USER MOD reduce.3.24.130724 H: found=0, std=0, add=980, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 976 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 23 HIS : no HD1:sc= 1.28 K(o=3.8,f=-9.2!) USER MOD Set 1.2: A 35 HIS : no HD1:sc= 2.12 K(o=3.8,f=-7.7!) USER MOD Set 1.3: A 113 CYS SG : rot 178:sc= 0.423 USER MOD Set 2.1: A 109 THR OG1 : rot 180:sc= 0.415 USER MOD Set 2.2: A 112 ASN : amide:sc= 0.839 K(o=1.3,f=-0.54!) USER MOD Set 3.1: A 40 SER OG : rot -172:sc= 1.15 USER MOD Set 3.2: A 55 THR OG1 : rot 75:sc= 2.11 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ -148:sc= 0.821 (180deg=0.127) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot -15:sc= 1.13 USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0.0586 USER MOD Single : A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 180:sc= 0.0398 USER MOD Single : A 57 LYS NZ :NH3+ -159:sc= 2.01 (180deg=1.51) USER MOD Single : A 61 LYS NZ :NH3+ -156:sc= 2.37 (180deg=2.11) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 72:sc= 2 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 ASN : amide:sc= 0.997 K(o=1,f=-2.1!) USER MOD Single : A 78 ASN : amide:sc= 1.8 K(o=1.8,f=-7.1!) USER MOD Single : A 79 LYS NZ :NH3+ -172:sc= 1.3 (180deg=1.18) USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 83 LYS NZ :NH3+ 160:sc= 1.23 (180deg=1.19) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 130:sc= 0.371 USER MOD Single : A 89 CYS SG : rot 180:sc= 0.0383 USER MOD Single : A 90 SER OG : rot 180:sc= 0.0115 USER MOD Single : A 91 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00529) USER MOD Single : A 94 GLN : amide:sc= 0.107 K(o=0.11,f=-1.1) USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ -174:sc= 0.46 (180deg=0.407) USER MOD Single : A 110 SER OG : rot -67:sc= 1.28 USER MOD Single : A 115 HIS : no HD1:sc= -0.0145 X(o=-0.015,f=0) USER MOD Single : A 118 ASN : amide:sc= 1.01 K(o=1,f=-1.4!) USER MOD Single : A 122 TYR OH : rot 6:sc= 0.0632 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 22.230 -4.654 2.891 1.00 0.00 N ATOM 2 CA MET A 1 20.933 -4.588 3.613 1.00 0.00 C ATOM 3 C MET A 1 19.792 -5.110 2.730 1.00 0.00 C ATOM 4 O MET A 1 19.351 -6.242 2.933 1.00 0.00 O ATOM 5 CB MET A 1 20.663 -3.186 4.209 1.00 0.00 C ATOM 6 CG MET A 1 19.364 -3.124 5.029 1.00 0.00 C ATOM 7 SD MET A 1 19.212 -4.339 6.374 1.00 0.00 S ATOM 8 CE MET A 1 20.389 -3.659 7.576 1.00 0.00 C ATOM 0 H1 MET A 1 22.988 -4.296 3.506 1.00 0.00 H new ATOM 0 H2 MET A 1 22.432 -5.640 2.630 1.00 0.00 H new ATOM 0 H3 MET A 1 22.178 -4.072 2.031 1.00 0.00 H new ATOM 0 HA MET A 1 20.991 -5.253 4.475 1.00 0.00 H new ATOM 0 HB2 MET A 1 21.501 -2.899 4.844 1.00 0.00 H new ATOM 0 HB3 MET A 1 20.611 -2.457 3.400 1.00 0.00 H new ATOM 0 HG2 MET A 1 19.275 -2.125 5.456 1.00 0.00 H new ATOM 0 HG3 MET A 1 18.522 -3.256 4.350 1.00 0.00 H new ATOM 0 HE1 MET A 1 20.412 -4.294 8.462 1.00 0.00 H new ATOM 0 HE2 MET A 1 21.383 -3.622 7.131 1.00 0.00 H new ATOM 0 HE3 MET A 1 20.080 -2.653 7.859 1.00 0.00 H new ATOM 20 N ARG A 2 19.299 -4.314 1.764 1.00 0.00 N ATOM 21 CA ARG A 2 18.185 -4.588 0.836 1.00 0.00 C ATOM 22 C ARG A 2 16.807 -4.757 1.494 1.00 0.00 C ATOM 23 O ARG A 2 15.826 -4.268 0.933 1.00 0.00 O ATOM 24 CB ARG A 2 18.538 -5.755 -0.112 1.00 0.00 C ATOM 25 CG ARG A 2 17.475 -5.962 -1.202 1.00 0.00 C ATOM 26 CD ARG A 2 17.887 -7.036 -2.215 1.00 0.00 C ATOM 27 NE ARG A 2 16.790 -7.297 -3.162 1.00 0.00 N ATOM 28 CZ ARG A 2 16.464 -6.555 -4.228 1.00 0.00 C ATOM 29 NH1 ARG A 2 17.219 -5.532 -4.621 1.00 0.00 N ATOM 30 NH2 ARG A 2 15.355 -6.853 -4.887 1.00 0.00 N ATOM 0 H ARG A 2 19.700 -3.391 1.599 1.00 0.00 H new ATOM 0 HA ARG A 2 18.069 -3.680 0.244 1.00 0.00 H new ATOM 0 HB2 ARG A 2 19.503 -5.561 -0.581 1.00 0.00 H new ATOM 0 HB3 ARG A 2 18.644 -6.672 0.468 1.00 0.00 H new ATOM 0 HG2 ARG A 2 16.531 -6.246 -0.737 1.00 0.00 H new ATOM 0 HG3 ARG A 2 17.303 -5.020 -1.723 1.00 0.00 H new ATOM 0 HD2 ARG A 2 18.775 -6.711 -2.758 1.00 0.00 H new ATOM 0 HD3 ARG A 2 18.151 -7.955 -1.692 1.00 0.00 H new ATOM 0 HE ARG A 2 16.222 -8.126 -2.989 1.00 0.00 H new ATOM 0 HH11 ARG A 2 18.068 -5.298 -4.107 1.00 0.00 H new ATOM 0 HH12 ARG A 2 16.949 -4.982 -5.437 1.00 0.00 H new ATOM 0 HH21 ARG A 2 14.772 -7.632 -4.579 1.00 0.00 H new ATOM 0 HH22 ARG A 2 15.083 -6.304 -5.703 1.00 0.00 H new ATOM 44 N ALA A 3 16.709 -5.397 2.658 1.00 0.00 N ATOM 45 CA ALA A 3 15.453 -5.735 3.316 1.00 0.00 C ATOM 46 C ALA A 3 15.527 -5.339 4.800 1.00 0.00 C ATOM 47 O ALA A 3 15.661 -6.210 5.660 1.00 0.00 O ATOM 48 CB ALA A 3 15.157 -7.226 3.096 1.00 0.00 C ATOM 0 H ALA A 3 17.528 -5.703 3.183 1.00 0.00 H new ATOM 0 HA ALA A 3 14.621 -5.177 2.886 1.00 0.00 H new ATOM 0 HB1 ALA A 3 14.219 -7.487 3.585 1.00 0.00 H new ATOM 0 HB2 ALA A 3 15.077 -7.427 2.028 1.00 0.00 H new ATOM 0 HB3 ALA A 3 15.965 -7.824 3.519 1.00 0.00 H new ATOM 54 N PRO A 4 15.482 -4.030 5.123 1.00 0.00 N ATOM 55 CA PRO A 4 15.580 -3.543 6.500 1.00 0.00 C ATOM 56 C PRO A 4 14.348 -3.860 7.363 1.00 0.00 C ATOM 57 O PRO A 4 14.410 -3.703 8.584 1.00 0.00 O ATOM 58 CB PRO A 4 15.791 -2.032 6.384 1.00 0.00 C ATOM 59 CG PRO A 4 15.174 -1.660 5.037 1.00 0.00 C ATOM 60 CD PRO A 4 15.374 -2.913 4.190 1.00 0.00 C ATOM 0 HA PRO A 4 16.400 -4.047 7.011 1.00 0.00 H new ATOM 0 HB2 PRO A 4 15.306 -1.500 7.203 1.00 0.00 H new ATOM 0 HB3 PRO A 4 16.850 -1.776 6.420 1.00 0.00 H new ATOM 0 HG2 PRO A 4 14.118 -1.408 5.136 1.00 0.00 H new ATOM 0 HG3 PRO A 4 15.668 -0.795 4.595 1.00 0.00 H new ATOM 0 HD2 PRO A 4 14.537 -3.057 3.507 1.00 0.00 H new ATOM 0 HD3 PRO A 4 16.273 -2.829 3.579 1.00 0.00 H new ATOM 68 N ILE A 5 13.244 -4.296 6.744 1.00 0.00 N ATOM 69 CA ILE A 5 11.936 -4.507 7.372 1.00 0.00 C ATOM 70 C ILE A 5 11.468 -3.187 8.028 1.00 0.00 C ATOM 71 O ILE A 5 11.435 -3.072 9.256 1.00 0.00 O ATOM 72 CB ILE A 5 11.936 -5.745 8.314 1.00 0.00 C ATOM 73 CG1 ILE A 5 12.646 -6.999 7.744 1.00 0.00 C ATOM 74 CG2 ILE A 5 10.496 -6.109 8.716 1.00 0.00 C ATOM 75 CD1 ILE A 5 12.098 -7.546 6.419 1.00 0.00 C ATOM 0 H ILE A 5 13.239 -4.521 5.749 1.00 0.00 H new ATOM 0 HA ILE A 5 11.194 -4.761 6.615 1.00 0.00 H new ATOM 0 HB ILE A 5 12.519 -5.440 9.183 1.00 0.00 H new ATOM 0 HG12 ILE A 5 13.701 -6.762 7.606 1.00 0.00 H new ATOM 0 HG13 ILE A 5 12.592 -7.792 8.490 1.00 0.00 H new ATOM 0 HG21 ILE A 5 10.511 -6.977 9.375 1.00 0.00 H new ATOM 0 HG22 ILE A 5 10.039 -5.267 9.235 1.00 0.00 H new ATOM 0 HG23 ILE A 5 9.917 -6.342 7.823 1.00 0.00 H new ATOM 0 HD11 ILE A 5 12.674 -8.422 6.121 1.00 0.00 H new ATOM 0 HD12 ILE A 5 11.052 -7.825 6.545 1.00 0.00 H new ATOM 0 HD13 ILE A 5 12.178 -6.780 5.648 1.00 0.00 H new ATOM 87 N PRO A 6 11.139 -2.155 7.226 1.00 0.00 N ATOM 88 CA PRO A 6 10.797 -0.835 7.752 1.00 0.00 C ATOM 89 C PRO A 6 9.403 -0.801 8.402 1.00 0.00 C ATOM 90 O PRO A 6 9.144 0.060 9.244 1.00 0.00 O ATOM 91 CB PRO A 6 10.875 0.102 6.544 1.00 0.00 C ATOM 92 CG PRO A 6 10.495 -0.798 5.368 1.00 0.00 C ATOM 93 CD PRO A 6 11.073 -2.155 5.767 1.00 0.00 C ATOM 0 HA PRO A 6 11.479 -0.540 8.550 1.00 0.00 H new ATOM 0 HB2 PRO A 6 10.189 0.943 6.644 1.00 0.00 H new ATOM 0 HB3 PRO A 6 11.875 0.519 6.423 1.00 0.00 H new ATOM 0 HG2 PRO A 6 9.415 -0.845 5.230 1.00 0.00 H new ATOM 0 HG3 PRO A 6 10.921 -0.438 4.431 1.00 0.00 H new ATOM 0 HD2 PRO A 6 10.443 -2.968 5.406 1.00 0.00 H new ATOM 0 HD3 PRO A 6 12.062 -2.300 5.332 1.00 0.00 H new ATOM 101 N GLU A 7 8.509 -1.717 8.011 1.00 0.00 N ATOM 102 CA GLU A 7 7.093 -1.729 8.383 1.00 0.00 C ATOM 103 C GLU A 7 6.502 -3.133 8.641 1.00 0.00 C ATOM 104 O GLU A 7 5.655 -3.225 9.533 1.00 0.00 O ATOM 105 CB GLU A 7 6.247 -1.018 7.306 1.00 0.00 C ATOM 106 CG GLU A 7 6.559 0.478 7.154 1.00 0.00 C ATOM 107 CD GLU A 7 5.589 1.160 6.173 1.00 0.00 C ATOM 108 OE1 GLU A 7 4.527 1.662 6.608 1.00 0.00 O ATOM 109 OE2 GLU A 7 5.884 1.223 4.957 1.00 0.00 O ATOM 0 H GLU A 7 8.763 -2.497 7.405 1.00 0.00 H new ATOM 0 HA GLU A 7 7.049 -1.197 9.333 1.00 0.00 H new ATOM 0 HB2 GLU A 7 6.408 -1.512 6.348 1.00 0.00 H new ATOM 0 HB3 GLU A 7 5.192 -1.135 7.552 1.00 0.00 H new ATOM 0 HG2 GLU A 7 6.496 0.965 8.127 1.00 0.00 H new ATOM 0 HG3 GLU A 7 7.583 0.603 6.801 1.00 0.00 H new ATOM 116 N PRO A 8 6.867 -4.215 7.914 1.00 0.00 N ATOM 117 CA PRO A 8 6.256 -5.529 8.114 1.00 0.00 C ATOM 118 C PRO A 8 6.434 -6.075 9.540 1.00 0.00 C ATOM 119 O PRO A 8 7.420 -5.772 10.218 1.00 0.00 O ATOM 120 CB PRO A 8 6.906 -6.475 7.098 1.00 0.00 C ATOM 121 CG PRO A 8 7.531 -5.561 6.047 1.00 0.00 C ATOM 122 CD PRO A 8 7.789 -4.256 6.792 1.00 0.00 C ATOM 0 HA PRO A 8 5.179 -5.446 7.970 1.00 0.00 H new ATOM 0 HB2 PRO A 8 7.660 -7.104 7.571 1.00 0.00 H new ATOM 0 HB3 PRO A 8 6.168 -7.142 6.652 1.00 0.00 H new ATOM 0 HG2 PRO A 8 8.455 -5.983 5.651 1.00 0.00 H new ATOM 0 HG3 PRO A 8 6.861 -5.411 5.201 1.00 0.00 H new ATOM 0 HD2 PRO A 8 8.821 -4.208 7.140 1.00 0.00 H new ATOM 0 HD3 PRO A 8 7.634 -3.400 6.135 1.00 0.00 H new ATOM 130 N LYS A 9 5.529 -6.965 9.957 1.00 0.00 N ATOM 131 CA LYS A 9 5.629 -7.761 11.181 1.00 0.00 C ATOM 132 C LYS A 9 5.111 -9.178 10.900 1.00 0.00 C ATOM 133 O LYS A 9 4.259 -9.331 10.021 1.00 0.00 O ATOM 134 CB LYS A 9 4.871 -7.099 12.350 1.00 0.00 C ATOM 135 CG LYS A 9 3.422 -6.653 12.069 1.00 0.00 C ATOM 136 CD LYS A 9 3.351 -5.165 11.687 1.00 0.00 C ATOM 137 CE LYS A 9 1.930 -4.681 11.374 1.00 0.00 C ATOM 138 NZ LYS A 9 1.426 -5.206 10.085 1.00 0.00 N ATOM 0 H LYS A 9 4.676 -7.157 9.432 1.00 0.00 H new ATOM 0 HA LYS A 9 6.674 -7.819 11.486 1.00 0.00 H new ATOM 0 HB2 LYS A 9 4.856 -7.798 13.186 1.00 0.00 H new ATOM 0 HB3 LYS A 9 5.439 -6.227 12.674 1.00 0.00 H new ATOM 0 HG2 LYS A 9 3.005 -7.256 11.263 1.00 0.00 H new ATOM 0 HG3 LYS A 9 2.808 -6.832 12.952 1.00 0.00 H new ATOM 0 HD2 LYS A 9 3.758 -4.569 12.504 1.00 0.00 H new ATOM 0 HD3 LYS A 9 3.985 -4.990 10.818 1.00 0.00 H new ATOM 0 HE2 LYS A 9 1.259 -4.989 12.176 1.00 0.00 H new ATOM 0 HE3 LYS A 9 1.917 -3.591 11.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 0.786 -4.509 9.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 2.227 -5.384 9.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 0.910 -6.094 10.250 1.00 0.00 H new ATOM 152 N PRO A 10 5.628 -10.226 11.570 1.00 0.00 N ATOM 153 CA PRO A 10 5.162 -11.595 11.376 1.00 0.00 C ATOM 154 C PRO A 10 3.630 -11.686 11.437 1.00 0.00 C ATOM 155 O PRO A 10 2.998 -11.074 12.301 1.00 0.00 O ATOM 156 CB PRO A 10 5.862 -12.424 12.456 1.00 0.00 C ATOM 157 CG PRO A 10 7.169 -11.661 12.676 1.00 0.00 C ATOM 158 CD PRO A 10 6.739 -10.203 12.512 1.00 0.00 C ATOM 0 HA PRO A 10 5.411 -11.976 10.385 1.00 0.00 H new ATOM 0 HB2 PRO A 10 5.269 -12.482 13.369 1.00 0.00 H new ATOM 0 HB3 PRO A 10 6.042 -13.448 12.127 1.00 0.00 H new ATOM 0 HG2 PRO A 10 7.587 -11.851 13.664 1.00 0.00 H new ATOM 0 HG3 PRO A 10 7.930 -11.943 11.948 1.00 0.00 H new ATOM 0 HD2 PRO A 10 6.435 -9.774 13.467 1.00 0.00 H new ATOM 0 HD3 PRO A 10 7.560 -9.592 12.136 1.00 0.00 H new ATOM 166 N GLY A 11 3.044 -12.435 10.501 1.00 0.00 N ATOM 167 CA GLY A 11 1.611 -12.489 10.240 1.00 0.00 C ATOM 168 C GLY A 11 1.228 -11.666 9.004 1.00 0.00 C ATOM 169 O GLY A 11 0.108 -11.798 8.511 1.00 0.00 O ATOM 0 H GLY A 11 3.579 -13.043 9.881 1.00 0.00 H new ATOM 0 HA2 GLY A 11 1.306 -13.526 10.096 1.00 0.00 H new ATOM 0 HA3 GLY A 11 1.069 -12.115 11.108 1.00 0.00 H new ATOM 173 N ASP A 12 2.117 -10.807 8.492 1.00 0.00 N ATOM 174 CA ASP A 12 1.818 -9.967 7.339 1.00 0.00 C ATOM 175 C ASP A 12 1.983 -10.738 6.034 1.00 0.00 C ATOM 176 O ASP A 12 2.911 -11.541 5.885 1.00 0.00 O ATOM 177 CB ASP A 12 2.741 -8.741 7.300 1.00 0.00 C ATOM 178 CG ASP A 12 2.319 -7.621 8.255 1.00 0.00 C ATOM 179 OD1 ASP A 12 1.160 -7.601 8.733 1.00 0.00 O ATOM 180 OD2 ASP A 12 3.128 -6.695 8.483 1.00 0.00 O ATOM 0 H ASP A 12 3.057 -10.679 8.867 1.00 0.00 H new ATOM 0 HA ASP A 12 0.781 -9.646 7.441 1.00 0.00 H new ATOM 0 HB2 ASP A 12 3.756 -9.053 7.547 1.00 0.00 H new ATOM 0 HB3 ASP A 12 2.767 -8.349 6.283 1.00 0.00 H new ATOM 185 N LEU A 13 1.098 -10.454 5.073 1.00 0.00 N ATOM 186 CA LEU A 13 1.259 -10.886 3.694 1.00 0.00 C ATOM 187 C LEU A 13 2.344 -10.017 3.069 1.00 0.00 C ATOM 188 O LEU A 13 2.345 -8.795 3.248 1.00 0.00 O ATOM 189 CB LEU A 13 -0.007 -10.673 2.846 1.00 0.00 C ATOM 190 CG LEU A 13 -1.261 -11.506 3.150 1.00 0.00 C ATOM 191 CD1 LEU A 13 -2.233 -11.401 1.970 1.00 0.00 C ATOM 192 CD2 LEU A 13 -0.904 -12.970 3.402 1.00 0.00 C ATOM 0 H LEU A 13 0.248 -9.915 5.238 1.00 0.00 H new ATOM 0 HA LEU A 13 1.494 -11.950 3.708 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.284 -9.622 2.928 1.00 0.00 H new ATOM 0 HB3 LEU A 13 0.261 -10.852 1.805 1.00 0.00 H new ATOM 0 HG LEU A 13 -1.729 -11.115 4.054 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.125 -11.991 2.180 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -2.514 -10.358 1.821 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.752 -11.779 1.068 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -1.812 -13.535 3.614 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -0.418 -13.383 2.518 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -0.227 -13.038 4.253 1.00 0.00 H new ATOM 204 N ILE A 14 3.190 -10.630 2.250 1.00 0.00 N ATOM 205 CA ILE A 14 4.244 -9.969 1.510 1.00 0.00 C ATOM 206 C ILE A 14 3.990 -10.304 0.045 1.00 0.00 C ATOM 207 O ILE A 14 3.827 -11.476 -0.302 1.00 0.00 O ATOM 208 CB ILE A 14 5.626 -10.488 1.978 1.00 0.00 C ATOM 209 CG1 ILE A 14 5.865 -10.391 3.503 1.00 0.00 C ATOM 210 CG2 ILE A 14 6.752 -9.775 1.212 1.00 0.00 C ATOM 211 CD1 ILE A 14 5.858 -8.974 4.092 1.00 0.00 C ATOM 0 H ILE A 14 3.155 -11.635 2.081 1.00 0.00 H new ATOM 0 HA ILE A 14 4.247 -8.890 1.668 1.00 0.00 H new ATOM 0 HB ILE A 14 5.633 -11.554 1.749 1.00 0.00 H new ATOM 0 HG12 ILE A 14 5.099 -10.978 4.010 1.00 0.00 H new ATOM 0 HG13 ILE A 14 6.825 -10.854 3.731 1.00 0.00 H new ATOM 0 HG21 ILE A 14 7.717 -10.150 1.552 1.00 0.00 H new ATOM 0 HG22 ILE A 14 6.644 -9.966 0.144 1.00 0.00 H new ATOM 0 HG23 ILE A 14 6.695 -8.702 1.396 1.00 0.00 H new ATOM 0 HD11 ILE A 14 6.035 -9.026 5.166 1.00 0.00 H new ATOM 0 HD12 ILE A 14 6.643 -8.381 3.623 1.00 0.00 H new ATOM 0 HD13 ILE A 14 4.891 -8.507 3.906 1.00 0.00 H new ATOM 223 N GLU A 15 3.963 -9.293 -0.819 1.00 0.00 N ATOM 224 CA GLU A 15 4.005 -9.515 -2.250 1.00 0.00 C ATOM 225 C GLU A 15 5.439 -9.238 -2.687 1.00 0.00 C ATOM 226 O GLU A 15 6.133 -8.391 -2.125 1.00 0.00 O ATOM 227 CB GLU A 15 2.948 -8.718 -3.018 1.00 0.00 C ATOM 228 CG GLU A 15 3.258 -7.235 -3.249 1.00 0.00 C ATOM 229 CD GLU A 15 2.213 -6.640 -4.203 1.00 0.00 C ATOM 230 OE1 GLU A 15 2.247 -6.963 -5.414 1.00 0.00 O ATOM 231 OE2 GLU A 15 1.345 -5.867 -3.742 1.00 0.00 O ATOM 0 H GLU A 15 3.912 -8.312 -0.546 1.00 0.00 H new ATOM 0 HA GLU A 15 3.739 -10.545 -2.490 1.00 0.00 H new ATOM 0 HB2 GLU A 15 2.798 -9.192 -3.988 1.00 0.00 H new ATOM 0 HB3 GLU A 15 2.004 -8.791 -2.478 1.00 0.00 H new ATOM 0 HG2 GLU A 15 3.249 -6.698 -2.301 1.00 0.00 H new ATOM 0 HG3 GLU A 15 4.257 -7.122 -3.670 1.00 0.00 H new ATOM 238 N ILE A 16 5.868 -9.963 -3.701 1.00 0.00 N ATOM 239 CA ILE A 16 7.223 -10.091 -4.183 1.00 0.00 C ATOM 240 C ILE A 16 7.120 -9.703 -5.651 1.00 0.00 C ATOM 241 O ILE A 16 6.582 -10.471 -6.448 1.00 0.00 O ATOM 242 CB ILE A 16 7.645 -11.569 -3.993 1.00 0.00 C ATOM 243 CG1 ILE A 16 7.593 -12.088 -2.539 1.00 0.00 C ATOM 244 CG2 ILE A 16 9.009 -11.852 -4.642 1.00 0.00 C ATOM 245 CD1 ILE A 16 8.634 -11.465 -1.615 1.00 0.00 C ATOM 0 H ILE A 16 5.220 -10.524 -4.254 1.00 0.00 H new ATOM 0 HA ILE A 16 7.963 -9.475 -3.671 1.00 0.00 H new ATOM 0 HB ILE A 16 6.879 -12.141 -4.515 1.00 0.00 H new ATOM 0 HG12 ILE A 16 6.600 -11.895 -2.132 1.00 0.00 H new ATOM 0 HG13 ILE A 16 7.730 -13.169 -2.546 1.00 0.00 H new ATOM 0 HG21 ILE A 16 9.274 -12.898 -4.490 1.00 0.00 H new ATOM 0 HG22 ILE A 16 8.954 -11.643 -5.710 1.00 0.00 H new ATOM 0 HG23 ILE A 16 9.768 -11.215 -4.187 1.00 0.00 H new ATOM 0 HD11 ILE A 16 8.529 -11.884 -0.614 1.00 0.00 H new ATOM 0 HD12 ILE A 16 9.633 -11.679 -1.995 1.00 0.00 H new ATOM 0 HD13 ILE A 16 8.485 -10.386 -1.574 1.00 0.00 H new ATOM 257 N PHE A 17 7.546 -8.503 -6.023 1.00 0.00 N ATOM 258 CA PHE A 17 7.546 -8.132 -7.433 1.00 0.00 C ATOM 259 C PHE A 17 8.565 -9.006 -8.163 1.00 0.00 C ATOM 260 O PHE A 17 9.639 -9.299 -7.632 1.00 0.00 O ATOM 261 CB PHE A 17 7.818 -6.635 -7.616 1.00 0.00 C ATOM 262 CG PHE A 17 6.583 -5.871 -8.053 1.00 0.00 C ATOM 263 CD1 PHE A 17 6.169 -5.932 -9.398 1.00 0.00 C ATOM 264 CD2 PHE A 17 5.822 -5.140 -7.119 1.00 0.00 C ATOM 265 CE1 PHE A 17 5.006 -5.259 -9.811 1.00 0.00 C ATOM 266 CE2 PHE A 17 4.659 -4.465 -7.536 1.00 0.00 C ATOM 267 CZ PHE A 17 4.251 -4.524 -8.880 1.00 0.00 C ATOM 0 H PHE A 17 7.889 -7.784 -5.386 1.00 0.00 H new ATOM 0 HA PHE A 17 6.561 -8.308 -7.865 1.00 0.00 H new ATOM 0 HB2 PHE A 17 8.187 -6.218 -6.679 1.00 0.00 H new ATOM 0 HB3 PHE A 17 8.606 -6.500 -8.357 1.00 0.00 H new ATOM 0 HD1 PHE A 17 6.747 -6.498 -10.114 1.00 0.00 H new ATOM 0 HD2 PHE A 17 6.130 -5.098 -6.085 1.00 0.00 H new ATOM 0 HE1 PHE A 17 4.692 -5.306 -10.843 1.00 0.00 H new ATOM 0 HE2 PHE A 17 4.079 -3.900 -6.821 1.00 0.00 H new ATOM 0 HZ PHE A 17 3.358 -4.005 -9.197 1.00 0.00 H new ATOM 277 N ARG A 18 8.228 -9.420 -9.383 1.00 0.00 N ATOM 278 CA ARG A 18 9.038 -10.277 -10.240 1.00 0.00 C ATOM 279 C ARG A 18 9.230 -9.557 -11.583 1.00 0.00 C ATOM 280 O ARG A 18 8.557 -8.552 -11.818 1.00 0.00 O ATOM 281 CB ARG A 18 8.307 -11.630 -10.354 1.00 0.00 C ATOM 282 CG ARG A 18 8.302 -12.397 -9.015 1.00 0.00 C ATOM 283 CD ARG A 18 8.934 -13.787 -9.147 1.00 0.00 C ATOM 284 NE ARG A 18 9.533 -14.233 -7.876 1.00 0.00 N ATOM 285 CZ ARG A 18 9.368 -15.399 -7.245 1.00 0.00 C ATOM 286 NH1 ARG A 18 8.540 -16.331 -7.711 1.00 0.00 N ATOM 287 NH2 ARG A 18 10.059 -15.604 -6.130 1.00 0.00 N ATOM 0 H ARG A 18 7.344 -9.155 -9.818 1.00 0.00 H new ATOM 0 HA ARG A 18 10.034 -10.474 -9.843 1.00 0.00 H new ATOM 0 HB2 ARG A 18 7.280 -11.462 -10.679 1.00 0.00 H new ATOM 0 HB3 ARG A 18 8.788 -12.239 -11.119 1.00 0.00 H new ATOM 0 HG2 ARG A 18 8.845 -11.821 -8.266 1.00 0.00 H new ATOM 0 HG3 ARG A 18 7.277 -12.497 -8.658 1.00 0.00 H new ATOM 0 HD2 ARG A 18 8.176 -14.503 -9.464 1.00 0.00 H new ATOM 0 HD3 ARG A 18 9.699 -13.767 -9.923 1.00 0.00 H new ATOM 0 HE ARG A 18 10.154 -13.565 -7.419 1.00 0.00 H new ATOM 0 HH11 ARG A 18 8.014 -16.163 -8.569 1.00 0.00 H new ATOM 0 HH12 ARG A 18 8.432 -17.213 -7.211 1.00 0.00 H new ATOM 0 HH21 ARG A 18 10.691 -14.883 -5.782 1.00 0.00 H new ATOM 0 HH22 ARG A 18 9.958 -16.483 -5.622 1.00 0.00 H new ATOM 301 N PRO A 19 10.129 -10.026 -12.471 1.00 0.00 N ATOM 302 CA PRO A 19 10.540 -9.292 -13.670 1.00 0.00 C ATOM 303 C PRO A 19 9.423 -8.734 -14.565 1.00 0.00 C ATOM 304 O PRO A 19 9.643 -7.722 -15.234 1.00 0.00 O ATOM 305 CB PRO A 19 11.451 -10.250 -14.441 1.00 0.00 C ATOM 306 CG PRO A 19 12.104 -11.060 -13.325 1.00 0.00 C ATOM 307 CD PRO A 19 10.976 -11.204 -12.305 1.00 0.00 C ATOM 0 HA PRO A 19 11.035 -8.375 -13.349 1.00 0.00 H new ATOM 0 HB2 PRO A 19 10.886 -10.884 -15.125 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.189 -9.715 -15.038 1.00 0.00 H new ATOM 0 HG2 PRO A 19 12.454 -12.029 -13.680 1.00 0.00 H new ATOM 0 HG3 PRO A 19 12.967 -10.545 -12.903 1.00 0.00 H new ATOM 0 HD2 PRO A 19 10.409 -12.119 -12.477 1.00 0.00 H new ATOM 0 HD3 PRO A 19 11.372 -11.260 -11.291 1.00 0.00 H new ATOM 315 N PHE A 20 8.239 -9.360 -14.584 1.00 0.00 N ATOM 316 CA PHE A 20 7.089 -8.898 -15.368 1.00 0.00 C ATOM 317 C PHE A 20 5.750 -9.182 -14.654 1.00 0.00 C ATOM 318 O PHE A 20 4.691 -9.143 -15.284 1.00 0.00 O ATOM 319 CB PHE A 20 7.165 -9.551 -16.765 1.00 0.00 C ATOM 320 CG PHE A 20 6.320 -8.889 -17.840 1.00 0.00 C ATOM 321 CD1 PHE A 20 6.641 -7.592 -18.288 1.00 0.00 C ATOM 322 CD2 PHE A 20 5.226 -9.571 -18.413 1.00 0.00 C ATOM 323 CE1 PHE A 20 5.868 -6.978 -19.291 1.00 0.00 C ATOM 324 CE2 PHE A 20 4.455 -8.955 -19.415 1.00 0.00 C ATOM 325 CZ PHE A 20 4.774 -7.658 -19.853 1.00 0.00 C ATOM 0 H PHE A 20 8.052 -10.209 -14.050 1.00 0.00 H new ATOM 0 HA PHE A 20 7.129 -7.814 -15.476 1.00 0.00 H new ATOM 0 HB2 PHE A 20 8.205 -9.550 -17.092 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.860 -10.594 -16.677 1.00 0.00 H new ATOM 0 HD1 PHE A 20 7.483 -7.068 -17.860 1.00 0.00 H new ATOM 0 HD2 PHE A 20 4.980 -10.569 -18.081 1.00 0.00 H new ATOM 0 HE1 PHE A 20 6.116 -5.983 -19.629 1.00 0.00 H new ATOM 0 HE2 PHE A 20 3.616 -9.479 -19.849 1.00 0.00 H new ATOM 0 HZ PHE A 20 4.179 -7.185 -20.620 1.00 0.00 H new ATOM 335 N TYR A 21 5.774 -9.523 -13.360 1.00 0.00 N ATOM 336 CA TYR A 21 4.617 -10.021 -12.611 1.00 0.00 C ATOM 337 C TYR A 21 4.865 -9.841 -11.107 1.00 0.00 C ATOM 338 O TYR A 21 5.764 -9.093 -10.721 1.00 0.00 O ATOM 339 CB TYR A 21 4.337 -11.486 -13.005 1.00 0.00 C ATOM 340 CG TYR A 21 5.433 -12.497 -12.703 1.00 0.00 C ATOM 341 CD1 TYR A 21 6.515 -12.668 -13.589 1.00 0.00 C ATOM 342 CD2 TYR A 21 5.333 -13.320 -11.568 1.00 0.00 C ATOM 343 CE1 TYR A 21 7.474 -13.670 -13.358 1.00 0.00 C ATOM 344 CE2 TYR A 21 6.268 -14.342 -11.341 1.00 0.00 C ATOM 345 CZ TYR A 21 7.345 -14.525 -12.237 1.00 0.00 C ATOM 346 OH TYR A 21 8.254 -15.513 -12.000 1.00 0.00 O ATOM 0 H TYR A 21 6.619 -9.458 -12.792 1.00 0.00 H new ATOM 0 HA TYR A 21 3.723 -9.449 -12.859 1.00 0.00 H new ATOM 0 HB2 TYR A 21 3.428 -11.807 -12.496 1.00 0.00 H new ATOM 0 HB3 TYR A 21 4.131 -11.517 -14.075 1.00 0.00 H new ATOM 0 HD1 TYR A 21 6.608 -12.025 -14.452 1.00 0.00 H new ATOM 0 HD2 TYR A 21 4.529 -13.165 -10.864 1.00 0.00 H new ATOM 0 HE1 TYR A 21 8.308 -13.787 -14.035 1.00 0.00 H new ATOM 0 HE2 TYR A 21 6.164 -14.988 -10.482 1.00 0.00 H new ATOM 0 HH TYR A 21 8.005 -15.998 -11.186 1.00 0.00 H new ATOM 356 N ARG A 22 4.101 -10.511 -10.239 1.00 0.00 N ATOM 357 CA ARG A 22 4.344 -10.523 -8.797 1.00 0.00 C ATOM 358 C ARG A 22 4.001 -11.892 -8.224 1.00 0.00 C ATOM 359 O ARG A 22 3.255 -12.654 -8.832 1.00 0.00 O ATOM 360 CB ARG A 22 3.609 -9.358 -8.099 1.00 0.00 C ATOM 361 CG ARG A 22 2.081 -9.287 -8.277 1.00 0.00 C ATOM 362 CD ARG A 22 1.341 -10.028 -7.157 1.00 0.00 C ATOM 363 NE ARG A 22 -0.123 -9.843 -7.238 1.00 0.00 N ATOM 364 CZ ARG A 22 -0.819 -8.776 -6.812 1.00 0.00 C ATOM 365 NH1 ARG A 22 -0.224 -7.664 -6.388 1.00 0.00 N ATOM 366 NH2 ARG A 22 -2.144 -8.843 -6.789 1.00 0.00 N ATOM 0 H ARG A 22 3.291 -11.064 -10.521 1.00 0.00 H new ATOM 0 HA ARG A 22 5.404 -10.357 -8.604 1.00 0.00 H new ATOM 0 HB2 ARG A 22 3.823 -9.414 -7.032 1.00 0.00 H new ATOM 0 HB3 ARG A 22 4.036 -8.423 -8.461 1.00 0.00 H new ATOM 0 HG2 ARG A 22 1.765 -8.244 -8.293 1.00 0.00 H new ATOM 0 HG3 ARG A 22 1.807 -9.718 -9.240 1.00 0.00 H new ATOM 0 HD2 ARG A 22 1.575 -11.091 -7.211 1.00 0.00 H new ATOM 0 HD3 ARG A 22 1.698 -9.672 -6.191 1.00 0.00 H new ATOM 0 HE ARG A 22 -0.659 -10.602 -7.660 1.00 0.00 H new ATOM 0 HH11 ARG A 22 0.794 -7.602 -6.379 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -0.786 -6.874 -6.072 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -2.617 -9.695 -7.092 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -2.690 -8.043 -6.469 1.00 0.00 H new ATOM 380 N HIS A 23 4.541 -12.191 -7.057 1.00 0.00 N ATOM 381 CA HIS A 23 4.459 -13.451 -6.339 1.00 0.00 C ATOM 382 C HIS A 23 4.063 -13.121 -4.897 1.00 0.00 C ATOM 383 O HIS A 23 4.043 -11.943 -4.528 1.00 0.00 O ATOM 384 CB HIS A 23 5.832 -14.145 -6.443 1.00 0.00 C ATOM 385 CG HIS A 23 5.967 -15.397 -5.618 1.00 0.00 C ATOM 386 ND1 HIS A 23 5.092 -16.482 -5.658 1.00 0.00 N ATOM 387 CD2 HIS A 23 6.936 -15.632 -4.688 1.00 0.00 C ATOM 388 CE1 HIS A 23 5.573 -17.361 -4.759 1.00 0.00 C ATOM 389 NE2 HIS A 23 6.675 -16.876 -4.166 1.00 0.00 N ATOM 0 H HIS A 23 5.093 -11.503 -6.545 1.00 0.00 H new ATOM 0 HA HIS A 23 3.716 -14.134 -6.749 1.00 0.00 H new ATOM 0 HB2 HIS A 23 6.021 -14.392 -7.488 1.00 0.00 H new ATOM 0 HB3 HIS A 23 6.605 -13.440 -6.138 1.00 0.00 H new ATOM 0 HD2 HIS A 23 7.747 -14.972 -4.416 1.00 0.00 H new ATOM 0 HE1 HIS A 23 5.133 -18.324 -4.545 1.00 0.00 H new ATOM 0 HE2 HIS A 23 7.225 -17.350 -3.450 1.00 0.00 H new ATOM 397 N TRP A 24 3.737 -14.118 -4.073 1.00 0.00 N ATOM 398 CA TRP A 24 3.243 -13.894 -2.720 1.00 0.00 C ATOM 399 C TRP A 24 3.893 -14.841 -1.728 1.00 0.00 C ATOM 400 O TRP A 24 4.165 -16.002 -2.039 1.00 0.00 O ATOM 401 CB TRP A 24 1.725 -14.055 -2.679 1.00 0.00 C ATOM 402 CG TRP A 24 0.972 -12.927 -3.293 1.00 0.00 C ATOM 403 CD1 TRP A 24 0.664 -12.785 -4.599 1.00 0.00 C ATOM 404 CD2 TRP A 24 0.445 -11.744 -2.629 1.00 0.00 C ATOM 405 NE1 TRP A 24 -0.017 -11.602 -4.777 1.00 0.00 N ATOM 406 CE2 TRP A 24 -0.202 -10.924 -3.596 1.00 0.00 C ATOM 407 CE3 TRP A 24 0.455 -11.292 -1.298 1.00 0.00 C ATOM 408 CZ2 TRP A 24 -0.844 -9.724 -3.253 1.00 0.00 C ATOM 409 CZ3 TRP A 24 -0.171 -10.081 -0.946 1.00 0.00 C ATOM 410 CH2 TRP A 24 -0.829 -9.305 -1.915 1.00 0.00 C ATOM 0 H TRP A 24 3.809 -15.103 -4.328 1.00 0.00 H new ATOM 0 HA TRP A 24 3.505 -12.875 -2.434 1.00 0.00 H new ATOM 0 HB2 TRP A 24 1.455 -14.978 -3.192 1.00 0.00 H new ATOM 0 HB3 TRP A 24 1.411 -14.164 -1.641 1.00 0.00 H new ATOM 0 HD1 TRP A 24 0.912 -13.488 -5.381 1.00 0.00 H new ATOM 0 HE1 TRP A 24 -0.347 -11.267 -5.682 1.00 0.00 H new ATOM 0 HE3 TRP A 24 0.948 -11.880 -0.538 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 -1.342 -9.133 -4.008 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 -0.145 -9.745 0.080 1.00 0.00 H new ATOM 0 HH2 TRP A 24 -1.322 -8.388 -1.630 1.00 0.00 H new ATOM 421 N ALA A 25 4.085 -14.327 -0.516 1.00 0.00 N ATOM 422 CA ALA A 25 4.689 -14.981 0.624 1.00 0.00 C ATOM 423 C ALA A 25 4.029 -14.428 1.894 1.00 0.00 C ATOM 424 O ALA A 25 3.265 -13.461 1.838 1.00 0.00 O ATOM 425 CB ALA A 25 6.195 -14.678 0.610 1.00 0.00 C ATOM 0 H ALA A 25 3.799 -13.373 -0.297 1.00 0.00 H new ATOM 0 HA ALA A 25 4.547 -16.061 0.591 1.00 0.00 H new ATOM 0 HB1 ALA A 25 6.671 -15.162 1.462 1.00 0.00 H new ATOM 0 HB2 ALA A 25 6.634 -15.056 -0.314 1.00 0.00 H new ATOM 0 HB3 ALA A 25 6.350 -13.601 0.671 1.00 0.00 H new ATOM 431 N ILE A 26 4.332 -15.009 3.049 1.00 0.00 N ATOM 432 CA ILE A 26 3.808 -14.581 4.335 1.00 0.00 C ATOM 433 C ILE A 26 4.949 -14.607 5.339 1.00 0.00 C ATOM 434 O ILE A 26 5.734 -15.553 5.359 1.00 0.00 O ATOM 435 CB ILE A 26 2.616 -15.481 4.698 1.00 0.00 C ATOM 436 CG1 ILE A 26 1.827 -14.954 5.903 1.00 0.00 C ATOM 437 CG2 ILE A 26 2.972 -16.969 4.820 1.00 0.00 C ATOM 438 CD1 ILE A 26 0.493 -15.694 6.019 1.00 0.00 C ATOM 0 H ILE A 26 4.963 -15.808 3.116 1.00 0.00 H new ATOM 0 HA ILE A 26 3.426 -13.560 4.322 1.00 0.00 H new ATOM 0 HB ILE A 26 1.944 -15.426 3.841 1.00 0.00 H new ATOM 0 HG12 ILE A 26 2.408 -15.089 6.816 1.00 0.00 H new ATOM 0 HG13 ILE A 26 1.650 -13.884 5.793 1.00 0.00 H new ATOM 0 HG21 ILE A 26 2.078 -17.537 5.078 1.00 0.00 H new ATOM 0 HG22 ILE A 26 3.368 -17.327 3.870 1.00 0.00 H new ATOM 0 HG23 ILE A 26 3.723 -17.101 5.599 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -0.061 -15.313 6.877 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -0.091 -15.537 5.112 1.00 0.00 H new ATOM 0 HD13 ILE A 26 0.679 -16.760 6.151 1.00 0.00 H new ATOM 450 N TYR A 27 5.078 -13.542 6.120 1.00 0.00 N ATOM 451 CA TYR A 27 6.170 -13.326 7.054 1.00 0.00 C ATOM 452 C TYR A 27 5.847 -14.111 8.327 1.00 0.00 C ATOM 453 O TYR A 27 4.748 -13.965 8.862 1.00 0.00 O ATOM 454 CB TYR A 27 6.258 -11.801 7.243 1.00 0.00 C ATOM 455 CG TYR A 27 7.471 -11.207 7.931 1.00 0.00 C ATOM 456 CD1 TYR A 27 8.750 -11.793 7.850 1.00 0.00 C ATOM 457 CD2 TYR A 27 7.317 -9.974 8.588 1.00 0.00 C ATOM 458 CE1 TYR A 27 9.847 -11.192 8.493 1.00 0.00 C ATOM 459 CE2 TYR A 27 8.403 -9.376 9.251 1.00 0.00 C ATOM 460 CZ TYR A 27 9.668 -10.003 9.236 1.00 0.00 C ATOM 461 OH TYR A 27 10.691 -9.446 9.940 1.00 0.00 O ATOM 0 H TYR A 27 4.400 -12.780 6.119 1.00 0.00 H new ATOM 0 HA TYR A 27 7.145 -13.680 6.718 1.00 0.00 H new ATOM 0 HB2 TYR A 27 6.185 -11.344 6.256 1.00 0.00 H new ATOM 0 HB3 TYR A 27 5.377 -11.489 7.805 1.00 0.00 H new ATOM 0 HD1 TYR A 27 8.888 -12.707 7.292 1.00 0.00 H new ATOM 0 HD2 TYR A 27 6.356 -9.482 8.583 1.00 0.00 H new ATOM 0 HE1 TYR A 27 10.827 -11.639 8.419 1.00 0.00 H new ATOM 0 HE2 TYR A 27 8.270 -8.439 9.771 1.00 0.00 H new ATOM 0 HH TYR A 27 11.417 -10.098 10.034 1.00 0.00 H new ATOM 471 N VAL A 28 6.767 -14.952 8.810 1.00 0.00 N ATOM 472 CA VAL A 28 6.481 -15.924 9.881 1.00 0.00 C ATOM 473 C VAL A 28 7.509 -15.914 11.020 1.00 0.00 C ATOM 474 O VAL A 28 7.332 -16.622 12.012 1.00 0.00 O ATOM 475 CB VAL A 28 6.334 -17.347 9.292 1.00 0.00 C ATOM 476 CG1 VAL A 28 5.098 -17.469 8.390 1.00 0.00 C ATOM 477 CG2 VAL A 28 7.585 -17.804 8.523 1.00 0.00 C ATOM 0 H VAL A 28 7.729 -14.982 8.474 1.00 0.00 H new ATOM 0 HA VAL A 28 5.537 -15.612 10.329 1.00 0.00 H new ATOM 0 HB VAL A 28 6.209 -18.007 10.151 1.00 0.00 H new ATOM 0 HG11 VAL A 28 5.033 -18.484 7.997 1.00 0.00 H new ATOM 0 HG12 VAL A 28 4.202 -17.245 8.969 1.00 0.00 H new ATOM 0 HG13 VAL A 28 5.181 -16.765 7.562 1.00 0.00 H new ATOM 0 HG21 VAL A 28 7.425 -18.809 8.132 1.00 0.00 H new ATOM 0 HG22 VAL A 28 7.774 -17.119 7.696 1.00 0.00 H new ATOM 0 HG23 VAL A 28 8.444 -17.808 9.195 1.00 0.00 H new ATOM 487 N GLY A 29 8.573 -15.122 10.912 1.00 0.00 N ATOM 488 CA GLY A 29 9.636 -15.043 11.901 1.00 0.00 C ATOM 489 C GLY A 29 10.443 -13.783 11.641 1.00 0.00 C ATOM 490 O GLY A 29 10.084 -13.004 10.764 1.00 0.00 O ATOM 0 H GLY A 29 8.720 -14.504 10.114 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.217 -15.024 12.907 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.277 -15.923 11.840 1.00 0.00 H new ATOM 494 N ASP A 30 11.531 -13.575 12.384 1.00 0.00 N ATOM 495 CA ASP A 30 12.297 -12.325 12.330 1.00 0.00 C ATOM 496 C ASP A 30 12.842 -12.013 10.928 1.00 0.00 C ATOM 497 O ASP A 30 12.978 -10.843 10.567 1.00 0.00 O ATOM 498 CB ASP A 30 13.444 -12.379 13.343 1.00 0.00 C ATOM 499 CG ASP A 30 14.285 -11.091 13.315 1.00 0.00 C ATOM 500 OD1 ASP A 30 13.815 -10.046 13.817 1.00 0.00 O ATOM 501 OD2 ASP A 30 15.441 -11.129 12.838 1.00 0.00 O ATOM 0 H ASP A 30 11.906 -14.263 13.037 1.00 0.00 H new ATOM 0 HA ASP A 30 11.610 -11.517 12.583 1.00 0.00 H new ATOM 0 HB2 ASP A 30 13.039 -12.528 14.344 1.00 0.00 H new ATOM 0 HB3 ASP A 30 14.082 -13.236 13.126 1.00 0.00 H new ATOM 506 N GLY A 31 13.095 -13.041 10.114 1.00 0.00 N ATOM 507 CA GLY A 31 13.610 -12.885 8.756 1.00 0.00 C ATOM 508 C GLY A 31 13.150 -13.969 7.786 1.00 0.00 C ATOM 509 O GLY A 31 13.720 -14.058 6.702 1.00 0.00 O ATOM 0 H GLY A 31 12.946 -14.013 10.384 1.00 0.00 H new ATOM 0 HA2 GLY A 31 13.301 -11.913 8.371 1.00 0.00 H new ATOM 0 HA3 GLY A 31 14.699 -12.882 8.790 1.00 0.00 H new ATOM 513 N TYR A 32 12.148 -14.789 8.126 1.00 0.00 N ATOM 514 CA TYR A 32 11.718 -15.917 7.299 1.00 0.00 C ATOM 515 C TYR A 32 10.284 -15.746 6.825 1.00 0.00 C ATOM 516 O TYR A 32 9.452 -15.128 7.498 1.00 0.00 O ATOM 517 CB TYR A 32 11.859 -17.237 8.067 1.00 0.00 C ATOM 518 CG TYR A 32 13.295 -17.687 8.225 1.00 0.00 C ATOM 519 CD1 TYR A 32 14.075 -17.176 9.278 1.00 0.00 C ATOM 520 CD2 TYR A 32 13.855 -18.594 7.305 1.00 0.00 C ATOM 521 CE1 TYR A 32 15.415 -17.578 9.424 1.00 0.00 C ATOM 522 CE2 TYR A 32 15.196 -18.996 7.442 1.00 0.00 C ATOM 523 CZ TYR A 32 15.982 -18.491 8.503 1.00 0.00 C ATOM 524 OH TYR A 32 17.280 -18.889 8.626 1.00 0.00 O ATOM 0 H TYR A 32 11.612 -14.686 8.987 1.00 0.00 H new ATOM 0 HA TYR A 32 12.366 -15.943 6.423 1.00 0.00 H new ATOM 0 HB2 TYR A 32 11.410 -17.125 9.054 1.00 0.00 H new ATOM 0 HB3 TYR A 32 11.297 -18.013 7.548 1.00 0.00 H new ATOM 0 HD1 TYR A 32 13.644 -16.473 9.976 1.00 0.00 H new ATOM 0 HD2 TYR A 32 13.255 -18.981 6.494 1.00 0.00 H new ATOM 0 HE1 TYR A 32 16.010 -17.191 10.238 1.00 0.00 H new ATOM 0 HE2 TYR A 32 15.626 -19.691 6.736 1.00 0.00 H new ATOM 0 HH TYR A 32 17.499 -19.518 7.907 1.00 0.00 H new ATOM 534 N VAL A 33 9.995 -16.365 5.684 1.00 0.00 N ATOM 535 CA VAL A 33 8.694 -16.366 5.043 1.00 0.00 C ATOM 536 C VAL A 33 8.308 -17.788 4.643 1.00 0.00 C ATOM 537 O VAL A 33 9.170 -18.634 4.405 1.00 0.00 O ATOM 538 CB VAL A 33 8.685 -15.451 3.798 1.00 0.00 C ATOM 539 CG1 VAL A 33 8.705 -13.966 4.167 1.00 0.00 C ATOM 540 CG2 VAL A 33 9.832 -15.742 2.817 1.00 0.00 C ATOM 0 H VAL A 33 10.692 -16.899 5.164 1.00 0.00 H new ATOM 0 HA VAL A 33 7.966 -15.980 5.757 1.00 0.00 H new ATOM 0 HB VAL A 33 7.746 -15.683 3.296 1.00 0.00 H new ATOM 0 HG11 VAL A 33 8.698 -13.365 3.258 1.00 0.00 H new ATOM 0 HG12 VAL A 33 7.826 -13.728 4.766 1.00 0.00 H new ATOM 0 HG13 VAL A 33 9.605 -13.746 4.740 1.00 0.00 H new ATOM 0 HG21 VAL A 33 9.765 -15.063 1.967 1.00 0.00 H new ATOM 0 HG22 VAL A 33 10.787 -15.598 3.321 1.00 0.00 H new ATOM 0 HG23 VAL A 33 9.758 -16.771 2.466 1.00 0.00 H new ATOM 550 N VAL A 34 7.005 -18.027 4.533 1.00 0.00 N ATOM 551 CA VAL A 34 6.422 -19.207 3.917 1.00 0.00 C ATOM 552 C VAL A 34 5.894 -18.732 2.564 1.00 0.00 C ATOM 553 O VAL A 34 5.387 -17.613 2.458 1.00 0.00 O ATOM 554 CB VAL A 34 5.329 -19.777 4.843 1.00 0.00 C ATOM 555 CG1 VAL A 34 4.341 -20.718 4.143 1.00 0.00 C ATOM 556 CG2 VAL A 34 5.987 -20.495 6.023 1.00 0.00 C ATOM 0 H VAL A 34 6.302 -17.377 4.885 1.00 0.00 H new ATOM 0 HA VAL A 34 7.129 -20.023 3.766 1.00 0.00 H new ATOM 0 HB VAL A 34 4.739 -18.926 5.184 1.00 0.00 H new ATOM 0 HG11 VAL A 34 3.605 -21.075 4.864 1.00 0.00 H new ATOM 0 HG12 VAL A 34 3.833 -20.182 3.341 1.00 0.00 H new ATOM 0 HG13 VAL A 34 4.881 -21.568 3.725 1.00 0.00 H new ATOM 0 HG21 VAL A 34 5.216 -20.899 6.679 1.00 0.00 H new ATOM 0 HG22 VAL A 34 6.610 -21.309 5.652 1.00 0.00 H new ATOM 0 HG23 VAL A 34 6.604 -19.790 6.580 1.00 0.00 H new ATOM 566 N HIS A 35 6.012 -19.554 1.523 1.00 0.00 N ATOM 567 CA HIS A 35 5.482 -19.248 0.195 1.00 0.00 C ATOM 568 C HIS A 35 5.357 -20.517 -0.642 1.00 0.00 C ATOM 569 O HIS A 35 5.799 -21.586 -0.213 1.00 0.00 O ATOM 570 CB HIS A 35 6.360 -18.197 -0.510 1.00 0.00 C ATOM 571 CG HIS A 35 7.730 -18.614 -0.994 1.00 0.00 C ATOM 572 ND1 HIS A 35 8.400 -17.971 -2.038 1.00 0.00 N ATOM 573 CD2 HIS A 35 8.548 -19.578 -0.470 1.00 0.00 C ATOM 574 CE1 HIS A 35 9.597 -18.568 -2.128 1.00 0.00 C ATOM 575 NE2 HIS A 35 9.711 -19.530 -1.202 1.00 0.00 N ATOM 0 H HIS A 35 6.482 -20.458 1.577 1.00 0.00 H new ATOM 0 HA HIS A 35 4.483 -18.827 0.310 1.00 0.00 H new ATOM 0 HB2 HIS A 35 5.804 -17.822 -1.369 1.00 0.00 H new ATOM 0 HB3 HIS A 35 6.490 -17.359 0.175 1.00 0.00 H new ATOM 0 HD2 HIS A 35 8.325 -20.242 0.352 1.00 0.00 H new ATOM 0 HE1 HIS A 35 10.362 -18.310 -2.846 1.00 0.00 H new ATOM 0 HE2 HIS A 35 10.526 -20.128 -1.063 1.00 0.00 H new ATOM 583 N LEU A 36 4.764 -20.412 -1.834 1.00 0.00 N ATOM 584 CA LEU A 36 4.784 -21.505 -2.801 1.00 0.00 C ATOM 585 C LEU A 36 6.127 -21.451 -3.535 1.00 0.00 C ATOM 586 O LEU A 36 6.603 -20.370 -3.887 1.00 0.00 O ATOM 587 CB LEU A 36 3.629 -21.401 -3.820 1.00 0.00 C ATOM 588 CG LEU A 36 2.244 -21.926 -3.394 1.00 0.00 C ATOM 589 CD1 LEU A 36 2.257 -23.402 -2.979 1.00 0.00 C ATOM 590 CD2 LEU A 36 1.650 -21.097 -2.264 1.00 0.00 C ATOM 0 H LEU A 36 4.265 -19.580 -2.150 1.00 0.00 H new ATOM 0 HA LEU A 36 4.656 -22.450 -2.272 1.00 0.00 H new ATOM 0 HB2 LEU A 36 3.519 -20.352 -4.095 1.00 0.00 H new ATOM 0 HB3 LEU A 36 3.928 -21.937 -4.721 1.00 0.00 H new ATOM 0 HG LEU A 36 1.620 -21.833 -4.283 1.00 0.00 H new ATOM 0 HD11 LEU A 36 1.251 -23.708 -2.691 1.00 0.00 H new ATOM 0 HD12 LEU A 36 2.596 -24.012 -3.816 1.00 0.00 H new ATOM 0 HD13 LEU A 36 2.933 -23.537 -2.135 1.00 0.00 H new ATOM 0 HD21 LEU A 36 0.674 -21.499 -1.992 1.00 0.00 H new ATOM 0 HD22 LEU A 36 2.312 -21.135 -1.399 1.00 0.00 H new ATOM 0 HD23 LEU A 36 1.539 -20.063 -2.591 1.00 0.00 H new ATOM 602 N ALA A 37 6.694 -22.620 -3.817 1.00 0.00 N ATOM 603 CA ALA A 37 7.910 -22.831 -4.600 1.00 0.00 C ATOM 604 C ALA A 37 7.686 -24.076 -5.471 1.00 0.00 C ATOM 605 O ALA A 37 6.828 -24.885 -5.124 1.00 0.00 O ATOM 606 CB ALA A 37 9.079 -23.060 -3.634 1.00 0.00 C ATOM 0 H ALA A 37 6.294 -23.498 -3.486 1.00 0.00 H new ATOM 0 HA ALA A 37 8.137 -21.972 -5.231 1.00 0.00 H new ATOM 0 HB1 ALA A 37 9.995 -23.219 -4.203 1.00 0.00 H new ATOM 0 HB2 ALA A 37 9.197 -22.187 -2.993 1.00 0.00 H new ATOM 0 HB3 ALA A 37 8.877 -23.937 -3.019 1.00 0.00 H new ATOM 612 N PRO A 38 8.402 -24.281 -6.587 1.00 0.00 N ATOM 613 CA PRO A 38 8.240 -25.499 -7.376 1.00 0.00 C ATOM 614 C PRO A 38 8.803 -26.715 -6.614 1.00 0.00 C ATOM 615 O PRO A 38 9.766 -26.562 -5.855 1.00 0.00 O ATOM 616 CB PRO A 38 8.981 -25.233 -8.687 1.00 0.00 C ATOM 617 CG PRO A 38 10.040 -24.196 -8.310 1.00 0.00 C ATOM 618 CD PRO A 38 9.389 -23.393 -7.183 1.00 0.00 C ATOM 0 HA PRO A 38 7.194 -25.738 -7.569 1.00 0.00 H new ATOM 0 HB2 PRO A 38 9.435 -26.142 -9.080 1.00 0.00 H new ATOM 0 HB3 PRO A 38 8.308 -24.855 -9.456 1.00 0.00 H new ATOM 0 HG2 PRO A 38 10.964 -24.671 -7.979 1.00 0.00 H new ATOM 0 HG3 PRO A 38 10.295 -23.560 -9.158 1.00 0.00 H new ATOM 0 HD2 PRO A 38 10.129 -23.080 -6.447 1.00 0.00 H new ATOM 0 HD3 PRO A 38 8.920 -22.488 -7.568 1.00 0.00 H new ATOM 626 N PRO A 39 8.279 -27.937 -6.839 1.00 0.00 N ATOM 627 CA PRO A 39 8.832 -29.146 -6.231 1.00 0.00 C ATOM 628 C PRO A 39 10.265 -29.409 -6.713 1.00 0.00 C ATOM 629 O PRO A 39 11.047 -30.021 -5.987 1.00 0.00 O ATOM 630 CB PRO A 39 7.904 -30.296 -6.641 1.00 0.00 C ATOM 631 CG PRO A 39 7.269 -29.795 -7.932 1.00 0.00 C ATOM 632 CD PRO A 39 7.190 -28.280 -7.743 1.00 0.00 C ATOM 0 HA PRO A 39 8.886 -29.044 -5.147 1.00 0.00 H new ATOM 0 HB2 PRO A 39 8.457 -31.222 -6.798 1.00 0.00 H new ATOM 0 HB3 PRO A 39 7.154 -30.499 -5.877 1.00 0.00 H new ATOM 0 HG2 PRO A 39 7.872 -30.058 -8.801 1.00 0.00 H new ATOM 0 HG3 PRO A 39 6.281 -30.230 -8.086 1.00 0.00 H new ATOM 0 HD2 PRO A 39 7.294 -27.761 -8.696 1.00 0.00 H new ATOM 0 HD3 PRO A 39 6.227 -27.988 -7.324 1.00 0.00 H new ATOM 640 N SER A 40 10.612 -28.921 -7.910 1.00 0.00 N ATOM 641 CA SER A 40 11.859 -29.146 -8.626 1.00 0.00 C ATOM 642 C SER A 40 13.114 -28.846 -7.796 1.00 0.00 C ATOM 643 O SER A 40 14.175 -29.409 -8.068 1.00 0.00 O ATOM 644 CB SER A 40 11.835 -28.290 -9.908 1.00 0.00 C ATOM 645 OG SER A 40 10.527 -28.215 -10.457 1.00 0.00 O ATOM 0 H SER A 40 9.979 -28.317 -8.435 1.00 0.00 H new ATOM 0 HA SER A 40 11.923 -30.208 -8.862 1.00 0.00 H new ATOM 0 HB2 SER A 40 12.195 -27.286 -9.684 1.00 0.00 H new ATOM 0 HB3 SER A 40 12.516 -28.716 -10.644 1.00 0.00 H new ATOM 0 HG SER A 40 10.565 -27.778 -11.333 1.00 0.00 H new ATOM 651 N GLU A 41 13.010 -27.990 -6.772 1.00 0.00 N ATOM 652 CA GLU A 41 14.129 -27.613 -5.906 1.00 0.00 C ATOM 653 C GLU A 41 14.394 -28.621 -4.781 1.00 0.00 C ATOM 654 O GLU A 41 15.267 -28.409 -3.937 1.00 0.00 O ATOM 655 CB GLU A 41 13.886 -26.211 -5.323 1.00 0.00 C ATOM 656 CG GLU A 41 13.727 -25.118 -6.390 1.00 0.00 C ATOM 657 CD GLU A 41 13.543 -23.715 -5.780 1.00 0.00 C ATOM 658 OE1 GLU A 41 12.965 -23.589 -4.676 1.00 0.00 O ATOM 659 OE2 GLU A 41 13.982 -22.724 -6.409 1.00 0.00 O ATOM 0 H GLU A 41 12.133 -27.535 -6.520 1.00 0.00 H new ATOM 0 HA GLU A 41 15.024 -27.609 -6.528 1.00 0.00 H new ATOM 0 HB2 GLU A 41 12.989 -26.235 -4.704 1.00 0.00 H new ATOM 0 HB3 GLU A 41 14.718 -25.950 -4.669 1.00 0.00 H new ATOM 0 HG2 GLU A 41 14.605 -25.117 -7.037 1.00 0.00 H new ATOM 0 HG3 GLU A 41 12.868 -25.352 -7.019 1.00 0.00 H new ATOM 666 N VAL A 42 13.633 -29.708 -4.768 1.00 0.00 N ATOM 667 CA VAL A 42 13.576 -30.667 -3.668 1.00 0.00 C ATOM 668 C VAL A 42 13.457 -32.100 -4.189 1.00 0.00 C ATOM 669 O VAL A 42 14.272 -32.949 -3.822 1.00 0.00 O ATOM 670 CB VAL A 42 12.393 -30.339 -2.719 1.00 0.00 C ATOM 671 CG1 VAL A 42 12.511 -31.127 -1.404 1.00 0.00 C ATOM 672 CG2 VAL A 42 12.267 -28.846 -2.360 1.00 0.00 C ATOM 0 H VAL A 42 13.020 -29.955 -5.545 1.00 0.00 H new ATOM 0 HA VAL A 42 14.507 -30.587 -3.107 1.00 0.00 H new ATOM 0 HB VAL A 42 11.503 -30.627 -3.279 1.00 0.00 H new ATOM 0 HG11 VAL A 42 11.671 -30.880 -0.755 1.00 0.00 H new ATOM 0 HG12 VAL A 42 12.503 -32.196 -1.618 1.00 0.00 H new ATOM 0 HG13 VAL A 42 13.444 -30.864 -0.905 1.00 0.00 H new ATOM 0 HG21 VAL A 42 11.416 -28.702 -1.694 1.00 0.00 H new ATOM 0 HG22 VAL A 42 13.178 -28.513 -1.862 1.00 0.00 H new ATOM 0 HG23 VAL A 42 12.118 -28.264 -3.270 1.00 0.00 H new ATOM 682 N ALA A 43 12.455 -32.374 -5.026 1.00 0.00 N ATOM 683 CA ALA A 43 12.075 -33.728 -5.413 1.00 0.00 C ATOM 684 C ALA A 43 11.311 -33.748 -6.742 1.00 0.00 C ATOM 685 O ALA A 43 10.925 -32.706 -7.275 1.00 0.00 O ATOM 686 CB ALA A 43 11.198 -34.329 -4.299 1.00 0.00 C ATOM 0 H ALA A 43 11.879 -31.651 -5.458 1.00 0.00 H new ATOM 0 HA ALA A 43 12.982 -34.317 -5.550 1.00 0.00 H new ATOM 0 HB1 ALA A 43 10.905 -35.342 -4.573 1.00 0.00 H new ATOM 0 HB2 ALA A 43 11.761 -34.354 -3.366 1.00 0.00 H new ATOM 0 HB3 ALA A 43 10.306 -33.716 -4.168 1.00 0.00 H new ATOM 692 N GLY A 44 11.043 -34.953 -7.243 1.00 0.00 N ATOM 693 CA GLY A 44 10.182 -35.219 -8.385 1.00 0.00 C ATOM 694 C GLY A 44 9.954 -36.726 -8.502 1.00 0.00 C ATOM 695 O GLY A 44 10.598 -37.509 -7.795 1.00 0.00 O ATOM 0 H GLY A 44 11.439 -35.804 -6.844 1.00 0.00 H new ATOM 0 HA2 GLY A 44 9.229 -34.703 -8.265 1.00 0.00 H new ATOM 0 HA3 GLY A 44 10.639 -34.836 -9.297 1.00 0.00 H new ATOM 699 N ALA A 45 9.039 -37.136 -9.386 1.00 0.00 N ATOM 700 CA ALA A 45 8.721 -38.548 -9.608 1.00 0.00 C ATOM 701 C ALA A 45 9.897 -39.318 -10.231 1.00 0.00 C ATOM 702 O ALA A 45 9.973 -40.543 -10.103 1.00 0.00 O ATOM 703 CB ALA A 45 7.482 -38.655 -10.506 1.00 0.00 C ATOM 0 H ALA A 45 8.498 -36.497 -9.968 1.00 0.00 H new ATOM 0 HA ALA A 45 8.520 -39.003 -8.638 1.00 0.00 H new ATOM 0 HB1 ALA A 45 7.243 -39.705 -10.673 1.00 0.00 H new ATOM 0 HB2 ALA A 45 6.638 -38.163 -10.022 1.00 0.00 H new ATOM 0 HB3 ALA A 45 7.683 -38.172 -11.462 1.00 0.00 H new ATOM 709 N GLY A 46 10.807 -38.614 -10.904 1.00 0.00 N ATOM 710 CA GLY A 46 11.985 -39.145 -11.570 1.00 0.00 C ATOM 711 C GLY A 46 12.680 -38.005 -12.309 1.00 0.00 C ATOM 712 O GLY A 46 12.273 -36.844 -12.181 1.00 0.00 O ATOM 0 H GLY A 46 10.733 -37.601 -11.001 1.00 0.00 H new ATOM 0 HA2 GLY A 46 12.662 -39.593 -10.842 1.00 0.00 H new ATOM 0 HA3 GLY A 46 11.702 -39.932 -12.269 1.00 0.00 H new ATOM 716 N ALA A 47 13.717 -38.323 -13.087 1.00 0.00 N ATOM 717 CA ALA A 47 14.339 -37.369 -13.998 1.00 0.00 C ATOM 718 C ALA A 47 13.301 -36.956 -15.048 1.00 0.00 C ATOM 719 O ALA A 47 12.879 -37.784 -15.861 1.00 0.00 O ATOM 720 CB ALA A 47 15.585 -37.988 -14.644 1.00 0.00 C ATOM 0 H ALA A 47 14.146 -39.248 -13.101 1.00 0.00 H new ATOM 0 HA ALA A 47 14.667 -36.482 -13.456 1.00 0.00 H new ATOM 0 HB1 ALA A 47 16.040 -37.266 -15.322 1.00 0.00 H new ATOM 0 HB2 ALA A 47 16.301 -38.258 -13.868 1.00 0.00 H new ATOM 0 HB3 ALA A 47 15.300 -38.880 -15.202 1.00 0.00 H new ATOM 726 N ALA A 48 12.862 -35.696 -15.006 1.00 0.00 N ATOM 727 CA ALA A 48 11.883 -35.158 -15.943 1.00 0.00 C ATOM 728 C ALA A 48 12.467 -35.118 -17.362 1.00 0.00 C ATOM 729 O ALA A 48 13.682 -34.981 -17.537 1.00 0.00 O ATOM 730 CB ALA A 48 11.455 -33.758 -15.486 1.00 0.00 C ATOM 0 H ALA A 48 13.181 -35.018 -14.314 1.00 0.00 H new ATOM 0 HA ALA A 48 11.006 -35.805 -15.961 1.00 0.00 H new ATOM 0 HB1 ALA A 48 10.723 -33.355 -16.186 1.00 0.00 H new ATOM 0 HB2 ALA A 48 11.011 -33.819 -14.492 1.00 0.00 H new ATOM 0 HB3 ALA A 48 12.326 -33.103 -15.455 1.00 0.00 H new ATOM 736 N SER A 49 11.599 -35.189 -18.372 1.00 0.00 N ATOM 737 CA SER A 49 11.963 -35.022 -19.776 1.00 0.00 C ATOM 738 C SER A 49 12.518 -33.612 -20.013 1.00 0.00 C ATOM 739 O SER A 49 13.581 -33.448 -20.617 1.00 0.00 O ATOM 740 CB SER A 49 10.718 -35.296 -20.635 1.00 0.00 C ATOM 741 OG SER A 49 9.551 -34.736 -20.042 1.00 0.00 O ATOM 0 H SER A 49 10.605 -35.368 -18.232 1.00 0.00 H new ATOM 0 HA SER A 49 12.747 -35.726 -20.055 1.00 0.00 H new ATOM 0 HB2 SER A 49 10.860 -34.876 -21.631 1.00 0.00 H new ATOM 0 HB3 SER A 49 10.587 -36.371 -20.758 1.00 0.00 H new ATOM 0 HG SER A 49 8.774 -34.923 -20.609 1.00 0.00 H new ATOM 747 N VAL A 50 11.828 -32.611 -19.467 1.00 0.00 N ATOM 748 CA VAL A 50 12.223 -31.212 -19.379 1.00 0.00 C ATOM 749 C VAL A 50 11.689 -30.702 -18.039 1.00 0.00 C ATOM 750 O VAL A 50 10.671 -31.206 -17.554 1.00 0.00 O ATOM 751 CB VAL A 50 11.660 -30.392 -20.568 1.00 0.00 C ATOM 752 CG1 VAL A 50 12.386 -30.712 -21.883 1.00 0.00 C ATOM 753 CG2 VAL A 50 10.147 -30.575 -20.787 1.00 0.00 C ATOM 0 H VAL A 50 10.913 -32.772 -19.045 1.00 0.00 H new ATOM 0 HA VAL A 50 13.306 -31.104 -19.432 1.00 0.00 H new ATOM 0 HB VAL A 50 11.838 -29.354 -20.287 1.00 0.00 H new ATOM 0 HG11 VAL A 50 11.959 -30.115 -22.689 1.00 0.00 H new ATOM 0 HG12 VAL A 50 13.446 -30.478 -21.780 1.00 0.00 H new ATOM 0 HG13 VAL A 50 12.269 -31.771 -22.115 1.00 0.00 H new ATOM 0 HG21 VAL A 50 9.826 -29.971 -21.636 1.00 0.00 H new ATOM 0 HG22 VAL A 50 9.933 -31.625 -20.988 1.00 0.00 H new ATOM 0 HG23 VAL A 50 9.609 -30.259 -19.893 1.00 0.00 H new ATOM 763 N MET A 51 12.333 -29.691 -17.443 1.00 0.00 N ATOM 764 CA MET A 51 11.923 -29.159 -16.141 1.00 0.00 C ATOM 765 C MET A 51 10.473 -28.663 -16.142 1.00 0.00 C ATOM 766 O MET A 51 9.819 -28.683 -15.099 1.00 0.00 O ATOM 767 CB MET A 51 12.897 -28.071 -15.655 1.00 0.00 C ATOM 768 CG MET A 51 12.891 -26.796 -16.511 1.00 0.00 C ATOM 769 SD MET A 51 14.071 -25.536 -15.958 1.00 0.00 S ATOM 770 CE MET A 51 13.722 -24.243 -17.182 1.00 0.00 C ATOM 0 H MET A 51 13.145 -29.224 -17.846 1.00 0.00 H new ATOM 0 HA MET A 51 11.964 -29.985 -15.431 1.00 0.00 H new ATOM 0 HB2 MET A 51 12.647 -27.807 -14.628 1.00 0.00 H new ATOM 0 HB3 MET A 51 13.906 -28.482 -15.642 1.00 0.00 H new ATOM 0 HG2 MET A 51 13.116 -27.062 -17.544 1.00 0.00 H new ATOM 0 HG3 MET A 51 11.888 -26.369 -16.503 1.00 0.00 H new ATOM 0 HE1 MET A 51 14.363 -23.382 -16.994 1.00 0.00 H new ATOM 0 HE2 MET A 51 13.916 -24.628 -18.183 1.00 0.00 H new ATOM 0 HE3 MET A 51 12.677 -23.941 -17.105 1.00 0.00 H new ATOM 780 N SER A 52 9.936 -28.269 -17.298 1.00 0.00 N ATOM 781 CA SER A 52 8.555 -27.841 -17.460 1.00 0.00 C ATOM 782 C SER A 52 7.551 -28.903 -16.987 1.00 0.00 C ATOM 783 O SER A 52 6.490 -28.545 -16.483 1.00 0.00 O ATOM 784 CB SER A 52 8.319 -27.496 -18.937 1.00 0.00 C ATOM 785 OG SER A 52 9.430 -26.793 -19.480 1.00 0.00 O ATOM 0 H SER A 52 10.468 -28.240 -18.168 1.00 0.00 H new ATOM 0 HA SER A 52 8.391 -26.964 -16.834 1.00 0.00 H new ATOM 0 HB2 SER A 52 8.150 -28.411 -19.505 1.00 0.00 H new ATOM 0 HB3 SER A 52 7.418 -26.890 -19.033 1.00 0.00 H new ATOM 0 HG SER A 52 9.257 -26.586 -20.422 1.00 0.00 H new ATOM 791 N ALA A 53 7.888 -30.197 -17.085 1.00 0.00 N ATOM 792 CA ALA A 53 7.026 -31.292 -16.636 1.00 0.00 C ATOM 793 C ALA A 53 6.960 -31.409 -15.103 1.00 0.00 C ATOM 794 O ALA A 53 6.188 -32.221 -14.586 1.00 0.00 O ATOM 795 CB ALA A 53 7.519 -32.605 -17.256 1.00 0.00 C ATOM 0 H ALA A 53 8.773 -30.512 -17.481 1.00 0.00 H new ATOM 0 HA ALA A 53 6.011 -31.076 -16.970 1.00 0.00 H new ATOM 0 HB1 ALA A 53 6.882 -33.425 -16.926 1.00 0.00 H new ATOM 0 HB2 ALA A 53 7.481 -32.531 -18.343 1.00 0.00 H new ATOM 0 HB3 ALA A 53 8.545 -32.794 -16.941 1.00 0.00 H new ATOM 801 N LEU A 54 7.766 -30.632 -14.372 1.00 0.00 N ATOM 802 CA LEU A 54 7.894 -30.694 -12.916 1.00 0.00 C ATOM 803 C LEU A 54 7.726 -29.311 -12.275 1.00 0.00 C ATOM 804 O LEU A 54 7.386 -29.224 -11.101 1.00 0.00 O ATOM 805 CB LEU A 54 9.265 -31.312 -12.584 1.00 0.00 C ATOM 806 CG LEU A 54 9.542 -31.564 -11.088 1.00 0.00 C ATOM 807 CD1 LEU A 54 8.515 -32.503 -10.440 1.00 0.00 C ATOM 808 CD2 LEU A 54 10.942 -32.173 -10.942 1.00 0.00 C ATOM 0 H LEU A 54 8.365 -29.921 -14.792 1.00 0.00 H new ATOM 0 HA LEU A 54 7.100 -31.316 -12.502 1.00 0.00 H new ATOM 0 HB2 LEU A 54 9.354 -32.260 -13.115 1.00 0.00 H new ATOM 0 HB3 LEU A 54 10.043 -30.655 -12.973 1.00 0.00 H new ATOM 0 HG LEU A 54 9.469 -30.605 -10.575 1.00 0.00 H new ATOM 0 HD11 LEU A 54 8.762 -32.642 -9.388 1.00 0.00 H new ATOM 0 HD12 LEU A 54 7.520 -32.067 -10.524 1.00 0.00 H new ATOM 0 HD13 LEU A 54 8.533 -33.467 -10.948 1.00 0.00 H new ATOM 0 HD21 LEU A 54 11.151 -32.356 -9.888 1.00 0.00 H new ATOM 0 HD22 LEU A 54 10.988 -33.114 -11.490 1.00 0.00 H new ATOM 0 HD23 LEU A 54 11.683 -31.482 -11.344 1.00 0.00 H new ATOM 820 N THR A 55 7.870 -28.228 -13.042 1.00 0.00 N ATOM 821 CA THR A 55 7.885 -26.853 -12.544 1.00 0.00 C ATOM 822 C THR A 55 6.564 -26.155 -12.886 1.00 0.00 C ATOM 823 O THR A 55 6.336 -24.983 -12.595 1.00 0.00 O ATOM 824 CB THR A 55 9.146 -26.162 -13.099 1.00 0.00 C ATOM 825 OG1 THR A 55 10.270 -27.020 -12.972 1.00 0.00 O ATOM 826 CG2 THR A 55 9.535 -24.854 -12.406 1.00 0.00 C ATOM 0 H THR A 55 7.982 -28.286 -14.054 1.00 0.00 H new ATOM 0 HA THR A 55 7.949 -26.810 -11.457 1.00 0.00 H new ATOM 0 HB THR A 55 8.885 -25.935 -14.133 1.00 0.00 H new ATOM 0 HG1 THR A 55 10.224 -27.722 -13.654 1.00 0.00 H new ATOM 0 HG21 THR A 55 10.434 -24.449 -12.871 1.00 0.00 H new ATOM 0 HG22 THR A 55 8.721 -24.135 -12.503 1.00 0.00 H new ATOM 0 HG23 THR A 55 9.727 -25.045 -11.350 1.00 0.00 H new ATOM 834 N ASP A 56 5.650 -26.941 -13.443 1.00 0.00 N ATOM 835 CA ASP A 56 4.248 -26.624 -13.671 1.00 0.00 C ATOM 836 C ASP A 56 3.375 -27.026 -12.470 1.00 0.00 C ATOM 837 O ASP A 56 2.159 -27.184 -12.577 1.00 0.00 O ATOM 838 CB ASP A 56 3.744 -27.272 -14.968 1.00 0.00 C ATOM 839 CG ASP A 56 3.478 -28.783 -14.829 1.00 0.00 C ATOM 840 OD1 ASP A 56 4.227 -29.475 -14.101 1.00 0.00 O ATOM 841 OD2 ASP A 56 2.525 -29.289 -15.466 1.00 0.00 O ATOM 0 H ASP A 56 5.886 -27.878 -13.768 1.00 0.00 H new ATOM 0 HA ASP A 56 4.167 -25.543 -13.782 1.00 0.00 H new ATOM 0 HB2 ASP A 56 2.826 -26.775 -15.281 1.00 0.00 H new ATOM 0 HB3 ASP A 56 4.479 -27.110 -15.757 1.00 0.00 H new ATOM 846 N LYS A 57 4.026 -27.197 -11.324 1.00 0.00 N ATOM 847 CA LYS A 57 3.521 -27.650 -10.032 1.00 0.00 C ATOM 848 C LYS A 57 4.120 -26.757 -8.958 1.00 0.00 C ATOM 849 O LYS A 57 5.055 -26.001 -9.240 1.00 0.00 O ATOM 850 CB LYS A 57 3.978 -29.093 -9.788 1.00 0.00 C ATOM 851 CG LYS A 57 3.237 -30.072 -10.694 1.00 0.00 C ATOM 852 CD LYS A 57 4.015 -31.388 -10.818 1.00 0.00 C ATOM 853 CE LYS A 57 3.361 -32.342 -11.831 1.00 0.00 C ATOM 854 NZ LYS A 57 3.700 -32.012 -13.238 1.00 0.00 N ATOM 0 H LYS A 57 5.026 -27.001 -11.272 1.00 0.00 H new ATOM 0 HA LYS A 57 2.432 -27.605 -10.012 1.00 0.00 H new ATOM 0 HB2 LYS A 57 5.051 -29.171 -9.965 1.00 0.00 H new ATOM 0 HB3 LYS A 57 3.807 -29.359 -8.745 1.00 0.00 H new ATOM 0 HG2 LYS A 57 2.243 -30.267 -10.291 1.00 0.00 H new ATOM 0 HG3 LYS A 57 3.100 -29.630 -11.681 1.00 0.00 H new ATOM 0 HD2 LYS A 57 5.039 -31.178 -11.125 1.00 0.00 H new ATOM 0 HD3 LYS A 57 4.068 -31.873 -9.843 1.00 0.00 H new ATOM 0 HE2 LYS A 57 3.676 -33.363 -11.617 1.00 0.00 H new ATOM 0 HE3 LYS A 57 2.279 -32.310 -11.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 2.988 -32.426 -13.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 3.713 -30.979 -13.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 4.637 -32.399 -13.469 1.00 0.00 H new ATOM 868 N ALA A 58 3.648 -26.888 -7.722 1.00 0.00 N ATOM 869 CA ALA A 58 4.192 -26.129 -6.600 1.00 0.00 C ATOM 870 C ALA A 58 4.067 -26.903 -5.297 1.00 0.00 C ATOM 871 O ALA A 58 3.401 -27.929 -5.221 1.00 0.00 O ATOM 872 CB ALA A 58 3.521 -24.749 -6.516 1.00 0.00 C ATOM 0 H ALA A 58 2.885 -27.517 -7.471 1.00 0.00 H new ATOM 0 HA ALA A 58 5.257 -25.973 -6.771 1.00 0.00 H new ATOM 0 HB1 ALA A 58 3.936 -24.193 -5.675 1.00 0.00 H new ATOM 0 HB2 ALA A 58 3.703 -24.199 -7.439 1.00 0.00 H new ATOM 0 HB3 ALA A 58 2.448 -24.874 -6.374 1.00 0.00 H new ATOM 878 N ILE A 59 4.724 -26.421 -4.253 1.00 0.00 N ATOM 879 CA ILE A 59 4.722 -26.979 -2.916 1.00 0.00 C ATOM 880 C ILE A 59 4.848 -25.801 -1.948 1.00 0.00 C ATOM 881 O ILE A 59 5.372 -24.749 -2.325 1.00 0.00 O ATOM 882 CB ILE A 59 5.863 -28.018 -2.757 1.00 0.00 C ATOM 883 CG1 ILE A 59 7.271 -27.390 -2.699 1.00 0.00 C ATOM 884 CG2 ILE A 59 5.814 -29.120 -3.834 1.00 0.00 C ATOM 885 CD1 ILE A 59 8.307 -28.421 -2.255 1.00 0.00 C ATOM 0 H ILE A 59 5.303 -25.584 -4.323 1.00 0.00 H new ATOM 0 HA ILE A 59 3.802 -27.524 -2.705 1.00 0.00 H new ATOM 0 HB ILE A 59 5.678 -28.478 -1.786 1.00 0.00 H new ATOM 0 HG12 ILE A 59 7.540 -26.997 -3.680 1.00 0.00 H new ATOM 0 HG13 ILE A 59 7.270 -26.548 -2.007 1.00 0.00 H new ATOM 0 HG21 ILE A 59 6.634 -29.820 -3.676 1.00 0.00 H new ATOM 0 HG22 ILE A 59 4.865 -29.652 -3.767 1.00 0.00 H new ATOM 0 HG23 ILE A 59 5.908 -28.668 -4.821 1.00 0.00 H new ATOM 0 HD11 ILE A 59 9.292 -27.956 -2.221 1.00 0.00 H new ATOM 0 HD12 ILE A 59 8.048 -28.794 -1.264 1.00 0.00 H new ATOM 0 HD13 ILE A 59 8.321 -29.250 -2.962 1.00 0.00 H new ATOM 897 N VAL A 60 4.377 -25.953 -0.714 1.00 0.00 N ATOM 898 CA VAL A 60 4.522 -24.916 0.301 1.00 0.00 C ATOM 899 C VAL A 60 5.918 -25.095 0.904 1.00 0.00 C ATOM 900 O VAL A 60 6.284 -26.203 1.306 1.00 0.00 O ATOM 901 CB VAL A 60 3.400 -25.030 1.350 1.00 0.00 C ATOM 902 CG1 VAL A 60 3.455 -23.858 2.342 1.00 0.00 C ATOM 903 CG2 VAL A 60 1.998 -25.044 0.717 1.00 0.00 C ATOM 0 H VAL A 60 3.889 -26.789 -0.392 1.00 0.00 H new ATOM 0 HA VAL A 60 4.429 -23.915 -0.120 1.00 0.00 H new ATOM 0 HB VAL A 60 3.568 -25.978 1.862 1.00 0.00 H new ATOM 0 HG11 VAL A 60 2.653 -23.962 3.072 1.00 0.00 H new ATOM 0 HG12 VAL A 60 4.416 -23.861 2.856 1.00 0.00 H new ATOM 0 HG13 VAL A 60 3.335 -22.919 1.802 1.00 0.00 H new ATOM 0 HG21 VAL A 60 1.245 -25.126 1.501 1.00 0.00 H new ATOM 0 HG22 VAL A 60 1.842 -24.121 0.159 1.00 0.00 H new ATOM 0 HG23 VAL A 60 1.912 -25.895 0.042 1.00 0.00 H new ATOM 913 N LYS A 61 6.695 -24.017 0.980 1.00 0.00 N ATOM 914 CA LYS A 61 8.103 -24.017 1.374 1.00 0.00 C ATOM 915 C LYS A 61 8.319 -22.861 2.351 1.00 0.00 C ATOM 916 O LYS A 61 7.537 -21.908 2.352 1.00 0.00 O ATOM 917 CB LYS A 61 8.942 -23.866 0.087 1.00 0.00 C ATOM 918 CG LYS A 61 10.414 -24.292 0.226 1.00 0.00 C ATOM 919 CD LYS A 61 11.178 -24.014 -1.078 1.00 0.00 C ATOM 920 CE LYS A 61 12.593 -24.596 -1.042 1.00 0.00 C ATOM 921 NZ LYS A 61 13.512 -23.936 -2.001 1.00 0.00 N ATOM 0 H LYS A 61 6.348 -23.083 0.760 1.00 0.00 H new ATOM 0 HA LYS A 61 8.403 -24.938 1.874 1.00 0.00 H new ATOM 0 HB2 LYS A 61 8.480 -24.457 -0.703 1.00 0.00 H new ATOM 0 HB3 LYS A 61 8.908 -22.825 -0.233 1.00 0.00 H new ATOM 0 HG2 LYS A 61 10.879 -23.751 1.050 1.00 0.00 H new ATOM 0 HG3 LYS A 61 10.471 -25.353 0.469 1.00 0.00 H new ATOM 0 HD2 LYS A 61 10.631 -24.441 -1.918 1.00 0.00 H new ATOM 0 HD3 LYS A 61 11.231 -22.938 -1.246 1.00 0.00 H new ATOM 0 HE2 LYS A 61 12.996 -24.497 -0.034 1.00 0.00 H new ATOM 0 HE3 LYS A 61 12.548 -25.662 -1.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 14.290 -24.584 -2.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 12.991 -23.688 -2.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 13.900 -23.072 -1.571 1.00 0.00 H new ATOM 935 N LYS A 62 9.380 -22.912 3.159 1.00 0.00 N ATOM 936 CA LYS A 62 9.754 -21.854 4.096 1.00 0.00 C ATOM 937 C LYS A 62 11.212 -21.507 3.829 1.00 0.00 C ATOM 938 O LYS A 62 12.034 -22.418 3.724 1.00 0.00 O ATOM 939 CB LYS A 62 9.525 -22.342 5.537 1.00 0.00 C ATOM 940 CG LYS A 62 9.908 -21.303 6.604 1.00 0.00 C ATOM 941 CD LYS A 62 9.524 -21.799 8.008 1.00 0.00 C ATOM 942 CE LYS A 62 10.028 -20.870 9.124 1.00 0.00 C ATOM 943 NZ LYS A 62 11.486 -21.014 9.388 1.00 0.00 N ATOM 0 H LYS A 62 10.017 -23.709 3.179 1.00 0.00 H new ATOM 0 HA LYS A 62 9.145 -20.959 3.964 1.00 0.00 H new ATOM 0 HB2 LYS A 62 8.475 -22.607 5.660 1.00 0.00 H new ATOM 0 HB3 LYS A 62 10.105 -23.250 5.701 1.00 0.00 H new ATOM 0 HG2 LYS A 62 10.980 -21.109 6.562 1.00 0.00 H new ATOM 0 HG3 LYS A 62 9.405 -20.359 6.396 1.00 0.00 H new ATOM 0 HD2 LYS A 62 8.439 -21.885 8.074 1.00 0.00 H new ATOM 0 HD3 LYS A 62 9.933 -22.798 8.160 1.00 0.00 H new ATOM 0 HE2 LYS A 62 9.814 -19.836 8.853 1.00 0.00 H new ATOM 0 HE3 LYS A 62 9.476 -21.080 10.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 11.767 -20.363 10.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 11.692 -21.992 9.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 12.019 -20.787 8.524 1.00 0.00 H new ATOM 957 N GLU A 63 11.530 -20.221 3.695 1.00 0.00 N ATOM 958 CA GLU A 63 12.833 -19.726 3.259 1.00 0.00 C ATOM 959 C GLU A 63 13.070 -18.345 3.875 1.00 0.00 C ATOM 960 O GLU A 63 12.141 -17.703 4.371 1.00 0.00 O ATOM 961 CB GLU A 63 12.893 -19.633 1.719 1.00 0.00 C ATOM 962 CG GLU A 63 12.849 -21.010 1.040 1.00 0.00 C ATOM 963 CD GLU A 63 13.157 -20.940 -0.458 1.00 0.00 C ATOM 964 OE1 GLU A 63 12.307 -20.441 -1.223 1.00 0.00 O ATOM 965 OE2 GLU A 63 14.201 -21.480 -0.889 1.00 0.00 O ATOM 0 H GLU A 63 10.867 -19.472 3.893 1.00 0.00 H new ATOM 0 HA GLU A 63 13.608 -20.418 3.588 1.00 0.00 H new ATOM 0 HB2 GLU A 63 12.058 -19.030 1.363 1.00 0.00 H new ATOM 0 HB3 GLU A 63 13.807 -19.117 1.426 1.00 0.00 H new ATOM 0 HG2 GLU A 63 13.567 -21.672 1.524 1.00 0.00 H new ATOM 0 HG3 GLU A 63 11.862 -21.450 1.184 1.00 0.00 H new ATOM 972 N LEU A 64 14.322 -17.889 3.873 1.00 0.00 N ATOM 973 CA LEU A 64 14.696 -16.565 4.356 1.00 0.00 C ATOM 974 C LEU A 64 14.124 -15.508 3.405 1.00 0.00 C ATOM 975 O LEU A 64 14.314 -15.608 2.191 1.00 0.00 O ATOM 976 CB LEU A 64 16.233 -16.486 4.414 1.00 0.00 C ATOM 977 CG LEU A 64 16.774 -15.261 5.174 1.00 0.00 C ATOM 978 CD1 LEU A 64 16.664 -15.448 6.692 1.00 0.00 C ATOM 979 CD2 LEU A 64 18.251 -15.057 4.820 1.00 0.00 C ATOM 0 H LEU A 64 15.112 -18.436 3.532 1.00 0.00 H new ATOM 0 HA LEU A 64 14.294 -16.383 5.353 1.00 0.00 H new ATOM 0 HB2 LEU A 64 16.614 -17.391 4.887 1.00 0.00 H new ATOM 0 HB3 LEU A 64 16.623 -16.470 3.396 1.00 0.00 H new ATOM 0 HG LEU A 64 16.178 -14.396 4.882 1.00 0.00 H new ATOM 0 HD11 LEU A 64 17.055 -14.565 7.197 1.00 0.00 H new ATOM 0 HD12 LEU A 64 15.619 -15.590 6.966 1.00 0.00 H new ATOM 0 HD13 LEU A 64 17.240 -16.323 6.994 1.00 0.00 H new ATOM 0 HD21 LEU A 64 18.637 -14.190 5.356 1.00 0.00 H new ATOM 0 HD22 LEU A 64 18.819 -15.943 5.105 1.00 0.00 H new ATOM 0 HD23 LEU A 64 18.349 -14.893 3.747 1.00 0.00 H new ATOM 991 N LEU A 65 13.468 -14.476 3.947 1.00 0.00 N ATOM 992 CA LEU A 65 12.825 -13.407 3.177 1.00 0.00 C ATOM 993 C LEU A 65 13.804 -12.775 2.202 1.00 0.00 C ATOM 994 O LEU A 65 13.428 -12.495 1.068 1.00 0.00 O ATOM 995 CB LEU A 65 12.229 -12.348 4.129 1.00 0.00 C ATOM 996 CG LEU A 65 11.450 -11.219 3.405 1.00 0.00 C ATOM 997 CD1 LEU A 65 10.347 -10.661 4.317 1.00 0.00 C ATOM 998 CD2 LEU A 65 12.329 -10.012 3.030 1.00 0.00 C ATOM 0 H LEU A 65 13.368 -14.359 4.955 1.00 0.00 H new ATOM 0 HA LEU A 65 12.013 -13.841 2.594 1.00 0.00 H new ATOM 0 HB2 LEU A 65 11.561 -12.843 4.834 1.00 0.00 H new ATOM 0 HB3 LEU A 65 13.035 -11.903 4.712 1.00 0.00 H new ATOM 0 HG LEU A 65 11.057 -11.683 2.501 1.00 0.00 H new ATOM 0 HD11 LEU A 65 9.809 -9.870 3.795 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.653 -11.460 4.579 1.00 0.00 H new ATOM 0 HD13 LEU A 65 10.795 -10.257 5.225 1.00 0.00 H new ATOM 0 HD21 LEU A 65 11.720 -9.261 2.527 1.00 0.00 H new ATOM 0 HD22 LEU A 65 12.762 -9.583 3.933 1.00 0.00 H new ATOM 0 HD23 LEU A 65 13.128 -10.337 2.364 1.00 0.00 H new ATOM 1010 N TYR A 66 15.049 -12.561 2.631 1.00 0.00 N ATOM 1011 CA TYR A 66 16.033 -11.811 1.861 1.00 0.00 C ATOM 1012 C TYR A 66 16.337 -12.489 0.518 1.00 0.00 C ATOM 1013 O TYR A 66 16.674 -11.798 -0.444 1.00 0.00 O ATOM 1014 CB TYR A 66 17.317 -11.623 2.688 1.00 0.00 C ATOM 1015 CG TYR A 66 17.162 -11.133 4.126 1.00 0.00 C ATOM 1016 CD1 TYR A 66 16.044 -10.378 4.545 1.00 0.00 C ATOM 1017 CD2 TYR A 66 18.169 -11.439 5.062 1.00 0.00 C ATOM 1018 CE1 TYR A 66 15.922 -9.959 5.882 1.00 0.00 C ATOM 1019 CE2 TYR A 66 18.054 -11.030 6.401 1.00 0.00 C ATOM 1020 CZ TYR A 66 16.926 -10.289 6.821 1.00 0.00 C ATOM 1021 OH TYR A 66 16.826 -9.896 8.122 1.00 0.00 O ATOM 0 H TYR A 66 15.400 -12.905 3.525 1.00 0.00 H new ATOM 0 HA TYR A 66 15.613 -10.830 1.637 1.00 0.00 H new ATOM 0 HB2 TYR A 66 17.845 -12.577 2.712 1.00 0.00 H new ATOM 0 HB3 TYR A 66 17.958 -10.918 2.159 1.00 0.00 H new ATOM 0 HD1 TYR A 66 15.275 -10.120 3.832 1.00 0.00 H new ATOM 0 HD2 TYR A 66 19.040 -11.995 4.747 1.00 0.00 H new ATOM 0 HE1 TYR A 66 15.061 -9.385 6.191 1.00 0.00 H new ATOM 0 HE2 TYR A 66 18.828 -11.282 7.110 1.00 0.00 H new ATOM 0 HH TYR A 66 17.607 -10.214 8.621 1.00 0.00 H new ATOM 1031 N ASP A 67 16.195 -13.817 0.427 1.00 0.00 N ATOM 1032 CA ASP A 67 16.366 -14.535 -0.835 1.00 0.00 C ATOM 1033 C ASP A 67 15.159 -14.308 -1.745 1.00 0.00 C ATOM 1034 O ASP A 67 15.325 -13.990 -2.922 1.00 0.00 O ATOM 1035 CB ASP A 67 16.549 -16.035 -0.586 1.00 0.00 C ATOM 1036 CG ASP A 67 16.707 -16.779 -1.922 1.00 0.00 C ATOM 1037 OD1 ASP A 67 17.809 -16.729 -2.515 1.00 0.00 O ATOM 1038 OD2 ASP A 67 15.742 -17.430 -2.378 1.00 0.00 O ATOM 0 H ASP A 67 15.961 -14.416 1.219 1.00 0.00 H new ATOM 0 HA ASP A 67 17.260 -14.149 -1.324 1.00 0.00 H new ATOM 0 HB2 ASP A 67 17.427 -16.203 0.038 1.00 0.00 H new ATOM 0 HB3 ASP A 67 15.690 -16.428 -0.042 1.00 0.00 H new ATOM 1043 N VAL A 68 13.944 -14.406 -1.194 1.00 0.00 N ATOM 1044 CA VAL A 68 12.699 -14.231 -1.942 1.00 0.00 C ATOM 1045 C VAL A 68 12.606 -12.787 -2.467 1.00 0.00 C ATOM 1046 O VAL A 68 12.240 -12.559 -3.623 1.00 0.00 O ATOM 1047 CB VAL A 68 11.490 -14.631 -1.059 1.00 0.00 C ATOM 1048 CG1 VAL A 68 10.226 -14.772 -1.916 1.00 0.00 C ATOM 1049 CG2 VAL A 68 11.707 -15.984 -0.353 1.00 0.00 C ATOM 0 H VAL A 68 13.798 -14.611 -0.206 1.00 0.00 H new ATOM 0 HA VAL A 68 12.687 -14.889 -2.811 1.00 0.00 H new ATOM 0 HB VAL A 68 11.383 -13.842 -0.315 1.00 0.00 H new ATOM 0 HG11 VAL A 68 9.386 -15.053 -1.281 1.00 0.00 H new ATOM 0 HG12 VAL A 68 10.010 -13.822 -2.404 1.00 0.00 H new ATOM 0 HG13 VAL A 68 10.383 -15.541 -2.672 1.00 0.00 H new ATOM 0 HG21 VAL A 68 10.833 -16.222 0.254 1.00 0.00 H new ATOM 0 HG22 VAL A 68 11.854 -16.765 -1.100 1.00 0.00 H new ATOM 0 HG23 VAL A 68 12.588 -15.924 0.286 1.00 0.00 H new ATOM 1059 N ALA A 69 13.027 -11.815 -1.652 1.00 0.00 N ATOM 1060 CA ALA A 69 13.116 -10.403 -2.002 1.00 0.00 C ATOM 1061 C ALA A 69 14.104 -10.125 -3.140 1.00 0.00 C ATOM 1062 O ALA A 69 14.108 -9.014 -3.674 1.00 0.00 O ATOM 1063 CB ALA A 69 13.514 -9.607 -0.754 1.00 0.00 C ATOM 0 H ALA A 69 13.325 -12.002 -0.695 1.00 0.00 H new ATOM 0 HA ALA A 69 12.136 -10.092 -2.364 1.00 0.00 H new ATOM 0 HB1 ALA A 69 13.584 -8.548 -1.004 1.00 0.00 H new ATOM 0 HB2 ALA A 69 12.762 -9.747 0.022 1.00 0.00 H new ATOM 0 HB3 ALA A 69 14.480 -9.958 -0.391 1.00 0.00 H new ATOM 1069 N GLY A 70 14.942 -11.086 -3.537 1.00 0.00 N ATOM 1070 CA GLY A 70 15.854 -10.947 -4.665 1.00 0.00 C ATOM 1071 C GLY A 70 15.135 -10.923 -6.020 1.00 0.00 C ATOM 1072 O GLY A 70 15.779 -10.623 -7.026 1.00 0.00 O ATOM 0 H GLY A 70 15.004 -11.993 -3.075 1.00 0.00 H new ATOM 0 HA2 GLY A 70 16.429 -10.028 -4.549 1.00 0.00 H new ATOM 0 HA3 GLY A 70 16.566 -11.772 -4.653 1.00 0.00 H new ATOM 1076 N SER A 71 13.833 -11.237 -6.062 1.00 0.00 N ATOM 1077 CA SER A 71 13.058 -11.354 -7.293 1.00 0.00 C ATOM 1078 C SER A 71 13.114 -10.075 -8.142 1.00 0.00 C ATOM 1079 O SER A 71 13.507 -10.127 -9.309 1.00 0.00 O ATOM 1080 CB SER A 71 11.616 -11.725 -6.944 1.00 0.00 C ATOM 1081 OG SER A 71 11.546 -12.956 -6.232 1.00 0.00 O ATOM 0 H SER A 71 13.284 -11.419 -5.222 1.00 0.00 H new ATOM 0 HA SER A 71 13.499 -12.142 -7.903 1.00 0.00 H new ATOM 0 HB2 SER A 71 11.171 -10.932 -6.343 1.00 0.00 H new ATOM 0 HB3 SER A 71 11.028 -11.800 -7.859 1.00 0.00 H new ATOM 0 HG SER A 71 11.889 -12.828 -5.323 1.00 0.00 H new ATOM 1087 N ASP A 72 12.768 -8.930 -7.548 1.00 0.00 N ATOM 1088 CA ASP A 72 12.949 -7.591 -8.107 1.00 0.00 C ATOM 1089 C ASP A 72 12.829 -6.544 -7.009 1.00 0.00 C ATOM 1090 O ASP A 72 13.734 -5.728 -6.839 1.00 0.00 O ATOM 1091 CB ASP A 72 11.915 -7.295 -9.198 1.00 0.00 C ATOM 1092 CG ASP A 72 12.122 -5.883 -9.769 1.00 0.00 C ATOM 1093 OD1 ASP A 72 13.132 -5.655 -10.473 1.00 0.00 O ATOM 1094 OD2 ASP A 72 11.267 -5.001 -9.536 1.00 0.00 O ATOM 0 H ASP A 72 12.335 -8.912 -6.624 1.00 0.00 H new ATOM 0 HA ASP A 72 13.944 -7.552 -8.551 1.00 0.00 H new ATOM 0 HB2 ASP A 72 11.999 -8.032 -9.996 1.00 0.00 H new ATOM 0 HB3 ASP A 72 10.909 -7.383 -8.787 1.00 0.00 H new ATOM 1099 N LYS A 73 11.765 -6.639 -6.211 1.00 0.00 N ATOM 1100 CA LYS A 73 11.521 -5.886 -4.978 1.00 0.00 C ATOM 1101 C LYS A 73 10.357 -6.561 -4.243 1.00 0.00 C ATOM 1102 O LYS A 73 9.865 -7.588 -4.715 1.00 0.00 O ATOM 1103 CB LYS A 73 11.270 -4.393 -5.290 1.00 0.00 C ATOM 1104 CG LYS A 73 9.968 -4.100 -6.058 1.00 0.00 C ATOM 1105 CD LYS A 73 9.821 -2.624 -6.459 1.00 0.00 C ATOM 1106 CE LYS A 73 9.690 -1.694 -5.243 1.00 0.00 C ATOM 1107 NZ LYS A 73 9.502 -0.275 -5.641 1.00 0.00 N ATOM 0 H LYS A 73 11.003 -7.283 -6.420 1.00 0.00 H new ATOM 0 HA LYS A 73 12.394 -5.900 -4.326 1.00 0.00 H new ATOM 0 HB2 LYS A 73 11.253 -3.839 -4.352 1.00 0.00 H new ATOM 0 HB3 LYS A 73 12.110 -4.012 -5.870 1.00 0.00 H new ATOM 0 HG2 LYS A 73 9.936 -4.718 -6.955 1.00 0.00 H new ATOM 0 HG3 LYS A 73 9.117 -4.389 -5.441 1.00 0.00 H new ATOM 0 HD2 LYS A 73 10.686 -2.324 -7.050 1.00 0.00 H new ATOM 0 HD3 LYS A 73 8.944 -2.510 -7.096 1.00 0.00 H new ATOM 0 HE2 LYS A 73 8.845 -2.013 -4.632 1.00 0.00 H new ATOM 0 HE3 LYS A 73 10.582 -1.781 -4.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 9.418 0.316 -4.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 10.319 0.039 -6.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 8.636 -0.186 -6.211 1.00 0.00 H new ATOM 1121 N TYR A 74 9.885 -6.018 -3.121 1.00 0.00 N ATOM 1122 CA TYR A 74 8.744 -6.569 -2.390 1.00 0.00 C ATOM 1123 C TYR A 74 8.018 -5.460 -1.626 1.00 0.00 C ATOM 1124 O TYR A 74 8.568 -4.367 -1.457 1.00 0.00 O ATOM 1125 CB TYR A 74 9.221 -7.677 -1.438 1.00 0.00 C ATOM 1126 CG TYR A 74 10.008 -7.184 -0.231 1.00 0.00 C ATOM 1127 CD1 TYR A 74 11.376 -6.864 -0.345 1.00 0.00 C ATOM 1128 CD2 TYR A 74 9.354 -6.993 1.002 1.00 0.00 C ATOM 1129 CE1 TYR A 74 12.083 -6.355 0.761 1.00 0.00 C ATOM 1130 CE2 TYR A 74 10.050 -6.484 2.111 1.00 0.00 C ATOM 1131 CZ TYR A 74 11.420 -6.155 1.994 1.00 0.00 C ATOM 1132 OH TYR A 74 12.095 -5.630 3.056 1.00 0.00 O ATOM 0 H TYR A 74 10.284 -5.182 -2.693 1.00 0.00 H new ATOM 0 HA TYR A 74 8.039 -7.004 -3.098 1.00 0.00 H new ATOM 0 HB2 TYR A 74 8.352 -8.233 -1.086 1.00 0.00 H new ATOM 0 HB3 TYR A 74 9.842 -8.376 -1.998 1.00 0.00 H new ATOM 0 HD1 TYR A 74 11.885 -7.010 -1.286 1.00 0.00 H new ATOM 0 HD2 TYR A 74 8.307 -7.240 1.096 1.00 0.00 H new ATOM 0 HE1 TYR A 74 13.132 -6.117 0.668 1.00 0.00 H new ATOM 0 HE2 TYR A 74 9.539 -6.344 3.052 1.00 0.00 H new ATOM 0 HH TYR A 74 11.491 -5.558 3.824 1.00 0.00 H new ATOM 1142 N GLN A 75 6.798 -5.741 -1.158 1.00 0.00 N ATOM 1143 CA GLN A 75 5.973 -4.838 -0.357 1.00 0.00 C ATOM 1144 C GLN A 75 5.112 -5.665 0.603 1.00 0.00 C ATOM 1145 O GLN A 75 4.692 -6.768 0.253 1.00 0.00 O ATOM 1146 CB GLN A 75 5.034 -4.013 -1.260 1.00 0.00 C ATOM 1147 CG GLN A 75 5.743 -3.087 -2.261 1.00 0.00 C ATOM 1148 CD GLN A 75 4.734 -2.254 -3.051 1.00 0.00 C ATOM 1149 OE1 GLN A 75 4.500 -1.083 -2.758 1.00 0.00 O ATOM 1150 NE2 GLN A 75 4.107 -2.833 -4.064 1.00 0.00 N ATOM 0 H GLN A 75 6.343 -6.637 -1.334 1.00 0.00 H new ATOM 0 HA GLN A 75 6.630 -4.164 0.192 1.00 0.00 H new ATOM 0 HB2 GLN A 75 4.392 -4.698 -1.814 1.00 0.00 H new ATOM 0 HB3 GLN A 75 4.384 -3.409 -0.627 1.00 0.00 H new ATOM 0 HG2 GLN A 75 6.427 -2.426 -1.728 1.00 0.00 H new ATOM 0 HG3 GLN A 75 6.345 -3.682 -2.948 1.00 0.00 H new ATOM 0 HE21 GLN A 75 4.308 -3.805 -4.300 1.00 0.00 H new ATOM 0 HE22 GLN A 75 3.423 -2.307 -4.608 1.00 0.00 H new ATOM 1159 N VAL A 76 4.818 -5.142 1.796 1.00 0.00 N ATOM 1160 CA VAL A 76 3.788 -5.720 2.658 1.00 0.00 C ATOM 1161 C VAL A 76 2.450 -5.252 2.077 1.00 0.00 C ATOM 1162 O VAL A 76 2.293 -4.070 1.751 1.00 0.00 O ATOM 1163 CB VAL A 76 4.017 -5.359 4.146 1.00 0.00 C ATOM 1164 CG1 VAL A 76 4.410 -3.896 4.419 1.00 0.00 C ATOM 1165 CG2 VAL A 76 2.817 -5.719 5.033 1.00 0.00 C ATOM 0 H VAL A 76 5.279 -4.320 2.185 1.00 0.00 H new ATOM 0 HA VAL A 76 3.813 -6.810 2.667 1.00 0.00 H new ATOM 0 HB VAL A 76 4.877 -5.975 4.409 1.00 0.00 H new ATOM 0 HG11 VAL A 76 4.546 -3.750 5.491 1.00 0.00 H new ATOM 0 HG12 VAL A 76 5.341 -3.666 3.900 1.00 0.00 H new ATOM 0 HG13 VAL A 76 3.622 -3.234 4.060 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.032 -5.444 6.066 1.00 0.00 H new ATOM 0 HG22 VAL A 76 1.935 -5.178 4.690 1.00 0.00 H new ATOM 0 HG23 VAL A 76 2.630 -6.791 4.974 1.00 0.00 H new ATOM 1175 N ASN A 77 1.499 -6.172 1.901 1.00 0.00 N ATOM 1176 CA ASN A 77 0.212 -5.887 1.266 1.00 0.00 C ATOM 1177 C ASN A 77 -0.852 -6.810 1.854 1.00 0.00 C ATOM 1178 O ASN A 77 -1.260 -7.793 1.235 1.00 0.00 O ATOM 1179 CB ASN A 77 0.304 -6.001 -0.268 1.00 0.00 C ATOM 1180 CG ASN A 77 -0.993 -5.571 -0.963 1.00 0.00 C ATOM 1181 OD1 ASN A 77 -1.993 -5.224 -0.340 1.00 0.00 O ATOM 1182 ND2 ASN A 77 -0.996 -5.544 -2.283 1.00 0.00 N ATOM 0 H ASN A 77 1.602 -7.142 2.198 1.00 0.00 H new ATOM 0 HA ASN A 77 -0.074 -4.856 1.474 1.00 0.00 H new ATOM 0 HB2 ASN A 77 1.128 -5.384 -0.627 1.00 0.00 H new ATOM 0 HB3 ASN A 77 0.535 -7.031 -0.540 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -1.829 -5.235 -2.785 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -0.166 -5.832 -2.801 1.00 0.00 H new ATOM 1189 N ASN A 78 -1.251 -6.536 3.098 1.00 0.00 N ATOM 1190 CA ASN A 78 -2.325 -7.272 3.759 1.00 0.00 C ATOM 1191 C ASN A 78 -3.640 -6.959 3.050 1.00 0.00 C ATOM 1192 O ASN A 78 -4.216 -5.887 3.255 1.00 0.00 O ATOM 1193 CB ASN A 78 -2.426 -6.913 5.248 1.00 0.00 C ATOM 1194 CG ASN A 78 -1.239 -7.407 6.051 1.00 0.00 C ATOM 1195 OD1 ASN A 78 -0.818 -8.548 5.902 1.00 0.00 O ATOM 1196 ND2 ASN A 78 -0.687 -6.582 6.920 1.00 0.00 N ATOM 0 H ASN A 78 -0.839 -5.800 3.672 1.00 0.00 H new ATOM 0 HA ASN A 78 -2.108 -8.339 3.699 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -2.505 -5.831 5.352 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -3.341 -7.340 5.659 1.00 0.00 H new ATOM 0 HD21 ASN A 78 0.106 -6.890 7.483 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -1.053 -5.636 7.029 1.00 0.00 H new ATOM 1203 N LYS A 79 -4.110 -7.880 2.206 1.00 0.00 N ATOM 1204 CA LYS A 79 -5.370 -7.721 1.484 1.00 0.00 C ATOM 1205 C LYS A 79 -6.502 -7.557 2.502 1.00 0.00 C ATOM 1206 O LYS A 79 -6.668 -8.423 3.361 1.00 0.00 O ATOM 1207 CB LYS A 79 -5.635 -8.946 0.588 1.00 0.00 C ATOM 1208 CG LYS A 79 -4.591 -9.207 -0.516 1.00 0.00 C ATOM 1209 CD LYS A 79 -4.493 -8.121 -1.602 1.00 0.00 C ATOM 1210 CE LYS A 79 -5.799 -7.848 -2.368 1.00 0.00 C ATOM 1211 NZ LYS A 79 -6.311 -9.038 -3.092 1.00 0.00 N ATOM 0 H LYS A 79 -3.627 -8.756 2.005 1.00 0.00 H new ATOM 0 HA LYS A 79 -5.316 -6.839 0.845 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -5.695 -9.831 1.222 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -6.611 -8.825 0.118 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -3.613 -9.318 -0.048 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -4.825 -10.157 -0.996 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -4.161 -7.193 -1.137 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -3.724 -8.412 -2.317 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -6.559 -7.503 -1.667 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -5.633 -7.041 -3.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -7.112 -8.760 -3.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -5.554 -9.436 -3.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -6.626 -9.753 -2.406 1.00 0.00 H new ATOM 1225 N HIS A 80 -7.268 -6.463 2.388 1.00 0.00 N ATOM 1226 CA HIS A 80 -8.511 -6.200 3.102 1.00 0.00 C ATOM 1227 C HIS A 80 -8.422 -6.500 4.592 1.00 0.00 C ATOM 1228 O HIS A 80 -9.376 -6.985 5.194 1.00 0.00 O ATOM 1229 CB HIS A 80 -9.693 -6.894 2.417 1.00 0.00 C ATOM 1230 CG HIS A 80 -9.830 -6.584 0.945 1.00 0.00 C ATOM 1231 ND1 HIS A 80 -9.746 -7.515 -0.096 1.00 0.00 N ATOM 1232 CD2 HIS A 80 -10.039 -5.343 0.415 1.00 0.00 C ATOM 1233 CE1 HIS A 80 -9.914 -6.809 -1.229 1.00 0.00 C ATOM 1234 NE2 HIS A 80 -10.090 -5.505 -0.952 1.00 0.00 N ATOM 0 H HIS A 80 -7.017 -5.700 1.759 1.00 0.00 H new ATOM 0 HA HIS A 80 -8.692 -5.126 3.048 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -9.587 -7.972 2.541 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -10.613 -6.604 2.924 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -10.144 -4.417 0.960 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -9.908 -7.231 -2.223 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -10.236 -4.763 -1.637 1.00 0.00 H new ATOM 1242 N ASP A 81 -7.311 -6.115 5.219 1.00 0.00 N ATOM 1243 CA ASP A 81 -7.147 -6.153 6.682 1.00 0.00 C ATOM 1244 C ASP A 81 -8.194 -5.290 7.416 1.00 0.00 C ATOM 1245 O ASP A 81 -8.346 -5.365 8.634 1.00 0.00 O ATOM 1246 CB ASP A 81 -5.732 -5.678 7.028 1.00 0.00 C ATOM 1247 CG ASP A 81 -5.389 -5.878 8.512 1.00 0.00 C ATOM 1248 OD1 ASP A 81 -5.170 -7.042 8.916 1.00 0.00 O ATOM 1249 OD2 ASP A 81 -5.256 -4.875 9.251 1.00 0.00 O ATOM 0 H ASP A 81 -6.489 -5.764 4.727 1.00 0.00 H new ATOM 0 HA ASP A 81 -7.300 -7.179 7.016 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -5.011 -6.220 6.416 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -5.635 -4.622 6.775 1.00 0.00 H new ATOM 1254 N ASP A 82 -8.932 -4.475 6.657 1.00 0.00 N ATOM 1255 CA ASP A 82 -9.987 -3.569 7.108 1.00 0.00 C ATOM 1256 C ASP A 82 -11.360 -4.259 7.102 1.00 0.00 C ATOM 1257 O ASP A 82 -12.288 -3.791 7.763 1.00 0.00 O ATOM 1258 CB ASP A 82 -9.998 -2.365 6.152 1.00 0.00 C ATOM 1259 CG ASP A 82 -11.189 -1.419 6.369 1.00 0.00 C ATOM 1260 OD1 ASP A 82 -11.239 -0.721 7.407 1.00 0.00 O ATOM 1261 OD2 ASP A 82 -12.040 -1.329 5.455 1.00 0.00 O ATOM 0 H ASP A 82 -8.798 -4.429 5.647 1.00 0.00 H new ATOM 0 HA ASP A 82 -9.791 -3.256 8.133 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -9.072 -1.804 6.277 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -10.015 -2.728 5.124 1.00 0.00 H new ATOM 1266 N LYS A 83 -11.495 -5.382 6.381 1.00 0.00 N ATOM 1267 CA LYS A 83 -12.782 -6.029 6.100 1.00 0.00 C ATOM 1268 C LYS A 83 -12.755 -7.532 6.394 1.00 0.00 C ATOM 1269 O LYS A 83 -13.816 -8.143 6.523 1.00 0.00 O ATOM 1270 CB LYS A 83 -13.191 -5.785 4.633 1.00 0.00 C ATOM 1271 CG LYS A 83 -13.033 -4.324 4.185 1.00 0.00 C ATOM 1272 CD LYS A 83 -13.640 -4.069 2.799 1.00 0.00 C ATOM 1273 CE LYS A 83 -14.023 -2.594 2.602 1.00 0.00 C ATOM 1274 NZ LYS A 83 -12.901 -1.646 2.818 1.00 0.00 N ATOM 0 H LYS A 83 -10.700 -5.872 5.971 1.00 0.00 H new ATOM 0 HA LYS A 83 -13.520 -5.581 6.766 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -12.588 -6.422 3.986 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -14.230 -6.087 4.499 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -13.511 -3.669 4.914 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -11.975 -4.064 4.169 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -12.926 -4.364 2.030 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -14.524 -4.694 2.670 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -14.408 -2.461 1.591 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -14.833 -2.345 3.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -13.118 -0.740 2.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -12.769 -1.491 3.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -12.029 -2.042 2.412 1.00 0.00 H new ATOM 1288 N TYR A 84 -11.564 -8.117 6.515 1.00 0.00 N ATOM 1289 CA TYR A 84 -11.319 -9.545 6.680 1.00 0.00 C ATOM 1290 C TYR A 84 -10.161 -9.726 7.673 1.00 0.00 C ATOM 1291 O TYR A 84 -9.855 -8.822 8.452 1.00 0.00 O ATOM 1292 CB TYR A 84 -11.059 -10.172 5.292 1.00 0.00 C ATOM 1293 CG TYR A 84 -12.296 -10.277 4.420 1.00 0.00 C ATOM 1294 CD1 TYR A 84 -13.238 -11.294 4.669 1.00 0.00 C ATOM 1295 CD2 TYR A 84 -12.511 -9.368 3.366 1.00 0.00 C ATOM 1296 CE1 TYR A 84 -14.395 -11.398 3.876 1.00 0.00 C ATOM 1297 CE2 TYR A 84 -13.666 -9.463 2.569 1.00 0.00 C ATOM 1298 CZ TYR A 84 -14.616 -10.480 2.823 1.00 0.00 C ATOM 1299 OH TYR A 84 -15.743 -10.590 2.063 1.00 0.00 O ATOM 0 H TYR A 84 -10.699 -7.576 6.499 1.00 0.00 H new ATOM 0 HA TYR A 84 -12.181 -10.066 7.097 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -10.309 -9.577 4.771 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -10.637 -11.168 5.428 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -13.071 -11.997 5.472 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -11.785 -8.593 3.169 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -15.115 -12.179 4.071 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -13.827 -8.761 1.764 1.00 0.00 H new ATOM 0 HH TYR A 84 -15.749 -9.885 1.382 1.00 0.00 H new ATOM 1309 N SER A 85 -9.538 -10.907 7.661 1.00 0.00 N ATOM 1310 CA SER A 85 -8.549 -11.364 8.637 1.00 0.00 C ATOM 1311 C SER A 85 -9.101 -11.410 10.076 1.00 0.00 C ATOM 1312 O SER A 85 -8.642 -10.655 10.937 1.00 0.00 O ATOM 1313 CB SER A 85 -7.251 -10.558 8.519 1.00 0.00 C ATOM 1314 OG SER A 85 -6.841 -10.457 7.165 1.00 0.00 O ATOM 0 H SER A 85 -9.719 -11.602 6.936 1.00 0.00 H new ATOM 0 HA SER A 85 -8.309 -12.399 8.395 1.00 0.00 H new ATOM 0 HB2 SER A 85 -7.398 -9.561 8.934 1.00 0.00 H new ATOM 0 HB3 SER A 85 -6.467 -11.036 9.106 1.00 0.00 H new ATOM 0 HG SER A 85 -6.651 -9.520 6.950 1.00 0.00 H new ATOM 1320 N PRO A 86 -10.073 -12.297 10.375 1.00 0.00 N ATOM 1321 CA PRO A 86 -10.510 -12.555 11.750 1.00 0.00 C ATOM 1322 C PRO A 86 -9.399 -13.042 12.688 1.00 0.00 C ATOM 1323 O PRO A 86 -9.531 -12.957 13.911 1.00 0.00 O ATOM 1324 CB PRO A 86 -11.603 -13.628 11.659 1.00 0.00 C ATOM 1325 CG PRO A 86 -12.048 -13.602 10.202 1.00 0.00 C ATOM 1326 CD PRO A 86 -10.788 -13.175 9.458 1.00 0.00 C ATOM 0 HA PRO A 86 -10.857 -11.616 12.181 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -11.219 -14.609 11.939 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -12.432 -13.407 12.331 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -12.399 -14.580 9.871 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -12.866 -12.899 10.044 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -10.180 -14.039 9.188 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -11.036 -12.657 8.532 1.00 0.00 H new ATOM 1334 N LEU A 87 -8.334 -13.604 12.120 1.00 0.00 N ATOM 1335 CA LEU A 87 -7.312 -14.336 12.848 1.00 0.00 C ATOM 1336 C LEU A 87 -6.259 -13.387 13.434 1.00 0.00 C ATOM 1337 O LEU A 87 -5.864 -12.439 12.749 1.00 0.00 O ATOM 1338 CB LEU A 87 -6.637 -15.306 11.870 1.00 0.00 C ATOM 1339 CG LEU A 87 -7.586 -16.349 11.251 1.00 0.00 C ATOM 1340 CD1 LEU A 87 -6.803 -17.188 10.240 1.00 0.00 C ATOM 1341 CD2 LEU A 87 -8.204 -17.278 12.304 1.00 0.00 C ATOM 0 H LEU A 87 -8.158 -13.559 11.116 1.00 0.00 H new ATOM 0 HA LEU A 87 -7.775 -14.873 13.676 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -6.176 -14.731 11.067 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -5.834 -15.827 12.391 1.00 0.00 H new ATOM 0 HG LEU A 87 -8.403 -15.812 10.770 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -7.464 -17.931 9.794 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -6.406 -16.540 9.459 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -5.979 -17.692 10.746 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -8.865 -17.994 11.815 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -7.412 -17.814 12.827 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -8.776 -16.687 13.020 1.00 0.00 H new ATOM 1353 N PRO A 88 -5.762 -13.640 14.658 1.00 0.00 N ATOM 1354 CA PRO A 88 -4.605 -12.939 15.196 1.00 0.00 C ATOM 1355 C PRO A 88 -3.328 -13.447 14.515 1.00 0.00 C ATOM 1356 O PRO A 88 -3.303 -14.551 13.957 1.00 0.00 O ATOM 1357 CB PRO A 88 -4.612 -13.249 16.696 1.00 0.00 C ATOM 1358 CG PRO A 88 -5.222 -14.648 16.755 1.00 0.00 C ATOM 1359 CD PRO A 88 -6.234 -14.639 15.608 1.00 0.00 C ATOM 0 HA PRO A 88 -4.640 -11.864 15.020 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -3.607 -13.229 17.117 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -5.206 -12.526 17.255 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -4.467 -15.422 16.619 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -5.703 -14.837 17.715 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -6.300 -15.621 15.140 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -7.231 -14.391 15.971 1.00 0.00 H new ATOM 1367 N CYS A 89 -2.245 -12.668 14.613 1.00 0.00 N ATOM 1368 CA CYS A 89 -0.957 -12.991 14.001 1.00 0.00 C ATOM 1369 C CYS A 89 -0.487 -14.394 14.382 1.00 0.00 C ATOM 1370 O CYS A 89 -0.017 -15.124 13.513 1.00 0.00 O ATOM 1371 CB CYS A 89 0.090 -11.938 14.384 1.00 0.00 C ATOM 1372 SG CYS A 89 -0.469 -10.285 13.872 1.00 0.00 S ATOM 0 H CYS A 89 -2.241 -11.786 15.126 1.00 0.00 H new ATOM 0 HA CYS A 89 -1.086 -12.978 12.919 1.00 0.00 H new ATOM 0 HB2 CYS A 89 0.258 -11.956 15.461 1.00 0.00 H new ATOM 0 HB3 CYS A 89 1.043 -12.172 13.909 1.00 0.00 H new ATOM 0 HG CYS A 89 0.426 -9.402 14.204 1.00 0.00 H new ATOM 1378 N SER A 90 -0.662 -14.797 15.643 1.00 0.00 N ATOM 1379 CA SER A 90 -0.243 -16.104 16.130 1.00 0.00 C ATOM 1380 C SER A 90 -0.835 -17.227 15.274 1.00 0.00 C ATOM 1381 O SER A 90 -0.092 -18.028 14.717 1.00 0.00 O ATOM 1382 CB SER A 90 -0.625 -16.239 17.612 1.00 0.00 C ATOM 1383 OG SER A 90 -0.295 -15.052 18.324 1.00 0.00 O ATOM 0 H SER A 90 -1.103 -14.217 16.357 1.00 0.00 H new ATOM 0 HA SER A 90 0.840 -16.193 16.047 1.00 0.00 H new ATOM 0 HB2 SER A 90 -1.693 -16.438 17.701 1.00 0.00 H new ATOM 0 HB3 SER A 90 -0.104 -17.090 18.051 1.00 0.00 H new ATOM 0 HG SER A 90 -0.547 -15.155 19.266 1.00 0.00 H new ATOM 1389 N LYS A 91 -2.158 -17.250 15.101 1.00 0.00 N ATOM 1390 CA LYS A 91 -2.868 -18.248 14.303 1.00 0.00 C ATOM 1391 C LYS A 91 -2.487 -18.166 12.829 1.00 0.00 C ATOM 1392 O LYS A 91 -2.356 -19.209 12.195 1.00 0.00 O ATOM 1393 CB LYS A 91 -4.392 -18.091 14.458 1.00 0.00 C ATOM 1394 CG LYS A 91 -4.938 -18.381 15.869 1.00 0.00 C ATOM 1395 CD LYS A 91 -4.743 -19.843 16.309 1.00 0.00 C ATOM 1396 CE LYS A 91 -5.373 -20.132 17.683 1.00 0.00 C ATOM 1397 NZ LYS A 91 -6.858 -20.113 17.665 1.00 0.00 N ATOM 0 H LYS A 91 -2.779 -16.559 15.522 1.00 0.00 H new ATOM 0 HA LYS A 91 -2.571 -19.228 14.677 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -4.667 -17.073 14.181 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -4.884 -18.758 13.750 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -4.443 -17.724 16.585 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -6.000 -18.139 15.897 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -5.184 -20.505 15.564 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -3.677 -20.069 16.346 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -5.033 -21.107 18.033 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -5.016 -19.394 18.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -7.220 -20.348 18.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -7.190 -19.166 17.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -7.206 -20.812 16.978 1.00 0.00 H new ATOM 1411 N ILE A 92 -2.286 -16.966 12.279 1.00 0.00 N ATOM 1412 CA ILE A 92 -1.869 -16.816 10.886 1.00 0.00 C ATOM 1413 C ILE A 92 -0.529 -17.543 10.693 1.00 0.00 C ATOM 1414 O ILE A 92 -0.388 -18.358 9.779 1.00 0.00 O ATOM 1415 CB ILE A 92 -1.796 -15.316 10.513 1.00 0.00 C ATOM 1416 CG1 ILE A 92 -3.192 -14.654 10.564 1.00 0.00 C ATOM 1417 CG2 ILE A 92 -1.198 -15.136 9.108 1.00 0.00 C ATOM 1418 CD1 ILE A 92 -3.133 -13.128 10.706 1.00 0.00 C ATOM 0 H ILE A 92 -2.406 -16.085 12.779 1.00 0.00 H new ATOM 0 HA ILE A 92 -2.597 -17.268 10.213 1.00 0.00 H new ATOM 0 HB ILE A 92 -1.153 -14.830 11.246 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -3.740 -14.907 9.656 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -3.753 -15.069 11.401 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -1.155 -14.075 8.864 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -0.192 -15.555 9.084 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -1.823 -15.651 8.378 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -4.146 -12.726 10.736 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -2.612 -12.868 11.628 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -2.599 -12.704 9.856 1.00 0.00 H new ATOM 1430 N ILE A 93 0.440 -17.286 11.575 1.00 0.00 N ATOM 1431 CA ILE A 93 1.764 -17.893 11.521 1.00 0.00 C ATOM 1432 C ILE A 93 1.626 -19.401 11.739 1.00 0.00 C ATOM 1433 O ILE A 93 2.203 -20.181 10.984 1.00 0.00 O ATOM 1434 CB ILE A 93 2.675 -17.221 12.575 1.00 0.00 C ATOM 1435 CG1 ILE A 93 2.861 -15.723 12.251 1.00 0.00 C ATOM 1436 CG2 ILE A 93 4.049 -17.902 12.653 1.00 0.00 C ATOM 1437 CD1 ILE A 93 3.427 -14.917 13.427 1.00 0.00 C ATOM 0 H ILE A 93 0.321 -16.641 12.356 1.00 0.00 H new ATOM 0 HA ILE A 93 2.228 -17.740 10.546 1.00 0.00 H new ATOM 0 HB ILE A 93 2.184 -17.327 13.542 1.00 0.00 H new ATOM 0 HG12 ILE A 93 3.529 -15.623 11.395 1.00 0.00 H new ATOM 0 HG13 ILE A 93 1.901 -15.299 11.957 1.00 0.00 H new ATOM 0 HG21 ILE A 93 4.661 -17.402 13.404 1.00 0.00 H new ATOM 0 HG22 ILE A 93 3.921 -18.949 12.927 1.00 0.00 H new ATOM 0 HG23 ILE A 93 4.542 -17.839 11.683 1.00 0.00 H new ATOM 0 HD11 ILE A 93 3.534 -13.872 13.134 1.00 0.00 H new ATOM 0 HD12 ILE A 93 2.748 -14.988 14.277 1.00 0.00 H new ATOM 0 HD13 ILE A 93 4.402 -15.317 13.706 1.00 0.00 H new ATOM 1449 N GLN A 94 0.844 -19.810 12.743 1.00 0.00 N ATOM 1450 CA GLN A 94 0.667 -21.218 13.094 1.00 0.00 C ATOM 1451 C GLN A 94 0.128 -22.000 11.886 1.00 0.00 C ATOM 1452 O GLN A 94 0.633 -23.073 11.560 1.00 0.00 O ATOM 1453 CB GLN A 94 -0.123 -21.382 14.417 1.00 0.00 C ATOM 1454 CG GLN A 94 -1.588 -21.833 14.345 1.00 0.00 C ATOM 1455 CD GLN A 94 -1.769 -23.297 13.929 1.00 0.00 C ATOM 1456 OE1 GLN A 94 -1.113 -24.199 14.443 1.00 0.00 O ATOM 1457 NE2 GLN A 94 -2.648 -23.561 12.977 1.00 0.00 N ATOM 0 H GLN A 94 0.315 -19.170 13.336 1.00 0.00 H new ATOM 0 HA GLN A 94 1.632 -21.673 13.319 1.00 0.00 H new ATOM 0 HB2 GLN A 94 0.414 -22.100 15.037 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -0.096 -20.426 14.940 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -2.052 -21.683 15.320 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -2.119 -21.196 13.637 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -3.188 -22.804 12.557 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -2.786 -24.521 12.663 1.00 0.00 H new ATOM 1466 N ARG A 95 -0.859 -21.442 11.175 1.00 0.00 N ATOM 1467 CA ARG A 95 -1.408 -22.042 9.965 1.00 0.00 C ATOM 1468 C ARG A 95 -0.310 -22.117 8.906 1.00 0.00 C ATOM 1469 O ARG A 95 -0.067 -23.193 8.359 1.00 0.00 O ATOM 1470 CB ARG A 95 -2.618 -21.198 9.527 1.00 0.00 C ATOM 1471 CG ARG A 95 -3.334 -21.646 8.247 1.00 0.00 C ATOM 1472 CD ARG A 95 -4.014 -23.017 8.328 1.00 0.00 C ATOM 1473 NE ARG A 95 -4.924 -23.207 7.180 1.00 0.00 N ATOM 1474 CZ ARG A 95 -6.170 -22.721 7.076 1.00 0.00 C ATOM 1475 NH1 ARG A 95 -6.775 -22.136 8.106 1.00 0.00 N ATOM 1476 NH2 ARG A 95 -6.828 -22.803 5.931 1.00 0.00 N ATOM 0 H ARG A 95 -1.298 -20.557 11.429 1.00 0.00 H new ATOM 0 HA ARG A 95 -1.754 -23.062 10.131 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -3.344 -21.193 10.340 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -2.285 -20.169 9.390 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -4.086 -20.900 7.989 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -2.610 -21.664 7.432 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -3.260 -23.804 8.337 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -4.572 -23.099 9.261 1.00 0.00 H new ATOM 0 HE ARG A 95 -4.573 -23.757 6.396 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -6.291 -22.049 9.000 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -7.723 -21.774 8.002 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -6.388 -23.238 5.120 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -7.775 -22.431 5.859 1.00 0.00 H new ATOM 1490 N ALA A 96 0.382 -21.002 8.651 1.00 0.00 N ATOM 1491 CA ALA A 96 1.420 -20.940 7.633 1.00 0.00 C ATOM 1492 C ALA A 96 2.450 -22.049 7.830 1.00 0.00 C ATOM 1493 O ALA A 96 2.776 -22.756 6.879 1.00 0.00 O ATOM 1494 CB ALA A 96 2.094 -19.562 7.643 1.00 0.00 C ATOM 0 H ALA A 96 0.234 -20.123 9.146 1.00 0.00 H new ATOM 0 HA ALA A 96 0.953 -21.090 6.660 1.00 0.00 H new ATOM 0 HB1 ALA A 96 2.868 -19.530 6.876 1.00 0.00 H new ATOM 0 HB2 ALA A 96 1.350 -18.792 7.440 1.00 0.00 H new ATOM 0 HB3 ALA A 96 2.543 -19.384 8.620 1.00 0.00 H new ATOM 1500 N GLU A 97 2.926 -22.230 9.062 1.00 0.00 N ATOM 1501 CA GLU A 97 3.973 -23.200 9.351 1.00 0.00 C ATOM 1502 C GLU A 97 3.439 -24.636 9.385 1.00 0.00 C ATOM 1503 O GLU A 97 4.228 -25.564 9.200 1.00 0.00 O ATOM 1504 CB GLU A 97 4.762 -22.834 10.621 1.00 0.00 C ATOM 1505 CG GLU A 97 4.009 -23.064 11.938 1.00 0.00 C ATOM 1506 CD GLU A 97 4.901 -22.780 13.160 1.00 0.00 C ATOM 1507 OE1 GLU A 97 5.686 -23.669 13.562 1.00 0.00 O ATOM 1508 OE2 GLU A 97 4.813 -21.679 13.749 1.00 0.00 O ATOM 0 H GLU A 97 2.598 -21.712 9.878 1.00 0.00 H new ATOM 0 HA GLU A 97 4.681 -23.158 8.523 1.00 0.00 H new ATOM 0 HB2 GLU A 97 5.683 -23.417 10.639 1.00 0.00 H new ATOM 0 HB3 GLU A 97 5.050 -21.784 10.562 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.130 -22.421 11.972 1.00 0.00 H new ATOM 0 HG3 GLU A 97 3.653 -24.093 11.979 1.00 0.00 H new ATOM 1515 N GLU A 98 2.129 -24.855 9.582 1.00 0.00 N ATOM 1516 CA GLU A 98 1.568 -26.198 9.573 1.00 0.00 C ATOM 1517 C GLU A 98 1.625 -26.764 8.157 1.00 0.00 C ATOM 1518 O GLU A 98 1.840 -27.964 7.975 1.00 0.00 O ATOM 1519 CB GLU A 98 0.117 -26.210 10.089 1.00 0.00 C ATOM 1520 CG GLU A 98 0.033 -26.471 11.599 1.00 0.00 C ATOM 1521 CD GLU A 98 -1.405 -26.787 12.058 1.00 0.00 C ATOM 1522 OE1 GLU A 98 -2.348 -26.028 11.741 1.00 0.00 O ATOM 1523 OE2 GLU A 98 -1.603 -27.814 12.748 1.00 0.00 O ATOM 0 H GLU A 98 1.447 -24.115 9.748 1.00 0.00 H new ATOM 0 HA GLU A 98 2.161 -26.820 10.243 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -0.354 -25.254 9.862 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -0.448 -26.977 9.559 1.00 0.00 H new ATOM 0 HG2 GLU A 98 0.686 -27.304 11.859 1.00 0.00 H new ATOM 0 HG3 GLU A 98 0.401 -25.598 12.138 1.00 0.00 H new ATOM 1530 N LEU A 99 1.430 -25.902 7.155 1.00 0.00 N ATOM 1531 CA LEU A 99 1.251 -26.353 5.777 1.00 0.00 C ATOM 1532 C LEU A 99 2.573 -26.525 5.021 1.00 0.00 C ATOM 1533 O LEU A 99 2.558 -27.078 3.923 1.00 0.00 O ATOM 1534 CB LEU A 99 0.313 -25.400 5.025 1.00 0.00 C ATOM 1535 CG LEU A 99 -1.029 -25.154 5.745 1.00 0.00 C ATOM 1536 CD1 LEU A 99 -1.863 -24.195 4.899 1.00 0.00 C ATOM 1537 CD2 LEU A 99 -1.850 -26.417 6.026 1.00 0.00 C ATOM 0 H LEU A 99 1.393 -24.890 7.275 1.00 0.00 H new ATOM 0 HA LEU A 99 0.798 -27.343 5.826 1.00 0.00 H new ATOM 0 HB2 LEU A 99 0.819 -24.445 4.882 1.00 0.00 H new ATOM 0 HB3 LEU A 99 0.114 -25.807 4.034 1.00 0.00 H new ATOM 0 HG LEU A 99 -0.782 -24.739 6.722 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.817 -24.009 5.393 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -1.326 -23.254 4.780 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -2.042 -24.636 3.919 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -2.775 -26.144 6.534 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -2.086 -26.915 5.085 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -1.274 -27.092 6.659 1.00 0.00 H new ATOM 1549 N VAL A 100 3.708 -26.074 5.567 1.00 0.00 N ATOM 1550 CA VAL A 100 5.018 -26.249 4.934 1.00 0.00 C ATOM 1551 C VAL A 100 5.247 -27.742 4.660 1.00 0.00 C ATOM 1552 O VAL A 100 5.004 -28.588 5.525 1.00 0.00 O ATOM 1553 CB VAL A 100 6.133 -25.626 5.803 1.00 0.00 C ATOM 1554 CG1 VAL A 100 7.525 -25.779 5.169 1.00 0.00 C ATOM 1555 CG2 VAL A 100 5.893 -24.124 6.008 1.00 0.00 C ATOM 0 H VAL A 100 3.743 -25.579 6.458 1.00 0.00 H new ATOM 0 HA VAL A 100 5.045 -25.723 3.980 1.00 0.00 H new ATOM 0 HB VAL A 100 6.102 -26.162 6.751 1.00 0.00 H new ATOM 0 HG11 VAL A 100 8.273 -25.325 5.819 1.00 0.00 H new ATOM 0 HG12 VAL A 100 7.752 -26.837 5.040 1.00 0.00 H new ATOM 0 HG13 VAL A 100 7.539 -25.284 4.198 1.00 0.00 H new ATOM 0 HG21 VAL A 100 6.691 -23.709 6.623 1.00 0.00 H new ATOM 0 HG22 VAL A 100 5.881 -23.622 5.041 1.00 0.00 H new ATOM 0 HG23 VAL A 100 4.935 -23.973 6.506 1.00 0.00 H new ATOM 1565 N GLY A 101 5.710 -28.059 3.449 1.00 0.00 N ATOM 1566 CA GLY A 101 5.982 -29.418 3.003 1.00 0.00 C ATOM 1567 C GLY A 101 4.795 -30.055 2.279 1.00 0.00 C ATOM 1568 O GLY A 101 4.961 -31.143 1.721 1.00 0.00 O ATOM 0 H GLY A 101 5.910 -27.357 2.737 1.00 0.00 H new ATOM 0 HA2 GLY A 101 6.846 -29.411 2.338 1.00 0.00 H new ATOM 0 HA3 GLY A 101 6.248 -30.031 3.864 1.00 0.00 H new ATOM 1572 N GLN A 102 3.615 -29.420 2.263 1.00 0.00 N ATOM 1573 CA GLN A 102 2.501 -29.884 1.442 1.00 0.00 C ATOM 1574 C GLN A 102 2.804 -29.599 -0.024 1.00 0.00 C ATOM 1575 O GLN A 102 3.583 -28.699 -0.348 1.00 0.00 O ATOM 1576 CB GLN A 102 1.180 -29.223 1.866 1.00 0.00 C ATOM 1577 CG GLN A 102 0.696 -29.835 3.186 1.00 0.00 C ATOM 1578 CD GLN A 102 -0.614 -29.238 3.704 1.00 0.00 C ATOM 1579 OE1 GLN A 102 -1.331 -28.519 3.012 1.00 0.00 O ATOM 1580 NE2 GLN A 102 -0.966 -29.540 4.944 1.00 0.00 N ATOM 0 H GLN A 102 3.413 -28.584 2.811 1.00 0.00 H new ATOM 0 HA GLN A 102 2.383 -30.958 1.584 1.00 0.00 H new ATOM 0 HB2 GLN A 102 1.321 -28.148 1.982 1.00 0.00 H new ATOM 0 HB3 GLN A 102 0.427 -29.364 1.091 1.00 0.00 H new ATOM 0 HG2 GLN A 102 0.566 -30.909 3.051 1.00 0.00 H new ATOM 0 HG3 GLN A 102 1.469 -29.700 3.942 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -0.366 -30.137 5.513 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -1.837 -29.175 5.330 1.00 0.00 H new ATOM 1589 N GLU A 103 2.148 -30.343 -0.908 1.00 0.00 N ATOM 1590 CA GLU A 103 2.412 -30.324 -2.342 1.00 0.00 C ATOM 1591 C GLU A 103 1.101 -30.059 -3.075 1.00 0.00 C ATOM 1592 O GLU A 103 0.045 -30.540 -2.650 1.00 0.00 O ATOM 1593 CB GLU A 103 3.017 -31.663 -2.801 1.00 0.00 C ATOM 1594 CG GLU A 103 4.299 -32.059 -2.049 1.00 0.00 C ATOM 1595 CD GLU A 103 4.904 -33.355 -2.616 1.00 0.00 C ATOM 1596 OE1 GLU A 103 4.541 -34.458 -2.145 1.00 0.00 O ATOM 1597 OE2 GLU A 103 5.760 -33.290 -3.526 1.00 0.00 O ATOM 0 H GLU A 103 1.404 -30.988 -0.643 1.00 0.00 H new ATOM 0 HA GLU A 103 3.131 -29.537 -2.569 1.00 0.00 H new ATOM 0 HB2 GLU A 103 2.274 -32.450 -2.671 1.00 0.00 H new ATOM 0 HB3 GLU A 103 3.236 -31.605 -3.867 1.00 0.00 H new ATOM 0 HG2 GLU A 103 5.029 -31.253 -2.121 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.075 -32.193 -0.991 1.00 0.00 H new ATOM 1604 N VAL A 104 1.167 -29.314 -4.178 1.00 0.00 N ATOM 1605 CA VAL A 104 0.007 -28.900 -4.952 1.00 0.00 C ATOM 1606 C VAL A 104 0.306 -28.996 -6.455 1.00 0.00 C ATOM 1607 O VAL A 104 1.432 -28.789 -6.911 1.00 0.00 O ATOM 1608 CB VAL A 104 -0.422 -27.478 -4.539 1.00 0.00 C ATOM 1609 CG1 VAL A 104 -1.163 -27.463 -3.193 1.00 0.00 C ATOM 1610 CG2 VAL A 104 0.721 -26.455 -4.479 1.00 0.00 C ATOM 0 H VAL A 104 2.049 -28.977 -4.563 1.00 0.00 H new ATOM 0 HA VAL A 104 -0.826 -29.571 -4.743 1.00 0.00 H new ATOM 0 HB VAL A 104 -1.093 -27.172 -5.342 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -1.445 -26.440 -2.944 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -2.059 -28.079 -3.264 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -0.511 -27.859 -2.414 1.00 0.00 H new ATOM 0 HG21 VAL A 104 0.325 -25.484 -4.180 1.00 0.00 H new ATOM 0 HG22 VAL A 104 1.465 -26.783 -3.753 1.00 0.00 H new ATOM 0 HG23 VAL A 104 1.186 -26.371 -5.461 1.00 0.00 H new ATOM 1620 N LEU A 105 -0.711 -29.333 -7.250 1.00 0.00 N ATOM 1621 CA LEU A 105 -0.496 -29.669 -8.655 1.00 0.00 C ATOM 1622 C LEU A 105 -0.618 -28.458 -9.583 1.00 0.00 C ATOM 1623 O LEU A 105 -0.293 -28.572 -10.763 1.00 0.00 O ATOM 1624 CB LEU A 105 -1.452 -30.804 -9.072 1.00 0.00 C ATOM 1625 CG LEU A 105 -0.783 -31.816 -10.021 1.00 0.00 C ATOM 1626 CD1 LEU A 105 0.252 -32.677 -9.276 1.00 0.00 C ATOM 1627 CD2 LEU A 105 -1.848 -32.735 -10.626 1.00 0.00 C ATOM 0 H LEU A 105 -1.684 -29.380 -6.946 1.00 0.00 H new ATOM 0 HA LEU A 105 0.532 -30.015 -8.758 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -1.805 -31.324 -8.181 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -2.328 -30.377 -9.560 1.00 0.00 H new ATOM 0 HG LEU A 105 -0.274 -31.257 -10.806 1.00 0.00 H new ATOM 0 HD11 LEU A 105 0.707 -33.382 -9.972 1.00 0.00 H new ATOM 0 HD12 LEU A 105 1.024 -32.034 -8.854 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -0.241 -33.226 -8.474 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -1.373 -33.450 -11.297 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -2.361 -33.272 -9.828 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -2.569 -32.138 -11.184 1.00 0.00 H new ATOM 1639 N TYR A 106 -1.090 -27.312 -9.080 1.00 0.00 N ATOM 1640 CA TYR A 106 -1.122 -26.071 -9.838 1.00 0.00 C ATOM 1641 C TYR A 106 0.282 -25.461 -9.929 1.00 0.00 C ATOM 1642 O TYR A 106 1.131 -25.682 -9.062 1.00 0.00 O ATOM 1643 CB TYR A 106 -2.144 -25.094 -9.239 1.00 0.00 C ATOM 1644 CG TYR A 106 -1.951 -24.693 -7.782 1.00 0.00 C ATOM 1645 CD1 TYR A 106 -0.897 -23.838 -7.405 1.00 0.00 C ATOM 1646 CD2 TYR A 106 -2.868 -25.135 -6.808 1.00 0.00 C ATOM 1647 CE1 TYR A 106 -0.757 -23.431 -6.067 1.00 0.00 C ATOM 1648 CE2 TYR A 106 -2.745 -24.718 -5.471 1.00 0.00 C ATOM 1649 CZ TYR A 106 -1.689 -23.856 -5.095 1.00 0.00 C ATOM 1650 OH TYR A 106 -1.554 -23.437 -3.805 1.00 0.00 O ATOM 0 H TYR A 106 -1.460 -27.226 -8.133 1.00 0.00 H new ATOM 0 HA TYR A 106 -1.447 -26.287 -10.856 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -2.138 -24.187 -9.843 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -3.135 -25.538 -9.339 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -0.193 -23.493 -8.148 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -3.671 -25.799 -7.091 1.00 0.00 H new ATOM 0 HE1 TYR A 106 0.065 -22.792 -5.782 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -3.456 -25.056 -4.732 1.00 0.00 H new ATOM 0 HH TYR A 106 -2.275 -23.816 -3.261 1.00 0.00 H new ATOM 1660 N LYS A 107 0.525 -24.663 -10.969 1.00 0.00 N ATOM 1661 CA LYS A 107 1.758 -23.969 -11.229 1.00 0.00 C ATOM 1662 C LYS A 107 1.822 -22.683 -10.397 1.00 0.00 C ATOM 1663 O LYS A 107 0.788 -22.129 -10.016 1.00 0.00 O ATOM 1664 CB LYS A 107 1.695 -23.695 -12.740 1.00 0.00 C ATOM 1665 CG LYS A 107 2.903 -22.912 -13.199 1.00 0.00 C ATOM 1666 CD LYS A 107 2.972 -22.644 -14.706 1.00 0.00 C ATOM 1667 CE LYS A 107 4.078 -21.619 -15.015 1.00 0.00 C ATOM 1668 NZ LYS A 107 3.762 -20.250 -14.517 1.00 0.00 N ATOM 0 H LYS A 107 -0.180 -24.483 -11.683 1.00 0.00 H new ATOM 0 HA LYS A 107 2.653 -24.528 -10.957 1.00 0.00 H new ATOM 0 HB2 LYS A 107 1.641 -24.639 -13.282 1.00 0.00 H new ATOM 0 HB3 LYS A 107 0.787 -23.140 -12.975 1.00 0.00 H new ATOM 0 HG2 LYS A 107 2.917 -21.956 -12.675 1.00 0.00 H new ATOM 0 HG3 LYS A 107 3.801 -23.452 -12.901 1.00 0.00 H new ATOM 0 HD2 LYS A 107 3.169 -23.574 -15.239 1.00 0.00 H new ATOM 0 HD3 LYS A 107 2.011 -22.271 -15.060 1.00 0.00 H new ATOM 0 HE2 LYS A 107 5.013 -21.956 -14.566 1.00 0.00 H new ATOM 0 HE3 LYS A 107 4.238 -21.579 -16.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 4.493 -19.585 -14.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 2.835 -19.952 -14.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 3.737 -20.256 -13.477 1.00 0.00 H new ATOM 1682 N LEU A 108 3.036 -22.170 -10.177 1.00 0.00 N ATOM 1683 CA LEU A 108 3.260 -20.841 -9.616 1.00 0.00 C ATOM 1684 C LEU A 108 2.613 -19.811 -10.546 1.00 0.00 C ATOM 1685 O LEU A 108 2.997 -19.713 -11.716 1.00 0.00 O ATOM 1686 CB LEU A 108 4.765 -20.502 -9.504 1.00 0.00 C ATOM 1687 CG LEU A 108 5.640 -21.304 -8.526 1.00 0.00 C ATOM 1688 CD1 LEU A 108 5.040 -21.350 -7.121 1.00 0.00 C ATOM 1689 CD2 LEU A 108 5.937 -22.723 -9.021 1.00 0.00 C ATOM 0 H LEU A 108 3.898 -22.674 -10.387 1.00 0.00 H new ATOM 0 HA LEU A 108 2.828 -20.821 -8.615 1.00 0.00 H new ATOM 0 HB2 LEU A 108 5.201 -20.608 -10.498 1.00 0.00 H new ATOM 0 HB3 LEU A 108 4.846 -19.450 -9.231 1.00 0.00 H new ATOM 0 HG LEU A 108 6.587 -20.767 -8.477 1.00 0.00 H new ATOM 0 HD11 LEU A 108 5.692 -21.927 -6.465 1.00 0.00 H new ATOM 0 HD12 LEU A 108 4.942 -20.336 -6.734 1.00 0.00 H new ATOM 0 HD13 LEU A 108 4.057 -21.820 -7.160 1.00 0.00 H new ATOM 0 HD21 LEU A 108 6.558 -23.241 -8.290 1.00 0.00 H new ATOM 0 HD22 LEU A 108 5.001 -23.266 -9.152 1.00 0.00 H new ATOM 0 HD23 LEU A 108 6.464 -22.673 -9.974 1.00 0.00 H new ATOM 1701 N THR A 109 1.679 -19.024 -10.022 1.00 0.00 N ATOM 1702 CA THR A 109 1.125 -17.849 -10.677 1.00 0.00 C ATOM 1703 C THR A 109 0.881 -16.819 -9.575 1.00 0.00 C ATOM 1704 O THR A 109 0.737 -17.187 -8.401 1.00 0.00 O ATOM 1705 CB THR A 109 -0.180 -18.166 -11.438 1.00 0.00 C ATOM 1706 OG1 THR A 109 -1.183 -18.623 -10.552 1.00 0.00 O ATOM 1707 CG2 THR A 109 -0.010 -19.209 -12.547 1.00 0.00 C ATOM 0 H THR A 109 1.275 -19.194 -9.101 1.00 0.00 H new ATOM 0 HA THR A 109 1.818 -17.473 -11.430 1.00 0.00 H new ATOM 0 HB THR A 109 -0.471 -17.225 -11.904 1.00 0.00 H new ATOM 0 HG1 THR A 109 -2.001 -18.816 -11.056 1.00 0.00 H new ATOM 0 HG21 THR A 109 -0.969 -19.379 -13.036 1.00 0.00 H new ATOM 0 HG22 THR A 109 0.712 -18.847 -13.279 1.00 0.00 H new ATOM 0 HG23 THR A 109 0.348 -20.144 -12.116 1.00 0.00 H new ATOM 1715 N SER A 110 0.788 -15.541 -9.946 1.00 0.00 N ATOM 1716 CA SER A 110 0.414 -14.479 -9.026 1.00 0.00 C ATOM 1717 C SER A 110 -0.893 -14.842 -8.314 1.00 0.00 C ATOM 1718 O SER A 110 -0.976 -14.742 -7.092 1.00 0.00 O ATOM 1719 CB SER A 110 0.287 -13.166 -9.814 1.00 0.00 C ATOM 1720 OG SER A 110 1.409 -12.993 -10.660 1.00 0.00 O ATOM 0 H SER A 110 0.971 -15.218 -10.896 1.00 0.00 H new ATOM 0 HA SER A 110 1.178 -14.352 -8.259 1.00 0.00 H new ATOM 0 HB2 SER A 110 -0.627 -13.177 -10.408 1.00 0.00 H new ATOM 0 HB3 SER A 110 0.209 -12.326 -9.124 1.00 0.00 H new ATOM 0 HG SER A 110 2.211 -12.849 -10.115 1.00 0.00 H new ATOM 1726 N GLU A 111 -1.883 -15.330 -9.070 1.00 0.00 N ATOM 1727 CA GLU A 111 -3.204 -15.659 -8.563 1.00 0.00 C ATOM 1728 C GLU A 111 -3.133 -16.830 -7.576 1.00 0.00 C ATOM 1729 O GLU A 111 -3.726 -16.753 -6.502 1.00 0.00 O ATOM 1730 CB GLU A 111 -4.100 -15.987 -9.768 1.00 0.00 C ATOM 1731 CG GLU A 111 -5.579 -16.176 -9.412 1.00 0.00 C ATOM 1732 CD GLU A 111 -6.259 -14.860 -8.988 1.00 0.00 C ATOM 1733 OE1 GLU A 111 -6.635 -14.055 -9.869 1.00 0.00 O ATOM 1734 OE2 GLU A 111 -6.451 -14.628 -7.774 1.00 0.00 O ATOM 0 H GLU A 111 -1.778 -15.508 -10.069 1.00 0.00 H new ATOM 0 HA GLU A 111 -3.623 -14.816 -8.014 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -4.013 -15.185 -10.501 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -3.732 -16.896 -10.244 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -6.105 -16.592 -10.271 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -5.664 -16.902 -8.603 1.00 0.00 H new ATOM 1741 N ASN A 112 -2.410 -17.906 -7.908 1.00 0.00 N ATOM 1742 CA ASN A 112 -2.402 -19.107 -7.074 1.00 0.00 C ATOM 1743 C ASN A 112 -1.724 -18.831 -5.738 1.00 0.00 C ATOM 1744 O ASN A 112 -2.218 -19.274 -4.698 1.00 0.00 O ATOM 1745 CB ASN A 112 -1.709 -20.284 -7.779 1.00 0.00 C ATOM 1746 CG ASN A 112 -2.588 -20.958 -8.833 1.00 0.00 C ATOM 1747 OD1 ASN A 112 -3.812 -20.990 -8.725 1.00 0.00 O ATOM 1748 ND2 ASN A 112 -1.997 -21.516 -9.874 1.00 0.00 N ATOM 0 H ASN A 112 -1.828 -17.967 -8.743 1.00 0.00 H new ATOM 0 HA ASN A 112 -3.441 -19.383 -6.897 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -0.794 -19.928 -8.252 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -1.415 -21.023 -7.034 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -2.557 -21.976 -10.592 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -0.981 -21.487 -9.960 1.00 0.00 H new ATOM 1755 N CYS A 113 -0.614 -18.087 -5.744 1.00 0.00 N ATOM 1756 CA CYS A 113 0.078 -17.749 -4.511 1.00 0.00 C ATOM 1757 C CYS A 113 -0.773 -16.795 -3.670 1.00 0.00 C ATOM 1758 O CYS A 113 -0.872 -16.988 -2.458 1.00 0.00 O ATOM 1759 CB CYS A 113 1.452 -17.153 -4.825 1.00 0.00 C ATOM 1760 SG CYS A 113 2.397 -18.337 -5.830 1.00 0.00 S ATOM 0 H CYS A 113 -0.182 -17.712 -6.588 1.00 0.00 H new ATOM 0 HA CYS A 113 0.234 -18.655 -3.926 1.00 0.00 H new ATOM 0 HB2 CYS A 113 1.340 -16.210 -5.361 1.00 0.00 H new ATOM 0 HB3 CYS A 113 1.987 -16.933 -3.901 1.00 0.00 H new ATOM 0 HG CYS A 113 3.546 -17.817 -6.147 1.00 0.00 H new ATOM 1766 N GLU A 114 -1.417 -15.805 -4.300 1.00 0.00 N ATOM 1767 CA GLU A 114 -2.290 -14.856 -3.615 1.00 0.00 C ATOM 1768 C GLU A 114 -3.464 -15.590 -2.955 1.00 0.00 C ATOM 1769 O GLU A 114 -3.828 -15.286 -1.817 1.00 0.00 O ATOM 1770 CB GLU A 114 -2.775 -13.795 -4.617 1.00 0.00 C ATOM 1771 CG GLU A 114 -3.413 -12.572 -3.942 1.00 0.00 C ATOM 1772 CD GLU A 114 -3.692 -11.402 -4.912 1.00 0.00 C ATOM 1773 OE1 GLU A 114 -3.075 -11.299 -6.000 1.00 0.00 O ATOM 1774 OE2 GLU A 114 -4.537 -10.546 -4.563 1.00 0.00 O ATOM 0 H GLU A 114 -1.344 -15.643 -5.304 1.00 0.00 H new ATOM 0 HA GLU A 114 -1.736 -14.353 -2.823 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -1.932 -13.467 -5.226 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -3.500 -14.248 -5.293 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -4.349 -12.874 -3.473 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -2.755 -12.223 -3.146 1.00 0.00 H new ATOM 1781 N HIS A 115 -4.026 -16.583 -3.648 1.00 0.00 N ATOM 1782 CA HIS A 115 -5.132 -17.396 -3.169 1.00 0.00 C ATOM 1783 C HIS A 115 -4.704 -18.194 -1.940 1.00 0.00 C ATOM 1784 O HIS A 115 -5.318 -18.047 -0.882 1.00 0.00 O ATOM 1785 CB HIS A 115 -5.621 -18.305 -4.306 1.00 0.00 C ATOM 1786 CG HIS A 115 -6.737 -19.240 -3.909 1.00 0.00 C ATOM 1787 ND1 HIS A 115 -8.104 -18.963 -4.012 1.00 0.00 N ATOM 1788 CD2 HIS A 115 -6.573 -20.514 -3.446 1.00 0.00 C ATOM 1789 CE1 HIS A 115 -8.730 -20.081 -3.602 1.00 0.00 C ATOM 1790 NE2 HIS A 115 -7.836 -21.024 -3.253 1.00 0.00 N ATOM 0 H HIS A 115 -3.712 -16.846 -4.582 1.00 0.00 H new ATOM 0 HA HIS A 115 -5.962 -16.758 -2.865 1.00 0.00 H new ATOM 0 HB2 HIS A 115 -5.960 -17.683 -5.134 1.00 0.00 H new ATOM 0 HB3 HIS A 115 -4.781 -18.894 -4.673 1.00 0.00 H new ATOM 0 HD2 HIS A 115 -5.637 -21.021 -3.267 1.00 0.00 H new ATOM 0 HE1 HIS A 115 -9.802 -20.205 -3.559 1.00 0.00 H new ATOM 0 HE2 HIS A 115 -8.057 -21.957 -2.905 1.00 0.00 H new ATOM 1798 N PHE A 116 -3.630 -18.991 -2.041 1.00 0.00 N ATOM 1799 CA PHE A 116 -3.166 -19.798 -0.919 1.00 0.00 C ATOM 1800 C PHE A 116 -2.857 -18.924 0.286 1.00 0.00 C ATOM 1801 O PHE A 116 -3.288 -19.228 1.395 1.00 0.00 O ATOM 1802 CB PHE A 116 -1.912 -20.593 -1.322 1.00 0.00 C ATOM 1803 CG PHE A 116 -1.047 -21.042 -0.148 1.00 0.00 C ATOM 1804 CD1 PHE A 116 -1.290 -22.271 0.493 1.00 0.00 C ATOM 1805 CD2 PHE A 116 -0.015 -20.204 0.327 1.00 0.00 C ATOM 1806 CE1 PHE A 116 -0.510 -22.651 1.601 1.00 0.00 C ATOM 1807 CE2 PHE A 116 0.747 -20.570 1.448 1.00 0.00 C ATOM 1808 CZ PHE A 116 0.504 -21.802 2.079 1.00 0.00 C ATOM 0 H PHE A 116 -3.072 -19.089 -2.889 1.00 0.00 H new ATOM 0 HA PHE A 116 -3.961 -20.493 -0.648 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -2.220 -21.472 -1.888 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -1.307 -19.980 -1.990 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -2.074 -22.922 0.135 1.00 0.00 H new ATOM 0 HD2 PHE A 116 0.191 -19.271 -0.177 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -0.691 -23.599 2.086 1.00 0.00 H new ATOM 0 HE2 PHE A 116 1.515 -19.909 1.823 1.00 0.00 H new ATOM 0 HZ PHE A 116 1.097 -22.097 2.932 1.00 0.00 H new ATOM 1818 N VAL A 117 -2.106 -17.844 0.087 1.00 0.00 N ATOM 1819 CA VAL A 117 -1.630 -17.071 1.221 1.00 0.00 C ATOM 1820 C VAL A 117 -2.809 -16.401 1.949 1.00 0.00 C ATOM 1821 O VAL A 117 -2.782 -16.261 3.174 1.00 0.00 O ATOM 1822 CB VAL A 117 -0.497 -16.134 0.763 1.00 0.00 C ATOM 1823 CG1 VAL A 117 -0.986 -14.810 0.164 1.00 0.00 C ATOM 1824 CG2 VAL A 117 0.456 -15.891 1.918 1.00 0.00 C ATOM 0 H VAL A 117 -1.821 -17.493 -0.828 1.00 0.00 H new ATOM 0 HA VAL A 117 -1.181 -17.712 1.980 1.00 0.00 H new ATOM 0 HB VAL A 117 0.022 -16.640 -0.051 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -0.128 -14.207 -0.134 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -1.607 -15.013 -0.708 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -1.570 -14.268 0.908 1.00 0.00 H new ATOM 0 HG21 VAL A 117 1.258 -15.228 1.594 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -0.084 -15.430 2.745 1.00 0.00 H new ATOM 0 HG23 VAL A 117 0.880 -16.840 2.246 1.00 0.00 H new ATOM 1834 N ASN A 118 -3.882 -16.047 1.229 1.00 0.00 N ATOM 1835 CA ASN A 118 -5.075 -15.487 1.854 1.00 0.00 C ATOM 1836 C ASN A 118 -5.859 -16.542 2.624 1.00 0.00 C ATOM 1837 O ASN A 118 -6.508 -16.197 3.610 1.00 0.00 O ATOM 1838 CB ASN A 118 -5.943 -14.725 0.847 1.00 0.00 C ATOM 1839 CG ASN A 118 -5.402 -13.306 0.729 1.00 0.00 C ATOM 1840 OD1 ASN A 118 -5.815 -12.416 1.460 1.00 0.00 O ATOM 1841 ND2 ASN A 118 -4.410 -13.078 -0.114 1.00 0.00 N ATOM 0 H ASN A 118 -3.943 -16.141 0.215 1.00 0.00 H new ATOM 0 HA ASN A 118 -4.742 -14.754 2.588 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -5.923 -15.221 -0.123 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -6.982 -14.709 1.176 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -3.982 -12.153 -0.159 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -4.073 -13.827 -0.719 1.00 0.00 H new ATOM 1848 N GLU A 119 -5.750 -17.823 2.267 1.00 0.00 N ATOM 1849 CA GLU A 119 -6.257 -18.917 3.075 1.00 0.00 C ATOM 1850 C GLU A 119 -5.671 -18.851 4.486 1.00 0.00 C ATOM 1851 O GLU A 119 -6.380 -19.073 5.461 1.00 0.00 O ATOM 1852 CB GLU A 119 -5.899 -20.254 2.402 1.00 0.00 C ATOM 1853 CG GLU A 119 -6.963 -21.305 2.678 1.00 0.00 C ATOM 1854 CD GLU A 119 -6.450 -22.732 2.410 1.00 0.00 C ATOM 1855 OE1 GLU A 119 -6.523 -23.205 1.254 1.00 0.00 O ATOM 1856 OE2 GLU A 119 -6.000 -23.393 3.375 1.00 0.00 O ATOM 0 H GLU A 119 -5.303 -18.125 1.401 1.00 0.00 H new ATOM 0 HA GLU A 119 -7.341 -18.836 3.155 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -5.797 -20.108 1.327 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -4.934 -20.603 2.769 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -7.289 -21.226 3.715 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -7.835 -21.110 2.054 1.00 0.00 H new ATOM 1863 N LEU A 120 -4.390 -18.494 4.604 1.00 0.00 N ATOM 1864 CA LEU A 120 -3.701 -18.395 5.883 1.00 0.00 C ATOM 1865 C LEU A 120 -4.151 -17.146 6.627 1.00 0.00 C ATOM 1866 O LEU A 120 -4.366 -17.182 7.837 1.00 0.00 O ATOM 1867 CB LEU A 120 -2.176 -18.323 5.697 1.00 0.00 C ATOM 1868 CG LEU A 120 -1.603 -19.242 4.612 1.00 0.00 C ATOM 1869 CD1 LEU A 120 -0.099 -19.014 4.521 1.00 0.00 C ATOM 1870 CD2 LEU A 120 -1.882 -20.721 4.852 1.00 0.00 C ATOM 0 H LEU A 120 -3.800 -18.264 3.804 1.00 0.00 H new ATOM 0 HA LEU A 120 -3.950 -19.289 6.454 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -1.904 -17.295 5.459 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -1.699 -18.568 6.646 1.00 0.00 H new ATOM 0 HG LEU A 120 -2.102 -18.985 3.678 1.00 0.00 H new ATOM 0 HD11 LEU A 120 0.321 -19.662 3.752 1.00 0.00 H new ATOM 0 HD12 LEU A 120 0.096 -17.973 4.264 1.00 0.00 H new ATOM 0 HD13 LEU A 120 0.363 -19.244 5.481 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -1.447 -21.309 4.044 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -1.440 -21.025 5.801 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -2.959 -20.888 4.883 1.00 0.00 H new ATOM 1882 N ARG A 121 -4.258 -16.025 5.904 1.00 0.00 N ATOM 1883 CA ARG A 121 -4.531 -14.727 6.508 1.00 0.00 C ATOM 1884 C ARG A 121 -5.977 -14.625 6.987 1.00 0.00 C ATOM 1885 O ARG A 121 -6.229 -13.959 7.991 1.00 0.00 O ATOM 1886 CB ARG A 121 -4.141 -13.622 5.503 1.00 0.00 C ATOM 1887 CG ARG A 121 -4.017 -12.197 6.072 1.00 0.00 C ATOM 1888 CD ARG A 121 -3.238 -12.177 7.393 1.00 0.00 C ATOM 1889 NE ARG A 121 -2.501 -10.938 7.690 1.00 0.00 N ATOM 1890 CZ ARG A 121 -3.003 -9.781 8.138 1.00 0.00 C ATOM 1891 NH1 ARG A 121 -4.298 -9.506 8.050 1.00 0.00 N ATOM 1892 NH2 ARG A 121 -2.200 -8.883 8.698 1.00 0.00 N ATOM 0 H ARG A 121 -4.157 -15.998 4.889 1.00 0.00 H new ATOM 0 HA ARG A 121 -3.926 -14.598 7.405 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -3.188 -13.893 5.049 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -4.883 -13.608 4.704 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -3.516 -11.558 5.345 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -5.012 -11.781 6.230 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -3.938 -12.364 8.207 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -2.529 -13.005 7.386 1.00 0.00 H new ATOM 0 HE ARG A 121 -1.493 -10.964 7.537 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -4.936 -10.184 7.633 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -4.655 -8.617 8.399 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -1.202 -9.076 8.786 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -2.581 -8.001 9.040 1.00 0.00 H new ATOM 1906 N TYR A 122 -6.916 -15.288 6.308 1.00 0.00 N ATOM 1907 CA TYR A 122 -8.340 -15.211 6.634 1.00 0.00 C ATOM 1908 C TYR A 122 -8.834 -16.465 7.358 1.00 0.00 C ATOM 1909 O TYR A 122 -9.704 -16.358 8.219 1.00 0.00 O ATOM 1910 CB TYR A 122 -9.172 -15.050 5.351 1.00 0.00 C ATOM 1911 CG TYR A 122 -8.971 -13.830 4.462 1.00 0.00 C ATOM 1912 CD1 TYR A 122 -8.224 -12.699 4.856 1.00 0.00 C ATOM 1913 CD2 TYR A 122 -9.603 -13.837 3.203 1.00 0.00 C ATOM 1914 CE1 TYR A 122 -8.116 -11.589 3.995 1.00 0.00 C ATOM 1915 CE2 TYR A 122 -9.507 -12.731 2.343 1.00 0.00 C ATOM 1916 CZ TYR A 122 -8.764 -11.596 2.738 1.00 0.00 C ATOM 1917 OH TYR A 122 -8.687 -10.509 1.919 1.00 0.00 O ATOM 0 H TYR A 122 -6.709 -15.895 5.515 1.00 0.00 H new ATOM 0 HA TYR A 122 -8.463 -14.349 7.290 1.00 0.00 H new ATOM 0 HB2 TYR A 122 -8.994 -15.932 4.736 1.00 0.00 H new ATOM 0 HB3 TYR A 122 -10.223 -15.070 5.641 1.00 0.00 H new ATOM 0 HD1 TYR A 122 -7.735 -12.684 5.819 1.00 0.00 H new ATOM 0 HD2 TYR A 122 -10.169 -14.704 2.895 1.00 0.00 H new ATOM 0 HE1 TYR A 122 -7.536 -10.729 4.296 1.00 0.00 H new ATOM 0 HE2 TYR A 122 -10.000 -12.748 1.382 1.00 0.00 H new ATOM 0 HH TYR A 122 -8.073 -9.851 2.306 1.00 0.00 H new ATOM 1927 N GLY A 123 -8.326 -17.646 6.998 1.00 0.00 N ATOM 1928 CA GLY A 123 -8.801 -18.942 7.475 1.00 0.00 C ATOM 1929 C GLY A 123 -9.240 -19.819 6.302 1.00 0.00 C ATOM 1930 O GLY A 123 -8.971 -21.021 6.306 1.00 0.00 O ATOM 0 H GLY A 123 -7.547 -17.726 6.345 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -8.010 -19.442 8.034 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -9.635 -18.799 8.162 1.00 0.00 H new ATOM 1934 N VAL A 124 -9.855 -19.216 5.280 1.00 0.00 N ATOM 1935 CA VAL A 124 -10.217 -19.823 4.002 1.00 0.00 C ATOM 1936 C VAL A 124 -10.088 -18.692 2.970 1.00 0.00 C ATOM 1937 O VAL A 124 -10.499 -17.563 3.258 1.00 0.00 O ATOM 1938 CB VAL A 124 -11.659 -20.393 4.038 1.00 0.00 C ATOM 1939 CG1 VAL A 124 -11.967 -21.177 2.752 1.00 0.00 C ATOM 1940 CG2 VAL A 124 -11.929 -21.338 5.223 1.00 0.00 C ATOM 0 H VAL A 124 -10.128 -18.234 5.329 1.00 0.00 H new ATOM 0 HA VAL A 124 -9.573 -20.668 3.758 1.00 0.00 H new ATOM 0 HB VAL A 124 -12.300 -19.518 4.142 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -12.983 -21.568 2.799 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -11.872 -20.515 1.891 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -11.264 -22.004 2.653 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -12.958 -21.694 5.177 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -11.248 -22.188 5.173 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -11.772 -20.802 6.159 1.00 0.00 H new ATOM 1950 N ALA A 125 -9.474 -18.962 1.809 1.00 0.00 N ATOM 1951 CA ALA A 125 -9.287 -17.969 0.758 1.00 0.00 C ATOM 1952 C ALA A 125 -10.635 -17.407 0.298 1.00 0.00 C ATOM 1953 O ALA A 125 -11.591 -18.192 0.115 1.00 0.00 O ATOM 1954 CB ALA A 125 -8.539 -18.601 -0.417 1.00 0.00 C ATOM 1955 OXT ALA A 125 -10.724 -16.183 0.073 1.00 0.00 O ATOM 0 H ALA A 125 -9.094 -19.880 1.578 1.00 0.00 H new ATOM 0 HA ALA A 125 -8.696 -17.142 1.153 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -8.400 -17.858 -1.202 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -7.566 -18.958 -0.079 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -9.117 -19.438 -0.808 1.00 0.00 H new TER 1961 ALA A 125