 -9.274 -3.216 -2.201 1.00 0.00 O ATOM 215 CB LEU A 14 -12.659 -2.772 -2.603 1.00 0.00 C ATOM 216 CG LEU A 14 -12.346 -1.327 -3.122 1.00 0.00 C ATOM 217 CD1 LEU A 14 -11.548 -0.525 -2.125 1.00 0.00 C ATOM 218 CD2 LEU A 14 -11.610 -1.353 -4.443 1.00 0.00 C ATOM 0 H LEU A 14 -12.952 -5.046 -1.608 1.00 0.00 H new ATOM 0 HA LEU A 14 -11.189 -3.972 -3.619 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -13.478 -3.164 -3.206 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -13.031 -2.678 -1.583 1.00 0.00 H new ATOM 0 HG LEU A 14 -13.313 -0.844 -3.263 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -11.355 0.469 -2.529 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -12.111 -0.437 -1.196 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -10.601 -1.027 -1.929 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -11.412 -0.332 -4.769 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -10.667 -1.886 -4.323 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -12.221 -1.860 -5.190 1.00 0.00 H new ATOM 230 N ARG A 15 -10.628 -3.403 -0.458 1.00 0.00 N ATOM 231 CA ARG A 15 -9.653 -2.968 0.492 1.00 0.00 C ATOM 232 C ARG A 15 -8.456 -3.879 0.560 1.00 0.00 C ATOM 233 O ARG A 15 -7.331 -3.412 0.553 1.00 0.00 O ATOM 234 CB ARG A 15 -10.284 -2.762 1.829 1.00 0.00 C ATOM 235 CG ARG A 15 -11.055 -3.904 2.381 1.00 0.00 C ATOM 236 CD ARG A 15 -11.913 -3.414 3.486 1.00 0.00 C ATOM 237 NE ARG A 15 -11.112 -2.671 4.482 1.00 0.00 N ATOM 238 CZ ARG A 15 -11.399 -2.505 5.765 1.00 0.00 C ATOM 239 NH1 ARG A 15 -12.603 -2.831 6.246 1.00 0.00 N ATOM 240 NH2 ARG A 15 -10.488 -1.942 6.550 1.00 0.00 N ATOM 0 H ARG A 15 -11.521 -3.678 -0.049 1.00 0.00 H new ATOM 0 HA ARG A 15 -9.267 -2.008 0.148 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -9.499 -2.505 2.540 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -10.949 -1.901 1.763 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -11.667 -4.358 1.601 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -10.377 -4.676 2.744 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -12.695 -2.768 3.086 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -12.410 -4.256 3.967 1.00 0.00 H new ATOM 0 HE ARG A 15 -10.249 -2.242 4.147 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -13.315 -3.213 5.623 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -12.810 -2.698 7.236 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -9.592 -1.648 6.162 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -10.685 -1.803 7.541 1.00 0.00 H new ATOM 254 N SER A 16 -8.696 -5.176 0.547 1.00 0.00 N ATOM 255 CA SER A 16 -7.636 -6.149 0.584 1.00 0.00 C ATOM 256 C SER A 16 -6.776 -6.035 -0.675 1.00 0.00 C ATOM 257 O SER A 16 -5.564 -6.257 -0.629 1.00 0.00 O ATOM 258 CB SER A 16 -8.227 -7.557 0.740 1.00 0.00 C ATOM 259 OG SER A 16 -7.231 -8.568 0.793 1.00 0.00 O ATOM 0 H SER A 16 -9.632 -5.579 0.510 1.00 0.00 H new ATOM 0 HA SER A 16 -6.993 -5.957 1.443 1.00 0.00 H new ATOM 0 HB2 SER A 16 -8.827 -7.596 1.649 1.00 0.00 H new ATOM 0 HB3 SER A 16 -8.899 -7.759 -0.094 1.00 0.00 H new ATOM 0 HG SER A 16 -7.659 -9.444 0.894 1.00 0.00 H new ATOM 265 N HIS A 17 -7.396 -5.640 -1.779 1.00 0.00 N ATOM 266 CA HIS A 17 -6.684 -5.467 -3.024 1.00 0.00 C ATOM 267 C HIS A 17 -5.752 -4.251 -2.923 1.00 0.00 C ATOM 268 O HIS A 17 -4.613 -4.270 -3.419 1.00 0.00 O ATOM 269 CB HIS A 17 -7.667 -5.278 -4.177 1.00 0.00 C ATOM 270 CG HIS A 17 -7.039 -5.472 -5.510 1.00 0.00 C ATOM 271 ND1 HIS A 17 -6.848 -6.700 -6.104 1.00 0.00 N ATOM 272 CD2 HIS A 17 -6.514 -4.571 -6.340 1.00 0.00 C ATOM 273 CE1 HIS A 17 -6.216 -6.508 -7.255 1.00 0.00 C ATOM 274 NE2 HIS A 17 -5.982 -5.223 -7.450 1.00 0.00 N ATOM 0 H HIS A 17 -8.394 -5.434 -1.831 1.00 0.00 H new ATOM 0 HA HIS A 17 -6.090 -6.360 -3.218 1.00 0.00 H new ATOM 0 HB2 HIS A 17 -8.492 -5.982 -4.064 1.00 0.00 H new ATOM 0 HB3 HIS A 17 -8.093 -4.276 -4.124 1.00 0.00 H new ATOM 0 HD1 HIS A 17 -7.141 -7.600 -5.725 1.00 0.00 H new ATOM 0 HD2 HIS A 17 -6.503 -3.503 -6.178 1.00 0.00 H new ATOM 0 HE1 HIS A 17 -5.932 -7.295 -7.938 1.00 0.00 H new ATOM 282 N LEU A 18 -6.248 -3.205 -2.291 1.00 0.00 N ATOM 283 CA LEU A 18 -5.474 -1.997 -2.052 1.00 0.00 C ATOM 284 C LEU A 18 -4.316 -2.298 -1.104 1.00 0.00 C ATOM 285 O LEU A 18 -3.202 -1.849 -1.322 1.00 0.00 O ATOM 286 CB LEU A 18 -6.382 -0.864 -1.522 1.00 0.00 C ATOM 287 CG LEU A 18 -7.188 -0.046 -2.573 1.00 0.00 C ATOM 288 CD1 LEU A 18 -7.840 -0.903 -3.627 1.00 0.00 C ATOM 289 CD2 LEU A 18 -8.265 0.729 -1.901 1.00 0.00 C ATOM 0 H LEU A 18 -7.200 -3.166 -1.927 1.00 0.00 H new ATOM 0 HA LEU A 18 -5.049 -1.650 -2.994 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -7.091 -1.301 -0.818 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -5.760 -0.169 -0.958 1.00 0.00 H new ATOM 0 HG LEU A 18 -6.462 0.605 -3.059 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -8.385 -0.268 -4.326 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -7.075 -1.463 -4.165 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -8.533 -1.599 -3.153 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -8.823 1.298 -2.645 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -8.940 0.044 -1.387 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -7.823 1.414 -1.177 1.00 0.00 H new ATOM 301 N VAL A 19 -4.599 -3.098 -0.080 1.00 0.00 N ATOM 302 CA VAL A 19 -3.588 -3.601 0.876 1.00 0.00 C ATOM 303 C VAL A 19 -2.487 -4.359 0.113 1.00 0.00 C ATOM 304 O VAL A 19 -1.293 -4.137 0.324 1.00 0.00 O ATOM 305 CB VAL A 19 -4.251 -4.595 1.888 1.00 0.00 C ATOM 306 CG1 VAL A 19 -3.247 -5.242 2.770 1.00 0.00 C ATOM 307 CG2 VAL A 19 -5.268 -3.917 2.742 1.00 0.00 C ATOM 0 H VAL A 19 -5.544 -3.425 0.121 1.00 0.00 H new ATOM 0 HA VAL A 19 -3.165 -2.751 1.411 1.00 0.00 H new ATOM 0 HB VAL A 19 -4.738 -5.358 1.281 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -3.751 -5.923 3.456 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -2.535 -5.800 2.162 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -2.718 -4.478 3.340 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -5.705 -4.640 3.431 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -4.792 -3.117 3.309 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -6.051 -3.497 2.111 1.00 0.00 H new ATOM 317 N HIS A 20 -2.924 -5.252 -0.746 1.00 0.00 N ATOM 318 CA HIS A 20 -2.065 -6.041 -1.612 1.00 0.00 C ATOM 319 C HIS A 20 -1.101 -5.135 -2.402 1.00 0.00 C ATOM 320 O HIS A 20 0.126 -5.321 -2.368 1.00 0.00 O ATOM 321 CB HIS A 20 -2.976 -6.865 -2.544 1.00 0.00 C ATOM 322 CG HIS A 20 -2.315 -7.527 -3.698 1.00 0.00 C ATOM 323 ND1 HIS A 20 -2.607 -7.217 -5.003 1.00 0.00 N ATOM 324 CD2 HIS A 20 -1.395 -8.512 -3.735 1.00 0.00 C ATOM 325 CE1 HIS A 20 -1.881 -7.995 -5.788 1.00 0.00 C ATOM 326 NE2 HIS A 20 -1.117 -8.816 -5.070 1.00 0.00 N ATOM 0 H HIS A 20 -3.915 -5.458 -0.868 1.00 0.00 H new ATOM 0 HA HIS A 20 -1.438 -6.713 -1.025 1.00 0.00 H new ATOM 0 HB2 HIS A 20 -3.471 -7.632 -1.948 1.00 0.00 H new ATOM 0 HB3 HIS A 20 -3.756 -6.208 -2.928 1.00 0.00 H new ATOM 0 HD2 HIS A 20 -0.947 -8.987 -2.875 1.00 0.00 H new ATOM 0 HE1 HIS A 20 -1.905 -7.968 -6.867 1.00 0.00 H new ATOM 0 HE2 HIS A 20 -0.466 -9.519 -5.421 1.00 0.00 H new ATOM 334 N LYS A 21 -1.663 -4.146 -3.066 1.00 0.00 N ATOM 335 CA LYS A 21 -0.884 -3.192 -3.829 1.00 0.00 C ATOM 336 C LYS A 21 0.031 -2.381 -2.945 1.00 0.00 C ATOM 337 O LYS A 21 1.199 -2.153 -3.302 1.00 0.00 O ATOM 338 CB LYS A 21 -1.788 -2.314 -4.673 1.00 0.00 C ATOM 339 CG LYS A 21 -2.276 -3.023 -5.908 1.00 0.00 C ATOM 340 CD LYS A 21 -3.363 -2.257 -6.618 1.00 0.00 C ATOM 341 CE LYS A 21 -3.806 -2.963 -7.898 1.00 0.00 C ATOM 342 NZ LYS A 21 -2.701 -3.180 -8.854 1.00 0.00 N ATOM 0 H LYS A 21 -2.669 -3.981 -3.092 1.00 0.00 H new ATOM 0 HA LYS A 21 -0.240 -3.751 -4.508 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -2.643 -1.996 -4.077 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -1.249 -1.412 -4.963 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -1.439 -3.178 -6.590 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -2.650 -4.009 -5.634 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -4.218 -2.138 -5.953 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -3.005 -1.256 -6.859 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -4.249 -3.925 -7.640 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -4.585 -2.372 -8.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -3.091 -3.439 -9.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -2.143 -2.307 -8.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -2.089 -3.947 -8.509 1.00 0.00 H new ATOM 356 N LEU A 22 -0.488 -1.974 -1.780 1.00 0.00 N ATOM 357 CA LEU A 22 0.286 -1.254 -0.780 1.00 0.00 C ATOM 358 C LEU A 22 1.565 -1.986 -0.498 1.00 0.00 C ATOM 359 O LEU A 22 2.630 -1.402 -0.616 1.00 0.00 O ATOM 360 CB LEU A 22 -0.513 -1.080 0.523 1.00 0.00 C ATOM 361 CG LEU A 22 -1.441 0.131 0.615 1.00 0.00 C ATOM 362 CD1 LEU A 22 -2.388 -0.021 1.794 1.00 0.00 C ATOM 363 CD2 LEU A 22 -0.613 1.353 0.851 1.00 0.00 C ATOM 0 H LEU A 22 -1.458 -2.138 -1.511 1.00 0.00 H new ATOM 0 HA LEU A 22 0.512 -0.264 -1.176 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -1.112 -1.978 0.674 1.00 0.00 H new ATOM 0 HB3 LEU A 22 0.196 -1.027 1.350 1.00 0.00 H new ATOM 0 HG LEU A 22 -2.011 0.210 -0.311 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -3.044 0.848 1.848 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -2.989 -0.921 1.664 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -1.812 -0.099 2.716 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -1.263 2.225 0.919 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -0.057 1.242 1.782 1.00 0.00 H new ATOM 0 HD23 LEU A 22 0.086 1.484 0.025 1.00 0.00 H new ATOM 375 N VAL A 23 1.449 -3.277 -0.194 1.00 0.00 N ATOM 376 CA VAL A 23 2.605 -4.129 0.064 1.00 0.00 C ATOM 377 C VAL A 23 3.566 -4.128 -1.108 1.00 0.00 C ATOM 378 O VAL A 23 4.722 -3.885 -0.916 1.00 0.00 O ATOM 379 CB VAL A 23 2.212 -5.597 0.362 1.00 0.00 C ATOM 380 CG1 VAL A 23 3.454 -6.465 0.424 1.00 0.00 C ATOM 381 CG2 VAL A 23 1.474 -5.691 1.661 1.00 0.00 C ATOM 0 H VAL A 23 0.553 -3.760 -0.120 1.00 0.00 H new ATOM 0 HA VAL A 23 3.085 -3.706 0.946 1.00 0.00 H new ATOM 0 HB VAL A 23 1.563 -5.947 -0.440 1.00 0.00 H new ATOM 0 HG11 VAL A 23 3.168 -7.496 0.634 1.00 0.00 H new ATOM 0 HG12 VAL A 23 3.977 -6.421 -0.532 1.00 0.00 H new ATOM 0 HG13 VAL A 23 4.112 -6.103 1.214 1.00 0.00 H new ATOM 0 HG21 VAL A 23 1.206 -6.730 1.853 1.00 0.00 H new ATOM 0 HG22 VAL A 23 2.109 -5.325 2.468 1.00 0.00 H new ATOM 0 HG23 VAL A 23 0.568 -5.087 1.610 1.00 0.00 H new ATOM 391 N GLN A 24 3.066 -4.376 -2.315 1.00 0.00 N ATOM 392 CA GLN A 24 3.938 -4.474 -3.507 1.00 0.00 C ATOM 393 C GLN A 24 4.824 -3.231 -3.672 1.00 0.00 C ATOM 394 O GLN A 24 5.978 -3.333 -4.095 1.00 0.00 O ATOM 395 CB GLN A 24 3.117 -4.698 -4.783 1.00 0.00 C ATOM 396 CG GLN A 24 2.274 -5.966 -4.789 1.00 0.00 C ATOM 397 CD GLN A 24 1.461 -6.106 -6.062 1.00 0.00 C ATOM 398 OE1 GLN A 24 0.339 -5.619 -6.146 1.00 0.00 O ATOM 399 NE2 GLN A 24 1.997 -6.795 -7.049 1.00 0.00 N ATOM 0 H GLN A 24 2.073 -4.513 -2.505 1.00 0.00 H new ATOM 0 HA GLN A 24 4.585 -5.337 -3.348 1.00 0.00 H new ATOM 0 HB2 GLN A 24 2.459 -3.841 -4.929 1.00 0.00 H new ATOM 0 HB3 GLN A 24 3.797 -4.727 -5.635 1.00 0.00 H new ATOM 0 HG2 GLN A 24 2.924 -6.834 -4.678 1.00 0.00 H new ATOM 0 HG3 GLN A 24 1.603 -5.959 -3.930 1.00 0.00 H new ATOM 0 HE21 GLN A 24 2.933 -7.187 -6.948 1.00 0.00 H new ATOM 0 HE22 GLN A 24 1.476 -6.936 -7.914 1.00 0.00 H new ATOM 408 N ALA A 25 4.270 -2.073 -3.363 1.00 0.00 N ATOM 409 CA ALA A 25 5.015 -0.838 -3.431 1.00 0.00 C ATOM 410 C ALA A 25 5.874 -0.589 -2.189 1.00 0.00 C ATOM 411 O ALA A 25 7.030 -0.249 -2.300 1.00 0.00 O ATOM 412 CB ALA A 25 4.060 0.273 -3.571 1.00 0.00 C ATOM 0 H ALA A 25 3.301 -1.966 -3.061 1.00 0.00 H new ATOM 0 HA ALA A 25 5.690 -0.908 -4.284 1.00 0.00 H new ATOM 0 HB1 ALA A 25 4.604 1.216 -3.624 1.00 0.00 H new ATOM 0 HB2 ALA A 25 3.477 0.139 -4.482 1.00 0.00 H new ATOM 0 HB3 ALA A 25 3.391 0.288 -2.711 1.00 0.00 H new ATOM 418 N ILE A 26 5.306 -0.770 -1.007 1.00 0.00 N ATOM 419 CA ILE A 26 6.020 -0.435 0.232 1.00 0.00 C ATOM 420 C ILE A 26 7.074 -1.496 0.533 1.00 0.00 C ATOM 421 O ILE A 26 8.046 -1.262 1.226 1.00 0.00 O ATOM 422 CB ILE A 26 5.015 -0.225 1.433 1.00 0.00 C ATOM 423 CG1 ILE A 26 5.669 0.441 2.679 1.00 0.00 C ATOM 424 CG2 ILE A 26 4.348 -1.532 1.820 1.00 0.00 C ATOM 425 CD1 ILE A 26 6.358 -0.510 3.654 1.00 0.00 C ATOM 0 H ILE A 26 4.366 -1.141 -0.871 1.00 0.00 H new ATOM 0 HA ILE A 26 6.538 0.514 0.095 1.00 0.00 H new ATOM 0 HB ILE A 26 4.258 0.470 1.071 1.00 0.00 H new ATOM 0 HG12 ILE A 26 6.401 1.172 2.335 1.00 0.00 H new ATOM 0 HG13 ILE A 26 4.899 0.991 3.220 1.00 0.00 H new ATOM 0 HG21 ILE A 26 3.662 -1.359 2.649 1.00 0.00 H new ATOM 0 HG22 ILE A 26 3.795 -1.925 0.967 1.00 0.00 H new ATOM 0 HG23 ILE A 26 5.108 -2.253 2.123 1.00 0.00 H new ATOM 0 HD11 ILE A 26 6.778 0.060 4.483 1.00 0.00 H new ATOM 0 HD12 ILE A 26 5.632 -1.227 4.037 1.00 0.00 H new ATOM 0 HD13 ILE A 26 7.157 -1.043 3.139 1.00 0.00 H new ATOM 437 N PHE A 27 6.873 -2.631 -0.012 1.00 0.00 N ATOM 438 CA PHE A 27 7.758 -3.720 0.101 1.00 0.00 C ATOM 439 C PHE A 27 8.020 -4.275 -1.281 1.00 0.00 C ATOM 440 O PHE A 27 7.309 -5.180 -1.725 1.00 0.00 O ATOM 441 CB PHE A 27 7.161 -4.800 1.011 1.00 0.00 C ATOM 442 CG PHE A 27 7.153 -4.460 2.477 1.00 0.00 C ATOM 443 CD1 PHE A 27 8.335 -4.423 3.200 1.00 0.00 C ATOM 444 CD2 PHE A 27 5.966 -4.202 3.139 1.00 0.00 C ATOM 445 CE1 PHE A 27 8.331 -4.131 4.552 1.00 0.00 C ATOM 446 CE2 PHE A 27 5.956 -3.906 4.490 1.00 0.00 C ATOM 447 CZ PHE A 27 7.140 -3.872 5.196 1.00 0.00 C ATOM 0 H PHE A 27 6.048 -2.836 -0.576 1.00 0.00 H new ATOM 0 HA PHE A 27 8.696 -3.389 0.546 1.00 0.00 H new ATOM 0 HB2 PHE A 27 6.137 -4.997 0.693 1.00 0.00 H new ATOM 0 HB3 PHE A 27 7.722 -5.724 0.870 1.00 0.00 H new ATOM 0 HD1 PHE A 27 9.271 -4.625 2.701 1.00 0.00 H new ATOM 0 HD2 PHE A 27 5.034 -4.232 2.593 1.00 0.00 H new ATOM 0 HE1 PHE A 27 9.260 -4.106 5.102 1.00 0.00 H new ATOM 0 HE2 PHE A 27 5.022 -3.702 4.992 1.00 0.00 H new ATOM 0 HZ PHE A 27 7.134 -3.643 6.251 1.00 0.00 H new ATOM 457 N PRO A 28 8.984 -3.680 -2.031 1.00 0.00 N ATOM 458 CA PRO A 28 9.322 -4.154 -3.361 1.00 0.00 C ATOM 459 C PRO A 28 9.778 -5.601 -3.293 1.00 0.00 C ATOM 460 O PRO A 28 10.857 -5.916 -2.764 1.00 0.00 O ATOM 461 CB PRO A 28 10.454 -3.223 -3.826 1.00 0.00 C ATOM 462 CG PRO A 28 10.960 -2.583 -2.581 1.00 0.00 C ATOM 463 CD PRO A 28 9.789 -2.507 -1.648 1.00 0.00 C ATOM 0 HA PRO A 28 8.479 -4.132 -4.052 1.00 0.00 H new ATOM 0 HB2 PRO A 28 11.242 -3.781 -4.332 1.00 0.00 H new ATOM 0 HB3 PRO A 28 10.088 -2.478 -4.532 1.00 0.00 H new ATOM 0 HG2 PRO A 28 11.770 -3.167 -2.144 1.00 0.00 H new ATOM 0 HG3 PRO A 28 11.359 -1.590 -2.788 1.00 0.00 H new ATOM 0 HD2 PRO A 28 10.101 -2.554 -0.605 1.00 0.00 H new ATOM 0 HD3 PRO A 28 9.233 -1.578 -1.773 1.00 0.00 H new ATOM 471 N THR A 29 8.930 -6.456 -3.756 1.00 0.00 N ATOM 472 CA THR A 29 9.125 -7.861 -3.680 1.00 0.00 C ATOM 473 C THR A 29 9.992 -8.365 -4.854 1.00 0.00 C ATOM 474 O THR A 29 10.001 -7.760 -5.940 1.00 0.00 O ATOM 475 CB THR A 29 7.740 -8.571 -3.659 1.00 0.00 C ATOM 476 OG1 THR A 29 7.886 -9.969 -3.412 1.00 0.00 O ATOM 477 CG2 THR A 29 6.984 -8.350 -4.968 1.00 0.00 C ATOM 0 H THR A 29 8.057 -6.187 -4.211 1.00 0.00 H new ATOM 0 HA THR A 29 9.660 -8.098 -2.760 1.00 0.00 H new ATOM 0 HB THR A 29 7.161 -8.130 -2.847 1.00 0.00 H new ATOM 0 HG1 THR A 29 7.517 -10.475 -4.166 1.00 0.00 H new ATOM 0 HG21 THR A 29 6.021 -8.858 -4.922 1.00 0.00 H new ATOM 0 HG22 THR A 29 6.824 -7.283 -5.120 1.00 0.00 H new ATOM 0 HG23 THR A 29 7.567 -8.751 -5.797 1.00 0.00 H new ATOM 485 N PRO A 30 10.780 -9.439 -4.637 1.00 0.00 N ATOM 486 CA PRO A 30 11.566 -10.060 -5.699 1.00 0.00 C ATOM 487 C PRO A 30 10.672 -10.837 -6.678 1.00 0.00 C ATOM 488 O PRO A 30 10.992 -10.965 -7.872 1.00 0.00 O ATOM 489 CB PRO A 30 12.486 -11.027 -4.937 1.00 0.00 C ATOM 490 CG PRO A 30 11.740 -11.349 -3.690 1.00 0.00 C ATOM 491 CD PRO A 30 11.012 -10.093 -3.324 1.00 0.00 C ATOM 0 HA PRO A 30 12.103 -9.329 -6.303 1.00 0.00 H new ATOM 0 HB2 PRO A 30 12.689 -11.925 -5.521 1.00 0.00 H new ATOM 0 HB3 PRO A 30 13.449 -10.567 -4.716 1.00 0.00 H new ATOM 0 HG2 PRO A 30 11.045 -12.173 -3.850 1.00 0.00 H new ATOM 0 HG3 PRO A 30 12.419 -11.655 -2.894 1.00 0.00 H new ATOM 0 HD2 PRO A 30 10.075 -10.306 -2.809 1.00 0.00 H new ATOM 0 HD3 PRO A 30 11.604 -9.464 -2.660 1.00 0.00 H new ATOM 499 N ASP A 31 9.547 -11.332 -6.176 1.00 0.00 N ATOM 500 CA ASP A 31 8.632 -12.132 -6.971 1.00 0.00 C ATOM 501 C ASP A 31 7.222 -12.057 -6.389 1.00 0.00 C ATOM 502 O ASP A 31 7.059 -11.705 -5.218 1.00 0.00 O ATOM 503 CB ASP A 31 9.091 -13.592 -7.028 1.00 0.00 C ATOM 504 CG ASP A 31 8.928 -14.353 -5.733 1.00 0.00 C ATOM 505 OD1 ASP A 31 9.861 -14.386 -4.912 1.00 0.00 O ATOM 506 OD2 ASP A 31 7.879 -14.973 -5.550 1.00 0.00 O ATOM 0 H ASP A 31 9.247 -11.190 -5.212 1.00 0.00 H new ATOM 0 HA ASP A 31 8.625 -11.730 -7.984 1.00 0.00 H new ATOM 0 HB2 ASP A 31 8.530 -14.105 -7.809 1.00 0.00 H new ATOM 0 HB3 ASP A 31 10.141 -13.618 -7.320 1.00 0.00 H new ATOM 511 N PRO A 32 6.173 -12.398 -7.174 1.00 0.00 N ATOM 512 CA PRO A 32 4.805 -12.301 -6.709 1.00 0.00 C ATOM 513 C PRO A 32 4.356 -13.453 -5.793 1.00 0.00 C ATOM 514 O PRO A 32 3.243 -13.439 -5.278 1.00 0.00 O ATOM 515 CB PRO A 32 3.976 -12.248 -7.987 1.00 0.00 C ATOM 516 CG PRO A 32 4.794 -12.943 -9.020 1.00 0.00 C ATOM 517 CD PRO A 32 6.238 -12.863 -8.582 1.00 0.00 C ATOM 0 HA PRO A 32 4.682 -11.423 -6.075 1.00 0.00 H new ATOM 0 HB2 PRO A 32 3.013 -12.741 -7.851 1.00 0.00 H new ATOM 0 HB3 PRO A 32 3.768 -11.218 -8.278 1.00 0.00 H new ATOM 0 HG2 PRO A 32 4.481 -13.982 -9.122 1.00 0.00 H new ATOM 0 HG3 PRO A 32 4.662 -12.473 -9.994 1.00 0.00 H new ATOM 0 HD2 PRO A 32 6.730 -13.833 -8.658 1.00 0.00 H new ATOM 0 HD3 PRO A 32 6.804 -12.169 -9.204 1.00 0.00 H new ATOM 525 N ALA A 33 5.206 -14.431 -5.579 1.00 0.00 N ATOM 526 CA ALA A 33 4.873 -15.527 -4.690 1.00 0.00 C ATOM 527 C ALA A 33 5.457 -15.271 -3.316 1.00 0.00 C ATOM 528 O ALA A 33 5.039 -15.857 -2.332 1.00 0.00 O ATOM 529 CB ALA A 33 5.311 -16.864 -5.248 1.00 0.00 C ATOM 0 H ALA A 33 6.131 -14.493 -6.005 1.00 0.00 H new ATOM 0 HA ALA A 33 3.788 -15.577 -4.600 1.00 0.00 H new ATOM 0 HB1 ALA A 33 5.041 -17.656 -4.549 1.00 0.00 H new ATOM 0 HB2 ALA A 33 4.816 -17.039 -6.203 1.00 0.00 H new ATOM 0 HB3 ALA A 33 6.391 -16.861 -5.394 1.00 0.00 H new ATOM 535 N ALA A 34 6.411 -14.352 -3.246 1.00 0.00 N ATOM 536 CA ALA A 34 6.958 -13.902 -1.962 1.00 0.00 C ATOM 537 C ALA A 34 5.868 -13.172 -1.193 1.00 0.00 C ATOM 538 O ALA A 34 5.904 -13.029 0.032 1.00 0.00 O ATOM 539 CB ALA A 34 8.161 -13.000 -2.180 1.00 0.00 C ATOM 0 H ALA A 34 6.826 -13.900 -4.061 1.00 0.00 H new ATOM 0 HA ALA A 34 7.293 -14.764 -1.385 1.00 0.00 H new ATOM 0 HB1 ALA A 34 8.553 -12.676 -1.216 1.00 0.00 H new ATOM 0 HB2 ALA A 34 8.933 -13.548 -2.720 1.00 0.00 H new ATOM 0 HB3 ALA A 34 7.861 -12.128 -2.761 1.00 0.00 H new ATOM 545 N LEU A 35 4.857 -12.802 -1.944 1.00 0.00 N ATOM 546 CA LEU A 35 3.697 -12.102 -1.483 1.00 0.00 C ATOM 547 C LEU A 35 2.697 -13.061 -0.839 1.00 0.00 C ATOM 548 O LEU A 35 1.575 -12.676 -0.521 1.00 0.00 O ATOM 549 CB LEU A 35 3.056 -11.405 -2.665 1.00 0.00 C ATOM 550 CG LEU A 35 3.980 -10.472 -3.430 1.00 0.00 C ATOM 551 CD1 LEU A 35 3.320 -9.990 -4.683 1.00 0.00 C ATOM 552 CD2 LEU A 35 4.395 -9.302 -2.566 1.00 0.00 C ATOM 0 H LEU A 35 4.827 -12.995 -2.945 1.00 0.00 H new ATOM 0 HA LEU A 35 3.993 -11.374 -0.728 1.00 0.00 H new ATOM 0 HB2 LEU A 35 2.675 -12.161 -3.352 1.00 0.00 H new ATOM 0 HB3 LEU A 35 2.198 -10.834 -2.311 1.00 0.00 H new ATOM 0 HG LEU A 35 4.876 -11.029 -3.704 1.00 0.00 H new ATOM 0 HD11 LEU A 35 3.997 -9.323 -5.217 1.00 0.00 H new ATOM 0 HD12 LEU A 35 3.075 -10.843 -5.317 1.00 0.00 H new ATOM 0 HD13 LEU A 35 2.406 -9.452 -4.429 1.00 0.00 H new ATOM 0 HD21 LEU A 35 5.056 -8.647 -3.134 1.00 0.00 H new ATOM 0 HD22 LEU A 35 3.510 -8.745 -2.258 1.00 0.00 H new ATOM 0 HD23 LEU A 35 4.918 -9.669 -1.683 1.00 0.00 H new ATOM 564 N LYS A 36 3.078 -14.310 -0.705 1.00 0.00 N ATOM 565 CA LYS A 36 2.268 -15.269 0.005 1.00 0.00 C ATOM 566 C LYS A 36 3.126 -16.092 0.975 1.00 0.00 C ATOM 567 O LYS A 36 2.641 -17.029 1.623 1.00 0.00 O ATOM 568 CB LYS A 36 1.467 -16.132 -0.980 1.00 0.00 C ATOM 569 CG LYS A 36 2.304 -16.917 -1.961 1.00 0.00 C ATOM 570 CD LYS A 36 1.466 -17.519 -3.070 1.00 0.00 C ATOM 571 CE LYS A 36 0.865 -16.446 -3.972 1.00 0.00 C ATOM 572 NZ LYS A 36 0.011 -17.032 -5.014 1.00 0.00 N ATOM 0 H LYS A 36 3.949 -14.686 -1.081 1.00 0.00 H new ATOM 0 HA LYS A 36 1.537 -14.740 0.617 1.00 0.00 H new ATOM 0 HB2 LYS A 36 0.850 -16.828 -0.412 1.00 0.00 H new ATOM 0 HB3 LYS A 36 0.789 -15.487 -1.538 1.00 0.00 H new ATOM 0 HG2 LYS A 36 3.062 -16.264 -2.394 1.00 0.00 H new ATOM 0 HG3 LYS A 36 2.831 -17.712 -1.433 1.00 0.00 H new ATOM 0 HD2 LYS A 36 2.082 -18.192 -3.666 1.00 0.00 H new ATOM 0 HD3 LYS A 36 0.666 -18.119 -2.636 1.00 0.00 H new ATOM 0 HE2 LYS A 36 0.280 -15.750 -3.371 1.00 0.00 H new ATOM 0 HE3 LYS A 36 1.665 -15.871 -4.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -0.381 -16.274 -5.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 0.575 -17.677 -5.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -0.767 -17.560 -4.569 1.00 0.00 H new ATOM 586 N ASP A 37 4.399 -15.714 1.096 1.00 0.00 N ATOM 587 CA ASP A 37 5.323 -16.400 2.007 1.00 0.00 C ATOM 588 C ASP A 37 5.195 -15.818 3.406 1.00 0.00 C ATOM 589 O ASP A 37 4.440 -14.889 3.616 1.00 0.00 O ATOM 590 CB ASP A 37 6.800 -16.283 1.560 1.00 0.00 C ATOM 591 CG ASP A 37 7.142 -17.024 0.280 1.00 0.00 C ATOM 592 OD1 ASP A 37 6.781 -18.210 0.148 1.00 0.00 O ATOM 593 OD2 ASP A 37 7.832 -16.454 -0.584 1.00 0.00 O ATOM 0 H ASP A 37 4.815 -14.940 0.578 1.00 0.00 H new ATOM 0 HA ASP A 37 5.049 -17.455 1.995 1.00 0.00 H new ATOM 0 HB2 ASP A 37 7.042 -15.228 1.428 1.00 0.00 H new ATOM 0 HB3 ASP A 37 7.437 -16.658 2.361 1.00 0.00 H new ATOM 598 N ARG A 38 5.966 -16.342 4.346 1.00 0.00 N ATOM 599 CA ARG A 38 5.972 -15.868 5.755 1.00 0.00 C ATOM 600 C ARG A 38 6.347 -14.388 5.856 1.00 0.00 C ATOM 601 O ARG A 38 5.967 -13.709 6.794 1.00 0.00 O ATOM 602 CB ARG A 38 6.915 -16.730 6.646 1.00 0.00 C ATOM 603 CG ARG A 38 8.437 -16.559 6.427 1.00 0.00 C ATOM 604 CD ARG A 38 8.910 -16.951 5.028 1.00 0.00 C ATOM 605 NE ARG A 38 8.587 -18.341 4.694 1.00 0.00 N ATOM 606 CZ ARG A 38 8.886 -18.956 3.537 1.00 0.00 C ATOM 607 NH1 ARG A 38 9.591 -18.330 2.592 1.00 0.00 N ATOM 608 NH2 ARG A 38 8.501 -20.210 3.345 1.00 0.00 N ATOM 0 H ARG A 38 6.613 -17.111 4.171 1.00 0.00 H new ATOM 0 HA ARG A 38 4.954 -15.982 6.128 1.00 0.00 H new ATOM 0 HB2 ARG A 38 6.695 -16.504 7.689 1.00 0.00 H new ATOM 0 HB3 ARG A 38 6.666 -17.779 6.488 1.00 0.00 H new ATOM 0 HG2 ARG A 38 8.706 -15.519 6.613 1.00 0.00 H new ATOM 0 HG3 ARG A 38 8.970 -17.162 7.162 1.00 0.00 H new ATOM 0 HD2 ARG A 38 8.451 -16.289 4.294 1.00 0.00 H new ATOM 0 HD3 ARG A 38 9.988 -16.805 4.959 1.00 0.00 H new ATOM 0 HE ARG A 38 8.093 -18.888 5.399 1.00 0.00 H new ATOM 0 HH11 ARG A 38 9.910 -17.373 2.743 1.00 0.00 H new ATOM 0 HH12 ARG A 38 9.811 -18.809 1.719 1.00 0.00 H new ATOM 0 HH21 ARG A 38 7.982 -20.701 4.073 1.00 0.00 H new ATOM 0 HH22 ARG A 38 8.724 -20.684 2.470 1.00 0.00 H new ATOM 622 N ARG A 39 7.071 -13.894 4.868 1.00 0.00 N ATOM 623 CA ARG A 39 7.461 -12.491 4.821 1.00 0.00 C ATOM 624 C ARG A 39 6.200 -11.628 4.663 1.00 0.00 C ATOM 625 O ARG A 39 6.066 -10.550 5.271 1.00 0.00 O ATOM 626 CB ARG A 39 8.414 -12.265 3.638 1.00 0.00 C ATOM 627 CG ARG A 39 8.885 -10.827 3.463 1.00 0.00 C ATOM 628 CD ARG A 39 9.841 -10.393 4.560 1.00 0.00 C ATOM 629 NE ARG A 39 11.145 -11.062 4.458 1.00 0.00 N ATOM 630 CZ ARG A 39 12.036 -11.156 5.450 1.00 0.00 C ATOM 631 NH1 ARG A 39 11.714 -10.772 6.676 1.00 0.00 N ATOM 632 NH2 ARG A 39 13.241 -11.667 5.217 1.00 0.00 N ATOM 0 H ARG A 39 7.405 -14.447 4.079 1.00 0.00 H new ATOM 0 HA ARG A 39 7.974 -12.213 5.742 1.00 0.00 H new ATOM 0 HB2 ARG A 39 9.287 -12.905 3.765 1.00 0.00 H new ATOM 0 HB3 ARG A 39 7.916 -12.583 2.722 1.00 0.00 H new ATOM 0 HG2 ARG A 39 9.376 -10.724 2.495 1.00 0.00 H new ATOM 0 HG3 ARG A 39 8.021 -10.163 3.455 1.00 0.00 H new ATOM 0 HD2 ARG A 39 9.984 -9.314 4.509 1.00 0.00 H new ATOM 0 HD3 ARG A 39 9.398 -10.610 5.532 1.00 0.00 H new ATOM 0 HE ARG A 39 11.389 -11.487 3.563 1.00 0.00 H new ATOM 0 HH11 ARG A 39 10.783 -10.403 6.867 1.00 0.00 H new ATOM 0 HH12 ARG A 39 12.397 -10.846 7.430 1.00 0.00 H new ATOM 0 HH21 ARG A 39 13.487 -11.988 4.280 1.00 0.00 H new ATOM 0 HH22 ARG A 39 13.920 -11.738 5.975 1.00 0.00 H new ATOM 646 N MET A 40 5.253 -12.164 3.907 1.00 0.00 N ATOM 647 CA MET A 40 4.017 -11.500 3.589 1.00 0.00 C ATOM 648 C MET A 40 3.218 -11.155 4.805 1.00 0.00 C ATOM 649 O MET A 40 2.649 -10.109 4.840 1.00 0.00 O ATOM 650 CB MET A 40 3.204 -12.313 2.571 1.00 0.00 C ATOM 651 CG MET A 40 1.710 -11.972 2.443 1.00 0.00 C ATOM 652 SD MET A 40 1.321 -10.224 2.135 1.00 0.00 S ATOM 653 CE MET A 40 2.353 -9.815 0.761 1.00 0.00 C ATOM 0 H MET A 40 5.333 -13.093 3.493 1.00 0.00 H new ATOM 0 HA MET A 40 4.273 -10.548 3.124 1.00 0.00 H new ATOM 0 HB2 MET A 40 3.666 -12.189 1.591 1.00 0.00 H new ATOM 0 HB3 MET A 40 3.290 -13.368 2.833 1.00 0.00 H new ATOM 0 HG2 MET A 40 1.289 -12.567 1.632 1.00 0.00 H new ATOM 0 HG3 MET A 40 1.206 -12.281 3.359 1.00 0.00 H new ATOM 0 HE1 MET A 40 2.198 -8.771 0.488 1.00 0.00 H new ATOM 0 HE2 MET A 40 3.398 -9.968 1.032 1.00 0.00 H new ATOM 0 HE3 MET A 40 2.101 -10.453 -0.086 1.00 0.00 H new ATOM 663 N GLU A 41 3.244 -11.985 5.838 1.00 0.00 N ATOM 664 CA GLU A 41 2.419 -11.700 7.014 1.00 0.00 C ATOM 665 C GLU A 41 2.825 -10.352 7.644 1.00 0.00 C ATOM 666 O GLU A 41 1.989 -9.620 8.137 1.00 0.00 O ATOM 667 CB GLU A 41 2.478 -12.826 8.047 1.00 0.00 C ATOM 668 CG GLU A 41 3.759 -12.882 8.839 1.00 0.00 C ATOM 669 CD GLU A 41 3.819 -14.065 9.752 1.00 0.00 C ATOM 670 OE1 GLU A 41 2.991 -14.152 10.679 1.00 0.00 O ATOM 671 OE2 GLU A 41 4.675 -14.940 9.562 1.00 0.00 O ATOM 0 H GLU A 41 3.805 -12.835 5.893 1.00 0.00 H new ATOM 0 HA GLU A 41 1.384 -11.632 6.678 1.00 0.00 H new ATOM 0 HB2 GLU A 41 1.643 -12.712 8.738 1.00 0.00 H new ATOM 0 HB3 GLU A 41 2.340 -13.779 7.536 1.00 0.00 H new ATOM 0 HG2 GLU A 41 4.605 -12.914 8.153 1.00 0.00 H new ATOM 0 HG3 GLU A 41 3.859 -11.969 9.426 1.00 0.00 H new ATOM 678 N ASN A 42 4.110 -10.019 7.558 1.00 0.00 N ATOM 679 CA ASN A 42 4.624 -8.757 8.081 1.00 0.00 C ATOM 680 C ASN A 42 4.310 -7.634 7.127 1.00 0.00 C ATOM 681 O ASN A 42 3.858 -6.556 7.533 1.00 0.00 O ATOM 682 CB ASN A 42 6.141 -8.832 8.329 1.00 0.00 C ATOM 683 CG ASN A 42 6.769 -7.460 8.590 1.00 0.00 C ATOM 684 OD1 ASN A 42 7.327 -6.854 7.555 1.00 0.00 O flip ATOM 685 ND2 ASN A 42 6.790 -6.975 9.716 1.00 0.00 N flip ATOM 0 H ASN A 42 4.820 -10.612 7.127 1.00 0.00 H new ATOM 0 HA ASN A 42 4.135 -8.564 9.036 1.00 0.00 H new ATOM 0 HB2 ASN A 42 6.333 -9.483 9.182 1.00 0.00 H new ATOM 0 HB3 ASN A 42 6.624 -9.289 7.465 1.00 0.00 H new ATOM 0 HD21 ASN A 42 6.350 -7.469 10.492 1.00 0.00 H new ATOM 0 HD22 ASN A 42 7.248 -6.078 9.876 1.00 0.00 H new ATOM 692 N LEU A 43 4.524 -7.907 5.853 1.00 0.00 N ATOM 693 CA LEU A 43 4.304 -6.924 4.804 1.00 0.00 C ATOM 694 C LEU A 43 2.837 -6.498 4.801 1.00 0.00 C ATOM 695 O LEU A 43 2.503 -5.298 4.868 1.00 0.00 O ATOM 696 CB LEU A 43 4.659 -7.515 3.436 1.00 0.00 C ATOM 697 CG LEU A 43 5.966 -8.315 3.302 1.00 0.00 C ATOM 698 CD1 LEU A 43 6.215 -8.703 1.852 1.00 0.00 C ATOM 699 CD2 LEU A 43 7.157 -7.573 3.877 1.00 0.00 C ATOM 0 H LEU A 43 4.854 -8.811 5.516 1.00 0.00 H new ATOM 0 HA LEU A 43 4.941 -6.060 4.996 1.00 0.00 H new ATOM 0 HB2 LEU A 43 3.839 -8.166 3.132 1.00 0.00 H new ATOM 0 HB3 LEU A 43 4.697 -6.694 2.720 1.00 0.00 H new ATOM 0 HG LEU A 43 5.846 -9.225 3.889 1.00 0.00 H new ATOM 0 HD11 LEU A 43 7.144 -9.268 1.781 1.00 0.00 H new ATOM 0 HD12 LEU A 43 5.389 -9.317 1.493 1.00 0.00 H new ATOM 0 HD13 LEU A 43 6.290 -7.803 1.242 1.00 0.00 H new ATOM 0 HD21 LEU A 43 8.055 -8.179 3.758 1.00 0.00 H new ATOM 0 HD22 LEU A 43 7.285 -6.627 3.351 1.00 0.00 H new ATOM 0 HD23 LEU A 43 6.988 -7.379 4.936 1.00 0.00 H new ATOM 711 N VAL A 44 1.973 -7.488 4.778 1.00 0.00 N ATOM 712 CA VAL A 44 0.561 -7.282 4.751 1.00 0.00 C ATOM 713 C VAL A 44 0.096 -6.708 6.069 1.00 0.00 C ATOM 714 O VAL A 44 -0.804 -5.914 6.084 1.00 0.00 O ATOM 715 CB VAL A 44 -0.212 -8.582 4.397 1.00 0.00 C ATOM 716 CG1 VAL A 44 -0.325 -9.570 5.549 1.00 0.00 C ATOM 717 CG2 VAL A 44 -1.544 -8.286 3.744 1.00 0.00 C ATOM 0 H VAL A 44 2.246 -8.471 4.778 1.00 0.00 H new ATOM 0 HA VAL A 44 0.342 -6.565 3.960 1.00 0.00 H new ATOM 0 HB VAL A 44 0.400 -9.096 3.656 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -0.878 -10.450 5.221 1.00 0.00 H new ATOM 0 HG12 VAL A 44 0.673 -9.868 5.872 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -0.851 -9.101 6.381 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -2.052 -9.222 3.513 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.160 -7.697 4.424 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -1.381 -7.725 2.824 1.00 0.00 H new ATOM 727 N ALA A 45 0.753 -7.086 7.176 1.00 0.00 N ATOM 728 CA ALA A 45 0.407 -6.540 8.493 1.00 0.00 C ATOM 729 C ALA A 45 0.512 -5.009 8.486 1.00 0.00 C ATOM 730 O ALA A 45 -0.398 -4.308 8.957 1.00 0.00 O ATOM 731 CB ALA A 45 1.290 -7.131 9.579 1.00 0.00 C ATOM 0 H ALA A 45 1.518 -7.760 7.185 1.00 0.00 H new ATOM 0 HA ALA A 45 -0.625 -6.816 8.711 1.00 0.00 H new ATOM 0 HB1 ALA A 45 1.011 -6.709 10.544 1.00 0.00 H new ATOM 0 HB2 ALA A 45 1.160 -8.213 9.605 1.00 0.00 H new ATOM 0 HB3 ALA A 45 2.333 -6.896 9.368 1.00 0.00 H new ATOM 737 N TYR A 46 1.605 -4.496 7.936 1.00 0.00 N ATOM 738 CA TYR A 46 1.772 -3.048 7.758 1.00 0.00 C ATOM 739 C TYR A 46 0.689 -2.508 6.840 1.00 0.00 C ATOM 740 O TYR A 46 0.076 -1.498 7.132 1.00 0.00 O ATOM 741 CB TYR A 46 3.180 -2.704 7.175 1.00 0.00 C ATOM 742 CG TYR A 46 3.263 -1.317 6.497 1.00 0.00 C ATOM 743 CD1 TYR A 46 2.873 -1.154 5.164 1.00 0.00 C ATOM 744 CD2 TYR A 46 3.679 -0.190 7.181 1.00 0.00 C ATOM 745 CE1 TYR A 46 2.895 0.070 4.554 1.00 0.00 C ATOM 746 CE2 TYR A 46 3.696 1.050 6.555 1.00 0.00 C ATOM 747 CZ TYR A 46 3.306 1.165 5.250 1.00 0.00 C ATOM 748 OH TYR A 46 3.318 2.394 4.641 1.00 0.00 O ATOM 0 H TYR A 46 2.391 -5.055 7.604 1.00 0.00 H new ATOM 0 HA TYR A 46 1.687 -2.578 8.738 1.00 0.00 H new ATOM 0 HB2 TYR A 46 3.914 -2.747 7.979 1.00 0.00 H new ATOM 0 HB3 TYR A 46 3.457 -3.468 6.449 1.00 0.00 H new ATOM 0 HD1 TYR A 46 2.546 -2.016 4.602 1.00 0.00 H new ATOM 0 HD2 TYR A 46 3.993 -0.274 8.211 1.00 0.00 H new ATOM 0 HE1 TYR A 46 2.587 0.167 3.523 1.00 0.00 H new ATOM 0 HE2 TYR A 46 4.018 1.925 7.100 1.00 0.00 H new ATOM 0 HH TYR A 46 4.121 2.886 4.913 1.00 0.00 H new ATOM 758 N ALA A 47 0.462 -3.170 5.740 1.00 0.00 N ATOM 759 CA ALA A 47 -0.495 -2.679 4.779 1.00 0.00 C ATOM 760 C ALA A 47 -1.900 -2.625 5.366 1.00 0.00 C ATOM 761 O ALA A 47 -2.622 -1.688 5.137 1.00 0.00 O ATOM 762 CB ALA A 47 -0.439 -3.485 3.520 1.00 0.00 C ATOM 0 H ALA A 47 0.921 -4.045 5.485 1.00 0.00 H new ATOM 0 HA ALA A 47 -0.226 -1.654 4.524 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -1.168 -3.099 2.808 1.00 0.00 H new ATOM 0 HB2 ALA A 47 0.560 -3.418 3.089 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -0.668 -4.527 3.744 1.00 0.00 H new ATOM 768 N LYS A 48 -2.233 -3.608 6.173 1.00 0.00 N ATOM 769 CA LYS A 48 -3.523 -3.681 6.857 1.00 0.00 C ATOM 770 C LYS A 48 -3.672 -2.575 7.880 1.00 0.00 C ATOM 771 O LYS A 48 -4.733 -1.949 7.982 1.00 0.00 O ATOM 772 CB LYS A 48 -3.645 -5.012 7.567 1.00 0.00 C ATOM 773 CG LYS A 48 -3.730 -6.199 6.638 1.00 0.00 C ATOM 774 CD LYS A 48 -3.680 -7.495 7.407 1.00 0.00 C ATOM 775 CE LYS A 48 -3.819 -8.686 6.478 1.00 0.00 C ATOM 776 NZ LYS A 48 -4.018 -9.955 7.210 1.00 0.00 N ATOM 0 H LYS A 48 -1.615 -4.392 6.381 1.00 0.00 H new ATOM 0 HA LYS A 48 -4.304 -3.571 6.105 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -2.786 -5.140 8.226 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -4.533 -4.995 8.200 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.655 -6.149 6.063 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -2.908 -6.165 5.923 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -2.738 -7.562 7.952 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -4.479 -7.513 8.148 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -4.661 -8.522 5.806 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -2.927 -8.765 5.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -4.107 -10.737 6.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -3.203 -10.128 7.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -4.884 -9.893 7.783 1.00 0.00 H new ATOM 790 N LYS A 49 -2.609 -2.333 8.637 1.00 0.00 N ATOM 791 CA LYS A 49 -2.636 -1.320 9.677 1.00 0.00 C ATOM 792 C LYS A 49 -2.758 0.063 9.036 1.00 0.00 C ATOM 793 O LYS A 49 -3.480 0.936 9.526 1.00 0.00 O ATOM 794 CB LYS A 49 -1.382 -1.420 10.595 1.00 0.00 C ATOM 795 CG LYS A 49 -0.092 -1.018 9.989 1.00 0.00 C ATOM 796 CD LYS A 49 1.051 -1.139 10.976 1.00 0.00 C ATOM 797 CE LYS A 49 2.271 -0.351 10.514 1.00 0.00 C ATOM 798 NZ LYS A 49 2.051 1.125 10.574 1.00 0.00 N ATOM 0 H LYS A 49 -1.720 -2.825 8.548 1.00 0.00 H new ATOM 0 HA LYS A 49 -3.505 -1.486 10.314 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -1.553 -0.802 11.477 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.292 -2.450 10.940 1.00 0.00 H new ATOM 0 HG2 LYS A 49 0.111 -1.641 9.118 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -0.161 0.011 9.636 1.00 0.00 H new ATOM 0 HD2 LYS A 49 0.730 -0.776 11.953 1.00 0.00 H new ATOM 0 HD3 LYS A 49 1.319 -2.189 11.098 1.00 0.00 H new ATOM 0 HE2 LYS A 49 3.127 -0.614 11.136 1.00 0.00 H new ATOM 0 HE3 LYS A 49 2.520 -0.637 9.492 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 2.969 1.614 10.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 1.479 1.424 9.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 1.552 1.366 11.454 1.00 0.00 H new ATOM 812 N VAL A 50 -2.093 0.221 7.914 1.00 0.00 N ATOM 813 CA VAL A 50 -2.103 1.443 7.160 1.00 0.00 C ATOM 814 C VAL A 50 -3.451 1.649 6.495 1.00 0.00 C ATOM 815 O VAL A 50 -4.048 2.711 6.620 1.00 0.00 O ATOM 816 CB VAL A 50 -0.932 1.452 6.138 1.00 0.00 C ATOM 817 CG1 VAL A 50 -1.081 2.530 5.085 1.00 0.00 C ATOM 818 CG2 VAL A 50 0.358 1.663 6.884 1.00 0.00 C ATOM 0 H VAL A 50 -1.521 -0.513 7.497 1.00 0.00 H new ATOM 0 HA VAL A 50 -1.951 2.284 7.837 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.938 0.493 5.619 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -0.235 2.488 4.399 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.006 2.371 4.530 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.110 3.507 5.567 1.00 0.00 H new ATOM 0 HG21 VAL A 50 1.189 1.672 6.179 1.00 0.00 H new ATOM 0 HG22 VAL A 50 0.321 2.615 7.413 1.00 0.00 H new ATOM 0 HG23 VAL A 50 0.500 0.855 7.602 1.00 0.00 H new ATOM 828 N GLU A 51 -3.935 0.611 5.848 1.00 0.00 N ATOM 829 CA GLU A 51 -5.218 0.617 5.176 1.00 0.00 C ATOM 830 C GLU A 51 -6.319 0.966 6.177 1.00 0.00 C ATOM 831 O GLU A 51 -7.104 1.877 5.941 1.00 0.00 O ATOM 832 CB GLU A 51 -5.417 -0.757 4.506 1.00 0.00 C ATOM 833 CG GLU A 51 -6.662 -0.955 3.656 1.00 0.00 C ATOM 834 CD GLU A 51 -7.918 -1.266 4.482 1.00 0.00 C ATOM 835 OE1 GLU A 51 -7.818 -2.006 5.494 1.00 0.00 O ATOM 836 OE2 GLU A 51 -9.009 -0.857 4.110 1.00 0.00 O ATOM 0 H GLU A 51 -3.439 -0.277 5.772 1.00 0.00 H new ATOM 0 HA GLU A 51 -5.259 1.377 4.396 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -4.548 -0.953 3.878 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -5.422 -1.515 5.290 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -6.837 -0.056 3.066 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -6.487 -1.769 2.952 1.00 0.00 H new ATOM 843 N GLY A 52 -6.300 0.295 7.328 1.00 0.00 N ATOM 844 CA GLY A 52 -7.271 0.551 8.380 1.00 0.00 C ATOM 845 C GLY A 52 -7.180 1.963 8.914 1.00 0.00 C ATOM 846 O GLY A 52 -8.191 2.579 9.258 1.00 0.00 O ATOM 0 H GLY A 52 -5.619 -0.431 7.552 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -8.275 0.375 7.995 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -7.114 -0.154 9.196 1.00 0.00 H new ATOM 850 N ASP A 53 -5.970 2.479 8.967 1.00 0.00 N ATOM 851 CA ASP A 53 -5.712 3.845 9.422 1.00 0.00 C ATOM 852 C ASP A 53 -6.376 4.855 8.476 1.00 0.00 C ATOM 853 O ASP A 53 -7.165 5.685 8.898 1.00 0.00 O ATOM 854 CB ASP A 53 -4.211 4.076 9.482 1.00 0.00 C ATOM 855 CG ASP A 53 -3.814 5.401 10.077 1.00 0.00 C ATOM 856 OD1 ASP A 53 -3.763 5.517 11.327 1.00 0.00 O ATOM 857 OD2 ASP A 53 -3.473 6.322 9.320 1.00 0.00 O ATOM 0 H ASP A 53 -5.130 1.968 8.697 1.00 0.00 H new ATOM 0 HA ASP A 53 -6.136 3.984 10.416 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -3.755 3.277 10.066 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -3.803 4.006 8.473 1.00 0.00 H new ATOM 862 N MET A 54 -6.101 4.728 7.186 1.00 0.00 N ATOM 863 CA MET A 54 -6.716 5.612 6.169 1.00 0.00 C ATOM 864 C MET A 54 -8.202 5.393 6.010 1.00 0.00 C ATOM 865 O MET A 54 -8.942 6.323 5.713 1.00 0.00 O ATOM 866 CB MET A 54 -5.984 5.615 4.811 1.00 0.00 C ATOM 867 CG MET A 54 -5.368 4.328 4.386 1.00 0.00 C ATOM 868 SD MET A 54 -3.661 4.596 3.822 1.00 0.00 S ATOM 869 CE MET A 54 -2.930 5.459 5.235 1.00 0.00 C ATOM 0 H MET A 54 -5.462 4.030 6.806 1.00 0.00 H new ATOM 0 HA MET A 54 -6.588 6.616 6.575 1.00 0.00 H new ATOM 0 HB2 MET A 54 -6.692 5.925 4.042 1.00 0.00 H new ATOM 0 HB3 MET A 54 -5.201 6.373 4.847 1.00 0.00 H new ATOM 0 HG2 MET A 54 -5.376 3.622 5.216 1.00 0.00 H new ATOM 0 HG3 MET A 54 -5.957 3.883 3.584 1.00 0.00 H new ATOM 0 HE1 MET A 54 -1.843 5.418 5.164 1.00 0.00 H new ATOM 0 HE2 MET A 54 -3.254 6.500 5.233 1.00 0.00 H new ATOM 0 HE3 MET A 54 -3.252 4.980 6.160 1.00 0.00 H new ATOM 879 N TYR A 55 -8.634 4.185 6.236 1.00 0.00 N ATOM 880 CA TYR A 55 -10.038 3.822 6.223 1.00 0.00 C ATOM 881 C TYR A 55 -10.752 4.611 7.352 1.00 0.00 C ATOM 882 O TYR A 55 -11.829 5.162 7.178 1.00 0.00 O ATOM 883 CB TYR A 55 -10.095 2.313 6.480 1.00 0.00 C ATOM 884 CG TYR A 55 -11.436 1.652 6.504 1.00 0.00 C ATOM 885 CD1 TYR A 55 -12.024 1.191 5.340 1.00 0.00 C ATOM 886 CD2 TYR A 55 -12.086 1.431 7.703 1.00 0.00 C ATOM 887 CE1 TYR A 55 -13.228 0.525 5.375 1.00 0.00 C ATOM 888 CE2 TYR A 55 -13.294 0.778 7.747 1.00 0.00 C ATOM 889 CZ TYR A 55 -13.860 0.324 6.581 1.00 0.00 C ATOM 890 OH TYR A 55 -15.048 -0.355 6.625 1.00 0.00 O ATOM 0 H TYR A 55 -8.013 3.402 6.440 1.00 0.00 H new ATOM 0 HA TYR A 55 -10.529 4.058 5.279 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -9.495 1.822 5.714 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -9.611 2.119 7.437 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -11.533 1.356 4.392 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -11.637 1.778 8.622 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -13.674 0.162 4.461 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -13.795 0.623 8.691 1.00 0.00 H new ATOM 0 HH TYR A 55 -15.359 -0.410 7.553 1.00 0.00 H new ATOM 900 N GLU A 56 -10.097 4.696 8.485 1.00 0.00 N ATOM 901 CA GLU A 56 -10.608 5.436 9.629 1.00 0.00 C ATOM 902 C GLU A 56 -10.404 6.940 9.500 1.00 0.00 C ATOM 903 O GLU A 56 -11.119 7.722 10.115 1.00 0.00 O ATOM 904 CB GLU A 56 -10.005 4.900 10.912 1.00 0.00 C ATOM 905 CG GLU A 56 -10.829 3.796 11.524 1.00 0.00 C ATOM 906 CD GLU A 56 -11.997 4.356 12.291 1.00 0.00 C ATOM 907 OE1 GLU A 56 -12.978 4.811 11.665 1.00 0.00 O ATOM 908 OE2 GLU A 56 -11.937 4.382 13.553 1.00 0.00 O ATOM 0 H GLU A 56 -9.192 4.255 8.647 1.00 0.00 H new ATOM 0 HA GLU A 56 -11.687 5.283 9.659 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -9.000 4.529 10.709 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -9.905 5.714 11.630 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -11.190 3.130 10.740 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -10.206 3.198 12.189 1.00 0.00 H new ATOM 915 N SER A 57 -9.476 7.329 8.692 1.00 0.00 N ATOM 916 CA SER A 57 -9.174 8.730 8.492 1.00 0.00 C ATOM 917 C SER A 57 -10.120 9.354 7.428 1.00 0.00 C ATOM 918 O SER A 57 -10.450 10.549 7.484 1.00 0.00 O ATOM 919 CB SER A 57 -7.695 8.869 8.073 1.00 0.00 C ATOM 920 OG SER A 57 -7.243 10.212 8.135 1.00 0.00 O ATOM 0 H SER A 57 -8.897 6.693 8.144 1.00 0.00 H new ATOM 0 HA SER A 57 -9.335 9.273 9.423 1.00 0.00 H new ATOM 0 HB2 SER A 57 -7.076 8.249 8.722 1.00 0.00 H new ATOM 0 HB3 SER A 57 -7.570 8.492 7.058 1.00 0.00 H new ATOM 0 HG SER A 57 -6.302 10.253 7.863 1.00 0.00 H new ATOM 926 N ALA A 58 -10.572 8.548 6.489 1.00 0.00 N ATOM 927 CA ALA A 58 -11.407 9.037 5.408 1.00 0.00 C ATOM 928 C ALA A 58 -12.887 9.007 5.743 1.00 0.00 C ATOM 929 O ALA A 58 -13.315 8.368 6.722 1.00 0.00 O ATOM 930 CB ALA A 58 -11.170 8.240 4.175 1.00 0.00 C ATOM 0 H ALA A 58 -10.375 7.548 6.452 1.00 0.00 H new ATOM 0 HA ALA A 58 -11.127 10.078 5.249 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -11.802 8.617 3.371 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -10.123 8.324 3.883 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -11.410 7.194 4.366 1.00 0.00 H new ATOM 936 N ASN A 59 -13.671 9.687 4.920 1.00 0.00 N ATOM 937 CA ASN A 59 -15.124 9.757 5.112 1.00 0.00 C ATOM 938 C ASN A 59 -15.874 9.113 3.943 1.00 0.00 C ATOM 939 O ASN A 59 -17.112 9.160 3.865 1.00 0.00 O ATOM 940 CB ASN A 59 -15.567 11.211 5.338 1.00 0.00 C ATOM 941 CG ASN A 59 -15.830 12.011 4.067 1.00 0.00 C ATOM 942 OD1 ASN A 59 -16.968 12.105 3.601 1.00 0.00 O ATOM 943 ND2 ASN A 59 -14.810 12.561 3.490 1.00 0.00 N ATOM 0 H ASN A 59 -13.330 10.202 4.108 1.00 0.00 H new ATOM 0 HA ASN A 59 -15.377 9.186 6.005 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -16.475 11.208 5.942 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -14.799 11.723 5.919 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -14.936 13.089 2.627 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -13.880 12.466 3.899 1.00 0.00 H new ATOM 950 N SER A 60 -15.133 8.503 3.073 1.00 0.00 N ATOM 951 CA SER A 60 -15.671 7.733 1.994 1.00 0.00 C ATOM 952 C SER A 60 -14.620 6.791 1.565 1.00 0.00 C ATOM 953 O SER A 60 -13.431 7.014 1.845 1.00 0.00 O ATOM 954 CB SER A 60 -16.111 8.602 0.822 1.00 0.00 C ATOM 955 OG SER A 60 -15.044 9.386 0.330 1.00 0.00 O ATOM 0 H SER A 60 -14.113 8.526 3.093 1.00 0.00 H new ATOM 0 HA SER A 60 -16.564 7.209 2.335 1.00 0.00 H new ATOM 0 HB2 SER A 60 -16.497 7.969 0.023 1.00 0.00 H new ATOM 0 HB3 SER A 60 -16.927 9.253 1.136 1.00 0.00 H new ATOM 0 HG SER A 60 -15.358 9.931 -0.422 1.00 0.00 H new ATOM 961 N ARG A 61 -15.010 5.729 0.918 1.00 0.00 N ATOM 962 CA ARG A 61 -14.028 4.795 0.462 1.00 0.00 C ATOM 963 C ARG A 61 -13.255 5.353 -0.697 1.00 0.00 C ATOM 964 O ARG A 61 -12.125 5.003 -0.899 1.00 0.00 O ATOM 965 CB ARG A 61 -14.566 3.386 0.174 1.00 0.00 C ATOM 966 CG ARG A 61 -15.483 3.204 -1.022 1.00 0.00 C ATOM 967 CD ARG A 61 -16.721 4.007 -0.927 1.00 0.00 C ATOM 968 NE ARG A 61 -17.683 3.539 -1.934 1.00 0.00 N ATOM 969 CZ ARG A 61 -18.611 4.267 -2.575 1.00 0.00 C ATOM 970 NH1 ARG A 61 -18.787 5.558 -2.303 1.00 0.00 N ATOM 971 NH2 ARG A 61 -19.384 3.676 -3.482 1.00 0.00 N ATOM 0 H ARG A 61 -15.978 5.494 0.700 1.00 0.00 H new ATOM 0 HA ARG A 61 -13.345 4.655 1.300 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -13.711 2.722 0.043 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -15.101 3.045 1.060 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -14.946 3.480 -1.930 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -15.746 2.150 -1.115 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -17.150 3.918 0.071 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -16.497 5.062 -1.085 1.00 0.00 H new ATOM 0 HE ARG A 61 -17.641 2.548 -2.173 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -18.211 6.013 -1.595 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -19.498 6.092 -2.802 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -19.267 2.683 -3.682 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -20.094 4.216 -3.977 1.00 0.00 H new ATOM 985 N ASP A 62 -13.878 6.257 -1.426 1.00 0.00 N ATOM 986 CA ASP A 62 -13.239 6.922 -2.540 1.00 0.00 C ATOM 987 C ASP A 62 -12.115 7.788 -2.019 1.00 0.00 C ATOM 988 O ASP A 62 -11.014 7.746 -2.534 1.00 0.00 O ATOM 989 CB ASP A 62 -14.253 7.753 -3.300 1.00 0.00 C ATOM 990 CG ASP A 62 -13.651 8.543 -4.444 1.00 0.00 C ATOM 991 OD1 ASP A 62 -13.431 7.979 -5.529 1.00 0.00 O ATOM 992 OD2 ASP A 62 -13.428 9.763 -4.286 1.00 0.00 O ATOM 0 H ASP A 62 -14.841 6.550 -1.262 1.00 0.00 H new ATOM 0 HA ASP A 62 -12.828 6.182 -3.226 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -15.029 7.096 -3.692 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -14.738 8.442 -2.608 1.00 0.00 H new ATOM 997 N GLU A 63 -12.400 8.528 -0.948 1.00 0.00 N ATOM 998 CA GLU A 63 -11.403 9.340 -0.280 1.00 0.00 C ATOM 999 C GLU A 63 -10.278 8.478 0.282 1.00 0.00 C ATOM 1000 O GLU A 63 -9.100 8.767 0.052 1.00 0.00 O ATOM 1001 CB GLU A 63 -12.054 10.206 0.816 1.00 0.00 C ATOM 1002 CG GLU A 63 -11.075 10.920 1.739 1.00 0.00 C ATOM 1003 CD GLU A 63 -11.723 11.970 2.581 1.00 0.00 C ATOM 1004 OE1 GLU A 63 -12.219 11.645 3.677 1.00 0.00 O ATOM 1005 OE2 GLU A 63 -11.760 13.149 2.170 1.00 0.00 O ATOM 0 H GLU A 63 -13.327 8.576 -0.526 1.00 0.00 H new ATOM 0 HA GLU A 63 -10.960 10.011 -1.016 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -12.690 10.952 0.339 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.704 9.573 1.420 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -10.596 10.187 2.388 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -10.288 11.378 1.140 1.00 0.00 H new ATOM 1012 N TYR A 64 -10.637 7.390 0.963 1.00 0.00 N ATOM 1013 CA TYR A 64 -9.651 6.534 1.587 1.00 0.00 C ATOM 1014 C TYR A 64 -8.768 5.862 0.536 1.00 0.00 C ATOM 1015 O TYR A 64 -7.544 5.912 0.634 1.00 0.00 O ATOM 1016 CB TYR A 64 -10.333 5.546 2.589 1.00 0.00 C ATOM 1017 CG TYR A 64 -10.102 4.089 2.376 1.00 0.00 C ATOM 1018 CD1 TYR A 64 -9.032 3.446 2.950 1.00 0.00 C ATOM 1019 CD2 TYR A 64 -10.957 3.361 1.586 1.00 0.00 C ATOM 1020 CE1 TYR A 64 -8.826 2.116 2.742 1.00 0.00 C ATOM 1021 CE2 TYR A 64 -10.759 2.035 1.364 1.00 0.00 C ATOM 1022 CZ TYR A 64 -9.688 1.416 1.944 1.00 0.00 C ATOM 1023 OH TYR A 64 -9.475 0.102 1.728 1.00 0.00 O ATOM 0 H TYR A 64 -11.603 7.088 1.092 1.00 0.00 H new ATOM 0 HA TYR A 64 -8.972 7.138 2.189 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -9.995 5.798 3.594 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -11.408 5.725 2.560 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -8.347 4.001 3.573 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -11.805 3.852 1.132 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -7.987 1.617 3.204 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -11.439 1.478 0.737 1.00 0.00 H new ATOM 0 HH TYR A 64 -9.447 -0.370 2.586 1.00 0.00 H new ATOM 1033 N TYR A 65 -9.404 5.306 -0.491 1.00 0.00 N ATOM 1034 CA TYR A 65 -8.725 4.685 -1.609 1.00 0.00 C ATOM 1035 C TYR A 65 -7.821 5.690 -2.292 1.00 0.00 C ATOM 1036 O TYR A 65 -6.668 5.405 -2.512 1.00 0.00 O ATOM 1037 CB TYR A 65 -9.782 4.067 -2.567 1.00 0.00 C ATOM 1038 CG TYR A 65 -9.374 3.723 -3.999 1.00 0.00 C ATOM 1039 CD1 TYR A 65 -8.105 3.264 -4.343 1.00 0.00 C ATOM 1040 CD2 TYR A 65 -10.300 3.876 -5.013 1.00 0.00 C ATOM 1041 CE1 TYR A 65 -7.788 2.974 -5.657 1.00 0.00 C ATOM 1042 CE2 TYR A 65 -9.991 3.591 -6.314 1.00 0.00 C ATOM 1043 CZ TYR A 65 -8.739 3.143 -6.638 1.00 0.00 C ATOM 1044 OH TYR A 65 -8.436 2.882 -7.951 1.00 0.00 O ATOM 0 H TYR A 65 -10.421 5.277 -0.565 1.00 0.00 H new ATOM 0 HA TYR A 65 -8.082 3.875 -1.265 1.00 0.00 H new ATOM 0 HB2 TYR A 65 -10.153 3.153 -2.102 1.00 0.00 H new ATOM 0 HB3 TYR A 65 -10.621 4.760 -2.622 1.00 0.00 H new ATOM 0 HD1 TYR A 65 -7.359 3.133 -3.573 1.00 0.00 H new ATOM 0 HD2 TYR A 65 -11.292 4.229 -4.772 1.00 0.00 H new ATOM 0 HE1 TYR A 65 -6.801 2.617 -5.912 1.00 0.00 H new ATOM 0 HE2 TYR A 65 -10.735 3.719 -7.086 1.00 0.00 H new ATOM 0 HH TYR A 65 -9.223 3.053 -8.509 1.00 0.00 H new ATOM 1054 N HIS A 66 -8.329 6.886 -2.539 1.00 0.00 N ATOM 1055 CA HIS A 66 -7.570 7.915 -3.237 1.00 0.00 C ATOM 1056 C HIS A 66 -6.341 8.359 -2.445 1.00 0.00 C ATOM 1057 O HIS A 66 -5.253 8.380 -2.981 1.00 0.00 O ATOM 1058 CB HIS A 66 -8.457 9.124 -3.588 1.00 0.00 C ATOM 1059 CG HIS A 66 -7.742 10.228 -4.324 1.00 0.00 C ATOM 1060 ND1 HIS A 66 -7.488 11.467 -3.787 1.00 0.00 N ATOM 1061 CD2 HIS A 66 -7.239 10.258 -5.578 1.00 0.00 C ATOM 1062 CE1 HIS A 66 -6.853 12.197 -4.706 1.00 0.00 C ATOM 1063 NE2 HIS A 66 -6.678 11.508 -5.815 1.00 0.00 N ATOM 0 H HIS A 66 -9.269 7.171 -2.265 1.00 0.00 H new ATOM 0 HA HIS A 66 -7.216 7.469 -4.167 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -9.294 8.781 -4.196 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -8.877 9.530 -2.668 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -7.268 9.441 -6.284 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -6.526 13.216 -4.560 1.00 0.00 H new ATOM 0 HE2 HIS A 66 -6.224 11.826 -6.671 1.00 0.00 H new ATOM 1071 N LEU A 67 -6.507 8.680 -1.175 1.00 0.00 N ATOM 1072 CA LEU A 67 -5.382 9.181 -0.391 1.00 0.00 C ATOM 1073 C LEU A 67 -4.318 8.086 -0.159 1.00 0.00 C ATOM 1074 O LEU A 67 -3.095 8.368 -0.127 1.00 0.00 O ATOM 1075 CB LEU A 67 -5.867 9.874 0.921 1.00 0.00 C ATOM 1076 CG LEU A 67 -6.541 9.008 2.002 1.00 0.00 C ATOM 1077 CD1 LEU A 67 -5.526 8.330 2.879 1.00 0.00 C ATOM 1078 CD2 LEU A 67 -7.505 9.810 2.848 1.00 0.00 C ATOM 0 H LEU A 67 -7.389 8.607 -0.668 1.00 0.00 H new ATOM 0 HA LEU A 67 -4.881 9.957 -0.970 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -5.005 10.362 1.376 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -6.568 10.661 0.641 1.00 0.00 H new ATOM 0 HG LEU A 67 -7.109 8.242 1.475 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -6.038 7.728 3.630 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -4.890 7.687 2.270 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -4.912 9.083 3.374 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -7.958 9.161 3.598 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -6.968 10.618 3.345 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -8.285 10.230 2.212 1.00 0.00 H new ATOM 1090 N LEU A 68 -4.767 6.833 -0.051 1.00 0.00 N ATOM 1091 CA LEU A 68 -3.847 5.727 0.141 1.00 0.00 C ATOM 1092 C LEU A 68 -3.139 5.451 -1.190 1.00 0.00 C ATOM 1093 O LEU A 68 -1.944 5.130 -1.230 1.00 0.00 O ATOM 1094 CB LEU A 68 -4.589 4.477 0.736 1.00 0.00 C ATOM 1095 CG LEU A 68 -5.336 3.504 -0.172 1.00 0.00 C ATOM 1096 CD1 LEU A 68 -4.370 2.521 -0.789 1.00 0.00 C ATOM 1097 CD2 LEU A 68 -6.377 2.763 0.626 1.00 0.00 C ATOM 0 H LEU A 68 -5.751 6.568 -0.094 1.00 0.00 H new ATOM 0 HA LEU A 68 -3.084 5.980 0.877 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -3.848 3.897 1.286 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -5.308 4.849 1.466 1.00 0.00 H new ATOM 0 HG LEU A 68 -5.823 4.066 -0.969 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -4.915 1.832 -1.435 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -3.628 3.061 -1.378 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -3.869 1.960 -0.000 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -6.909 2.069 -0.025 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -5.893 2.208 1.429 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -7.084 3.475 1.052 1.00 0.00 H new ATOM 1109 N ALA A 69 -3.893 5.639 -2.272 1.00 0.00 N ATOM 1110 CA ALA A 69 -3.408 5.524 -3.638 1.00 0.00 C ATOM 1111 C ALA A 69 -2.344 6.568 -3.886 1.00 0.00 C ATOM 1112 O ALA A 69 -1.359 6.327 -4.556 1.00 0.00 O ATOM 1113 CB ALA A 69 -4.560 5.736 -4.601 1.00 0.00 C ATOM 0 H ALA A 69 -4.882 5.881 -2.217 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.984 4.532 -3.791 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -4.198 5.650 -5.626 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -5.327 4.982 -4.423 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -4.984 6.728 -4.448 1.00 0.00 H new ATOM 1119 N GLU A 70 -2.555 7.713 -3.319 1.00 0.00 N ATOM 1120 CA GLU A 70 -1.625 8.800 -3.398 1.00 0.00 C ATOM 1121 C GLU A 70 -0.331 8.451 -2.717 1.00 0.00 C ATOM 1122 O GLU A 70 0.764 8.691 -3.272 1.00 0.00 O ATOM 1123 CB GLU A 70 -2.240 10.035 -2.783 1.00 0.00 C ATOM 1124 CG GLU A 70 -3.239 10.699 -3.683 1.00 0.00 C ATOM 1125 CD GLU A 70 -2.549 11.479 -4.758 1.00 0.00 C ATOM 1126 OE1 GLU A 70 -2.079 10.886 -5.757 1.00 0.00 O ATOM 1127 OE2 GLU A 70 -2.383 12.697 -4.579 1.00 0.00 O ATOM 0 H GLU A 70 -3.393 7.925 -2.778 1.00 0.00 H new ATOM 0 HA GLU A 70 -1.401 8.998 -4.446 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -2.726 9.764 -1.846 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -1.450 10.745 -2.539 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -3.887 9.947 -4.132 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -3.877 11.362 -3.099 1.00 0.00 H new ATOM 1134 N LYS A 71 -0.438 7.856 -1.538 1.00 0.00 N ATOM 1135 CA LYS A 71 0.732 7.506 -0.786 1.00 0.00 C ATOM 1136 C LYS A 71 1.509 6.384 -1.478 1.00 0.00 C ATOM 1137 O LYS A 71 2.723 6.446 -1.568 1.00 0.00 O ATOM 1138 CB LYS A 71 0.396 7.230 0.724 1.00 0.00 C ATOM 1139 CG LYS A 71 0.317 5.767 1.235 1.00 0.00 C ATOM 1140 CD LYS A 71 1.709 5.112 1.322 1.00 0.00 C ATOM 1141 CE LYS A 71 1.777 3.972 2.318 1.00 0.00 C ATOM 1142 NZ LYS A 71 1.766 4.456 3.721 1.00 0.00 N ATOM 0 H LYS A 71 -1.323 7.611 -1.093 1.00 0.00 H new ATOM 0 HA LYS A 71 1.405 8.363 -0.766 1.00 0.00 H new ATOM 0 HB2 LYS A 71 1.145 7.746 1.325 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -0.563 7.702 0.937 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -0.154 5.751 2.218 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -0.318 5.183 0.568 1.00 0.00 H new ATOM 0 HD2 LYS A 71 1.990 4.741 0.336 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.442 5.870 1.598 1.00 0.00 H new ATOM 0 HE2 LYS A 71 0.932 3.302 2.159 1.00 0.00 H new ATOM 0 HE3 LYS A 71 2.682 3.391 2.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 2.353 3.830 4.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 2.147 5.423 3.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 0.790 4.455 4.081 1.00 0.00 H new ATOM 1156 N ILE A 72 0.812 5.383 -1.992 1.00 0.00 N ATOM 1157 CA ILE A 72 1.496 4.276 -2.654 1.00 0.00 C ATOM 1158 C ILE A 72 2.240 4.770 -3.897 1.00 0.00 C ATOM 1159 O ILE A 72 3.401 4.451 -4.099 1.00 0.00 O ATOM 1160 CB ILE A 72 0.542 3.097 -3.023 1.00 0.00 C ATOM 1161 CG1 ILE A 72 1.317 1.931 -3.541 1.00 0.00 C ATOM 1162 CG2 ILE A 72 -0.499 3.478 -3.985 1.00 0.00 C ATOM 1163 CD1 ILE A 72 0.477 0.786 -4.041 1.00 0.00 C ATOM 0 H ILE A 72 -0.205 5.310 -1.967 1.00 0.00 H new ATOM 0 HA ILE A 72 2.214 3.882 -1.934 1.00 0.00 H new ATOM 0 HB ILE A 72 0.035 2.815 -2.100 1.00 0.00 H new ATOM 0 HG12 ILE A 72 1.961 2.272 -4.352 1.00 0.00 H new ATOM 0 HG13 ILE A 72 1.970 1.565 -2.748 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -1.129 2.615 -4.200 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -1.109 4.277 -3.563 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -0.033 3.826 -4.907 1.00 0.00 H new ATOM 0 HD11 ILE A 72 1.127 -0.014 -4.397 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -0.148 0.412 -3.230 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -0.157 1.130 -4.859 1.00 0.00 H new ATOM 1175 N TYR A 73 1.567 5.602 -4.656 1.00 0.00 N ATOM 1176 CA TYR A 73 2.055 6.180 -5.884 1.00 0.00 C ATOM 1177 C TYR A 73 3.393 6.904 -5.632 1.00 0.00 C ATOM 1178 O TYR A 73 4.436 6.591 -6.264 1.00 0.00 O ATOM 1179 CB TYR A 73 0.971 7.162 -6.347 1.00 0.00 C ATOM 1180 CG TYR A 73 1.150 7.829 -7.671 1.00 0.00 C ATOM 1181 CD1 TYR A 73 1.969 8.925 -7.805 1.00 0.00 C ATOM 1182 CD2 TYR A 73 0.443 7.390 -8.779 1.00 0.00 C ATOM 1183 CE1 TYR A 73 2.090 9.574 -9.024 1.00 0.00 C ATOM 1184 CE2 TYR A 73 0.561 8.014 -9.993 1.00 0.00 C ATOM 1185 CZ TYR A 73 1.381 9.106 -10.116 1.00 0.00 C ATOM 1186 OH TYR A 73 1.476 9.743 -11.330 1.00 0.00 O ATOM 0 H TYR A 73 0.622 5.908 -4.423 1.00 0.00 H new ATOM 0 HA TYR A 73 2.244 5.423 -6.645 1.00 0.00 H new ATOM 0 HB2 TYR A 73 0.022 6.626 -6.368 1.00 0.00 H new ATOM 0 HB3 TYR A 73 0.880 7.941 -5.590 1.00 0.00 H new ATOM 0 HD1 TYR A 73 2.524 9.284 -6.951 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -0.214 6.539 -8.684 1.00 0.00 H new ATOM 0 HE1 TYR A 73 2.732 10.437 -9.120 1.00 0.00 H new ATOM 0 HE2 TYR A 73 0.012 7.648 -10.848 1.00 0.00 H new ATOM 0 HH TYR A 73 0.914 9.281 -11.987 1.00 0.00 H new ATOM 1196 N LYS A 74 3.376 7.819 -4.661 1.00 0.00 N ATOM 1197 CA LYS A 74 4.551 8.609 -4.331 1.00 0.00 C ATOM 1198 C LYS A 74 5.666 7.713 -3.781 1.00 0.00 C ATOM 1199 O LYS A 74 6.831 7.968 -4.017 1.00 0.00 O ATOM 1200 CB LYS A 74 4.205 9.746 -3.350 1.00 0.00 C ATOM 1201 CG LYS A 74 3.786 9.259 -1.979 1.00 0.00 C ATOM 1202 CD LYS A 74 3.333 10.378 -1.042 1.00 0.00 C ATOM 1203 CE LYS A 74 2.113 11.098 -1.588 1.00 0.00 C ATOM 1204 NZ LYS A 74 1.583 12.114 -0.663 1.00 0.00 N ATOM 0 H LYS A 74 2.556 8.027 -4.091 1.00 0.00 H new ATOM 0 HA LYS A 74 4.915 9.074 -5.247 1.00 0.00 H new ATOM 0 HB2 LYS A 74 5.071 10.400 -3.245 1.00 0.00 H new ATOM 0 HB3 LYS A 74 3.401 10.348 -3.774 1.00 0.00 H new ATOM 0 HG2 LYS A 74 2.975 8.540 -2.091 1.00 0.00 H new ATOM 0 HG3 LYS A 74 4.621 8.729 -1.521 1.00 0.00 H new ATOM 0 HD2 LYS A 74 3.103 9.962 -0.061 1.00 0.00 H new ATOM 0 HD3 LYS A 74 4.146 11.090 -0.904 1.00 0.00 H new ATOM 0 HE2 LYS A 74 2.372 11.575 -2.533 1.00 0.00 H new ATOM 0 HE3 LYS A 74 1.333 10.368 -1.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 0.752 12.572 -1.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 1.308 11.660 0.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 2.315 12.829 -0.477 1.00 0.00 H new ATOM 1218 N ILE A 75 5.282 6.645 -3.093 1.00 0.00 N ATOM 1219 CA ILE A 75 6.215 5.694 -2.531 1.00 0.00 C ATOM 1220 C ILE A 75 6.936 4.918 -3.625 1.00 0.00 C ATOM 1221 O ILE A 75 8.147 4.724 -3.551 1.00 0.00 O ATOM 1222 CB ILE A 75 5.508 4.739 -1.495 1.00 0.00 C ATOM 1223 CG1 ILE A 75 5.736 5.208 -0.050 1.00 0.00 C ATOM 1224 CG2 ILE A 75 5.909 3.276 -1.654 1.00 0.00 C ATOM 1225 CD1 ILE A 75 5.266 6.619 0.263 1.00 0.00 C ATOM 0 H ILE A 75 4.304 6.418 -2.911 1.00 0.00 H new ATOM 0 HA ILE A 75 6.972 6.253 -1.982 1.00 0.00 H new ATOM 0 HB ILE A 75 4.443 4.799 -1.717 1.00 0.00 H new ATOM 0 HG12 ILE A 75 5.227 4.517 0.622 1.00 0.00 H new ATOM 0 HG13 ILE A 75 6.801 5.141 0.171 1.00 0.00 H new ATOM 0 HG21 ILE A 75 5.387 2.673 -0.911 1.00 0.00 H new ATOM 0 HG22 ILE A 75 5.642 2.932 -2.653 1.00 0.00 H new ATOM 0 HG23 ILE A 75 6.985 3.176 -1.512 1.00 0.00 H new ATOM 0 HD11 ILE A 75 5.474 6.848 1.308 1.00 0.00 H new ATOM 0 HD12 ILE A 75 5.792 7.328 -0.376 1.00 0.00 H new ATOM 0 HD13 ILE A 75 4.194 6.694 0.082 1.00 0.00 H new ATOM 1237 N GLN A 76 6.209 4.528 -4.662 1.00 0.00 N ATOM 1238 CA GLN A 76 6.819 3.772 -5.736 1.00 0.00 C ATOM 1239 C GLN A 76 7.827 4.645 -6.458 1.00 0.00 C ATOM 1240 O GLN A 76 8.915 4.198 -6.828 1.00 0.00 O ATOM 1241 CB GLN A 76 5.796 3.233 -6.710 1.00 0.00 C ATOM 1242 CG GLN A 76 4.643 2.501 -6.070 1.00 0.00 C ATOM 1243 CD GLN A 76 3.855 1.669 -7.058 1.00 0.00 C ATOM 1244 OE1 GLN A 76 4.396 1.162 -8.028 1.00 0.00 O ATOM 1245 NE2 GLN A 76 2.574 1.554 -6.836 1.00 0.00 N ATOM 0 H GLN A 76 5.214 4.720 -4.779 1.00 0.00 H new ATOM 0 HA GLN A 76 7.322 2.911 -5.296 1.00 0.00 H new ATOM 0 HB2 GLN A 76 5.401 4.062 -7.298 1.00 0.00 H new ATOM 0 HB3 GLN A 76 6.296 2.559 -7.405 1.00 0.00 H new ATOM 0 HG2 GLN A 76 5.023 1.854 -5.279 1.00 0.00 H new ATOM 0 HG3 GLN A 76 3.977 3.223 -5.598 1.00 0.00 H new ATOM 0 HE21 GLN A 76 2.157 1.992 -6.014 1.00 0.00 H new ATOM 0 HE22 GLN A 76 1.989 1.026 -7.484 1.00 0.00 H new ATOM 1254 N LYS A 77 7.480 5.901 -6.641 1.00 0.00 N ATOM 1255 CA LYS A 77 8.443 6.821 -7.207 1.00 0.00 C ATOM 1256 C LYS A 77 9.573 7.195 -6.276 1.00 0.00 C ATOM 1257 O LYS A 77 10.665 7.547 -6.725 1.00 0.00 O ATOM 1258 CB LYS A 77 7.830 8.003 -7.898 1.00 0.00 C ATOM 1259 CG LYS A 77 6.607 8.563 -7.276 1.00 0.00 C ATOM 1260 CD LYS A 77 5.642 9.033 -8.349 1.00 0.00 C ATOM 1261 CE LYS A 77 5.124 7.884 -9.288 1.00 0.00 C ATOM 1262 NZ LYS A 77 6.127 7.366 -10.293 1.00 0.00 N ATOM 0 H LYS A 77 6.569 6.300 -6.415 1.00 0.00 H new ATOM 0 HA LYS A 77 8.916 6.241 -8.000 1.00 0.00 H new ATOM 0 HB2 LYS A 77 8.579 8.793 -7.954 1.00 0.00 H new ATOM 0 HB3 LYS A 77 7.593 7.716 -8.922 1.00 0.00 H new ATOM 0 HG2 LYS A 77 6.129 7.808 -6.652 1.00 0.00 H new ATOM 0 HG3 LYS A 77 6.870 9.395 -6.623 1.00 0.00 H new ATOM 0 HD2 LYS A 77 4.787 9.511 -7.871 1.00 0.00 H new ATOM 0 HD3 LYS A 77 6.133 9.793 -8.958 1.00 0.00 H new ATOM 0 HE2 LYS A 77 4.794 7.051 -8.667 1.00 0.00 H new ATOM 0 HE3 LYS A 77 4.248 8.246 -9.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 5.636 7.111 -11.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 6.833 8.104 -10.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 6.603 6.526 -9.907 1.00 0.00 H new ATOM 1276 N GLU A 78 9.307 7.140 -4.996 1.00 0.00 N ATOM 1277 CA GLU A 78 10.306 7.398 -3.988 1.00 0.00 C ATOM 1278 C GLU A 78 11.357 6.312 -4.093 1.00 0.00 C ATOM 1279 O GLU A 78 12.530 6.605 -4.281 1.00 0.00 O ATOM 1280 CB GLU A 78 9.626 7.419 -2.607 1.00 0.00 C ATOM 1281 CG GLU A 78 10.447 7.983 -1.433 1.00 0.00 C ATOM 1282 CD GLU A 78 11.603 7.110 -0.973 1.00 0.00 C ATOM 1283 OE1 GLU A 78 11.368 6.063 -0.374 1.00 0.00 O ATOM 1284 OE2 GLU A 78 12.779 7.486 -1.168 1.00 0.00 O ATOM 0 H GLU A 78 8.386 6.914 -4.620 1.00 0.00 H new ATOM 0 HA GLU A 78 10.789 8.365 -4.129 1.00 0.00 H new ATOM 0 HB2 GLU A 78 8.709 8.002 -2.690 1.00 0.00 H new ATOM 0 HB3 GLU A 78 9.334 6.399 -2.357 1.00 0.00 H new ATOM 0 HG2 GLU A 78 10.841 8.958 -1.721 1.00 0.00 H new ATOM 0 HG3 GLU A 78 9.778 8.147 -0.588 1.00 0.00 H new ATOM 1291 N LEU A 79 10.912 5.061 -4.072 1.00 0.00 N ATOM 1292 CA LEU A 79 11.818 3.931 -4.156 1.00 0.00 C ATOM 1293 C LEU A 79 12.591 3.911 -5.469 1.00 0.00 C ATOM 1294 O LEU A 79 13.797 3.589 -5.479 1.00 0.00 O ATOM 1295 CB LEU A 79 11.106 2.587 -3.850 1.00 0.00 C ATOM 1296 CG LEU A 79 9.962 2.141 -4.771 1.00 0.00 C ATOM 1297 CD1 LEU A 79 10.467 1.438 -6.028 1.00 0.00 C ATOM 1298 CD2 LEU A 79 8.987 1.271 -4.027 1.00 0.00 C ATOM 0 H LEU A 79 9.927 4.807 -3.997 1.00 0.00 H new ATOM 0 HA LEU A 79 12.563 4.061 -3.371 1.00 0.00 H new ATOM 0 HB2 LEU A 79 11.862 1.802 -3.856 1.00 0.00 H new ATOM 0 HB3 LEU A 79 10.712 2.643 -2.835 1.00 0.00 H new ATOM 0 HG LEU A 79 9.446 3.044 -5.098 1.00 0.00 H new ATOM 0 HD11 LEU A 79 9.619 1.143 -6.645 1.00 0.00 H new ATOM 0 HD12 LEU A 79 11.107 2.116 -6.592 1.00 0.00 H new ATOM 0 HD13 LEU A 79 11.036 0.552 -5.746 1.00 0.00 H new ATOM 0 HD21 LEU A 79 8.185 0.967 -4.699 1.00 0.00 H new ATOM 0 HD22 LEU A 79 9.501 0.386 -3.652 1.00 0.00 H new ATOM 0 HD23 LEU A 79 8.567 1.829 -3.190 1.00 0.00 H new ATOM 1310 N GLU A 80 11.933 4.305 -6.570 1.00 0.00 N ATOM 1311 CA GLU A 80 12.602 4.297 -7.844 1.00 0.00 C ATOM 1312 C GLU A 80 13.738 5.325 -7.863 1.00 0.00 C ATOM 1313 O GLU A 80 14.852 4.993 -8.232 1.00 0.00 O ATOM 1314 CB GLU A 80 11.628 4.463 -9.051 1.00 0.00 C ATOM 1315 CG GLU A 80 11.088 5.869 -9.299 1.00 0.00 C ATOM 1316 CD GLU A 80 10.087 5.942 -10.446 1.00 0.00 C ATOM 1317 OE1 GLU A 80 10.500 5.743 -11.605 1.00 0.00 O ATOM 1318 OE2 GLU A 80 8.887 6.265 -10.225 1.00 0.00 O ATOM 0 H GLU A 80 10.964 4.622 -6.589 1.00 0.00 H new ATOM 0 HA GLU A 80 13.042 3.308 -7.969 1.00 0.00 H new ATOM 0 HB2 GLU A 80 12.142 4.130 -9.953 1.00 0.00 H new ATOM 0 HB3 GLU A 80 10.781 3.793 -8.901 1.00 0.00 H new ATOM 0 HG2 GLU A 80 10.612 6.233 -8.388 1.00 0.00 H new ATOM 0 HG3 GLU A 80 11.922 6.538 -9.512 1.00 0.00 H new ATOM 1325 N GLU A 81 13.483 6.541 -7.362 1.00 0.00 N ATOM 1326 CA GLU A 81 14.498 7.585 -7.387 1.00 0.00 C ATOM 1327 C GLU A 81 15.634 7.288 -6.405 1.00 0.00 C ATOM 1328 O GLU A 81 16.812 7.417 -6.763 1.00 0.00 O ATOM 1329 CB GLU A 81 13.904 8.994 -7.144 1.00 0.00 C ATOM 1330 CG GLU A 81 13.239 9.184 -5.790 1.00 0.00 C ATOM 1331 CD GLU A 81 12.712 10.569 -5.571 1.00 0.00 C ATOM 1332 OE1 GLU A 81 13.469 11.439 -5.078 1.00 0.00 O ATOM 1333 OE2 GLU A 81 11.525 10.825 -5.851 1.00 0.00 O ATOM 0 H GLU A 81 12.595 6.817 -6.942 1.00 0.00 H new ATOM 0 HA GLU A 81 14.916 7.586 -8.394 1.00 0.00 H new ATOM 0 HB2 GLU A 81 14.700 9.731 -7.248 1.00 0.00 H new ATOM 0 HB3 GLU A 81 13.172 9.203 -7.924 1.00 0.00 H new ATOM 0 HG2 GLU A 81 12.419 8.473 -5.694 1.00 0.00 H new ATOM 0 HG3 GLU A 81 13.958 8.949 -5.005 1.00 0.00 H new ATOM 1340 N LYS A 82 15.285 6.839 -5.190 1.00 0.00 N ATOM 1341 CA LYS A 82 16.279 6.579 -4.153 1.00 0.00 C ATOM 1342 C LYS A 82 17.256 5.502 -4.541 1.00 0.00 C ATOM 1343 O LYS A 82 18.470 5.680 -4.381 1.00 0.00 O ATOM 1344 CB LYS A 82 15.646 6.282 -2.780 1.00 0.00 C ATOM 1345 CG LYS A 82 14.639 5.150 -2.792 1.00 0.00 C ATOM 1346 CD LYS A 82 14.983 4.005 -1.877 1.00 0.00 C ATOM 1347 CE LYS A 82 15.007 4.430 -0.439 1.00 0.00 C ATOM 1348 NZ LYS A 82 13.739 5.069 0.002 1.00 0.00 N ATOM 0 H LYS A 82 14.323 6.651 -4.908 1.00 0.00 H new ATOM 0 HA LYS A 82 16.842 7.507 -4.055 1.00 0.00 H new ATOM 0 HB2 LYS A 82 16.439 6.041 -2.072 1.00 0.00 H new ATOM 0 HB3 LYS A 82 15.156 7.185 -2.415 1.00 0.00 H new ATOM 0 HG2 LYS A 82 13.663 5.545 -2.510 1.00 0.00 H new ATOM 0 HG3 LYS A 82 14.548 4.771 -3.810 1.00 0.00 H new ATOM 0 HD2 LYS A 82 14.255 3.204 -2.007 1.00 0.00 H new ATOM 0 HD3 LYS A 82 15.956 3.599 -2.153 1.00 0.00 H new ATOM 0 HE2 LYS A 82 15.205 3.560 0.187 1.00 0.00 H new ATOM 0 HE3 LYS A 82 15.831 5.127 -0.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 13.626 4.944 1.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 13.766 6.084 -0.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 12.937 4.627 -0.491 1.00 0.00 H new ATOM 1362 N ARG A 83 16.747 4.404 -5.064 1.00 0.00 N ATOM 1363 CA ARG A 83 17.589 3.306 -5.421 1.00 0.00 C ATOM 1364 C ARG A 83 18.327 3.596 -6.744 1.00 0.00 C ATOM 1365 O ARG A 83 19.476 3.186 -6.923 1.00 0.00 O ATOM 1366 CB ARG A 83 16.780 2.001 -5.502 1.00 0.00 C ATOM 1367 CG ARG A 83 17.663 0.773 -5.707 1.00 0.00 C ATOM 1368 CD ARG A 83 16.897 -0.445 -6.191 1.00 0.00 C ATOM 1369 NE ARG A 83 15.875 -0.941 -5.271 1.00 0.00 N ATOM 1370 CZ ARG A 83 15.168 -2.069 -5.452 1.00 0.00 C ATOM 1371 NH1 ARG A 83 15.360 -2.817 -6.534 1.00 0.00 N ATOM 1372 NH2 ARG A 83 14.272 -2.424 -4.552 1.00 0.00 N ATOM 0 H ARG A 83 15.754 4.259 -5.247 1.00 0.00 H new ATOM 0 HA ARG A 83 18.340 3.179 -4.642 1.00 0.00 H new ATOM 0 HB2 ARG A 83 16.202 1.879 -4.586 1.00 0.00 H new ATOM 0 HB3 ARG A 83 16.066 2.071 -6.323 1.00 0.00 H new ATOM 0 HG2 ARG A 83 18.444 1.012 -6.429 1.00 0.00 H new ATOM 0 HG3 ARG A 83 18.160 0.531 -4.768 1.00 0.00 H new ATOM 0 HD2 ARG A 83 16.421 -0.202 -7.141 1.00 0.00 H new ATOM 0 HD3 ARG A 83 17.608 -1.248 -6.387 1.00 0.00 H new ATOM 0 HE ARG A 83 15.685 -0.392 -4.433 1.00 0.00 H new ATOM 0 HH11 ARG A 83 16.048 -2.536 -7.233 1.00 0.00 H new ATOM 0 HH12 ARG A 83 14.820 -3.672 -6.665 1.00 0.00 H new ATOM 0 HH21 ARG A 83 14.120 -1.844 -3.727 1.00 0.00 H new ATOM 0 HH22 ARG A 83 13.731 -3.279 -4.681 1.00 0.00 H new ATOM 1649 N LEU B 114 11.238 2.736 3.723 1.00 0.00 N ATOM 1650 CA LEU B 114 11.160 2.128 2.436 1.00 0.00 C ATOM 1651 C LEU B 114 12.513 1.606 1.982 1.00 0.00 C ATOM 1652 O LEU B 114 12.560 0.691 1.234 1.00 0.00 O ATOM 1653 CB LEU B 114 10.537 3.087 1.426 1.00 0.00 C ATOM 1654 CG LEU B 114 10.243 2.547 0.018 1.00 0.00 C ATOM 1655 CD1 LEU B 114 9.403 1.275 0.076 1.00 0.00 C ATOM 1656 CD2 LEU B 114 9.505 3.602 -0.770 1.00 0.00 C ATOM 0 HA LEU B 114 10.505 1.260 2.507 1.00 0.00 H new ATOM 0 HB2 LEU B 114 9.601 3.456 1.846 1.00 0.00 H new ATOM 0 HB3 LEU B 114 11.201 3.945 1.324 1.00 0.00 H new ATOM 0 HG LEU B 114 11.190 2.305 -0.465 1.00 0.00 H new ATOM 0 HD11 LEU B 114 9.212 0.918 -0.936 1.00 0.00 H new ATOM 0 HD12 LEU B 114 9.940 0.509 0.635 1.00 0.00 H new ATOM 0 HD13 LEU B 114 8.455 1.487 0.570 1.00 0.00 H new ATOM 0 HD21 LEU B 114 9.293 3.226 -1.771 1.00 0.00 H new ATOM 0 HD22 LEU B 114 8.569 3.844 -0.267 1.00 0.00 H new ATOM 0 HD23 LEU B 114 10.120 4.499 -0.842 1.00 0.00 H new ATOM 1668 N LEU B 115 13.618 2.176 2.462 1.00 0.00 N ATOM 1669 CA LEU B 115 14.941 1.622 2.114 1.00 0.00 C ATOM 1670 C LEU B 115 15.150 0.275 2.824 1.00 0.00 C ATOM 1671 O LEU B 115 15.724 -0.674 2.255 1.00 0.00 O ATOM 1672 CB LEU B 115 16.088 2.587 2.449 1.00 0.00 C ATOM 1673 CG LEU B 115 17.490 2.162 1.962 1.00 0.00 C ATOM 1674 CD1 LEU B 115 17.528 2.001 0.433 1.00 0.00 C ATOM 1675 CD2 LEU B 115 18.531 3.172 2.414 1.00 0.00 C ATOM 0 H LEU B 115 13.635 2.993 3.072 1.00 0.00 H new ATOM 0 HA LEU B 115 14.957 1.472 1.034 1.00 0.00 H new ATOM 0 HB2 LEU B 115 15.855 3.561 2.019 1.00 0.00 H new ATOM 0 HB3 LEU B 115 16.124 2.716 3.531 1.00 0.00 H new ATOM 0 HG LEU B 115 17.720 1.193 2.404 1.00 0.00 H new ATOM 0 HD11 LEU B 115 18.529 1.701 0.123 1.00 0.00 H new ATOM 0 HD12 LEU B 115 16.811 1.238 0.130 1.00 0.00 H new ATOM 0 HD13 LEU B 115 17.271 2.949 -0.039 1.00 0.00 H new ATOM 0 HD21 LEU B 115 19.515 2.861 2.064 1.00 0.00 H new ATOM 0 HD22 LEU B 115 18.292 4.151 2.000 1.00 0.00 H new ATOM 0 HD23 LEU B 115 18.534 3.229 3.502 1.00 0.00 H new ATOM 1687 N THR B 116 14.640 0.180 4.044 1.00 0.00 N ATOM 1688 CA THR B 116 14.714 -1.046 4.816 1.00 0.00 C ATOM 1689 C THR B 116 13.884 -2.136 4.100 1.00 0.00 C ATOM 1690 O THR B 116 14.261 -3.316 4.056 1.00 0.00 O ATOM 1691 CB THR B 116 14.187 -0.820 6.262 1.00 0.00 C ATOM 1692 OG1 THR B 116 14.876 0.296 6.856 1.00 0.00 O ATOM 1693 CG2 THR B 116 14.424 -2.046 7.128 1.00 0.00 C ATOM 0 H THR B 116 14.167 0.947 4.521 1.00 0.00 H new ATOM 0 HA THR B 116 15.753 -1.366 4.890 1.00 0.00 H new ATOM 0 HB THR B 116 13.116 -0.625 6.204 1.00 0.00 H new ATOM 0 HG1 THR B 116 14.543 0.439 7.766 1.00 0.00 H new ATOM 0 HG21 THR B 116 14.046 -1.860 8.133 1.00 0.00 H new ATOM 0 HG22 THR B 116 13.904 -2.902 6.697 1.00 0.00 H new ATOM 0 HG23 THR B 116 15.492 -2.257 7.175 1.00 0.00 H new ATOM 1701 N SER B 117 12.789 -1.713 3.512 1.00 0.00 N ATOM 1702 CA SER B 117 11.933 -2.578 2.733 1.00 0.00 C ATOM 1703 C SER B 117 12.546 -2.857 1.345 1.00 0.00 C ATOM 1704 O SER B 117 12.440 -3.946 0.817 1.00 0.00 O ATOM 1705 CB SER B 117 10.611 -1.886 2.577 1.00 0.00 C ATOM 1706 OG SER B 117 10.108 -1.480 3.839 1.00 0.00 O ATOM 0 H SER B 117 12.464 -0.748 3.562 1.00 0.00 H new ATOM 0 HA SER B 117 11.815 -3.536 3.239 1.00 0.00 H new ATOM 0 HB2 SER B 117 10.723 -1.018 1.928 1.00 0.00 H new ATOM 0 HB3 SER B 117 9.899 -2.555 2.094 1.00 0.00 H new ATOM 0 HG SER B 117 9.547 -2.192 4.212 1.00 0.00 H new ATOM 1712 N ASP B 118 13.193 -1.854 0.793 1.00 0.00 N ATOM 1713 CA ASP B 118 13.857 -1.889 -0.521 1.00 0.00 C ATOM 1714 C ASP B 118 14.895 -2.990 -0.561 1.00 0.00 C ATOM 1715 O ASP B 118 15.046 -3.709 -1.557 1.00 0.00 O ATOM 1716 CB ASP B 118 14.520 -0.534 -0.764 1.00 0.00 C ATOM 1717 CG ASP B 118 15.164 -0.415 -2.096 1.00 0.00 C ATOM 1718 OD1 ASP B 118 14.453 -0.203 -3.076 1.00 0.00 O ATOM 1719 OD2 ASP B 118 16.386 -0.520 -2.182 1.00 0.00 O ATOM 0 H ASP B 118 13.283 -0.949 1.254 1.00 0.00 H new ATOM 0 HA ASP B 118 13.121 -2.091 -1.299 1.00 0.00 H new ATOM 0 HB2 ASP B 118 13.771 0.251 -0.661 1.00 0.00 H new ATOM 0 HB3 ASP B 118 15.269 -0.362 0.009 1.00 0.00 H new ATOM 1958 N MET B 141 -11.063 -2.332 -12.028 1.00 0.00 N ATOM 1959 CA MET B 141 -10.202 -1.267 -11.576 1.00 0.00 C ATOM 1960 C MET B 141 -8.970 -1.139 -12.416 1.00 0.00 C ATOM 1961 O MET B 141 -8.518 -0.051 -12.630 1.00 0.00 O ATOM 1962 CB MET B 141 -9.828 -1.453 -10.104 1.00 0.00 C ATOM 1963 CG MET B 141 -9.110 -2.760 -9.799 1.00 0.00 C ATOM 1964 SD MET B 141 -8.671 -2.943 -8.066 1.00 0.00 S ATOM 1965 CE MET B 141 -10.274 -3.032 -7.293 1.00 0.00 C ATOM 0 HA MET B 141 -10.765 -0.340 -11.681 1.00 0.00 H new ATOM 0 HB2 MET B 141 -9.193 -0.623 -9.795 1.00 0.00 H new ATOM 0 HB3 MET B 141 -10.735 -1.402 -9.502 1.00 0.00 H new ATOM 0 HG2 MET B 141 -9.747 -3.594 -10.095 1.00 0.00 H new ATOM 0 HG3 MET B 141 -8.205 -2.819 -10.404 1.00 0.00 H new ATOM 0 HE1 MET B 141 -10.169 -3.424 -6.281 1.00 0.00 H new ATOM 0 HE2 MET B 141 -10.714 -2.036 -7.252 1.00 0.00 H new ATOM 0 HE3 MET B 141 -10.921 -3.691 -7.872 1.00 0.00 H new ATOM 1975 N GLU B 142 -8.497 -2.267 -12.913 1.00 0.00 N ATOM 1976 CA GLU B 142 -7.227 -2.467 -13.641 1.00 0.00 C ATOM 1977 C GLU B 142 -6.568 -1.182 -14.221 1.00 0.00 C ATOM 1978 O GLU B 142 -5.559 -0.699 -13.684 1.00 0.00 O ATOM 1979 CB GLU B 142 -7.395 -3.535 -14.741 1.00 0.00 C ATOM 1980 CG GLU B 142 -7.840 -4.934 -14.259 1.00 0.00 C ATOM 1981 CD GLU B 142 -9.308 -5.023 -13.834 1.00 0.00 C ATOM 1982 OE1 GLU B 142 -9.635 -4.702 -12.670 1.00 0.00 O ATOM 1983 OE2 GLU B 142 -10.152 -5.428 -14.659 1.00 0.00 O ATOM 0 H GLU B 142 -9.017 -3.139 -12.819 1.00 0.00 H new ATOM 0 HA GLU B 142 -6.527 -2.812 -12.880 1.00 0.00 H new ATOM 0 HB2 GLU B 142 -8.125 -3.172 -15.465 1.00 0.00 H new ATOM 0 HB3 GLU B 142 -6.447 -3.638 -15.269 1.00 0.00 H new ATOM 0 HG2 GLU B 142 -7.662 -5.653 -15.059 1.00 0.00 H new ATOM 0 HG3 GLU B 142 -7.213 -5.231 -13.418 1.00 0.00 H new ATOM 1990 N SER B 143 -7.169 -0.599 -15.244 1.00 0.00 N ATOM 1991 CA SER B 143 -6.569 0.558 -15.912 1.00 0.00 C ATOM 1992 C SER B 143 -6.668 1.819 -15.043 1.00 0.00 C ATOM 1993 O SER B 143 -5.707 2.609 -14.947 1.00 0.00 O ATOM 1994 CB SER B 143 -7.234 0.788 -17.271 1.00 0.00 C ATOM 1995 OG SER B 143 -7.108 -0.363 -18.101 1.00 0.00 O ATOM 0 H SER B 143 -8.063 -0.899 -15.632 1.00 0.00 H new ATOM 0 HA SER B 143 -5.511 0.346 -16.068 1.00 0.00 H new ATOM 0 HB2 SER B 143 -8.288 1.025 -17.129 1.00 0.00 H new ATOM 0 HB3 SER B 143 -6.778 1.647 -17.763 1.00 0.00 H new ATOM 0 HG SER B 143 -7.542 -0.194 -18.963 1.00 0.00 H new ATOM 2001 N ILE B 144 -7.796 1.952 -14.372 1.00 0.00 N ATOM 2002 CA ILE B 144 -8.103 3.094 -13.531 1.00 0.00 C ATOM 2003 C ILE B 144 -7.162 3.134 -12.335 1.00 0.00 C ATOM 2004 O ILE B 144 -6.462 4.129 -12.115 1.00 0.00 O ATOM 2005 CB ILE B 144 -9.575 3.027 -13.035 1.00 0.00 C ATOM 2006 CG1 ILE B 144 -10.536 3.072 -14.233 1.00 0.00 C ATOM 2007 CG2 ILE B 144 -9.880 4.153 -12.043 1.00 0.00 C ATOM 2008 CD1 ILE B 144 -11.993 2.937 -13.870 1.00 0.00 C ATOM 0 H ILE B 144 -8.540 1.255 -14.397 1.00 0.00 H new ATOM 0 HA ILE B 144 -7.971 4.000 -14.123 1.00 0.00 H new ATOM 0 HB ILE B 144 -9.718 2.083 -12.508 1.00 0.00 H new ATOM 0 HG12 ILE B 144 -10.392 4.014 -14.763 1.00 0.00 H new ATOM 0 HG13 ILE B 144 -10.271 2.273 -14.925 1.00 0.00 H new ATOM 0 HG21 ILE B 144 -10.917 4.078 -11.715 1.00 0.00 H new ATOM 0 HG22 ILE B 144 -9.220 4.067 -11.180 1.00 0.00 H new ATOM 0 HG23 ILE B 144 -9.721 5.117 -12.527 1.00 0.00 H new ATOM 0 HD11 ILE B 144 -12.599 2.979 -14.775 1.00 0.00 H new ATOM 0 HD12 ILE B 144 -12.156 1.983 -13.368 1.00 0.00 H new ATOM 0 HD13 ILE B 144 -12.279 3.751 -13.204 1.00 0.00 H new ATOM 2020 N ILE B 145 -7.099 2.032 -11.618 1.00 0.00 N ATOM 2021 CA ILE B 145 -6.292 1.930 -10.425 1.00 0.00 C ATOM 2022 C ILE B 145 -4.813 2.045 -10.780 1.00 0.00 C ATOM 2023 O ILE B 145 -4.031 2.562 -10.007 1.00 0.00 O ATOM 2024 CB ILE B 145 -6.603 0.633 -9.609 1.00 0.00 C ATOM 2025 CG1 ILE B 145 -5.956 0.685 -8.228 1.00 0.00 C ATOM 2026 CG2 ILE B 145 -6.136 -0.616 -10.352 1.00 0.00 C ATOM 2027 CD1 ILE B 145 -6.415 -0.415 -7.302 1.00 0.00 C ATOM 0 H ILE B 145 -7.609 1.179 -11.849 1.00 0.00 H new ATOM 0 HA ILE B 145 -6.550 2.763 -9.771 1.00 0.00 H new ATOM 0 HB ILE B 145 -7.685 0.580 -9.488 1.00 0.00 H new ATOM 0 HG12 ILE B 145 -4.874 0.625 -8.341 1.00 0.00 H new ATOM 0 HG13 ILE B 145 -6.176 1.649 -7.770 1.00 0.00 H new ATOM 0 HG21 ILE B 145 -6.367 -1.500 -9.758 1.00 0.00 H new ATOM 0 HG22 ILE B 145 -6.647 -0.680 -11.313 1.00 0.00 H new ATOM 0 HG23 ILE B 145 -5.060 -0.560 -10.517 1.00 0.00 H new ATOM 0 HD11 ILE B 145 -5.913 -0.314 -6.340 1.00 0.00 H new ATOM 0 HD12 ILE B 145 -7.493 -0.343 -7.158 1.00 0.00 H new ATOM 0 HD13 ILE B 145 -6.171 -1.384 -7.738 1.00 0.00 H new ATOM 2039 N ARG B 146 -4.447 1.576 -11.966 1.00 0.00 N ATOM 2040 CA ARG B 146 -3.097 1.747 -12.458 1.00 0.00 C ATOM 2041 C ARG B 146 -2.753 3.242 -12.562 1.00 0.00 C ATOM 2042 O ARG B 146 -1.777 3.693 -11.984 1.00 0.00 O ATOM 2043 CB ARG B 146 -2.927 1.021 -13.795 1.00 0.00 C ATOM 2044 CG ARG B 146 -1.560 1.151 -14.445 1.00 0.00 C ATOM 2045 CD ARG B 146 -1.429 0.166 -15.595 1.00 0.00 C ATOM 2046 NE ARG B 146 -1.509 -1.231 -15.113 1.00 0.00 N ATOM 2047 CZ ARG B 146 -2.137 -2.246 -15.716 1.00 0.00 C ATOM 2048 NH1 ARG B 146 -2.786 -2.071 -16.868 1.00 0.00 N ATOM 2049 NH2 ARG B 146 -2.115 -3.439 -15.143 1.00 0.00 N ATOM 0 H ARG B 146 -5.069 1.075 -12.600 1.00 0.00 H new ATOM 0 HA ARG B 146 -2.395 1.301 -11.753 1.00 0.00 H new ATOM 0 HB2 ARG B 146 -3.137 -0.038 -13.642 1.00 0.00 H new ATOM 0 HB3 ARG B 146 -3.677 1.398 -14.490 1.00 0.00 H new ATOM 0 HG2 ARG B 146 -1.418 2.168 -14.810 1.00 0.00 H new ATOM 0 HG3 ARG B 146 -0.779 0.966 -13.707 1.00 0.00 H new ATOM 0 HD2 ARG B 146 -2.218 0.348 -16.325 1.00 0.00 H new ATOM 0 HD3 ARG B 146 -0.479 0.324 -16.106 1.00 0.00 H new ATOM 0 HE ARG B 146 -1.038 -1.441 -14.233 1.00 0.00 H new ATOM 0 HH11 ARG B 146 -2.810 -1.150 -17.305 1.00 0.00 H new ATOM 0 HH12 ARG B 146 -3.259 -2.858 -17.312 1.00 0.00 H new ATOM 0 HH21 ARG B 146 -1.625 -3.571 -14.258 1.00 0.00 H new ATOM 0 HH22 ARG B 146 -2.588 -4.227 -15.586 1.00 0.00 H new ATOM 2063 N SER B 147 -3.608 4.005 -13.215 1.00 0.00 N ATOM 2064 CA SER B 147 -3.366 5.423 -13.393 1.00 0.00 C ATOM 2065 C SER B 147 -3.477 6.233 -12.080 1.00 0.00 C ATOM 2066 O SER B 147 -2.692 7.154 -11.838 1.00 0.00 O ATOM 2067 CB SER B 147 -4.285 5.984 -14.486 1.00 0.00 C ATOM 2068 OG SER B 147 -5.647 5.590 -14.292 1.00 0.00 O ATOM 0 H SER B 147 -4.476 3.667 -13.631 1.00 0.00 H new ATOM 0 HA SER B 147 -2.330 5.533 -13.714 1.00 0.00 H new ATOM 0 HB2 SER B 147 -4.219 7.072 -14.492 1.00 0.00 H new ATOM 0 HB3 SER B 147 -3.942 5.638 -15.461 1.00 0.00 H new ATOM 0 HG SER B 147 -5.745 5.176 -13.409 1.00 0.00 H new ATOM 2074 N GLU B 148 -4.439 5.884 -11.256 1.00 0.00 N ATOM 2075 CA GLU B 148 -4.704 6.604 -10.024 1.00 0.00 C ATOM 2076 C GLU B 148 -3.764 6.203 -8.891 1.00 0.00 C ATOM 2077 O GLU B 148 -3.106 7.048 -8.273 1.00 0.00 O ATOM 2078 CB GLU B 148 -6.147 6.376 -9.597 1.00 0.00 C ATOM 2079 CG GLU B 148 -7.172 6.882 -10.593 1.00 0.00 C ATOM 2080 CD GLU B 148 -7.099 8.368 -10.781 1.00 0.00 C ATOM 2081 OE1 GLU B 148 -7.460 9.111 -9.841 1.00 0.00 O ATOM 2082 OE2 GLU B 148 -6.676 8.825 -11.855 1.00 0.00 O ATOM 0 H GLU B 148 -5.062 5.093 -11.418 1.00 0.00 H new ATOM 0 HA GLU B 148 -4.530 7.661 -10.227 1.00 0.00 H new ATOM 0 HB2 GLU B 148 -6.304 5.309 -9.440 1.00 0.00 H new ATOM 0 HB3 GLU B 148 -6.313 6.867 -8.638 1.00 0.00 H new ATOM 0 HG2 GLU B 148 -7.017 6.389 -11.553 1.00 0.00 H new ATOM 0 HG3 GLU B 148 -8.171 6.610 -10.253 1.00 0.00 H new ATOM 2089 N LEU B 149 -3.698 4.925 -8.646 1.00 0.00 N ATOM 2090 CA LEU B 149 -3.002 4.377 -7.505 1.00 0.00 C ATOM 2091 C LEU B 149 -1.598 3.928 -7.834 1.00 0.00 C ATOM 2092 O LEU B 149 -0.789 3.785 -6.938 1.00 0.00 O ATOM 2093 CB LEU B 149 -3.887 3.249 -6.876 1.00 0.00 C ATOM 2094 CG LEU B 149 -3.324 2.409 -5.711 1.00 0.00 C ATOM 2095 CD1 LEU B 149 -4.452 1.874 -4.847 1.00 0.00 C ATOM 2096 CD2 LEU B 149 -2.529 1.232 -6.240 1.00 0.00 C ATOM 0 H LEU B 149 -4.132 4.219 -9.240 1.00 0.00 H new ATOM 0 HA LEU B 149 -2.858 5.161 -6.761 1.00 0.00 H new ATOM 0 HB2 LEU B 149 -4.811 3.712 -6.529 1.00 0.00 H new ATOM 0 HB3 LEU B 149 -4.157 2.560 -7.676 1.00 0.00 H new ATOM 0 HG LEU B 149 -2.678 3.056 -5.118 1.00 0.00 H new ATOM 0 HD11 LEU B 149 -4.036 1.284 -4.030 1.00 0.00 H new ATOM 0 HD12 LEU B 149 -5.024 2.707 -4.438 1.00 0.00 H new ATOM 0 HD13 LEU B 149 -5.107 1.246 -5.451 1.00 0.00 H new ATOM 0 HD21 LEU B 149 -2.140 0.651 -5.404 1.00 0.00 H new ATOM 0 HD22 LEU B 149 -3.175 0.601 -6.851 1.00 0.00 H new ATOM 0 HD23 LEU B 149 -1.700 1.596 -6.846 1.00 0.00 H new