USER MOD reduce.3.24.130724 H: found=0, std=0, add=750, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 748 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 1 MET N :NH3+ -107:sc= 0.0539 (180deg=0) USER MOD Set 1.2: B 35 ASN : amide:sc= 0 K(o=0.054,f=-1.6) USER MOD Set 2.1: B 13 ASN : amide:sc=-0.00382 K(o=-0.0038,f=0.9) USER MOD Set 2.2: B 19 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: B 11 SER OG : rot -95:sc= 0.4 USER MOD Set 3.2: B 21 THR OG1 : rot 180:sc= 0.37 USER MOD Set 4.1: A 35 ASN : amide:sc= 0 K(o=0.047,f=-1.9!) USER MOD Set 4.2: B 1 MET N :NH3+ 129:sc= 0.0468 (180deg=0) USER MOD Set 5.1: A 13 ASN : amide:sc= 0.00632 K(o=0.0063,f=0.95) USER MOD Set 5.2: A 19 THR OG1 : rot 180:sc= 0 USER MOD Set 6.1: A 11 SER OG : rot 107:sc= 0.216 USER MOD Set 6.2: A 21 THR OG1 : rot 180:sc= 0.244 USER MOD Single : A 1 MET CE :methyl -175:sc= -0.186 (180deg=-0.247) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.358 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 GLN : amide:sc= -0.321 K(o=-0.32,f=-1.6) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HD1:sc= -1.19 K(o=-1.2,f=-0.51) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl -177:sc= -0.125 (180deg=-0.154) USER MOD Single : B 5 THR OG1 : rot 180:sc= 0 USER MOD Single : B 7 LYS NZ :NH3+ -161:sc= -0.0458 (180deg=-0.368) USER MOD Single : B 26 SER OG : rot 180:sc= 0 USER MOD Single : B 28 GLN : amide:sc= -0.419 K(o=-0.42,f=-1.8!) USER MOD Single : B 29 GLN : amide:sc= -1.73! C(o=-1.7!,f=-4.6!) USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 HIS : no HD1:sc= -0.128 X(o=-0.13,f=-0.11) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 23.202 -2.303 -6.688 1.00 1.00 N ATOM 2 CA MET A 1 22.192 -1.485 -7.384 1.00 1.00 C ATOM 3 C MET A 1 22.864 -0.475 -8.306 1.00 1.00 C ATOM 4 O MET A 1 23.960 -0.008 -8.010 1.00 1.00 O ATOM 5 CB MET A 1 21.289 -0.777 -6.369 1.00 1.00 C ATOM 6 CG MET A 1 20.165 -0.013 -7.068 1.00 1.00 C ATOM 7 SD MET A 1 18.749 0.392 -6.009 1.00 1.00 S ATOM 8 CE MET A 1 19.566 1.399 -4.746 1.00 1.00 C ATOM 0 H1 MET A 1 23.208 -3.262 -7.089 1.00 1.00 H new ATOM 0 H2 MET A 1 24.141 -1.871 -6.808 1.00 1.00 H new ATOM 0 H3 MET A 1 22.970 -2.353 -5.675 1.00 1.00 H new ATOM 0 HA MET A 1 21.573 -2.142 -7.995 1.00 1.00 H new ATOM 0 HB2 MET A 1 20.863 -1.510 -5.684 1.00 1.00 H new ATOM 0 HB3 MET A 1 21.883 -0.087 -5.769 1.00 1.00 H new ATOM 0 HG2 MET A 1 20.572 0.912 -7.476 1.00 1.00 H new ATOM 0 HG3 MET A 1 19.812 -0.605 -7.912 1.00 1.00 H new ATOM 0 HE1 MET A 1 18.849 1.656 -3.966 1.00 1.00 H new ATOM 0 HE2 MET A 1 20.391 0.836 -4.309 1.00 1.00 H new ATOM 0 HE3 MET A 1 19.950 2.312 -5.201 1.00 1.00 H new ATOM 20 N LEU A 2 22.207 -0.141 -9.421 1.00 1.00 N ATOM 21 CA LEU A 2 22.694 0.855 -10.363 1.00 1.00 C ATOM 22 C LEU A 2 21.785 2.083 -10.289 1.00 1.00 C ATOM 23 O LEU A 2 20.727 2.123 -10.916 1.00 1.00 O ATOM 24 CB LEU A 2 22.724 0.260 -11.778 1.00 1.00 C ATOM 25 CG LEU A 2 23.782 0.886 -12.699 1.00 1.00 C ATOM 26 CD1 LEU A 2 23.318 0.843 -14.147 1.00 1.00 C ATOM 27 CD2 LEU A 2 24.154 2.324 -12.370 1.00 1.00 C ATOM 0 H LEU A 2 21.317 -0.560 -9.691 1.00 1.00 H new ATOM 0 HA LEU A 2 23.711 1.156 -10.111 1.00 1.00 H new ATOM 0 HB2 LEU A 2 22.909 -0.812 -11.706 1.00 1.00 H new ATOM 0 HB3 LEU A 2 21.742 0.384 -12.234 1.00 1.00 H new ATOM 0 HG LEU A 2 24.673 0.280 -12.537 1.00 1.00 H new ATOM 0 HD11 LEU A 2 24.079 1.290 -14.786 1.00 1.00 H new ATOM 0 HD12 LEU A 2 23.155 -0.192 -14.446 1.00 1.00 H new ATOM 0 HD13 LEU A 2 22.387 1.400 -14.247 1.00 1.00 H new ATOM 0 HD21 LEU A 2 24.907 2.676 -13.076 1.00 1.00 H new ATOM 0 HD22 LEU A 2 23.268 2.954 -12.441 1.00 1.00 H new ATOM 0 HD23 LEU A 2 24.554 2.374 -11.357 1.00 1.00 H new ATOM 39 N ILE A 3 22.198 3.090 -9.518 1.00 1.00 N ATOM 40 CA ILE A 3 21.426 4.306 -9.325 1.00 1.00 C ATOM 41 C ILE A 3 21.676 5.259 -10.490 1.00 1.00 C ATOM 42 O ILE A 3 22.773 5.288 -11.043 1.00 1.00 O ATOM 43 CB ILE A 3 21.830 4.970 -8.001 1.00 1.00 C ATOM 44 CG1 ILE A 3 21.456 4.090 -6.800 1.00 1.00 C ATOM 45 CG2 ILE A 3 21.103 6.308 -7.844 1.00 1.00 C ATOM 46 CD1 ILE A 3 22.505 3.022 -6.496 1.00 1.00 C ATOM 0 H ILE A 3 23.082 3.079 -9.010 1.00 1.00 H new ATOM 0 HA ILE A 3 20.364 4.062 -9.287 1.00 1.00 H new ATOM 0 HB ILE A 3 22.910 5.115 -8.026 1.00 1.00 H new ATOM 0 HG12 ILE A 3 21.322 4.721 -5.921 1.00 1.00 H new ATOM 0 HG13 ILE A 3 20.499 3.607 -6.994 1.00 1.00 H new ATOM 0 HG21 ILE A 3 21.395 6.773 -6.902 1.00 1.00 H new ATOM 0 HG22 ILE A 3 21.369 6.966 -8.671 1.00 1.00 H new ATOM 0 HG23 ILE A 3 20.026 6.139 -7.847 1.00 1.00 H new ATOM 0 HD11 ILE A 3 22.185 2.432 -5.637 1.00 1.00 H new ATOM 0 HD12 ILE A 3 22.622 2.370 -7.362 1.00 1.00 H new ATOM 0 HD13 ILE A 3 23.458 3.501 -6.272 1.00 1.00 H new ATOM 58 N LEU A 4 20.657 6.037 -10.860 1.00 1.00 N ATOM 59 CA LEU A 4 20.757 7.058 -11.891 1.00 1.00 C ATOM 60 C LEU A 4 19.886 8.251 -11.494 1.00 1.00 C ATOM 61 O LEU A 4 19.057 8.146 -10.590 1.00 1.00 O ATOM 62 CB LEU A 4 20.273 6.499 -13.236 1.00 1.00 C ATOM 63 CG LEU A 4 21.078 5.299 -13.750 1.00 1.00 C ATOM 64 CD1 LEU A 4 20.395 4.752 -14.999 1.00 1.00 C ATOM 65 CD2 LEU A 4 22.499 5.678 -14.157 1.00 1.00 C ATOM 0 H LEU A 4 19.729 5.970 -10.443 1.00 1.00 H new ATOM 0 HA LEU A 4 21.797 7.370 -11.991 1.00 1.00 H new ATOM 0 HB2 LEU A 4 19.228 6.205 -13.138 1.00 1.00 H new ATOM 0 HB3 LEU A 4 20.312 7.294 -13.981 1.00 1.00 H new ATOM 0 HG LEU A 4 21.123 4.572 -12.939 1.00 1.00 H new ATOM 0 HD11 LEU A 4 20.957 3.897 -15.376 1.00 1.00 H new ATOM 0 HD12 LEU A 4 19.381 4.439 -14.751 1.00 1.00 H new ATOM 0 HD13 LEU A 4 20.359 5.528 -15.763 1.00 1.00 H new ATOM 0 HD21 LEU A 4 23.024 4.792 -14.513 1.00 1.00 H new ATOM 0 HD22 LEU A 4 22.463 6.423 -14.952 1.00 1.00 H new ATOM 0 HD23 LEU A 4 23.026 6.091 -13.297 1.00 1.00 H new ATOM 77 N THR A 5 20.074 9.387 -12.170 1.00 1.00 N ATOM 78 CA THR A 5 19.256 10.576 -11.963 1.00 1.00 C ATOM 79 C THR A 5 18.547 10.890 -13.276 1.00 1.00 C ATOM 80 O THR A 5 18.958 11.773 -14.026 1.00 1.00 O ATOM 81 CB THR A 5 20.114 11.747 -11.471 1.00 1.00 C ATOM 82 OG1 THR A 5 20.834 11.361 -10.320 1.00 1.00 O ATOM 83 CG2 THR A 5 19.251 12.949 -11.099 1.00 1.00 C ATOM 0 H THR A 5 20.800 9.505 -12.877 1.00 1.00 H new ATOM 0 HA THR A 5 18.510 10.400 -11.188 1.00 1.00 H new ATOM 0 HB THR A 5 20.789 12.021 -12.281 1.00 1.00 H new ATOM 0 HG1 THR A 5 21.382 12.112 -10.010 1.00 1.00 H new ATOM 0 HG21 THR A 5 19.889 13.762 -10.754 1.00 1.00 H new ATOM 0 HG22 THR A 5 18.687 13.276 -11.972 1.00 1.00 H new ATOM 0 HG23 THR A 5 18.560 12.668 -10.304 1.00 1.00 H new ATOM 91 N ARG A 6 17.470 10.151 -13.551 1.00 1.00 N ATOM 92 CA ARG A 6 16.737 10.253 -14.807 1.00 1.00 C ATOM 93 C ARG A 6 15.871 11.512 -14.805 1.00 1.00 C ATOM 94 O ARG A 6 15.776 12.188 -13.783 1.00 1.00 O ATOM 95 CB ARG A 6 15.907 8.974 -14.975 1.00 1.00 C ATOM 96 CG ARG A 6 15.388 8.712 -16.394 1.00 1.00 C ATOM 97 CD ARG A 6 16.507 8.404 -17.396 1.00 1.00 C ATOM 98 NE ARG A 6 17.178 9.618 -17.880 1.00 1.00 N ATOM 99 CZ ARG A 6 18.474 9.907 -17.738 1.00 1.00 C ATOM 100 NH1 ARG A 6 19.297 9.086 -17.090 1.00 1.00 N ATOM 101 NH2 ARG A 6 18.948 11.035 -18.254 1.00 1.00 N ATOM 0 H ARG A 6 17.083 9.464 -12.904 1.00 1.00 H new ATOM 0 HA ARG A 6 17.417 10.343 -15.654 1.00 1.00 H new ATOM 0 HB2 ARG A 6 16.514 8.123 -14.665 1.00 1.00 H new ATOM 0 HB3 ARG A 6 15.055 9.022 -14.297 1.00 1.00 H new ATOM 0 HG2 ARG A 6 14.689 7.876 -16.370 1.00 1.00 H new ATOM 0 HG3 ARG A 6 14.831 9.584 -16.737 1.00 1.00 H new ATOM 0 HD2 ARG A 6 17.241 7.750 -16.926 1.00 1.00 H new ATOM 0 HD3 ARG A 6 16.091 7.860 -18.244 1.00 1.00 H new ATOM 0 HE ARG A 6 16.601 10.303 -18.369 1.00 1.00 H new ATOM 0 HH11 ARG A 6 18.941 8.217 -16.691 1.00 1.00 H new ATOM 0 HH12 ARG A 6 20.284 9.325 -16.993 1.00 1.00 H new ATOM 0 HH21 ARG A 6 18.324 11.670 -18.752 1.00 1.00 H new ATOM 0 HH22 ARG A 6 19.936 11.267 -18.152 1.00 1.00 H new ATOM 115 N LYS A 7 15.238 11.837 -15.936 1.00 1.00 N ATOM 116 CA LYS A 7 14.354 12.991 -16.027 1.00 1.00 C ATOM 117 C LYS A 7 12.977 12.550 -16.510 1.00 1.00 C ATOM 118 O LYS A 7 12.857 11.532 -17.188 1.00 1.00 O ATOM 119 CB LYS A 7 14.952 14.050 -16.962 1.00 1.00 C ATOM 120 CG LYS A 7 16.429 14.319 -16.653 1.00 1.00 C ATOM 121 CD LYS A 7 16.905 15.566 -17.402 1.00 1.00 C ATOM 122 CE LYS A 7 18.429 15.669 -17.337 1.00 1.00 C ATOM 123 NZ LYS A 7 18.914 16.896 -18.001 1.00 1.00 N ATOM 0 H LYS A 7 15.326 11.309 -16.805 1.00 1.00 H new ATOM 0 HA LYS A 7 14.247 13.439 -15.039 1.00 1.00 H new ATOM 0 HB2 LYS A 7 14.852 13.719 -17.996 1.00 1.00 H new ATOM 0 HB3 LYS A 7 14.387 14.977 -16.868 1.00 1.00 H new ATOM 0 HG2 LYS A 7 16.565 14.456 -15.580 1.00 1.00 H new ATOM 0 HG3 LYS A 7 17.032 13.459 -16.944 1.00 1.00 H new ATOM 0 HD2 LYS A 7 16.580 15.521 -18.441 1.00 1.00 H new ATOM 0 HD3 LYS A 7 16.454 16.457 -16.965 1.00 1.00 H new ATOM 0 HE2 LYS A 7 18.752 15.665 -16.296 1.00 1.00 H new ATOM 0 HE3 LYS A 7 18.875 14.795 -17.812 1.00 1.00 H new ATOM 0 HZ1 LYS A 7 19.951 16.937 -17.940 1.00 1.00 H new ATOM 0 HZ2 LYS A 7 18.626 16.887 -19.000 1.00 1.00 H new ATOM 0 HZ3 LYS A 7 18.507 17.729 -17.531 1.00 1.00 H new ATOM 137 N VAL A 8 11.939 13.314 -16.165 1.00 1.00 N ATOM 138 CA VAL A 8 10.568 12.992 -16.541 1.00 1.00 C ATOM 139 C VAL A 8 10.449 12.879 -18.058 1.00 1.00 C ATOM 140 O VAL A 8 10.812 13.802 -18.787 1.00 1.00 O ATOM 141 CB VAL A 8 9.627 14.073 -16.003 1.00 1.00 C ATOM 142 CG1 VAL A 8 8.208 13.853 -16.525 1.00 1.00 C ATOM 143 CG2 VAL A 8 9.612 14.032 -14.474 1.00 1.00 C ATOM 0 H VAL A 8 12.028 14.171 -15.618 1.00 1.00 H new ATOM 0 HA VAL A 8 10.289 12.032 -16.108 1.00 1.00 H new ATOM 0 HB VAL A 8 9.986 15.045 -16.343 1.00 1.00 H new ATOM 0 HG11 VAL A 8 7.552 14.630 -16.133 1.00 1.00 H new ATOM 0 HG12 VAL A 8 8.210 13.895 -17.614 1.00 1.00 H new ATOM 0 HG13 VAL A 8 7.848 12.877 -16.201 1.00 1.00 H new ATOM 0 HG21 VAL A 8 8.941 14.803 -14.096 1.00 1.00 H new ATOM 0 HG22 VAL A 8 9.266 13.054 -14.140 1.00 1.00 H new ATOM 0 HG23 VAL A 8 10.619 14.210 -14.095 1.00 1.00 H new ATOM 153 N GLY A 9 9.937 11.738 -18.526 1.00 1.00 N ATOM 154 CA GLY A 9 9.696 11.485 -19.938 1.00 1.00 C ATOM 155 C GLY A 9 10.820 10.676 -20.585 1.00 1.00 C ATOM 156 O GLY A 9 10.666 10.207 -21.710 1.00 1.00 O ATOM 0 H GLY A 9 9.677 10.958 -17.923 1.00 1.00 H new ATOM 0 HA2 GLY A 9 8.754 10.949 -20.053 1.00 1.00 H new ATOM 0 HA3 GLY A 9 9.588 12.435 -20.461 1.00 1.00 H new ATOM 160 N GLU A 10 11.947 10.511 -19.884 1.00 1.00 N ATOM 161 CA GLU A 10 13.047 9.684 -20.360 1.00 1.00 C ATOM 162 C GLU A 10 12.841 8.246 -19.879 1.00 1.00 C ATOM 163 O GLU A 10 11.859 7.957 -19.194 1.00 1.00 O ATOM 164 CB GLU A 10 14.377 10.264 -19.877 1.00 1.00 C ATOM 165 CG GLU A 10 14.564 11.676 -20.439 1.00 1.00 C ATOM 166 CD GLU A 10 15.977 12.198 -20.195 1.00 1.00 C ATOM 167 OE1 GLU A 10 16.498 11.962 -19.082 1.00 1.00 O ATOM 168 OE2 GLU A 10 16.528 12.829 -21.124 1.00 1.00 O ATOM 0 H GLU A 10 12.116 10.946 -18.977 1.00 1.00 H new ATOM 0 HA GLU A 10 13.070 9.675 -21.450 1.00 1.00 H new ATOM 0 HB2 GLU A 10 14.398 10.291 -18.788 1.00 1.00 H new ATOM 0 HB3 GLU A 10 15.200 9.624 -20.196 1.00 1.00 H new ATOM 0 HG2 GLU A 10 14.357 11.672 -21.509 1.00 1.00 H new ATOM 0 HG3 GLU A 10 13.842 12.350 -19.977 1.00 1.00 H new ATOM 175 N SER A 11 13.753 7.334 -20.228 1.00 1.00 N ATOM 176 CA SER A 11 13.576 5.936 -19.865 1.00 1.00 C ATOM 177 C SER A 11 14.880 5.235 -19.516 1.00 1.00 C ATOM 178 O SER A 11 15.969 5.800 -19.615 1.00 1.00 O ATOM 179 CB SER A 11 12.892 5.209 -21.020 1.00 1.00 C ATOM 180 OG SER A 11 12.441 3.932 -20.627 1.00 1.00 O ATOM 0 H SER A 11 14.604 7.538 -20.752 1.00 1.00 H new ATOM 0 HA SER A 11 12.961 5.909 -18.965 1.00 1.00 H new ATOM 0 HB2 SER A 11 12.049 5.801 -21.377 1.00 1.00 H new ATOM 0 HB3 SER A 11 13.588 5.111 -21.853 1.00 1.00 H new ATOM 0 HG SER A 11 11.464 3.940 -20.547 1.00 1.00 H new ATOM 186 N ILE A 12 14.728 3.978 -19.103 1.00 1.00 N ATOM 187 CA ILE A 12 15.779 3.073 -18.686 1.00 1.00 C ATOM 188 C ILE A 12 15.515 1.719 -19.350 1.00 1.00 C ATOM 189 O ILE A 12 14.396 1.464 -19.791 1.00 1.00 O ATOM 190 CB ILE A 12 15.710 2.952 -17.159 1.00 1.00 C ATOM 191 CG1 ILE A 12 15.872 4.293 -16.429 1.00 1.00 C ATOM 192 CG2 ILE A 12 16.744 1.955 -16.653 1.00 1.00 C ATOM 193 CD1 ILE A 12 17.247 4.919 -16.643 1.00 1.00 C ATOM 0 H ILE A 12 13.806 3.544 -19.050 1.00 1.00 H new ATOM 0 HA ILE A 12 16.769 3.428 -18.974 1.00 1.00 H new ATOM 0 HB ILE A 12 14.707 2.592 -16.931 1.00 1.00 H new ATOM 0 HG12 ILE A 12 15.105 4.985 -16.775 1.00 1.00 H new ATOM 0 HG13 ILE A 12 15.708 4.143 -15.362 1.00 1.00 H new ATOM 0 HG21 ILE A 12 16.679 1.883 -15.567 1.00 1.00 H new ATOM 0 HG22 ILE A 12 16.552 0.977 -17.093 1.00 1.00 H new ATOM 0 HG23 ILE A 12 17.742 2.291 -16.936 1.00 1.00 H new ATOM 0 HD11 ILE A 12 17.304 5.865 -16.104 1.00 1.00 H new ATOM 0 HD12 ILE A 12 18.017 4.242 -16.272 1.00 1.00 H new ATOM 0 HD13 ILE A 12 17.404 5.098 -17.707 1.00 1.00 H new ATOM 205 N ASN A 13 16.522 0.845 -19.429 1.00 1.00 N ATOM 206 CA ASN A 13 16.346 -0.480 -20.005 1.00 1.00 C ATOM 207 C ASN A 13 17.007 -1.542 -19.134 1.00 1.00 C ATOM 208 O ASN A 13 17.934 -1.252 -18.380 1.00 1.00 O ATOM 209 CB ASN A 13 16.933 -0.509 -21.416 1.00 1.00 C ATOM 210 CG ASN A 13 16.117 0.346 -22.373 1.00 1.00 C ATOM 211 OD1 ASN A 13 16.544 1.424 -22.776 1.00 1.00 O ATOM 212 ND2 ASN A 13 14.935 -0.138 -22.744 1.00 1.00 N ATOM 0 H ASN A 13 17.468 1.037 -19.099 1.00 1.00 H new ATOM 0 HA ASN A 13 15.280 -0.701 -20.055 1.00 1.00 H new ATOM 0 HB2 ASN A 13 17.962 -0.150 -21.391 1.00 1.00 H new ATOM 0 HB3 ASN A 13 16.963 -1.537 -21.778 1.00 1.00 H new ATOM 0 HD21 ASN A 13 14.346 0.391 -23.387 1.00 1.00 H new ATOM 0 HD22 ASN A 13 14.617 -1.039 -22.386 1.00 1.00 H new ATOM 219 N ILE A 14 16.513 -2.779 -19.248 1.00 1.00 N ATOM 220 CA ILE A 14 17.033 -3.927 -18.522 1.00 1.00 C ATOM 221 C ILE A 14 17.006 -5.140 -19.449 1.00 1.00 C ATOM 222 O ILE A 14 16.143 -5.242 -20.322 1.00 1.00 O ATOM 223 CB ILE A 14 16.196 -4.177 -17.255 1.00 1.00 C ATOM 224 CG1 ILE A 14 16.186 -2.933 -16.355 1.00 1.00 C ATOM 225 CG2 ILE A 14 16.758 -5.376 -16.481 1.00 1.00 C ATOM 226 CD1 ILE A 14 15.298 -3.119 -15.124 1.00 1.00 C ATOM 0 H ILE A 14 15.728 -3.007 -19.858 1.00 1.00 H new ATOM 0 HA ILE A 14 18.059 -3.740 -18.206 1.00 1.00 H new ATOM 0 HB ILE A 14 15.172 -4.393 -17.558 1.00 1.00 H new ATOM 0 HG12 ILE A 14 17.204 -2.709 -16.036 1.00 1.00 H new ATOM 0 HG13 ILE A 14 15.835 -2.075 -16.928 1.00 1.00 H new ATOM 0 HG21 ILE A 14 16.159 -5.545 -15.586 1.00 1.00 H new ATOM 0 HG22 ILE A 14 16.726 -6.264 -17.112 1.00 1.00 H new ATOM 0 HG23 ILE A 14 17.790 -5.173 -16.194 1.00 1.00 H new ATOM 0 HD11 ILE A 14 15.322 -2.214 -14.518 1.00 1.00 H new ATOM 0 HD12 ILE A 14 14.274 -3.316 -15.441 1.00 1.00 H new ATOM 0 HD13 ILE A 14 15.664 -3.960 -14.535 1.00 1.00 H new ATOM 238 N GLY A 15 17.955 -6.062 -19.258 1.00 1.00 N ATOM 239 CA GLY A 15 18.070 -7.261 -20.072 1.00 1.00 C ATOM 240 C GLY A 15 18.173 -6.897 -21.549 1.00 1.00 C ATOM 241 O GLY A 15 19.088 -6.181 -21.953 1.00 1.00 O ATOM 0 H GLY A 15 18.665 -5.991 -18.529 1.00 1.00 H new ATOM 0 HA2 GLY A 15 18.949 -7.830 -19.770 1.00 1.00 H new ATOM 0 HA3 GLY A 15 17.204 -7.902 -19.909 1.00 1.00 H new ATOM 245 N ASP A 16 17.228 -7.393 -22.351 1.00 1.00 N ATOM 246 CA ASP A 16 17.158 -7.105 -23.777 1.00 1.00 C ATOM 247 C ASP A 16 15.703 -6.932 -24.230 1.00 1.00 C ATOM 248 O ASP A 16 15.441 -6.750 -25.417 1.00 1.00 O ATOM 249 CB ASP A 16 17.853 -8.236 -24.538 1.00 1.00 C ATOM 250 CG ASP A 16 17.985 -7.932 -26.029 1.00 1.00 C ATOM 251 OD1 ASP A 16 18.500 -6.839 -26.353 1.00 1.00 O ATOM 252 OD2 ASP A 16 17.572 -8.797 -26.833 1.00 1.00 O ATOM 0 H ASP A 16 16.486 -8.010 -22.022 1.00 1.00 H new ATOM 0 HA ASP A 16 17.667 -6.165 -23.990 1.00 1.00 H new ATOM 0 HB2 ASP A 16 18.843 -8.402 -24.114 1.00 1.00 H new ATOM 0 HB3 ASP A 16 17.290 -9.160 -24.406 1.00 1.00 H new ATOM 257 N ASP A 17 14.754 -6.990 -23.288 1.00 1.00 N ATOM 258 CA ASP A 17 13.330 -6.949 -23.595 1.00 1.00 C ATOM 259 C ASP A 17 12.542 -6.091 -22.604 1.00 1.00 C ATOM 260 O ASP A 17 11.316 -6.035 -22.695 1.00 1.00 O ATOM 261 CB ASP A 17 12.776 -8.376 -23.592 1.00 1.00 C ATOM 262 CG ASP A 17 13.410 -9.235 -24.683 1.00 1.00 C ATOM 263 OD1 ASP A 17 12.974 -9.102 -25.849 1.00 1.00 O ATOM 264 OD2 ASP A 17 14.323 -10.019 -24.343 1.00 1.00 O ATOM 0 H ASP A 17 14.958 -7.067 -22.292 1.00 1.00 H new ATOM 0 HA ASP A 17 13.216 -6.493 -24.578 1.00 1.00 H new ATOM 0 HB2 ASP A 17 12.956 -8.833 -22.619 1.00 1.00 H new ATOM 0 HB3 ASP A 17 11.696 -8.346 -23.735 1.00 1.00 H new ATOM 269 N ILE A 18 13.215 -5.421 -21.659 1.00 1.00 N ATOM 270 CA ILE A 18 12.522 -4.676 -20.616 1.00 1.00 C ATOM 271 C ILE A 18 12.872 -3.190 -20.684 1.00 1.00 C ATOM 272 O ILE A 18 14.004 -2.824 -21.003 1.00 1.00 O ATOM 273 CB ILE A 18 12.870 -5.286 -19.251 1.00 1.00 C ATOM 274 CG1 ILE A 18 12.426 -6.755 -19.216 1.00 1.00 C ATOM 275 CG2 ILE A 18 12.194 -4.502 -18.120 1.00 1.00 C ATOM 276 CD1 ILE A 18 12.915 -7.471 -17.957 1.00 1.00 C ATOM 0 H ILE A 18 14.233 -5.383 -21.601 1.00 1.00 H new ATOM 0 HA ILE A 18 11.445 -4.750 -20.765 1.00 1.00 H new ATOM 0 HB ILE A 18 13.949 -5.232 -19.106 1.00 1.00 H new ATOM 0 HG12 ILE A 18 11.338 -6.806 -19.263 1.00 1.00 H new ATOM 0 HG13 ILE A 18 12.808 -7.270 -20.097 1.00 1.00 H new ATOM 0 HG21 ILE A 18 12.453 -4.950 -17.161 1.00 1.00 H new ATOM 0 HG22 ILE A 18 12.535 -3.467 -18.141 1.00 1.00 H new ATOM 0 HG23 ILE A 18 11.113 -4.531 -18.253 1.00 1.00 H new ATOM 0 HD11 ILE A 18 12.578 -8.507 -17.974 1.00 1.00 H new ATOM 0 HD12 ILE A 18 14.004 -7.444 -17.923 1.00 1.00 H new ATOM 0 HD13 ILE A 18 12.512 -6.973 -17.075 1.00 1.00 H new ATOM 288 N THR A 19 11.889 -2.336 -20.382 1.00 1.00 N ATOM 289 CA THR A 19 12.047 -0.890 -20.390 1.00 1.00 C ATOM 290 C THR A 19 11.334 -0.299 -19.179 1.00 1.00 C ATOM 291 O THR A 19 10.233 -0.729 -18.843 1.00 1.00 O ATOM 292 CB THR A 19 11.453 -0.330 -21.685 1.00 1.00 C ATOM 293 OG1 THR A 19 12.058 -0.948 -22.800 1.00 1.00 O ATOM 294 CG2 THR A 19 11.659 1.177 -21.792 1.00 1.00 C ATOM 0 H THR A 19 10.951 -2.640 -20.122 1.00 1.00 H new ATOM 0 HA THR A 19 13.103 -0.626 -20.340 1.00 1.00 H new ATOM 0 HB THR A 19 10.383 -0.537 -21.669 1.00 1.00 H new ATOM 0 HG1 THR A 19 11.672 -0.585 -23.624 1.00 1.00 H new ATOM 0 HG21 THR A 19 11.224 1.538 -22.724 1.00 1.00 H new ATOM 0 HG22 THR A 19 11.174 1.671 -20.950 1.00 1.00 H new ATOM 0 HG23 THR A 19 12.726 1.400 -21.779 1.00 1.00 H new ATOM 302 N ILE A 20 11.960 0.683 -18.526 1.00 1.00 N ATOM 303 CA ILE A 20 11.445 1.292 -17.305 1.00 1.00 C ATOM 304 C ILE A 20 11.397 2.808 -17.485 1.00 1.00 C ATOM 305 O ILE A 20 12.378 3.504 -17.232 1.00 1.00 O ATOM 306 CB ILE A 20 12.308 0.908 -16.092 1.00 1.00 C ATOM 307 CG1 ILE A 20 12.694 -0.577 -16.046 1.00 1.00 C ATOM 308 CG2 ILE A 20 11.578 1.313 -14.809 1.00 1.00 C ATOM 309 CD1 ILE A 20 11.501 -1.513 -15.872 1.00 1.00 C ATOM 0 H ILE A 20 12.847 1.079 -18.836 1.00 1.00 H new ATOM 0 HA ILE A 20 10.438 0.921 -17.116 1.00 1.00 H new ATOM 0 HB ILE A 20 13.249 1.450 -16.187 1.00 1.00 H new ATOM 0 HG12 ILE A 20 13.218 -0.836 -16.966 1.00 1.00 H new ATOM 0 HG13 ILE A 20 13.393 -0.737 -15.225 1.00 1.00 H new ATOM 0 HG21 ILE A 20 12.185 1.043 -13.945 1.00 1.00 H new ATOM 0 HG22 ILE A 20 11.408 2.390 -14.811 1.00 1.00 H new ATOM 0 HG23 ILE A 20 10.621 0.795 -14.756 1.00 1.00 H new ATOM 0 HD11 ILE A 20 11.849 -2.546 -15.848 1.00 1.00 H new ATOM 0 HD12 ILE A 20 10.990 -1.281 -14.938 1.00 1.00 H new ATOM 0 HD13 ILE A 20 10.811 -1.382 -16.706 1.00 1.00 H new ATOM 321 N THR A 21 10.249 3.325 -17.926 1.00 1.00 N ATOM 322 CA THR A 21 10.083 4.750 -18.181 1.00 1.00 C ATOM 323 C THR A 21 9.691 5.483 -16.899 1.00 1.00 C ATOM 324 O THR A 21 9.137 4.883 -15.978 1.00 1.00 O ATOM 325 CB THR A 21 9.011 4.927 -19.262 1.00 1.00 C ATOM 326 OG1 THR A 21 9.356 4.132 -20.375 1.00 1.00 O ATOM 327 CG2 THR A 21 8.901 6.374 -19.739 1.00 1.00 C ATOM 0 H THR A 21 9.415 2.769 -18.114 1.00 1.00 H new ATOM 0 HA THR A 21 11.024 5.178 -18.526 1.00 1.00 H new ATOM 0 HB THR A 21 8.055 4.633 -18.828 1.00 1.00 H new ATOM 0 HG1 THR A 21 8.677 4.235 -21.074 1.00 1.00 H new ATOM 0 HG21 THR A 21 8.128 6.447 -20.504 1.00 1.00 H new ATOM 0 HG22 THR A 21 8.640 7.016 -18.897 1.00 1.00 H new ATOM 0 HG23 THR A 21 9.856 6.693 -20.156 1.00 1.00 H new ATOM 335 N ILE A 22 9.978 6.788 -16.840 1.00 1.00 N ATOM 336 CA ILE A 22 9.584 7.656 -15.740 1.00 1.00 C ATOM 337 C ILE A 22 8.545 8.633 -16.279 1.00 1.00 C ATOM 338 O ILE A 22 8.877 9.649 -16.886 1.00 1.00 O ATOM 339 CB ILE A 22 10.816 8.328 -15.110 1.00 1.00 C ATOM 340 CG1 ILE A 22 10.438 9.457 -14.145 1.00 1.00 C ATOM 341 CG2 ILE A 22 11.775 8.885 -16.162 1.00 1.00 C ATOM 342 CD1 ILE A 22 9.593 8.941 -12.983 1.00 1.00 C ATOM 0 H ILE A 22 10.499 7.273 -17.571 1.00 1.00 H new ATOM 0 HA ILE A 22 9.129 7.095 -14.924 1.00 1.00 H new ATOM 0 HB ILE A 22 11.317 7.537 -14.552 1.00 1.00 H new ATOM 0 HG12 ILE A 22 11.343 9.925 -13.758 1.00 1.00 H new ATOM 0 HG13 ILE A 22 9.886 10.228 -14.683 1.00 1.00 H new ATOM 0 HG21 ILE A 22 12.628 9.349 -15.667 1.00 1.00 H new ATOM 0 HG22 ILE A 22 12.124 8.075 -16.802 1.00 1.00 H new ATOM 0 HG23 ILE A 22 11.258 9.629 -16.768 1.00 1.00 H new ATOM 0 HD11 ILE A 22 9.343 9.769 -12.319 1.00 1.00 H new ATOM 0 HD12 ILE A 22 8.676 8.496 -13.369 1.00 1.00 H new ATOM 0 HD13 ILE A 22 10.156 8.189 -12.430 1.00 1.00 H new ATOM 354 N LEU A 23 7.266 8.317 -16.056 1.00 1.00 N ATOM 355 CA LEU A 23 6.172 9.054 -16.663 1.00 1.00 C ATOM 356 C LEU A 23 6.038 10.436 -16.033 1.00 1.00 C ATOM 357 O LEU A 23 5.580 11.368 -16.691 1.00 1.00 O ATOM 358 CB LEU A 23 4.856 8.289 -16.486 1.00 1.00 C ATOM 359 CG LEU A 23 4.987 6.768 -16.617 1.00 1.00 C ATOM 360 CD1 LEU A 23 3.607 6.148 -16.413 1.00 1.00 C ATOM 361 CD2 LEU A 23 5.524 6.352 -17.983 1.00 1.00 C ATOM 0 H LEU A 23 6.969 7.549 -15.454 1.00 1.00 H new ATOM 0 HA LEU A 23 6.389 9.167 -17.725 1.00 1.00 H new ATOM 0 HB2 LEU A 23 4.443 8.523 -15.505 1.00 1.00 H new ATOM 0 HB3 LEU A 23 4.140 8.645 -17.227 1.00 1.00 H new ATOM 0 HG LEU A 23 5.695 6.419 -15.866 1.00 1.00 H new ATOM 0 HD11 LEU A 23 3.678 5.064 -16.502 1.00 1.00 H new ATOM 0 HD12 LEU A 23 3.235 6.407 -15.422 1.00 1.00 H new ATOM 0 HD13 LEU A 23 2.921 6.530 -17.169 1.00 1.00 H new ATOM 0 HD21 LEU A 23 5.600 5.266 -18.029 1.00 1.00 H new ATOM 0 HD22 LEU A 23 4.847 6.702 -18.762 1.00 1.00 H new ATOM 0 HD23 LEU A 23 6.510 6.791 -18.135 1.00 1.00 H new ATOM 373 N GLY A 24 6.436 10.575 -14.762 1.00 1.00 N ATOM 374 CA GLY A 24 6.407 11.873 -14.109 1.00 1.00 C ATOM 375 C GLY A 24 6.353 11.777 -12.590 1.00 1.00 C ATOM 376 O GLY A 24 6.457 10.694 -12.018 1.00 1.00 O ATOM 0 H GLY A 24 6.776 9.811 -14.179 1.00 1.00 H new ATOM 0 HA2 GLY A 24 7.292 12.439 -14.400 1.00 1.00 H new ATOM 0 HA3 GLY A 24 5.540 12.432 -14.463 1.00 1.00 H new ATOM 380 N VAL A 25 6.189 12.934 -11.943 1.00 1.00 N ATOM 381 CA VAL A 25 6.123 13.058 -10.494 1.00 1.00 C ATOM 382 C VAL A 25 4.841 13.790 -10.106 1.00 1.00 C ATOM 383 O VAL A 25 4.409 14.706 -10.804 1.00 1.00 O ATOM 384 CB VAL A 25 7.388 13.768 -9.989 1.00 1.00 C ATOM 385 CG1 VAL A 25 7.566 15.149 -10.626 1.00 1.00 C ATOM 386 CG2 VAL A 25 7.359 13.932 -8.470 1.00 1.00 C ATOM 0 H VAL A 25 6.097 13.827 -12.427 1.00 1.00 H new ATOM 0 HA VAL A 25 6.090 12.076 -10.021 1.00 1.00 H new ATOM 0 HB VAL A 25 8.228 13.136 -10.277 1.00 1.00 H new ATOM 0 HG11 VAL A 25 8.473 15.614 -10.239 1.00 1.00 H new ATOM 0 HG12 VAL A 25 7.645 15.043 -11.708 1.00 1.00 H new ATOM 0 HG13 VAL A 25 6.707 15.775 -10.385 1.00 1.00 H new ATOM 0 HG21 VAL A 25 8.267 14.438 -8.141 1.00 1.00 H new ATOM 0 HG22 VAL A 25 6.490 14.525 -8.185 1.00 1.00 H new ATOM 0 HG23 VAL A 25 7.299 12.951 -7.999 1.00 1.00 H new ATOM 396 N SER A 26 4.237 13.379 -8.988 1.00 1.00 N ATOM 397 CA SER A 26 2.978 13.930 -8.502 1.00 1.00 C ATOM 398 C SER A 26 2.990 13.923 -6.978 1.00 1.00 C ATOM 399 O SER A 26 2.676 12.908 -6.358 1.00 1.00 O ATOM 400 CB SER A 26 1.806 13.096 -9.024 1.00 1.00 C ATOM 401 OG SER A 26 1.750 13.152 -10.434 1.00 1.00 O ATOM 0 H SER A 26 4.617 12.645 -8.390 1.00 1.00 H new ATOM 0 HA SER A 26 2.862 14.953 -8.861 1.00 1.00 H new ATOM 0 HB2 SER A 26 1.915 12.061 -8.699 1.00 1.00 H new ATOM 0 HB3 SER A 26 0.872 13.466 -8.602 1.00 1.00 H new ATOM 0 HG SER A 26 0.997 12.613 -10.753 1.00 1.00 H new ATOM 407 N GLY A 27 3.351 15.055 -6.368 1.00 1.00 N ATOM 408 CA GLY A 27 3.480 15.119 -4.922 1.00 1.00 C ATOM 409 C GLY A 27 4.628 14.218 -4.477 1.00 1.00 C ATOM 410 O GLY A 27 5.613 14.061 -5.197 1.00 1.00 O ATOM 0 H GLY A 27 3.556 15.928 -6.853 1.00 1.00 H new ATOM 0 HA2 GLY A 27 3.666 16.146 -4.607 1.00 1.00 H new ATOM 0 HA3 GLY A 27 2.550 14.803 -4.448 1.00 1.00 H new ATOM 414 N GLN A 28 4.504 13.624 -3.289 1.00 1.00 N ATOM 415 CA GLN A 28 5.498 12.696 -2.773 1.00 1.00 C ATOM 416 C GLN A 28 5.529 11.388 -3.577 1.00 1.00 C ATOM 417 O GLN A 28 6.373 10.531 -3.319 1.00 1.00 O ATOM 418 CB GLN A 28 5.209 12.445 -1.293 1.00 1.00 C ATOM 419 CG GLN A 28 6.343 11.649 -0.646 1.00 1.00 C ATOM 420 CD GLN A 28 6.380 11.887 0.856 1.00 1.00 C ATOM 421 OE1 GLN A 28 5.984 11.033 1.645 1.00 1.00 O ATOM 422 NE2 GLN A 28 6.861 13.061 1.256 1.00 1.00 N ATOM 0 H GLN A 28 3.713 13.775 -2.663 1.00 1.00 H new ATOM 0 HA GLN A 28 6.490 13.136 -2.878 1.00 1.00 H new ATOM 0 HB2 GLN A 28 5.085 13.396 -0.776 1.00 1.00 H new ATOM 0 HB3 GLN A 28 4.271 11.901 -1.188 1.00 1.00 H new ATOM 0 HG2 GLN A 28 6.209 10.586 -0.847 1.00 1.00 H new ATOM 0 HG3 GLN A 28 7.296 11.939 -1.089 1.00 1.00 H new ATOM 0 HE21 GLN A 28 7.180 13.743 0.568 1.00 1.00 H new ATOM 0 HE22 GLN A 28 6.911 13.279 2.251 1.00 1.00 H new ATOM 431 N GLN A 29 4.622 11.216 -4.548 1.00 1.00 N ATOM 432 CA GLN A 29 4.582 10.007 -5.358 1.00 1.00 C ATOM 433 C GLN A 29 5.253 10.216 -6.715 1.00 1.00 C ATOM 434 O GLN A 29 5.526 11.344 -7.123 1.00 1.00 O ATOM 435 CB GLN A 29 3.142 9.535 -5.570 1.00 1.00 C ATOM 436 CG GLN A 29 2.383 9.387 -4.254 1.00 1.00 C ATOM 437 CD GLN A 29 0.980 8.864 -4.502 1.00 1.00 C ATOM 438 OE1 GLN A 29 0.710 7.678 -4.333 1.00 1.00 O ATOM 439 NE2 GLN A 29 0.073 9.744 -4.907 1.00 1.00 N ATOM 0 H GLN A 29 3.908 11.904 -4.786 1.00 1.00 H new ATOM 0 HA GLN A 29 5.133 9.242 -4.812 1.00 1.00 H new ATOM 0 HB2 GLN A 29 2.619 10.245 -6.211 1.00 1.00 H new ATOM 0 HB3 GLN A 29 3.148 8.579 -6.093 1.00 1.00 H new ATOM 0 HG2 GLN A 29 2.919 8.706 -3.593 1.00 1.00 H new ATOM 0 HG3 GLN A 29 2.333 10.350 -3.746 1.00 1.00 H new ATOM 0 HE21 GLN A 29 0.333 10.722 -5.037 1.00 1.00 H new ATOM 0 HE22 GLN A 29 -0.884 9.443 -5.088 1.00 1.00 H new ATOM 448 N VAL A 30 5.513 9.105 -7.409 1.00 1.00 N ATOM 449 CA VAL A 30 6.170 9.087 -8.706 1.00 1.00 C ATOM 450 C VAL A 30 5.505 8.045 -9.599 1.00 1.00 C ATOM 451 O VAL A 30 5.281 6.913 -9.173 1.00 1.00 O ATOM 452 CB VAL A 30 7.655 8.758 -8.508 1.00 1.00 C ATOM 453 CG1 VAL A 30 8.363 8.614 -9.854 1.00 1.00 C ATOM 454 CG2 VAL A 30 8.352 9.869 -7.722 1.00 1.00 C ATOM 0 H VAL A 30 5.264 8.175 -7.072 1.00 1.00 H new ATOM 0 HA VAL A 30 6.082 10.062 -9.185 1.00 1.00 H new ATOM 0 HB VAL A 30 7.709 7.819 -7.958 1.00 1.00 H new ATOM 0 HG11 VAL A 30 9.415 8.381 -9.689 1.00 1.00 H new ATOM 0 HG12 VAL A 30 7.899 7.810 -10.425 1.00 1.00 H new ATOM 0 HG13 VAL A 30 8.282 9.548 -10.410 1.00 1.00 H new ATOM 0 HG21 VAL A 30 9.405 9.617 -7.592 1.00 1.00 H new ATOM 0 HG22 VAL A 30 8.268 10.809 -8.268 1.00 1.00 H new ATOM 0 HG23 VAL A 30 7.881 9.974 -6.745 1.00 1.00 H new ATOM 464 N ARG A 31 5.191 8.434 -10.839 1.00 1.00 N ATOM 465 CA ARG A 31 4.605 7.555 -11.841 1.00 1.00 C ATOM 466 C ARG A 31 5.707 6.900 -12.661 1.00 1.00 C ATOM 467 O ARG A 31 6.391 7.572 -13.435 1.00 1.00 O ATOM 468 CB ARG A 31 3.697 8.355 -12.776 1.00 1.00 C ATOM 469 CG ARG A 31 2.240 8.356 -12.320 1.00 1.00 C ATOM 470 CD ARG A 31 1.635 6.970 -12.548 1.00 1.00 C ATOM 471 NE ARG A 31 0.178 6.986 -12.363 1.00 1.00 N ATOM 472 CZ ARG A 31 -0.708 7.219 -13.336 1.00 1.00 C ATOM 473 NH1 ARG A 31 -0.302 7.457 -14.580 1.00 1.00 N ATOM 474 NH2 ARG A 31 -2.013 7.217 -13.071 1.00 1.00 N ATOM 0 H ARG A 31 5.342 9.385 -11.174 1.00 1.00 H new ATOM 0 HA ARG A 31 4.019 6.789 -11.333 1.00 1.00 H new ATOM 0 HB2 ARG A 31 4.056 9.382 -12.834 1.00 1.00 H new ATOM 0 HB3 ARG A 31 3.759 7.938 -13.781 1.00 1.00 H new ATOM 0 HG2 ARG A 31 2.178 8.623 -11.265 1.00 1.00 H new ATOM 0 HG3 ARG A 31 1.675 9.107 -12.873 1.00 1.00 H new ATOM 0 HD2 ARG A 31 1.872 6.629 -13.556 1.00 1.00 H new ATOM 0 HD3 ARG A 31 2.084 6.257 -11.856 1.00 1.00 H new ATOM 0 HE ARG A 31 -0.183 6.807 -11.426 1.00 1.00 H new ATOM 0 HH11 ARG A 31 0.694 7.463 -14.799 1.00 1.00 H new ATOM 0 HH12 ARG A 31 -0.987 7.634 -15.315 1.00 1.00 H new ATOM 0 HH21 ARG A 31 -2.340 7.037 -12.122 1.00 1.00 H new ATOM 0 HH22 ARG A 31 -2.685 7.395 -13.817 1.00 1.00 H new ATOM 488 N ILE A 32 5.866 5.587 -12.479 1.00 1.00 N ATOM 489 CA ILE A 32 6.830 4.772 -13.207 1.00 1.00 C ATOM 490 C ILE A 32 6.066 3.812 -14.121 1.00 1.00 C ATOM 491 O ILE A 32 4.924 3.453 -13.831 1.00 1.00 O ATOM 492 CB ILE A 32 7.715 4.018 -12.202 1.00 1.00 C ATOM 493 CG1 ILE A 32 8.360 5.015 -11.227 1.00 1.00 C ATOM 494 CG2 ILE A 32 8.802 3.222 -12.934 1.00 1.00 C ATOM 495 CD1 ILE A 32 9.201 4.319 -10.154 1.00 1.00 C ATOM 0 H ILE A 32 5.315 5.054 -11.807 1.00 1.00 H new ATOM 0 HA ILE A 32 7.480 5.392 -13.824 1.00 1.00 H new ATOM 0 HB ILE A 32 7.093 3.320 -11.643 1.00 1.00 H new ATOM 0 HG12 ILE A 32 8.989 5.709 -11.784 1.00 1.00 H new ATOM 0 HG13 ILE A 32 7.580 5.606 -10.747 1.00 1.00 H new ATOM 0 HG21 ILE A 32 9.419 2.695 -12.206 1.00 1.00 H new ATOM 0 HG22 ILE A 32 8.335 2.501 -13.605 1.00 1.00 H new ATOM 0 HG23 ILE A 32 9.426 3.904 -13.512 1.00 1.00 H new ATOM 0 HD11 ILE A 32 9.635 5.067 -9.490 1.00 1.00 H new ATOM 0 HD12 ILE A 32 8.569 3.645 -9.577 1.00 1.00 H new ATOM 0 HD13 ILE A 32 9.999 3.749 -10.630 1.00 1.00 H new ATOM 507 N GLY A 33 6.690 3.393 -15.225 1.00 1.00 N ATOM 508 CA GLY A 33 6.077 2.501 -16.198 1.00 1.00 C ATOM 509 C GLY A 33 7.000 1.331 -16.515 1.00 1.00 C ATOM 510 O GLY A 33 7.993 1.503 -17.220 1.00 1.00 O ATOM 0 H GLY A 33 7.642 3.669 -15.466 1.00 1.00 H new ATOM 0 HA2 GLY A 33 5.129 2.128 -15.810 1.00 1.00 H new ATOM 0 HA3 GLY A 33 5.853 3.051 -17.112 1.00 1.00 H new ATOM 514 N ILE A 34 6.674 0.145 -15.993 1.00 1.00 N ATOM 515 CA ILE A 34 7.480 -1.049 -16.188 1.00 1.00 C ATOM 516 C ILE A 34 6.941 -1.814 -17.390 1.00 1.00 C ATOM 517 O ILE A 34 5.839 -2.357 -17.342 1.00 1.00 O ATOM 518 CB ILE A 34 7.460 -1.933 -14.933 1.00 1.00 C ATOM 519 CG1 ILE A 34 8.100 -1.241 -13.724 1.00 1.00 C ATOM 520 CG2 ILE A 34 8.259 -3.208 -15.221 1.00 1.00 C ATOM 521 CD1 ILE A 34 7.153 -0.261 -13.029 1.00 1.00 C ATOM 0 H ILE A 34 5.842 -0.007 -15.424 1.00 1.00 H new ATOM 0 HA ILE A 34 8.515 -0.761 -16.371 1.00 1.00 H new ATOM 0 HB ILE A 34 6.418 -2.146 -14.696 1.00 1.00 H new ATOM 0 HG12 ILE A 34 8.422 -1.997 -13.008 1.00 1.00 H new ATOM 0 HG13 ILE A 34 8.993 -0.707 -14.048 1.00 1.00 H new ATOM 0 HG21 ILE A 34 8.254 -3.847 -14.338 1.00 1.00 H new ATOM 0 HG22 ILE A 34 7.806 -3.740 -16.057 1.00 1.00 H new ATOM 0 HG23 ILE A 34 9.286 -2.945 -15.473 1.00 1.00 H new ATOM 0 HD11 ILE A 34 7.662 0.198 -12.181 1.00 1.00 H new ATOM 0 HD12 ILE A 34 6.851 0.514 -13.733 1.00 1.00 H new ATOM 0 HD13 ILE A 34 6.271 -0.795 -12.677 1.00 1.00 H new ATOM 533 N ASN A 35 7.715 -1.858 -18.474 1.00 1.00 N ATOM 534 CA ASN A 35 7.321 -2.549 -19.687 1.00 1.00 C ATOM 535 C ASN A 35 8.170 -3.797 -19.880 1.00 1.00 C ATOM 536 O ASN A 35 9.368 -3.714 -20.142 1.00 1.00 O ATOM 537 CB ASN A 35 7.436 -1.604 -20.878 1.00 1.00 C ATOM 538 CG ASN A 35 6.825 -2.229 -22.124 1.00 1.00 C ATOM 539 OD1 ASN A 35 5.624 -2.482 -22.168 1.00 1.00 O ATOM 540 ND2 ASN A 35 7.642 -2.481 -23.141 1.00 1.00 N ATOM 0 H ASN A 35 8.631 -1.414 -18.529 1.00 1.00 H new ATOM 0 HA ASN A 35 6.281 -2.866 -19.605 1.00 1.00 H new ATOM 0 HB2 ASN A 35 6.932 -0.664 -20.652 1.00 1.00 H new ATOM 0 HB3 ASN A 35 8.484 -1.368 -21.061 1.00 1.00 H new ATOM 0 HD21 ASN A 35 7.277 -2.899 -23.997 1.00 1.00 H new ATOM 0 HD22 ASN A 35 8.634 -2.256 -23.066 1.00 1.00 H new ATOM 547 N ALA A 36 7.525 -4.953 -19.747 1.00 1.00 N ATOM 548 CA ALA A 36 8.160 -6.253 -19.881 1.00 1.00 C ATOM 549 C ALA A 36 7.181 -7.229 -20.534 1.00 1.00 C ATOM 550 O ALA A 36 5.968 -7.029 -20.453 1.00 1.00 O ATOM 551 CB ALA A 36 8.560 -6.739 -18.488 1.00 1.00 C ATOM 0 H ALA A 36 6.528 -5.009 -19.539 1.00 1.00 H new ATOM 0 HA ALA A 36 9.048 -6.186 -20.509 1.00 1.00 H new ATOM 0 HB1 ALA A 36 9.039 -7.715 -18.567 1.00 1.00 H new ATOM 0 HB2 ALA A 36 9.255 -6.029 -18.040 1.00 1.00 H new ATOM 0 HB3 ALA A 36 7.671 -6.821 -17.862 1.00 1.00 H new ATOM 557 N PRO A 37 7.683 -8.285 -21.184 1.00 1.00 N ATOM 558 CA PRO A 37 6.847 -9.297 -21.804 1.00 1.00 C ATOM 559 C PRO A 37 6.227 -10.193 -20.736 1.00 1.00 C ATOM 560 O PRO A 37 6.692 -10.232 -19.599 1.00 1.00 O ATOM 561 CB PRO A 37 7.801 -10.087 -22.701 1.00 1.00 C ATOM 562 CG PRO A 37 9.131 -9.993 -21.955 1.00 1.00 C ATOM 563 CD PRO A 37 9.091 -8.581 -21.372 1.00 1.00 C ATOM 0 HA PRO A 37 6.018 -8.872 -22.369 1.00 1.00 H new ATOM 0 HB2 PRO A 37 7.478 -11.121 -22.822 1.00 1.00 H new ATOM 0 HB3 PRO A 37 7.867 -9.655 -23.700 1.00 1.00 H new ATOM 0 HG2 PRO A 37 9.212 -10.751 -21.176 1.00 1.00 H new ATOM 0 HG3 PRO A 37 9.981 -10.131 -22.624 1.00 1.00 H new ATOM 0 HD2 PRO A 37 9.633 -8.530 -20.428 1.00 1.00 H new ATOM 0 HD3 PRO A 37 9.557 -7.863 -22.047 1.00 1.00 H new ATOM 571 N LYS A 38 5.168 -10.922 -21.100 1.00 1.00 N ATOM 572 CA LYS A 38 4.508 -11.857 -20.196 1.00 1.00 C ATOM 573 C LYS A 38 5.406 -13.056 -19.881 1.00 1.00 C ATOM 574 O LYS A 38 5.025 -13.923 -19.098 1.00 1.00 O ATOM 575 CB LYS A 38 3.181 -12.301 -20.818 1.00 1.00 C ATOM 576 CG LYS A 38 2.133 -11.186 -20.720 1.00 1.00 C ATOM 577 CD LYS A 38 1.554 -11.118 -19.307 1.00 1.00 C ATOM 578 CE LYS A 38 0.475 -10.040 -19.265 1.00 1.00 C ATOM 579 NZ LYS A 38 -0.183 -9.987 -17.946 1.00 1.00 N ATOM 0 H LYS A 38 4.748 -10.878 -22.028 1.00 1.00 H new ATOM 0 HA LYS A 38 4.308 -11.358 -19.248 1.00 1.00 H new ATOM 0 HB2 LYS A 38 3.336 -12.570 -21.863 1.00 1.00 H new ATOM 0 HB3 LYS A 38 2.817 -13.194 -20.310 1.00 1.00 H new ATOM 0 HG2 LYS A 38 2.586 -10.229 -20.980 1.00 1.00 H new ATOM 0 HG3 LYS A 38 1.334 -11.366 -21.439 1.00 1.00 H new ATOM 0 HD2 LYS A 38 1.133 -12.083 -19.025 1.00 1.00 H new ATOM 0 HD3 LYS A 38 2.341 -10.891 -18.588 1.00 1.00 H new ATOM 0 HE2 LYS A 38 0.919 -9.070 -19.491 1.00 1.00 H new ATOM 0 HE3 LYS A 38 -0.269 -10.238 -20.037 1.00 1.00 H new ATOM 0 HZ1 LYS A 38 -0.911 -9.244 -17.951 1.00 1.00 H new ATOM 0 HZ2 LYS A 38 -0.627 -10.905 -17.742 1.00 1.00 H new ATOM 0 HZ3 LYS A 38 0.524 -9.774 -17.214 1.00 1.00 H new ATOM 593 N ASP A 39 6.597 -13.107 -20.484 1.00 1.00 N ATOM 594 CA ASP A 39 7.594 -14.126 -20.191 1.00 1.00 C ATOM 595 C ASP A 39 8.157 -13.935 -18.782 1.00 1.00 C ATOM 596 O ASP A 39 8.796 -14.836 -18.239 1.00 1.00 O ATOM 597 CB ASP A 39 8.729 -14.015 -21.209 1.00 1.00 C ATOM 598 CG ASP A 39 9.721 -15.168 -21.080 1.00 1.00 C ATOM 599 OD1 ASP A 39 9.286 -16.326 -21.264 1.00 1.00 O ATOM 600 OD2 ASP A 39 10.907 -14.882 -20.798 1.00 1.00 O ATOM 0 H ASP A 39 6.893 -12.436 -21.193 1.00 1.00 H new ATOM 0 HA ASP A 39 7.128 -15.109 -20.250 1.00 1.00 H new ATOM 0 HB2 ASP A 39 8.314 -14.004 -22.217 1.00 1.00 H new ATOM 0 HB3 ASP A 39 9.251 -13.069 -21.069 1.00 1.00 H new ATOM 605 N VAL A 40 7.919 -12.760 -18.192 1.00 1.00 N ATOM 606 CA VAL A 40 8.402 -12.412 -16.864 1.00 1.00 C ATOM 607 C VAL A 40 7.282 -11.752 -16.066 1.00 1.00 C ATOM 608 O VAL A 40 6.216 -11.452 -16.607 1.00 1.00 O ATOM 609 CB VAL A 40 9.629 -11.495 -16.968 1.00 1.00 C ATOM 610 CG1 VAL A 40 10.689 -12.100 -17.891 1.00 1.00 C ATOM 611 CG2 VAL A 40 9.266 -10.118 -17.519 1.00 1.00 C ATOM 0 H VAL A 40 7.377 -12.017 -18.634 1.00 1.00 H new ATOM 0 HA VAL A 40 8.708 -13.318 -16.340 1.00 1.00 H new ATOM 0 HB VAL A 40 10.018 -11.392 -15.955 1.00 1.00 H new ATOM 0 HG11 VAL A 40 11.547 -11.431 -17.947 1.00 1.00 H new ATOM 0 HG12 VAL A 40 11.007 -13.065 -17.497 1.00 1.00 H new ATOM 0 HG13 VAL A 40 10.269 -12.236 -18.888 1.00 1.00 H new ATOM 0 HG21 VAL A 40 10.163 -9.501 -17.576 1.00 1.00 H new ATOM 0 HG22 VAL A 40 8.836 -10.226 -18.515 1.00 1.00 H new ATOM 0 HG23 VAL A 40 8.540 -9.642 -16.860 1.00 1.00 H new ATOM 621 N ALA A 41 7.518 -11.519 -14.774 1.00 1.00 N ATOM 622 CA ALA A 41 6.518 -10.926 -13.903 1.00 1.00 C ATOM 623 C ALA A 41 6.948 -9.530 -13.458 1.00 1.00 C ATOM 624 O ALA A 41 8.116 -9.166 -13.569 1.00 1.00 O ATOM 625 CB ALA A 41 6.300 -11.846 -12.702 1.00 1.00 C ATOM 0 H ALA A 41 8.401 -11.736 -14.311 1.00 1.00 H new ATOM 0 HA ALA A 41 5.579 -10.817 -14.445 1.00 1.00 H new ATOM 0 HB1 ALA A 41 5.551 -11.410 -12.041 1.00 1.00 H new ATOM 0 HB2 ALA A 41 5.956 -12.821 -13.048 1.00 1.00 H new ATOM 0 HB3 ALA A 41 7.238 -11.964 -12.159 1.00 1.00 H new ATOM 631 N VAL A 42 5.989 -8.754 -12.952 1.00 1.00 N ATOM 632 CA VAL A 42 6.225 -7.424 -12.410 1.00 1.00 C ATOM 633 C VAL A 42 5.121 -7.096 -11.410 1.00 1.00 C ATOM 634 O VAL A 42 3.939 -7.099 -11.746 1.00 1.00 O ATOM 635 CB VAL A 42 6.323 -6.377 -13.532 1.00 1.00 C ATOM 636 CG1 VAL A 42 5.354 -6.657 -14.678 1.00 1.00 C ATOM 637 CG2 VAL A 42 6.060 -4.968 -12.998 1.00 1.00 C ATOM 0 H VAL A 42 5.011 -9.041 -12.909 1.00 1.00 H new ATOM 0 HA VAL A 42 7.183 -7.403 -11.890 1.00 1.00 H new ATOM 0 HB VAL A 42 7.341 -6.444 -13.916 1.00 1.00 H new ATOM 0 HG11 VAL A 42 5.464 -5.889 -15.443 1.00 1.00 H new ATOM 0 HG12 VAL A 42 5.574 -7.633 -15.110 1.00 1.00 H new ATOM 0 HG13 VAL A 42 4.332 -6.649 -14.300 1.00 1.00 H new ATOM 0 HG21 VAL A 42 6.136 -4.249 -13.814 1.00 1.00 H new ATOM 0 HG22 VAL A 42 5.060 -4.923 -12.567 1.00 1.00 H new ATOM 0 HG23 VAL A 42 6.796 -4.726 -12.232 1.00 1.00 H new ATOM 647 N HIS A 43 5.523 -6.810 -10.171 1.00 1.00 N ATOM 648 CA HIS A 43 4.616 -6.484 -9.076 1.00 1.00 C ATOM 649 C HIS A 43 5.268 -5.453 -8.159 1.00 1.00 C ATOM 650 O HIS A 43 6.433 -5.113 -8.349 1.00 1.00 O ATOM 651 CB HIS A 43 4.294 -7.755 -8.280 1.00 1.00 C ATOM 652 CG HIS A 43 3.661 -8.851 -9.101 1.00 1.00 C ATOM 653 ND1 HIS A 43 2.322 -9.170 -9.143 1.00 1.00 N ATOM 654 CD2 HIS A 43 4.320 -9.709 -9.941 1.00 1.00 C ATOM 655 CE1 HIS A 43 2.180 -10.184 -10.017 1.00 1.00 C ATOM 656 NE2 HIS A 43 3.368 -10.551 -10.523 1.00 1.00 N ATOM 0 H HIS A 43 6.506 -6.799 -9.898 1.00 1.00 H new ATOM 0 HA HIS A 43 3.693 -6.070 -9.482 1.00 1.00 H new ATOM 0 HB2 HIS A 43 5.213 -8.134 -7.834 1.00 1.00 H new ATOM 0 HB3 HIS A 43 3.624 -7.497 -7.459 1.00 1.00 H new ATOM 0 HD2 HIS A 43 5.385 -9.731 -10.121 1.00 1.00 H new ATOM 0 HE1 HIS A 43 1.237 -10.641 -10.276 1.00 1.00 H new ATOM 0 HE2 HIS A 43 3.541 -11.296 -11.198 1.00 1.00 H new ATOM 664 N ARG A 44 4.528 -4.951 -7.164 1.00 1.00 N ATOM 665 CA ARG A 44 5.089 -4.045 -6.168 1.00 1.00 C ATOM 666 C ARG A 44 5.182 -4.730 -4.806 1.00 1.00 C ATOM 667 O ARG A 44 4.664 -5.829 -4.629 1.00 1.00 O ATOM 668 CB ARG A 44 4.353 -2.700 -6.133 1.00 1.00 C ATOM 669 CG ARG A 44 2.861 -2.682 -6.469 1.00 1.00 C ATOM 670 CD ARG A 44 2.038 -3.214 -5.302 1.00 1.00 C ATOM 671 NE ARG A 44 0.618 -2.880 -5.448 1.00 1.00 N ATOM 672 CZ ARG A 44 0.041 -1.782 -4.955 1.00 1.00 C ATOM 673 NH1 ARG A 44 0.756 -0.848 -4.331 1.00 1.00 N ATOM 674 NH2 ARG A 44 -1.270 -1.616 -5.086 1.00 1.00 N ATOM 0 H ARG A 44 3.539 -5.160 -7.031 1.00 1.00 H new ATOM 0 HA ARG A 44 6.110 -3.800 -6.462 1.00 1.00 H new ATOM 0 HB2 ARG A 44 4.474 -2.280 -5.134 1.00 1.00 H new ATOM 0 HB3 ARG A 44 4.858 -2.026 -6.825 1.00 1.00 H new ATOM 0 HG2 ARG A 44 2.549 -1.665 -6.706 1.00 1.00 H new ATOM 0 HG3 ARG A 44 2.676 -3.287 -7.356 1.00 1.00 H new ATOM 0 HD2 ARG A 44 2.153 -4.296 -5.238 1.00 1.00 H new ATOM 0 HD3 ARG A 44 2.417 -2.797 -4.369 1.00 1.00 H new ATOM 0 HE ARG A 44 0.029 -3.534 -5.963 1.00 1.00 H new ATOM 0 HH11 ARG A 44 1.764 -0.965 -4.223 1.00 1.00 H new ATOM 0 HH12 ARG A 44 0.296 -0.016 -3.961 1.00 1.00 H new ATOM 0 HH21 ARG A 44 -1.829 -2.325 -5.561 1.00 1.00 H new ATOM 0 HH22 ARG A 44 -1.718 -0.780 -4.712 1.00 1.00 H new ATOM 688 N GLU A 45 5.842 -4.087 -3.838 1.00 1.00 N ATOM 689 CA GLU A 45 6.162 -4.695 -2.550 1.00 1.00 C ATOM 690 C GLU A 45 4.932 -5.245 -1.833 1.00 1.00 C ATOM 691 O GLU A 45 4.971 -6.356 -1.308 1.00 1.00 O ATOM 692 CB GLU A 45 6.846 -3.671 -1.644 1.00 1.00 C ATOM 693 CG GLU A 45 8.195 -3.230 -2.205 1.00 1.00 C ATOM 694 CD GLU A 45 8.875 -2.267 -1.237 1.00 1.00 C ATOM 695 OE1 GLU A 45 8.514 -1.070 -1.268 1.00 1.00 O ATOM 696 OE2 GLU A 45 9.751 -2.734 -0.475 1.00 1.00 O ATOM 0 H GLU A 45 6.169 -3.125 -3.930 1.00 1.00 H new ATOM 0 HA GLU A 45 6.828 -5.532 -2.758 1.00 1.00 H new ATOM 0 HB2 GLU A 45 6.200 -2.801 -1.526 1.00 1.00 H new ATOM 0 HB3 GLU A 45 6.988 -4.100 -0.652 1.00 1.00 H new ATOM 0 HG2 GLU A 45 8.830 -4.100 -2.371 1.00 1.00 H new ATOM 0 HG3 GLU A 45 8.055 -2.747 -3.172 1.00 1.00 H new ATOM 703 N GLU A 46 3.842 -4.476 -1.808 1.00 1.00 N ATOM 704 CA GLU A 46 2.613 -4.856 -1.128 1.00 1.00 C ATOM 705 C GLU A 46 1.911 -6.024 -1.822 1.00 1.00 C ATOM 706 O GLU A 46 0.847 -6.453 -1.379 1.00 1.00 O ATOM 707 CB GLU A 46 1.656 -3.661 -1.058 1.00 1.00 C ATOM 708 CG GLU A 46 2.306 -2.424 -0.434 1.00 1.00 C ATOM 709 CD GLU A 46 2.788 -1.443 -1.502 1.00 1.00 C ATOM 710 OE1 GLU A 46 3.711 -1.804 -2.266 1.00 1.00 O ATOM 711 OE2 GLU A 46 2.228 -0.326 -1.551 1.00 1.00 O ATOM 0 H GLU A 46 3.792 -3.565 -2.264 1.00 1.00 H new ATOM 0 HA GLU A 46 2.887 -5.174 -0.122 1.00 1.00 H new ATOM 0 HB2 GLU A 46 1.310 -3.418 -2.063 1.00 1.00 H new ATOM 0 HB3 GLU A 46 0.777 -3.938 -0.476 1.00 1.00 H new ATOM 0 HG2 GLU A 46 1.590 -1.927 0.221 1.00 1.00 H new ATOM 0 HG3 GLU A 46 3.148 -2.729 0.187 1.00 1.00 H new ATOM 718 N ILE A 47 2.500 -6.538 -2.907 1.00 1.00 N ATOM 719 CA ILE A 47 1.888 -7.557 -3.745 1.00 1.00 C ATOM 720 C ILE A 47 2.848 -8.706 -4.028 1.00 1.00 C ATOM 721 O ILE A 47 2.404 -9.837 -4.210 1.00 1.00 O ATOM 722 CB ILE A 47 1.453 -6.876 -5.048 1.00 1.00 C ATOM 723 CG1 ILE A 47 0.327 -5.871 -4.787 1.00 1.00 C ATOM 724 CG2 ILE A 47 1.034 -7.873 -6.120 1.00 1.00 C ATOM 725 CD1 ILE A 47 -0.969 -6.510 -4.311 1.00 1.00 C ATOM 0 H ILE A 47 3.425 -6.250 -3.226 1.00 1.00 H new ATOM 0 HA ILE A 47 1.031 -7.994 -3.232 1.00 1.00 H new ATOM 0 HB ILE A 47 2.325 -6.344 -5.428 1.00 1.00 H new ATOM 0 HG12 ILE A 47 0.662 -5.151 -4.040 1.00 1.00 H new ATOM 0 HG13 ILE A 47 0.131 -5.313 -5.703 1.00 1.00 H new ATOM 0 HG21 ILE A 47 0.736 -7.336 -7.020 1.00 1.00 H new ATOM 0 HG22 ILE A 47 1.871 -8.532 -6.351 1.00 1.00 H new ATOM 0 HG23 ILE A 47 0.195 -8.466 -5.757 1.00 1.00 H new ATOM 0 HD11 ILE A 47 -1.718 -5.735 -4.148 1.00 1.00 H new ATOM 0 HD12 ILE A 47 -1.329 -7.209 -5.066 1.00 1.00 H new ATOM 0 HD13 ILE A 47 -0.790 -7.044 -3.378 1.00 1.00 H new ATOM 737 N TYR A 48 4.156 -8.440 -4.068 1.00 1.00 N ATOM 738 CA TYR A 48 5.138 -9.480 -4.311 1.00 1.00 C ATOM 739 C TYR A 48 5.073 -10.521 -3.200 1.00 1.00 C ATOM 740 O TYR A 48 4.799 -11.689 -3.465 1.00 1.00 O ATOM 741 CB TYR A 48 6.535 -8.863 -4.409 1.00 1.00 C ATOM 742 CG TYR A 48 7.652 -9.883 -4.474 1.00 1.00 C ATOM 743 CD1 TYR A 48 7.485 -11.078 -5.192 1.00 1.00 C ATOM 744 CD2 TYR A 48 8.861 -9.632 -3.808 1.00 1.00 C ATOM 745 CE1 TYR A 48 8.515 -12.030 -5.229 1.00 1.00 C ATOM 746 CE2 TYR A 48 9.899 -10.573 -3.845 1.00 1.00 C ATOM 747 CZ TYR A 48 9.728 -11.779 -4.556 1.00 1.00 C ATOM 748 OH TYR A 48 10.730 -12.702 -4.591 1.00 1.00 O ATOM 0 H TYR A 48 4.552 -7.510 -3.934 1.00 1.00 H new ATOM 0 HA TYR A 48 4.918 -9.976 -5.256 1.00 1.00 H new ATOM 0 HB2 TYR A 48 6.581 -8.231 -5.296 1.00 1.00 H new ATOM 0 HB3 TYR A 48 6.697 -8.215 -3.547 1.00 1.00 H new ATOM 0 HD1 TYR A 48 6.560 -11.265 -5.718 1.00 1.00 H new ATOM 0 HD2 TYR A 48 8.993 -8.708 -3.264 1.00 1.00 H new ATOM 0 HE1 TYR A 48 8.379 -12.953 -5.772 1.00 1.00 H new ATOM 0 HE2 TYR A 48 10.828 -10.375 -3.330 1.00 1.00 H new ATOM 0 HH TYR A 48 11.497 -12.372 -4.077 1.00 1.00 H new ATOM 846 N MET B 1 2.474 -2.182 -21.150 1.00 1.00 N ATOM 847 CA MET B 1 3.225 -1.636 -20.003 1.00 1.00 C ATOM 848 C MET B 1 2.400 -1.747 -18.727 1.00 1.00 C ATOM 849 O MET B 1 1.176 -1.665 -18.780 1.00 1.00 O ATOM 850 CB MET B 1 3.618 -0.181 -20.274 1.00 1.00 C ATOM 851 CG MET B 1 4.500 0.375 -19.158 1.00 1.00 C ATOM 852 SD MET B 1 5.444 1.855 -19.619 1.00 1.00 S ATOM 853 CE MET B 1 4.092 2.989 -20.025 1.00 1.00 C ATOM 0 H1 MET B 1 2.473 -1.489 -21.926 1.00 1.00 H new ATOM 0 H2 MET B 1 2.925 -3.062 -21.473 1.00 1.00 H new ATOM 0 H3 MET B 1 1.495 -2.380 -20.861 1.00 1.00 H new ATOM 0 HA MET B 1 4.136 -2.219 -19.869 1.00 1.00 H new ATOM 0 HB2 MET B 1 4.147 -0.117 -21.225 1.00 1.00 H new ATOM 0 HB3 MET B 1 2.719 0.429 -20.368 1.00 1.00 H new ATOM 0 HG2 MET B 1 3.872 0.612 -18.299 1.00 1.00 H new ATOM 0 HG3 MET B 1 5.196 -0.401 -18.840 1.00 1.00 H new ATOM 0 HE1 MET B 1 4.504 3.933 -20.381 1.00 1.00 H new ATOM 0 HE2 MET B 1 3.469 2.549 -20.803 1.00 1.00 H new ATOM 0 HE3 MET B 1 3.488 3.169 -19.135 1.00 1.00 H new ATOM 865 N LEU B 2 3.069 -1.931 -17.583 1.00 1.00 N ATOM 866 CA LEU B 2 2.416 -1.992 -16.284 1.00 1.00 C ATOM 867 C LEU B 2 2.802 -0.753 -15.481 1.00 1.00 C ATOM 868 O LEU B 2 3.878 -0.692 -14.888 1.00 1.00 O ATOM 869 CB LEU B 2 2.821 -3.276 -15.547 1.00 1.00 C ATOM 870 CG LEU B 2 1.745 -3.806 -14.585 1.00 1.00 C ATOM 871 CD1 LEU B 2 2.391 -4.528 -13.411 1.00 1.00 C ATOM 872 CD2 LEU B 2 0.809 -2.750 -14.018 1.00 1.00 C ATOM 0 H LEU B 2 4.082 -2.041 -17.539 1.00 1.00 H new ATOM 0 HA LEU B 2 1.334 -2.011 -16.411 1.00 1.00 H new ATOM 0 HB2 LEU B 2 3.050 -4.048 -16.281 1.00 1.00 H new ATOM 0 HB3 LEU B 2 3.736 -3.088 -14.985 1.00 1.00 H new ATOM 0 HG LEU B 2 1.142 -4.475 -15.199 1.00 1.00 H new ATOM 0 HD11 LEU B 2 1.616 -4.897 -12.740 1.00 1.00 H new ATOM 0 HD12 LEU B 2 2.981 -5.367 -13.780 1.00 1.00 H new ATOM 0 HD13 LEU B 2 3.040 -3.838 -12.872 1.00 1.00 H new ATOM 0 HD21 LEU B 2 0.087 -3.223 -13.352 1.00 1.00 H new ATOM 0 HD22 LEU B 2 1.387 -2.012 -13.461 1.00 1.00 H new ATOM 0 HD23 LEU B 2 0.281 -2.256 -14.834 1.00 1.00 H new ATOM 884 N ILE B 3 1.916 0.241 -15.463 1.00 1.00 N ATOM 885 CA ILE B 3 2.152 1.489 -14.762 1.00 1.00 C ATOM 886 C ILE B 3 1.817 1.304 -13.286 1.00 1.00 C ATOM 887 O ILE B 3 0.850 0.623 -12.949 1.00 1.00 O ATOM 888 CB ILE B 3 1.293 2.595 -15.390 1.00 1.00 C ATOM 889 CG1 ILE B 3 1.728 2.887 -16.833 1.00 1.00 C ATOM 890 CG2 ILE B 3 1.440 3.891 -14.587 1.00 1.00 C ATOM 891 CD1 ILE B 3 1.132 1.916 -17.853 1.00 1.00 C ATOM 0 H ILE B 3 1.014 0.198 -15.937 1.00 1.00 H new ATOM 0 HA ILE B 3 3.199 1.779 -14.846 1.00 1.00 H new ATOM 0 HB ILE B 3 0.260 2.248 -15.383 1.00 1.00 H new ATOM 0 HG12 ILE B 3 1.434 3.904 -17.095 1.00 1.00 H new ATOM 0 HG13 ILE B 3 2.815 2.844 -16.893 1.00 1.00 H new ATOM 0 HG21 ILE B 3 0.827 4.671 -15.039 1.00 1.00 H new ATOM 0 HG22 ILE B 3 1.113 3.722 -13.561 1.00 1.00 H new ATOM 0 HG23 ILE B 3 2.484 4.204 -14.589 1.00 1.00 H new ATOM 0 HD11 ILE B 3 1.480 2.179 -18.852 1.00 1.00 H new ATOM 0 HD12 ILE B 3 1.447 0.900 -17.615 1.00 1.00 H new ATOM 0 HD13 ILE B 3 0.044 1.976 -17.820 1.00 1.00 H new ATOM 903 N LEU B 4 2.618 1.911 -12.409 1.00 1.00 N ATOM 904 CA LEU B 4 2.391 1.904 -10.972 1.00 1.00 C ATOM 905 C LEU B 4 2.765 3.273 -10.411 1.00 1.00 C ATOM 906 O LEU B 4 3.380 4.086 -11.102 1.00 1.00 O ATOM 907 CB LEU B 4 3.246 0.821 -10.295 1.00 1.00 C ATOM 908 CG LEU B 4 2.841 -0.617 -10.647 1.00 1.00 C ATOM 909 CD1 LEU B 4 3.794 -1.594 -9.961 1.00 1.00 C ATOM 910 CD2 LEU B 4 1.436 -0.943 -10.147 1.00 1.00 C ATOM 0 H LEU B 4 3.453 2.427 -12.686 1.00 1.00 H new ATOM 0 HA LEU B 4 1.341 1.688 -10.775 1.00 1.00 H new ATOM 0 HB2 LEU B 4 4.289 0.971 -10.575 1.00 1.00 H new ATOM 0 HB3 LEU B 4 3.184 0.949 -9.214 1.00 1.00 H new ATOM 0 HG LEU B 4 2.876 -0.707 -11.733 1.00 1.00 H new ATOM 0 HD11 LEU B 4 3.508 -2.616 -10.210 1.00 1.00 H new ATOM 0 HD12 LEU B 4 4.813 -1.409 -10.302 1.00 1.00 H new ATOM 0 HD13 LEU B 4 3.742 -1.455 -8.881 1.00 1.00 H new ATOM 0 HD21 LEU B 4 1.184 -1.969 -10.414 1.00 1.00 H new ATOM 0 HD22 LEU B 4 1.400 -0.831 -9.063 1.00 1.00 H new ATOM 0 HD23 LEU B 4 0.719 -0.262 -10.606 1.00 1.00 H new ATOM 922 N THR B 5 2.394 3.528 -9.155 1.00 1.00 N ATOM 923 CA THR B 5 2.783 4.753 -8.471 1.00 1.00 C ATOM 924 C THR B 5 3.493 4.387 -7.172 1.00 1.00 C ATOM 925 O THR B 5 3.077 3.468 -6.468 1.00 1.00 O ATOM 926 CB THR B 5 1.557 5.640 -8.236 1.00 1.00 C ATOM 927 OG1 THR B 5 0.943 5.934 -9.473 1.00 1.00 O ATOM 928 CG2 THR B 5 1.954 6.953 -7.579 1.00 1.00 C ATOM 0 H THR B 5 1.823 2.897 -8.593 1.00 1.00 H new ATOM 0 HA THR B 5 3.474 5.329 -9.086 1.00 1.00 H new ATOM 0 HB THR B 5 0.871 5.101 -7.582 1.00 1.00 H new ATOM 0 HG1 THR B 5 0.158 6.500 -9.322 1.00 1.00 H new ATOM 0 HG21 THR B 5 1.066 7.565 -7.423 1.00 1.00 H new ATOM 0 HG22 THR B 5 2.429 6.751 -6.619 1.00 1.00 H new ATOM 0 HG23 THR B 5 2.653 7.486 -8.224 1.00 1.00 H new ATOM 936 N ARG B 6 4.572 5.106 -6.848 1.00 1.00 N ATOM 937 CA ARG B 6 5.396 4.811 -5.682 1.00 1.00 C ATOM 938 C ARG B 6 5.754 6.093 -4.942 1.00 1.00 C ATOM 939 O ARG B 6 6.136 7.079 -5.567 1.00 1.00 O ATOM 940 CB ARG B 6 6.686 4.126 -6.150 1.00 1.00 C ATOM 941 CG ARG B 6 6.481 2.761 -6.814 1.00 1.00 C ATOM 942 CD ARG B 6 6.271 1.632 -5.802 1.00 1.00 C ATOM 943 NE ARG B 6 4.991 1.745 -5.103 1.00 1.00 N ATOM 944 CZ ARG B 6 4.573 0.920 -4.142 1.00 1.00 C ATOM 945 NH1 ARG B 6 5.306 -0.125 -3.767 1.00 1.00 N ATOM 946 NH2 ARG B 6 3.406 1.144 -3.546 1.00 1.00 N ATOM 0 H ARG B 6 4.895 5.908 -7.389 1.00 1.00 H new ATOM 0 HA ARG B 6 4.839 4.160 -5.008 1.00 1.00 H new ATOM 0 HB2 ARG B 6 7.196 4.784 -6.853 1.00 1.00 H new ATOM 0 HB3 ARG B 6 7.347 4.002 -5.292 1.00 1.00 H new ATOM 0 HG2 ARG B 6 5.618 2.812 -7.478 1.00 1.00 H new ATOM 0 HG3 ARG B 6 7.348 2.530 -7.434 1.00 1.00 H new ATOM 0 HD2 ARG B 6 6.318 0.672 -6.317 1.00 1.00 H new ATOM 0 HD3 ARG B 6 7.082 1.644 -5.074 1.00 1.00 H new ATOM 0 HE ARG B 6 4.373 2.511 -5.370 1.00 1.00 H new ATOM 0 HH11 ARG B 6 6.204 -0.306 -4.216 1.00 1.00 H new ATOM 0 HH12 ARG B 6 4.970 -0.745 -3.030 1.00 1.00 H new ATOM 0 HH21 ARG B 6 2.836 1.943 -3.824 1.00 1.00 H new ATOM 0 HH22 ARG B 6 3.080 0.517 -2.810 1.00 1.00 H new ATOM 960 N LYS B 7 5.633 6.078 -3.610 1.00 1.00 N ATOM 961 CA LYS B 7 6.098 7.181 -2.784 1.00 1.00 C ATOM 962 C LYS B 7 7.619 7.093 -2.705 1.00 1.00 C ATOM 963 O LYS B 7 8.192 6.039 -2.975 1.00 1.00 O ATOM 964 CB LYS B 7 5.508 7.093 -1.370 1.00 1.00 C ATOM 965 CG LYS B 7 4.017 7.434 -1.281 1.00 1.00 C ATOM 966 CD LYS B 7 3.118 6.351 -1.883 1.00 1.00 C ATOM 967 CE LYS B 7 1.643 6.662 -1.623 1.00 1.00 C ATOM 968 NZ LYS B 7 1.320 6.628 -0.184 1.00 1.00 N ATOM 0 H LYS B 7 5.215 5.309 -3.086 1.00 1.00 H new ATOM 0 HA LYS B 7 5.781 8.127 -3.223 1.00 1.00 H new ATOM 0 HB2 LYS B 7 5.660 6.083 -0.989 1.00 1.00 H new ATOM 0 HB3 LYS B 7 6.062 7.767 -0.716 1.00 1.00 H new ATOM 0 HG2 LYS B 7 3.746 7.584 -0.236 1.00 1.00 H new ATOM 0 HG3 LYS B 7 3.834 8.377 -1.796 1.00 1.00 H new ATOM 0 HD2 LYS B 7 3.296 6.280 -2.956 1.00 1.00 H new ATOM 0 HD3 LYS B 7 3.371 5.382 -1.453 1.00 1.00 H new ATOM 0 HE2 LYS B 7 1.403 7.646 -2.026 1.00 1.00 H new ATOM 0 HE3 LYS B 7 1.021 5.940 -2.152 1.00 1.00 H new ATOM 0 HZ1 LYS B 7 0.293 6.521 -0.061 1.00 1.00 H new ATOM 0 HZ2 LYS B 7 1.808 5.825 0.262 1.00 1.00 H new ATOM 0 HZ3 LYS B 7 1.631 7.514 0.263 1.00 1.00 H new ATOM 982 N VAL B 8 8.283 8.190 -2.337 1.00 1.00 N ATOM 983 CA VAL B 8 9.727 8.179 -2.135 1.00 1.00 C ATOM 984 C VAL B 8 10.076 7.138 -1.073 1.00 1.00 C ATOM 985 O VAL B 8 9.553 7.179 0.040 1.00 1.00 O ATOM 986 CB VAL B 8 10.191 9.572 -1.702 1.00 1.00 C ATOM 987 CG1 VAL B 8 11.669 9.538 -1.315 1.00 1.00 C ATOM 988 CG2 VAL B 8 9.984 10.564 -2.847 1.00 1.00 C ATOM 0 H VAL B 8 7.842 9.095 -2.174 1.00 1.00 H new ATOM 0 HA VAL B 8 10.234 7.918 -3.064 1.00 1.00 H new ATOM 0 HB VAL B 8 9.605 9.886 -0.839 1.00 1.00 H new ATOM 0 HG11 VAL B 8 11.988 10.534 -1.009 1.00 1.00 H new ATOM 0 HG12 VAL B 8 11.813 8.841 -0.489 1.00 1.00 H new ATOM 0 HG13 VAL B 8 12.262 9.214 -2.171 1.00 1.00 H new ATOM 0 HG21 VAL B 8 10.315 11.554 -2.535 1.00 1.00 H new ATOM 0 HG22 VAL B 8 10.562 10.245 -3.714 1.00 1.00 H new ATOM 0 HG23 VAL B 8 8.927 10.601 -3.109 1.00 1.00 H new ATOM 998 N GLY B 9 10.964 6.205 -1.425 1.00 1.00 N ATOM 999 CA GLY B 9 11.422 5.147 -0.538 1.00 1.00 C ATOM 1000 C GLY B 9 10.736 3.811 -0.818 1.00 1.00 C ATOM 1001 O GLY B 9 11.168 2.784 -0.296 1.00 1.00 O ATOM 0 H GLY B 9 11.389 6.168 -2.352 1.00 1.00 H new ATOM 0 HA2 GLY B 9 12.500 5.028 -0.646 1.00 1.00 H new ATOM 0 HA3 GLY B 9 11.236 5.438 0.496 1.00 1.00 H new ATOM 1005 N GLU B 10 9.677 3.807 -1.634 1.00 1.00 N ATOM 1006 CA GLU B 10 8.991 2.580 -2.011 1.00 1.00 C ATOM 1007 C GLU B 10 9.730 1.898 -3.166 1.00 1.00 C ATOM 1008 O GLU B 10 10.701 2.441 -3.698 1.00 1.00 O ATOM 1009 CB GLU B 10 7.545 2.887 -2.403 1.00 1.00 C ATOM 1010 CG GLU B 10 6.764 3.503 -1.241 1.00 1.00 C ATOM 1011 CD GLU B 10 6.657 2.543 -0.057 1.00 1.00 C ATOM 1012 OE1 GLU B 10 5.814 1.622 -0.135 1.00 1.00 O ATOM 1013 OE2 GLU B 10 7.418 2.737 0.918 1.00 1.00 O ATOM 0 H GLU B 10 9.278 4.651 -2.046 1.00 1.00 H new ATOM 0 HA GLU B 10 8.981 1.901 -1.158 1.00 1.00 H new ATOM 0 HB2 GLU B 10 7.535 3.571 -3.252 1.00 1.00 H new ATOM 0 HB3 GLU B 10 7.053 1.970 -2.727 1.00 1.00 H new ATOM 0 HG2 GLU B 10 7.254 4.422 -0.920 1.00 1.00 H new ATOM 0 HG3 GLU B 10 5.764 3.776 -1.579 1.00 1.00 H new ATOM 1020 N SER B 11 9.272 0.705 -3.556 1.00 1.00 N ATOM 1021 CA SER B 11 9.954 -0.097 -4.564 1.00 1.00 C ATOM 1022 C SER B 11 8.976 -0.916 -5.399 1.00 1.00 C ATOM 1023 O SER B 11 7.778 -0.963 -5.120 1.00 1.00 O ATOM 1024 CB SER B 11 10.947 -1.043 -3.882 1.00 1.00 C ATOM 1025 OG SER B 11 11.958 -0.311 -3.222 1.00 1.00 O ATOM 0 H SER B 11 8.426 0.275 -3.183 1.00 1.00 H new ATOM 0 HA SER B 11 10.477 0.588 -5.232 1.00 1.00 H new ATOM 0 HB2 SER B 11 10.422 -1.675 -3.166 1.00 1.00 H new ATOM 0 HB3 SER B 11 11.395 -1.705 -4.623 1.00 1.00 H new ATOM 0 HG SER B 11 12.735 -0.221 -3.812 1.00 1.00 H new ATOM 1031 N ILE B 12 9.521 -1.563 -6.434 1.00 1.00 N ATOM 1032 CA ILE B 12 8.816 -2.429 -7.367 1.00 1.00 C ATOM 1033 C ILE B 12 9.708 -3.644 -7.628 1.00 1.00 C ATOM 1034 O ILE B 12 10.885 -3.636 -7.276 1.00 1.00 O ATOM 1035 CB ILE B 12 8.509 -1.643 -8.654 1.00 1.00 C ATOM 1036 CG1 ILE B 12 7.582 -0.475 -8.298 1.00 1.00 C ATOM 1037 CG2 ILE B 12 7.852 -2.512 -9.734 1.00 1.00 C ATOM 1038 CD1 ILE B 12 7.225 0.363 -9.523 1.00 1.00 C ATOM 0 H ILE B 12 10.515 -1.489 -6.649 1.00 1.00 H new ATOM 0 HA ILE B 12 7.862 -2.771 -6.965 1.00 1.00 H new ATOM 0 HB ILE B 12 9.453 -1.286 -9.067 1.00 1.00 H new ATOM 0 HG12 ILE B 12 6.669 -0.861 -7.844 1.00 1.00 H new ATOM 0 HG13 ILE B 12 8.065 0.158 -7.554 1.00 1.00 H new ATOM 0 HG21 ILE B 12 7.658 -1.907 -10.619 1.00 1.00 H new ATOM 0 HG22 ILE B 12 8.519 -3.334 -9.995 1.00 1.00 H new ATOM 0 HG23 ILE B 12 6.912 -2.914 -9.356 1.00 1.00 H new ATOM 0 HD11 ILE B 12 6.567 1.180 -9.226 1.00 1.00 H new ATOM 0 HD12 ILE B 12 8.135 0.772 -9.962 1.00 1.00 H new ATOM 0 HD13 ILE B 12 6.718 -0.263 -10.257 1.00 1.00 H new ATOM 1050 N ASN B 13 9.160 -4.691 -8.245 1.00 1.00 N ATOM 1051 CA ASN B 13 9.898 -5.916 -8.513 1.00 1.00 C ATOM 1052 C ASN B 13 9.656 -6.391 -9.939 1.00 1.00 C ATOM 1053 O ASN B 13 8.625 -6.087 -10.539 1.00 1.00 O ATOM 1054 CB ASN B 13 9.474 -6.995 -7.514 1.00 1.00 C ATOM 1055 CG ASN B 13 9.931 -6.654 -6.104 1.00 1.00 C ATOM 1056 OD1 ASN B 13 9.131 -6.273 -5.255 1.00 1.00 O ATOM 1057 ND2 ASN B 13 11.229 -6.793 -5.850 1.00 1.00 N ATOM 0 H ASN B 13 8.194 -4.710 -8.571 1.00 1.00 H new ATOM 0 HA ASN B 13 10.964 -5.718 -8.400 1.00 1.00 H new ATOM 0 HB2 ASN B 13 8.389 -7.103 -7.531 1.00 1.00 H new ATOM 0 HB3 ASN B 13 9.895 -7.955 -7.813 1.00 1.00 H new ATOM 0 HD21 ASN B 13 11.593 -6.580 -4.921 1.00 1.00 H new ATOM 0 HD22 ASN B 13 11.861 -7.113 -6.584 1.00 1.00 H new ATOM 1064 N ILE B 14 10.622 -7.143 -10.475 1.00 1.00 N ATOM 1065 CA ILE B 14 10.560 -7.691 -11.823 1.00 1.00 C ATOM 1066 C ILE B 14 11.187 -9.084 -11.814 1.00 1.00 C ATOM 1067 O ILE B 14 12.095 -9.355 -11.026 1.00 1.00 O ATOM 1068 CB ILE B 14 11.292 -6.757 -12.804 1.00 1.00 C ATOM 1069 CG1 ILE B 14 10.681 -5.348 -12.767 1.00 1.00 C ATOM 1070 CG2 ILE B 14 11.210 -7.323 -14.226 1.00 1.00 C ATOM 1071 CD1 ILE B 14 11.416 -4.374 -13.687 1.00 1.00 C ATOM 0 H ILE B 14 11.477 -7.388 -9.975 1.00 1.00 H new ATOM 0 HA ILE B 14 9.524 -7.770 -12.151 1.00 1.00 H new ATOM 0 HB ILE B 14 12.338 -6.691 -12.503 1.00 1.00 H new ATOM 0 HG12 ILE B 14 9.633 -5.401 -13.061 1.00 1.00 H new ATOM 0 HG13 ILE B 14 10.707 -4.970 -11.745 1.00 1.00 H new ATOM 0 HG21 ILE B 14 11.730 -6.656 -14.914 1.00 1.00 H new ATOM 0 HG22 ILE B 14 11.676 -8.308 -14.253 1.00 1.00 H new ATOM 0 HG23 ILE B 14 10.165 -7.408 -14.524 1.00 1.00 H new ATOM 0 HD11 ILE B 14 10.947 -3.392 -13.626 1.00 1.00 H new ATOM 0 HD12 ILE B 14 12.459 -4.298 -13.378 1.00 1.00 H new ATOM 0 HD13 ILE B 14 11.367 -4.736 -14.714 1.00 1.00 H new ATOM 1083 N GLY B 15 10.702 -9.966 -12.692 1.00 1.00 N ATOM 1084 CA GLY B 15 11.187 -11.333 -12.789 1.00 1.00 C ATOM 1085 C GLY B 15 11.100 -12.028 -11.433 1.00 1.00 C ATOM 1086 O GLY B 15 10.026 -12.111 -10.841 1.00 1.00 O ATOM 0 H GLY B 15 9.959 -9.745 -13.355 1.00 1.00 H new ATOM 0 HA2 GLY B 15 10.599 -11.882 -13.524 1.00 1.00 H new ATOM 0 HA3 GLY B 15 12.219 -11.335 -13.140 1.00 1.00 H new ATOM 1090 N ASP B 16 12.239 -12.525 -10.947 1.00 1.00 N ATOM 1091 CA ASP B 16 12.335 -13.174 -9.646 1.00 1.00 C ATOM 1092 C ASP B 16 13.630 -12.775 -8.929 1.00 1.00 C ATOM 1093 O ASP B 16 13.907 -13.262 -7.834 1.00 1.00 O ATOM 1094 CB ASP B 16 12.247 -14.689 -9.850 1.00 1.00 C ATOM 1095 CG ASP B 16 12.137 -15.444 -8.529 1.00 1.00 C ATOM 1096 OD1 ASP B 16 11.191 -15.144 -7.767 1.00 1.00 O ATOM 1097 OD2 ASP B 16 13.001 -16.319 -8.289 1.00 1.00 O ATOM 0 H ASP B 16 13.125 -12.486 -11.452 1.00 1.00 H new ATOM 0 HA ASP B 16 11.512 -12.850 -9.009 1.00 1.00 H new ATOM 0 HB2 ASP B 16 11.382 -14.920 -10.472 1.00 1.00 H new ATOM 0 HB3 ASP B 16 13.129 -15.033 -10.390 1.00 1.00 H new ATOM 1102 N ASP B 17 14.428 -11.893 -9.541 1.00 1.00 N ATOM 1103 CA ASP B 17 15.727 -11.494 -9.014 1.00 1.00 C ATOM 1104 C ASP B 17 15.994 -9.996 -9.189 1.00 1.00 C ATOM 1105 O ASP B 17 17.093 -9.538 -8.880 1.00 1.00 O ATOM 1106 CB ASP B 17 16.827 -12.298 -9.714 1.00 1.00 C ATOM 1107 CG ASP B 17 16.698 -13.795 -9.449 1.00 1.00 C ATOM 1108 OD1 ASP B 17 17.133 -14.227 -8.358 1.00 1.00 O ATOM 1109 OD2 ASP B 17 16.167 -14.496 -10.338 1.00 1.00 O ATOM 0 H ASP B 17 14.185 -11.437 -10.420 1.00 1.00 H new ATOM 0 HA ASP B 17 15.726 -11.700 -7.944 1.00 1.00 H new ATOM 0 HB2 ASP B 17 16.782 -12.115 -10.788 1.00 1.00 H new ATOM 0 HB3 ASP B 17 17.802 -11.952 -9.372 1.00 1.00 H new ATOM 1114 N ILE B 18 15.015 -9.226 -9.679 1.00 1.00 N ATOM 1115 CA ILE B 18 15.222 -7.811 -9.964 1.00 1.00 C ATOM 1116 C ILE B 18 14.292 -6.949 -9.112 1.00 1.00 C ATOM 1117 O ILE B 18 13.150 -7.325 -8.850 1.00 1.00 O ATOM 1118 CB ILE B 18 15.014 -7.563 -11.466 1.00 1.00 C ATOM 1119 CG1 ILE B 18 16.030 -8.390 -12.267 1.00 1.00 C ATOM 1120 CG2 ILE B 18 15.167 -6.073 -11.792 1.00 1.00 C ATOM 1121 CD1 ILE B 18 15.778 -8.306 -13.774 1.00 1.00 C ATOM 0 H ILE B 18 14.075 -9.563 -9.884 1.00 1.00 H new ATOM 0 HA ILE B 18 16.243 -7.529 -9.706 1.00 1.00 H new ATOM 0 HB ILE B 18 14.004 -7.869 -11.740 1.00 1.00 H new ATOM 0 HG12 ILE B 18 17.038 -8.037 -12.048 1.00 1.00 H new ATOM 0 HG13 ILE B 18 15.981 -9.431 -11.949 1.00 1.00 H new ATOM 0 HG21 ILE B 18 15.016 -5.917 -12.860 1.00 1.00 H new ATOM 0 HG22 ILE B 18 14.426 -5.500 -11.234 1.00 1.00 H new ATOM 0 HG23 ILE B 18 16.167 -5.741 -11.514 1.00 1.00 H new ATOM 0 HD11 ILE B 18 16.520 -8.906 -14.301 1.00 1.00 H new ATOM 0 HD12 ILE B 18 14.780 -8.684 -13.998 1.00 1.00 H new ATOM 0 HD13 ILE B 18 15.854 -7.268 -14.098 1.00 1.00 H new ATOM 1133 N THR B 19 14.790 -5.786 -8.679 1.00 1.00 N ATOM 1134 CA THR B 19 14.035 -4.843 -7.866 1.00 1.00 C ATOM 1135 C THR B 19 14.334 -3.425 -8.335 1.00 1.00 C ATOM 1136 O THR B 19 15.458 -3.129 -8.733 1.00 1.00 O ATOM 1137 CB THR B 19 14.433 -5.016 -6.395 1.00 1.00 C ATOM 1138 OG1 THR B 19 14.197 -6.347 -5.989 1.00 1.00 O ATOM 1139 CG2 THR B 19 13.638 -4.090 -5.477 1.00 1.00 C ATOM 0 H THR B 19 15.739 -5.475 -8.888 1.00 1.00 H new ATOM 0 HA THR B 19 12.966 -5.030 -7.968 1.00 1.00 H new ATOM 0 HB THR B 19 15.491 -4.766 -6.316 1.00 1.00 H new ATOM 0 HG1 THR B 19 14.454 -6.453 -5.049 1.00 1.00 H new ATOM 0 HG21 THR B 19 13.951 -4.245 -4.444 1.00 1.00 H new ATOM 0 HG22 THR B 19 13.820 -3.053 -5.760 1.00 1.00 H new ATOM 0 HG23 THR B 19 12.575 -4.310 -5.571 1.00 1.00 H new ATOM 1147 N ILE B 20 13.326 -2.550 -8.286 1.00 1.00 N ATOM 1148 CA ILE B 20 13.452 -1.156 -8.687 1.00 1.00 C ATOM 1149 C ILE B 20 13.043 -0.296 -7.496 1.00 1.00 C ATOM 1150 O ILE B 20 12.191 -0.710 -6.713 1.00 1.00 O ATOM 1151 CB ILE B 20 12.551 -0.873 -9.901 1.00 1.00 C ATOM 1152 CG1 ILE B 20 12.660 -1.944 -10.999 1.00 1.00 C ATOM 1153 CG2 ILE B 20 12.868 0.504 -10.489 1.00 1.00 C ATOM 1154 CD1 ILE B 20 14.057 -2.047 -11.611 1.00 1.00 C ATOM 0 H ILE B 20 12.391 -2.798 -7.962 1.00 1.00 H new ATOM 0 HA ILE B 20 14.477 -0.928 -8.978 1.00 1.00 H new ATOM 0 HB ILE B 20 11.525 -0.896 -9.534 1.00 1.00 H new ATOM 0 HG12 ILE B 20 12.382 -2.912 -10.581 1.00 1.00 H new ATOM 0 HG13 ILE B 20 11.942 -1.720 -11.788 1.00 1.00 H new ATOM 0 HG21 ILE B 20 12.223 0.690 -11.347 1.00 1.00 H new ATOM 0 HG22 ILE B 20 12.697 1.271 -9.733 1.00 1.00 H new ATOM 0 HG23 ILE B 20 13.911 0.533 -10.806 1.00 1.00 H new ATOM 0 HD11 ILE B 20 14.062 -2.821 -12.378 1.00 1.00 H new ATOM 0 HD12 ILE B 20 14.330 -1.091 -12.059 1.00 1.00 H new ATOM 0 HD13 ILE B 20 14.777 -2.302 -10.833 1.00 1.00 H new ATOM 1166 N THR B 21 13.630 0.893 -7.343 1.00 1.00 N ATOM 1167 CA THR B 21 13.341 1.739 -6.191 1.00 1.00 C ATOM 1168 C THR B 21 13.297 3.208 -6.600 1.00 1.00 C ATOM 1169 O THR B 21 13.913 3.598 -7.592 1.00 1.00 O ATOM 1170 CB THR B 21 14.419 1.507 -5.122 1.00 1.00 C ATOM 1171 OG1 THR B 21 14.494 0.134 -4.808 1.00 1.00 O ATOM 1172 CG2 THR B 21 14.128 2.262 -3.827 1.00 1.00 C ATOM 0 H THR B 21 14.304 1.287 -8.000 1.00 1.00 H new ATOM 0 HA THR B 21 12.364 1.479 -5.785 1.00 1.00 H new ATOM 0 HB THR B 21 15.356 1.873 -5.540 1.00 1.00 H new ATOM 0 HG1 THR B 21 15.184 -0.009 -4.127 1.00 1.00 H new ATOM 0 HG21 THR B 21 14.920 2.064 -3.105 1.00 1.00 H new ATOM 0 HG22 THR B 21 14.083 3.332 -4.032 1.00 1.00 H new ATOM 0 HG23 THR B 21 13.173 1.930 -3.419 1.00 1.00 H new ATOM 1180 N ILE B 22 12.567 4.021 -5.831 1.00 1.00 N ATOM 1181 CA ILE B 22 12.500 5.462 -6.017 1.00 1.00 C ATOM 1182 C ILE B 22 13.164 6.113 -4.805 1.00 1.00 C ATOM 1183 O ILE B 22 12.552 6.264 -3.749 1.00 1.00 O ATOM 1184 CB ILE B 22 11.049 5.908 -6.261 1.00 1.00 C ATOM 1185 CG1 ILE B 22 10.892 7.430 -6.168 1.00 1.00 C ATOM 1186 CG2 ILE B 22 10.069 5.257 -5.283 1.00 1.00 C ATOM 1187 CD1 ILE B 22 11.763 8.144 -7.200 1.00 1.00 C ATOM 0 H ILE B 22 12.000 3.686 -5.052 1.00 1.00 H new ATOM 0 HA ILE B 22 13.041 5.783 -6.908 1.00 1.00 H new ATOM 0 HB ILE B 22 10.812 5.581 -7.273 1.00 1.00 H new ATOM 0 HG12 ILE B 22 9.847 7.700 -6.322 1.00 1.00 H new ATOM 0 HG13 ILE B 22 11.163 7.765 -5.167 1.00 1.00 H new ATOM 0 HG21 ILE B 22 9.058 5.604 -5.496 1.00 1.00 H new ATOM 0 HG22 ILE B 22 10.112 4.173 -5.392 1.00 1.00 H new ATOM 0 HG23 ILE B 22 10.338 5.529 -4.263 1.00 1.00 H new ATOM 0 HD11 ILE B 22 11.628 9.222 -7.107 1.00 1.00 H new ATOM 0 HD12 ILE B 22 12.810 7.893 -7.028 1.00 1.00 H new ATOM 0 HD13 ILE B 22 11.474 7.827 -8.202 1.00 1.00 H new ATOM 1199 N LEU B 23 14.431 6.501 -4.963 1.00 1.00 N ATOM 1200 CA LEU B 23 15.231 7.001 -3.857 1.00 1.00 C ATOM 1201 C LEU B 23 14.755 8.393 -3.455 1.00 1.00 C ATOM 1202 O LEU B 23 14.892 8.783 -2.297 1.00 1.00 O ATOM 1203 CB LEU B 23 16.707 7.070 -4.255 1.00 1.00 C ATOM 1204 CG LEU B 23 17.173 5.910 -5.142 1.00 1.00 C ATOM 1205 CD1 LEU B 23 18.652 6.103 -5.453 1.00 1.00 C ATOM 1206 CD2 LEU B 23 16.991 4.556 -4.466 1.00 1.00 C ATOM 0 H LEU B 23 14.923 6.476 -5.856 1.00 1.00 H new ATOM 0 HA LEU B 23 15.117 6.318 -3.015 1.00 1.00 H new ATOM 0 HB2 LEU B 23 16.887 8.009 -4.779 1.00 1.00 H new ATOM 0 HB3 LEU B 23 17.315 7.088 -3.351 1.00 1.00 H new ATOM 0 HG LEU B 23 16.567 5.915 -6.048 1.00 1.00 H new ATOM 0 HD11 LEU B 23 19.001 5.286 -6.084 1.00 1.00 H new ATOM 0 HD12 LEU B 23 18.794 7.050 -5.974 1.00 1.00 H new ATOM 0 HD13 LEU B 23 19.221 6.112 -4.523 1.00 1.00 H new ATOM 0 HD21 LEU B 23 17.335 3.767 -5.134 1.00 1.00 H new ATOM 0 HD22 LEU B 23 17.571 4.529 -3.543 1.00 1.00 H new ATOM 0 HD23 LEU B 23 15.937 4.403 -4.237 1.00 1.00 H new ATOM 1218 N GLY B 24 14.195 9.137 -4.414 1.00 1.00 N ATOM 1219 CA GLY B 24 13.603 10.435 -4.132 1.00 1.00 C ATOM 1220 C GLY B 24 13.501 11.307 -5.375 1.00 1.00 C ATOM 1221 O GLY B 24 14.041 10.975 -6.428 1.00 1.00 O ATOM 0 H GLY B 24 14.143 8.856 -5.393 1.00 1.00 H new ATOM 0 HA2 GLY B 24 12.609 10.294 -3.708 1.00 1.00 H new ATOM 0 HA3 GLY B 24 14.201 10.948 -3.379 1.00 1.00 H new ATOM 1225 N VAL B 25 12.798 12.433 -5.241 1.00 1.00 N ATOM 1226 CA VAL B 25 12.658 13.393 -6.325 1.00 1.00 C ATOM 1227 C VAL B 25 13.911 14.260 -6.420 1.00 1.00 C ATOM 1228 O VAL B 25 14.703 14.329 -5.480 1.00 1.00 O ATOM 1229 CB VAL B 25 11.416 14.264 -6.105 1.00 1.00 C ATOM 1230 CG1 VAL B 25 10.158 13.393 -6.068 1.00 1.00 C ATOM 1231 CG2 VAL B 25 11.507 15.062 -4.803 1.00 1.00 C ATOM 0 H VAL B 25 12.315 12.699 -4.383 1.00 1.00 H new ATOM 0 HA VAL B 25 12.537 12.852 -7.264 1.00 1.00 H new ATOM 0 HB VAL B 25 11.362 14.965 -6.938 1.00 1.00 H new ATOM 0 HG11 VAL B 25 9.283 14.024 -5.911 1.00 1.00 H new ATOM 0 HG12 VAL B 25 10.056 12.860 -7.013 1.00 1.00 H new ATOM 0 HG13 VAL B 25 10.237 12.674 -5.253 1.00 1.00 H new ATOM 0 HG21 VAL B 25 10.608 15.667 -4.683 1.00 1.00 H new ATOM 0 HG22 VAL B 25 11.597 14.376 -3.961 1.00 1.00 H new ATOM 0 HG23 VAL B 25 12.381 15.713 -4.836 1.00 1.00 H new ATOM 1241 N SER B 26 14.080 14.920 -7.566 1.00 1.00 N ATOM 1242 CA SER B 26 15.190 15.820 -7.845 1.00 1.00 C ATOM 1243 C SER B 26 14.684 16.954 -8.733 1.00 1.00 C ATOM 1244 O SER B 26 15.366 17.381 -9.665 1.00 1.00 O ATOM 1245 CB SER B 26 16.328 15.052 -8.521 1.00 1.00 C ATOM 1246 OG SER B 26 16.831 14.054 -7.659 1.00 1.00 O ATOM 0 H SER B 26 13.427 14.838 -8.346 1.00 1.00 H new ATOM 0 HA SER B 26 15.580 16.240 -6.918 1.00 1.00 H new ATOM 0 HB2 SER B 26 15.969 14.597 -9.444 1.00 1.00 H new ATOM 0 HB3 SER B 26 17.127 15.741 -8.795 1.00 1.00 H new ATOM 0 HG SER B 26 17.557 13.571 -8.106 1.00 1.00 H new ATOM 1252 N GLY B 27 13.476 17.442 -8.439 1.00 1.00 N ATOM 1253 CA GLY B 27 12.823 18.461 -9.241 1.00 1.00 C ATOM 1254 C GLY B 27 12.265 17.819 -10.504 1.00 1.00 C ATOM 1255 O GLY B 27 11.482 16.872 -10.424 1.00 1.00 O ATOM 0 H GLY B 27 12.928 17.136 -7.635 1.00 1.00 H new ATOM 0 HA2 GLY B 27 12.021 18.931 -8.672 1.00 1.00 H new ATOM 0 HA3 GLY B 27 13.532 19.247 -9.500 1.00 1.00 H new ATOM 1259 N GLN B 28 12.666 18.328 -11.672 1.00 1.00 N ATOM 1260 CA GLN B 28 12.275 17.747 -12.946 1.00 1.00 C ATOM 1261 C GLN B 28 13.022 16.431 -13.179 1.00 1.00 C ATOM 1262 O GLN B 28 12.721 15.700 -14.122 1.00 1.00 O ATOM 1263 CB GLN B 28 12.570 18.759 -14.056 1.00 1.00 C ATOM 1264 CG GLN B 28 11.812 18.440 -15.347 1.00 1.00 C ATOM 1265 CD GLN B 28 10.299 18.461 -15.145 1.00 1.00 C ATOM 1266 OE1 GLN B 28 9.603 17.527 -15.531 1.00 1.00 O ATOM 1267 NE2 GLN B 28 9.773 19.524 -14.540 1.00 1.00 N ATOM 0 H GLN B 28 13.266 19.148 -11.755 1.00 1.00 H new ATOM 0 HA GLN B 28 11.209 17.521 -12.945 1.00 1.00 H new ATOM 0 HB2 GLN B 28 12.299 19.758 -13.715 1.00 1.00 H new ATOM 0 HB3 GLN B 28 13.641 18.771 -14.259 1.00 1.00 H new ATOM 0 HG2 GLN B 28 12.085 19.164 -16.115 1.00 1.00 H new ATOM 0 HG3 GLN B 28 12.115 17.459 -15.712 1.00 1.00 H new ATOM 0 HE21 GLN B 28 10.377 20.285 -14.230 1.00 1.00 H new ATOM 0 HE22 GLN B 28 8.766 19.577 -14.386 1.00 1.00 H new ATOM 1276 N GLN B 29 14.002 16.126 -12.318 1.00 1.00 N ATOM 1277 CA GLN B 29 14.740 14.876 -12.384 1.00 1.00 C ATOM 1278 C GLN B 29 14.277 13.955 -11.259 1.00 1.00 C ATOM 1279 O GLN B 29 13.546 14.384 -10.368 1.00 1.00 O ATOM 1280 CB GLN B 29 16.248 15.135 -12.305 1.00 1.00 C ATOM 1281 CG GLN B 29 16.677 16.278 -13.225 1.00 1.00 C ATOM 1282 CD GLN B 29 18.189 16.388 -13.262 1.00 1.00 C ATOM 1283 OE1 GLN B 29 18.833 15.911 -14.192 1.00 1.00 O ATOM 1284 NE2 GLN B 29 18.777 17.016 -12.252 1.00 1.00 N ATOM 0 H GLN B 29 14.298 16.743 -11.561 1.00 1.00 H new ATOM 0 HA GLN B 29 14.542 14.389 -13.339 1.00 1.00 H new ATOM 0 HB2 GLN B 29 16.522 15.373 -11.277 1.00 1.00 H new ATOM 0 HB3 GLN B 29 16.787 14.228 -12.577 1.00 1.00 H new ATOM 0 HG2 GLN B 29 16.294 16.107 -14.231 1.00 1.00 H new ATOM 0 HG3 GLN B 29 16.246 17.216 -12.875 1.00 1.00 H new ATOM 0 HE21 GLN B 29 18.214 17.402 -11.494 1.00 1.00 H new ATOM 0 HE22 GLN B 29 19.792 17.113 -12.234 1.00 1.00 H new ATOM 1293 N VAL B 30 14.699 12.689 -11.292 1.00 1.00 N ATOM 1294 CA VAL B 30 14.283 11.707 -10.303 1.00 1.00 C ATOM 1295 C VAL B 30 15.414 10.722 -10.020 1.00 1.00 C ATOM 1296 O VAL B 30 15.951 10.106 -10.940 1.00 1.00 O ATOM 1297 CB VAL B 30 13.053 10.946 -10.819 1.00 1.00 C ATOM 1298 CG1 VAL B 30 12.518 10.030 -9.721 1.00 1.00 C ATOM 1299 CG2 VAL B 30 11.919 11.888 -11.226 1.00 1.00 C ATOM 0 H VAL B 30 15.334 12.323 -12.002 1.00 1.00 H new ATOM 0 HA VAL B 30 14.031 12.226 -9.378 1.00 1.00 H new ATOM 0 HB VAL B 30 13.375 10.380 -11.693 1.00 1.00 H new ATOM 0 HG11 VAL B 30 11.645 9.491 -10.090 1.00 1.00 H new ATOM 0 HG12 VAL B 30 13.290 9.316 -9.434 1.00 1.00 H new ATOM 0 HG13 VAL B 30 12.236 10.627 -8.854 1.00 1.00 H new ATOM 0 HG21 VAL B 30 11.071 11.304 -11.584 1.00 1.00 H new ATOM 0 HG22 VAL B 30 11.612 12.482 -10.365 1.00 1.00 H new ATOM 0 HG23 VAL B 30 12.264 12.551 -12.020 1.00 1.00 H new ATOM 1309 N ARG B 31 15.776 10.574 -8.741 1.00 1.00 N ATOM 1310 CA ARG B 31 16.728 9.563 -8.305 1.00 1.00 C ATOM 1311 C ARG B 31 16.021 8.218 -8.224 1.00 1.00 C ATOM 1312 O ARG B 31 15.281 7.951 -7.275 1.00 1.00 O ATOM 1313 CB ARG B 31 17.313 9.918 -6.939 1.00 1.00 C ATOM 1314 CG ARG B 31 18.617 10.703 -7.056 1.00 1.00 C ATOM 1315 CD ARG B 31 19.724 9.791 -7.582 1.00 1.00 C ATOM 1316 NE ARG B 31 21.031 10.457 -7.539 1.00 1.00 N ATOM 1317 CZ ARG B 31 21.893 10.369 -6.521 1.00 1.00 C ATOM 1318 NH1 ARG B 31 21.604 9.637 -5.450 1.00 1.00 N ATOM 1319 NH2 ARG B 31 23.056 11.014 -6.569 1.00 1.00 N ATOM 0 H ARG B 31 15.414 11.154 -7.984 1.00 1.00 H new ATOM 0 HA ARG B 31 17.545 9.515 -9.025 1.00 1.00 H new ATOM 0 HB2 ARG B 31 16.587 10.505 -6.376 1.00 1.00 H new ATOM 0 HB3 ARG B 31 17.491 9.004 -6.373 1.00 1.00 H new ATOM 0 HG2 ARG B 31 18.483 11.551 -7.727 1.00 1.00 H new ATOM 0 HG3 ARG B 31 18.898 11.107 -6.083 1.00 1.00 H new ATOM 0 HD2 ARG B 31 19.759 8.878 -6.987 1.00 1.00 H new ATOM 0 HD3 ARG B 31 19.498 9.495 -8.606 1.00 1.00 H new ATOM 0 HE ARG B 31 21.300 11.026 -8.341 1.00 1.00 H new ATOM 0 HH11 ARG B 31 20.717 9.135 -5.399 1.00 1.00 H new ATOM 0 HH12 ARG B 31 22.269 9.577 -4.679 1.00 1.00 H new ATOM 0 HH21 ARG B 31 23.293 11.578 -7.385 1.00 1.00 H new ATOM 0 HH22 ARG B 31 23.711 10.944 -5.790 1.00 1.00 H new ATOM 1333 N ILE B 32 16.264 7.383 -9.235 1.00 1.00 N ATOM 1334 CA ILE B 32 15.714 6.040 -9.343 1.00 1.00 C ATOM 1335 C ILE B 32 16.865 5.043 -9.226 1.00 1.00 C ATOM 1336 O ILE B 32 18.011 5.377 -9.528 1.00 1.00 O ATOM 1337 CB ILE B 32 14.982 5.897 -10.688 1.00 1.00 C ATOM 1338 CG1 ILE B 32 13.899 6.977 -10.809 1.00 1.00 C ATOM 1339 CG2 ILE B 32 14.350 4.507 -10.825 1.00 1.00 C ATOM 1340 CD1 ILE B 32 13.196 6.944 -12.168 1.00 1.00 C ATOM 0 H ILE B 32 16.865 7.633 -10.020 1.00 1.00 H new ATOM 0 HA ILE B 32 14.994 5.846 -8.548 1.00 1.00 H new ATOM 0 HB ILE B 32 15.710 6.022 -11.489 1.00 1.00 H new ATOM 0 HG12 ILE B 32 13.162 6.840 -10.018 1.00 1.00 H new ATOM 0 HG13 ILE B 32 14.349 7.958 -10.659 1.00 1.00 H new ATOM 0 HG21 ILE B 32 13.839 4.433 -11.785 1.00 1.00 H new ATOM 0 HG22 ILE B 32 15.129 3.746 -10.769 1.00 1.00 H new ATOM 0 HG23 ILE B 32 13.633 4.352 -10.019 1.00 1.00 H new ATOM 0 HD11 ILE B 32 12.438 7.727 -12.205 1.00 1.00 H new ATOM 0 HD12 ILE B 32 13.927 7.109 -12.960 1.00 1.00 H new ATOM 0 HD13 ILE B 32 12.721 5.973 -12.309 1.00 1.00 H new ATOM 1352 N GLY B 33 16.568 3.818 -8.789 1.00 1.00 N ATOM 1353 CA GLY B 33 17.569 2.771 -8.680 1.00 1.00 C ATOM 1354 C GLY B 33 17.077 1.493 -9.344 1.00 1.00 C ATOM 1355 O GLY B 33 15.885 1.197 -9.328 1.00 1.00 O ATOM 0 H GLY B 33 15.632 3.531 -8.504 1.00 1.00 H new ATOM 0 HA2 GLY B 33 18.498 3.097 -9.148 1.00 1.00 H new ATOM 0 HA3 GLY B 33 17.792 2.580 -7.630 1.00 1.00 H new ATOM 1359 N ILE B 34 18.010 0.737 -9.927 1.00 1.00 N ATOM 1360 CA ILE B 34 17.724 -0.514 -10.614 1.00 1.00 C ATOM 1361 C ILE B 34 18.657 -1.581 -10.053 1.00 1.00 C ATOM 1362 O ILE B 34 19.865 -1.536 -10.281 1.00 1.00 O ATOM 1363 CB ILE B 34 17.908 -0.359 -12.131 1.00 1.00 C ATOM 1364 CG1 ILE B 34 16.941 0.663 -12.741 1.00 1.00 C ATOM 1365 CG2 ILE B 34 17.651 -1.713 -12.796 1.00 1.00 C ATOM 1366 CD1 ILE B 34 17.503 2.086 -12.709 1.00 1.00 C ATOM 0 H ILE B 34 18.999 0.985 -9.932 1.00 1.00 H new ATOM 0 HA ILE B 34 16.687 -0.805 -10.449 1.00 1.00 H new ATOM 0 HB ILE B 34 18.925 -0.006 -12.303 1.00 1.00 H new ATOM 0 HG12 ILE B 34 16.724 0.384 -13.772 1.00 1.00 H new ATOM 0 HG13 ILE B 34 15.997 0.636 -12.198 1.00 1.00 H new ATOM 0 HG21 ILE B 34 17.778 -1.619 -13.874 1.00 1.00 H new ATOM 0 HG22 ILE B 34 18.358 -2.448 -12.410 1.00 1.00 H new ATOM 0 HG23 ILE B 34 16.634 -2.038 -12.578 1.00 1.00 H new ATOM 0 HD11 ILE B 34 16.781 2.772 -13.152 1.00 1.00 H new ATOM 0 HD12 ILE B 34 17.695 2.378 -11.677 1.00 1.00 H new ATOM 0 HD13 ILE B 34 18.433 2.123 -13.276 1.00 1.00 H new ATOM 1378 N ASN B 35 18.099 -2.542 -9.315 1.00 1.00 N ATOM 1379 CA ASN B 35 18.879 -3.589 -8.681 1.00 1.00 C ATOM 1380 C ASN B 35 18.657 -4.921 -9.382 1.00 1.00 C ATOM 1381 O ASN B 35 17.583 -5.511 -9.302 1.00 1.00 O ATOM 1382 CB ASN B 35 18.520 -3.672 -7.203 1.00 1.00 C ATOM 1383 CG ASN B 35 19.485 -4.583 -6.458 1.00 1.00 C ATOM 1384 OD1 ASN B 35 20.685 -4.325 -6.427 1.00 1.00 O ATOM 1385 ND2 ASN B 35 18.973 -5.652 -5.855 1.00 1.00 N ATOM 0 H ASN B 35 17.096 -2.610 -9.144 1.00 1.00 H new ATOM 0 HA ASN B 35 19.939 -3.348 -8.765 1.00 1.00 H new ATOM 0 HB2 ASN B 35 18.542 -2.675 -6.763 1.00 1.00 H new ATOM 0 HB3 ASN B 35 17.502 -4.046 -7.093 1.00 1.00 H new ATOM 0 HD21 ASN B 35 19.583 -6.291 -5.345 1.00 1.00 H new ATOM 0 HD22 ASN B 35 17.970 -5.833 -5.903 1.00 1.00 H new ATOM 1392 N ALA B 36 19.699 -5.381 -10.071 1.00 1.00 N ATOM 1393 CA ALA B 36 19.692 -6.630 -10.812 1.00 1.00 C ATOM 1394 C ALA B 36 21.058 -7.297 -10.673 1.00 1.00 C ATOM 1395 O ALA B 36 22.055 -6.610 -10.449 1.00 1.00 O ATOM 1396 CB ALA B 36 19.375 -6.318 -12.273 1.00 1.00 C ATOM 0 H ALA B 36 20.587 -4.882 -10.128 1.00 1.00 H new ATOM 0 HA ALA B 36 18.937 -7.314 -10.424 1.00 1.00 H new ATOM 0 HB1 ALA B 36 19.365 -7.243 -12.849 1.00 1.00 H new ATOM 0 HB2 ALA B 36 18.398 -5.839 -12.339 1.00 1.00 H new ATOM 0 HB3 ALA B 36 20.136 -5.649 -12.675 1.00 1.00 H new ATOM 1402 N PRO B 37 21.129 -8.628 -10.802 1.00 1.00 N ATOM 1403 CA PRO B 37 22.378 -9.356 -10.686 1.00 1.00 C ATOM 1404 C PRO B 37 23.257 -9.092 -11.906 1.00 1.00 C ATOM 1405 O PRO B 37 22.769 -8.670 -12.953 1.00 1.00 O ATOM 1406 CB PRO B 37 21.966 -10.826 -10.599 1.00 1.00 C ATOM 1407 CG PRO B 37 20.660 -10.870 -11.390 1.00 1.00 C ATOM 1408 CD PRO B 37 20.019 -9.524 -11.063 1.00 1.00 C ATOM 0 HA PRO B 37 22.964 -9.054 -9.818 1.00 1.00 H new ATOM 0 HB2 PRO B 37 22.721 -11.482 -11.032 1.00 1.00 H new ATOM 0 HB3 PRO B 37 21.822 -11.143 -9.566 1.00 1.00 H new ATOM 0 HG2 PRO B 37 20.839 -10.983 -12.459 1.00 1.00 H new ATOM 0 HG3 PRO B 37 20.029 -11.704 -11.082 1.00 1.00 H new ATOM 0 HD2 PRO B 37 19.410 -9.166 -11.893 1.00 1.00 H new ATOM 0 HD3 PRO B 37 19.362 -9.601 -10.196 1.00 1.00 H new ATOM 1416 N LYS B 38 24.562 -9.340 -11.773 1.00 1.00 N ATOM 1417 CA LYS B 38 25.521 -9.133 -12.851 1.00 1.00 C ATOM 1418 C LYS B 38 25.277 -10.113 -14.002 1.00 1.00 C ATOM 1419 O LYS B 38 25.951 -10.042 -15.028 1.00 1.00 O ATOM 1420 CB LYS B 38 26.938 -9.280 -12.287 1.00 1.00 C ATOM 1421 CG LYS B 38 27.261 -8.189 -11.255 1.00 1.00 C ATOM 1422 CD LYS B 38 28.049 -7.024 -11.858 1.00 1.00 C ATOM 1423 CE LYS B 38 27.233 -6.271 -12.905 1.00 1.00 C ATOM 1424 NZ LYS B 38 27.961 -5.077 -13.373 1.00 1.00 N ATOM 0 H LYS B 38 24.980 -9.691 -10.911 1.00 1.00 H new ATOM 0 HA LYS B 38 25.398 -8.129 -13.258 1.00 1.00 H new ATOM 0 HB2 LYS B 38 27.044 -10.261 -11.823 1.00 1.00 H new ATOM 0 HB3 LYS B 38 27.660 -9.233 -13.102 1.00 1.00 H new ATOM 0 HG2 LYS B 38 26.332 -7.812 -10.828 1.00 1.00 H new ATOM 0 HG3 LYS B 38 27.834 -8.626 -10.437 1.00 1.00 H new ATOM 0 HD2 LYS B 38 28.346 -6.337 -11.066 1.00 1.00 H new ATOM 0 HD3 LYS B 38 28.965 -7.401 -12.313 1.00 1.00 H new ATOM 0 HE2 LYS B 38 27.020 -6.927 -13.749 1.00 1.00 H new ATOM 0 HE3 LYS B 38 26.273 -5.975 -12.482 1.00 1.00 H new ATOM 0 HZ1 LYS B 38 27.389 -4.579 -14.085 1.00 1.00 H new ATOM 0 HZ2 LYS B 38 28.142 -4.443 -12.569 1.00 1.00 H new ATOM 0 HZ3 LYS B 38 28.866 -5.366 -13.796 1.00 1.00 H new ATOM 1438 N ASP B 39 24.317 -11.029 -13.835 1.00 1.00 N ATOM 1439 CA ASP B 39 23.922 -11.991 -14.853 1.00 1.00 C ATOM 1440 C ASP B 39 23.056 -11.340 -15.933 1.00 1.00 C ATOM 1441 O ASP B 39 22.783 -11.958 -16.962 1.00 1.00 O ATOM 1442 CB ASP B 39 23.137 -13.119 -14.186 1.00 1.00 C ATOM 1443 CG ASP B 39 24.029 -13.951 -13.267 1.00 1.00 C ATOM 1444 OD1 ASP B 39 24.736 -14.834 -13.801 1.00 1.00 O ATOM 1445 OD2 ASP B 39 23.998 -13.697 -12.043 1.00 1.00 O ATOM 0 H ASP B 39 23.786 -11.119 -12.969 1.00 1.00 H new ATOM 0 HA ASP B 39 24.821 -12.378 -15.332 1.00 1.00 H new ATOM 0 HB2 ASP B 39 22.311 -12.699 -13.612 1.00 1.00 H new ATOM 0 HB3 ASP B 39 22.700 -13.761 -14.950 1.00 1.00 H new ATOM 1450 N VAL B 40 22.622 -10.096 -15.705 1.00 1.00 N ATOM 1451 CA VAL B 40 21.806 -9.344 -16.649 1.00 1.00 C ATOM 1452 C VAL B 40 22.364 -7.931 -16.793 1.00 1.00 C ATOM 1453 O VAL B 40 23.286 -7.548 -16.071 1.00 1.00 O ATOM 1454 CB VAL B 40 20.338 -9.320 -16.200 1.00 1.00 C ATOM 1455 CG1 VAL B 40 19.781 -10.736 -16.060 1.00 1.00 C ATOM 1456 CG2 VAL B 40 20.179 -8.633 -14.847 1.00 1.00 C ATOM 0 H VAL B 40 22.833 -9.582 -14.849 1.00 1.00 H new ATOM 0 HA VAL B 40 21.841 -9.833 -17.622 1.00 1.00 H new ATOM 0 HB VAL B 40 19.793 -8.770 -16.967 1.00 1.00 H new ATOM 0 HG11 VAL B 40 18.740 -10.688 -15.741 1.00 1.00 H new ATOM 0 HG12 VAL B 40 19.843 -11.248 -17.020 1.00 1.00 H new ATOM 0 HG13 VAL B 40 20.363 -11.284 -15.319 1.00 1.00 H new ATOM 0 HG21 VAL B 40 19.128 -8.634 -14.560 1.00 1.00 H new ATOM 0 HG22 VAL B 40 20.761 -9.168 -14.097 1.00 1.00 H new ATOM 0 HG23 VAL B 40 20.535 -7.605 -14.917 1.00 1.00 H new ATOM 1466 N ALA B 41 21.810 -7.149 -17.722 1.00 1.00 N ATOM 1467 CA ALA B 41 22.311 -5.813 -17.994 1.00 1.00 C ATOM 1468 C ALA B 41 21.267 -4.746 -17.675 1.00 1.00 C ATOM 1469 O ALA B 41 20.075 -5.032 -17.578 1.00 1.00 O ATOM 1470 CB ALA B 41 22.745 -5.737 -19.459 1.00 1.00 C ATOM 0 H ALA B 41 21.013 -7.425 -18.296 1.00 1.00 H new ATOM 0 HA ALA B 41 23.167 -5.616 -17.349 1.00 1.00 H new ATOM 0 HB1 ALA B 41 23.123 -4.738 -19.675 1.00 1.00 H new ATOM 0 HB2 ALA B 41 23.530 -6.470 -19.644 1.00 1.00 H new ATOM 0 HB3 ALA B 41 21.891 -5.949 -20.103 1.00 1.00 H new ATOM 1476 N VAL B 42 21.739 -3.509 -17.516 1.00 1.00 N ATOM 1477 CA VAL B 42 20.914 -2.333 -17.281 1.00 1.00 C ATOM 1478 C VAL B 42 21.641 -1.120 -17.847 1.00 1.00 C ATOM 1479 O VAL B 42 22.795 -0.861 -17.510 1.00 1.00 O ATOM 1480 CB VAL B 42 20.590 -2.169 -15.786 1.00 1.00 C ATOM 1481 CG1 VAL B 42 21.756 -2.587 -14.894 1.00 1.00 C ATOM 1482 CG2 VAL B 42 20.216 -0.722 -15.447 1.00 1.00 C ATOM 0 H VAL B 42 22.736 -3.296 -17.549 1.00 1.00 H new ATOM 0 HA VAL B 42 19.954 -2.442 -17.786 1.00 1.00 H new ATOM 0 HB VAL B 42 19.741 -2.824 -15.593 1.00 1.00 H new ATOM 0 HG11 VAL B 42 21.480 -2.454 -13.848 1.00 1.00 H new ATOM 0 HG12 VAL B 42 21.995 -3.635 -15.075 1.00 1.00 H new ATOM 0 HG13 VAL B 42 22.627 -1.972 -15.121 1.00 1.00 H new ATOM 0 HG21 VAL B 42 19.993 -0.643 -14.383 1.00 1.00 H new ATOM 0 HG22 VAL B 42 21.049 -0.064 -15.693 1.00 1.00 H new ATOM 0 HG23 VAL B 42 19.339 -0.428 -16.024 1.00 1.00 H new ATOM 1492 N HIS B 43 20.951 -0.375 -18.711 1.00 1.00 N ATOM 1493 CA HIS B 43 21.478 0.830 -19.332 1.00 1.00 C ATOM 1494 C HIS B 43 20.397 1.907 -19.361 1.00 1.00 C ATOM 1495 O HIS B 43 19.247 1.639 -19.014 1.00 1.00 O ATOM 1496 CB HIS B 43 22.026 0.500 -20.720 1.00 1.00 C ATOM 1497 CG HIS B 43 23.210 -0.430 -20.643 1.00 1.00 C ATOM 1498 ND1 HIS B 43 24.520 -0.062 -20.431 1.00 1.00 N ATOM 1499 CD2 HIS B 43 23.174 -1.792 -20.765 1.00 1.00 C ATOM 1500 CE1 HIS B 43 25.253 -1.190 -20.388 1.00 1.00 C ATOM 1501 NE2 HIS B 43 24.479 -2.268 -20.601 1.00 1.00 N ATOM 0 H HIS B 43 19.999 -0.598 -19.000 1.00 1.00 H new ATOM 0 HA HIS B 43 22.309 1.225 -18.748 1.00 1.00 H new ATOM 0 HB2 HIS B 43 21.241 0.042 -21.322 1.00 1.00 H new ATOM 0 HB3 HIS B 43 22.318 1.421 -21.225 1.00 1.00 H new ATOM 0 HD2 HIS B 43 22.296 -2.392 -20.954 1.00 1.00 H new ATOM 0 HE1 HIS B 43 26.317 -1.224 -20.207 1.00 1.00 H new ATOM 0 HE2 HIS B 43 24.783 -3.241 -20.636 1.00 1.00 H new ATOM 1509 N ARG B 44 20.757 3.126 -19.774 1.00 1.00 N ATOM 1510 CA ARG B 44 19.868 4.268 -19.637 1.00 1.00 C ATOM 1511 C ARG B 44 19.713 5.042 -20.942 1.00 1.00 C ATOM 1512 O ARG B 44 20.658 5.158 -21.713 1.00 1.00 O ATOM 1513 CB ARG B 44 20.364 5.086 -18.434 1.00 1.00 C ATOM 1514 CG ARG B 44 20.681 6.572 -18.624 1.00 1.00 C ATOM 1515 CD ARG B 44 22.024 6.760 -19.327 1.00 1.00 C ATOM 1516 NE ARG B 44 22.564 8.110 -19.148 1.00 1.00 N ATOM 1517 CZ ARG B 44 22.127 9.212 -19.765 1.00 1.00 C ATOM 1518 NH1 ARG B 44 21.130 9.155 -20.647 1.00 1.00 N ATOM 1519 NH2 ARG B 44 22.692 10.387 -19.500 1.00 1.00 N ATOM 0 H ARG B 44 21.657 3.340 -20.204 1.00 1.00 H new ATOM 0 HA ARG B 44 18.844 3.956 -19.431 1.00 1.00 H new ATOM 0 HB2 ARG B 44 19.610 5.008 -17.651 1.00 1.00 H new ATOM 0 HB3 ARG B 44 21.266 4.603 -18.058 1.00 1.00 H new ATOM 0 HG2 ARG B 44 19.891 7.044 -19.209 1.00 1.00 H new ATOM 0 HG3 ARG B 44 20.701 7.070 -17.655 1.00 1.00 H new ATOM 0 HD2 ARG B 44 22.738 6.032 -18.941 1.00 1.00 H new ATOM 0 HD3 ARG B 44 21.905 6.557 -20.391 1.00 1.00 H new ATOM 0 HE ARG B 44 23.341 8.218 -18.496 1.00 1.00 H new ATOM 0 HH11 ARG B 44 20.688 8.261 -20.860 1.00 1.00 H new ATOM 0 HH12 ARG B 44 20.809 10.006 -21.109 1.00 1.00 H new ATOM 0 HH21 ARG B 44 23.457 10.445 -18.827 1.00 1.00 H new ATOM 0 HH22 ARG B 44 22.361 11.230 -19.969 1.00 1.00 H new