USER MOD reduce.3.24.130724 H: found=0, std=0, add=665, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 662 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 49 TYR OH : rot 30:sc= 0.274 USER MOD Set 1.2: A 64 ASN : amide:sc= -0.0396 X(o=0.25,f=0.39) USER MOD Set 1.3: A 66 THR OG1 : rot 180:sc= 0.0141 USER MOD Set 2.1: A 58 THR OG1 : rot 180:sc= -0.329 USER MOD Set 2.2: A 63 TYR OH : rot 180:sc= 0.608 USER MOD Set 3.1: A 1 GLY N :NH3+ -104:sc= 1.32 (180deg=0) USER MOD Set 3.2: A 4 SER OG : rot 39:sc= 1.26 USER MOD Single : A 8 LYS NZ :NH3+ -154:sc= 0.349 (180deg=-0.244) USER MOD Single : A 11 THR OG1 : rot -14:sc= -1.35 USER MOD Single : A 12 THR OG1 : rot 62:sc= 0.245 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot -169:sc= -1.66 USER MOD Single : A 31 MET CE :methyl -146:sc= -0.836 (180deg=-2.64!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ -150:sc= 0.54 (180deg=0.218) USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 THR OG1 : rot -150:sc= -0.0413 USER MOD Single : A 44 GLN : amide:sc= -1.13 K(o=-1.1,f=-0.14) USER MOD Single : A 50 ASN : amide:sc= -0.0296 K(o=-0.03,f=-0.63) USER MOD Single : A 59 THR OG1 : rot 180:sc= -0.981 USER MOD Single : A 70 THR OG1 : rot 180:sc= -0.0848 USER MOD Single : A 74 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.01) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -1.179 -1.454 2.237 1.00 0.00 N ATOM 2 CA GLY A 1 -0.088 -2.454 2.219 1.00 0.00 C ATOM 3 C GLY A 1 0.149 -3.032 0.829 1.00 0.00 C ATOM 4 O GLY A 1 -0.361 -2.480 -0.157 1.00 0.00 O ATOM 0 H1 GLY A 1 -0.773 -0.498 2.294 1.00 0.00 H new ATOM 0 H2 GLY A 1 -1.742 -1.539 1.367 1.00 0.00 H new ATOM 0 H3 GLY A 1 -1.789 -1.621 3.062 1.00 0.00 H new ATOM 0 HA2 GLY A 1 0.831 -1.991 2.578 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -0.329 -3.262 2.909 1.00 0.00 H new ATOM 7 N PRO A 2 0.931 -4.150 0.713 1.00 0.00 N ATOM 8 CA PRO A 2 1.232 -4.794 -0.587 1.00 0.00 C ATOM 9 C PRO A 2 -0.046 -5.316 -1.287 1.00 0.00 C ATOM 10 O PRO A 2 -0.579 -6.382 -0.939 1.00 0.00 O ATOM 11 CB PRO A 2 2.214 -5.943 -0.213 1.00 0.00 C ATOM 12 CG PRO A 2 1.956 -6.207 1.246 1.00 0.00 C ATOM 13 CD PRO A 2 1.590 -4.865 1.838 1.00 0.00 C ATOM 0 HA PRO A 2 1.664 -4.100 -1.308 1.00 0.00 H new ATOM 0 HB2 PRO A 2 2.030 -6.833 -0.815 1.00 0.00 H new ATOM 0 HB3 PRO A 2 3.250 -5.650 -0.385 1.00 0.00 H new ATOM 0 HG2 PRO A 2 1.149 -6.928 1.378 1.00 0.00 H new ATOM 0 HG3 PRO A 2 2.838 -6.623 1.732 1.00 0.00 H new ATOM 0 HD2 PRO A 2 0.920 -4.973 2.691 1.00 0.00 H new ATOM 0 HD3 PRO A 2 2.471 -4.330 2.191 1.00 0.00 H new ATOM 21 N GLY A 3 -0.563 -4.511 -2.229 1.00 0.00 N ATOM 22 CA GLY A 3 -1.723 -4.883 -3.043 1.00 0.00 C ATOM 23 C GLY A 3 -2.809 -3.813 -3.069 1.00 0.00 C ATOM 24 O GLY A 3 -3.550 -3.719 -4.055 1.00 0.00 O ATOM 0 H GLY A 3 -0.187 -3.587 -2.445 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -1.394 -5.082 -4.063 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -2.146 -5.811 -2.658 1.00 0.00 H new ATOM 28 N SER A 4 -2.926 -3.013 -1.985 1.00 0.00 N ATOM 29 CA SER A 4 -3.926 -1.938 -1.904 1.00 0.00 C ATOM 30 C SER A 4 -3.504 -0.764 -2.813 1.00 0.00 C ATOM 31 O SER A 4 -2.450 -0.144 -2.606 1.00 0.00 O ATOM 32 CB SER A 4 -4.119 -1.479 -0.436 1.00 0.00 C ATOM 33 OG SER A 4 -2.894 -1.114 0.161 1.00 0.00 O ATOM 0 H SER A 4 -2.337 -3.096 -1.156 1.00 0.00 H new ATOM 0 HA SER A 4 -4.886 -2.315 -2.255 1.00 0.00 H new ATOM 0 HB2 SER A 4 -4.805 -0.632 -0.406 1.00 0.00 H new ATOM 0 HB3 SER A 4 -4.579 -2.282 0.139 1.00 0.00 H new ATOM 0 HG SER A 4 -2.341 -0.637 -0.493 1.00 0.00 H new ATOM 39 N LEU A 5 -4.327 -0.506 -3.834 1.00 0.00 N ATOM 40 CA LEU A 5 -4.070 0.484 -4.895 1.00 0.00 C ATOM 41 C LEU A 5 -4.730 1.842 -4.576 1.00 0.00 C ATOM 42 O LEU A 5 -5.884 1.900 -4.131 1.00 0.00 O ATOM 43 CB LEU A 5 -4.525 -0.108 -6.270 1.00 0.00 C ATOM 44 CG LEU A 5 -5.842 -0.969 -6.301 1.00 0.00 C ATOM 45 CD1 LEU A 5 -7.130 -0.109 -6.263 1.00 0.00 C ATOM 46 CD2 LEU A 5 -5.836 -1.934 -7.506 1.00 0.00 C ATOM 0 H LEU A 5 -5.216 -0.991 -3.952 1.00 0.00 H new ATOM 0 HA LEU A 5 -3.001 0.688 -4.952 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -4.651 0.721 -6.966 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -3.713 -0.725 -6.654 1.00 0.00 H new ATOM 0 HG LEU A 5 -5.854 -1.562 -5.386 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -8.003 -0.761 -6.287 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -7.145 0.484 -5.349 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -7.149 0.555 -7.127 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -6.755 -2.519 -7.508 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -5.769 -1.361 -8.431 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -4.980 -2.604 -7.431 1.00 0.00 H new ATOM 58 N GLU A 6 -3.971 2.926 -4.809 1.00 0.00 N ATOM 59 CA GLU A 6 -4.401 4.296 -4.482 1.00 0.00 C ATOM 60 C GLU A 6 -5.185 4.902 -5.653 1.00 0.00 C ATOM 61 O GLU A 6 -4.614 5.218 -6.697 1.00 0.00 O ATOM 62 CB GLU A 6 -3.187 5.196 -4.131 1.00 0.00 C ATOM 63 CG GLU A 6 -3.586 6.635 -3.728 1.00 0.00 C ATOM 64 CD GLU A 6 -2.390 7.557 -3.462 1.00 0.00 C ATOM 65 OE1 GLU A 6 -1.822 8.099 -4.436 1.00 0.00 O ATOM 66 OE2 GLU A 6 -2.014 7.745 -2.285 1.00 0.00 O ATOM 0 H GLU A 6 -3.043 2.877 -5.229 1.00 0.00 H new ATOM 0 HA GLU A 6 -5.050 4.244 -3.608 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -2.630 4.739 -3.313 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -2.516 5.240 -4.989 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -4.197 7.068 -4.520 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -4.207 6.593 -2.833 1.00 0.00 H new ATOM 73 N ILE A 7 -6.495 5.049 -5.469 1.00 0.00 N ATOM 74 CA ILE A 7 -7.396 5.654 -6.461 1.00 0.00 C ATOM 75 C ILE A 7 -7.892 7.034 -5.987 1.00 0.00 C ATOM 76 O ILE A 7 -7.636 7.451 -4.849 1.00 0.00 O ATOM 77 CB ILE A 7 -8.627 4.713 -6.736 1.00 0.00 C ATOM 78 CG1 ILE A 7 -9.463 4.479 -5.427 1.00 0.00 C ATOM 79 CG2 ILE A 7 -8.148 3.368 -7.334 1.00 0.00 C ATOM 80 CD1 ILE A 7 -10.765 3.725 -5.629 1.00 0.00 C ATOM 0 H ILE A 7 -6.971 4.749 -4.618 1.00 0.00 H new ATOM 0 HA ILE A 7 -6.834 5.785 -7.385 1.00 0.00 H new ATOM 0 HB ILE A 7 -9.279 5.202 -7.460 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -8.848 3.930 -4.714 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -9.686 5.447 -4.977 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -9.009 2.725 -7.520 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -7.624 3.553 -8.272 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -7.474 2.877 -6.632 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -11.272 3.612 -4.671 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -11.405 4.281 -6.315 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -10.554 2.741 -6.047 1.00 0.00 H new ATOM 92 N LYS A 8 -8.602 7.739 -6.883 1.00 0.00 N ATOM 93 CA LYS A 8 -9.261 9.028 -6.575 1.00 0.00 C ATOM 94 C LYS A 8 -10.776 8.907 -6.787 1.00 0.00 C ATOM 95 O LYS A 8 -11.225 8.079 -7.581 1.00 0.00 O ATOM 96 CB LYS A 8 -8.678 10.181 -7.448 1.00 0.00 C ATOM 97 CG LYS A 8 -7.168 10.500 -7.182 1.00 0.00 C ATOM 98 CD LYS A 8 -6.212 9.906 -8.246 1.00 0.00 C ATOM 99 CE LYS A 8 -6.374 10.592 -9.613 1.00 0.00 C ATOM 100 NZ LYS A 8 -5.390 10.107 -10.613 1.00 0.00 N ATOM 0 H LYS A 8 -8.738 7.433 -7.847 1.00 0.00 H new ATOM 0 HA LYS A 8 -9.067 9.271 -5.530 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -8.801 9.921 -8.499 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -9.263 11.084 -7.272 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -7.034 11.581 -7.149 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -6.891 10.114 -6.201 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -5.181 10.012 -7.907 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -6.405 8.838 -8.351 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -7.383 10.417 -9.986 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -6.262 11.669 -9.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -5.228 10.846 -11.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -4.493 9.883 -10.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -5.759 9.252 -11.077 1.00 0.00 H new ATOM 114 N ILE A 9 -11.570 9.704 -6.030 1.00 0.00 N ATOM 115 CA ILE A 9 -13.045 9.755 -6.181 1.00 0.00 C ATOM 116 C ILE A 9 -13.495 11.234 -6.264 1.00 0.00 C ATOM 117 O ILE A 9 -13.602 11.926 -5.242 1.00 0.00 O ATOM 118 CB ILE A 9 -13.854 9.038 -5.007 1.00 0.00 C ATOM 119 CG1 ILE A 9 -13.441 7.530 -4.791 1.00 0.00 C ATOM 120 CG2 ILE A 9 -15.386 9.137 -5.274 1.00 0.00 C ATOM 121 CD1 ILE A 9 -12.169 7.307 -3.981 1.00 0.00 C ATOM 0 H ILE A 9 -11.210 10.324 -5.304 1.00 0.00 H new ATOM 0 HA ILE A 9 -13.274 9.206 -7.094 1.00 0.00 H new ATOM 0 HB ILE A 9 -13.598 9.566 -4.088 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -14.263 7.014 -4.294 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -13.316 7.062 -5.768 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -15.929 8.645 -4.467 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -15.680 10.186 -5.322 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -15.623 8.650 -6.220 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -11.977 6.238 -3.892 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -11.329 7.786 -4.484 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -12.291 7.737 -2.987 1.00 0.00 H new ATOM 133 N ARG A 10 -13.710 11.719 -7.490 1.00 0.00 N ATOM 134 CA ARG A 10 -14.256 13.057 -7.749 1.00 0.00 C ATOM 135 C ARG A 10 -15.784 13.065 -7.492 1.00 0.00 C ATOM 136 O ARG A 10 -16.549 12.395 -8.190 1.00 0.00 O ATOM 137 CB ARG A 10 -13.933 13.478 -9.206 1.00 0.00 C ATOM 138 CG ARG A 10 -14.341 14.924 -9.562 1.00 0.00 C ATOM 139 CD ARG A 10 -13.946 15.315 -10.993 1.00 0.00 C ATOM 140 NE ARG A 10 -14.328 16.706 -11.299 1.00 0.00 N ATOM 141 CZ ARG A 10 -13.482 17.696 -11.612 1.00 0.00 C ATOM 142 NH1 ARG A 10 -12.168 17.490 -11.661 1.00 0.00 N ATOM 143 NH2 ARG A 10 -13.952 18.902 -11.875 1.00 0.00 N ATOM 0 H ARG A 10 -13.509 11.191 -8.339 1.00 0.00 H new ATOM 0 HA ARG A 10 -13.796 13.777 -7.072 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -12.862 13.365 -9.374 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -14.437 12.794 -9.888 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -15.419 15.032 -9.444 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -13.873 15.613 -8.859 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -12.870 15.196 -11.120 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -14.427 14.640 -11.701 1.00 0.00 H new ATOM 0 HE ARG A 10 -15.322 16.934 -11.270 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -11.789 16.565 -11.458 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -11.540 18.257 -11.901 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -14.956 19.077 -11.839 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -13.311 19.658 -12.114 1.00 0.00 H new ATOM 157 N THR A 11 -16.207 13.811 -6.469 1.00 0.00 N ATOM 158 CA THR A 11 -17.605 13.858 -6.008 1.00 0.00 C ATOM 159 C THR A 11 -18.487 14.833 -6.830 1.00 0.00 C ATOM 160 O THR A 11 -17.993 15.552 -7.703 1.00 0.00 O ATOM 161 CB THR A 11 -17.619 14.305 -4.520 1.00 0.00 C ATOM 162 OG1 THR A 11 -17.124 15.649 -4.440 1.00 0.00 O ATOM 163 CG2 THR A 11 -16.746 13.399 -3.637 1.00 0.00 C ATOM 0 H THR A 11 -15.583 14.409 -5.927 1.00 0.00 H new ATOM 0 HA THR A 11 -18.024 12.860 -6.137 1.00 0.00 H new ATOM 0 HB THR A 11 -18.644 14.239 -4.156 1.00 0.00 H new ATOM 0 HG1 THR A 11 -16.689 15.888 -5.285 1.00 0.00 H new ATOM 0 HG21 THR A 11 -16.786 13.749 -2.605 1.00 0.00 H new ATOM 0 HG22 THR A 11 -17.117 12.375 -3.688 1.00 0.00 H new ATOM 0 HG23 THR A 11 -15.716 13.430 -3.991 1.00 0.00 H new ATOM 171 N THR A 12 -19.801 14.860 -6.497 1.00 0.00 N ATOM 172 CA THR A 12 -20.755 15.883 -6.995 1.00 0.00 C ATOM 173 C THR A 12 -20.484 17.269 -6.366 1.00 0.00 C ATOM 174 O THR A 12 -21.053 18.280 -6.804 1.00 0.00 O ATOM 175 CB THR A 12 -22.238 15.460 -6.702 1.00 0.00 C ATOM 176 OG1 THR A 12 -22.323 14.847 -5.401 1.00 0.00 O ATOM 177 CG2 THR A 12 -22.788 14.499 -7.764 1.00 0.00 C ATOM 0 H THR A 12 -20.229 14.174 -5.876 1.00 0.00 H new ATOM 0 HA THR A 12 -20.608 15.955 -8.073 1.00 0.00 H new ATOM 0 HB THR A 12 -22.847 16.364 -6.730 1.00 0.00 H new ATOM 0 HG1 THR A 12 -22.063 15.497 -4.715 1.00 0.00 H new ATOM 0 HG21 THR A 12 -23.817 14.235 -7.518 1.00 0.00 H new ATOM 0 HG22 THR A 12 -22.761 14.982 -8.741 1.00 0.00 H new ATOM 0 HG23 THR A 12 -22.178 13.596 -7.789 1.00 0.00 H new ATOM 185 N GLU A 13 -19.638 17.302 -5.318 1.00 0.00 N ATOM 186 CA GLU A 13 -19.189 18.558 -4.681 1.00 0.00 C ATOM 187 C GLU A 13 -18.123 19.239 -5.568 1.00 0.00 C ATOM 188 O GLU A 13 -17.830 20.431 -5.410 1.00 0.00 O ATOM 189 CB GLU A 13 -18.613 18.285 -3.254 1.00 0.00 C ATOM 190 CG GLU A 13 -19.374 17.225 -2.416 1.00 0.00 C ATOM 191 CD GLU A 13 -20.893 17.451 -2.343 1.00 0.00 C ATOM 192 OE1 GLU A 13 -21.656 16.692 -2.986 1.00 0.00 O ATOM 193 OE2 GLU A 13 -21.330 18.399 -1.658 1.00 0.00 O ATOM 0 H GLU A 13 -19.247 16.463 -4.890 1.00 0.00 H new ATOM 0 HA GLU A 13 -20.047 19.222 -4.576 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -17.576 17.966 -3.355 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -18.605 19.223 -2.699 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -19.185 16.239 -2.840 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -18.970 17.220 -1.404 1.00 0.00 H new ATOM 200 N GLY A 14 -17.538 18.444 -6.490 1.00 0.00 N ATOM 201 CA GLY A 14 -16.489 18.902 -7.399 1.00 0.00 C ATOM 202 C GLY A 14 -15.104 18.494 -6.922 1.00 0.00 C ATOM 203 O GLY A 14 -14.167 18.411 -7.726 1.00 0.00 O ATOM 0 H GLY A 14 -17.788 17.463 -6.617 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -16.666 18.491 -8.393 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -16.536 19.987 -7.490 1.00 0.00 H new ATOM 207 N ARG A 15 -14.986 18.241 -5.598 1.00 0.00 N ATOM 208 CA ARG A 15 -13.717 17.885 -4.944 1.00 0.00 C ATOM 209 C ARG A 15 -13.257 16.478 -5.364 1.00 0.00 C ATOM 210 O ARG A 15 -14.075 15.568 -5.530 1.00 0.00 O ATOM 211 CB ARG A 15 -13.863 17.962 -3.392 1.00 0.00 C ATOM 212 CG ARG A 15 -14.785 16.879 -2.782 1.00 0.00 C ATOM 213 CD ARG A 15 -15.021 17.051 -1.280 1.00 0.00 C ATOM 214 NE ARG A 15 -15.868 18.217 -0.993 1.00 0.00 N ATOM 215 CZ ARG A 15 -16.332 18.573 0.216 1.00 0.00 C ATOM 216 NH1 ARG A 15 -15.989 17.900 1.312 1.00 0.00 N ATOM 217 NH2 ARG A 15 -17.131 19.618 0.338 1.00 0.00 N ATOM 0 H ARG A 15 -15.776 18.280 -4.955 1.00 0.00 H new ATOM 0 HA ARG A 15 -12.961 18.602 -5.263 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -12.874 17.876 -2.942 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -14.251 18.945 -3.124 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -15.745 16.899 -3.297 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -14.347 15.897 -2.963 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -15.491 16.152 -0.880 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -14.063 17.163 -0.772 1.00 0.00 H new ATOM 0 HE ARG A 15 -16.127 18.809 -1.782 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -15.363 17.098 1.243 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -16.352 18.187 2.221 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -17.397 20.156 -0.487 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -17.482 19.887 1.257 1.00 0.00 H new ATOM 231 N THR A 16 -11.946 16.325 -5.552 1.00 0.00 N ATOM 232 CA THR A 16 -11.319 15.033 -5.835 1.00 0.00 C ATOM 233 C THR A 16 -10.727 14.463 -4.533 1.00 0.00 C ATOM 234 O THR A 16 -9.900 15.106 -3.878 1.00 0.00 O ATOM 235 CB THR A 16 -10.218 15.189 -6.934 1.00 0.00 C ATOM 236 OG1 THR A 16 -10.796 15.804 -8.099 1.00 0.00 O ATOM 237 CG2 THR A 16 -9.604 13.836 -7.337 1.00 0.00 C ATOM 0 H THR A 16 -11.284 17.100 -5.512 1.00 0.00 H new ATOM 0 HA THR A 16 -12.068 14.339 -6.216 1.00 0.00 H new ATOM 0 HB THR A 16 -9.423 15.809 -6.519 1.00 0.00 H new ATOM 0 HG1 THR A 16 -10.109 15.905 -8.790 1.00 0.00 H new ATOM 0 HG21 THR A 16 -8.845 13.995 -8.103 1.00 0.00 H new ATOM 0 HG22 THR A 16 -9.147 13.369 -6.464 1.00 0.00 H new ATOM 0 HG23 THR A 16 -10.385 13.185 -7.730 1.00 0.00 H new ATOM 245 N LEU A 17 -11.198 13.270 -4.156 1.00 0.00 N ATOM 246 CA LEU A 17 -10.726 12.534 -2.970 1.00 0.00 C ATOM 247 C LEU A 17 -9.582 11.613 -3.394 1.00 0.00 C ATOM 248 O LEU A 17 -9.398 11.388 -4.587 1.00 0.00 O ATOM 249 CB LEU A 17 -11.889 11.708 -2.351 1.00 0.00 C ATOM 250 CG LEU A 17 -13.170 12.520 -1.971 1.00 0.00 C ATOM 251 CD1 LEU A 17 -14.314 11.581 -1.536 1.00 0.00 C ATOM 252 CD2 LEU A 17 -12.875 13.591 -0.892 1.00 0.00 C ATOM 0 H LEU A 17 -11.928 12.778 -4.671 1.00 0.00 H new ATOM 0 HA LEU A 17 -10.372 13.235 -2.214 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -12.172 10.928 -3.057 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -11.519 11.208 -1.456 1.00 0.00 H new ATOM 0 HG LEU A 17 -13.496 13.051 -2.866 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -15.192 12.173 -1.278 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -14.560 10.904 -2.354 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -13.999 11.001 -0.668 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -13.791 14.132 -0.657 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -12.499 13.106 0.009 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -12.127 14.289 -1.267 1.00 0.00 H new ATOM 264 N THR A 18 -8.810 11.090 -2.434 1.00 0.00 N ATOM 265 CA THR A 18 -7.717 10.147 -2.721 1.00 0.00 C ATOM 266 C THR A 18 -7.601 9.128 -1.569 1.00 0.00 C ATOM 267 O THR A 18 -7.242 9.497 -0.446 1.00 0.00 O ATOM 268 CB THR A 18 -6.350 10.904 -2.922 1.00 0.00 C ATOM 269 OG1 THR A 18 -6.471 11.863 -3.987 1.00 0.00 O ATOM 270 CG2 THR A 18 -5.184 9.951 -3.255 1.00 0.00 C ATOM 0 H THR A 18 -8.922 11.305 -1.443 1.00 0.00 H new ATOM 0 HA THR A 18 -7.945 9.622 -3.649 1.00 0.00 H new ATOM 0 HB THR A 18 -6.126 11.397 -1.976 1.00 0.00 H new ATOM 0 HG1 THR A 18 -5.618 12.331 -4.105 1.00 0.00 H new ATOM 0 HG21 THR A 18 -4.268 10.528 -3.383 1.00 0.00 H new ATOM 0 HG22 THR A 18 -5.053 9.238 -2.441 1.00 0.00 H new ATOM 0 HG23 THR A 18 -5.406 9.413 -4.177 1.00 0.00 H new ATOM 278 N VAL A 19 -7.949 7.854 -1.843 1.00 0.00 N ATOM 279 CA VAL A 19 -7.835 6.750 -0.861 1.00 0.00 C ATOM 280 C VAL A 19 -7.172 5.533 -1.523 1.00 0.00 C ATOM 281 O VAL A 19 -7.235 5.374 -2.744 1.00 0.00 O ATOM 282 CB VAL A 19 -9.234 6.315 -0.248 1.00 0.00 C ATOM 283 CG1 VAL A 19 -9.922 7.482 0.501 1.00 0.00 C ATOM 284 CG2 VAL A 19 -10.183 5.705 -1.319 1.00 0.00 C ATOM 0 H VAL A 19 -8.316 7.560 -2.748 1.00 0.00 H new ATOM 0 HA VAL A 19 -7.224 7.123 -0.039 1.00 0.00 H new ATOM 0 HB VAL A 19 -9.020 5.532 0.480 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -10.876 7.143 0.905 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -9.282 7.819 1.316 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -10.094 8.307 -0.190 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -11.126 5.423 -0.851 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -10.371 6.441 -2.100 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -9.717 4.822 -1.757 1.00 0.00 H new ATOM 294 N ASP A 20 -6.540 4.681 -0.704 1.00 0.00 N ATOM 295 CA ASP A 20 -6.015 3.378 -1.151 1.00 0.00 C ATOM 296 C ASP A 20 -6.943 2.276 -0.627 1.00 0.00 C ATOM 297 O ASP A 20 -7.365 2.304 0.536 1.00 0.00 O ATOM 298 CB ASP A 20 -4.536 3.147 -0.709 1.00 0.00 C ATOM 299 CG ASP A 20 -4.327 3.054 0.811 1.00 0.00 C ATOM 300 OD1 ASP A 20 -4.283 1.927 1.355 1.00 0.00 O ATOM 301 OD2 ASP A 20 -4.214 4.112 1.469 1.00 0.00 O ATOM 0 H ASP A 20 -6.377 4.872 0.285 1.00 0.00 H new ATOM 0 HA ASP A 20 -5.999 3.358 -2.241 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -4.173 2.228 -1.169 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -3.924 3.961 -1.097 1.00 0.00 H new ATOM 306 N VAL A 21 -7.289 1.342 -1.515 1.00 0.00 N ATOM 307 CA VAL A 21 -8.225 0.231 -1.245 1.00 0.00 C ATOM 308 C VAL A 21 -7.728 -1.033 -1.953 1.00 0.00 C ATOM 309 O VAL A 21 -6.966 -0.954 -2.919 1.00 0.00 O ATOM 310 CB VAL A 21 -9.690 0.553 -1.740 1.00 0.00 C ATOM 311 CG1 VAL A 21 -10.407 1.575 -0.828 1.00 0.00 C ATOM 312 CG2 VAL A 21 -9.659 1.036 -3.209 1.00 0.00 C ATOM 0 H VAL A 21 -6.922 1.330 -2.466 1.00 0.00 H new ATOM 0 HA VAL A 21 -8.259 0.084 -0.166 1.00 0.00 H new ATOM 0 HB VAL A 21 -10.269 -0.369 -1.684 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -11.410 1.763 -1.211 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -10.473 1.176 0.184 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -9.844 2.508 -0.814 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -10.674 1.256 -3.541 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -9.050 1.937 -3.283 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -9.231 0.256 -3.839 1.00 0.00 H new ATOM 322 N LYS A 22 -8.181 -2.193 -1.475 1.00 0.00 N ATOM 323 CA LYS A 22 -7.802 -3.491 -2.050 1.00 0.00 C ATOM 324 C LYS A 22 -8.707 -3.822 -3.264 1.00 0.00 C ATOM 325 O LYS A 22 -9.920 -3.634 -3.181 1.00 0.00 O ATOM 326 CB LYS A 22 -7.901 -4.582 -0.960 1.00 0.00 C ATOM 327 CG LYS A 22 -7.004 -4.322 0.272 1.00 0.00 C ATOM 328 CD LYS A 22 -7.119 -5.430 1.346 1.00 0.00 C ATOM 329 CE LYS A 22 -6.679 -6.806 0.824 1.00 0.00 C ATOM 330 NZ LYS A 22 -6.757 -7.858 1.873 1.00 0.00 N ATOM 0 H LYS A 22 -8.818 -2.263 -0.682 1.00 0.00 H new ATOM 0 HA LYS A 22 -6.773 -3.450 -2.406 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -8.938 -4.661 -0.632 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -7.631 -5.543 -1.397 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -5.966 -4.243 -0.051 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -7.274 -3.364 0.716 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -6.509 -5.160 2.208 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -8.151 -5.490 1.692 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -7.307 -7.090 -0.020 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -5.656 -6.741 0.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -6.451 -8.769 1.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -6.138 -7.602 2.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -7.737 -7.940 2.210 1.00 0.00 H new ATOM 344 N PRO A 23 -8.128 -4.318 -4.408 1.00 0.00 N ATOM 345 CA PRO A 23 -8.892 -4.614 -5.654 1.00 0.00 C ATOM 346 C PRO A 23 -9.964 -5.726 -5.484 1.00 0.00 C ATOM 347 O PRO A 23 -10.876 -5.840 -6.310 1.00 0.00 O ATOM 348 CB PRO A 23 -7.791 -5.033 -6.671 1.00 0.00 C ATOM 349 CG PRO A 23 -6.639 -5.474 -5.818 1.00 0.00 C ATOM 350 CD PRO A 23 -6.681 -4.600 -4.585 1.00 0.00 C ATOM 0 HA PRO A 23 -9.474 -3.750 -5.974 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -8.136 -5.838 -7.319 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -7.511 -4.201 -7.317 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -6.729 -6.528 -5.554 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -5.693 -5.358 -6.348 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -6.263 -5.110 -3.717 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -6.108 -3.683 -4.723 1.00 0.00 H new ATOM 358 N ASP A 24 -9.861 -6.527 -4.410 1.00 0.00 N ATOM 359 CA ASP A 24 -10.826 -7.616 -4.135 1.00 0.00 C ATOM 360 C ASP A 24 -12.048 -7.113 -3.344 1.00 0.00 C ATOM 361 O ASP A 24 -12.993 -7.875 -3.131 1.00 0.00 O ATOM 362 CB ASP A 24 -10.143 -8.792 -3.390 1.00 0.00 C ATOM 363 CG ASP A 24 -9.646 -8.434 -1.977 1.00 0.00 C ATOM 364 OD1 ASP A 24 -8.682 -7.651 -1.861 1.00 0.00 O ATOM 365 OD2 ASP A 24 -10.200 -8.950 -0.985 1.00 0.00 O ATOM 0 H ASP A 24 -9.119 -6.444 -3.715 1.00 0.00 H new ATOM 0 HA ASP A 24 -11.182 -7.978 -5.099 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -10.847 -9.621 -3.317 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -9.298 -9.143 -3.983 1.00 0.00 H new ATOM 370 N ARG A 25 -12.032 -5.825 -2.923 1.00 0.00 N ATOM 371 CA ARG A 25 -13.173 -5.203 -2.205 1.00 0.00 C ATOM 372 C ARG A 25 -14.334 -4.949 -3.178 1.00 0.00 C ATOM 373 O ARG A 25 -14.166 -5.066 -4.392 1.00 0.00 O ATOM 374 CB ARG A 25 -12.752 -3.867 -1.512 1.00 0.00 C ATOM 375 CG ARG A 25 -11.629 -4.006 -0.473 1.00 0.00 C ATOM 376 CD ARG A 25 -11.955 -4.991 0.662 1.00 0.00 C ATOM 377 NE ARG A 25 -13.034 -4.511 1.548 1.00 0.00 N ATOM 378 CZ ARG A 25 -13.578 -5.215 2.572 1.00 0.00 C ATOM 379 NH1 ARG A 25 -13.245 -6.482 2.796 1.00 0.00 N ATOM 380 NH2 ARG A 25 -14.456 -4.650 3.376 1.00 0.00 N ATOM 0 H ARG A 25 -11.242 -5.196 -3.068 1.00 0.00 H new ATOM 0 HA ARG A 25 -13.498 -5.896 -1.429 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -12.433 -3.161 -2.279 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -13.627 -3.435 -1.025 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -10.719 -4.333 -0.976 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -11.421 -3.026 -0.043 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -12.245 -5.950 0.232 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -11.057 -5.165 1.254 1.00 0.00 H new ATOM 0 HE ARG A 25 -13.400 -3.575 1.376 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -12.567 -6.946 2.191 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -13.668 -6.991 3.572 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -14.730 -3.678 3.230 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -14.862 -5.184 4.144 1.00 0.00 H new ATOM 394 N THR A 26 -15.502 -4.605 -2.632 1.00 0.00 N ATOM 395 CA THR A 26 -16.696 -4.283 -3.421 1.00 0.00 C ATOM 396 C THR A 26 -16.775 -2.773 -3.657 1.00 0.00 C ATOM 397 O THR A 26 -16.094 -1.989 -2.978 1.00 0.00 O ATOM 398 CB THR A 26 -17.987 -4.770 -2.697 1.00 0.00 C ATOM 399 OG1 THR A 26 -18.008 -4.243 -1.362 1.00 0.00 O ATOM 400 CG2 THR A 26 -18.068 -6.304 -2.646 1.00 0.00 C ATOM 0 H THR A 26 -15.648 -4.541 -1.625 1.00 0.00 H new ATOM 0 HA THR A 26 -16.621 -4.797 -4.379 1.00 0.00 H new ATOM 0 HB THR A 26 -18.848 -4.410 -3.261 1.00 0.00 H new ATOM 0 HG1 THR A 26 -18.719 -4.681 -0.849 1.00 0.00 H new ATOM 0 HG21 THR A 26 -18.982 -6.603 -2.133 1.00 0.00 H new ATOM 0 HG22 THR A 26 -18.074 -6.702 -3.661 1.00 0.00 H new ATOM 0 HG23 THR A 26 -17.205 -6.696 -2.108 1.00 0.00 H new ATOM 408 N ILE A 27 -17.608 -2.370 -4.633 1.00 0.00 N ATOM 409 CA ILE A 27 -17.852 -0.952 -4.931 1.00 0.00 C ATOM 410 C ILE A 27 -18.597 -0.313 -3.738 1.00 0.00 C ATOM 411 O ILE A 27 -18.431 0.869 -3.481 1.00 0.00 O ATOM 412 CB ILE A 27 -18.646 -0.770 -6.281 1.00 0.00 C ATOM 413 CG1 ILE A 27 -17.900 -1.467 -7.469 1.00 0.00 C ATOM 414 CG2 ILE A 27 -18.925 0.722 -6.603 1.00 0.00 C ATOM 415 CD1 ILE A 27 -16.499 -0.954 -7.764 1.00 0.00 C ATOM 0 H ILE A 27 -18.126 -3.014 -5.231 1.00 0.00 H new ATOM 0 HA ILE A 27 -16.897 -0.444 -5.069 1.00 0.00 H new ATOM 0 HB ILE A 27 -19.613 -1.255 -6.148 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -17.838 -2.535 -7.258 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -18.505 -1.354 -8.369 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -19.474 0.795 -7.542 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -19.517 1.163 -5.801 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -17.980 1.258 -6.693 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -16.078 -1.507 -8.604 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -16.545 0.106 -8.014 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -15.868 -1.093 -6.886 1.00 0.00 H new ATOM 427 N GLU A 28 -19.377 -1.153 -2.997 1.00 0.00 N ATOM 428 CA GLU A 28 -19.997 -0.803 -1.690 1.00 0.00 C ATOM 429 C GLU A 28 -18.976 -0.144 -0.748 1.00 0.00 C ATOM 430 O GLU A 28 -19.273 0.865 -0.105 1.00 0.00 O ATOM 431 CB GLU A 28 -20.558 -2.094 -1.006 1.00 0.00 C ATOM 432 CG GLU A 28 -21.744 -2.779 -1.728 1.00 0.00 C ATOM 433 CD GLU A 28 -23.123 -2.164 -1.414 1.00 0.00 C ATOM 434 OE1 GLU A 28 -24.016 -2.890 -0.921 1.00 0.00 O ATOM 435 OE2 GLU A 28 -23.322 -0.960 -1.650 1.00 0.00 O ATOM 0 H GLU A 28 -19.593 -2.103 -3.297 1.00 0.00 H new ATOM 0 HA GLU A 28 -20.805 -0.097 -1.882 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -19.747 -2.816 -0.915 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -20.872 -1.839 0.006 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -21.575 -2.731 -2.804 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -21.760 -3.834 -1.454 1.00 0.00 H new ATOM 442 N GLU A 29 -17.766 -0.740 -0.697 1.00 0.00 N ATOM 443 CA GLU A 29 -16.662 -0.256 0.145 1.00 0.00 C ATOM 444 C GLU A 29 -16.215 1.131 -0.300 1.00 0.00 C ATOM 445 O GLU A 29 -15.997 1.992 0.533 1.00 0.00 O ATOM 446 CB GLU A 29 -15.465 -1.251 0.135 1.00 0.00 C ATOM 447 CG GLU A 29 -15.835 -2.682 0.577 1.00 0.00 C ATOM 448 CD GLU A 29 -16.601 -2.719 1.911 1.00 0.00 C ATOM 449 OE1 GLU A 29 -16.021 -2.315 2.943 1.00 0.00 O ATOM 450 OE2 GLU A 29 -17.779 -3.143 1.936 1.00 0.00 O ATOM 0 H GLU A 29 -17.531 -1.571 -1.240 1.00 0.00 H new ATOM 0 HA GLU A 29 -17.028 -0.188 1.169 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -15.046 -1.289 -0.871 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -14.683 -0.870 0.792 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -16.442 -3.150 -0.198 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -14.925 -3.275 0.670 1.00 0.00 H new ATOM 457 N LEU A 30 -16.126 1.332 -1.629 1.00 0.00 N ATOM 458 CA LEU A 30 -15.751 2.632 -2.225 1.00 0.00 C ATOM 459 C LEU A 30 -16.768 3.707 -1.850 1.00 0.00 C ATOM 460 O LEU A 30 -16.393 4.826 -1.520 1.00 0.00 O ATOM 461 CB LEU A 30 -15.657 2.534 -3.766 1.00 0.00 C ATOM 462 CG LEU A 30 -14.649 1.490 -4.321 1.00 0.00 C ATOM 463 CD1 LEU A 30 -14.611 1.505 -5.864 1.00 0.00 C ATOM 464 CD2 LEU A 30 -13.246 1.693 -3.713 1.00 0.00 C ATOM 0 H LEU A 30 -16.311 0.603 -2.318 1.00 0.00 H new ATOM 0 HA LEU A 30 -14.772 2.904 -1.829 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -16.647 2.297 -4.156 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -15.386 3.515 -4.157 1.00 0.00 H new ATOM 0 HG LEU A 30 -14.996 0.502 -4.019 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -13.896 0.763 -6.218 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -15.601 1.270 -6.255 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -14.310 2.493 -6.211 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -12.562 0.948 -4.120 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -12.884 2.691 -3.959 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -13.299 1.583 -2.630 1.00 0.00 H new ATOM 476 N MET A 31 -18.058 3.320 -1.912 1.00 0.00 N ATOM 477 CA MET A 31 -19.196 4.183 -1.584 1.00 0.00 C ATOM 478 C MET A 31 -19.152 4.611 -0.102 1.00 0.00 C ATOM 479 O MET A 31 -19.575 5.714 0.244 1.00 0.00 O ATOM 480 CB MET A 31 -20.535 3.480 -1.952 1.00 0.00 C ATOM 481 CG MET A 31 -20.619 2.999 -3.416 1.00 0.00 C ATOM 482 SD MET A 31 -22.298 2.818 -4.065 1.00 0.00 S ATOM 483 CE MET A 31 -22.649 4.487 -4.620 1.00 0.00 C ATOM 0 H MET A 31 -18.336 2.381 -2.197 1.00 0.00 H new ATOM 0 HA MET A 31 -19.130 5.093 -2.180 1.00 0.00 H new ATOM 0 HB2 MET A 31 -20.676 2.624 -1.292 1.00 0.00 H new ATOM 0 HB3 MET A 31 -21.358 4.169 -1.760 1.00 0.00 H new ATOM 0 HG2 MET A 31 -20.076 3.703 -4.046 1.00 0.00 H new ATOM 0 HG3 MET A 31 -20.109 2.039 -3.497 1.00 0.00 H new ATOM 0 HE1 MET A 31 -23.707 4.704 -4.473 1.00 0.00 H new ATOM 0 HE2 MET A 31 -22.050 5.195 -4.047 1.00 0.00 H new ATOM 0 HE3 MET A 31 -22.404 4.578 -5.678 1.00 0.00 H new ATOM 493 N GLU A 32 -18.594 3.736 0.745 1.00 0.00 N ATOM 494 CA GLU A 32 -18.374 4.020 2.175 1.00 0.00 C ATOM 495 C GLU A 32 -17.134 4.888 2.402 1.00 0.00 C ATOM 496 O GLU A 32 -17.122 5.705 3.327 1.00 0.00 O ATOM 497 CB GLU A 32 -18.271 2.696 2.966 1.00 0.00 C ATOM 498 CG GLU A 32 -19.591 1.908 3.043 1.00 0.00 C ATOM 499 CD GLU A 32 -20.737 2.671 3.746 1.00 0.00 C ATOM 500 OE1 GLU A 32 -20.983 2.428 4.947 1.00 0.00 O ATOM 501 OE2 GLU A 32 -21.409 3.508 3.102 1.00 0.00 O ATOM 0 H GLU A 32 -18.281 2.808 0.460 1.00 0.00 H new ATOM 0 HA GLU A 32 -19.230 4.587 2.540 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -17.511 2.067 2.503 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -17.931 2.915 3.978 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -19.907 1.648 2.033 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -19.413 0.972 3.572 1.00 0.00 H new ATOM 508 N LYS A 33 -16.096 4.699 1.570 1.00 0.00 N ATOM 509 CA LYS A 33 -14.850 5.483 1.671 1.00 0.00 C ATOM 510 C LYS A 33 -15.121 6.953 1.326 1.00 0.00 C ATOM 511 O LYS A 33 -14.767 7.835 2.092 1.00 0.00 O ATOM 512 CB LYS A 33 -13.694 4.903 0.793 1.00 0.00 C ATOM 513 CG LYS A 33 -13.321 3.426 1.083 1.00 0.00 C ATOM 514 CD LYS A 33 -13.321 3.084 2.593 1.00 0.00 C ATOM 515 CE LYS A 33 -12.973 1.619 2.873 1.00 0.00 C ATOM 516 NZ LYS A 33 -13.047 1.297 4.324 1.00 0.00 N ATOM 0 H LYS A 33 -16.094 4.009 0.818 1.00 0.00 H new ATOM 0 HA LYS A 33 -14.510 5.415 2.704 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -13.977 4.990 -0.256 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -12.807 5.520 0.936 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -14.025 2.772 0.569 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -12.334 3.219 0.670 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -12.605 3.726 3.106 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -14.303 3.305 3.010 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -13.656 0.972 2.323 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -11.969 1.408 2.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -12.804 0.296 4.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -12.377 1.896 4.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -14.012 1.474 4.670 1.00 0.00 H new ATOM 530 N LEU A 34 -15.803 7.207 0.201 1.00 0.00 N ATOM 531 CA LEU A 34 -16.191 8.577 -0.196 1.00 0.00 C ATOM 532 C LEU A 34 -17.183 9.180 0.825 1.00 0.00 C ATOM 533 O LEU A 34 -17.122 10.373 1.111 1.00 0.00 O ATOM 534 CB LEU A 34 -16.734 8.591 -1.659 1.00 0.00 C ATOM 535 CG LEU A 34 -17.945 7.643 -1.981 1.00 0.00 C ATOM 536 CD1 LEU A 34 -19.321 8.311 -1.746 1.00 0.00 C ATOM 537 CD2 LEU A 34 -17.845 7.048 -3.401 1.00 0.00 C ATOM 0 H LEU A 34 -16.100 6.484 -0.454 1.00 0.00 H new ATOM 0 HA LEU A 34 -15.309 9.217 -0.186 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -17.030 9.612 -1.900 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -15.913 8.330 -2.327 1.00 0.00 H new ATOM 0 HG LEU A 34 -17.877 6.821 -1.268 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -20.115 7.604 -1.987 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -19.406 8.611 -0.701 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -19.413 9.190 -2.384 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -18.701 6.398 -3.584 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -17.838 7.855 -4.134 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -16.925 6.470 -3.489 1.00 0.00 H new ATOM 549 N LYS A 35 -18.046 8.325 1.417 1.00 0.00 N ATOM 550 CA LYS A 35 -19.001 8.742 2.466 1.00 0.00 C ATOM 551 C LYS A 35 -18.259 9.256 3.728 1.00 0.00 C ATOM 552 O LYS A 35 -18.614 10.301 4.268 1.00 0.00 O ATOM 553 CB LYS A 35 -19.958 7.564 2.812 1.00 0.00 C ATOM 554 CG LYS A 35 -20.951 7.810 3.973 1.00 0.00 C ATOM 555 CD LYS A 35 -21.787 9.105 3.813 1.00 0.00 C ATOM 556 CE LYS A 35 -22.808 9.310 4.941 1.00 0.00 C ATOM 557 NZ LYS A 35 -23.527 10.614 4.806 1.00 0.00 N ATOM 0 H LYS A 35 -18.100 7.334 1.183 1.00 0.00 H new ATOM 0 HA LYS A 35 -19.597 9.571 2.084 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -20.530 7.314 1.919 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -19.353 6.691 3.058 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -21.627 6.958 4.048 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -20.396 7.860 4.910 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -21.114 9.962 3.781 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -22.312 9.075 2.858 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -23.530 8.494 4.931 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -22.299 9.273 5.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -23.795 10.962 5.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -22.904 11.308 4.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -24.383 10.481 4.230 1.00 0.00 H new ATOM 571 N GLU A 36 -17.214 8.539 4.171 1.00 0.00 N ATOM 572 CA GLU A 36 -16.453 8.925 5.386 1.00 0.00 C ATOM 573 C GLU A 36 -15.510 10.119 5.102 1.00 0.00 C ATOM 574 O GLU A 36 -15.159 10.863 6.022 1.00 0.00 O ATOM 575 CB GLU A 36 -15.662 7.717 5.968 1.00 0.00 C ATOM 576 CG GLU A 36 -14.579 7.136 5.038 1.00 0.00 C ATOM 577 CD GLU A 36 -13.768 5.991 5.656 1.00 0.00 C ATOM 578 OE1 GLU A 36 -12.647 6.241 6.159 1.00 0.00 O ATOM 579 OE2 GLU A 36 -14.253 4.840 5.663 1.00 0.00 O ATOM 0 H GLU A 36 -16.873 7.693 3.714 1.00 0.00 H new ATOM 0 HA GLU A 36 -17.177 9.241 6.137 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -15.190 8.027 6.900 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -16.369 6.925 6.216 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -15.054 6.778 4.125 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -13.896 7.935 4.750 1.00 0.00 H new ATOM 586 N GLN A 37 -15.123 10.303 3.818 1.00 0.00 N ATOM 587 CA GLN A 37 -14.220 11.397 3.393 1.00 0.00 C ATOM 588 C GLN A 37 -14.971 12.743 3.321 1.00 0.00 C ATOM 589 O GLN A 37 -14.695 13.652 4.109 1.00 0.00 O ATOM 590 CB GLN A 37 -13.577 11.065 2.015 1.00 0.00 C ATOM 591 CG GLN A 37 -12.585 9.881 2.025 1.00 0.00 C ATOM 592 CD GLN A 37 -11.247 10.213 2.678 1.00 0.00 C ATOM 593 OE1 GLN A 37 -11.057 10.043 3.884 1.00 0.00 O ATOM 594 NE2 GLN A 37 -10.306 10.680 1.882 1.00 0.00 N ATOM 0 H GLN A 37 -15.426 9.701 3.052 1.00 0.00 H new ATOM 0 HA GLN A 37 -13.430 11.489 4.138 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -14.373 10.846 1.303 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -13.058 11.951 1.650 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -13.039 9.042 2.552 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -12.409 9.556 1.000 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -10.496 10.809 0.888 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -9.388 10.913 2.260 1.00 0.00 H new ATOM 603 N THR A 38 -15.922 12.857 2.372 1.00 0.00 N ATOM 604 CA THR A 38 -16.636 14.127 2.088 1.00 0.00 C ATOM 605 C THR A 38 -17.966 14.230 2.862 1.00 0.00 C ATOM 606 O THR A 38 -18.419 15.343 3.155 1.00 0.00 O ATOM 607 CB THR A 38 -16.881 14.318 0.545 1.00 0.00 C ATOM 608 OG1 THR A 38 -17.620 15.527 0.277 1.00 0.00 O ATOM 609 CG2 THR A 38 -17.616 13.137 -0.083 1.00 0.00 C ATOM 0 H THR A 38 -16.218 12.079 1.782 1.00 0.00 H new ATOM 0 HA THR A 38 -15.988 14.932 2.434 1.00 0.00 H new ATOM 0 HB THR A 38 -15.891 14.385 0.093 1.00 0.00 H new ATOM 0 HG1 THR A 38 -18.156 15.409 -0.535 1.00 0.00 H new ATOM 0 HG21 THR A 38 -17.758 13.322 -1.148 1.00 0.00 H new ATOM 0 HG22 THR A 38 -17.028 12.229 0.052 1.00 0.00 H new ATOM 0 HG23 THR A 38 -18.587 13.016 0.397 1.00 0.00 H new ATOM 617 N GLY A 39 -18.581 13.078 3.204 1.00 0.00 N ATOM 618 CA GLY A 39 -19.853 13.062 3.952 1.00 0.00 C ATOM 619 C GLY A 39 -21.095 12.968 3.075 1.00 0.00 C ATOM 620 O GLY A 39 -22.223 13.027 3.594 1.00 0.00 O ATOM 0 H GLY A 39 -18.219 12.153 2.975 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -19.845 12.218 4.642 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -19.917 13.967 4.556 1.00 0.00 H new ATOM 624 N VAL A 40 -20.901 12.798 1.751 1.00 0.00 N ATOM 625 CA VAL A 40 -22.008 12.719 0.783 1.00 0.00 C ATOM 626 C VAL A 40 -22.648 11.295 0.843 1.00 0.00 C ATOM 627 O VAL A 40 -21.920 10.297 0.792 1.00 0.00 O ATOM 628 CB VAL A 40 -21.522 13.112 -0.687 1.00 0.00 C ATOM 629 CG1 VAL A 40 -20.715 11.995 -1.389 1.00 0.00 C ATOM 630 CG2 VAL A 40 -22.698 13.605 -1.563 1.00 0.00 C ATOM 0 H VAL A 40 -19.977 12.712 1.327 1.00 0.00 H new ATOM 0 HA VAL A 40 -22.776 13.446 1.050 1.00 0.00 H new ATOM 0 HB VAL A 40 -20.828 13.943 -0.559 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -20.417 12.331 -2.382 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -19.826 11.765 -0.802 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -21.332 11.101 -1.478 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -22.329 13.863 -2.556 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -23.445 12.815 -1.647 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -23.150 14.484 -1.104 1.00 0.00 H new ATOM 640 N PRO A 41 -24.010 11.178 1.020 1.00 0.00 N ATOM 641 CA PRO A 41 -24.699 9.868 1.161 1.00 0.00 C ATOM 642 C PRO A 41 -24.726 9.080 -0.180 1.00 0.00 C ATOM 643 O PRO A 41 -25.393 9.505 -1.128 1.00 0.00 O ATOM 644 CB PRO A 41 -26.122 10.264 1.638 1.00 0.00 C ATOM 645 CG PRO A 41 -26.337 11.629 1.067 1.00 0.00 C ATOM 646 CD PRO A 41 -24.980 12.306 1.110 1.00 0.00 C ATOM 0 HA PRO A 41 -24.196 9.195 1.855 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -26.872 9.560 1.278 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -26.189 10.273 2.726 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -26.715 11.572 0.046 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -27.072 12.186 1.648 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -24.857 13.005 0.283 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -24.847 12.874 2.030 1.00 0.00 H new ATOM 654 N PRO A 42 -24.002 7.912 -0.270 1.00 0.00 N ATOM 655 CA PRO A 42 -23.777 7.176 -1.551 1.00 0.00 C ATOM 656 C PRO A 42 -25.067 6.616 -2.185 1.00 0.00 C ATOM 657 O PRO A 42 -25.064 6.218 -3.352 1.00 0.00 O ATOM 658 CB PRO A 42 -22.811 6.041 -1.139 1.00 0.00 C ATOM 659 CG PRO A 42 -23.047 5.841 0.325 1.00 0.00 C ATOM 660 CD PRO A 42 -23.351 7.211 0.872 1.00 0.00 C ATOM 0 HA PRO A 42 -23.383 7.833 -2.326 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -23.013 5.128 -1.699 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -21.775 6.314 -1.338 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -23.876 5.156 0.499 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -22.170 5.410 0.809 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -24.011 7.159 1.738 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -22.444 7.724 1.192 1.00 0.00 H new ATOM 668 N GLU A 43 -26.151 6.599 -1.403 1.00 0.00 N ATOM 669 CA GLU A 43 -27.503 6.219 -1.870 1.00 0.00 C ATOM 670 C GLU A 43 -27.997 7.155 -3.001 1.00 0.00 C ATOM 671 O GLU A 43 -28.809 6.758 -3.841 1.00 0.00 O ATOM 672 CB GLU A 43 -28.487 6.250 -0.666 1.00 0.00 C ATOM 673 CG GLU A 43 -28.537 7.608 0.068 1.00 0.00 C ATOM 674 CD GLU A 43 -29.513 7.641 1.248 1.00 0.00 C ATOM 675 OE1 GLU A 43 -29.126 7.223 2.362 1.00 0.00 O ATOM 676 OE2 GLU A 43 -30.672 8.079 1.071 1.00 0.00 O ATOM 0 H GLU A 43 -26.122 6.850 -0.415 1.00 0.00 H new ATOM 0 HA GLU A 43 -27.459 5.211 -2.282 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -29.488 6.003 -1.021 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -28.201 5.475 0.045 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -27.538 7.852 0.429 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -28.817 8.384 -0.644 1.00 0.00 H new ATOM 683 N GLN A 44 -27.485 8.401 -3.001 1.00 0.00 N ATOM 684 CA GLN A 44 -27.849 9.440 -3.977 1.00 0.00 C ATOM 685 C GLN A 44 -26.776 9.577 -5.080 1.00 0.00 C ATOM 686 O GLN A 44 -26.838 10.510 -5.884 1.00 0.00 O ATOM 687 CB GLN A 44 -28.022 10.797 -3.248 1.00 0.00 C ATOM 688 CG GLN A 44 -29.002 10.780 -2.056 1.00 0.00 C ATOM 689 CD GLN A 44 -29.179 12.139 -1.355 1.00 0.00 C ATOM 690 OE1 GLN A 44 -30.238 12.428 -0.807 1.00 0.00 O ATOM 691 NE2 GLN A 44 -28.149 12.976 -1.355 1.00 0.00 N ATOM 0 H GLN A 44 -26.799 8.715 -2.314 1.00 0.00 H new ATOM 0 HA GLN A 44 -28.786 9.149 -4.451 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -27.046 11.127 -2.891 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -28.365 11.538 -3.970 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -29.975 10.437 -2.407 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -28.652 10.051 -1.325 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -27.279 12.713 -1.817 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -28.228 13.882 -0.893 1.00 0.00 H new ATOM 700 N LEU A 45 -25.773 8.666 -5.093 1.00 0.00 N ATOM 701 CA LEU A 45 -24.655 8.700 -6.073 1.00 0.00 C ATOM 702 C LEU A 45 -24.508 7.372 -6.827 1.00 0.00 C ATOM 703 O LEU A 45 -24.996 6.323 -6.401 1.00 0.00 O ATOM 704 CB LEU A 45 -23.286 9.041 -5.399 1.00 0.00 C ATOM 705 CG LEU A 45 -23.102 10.495 -4.844 1.00 0.00 C ATOM 706 CD1 LEU A 45 -23.576 11.556 -5.864 1.00 0.00 C ATOM 707 CD2 LEU A 45 -23.772 10.677 -3.475 1.00 0.00 C ATOM 0 H LEU A 45 -25.714 7.892 -4.431 1.00 0.00 H new ATOM 0 HA LEU A 45 -24.914 9.490 -6.778 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -23.132 8.343 -4.576 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -22.496 8.855 -6.126 1.00 0.00 H new ATOM 0 HG LEU A 45 -22.033 10.648 -4.693 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -23.434 12.552 -5.445 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -22.997 11.462 -6.782 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -24.632 11.403 -6.084 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -23.619 11.699 -3.128 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -24.840 10.479 -3.564 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -23.333 9.982 -2.760 1.00 0.00 H new ATOM 719 N ARG A 46 -23.793 7.469 -7.957 1.00 0.00 N ATOM 720 CA ARG A 46 -23.347 6.338 -8.778 1.00 0.00 C ATOM 721 C ARG A 46 -21.831 6.491 -8.957 1.00 0.00 C ATOM 722 O ARG A 46 -21.380 7.537 -9.452 1.00 0.00 O ATOM 723 CB ARG A 46 -24.033 6.362 -10.175 1.00 0.00 C ATOM 724 CG ARG A 46 -25.575 6.397 -10.150 1.00 0.00 C ATOM 725 CD ARG A 46 -26.191 6.580 -11.547 1.00 0.00 C ATOM 726 NE ARG A 46 -27.669 6.585 -11.522 1.00 0.00 N ATOM 727 CZ ARG A 46 -28.461 5.652 -12.081 1.00 0.00 C ATOM 728 NH1 ARG A 46 -27.951 4.605 -12.718 1.00 0.00 N ATOM 729 NH2 ARG A 46 -29.775 5.765 -12.000 1.00 0.00 N ATOM 0 H ARG A 46 -23.500 8.369 -8.336 1.00 0.00 H new ATOM 0 HA ARG A 46 -23.606 5.396 -8.295 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -23.675 7.234 -10.723 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -23.715 5.482 -10.733 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -25.948 5.471 -9.712 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -25.905 7.210 -9.503 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -25.836 7.517 -11.976 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -25.845 5.779 -12.200 1.00 0.00 H new ATOM 0 HE ARG A 46 -28.126 7.360 -11.041 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -26.940 4.496 -12.791 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -28.571 3.910 -13.134 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -30.189 6.560 -11.513 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -30.375 5.057 -12.424 1.00 0.00 H new ATOM 743 N VAL A 47 -21.054 5.483 -8.538 1.00 0.00 N ATOM 744 CA VAL A 47 -19.587 5.490 -8.721 1.00 0.00 C ATOM 745 C VAL A 47 -19.271 5.158 -10.190 1.00 0.00 C ATOM 746 O VAL A 47 -19.830 4.213 -10.744 1.00 0.00 O ATOM 747 CB VAL A 47 -18.867 4.476 -7.755 1.00 0.00 C ATOM 748 CG1 VAL A 47 -17.336 4.491 -7.960 1.00 0.00 C ATOM 749 CG2 VAL A 47 -19.215 4.780 -6.285 1.00 0.00 C ATOM 0 H VAL A 47 -21.412 4.651 -8.070 1.00 0.00 H new ATOM 0 HA VAL A 47 -19.209 6.481 -8.472 1.00 0.00 H new ATOM 0 HB VAL A 47 -19.229 3.477 -7.999 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -16.871 3.780 -7.278 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -17.104 4.213 -8.988 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -16.952 5.491 -7.759 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -18.707 4.067 -5.636 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -18.893 5.791 -6.036 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -20.292 4.697 -6.141 1.00 0.00 H new ATOM 759 N ILE A 48 -18.404 5.971 -10.817 1.00 0.00 N ATOM 760 CA ILE A 48 -18.115 5.910 -12.262 1.00 0.00 C ATOM 761 C ILE A 48 -16.593 5.824 -12.499 1.00 0.00 C ATOM 762 O ILE A 48 -15.881 6.792 -12.252 1.00 0.00 O ATOM 763 CB ILE A 48 -18.675 7.195 -13.008 1.00 0.00 C ATOM 764 CG1 ILE A 48 -20.189 7.448 -12.696 1.00 0.00 C ATOM 765 CG2 ILE A 48 -18.436 7.111 -14.535 1.00 0.00 C ATOM 766 CD1 ILE A 48 -21.153 6.362 -13.136 1.00 0.00 C ATOM 0 H ILE A 48 -17.878 6.697 -10.331 1.00 0.00 H new ATOM 0 HA ILE A 48 -18.605 5.021 -12.660 1.00 0.00 H new ATOM 0 HB ILE A 48 -18.117 8.048 -12.622 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -20.299 7.589 -11.621 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -20.485 8.383 -13.172 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -18.831 8.006 -15.015 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -17.367 7.036 -14.732 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -18.942 6.232 -14.935 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -22.170 6.648 -12.867 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -21.086 6.232 -14.216 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -20.896 5.425 -12.641 1.00 0.00 H new ATOM 778 N TYR A 49 -16.105 4.667 -12.972 1.00 0.00 N ATOM 779 CA TYR A 49 -14.686 4.500 -13.376 1.00 0.00 C ATOM 780 C TYR A 49 -14.500 4.911 -14.838 1.00 0.00 C ATOM 781 O TYR A 49 -14.970 4.210 -15.734 1.00 0.00 O ATOM 782 CB TYR A 49 -14.211 3.031 -13.189 1.00 0.00 C ATOM 783 CG TYR A 49 -12.834 2.697 -13.820 1.00 0.00 C ATOM 784 CD1 TYR A 49 -11.645 3.091 -13.213 1.00 0.00 C ATOM 785 CD2 TYR A 49 -12.730 1.976 -15.024 1.00 0.00 C ATOM 786 CE1 TYR A 49 -10.423 2.789 -13.772 1.00 0.00 C ATOM 787 CE2 TYR A 49 -11.500 1.682 -15.583 1.00 0.00 C ATOM 788 CZ TYR A 49 -10.352 2.087 -14.950 1.00 0.00 C ATOM 789 OH TYR A 49 -9.117 1.791 -15.494 1.00 0.00 O ATOM 0 H TYR A 49 -16.669 3.825 -13.087 1.00 0.00 H new ATOM 0 HA TYR A 49 -14.083 5.142 -12.734 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -14.166 2.814 -12.122 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -14.960 2.366 -13.618 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -11.681 3.644 -12.286 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -13.630 1.645 -15.522 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -9.515 3.106 -13.281 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -11.443 1.136 -16.513 1.00 0.00 H new ATOM 0 HH TYR A 49 -8.457 1.698 -14.776 1.00 0.00 H new ATOM 799 N ASN A 50 -13.837 6.057 -15.055 1.00 0.00 N ATOM 800 CA ASN A 50 -13.304 6.463 -16.379 1.00 0.00 C ATOM 801 C ASN A 50 -14.427 6.590 -17.464 1.00 0.00 C ATOM 802 O ASN A 50 -14.149 6.581 -18.669 1.00 0.00 O ATOM 803 CB ASN A 50 -12.172 5.465 -16.800 1.00 0.00 C ATOM 804 CG ASN A 50 -11.258 5.956 -17.929 1.00 0.00 C ATOM 805 OD1 ASN A 50 -11.053 7.160 -18.111 1.00 0.00 O ATOM 806 ND2 ASN A 50 -10.695 5.029 -18.682 1.00 0.00 N ATOM 0 H ASN A 50 -13.651 6.737 -14.318 1.00 0.00 H new ATOM 0 HA ASN A 50 -12.878 7.463 -16.296 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -11.558 5.246 -15.926 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -12.633 4.527 -17.109 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -10.069 5.299 -19.441 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -10.886 4.043 -18.505 1.00 0.00 H new ATOM 813 N GLY A 51 -15.695 6.747 -17.016 1.00 0.00 N ATOM 814 CA GLY A 51 -16.861 6.834 -17.915 1.00 0.00 C ATOM 815 C GLY A 51 -17.712 5.559 -17.948 1.00 0.00 C ATOM 816 O GLY A 51 -18.552 5.399 -18.836 1.00 0.00 O ATOM 0 H GLY A 51 -15.933 6.816 -16.027 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -17.487 7.670 -17.603 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -16.514 7.055 -18.925 1.00 0.00 H new ATOM 820 N ARG A 52 -17.499 4.665 -16.967 1.00 0.00 N ATOM 821 CA ARG A 52 -18.249 3.399 -16.811 1.00 0.00 C ATOM 822 C ARG A 52 -18.982 3.393 -15.463 1.00 0.00 C ATOM 823 O ARG A 52 -18.370 3.708 -14.444 1.00 0.00 O ATOM 824 CB ARG A 52 -17.269 2.195 -16.882 1.00 0.00 C ATOM 825 CG ARG A 52 -17.884 0.834 -16.483 1.00 0.00 C ATOM 826 CD ARG A 52 -16.886 -0.329 -16.601 1.00 0.00 C ATOM 827 NE ARG A 52 -16.365 -0.495 -17.971 1.00 0.00 N ATOM 828 CZ ARG A 52 -16.925 -1.242 -18.939 1.00 0.00 C ATOM 829 NH1 ARG A 52 -18.083 -1.864 -18.748 1.00 0.00 N ATOM 830 NH2 ARG A 52 -16.321 -1.365 -20.107 1.00 0.00 N ATOM 0 H ARG A 52 -16.790 4.801 -16.246 1.00 0.00 H new ATOM 0 HA ARG A 52 -18.979 3.314 -17.616 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -16.882 2.119 -17.898 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -16.418 2.398 -16.231 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -18.248 0.892 -15.457 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -18.748 0.631 -17.116 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -16.054 -0.159 -15.918 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -17.372 -1.253 -16.287 1.00 0.00 H new ATOM 0 HE ARG A 52 -15.504 0.000 -18.205 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -18.565 -1.780 -17.853 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -18.490 -2.425 -19.496 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -15.432 -0.894 -20.273 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -16.744 -1.931 -20.843 1.00 0.00 H new ATOM 844 N GLU A 53 -20.274 3.004 -15.459 1.00 0.00 N ATOM 845 CA GLU A 53 -21.069 2.897 -14.221 1.00 0.00 C ATOM 846 C GLU A 53 -20.686 1.620 -13.458 1.00 0.00 C ATOM 847 O GLU A 53 -20.604 0.532 -14.047 1.00 0.00 O ATOM 848 CB GLU A 53 -22.593 2.917 -14.515 1.00 0.00 C ATOM 849 CG GLU A 53 -23.460 3.262 -13.278 1.00 0.00 C ATOM 850 CD GLU A 53 -24.953 3.402 -13.609 1.00 0.00 C ATOM 851 OE1 GLU A 53 -25.721 2.437 -13.414 1.00 0.00 O ATOM 852 OE2 GLU A 53 -25.363 4.480 -14.088 1.00 0.00 O ATOM 0 H GLU A 53 -20.789 2.758 -16.304 1.00 0.00 H new ATOM 0 HA GLU A 53 -20.844 3.765 -13.602 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -22.793 3.644 -15.302 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -22.893 1.942 -14.898 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -23.332 2.485 -12.524 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -23.102 4.194 -12.839 1.00 0.00 H new ATOM 859 N LEU A 54 -20.433 1.767 -12.151 1.00 0.00 N ATOM 860 CA LEU A 54 -19.986 0.663 -11.285 1.00 0.00 C ATOM 861 C LEU A 54 -21.139 0.224 -10.379 1.00 0.00 C ATOM 862 O LEU A 54 -21.646 1.027 -9.578 1.00 0.00 O ATOM 863 CB LEU A 54 -18.757 1.078 -10.418 1.00 0.00 C ATOM 864 CG LEU A 54 -17.582 1.820 -11.147 1.00 0.00 C ATOM 865 CD1 LEU A 54 -16.336 1.904 -10.250 1.00 0.00 C ATOM 866 CD2 LEU A 54 -17.252 1.204 -12.520 1.00 0.00 C ATOM 0 H LEU A 54 -20.532 2.656 -11.661 1.00 0.00 H new ATOM 0 HA LEU A 54 -19.680 -0.167 -11.922 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -19.113 1.720 -9.612 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -18.352 0.179 -9.954 1.00 0.00 H new ATOM 0 HG LEU A 54 -17.925 2.836 -11.342 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -15.539 2.423 -10.782 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -16.580 2.450 -9.339 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -16.005 0.898 -9.992 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -16.432 1.757 -12.979 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -16.960 0.162 -12.390 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -18.130 1.257 -13.163 1.00 0.00 H new ATOM 878 N GLU A 55 -21.553 -1.043 -10.525 1.00 0.00 N ATOM 879 CA GLU A 55 -22.578 -1.660 -9.682 1.00 0.00 C ATOM 880 C GLU A 55 -21.997 -1.917 -8.277 1.00 0.00 C ATOM 881 O GLU A 55 -20.969 -2.588 -8.178 1.00 0.00 O ATOM 882 CB GLU A 55 -23.081 -2.983 -10.315 1.00 0.00 C ATOM 883 CG GLU A 55 -23.585 -2.826 -11.762 1.00 0.00 C ATOM 884 CD GLU A 55 -24.876 -2.004 -11.866 1.00 0.00 C ATOM 885 OE1 GLU A 55 -25.975 -2.591 -11.720 1.00 0.00 O ATOM 886 OE2 GLU A 55 -24.812 -0.773 -12.091 1.00 0.00 O ATOM 0 H GLU A 55 -21.181 -1.670 -11.238 1.00 0.00 H new ATOM 0 HA GLU A 55 -23.429 -0.984 -9.599 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -22.272 -3.713 -10.299 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -23.887 -3.386 -9.701 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -22.809 -2.349 -12.361 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -23.755 -3.814 -12.190 1.00 0.00 H new ATOM 893 N PRO A 56 -22.647 -1.366 -7.194 1.00 0.00 N ATOM 894 CA PRO A 56 -22.193 -1.503 -5.778 1.00 0.00 C ATOM 895 C PRO A 56 -21.772 -2.944 -5.398 1.00 0.00 C ATOM 896 O PRO A 56 -20.708 -3.165 -4.802 1.00 0.00 O ATOM 897 CB PRO A 56 -23.427 -1.058 -4.950 1.00 0.00 C ATOM 898 CG PRO A 56 -24.261 -0.203 -5.860 1.00 0.00 C ATOM 899 CD PRO A 56 -23.871 -0.538 -7.296 1.00 0.00 C ATOM 0 HA PRO A 56 -21.299 -0.907 -5.595 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -23.993 -1.922 -4.602 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -23.121 -0.500 -4.065 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -25.322 -0.393 -5.697 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -24.091 0.854 -5.654 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -24.670 -1.080 -7.803 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -23.684 0.368 -7.873 1.00 0.00 H new ATOM 907 N ARG A 57 -22.623 -3.901 -5.790 1.00 0.00 N ATOM 908 CA ARG A 57 -22.471 -5.337 -5.479 1.00 0.00 C ATOM 909 C ARG A 57 -21.162 -5.944 -6.036 1.00 0.00 C ATOM 910 O ARG A 57 -20.593 -6.855 -5.433 1.00 0.00 O ATOM 911 CB ARG A 57 -23.693 -6.112 -6.039 1.00 0.00 C ATOM 912 CG ARG A 57 -23.892 -6.000 -7.571 1.00 0.00 C ATOM 913 CD ARG A 57 -25.092 -6.819 -8.075 1.00 0.00 C ATOM 914 NE ARG A 57 -25.349 -6.601 -9.509 1.00 0.00 N ATOM 915 CZ ARG A 57 -26.414 -5.962 -10.025 1.00 0.00 C ATOM 916 NH1 ARG A 57 -27.333 -5.410 -9.230 1.00 0.00 N ATOM 917 NH2 ARG A 57 -26.553 -5.859 -11.333 1.00 0.00 N ATOM 0 H ARG A 57 -23.455 -3.699 -6.344 1.00 0.00 H new ATOM 0 HA ARG A 57 -22.420 -5.430 -4.394 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -23.588 -7.165 -5.777 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -24.593 -5.749 -5.543 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -24.034 -4.953 -7.839 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -22.988 -6.339 -8.076 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -24.907 -7.878 -7.897 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -25.980 -6.550 -7.503 1.00 0.00 H new ATOM 0 HE ARG A 57 -24.660 -6.966 -10.167 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -27.233 -5.470 -8.217 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -28.135 -4.929 -9.636 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -25.852 -6.264 -11.954 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -27.361 -5.374 -11.723 1.00 0.00 H new ATOM 931 N THR A 58 -20.711 -5.428 -7.186 1.00 0.00 N ATOM 932 CA THR A 58 -19.545 -5.969 -7.919 1.00 0.00 C ATOM 933 C THR A 58 -18.221 -5.539 -7.239 1.00 0.00 C ATOM 934 O THR A 58 -18.203 -4.570 -6.476 1.00 0.00 O ATOM 935 CB THR A 58 -19.581 -5.475 -9.400 1.00 0.00 C ATOM 936 OG1 THR A 58 -20.903 -5.625 -9.934 1.00 0.00 O ATOM 937 CG2 THR A 58 -18.585 -6.227 -10.300 1.00 0.00 C ATOM 0 H THR A 58 -21.141 -4.622 -7.640 1.00 0.00 H new ATOM 0 HA THR A 58 -19.594 -7.058 -7.903 1.00 0.00 H new ATOM 0 HB THR A 58 -19.290 -4.425 -9.390 1.00 0.00 H new ATOM 0 HG1 THR A 58 -20.918 -5.312 -10.862 1.00 0.00 H new ATOM 0 HG21 THR A 58 -18.653 -5.843 -11.318 1.00 0.00 H new ATOM 0 HG22 THR A 58 -17.573 -6.081 -9.924 1.00 0.00 H new ATOM 0 HG23 THR A 58 -18.823 -7.291 -10.297 1.00 0.00 H new ATOM 945 N THR A 59 -17.123 -6.278 -7.504 1.00 0.00 N ATOM 946 CA THR A 59 -15.786 -5.951 -6.966 1.00 0.00 C ATOM 947 C THR A 59 -15.009 -5.007 -7.914 1.00 0.00 C ATOM 948 O THR A 59 -15.396 -4.798 -9.076 1.00 0.00 O ATOM 949 CB THR A 59 -14.956 -7.248 -6.676 1.00 0.00 C ATOM 950 OG1 THR A 59 -14.809 -8.014 -7.873 1.00 0.00 O ATOM 951 CG2 THR A 59 -15.621 -8.111 -5.587 1.00 0.00 C ATOM 0 H THR A 59 -17.138 -7.111 -8.092 1.00 0.00 H new ATOM 0 HA THR A 59 -15.938 -5.428 -6.022 1.00 0.00 H new ATOM 0 HB THR A 59 -13.975 -6.941 -6.315 1.00 0.00 H new ATOM 0 HG1 THR A 59 -14.288 -8.822 -7.683 1.00 0.00 H new ATOM 0 HG21 THR A 59 -15.019 -9.002 -5.411 1.00 0.00 H new ATOM 0 HG22 THR A 59 -15.697 -7.537 -4.664 1.00 0.00 H new ATOM 0 HG23 THR A 59 -16.618 -8.406 -5.915 1.00 0.00 H new ATOM 959 N LEU A 60 -13.896 -4.470 -7.386 1.00 0.00 N ATOM 960 CA LEU A 60 -13.059 -3.439 -8.043 1.00 0.00 C ATOM 961 C LEU A 60 -12.313 -4.007 -9.261 1.00 0.00 C ATOM 962 O LEU A 60 -12.264 -3.386 -10.332 1.00 0.00 O ATOM 963 CB LEU A 60 -12.023 -2.873 -7.015 1.00 0.00 C ATOM 964 CG LEU A 60 -12.503 -1.732 -6.067 1.00 0.00 C ATOM 965 CD1 LEU A 60 -13.830 -2.067 -5.381 1.00 0.00 C ATOM 966 CD2 LEU A 60 -11.417 -1.393 -5.030 1.00 0.00 C ATOM 0 H LEU A 60 -13.541 -4.744 -6.470 1.00 0.00 H new ATOM 0 HA LEU A 60 -13.717 -2.643 -8.391 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -11.675 -3.701 -6.397 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -11.161 -2.507 -7.572 1.00 0.00 H new ATOM 0 HG LEU A 60 -12.680 -0.852 -6.686 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -14.122 -1.242 -4.731 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -14.600 -2.225 -6.136 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -13.714 -2.973 -4.786 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -11.772 -0.595 -4.379 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -11.196 -2.277 -4.432 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -10.513 -1.067 -5.544 1.00 0.00 H new ATOM 978 N GLU A 61 -11.723 -5.181 -9.052 1.00 0.00 N ATOM 979 CA GLU A 61 -10.905 -5.900 -10.051 1.00 0.00 C ATOM 980 C GLU A 61 -11.671 -6.158 -11.375 1.00 0.00 C ATOM 981 O GLU A 61 -11.060 -6.257 -12.445 1.00 0.00 O ATOM 982 CB GLU A 61 -10.420 -7.230 -9.423 1.00 0.00 C ATOM 983 CG GLU A 61 -11.566 -8.106 -8.876 1.00 0.00 C ATOM 984 CD GLU A 61 -11.091 -9.372 -8.152 1.00 0.00 C ATOM 985 OE1 GLU A 61 -10.505 -10.260 -8.810 1.00 0.00 O ATOM 986 OE2 GLU A 61 -11.329 -9.506 -6.934 1.00 0.00 O ATOM 0 H GLU A 61 -11.796 -5.679 -8.165 1.00 0.00 H new ATOM 0 HA GLU A 61 -10.052 -5.275 -10.316 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -9.867 -7.796 -10.172 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -9.725 -7.008 -8.613 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -12.168 -7.511 -8.189 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -12.216 -8.394 -9.702 1.00 0.00 H new ATOM 993 N GLU A 62 -13.010 -6.239 -11.279 1.00 0.00 N ATOM 994 CA GLU A 62 -13.905 -6.460 -12.431 1.00 0.00 C ATOM 995 C GLU A 62 -13.995 -5.219 -13.327 1.00 0.00 C ATOM 996 O GLU A 62 -14.154 -5.325 -14.546 1.00 0.00 O ATOM 997 CB GLU A 62 -15.310 -6.870 -11.925 1.00 0.00 C ATOM 998 CG GLU A 62 -15.319 -8.149 -11.068 1.00 0.00 C ATOM 999 CD GLU A 62 -14.620 -9.339 -11.757 1.00 0.00 C ATOM 1000 OE1 GLU A 62 -15.241 -9.981 -12.633 1.00 0.00 O ATOM 1001 OE2 GLU A 62 -13.448 -9.623 -11.440 1.00 0.00 O ATOM 0 H GLU A 62 -13.507 -6.152 -10.392 1.00 0.00 H new ATOM 0 HA GLU A 62 -13.489 -7.265 -13.037 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -15.728 -6.050 -11.340 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -15.966 -7.016 -12.783 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -14.827 -7.946 -10.117 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -16.350 -8.421 -10.842 1.00 0.00 H new ATOM 1008 N TYR A 63 -13.881 -4.044 -12.706 1.00 0.00 N ATOM 1009 CA TYR A 63 -13.946 -2.750 -13.411 1.00 0.00 C ATOM 1010 C TYR A 63 -12.553 -2.209 -13.742 1.00 0.00 C ATOM 1011 O TYR A 63 -12.450 -1.122 -14.314 1.00 0.00 O ATOM 1012 CB TYR A 63 -14.724 -1.740 -12.549 1.00 0.00 C ATOM 1013 CG TYR A 63 -16.183 -2.144 -12.343 1.00 0.00 C ATOM 1014 CD1 TYR A 63 -16.709 -2.366 -11.077 1.00 0.00 C ATOM 1015 CD2 TYR A 63 -17.040 -2.284 -13.436 1.00 0.00 C ATOM 1016 CE1 TYR A 63 -18.023 -2.723 -10.909 1.00 0.00 C ATOM 1017 CE2 TYR A 63 -18.354 -2.642 -13.268 1.00 0.00 C ATOM 1018 CZ TYR A 63 -18.843 -2.854 -12.006 1.00 0.00 C ATOM 1019 OH TYR A 63 -20.156 -3.213 -11.840 1.00 0.00 O ATOM 0 H TYR A 63 -13.741 -3.956 -11.700 1.00 0.00 H new ATOM 0 HA TYR A 63 -14.463 -2.903 -14.358 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -14.237 -1.645 -11.579 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -14.686 -0.759 -13.022 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -16.073 -2.256 -10.211 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -16.662 -2.107 -14.432 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -18.413 -2.901 -9.918 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -18.999 -2.756 -14.126 1.00 0.00 H new ATOM 0 HH TYR A 63 -20.595 -3.260 -12.715 1.00 0.00 H new ATOM 1029 N ASN A 64 -11.504 -2.980 -13.384 1.00 0.00 N ATOM 1030 CA ASN A 64 -10.094 -2.584 -13.568 1.00 0.00 C ATOM 1031 C ASN A 64 -9.807 -1.289 -12.767 1.00 0.00 C ATOM 1032 O ASN A 64 -9.149 -0.351 -13.243 1.00 0.00 O ATOM 1033 CB ASN A 64 -9.754 -2.457 -15.094 1.00 0.00 C ATOM 1034 CG ASN A 64 -8.264 -2.241 -15.407 1.00 0.00 C ATOM 1035 OD1 ASN A 64 -7.483 -3.192 -15.482 1.00 0.00 O ATOM 1036 ND2 ASN A 64 -7.870 -1.002 -15.638 1.00 0.00 N ATOM 0 H ASN A 64 -11.614 -3.900 -12.957 1.00 0.00 H new ATOM 0 HA ASN A 64 -9.435 -3.357 -13.173 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -10.091 -3.360 -15.603 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -10.323 -1.626 -15.511 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -6.899 -0.814 -15.885 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -8.537 -0.233 -15.569 1.00 0.00 H new ATOM 1043 N ILE A 65 -10.339 -1.255 -11.523 1.00 0.00 N ATOM 1044 CA ILE A 65 -10.042 -0.182 -10.559 1.00 0.00 C ATOM 1045 C ILE A 65 -8.581 -0.340 -10.119 1.00 0.00 C ATOM 1046 O ILE A 65 -8.277 -1.091 -9.199 1.00 0.00 O ATOM 1047 CB ILE A 65 -11.009 -0.211 -9.315 1.00 0.00 C ATOM 1048 CG1 ILE A 65 -12.501 -0.160 -9.761 1.00 0.00 C ATOM 1049 CG2 ILE A 65 -10.700 0.936 -8.321 1.00 0.00 C ATOM 1050 CD1 ILE A 65 -12.897 1.102 -10.476 1.00 0.00 C ATOM 0 H ILE A 65 -10.979 -1.965 -11.167 1.00 0.00 H new ATOM 0 HA ILE A 65 -10.198 0.784 -11.038 1.00 0.00 H new ATOM 0 HB ILE A 65 -10.837 -1.155 -8.798 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -12.701 -1.010 -10.414 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -13.134 -0.278 -8.881 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -11.388 0.882 -7.477 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -9.676 0.839 -7.961 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -10.818 1.896 -8.824 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -13.951 1.050 -10.749 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -12.734 1.958 -9.821 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -12.294 1.214 -11.377 1.00 0.00 H new ATOM 1062 N THR A 66 -7.696 0.293 -10.890 1.00 0.00 N ATOM 1063 CA THR A 66 -6.238 0.242 -10.714 1.00 0.00 C ATOM 1064 C THR A 66 -5.717 1.568 -10.098 1.00 0.00 C ATOM 1065 O THR A 66 -6.469 2.539 -10.040 1.00 0.00 O ATOM 1066 CB THR A 66 -5.589 -0.060 -12.113 1.00 0.00 C ATOM 1067 OG1 THR A 66 -6.249 0.700 -13.142 1.00 0.00 O ATOM 1068 CG2 THR A 66 -5.652 -1.561 -12.452 1.00 0.00 C ATOM 0 H THR A 66 -7.979 0.874 -11.679 1.00 0.00 H new ATOM 0 HA THR A 66 -5.961 -0.550 -10.018 1.00 0.00 H new ATOM 0 HB THR A 66 -4.540 0.232 -12.062 1.00 0.00 H new ATOM 0 HG1 THR A 66 -5.836 0.505 -14.009 1.00 0.00 H new ATOM 0 HG21 THR A 66 -5.194 -1.734 -13.426 1.00 0.00 H new ATOM 0 HG22 THR A 66 -5.114 -2.128 -11.693 1.00 0.00 H new ATOM 0 HG23 THR A 66 -6.692 -1.885 -12.478 1.00 0.00 H new ATOM 1076 N PRO A 67 -4.435 1.642 -9.595 1.00 0.00 N ATOM 1077 CA PRO A 67 -3.912 2.876 -8.963 1.00 0.00 C ATOM 1078 C PRO A 67 -3.742 4.031 -9.982 1.00 0.00 C ATOM 1079 O PRO A 67 -3.464 3.803 -11.167 1.00 0.00 O ATOM 1080 CB PRO A 67 -2.557 2.432 -8.358 1.00 0.00 C ATOM 1081 CG PRO A 67 -2.125 1.277 -9.209 1.00 0.00 C ATOM 1082 CD PRO A 67 -3.404 0.560 -9.600 1.00 0.00 C ATOM 0 HA PRO A 67 -4.594 3.280 -8.214 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -1.826 3.240 -8.386 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -2.666 2.137 -7.314 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -1.583 1.620 -10.090 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -1.456 0.614 -8.661 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -3.317 0.094 -10.582 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -3.651 -0.231 -8.893 1.00 0.00 H new ATOM 1090 N GLY A 68 -3.961 5.263 -9.503 1.00 0.00 N ATOM 1091 CA GLY A 68 -3.776 6.466 -10.301 1.00 0.00 C ATOM 1092 C GLY A 68 -4.966 6.816 -11.183 1.00 0.00 C ATOM 1093 O GLY A 68 -4.848 7.698 -12.035 1.00 0.00 O ATOM 0 H GLY A 68 -4.272 5.446 -8.549 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -3.573 7.304 -9.634 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -2.895 6.339 -10.931 1.00 0.00 H new ATOM 1097 N VAL A 69 -6.120 6.149 -10.981 1.00 0.00 N ATOM 1098 CA VAL A 69 -7.346 6.406 -11.774 1.00 0.00 C ATOM 1099 C VAL A 69 -8.300 7.366 -11.033 1.00 0.00 C ATOM 1100 O VAL A 69 -8.150 7.591 -9.822 1.00 0.00 O ATOM 1101 CB VAL A 69 -8.097 5.070 -12.129 1.00 0.00 C ATOM 1102 CG1 VAL A 69 -7.143 4.073 -12.833 1.00 0.00 C ATOM 1103 CG2 VAL A 69 -8.782 4.434 -10.887 1.00 0.00 C ATOM 0 H VAL A 69 -6.232 5.424 -10.272 1.00 0.00 H new ATOM 0 HA VAL A 69 -7.029 6.878 -12.704 1.00 0.00 H new ATOM 0 HB VAL A 69 -8.896 5.319 -12.827 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -7.684 3.157 -13.069 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -6.765 4.519 -13.753 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -6.307 3.841 -12.173 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -9.287 3.514 -11.181 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -8.029 4.209 -10.132 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -9.511 5.133 -10.476 1.00 0.00 H new ATOM 1113 N THR A 70 -9.277 7.916 -11.773 1.00 0.00 N ATOM 1114 CA THR A 70 -10.290 8.836 -11.239 1.00 0.00 C ATOM 1115 C THR A 70 -11.697 8.223 -11.390 1.00 0.00 C ATOM 1116 O THR A 70 -12.184 7.985 -12.503 1.00 0.00 O ATOM 1117 CB THR A 70 -10.240 10.213 -11.976 1.00 0.00 C ATOM 1118 OG1 THR A 70 -8.910 10.742 -11.904 1.00 0.00 O ATOM 1119 CG2 THR A 70 -11.232 11.234 -11.374 1.00 0.00 C ATOM 0 H THR A 70 -9.385 7.731 -12.770 1.00 0.00 H new ATOM 0 HA THR A 70 -10.074 8.997 -10.183 1.00 0.00 H new ATOM 0 HB THR A 70 -10.529 10.044 -13.013 1.00 0.00 H new ATOM 0 HG1 THR A 70 -8.876 11.605 -12.367 1.00 0.00 H new ATOM 0 HG21 THR A 70 -11.161 12.175 -11.919 1.00 0.00 H new ATOM 0 HG22 THR A 70 -12.247 10.845 -11.453 1.00 0.00 H new ATOM 0 HG23 THR A 70 -10.989 11.403 -10.325 1.00 0.00 H new ATOM 1127 N LEU A 71 -12.311 7.925 -10.247 1.00 0.00 N ATOM 1128 CA LEU A 71 -13.744 7.614 -10.139 1.00 0.00 C ATOM 1129 C LEU A 71 -14.526 8.930 -10.045 1.00 0.00 C ATOM 1130 O LEU A 71 -13.962 9.965 -9.698 1.00 0.00 O ATOM 1131 CB LEU A 71 -14.017 6.712 -8.895 1.00 0.00 C ATOM 1132 CG LEU A 71 -13.739 5.169 -9.050 1.00 0.00 C ATOM 1133 CD1 LEU A 71 -12.402 4.859 -9.753 1.00 0.00 C ATOM 1134 CD2 LEU A 71 -13.802 4.474 -7.674 1.00 0.00 C ATOM 0 H LEU A 71 -11.823 7.891 -9.352 1.00 0.00 H new ATOM 0 HA LEU A 71 -14.070 7.062 -11.021 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -13.411 7.083 -8.069 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -15.060 6.840 -8.607 1.00 0.00 H new ATOM 0 HG LEU A 71 -14.523 4.773 -9.695 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -12.272 3.779 -9.828 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -12.407 5.294 -10.752 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -11.581 5.284 -9.176 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -13.608 3.408 -7.795 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -13.051 4.906 -7.013 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -14.792 4.616 -7.240 1.00 0.00 H new ATOM 1146 N GLU A 72 -15.817 8.880 -10.369 1.00 0.00 N ATOM 1147 CA GLU A 72 -16.703 10.059 -10.339 1.00 0.00 C ATOM 1148 C GLU A 72 -18.048 9.671 -9.724 1.00 0.00 C ATOM 1149 O GLU A 72 -18.422 8.501 -9.715 1.00 0.00 O ATOM 1150 CB GLU A 72 -16.896 10.663 -11.764 1.00 0.00 C ATOM 1151 CG GLU A 72 -15.660 11.409 -12.323 1.00 0.00 C ATOM 1152 CD GLU A 72 -15.881 11.989 -13.733 1.00 0.00 C ATOM 1153 OE1 GLU A 72 -16.602 13.001 -13.864 1.00 0.00 O ATOM 1154 OE2 GLU A 72 -15.339 11.433 -14.714 1.00 0.00 O ATOM 0 H GLU A 72 -16.286 8.023 -10.661 1.00 0.00 H new ATOM 0 HA GLU A 72 -16.237 10.829 -9.724 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -17.160 9.860 -12.452 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -17.740 11.353 -11.740 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -15.395 12.218 -11.643 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -14.812 10.724 -12.349 1.00 0.00 H new ATOM 1161 N LEU A 73 -18.757 10.674 -9.193 1.00 0.00 N ATOM 1162 CA LEU A 73 -20.070 10.500 -8.555 1.00 0.00 C ATOM 1163 C LEU A 73 -21.131 11.277 -9.335 1.00 0.00 C ATOM 1164 O LEU A 73 -21.079 12.502 -9.417 1.00 0.00 O ATOM 1165 CB LEU A 73 -20.012 10.963 -7.074 1.00 0.00 C ATOM 1166 CG LEU A 73 -19.112 10.093 -6.141 1.00 0.00 C ATOM 1167 CD1 LEU A 73 -19.145 10.605 -4.684 1.00 0.00 C ATOM 1168 CD2 LEU A 73 -19.510 8.599 -6.224 1.00 0.00 C ATOM 0 H LEU A 73 -18.433 11.641 -9.194 1.00 0.00 H new ATOM 0 HA LEU A 73 -20.340 9.444 -8.566 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -19.651 11.991 -7.045 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -21.025 10.970 -6.672 1.00 0.00 H new ATOM 0 HG LEU A 73 -18.084 10.185 -6.492 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -18.507 9.976 -4.063 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -18.783 11.633 -4.651 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -20.168 10.568 -4.308 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -18.868 8.014 -5.565 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -20.549 8.482 -5.916 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -19.393 8.248 -7.249 1.00 0.00 H new ATOM 1180 N LYS A 74 -22.049 10.536 -9.966 1.00 0.00 N ATOM 1181 CA LYS A 74 -23.203 11.099 -10.693 1.00 0.00 C ATOM 1182 C LYS A 74 -24.482 10.821 -9.881 1.00 0.00 C ATOM 1183 O LYS A 74 -24.637 9.730 -9.330 1.00 0.00 O ATOM 1184 CB LYS A 74 -23.289 10.483 -12.132 1.00 0.00 C ATOM 1185 CG LYS A 74 -22.364 11.145 -13.201 1.00 0.00 C ATOM 1186 CD LYS A 74 -20.853 11.048 -12.871 1.00 0.00 C ATOM 1187 CE LYS A 74 -19.949 11.649 -13.958 1.00 0.00 C ATOM 1188 NZ LYS A 74 -20.162 13.108 -14.118 1.00 0.00 N ATOM 0 H LYS A 74 -22.015 9.517 -9.989 1.00 0.00 H new ATOM 0 HA LYS A 74 -23.087 12.177 -10.808 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -23.043 9.423 -12.070 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -24.321 10.551 -12.477 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -22.546 10.673 -14.167 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -22.637 12.195 -13.303 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -20.662 11.559 -11.927 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -20.587 10.001 -12.726 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -18.905 11.461 -13.705 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -20.142 11.149 -14.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -19.508 13.477 -14.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -21.142 13.285 -14.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -19.985 13.586 -13.211 1.00 0.00 H new ATOM 1202 N THR A 75 -25.388 11.808 -9.829 1.00 0.00 N ATOM 1203 CA THR A 75 -26.604 11.753 -8.987 1.00 0.00 C ATOM 1204 C THR A 75 -27.562 10.609 -9.399 1.00 0.00 C ATOM 1205 O THR A 75 -27.755 10.342 -10.590 1.00 0.00 O ATOM 1206 CB THR A 75 -27.356 13.125 -9.025 1.00 0.00 C ATOM 1207 OG1 THR A 75 -27.628 13.504 -10.384 1.00 0.00 O ATOM 1208 CG2 THR A 75 -26.545 14.244 -8.329 1.00 0.00 C ATOM 0 H THR A 75 -25.303 12.670 -10.368 1.00 0.00 H new ATOM 0 HA THR A 75 -26.275 11.546 -7.969 1.00 0.00 H new ATOM 0 HB THR A 75 -28.293 12.998 -8.483 1.00 0.00 H new ATOM 0 HG1 THR A 75 -28.100 14.363 -10.396 1.00 0.00 H new ATOM 0 HG21 THR A 75 -27.101 15.180 -8.377 1.00 0.00 H new ATOM 0 HG22 THR A 75 -26.375 13.976 -7.286 1.00 0.00 H new ATOM 0 HG23 THR A 75 -25.586 14.366 -8.833 1.00 0.00 H new ATOM 1216 N ARG A 76 -28.146 9.948 -8.386 1.00 0.00 N ATOM 1217 CA ARG A 76 -29.047 8.786 -8.547 1.00 0.00 C ATOM 1218 C ARG A 76 -30.406 9.121 -7.899 1.00 0.00 C ATOM 1219 O ARG A 76 -30.454 9.762 -6.836 1.00 0.00 O ATOM 1220 CB ARG A 76 -28.383 7.524 -7.900 1.00 0.00 C ATOM 1221 CG ARG A 76 -28.924 6.138 -8.362 1.00 0.00 C ATOM 1222 CD ARG A 76 -30.258 5.716 -7.723 1.00 0.00 C ATOM 1223 NE ARG A 76 -30.163 5.559 -6.263 1.00 0.00 N ATOM 1224 CZ ARG A 76 -31.070 4.942 -5.490 1.00 0.00 C ATOM 1225 NH1 ARG A 76 -32.206 4.482 -6.007 1.00 0.00 N ATOM 1226 NH2 ARG A 76 -30.842 4.796 -4.199 1.00 0.00 N ATOM 0 H ARG A 76 -28.004 10.209 -7.410 1.00 0.00 H new ATOM 0 HA ARG A 76 -29.217 8.566 -9.601 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -27.313 7.558 -8.106 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -28.502 7.593 -6.819 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -29.046 6.155 -9.445 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -28.175 5.379 -8.138 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -31.019 6.461 -7.956 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -30.587 4.775 -8.165 1.00 0.00 H new ATOM 0 HE ARG A 76 -29.342 5.951 -5.802 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -32.396 4.596 -7.003 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -32.887 4.015 -5.408 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -29.978 5.152 -3.790 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -31.530 4.327 -3.609 1.00 0.00 H new ATOM 1240 N SER A 77 -31.500 8.676 -8.543 1.00 0.00 N ATOM 1241 CA SER A 77 -32.877 8.901 -8.069 1.00 0.00 C ATOM 1242 C SER A 77 -33.185 8.048 -6.810 1.00 0.00 C ATOM 1243 O SER A 77 -33.570 6.876 -6.912 1.00 0.00 O ATOM 1244 CB SER A 77 -33.876 8.590 -9.213 1.00 0.00 C ATOM 1245 OG SER A 77 -35.223 8.794 -8.812 1.00 0.00 O ATOM 0 H SER A 77 -31.453 8.146 -9.413 1.00 0.00 H new ATOM 0 HA SER A 77 -32.983 9.947 -7.782 1.00 0.00 H new ATOM 0 HB2 SER A 77 -33.653 9.224 -10.071 1.00 0.00 H new ATOM 0 HB3 SER A 77 -33.746 7.557 -9.537 1.00 0.00 H new ATOM 0 HG SER A 77 -35.822 8.589 -9.560 1.00 0.00 H new ATOM 1251 N SER A 78 -32.947 8.645 -5.631 1.00 0.00 N ATOM 1252 CA SER A 78 -33.271 8.049 -4.319 1.00 0.00 C ATOM 1253 C SER A 78 -34.465 8.805 -3.699 1.00 0.00 C ATOM 1254 O SER A 78 -34.507 10.035 -3.756 1.00 0.00 O ATOM 1255 CB SER A 78 -32.031 8.126 -3.394 1.00 0.00 C ATOM 1256 OG SER A 78 -32.266 7.491 -2.146 1.00 0.00 O ATOM 0 H SER A 78 -32.518 9.568 -5.558 1.00 0.00 H new ATOM 0 HA SER A 78 -33.545 7.001 -4.442 1.00 0.00 H new ATOM 0 HB2 SER A 78 -31.180 7.656 -3.887 1.00 0.00 H new ATOM 0 HB3 SER A 78 -31.766 9.170 -3.227 1.00 0.00 H new ATOM 0 HG SER A 78 -31.463 7.557 -1.589 1.00 0.00 H new ATOM 1262 N GLY A 79 -35.432 8.067 -3.119 1.00 0.00 N ATOM 1263 CA GLY A 79 -36.620 8.677 -2.509 1.00 0.00 C ATOM 1264 C GLY A 79 -37.810 7.720 -2.416 1.00 0.00 C ATOM 1265 O GLY A 79 -38.661 7.695 -3.316 1.00 0.00 O ATOM 0 H GLY A 79 -35.410 7.049 -3.062 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -36.367 9.029 -1.509 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -36.910 9.552 -3.091 1.00 0.00 H new ATOM 1269 N HIS A 80 -37.850 6.905 -1.341 1.00 0.00 N ATOM 1270 CA HIS A 80 -39.047 6.112 -0.963 1.00 0.00 C ATOM 1271 C HIS A 80 -39.758 6.842 0.190 1.00 0.00 C ATOM 1272 O HIS A 80 -39.427 6.641 1.366 1.00 0.00 O ATOM 1273 CB HIS A 80 -38.666 4.661 -0.546 1.00 0.00 C ATOM 1274 CG HIS A 80 -38.017 3.843 -1.634 1.00 0.00 C ATOM 1275 ND1 HIS A 80 -38.718 3.265 -2.670 1.00 0.00 N ATOM 1276 CD2 HIS A 80 -36.722 3.496 -1.836 1.00 0.00 C ATOM 1277 CE1 HIS A 80 -37.889 2.611 -3.453 1.00 0.00 C ATOM 1278 NE2 HIS A 80 -36.673 2.732 -2.971 1.00 0.00 N ATOM 0 H HIS A 80 -37.059 6.776 -0.711 1.00 0.00 H new ATOM 0 HA HIS A 80 -39.711 6.026 -1.823 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -37.989 4.708 0.307 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -39.566 4.146 -0.210 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -35.883 3.772 -1.215 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -38.162 2.065 -4.344 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -35.831 2.324 -3.376 1.00 0.00 H new ATOM 1287 N GLY A 81 -40.689 7.743 -0.169 1.00 0.00 N ATOM 1288 CA GLY A 81 -41.370 8.610 0.796 1.00 0.00 C ATOM 1289 C GLY A 81 -40.576 9.887 1.048 1.00 0.00 C ATOM 1290 O GLY A 81 -41.058 10.992 0.783 1.00 0.00 O ATOM 0 H GLY A 81 -40.987 7.887 -1.134 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -42.363 8.864 0.424 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -41.509 8.074 1.735 1.00 0.00 H new ATOM 1294 N THR A 82 -39.345 9.716 1.565 1.00 0.00 N ATOM 1295 CA THR A 82 -38.367 10.804 1.758 1.00 0.00 C ATOM 1296 C THR A 82 -36.974 10.332 1.256 1.00 0.00 C ATOM 1297 CB THR A 82 -38.295 11.258 3.267 1.00 0.00 C ATOM 1298 OG1 THR A 82 -38.177 10.115 4.129 1.00 0.00 O ATOM 1299 CG2 THR A 82 -39.519 12.089 3.692 1.00 0.00 C ATOM 0 H THR A 82 -38.997 8.805 1.865 1.00 0.00 H new ATOM 0 HA THR A 82 -38.688 11.670 1.180 1.00 0.00 H new ATOM 0 HB THR A 82 -37.412 11.891 3.361 1.00 0.00 H new ATOM 0 HG1 THR A 82 -38.132 10.412 5.062 1.00 0.00 H new ATOM 0 HG21 THR A 82 -39.419 12.375 4.739 1.00 0.00 H new ATOM 0 HG22 THR A 82 -39.582 12.985 3.075 1.00 0.00 H new ATOM 0 HG23 THR A 82 -40.424 11.495 3.563 1.00 0.00 H new TER 1307 THR A 82