USER MOD reduce.3.24.130724 H: found=0, std=0, add=935, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 933 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: C 11 SER OG : rot 180:sc= 0.561 USER MOD Set 1.2: C 21 THR OG1 : rot -72:sc= 0.629 USER MOD Set 2.1: C 13 ASN : amide:sc= 0 K(o=0,f=0.58) USER MOD Set 2.2: C 19 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 13 ASN : amide:sc= -0.343 K(o=-0.35,f=-2.3) USER MOD Set 3.2: A 19 THR OG1 : rot 180:sc=-0.00645 USER MOD Single : A 1 MET CE :methyl 172:sc= -0.221 (180deg=-0.431) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ -153:sc= -1.41! (180deg=-1.65!) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 29 GLN : amide:sc= -2.03 K(o=-2,f=-0.62) USER MOD Single : A 35 ASN : amide:sc= 0.186 X(o=0.19,f=-0.097) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HD1:sc= -0.559 X(o=-0.56,f=-0.4) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 1.12 K(o=1.1,f=0) USER MOD Single : A 52 GLN : amide:sc= -3.48! K(o=-3.5!,f=-1.9) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : C 1 MET CE :methyl 172:sc= -0.848 (180deg=-1.25) USER MOD Single : C 1 MET N :NH3+ 140:sc= 0.0133 (180deg=0) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0 USER MOD Single : C 7 LYS NZ :NH3+ -159:sc= -0.0848 (180deg=-0.471) USER MOD Single : C 26 SER OG : rot 180:sc= 0 USER MOD Single : C 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 29 GLN : amide:sc=-0.00108 X(o=-0.0011,f=0) USER MOD Single : C 35 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : C 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 HIS : no HE2:sc= -1.07 X(o=-1.1,f=-1.1) USER MOD Single : C 48 TYR OH : rot 29:sc= 0.11 USER MOD Single : C 49 GLN : amide:sc= 1.09 K(o=1.1,f=0) USER MOD Single : C 52 GLN : amide:sc= -3.34! K(o=-3.3!,f=-1.3) USER MOD Single : C 56 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.836 -7.739 -10.105 1.00 0.00 N ATOM 2 CA MET A 1 4.092 -6.747 -9.302 1.00 0.00 C ATOM 3 C MET A 1 2.786 -7.358 -8.816 1.00 0.00 C ATOM 4 O MET A 1 2.005 -7.859 -9.622 1.00 0.00 O ATOM 5 CB MET A 1 3.833 -5.479 -10.120 1.00 0.00 C ATOM 6 CG MET A 1 3.619 -4.273 -9.207 1.00 0.00 C ATOM 7 SD MET A 1 3.457 -2.691 -10.069 1.00 0.00 S ATOM 8 CE MET A 1 1.856 -2.947 -10.869 1.00 0.00 C ATOM 0 H1 MET A 1 5.728 -7.319 -10.436 1.00 0.00 H new ATOM 0 H2 MET A 1 5.042 -8.574 -9.521 1.00 0.00 H new ATOM 0 H3 MET A 1 4.262 -8.023 -10.925 1.00 0.00 H new ATOM 0 HA MET A 1 4.691 -6.467 -8.435 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.677 -5.292 -10.784 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.956 -5.622 -10.751 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.722 -4.440 -8.611 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.456 -4.208 -8.511 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.527 -2.016 -11.332 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.950 -3.719 -11.633 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.124 -3.261 -10.125 1.00 0.00 H new ATOM 20 N LEU A 2 2.539 -7.328 -7.502 1.00 0.00 N ATOM 21 CA LEU A 2 1.371 -7.965 -6.904 1.00 0.00 C ATOM 22 C LEU A 2 0.235 -6.954 -6.757 1.00 0.00 C ATOM 23 O LEU A 2 0.206 -6.185 -5.797 1.00 0.00 O ATOM 24 CB LEU A 2 1.782 -8.565 -5.548 1.00 0.00 C ATOM 25 CG LEU A 2 0.866 -9.687 -5.027 1.00 0.00 C ATOM 26 CD1 LEU A 2 0.900 -9.697 -3.504 1.00 0.00 C ATOM 27 CD2 LEU A 2 -0.583 -9.586 -5.479 1.00 0.00 C ATOM 0 H LEU A 2 3.145 -6.861 -6.828 1.00 0.00 H new ATOM 0 HA LEU A 2 1.004 -8.766 -7.546 1.00 0.00 H new ATOM 0 HB2 LEU A 2 2.796 -8.955 -5.633 1.00 0.00 H new ATOM 0 HB3 LEU A 2 1.809 -7.766 -4.807 1.00 0.00 H new ATOM 0 HG LEU A 2 1.258 -10.610 -5.453 1.00 0.00 H new ATOM 0 HD11 LEU A 2 0.252 -10.490 -3.131 1.00 0.00 H new ATOM 0 HD12 LEU A 2 1.921 -9.872 -3.164 1.00 0.00 H new ATOM 0 HD13 LEU A 2 0.551 -8.736 -3.126 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -1.152 -10.418 -5.064 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -1.008 -8.645 -5.130 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -0.628 -9.623 -6.567 1.00 0.00 H new ATOM 39 N ILE A 3 -0.704 -6.952 -7.707 1.00 0.00 N ATOM 40 CA ILE A 3 -1.870 -6.083 -7.648 1.00 0.00 C ATOM 41 C ILE A 3 -2.889 -6.676 -6.688 1.00 0.00 C ATOM 42 O ILE A 3 -2.992 -7.895 -6.554 1.00 0.00 O ATOM 43 CB ILE A 3 -2.497 -5.901 -9.039 1.00 0.00 C ATOM 44 CG1 ILE A 3 -1.621 -4.994 -9.905 1.00 0.00 C ATOM 45 CG2 ILE A 3 -3.860 -5.212 -8.949 1.00 0.00 C ATOM 46 CD1 ILE A 3 -0.464 -5.729 -10.572 1.00 0.00 C ATOM 0 H ILE A 3 -0.673 -7.551 -8.532 1.00 0.00 H new ATOM 0 HA ILE A 3 -1.557 -5.101 -7.293 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.594 -6.898 -9.468 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -2.239 -4.531 -10.674 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.223 -4.189 -9.288 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -4.277 -5.098 -9.950 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -4.534 -5.816 -8.342 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -3.742 -4.230 -8.491 1.00 0.00 H new ATOM 0 HD11 ILE A 3 0.116 -5.027 -11.171 1.00 0.00 H new ATOM 0 HD12 ILE A 3 0.176 -6.170 -9.808 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.856 -6.517 -11.215 1.00 0.00 H new ATOM 58 N LEU A 4 -3.647 -5.805 -6.025 1.00 0.00 N ATOM 59 CA LEU A 4 -4.717 -6.185 -5.122 1.00 0.00 C ATOM 60 C LEU A 4 -5.837 -5.155 -5.246 1.00 0.00 C ATOM 61 O LEU A 4 -5.660 -4.093 -5.847 1.00 0.00 O ATOM 62 CB LEU A 4 -4.200 -6.235 -3.682 1.00 0.00 C ATOM 63 CG LEU A 4 -3.174 -7.348 -3.447 1.00 0.00 C ATOM 64 CD1 LEU A 4 -2.588 -7.246 -2.042 1.00 0.00 C ATOM 65 CD2 LEU A 4 -3.810 -8.731 -3.582 1.00 0.00 C ATOM 0 H LEU A 4 -3.527 -4.795 -6.106 1.00 0.00 H new ATOM 0 HA LEU A 4 -5.091 -7.175 -5.382 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -3.749 -5.275 -3.431 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.042 -6.378 -3.005 1.00 0.00 H new ATOM 0 HG LEU A 4 -2.396 -7.224 -4.200 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -1.861 -8.044 -1.892 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -2.097 -6.280 -1.922 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -3.387 -7.340 -1.307 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -3.054 -9.497 -3.409 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -4.609 -8.837 -2.848 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -4.221 -8.846 -4.585 1.00 0.00 H new ATOM 77 N THR A 5 -6.991 -5.477 -4.671 1.00 0.00 N ATOM 78 CA THR A 5 -8.160 -4.612 -4.705 1.00 0.00 C ATOM 79 C THR A 5 -8.632 -4.431 -3.274 1.00 0.00 C ATOM 80 O THR A 5 -8.651 -5.384 -2.496 1.00 0.00 O ATOM 81 CB THR A 5 -9.230 -5.251 -5.592 1.00 0.00 C ATOM 82 OG1 THR A 5 -8.730 -5.341 -6.907 1.00 0.00 O ATOM 83 CG2 THR A 5 -10.511 -4.422 -5.632 1.00 0.00 C ATOM 0 H THR A 5 -7.140 -6.351 -4.166 1.00 0.00 H new ATOM 0 HA THR A 5 -7.933 -3.633 -5.128 1.00 0.00 H new ATOM 0 HB THR A 5 -9.465 -6.231 -5.178 1.00 0.00 H new ATOM 0 HG1 THR A 5 -9.406 -5.751 -7.487 1.00 0.00 H new ATOM 0 HG21 THR A 5 -11.243 -4.913 -6.273 1.00 0.00 H new ATOM 0 HG22 THR A 5 -10.916 -4.329 -4.624 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.290 -3.430 -6.027 1.00 0.00 H new ATOM 91 N ARG A 6 -9.009 -3.201 -2.927 1.00 0.00 N ATOM 92 CA ARG A 6 -9.327 -2.846 -1.555 1.00 0.00 C ATOM 93 C ARG A 6 -10.448 -1.817 -1.542 1.00 0.00 C ATOM 94 O ARG A 6 -10.808 -1.297 -2.594 1.00 0.00 O ATOM 95 CB ARG A 6 -8.035 -2.305 -0.931 1.00 0.00 C ATOM 96 CG ARG A 6 -8.008 -2.281 0.601 1.00 0.00 C ATOM 97 CD ARG A 6 -7.929 -3.688 1.202 1.00 0.00 C ATOM 98 NE ARG A 6 -9.210 -4.397 1.159 1.00 0.00 N ATOM 99 CZ ARG A 6 -9.373 -5.689 0.862 1.00 0.00 C ATOM 100 NH1 ARG A 6 -8.340 -6.465 0.546 1.00 0.00 N ATOM 101 NH2 ARG A 6 -10.597 -6.212 0.882 1.00 0.00 N ATOM 0 H ARG A 6 -9.101 -2.430 -3.589 1.00 0.00 H new ATOM 0 HA ARG A 6 -9.681 -3.701 -0.979 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -7.200 -2.910 -1.283 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -7.871 -1.291 -1.297 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -7.153 -1.696 0.938 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -8.903 -1.780 0.970 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -7.180 -4.267 0.662 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -7.592 -3.618 2.236 1.00 0.00 H new ATOM 0 HE ARG A 6 -10.049 -3.858 1.374 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -7.397 -6.076 0.527 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -8.491 -7.449 0.323 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -11.398 -5.627 1.122 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -10.734 -7.197 0.657 1.00 0.00 H new ATOM 115 N LYS A 7 -11.002 -1.518 -0.363 1.00 0.00 N ATOM 116 CA LYS A 7 -12.059 -0.522 -0.235 1.00 0.00 C ATOM 117 C LYS A 7 -11.785 0.377 0.963 1.00 0.00 C ATOM 118 O LYS A 7 -11.032 0.005 1.862 1.00 0.00 O ATOM 119 CB LYS A 7 -13.427 -1.197 -0.106 1.00 0.00 C ATOM 120 CG LYS A 7 -13.778 -2.025 -1.346 1.00 0.00 C ATOM 121 CD LYS A 7 -13.297 -3.480 -1.331 1.00 0.00 C ATOM 122 CE LYS A 7 -14.345 -4.400 -0.707 1.00 0.00 C ATOM 123 NZ LYS A 7 -14.555 -4.123 0.728 1.00 0.00 N ATOM 0 H LYS A 7 -10.731 -1.956 0.517 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.072 0.092 -1.136 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -13.432 -1.841 0.773 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -14.193 -0.437 0.051 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -14.861 -2.021 -1.468 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -13.356 -1.531 -2.221 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -13.083 -3.806 -2.349 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -12.365 -3.552 -0.770 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -15.289 -4.283 -1.239 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -14.035 -5.437 -0.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -14.883 -4.988 1.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -13.660 -3.810 1.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -15.270 -3.376 0.836 1.00 0.00 H new ATOM 137 N VAL A 8 -12.406 1.558 0.961 1.00 0.00 N ATOM 138 CA VAL A 8 -12.196 2.561 1.991 1.00 0.00 C ATOM 139 C VAL A 8 -12.353 1.952 3.382 1.00 0.00 C ATOM 140 O VAL A 8 -13.407 1.410 3.715 1.00 0.00 O ATOM 141 CB VAL A 8 -13.182 3.714 1.785 1.00 0.00 C ATOM 142 CG1 VAL A 8 -13.033 4.740 2.905 1.00 0.00 C ATOM 143 CG2 VAL A 8 -12.925 4.386 0.438 1.00 0.00 C ATOM 0 H VAL A 8 -13.070 1.841 0.240 1.00 0.00 H new ATOM 0 HA VAL A 8 -11.179 2.945 1.914 1.00 0.00 H new ATOM 0 HB VAL A 8 -14.196 3.314 1.800 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -13.739 5.555 2.748 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -13.236 4.264 3.864 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -12.017 5.135 2.904 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -13.631 5.205 0.299 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -11.907 4.776 0.414 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -13.053 3.657 -0.362 1.00 0.00 H new ATOM 153 N GLY A 9 -11.293 2.044 4.192 1.00 0.00 N ATOM 154 CA GLY A 9 -11.306 1.587 5.575 1.00 0.00 C ATOM 155 C GLY A 9 -10.535 0.284 5.768 1.00 0.00 C ATOM 156 O GLY A 9 -10.150 -0.029 6.893 1.00 0.00 O ATOM 0 H GLY A 9 -10.400 2.441 3.900 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -10.875 2.358 6.213 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.337 1.446 5.898 1.00 0.00 H new ATOM 160 N GLU A 10 -10.302 -0.475 4.693 1.00 0.00 N ATOM 161 CA GLU A 10 -9.581 -1.739 4.774 1.00 0.00 C ATOM 162 C GLU A 10 -8.067 -1.516 4.640 1.00 0.00 C ATOM 163 O GLU A 10 -7.610 -0.377 4.527 1.00 0.00 O ATOM 164 CB GLU A 10 -10.117 -2.685 3.698 1.00 0.00 C ATOM 165 CG GLU A 10 -11.611 -2.940 3.910 1.00 0.00 C ATOM 166 CD GLU A 10 -12.186 -3.839 2.830 1.00 0.00 C ATOM 167 OE1 GLU A 10 -11.789 -3.674 1.653 1.00 0.00 O ATOM 168 OE2 GLU A 10 -13.029 -4.698 3.169 1.00 0.00 O ATOM 0 H GLU A 10 -10.607 -0.229 3.751 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.743 -2.194 5.751 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -9.951 -2.254 2.710 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.572 -3.629 3.730 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -11.767 -3.399 4.886 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.145 -1.990 3.915 1.00 0.00 H new ATOM 175 N SER A 11 -7.286 -2.600 4.655 1.00 0.00 N ATOM 176 CA SER A 11 -5.831 -2.512 4.665 1.00 0.00 C ATOM 177 C SER A 11 -5.144 -3.649 3.916 1.00 0.00 C ATOM 178 O SER A 11 -5.777 -4.616 3.491 1.00 0.00 O ATOM 179 CB SER A 11 -5.328 -2.477 6.108 1.00 0.00 C ATOM 180 OG SER A 11 -5.932 -3.496 6.879 1.00 0.00 O ATOM 0 H SER A 11 -7.645 -3.555 4.660 1.00 0.00 H new ATOM 0 HA SER A 11 -5.574 -1.592 4.141 1.00 0.00 H new ATOM 0 HB2 SER A 11 -4.245 -2.598 6.123 1.00 0.00 H new ATOM 0 HB3 SER A 11 -5.546 -1.504 6.549 1.00 0.00 H new ATOM 0 HG SER A 11 -5.594 -3.455 7.798 1.00 0.00 H new ATOM 186 N ILE A 12 -3.823 -3.501 3.769 1.00 0.00 N ATOM 187 CA ILE A 12 -2.927 -4.414 3.078 1.00 0.00 C ATOM 188 C ILE A 12 -1.695 -4.600 3.970 1.00 0.00 C ATOM 189 O ILE A 12 -1.473 -3.796 4.874 1.00 0.00 O ATOM 190 CB ILE A 12 -2.551 -3.791 1.723 1.00 0.00 C ATOM 191 CG1 ILE A 12 -3.770 -3.589 0.815 1.00 0.00 C ATOM 192 CG2 ILE A 12 -1.509 -4.636 0.986 1.00 0.00 C ATOM 193 CD1 ILE A 12 -4.447 -4.902 0.406 1.00 0.00 C ATOM 0 H ILE A 12 -3.330 -2.694 4.153 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.387 -5.384 2.890 1.00 0.00 H new ATOM 0 HB ILE A 12 -2.126 -2.813 1.951 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -4.496 -2.959 1.328 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -3.461 -3.053 -0.082 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -1.267 -4.166 0.033 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -0.607 -4.711 1.593 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -1.910 -5.634 0.807 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -5.302 -4.686 -0.235 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -3.735 -5.525 -0.135 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -4.786 -5.429 1.297 1.00 0.00 H new ATOM 205 N ASN A 13 -0.887 -5.642 3.739 1.00 0.00 N ATOM 206 CA ASN A 13 0.230 -5.936 4.621 1.00 0.00 C ATOM 207 C ASN A 13 1.456 -6.415 3.847 1.00 0.00 C ATOM 208 O ASN A 13 1.332 -7.060 2.805 1.00 0.00 O ATOM 209 CB ASN A 13 -0.232 -6.984 5.637 1.00 0.00 C ATOM 210 CG ASN A 13 0.743 -7.129 6.797 1.00 0.00 C ATOM 211 OD1 ASN A 13 1.858 -7.612 6.625 1.00 0.00 O ATOM 212 ND2 ASN A 13 0.328 -6.707 7.987 1.00 0.00 N ATOM 0 H ASN A 13 -0.991 -6.285 2.954 1.00 0.00 H new ATOM 0 HA ASN A 13 0.536 -5.025 5.136 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.213 -6.707 6.022 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -0.346 -7.946 5.138 1.00 0.00 H new ATOM 0 HD21 ASN A 13 0.944 -6.779 8.797 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -0.606 -6.311 8.090 1.00 0.00 H new ATOM 219 N ILE A 14 2.644 -6.092 4.373 1.00 0.00 N ATOM 220 CA ILE A 14 3.925 -6.435 3.766 1.00 0.00 C ATOM 221 C ILE A 14 4.917 -6.838 4.857 1.00 0.00 C ATOM 222 O ILE A 14 4.894 -6.302 5.966 1.00 0.00 O ATOM 223 CB ILE A 14 4.451 -5.226 2.979 1.00 0.00 C ATOM 224 CG1 ILE A 14 3.473 -4.843 1.859 1.00 0.00 C ATOM 225 CG2 ILE A 14 5.833 -5.536 2.395 1.00 0.00 C ATOM 226 CD1 ILE A 14 3.935 -3.617 1.070 1.00 0.00 C ATOM 0 H ILE A 14 2.738 -5.576 5.248 1.00 0.00 H new ATOM 0 HA ILE A 14 3.800 -7.275 3.083 1.00 0.00 H new ATOM 0 HB ILE A 14 4.539 -4.381 3.662 1.00 0.00 H new ATOM 0 HG12 ILE A 14 3.357 -5.686 1.178 1.00 0.00 H new ATOM 0 HG13 ILE A 14 2.492 -4.645 2.290 1.00 0.00 H new ATOM 0 HG21 ILE A 14 6.195 -4.671 1.839 1.00 0.00 H new ATOM 0 HG22 ILE A 14 6.527 -5.764 3.204 1.00 0.00 H new ATOM 0 HG23 ILE A 14 5.761 -6.393 1.726 1.00 0.00 H new ATOM 0 HD11 ILE A 14 3.207 -3.390 0.291 1.00 0.00 H new ATOM 0 HD12 ILE A 14 4.024 -2.764 1.743 1.00 0.00 H new ATOM 0 HD13 ILE A 14 4.903 -3.822 0.613 1.00 0.00 H new ATOM 238 N GLY A 15 5.798 -7.787 4.534 1.00 0.00 N ATOM 239 CA GLY A 15 6.820 -8.251 5.461 1.00 0.00 C ATOM 240 C GLY A 15 6.205 -8.759 6.764 1.00 0.00 C ATOM 241 O GLY A 15 5.200 -9.469 6.754 1.00 0.00 O ATOM 0 H GLY A 15 5.819 -8.251 3.626 1.00 0.00 H new ATOM 0 HA2 GLY A 15 7.400 -9.048 4.996 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.513 -7.438 5.677 1.00 0.00 H new ATOM 245 N ASP A 16 6.823 -8.382 7.883 1.00 0.00 N ATOM 246 CA ASP A 16 6.370 -8.747 9.219 1.00 0.00 C ATOM 247 C ASP A 16 6.301 -7.499 10.107 1.00 0.00 C ATOM 248 O ASP A 16 6.043 -7.594 11.307 1.00 0.00 O ATOM 249 CB ASP A 16 7.316 -9.807 9.790 1.00 0.00 C ATOM 250 CG ASP A 16 6.852 -10.336 11.148 1.00 0.00 C ATOM 251 OD1 ASP A 16 5.666 -10.722 11.248 1.00 0.00 O ATOM 252 OD2 ASP A 16 7.687 -10.352 12.081 1.00 0.00 O ATOM 0 H ASP A 16 7.665 -7.806 7.884 1.00 0.00 H new ATOM 0 HA ASP A 16 5.366 -9.170 9.179 1.00 0.00 H new ATOM 0 HB2 ASP A 16 7.393 -10.637 9.088 1.00 0.00 H new ATOM 0 HB3 ASP A 16 8.314 -9.382 9.891 1.00 0.00 H new ATOM 257 N ASP A 17 6.536 -6.320 9.515 1.00 0.00 N ATOM 258 CA ASP A 17 6.582 -5.061 10.243 1.00 0.00 C ATOM 259 C ASP A 17 5.983 -3.902 9.434 1.00 0.00 C ATOM 260 O ASP A 17 6.136 -2.749 9.829 1.00 0.00 O ATOM 261 CB ASP A 17 8.033 -4.738 10.606 1.00 0.00 C ATOM 262 CG ASP A 17 8.639 -5.782 11.541 1.00 0.00 C ATOM 263 OD1 ASP A 17 8.364 -5.698 12.759 1.00 0.00 O ATOM 264 OD2 ASP A 17 9.374 -6.653 11.033 1.00 0.00 O ATOM 0 H ASP A 17 6.699 -6.221 8.513 1.00 0.00 H new ATOM 0 HA ASP A 17 5.981 -5.176 11.145 1.00 0.00 H new ATOM 0 HB2 ASP A 17 8.629 -4.678 9.695 1.00 0.00 H new ATOM 0 HB3 ASP A 17 8.078 -3.758 11.081 1.00 0.00 H new ATOM 269 N ILE A 18 5.307 -4.178 8.311 1.00 0.00 N ATOM 270 CA ILE A 18 4.748 -3.123 7.479 1.00 0.00 C ATOM 271 C ILE A 18 3.281 -3.414 7.174 1.00 0.00 C ATOM 272 O ILE A 18 2.903 -4.543 6.866 1.00 0.00 O ATOM 273 CB ILE A 18 5.558 -3.012 6.180 1.00 0.00 C ATOM 274 CG1 ILE A 18 7.028 -2.711 6.491 1.00 0.00 C ATOM 275 CG2 ILE A 18 4.969 -1.921 5.283 1.00 0.00 C ATOM 276 CD1 ILE A 18 7.882 -2.773 5.222 1.00 0.00 C ATOM 0 H ILE A 18 5.138 -5.122 7.965 1.00 0.00 H new ATOM 0 HA ILE A 18 4.803 -2.174 8.013 1.00 0.00 H new ATOM 0 HB ILE A 18 5.505 -3.965 5.653 1.00 0.00 H new ATOM 0 HG12 ILE A 18 7.113 -1.723 6.942 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.403 -3.428 7.221 1.00 0.00 H new ATOM 0 HG21 ILE A 18 5.552 -1.851 4.364 1.00 0.00 H new ATOM 0 HG22 ILE A 18 3.936 -2.169 5.039 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.999 -0.965 5.805 1.00 0.00 H new ATOM 0 HD11 ILE A 18 8.921 -2.555 5.471 1.00 0.00 H new ATOM 0 HD12 ILE A 18 7.815 -3.770 4.786 1.00 0.00 H new ATOM 0 HD13 ILE A 18 7.520 -2.038 4.503 1.00 0.00 H new ATOM 288 N THR A 19 2.454 -2.371 7.258 1.00 0.00 N ATOM 289 CA THR A 19 1.033 -2.456 6.961 1.00 0.00 C ATOM 290 C THR A 19 0.598 -1.139 6.325 1.00 0.00 C ATOM 291 O THR A 19 1.188 -0.099 6.603 1.00 0.00 O ATOM 292 CB THR A 19 0.238 -2.727 8.248 1.00 0.00 C ATOM 293 OG1 THR A 19 0.827 -3.777 8.982 1.00 0.00 O ATOM 294 CG2 THR A 19 -1.204 -3.123 7.946 1.00 0.00 C ATOM 0 H THR A 19 2.759 -1.438 7.537 1.00 0.00 H new ATOM 0 HA THR A 19 0.840 -3.278 6.272 1.00 0.00 H new ATOM 0 HB THR A 19 0.249 -1.801 8.824 1.00 0.00 H new ATOM 0 HG1 THR A 19 0.309 -3.936 9.799 1.00 0.00 H new ATOM 0 HG21 THR A 19 -1.734 -3.307 8.880 1.00 0.00 H new ATOM 0 HG22 THR A 19 -1.696 -2.317 7.402 1.00 0.00 H new ATOM 0 HG23 THR A 19 -1.213 -4.029 7.340 1.00 0.00 H new ATOM 302 N ILE A 20 -0.428 -1.184 5.469 1.00 0.00 N ATOM 303 CA ILE A 20 -0.875 -0.028 4.703 1.00 0.00 C ATOM 304 C ILE A 20 -2.396 0.053 4.769 1.00 0.00 C ATOM 305 O ILE A 20 -3.056 -0.979 4.871 1.00 0.00 O ATOM 306 CB ILE A 20 -0.413 -0.169 3.246 1.00 0.00 C ATOM 307 CG1 ILE A 20 1.066 -0.554 3.118 1.00 0.00 C ATOM 308 CG2 ILE A 20 -0.669 1.133 2.489 1.00 0.00 C ATOM 309 CD1 ILE A 20 2.029 0.529 3.601 1.00 0.00 C ATOM 0 H ILE A 20 -0.971 -2.029 5.291 1.00 0.00 H new ATOM 0 HA ILE A 20 -0.448 0.884 5.120 1.00 0.00 H new ATOM 0 HB ILE A 20 -0.995 -0.982 2.812 1.00 0.00 H new ATOM 0 HG12 ILE A 20 1.245 -1.466 3.687 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.284 -0.781 2.074 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.338 1.024 1.456 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -1.735 1.361 2.507 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -0.117 1.944 2.963 1.00 0.00 H new ATOM 0 HD11 ILE A 20 3.056 0.184 3.479 1.00 0.00 H new ATOM 0 HD12 ILE A 20 1.879 1.436 3.016 1.00 0.00 H new ATOM 0 HD13 ILE A 20 1.840 0.741 4.653 1.00 0.00 H new ATOM 321 N THR A 21 -2.958 1.263 4.707 1.00 0.00 N ATOM 322 CA THR A 21 -4.395 1.456 4.862 1.00 0.00 C ATOM 323 C THR A 21 -4.911 2.482 3.854 1.00 0.00 C ATOM 324 O THR A 21 -4.181 3.387 3.453 1.00 0.00 O ATOM 325 CB THR A 21 -4.679 1.913 6.300 1.00 0.00 C ATOM 326 OG1 THR A 21 -4.172 0.956 7.205 1.00 0.00 O ATOM 327 CG2 THR A 21 -6.174 2.079 6.563 1.00 0.00 C ATOM 0 H THR A 21 -2.434 2.124 4.550 1.00 0.00 H new ATOM 0 HA THR A 21 -4.914 0.517 4.671 1.00 0.00 H new ATOM 0 HB THR A 21 -4.194 2.880 6.437 1.00 0.00 H new ATOM 0 HG1 THR A 21 -4.351 1.247 8.123 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.329 2.403 7.592 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.583 2.826 5.882 1.00 0.00 H new ATOM 0 HG23 THR A 21 -6.680 1.127 6.403 1.00 0.00 H new ATOM 335 N ILE A 22 -6.179 2.337 3.450 1.00 0.00 N ATOM 336 CA ILE A 22 -6.833 3.239 2.515 1.00 0.00 C ATOM 337 C ILE A 22 -7.882 4.050 3.270 1.00 0.00 C ATOM 338 O ILE A 22 -9.019 3.618 3.453 1.00 0.00 O ATOM 339 CB ILE A 22 -7.371 2.450 1.306 1.00 0.00 C ATOM 340 CG1 ILE A 22 -8.261 3.296 0.386 1.00 0.00 C ATOM 341 CG2 ILE A 22 -8.156 1.209 1.734 1.00 0.00 C ATOM 342 CD1 ILE A 22 -7.480 4.439 -0.254 1.00 0.00 C ATOM 0 H ILE A 22 -6.780 1.578 3.771 1.00 0.00 H new ATOM 0 HA ILE A 22 -6.131 3.958 2.093 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.483 2.149 0.751 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.685 2.663 -0.393 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -9.096 3.700 0.958 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -8.516 0.684 0.850 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.507 0.549 2.309 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -9.005 1.509 2.349 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -8.143 5.016 -0.899 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -7.078 5.086 0.525 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.661 4.033 -0.847 1.00 0.00 H new ATOM 354 N LEU A 23 -7.485 5.249 3.714 1.00 0.00 N ATOM 355 CA LEU A 23 -8.325 6.100 4.544 1.00 0.00 C ATOM 356 C LEU A 23 -9.538 6.612 3.777 1.00 0.00 C ATOM 357 O LEU A 23 -10.572 6.887 4.379 1.00 0.00 O ATOM 358 CB LEU A 23 -7.504 7.289 5.048 1.00 0.00 C ATOM 359 CG LEU A 23 -6.304 6.877 5.902 1.00 0.00 C ATOM 360 CD1 LEU A 23 -5.558 8.137 6.320 1.00 0.00 C ATOM 361 CD2 LEU A 23 -6.743 6.118 7.151 1.00 0.00 C ATOM 0 H LEU A 23 -6.571 5.650 3.504 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.683 5.504 5.383 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -7.152 7.867 4.193 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -8.149 7.945 5.632 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.664 6.218 5.315 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -4.697 7.865 6.931 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -5.219 8.670 5.432 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -6.223 8.779 6.897 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -5.866 5.840 7.735 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -7.393 6.753 7.753 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.284 5.218 6.859 1.00 0.00 H new ATOM 373 N GLY A 24 -9.417 6.741 2.454 1.00 0.00 N ATOM 374 CA GLY A 24 -10.535 7.164 1.630 1.00 0.00 C ATOM 375 C GLY A 24 -10.119 7.530 0.207 1.00 0.00 C ATOM 376 O GLY A 24 -8.968 7.338 -0.189 1.00 0.00 O ATOM 0 H GLY A 24 -8.556 6.558 1.938 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -11.275 6.365 1.593 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -11.018 8.024 2.095 1.00 0.00 H new ATOM 380 N VAL A 25 -11.073 8.061 -0.557 1.00 0.00 N ATOM 381 CA VAL A 25 -10.883 8.412 -1.961 1.00 0.00 C ATOM 382 C VAL A 25 -11.588 9.734 -2.255 1.00 0.00 C ATOM 383 O VAL A 25 -12.539 10.101 -1.564 1.00 0.00 O ATOM 384 CB VAL A 25 -11.410 7.262 -2.833 1.00 0.00 C ATOM 385 CG1 VAL A 25 -12.912 7.051 -2.634 1.00 0.00 C ATOM 386 CG2 VAL A 25 -11.151 7.505 -4.318 1.00 0.00 C ATOM 0 H VAL A 25 -12.012 8.262 -0.212 1.00 0.00 H new ATOM 0 HA VAL A 25 -9.826 8.551 -2.189 1.00 0.00 H new ATOM 0 HB VAL A 25 -10.867 6.372 -2.515 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -13.251 6.230 -3.266 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -13.110 6.811 -1.590 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -13.446 7.962 -2.905 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -11.540 6.667 -4.897 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.649 8.423 -4.629 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -10.079 7.598 -4.490 1.00 0.00 H new ATOM 396 N SER A 26 -11.117 10.442 -3.283 1.00 0.00 N ATOM 397 CA SER A 26 -11.605 11.765 -3.646 1.00 0.00 C ATOM 398 C SER A 26 -11.522 11.937 -5.159 1.00 0.00 C ATOM 399 O SER A 26 -10.830 12.826 -5.659 1.00 0.00 O ATOM 400 CB SER A 26 -10.771 12.836 -2.941 1.00 0.00 C ATOM 401 OG SER A 26 -10.870 12.709 -1.537 1.00 0.00 O ATOM 0 H SER A 26 -10.374 10.103 -3.894 1.00 0.00 H new ATOM 0 HA SER A 26 -12.644 11.871 -3.333 1.00 0.00 H new ATOM 0 HB2 SER A 26 -9.728 12.749 -3.245 1.00 0.00 H new ATOM 0 HB3 SER A 26 -11.111 13.826 -3.245 1.00 0.00 H new ATOM 0 HG SER A 26 -10.328 13.403 -1.107 1.00 0.00 H new ATOM 407 N GLY A 27 -12.229 11.078 -5.900 1.00 0.00 N ATOM 408 CA GLY A 27 -12.209 11.134 -7.349 1.00 0.00 C ATOM 409 C GLY A 27 -10.889 10.581 -7.867 1.00 0.00 C ATOM 410 O GLY A 27 -10.477 9.493 -7.475 1.00 0.00 O ATOM 0 H GLY A 27 -12.818 10.341 -5.513 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -13.040 10.558 -7.756 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -12.340 12.163 -7.684 1.00 0.00 H new ATOM 414 N GLN A 28 -10.228 11.339 -8.743 1.00 0.00 N ATOM 415 CA GLN A 28 -8.928 10.969 -9.279 1.00 0.00 C ATOM 416 C GLN A 28 -7.842 11.078 -8.195 1.00 0.00 C ATOM 417 O GLN A 28 -6.672 10.814 -8.462 1.00 0.00 O ATOM 418 CB GLN A 28 -8.616 11.860 -10.484 1.00 0.00 C ATOM 419 CG GLN A 28 -7.463 11.296 -11.319 1.00 0.00 C ATOM 420 CD GLN A 28 -7.227 12.103 -12.590 1.00 0.00 C ATOM 421 OE1 GLN A 28 -8.116 12.785 -13.095 1.00 0.00 O ATOM 422 NE2 GLN A 28 -6.014 12.028 -13.131 1.00 0.00 N ATOM 0 H GLN A 28 -10.584 12.227 -9.098 1.00 0.00 H new ATOM 0 HA GLN A 28 -8.946 9.930 -9.607 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -9.505 11.954 -11.107 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -8.360 12.862 -10.140 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -6.552 11.289 -10.720 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -7.679 10.261 -11.582 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -5.294 11.454 -12.691 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -5.804 12.544 -13.985 1.00 0.00 H new ATOM 431 N GLN A 29 -8.221 11.463 -6.969 1.00 0.00 N ATOM 432 CA GLN A 29 -7.286 11.551 -5.857 1.00 0.00 C ATOM 433 C GLN A 29 -7.626 10.522 -4.787 1.00 0.00 C ATOM 434 O GLN A 29 -8.726 9.969 -4.763 1.00 0.00 O ATOM 435 CB GLN A 29 -7.264 12.965 -5.264 1.00 0.00 C ATOM 436 CG GLN A 29 -7.034 14.028 -6.345 1.00 0.00 C ATOM 437 CD GLN A 29 -6.642 15.370 -5.736 1.00 0.00 C ATOM 438 OE1 GLN A 29 -7.182 16.410 -6.096 1.00 0.00 O ATOM 439 NE2 GLN A 29 -5.689 15.357 -4.802 1.00 0.00 N ATOM 0 H GLN A 29 -9.179 11.719 -6.729 1.00 0.00 H new ATOM 0 HA GLN A 29 -6.288 11.333 -6.238 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -8.208 13.161 -4.755 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -6.477 13.033 -4.513 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.251 13.693 -7.025 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.941 14.147 -6.938 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -5.259 14.475 -4.524 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.391 16.229 -4.366 1.00 0.00 H new ATOM 448 N VAL A 30 -6.669 10.264 -3.893 1.00 0.00 N ATOM 449 CA VAL A 30 -6.745 9.187 -2.913 1.00 0.00 C ATOM 450 C VAL A 30 -6.080 9.614 -1.604 1.00 0.00 C ATOM 451 O VAL A 30 -5.229 10.498 -1.605 1.00 0.00 O ATOM 452 CB VAL A 30 -6.045 7.961 -3.521 1.00 0.00 C ATOM 453 CG1 VAL A 30 -5.726 6.882 -2.492 1.00 0.00 C ATOM 454 CG2 VAL A 30 -6.915 7.320 -4.608 1.00 0.00 C ATOM 0 H VAL A 30 -5.808 10.808 -3.832 1.00 0.00 H new ATOM 0 HA VAL A 30 -7.782 8.945 -2.680 1.00 0.00 H new ATOM 0 HB VAL A 30 -5.110 8.338 -3.936 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.233 6.044 -2.985 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -5.067 7.292 -1.727 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -6.650 6.537 -2.028 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -6.399 6.455 -5.024 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -7.864 7.003 -4.175 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -7.102 8.046 -5.400 1.00 0.00 H new ATOM 464 N ARG A 31 -6.475 8.995 -0.484 1.00 0.00 N ATOM 465 CA ARG A 31 -5.914 9.278 0.833 1.00 0.00 C ATOM 466 C ARG A 31 -5.569 7.956 1.510 1.00 0.00 C ATOM 467 O ARG A 31 -6.434 7.102 1.696 1.00 0.00 O ATOM 468 CB ARG A 31 -6.946 10.057 1.660 1.00 0.00 C ATOM 469 CG ARG A 31 -6.419 11.394 2.196 1.00 0.00 C ATOM 470 CD ARG A 31 -5.303 11.251 3.240 1.00 0.00 C ATOM 471 NE ARG A 31 -4.998 12.563 3.827 1.00 0.00 N ATOM 472 CZ ARG A 31 -5.630 13.048 4.901 1.00 0.00 C ATOM 473 NH1 ARG A 31 -6.563 12.330 5.521 1.00 0.00 N ATOM 474 NH2 ARG A 31 -5.329 14.255 5.364 1.00 0.00 N ATOM 0 H ARG A 31 -7.200 8.278 -0.472 1.00 0.00 H new ATOM 0 HA ARG A 31 -5.010 9.880 0.746 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -7.827 10.243 1.045 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -7.268 9.440 2.499 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -6.047 11.988 1.361 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -7.247 11.949 2.638 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -5.610 10.556 4.021 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -4.410 10.834 2.776 1.00 0.00 H new ATOM 0 HE ARG A 31 -4.269 13.131 3.395 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -6.802 11.400 5.178 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -7.039 12.710 6.339 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -4.614 14.815 4.900 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.813 14.622 6.183 1.00 0.00 H new ATOM 488 N ILE A 32 -4.300 7.788 1.887 1.00 0.00 N ATOM 489 CA ILE A 32 -3.806 6.532 2.432 1.00 0.00 C ATOM 490 C ILE A 32 -2.890 6.765 3.627 1.00 0.00 C ATOM 491 O ILE A 32 -2.408 7.873 3.853 1.00 0.00 O ATOM 492 CB ILE A 32 -3.037 5.752 1.360 1.00 0.00 C ATOM 493 CG1 ILE A 32 -1.954 6.628 0.713 1.00 0.00 C ATOM 494 CG2 ILE A 32 -3.995 5.205 0.308 1.00 0.00 C ATOM 495 CD1 ILE A 32 -0.959 5.761 -0.058 1.00 0.00 C ATOM 0 H ILE A 32 -3.592 8.519 1.822 1.00 0.00 H new ATOM 0 HA ILE A 32 -4.672 5.957 2.760 1.00 0.00 H new ATOM 0 HB ILE A 32 -2.540 4.910 1.842 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.416 7.350 0.039 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.431 7.198 1.481 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -3.432 4.654 -0.445 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -4.715 4.538 0.783 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -4.524 6.031 -0.167 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -0.198 6.396 -0.511 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -0.485 5.057 0.625 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -1.484 5.211 -0.839 1.00 0.00 H new ATOM 507 N GLY A 33 -2.656 5.699 4.391 1.00 0.00 N ATOM 508 CA GLY A 33 -1.771 5.731 5.539 1.00 0.00 C ATOM 509 C GLY A 33 -0.792 4.563 5.466 1.00 0.00 C ATOM 510 O GLY A 33 -1.018 3.599 4.735 1.00 0.00 O ATOM 0 H GLY A 33 -3.081 4.787 4.224 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -1.225 6.674 5.564 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -2.352 5.674 6.460 1.00 0.00 H new ATOM 514 N ILE A 34 0.291 4.656 6.235 1.00 0.00 N ATOM 515 CA ILE A 34 1.365 3.673 6.236 1.00 0.00 C ATOM 516 C ILE A 34 1.750 3.396 7.680 1.00 0.00 C ATOM 517 O ILE A 34 1.832 4.312 8.498 1.00 0.00 O ATOM 518 CB ILE A 34 2.564 4.239 5.461 1.00 0.00 C ATOM 519 CG1 ILE A 34 2.177 4.477 3.996 1.00 0.00 C ATOM 520 CG2 ILE A 34 3.761 3.288 5.541 1.00 0.00 C ATOM 521 CD1 ILE A 34 3.296 5.143 3.195 1.00 0.00 C ATOM 0 H ILE A 34 0.446 5.428 6.883 1.00 0.00 H new ATOM 0 HA ILE A 34 1.046 2.747 5.758 1.00 0.00 H new ATOM 0 HB ILE A 34 2.850 5.188 5.914 1.00 0.00 H new ATOM 0 HG12 ILE A 34 1.920 3.525 3.532 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.285 5.102 3.956 1.00 0.00 H new ATOM 0 HG21 ILE A 34 4.598 3.710 4.985 1.00 0.00 H new ATOM 0 HG22 ILE A 34 4.049 3.153 6.583 1.00 0.00 H new ATOM 0 HG23 ILE A 34 3.489 2.324 5.112 1.00 0.00 H new ATOM 0 HD11 ILE A 34 2.969 5.288 2.165 1.00 0.00 H new ATOM 0 HD12 ILE A 34 3.536 6.109 3.639 1.00 0.00 H new ATOM 0 HD13 ILE A 34 4.181 4.507 3.209 1.00 0.00 H new ATOM 533 N ASN A 35 1.985 2.120 7.982 1.00 0.00 N ATOM 534 CA ASN A 35 2.288 1.656 9.322 1.00 0.00 C ATOM 535 C ASN A 35 3.550 0.802 9.282 1.00 0.00 C ATOM 536 O ASN A 35 3.498 -0.415 9.446 1.00 0.00 O ATOM 537 CB ASN A 35 1.095 0.879 9.886 1.00 0.00 C ATOM 538 CG ASN A 35 -0.168 1.723 9.956 1.00 0.00 C ATOM 539 OD1 ASN A 35 -0.795 2.005 8.938 1.00 0.00 O ATOM 540 ND2 ASN A 35 -0.552 2.132 11.162 1.00 0.00 N ATOM 0 H ASN A 35 1.968 1.373 7.287 1.00 0.00 H new ATOM 0 HA ASN A 35 2.470 2.504 9.982 1.00 0.00 H new ATOM 0 HB2 ASN A 35 0.909 0.003 9.264 1.00 0.00 H new ATOM 0 HB3 ASN A 35 1.341 0.515 10.884 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -1.393 2.700 11.264 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -0.005 1.878 11.985 1.00 0.00 H new ATOM 547 N ALA A 36 4.680 1.470 9.060 1.00 0.00 N ATOM 548 CA ALA A 36 5.998 0.868 9.092 1.00 0.00 C ATOM 549 C ALA A 36 6.796 1.556 10.191 1.00 0.00 C ATOM 550 O ALA A 36 6.478 2.689 10.560 1.00 0.00 O ATOM 551 CB ALA A 36 6.671 1.060 7.736 1.00 0.00 C ATOM 0 H ALA A 36 4.698 2.468 8.849 1.00 0.00 H new ATOM 0 HA ALA A 36 5.938 -0.201 9.295 1.00 0.00 H new ATOM 0 HB1 ALA A 36 7.663 0.609 7.755 1.00 0.00 H new ATOM 0 HB2 ALA A 36 6.070 0.584 6.961 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.761 2.125 7.522 1.00 0.00 H new ATOM 557 N PRO A 37 7.828 0.898 10.727 1.00 0.00 N ATOM 558 CA PRO A 37 8.618 1.458 11.797 1.00 0.00 C ATOM 559 C PRO A 37 9.407 2.635 11.248 1.00 0.00 C ATOM 560 O PRO A 37 9.791 2.643 10.081 1.00 0.00 O ATOM 561 CB PRO A 37 9.517 0.322 12.280 1.00 0.00 C ATOM 562 CG PRO A 37 9.667 -0.557 11.037 1.00 0.00 C ATOM 563 CD PRO A 37 8.313 -0.414 10.353 1.00 0.00 C ATOM 0 HA PRO A 37 8.025 1.836 12.629 1.00 0.00 H new ATOM 0 HB2 PRO A 37 10.481 0.692 12.630 1.00 0.00 H new ATOM 0 HB3 PRO A 37 9.066 -0.225 13.108 1.00 0.00 H new ATOM 0 HG2 PRO A 37 10.481 -0.216 10.397 1.00 0.00 H new ATOM 0 HG3 PRO A 37 9.880 -1.594 11.299 1.00 0.00 H new ATOM 0 HD2 PRO A 37 8.408 -0.503 9.271 1.00 0.00 H new ATOM 0 HD3 PRO A 37 7.625 -1.194 10.678 1.00 0.00 H new ATOM 571 N LYS A 38 9.655 3.635 12.092 1.00 0.00 N ATOM 572 CA LYS A 38 10.405 4.813 11.685 1.00 0.00 C ATOM 573 C LYS A 38 11.869 4.443 11.443 1.00 0.00 C ATOM 574 O LYS A 38 12.678 5.291 11.069 1.00 0.00 O ATOM 575 CB LYS A 38 10.220 5.914 12.729 1.00 0.00 C ATOM 576 CG LYS A 38 8.713 6.130 12.917 1.00 0.00 C ATOM 577 CD LYS A 38 8.400 7.312 13.827 1.00 0.00 C ATOM 578 CE LYS A 38 6.889 7.367 14.057 1.00 0.00 C ATOM 579 NZ LYS A 38 6.511 8.518 14.898 1.00 0.00 N ATOM 0 H LYS A 38 9.345 3.649 13.064 1.00 0.00 H new ATOM 0 HA LYS A 38 10.028 5.203 10.739 1.00 0.00 H new ATOM 0 HB2 LYS A 38 10.686 5.629 13.672 1.00 0.00 H new ATOM 0 HB3 LYS A 38 10.701 6.836 12.402 1.00 0.00 H new ATOM 0 HG2 LYS A 38 8.249 6.292 11.944 1.00 0.00 H new ATOM 0 HG3 LYS A 38 8.269 5.226 13.335 1.00 0.00 H new ATOM 0 HD2 LYS A 38 8.923 7.206 14.777 1.00 0.00 H new ATOM 0 HD3 LYS A 38 8.747 8.240 13.374 1.00 0.00 H new ATOM 0 HE2 LYS A 38 6.376 7.432 13.097 1.00 0.00 H new ATOM 0 HE3 LYS A 38 6.559 6.444 14.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 5.480 8.525 15.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 6.982 8.442 15.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 6.805 9.400 14.432 1.00 0.00 H new ATOM 593 N ASP A 39 12.200 3.165 11.660 1.00 0.00 N ATOM 594 CA ASP A 39 13.508 2.599 11.381 1.00 0.00 C ATOM 595 C ASP A 39 13.661 2.233 9.902 1.00 0.00 C ATOM 596 O ASP A 39 14.774 1.931 9.473 1.00 0.00 O ATOM 597 CB ASP A 39 13.714 1.355 12.244 1.00 0.00 C ATOM 598 CG ASP A 39 13.686 1.709 13.727 1.00 0.00 C ATOM 599 OD1 ASP A 39 14.723 2.213 14.214 1.00 0.00 O ATOM 600 OD2 ASP A 39 12.635 1.476 14.364 1.00 0.00 O ATOM 0 H ASP A 39 11.543 2.486 12.044 1.00 0.00 H new ATOM 0 HA ASP A 39 14.262 3.350 11.618 1.00 0.00 H new ATOM 0 HB2 ASP A 39 12.936 0.624 12.026 1.00 0.00 H new ATOM 0 HB3 ASP A 39 14.668 0.889 11.995 1.00 0.00 H new ATOM 605 N VAL A 40 12.573 2.256 9.119 1.00 0.00 N ATOM 606 CA VAL A 40 12.669 2.066 7.676 1.00 0.00 C ATOM 607 C VAL A 40 12.146 3.299 6.946 1.00 0.00 C ATOM 608 O VAL A 40 11.208 3.965 7.387 1.00 0.00 O ATOM 609 CB VAL A 40 11.942 0.797 7.209 1.00 0.00 C ATOM 610 CG1 VAL A 40 12.496 -0.441 7.914 1.00 0.00 C ATOM 611 CG2 VAL A 40 10.434 0.876 7.437 1.00 0.00 C ATOM 0 H VAL A 40 11.625 2.404 9.464 1.00 0.00 H new ATOM 0 HA VAL A 40 13.722 1.932 7.429 1.00 0.00 H new ATOM 0 HB VAL A 40 12.120 0.717 6.137 1.00 0.00 H new ATOM 0 HG11 VAL A 40 11.964 -1.327 7.566 1.00 0.00 H new ATOM 0 HG12 VAL A 40 13.558 -0.543 7.689 1.00 0.00 H new ATOM 0 HG13 VAL A 40 12.362 -0.337 8.991 1.00 0.00 H new ATOM 0 HG21 VAL A 40 9.965 -0.045 7.091 1.00 0.00 H new ATOM 0 HG22 VAL A 40 10.233 1.008 8.500 1.00 0.00 H new ATOM 0 HG23 VAL A 40 10.026 1.722 6.883 1.00 0.00 H new ATOM 621 N ALA A 41 12.781 3.597 5.813 1.00 0.00 N ATOM 622 CA ALA A 41 12.484 4.778 5.022 1.00 0.00 C ATOM 623 C ALA A 41 11.124 4.654 4.336 1.00 0.00 C ATOM 624 O ALA A 41 10.714 3.566 3.936 1.00 0.00 O ATOM 625 CB ALA A 41 13.584 4.958 3.982 1.00 0.00 C ATOM 0 H ALA A 41 13.522 3.017 5.420 1.00 0.00 H new ATOM 0 HA ALA A 41 12.443 5.647 5.678 1.00 0.00 H new ATOM 0 HB1 ALA A 41 13.374 5.842 3.380 1.00 0.00 H new ATOM 0 HB2 ALA A 41 14.543 5.081 4.485 1.00 0.00 H new ATOM 0 HB3 ALA A 41 13.622 4.080 3.337 1.00 0.00 H new ATOM 631 N VAL A 42 10.433 5.790 4.205 1.00 0.00 N ATOM 632 CA VAL A 42 9.153 5.892 3.527 1.00 0.00 C ATOM 633 C VAL A 42 9.088 7.249 2.841 1.00 0.00 C ATOM 634 O VAL A 42 9.005 8.275 3.508 1.00 0.00 O ATOM 635 CB VAL A 42 8.014 5.764 4.547 1.00 0.00 C ATOM 636 CG1 VAL A 42 6.664 5.941 3.868 1.00 0.00 C ATOM 637 CG2 VAL A 42 8.022 4.403 5.245 1.00 0.00 C ATOM 0 H VAL A 42 10.762 6.680 4.579 1.00 0.00 H new ATOM 0 HA VAL A 42 9.049 5.095 2.791 1.00 0.00 H new ATOM 0 HB VAL A 42 8.172 6.546 5.289 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.869 5.847 4.608 1.00 0.00 H new ATOM 0 HG12 VAL A 42 6.615 6.927 3.407 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.539 5.176 3.102 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.199 4.355 5.959 1.00 0.00 H new ATOM 0 HG22 VAL A 42 7.905 3.613 4.503 1.00 0.00 H new ATOM 0 HG23 VAL A 42 8.967 4.270 5.771 1.00 0.00 H new ATOM 647 N HIS A 43 9.123 7.264 1.504 1.00 0.00 N ATOM 648 CA HIS A 43 9.072 8.507 0.750 1.00 0.00 C ATOM 649 C HIS A 43 8.389 8.302 -0.593 1.00 0.00 C ATOM 650 O HIS A 43 8.337 7.189 -1.115 1.00 0.00 O ATOM 651 CB HIS A 43 10.479 9.063 0.508 1.00 0.00 C ATOM 652 CG HIS A 43 11.279 9.302 1.759 1.00 0.00 C ATOM 653 ND1 HIS A 43 11.293 10.493 2.487 1.00 0.00 N ATOM 654 CD2 HIS A 43 12.106 8.397 2.358 1.00 0.00 C ATOM 655 CE1 HIS A 43 12.140 10.276 3.507 1.00 0.00 C ATOM 656 NE2 HIS A 43 12.638 9.027 3.462 1.00 0.00 N ATOM 0 H HIS A 43 9.187 6.425 0.928 1.00 0.00 H new ATOM 0 HA HIS A 43 8.499 9.219 1.344 1.00 0.00 H new ATOM 0 HB2 HIS A 43 11.025 8.369 -0.130 1.00 0.00 H new ATOM 0 HB3 HIS A 43 10.396 10.002 -0.040 1.00 0.00 H new ATOM 0 HD2 HIS A 43 12.304 7.387 2.031 1.00 0.00 H new ATOM 0 HE1 HIS A 43 12.388 11.007 4.262 1.00 0.00 H new ATOM 0 HE2 HIS A 43 13.294 8.618 4.128 1.00 0.00 H new ATOM 664 N ARG A 44 7.859 9.391 -1.154 1.00 0.00 N ATOM 665 CA ARG A 44 7.221 9.379 -2.458 1.00 0.00 C ATOM 666 C ARG A 44 8.252 9.177 -3.561 1.00 0.00 C ATOM 667 O ARG A 44 9.442 9.404 -3.350 1.00 0.00 O ATOM 668 CB ARG A 44 6.465 10.691 -2.655 1.00 0.00 C ATOM 669 CG ARG A 44 7.435 11.876 -2.648 1.00 0.00 C ATOM 670 CD ARG A 44 6.677 13.195 -2.766 1.00 0.00 C ATOM 671 NE ARG A 44 5.887 13.459 -1.568 1.00 0.00 N ATOM 672 CZ ARG A 44 5.017 14.466 -1.462 1.00 0.00 C ATOM 673 NH1 ARG A 44 4.801 15.290 -2.484 1.00 0.00 N ATOM 674 NH2 ARG A 44 4.357 14.652 -0.324 1.00 0.00 N ATOM 0 H ARG A 44 7.864 10.308 -0.708 1.00 0.00 H new ATOM 0 HA ARG A 44 6.518 8.547 -2.509 1.00 0.00 H new ATOM 0 HB2 ARG A 44 5.920 10.665 -3.599 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.726 10.814 -1.863 1.00 0.00 H new ATOM 0 HG2 ARG A 44 8.020 11.868 -1.728 1.00 0.00 H new ATOM 0 HG3 ARG A 44 8.139 11.781 -3.474 1.00 0.00 H new ATOM 0 HD2 ARG A 44 7.383 14.010 -2.926 1.00 0.00 H new ATOM 0 HD3 ARG A 44 6.022 13.165 -3.637 1.00 0.00 H new ATOM 0 HE ARG A 44 6.006 12.839 -0.767 1.00 0.00 H new ATOM 0 HH11 ARG A 44 5.303 15.156 -3.362 1.00 0.00 H new ATOM 0 HH12 ARG A 44 4.133 16.055 -2.390 1.00 0.00 H new ATOM 0 HH21 ARG A 44 4.516 14.026 0.466 1.00 0.00 H new ATOM 0 HH22 ARG A 44 3.692 15.421 -0.240 1.00 0.00 H new ATOM 688 N GLU A 45 7.807 8.755 -4.744 1.00 0.00 N ATOM 689 CA GLU A 45 8.726 8.547 -5.860 1.00 0.00 C ATOM 690 C GLU A 45 9.285 9.880 -6.360 1.00 0.00 C ATOM 691 O GLU A 45 10.356 9.918 -6.964 1.00 0.00 O ATOM 692 CB GLU A 45 8.038 7.755 -6.981 1.00 0.00 C ATOM 693 CG GLU A 45 6.922 8.527 -7.693 1.00 0.00 C ATOM 694 CD GLU A 45 7.446 9.515 -8.733 1.00 0.00 C ATOM 695 OE1 GLU A 45 8.329 9.119 -9.528 1.00 0.00 O ATOM 696 OE2 GLU A 45 6.956 10.669 -8.726 1.00 0.00 O ATOM 0 H GLU A 45 6.829 8.553 -4.952 1.00 0.00 H new ATOM 0 HA GLU A 45 9.572 7.955 -5.512 1.00 0.00 H new ATOM 0 HB2 GLU A 45 8.787 7.459 -7.715 1.00 0.00 H new ATOM 0 HB3 GLU A 45 7.622 6.839 -6.562 1.00 0.00 H new ATOM 0 HG2 GLU A 45 6.251 7.818 -8.179 1.00 0.00 H new ATOM 0 HG3 GLU A 45 6.332 9.067 -6.952 1.00 0.00 H new ATOM 703 N GLU A 46 8.552 10.964 -6.105 1.00 0.00 N ATOM 704 CA GLU A 46 8.928 12.317 -6.491 1.00 0.00 C ATOM 705 C GLU A 46 10.131 12.816 -5.684 1.00 0.00 C ATOM 706 O GLU A 46 10.730 13.828 -6.039 1.00 0.00 O ATOM 707 CB GLU A 46 7.701 13.205 -6.258 1.00 0.00 C ATOM 708 CG GLU A 46 7.908 14.682 -6.592 1.00 0.00 C ATOM 709 CD GLU A 46 6.624 15.465 -6.313 1.00 0.00 C ATOM 710 OE1 GLU A 46 6.170 15.428 -5.145 1.00 0.00 O ATOM 711 OE2 GLU A 46 6.110 16.090 -7.265 1.00 0.00 O ATOM 0 H GLU A 46 7.660 10.921 -5.612 1.00 0.00 H new ATOM 0 HA GLU A 46 9.231 12.343 -7.538 1.00 0.00 H new ATOM 0 HB2 GLU A 46 6.874 12.824 -6.857 1.00 0.00 H new ATOM 0 HB3 GLU A 46 7.402 13.121 -5.213 1.00 0.00 H new ATOM 0 HG2 GLU A 46 8.727 15.087 -5.998 1.00 0.00 H new ATOM 0 HG3 GLU A 46 8.190 14.791 -7.639 1.00 0.00 H new ATOM 718 N ILE A 47 10.493 12.121 -4.600 1.00 0.00 N ATOM 719 CA ILE A 47 11.546 12.579 -3.703 1.00 0.00 C ATOM 720 C ILE A 47 12.493 11.445 -3.339 1.00 0.00 C ATOM 721 O ILE A 47 13.654 11.703 -3.041 1.00 0.00 O ATOM 722 CB ILE A 47 10.910 13.217 -2.458 1.00 0.00 C ATOM 723 CG1 ILE A 47 10.369 14.602 -2.841 1.00 0.00 C ATOM 724 CG2 ILE A 47 11.894 13.342 -1.293 1.00 0.00 C ATOM 725 CD1 ILE A 47 9.948 15.397 -1.603 1.00 0.00 C ATOM 0 H ILE A 47 10.067 11.236 -4.327 1.00 0.00 H new ATOM 0 HA ILE A 47 12.148 13.333 -4.211 1.00 0.00 H new ATOM 0 HB ILE A 47 10.104 12.567 -2.117 1.00 0.00 H new ATOM 0 HG12 ILE A 47 11.133 15.155 -3.388 1.00 0.00 H new ATOM 0 HG13 ILE A 47 9.516 14.489 -3.511 1.00 0.00 H new ATOM 0 HG21 ILE A 47 11.392 13.799 -0.440 1.00 0.00 H new ATOM 0 HG22 ILE A 47 12.255 12.352 -1.014 1.00 0.00 H new ATOM 0 HG23 ILE A 47 12.737 13.964 -1.594 1.00 0.00 H new ATOM 0 HD11 ILE A 47 9.570 16.373 -1.908 1.00 0.00 H new ATOM 0 HD12 ILE A 47 9.166 14.855 -1.071 1.00 0.00 H new ATOM 0 HD13 ILE A 47 10.808 15.531 -0.947 1.00 0.00 H new ATOM 737 N TYR A 48 12.050 10.187 -3.351 1.00 0.00 N ATOM 738 CA TYR A 48 12.943 9.114 -2.946 1.00 0.00 C ATOM 739 C TYR A 48 14.133 9.031 -3.893 1.00 0.00 C ATOM 740 O TYR A 48 15.244 8.705 -3.479 1.00 0.00 O ATOM 741 CB TYR A 48 12.197 7.784 -2.934 1.00 0.00 C ATOM 742 CG TYR A 48 13.116 6.671 -2.499 1.00 0.00 C ATOM 743 CD1 TYR A 48 13.293 6.410 -1.134 1.00 0.00 C ATOM 744 CD2 TYR A 48 13.800 5.918 -3.461 1.00 0.00 C ATOM 745 CE1 TYR A 48 14.164 5.393 -0.725 1.00 0.00 C ATOM 746 CE2 TYR A 48 14.671 4.902 -3.060 1.00 0.00 C ATOM 747 CZ TYR A 48 14.843 4.618 -1.687 1.00 0.00 C ATOM 748 OH TYR A 48 15.661 3.604 -1.286 1.00 0.00 O ATOM 0 H TYR A 48 11.112 9.897 -3.627 1.00 0.00 H new ATOM 0 HA TYR A 48 13.306 9.326 -1.940 1.00 0.00 H new ATOM 0 HB2 TYR A 48 11.343 7.844 -2.259 1.00 0.00 H new ATOM 0 HB3 TYR A 48 11.803 7.572 -3.928 1.00 0.00 H new ATOM 0 HD1 TYR A 48 12.758 6.992 -0.398 1.00 0.00 H new ATOM 0 HD2 TYR A 48 13.654 6.122 -4.511 1.00 0.00 H new ATOM 0 HE1 TYR A 48 14.316 5.202 0.327 1.00 0.00 H new ATOM 0 HE2 TYR A 48 15.213 4.333 -3.801 1.00 0.00 H new ATOM 0 HH TYR A 48 16.052 3.168 -2.072 1.00 0.00 H new ATOM 758 N GLN A 49 13.895 9.330 -5.172 1.00 0.00 N ATOM 759 CA GLN A 49 14.922 9.261 -6.194 1.00 0.00 C ATOM 760 C GLN A 49 15.894 10.431 -6.076 1.00 0.00 C ATOM 761 O GLN A 49 16.980 10.389 -6.659 1.00 0.00 O ATOM 762 CB GLN A 49 14.247 9.233 -7.565 1.00 0.00 C ATOM 763 CG GLN A 49 13.251 8.074 -7.609 1.00 0.00 C ATOM 764 CD GLN A 49 12.601 7.934 -8.982 1.00 0.00 C ATOM 765 OE1 GLN A 49 13.201 7.392 -9.909 1.00 0.00 O ATOM 766 NE2 GLN A 49 11.370 8.419 -9.120 1.00 0.00 N ATOM 0 H GLN A 49 12.983 9.626 -5.520 1.00 0.00 H new ATOM 0 HA GLN A 49 15.508 8.351 -6.062 1.00 0.00 H new ATOM 0 HB2 GLN A 49 13.734 10.177 -7.751 1.00 0.00 H new ATOM 0 HB3 GLN A 49 14.994 9.116 -8.350 1.00 0.00 H new ATOM 0 HG2 GLN A 49 13.762 7.146 -7.353 1.00 0.00 H new ATOM 0 HG3 GLN A 49 12.479 8.230 -6.856 1.00 0.00 H new ATOM 0 HE21 GLN A 49 10.905 8.862 -8.328 1.00 0.00 H new ATOM 0 HE22 GLN A 49 10.892 8.348 -10.018 1.00 0.00 H new ATOM 775 N ARG A 50 15.516 11.473 -5.323 1.00 0.00 N ATOM 776 CA ARG A 50 16.388 12.616 -5.077 1.00 0.00 C ATOM 777 C ARG A 50 17.158 12.415 -3.773 1.00 0.00 C ATOM 778 O ARG A 50 18.251 12.948 -3.621 1.00 0.00 O ATOM 779 CB ARG A 50 15.568 13.916 -5.085 1.00 0.00 C ATOM 780 CG ARG A 50 15.229 14.439 -3.685 1.00 0.00 C ATOM 781 CD ARG A 50 14.214 15.575 -3.766 1.00 0.00 C ATOM 782 NE ARG A 50 14.779 16.759 -4.428 1.00 0.00 N ATOM 783 CZ ARG A 50 14.094 17.884 -4.658 1.00 0.00 C ATOM 784 NH1 ARG A 50 12.823 18.001 -4.284 1.00 0.00 N ATOM 785 NH2 ARG A 50 14.686 18.904 -5.268 1.00 0.00 N ATOM 0 H ARG A 50 14.603 11.542 -4.873 1.00 0.00 H new ATOM 0 HA ARG A 50 17.125 12.698 -5.876 1.00 0.00 H new ATOM 0 HB2 ARG A 50 16.124 14.683 -5.625 1.00 0.00 H new ATOM 0 HB3 ARG A 50 14.642 13.748 -5.634 1.00 0.00 H new ATOM 0 HG2 ARG A 50 14.828 13.629 -3.076 1.00 0.00 H new ATOM 0 HG3 ARG A 50 16.136 14.789 -3.193 1.00 0.00 H new ATOM 0 HD2 ARG A 50 13.333 15.238 -4.312 1.00 0.00 H new ATOM 0 HD3 ARG A 50 13.884 15.841 -2.762 1.00 0.00 H new ATOM 0 HE ARG A 50 15.752 16.720 -4.730 1.00 0.00 H new ATOM 0 HH11 ARG A 50 12.356 17.225 -3.814 1.00 0.00 H new ATOM 0 HH12 ARG A 50 12.315 18.866 -4.467 1.00 0.00 H new ATOM 0 HH21 ARG A 50 15.660 18.828 -5.560 1.00 0.00 H new ATOM 0 HH22 ARG A 50 14.166 19.764 -5.445 1.00 0.00 H new ATOM 799 N ILE A 51 16.590 11.645 -2.833 1.00 0.00 N ATOM 800 CA ILE A 51 17.253 11.300 -1.583 1.00 0.00 C ATOM 801 C ILE A 51 18.386 10.324 -1.882 1.00 0.00 C ATOM 802 O ILE A 51 19.529 10.536 -1.477 1.00 0.00 O ATOM 803 CB ILE A 51 16.241 10.653 -0.627 1.00 0.00 C ATOM 804 CG1 ILE A 51 15.201 11.679 -0.180 1.00 0.00 C ATOM 805 CG2 ILE A 51 16.919 10.088 0.622 1.00 0.00 C ATOM 806 CD1 ILE A 51 14.055 10.989 0.551 1.00 0.00 C ATOM 0 H ILE A 51 15.655 11.247 -2.926 1.00 0.00 H new ATOM 0 HA ILE A 51 17.657 12.197 -1.114 1.00 0.00 H new ATOM 0 HB ILE A 51 15.766 9.839 -1.175 1.00 0.00 H new ATOM 0 HG12 ILE A 51 15.666 12.417 0.474 1.00 0.00 H new ATOM 0 HG13 ILE A 51 14.817 12.218 -1.046 1.00 0.00 H new ATOM 0 HG21 ILE A 51 16.168 9.639 1.272 1.00 0.00 H new ATOM 0 HG22 ILE A 51 17.646 9.330 0.330 1.00 0.00 H new ATOM 0 HG23 ILE A 51 17.427 10.892 1.155 1.00 0.00 H new ATOM 0 HD11 ILE A 51 13.322 11.733 0.863 1.00 0.00 H new ATOM 0 HD12 ILE A 51 13.580 10.269 -0.115 1.00 0.00 H new ATOM 0 HD13 ILE A 51 14.442 10.471 1.428 1.00 0.00 H new ATOM 818 N GLN A 52 18.063 9.248 -2.600 1.00 0.00 N ATOM 819 CA GLN A 52 19.009 8.186 -2.896 1.00 0.00 C ATOM 820 C GLN A 52 20.043 8.620 -3.930 1.00 0.00 C ATOM 821 O GLN A 52 20.859 7.812 -4.370 1.00 0.00 O ATOM 822 CB GLN A 52 18.245 6.926 -3.319 1.00 0.00 C ATOM 823 CG GLN A 52 17.408 6.430 -2.143 1.00 0.00 C ATOM 824 CD GLN A 52 18.209 6.404 -0.848 1.00 0.00 C ATOM 825 OE1 GLN A 52 19.220 5.711 -0.737 1.00 0.00 O ATOM 826 NE2 GLN A 52 17.764 7.170 0.142 1.00 0.00 N ATOM 0 H GLN A 52 17.134 9.093 -2.991 1.00 0.00 H new ATOM 0 HA GLN A 52 19.576 7.953 -1.995 1.00 0.00 H new ATOM 0 HB2 GLN A 52 17.602 7.145 -4.172 1.00 0.00 H new ATOM 0 HB3 GLN A 52 18.943 6.152 -3.636 1.00 0.00 H new ATOM 0 HG2 GLN A 52 16.538 7.075 -2.019 1.00 0.00 H new ATOM 0 HG3 GLN A 52 17.035 5.429 -2.359 1.00 0.00 H new ATOM 0 HE21 GLN A 52 16.922 7.731 0.014 1.00 0.00 H new ATOM 0 HE22 GLN A 52 18.264 7.197 1.030 1.00 0.00 H new ATOM 835 N ALA A 53 20.015 9.896 -4.321 1.00 0.00 N ATOM 836 CA ALA A 53 20.994 10.435 -5.239 1.00 0.00 C ATOM 837 C ALA A 53 22.366 10.566 -4.562 1.00 0.00 C ATOM 838 O ALA A 53 23.375 10.683 -5.252 1.00 0.00 O ATOM 839 CB ALA A 53 20.514 11.793 -5.750 1.00 0.00 C ATOM 0 H ALA A 53 19.317 10.571 -4.008 1.00 0.00 H new ATOM 0 HA ALA A 53 21.105 9.752 -6.081 1.00 0.00 H new ATOM 0 HB1 ALA A 53 21.250 12.202 -6.442 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.560 11.672 -6.264 1.00 0.00 H new ATOM 0 HB3 ALA A 53 20.389 12.475 -4.909 1.00 0.00 H new ATOM 845 N GLY A 54 22.407 10.548 -3.225 1.00 0.00 N ATOM 846 CA GLY A 54 23.658 10.618 -2.478 1.00 0.00 C ATOM 847 C GLY A 54 23.553 11.542 -1.265 1.00 0.00 C ATOM 848 O GLY A 54 24.577 11.943 -0.714 1.00 0.00 O ATOM 0 H GLY A 54 21.576 10.485 -2.637 1.00 0.00 H new ATOM 0 HA2 GLY A 54 23.939 9.618 -2.148 1.00 0.00 H new ATOM 0 HA3 GLY A 54 24.453 10.972 -3.135 1.00 0.00 H new ATOM 852 N LEU A 55 22.328 11.882 -0.851 1.00 0.00 N ATOM 853 CA LEU A 55 22.081 12.854 0.201 1.00 0.00 C ATOM 854 C LEU A 55 20.943 12.399 1.117 1.00 0.00 C ATOM 855 O LEU A 55 20.468 11.270 1.019 1.00 0.00 O ATOM 856 CB LEU A 55 21.788 14.202 -0.469 1.00 0.00 C ATOM 857 CG LEU A 55 20.617 14.146 -1.461 1.00 0.00 C ATOM 858 CD1 LEU A 55 19.264 14.074 -0.758 1.00 0.00 C ATOM 859 CD2 LEU A 55 20.645 15.403 -2.319 1.00 0.00 C ATOM 0 H LEU A 55 21.477 11.482 -1.245 1.00 0.00 H new ATOM 0 HA LEU A 55 22.956 12.954 0.844 1.00 0.00 H new ATOM 0 HB2 LEU A 55 21.568 14.942 0.300 1.00 0.00 H new ATOM 0 HB3 LEU A 55 22.682 14.542 -0.992 1.00 0.00 H new ATOM 0 HG LEU A 55 20.734 13.244 -2.062 1.00 0.00 H new ATOM 0 HD11 LEU A 55 18.469 14.036 -1.502 1.00 0.00 H new ATOM 0 HD12 LEU A 55 19.223 13.179 -0.138 1.00 0.00 H new ATOM 0 HD13 LEU A 55 19.132 14.956 -0.131 1.00 0.00 H new ATOM 0 HD21 LEU A 55 19.818 15.377 -3.029 1.00 0.00 H new ATOM 0 HD22 LEU A 55 20.548 16.281 -1.681 1.00 0.00 H new ATOM 0 HD23 LEU A 55 21.589 15.452 -2.862 1.00 0.00 H new ATOM 871 N THR A 56 20.506 13.289 2.010 1.00 0.00 N ATOM 872 CA THR A 56 19.387 13.042 2.910 1.00 0.00 C ATOM 873 C THR A 56 18.533 14.304 3.027 1.00 0.00 C ATOM 874 O THR A 56 18.856 15.327 2.426 1.00 0.00 O ATOM 875 CB THR A 56 19.908 12.587 4.278 1.00 0.00 C ATOM 876 OG1 THR A 56 20.772 13.565 4.812 1.00 0.00 O ATOM 877 CG2 THR A 56 20.673 11.269 4.136 1.00 0.00 C ATOM 0 H THR A 56 20.927 14.211 2.127 1.00 0.00 H new ATOM 0 HA THR A 56 18.761 12.245 2.509 1.00 0.00 H new ATOM 0 HB THR A 56 19.058 12.445 4.945 1.00 0.00 H new ATOM 0 HG1 THR A 56 21.100 13.269 5.687 1.00 0.00 H new ATOM 0 HG21 THR A 56 21.039 10.954 5.113 1.00 0.00 H new ATOM 0 HG22 THR A 56 20.009 10.504 3.733 1.00 0.00 H new ATOM 0 HG23 THR A 56 21.517 11.409 3.460 1.00 0.00 H new ATOM 885 N ALA A 57 17.438 14.237 3.794 1.00 0.00 N ATOM 886 CA ALA A 57 16.515 15.358 3.950 1.00 0.00 C ATOM 887 C ALA A 57 17.252 16.663 4.271 1.00 0.00 C ATOM 888 O ALA A 57 18.283 16.643 4.942 1.00 0.00 O ATOM 889 CB ALA A 57 15.508 15.027 5.051 1.00 0.00 C ATOM 0 H ALA A 57 17.171 13.405 4.321 1.00 0.00 H new ATOM 0 HA ALA A 57 15.994 15.510 3.005 1.00 0.00 H new ATOM 0 HB1 ALA A 57 14.815 15.860 5.173 1.00 0.00 H new ATOM 0 HB2 ALA A 57 14.952 14.130 4.778 1.00 0.00 H new ATOM 0 HB3 ALA A 57 16.037 14.855 5.988 1.00 0.00 H new ATOM 895 N PRO A 58 16.727 17.801 3.797 1.00 0.00 N ATOM 896 CA PRO A 58 17.360 19.102 3.938 1.00 0.00 C ATOM 897 C PRO A 58 17.331 19.612 5.374 1.00 0.00 C ATOM 898 O PRO A 58 18.219 20.366 5.766 1.00 0.00 O ATOM 899 CB PRO A 58 16.564 20.031 3.020 1.00 0.00 C ATOM 900 CG PRO A 58 15.178 19.387 2.961 1.00 0.00 C ATOM 901 CD PRO A 58 15.475 17.894 3.071 1.00 0.00 C ATOM 0 HA PRO A 58 18.416 19.051 3.673 1.00 0.00 H new ATOM 0 HB2 PRO A 58 16.518 21.044 3.419 1.00 0.00 H new ATOM 0 HB3 PRO A 58 17.016 20.099 2.030 1.00 0.00 H new ATOM 0 HG2 PRO A 58 14.541 19.731 3.776 1.00 0.00 H new ATOM 0 HG3 PRO A 58 14.663 19.627 2.031 1.00 0.00 H new ATOM 0 HD2 PRO A 58 14.676 17.373 3.598 1.00 0.00 H new ATOM 0 HD3 PRO A 58 15.558 17.437 2.085 1.00 0.00 H new ATOM 909 N ASP A 59 16.324 19.214 6.155 1.00 0.00 N ATOM 910 CA ASP A 59 16.173 19.691 7.519 1.00 0.00 C ATOM 911 C ASP A 59 15.157 18.840 8.282 1.00 0.00 C ATOM 912 O ASP A 59 14.483 17.992 7.697 1.00 0.00 O ATOM 913 CB ASP A 59 15.740 21.160 7.476 1.00 0.00 C ATOM 914 CG ASP A 59 14.306 21.332 6.974 1.00 0.00 C ATOM 915 OD1 ASP A 59 13.392 21.297 7.824 1.00 0.00 O ATOM 916 OD2 ASP A 59 14.133 21.499 5.744 1.00 0.00 O ATOM 0 H ASP A 59 15.601 18.559 5.858 1.00 0.00 H new ATOM 0 HA ASP A 59 17.123 19.608 8.046 1.00 0.00 H new ATOM 0 HB2 ASP A 59 15.827 21.591 8.474 1.00 0.00 H new ATOM 0 HB3 ASP A 59 16.418 21.717 6.829 1.00 0.00 H new ATOM 1635 N MET C 1 1.731 7.308 12.623 1.00 0.00 N ATOM 1636 CA MET C 1 1.333 6.798 11.296 1.00 0.00 C ATOM 1637 C MET C 1 1.599 7.854 10.233 1.00 0.00 C ATOM 1638 O MET C 1 1.278 9.019 10.449 1.00 0.00 O ATOM 1639 CB MET C 1 -0.148 6.405 11.299 1.00 0.00 C ATOM 1640 CG MET C 1 -0.450 5.450 10.148 1.00 0.00 C ATOM 1641 SD MET C 1 -2.160 4.852 10.074 1.00 0.00 S ATOM 1642 CE MET C 1 -2.993 6.367 9.537 1.00 0.00 C ATOM 0 H1 MET C 1 1.032 7.011 13.333 1.00 0.00 H new ATOM 0 H2 MET C 1 2.665 6.926 12.876 1.00 0.00 H new ATOM 0 H3 MET C 1 1.777 8.347 12.596 1.00 0.00 H new ATOM 0 HA MET C 1 1.924 5.911 11.067 1.00 0.00 H new ATOM 0 HB2 MET C 1 -0.403 5.933 12.248 1.00 0.00 H new ATOM 0 HB3 MET C 1 -0.767 7.298 11.211 1.00 0.00 H new ATOM 0 HG2 MET C 1 -0.216 5.952 9.209 1.00 0.00 H new ATOM 0 HG3 MET C 1 0.216 4.591 10.225 1.00 0.00 H new ATOM 0 HE1 MET C 1 -4.034 6.146 9.302 1.00 0.00 H new ATOM 0 HE2 MET C 1 -2.950 7.108 10.335 1.00 0.00 H new ATOM 0 HE3 MET C 1 -2.497 6.760 8.650 1.00 0.00 H new ATOM 1654 N LEU C 2 2.178 7.470 9.095 1.00 0.00 N ATOM 1655 CA LEU C 2 2.484 8.418 8.031 1.00 0.00 C ATOM 1656 C LEU C 2 1.343 8.384 7.007 1.00 0.00 C ATOM 1657 O LEU C 2 0.961 7.308 6.550 1.00 0.00 O ATOM 1658 CB LEU C 2 3.835 8.021 7.417 1.00 0.00 C ATOM 1659 CG LEU C 2 4.608 9.139 6.702 1.00 0.00 C ATOM 1660 CD1 LEU C 2 5.645 8.505 5.777 1.00 0.00 C ATOM 1661 CD2 LEU C 2 3.747 10.084 5.876 1.00 0.00 C ATOM 0 H LEU C 2 2.444 6.507 8.889 1.00 0.00 H new ATOM 0 HA LEU C 2 2.566 9.440 8.401 1.00 0.00 H new ATOM 0 HB2 LEU C 2 4.467 7.620 8.209 1.00 0.00 H new ATOM 0 HB3 LEU C 2 3.664 7.213 6.706 1.00 0.00 H new ATOM 0 HG LEU C 2 5.058 9.742 7.490 1.00 0.00 H new ATOM 0 HD11 LEU C 2 6.201 9.289 5.263 1.00 0.00 H new ATOM 0 HD12 LEU C 2 6.333 7.897 6.364 1.00 0.00 H new ATOM 0 HD13 LEU C 2 5.142 7.876 5.043 1.00 0.00 H new ATOM 0 HD21 LEU C 2 4.380 10.839 5.409 1.00 0.00 H new ATOM 0 HD22 LEU C 2 3.226 9.519 5.103 1.00 0.00 H new ATOM 0 HD23 LEU C 2 3.018 10.571 6.523 1.00 0.00 H new ATOM 1673 N ILE C 3 0.800 9.554 6.651 1.00 0.00 N ATOM 1674 CA ILE C 3 -0.302 9.685 5.704 1.00 0.00 C ATOM 1675 C ILE C 3 0.182 10.448 4.482 1.00 0.00 C ATOM 1676 O ILE C 3 1.080 11.285 4.579 1.00 0.00 O ATOM 1677 CB ILE C 3 -1.491 10.422 6.350 1.00 0.00 C ATOM 1678 CG1 ILE C 3 -2.264 9.527 7.325 1.00 0.00 C ATOM 1679 CG2 ILE C 3 -2.503 10.887 5.302 1.00 0.00 C ATOM 1680 CD1 ILE C 3 -1.593 9.472 8.688 1.00 0.00 C ATOM 0 H ILE C 3 1.123 10.448 7.021 1.00 0.00 H new ATOM 0 HA ILE C 3 -0.639 8.691 5.409 1.00 0.00 H new ATOM 0 HB ILE C 3 -1.050 11.270 6.874 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -3.282 9.902 7.435 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -2.338 8.520 6.915 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -3.327 11.402 5.795 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -2.016 11.567 4.603 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -2.888 10.023 4.760 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -2.170 8.828 9.352 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -0.584 9.073 8.581 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -1.543 10.476 9.110 1.00 0.00 H new ATOM 1692 N LEU C 4 -0.418 10.152 3.328 1.00 0.00 N ATOM 1693 CA LEU C 4 -0.150 10.846 2.081 1.00 0.00 C ATOM 1694 C LEU C 4 -1.443 10.922 1.275 1.00 0.00 C ATOM 1695 O LEU C 4 -2.419 10.231 1.578 1.00 0.00 O ATOM 1696 CB LEU C 4 0.926 10.106 1.278 1.00 0.00 C ATOM 1697 CG LEU C 4 2.309 10.131 1.939 1.00 0.00 C ATOM 1698 CD1 LEU C 4 3.282 9.284 1.126 1.00 0.00 C ATOM 1699 CD2 LEU C 4 2.883 11.545 1.990 1.00 0.00 C ATOM 0 H LEU C 4 -1.113 9.411 3.239 1.00 0.00 H new ATOM 0 HA LEU C 4 0.214 11.851 2.294 1.00 0.00 H new ATOM 0 HB2 LEU C 4 0.617 9.070 1.140 1.00 0.00 H new ATOM 0 HB3 LEU C 4 0.998 10.552 0.286 1.00 0.00 H new ATOM 0 HG LEU C 4 2.187 9.746 2.951 1.00 0.00 H new ATOM 0 HD11 LEU C 4 4.264 9.304 1.598 1.00 0.00 H new ATOM 0 HD12 LEU C 4 2.921 8.256 1.082 1.00 0.00 H new ATOM 0 HD13 LEU C 4 3.357 9.685 0.115 1.00 0.00 H new ATOM 0 HD21 LEU C 4 3.864 11.523 2.465 1.00 0.00 H new ATOM 0 HD22 LEU C 4 2.979 11.935 0.977 1.00 0.00 H new ATOM 0 HD23 LEU C 4 2.216 12.188 2.564 1.00 0.00 H new ATOM 1711 N THR C 5 -1.445 11.766 0.246 1.00 0.00 N ATOM 1712 CA THR C 5 -2.598 12.002 -0.601 1.00 0.00 C ATOM 1713 C THR C 5 -2.167 11.762 -2.038 1.00 0.00 C ATOM 1714 O THR C 5 -1.477 12.581 -2.644 1.00 0.00 O ATOM 1715 CB THR C 5 -3.126 13.422 -0.379 1.00 0.00 C ATOM 1716 OG1 THR C 5 -3.562 13.536 0.954 1.00 0.00 O ATOM 1717 CG2 THR C 5 -4.302 13.744 -1.302 1.00 0.00 C ATOM 0 H THR C 5 -0.627 12.313 -0.023 1.00 0.00 H new ATOM 0 HA THR C 5 -3.417 11.325 -0.359 1.00 0.00 H new ATOM 0 HB THR C 5 -2.319 14.121 -0.598 1.00 0.00 H new ATOM 0 HG1 THR C 5 -3.901 14.442 1.111 1.00 0.00 H new ATOM 0 HG21 THR C 5 -4.646 14.761 -1.112 1.00 0.00 H new ATOM 0 HG22 THR C 5 -3.984 13.657 -2.341 1.00 0.00 H new ATOM 0 HG23 THR C 5 -5.116 13.044 -1.112 1.00 0.00 H new ATOM 1725 N ARG C 6 -2.585 10.612 -2.568 1.00 0.00 N ATOM 1726 CA ARG C 6 -2.133 10.116 -3.853 1.00 0.00 C ATOM 1727 C ARG C 6 -3.102 10.510 -4.955 1.00 0.00 C ATOM 1728 O ARG C 6 -4.190 11.020 -4.688 1.00 0.00 O ATOM 1729 CB ARG C 6 -2.070 8.587 -3.774 1.00 0.00 C ATOM 1730 CG ARG C 6 -1.034 8.111 -2.759 1.00 0.00 C ATOM 1731 CD ARG C 6 0.377 8.177 -3.344 1.00 0.00 C ATOM 1732 NE ARG C 6 0.580 7.148 -4.375 1.00 0.00 N ATOM 1733 CZ ARG C 6 0.678 5.838 -4.126 1.00 0.00 C ATOM 1734 NH1 ARG C 6 0.574 5.357 -2.890 1.00 0.00 N ATOM 1735 NH2 ARG C 6 0.888 4.985 -5.123 1.00 0.00 N ATOM 0 H ARG C 6 -3.255 9.997 -2.106 1.00 0.00 H new ATOM 0 HA ARG C 6 -1.156 10.542 -4.082 1.00 0.00 H new ATOM 0 HB2 ARG C 6 -3.051 8.197 -3.502 1.00 0.00 H new ATOM 0 HB3 ARG C 6 -1.828 8.182 -4.757 1.00 0.00 H new ATOM 0 HG2 ARG C 6 -1.089 8.728 -1.862 1.00 0.00 H new ATOM 0 HG3 ARG C 6 -1.259 7.088 -2.457 1.00 0.00 H new ATOM 0 HD2 ARG C 6 0.548 9.164 -3.774 1.00 0.00 H new ATOM 0 HD3 ARG C 6 1.109 8.045 -2.547 1.00 0.00 H new ATOM 0 HE ARG C 6 0.651 7.454 -5.345 1.00 0.00 H new ATOM 0 HH11 ARG C 6 0.416 5.992 -2.107 1.00 0.00 H new ATOM 0 HH12 ARG C 6 0.652 4.353 -2.725 1.00 0.00 H new ATOM 0 HH21 ARG C 6 0.975 5.329 -6.079 1.00 0.00 H new ATOM 0 HH22 ARG C 6 0.963 3.986 -4.932 1.00 0.00 H new ATOM 1749 N LYS C 7 -2.696 10.272 -6.202 1.00 0.00 N ATOM 1750 CA LYS C 7 -3.562 10.392 -7.362 1.00 0.00 C ATOM 1751 C LYS C 7 -3.244 9.241 -8.297 1.00 0.00 C ATOM 1752 O LYS C 7 -2.161 8.661 -8.222 1.00 0.00 O ATOM 1753 CB LYS C 7 -3.376 11.727 -8.089 1.00 0.00 C ATOM 1754 CG LYS C 7 -3.658 12.962 -7.231 1.00 0.00 C ATOM 1755 CD LYS C 7 -2.429 13.391 -6.433 1.00 0.00 C ATOM 1756 CE LYS C 7 -2.568 14.820 -5.897 1.00 0.00 C ATOM 1757 NZ LYS C 7 -2.617 15.812 -6.990 1.00 0.00 N ATOM 0 H LYS C 7 -1.744 9.987 -6.432 1.00 0.00 H new ATOM 0 HA LYS C 7 -4.601 10.358 -7.034 1.00 0.00 H new ATOM 0 HB2 LYS C 7 -2.353 11.784 -8.460 1.00 0.00 H new ATOM 0 HB3 LYS C 7 -4.033 11.747 -8.959 1.00 0.00 H new ATOM 0 HG2 LYS C 7 -3.981 13.783 -7.871 1.00 0.00 H new ATOM 0 HG3 LYS C 7 -4.480 12.749 -6.547 1.00 0.00 H new ATOM 0 HD2 LYS C 7 -2.278 12.704 -5.601 1.00 0.00 H new ATOM 0 HD3 LYS C 7 -1.544 13.325 -7.065 1.00 0.00 H new ATOM 0 HE2 LYS C 7 -3.474 14.896 -5.296 1.00 0.00 H new ATOM 0 HE3 LYS C 7 -1.729 15.045 -5.239 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 -2.356 16.749 -6.621 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 -1.950 15.537 -7.739 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 -3.580 15.850 -7.381 1.00 0.00 H new ATOM 1771 N VAL C 8 -4.185 8.908 -9.174 1.00 0.00 N ATOM 1772 CA VAL C 8 -4.056 7.764 -10.061 1.00 0.00 C ATOM 1773 C VAL C 8 -2.784 7.889 -10.896 1.00 0.00 C ATOM 1774 O VAL C 8 -2.640 8.829 -11.674 1.00 0.00 O ATOM 1775 CB VAL C 8 -5.292 7.676 -10.962 1.00 0.00 C ATOM 1776 CG1 VAL C 8 -5.145 6.503 -11.933 1.00 0.00 C ATOM 1777 CG2 VAL C 8 -6.548 7.485 -10.113 1.00 0.00 C ATOM 0 H VAL C 8 -5.057 9.425 -9.288 1.00 0.00 H new ATOM 0 HA VAL C 8 -3.986 6.851 -9.470 1.00 0.00 H new ATOM 0 HB VAL C 8 -5.382 8.603 -11.528 1.00 0.00 H new ATOM 0 HG11 VAL C 8 -6.027 6.446 -12.571 1.00 0.00 H new ATOM 0 HG12 VAL C 8 -4.259 6.651 -12.551 1.00 0.00 H new ATOM 0 HG13 VAL C 8 -5.044 5.575 -11.370 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -7.421 7.424 -10.763 1.00 0.00 H new ATOM 0 HG22 VAL C 8 -6.460 6.565 -9.535 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -6.660 8.330 -9.434 1.00 0.00 H new ATOM 1787 N GLY C 9 -1.863 6.932 -10.727 1.00 0.00 N ATOM 1788 CA GLY C 9 -0.624 6.865 -11.486 1.00 0.00 C ATOM 1789 C GLY C 9 0.615 7.111 -10.627 1.00 0.00 C ATOM 1790 O GLY C 9 1.714 6.722 -11.015 1.00 0.00 O ATOM 0 H GLY C 9 -1.966 6.177 -10.049 1.00 0.00 H new ATOM 0 HA2 GLY C 9 -0.545 5.885 -11.956 1.00 0.00 H new ATOM 0 HA3 GLY C 9 -0.655 7.602 -12.288 1.00 0.00 H new ATOM 1794 N GLU C 10 0.457 7.750 -9.462 1.00 0.00 N ATOM 1795 CA GLU C 10 1.583 8.037 -8.585 1.00 0.00 C ATOM 1796 C GLU C 10 2.095 6.774 -7.889 1.00 0.00 C ATOM 1797 O GLU C 10 1.440 5.729 -7.898 1.00 0.00 O ATOM 1798 CB GLU C 10 1.173 9.062 -7.526 1.00 0.00 C ATOM 1799 CG GLU C 10 0.811 10.394 -8.172 1.00 0.00 C ATOM 1800 CD GLU C 10 0.624 11.483 -7.121 1.00 0.00 C ATOM 1801 OE1 GLU C 10 0.035 11.164 -6.064 1.00 0.00 O ATOM 1802 OE2 GLU C 10 1.070 12.622 -7.374 1.00 0.00 O ATOM 0 H GLU C 10 -0.443 8.076 -9.110 1.00 0.00 H new ATOM 0 HA GLU C 10 2.386 8.437 -9.204 1.00 0.00 H new ATOM 0 HB2 GLU C 10 0.322 8.685 -6.959 1.00 0.00 H new ATOM 0 HB3 GLU C 10 1.989 9.206 -6.818 1.00 0.00 H new ATOM 0 HG2 GLU C 10 1.596 10.688 -8.869 1.00 0.00 H new ATOM 0 HG3 GLU C 10 -0.105 10.283 -8.752 1.00 0.00 H new ATOM 1809 N SER C 11 3.274 6.879 -7.278 1.00 0.00 N ATOM 1810 CA SER C 11 3.902 5.771 -6.573 1.00 0.00 C ATOM 1811 C SER C 11 4.633 6.263 -5.335 1.00 0.00 C ATOM 1812 O SER C 11 4.998 7.435 -5.239 1.00 0.00 O ATOM 1813 CB SER C 11 4.888 5.054 -7.498 1.00 0.00 C ATOM 1814 OG SER C 11 4.209 4.496 -8.597 1.00 0.00 O ATOM 0 H SER C 11 3.820 7.740 -7.260 1.00 0.00 H new ATOM 0 HA SER C 11 3.120 5.077 -6.264 1.00 0.00 H new ATOM 0 HB2 SER C 11 5.645 5.756 -7.848 1.00 0.00 H new ATOM 0 HB3 SER C 11 5.409 4.271 -6.948 1.00 0.00 H new ATOM 0 HG SER C 11 4.851 4.042 -9.182 1.00 0.00 H new ATOM 1820 N ILE C 12 4.845 5.346 -4.387 1.00 0.00 N ATOM 1821 CA ILE C 12 5.551 5.599 -3.135 1.00 0.00 C ATOM 1822 C ILE C 12 6.582 4.488 -2.956 1.00 0.00 C ATOM 1823 O ILE C 12 6.503 3.470 -3.639 1.00 0.00 O ATOM 1824 CB ILE C 12 4.548 5.638 -1.968 1.00 0.00 C ATOM 1825 CG1 ILE C 12 3.454 6.694 -2.183 1.00 0.00 C ATOM 1826 CG2 ILE C 12 5.230 5.915 -0.622 1.00 0.00 C ATOM 1827 CD1 ILE C 12 3.962 8.135 -2.199 1.00 0.00 C ATOM 0 H ILE C 12 4.521 4.383 -4.475 1.00 0.00 H new ATOM 0 HA ILE C 12 6.058 6.564 -3.154 1.00 0.00 H new ATOM 0 HB ILE C 12 4.096 4.646 -1.944 1.00 0.00 H new ATOM 0 HG12 ILE C 12 2.949 6.489 -3.127 1.00 0.00 H new ATOM 0 HG13 ILE C 12 2.709 6.593 -1.394 1.00 0.00 H new ATOM 0 HG21 ILE C 12 4.480 5.933 0.169 1.00 0.00 H new ATOM 0 HG22 ILE C 12 5.958 5.131 -0.415 1.00 0.00 H new ATOM 0 HG23 ILE C 12 5.737 6.879 -0.663 1.00 0.00 H new ATOM 0 HD11 ILE C 12 3.124 8.814 -2.356 1.00 0.00 H new ATOM 0 HD12 ILE C 12 4.440 8.363 -1.246 1.00 0.00 H new ATOM 0 HD13 ILE C 12 4.684 8.257 -3.006 1.00 0.00 H new ATOM 1839 N ASN C 13 7.545 4.663 -2.051 1.00 0.00 N ATOM 1840 CA ASN C 13 8.633 3.717 -1.882 1.00 0.00 C ATOM 1841 C ASN C 13 8.878 3.460 -0.398 1.00 0.00 C ATOM 1842 O ASN C 13 8.724 4.359 0.428 1.00 0.00 O ATOM 1843 CB ASN C 13 9.871 4.290 -2.576 1.00 0.00 C ATOM 1844 CG ASN C 13 11.000 3.275 -2.637 1.00 0.00 C ATOM 1845 OD1 ASN C 13 11.742 3.092 -1.676 1.00 0.00 O ATOM 1846 ND2 ASN C 13 11.137 2.606 -3.775 1.00 0.00 N ATOM 0 H ASN C 13 7.587 5.463 -1.420 1.00 0.00 H new ATOM 0 HA ASN C 13 8.387 2.756 -2.333 1.00 0.00 H new ATOM 0 HB2 ASN C 13 9.609 4.605 -3.586 1.00 0.00 H new ATOM 0 HB3 ASN C 13 10.209 5.179 -2.043 1.00 0.00 H new ATOM 0 HD21 ASN C 13 11.878 1.912 -3.873 1.00 0.00 H new ATOM 0 HD22 ASN C 13 10.501 2.786 -4.552 1.00 0.00 H new ATOM 1853 N ILE C 14 9.264 2.220 -0.075 1.00 0.00 N ATOM 1854 CA ILE C 14 9.493 1.773 1.294 1.00 0.00 C ATOM 1855 C ILE C 14 10.813 1.006 1.362 1.00 0.00 C ATOM 1856 O ILE C 14 11.202 0.339 0.401 1.00 0.00 O ATOM 1857 CB ILE C 14 8.351 0.850 1.753 1.00 0.00 C ATOM 1858 CG1 ILE C 14 6.950 1.411 1.468 1.00 0.00 C ATOM 1859 CG2 ILE C 14 8.500 0.551 3.254 1.00 0.00 C ATOM 1860 CD1 ILE C 14 6.614 2.632 2.315 1.00 0.00 C ATOM 0 H ILE C 14 9.427 1.492 -0.771 1.00 0.00 H new ATOM 0 HA ILE C 14 9.532 2.645 1.947 1.00 0.00 H new ATOM 0 HB ILE C 14 8.438 -0.066 1.168 1.00 0.00 H new ATOM 0 HG12 ILE C 14 6.879 1.677 0.413 1.00 0.00 H new ATOM 0 HG13 ILE C 14 6.209 0.633 1.652 1.00 0.00 H new ATOM 0 HG21 ILE C 14 7.690 -0.103 3.577 1.00 0.00 H new ATOM 0 HG22 ILE C 14 9.456 0.060 3.434 1.00 0.00 H new ATOM 0 HG23 ILE C 14 8.459 1.484 3.817 1.00 0.00 H new ATOM 0 HD11 ILE C 14 5.612 2.982 2.068 1.00 0.00 H new ATOM 0 HD12 ILE C 14 6.655 2.365 3.371 1.00 0.00 H new ATOM 0 HD13 ILE C 14 7.335 3.424 2.113 1.00 0.00 H new ATOM 1872 N GLY C 15 11.504 1.094 2.502 1.00 0.00 N ATOM 1873 CA GLY C 15 12.752 0.384 2.710 1.00 0.00 C ATOM 1874 C GLY C 15 13.761 0.736 1.621 1.00 0.00 C ATOM 1875 O GLY C 15 13.944 1.908 1.291 1.00 0.00 O ATOM 0 H GLY C 15 11.209 1.659 3.298 1.00 0.00 H new ATOM 0 HA2 GLY C 15 13.162 0.637 3.688 1.00 0.00 H new ATOM 0 HA3 GLY C 15 12.569 -0.691 2.710 1.00 0.00 H new ATOM 1879 N ASP C 16 14.412 -0.289 1.066 1.00 0.00 N ATOM 1880 CA ASP C 16 15.381 -0.131 -0.008 1.00 0.00 C ATOM 1881 C ASP C 16 15.083 -1.100 -1.157 1.00 0.00 C ATOM 1882 O ASP C 16 15.856 -1.180 -2.111 1.00 0.00 O ATOM 1883 CB ASP C 16 16.791 -0.355 0.536 1.00 0.00 C ATOM 1884 CG ASP C 16 17.153 0.653 1.628 1.00 0.00 C ATOM 1885 OD1 ASP C 16 17.687 1.729 1.276 1.00 0.00 O ATOM 1886 OD2 ASP C 16 16.890 0.338 2.809 1.00 0.00 O ATOM 0 H ASP C 16 14.277 -1.258 1.355 1.00 0.00 H new ATOM 0 HA ASP C 16 15.310 0.883 -0.401 1.00 0.00 H new ATOM 0 HB2 ASP C 16 16.868 -1.366 0.936 1.00 0.00 H new ATOM 0 HB3 ASP C 16 17.510 -0.279 -0.280 1.00 0.00 H new ATOM 1891 N ASP C 17 13.971 -1.840 -1.072 1.00 0.00 N ATOM 1892 CA ASP C 17 13.622 -2.865 -2.048 1.00 0.00 C ATOM 1893 C ASP C 17 12.109 -2.969 -2.264 1.00 0.00 C ATOM 1894 O ASP C 17 11.643 -3.949 -2.845 1.00 0.00 O ATOM 1895 CB ASP C 17 14.153 -4.225 -1.577 1.00 0.00 C ATOM 1896 CG ASP C 17 15.672 -4.233 -1.404 1.00 0.00 C ATOM 1897 OD1 ASP C 17 16.370 -4.398 -2.428 1.00 0.00 O ATOM 1898 OD2 ASP C 17 16.124 -4.074 -0.248 1.00 0.00 O ATOM 0 H ASP C 17 13.289 -1.740 -0.320 1.00 0.00 H new ATOM 0 HA ASP C 17 14.078 -2.580 -2.996 1.00 0.00 H new ATOM 0 HB2 ASP C 17 13.681 -4.487 -0.630 1.00 0.00 H new ATOM 0 HB3 ASP C 17 13.869 -4.992 -2.298 1.00 0.00 H new ATOM 1903 N ILE C 18 11.324 -1.986 -1.807 1.00 0.00 N ATOM 1904 CA ILE C 18 9.873 -2.060 -1.909 1.00 0.00 C ATOM 1905 C ILE C 18 9.313 -0.769 -2.498 1.00 0.00 C ATOM 1906 O ILE C 18 9.769 0.325 -2.169 1.00 0.00 O ATOM 1907 CB ILE C 18 9.287 -2.327 -0.514 1.00 0.00 C ATOM 1908 CG1 ILE C 18 9.797 -3.672 0.026 1.00 0.00 C ATOM 1909 CG2 ILE C 18 7.755 -2.310 -0.556 1.00 0.00 C ATOM 1910 CD1 ILE C 18 9.372 -3.908 1.477 1.00 0.00 C ATOM 0 H ILE C 18 11.674 -1.135 -1.366 1.00 0.00 H new ATOM 0 HA ILE C 18 9.594 -2.875 -2.576 1.00 0.00 H new ATOM 0 HB ILE C 18 9.616 -1.533 0.157 1.00 0.00 H new ATOM 0 HG12 ILE C 18 9.417 -4.480 -0.599 1.00 0.00 H new ATOM 0 HG13 ILE C 18 10.884 -3.701 -0.042 1.00 0.00 H new ATOM 0 HG21 ILE C 18 7.362 -2.501 0.442 1.00 0.00 H new ATOM 0 HG22 ILE C 18 7.411 -1.335 -0.901 1.00 0.00 H new ATOM 0 HG23 ILE C 18 7.401 -3.082 -1.239 1.00 0.00 H new ATOM 0 HD11 ILE C 18 9.755 -4.871 1.816 1.00 0.00 H new ATOM 0 HD12 ILE C 18 9.774 -3.115 2.107 1.00 0.00 H new ATOM 0 HD13 ILE C 18 8.284 -3.907 1.542 1.00 0.00 H new ATOM 1922 N THR C 19 8.315 -0.896 -3.381 1.00 0.00 N ATOM 1923 CA THR C 19 7.661 0.241 -4.011 1.00 0.00 C ATOM 1924 C THR C 19 6.175 -0.062 -4.170 1.00 0.00 C ATOM 1925 O THR C 19 5.787 -1.226 -4.238 1.00 0.00 O ATOM 1926 CB THR C 19 8.298 0.521 -5.383 1.00 0.00 C ATOM 1927 OG1 THR C 19 9.704 0.397 -5.319 1.00 0.00 O ATOM 1928 CG2 THR C 19 7.991 1.935 -5.863 1.00 0.00 C ATOM 0 H THR C 19 7.942 -1.798 -3.675 1.00 0.00 H new ATOM 0 HA THR C 19 7.784 1.126 -3.387 1.00 0.00 H new ATOM 0 HB THR C 19 7.877 -0.209 -6.074 1.00 0.00 H new ATOM 0 HG1 THR C 19 10.089 0.578 -6.202 1.00 0.00 H new ATOM 0 HG21 THR C 19 8.456 2.098 -6.835 1.00 0.00 H new ATOM 0 HG22 THR C 19 6.912 2.063 -5.951 1.00 0.00 H new ATOM 0 HG23 THR C 19 8.385 2.656 -5.147 1.00 0.00 H new ATOM 1936 N ILE C 20 5.337 0.980 -4.227 1.00 0.00 N ATOM 1937 CA ILE C 20 3.883 0.839 -4.258 1.00 0.00 C ATOM 1938 C ILE C 20 3.300 1.798 -5.298 1.00 0.00 C ATOM 1939 O ILE C 20 3.867 2.862 -5.527 1.00 0.00 O ATOM 1940 CB ILE C 20 3.310 1.163 -2.864 1.00 0.00 C ATOM 1941 CG1 ILE C 20 4.078 0.478 -1.720 1.00 0.00 C ATOM 1942 CG2 ILE C 20 1.831 0.769 -2.801 1.00 0.00 C ATOM 1943 CD1 ILE C 20 3.898 -1.039 -1.698 1.00 0.00 C ATOM 0 H ILE C 20 5.654 1.949 -4.253 1.00 0.00 H new ATOM 0 HA ILE C 20 3.618 -0.183 -4.527 1.00 0.00 H new ATOM 0 HB ILE C 20 3.422 2.238 -2.723 1.00 0.00 H new ATOM 0 HG12 ILE C 20 5.139 0.710 -1.813 1.00 0.00 H new ATOM 0 HG13 ILE C 20 3.744 0.891 -0.768 1.00 0.00 H new ATOM 0 HG21 ILE C 20 1.434 1.001 -1.813 1.00 0.00 H new ATOM 0 HG22 ILE C 20 1.274 1.325 -3.555 1.00 0.00 H new ATOM 0 HG23 ILE C 20 1.731 -0.300 -2.990 1.00 0.00 H new ATOM 0 HD11 ILE C 20 4.465 -1.461 -0.868 1.00 0.00 H new ATOM 0 HD12 ILE C 20 2.842 -1.278 -1.575 1.00 0.00 H new ATOM 0 HD13 ILE C 20 4.259 -1.462 -2.636 1.00 0.00 H new ATOM 1955 N THR C 21 2.175 1.435 -5.926 1.00 0.00 N ATOM 1956 CA THR C 21 1.565 2.247 -6.976 1.00 0.00 C ATOM 1957 C THR C 21 0.037 2.221 -6.863 1.00 0.00 C ATOM 1958 O THR C 21 -0.535 1.242 -6.383 1.00 0.00 O ATOM 1959 CB THR C 21 2.004 1.713 -8.345 1.00 0.00 C ATOM 1960 OG1 THR C 21 3.411 1.671 -8.421 1.00 0.00 O ATOM 1961 CG2 THR C 21 1.506 2.590 -9.493 1.00 0.00 C ATOM 0 H THR C 21 1.667 0.575 -5.719 1.00 0.00 H new ATOM 0 HA THR C 21 1.894 3.280 -6.864 1.00 0.00 H new ATOM 0 HB THR C 21 1.573 0.717 -8.443 1.00 0.00 H new ATOM 0 HG1 THR C 21 3.763 2.584 -8.484 1.00 0.00 H new ATOM 0 HG21 THR C 21 1.842 2.172 -10.442 1.00 0.00 H new ATOM 0 HG22 THR C 21 0.417 2.626 -9.477 1.00 0.00 H new ATOM 0 HG23 THR C 21 1.904 3.598 -9.380 1.00 0.00 H new ATOM 1969 N ILE C 22 -0.625 3.296 -7.312 1.00 0.00 N ATOM 1970 CA ILE C 22 -2.081 3.408 -7.324 1.00 0.00 C ATOM 1971 C ILE C 22 -2.551 3.347 -8.777 1.00 0.00 C ATOM 1972 O ILE C 22 -2.507 4.340 -9.501 1.00 0.00 O ATOM 1973 CB ILE C 22 -2.528 4.678 -6.576 1.00 0.00 C ATOM 1974 CG1 ILE C 22 -4.030 4.957 -6.718 1.00 0.00 C ATOM 1975 CG2 ILE C 22 -1.784 5.932 -7.044 1.00 0.00 C ATOM 1976 CD1 ILE C 22 -4.876 3.862 -6.075 1.00 0.00 C ATOM 0 H ILE C 22 -0.153 4.121 -7.681 1.00 0.00 H new ATOM 0 HA ILE C 22 -2.548 2.580 -6.790 1.00 0.00 H new ATOM 0 HB ILE C 22 -2.289 4.470 -5.533 1.00 0.00 H new ATOM 0 HG12 ILE C 22 -4.266 5.916 -6.257 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -4.285 5.040 -7.774 1.00 0.00 H new ATOM 0 HG21 ILE C 22 -2.139 6.796 -6.483 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -0.715 5.805 -6.876 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -1.968 6.089 -8.107 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -5.933 4.099 -6.198 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -4.660 2.907 -6.554 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -4.640 3.797 -5.013 1.00 0.00 H new ATOM 1988 N LEU C 23 -3.003 2.166 -9.205 1.00 0.00 N ATOM 1989 CA LEU C 23 -3.364 1.941 -10.597 1.00 0.00 C ATOM 1990 C LEU C 23 -4.640 2.686 -10.971 1.00 0.00 C ATOM 1991 O LEU C 23 -4.821 3.052 -12.131 1.00 0.00 O ATOM 1992 CB LEU C 23 -3.572 0.445 -10.847 1.00 0.00 C ATOM 1993 CG LEU C 23 -2.415 -0.425 -10.356 1.00 0.00 C ATOM 1994 CD1 LEU C 23 -2.669 -1.847 -10.824 1.00 0.00 C ATOM 1995 CD2 LEU C 23 -1.053 0.047 -10.861 1.00 0.00 C ATOM 0 H LEU C 23 -3.126 1.352 -8.602 1.00 0.00 H new ATOM 0 HA LEU C 23 -2.548 2.317 -11.214 1.00 0.00 H new ATOM 0 HB2 LEU C 23 -4.490 0.127 -10.353 1.00 0.00 H new ATOM 0 HB3 LEU C 23 -3.712 0.280 -11.915 1.00 0.00 H new ATOM 0 HG LEU C 23 -2.378 -0.359 -9.269 1.00 0.00 H new ATOM 0 HD11 LEU C 23 -1.857 -2.491 -10.487 1.00 0.00 H new ATOM 0 HD12 LEU C 23 -3.612 -2.204 -10.409 1.00 0.00 H new ATOM 0 HD13 LEU C 23 -2.721 -1.868 -11.913 1.00 0.00 H new ATOM 0 HD21 LEU C 23 -0.274 -0.612 -10.477 1.00 0.00 H new ATOM 0 HD22 LEU C 23 -1.042 0.026 -11.951 1.00 0.00 H new ATOM 0 HD23 LEU C 23 -0.870 1.065 -10.516 1.00 0.00 H new ATOM 2007 N GLY C 24 -5.521 2.908 -9.995 1.00 0.00 N ATOM 2008 CA GLY C 24 -6.751 3.644 -10.223 1.00 0.00 C ATOM 2009 C GLY C 24 -7.762 3.462 -9.098 1.00 0.00 C ATOM 2010 O GLY C 24 -7.440 2.946 -8.030 1.00 0.00 O ATOM 0 H GLY C 24 -5.398 2.584 -9.036 1.00 0.00 H new ATOM 0 HA2 GLY C 24 -6.521 4.704 -10.331 1.00 0.00 H new ATOM 0 HA3 GLY C 24 -7.196 3.317 -11.163 1.00 0.00 H new ATOM 2014 N VAL C 25 -8.997 3.897 -9.355 1.00 0.00 N ATOM 2015 CA VAL C 25 -10.082 3.836 -8.385 1.00 0.00 C ATOM 2016 C VAL C 25 -11.323 3.236 -9.034 1.00 0.00 C ATOM 2017 O VAL C 25 -11.422 3.174 -10.259 1.00 0.00 O ATOM 2018 CB VAL C 25 -10.374 5.233 -7.826 1.00 0.00 C ATOM 2019 CG1 VAL C 25 -9.138 5.810 -7.133 1.00 0.00 C ATOM 2020 CG2 VAL C 25 -10.809 6.193 -8.932 1.00 0.00 C ATOM 0 H VAL C 25 -9.270 4.304 -10.250 1.00 0.00 H new ATOM 0 HA VAL C 25 -9.785 3.197 -7.554 1.00 0.00 H new ATOM 0 HB VAL C 25 -11.184 5.126 -7.104 1.00 0.00 H new ATOM 0 HG11 VAL C 25 -9.369 6.802 -6.744 1.00 0.00 H new ATOM 0 HG12 VAL C 25 -8.844 5.157 -6.311 1.00 0.00 H new ATOM 0 HG13 VAL C 25 -8.320 5.882 -7.849 1.00 0.00 H new ATOM 0 HG21 VAL C 25 -11.009 7.175 -8.504 1.00 0.00 H new ATOM 0 HG22 VAL C 25 -10.016 6.276 -9.675 1.00 0.00 H new ATOM 0 HG23 VAL C 25 -11.713 5.814 -9.408 1.00 0.00 H new ATOM 2030 N SER C 26 -12.269 2.800 -8.198 1.00 0.00 N ATOM 2031 CA SER C 26 -13.493 2.145 -8.638 1.00 0.00 C ATOM 2032 C SER C 26 -14.614 2.481 -7.660 1.00 0.00 C ATOM 2033 O SER C 26 -15.254 1.589 -7.105 1.00 0.00 O ATOM 2034 CB SER C 26 -13.267 0.631 -8.707 1.00 0.00 C ATOM 2035 OG SER C 26 -12.367 0.316 -9.747 1.00 0.00 O ATOM 0 H SER C 26 -12.201 2.896 -7.185 1.00 0.00 H new ATOM 0 HA SER C 26 -13.773 2.497 -9.631 1.00 0.00 H new ATOM 0 HB2 SER C 26 -12.874 0.272 -7.756 1.00 0.00 H new ATOM 0 HB3 SER C 26 -14.217 0.122 -8.872 1.00 0.00 H new ATOM 0 HG SER C 26 -12.230 -0.654 -9.779 1.00 0.00 H new ATOM 2041 N GLY C 27 -14.852 3.779 -7.447 1.00 0.00 N ATOM 2042 CA GLY C 27 -15.861 4.221 -6.500 1.00 0.00 C ATOM 2043 C GLY C 27 -15.343 4.026 -5.080 1.00 0.00 C ATOM 2044 O GLY C 27 -14.225 4.432 -4.762 1.00 0.00 O ATOM 0 H GLY C 27 -14.357 4.535 -7.920 1.00 0.00 H new ATOM 0 HA2 GLY C 27 -16.101 5.271 -6.671 1.00 0.00 H new ATOM 0 HA3 GLY C 27 -16.782 3.656 -6.643 1.00 0.00 H new ATOM 2048 N GLN C 28 -16.155 3.408 -4.218 1.00 0.00 N ATOM 2049 CA GLN C 28 -15.756 3.079 -2.860 1.00 0.00 C ATOM 2050 C GLN C 28 -14.639 2.027 -2.866 1.00 0.00 C ATOM 2051 O GLN C 28 -14.062 1.734 -1.817 1.00 0.00 O ATOM 2052 CB GLN C 28 -16.997 2.600 -2.096 1.00 0.00 C ATOM 2053 CG GLN C 28 -16.682 2.297 -0.628 1.00 0.00 C ATOM 2054 CD GLN C 28 -17.963 2.117 0.181 1.00 0.00 C ATOM 2055 OE1 GLN C 28 -18.239 2.884 1.098 1.00 0.00 O ATOM 2056 NE2 GLN C 28 -18.757 1.103 -0.149 1.00 0.00 N ATOM 0 H GLN C 28 -17.107 3.124 -4.449 1.00 0.00 H new ATOM 0 HA GLN C 28 -15.351 3.958 -2.358 1.00 0.00 H new ATOM 0 HB2 GLN C 28 -17.774 3.363 -2.151 1.00 0.00 H new ATOM 0 HB3 GLN C 28 -17.395 1.705 -2.574 1.00 0.00 H new ATOM 0 HG2 GLN C 28 -16.076 1.393 -0.562 1.00 0.00 H new ATOM 0 HG3 GLN C 28 -16.091 3.109 -0.204 1.00 0.00 H new ATOM 0 HE21 GLN C 28 -18.500 0.483 -0.917 1.00 0.00 H new ATOM 0 HE22 GLN C 28 -19.624 0.945 0.365 1.00 0.00 H new ATOM 2065 N GLN C 29 -14.325 1.460 -4.035 1.00 0.00 N ATOM 2066 CA GLN C 29 -13.234 0.503 -4.161 1.00 0.00 C ATOM 2067 C GLN C 29 -11.999 1.180 -4.753 1.00 0.00 C ATOM 2068 O GLN C 29 -12.072 2.289 -5.283 1.00 0.00 O ATOM 2069 CB GLN C 29 -13.631 -0.675 -5.053 1.00 0.00 C ATOM 2070 CG GLN C 29 -14.954 -1.343 -4.687 1.00 0.00 C ATOM 2071 CD GLN C 29 -15.145 -2.567 -5.572 1.00 0.00 C ATOM 2072 OE1 GLN C 29 -15.729 -2.480 -6.647 1.00 0.00 O ATOM 2073 NE2 GLN C 29 -14.647 -3.716 -5.123 1.00 0.00 N ATOM 0 H GLN C 29 -14.816 1.652 -4.908 1.00 0.00 H new ATOM 0 HA GLN C 29 -13.008 0.130 -3.162 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -13.690 -0.327 -6.084 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -12.840 -1.424 -5.014 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -14.953 -1.633 -3.636 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -15.780 -0.645 -4.824 1.00 0.00 H new ATOM 0 HE21 GLN C 29 -14.168 -3.747 -4.223 1.00 0.00 H new ATOM 0 HE22 GLN C 29 -14.744 -4.566 -5.679 1.00 0.00 H new ATOM 2082 N VAL C 30 -10.858 0.498 -4.654 1.00 0.00 N ATOM 2083 CA VAL C 30 -9.558 1.018 -5.054 1.00 0.00 C ATOM 2084 C VAL C 30 -8.723 -0.109 -5.656 1.00 0.00 C ATOM 2085 O VAL C 30 -8.877 -1.269 -5.274 1.00 0.00 O ATOM 2086 CB VAL C 30 -8.872 1.616 -3.816 1.00 0.00 C ATOM 2087 CG1 VAL C 30 -7.423 2.007 -4.105 1.00 0.00 C ATOM 2088 CG2 VAL C 30 -9.620 2.867 -3.350 1.00 0.00 C ATOM 0 H VAL C 30 -10.815 -0.452 -4.285 1.00 0.00 H new ATOM 0 HA VAL C 30 -9.669 1.796 -5.810 1.00 0.00 H new ATOM 0 HB VAL C 30 -8.886 0.849 -3.042 1.00 0.00 H new ATOM 0 HG11 VAL C 30 -6.973 2.426 -3.205 1.00 0.00 H new ATOM 0 HG12 VAL C 30 -6.863 1.125 -4.414 1.00 0.00 H new ATOM 0 HG13 VAL C 30 -7.399 2.750 -4.902 1.00 0.00 H new ATOM 0 HG21 VAL C 30 -9.124 3.281 -2.472 1.00 0.00 H new ATOM 0 HG22 VAL C 30 -9.623 3.608 -4.149 1.00 0.00 H new ATOM 0 HG23 VAL C 30 -10.647 2.604 -3.096 1.00 0.00 H new ATOM 2098 N ARG C 31 -7.834 0.238 -6.594 1.00 0.00 N ATOM 2099 CA ARG C 31 -6.972 -0.715 -7.284 1.00 0.00 C ATOM 2100 C ARG C 31 -5.522 -0.260 -7.145 1.00 0.00 C ATOM 2101 O ARG C 31 -5.139 0.801 -7.637 1.00 0.00 O ATOM 2102 CB ARG C 31 -7.387 -0.790 -8.757 1.00 0.00 C ATOM 2103 CG ARG C 31 -7.855 -2.192 -9.158 1.00 0.00 C ATOM 2104 CD ARG C 31 -6.697 -3.190 -9.237 1.00 0.00 C ATOM 2105 NE ARG C 31 -7.157 -4.477 -9.764 1.00 0.00 N ATOM 2106 CZ ARG C 31 -7.328 -4.744 -11.064 1.00 0.00 C ATOM 2107 NH1 ARG C 31 -7.005 -3.856 -11.999 1.00 0.00 N ATOM 2108 NH2 ARG C 31 -7.831 -5.916 -11.441 1.00 0.00 N ATOM 0 H ARG C 31 -7.695 1.202 -6.895 1.00 0.00 H new ATOM 0 HA ARG C 31 -7.069 -1.709 -6.847 1.00 0.00 H new ATOM 0 HB2 ARG C 31 -8.188 -0.075 -8.943 1.00 0.00 H new ATOM 0 HB3 ARG C 31 -6.545 -0.497 -9.385 1.00 0.00 H new ATOM 0 HG2 ARG C 31 -8.590 -2.548 -8.436 1.00 0.00 H new ATOM 0 HG3 ARG C 31 -8.356 -2.143 -10.125 1.00 0.00 H new ATOM 0 HD2 ARG C 31 -5.909 -2.791 -9.876 1.00 0.00 H new ATOM 0 HD3 ARG C 31 -6.264 -3.331 -8.247 1.00 0.00 H new ATOM 0 HE ARG C 31 -7.361 -5.220 -9.095 1.00 0.00 H new ATOM 0 HH11 ARG C 31 -6.619 -2.951 -11.731 1.00 0.00 H new ATOM 0 HH12 ARG C 31 -7.143 -4.080 -12.984 1.00 0.00 H new ATOM 0 HH21 ARG C 31 -8.086 -6.611 -10.739 1.00 0.00 H new ATOM 0 HH22 ARG C 31 -7.962 -6.120 -12.432 1.00 0.00 H new ATOM 2122 N ILE C 32 -4.722 -1.075 -6.463 1.00 0.00 N ATOM 2123 CA ILE C 32 -3.350 -0.742 -6.094 1.00 0.00 C ATOM 2124 C ILE C 32 -2.446 -1.947 -6.319 1.00 0.00 C ATOM 2125 O ILE C 32 -2.923 -3.076 -6.421 1.00 0.00 O ATOM 2126 CB ILE C 32 -3.295 -0.315 -4.619 1.00 0.00 C ATOM 2127 CG1 ILE C 32 -4.105 -1.283 -3.743 1.00 0.00 C ATOM 2128 CG2 ILE C 32 -3.794 1.124 -4.476 1.00 0.00 C ATOM 2129 CD1 ILE C 32 -4.029 -0.913 -2.264 1.00 0.00 C ATOM 0 H ILE C 32 -5.014 -2.000 -6.146 1.00 0.00 H new ATOM 0 HA ILE C 32 -3.004 0.083 -6.717 1.00 0.00 H new ATOM 0 HB ILE C 32 -2.262 -0.353 -4.275 1.00 0.00 H new ATOM 0 HG12 ILE C 32 -5.146 -1.279 -4.065 1.00 0.00 H new ATOM 0 HG13 ILE C 32 -3.732 -2.298 -3.883 1.00 0.00 H new ATOM 0 HG21 ILE C 32 -3.753 1.421 -3.428 1.00 0.00 H new ATOM 0 HG22 ILE C 32 -3.163 1.788 -5.067 1.00 0.00 H new ATOM 0 HG23 ILE C 32 -4.822 1.189 -4.831 1.00 0.00 H new ATOM 0 HD11 ILE C 32 -4.615 -1.623 -1.681 1.00 0.00 H new ATOM 0 HD12 ILE C 32 -2.990 -0.943 -1.934 1.00 0.00 H new ATOM 0 HD13 ILE C 32 -4.427 0.091 -2.119 1.00 0.00 H new ATOM 2141 N GLY C 33 -1.137 -1.709 -6.396 1.00 0.00 N ATOM 2142 CA GLY C 33 -0.181 -2.781 -6.587 1.00 0.00 C ATOM 2143 C GLY C 33 1.059 -2.573 -5.735 1.00 0.00 C ATOM 2144 O GLY C 33 1.328 -1.464 -5.271 1.00 0.00 O ATOM 0 H GLY C 33 -0.721 -0.780 -6.328 1.00 0.00 H new ATOM 0 HA2 GLY C 33 -0.644 -3.734 -6.332 1.00 0.00 H new ATOM 0 HA3 GLY C 33 0.102 -2.835 -7.638 1.00 0.00 H new ATOM 2148 N ILE C 34 1.808 -3.660 -5.539 1.00 0.00 N ATOM 2149 CA ILE C 34 3.006 -3.667 -4.721 1.00 0.00 C ATOM 2150 C ILE C 34 4.147 -4.214 -5.565 1.00 0.00 C ATOM 2151 O ILE C 34 3.944 -5.121 -6.372 1.00 0.00 O ATOM 2152 CB ILE C 34 2.796 -4.536 -3.471 1.00 0.00 C ATOM 2153 CG1 ILE C 34 1.735 -3.963 -2.523 1.00 0.00 C ATOM 2154 CG2 ILE C 34 4.111 -4.645 -2.690 1.00 0.00 C ATOM 2155 CD1 ILE C 34 0.312 -4.369 -2.907 1.00 0.00 C ATOM 0 H ILE C 34 1.591 -4.567 -5.952 1.00 0.00 H new ATOM 0 HA ILE C 34 3.239 -2.656 -4.386 1.00 0.00 H new ATOM 0 HB ILE C 34 2.456 -5.510 -3.823 1.00 0.00 H new ATOM 0 HG12 ILE C 34 1.942 -4.301 -1.508 1.00 0.00 H new ATOM 0 HG13 ILE C 34 1.808 -2.875 -2.519 1.00 0.00 H new ATOM 0 HG21 ILE C 34 3.958 -5.262 -1.804 1.00 0.00 H new ATOM 0 HG22 ILE C 34 4.873 -5.100 -3.322 1.00 0.00 H new ATOM 0 HG23 ILE C 34 4.438 -3.650 -2.387 1.00 0.00 H new ATOM 0 HD11 ILE C 34 -0.394 -3.934 -2.200 1.00 0.00 H new ATOM 0 HD12 ILE C 34 0.089 -4.008 -3.911 1.00 0.00 H new ATOM 0 HD13 ILE C 34 0.225 -5.455 -2.884 1.00 0.00 H new ATOM 2167 N ASN C 35 5.346 -3.665 -5.376 1.00 0.00 N ATOM 2168 CA ASN C 35 6.514 -4.028 -6.155 1.00 0.00 C ATOM 2169 C ASN C 35 7.666 -4.340 -5.208 1.00 0.00 C ATOM 2170 O ASN C 35 8.607 -3.560 -5.036 1.00 0.00 O ATOM 2171 CB ASN C 35 6.822 -2.910 -7.146 1.00 0.00 C ATOM 2172 CG ASN C 35 7.653 -3.404 -8.325 1.00 0.00 C ATOM 2173 OD1 ASN C 35 8.569 -4.206 -8.167 1.00 0.00 O ATOM 2174 ND2 ASN C 35 7.334 -2.919 -9.522 1.00 0.00 N ATOM 0 H ASN C 35 5.529 -2.951 -4.671 1.00 0.00 H new ATOM 0 HA ASN C 35 6.338 -4.928 -6.744 1.00 0.00 H new ATOM 0 HB2 ASN C 35 5.888 -2.484 -7.514 1.00 0.00 H new ATOM 0 HB3 ASN C 35 7.358 -2.110 -6.635 1.00 0.00 H new ATOM 0 HD21 ASN C 35 7.857 -3.212 -10.347 1.00 0.00 H new ATOM 0 HD22 ASN C 35 6.566 -2.254 -9.615 1.00 0.00 H new ATOM 2181 N ALA C 36 7.552 -5.515 -4.595 1.00 0.00 N ATOM 2182 CA ALA C 36 8.509 -6.083 -3.661 1.00 0.00 C ATOM 2183 C ALA C 36 8.871 -7.485 -4.141 1.00 0.00 C ATOM 2184 O ALA C 36 8.116 -8.081 -4.907 1.00 0.00 O ATOM 2185 CB ALA C 36 7.854 -6.138 -2.281 1.00 0.00 C ATOM 0 H ALA C 36 6.748 -6.124 -4.747 1.00 0.00 H new ATOM 0 HA ALA C 36 9.416 -5.481 -3.603 1.00 0.00 H new ATOM 0 HB1 ALA C 36 8.555 -6.562 -1.562 1.00 0.00 H new ATOM 0 HB2 ALA C 36 7.578 -5.131 -1.969 1.00 0.00 H new ATOM 0 HB3 ALA C 36 6.961 -6.761 -2.327 1.00 0.00 H new ATOM 2191 N PRO C 37 10.014 -8.023 -3.704 1.00 0.00 N ATOM 2192 CA PRO C 37 10.429 -9.361 -4.072 1.00 0.00 C ATOM 2193 C PRO C 37 9.627 -10.377 -3.265 1.00 0.00 C ATOM 2194 O PRO C 37 9.146 -10.062 -2.175 1.00 0.00 O ATOM 2195 CB PRO C 37 11.911 -9.421 -3.702 1.00 0.00 C ATOM 2196 CG PRO C 37 11.998 -8.481 -2.498 1.00 0.00 C ATOM 2197 CD PRO C 37 10.982 -7.393 -2.831 1.00 0.00 C ATOM 0 HA PRO C 37 10.267 -9.586 -5.126 1.00 0.00 H new ATOM 0 HB2 PRO C 37 12.224 -10.434 -3.448 1.00 0.00 H new ATOM 0 HB3 PRO C 37 12.547 -9.087 -4.522 1.00 0.00 H new ATOM 0 HG2 PRO C 37 11.749 -8.993 -1.569 1.00 0.00 H new ATOM 0 HG3 PRO C 37 13.001 -8.072 -2.378 1.00 0.00 H new ATOM 0 HD2 PRO C 37 10.506 -7.011 -1.928 1.00 0.00 H new ATOM 0 HD3 PRO C 37 11.461 -6.546 -3.322 1.00 0.00 H new ATOM 2205 N LYS C 38 9.473 -11.599 -3.780 1.00 0.00 N ATOM 2206 CA LYS C 38 8.797 -12.655 -3.037 1.00 0.00 C ATOM 2207 C LYS C 38 9.638 -13.105 -1.846 1.00 0.00 C ATOM 2208 O LYS C 38 9.224 -13.979 -1.087 1.00 0.00 O ATOM 2209 CB LYS C 38 8.426 -13.805 -3.973 1.00 0.00 C ATOM 2210 CG LYS C 38 7.298 -13.290 -4.864 1.00 0.00 C ATOM 2211 CD LYS C 38 6.641 -14.401 -5.679 1.00 0.00 C ATOM 2212 CE LYS C 38 7.608 -14.939 -6.731 1.00 0.00 C ATOM 2213 NZ LYS C 38 6.985 -16.016 -7.525 1.00 0.00 N ATOM 0 H LYS C 38 9.806 -11.877 -4.703 1.00 0.00 H new ATOM 0 HA LYS C 38 7.866 -12.266 -2.625 1.00 0.00 H new ATOM 0 HB2 LYS C 38 9.284 -14.111 -4.571 1.00 0.00 H new ATOM 0 HB3 LYS C 38 8.105 -14.679 -3.406 1.00 0.00 H new ATOM 0 HG2 LYS C 38 6.544 -12.804 -4.245 1.00 0.00 H new ATOM 0 HG3 LYS C 38 7.692 -12.532 -5.541 1.00 0.00 H new ATOM 0 HD2 LYS C 38 6.329 -15.209 -5.017 1.00 0.00 H new ATOM 0 HD3 LYS C 38 5.742 -14.021 -6.164 1.00 0.00 H new ATOM 0 HE2 LYS C 38 7.919 -14.129 -7.391 1.00 0.00 H new ATOM 0 HE3 LYS C 38 8.507 -15.316 -6.244 1.00 0.00 H new ATOM 0 HZ1 LYS C 38 7.664 -16.363 -8.232 1.00 0.00 H new ATOM 0 HZ2 LYS C 38 6.711 -16.797 -6.896 1.00 0.00 H new ATOM 0 HZ3 LYS C 38 6.141 -15.648 -8.008 1.00 0.00 H new ATOM 2227 N ASP C 39 10.818 -12.503 -1.682 1.00 0.00 N ATOM 2228 CA ASP C 39 11.659 -12.704 -0.513 1.00 0.00 C ATOM 2229 C ASP C 39 11.007 -12.055 0.714 1.00 0.00 C ATOM 2230 O ASP C 39 11.429 -12.314 1.841 1.00 0.00 O ATOM 2231 CB ASP C 39 13.046 -12.111 -0.764 1.00 0.00 C ATOM 2232 CG ASP C 39 13.788 -12.890 -1.850 1.00 0.00 C ATOM 2233 OD1 ASP C 39 14.302 -13.986 -1.527 1.00 0.00 O ATOM 2234 OD2 ASP C 39 13.840 -12.382 -2.994 1.00 0.00 O ATOM 0 H ASP C 39 11.215 -11.858 -2.366 1.00 0.00 H new ATOM 0 HA ASP C 39 11.768 -13.772 -0.324 1.00 0.00 H new ATOM 0 HB2 ASP C 39 12.950 -11.067 -1.062 1.00 0.00 H new ATOM 0 HB3 ASP C 39 13.625 -12.127 0.160 1.00 0.00 H new ATOM 2239 N VAL C 40 9.986 -11.218 0.503 1.00 0.00 N ATOM 2240 CA VAL C 40 9.179 -10.681 1.589 1.00 0.00 C ATOM 2241 C VAL C 40 7.699 -10.937 1.314 1.00 0.00 C ATOM 2242 O VAL C 40 7.244 -10.900 0.169 1.00 0.00 O ATOM 2243 CB VAL C 40 9.457 -9.190 1.801 1.00 0.00 C ATOM 2244 CG1 VAL C 40 10.950 -8.950 2.025 1.00 0.00 C ATOM 2245 CG2 VAL C 40 8.989 -8.341 0.618 1.00 0.00 C ATOM 0 H VAL C 40 9.701 -10.899 -0.423 1.00 0.00 H new ATOM 0 HA VAL C 40 9.452 -11.193 2.512 1.00 0.00 H new ATOM 0 HB VAL C 40 8.893 -8.888 2.684 1.00 0.00 H new ATOM 0 HG11 VAL C 40 11.129 -7.885 2.174 1.00 0.00 H new ATOM 0 HG12 VAL C 40 11.279 -9.500 2.907 1.00 0.00 H new ATOM 0 HG13 VAL C 40 11.508 -9.294 1.154 1.00 0.00 H new ATOM 0 HG21 VAL C 40 9.207 -7.291 0.815 1.00 0.00 H new ATOM 0 HG22 VAL C 40 9.510 -8.657 -0.286 1.00 0.00 H new ATOM 0 HG23 VAL C 40 7.915 -8.469 0.481 1.00 0.00 H new ATOM 2255 N ALA C 41 6.949 -11.203 2.381 1.00 0.00 N ATOM 2256 CA ALA C 41 5.539 -11.534 2.286 1.00 0.00 C ATOM 2257 C ALA C 41 4.720 -10.312 1.878 1.00 0.00 C ATOM 2258 O ALA C 41 5.021 -9.192 2.289 1.00 0.00 O ATOM 2259 CB ALA C 41 5.072 -12.059 3.642 1.00 0.00 C ATOM 0 H ALA C 41 7.308 -11.194 3.336 1.00 0.00 H new ATOM 0 HA ALA C 41 5.395 -12.297 1.521 1.00 0.00 H new ATOM 0 HB1 ALA C 41 4.013 -12.313 3.589 1.00 0.00 H new ATOM 0 HB2 ALA C 41 5.646 -12.948 3.905 1.00 0.00 H new ATOM 0 HB3 ALA C 41 5.223 -11.292 4.401 1.00 0.00 H new ATOM 2265 N VAL C 42 3.680 -10.531 1.066 1.00 0.00 N ATOM 2266 CA VAL C 42 2.748 -9.488 0.658 1.00 0.00 C ATOM 2267 C VAL C 42 1.382 -10.135 0.454 1.00 0.00 C ATOM 2268 O VAL C 42 1.240 -10.987 -0.424 1.00 0.00 O ATOM 2269 CB VAL C 42 3.212 -8.830 -0.645 1.00 0.00 C ATOM 2270 CG1 VAL C 42 2.241 -7.729 -1.056 1.00 0.00 C ATOM 2271 CG2 VAL C 42 4.594 -8.190 -0.519 1.00 0.00 C ATOM 0 H VAL C 42 3.464 -11.447 0.673 1.00 0.00 H new ATOM 0 HA VAL C 42 2.697 -8.715 1.425 1.00 0.00 H new ATOM 0 HB VAL C 42 3.252 -9.627 -1.388 1.00 0.00 H new ATOM 0 HG11 VAL C 42 2.583 -7.270 -1.984 1.00 0.00 H new ATOM 0 HG12 VAL C 42 1.249 -8.156 -1.206 1.00 0.00 H new ATOM 0 HG13 VAL C 42 2.195 -6.973 -0.272 1.00 0.00 H new ATOM 0 HG21 VAL C 42 4.874 -7.738 -1.471 1.00 0.00 H new ATOM 0 HG22 VAL C 42 4.570 -7.422 0.254 1.00 0.00 H new ATOM 0 HG23 VAL C 42 5.325 -8.953 -0.250 1.00 0.00 H new ATOM 2281 N HIS C 43 0.394 -9.731 1.260 1.00 0.00 N ATOM 2282 CA HIS C 43 -0.960 -10.273 1.230 1.00 0.00 C ATOM 2283 C HIS C 43 -1.971 -9.189 1.602 1.00 0.00 C ATOM 2284 O HIS C 43 -1.590 -8.043 1.829 1.00 0.00 O ATOM 2285 CB HIS C 43 -1.096 -11.447 2.220 1.00 0.00 C ATOM 2286 CG HIS C 43 -0.010 -12.489 2.140 1.00 0.00 C ATOM 2287 ND1 HIS C 43 -0.134 -13.736 1.522 1.00 0.00 N ATOM 2288 CD2 HIS C 43 1.245 -12.371 2.665 1.00 0.00 C ATOM 2289 CE1 HIS C 43 1.053 -14.338 1.688 1.00 0.00 C ATOM 2290 NE2 HIS C 43 1.900 -13.544 2.367 1.00 0.00 N ATOM 0 H HIS C 43 0.520 -9.004 1.964 1.00 0.00 H new ATOM 0 HA HIS C 43 -1.159 -10.629 0.219 1.00 0.00 H new ATOM 0 HB2 HIS C 43 -1.117 -11.045 3.233 1.00 0.00 H new ATOM 0 HB3 HIS C 43 -2.056 -11.934 2.050 1.00 0.00 H new ATOM 0 HD1 HIS C 43 -0.954 -14.110 1.045 1.00 0.00 H new ATOM 0 HD2 HIS C 43 1.644 -11.526 3.206 1.00 0.00 H new ATOM 0 HE1 HIS C 43 1.296 -15.326 1.326 1.00 0.00 H new ATOM 2298 N ARG C 44 -3.261 -9.545 1.671 1.00 0.00 N ATOM 2299 CA ARG C 44 -4.297 -8.605 2.078 1.00 0.00 C ATOM 2300 C ARG C 44 -4.848 -8.966 3.456 1.00 0.00 C ATOM 2301 O ARG C 44 -4.785 -10.121 3.871 1.00 0.00 O ATOM 2302 CB ARG C 44 -5.372 -8.458 0.989 1.00 0.00 C ATOM 2303 CG ARG C 44 -5.955 -9.731 0.371 1.00 0.00 C ATOM 2304 CD ARG C 44 -6.521 -10.688 1.412 1.00 0.00 C ATOM 2305 NE ARG C 44 -7.650 -11.472 0.885 1.00 0.00 N ATOM 2306 CZ ARG C 44 -7.572 -12.536 0.080 1.00 0.00 C ATOM 2307 NH1 ARG C 44 -6.408 -12.967 -0.392 1.00 0.00 N ATOM 2308 NH2 ARG C 44 -8.681 -13.179 -0.263 1.00 0.00 N ATOM 0 H ARG C 44 -3.605 -10.479 1.449 1.00 0.00 H new ATOM 0 HA ARG C 44 -3.857 -7.614 2.186 1.00 0.00 H new ATOM 0 HB2 ARG C 44 -6.197 -7.885 1.411 1.00 0.00 H new ATOM 0 HB3 ARG C 44 -4.949 -7.860 0.182 1.00 0.00 H new ATOM 0 HG2 ARG C 44 -6.742 -9.460 -0.333 1.00 0.00 H new ATOM 0 HG3 ARG C 44 -5.179 -10.240 -0.200 1.00 0.00 H new ATOM 0 HD2 ARG C 44 -5.735 -11.365 1.747 1.00 0.00 H new ATOM 0 HD3 ARG C 44 -6.848 -10.122 2.284 1.00 0.00 H new ATOM 0 HE ARG C 44 -8.585 -11.173 1.162 1.00 0.00 H new ATOM 0 HH11 ARG C 44 -5.546 -12.483 -0.142 1.00 0.00 H new ATOM 0 HH12 ARG C 44 -6.376 -13.782 -1.005 1.00 0.00 H new ATOM 0 HH21 ARG C 44 -9.584 -12.860 0.087 1.00 0.00 H new ATOM 0 HH22 ARG C 44 -8.630 -13.992 -0.877 1.00 0.00 H new ATOM 2322 N GLU C 45 -5.393 -7.973 4.171 1.00 0.00 N ATOM 2323 CA GLU C 45 -5.772 -8.120 5.575 1.00 0.00 C ATOM 2324 C GLU C 45 -6.827 -9.196 5.821 1.00 0.00 C ATOM 2325 O GLU C 45 -6.919 -9.724 6.927 1.00 0.00 O ATOM 2326 CB GLU C 45 -6.216 -6.763 6.132 1.00 0.00 C ATOM 2327 CG GLU C 45 -7.541 -6.261 5.545 1.00 0.00 C ATOM 2328 CD GLU C 45 -8.771 -6.919 6.168 1.00 0.00 C ATOM 2329 OE1 GLU C 45 -8.810 -7.028 7.415 1.00 0.00 O ATOM 2330 OE2 GLU C 45 -9.674 -7.310 5.391 1.00 0.00 O ATOM 0 H GLU C 45 -5.582 -7.046 3.789 1.00 0.00 H new ATOM 0 HA GLU C 45 -4.887 -8.465 6.110 1.00 0.00 H new ATOM 0 HB2 GLU C 45 -6.314 -6.839 7.215 1.00 0.00 H new ATOM 0 HB3 GLU C 45 -5.438 -6.026 5.933 1.00 0.00 H new ATOM 0 HG2 GLU C 45 -7.606 -5.182 5.685 1.00 0.00 H new ATOM 0 HG3 GLU C 45 -7.546 -6.444 4.470 1.00 0.00 H new ATOM 2337 N GLU C 46 -7.625 -9.528 4.805 1.00 0.00 N ATOM 2338 CA GLU C 46 -8.653 -10.552 4.912 1.00 0.00 C ATOM 2339 C GLU C 46 -8.026 -11.938 5.090 1.00 0.00 C ATOM 2340 O GLU C 46 -8.721 -12.891 5.446 1.00 0.00 O ATOM 2341 CB GLU C 46 -9.522 -10.477 3.649 1.00 0.00 C ATOM 2342 CG GLU C 46 -10.607 -11.548 3.565 1.00 0.00 C ATOM 2343 CD GLU C 46 -11.338 -11.448 2.229 1.00 0.00 C ATOM 2344 OE1 GLU C 46 -10.681 -11.717 1.198 1.00 0.00 O ATOM 2345 OE2 GLU C 46 -12.540 -11.103 2.248 1.00 0.00 O ATOM 0 H GLU C 46 -7.573 -9.091 3.885 1.00 0.00 H new ATOM 0 HA GLU C 46 -9.273 -10.380 5.792 1.00 0.00 H new ATOM 0 HB2 GLU C 46 -9.994 -9.495 3.605 1.00 0.00 H new ATOM 0 HB3 GLU C 46 -8.878 -10.561 2.774 1.00 0.00 H new ATOM 0 HG2 GLU C 46 -10.162 -12.537 3.672 1.00 0.00 H new ATOM 0 HG3 GLU C 46 -11.314 -11.426 4.386 1.00 0.00 H new ATOM 2352 N ILE C 47 -6.716 -12.058 4.846 1.00 0.00 N ATOM 2353 CA ILE C 47 -6.021 -13.333 4.914 1.00 0.00 C ATOM 2354 C ILE C 47 -4.697 -13.227 5.661 1.00 0.00 C ATOM 2355 O ILE C 47 -4.226 -14.229 6.194 1.00 0.00 O ATOM 2356 CB ILE C 47 -5.827 -13.854 3.481 1.00 0.00 C ATOM 2357 CG1 ILE C 47 -6.993 -14.785 3.130 1.00 0.00 C ATOM 2358 CG2 ILE C 47 -4.470 -14.532 3.280 1.00 0.00 C ATOM 2359 CD1 ILE C 47 -6.708 -15.578 1.857 1.00 0.00 C ATOM 0 H ILE C 47 -6.116 -11.272 4.597 1.00 0.00 H new ATOM 0 HA ILE C 47 -6.623 -14.041 5.484 1.00 0.00 H new ATOM 0 HB ILE C 47 -5.827 -13.004 2.798 1.00 0.00 H new ATOM 0 HG12 ILE C 47 -7.173 -15.473 3.956 1.00 0.00 H new ATOM 0 HG13 ILE C 47 -7.902 -14.199 2.999 1.00 0.00 H new ATOM 0 HG21 ILE C 47 -4.386 -14.881 2.251 1.00 0.00 H new ATOM 0 HG22 ILE C 47 -3.673 -13.818 3.487 1.00 0.00 H new ATOM 0 HG23 ILE C 47 -4.383 -15.380 3.959 1.00 0.00 H new ATOM 0 HD11 ILE C 47 -7.554 -16.228 1.636 1.00 0.00 H new ATOM 0 HD12 ILE C 47 -6.553 -14.889 1.026 1.00 0.00 H new ATOM 0 HD13 ILE C 47 -5.813 -16.183 1.998 1.00 0.00 H new ATOM 2371 N TYR C 48 -4.075 -12.049 5.725 1.00 0.00 N ATOM 2372 CA TYR C 48 -2.780 -11.959 6.371 1.00 0.00 C ATOM 2373 C TYR C 48 -2.895 -12.340 7.846 1.00 0.00 C ATOM 2374 O TYR C 48 -1.963 -12.890 8.432 1.00 0.00 O ATOM 2375 CB TYR C 48 -2.221 -10.549 6.231 1.00 0.00 C ATOM 2376 CG TYR C 48 -0.878 -10.436 6.902 1.00 0.00 C ATOM 2377 CD1 TYR C 48 0.291 -10.731 6.187 1.00 0.00 C ATOM 2378 CD2 TYR C 48 -0.808 -10.049 8.245 1.00 0.00 C ATOM 2379 CE1 TYR C 48 1.537 -10.647 6.820 1.00 0.00 C ATOM 2380 CE2 TYR C 48 0.433 -9.968 8.887 1.00 0.00 C ATOM 2381 CZ TYR C 48 1.615 -10.251 8.171 1.00 0.00 C ATOM 2382 OH TYR C 48 2.827 -10.145 8.782 1.00 0.00 O ATOM 0 H TYR C 48 -4.438 -11.174 5.348 1.00 0.00 H new ATOM 0 HA TYR C 48 -2.097 -12.656 5.885 1.00 0.00 H new ATOM 0 HB2 TYR C 48 -2.128 -10.293 5.176 1.00 0.00 H new ATOM 0 HB3 TYR C 48 -2.914 -9.833 6.672 1.00 0.00 H new ATOM 0 HD1 TYR C 48 0.231 -11.023 5.149 1.00 0.00 H new ATOM 0 HD2 TYR C 48 -1.712 -9.813 8.786 1.00 0.00 H new ATOM 0 HE1 TYR C 48 2.438 -10.885 6.274 1.00 0.00 H new ATOM 0 HE2 TYR C 48 0.486 -9.689 9.929 1.00 0.00 H new ATOM 0 HH TYR C 48 3.510 -9.918 8.117 1.00 0.00 H new ATOM 2392 N GLN C 49 -4.048 -12.043 8.443 1.00 0.00 N ATOM 2393 CA GLN C 49 -4.293 -12.310 9.849 1.00 0.00 C ATOM 2394 C GLN C 49 -4.527 -13.800 10.087 1.00 0.00 C ATOM 2395 O GLN C 49 -4.552 -14.248 11.233 1.00 0.00 O ATOM 2396 CB GLN C 49 -5.497 -11.480 10.297 1.00 0.00 C ATOM 2397 CG GLN C 49 -5.223 -10.008 9.989 1.00 0.00 C ATOM 2398 CD GLN C 49 -6.363 -9.114 10.456 1.00 0.00 C ATOM 2399 OE1 GLN C 49 -6.516 -8.848 11.644 1.00 0.00 O ATOM 2400 NE2 GLN C 49 -7.174 -8.639 9.514 1.00 0.00 N ATOM 0 H GLN C 49 -4.836 -11.610 7.961 1.00 0.00 H new ATOM 0 HA GLN C 49 -3.420 -12.028 10.437 1.00 0.00 H new ATOM 0 HB2 GLN C 49 -6.398 -11.812 9.781 1.00 0.00 H new ATOM 0 HB3 GLN C 49 -5.673 -11.616 11.364 1.00 0.00 H new ATOM 0 HG2 GLN C 49 -4.297 -9.701 10.475 1.00 0.00 H new ATOM 0 HG3 GLN C 49 -5.077 -9.882 8.916 1.00 0.00 H new ATOM 0 HE21 GLN C 49 -7.016 -8.881 8.536 1.00 0.00 H new ATOM 0 HE22 GLN C 49 -7.953 -8.033 9.770 1.00 0.00 H new ATOM 2409 N ARG C 50 -4.703 -14.571 9.002 1.00 0.00 N ATOM 2410 CA ARG C 50 -4.851 -16.019 9.087 1.00 0.00 C ATOM 2411 C ARG C 50 -3.495 -16.694 8.910 1.00 0.00 C ATOM 2412 O ARG C 50 -3.262 -17.757 9.477 1.00 0.00 O ATOM 2413 CB ARG C 50 -5.891 -16.495 8.060 1.00 0.00 C ATOM 2414 CG ARG C 50 -5.290 -17.152 6.815 1.00 0.00 C ATOM 2415 CD ARG C 50 -6.408 -17.458 5.824 1.00 0.00 C ATOM 2416 NE ARG C 50 -7.289 -18.529 6.313 1.00 0.00 N ATOM 2417 CZ ARG C 50 -8.379 -18.950 5.672 1.00 0.00 C ATOM 2418 NH1 ARG C 50 -8.743 -18.405 4.516 1.00 0.00 N ATOM 2419 NH2 ARG C 50 -9.115 -19.928 6.190 1.00 0.00 N ATOM 0 H ARG C 50 -4.745 -14.204 8.051 1.00 0.00 H new ATOM 0 HA ARG C 50 -5.219 -16.301 10.074 1.00 0.00 H new ATOM 0 HB2 ARG C 50 -6.563 -17.205 8.543 1.00 0.00 H new ATOM 0 HB3 ARG C 50 -6.496 -15.643 7.751 1.00 0.00 H new ATOM 0 HG2 ARG C 50 -4.554 -16.490 6.359 1.00 0.00 H new ATOM 0 HG3 ARG C 50 -4.768 -18.069 7.088 1.00 0.00 H new ATOM 0 HD2 ARG C 50 -6.995 -16.556 5.647 1.00 0.00 H new ATOM 0 HD3 ARG C 50 -5.976 -17.750 4.867 1.00 0.00 H new ATOM 0 HE ARG C 50 -7.051 -18.978 7.198 1.00 0.00 H new ATOM 0 HH11 ARG C 50 -8.186 -17.654 4.108 1.00 0.00 H new ATOM 0 HH12 ARG C 50 -9.580 -18.737 4.037 1.00 0.00 H new ATOM 0 HH21 ARG C 50 -8.845 -20.355 7.076 1.00 0.00 H new ATOM 0 HH22 ARG C 50 -9.950 -20.252 5.701 1.00 0.00 H new ATOM 2433 N ILE C 51 -2.605 -16.082 8.123 1.00 0.00 N ATOM 2434 CA ILE C 51 -1.248 -16.579 7.923 1.00 0.00 C ATOM 2435 C ILE C 51 -0.474 -16.434 9.227 1.00 0.00 C ATOM 2436 O ILE C 51 0.177 -17.368 9.685 1.00 0.00 O ATOM 2437 CB ILE C 51 -0.577 -15.767 6.810 1.00 0.00 C ATOM 2438 CG1 ILE C 51 -1.299 -15.978 5.481 1.00 0.00 C ATOM 2439 CG2 ILE C 51 0.897 -16.151 6.652 1.00 0.00 C ATOM 2440 CD1 ILE C 51 -0.814 -14.972 4.444 1.00 0.00 C ATOM 0 H ILE C 51 -2.810 -15.226 7.607 1.00 0.00 H new ATOM 0 HA ILE C 51 -1.265 -17.630 7.633 1.00 0.00 H new ATOM 0 HB ILE C 51 -0.636 -14.716 7.093 1.00 0.00 H new ATOM 0 HG12 ILE C 51 -1.124 -16.992 5.122 1.00 0.00 H new ATOM 0 HG13 ILE C 51 -2.374 -15.872 5.624 1.00 0.00 H new ATOM 0 HG21 ILE C 51 1.344 -15.557 5.855 1.00 0.00 H new ATOM 0 HG22 ILE C 51 1.425 -15.960 7.586 1.00 0.00 H new ATOM 0 HG23 ILE C 51 0.973 -17.209 6.402 1.00 0.00 H new ATOM 0 HD11 ILE C 51 -1.339 -15.137 3.503 1.00 0.00 H new ATOM 0 HD12 ILE C 51 -1.013 -13.960 4.798 1.00 0.00 H new ATOM 0 HD13 ILE C 51 0.257 -15.098 4.288 1.00 0.00 H new ATOM 2452 N GLN C 52 -0.545 -15.247 9.825 1.00 0.00 N ATOM 2453 CA GLN C 52 0.192 -14.939 11.038 1.00 0.00 C ATOM 2454 C GLN C 52 -0.452 -15.580 12.264 1.00 0.00 C ATOM 2455 O GLN C 52 -0.013 -15.341 13.388 1.00 0.00 O ATOM 2456 CB GLN C 52 0.336 -13.421 11.167 1.00 0.00 C ATOM 2457 CG GLN C 52 1.180 -12.889 10.008 1.00 0.00 C ATOM 2458 CD GLN C 52 2.480 -13.667 9.842 1.00 0.00 C ATOM 2459 OE1 GLN C 52 3.376 -13.595 10.680 1.00 0.00 O ATOM 2460 NE2 GLN C 52 2.585 -14.420 8.751 1.00 0.00 N ATOM 0 H GLN C 52 -1.116 -14.476 9.479 1.00 0.00 H new ATOM 0 HA GLN C 52 1.191 -15.370 10.975 1.00 0.00 H new ATOM 0 HB2 GLN C 52 -0.647 -12.950 11.161 1.00 0.00 H new ATOM 0 HB3 GLN C 52 0.805 -13.169 12.118 1.00 0.00 H new ATOM 0 HG2 GLN C 52 0.604 -12.945 9.085 1.00 0.00 H new ATOM 0 HG3 GLN C 52 1.407 -11.837 10.178 1.00 0.00 H new ATOM 0 HE21 GLN C 52 1.819 -14.453 8.079 1.00 0.00 H new ATOM 0 HE22 GLN C 52 3.432 -14.964 8.587 1.00 0.00 H new ATOM 2469 N ALA C 53 -1.489 -16.398 12.061 1.00 0.00 N ATOM 2470 CA ALA C 53 -2.115 -17.122 13.148 1.00 0.00 C ATOM 2471 C ALA C 53 -1.213 -18.262 13.638 1.00 0.00 C ATOM 2472 O ALA C 53 -1.427 -18.778 14.736 1.00 0.00 O ATOM 2473 CB ALA C 53 -3.463 -17.675 12.689 1.00 0.00 C ATOM 0 H ALA C 53 -1.907 -16.569 11.146 1.00 0.00 H new ATOM 0 HA ALA C 53 -2.272 -16.434 13.979 1.00 0.00 H new ATOM 0 HB1 ALA C 53 -3.931 -18.219 13.509 1.00 0.00 H new ATOM 0 HB2 ALA C 53 -4.109 -16.852 12.384 1.00 0.00 H new ATOM 0 HB3 ALA C 53 -3.312 -18.349 11.846 1.00 0.00 H new ATOM 2479 N GLY C 54 -0.211 -18.654 12.837 1.00 0.00 N ATOM 2480 CA GLY C 54 0.721 -19.710 13.207 1.00 0.00 C ATOM 2481 C GLY C 54 0.887 -20.745 12.096 1.00 0.00 C ATOM 2482 O GLY C 54 1.361 -21.848 12.354 1.00 0.00 O ATOM 0 H GLY C 54 -0.031 -18.245 11.920 1.00 0.00 H new ATOM 0 HA2 GLY C 54 1.691 -19.271 13.441 1.00 0.00 H new ATOM 0 HA3 GLY C 54 0.368 -20.204 14.112 1.00 0.00 H new ATOM 2486 N LEU C 55 0.502 -20.392 10.868 1.00 0.00 N ATOM 2487 CA LEU C 55 0.476 -21.310 9.738 1.00 0.00 C ATOM 2488 C LEU C 55 0.949 -20.623 8.458 1.00 0.00 C ATOM 2489 O LEU C 55 1.419 -19.487 8.487 1.00 0.00 O ATOM 2490 CB LEU C 55 -0.949 -21.860 9.607 1.00 0.00 C ATOM 2491 CG LEU C 55 -2.008 -20.762 9.422 1.00 0.00 C ATOM 2492 CD1 LEU C 55 -2.056 -20.222 7.990 1.00 0.00 C ATOM 2493 CD2 LEU C 55 -3.374 -21.355 9.751 1.00 0.00 C ATOM 0 H LEU C 55 0.197 -19.448 10.632 1.00 0.00 H new ATOM 0 HA LEU C 55 1.166 -22.137 9.907 1.00 0.00 H new ATOM 0 HB2 LEU C 55 -0.991 -22.543 8.758 1.00 0.00 H new ATOM 0 HB3 LEU C 55 -1.190 -22.442 10.497 1.00 0.00 H new ATOM 0 HG LEU C 55 -1.746 -19.935 10.082 1.00 0.00 H new ATOM 0 HD11 LEU C 55 -2.822 -19.449 7.918 1.00 0.00 H new ATOM 0 HD12 LEU C 55 -1.087 -19.798 7.728 1.00 0.00 H new ATOM 0 HD13 LEU C 55 -2.294 -21.034 7.303 1.00 0.00 H new ATOM 0 HD21 LEU C 55 -4.142 -20.591 9.626 1.00 0.00 H new ATOM 0 HD22 LEU C 55 -3.580 -22.189 9.080 1.00 0.00 H new ATOM 0 HD23 LEU C 55 -3.378 -21.709 10.782 1.00 0.00 H new ATOM 2505 N THR C 56 0.824 -21.321 7.329 1.00 0.00 N ATOM 2506 CA THR C 56 1.187 -20.793 6.020 1.00 0.00 C ATOM 2507 C THR C 56 0.174 -21.261 4.977 1.00 0.00 C ATOM 2508 O THR C 56 -0.720 -22.049 5.286 1.00 0.00 O ATOM 2509 CB THR C 56 2.606 -21.237 5.646 1.00 0.00 C ATOM 2510 OG1 THR C 56 2.694 -22.647 5.642 1.00 0.00 O ATOM 2511 CG2 THR C 56 3.620 -20.682 6.648 1.00 0.00 C ATOM 0 H THR C 56 0.465 -22.275 7.300 1.00 0.00 H new ATOM 0 HA THR C 56 1.172 -19.704 6.053 1.00 0.00 H new ATOM 0 HB THR C 56 2.829 -20.853 4.650 1.00 0.00 H new ATOM 0 HG1 THR C 56 3.604 -22.917 5.400 1.00 0.00 H new ATOM 0 HG21 THR C 56 4.622 -21.006 6.369 1.00 0.00 H new ATOM 0 HG22 THR C 56 3.577 -19.593 6.644 1.00 0.00 H new ATOM 0 HG23 THR C 56 3.384 -21.051 7.646 1.00 0.00 H new ATOM 2519 N ALA C 57 0.303 -20.782 3.737 1.00 0.00 N ATOM 2520 CA ALA C 57 -0.633 -21.115 2.674 1.00 0.00 C ATOM 2521 C ALA C 57 -0.791 -22.635 2.532 1.00 0.00 C ATOM 2522 O ALA C 57 0.190 -23.370 2.674 1.00 0.00 O ATOM 2523 CB ALA C 57 -0.143 -20.497 1.366 1.00 0.00 C ATOM 0 H ALA C 57 1.056 -20.157 3.449 1.00 0.00 H new ATOM 0 HA ALA C 57 -1.613 -20.709 2.923 1.00 0.00 H new ATOM 0 HB1 ALA C 57 -0.840 -20.742 0.564 1.00 0.00 H new ATOM 0 HB2 ALA C 57 -0.082 -19.414 1.475 1.00 0.00 H new ATOM 0 HB3 ALA C 57 0.843 -20.893 1.124 1.00 0.00 H new