USER MOD reduce.3.24.130724 H: found=0, std=0, add=959, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 961 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 122 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 126 GLN : amide:sc= -0.169 K(o=-0.17,f=-2.2!) USER MOD Set 2.1: A 100 TYR OH : rot 180:sc= -0.0205 USER MOD Set 2.2: A 104 MET CE :methyl -177:sc= -0.133 (180deg=-0.138) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 HIS : no HD1:sc= -3.61! C(o=-3.6!,f=-4.1!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 HIS : no HD1:sc= -3.54! C(o=-3.5!,f=-5.6!) USER MOD Single : A 36 LYS NZ :NH3+ -129:sc= -0.197 (180deg=-0.983) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc=-0.00577 USER MOD Single : A 42 TYR OH : rot 165:sc= 0 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0112) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 GLN : amide:sc= -0.043 K(o=-0.043,f=-1.8!) USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=-0.078) USER MOD Single : A 58 ASN : amide:sc= -0.505 K(o=-0.51,f=-4.8!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 CYS SG : rot 51:sc= -7.07! USER MOD Single : A 69 ASN : amide:sc= 0 K(o=0,f=-3.5!) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 GLN : amide:sc=-0.00131 X(o=-0.0013,f=-0.024) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 CYS SG : rot 180:sc= -1.01 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 26:sc= 0.00504 USER MOD Single : A 87 MET CE :methyl -174:sc= -3.73! (180deg=-3.97!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 CYS SG : rot 110:sc= -0.725 USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=-0.0087) USER MOD Single : A 99 GLN : amide:sc= -0.739 K(o=-0.74,f=-4.8!) USER MOD Single : A 107 CYS SG : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 MET CE :methyl -126:sc= -0.97 (180deg=-3.99!) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 66 N ILE A 8 16.454 -2.536 8.918 1.00 0.00 N ATOM 67 CA ILE A 8 15.132 -1.946 8.747 1.00 0.00 C ATOM 68 C ILE A 8 14.303 -2.736 7.739 1.00 0.00 C ATOM 69 O ILE A 8 14.597 -2.765 6.544 1.00 0.00 O ATOM 70 CB ILE A 8 15.225 -0.481 8.282 1.00 0.00 C ATOM 71 CG1 ILE A 8 15.952 0.364 9.330 1.00 0.00 C ATOM 72 CG2 ILE A 8 13.836 0.079 8.014 1.00 0.00 C ATOM 73 CD1 ILE A 8 15.110 0.673 10.548 1.00 0.00 C ATOM 0 HA ILE A 8 14.644 -1.979 9.721 1.00 0.00 H new ATOM 0 HB ILE A 8 15.795 -0.445 7.354 1.00 0.00 H new ATOM 0 HG12 ILE A 8 16.854 -0.160 9.646 1.00 0.00 H new ATOM 0 HG13 ILE A 8 16.271 1.300 8.872 1.00 0.00 H new ATOM 0 HG21 ILE A 8 13.919 1.115 7.686 1.00 0.00 H new ATOM 0 HG22 ILE A 8 13.350 -0.510 7.236 1.00 0.00 H new ATOM 0 HG23 ILE A 8 13.243 0.034 8.927 1.00 0.00 H new ATOM 0 HD11 ILE A 8 15.690 1.275 11.248 1.00 0.00 H new ATOM 0 HD12 ILE A 8 14.220 1.225 10.245 1.00 0.00 H new ATOM 0 HD13 ILE A 8 14.812 -0.258 11.030 1.00 0.00 H new ATOM 85 N PRO A 9 13.241 -3.391 8.230 1.00 0.00 N ATOM 86 CA PRO A 9 12.346 -4.192 7.389 1.00 0.00 C ATOM 87 C PRO A 9 11.506 -3.330 6.453 1.00 0.00 C ATOM 88 O PRO A 9 10.464 -2.806 6.846 1.00 0.00 O ATOM 89 CB PRO A 9 11.452 -4.908 8.404 1.00 0.00 C ATOM 90 CG PRO A 9 11.466 -4.030 9.607 1.00 0.00 C ATOM 91 CD PRO A 9 12.831 -3.400 9.645 1.00 0.00 C ATOM 0 HA PRO A 9 12.897 -4.868 6.735 1.00 0.00 H new ATOM 0 HB2 PRO A 9 10.440 -5.036 8.019 1.00 0.00 H new ATOM 0 HB3 PRO A 9 11.833 -5.903 8.635 1.00 0.00 H new ATOM 0 HG2 PRO A 9 10.687 -3.270 9.544 1.00 0.00 H new ATOM 0 HG3 PRO A 9 11.277 -4.606 10.513 1.00 0.00 H new ATOM 0 HD2 PRO A 9 12.797 -2.393 10.060 1.00 0.00 H new ATOM 0 HD3 PRO A 9 13.522 -3.976 10.260 1.00 0.00 H new ATOM 99 N GLU A 10 11.965 -3.188 5.214 1.00 0.00 N ATOM 100 CA GLU A 10 11.254 -2.389 4.223 1.00 0.00 C ATOM 101 C GLU A 10 10.813 -3.251 3.044 1.00 0.00 C ATOM 102 O GLU A 10 11.492 -4.209 2.672 1.00 0.00 O ATOM 103 CB GLU A 10 12.140 -1.244 3.728 1.00 0.00 C ATOM 104 CG GLU A 10 12.785 -0.446 4.848 1.00 0.00 C ATOM 105 CD GLU A 10 13.776 0.582 4.336 1.00 0.00 C ATOM 106 OE1 GLU A 10 13.347 1.518 3.629 1.00 0.00 O ATOM 107 OE2 GLU A 10 14.980 0.451 4.642 1.00 0.00 O ATOM 0 H GLU A 10 12.826 -3.616 4.872 1.00 0.00 H new ATOM 0 HA GLU A 10 10.366 -1.973 4.699 1.00 0.00 H new ATOM 0 HB2 GLU A 10 12.922 -1.652 3.087 1.00 0.00 H new ATOM 0 HB3 GLU A 10 11.541 -0.572 3.113 1.00 0.00 H new ATOM 0 HG2 GLU A 10 12.009 0.058 5.423 1.00 0.00 H new ATOM 0 HG3 GLU A 10 13.294 -1.128 5.529 1.00 0.00 H new ATOM 114 N LEU A 11 9.671 -2.905 2.460 1.00 0.00 N ATOM 115 CA LEU A 11 9.137 -3.647 1.323 1.00 0.00 C ATOM 116 C LEU A 11 9.389 -2.899 0.018 1.00 0.00 C ATOM 117 O LEU A 11 9.153 -1.694 -0.076 1.00 0.00 O ATOM 118 CB LEU A 11 7.637 -3.887 1.505 1.00 0.00 C ATOM 119 CG LEU A 11 7.245 -5.194 2.195 1.00 0.00 C ATOM 120 CD1 LEU A 11 5.950 -5.019 2.973 1.00 0.00 C ATOM 121 CD2 LEU A 11 7.110 -6.316 1.176 1.00 0.00 C ATOM 0 H LEU A 11 9.097 -2.115 2.755 1.00 0.00 H new ATOM 0 HA LEU A 11 9.649 -4.608 1.274 1.00 0.00 H new ATOM 0 HB2 LEU A 11 7.224 -3.058 2.080 1.00 0.00 H new ATOM 0 HB3 LEU A 11 7.164 -3.862 0.523 1.00 0.00 H new ATOM 0 HG LEU A 11 8.034 -5.462 2.898 1.00 0.00 H new ATOM 0 HD11 LEU A 11 5.687 -5.959 3.457 1.00 0.00 H new ATOM 0 HD12 LEU A 11 6.082 -4.246 3.730 1.00 0.00 H new ATOM 0 HD13 LEU A 11 5.152 -4.727 2.290 1.00 0.00 H new ATOM 0 HD21 LEU A 11 6.831 -7.238 1.685 1.00 0.00 H new ATOM 0 HD22 LEU A 11 6.341 -6.056 0.448 1.00 0.00 H new ATOM 0 HD23 LEU A 11 8.061 -6.458 0.663 1.00 0.00 H new ATOM 133 N LYS A 12 9.869 -3.621 -0.988 1.00 0.00 N ATOM 134 CA LYS A 12 10.151 -3.029 -2.290 1.00 0.00 C ATOM 135 C LYS A 12 9.296 -3.672 -3.378 1.00 0.00 C ATOM 136 O LYS A 12 9.511 -4.826 -3.748 1.00 0.00 O ATOM 137 CB LYS A 12 11.634 -3.184 -2.634 1.00 0.00 C ATOM 138 CG LYS A 12 12.567 -2.730 -1.525 1.00 0.00 C ATOM 139 CD LYS A 12 12.903 -1.253 -1.649 1.00 0.00 C ATOM 140 CE LYS A 12 14.126 -1.032 -2.526 1.00 0.00 C ATOM 141 NZ LYS A 12 15.394 -1.204 -1.764 1.00 0.00 N ATOM 0 H LYS A 12 10.071 -4.619 -0.927 1.00 0.00 H new ATOM 0 HA LYS A 12 9.905 -1.968 -2.239 1.00 0.00 H new ATOM 0 HB2 LYS A 12 11.838 -4.230 -2.863 1.00 0.00 H new ATOM 0 HB3 LYS A 12 11.851 -2.612 -3.536 1.00 0.00 H new ATOM 0 HG2 LYS A 12 12.102 -2.918 -0.557 1.00 0.00 H new ATOM 0 HG3 LYS A 12 13.485 -3.317 -1.557 1.00 0.00 H new ATOM 0 HD2 LYS A 12 12.051 -0.719 -2.070 1.00 0.00 H new ATOM 0 HD3 LYS A 12 13.084 -0.835 -0.659 1.00 0.00 H new ATOM 0 HE2 LYS A 12 14.106 -1.733 -3.360 1.00 0.00 H new ATOM 0 HE3 LYS A 12 14.091 -0.029 -2.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 16.204 -1.045 -2.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 15.425 -0.518 -0.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 15.440 -2.169 -1.379 1.00 0.00 H new ATOM 155 N ASP A 13 8.328 -2.918 -3.886 1.00 0.00 N ATOM 156 CA ASP A 13 7.442 -3.413 -4.933 1.00 0.00 C ATOM 157 C ASP A 13 6.504 -2.312 -5.418 1.00 0.00 C ATOM 158 O ASP A 13 6.027 -1.496 -4.629 1.00 0.00 O ATOM 159 CB ASP A 13 6.630 -4.604 -4.421 1.00 0.00 C ATOM 160 CG ASP A 13 7.358 -5.922 -4.600 1.00 0.00 C ATOM 161 OD1 ASP A 13 8.087 -6.065 -5.603 1.00 0.00 O ATOM 162 OD2 ASP A 13 7.198 -6.810 -3.736 1.00 0.00 O ATOM 0 H ASP A 13 8.137 -1.961 -3.590 1.00 0.00 H new ATOM 0 HA ASP A 13 8.057 -3.736 -5.773 1.00 0.00 H new ATOM 0 HB2 ASP A 13 6.403 -4.458 -3.365 1.00 0.00 H new ATOM 0 HB3 ASP A 13 5.677 -4.644 -4.949 1.00 0.00 H new ATOM 167 N HIS A 14 6.245 -2.295 -6.721 1.00 0.00 N ATOM 168 CA HIS A 14 5.364 -1.293 -7.312 1.00 0.00 C ATOM 169 C HIS A 14 3.983 -1.879 -7.586 1.00 0.00 C ATOM 170 O HIS A 14 3.823 -2.744 -8.449 1.00 0.00 O ATOM 171 CB HIS A 14 5.969 -0.753 -8.609 1.00 0.00 C ATOM 172 CG HIS A 14 4.973 -0.072 -9.496 1.00 0.00 C ATOM 173 ND1 HIS A 14 4.515 -0.621 -10.675 1.00 0.00 N ATOM 174 CD2 HIS A 14 4.344 1.120 -9.369 1.00 0.00 C ATOM 175 CE1 HIS A 14 3.650 0.204 -11.236 1.00 0.00 C ATOM 176 NE2 HIS A 14 3.528 1.269 -10.463 1.00 0.00 N ATOM 0 H HIS A 14 6.632 -2.963 -7.388 1.00 0.00 H new ATOM 0 HA HIS A 14 5.257 -0.474 -6.601 1.00 0.00 H new ATOM 0 HB2 HIS A 14 6.765 -0.050 -8.364 1.00 0.00 H new ATOM 0 HB3 HIS A 14 6.428 -1.576 -9.157 1.00 0.00 H new ATOM 0 HD2 HIS A 14 4.462 1.823 -8.558 1.00 0.00 H new ATOM 0 HE1 HIS A 14 3.131 0.037 -12.168 1.00 0.00 H new ATOM 0 HE2 HIS A 14 2.926 2.071 -10.649 1.00 0.00 H new ATOM 185 N LEU A 15 2.987 -1.402 -6.847 1.00 0.00 N ATOM 186 CA LEU A 15 1.617 -1.879 -7.010 1.00 0.00 C ATOM 187 C LEU A 15 0.885 -1.076 -8.080 1.00 0.00 C ATOM 188 O LEU A 15 1.473 -0.218 -8.738 1.00 0.00 O ATOM 189 CB LEU A 15 0.864 -1.788 -5.682 1.00 0.00 C ATOM 190 CG LEU A 15 1.596 -2.333 -4.456 1.00 0.00 C ATOM 191 CD1 LEU A 15 1.167 -1.587 -3.202 1.00 0.00 C ATOM 192 CD2 LEU A 15 1.343 -3.826 -4.303 1.00 0.00 C ATOM 0 H LEU A 15 3.102 -0.686 -6.130 1.00 0.00 H new ATOM 0 HA LEU A 15 1.656 -2.921 -7.328 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.618 -0.742 -5.498 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.079 -2.324 -5.785 1.00 0.00 H new ATOM 0 HG LEU A 15 2.666 -2.179 -4.598 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.699 -1.989 -2.340 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.401 -0.528 -3.311 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.094 -1.709 -3.056 1.00 0.00 H new ATOM 0 HD21 LEU A 15 1.872 -4.197 -3.425 1.00 0.00 H new ATOM 0 HD22 LEU A 15 0.274 -4.004 -4.184 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.701 -4.349 -5.190 1.00 0.00 H new ATOM 204 N ARG A 16 -0.403 -1.359 -8.247 1.00 0.00 N ATOM 205 CA ARG A 16 -1.216 -0.662 -9.236 1.00 0.00 C ATOM 206 C ARG A 16 -1.700 0.680 -8.694 1.00 0.00 C ATOM 207 O ARG A 16 -2.463 0.732 -7.729 1.00 0.00 O ATOM 208 CB ARG A 16 -2.415 -1.523 -9.640 1.00 0.00 C ATOM 209 CG ARG A 16 -2.068 -2.625 -10.628 1.00 0.00 C ATOM 210 CD ARG A 16 -1.565 -3.872 -9.918 1.00 0.00 C ATOM 211 NE ARG A 16 -2.652 -4.788 -9.585 1.00 0.00 N ATOM 212 CZ ARG A 16 -3.408 -5.392 -10.495 1.00 0.00 C ATOM 213 NH1 ARG A 16 -3.196 -5.178 -11.786 1.00 0.00 N ATOM 214 NH2 ARG A 16 -4.379 -6.213 -10.114 1.00 0.00 N ATOM 0 H ARG A 16 -0.906 -2.066 -7.710 1.00 0.00 H new ATOM 0 HA ARG A 16 -0.597 -0.478 -10.114 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -2.847 -1.971 -8.746 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -3.181 -0.882 -10.077 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -2.948 -2.873 -11.222 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -1.306 -2.267 -11.321 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -0.841 -4.384 -10.553 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -1.042 -3.584 -9.006 1.00 0.00 H new ATOM 0 HE ARG A 16 -2.841 -4.974 -8.600 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -2.451 -4.548 -12.083 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -3.778 -5.643 -12.482 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -4.545 -6.381 -9.122 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -4.959 -6.676 -10.814 1.00 0.00 H new ATOM 228 N ILE A 17 -1.252 1.762 -9.321 1.00 0.00 N ATOM 229 CA ILE A 17 -1.639 3.103 -8.903 1.00 0.00 C ATOM 230 C ILE A 17 -2.484 3.790 -9.971 1.00 0.00 C ATOM 231 O ILE A 17 -2.064 3.920 -11.121 1.00 0.00 O ATOM 232 CB ILE A 17 -0.407 3.976 -8.599 1.00 0.00 C ATOM 233 CG1 ILE A 17 0.226 3.557 -7.270 1.00 0.00 C ATOM 234 CG2 ILE A 17 -0.795 5.447 -8.567 1.00 0.00 C ATOM 235 CD1 ILE A 17 1.543 4.245 -6.986 1.00 0.00 C ATOM 0 H ILE A 17 -0.620 1.736 -10.121 1.00 0.00 H new ATOM 0 HA ILE A 17 -2.228 2.991 -7.993 1.00 0.00 H new ATOM 0 HB ILE A 17 0.327 3.832 -9.391 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -0.471 3.774 -6.460 1.00 0.00 H new ATOM 0 HG13 ILE A 17 0.382 2.478 -7.275 1.00 0.00 H new ATOM 0 HG21 ILE A 17 0.086 6.051 -8.351 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -1.205 5.736 -9.535 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -1.545 5.609 -7.792 1.00 0.00 H new ATOM 0 HD11 ILE A 17 1.934 3.901 -6.029 1.00 0.00 H new ATOM 0 HD12 ILE A 17 2.255 4.007 -7.776 1.00 0.00 H new ATOM 0 HD13 ILE A 17 1.389 5.323 -6.948 1.00 0.00 H new ATOM 247 N PHE A 18 -3.676 4.229 -9.582 1.00 0.00 N ATOM 248 CA PHE A 18 -4.581 4.904 -10.505 1.00 0.00 C ATOM 249 C PHE A 18 -5.308 6.052 -9.813 1.00 0.00 C ATOM 250 O PHE A 18 -5.804 5.903 -8.695 1.00 0.00 O ATOM 251 CB PHE A 18 -5.596 3.911 -11.075 1.00 0.00 C ATOM 252 CG PHE A 18 -6.881 4.554 -11.514 1.00 0.00 C ATOM 253 CD1 PHE A 18 -6.908 5.405 -12.607 1.00 0.00 C ATOM 254 CD2 PHE A 18 -8.062 4.307 -10.833 1.00 0.00 C ATOM 255 CE1 PHE A 18 -8.088 5.997 -13.014 1.00 0.00 C ATOM 256 CE2 PHE A 18 -9.246 4.896 -11.236 1.00 0.00 C ATOM 257 CZ PHE A 18 -9.259 5.743 -12.327 1.00 0.00 C ATOM 0 H PHE A 18 -4.038 4.130 -8.634 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.987 5.314 -11.322 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -5.149 3.394 -11.924 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -5.816 3.155 -10.321 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -5.995 5.608 -13.147 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -8.058 3.647 -9.978 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -8.095 6.658 -13.868 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -10.160 4.694 -10.698 1.00 0.00 H new ATOM 0 HZ PHE A 18 -10.183 6.206 -12.642 1.00 0.00 H new ATOM 267 N ARG A 19 -5.368 7.198 -10.484 1.00 0.00 N ATOM 268 CA ARG A 19 -6.033 8.372 -9.933 1.00 0.00 C ATOM 269 C ARG A 19 -6.727 9.171 -11.033 1.00 0.00 C ATOM 270 O ARG A 19 -6.091 9.870 -11.821 1.00 0.00 O ATOM 271 CB ARG A 19 -5.024 9.261 -9.202 1.00 0.00 C ATOM 272 CG ARG A 19 -4.657 8.753 -7.818 1.00 0.00 C ATOM 273 CD ARG A 19 -3.268 9.217 -7.405 1.00 0.00 C ATOM 274 NE ARG A 19 -2.239 8.758 -8.334 1.00 0.00 N ATOM 275 CZ ARG A 19 -0.949 9.042 -8.200 1.00 0.00 C ATOM 276 NH1 ARG A 19 -0.531 9.780 -7.180 1.00 0.00 N ATOM 277 NH2 ARG A 19 -0.073 8.588 -9.087 1.00 0.00 N ATOM 0 H ARG A 19 -4.964 7.338 -11.410 1.00 0.00 H new ATOM 0 HA ARG A 19 -6.787 8.031 -9.224 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -4.118 9.339 -9.803 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -5.435 10.267 -9.114 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -5.390 9.106 -7.093 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -4.696 7.664 -7.807 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -3.250 10.306 -7.353 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -3.045 8.846 -6.405 1.00 0.00 H new ATOM 0 HE ARG A 19 -2.527 8.188 -9.129 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -1.201 10.131 -6.496 1.00 0.00 H new ATOM 0 HH12 ARG A 19 0.461 9.996 -7.080 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -0.390 8.020 -9.873 1.00 0.00 H new ATOM 0 HH22 ARG A 19 0.918 8.807 -8.983 1.00 0.00 H new ATOM 291 N PRO A 20 -8.063 9.064 -11.089 1.00 0.00 N ATOM 292 CA PRO A 20 -8.872 9.768 -12.088 1.00 0.00 C ATOM 293 C PRO A 20 -8.904 11.274 -11.851 1.00 0.00 C ATOM 294 O PRO A 20 -9.564 12.013 -12.582 1.00 0.00 O ATOM 295 CB PRO A 20 -10.267 9.167 -11.902 1.00 0.00 C ATOM 296 CG PRO A 20 -10.289 8.691 -10.491 1.00 0.00 C ATOM 297 CD PRO A 20 -8.886 8.248 -10.182 1.00 0.00 C ATOM 0 HA PRO A 20 -8.472 9.648 -13.095 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -11.045 9.909 -12.082 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -10.441 8.347 -12.599 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -10.605 9.486 -9.816 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -10.994 7.869 -10.367 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -8.629 8.425 -9.138 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -8.751 7.182 -10.367 1.00 0.00 H new ATOM 432 N TYR A 28 -2.843 3.427 -15.094 1.00 0.00 N ATOM 433 CA TYR A 28 -1.720 2.889 -14.335 1.00 0.00 C ATOM 434 C TYR A 28 -0.419 3.021 -15.122 1.00 0.00 C ATOM 435 O TYR A 28 -0.300 2.513 -16.237 1.00 0.00 O ATOM 436 CB TYR A 28 -1.970 1.421 -13.985 1.00 0.00 C ATOM 437 CG TYR A 28 -3.304 1.178 -13.315 1.00 0.00 C ATOM 438 CD1 TYR A 28 -3.460 1.363 -11.947 1.00 0.00 C ATOM 439 CD2 TYR A 28 -4.407 0.761 -14.050 1.00 0.00 C ATOM 440 CE1 TYR A 28 -4.676 1.141 -11.331 1.00 0.00 C ATOM 441 CE2 TYR A 28 -5.627 0.538 -13.442 1.00 0.00 C ATOM 442 CZ TYR A 28 -5.757 0.729 -12.083 1.00 0.00 C ATOM 443 OH TYR A 28 -6.971 0.507 -11.473 1.00 0.00 O ATOM 0 HA TYR A 28 -1.627 3.464 -13.414 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -1.916 0.825 -14.896 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -1.174 1.072 -13.328 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -2.616 1.686 -11.355 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -4.309 0.609 -15.115 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -4.780 1.289 -10.266 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -6.475 0.216 -14.028 1.00 0.00 H new ATOM 0 HH TYR A 28 -7.627 0.223 -12.143 1.00 0.00 H new ATOM 453 N ARG A 29 0.555 3.706 -14.531 1.00 0.00 N ATOM 454 CA ARG A 29 1.848 3.906 -15.175 1.00 0.00 C ATOM 455 C ARG A 29 2.967 3.270 -14.355 1.00 0.00 C ATOM 456 O ARG A 29 2.832 3.078 -13.147 1.00 0.00 O ATOM 457 CB ARG A 29 2.123 5.399 -15.362 1.00 0.00 C ATOM 458 CG ARG A 29 3.341 5.690 -16.223 1.00 0.00 C ATOM 459 CD ARG A 29 3.788 7.137 -16.083 1.00 0.00 C ATOM 460 NE ARG A 29 2.826 8.067 -16.669 1.00 0.00 N ATOM 461 CZ ARG A 29 2.730 8.299 -17.973 1.00 0.00 C ATOM 462 NH1 ARG A 29 3.532 7.673 -18.823 1.00 0.00 N ATOM 463 NH2 ARG A 29 1.829 9.160 -18.430 1.00 0.00 N ATOM 0 H ARG A 29 0.473 4.132 -13.608 1.00 0.00 H new ATOM 0 HA ARG A 29 1.818 3.424 -16.152 1.00 0.00 H new ATOM 0 HB2 ARG A 29 1.249 5.867 -15.814 1.00 0.00 H new ATOM 0 HB3 ARG A 29 2.261 5.860 -14.384 1.00 0.00 H new ATOM 0 HG2 ARG A 29 4.157 5.026 -15.937 1.00 0.00 H new ATOM 0 HG3 ARG A 29 3.109 5.479 -17.267 1.00 0.00 H new ATOM 0 HD2 ARG A 29 3.924 7.374 -15.028 1.00 0.00 H new ATOM 0 HD3 ARG A 29 4.757 7.265 -16.566 1.00 0.00 H new ATOM 0 HE ARG A 29 2.194 8.565 -16.043 1.00 0.00 H new ATOM 0 HH11 ARG A 29 4.226 7.011 -18.476 1.00 0.00 H new ATOM 0 HH12 ARG A 29 3.455 7.854 -19.824 1.00 0.00 H new ATOM 0 HH21 ARG A 29 1.210 9.644 -17.779 1.00 0.00 H new ATOM 0 HH22 ARG A 29 1.756 9.338 -19.432 1.00 0.00 H new ATOM 477 N GLN A 30 4.071 2.947 -15.022 1.00 0.00 N ATOM 478 CA GLN A 30 5.212 2.332 -14.355 1.00 0.00 C ATOM 479 C GLN A 30 5.834 3.290 -13.345 1.00 0.00 C ATOM 480 O GLN A 30 6.387 4.326 -13.715 1.00 0.00 O ATOM 481 CB GLN A 30 6.261 1.905 -15.383 1.00 0.00 C ATOM 482 CG GLN A 30 7.225 0.849 -14.867 1.00 0.00 C ATOM 483 CD GLN A 30 8.577 0.909 -15.550 1.00 0.00 C ATOM 484 OE1 GLN A 30 8.815 0.221 -16.544 1.00 0.00 O ATOM 485 NE2 GLN A 30 9.473 1.734 -15.020 1.00 0.00 N ATOM 0 H GLN A 30 4.199 3.101 -16.022 1.00 0.00 H new ATOM 0 HA GLN A 30 4.856 1.451 -13.821 1.00 0.00 H new ATOM 0 HB2 GLN A 30 5.754 1.521 -16.268 1.00 0.00 H new ATOM 0 HB3 GLN A 30 6.829 2.781 -15.696 1.00 0.00 H new ATOM 0 HG2 GLN A 30 7.359 0.978 -13.793 1.00 0.00 H new ATOM 0 HG3 GLN A 30 6.790 -0.139 -15.017 1.00 0.00 H new ATOM 0 HE21 GLN A 30 9.234 2.286 -14.196 1.00 0.00 H new ATOM 0 HE22 GLN A 30 10.400 1.816 -15.437 1.00 0.00 H new ATOM 494 N HIS A 31 5.739 2.938 -12.066 1.00 0.00 N ATOM 495 CA HIS A 31 6.293 3.768 -11.002 1.00 0.00 C ATOM 496 C HIS A 31 6.974 2.908 -9.942 1.00 0.00 C ATOM 497 O HIS A 31 6.850 1.684 -9.948 1.00 0.00 O ATOM 498 CB HIS A 31 5.191 4.612 -10.360 1.00 0.00 C ATOM 499 CG HIS A 31 4.585 5.615 -11.292 1.00 0.00 C ATOM 500 ND1 HIS A 31 5.326 6.570 -11.956 1.00 0.00 N ATOM 501 CD2 HIS A 31 3.300 5.807 -11.672 1.00 0.00 C ATOM 502 CE1 HIS A 31 4.522 7.307 -12.702 1.00 0.00 C ATOM 503 NE2 HIS A 31 3.288 6.864 -12.548 1.00 0.00 N ATOM 0 H HIS A 31 5.284 2.085 -11.742 1.00 0.00 H new ATOM 0 HA HIS A 31 7.039 4.430 -11.441 1.00 0.00 H new ATOM 0 HB2 HIS A 31 4.407 3.951 -9.991 1.00 0.00 H new ATOM 0 HB3 HIS A 31 5.601 5.133 -9.495 1.00 0.00 H new ATOM 0 HD2 HIS A 31 2.444 5.235 -11.347 1.00 0.00 H new ATOM 0 HE1 HIS A 31 4.823 8.132 -13.331 1.00 0.00 H new ATOM 0 HE2 HIS A 31 2.460 7.245 -13.006 1.00 0.00 H new ATOM 512 N TRP A 32 7.695 3.557 -9.035 1.00 0.00 N ATOM 513 CA TRP A 32 8.397 2.852 -7.969 1.00 0.00 C ATOM 514 C TRP A 32 7.784 3.170 -6.609 1.00 0.00 C ATOM 515 O TRP A 32 7.626 4.336 -6.247 1.00 0.00 O ATOM 516 CB TRP A 32 9.881 3.224 -7.973 1.00 0.00 C ATOM 517 CG TRP A 32 10.682 2.485 -6.945 1.00 0.00 C ATOM 518 CD1 TRP A 32 11.495 3.030 -5.993 1.00 0.00 C ATOM 519 CD2 TRP A 32 10.748 1.066 -6.768 1.00 0.00 C ATOM 520 NE1 TRP A 32 12.063 2.034 -5.234 1.00 0.00 N ATOM 521 CE2 TRP A 32 11.620 0.821 -5.689 1.00 0.00 C ATOM 522 CE3 TRP A 32 10.154 -0.022 -7.414 1.00 0.00 C ATOM 523 CZ2 TRP A 32 11.911 -0.466 -5.245 1.00 0.00 C ATOM 524 CZ3 TRP A 32 10.445 -1.298 -6.973 1.00 0.00 C ATOM 525 CH2 TRP A 32 11.316 -1.512 -5.897 1.00 0.00 C ATOM 0 H TRP A 32 7.809 4.570 -9.016 1.00 0.00 H new ATOM 0 HA TRP A 32 8.298 1.782 -8.150 1.00 0.00 H new ATOM 0 HB2 TRP A 32 10.296 3.022 -8.960 1.00 0.00 H new ATOM 0 HB3 TRP A 32 9.980 4.295 -7.799 1.00 0.00 H new ATOM 0 HD1 TRP A 32 11.667 4.087 -5.856 1.00 0.00 H new ATOM 0 HE1 TRP A 32 12.709 2.176 -4.458 1.00 0.00 H new ATOM 0 HE3 TRP A 32 9.480 0.132 -8.243 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 12.582 -0.633 -4.416 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 9.993 -2.146 -7.466 1.00 0.00 H new ATOM 0 HH2 TRP A 32 11.522 -2.522 -5.576 1.00 0.00 H new ATOM 536 N VAL A 33 7.441 2.126 -5.861 1.00 0.00 N ATOM 537 CA VAL A 33 6.847 2.296 -4.540 1.00 0.00 C ATOM 538 C VAL A 33 7.671 1.586 -3.472 1.00 0.00 C ATOM 539 O VAL A 33 8.222 0.511 -3.709 1.00 0.00 O ATOM 540 CB VAL A 33 5.404 1.758 -4.501 1.00 0.00 C ATOM 541 CG1 VAL A 33 4.737 2.113 -3.181 1.00 0.00 C ATOM 542 CG2 VAL A 33 4.602 2.299 -5.675 1.00 0.00 C ATOM 0 H VAL A 33 7.564 1.155 -6.147 1.00 0.00 H new ATOM 0 HA VAL A 33 6.834 3.366 -4.333 1.00 0.00 H new ATOM 0 HB VAL A 33 5.438 0.672 -4.583 1.00 0.00 H new ATOM 0 HG11 VAL A 33 3.719 1.725 -3.172 1.00 0.00 H new ATOM 0 HG12 VAL A 33 5.301 1.673 -2.359 1.00 0.00 H new ATOM 0 HG13 VAL A 33 4.713 3.197 -3.065 1.00 0.00 H new ATOM 0 HG21 VAL A 33 3.585 1.909 -5.632 1.00 0.00 H new ATOM 0 HG22 VAL A 33 4.575 3.388 -5.627 1.00 0.00 H new ATOM 0 HG23 VAL A 33 5.070 1.989 -6.609 1.00 0.00 H new ATOM 552 N VAL A 34 7.751 2.195 -2.293 1.00 0.00 N ATOM 553 CA VAL A 34 8.507 1.621 -1.186 1.00 0.00 C ATOM 554 C VAL A 34 7.786 1.834 0.141 1.00 0.00 C ATOM 555 O VAL A 34 7.486 2.966 0.522 1.00 0.00 O ATOM 556 CB VAL A 34 9.919 2.230 -1.094 1.00 0.00 C ATOM 557 CG1 VAL A 34 10.667 1.667 0.104 1.00 0.00 C ATOM 558 CG2 VAL A 34 10.691 1.981 -2.381 1.00 0.00 C ATOM 0 H VAL A 34 7.302 3.086 -2.080 1.00 0.00 H new ATOM 0 HA VAL A 34 8.593 0.552 -1.382 1.00 0.00 H new ATOM 0 HB VAL A 34 9.823 3.307 -0.957 1.00 0.00 H new ATOM 0 HG11 VAL A 34 11.662 2.109 0.152 1.00 0.00 H new ATOM 0 HG12 VAL A 34 10.121 1.902 1.017 1.00 0.00 H new ATOM 0 HG13 VAL A 34 10.755 0.585 0.002 1.00 0.00 H new ATOM 0 HG21 VAL A 34 11.686 2.418 -2.299 1.00 0.00 H new ATOM 0 HG22 VAL A 34 10.779 0.908 -2.551 1.00 0.00 H new ATOM 0 HG23 VAL A 34 10.162 2.439 -3.217 1.00 0.00 H new ATOM 568 N PHE A 35 7.511 0.739 0.841 1.00 0.00 N ATOM 569 CA PHE A 35 6.825 0.805 2.126 1.00 0.00 C ATOM 570 C PHE A 35 7.826 0.810 3.278 1.00 0.00 C ATOM 571 O PHE A 35 8.639 -0.105 3.414 1.00 0.00 O ATOM 572 CB PHE A 35 5.863 -0.375 2.276 1.00 0.00 C ATOM 573 CG PHE A 35 5.360 -0.564 3.679 1.00 0.00 C ATOM 574 CD1 PHE A 35 4.646 0.440 4.314 1.00 0.00 C ATOM 575 CD2 PHE A 35 5.601 -1.745 4.362 1.00 0.00 C ATOM 576 CE1 PHE A 35 4.181 0.269 5.604 1.00 0.00 C ATOM 577 CE2 PHE A 35 5.139 -1.921 5.653 1.00 0.00 C ATOM 578 CZ PHE A 35 4.429 -0.912 6.275 1.00 0.00 C ATOM 0 H PHE A 35 7.753 -0.205 0.540 1.00 0.00 H new ATOM 0 HA PHE A 35 6.256 1.734 2.158 1.00 0.00 H new ATOM 0 HB2 PHE A 35 5.013 -0.227 1.611 1.00 0.00 H new ATOM 0 HB3 PHE A 35 6.366 -1.287 1.953 1.00 0.00 H new ATOM 0 HD1 PHE A 35 4.451 1.367 3.795 1.00 0.00 H new ATOM 0 HD2 PHE A 35 6.156 -2.537 3.881 1.00 0.00 H new ATOM 0 HE1 PHE A 35 3.624 1.058 6.087 1.00 0.00 H new ATOM 0 HE2 PHE A 35 5.333 -2.846 6.175 1.00 0.00 H new ATOM 0 HZ PHE A 35 4.069 -1.047 7.284 1.00 0.00 H new ATOM 588 N LYS A 36 7.762 1.847 4.106 1.00 0.00 N ATOM 589 CA LYS A 36 8.661 1.973 5.247 1.00 0.00 C ATOM 590 C LYS A 36 7.929 1.675 6.551 1.00 0.00 C ATOM 591 O LYS A 36 6.705 1.781 6.625 1.00 0.00 O ATOM 592 CB LYS A 36 9.261 3.380 5.297 1.00 0.00 C ATOM 593 CG LYS A 36 10.252 3.578 6.430 1.00 0.00 C ATOM 594 CD LYS A 36 11.510 2.751 6.223 1.00 0.00 C ATOM 595 CE LYS A 36 12.727 3.422 6.841 1.00 0.00 C ATOM 596 NZ LYS A 36 12.974 4.769 6.256 1.00 0.00 N ATOM 0 H LYS A 36 7.096 2.613 4.008 1.00 0.00 H new ATOM 0 HA LYS A 36 9.464 1.246 5.127 1.00 0.00 H new ATOM 0 HB2 LYS A 36 9.759 3.588 4.350 1.00 0.00 H new ATOM 0 HB3 LYS A 36 8.455 4.106 5.399 1.00 0.00 H new ATOM 0 HG2 LYS A 36 10.517 4.633 6.502 1.00 0.00 H new ATOM 0 HG3 LYS A 36 9.785 3.301 7.375 1.00 0.00 H new ATOM 0 HD2 LYS A 36 11.374 1.764 6.665 1.00 0.00 H new ATOM 0 HD3 LYS A 36 11.678 2.603 5.156 1.00 0.00 H new ATOM 0 HE2 LYS A 36 12.583 3.514 7.918 1.00 0.00 H new ATOM 0 HE3 LYS A 36 13.605 2.794 6.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 13.966 4.839 5.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 12.350 4.911 5.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 12.778 5.499 6.970 1.00 0.00 H new ATOM 610 N GLU A 37 8.687 1.303 7.578 1.00 0.00 N ATOM 611 CA GLU A 37 8.108 0.990 8.880 1.00 0.00 C ATOM 612 C GLU A 37 6.874 1.847 9.147 1.00 0.00 C ATOM 613 O GLU A 37 5.753 1.341 9.203 1.00 0.00 O ATOM 614 CB GLU A 37 9.142 1.206 9.987 1.00 0.00 C ATOM 615 CG GLU A 37 10.394 0.361 9.825 1.00 0.00 C ATOM 616 CD GLU A 37 11.282 0.393 11.053 1.00 0.00 C ATOM 617 OE1 GLU A 37 11.010 -0.371 12.003 1.00 0.00 O ATOM 618 OE2 GLU A 37 12.251 1.181 11.064 1.00 0.00 O ATOM 0 H GLU A 37 9.702 1.211 7.534 1.00 0.00 H new ATOM 0 HA GLU A 37 7.807 -0.057 8.873 1.00 0.00 H new ATOM 0 HB2 GLU A 37 9.425 2.259 10.008 1.00 0.00 H new ATOM 0 HB3 GLU A 37 8.684 0.980 10.950 1.00 0.00 H new ATOM 0 HG2 GLU A 37 10.108 -0.670 9.615 1.00 0.00 H new ATOM 0 HG3 GLU A 37 10.959 0.717 8.963 1.00 0.00 H new ATOM 625 N THR A 38 7.088 3.148 9.311 1.00 0.00 N ATOM 626 CA THR A 38 5.995 4.076 9.573 1.00 0.00 C ATOM 627 C THR A 38 5.946 5.179 8.522 1.00 0.00 C ATOM 628 O THR A 38 5.343 6.231 8.738 1.00 0.00 O ATOM 629 CB THR A 38 6.125 4.717 10.968 1.00 0.00 C ATOM 630 OG1 THR A 38 7.506 4.910 11.292 1.00 0.00 O ATOM 631 CG2 THR A 38 5.467 3.845 12.027 1.00 0.00 C ATOM 0 H THR A 38 8.009 3.584 9.267 1.00 0.00 H new ATOM 0 HA THR A 38 5.072 3.497 9.531 1.00 0.00 H new ATOM 0 HB THR A 38 5.619 5.682 10.949 1.00 0.00 H new ATOM 0 HG1 THR A 38 7.580 5.319 12.179 1.00 0.00 H new ATOM 0 HG21 THR A 38 5.571 4.318 13.004 1.00 0.00 H new ATOM 0 HG22 THR A 38 4.409 3.725 11.793 1.00 0.00 H new ATOM 0 HG23 THR A 38 5.948 2.867 12.044 1.00 0.00 H new ATOM 639 N THR A 39 6.584 4.933 7.382 1.00 0.00 N ATOM 640 CA THR A 39 6.613 5.906 6.297 1.00 0.00 C ATOM 641 C THR A 39 6.340 5.239 4.954 1.00 0.00 C ATOM 642 O THR A 39 6.343 4.012 4.846 1.00 0.00 O ATOM 643 CB THR A 39 7.969 6.633 6.231 1.00 0.00 C ATOM 644 OG1 THR A 39 8.548 6.709 7.538 1.00 0.00 O ATOM 645 CG2 THR A 39 7.804 8.035 5.662 1.00 0.00 C ATOM 0 H THR A 39 7.088 4.068 7.186 1.00 0.00 H new ATOM 0 HA THR A 39 5.829 6.634 6.504 1.00 0.00 H new ATOM 0 HB THR A 39 8.629 6.066 5.574 1.00 0.00 H new ATOM 0 HG1 THR A 39 9.411 7.171 7.487 1.00 0.00 H new ATOM 0 HG21 THR A 39 8.775 8.529 5.625 1.00 0.00 H new ATOM 0 HG22 THR A 39 7.390 7.973 4.656 1.00 0.00 H new ATOM 0 HG23 THR A 39 7.129 8.608 6.297 1.00 0.00 H new ATOM 653 N LEU A 40 6.106 6.054 3.931 1.00 0.00 N ATOM 654 CA LEU A 40 5.833 5.543 2.592 1.00 0.00 C ATOM 655 C LEU A 40 6.058 6.624 1.540 1.00 0.00 C ATOM 656 O LEU A 40 5.574 7.747 1.676 1.00 0.00 O ATOM 657 CB LEU A 40 4.397 5.023 2.507 1.00 0.00 C ATOM 658 CG LEU A 40 4.129 3.962 1.439 1.00 0.00 C ATOM 659 CD1 LEU A 40 2.834 3.222 1.734 1.00 0.00 C ATOM 660 CD2 LEU A 40 4.080 4.597 0.057 1.00 0.00 C ATOM 0 H LEU A 40 6.100 7.071 4.003 1.00 0.00 H new ATOM 0 HA LEU A 40 6.523 4.722 2.395 1.00 0.00 H new ATOM 0 HB2 LEU A 40 4.124 4.610 3.478 1.00 0.00 H new ATOM 0 HB3 LEU A 40 3.736 5.870 2.323 1.00 0.00 H new ATOM 0 HG LEU A 40 4.947 3.241 1.457 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.660 2.471 0.963 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.907 2.734 2.706 1.00 0.00 H new ATOM 0 HD13 LEU A 40 2.005 3.930 1.745 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.888 3.827 -0.691 1.00 0.00 H new ATOM 0 HD22 LEU A 40 3.283 5.340 0.026 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.034 5.080 -0.156 1.00 0.00 H new ATOM 672 N SER A 41 6.794 6.276 0.489 1.00 0.00 N ATOM 673 CA SER A 41 7.085 7.217 -0.586 1.00 0.00 C ATOM 674 C SER A 41 7.246 6.488 -1.917 1.00 0.00 C ATOM 675 O SER A 41 7.543 5.294 -1.951 1.00 0.00 O ATOM 676 CB SER A 41 8.354 8.010 -0.269 1.00 0.00 C ATOM 677 OG SER A 41 8.212 8.737 0.939 1.00 0.00 O ATOM 0 H SER A 41 7.200 5.349 0.359 1.00 0.00 H new ATOM 0 HA SER A 41 6.245 7.907 -0.669 1.00 0.00 H new ATOM 0 HB2 SER A 41 9.202 7.329 -0.190 1.00 0.00 H new ATOM 0 HB3 SER A 41 8.571 8.697 -1.087 1.00 0.00 H new ATOM 0 HG SER A 41 9.037 9.234 1.120 1.00 0.00 H new ATOM 683 N TYR A 42 7.049 7.216 -3.010 1.00 0.00 N ATOM 684 CA TYR A 42 7.170 6.640 -4.344 1.00 0.00 C ATOM 685 C TYR A 42 7.866 7.608 -5.295 1.00 0.00 C ATOM 686 O TYR A 42 8.020 8.792 -4.991 1.00 0.00 O ATOM 687 CB TYR A 42 5.789 6.275 -4.892 1.00 0.00 C ATOM 688 CG TYR A 42 4.872 7.465 -5.066 1.00 0.00 C ATOM 689 CD1 TYR A 42 4.512 8.254 -3.981 1.00 0.00 C ATOM 690 CD2 TYR A 42 4.367 7.800 -6.316 1.00 0.00 C ATOM 691 CE1 TYR A 42 3.675 9.342 -4.135 1.00 0.00 C ATOM 692 CE2 TYR A 42 3.530 8.887 -6.480 1.00 0.00 C ATOM 693 CZ TYR A 42 3.187 9.654 -5.387 1.00 0.00 C ATOM 694 OH TYR A 42 2.353 10.738 -5.545 1.00 0.00 O ATOM 0 H TYR A 42 6.805 8.206 -2.999 1.00 0.00 H new ATOM 0 HA TYR A 42 7.775 5.736 -4.268 1.00 0.00 H new ATOM 0 HB2 TYR A 42 5.909 5.776 -5.854 1.00 0.00 H new ATOM 0 HB3 TYR A 42 5.318 5.559 -4.218 1.00 0.00 H new ATOM 0 HD1 TYR A 42 4.893 8.013 -3.000 1.00 0.00 H new ATOM 0 HD2 TYR A 42 4.633 7.201 -7.174 1.00 0.00 H new ATOM 0 HE1 TYR A 42 3.404 9.945 -3.281 1.00 0.00 H new ATOM 0 HE2 TYR A 42 3.147 9.134 -7.459 1.00 0.00 H new ATOM 0 HH TYR A 42 2.291 10.967 -6.496 1.00 0.00 H new ATOM 704 N TYR A 43 8.286 7.097 -6.447 1.00 0.00 N ATOM 705 CA TYR A 43 8.968 7.915 -7.443 1.00 0.00 C ATOM 706 C TYR A 43 8.462 7.598 -8.847 1.00 0.00 C ATOM 707 O TYR A 43 7.741 6.623 -9.055 1.00 0.00 O ATOM 708 CB TYR A 43 10.479 7.689 -7.370 1.00 0.00 C ATOM 709 CG TYR A 43 10.991 7.462 -5.965 1.00 0.00 C ATOM 710 CD1 TYR A 43 10.637 6.324 -5.252 1.00 0.00 C ATOM 711 CD2 TYR A 43 11.827 8.386 -5.351 1.00 0.00 C ATOM 712 CE1 TYR A 43 11.101 6.112 -3.968 1.00 0.00 C ATOM 713 CE2 TYR A 43 12.297 8.182 -4.069 1.00 0.00 C ATOM 714 CZ TYR A 43 11.931 7.044 -3.381 1.00 0.00 C ATOM 715 OH TYR A 43 12.396 6.838 -2.102 1.00 0.00 O ATOM 0 H TYR A 43 8.166 6.120 -6.714 1.00 0.00 H new ATOM 0 HA TYR A 43 8.753 8.961 -7.227 1.00 0.00 H new ATOM 0 HB2 TYR A 43 10.739 6.828 -7.986 1.00 0.00 H new ATOM 0 HB3 TYR A 43 10.988 8.553 -7.798 1.00 0.00 H new ATOM 0 HD1 TYR A 43 9.988 5.592 -5.709 1.00 0.00 H new ATOM 0 HD2 TYR A 43 12.114 9.279 -5.886 1.00 0.00 H new ATOM 0 HE1 TYR A 43 10.815 5.222 -3.427 1.00 0.00 H new ATOM 0 HE2 TYR A 43 12.948 8.910 -3.607 1.00 0.00 H new ATOM 0 HH TYR A 43 12.969 7.588 -1.838 1.00 0.00 H new ATOM 725 N LYS A 44 8.847 8.430 -9.808 1.00 0.00 N ATOM 726 CA LYS A 44 8.436 8.241 -11.194 1.00 0.00 C ATOM 727 C LYS A 44 9.080 6.991 -11.787 1.00 0.00 C ATOM 728 O LYS A 44 8.388 6.096 -12.271 1.00 0.00 O ATOM 729 CB LYS A 44 8.811 9.466 -12.031 1.00 0.00 C ATOM 730 CG LYS A 44 7.928 10.674 -11.771 1.00 0.00 C ATOM 731 CD LYS A 44 8.247 11.814 -12.724 1.00 0.00 C ATOM 732 CE LYS A 44 9.396 12.666 -12.208 1.00 0.00 C ATOM 733 NZ LYS A 44 8.959 13.590 -11.126 1.00 0.00 N ATOM 0 H LYS A 44 9.444 9.243 -9.652 1.00 0.00 H new ATOM 0 HA LYS A 44 7.354 8.114 -11.211 1.00 0.00 H new ATOM 0 HB2 LYS A 44 9.847 9.733 -11.825 1.00 0.00 H new ATOM 0 HB3 LYS A 44 8.753 9.205 -13.088 1.00 0.00 H new ATOM 0 HG2 LYS A 44 6.881 10.390 -11.879 1.00 0.00 H new ATOM 0 HG3 LYS A 44 8.063 11.010 -10.743 1.00 0.00 H new ATOM 0 HD2 LYS A 44 8.503 11.410 -13.703 1.00 0.00 H new ATOM 0 HD3 LYS A 44 7.362 12.437 -12.858 1.00 0.00 H new ATOM 0 HE2 LYS A 44 10.189 12.018 -11.834 1.00 0.00 H new ATOM 0 HE3 LYS A 44 9.818 13.244 -13.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 9.744 14.223 -10.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 8.152 14.156 -11.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 8.675 13.038 -10.292 1.00 0.00 H new ATOM 747 N SER A 45 10.407 6.938 -11.744 1.00 0.00 N ATOM 748 CA SER A 45 11.144 5.798 -12.279 1.00 0.00 C ATOM 749 C SER A 45 12.133 5.260 -11.250 1.00 0.00 C ATOM 750 O SER A 45 12.743 6.023 -10.501 1.00 0.00 O ATOM 751 CB SER A 45 11.885 6.198 -13.556 1.00 0.00 C ATOM 752 OG SER A 45 12.747 5.160 -13.991 1.00 0.00 O ATOM 0 H SER A 45 10.994 7.670 -11.345 1.00 0.00 H new ATOM 0 HA SER A 45 10.428 5.011 -12.515 1.00 0.00 H new ATOM 0 HB2 SER A 45 11.165 6.430 -14.341 1.00 0.00 H new ATOM 0 HB3 SER A 45 12.463 7.104 -13.376 1.00 0.00 H new ATOM 0 HG SER A 45 13.208 5.439 -14.810 1.00 0.00 H new ATOM 758 N GLN A 46 12.286 3.940 -11.220 1.00 0.00 N ATOM 759 CA GLN A 46 13.201 3.298 -10.283 1.00 0.00 C ATOM 760 C GLN A 46 14.554 4.001 -10.276 1.00 0.00 C ATOM 761 O GLN A 46 15.125 4.259 -9.216 1.00 0.00 O ATOM 762 CB GLN A 46 13.381 1.822 -10.642 1.00 0.00 C ATOM 763 CG GLN A 46 13.968 0.989 -9.515 1.00 0.00 C ATOM 764 CD GLN A 46 14.522 -0.337 -9.997 1.00 0.00 C ATOM 765 OE1 GLN A 46 14.739 -0.535 -11.193 1.00 0.00 O ATOM 766 NE2 GLN A 46 14.754 -1.256 -9.066 1.00 0.00 N ATOM 0 H GLN A 46 11.789 3.294 -11.833 1.00 0.00 H new ATOM 0 HA GLN A 46 12.769 3.371 -9.285 1.00 0.00 H new ATOM 0 HB2 GLN A 46 12.415 1.405 -10.925 1.00 0.00 H new ATOM 0 HB3 GLN A 46 14.029 1.745 -11.515 1.00 0.00 H new ATOM 0 HG2 GLN A 46 14.762 1.554 -9.026 1.00 0.00 H new ATOM 0 HG3 GLN A 46 13.199 0.806 -8.765 1.00 0.00 H new ATOM 0 HE21 GLN A 46 14.560 -1.050 -8.086 1.00 0.00 H new ATOM 0 HE22 GLN A 46 15.126 -2.168 -9.331 1.00 0.00 H new ATOM 775 N ASP A 47 15.063 4.307 -11.464 1.00 0.00 N ATOM 776 CA ASP A 47 16.349 4.980 -11.595 1.00 0.00 C ATOM 777 C ASP A 47 16.398 6.232 -10.725 1.00 0.00 C ATOM 778 O ASP A 47 17.248 6.353 -9.843 1.00 0.00 O ATOM 779 CB ASP A 47 16.610 5.349 -13.057 1.00 0.00 C ATOM 780 CG ASP A 47 18.041 5.788 -13.297 1.00 0.00 C ATOM 781 OD1 ASP A 47 18.945 5.262 -12.615 1.00 0.00 O ATOM 782 OD2 ASP A 47 18.256 6.659 -14.166 1.00 0.00 O ATOM 0 H ASP A 47 14.604 4.099 -12.351 1.00 0.00 H new ATOM 0 HA ASP A 47 17.126 4.294 -11.258 1.00 0.00 H new ATOM 0 HB2 ASP A 47 16.385 4.491 -13.691 1.00 0.00 H new ATOM 0 HB3 ASP A 47 15.933 6.150 -13.353 1.00 0.00 H new ATOM 787 N GLU A 48 15.482 7.161 -10.981 1.00 0.00 N ATOM 788 CA GLU A 48 15.423 8.405 -10.223 1.00 0.00 C ATOM 789 C GLU A 48 15.815 8.172 -8.766 1.00 0.00 C ATOM 790 O GLU A 48 16.751 8.789 -8.259 1.00 0.00 O ATOM 791 CB GLU A 48 14.018 9.006 -10.294 1.00 0.00 C ATOM 792 CG GLU A 48 13.614 9.443 -11.692 1.00 0.00 C ATOM 793 CD GLU A 48 12.560 10.533 -11.680 1.00 0.00 C ATOM 794 OE1 GLU A 48 11.671 10.489 -10.804 1.00 0.00 O ATOM 795 OE2 GLU A 48 12.623 11.430 -12.547 1.00 0.00 O ATOM 0 H GLU A 48 14.771 7.075 -11.707 1.00 0.00 H new ATOM 0 HA GLU A 48 16.132 9.105 -10.666 1.00 0.00 H new ATOM 0 HB2 GLU A 48 13.299 8.272 -9.930 1.00 0.00 H new ATOM 0 HB3 GLU A 48 13.965 9.864 -9.624 1.00 0.00 H new ATOM 0 HG2 GLU A 48 14.495 9.800 -12.226 1.00 0.00 H new ATOM 0 HG3 GLU A 48 13.235 8.582 -12.243 1.00 0.00 H new ATOM 802 N ALA A 49 15.091 7.279 -8.100 1.00 0.00 N ATOM 803 CA ALA A 49 15.363 6.964 -6.703 1.00 0.00 C ATOM 804 C ALA A 49 16.828 6.594 -6.499 1.00 0.00 C ATOM 805 O ALA A 49 17.495 6.080 -7.398 1.00 0.00 O ATOM 806 CB ALA A 49 14.461 5.833 -6.232 1.00 0.00 C ATOM 0 H ALA A 49 14.312 6.761 -8.505 1.00 0.00 H new ATOM 0 HA ALA A 49 15.154 7.853 -6.108 1.00 0.00 H new ATOM 0 HB1 ALA A 49 14.675 5.608 -5.187 1.00 0.00 H new ATOM 0 HB2 ALA A 49 13.418 6.134 -6.332 1.00 0.00 H new ATOM 0 HB3 ALA A 49 14.643 4.946 -6.839 1.00 0.00 H new ATOM 812 N PRO A 50 17.344 6.861 -5.290 1.00 0.00 N ATOM 813 CA PRO A 50 16.561 7.473 -4.213 1.00 0.00 C ATOM 814 C PRO A 50 16.223 8.932 -4.499 1.00 0.00 C ATOM 815 O PRO A 50 15.076 9.354 -4.355 1.00 0.00 O ATOM 816 CB PRO A 50 17.486 7.367 -2.998 1.00 0.00 C ATOM 817 CG PRO A 50 18.860 7.312 -3.571 1.00 0.00 C ATOM 818 CD PRO A 50 18.732 6.586 -4.882 1.00 0.00 C ATOM 0 HA PRO A 50 15.599 6.980 -4.078 1.00 0.00 H new ATOM 0 HB2 PRO A 50 17.368 8.224 -2.335 1.00 0.00 H new ATOM 0 HB3 PRO A 50 17.266 6.476 -2.410 1.00 0.00 H new ATOM 0 HG2 PRO A 50 19.262 8.314 -3.717 1.00 0.00 H new ATOM 0 HG3 PRO A 50 19.542 6.790 -2.900 1.00 0.00 H new ATOM 0 HD2 PRO A 50 19.447 6.955 -5.617 1.00 0.00 H new ATOM 0 HD3 PRO A 50 18.913 5.517 -4.769 1.00 0.00 H new ATOM 826 N GLY A 51 17.229 9.700 -4.907 1.00 0.00 N ATOM 827 CA GLY A 51 17.017 11.103 -5.208 1.00 0.00 C ATOM 828 C GLY A 51 15.976 11.738 -4.308 1.00 0.00 C ATOM 829 O GLY A 51 16.253 12.047 -3.149 1.00 0.00 O ATOM 0 H GLY A 51 18.187 9.375 -5.034 1.00 0.00 H new ATOM 0 HA2 GLY A 51 17.960 11.640 -5.103 1.00 0.00 H new ATOM 0 HA3 GLY A 51 16.705 11.205 -6.247 1.00 0.00 H new ATOM 833 N ASP A 52 14.776 11.935 -4.842 1.00 0.00 N ATOM 834 CA ASP A 52 13.689 12.538 -4.079 1.00 0.00 C ATOM 835 C ASP A 52 12.343 11.955 -4.496 1.00 0.00 C ATOM 836 O ASP A 52 11.978 11.950 -5.672 1.00 0.00 O ATOM 837 CB ASP A 52 13.683 14.056 -4.271 1.00 0.00 C ATOM 838 CG ASP A 52 14.869 14.728 -3.608 1.00 0.00 C ATOM 839 OD1 ASP A 52 14.768 15.063 -2.409 1.00 0.00 O ATOM 840 OD2 ASP A 52 15.899 14.919 -4.289 1.00 0.00 O ATOM 0 H ASP A 52 14.531 11.686 -5.800 1.00 0.00 H new ATOM 0 HA ASP A 52 13.851 12.313 -3.025 1.00 0.00 H new ATOM 0 HB2 ASP A 52 13.689 14.285 -5.337 1.00 0.00 H new ATOM 0 HB3 ASP A 52 12.760 14.467 -3.862 1.00 0.00 H new ATOM 845 N PRO A 53 11.586 11.449 -3.511 1.00 0.00 N ATOM 846 CA PRO A 53 10.268 10.853 -3.751 1.00 0.00 C ATOM 847 C PRO A 53 9.226 11.892 -4.152 1.00 0.00 C ATOM 848 O PRO A 53 9.067 12.914 -3.484 1.00 0.00 O ATOM 849 CB PRO A 53 9.909 10.229 -2.400 1.00 0.00 C ATOM 850 CG PRO A 53 10.680 11.020 -1.401 1.00 0.00 C ATOM 851 CD PRO A 53 11.957 11.421 -2.086 1.00 0.00 C ATOM 0 HA PRO A 53 10.288 10.138 -4.574 1.00 0.00 H new ATOM 0 HB2 PRO A 53 8.837 10.287 -2.209 1.00 0.00 H new ATOM 0 HB3 PRO A 53 10.182 9.174 -2.366 1.00 0.00 H new ATOM 0 HG2 PRO A 53 10.118 11.897 -1.080 1.00 0.00 H new ATOM 0 HG3 PRO A 53 10.885 10.428 -0.509 1.00 0.00 H new ATOM 0 HD2 PRO A 53 12.308 12.394 -1.743 1.00 0.00 H new ATOM 0 HD3 PRO A 53 12.758 10.707 -1.893 1.00 0.00 H new ATOM 859 N ILE A 54 8.520 11.624 -5.245 1.00 0.00 N ATOM 860 CA ILE A 54 7.493 12.535 -5.732 1.00 0.00 C ATOM 861 C ILE A 54 6.743 13.189 -4.576 1.00 0.00 C ATOM 862 O ILE A 54 6.436 14.379 -4.617 1.00 0.00 O ATOM 863 CB ILE A 54 6.481 11.810 -6.640 1.00 0.00 C ATOM 864 CG1 ILE A 54 7.164 11.336 -7.925 1.00 0.00 C ATOM 865 CG2 ILE A 54 5.309 12.724 -6.963 1.00 0.00 C ATOM 866 CD1 ILE A 54 6.428 10.213 -8.621 1.00 0.00 C ATOM 0 H ILE A 54 8.641 10.783 -5.810 1.00 0.00 H new ATOM 0 HA ILE A 54 8.004 13.304 -6.312 1.00 0.00 H new ATOM 0 HB ILE A 54 6.100 10.937 -6.110 1.00 0.00 H new ATOM 0 HG12 ILE A 54 7.256 12.179 -8.610 1.00 0.00 H new ATOM 0 HG13 ILE A 54 8.175 11.005 -7.689 1.00 0.00 H new ATOM 0 HG21 ILE A 54 4.603 12.197 -7.605 1.00 0.00 H new ATOM 0 HG22 ILE A 54 4.810 13.017 -6.039 1.00 0.00 H new ATOM 0 HG23 ILE A 54 5.672 13.614 -7.477 1.00 0.00 H new ATOM 0 HD11 ILE A 54 6.969 9.928 -9.523 1.00 0.00 H new ATOM 0 HD12 ILE A 54 6.359 9.354 -7.953 1.00 0.00 H new ATOM 0 HD13 ILE A 54 5.425 10.546 -8.889 1.00 0.00 H new ATOM 878 N GLN A 55 6.454 12.401 -3.545 1.00 0.00 N ATOM 879 CA GLN A 55 5.742 12.904 -2.376 1.00 0.00 C ATOM 880 C GLN A 55 5.797 11.898 -1.231 1.00 0.00 C ATOM 881 O GLN A 55 5.612 10.699 -1.437 1.00 0.00 O ATOM 882 CB GLN A 55 4.286 13.210 -2.733 1.00 0.00 C ATOM 883 CG GLN A 55 3.682 14.335 -1.908 1.00 0.00 C ATOM 884 CD GLN A 55 2.168 14.267 -1.850 1.00 0.00 C ATOM 885 OE1 GLN A 55 1.519 13.809 -2.790 1.00 0.00 O ATOM 886 NE2 GLN A 55 1.597 14.724 -0.741 1.00 0.00 N ATOM 0 H GLN A 55 6.702 11.413 -3.496 1.00 0.00 H new ATOM 0 HA GLN A 55 6.230 13.823 -2.051 1.00 0.00 H new ATOM 0 HB2 GLN A 55 4.227 13.473 -3.789 1.00 0.00 H new ATOM 0 HB3 GLN A 55 3.689 12.308 -2.595 1.00 0.00 H new ATOM 0 HG2 GLN A 55 4.083 14.294 -0.895 1.00 0.00 H new ATOM 0 HG3 GLN A 55 3.983 15.293 -2.331 1.00 0.00 H new ATOM 0 HE21 GLN A 55 2.174 15.095 0.014 1.00 0.00 H new ATOM 0 HE22 GLN A 55 0.582 14.704 -0.644 1.00 0.00 H new ATOM 895 N GLN A 56 6.052 12.395 -0.025 1.00 0.00 N ATOM 896 CA GLN A 56 6.132 11.539 1.152 1.00 0.00 C ATOM 897 C GLN A 56 4.969 11.809 2.102 1.00 0.00 C ATOM 898 O GLN A 56 4.541 12.952 2.266 1.00 0.00 O ATOM 899 CB GLN A 56 7.460 11.757 1.878 1.00 0.00 C ATOM 900 CG GLN A 56 7.533 13.076 2.631 1.00 0.00 C ATOM 901 CD GLN A 56 8.892 13.316 3.259 1.00 0.00 C ATOM 902 OE1 GLN A 56 9.466 12.423 3.883 1.00 0.00 O ATOM 903 NE2 GLN A 56 9.414 14.526 3.097 1.00 0.00 N ATOM 0 H GLN A 56 6.207 13.386 0.162 1.00 0.00 H new ATOM 0 HA GLN A 56 6.073 10.502 0.821 1.00 0.00 H new ATOM 0 HB2 GLN A 56 7.619 10.938 2.580 1.00 0.00 H new ATOM 0 HB3 GLN A 56 8.272 11.717 1.152 1.00 0.00 H new ATOM 0 HG2 GLN A 56 7.304 13.893 1.947 1.00 0.00 H new ATOM 0 HG3 GLN A 56 6.770 13.088 3.409 1.00 0.00 H new ATOM 0 HE21 GLN A 56 8.903 15.236 2.572 1.00 0.00 H new ATOM 0 HE22 GLN A 56 10.326 14.746 3.497 1.00 0.00 H new ATOM 912 N LEU A 57 4.462 10.750 2.724 1.00 0.00 N ATOM 913 CA LEU A 57 3.348 10.873 3.658 1.00 0.00 C ATOM 914 C LEU A 57 3.558 9.979 4.876 1.00 0.00 C ATOM 915 O LEU A 57 3.935 8.815 4.746 1.00 0.00 O ATOM 916 CB LEU A 57 2.034 10.510 2.964 1.00 0.00 C ATOM 917 CG LEU A 57 1.899 10.954 1.507 1.00 0.00 C ATOM 918 CD1 LEU A 57 2.620 9.984 0.585 1.00 0.00 C ATOM 919 CD2 LEU A 57 0.432 11.071 1.120 1.00 0.00 C ATOM 0 H LEU A 57 4.804 9.797 2.599 1.00 0.00 H new ATOM 0 HA LEU A 57 3.300 11.908 3.995 1.00 0.00 H new ATOM 0 HB2 LEU A 57 1.911 9.428 3.006 1.00 0.00 H new ATOM 0 HB3 LEU A 57 1.213 10.946 3.533 1.00 0.00 H new ATOM 0 HG LEU A 57 2.362 11.935 1.401 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.513 10.316 -0.448 1.00 0.00 H new ATOM 0 HD12 LEU A 57 3.677 9.950 0.848 1.00 0.00 H new ATOM 0 HD13 LEU A 57 2.187 8.989 0.693 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.354 11.388 0.080 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.055 10.103 1.242 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -0.056 11.806 1.761 1.00 0.00 H new ATOM 931 N ASN A 58 3.308 10.531 6.059 1.00 0.00 N ATOM 932 CA ASN A 58 3.467 9.782 7.300 1.00 0.00 C ATOM 933 C ASN A 58 2.214 8.969 7.610 1.00 0.00 C ATOM 934 O ASN A 58 1.258 9.480 8.195 1.00 0.00 O ATOM 935 CB ASN A 58 3.770 10.735 8.459 1.00 0.00 C ATOM 936 CG ASN A 58 3.799 10.025 9.798 1.00 0.00 C ATOM 937 OD1 ASN A 58 3.837 8.796 9.861 1.00 0.00 O ATOM 938 ND2 ASN A 58 3.781 10.798 10.878 1.00 0.00 N ATOM 0 H ASN A 58 2.995 11.494 6.184 1.00 0.00 H new ATOM 0 HA ASN A 58 4.303 9.094 7.175 1.00 0.00 H new ATOM 0 HB2 ASN A 58 4.731 11.219 8.286 1.00 0.00 H new ATOM 0 HB3 ASN A 58 3.017 11.523 8.485 1.00 0.00 H new ATOM 0 HD21 ASN A 58 3.799 10.377 11.807 1.00 0.00 H new ATOM 0 HD22 ASN A 58 3.749 11.813 10.778 1.00 0.00 H new ATOM 945 N LEU A 59 2.226 7.701 7.215 1.00 0.00 N ATOM 946 CA LEU A 59 1.091 6.816 7.451 1.00 0.00 C ATOM 947 C LEU A 59 0.463 7.087 8.814 1.00 0.00 C ATOM 948 O LEU A 59 -0.758 7.176 8.941 1.00 0.00 O ATOM 949 CB LEU A 59 1.532 5.354 7.361 1.00 0.00 C ATOM 950 CG LEU A 59 1.775 4.811 5.953 1.00 0.00 C ATOM 951 CD1 LEU A 59 2.694 3.600 5.998 1.00 0.00 C ATOM 952 CD2 LEU A 59 0.455 4.456 5.283 1.00 0.00 C ATOM 0 H LEU A 59 3.009 7.263 6.730 1.00 0.00 H new ATOM 0 HA LEU A 59 0.343 7.012 6.682 1.00 0.00 H new ATOM 0 HB2 LEU A 59 2.450 5.236 7.937 1.00 0.00 H new ATOM 0 HB3 LEU A 59 0.773 4.736 7.841 1.00 0.00 H new ATOM 0 HG LEU A 59 2.262 5.589 5.364 1.00 0.00 H new ATOM 0 HD11 LEU A 59 2.855 3.228 4.986 1.00 0.00 H new ATOM 0 HD12 LEU A 59 3.650 3.885 6.436 1.00 0.00 H new ATOM 0 HD13 LEU A 59 2.236 2.818 6.604 1.00 0.00 H new ATOM 0 HD21 LEU A 59 0.647 4.071 4.282 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -0.059 3.696 5.871 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -0.170 5.347 5.216 1.00 0.00 H new ATOM 964 N LYS A 60 1.306 7.218 9.833 1.00 0.00 N ATOM 965 CA LYS A 60 0.836 7.483 11.187 1.00 0.00 C ATOM 966 C LYS A 60 -0.103 8.685 11.212 1.00 0.00 C ATOM 967 O LYS A 60 0.318 9.819 10.985 1.00 0.00 O ATOM 968 CB LYS A 60 2.022 7.730 12.122 1.00 0.00 C ATOM 969 CG LYS A 60 1.734 7.386 13.573 1.00 0.00 C ATOM 970 CD LYS A 60 3.006 7.032 14.325 1.00 0.00 C ATOM 971 CE LYS A 60 3.658 8.267 14.930 1.00 0.00 C ATOM 972 NZ LYS A 60 5.133 8.109 15.057 1.00 0.00 N ATOM 0 H LYS A 60 2.320 7.145 9.746 1.00 0.00 H new ATOM 0 HA LYS A 60 0.286 6.607 11.531 1.00 0.00 H new ATOM 0 HB2 LYS A 60 2.873 7.141 11.780 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.313 8.778 12.057 1.00 0.00 H new ATOM 0 HG2 LYS A 60 1.247 8.231 14.058 1.00 0.00 H new ATOM 0 HG3 LYS A 60 1.038 6.548 13.618 1.00 0.00 H new ATOM 0 HD2 LYS A 60 2.776 6.317 15.115 1.00 0.00 H new ATOM 0 HD3 LYS A 60 3.707 6.544 13.647 1.00 0.00 H new ATOM 0 HE2 LYS A 60 3.438 9.135 14.309 1.00 0.00 H new ATOM 0 HE3 LYS A 60 3.227 8.461 15.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 5.540 8.971 15.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 5.344 7.296 15.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 5.547 7.950 14.117 1.00 0.00 H new ATOM 986 N GLY A 61 -1.378 8.429 11.490 1.00 0.00 N ATOM 987 CA GLY A 61 -2.356 9.500 11.540 1.00 0.00 C ATOM 988 C GLY A 61 -3.370 9.413 10.417 1.00 0.00 C ATOM 989 O GLY A 61 -4.514 9.842 10.570 1.00 0.00 O ATOM 0 H GLY A 61 -1.751 7.499 11.681 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -2.876 9.469 12.498 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -1.842 10.460 11.488 1.00 0.00 H new ATOM 993 N CYS A 62 -2.950 8.858 9.285 1.00 0.00 N ATOM 994 CA CYS A 62 -3.830 8.718 8.130 1.00 0.00 C ATOM 995 C CYS A 62 -4.943 7.714 8.413 1.00 0.00 C ATOM 996 O CYS A 62 -5.052 7.190 9.521 1.00 0.00 O ATOM 997 CB CYS A 62 -3.030 8.279 6.903 1.00 0.00 C ATOM 998 SG CYS A 62 -1.356 8.961 6.832 1.00 0.00 S ATOM 0 H CYS A 62 -2.006 8.498 9.143 1.00 0.00 H new ATOM 0 HA CYS A 62 -4.284 9.689 7.930 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -2.968 7.191 6.893 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -3.571 8.576 6.004 1.00 0.00 H new ATOM 0 HG CYS A 62 -0.755 8.755 7.966 1.00 0.00 H new ATOM 1004 N GLU A 63 -5.767 7.452 7.403 1.00 0.00 N ATOM 1005 CA GLU A 63 -6.873 6.512 7.544 1.00 0.00 C ATOM 1006 C GLU A 63 -6.732 5.354 6.561 1.00 0.00 C ATOM 1007 O GLU A 63 -6.029 5.461 5.556 1.00 0.00 O ATOM 1008 CB GLU A 63 -8.208 7.225 7.322 1.00 0.00 C ATOM 1009 CG GLU A 63 -9.371 6.584 8.061 1.00 0.00 C ATOM 1010 CD GLU A 63 -9.280 6.769 9.564 1.00 0.00 C ATOM 1011 OE1 GLU A 63 -8.724 7.797 10.003 1.00 0.00 O ATOM 1012 OE2 GLU A 63 -9.767 5.885 10.300 1.00 0.00 O ATOM 0 H GLU A 63 -5.690 7.877 6.479 1.00 0.00 H new ATOM 0 HA GLU A 63 -6.848 6.110 8.557 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -8.113 8.263 7.641 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -8.430 7.239 6.255 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -10.306 7.014 7.702 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -9.400 5.519 7.831 1.00 0.00 H new ATOM 1019 N VAL A 64 -7.406 4.248 6.858 1.00 0.00 N ATOM 1020 CA VAL A 64 -7.357 3.069 6.001 1.00 0.00 C ATOM 1021 C VAL A 64 -8.755 2.521 5.741 1.00 0.00 C ATOM 1022 O VAL A 64 -9.540 2.326 6.669 1.00 0.00 O ATOM 1023 CB VAL A 64 -6.489 1.959 6.622 1.00 0.00 C ATOM 1024 CG1 VAL A 64 -6.568 0.690 5.787 1.00 0.00 C ATOM 1025 CG2 VAL A 64 -5.048 2.426 6.762 1.00 0.00 C ATOM 0 H VAL A 64 -7.993 4.143 7.686 1.00 0.00 H new ATOM 0 HA VAL A 64 -6.911 3.382 5.057 1.00 0.00 H new ATOM 0 HB VAL A 64 -6.873 1.735 7.617 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -5.948 -0.083 6.241 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -7.602 0.347 5.743 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -6.210 0.896 4.778 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -4.449 1.629 7.203 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -4.650 2.678 5.779 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -5.011 3.305 7.405 1.00 0.00 H new ATOM 1035 N VAL A 65 -9.061 2.272 4.471 1.00 0.00 N ATOM 1036 CA VAL A 65 -10.365 1.743 4.088 1.00 0.00 C ATOM 1037 C VAL A 65 -10.221 0.566 3.131 1.00 0.00 C ATOM 1038 O VAL A 65 -10.009 0.733 1.929 1.00 0.00 O ATOM 1039 CB VAL A 65 -11.236 2.826 3.425 1.00 0.00 C ATOM 1040 CG1 VAL A 65 -12.601 2.263 3.059 1.00 0.00 C ATOM 1041 CG2 VAL A 65 -11.377 4.032 4.342 1.00 0.00 C ATOM 0 H VAL A 65 -8.424 2.428 3.690 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.851 1.405 5.003 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.745 3.151 2.508 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -13.203 3.043 2.592 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -12.478 1.433 2.363 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -13.102 1.909 3.960 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -11.996 4.787 3.857 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -11.845 3.725 5.277 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -10.391 4.449 4.549 1.00 0.00 H new ATOM 1051 N PRO A 66 -10.338 -0.655 3.673 1.00 0.00 N ATOM 1052 CA PRO A 66 -10.226 -1.886 2.884 1.00 0.00 C ATOM 1053 C PRO A 66 -11.410 -2.082 1.944 1.00 0.00 C ATOM 1054 O PRO A 66 -12.566 -1.995 2.359 1.00 0.00 O ATOM 1055 CB PRO A 66 -10.198 -2.987 3.947 1.00 0.00 C ATOM 1056 CG PRO A 66 -10.904 -2.399 5.120 1.00 0.00 C ATOM 1057 CD PRO A 66 -10.591 -0.929 5.097 1.00 0.00 C ATOM 0 HA PRO A 66 -9.349 -1.877 2.237 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -10.698 -3.889 3.596 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -9.175 -3.267 4.200 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -11.978 -2.570 5.055 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -10.564 -2.856 6.049 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -11.422 -0.336 5.479 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -9.722 -0.694 5.712 1.00 0.00 H new ATOM 1065 N ASP A 67 -11.115 -2.348 0.676 1.00 0.00 N ATOM 1066 CA ASP A 67 -12.156 -2.558 -0.323 1.00 0.00 C ATOM 1067 C ASP A 67 -11.920 -3.856 -1.090 1.00 0.00 C ATOM 1068 O ASP A 67 -12.230 -3.953 -2.277 1.00 0.00 O ATOM 1069 CB ASP A 67 -12.206 -1.378 -1.295 1.00 0.00 C ATOM 1070 CG ASP A 67 -13.149 -0.286 -0.832 1.00 0.00 C ATOM 1071 OD1 ASP A 67 -12.702 0.604 -0.079 1.00 0.00 O ATOM 1072 OD2 ASP A 67 -14.335 -0.321 -1.222 1.00 0.00 O ATOM 0 H ASP A 67 -10.164 -2.423 0.316 1.00 0.00 H new ATOM 0 HA ASP A 67 -13.112 -2.632 0.195 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -11.204 -0.964 -1.411 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -12.520 -1.733 -2.277 1.00 0.00 H new ATOM 1077 N VAL A 68 -11.367 -4.850 -0.403 1.00 0.00 N ATOM 1078 CA VAL A 68 -11.088 -6.142 -1.019 1.00 0.00 C ATOM 1079 C VAL A 68 -12.320 -7.040 -0.994 1.00 0.00 C ATOM 1080 O VAL A 68 -12.908 -7.275 0.060 1.00 0.00 O ATOM 1081 CB VAL A 68 -9.926 -6.863 -0.310 1.00 0.00 C ATOM 1082 CG1 VAL A 68 -10.042 -6.706 1.199 1.00 0.00 C ATOM 1083 CG2 VAL A 68 -9.895 -8.333 -0.699 1.00 0.00 C ATOM 0 H VAL A 68 -11.103 -4.786 0.580 1.00 0.00 H new ATOM 0 HA VAL A 68 -10.806 -5.945 -2.053 1.00 0.00 H new ATOM 0 HB VAL A 68 -8.989 -6.406 -0.629 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -9.213 -7.222 1.683 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -10.012 -5.648 1.458 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -10.984 -7.136 1.538 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -9.068 -8.827 -0.189 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -10.834 -8.806 -0.410 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -9.761 -8.421 -1.777 1.00 0.00 H new ATOM 1093 N ASN A 69 -12.704 -7.540 -2.165 1.00 0.00 N ATOM 1094 CA ASN A 69 -13.867 -8.413 -2.278 1.00 0.00 C ATOM 1095 C ASN A 69 -13.463 -9.795 -2.779 1.00 0.00 C ATOM 1096 O ASN A 69 -13.623 -10.112 -3.958 1.00 0.00 O ATOM 1097 CB ASN A 69 -14.902 -7.798 -3.222 1.00 0.00 C ATOM 1098 CG ASN A 69 -15.684 -6.674 -2.571 1.00 0.00 C ATOM 1099 OD1 ASN A 69 -15.176 -5.978 -1.692 1.00 0.00 O ATOM 1100 ND2 ASN A 69 -16.927 -6.492 -3.000 1.00 0.00 N ATOM 0 H ASN A 69 -12.227 -7.356 -3.048 1.00 0.00 H new ATOM 0 HA ASN A 69 -14.308 -8.520 -1.287 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -14.398 -7.419 -4.111 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -15.593 -8.573 -3.553 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -17.502 -5.751 -2.599 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -17.307 -7.093 -3.731 1.00 0.00 H new ATOM 1107 N VAL A 70 -12.938 -10.616 -1.875 1.00 0.00 N ATOM 1108 CA VAL A 70 -12.511 -11.966 -2.224 1.00 0.00 C ATOM 1109 C VAL A 70 -13.502 -12.626 -3.176 1.00 0.00 C ATOM 1110 O VAL A 70 -13.141 -13.519 -3.943 1.00 0.00 O ATOM 1111 CB VAL A 70 -12.356 -12.848 -0.970 1.00 0.00 C ATOM 1112 CG1 VAL A 70 -12.074 -14.290 -1.363 1.00 0.00 C ATOM 1113 CG2 VAL A 70 -11.255 -12.306 -0.072 1.00 0.00 C ATOM 0 H VAL A 70 -12.798 -10.370 -0.895 1.00 0.00 H new ATOM 0 HA VAL A 70 -11.543 -11.875 -2.717 1.00 0.00 H new ATOM 0 HB VAL A 70 -13.292 -12.826 -0.412 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -11.968 -14.898 -0.464 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -12.900 -14.672 -1.964 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -11.152 -14.335 -1.943 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -11.159 -12.941 0.809 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -10.312 -12.297 -0.618 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -11.504 -11.291 0.237 1.00 0.00 H new ATOM 1123 N SER A 71 -14.753 -12.181 -3.122 1.00 0.00 N ATOM 1124 CA SER A 71 -15.798 -12.730 -3.978 1.00 0.00 C ATOM 1125 C SER A 71 -15.378 -12.687 -5.444 1.00 0.00 C ATOM 1126 O SER A 71 -15.542 -13.662 -6.177 1.00 0.00 O ATOM 1127 CB SER A 71 -17.104 -11.956 -3.787 1.00 0.00 C ATOM 1128 OG SER A 71 -18.221 -12.734 -4.180 1.00 0.00 O ATOM 0 H SER A 71 -15.068 -11.441 -2.494 1.00 0.00 H new ATOM 0 HA SER A 71 -15.956 -13.770 -3.693 1.00 0.00 H new ATOM 0 HB2 SER A 71 -17.209 -11.666 -2.741 1.00 0.00 H new ATOM 0 HB3 SER A 71 -17.074 -11.036 -4.371 1.00 0.00 H new ATOM 0 HG SER A 71 -19.043 -12.217 -4.046 1.00 0.00 H new ATOM 1134 N GLY A 72 -14.835 -11.549 -5.865 1.00 0.00 N ATOM 1135 CA GLY A 72 -14.400 -11.399 -7.241 1.00 0.00 C ATOM 1136 C GLY A 72 -12.890 -11.412 -7.376 1.00 0.00 C ATOM 1137 O GLY A 72 -12.343 -10.887 -8.345 1.00 0.00 O ATOM 0 H GLY A 72 -14.689 -10.728 -5.277 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -14.822 -12.204 -7.842 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -14.790 -10.463 -7.642 1.00 0.00 H new ATOM 1141 N GLN A 73 -12.215 -12.012 -6.401 1.00 0.00 N ATOM 1142 CA GLN A 73 -10.759 -12.090 -6.415 1.00 0.00 C ATOM 1143 C GLN A 73 -10.144 -10.719 -6.677 1.00 0.00 C ATOM 1144 O GLN A 73 -9.249 -10.577 -7.510 1.00 0.00 O ATOM 1145 CB GLN A 73 -10.290 -13.084 -7.478 1.00 0.00 C ATOM 1146 CG GLN A 73 -10.809 -14.496 -7.262 1.00 0.00 C ATOM 1147 CD GLN A 73 -10.124 -15.198 -6.106 1.00 0.00 C ATOM 1148 OE1 GLN A 73 -8.901 -15.340 -6.087 1.00 0.00 O ATOM 1149 NE2 GLN A 73 -10.911 -15.643 -5.133 1.00 0.00 N ATOM 0 H GLN A 73 -12.653 -12.451 -5.591 1.00 0.00 H new ATOM 0 HA GLN A 73 -10.429 -12.435 -5.435 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -10.612 -12.733 -8.459 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -9.200 -13.104 -7.489 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -11.882 -14.460 -7.076 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -10.663 -15.076 -8.173 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -11.920 -15.504 -5.189 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -10.506 -16.124 -4.330 1.00 0.00 H new ATOM 1158 N LYS A 74 -10.630 -9.711 -5.960 1.00 0.00 N ATOM 1159 CA LYS A 74 -10.128 -8.351 -6.113 1.00 0.00 C ATOM 1160 C LYS A 74 -9.684 -7.780 -4.770 1.00 0.00 C ATOM 1161 O LYS A 74 -10.486 -7.644 -3.846 1.00 0.00 O ATOM 1162 CB LYS A 74 -11.205 -7.454 -6.729 1.00 0.00 C ATOM 1163 CG LYS A 74 -10.839 -5.980 -6.734 1.00 0.00 C ATOM 1164 CD LYS A 74 -12.075 -5.099 -6.669 1.00 0.00 C ATOM 1165 CE LYS A 74 -12.900 -5.200 -7.943 1.00 0.00 C ATOM 1166 NZ LYS A 74 -14.232 -4.551 -7.795 1.00 0.00 N ATOM 0 H LYS A 74 -11.372 -9.811 -5.267 1.00 0.00 H new ATOM 0 HA LYS A 74 -9.265 -8.382 -6.778 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -11.393 -7.777 -7.753 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -12.136 -7.587 -6.177 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -10.191 -5.762 -5.885 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -10.272 -5.748 -7.636 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -12.686 -5.390 -5.815 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -11.776 -4.063 -6.509 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -12.358 -4.732 -8.765 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -13.035 -6.249 -8.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -14.763 -4.642 -8.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -14.760 -5.014 -7.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -14.104 -3.544 -7.569 1.00 0.00 H new ATOM 1180 N PHE A 75 -8.401 -7.446 -4.669 1.00 0.00 N ATOM 1181 CA PHE A 75 -7.851 -6.890 -3.439 1.00 0.00 C ATOM 1182 C PHE A 75 -7.303 -5.485 -3.675 1.00 0.00 C ATOM 1183 O PHE A 75 -6.419 -5.285 -4.509 1.00 0.00 O ATOM 1184 CB PHE A 75 -6.745 -7.796 -2.894 1.00 0.00 C ATOM 1185 CG PHE A 75 -7.084 -9.258 -2.954 1.00 0.00 C ATOM 1186 CD1 PHE A 75 -7.241 -9.897 -4.174 1.00 0.00 C ATOM 1187 CD2 PHE A 75 -7.246 -9.994 -1.791 1.00 0.00 C ATOM 1188 CE1 PHE A 75 -7.554 -11.242 -4.232 1.00 0.00 C ATOM 1189 CE2 PHE A 75 -7.558 -11.340 -1.843 1.00 0.00 C ATOM 1190 CZ PHE A 75 -7.712 -11.964 -3.065 1.00 0.00 C ATOM 0 H PHE A 75 -7.724 -7.551 -5.424 1.00 0.00 H new ATOM 0 HA PHE A 75 -8.655 -6.829 -2.706 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -5.830 -7.620 -3.460 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -6.538 -7.521 -1.860 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -7.117 -9.338 -5.090 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -7.127 -9.510 -0.833 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -7.675 -11.728 -5.189 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -7.681 -11.902 -0.929 1.00 0.00 H new ATOM 0 HZ PHE A 75 -7.956 -13.015 -3.108 1.00 0.00 H new ATOM 1200 N CYS A 76 -7.833 -4.518 -2.936 1.00 0.00 N ATOM 1201 CA CYS A 76 -7.399 -3.131 -3.065 1.00 0.00 C ATOM 1202 C CYS A 76 -7.254 -2.478 -1.694 1.00 0.00 C ATOM 1203 O CYS A 76 -7.868 -2.912 -0.720 1.00 0.00 O ATOM 1204 CB CYS A 76 -8.393 -2.341 -3.917 1.00 0.00 C ATOM 1205 SG CYS A 76 -8.336 -2.743 -5.679 1.00 0.00 S ATOM 0 H CYS A 76 -8.564 -4.668 -2.241 1.00 0.00 H new ATOM 0 HA CYS A 76 -6.426 -3.124 -3.556 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -9.401 -2.526 -3.545 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -8.197 -1.276 -3.792 1.00 0.00 H new ATOM 0 HG CYS A 76 -9.214 -2.026 -6.316 1.00 0.00 H new ATOM 1211 N ILE A 77 -6.436 -1.432 -1.627 1.00 0.00 N ATOM 1212 CA ILE A 77 -6.209 -0.719 -0.376 1.00 0.00 C ATOM 1213 C ILE A 77 -6.419 0.781 -0.553 1.00 0.00 C ATOM 1214 O ILE A 77 -5.567 1.477 -1.106 1.00 0.00 O ATOM 1215 CB ILE A 77 -4.789 -0.968 0.164 1.00 0.00 C ATOM 1216 CG1 ILE A 77 -4.529 -2.469 0.305 1.00 0.00 C ATOM 1217 CG2 ILE A 77 -4.600 -0.264 1.500 1.00 0.00 C ATOM 1218 CD1 ILE A 77 -3.092 -2.804 0.638 1.00 0.00 C ATOM 0 H ILE A 77 -5.920 -1.060 -2.424 1.00 0.00 H new ATOM 0 HA ILE A 77 -6.934 -1.102 0.342 1.00 0.00 H new ATOM 0 HB ILE A 77 -4.069 -0.559 -0.545 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -5.177 -2.870 1.084 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.803 -2.966 -0.625 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -3.591 -0.449 1.869 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -4.748 0.808 1.370 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -5.325 -0.646 2.218 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -2.981 -3.885 0.723 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -2.439 -2.433 -0.152 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -2.819 -2.336 1.584 1.00 0.00 H new ATOM 1230 N LYS A 78 -7.558 1.274 -0.078 1.00 0.00 N ATOM 1231 CA LYS A 78 -7.880 2.692 -0.179 1.00 0.00 C ATOM 1232 C LYS A 78 -7.253 3.476 0.969 1.00 0.00 C ATOM 1233 O LYS A 78 -7.740 3.437 2.100 1.00 0.00 O ATOM 1234 CB LYS A 78 -9.397 2.893 -0.180 1.00 0.00 C ATOM 1235 CG LYS A 78 -9.827 4.277 -0.633 1.00 0.00 C ATOM 1236 CD LYS A 78 -9.881 5.253 0.531 1.00 0.00 C ATOM 1237 CE LYS A 78 -10.928 6.333 0.304 1.00 0.00 C ATOM 1238 NZ LYS A 78 -12.268 5.921 0.806 1.00 0.00 N ATOM 0 H LYS A 78 -8.274 0.711 0.381 1.00 0.00 H new ATOM 0 HA LYS A 78 -7.470 3.066 -1.117 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -9.853 2.148 -0.832 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -9.779 2.714 0.825 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -9.132 4.646 -1.387 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -10.808 4.218 -1.105 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -10.107 4.713 1.450 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -8.903 5.715 0.665 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -10.619 7.250 0.806 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -10.993 6.558 -0.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -12.953 6.684 0.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -12.575 5.060 0.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -12.213 5.731 1.827 1.00 0.00 H new ATOM 1252 N LEU A 79 -6.171 4.187 0.673 1.00 0.00 N ATOM 1253 CA LEU A 79 -5.478 4.982 1.681 1.00 0.00 C ATOM 1254 C LEU A 79 -5.963 6.428 1.662 1.00 0.00 C ATOM 1255 O LEU A 79 -6.181 7.007 0.596 1.00 0.00 O ATOM 1256 CB LEU A 79 -3.967 4.935 1.446 1.00 0.00 C ATOM 1257 CG LEU A 79 -3.089 5.139 2.681 1.00 0.00 C ATOM 1258 CD1 LEU A 79 -3.251 3.977 3.648 1.00 0.00 C ATOM 1259 CD2 LEU A 79 -1.631 5.300 2.277 1.00 0.00 C ATOM 0 H LEU A 79 -5.754 4.229 -0.257 1.00 0.00 H new ATOM 0 HA LEU A 79 -5.700 4.557 2.660 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.718 3.971 1.003 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.710 5.699 0.712 1.00 0.00 H new ATOM 0 HG LEU A 79 -3.409 6.051 3.185 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -2.619 4.139 4.521 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -4.292 3.908 3.962 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.958 3.050 3.155 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.020 5.444 3.168 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.299 4.406 1.750 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -1.528 6.166 1.623 1.00 0.00 H new ATOM 1271 N LEU A 80 -6.127 7.007 2.846 1.00 0.00 N ATOM 1272 CA LEU A 80 -6.583 8.388 2.966 1.00 0.00 C ATOM 1273 C LEU A 80 -5.658 9.191 3.874 1.00 0.00 C ATOM 1274 O LEU A 80 -5.730 9.087 5.099 1.00 0.00 O ATOM 1275 CB LEU A 80 -8.012 8.428 3.511 1.00 0.00 C ATOM 1276 CG LEU A 80 -9.124 8.151 2.499 1.00 0.00 C ATOM 1277 CD1 LEU A 80 -10.458 7.972 3.207 1.00 0.00 C ATOM 1278 CD2 LEU A 80 -9.208 9.276 1.477 1.00 0.00 C ATOM 0 H LEU A 80 -5.951 6.542 3.737 1.00 0.00 H new ATOM 0 HA LEU A 80 -6.566 8.837 1.973 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -8.092 7.699 4.318 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -8.185 9.410 3.951 1.00 0.00 H new ATOM 0 HG LEU A 80 -8.888 7.226 1.973 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -11.237 7.776 2.471 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -10.393 7.132 3.899 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -10.701 8.879 3.760 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -10.005 9.062 0.765 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -9.420 10.216 1.987 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -8.259 9.357 0.946 1.00 0.00 H new ATOM 1290 N VAL A 81 -4.789 9.993 3.266 1.00 0.00 N ATOM 1291 CA VAL A 81 -3.852 10.816 4.020 1.00 0.00 C ATOM 1292 C VAL A 81 -4.251 12.286 3.974 1.00 0.00 C ATOM 1293 O VAL A 81 -4.658 12.813 2.938 1.00 0.00 O ATOM 1294 CB VAL A 81 -2.416 10.669 3.482 1.00 0.00 C ATOM 1295 CG1 VAL A 81 -1.462 11.571 4.249 1.00 0.00 C ATOM 1296 CG2 VAL A 81 -1.966 9.217 3.556 1.00 0.00 C ATOM 0 H VAL A 81 -4.715 10.090 2.253 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.883 10.466 5.052 1.00 0.00 H new ATOM 0 HB VAL A 81 -2.405 10.977 2.436 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -0.453 11.453 3.854 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.775 12.609 4.139 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -1.473 11.299 5.304 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -0.950 9.131 3.172 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -1.992 8.880 4.592 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -2.634 8.598 2.957 1.00 0.00 H new ATOM 1306 N PRO A 82 -4.134 12.968 5.124 1.00 0.00 N ATOM 1307 CA PRO A 82 -4.477 14.388 5.241 1.00 0.00 C ATOM 1308 C PRO A 82 -3.495 15.285 4.495 1.00 0.00 C ATOM 1309 O PRO A 82 -2.318 14.952 4.355 1.00 0.00 O ATOM 1310 CB PRO A 82 -4.401 14.649 6.747 1.00 0.00 C ATOM 1311 CG PRO A 82 -3.457 13.618 7.262 1.00 0.00 C ATOM 1312 CD PRO A 82 -3.657 12.404 6.398 1.00 0.00 C ATOM 0 HA PRO A 82 -5.451 14.609 4.805 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -4.041 15.656 6.957 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -5.381 14.557 7.215 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -2.427 13.970 7.207 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -3.661 13.390 8.308 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -2.730 11.846 6.268 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -4.385 11.718 6.831 1.00 0.00 H new ATOM 1320 N SER A 83 -3.986 16.424 4.017 1.00 0.00 N ATOM 1321 CA SER A 83 -3.152 17.368 3.282 1.00 0.00 C ATOM 1322 C SER A 83 -3.551 18.806 3.599 1.00 0.00 C ATOM 1323 O SER A 83 -4.656 19.082 4.067 1.00 0.00 O ATOM 1324 CB SER A 83 -3.264 17.115 1.778 1.00 0.00 C ATOM 1325 OG SER A 83 -2.303 16.166 1.347 1.00 0.00 O ATOM 0 H SER A 83 -4.957 16.716 4.126 1.00 0.00 H new ATOM 0 HA SER A 83 -2.118 17.220 3.592 1.00 0.00 H new ATOM 0 HB2 SER A 83 -4.266 16.757 1.540 1.00 0.00 H new ATOM 0 HB3 SER A 83 -3.123 18.051 1.237 1.00 0.00 H new ATOM 0 HG SER A 83 -2.063 15.581 2.095 1.00 0.00 H new ATOM 1331 N PRO A 84 -2.631 19.746 3.336 1.00 0.00 N ATOM 1332 CA PRO A 84 -2.862 21.172 3.584 1.00 0.00 C ATOM 1333 C PRO A 84 -3.887 21.768 2.625 1.00 0.00 C ATOM 1334 O PRO A 84 -4.366 22.883 2.830 1.00 0.00 O ATOM 1335 CB PRO A 84 -1.485 21.800 3.355 1.00 0.00 C ATOM 1336 CG PRO A 84 -0.791 20.862 2.429 1.00 0.00 C ATOM 1337 CD PRO A 84 -1.293 19.488 2.777 1.00 0.00 C ATOM 0 HA PRO A 84 -3.267 21.353 4.580 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -1.571 22.795 2.919 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -0.938 21.908 4.292 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -1.011 21.106 1.390 1.00 0.00 H new ATOM 0 HG3 PRO A 84 0.291 20.924 2.549 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -1.341 18.843 1.899 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -0.644 18.994 3.500 1.00 0.00 H new ATOM 1345 N GLU A 85 -4.218 21.018 1.579 1.00 0.00 N ATOM 1346 CA GLU A 85 -5.185 21.475 0.588 1.00 0.00 C ATOM 1347 C GLU A 85 -6.319 20.465 0.429 1.00 0.00 C ATOM 1348 O GLU A 85 -7.115 20.552 -0.504 1.00 0.00 O ATOM 1349 CB GLU A 85 -4.499 21.704 -0.760 1.00 0.00 C ATOM 1350 CG GLU A 85 -3.869 23.080 -0.896 1.00 0.00 C ATOM 1351 CD GLU A 85 -4.881 24.151 -1.255 1.00 0.00 C ATOM 1352 OE1 GLU A 85 -5.699 23.912 -2.167 1.00 0.00 O ATOM 1353 OE2 GLU A 85 -4.854 25.228 -0.623 1.00 0.00 O ATOM 0 H GLU A 85 -3.831 20.092 1.396 1.00 0.00 H new ATOM 0 HA GLU A 85 -5.606 22.418 0.937 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -3.729 20.946 -0.900 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -5.229 21.567 -1.558 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -3.381 23.346 0.041 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -3.094 23.047 -1.661 1.00 0.00 H new ATOM 1360 N GLY A 86 -6.383 19.507 1.349 1.00 0.00 N ATOM 1361 CA GLY A 86 -7.421 18.494 1.293 1.00 0.00 C ATOM 1362 C GLY A 86 -6.928 17.133 1.745 1.00 0.00 C ATOM 1363 O GLY A 86 -6.850 16.861 2.942 1.00 0.00 O ATOM 0 H GLY A 86 -5.735 19.414 2.131 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -8.258 18.801 1.920 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -7.798 18.420 0.273 1.00 0.00 H new ATOM 1367 N MET A 87 -6.596 16.277 0.784 1.00 0.00 N ATOM 1368 CA MET A 87 -6.109 14.937 1.091 1.00 0.00 C ATOM 1369 C MET A 87 -5.643 14.225 -0.175 1.00 0.00 C ATOM 1370 O MET A 87 -6.041 14.585 -1.283 1.00 0.00 O ATOM 1371 CB MET A 87 -7.204 14.118 1.777 1.00 0.00 C ATOM 1372 CG MET A 87 -8.328 13.701 0.842 1.00 0.00 C ATOM 1373 SD MET A 87 -9.630 12.784 1.687 1.00 0.00 S ATOM 1374 CE MET A 87 -8.715 12.078 3.055 1.00 0.00 C ATOM 0 H MET A 87 -6.655 16.487 -0.212 1.00 0.00 H new ATOM 0 HA MET A 87 -5.259 15.032 1.767 1.00 0.00 H new ATOM 0 HB2 MET A 87 -6.758 13.226 2.216 1.00 0.00 H new ATOM 0 HB3 MET A 87 -7.622 14.701 2.597 1.00 0.00 H new ATOM 0 HG2 MET A 87 -8.757 14.589 0.377 1.00 0.00 H new ATOM 0 HG3 MET A 87 -7.919 13.087 0.039 1.00 0.00 H new ATOM 0 HE1 MET A 87 -9.359 11.396 3.610 1.00 0.00 H new ATOM 0 HE2 MET A 87 -7.853 11.532 2.673 1.00 0.00 H new ATOM 0 HE3 MET A 87 -8.375 12.876 3.716 1.00 0.00 H new ATOM 1384 N SER A 88 -4.798 13.214 -0.003 1.00 0.00 N ATOM 1385 CA SER A 88 -4.275 12.454 -1.133 1.00 0.00 C ATOM 1386 C SER A 88 -4.899 11.063 -1.188 1.00 0.00 C ATOM 1387 O SER A 88 -4.595 10.203 -0.362 1.00 0.00 O ATOM 1388 CB SER A 88 -2.753 12.340 -1.037 1.00 0.00 C ATOM 1389 OG SER A 88 -2.237 11.519 -2.070 1.00 0.00 O ATOM 0 H SER A 88 -4.461 12.902 0.908 1.00 0.00 H new ATOM 0 HA SER A 88 -4.535 12.986 -2.048 1.00 0.00 H new ATOM 0 HB2 SER A 88 -2.306 13.332 -1.099 1.00 0.00 H new ATOM 0 HB3 SER A 88 -2.477 11.926 -0.067 1.00 0.00 H new ATOM 0 HG SER A 88 -1.262 11.463 -1.987 1.00 0.00 H new ATOM 1395 N GLU A 89 -5.773 10.851 -2.167 1.00 0.00 N ATOM 1396 CA GLU A 89 -6.440 9.564 -2.329 1.00 0.00 C ATOM 1397 C GLU A 89 -5.642 8.650 -3.254 1.00 0.00 C ATOM 1398 O GLU A 89 -5.541 8.901 -4.455 1.00 0.00 O ATOM 1399 CB GLU A 89 -7.852 9.763 -2.884 1.00 0.00 C ATOM 1400 CG GLU A 89 -8.904 9.978 -1.809 1.00 0.00 C ATOM 1401 CD GLU A 89 -10.053 10.846 -2.283 1.00 0.00 C ATOM 1402 OE1 GLU A 89 -11.003 10.299 -2.881 1.00 0.00 O ATOM 1403 OE2 GLU A 89 -10.002 12.073 -2.056 1.00 0.00 O ATOM 0 H GLU A 89 -6.036 11.553 -2.859 1.00 0.00 H new ATOM 0 HA GLU A 89 -6.506 9.092 -1.349 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -7.851 10.621 -3.557 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -8.126 8.892 -3.479 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -9.292 9.012 -1.487 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -8.439 10.441 -0.938 1.00 0.00 H new ATOM 1410 N ILE A 90 -5.077 7.590 -2.685 1.00 0.00 N ATOM 1411 CA ILE A 90 -4.289 6.639 -3.458 1.00 0.00 C ATOM 1412 C ILE A 90 -4.955 5.267 -3.486 1.00 0.00 C ATOM 1413 O ILE A 90 -5.309 4.716 -2.443 1.00 0.00 O ATOM 1414 CB ILE A 90 -2.865 6.494 -2.888 1.00 0.00 C ATOM 1415 CG1 ILE A 90 -2.121 7.828 -2.970 1.00 0.00 C ATOM 1416 CG2 ILE A 90 -2.103 5.410 -3.637 1.00 0.00 C ATOM 1417 CD1 ILE A 90 -0.796 7.827 -2.240 1.00 0.00 C ATOM 0 H ILE A 90 -5.151 7.369 -1.692 1.00 0.00 H new ATOM 0 HA ILE A 90 -4.228 7.031 -4.473 1.00 0.00 H new ATOM 0 HB ILE A 90 -2.937 6.203 -1.840 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -1.949 8.075 -4.018 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -2.754 8.614 -2.557 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -1.099 5.319 -3.223 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -2.626 4.459 -3.533 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -2.038 5.674 -4.692 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -0.324 8.805 -2.341 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -0.962 7.611 -1.185 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -0.145 7.064 -2.668 1.00 0.00 H new ATOM 1429 N TYR A 91 -5.121 4.721 -4.685 1.00 0.00 N ATOM 1430 CA TYR A 91 -5.745 3.414 -4.850 1.00 0.00 C ATOM 1431 C TYR A 91 -4.713 2.363 -5.246 1.00 0.00 C ATOM 1432 O TYR A 91 -4.147 2.412 -6.339 1.00 0.00 O ATOM 1433 CB TYR A 91 -6.850 3.482 -5.905 1.00 0.00 C ATOM 1434 CG TYR A 91 -7.921 4.504 -5.595 1.00 0.00 C ATOM 1435 CD1 TYR A 91 -8.389 4.676 -4.297 1.00 0.00 C ATOM 1436 CD2 TYR A 91 -8.466 5.295 -6.598 1.00 0.00 C ATOM 1437 CE1 TYR A 91 -9.367 5.608 -4.009 1.00 0.00 C ATOM 1438 CE2 TYR A 91 -9.444 6.230 -6.319 1.00 0.00 C ATOM 1439 CZ TYR A 91 -9.891 6.383 -5.023 1.00 0.00 C ATOM 1440 OH TYR A 91 -10.866 7.312 -4.741 1.00 0.00 O ATOM 0 H TYR A 91 -4.832 5.163 -5.557 1.00 0.00 H new ATOM 0 HA TYR A 91 -6.182 3.126 -3.894 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -6.404 3.717 -6.871 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -7.313 2.500 -5.998 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -7.981 4.071 -3.501 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -8.119 5.177 -7.614 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -9.720 5.729 -2.995 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -9.856 6.838 -7.111 1.00 0.00 H new ATOM 0 HH TYR A 91 -11.126 7.774 -5.565 1.00 0.00 H new ATOM 1450 N LEU A 92 -4.472 1.412 -4.351 1.00 0.00 N ATOM 1451 CA LEU A 92 -3.509 0.346 -4.605 1.00 0.00 C ATOM 1452 C LEU A 92 -4.212 -0.998 -4.765 1.00 0.00 C ATOM 1453 O LEU A 92 -4.897 -1.462 -3.854 1.00 0.00 O ATOM 1454 CB LEU A 92 -2.490 0.271 -3.467 1.00 0.00 C ATOM 1455 CG LEU A 92 -1.726 1.560 -3.163 1.00 0.00 C ATOM 1456 CD1 LEU A 92 -0.871 1.392 -1.916 1.00 0.00 C ATOM 1457 CD2 LEU A 92 -0.865 1.963 -4.351 1.00 0.00 C ATOM 0 H LEU A 92 -4.931 1.357 -3.442 1.00 0.00 H new ATOM 0 HA LEU A 92 -2.989 0.574 -5.535 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -3.009 -0.042 -2.561 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.767 -0.509 -3.705 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.450 2.354 -2.979 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -0.335 2.319 -1.715 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -1.510 1.151 -1.066 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -0.155 0.585 -2.072 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -0.329 2.882 -4.116 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.149 1.170 -4.567 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -1.500 2.125 -5.222 1.00 0.00 H new ATOM 1469 N ARG A 93 -4.035 -1.618 -5.926 1.00 0.00 N ATOM 1470 CA ARG A 93 -4.652 -2.910 -6.204 1.00 0.00 C ATOM 1471 C ARG A 93 -3.597 -4.009 -6.288 1.00 0.00 C ATOM 1472 O ARG A 93 -2.655 -3.920 -7.077 1.00 0.00 O ATOM 1473 CB ARG A 93 -5.446 -2.849 -7.510 1.00 0.00 C ATOM 1474 CG ARG A 93 -5.855 -4.215 -8.038 1.00 0.00 C ATOM 1475 CD ARG A 93 -6.295 -4.141 -9.492 1.00 0.00 C ATOM 1476 NE ARG A 93 -7.458 -3.275 -9.668 1.00 0.00 N ATOM 1477 CZ ARG A 93 -7.931 -2.911 -10.855 1.00 0.00 C ATOM 1478 NH1 ARG A 93 -7.343 -3.336 -11.965 1.00 0.00 N ATOM 1479 NH2 ARG A 93 -8.994 -2.121 -10.934 1.00 0.00 N ATOM 0 H ARG A 93 -3.470 -1.247 -6.690 1.00 0.00 H new ATOM 0 HA ARG A 93 -5.331 -3.144 -5.384 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -6.341 -2.246 -7.354 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -4.847 -2.341 -8.266 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -5.019 -4.908 -7.945 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -6.668 -4.613 -7.430 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -5.471 -3.770 -10.102 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -6.531 -5.143 -9.851 1.00 0.00 H new ATOM 0 HE ARG A 93 -7.933 -2.931 -8.834 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -6.526 -3.944 -11.909 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -7.708 -3.055 -12.875 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -9.449 -1.792 -10.083 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -9.356 -1.843 -11.846 1.00 0.00 H new ATOM 1493 N CYS A 94 -3.762 -5.043 -5.471 1.00 0.00 N ATOM 1494 CA CYS A 94 -2.823 -6.160 -5.452 1.00 0.00 C ATOM 1495 C CYS A 94 -3.259 -7.253 -6.422 1.00 0.00 C ATOM 1496 O CYS A 94 -4.302 -7.145 -7.066 1.00 0.00 O ATOM 1497 CB CYS A 94 -2.708 -6.731 -4.038 1.00 0.00 C ATOM 1498 SG CYS A 94 -1.531 -5.855 -2.981 1.00 0.00 S ATOM 0 H CYS A 94 -4.536 -5.132 -4.813 1.00 0.00 H new ATOM 0 HA CYS A 94 -1.848 -5.789 -5.767 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -3.691 -6.707 -3.567 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -2.412 -7.778 -4.104 1.00 0.00 H new ATOM 0 HG CYS A 94 -2.177 -5.201 -2.061 1.00 0.00 H new ATOM 1504 N GLN A 95 -2.452 -8.304 -6.521 1.00 0.00 N ATOM 1505 CA GLN A 95 -2.753 -9.416 -7.415 1.00 0.00 C ATOM 1506 C GLN A 95 -3.439 -10.550 -6.661 1.00 0.00 C ATOM 1507 O GLN A 95 -4.398 -11.145 -7.152 1.00 0.00 O ATOM 1508 CB GLN A 95 -1.473 -9.929 -8.076 1.00 0.00 C ATOM 1509 CG GLN A 95 -0.339 -10.178 -7.094 1.00 0.00 C ATOM 1510 CD GLN A 95 0.882 -10.786 -7.755 1.00 0.00 C ATOM 1511 OE1 GLN A 95 0.795 -11.823 -8.413 1.00 0.00 O ATOM 1512 NE2 GLN A 95 2.031 -10.142 -7.584 1.00 0.00 N ATOM 0 H GLN A 95 -1.585 -8.409 -5.994 1.00 0.00 H new ATOM 0 HA GLN A 95 -3.432 -9.054 -8.187 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -1.694 -10.856 -8.606 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -1.144 -9.206 -8.822 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -0.060 -9.237 -6.620 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -0.688 -10.842 -6.303 1.00 0.00 H new ATOM 0 HE21 GLN A 95 2.058 -9.285 -7.031 1.00 0.00 H new ATOM 0 HE22 GLN A 95 2.886 -10.504 -8.006 1.00 0.00 H new ATOM 1521 N ASP A 96 -2.941 -10.845 -5.465 1.00 0.00 N ATOM 1522 CA ASP A 96 -3.507 -11.907 -4.642 1.00 0.00 C ATOM 1523 C ASP A 96 -3.503 -11.513 -3.168 1.00 0.00 C ATOM 1524 O ASP A 96 -2.992 -10.456 -2.800 1.00 0.00 O ATOM 1525 CB ASP A 96 -2.722 -13.206 -4.837 1.00 0.00 C ATOM 1526 CG ASP A 96 -3.271 -14.049 -5.971 1.00 0.00 C ATOM 1527 OD1 ASP A 96 -4.501 -14.024 -6.186 1.00 0.00 O ATOM 1528 OD2 ASP A 96 -2.471 -14.735 -6.642 1.00 0.00 O ATOM 0 H ASP A 96 -2.146 -10.363 -5.044 1.00 0.00 H new ATOM 0 HA ASP A 96 -4.539 -12.064 -4.955 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -1.677 -12.969 -5.037 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -2.747 -13.784 -3.913 1.00 0.00 H new ATOM 1533 N GLU A 97 -4.078 -12.371 -2.330 1.00 0.00 N ATOM 1534 CA GLU A 97 -4.142 -12.110 -0.897 1.00 0.00 C ATOM 1535 C GLU A 97 -2.745 -12.092 -0.284 1.00 0.00 C ATOM 1536 O GLU A 97 -2.490 -11.375 0.683 1.00 0.00 O ATOM 1537 CB GLU A 97 -5.003 -13.167 -0.202 1.00 0.00 C ATOM 1538 CG GLU A 97 -4.481 -14.584 -0.371 1.00 0.00 C ATOM 1539 CD GLU A 97 -5.553 -15.632 -0.145 1.00 0.00 C ATOM 1540 OE1 GLU A 97 -5.991 -15.794 1.013 1.00 0.00 O ATOM 1541 OE2 GLU A 97 -5.955 -16.290 -1.128 1.00 0.00 O ATOM 0 H GLU A 97 -4.505 -13.251 -2.619 1.00 0.00 H new ATOM 0 HA GLU A 97 -4.596 -11.130 -0.752 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -5.061 -12.935 0.861 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -6.018 -13.113 -0.596 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -4.072 -14.699 -1.375 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -3.662 -14.751 0.328 1.00 0.00 H new ATOM 1548 N GLN A 98 -1.846 -12.888 -0.853 1.00 0.00 N ATOM 1549 CA GLN A 98 -0.475 -12.965 -0.362 1.00 0.00 C ATOM 1550 C GLN A 98 0.144 -11.575 -0.257 1.00 0.00 C ATOM 1551 O GLN A 98 0.629 -11.180 0.804 1.00 0.00 O ATOM 1552 CB GLN A 98 0.371 -13.844 -1.284 1.00 0.00 C ATOM 1553 CG GLN A 98 0.346 -15.318 -0.911 1.00 0.00 C ATOM 1554 CD GLN A 98 1.380 -15.672 0.140 1.00 0.00 C ATOM 1555 OE1 GLN A 98 2.584 -15.585 -0.104 1.00 0.00 O ATOM 1556 NE2 GLN A 98 0.916 -16.073 1.317 1.00 0.00 N ATOM 0 H GLN A 98 -2.042 -13.488 -1.654 1.00 0.00 H new ATOM 0 HA GLN A 98 -0.497 -13.410 0.633 1.00 0.00 H new ATOM 0 HB2 GLN A 98 0.015 -13.731 -2.308 1.00 0.00 H new ATOM 0 HB3 GLN A 98 1.402 -13.490 -1.264 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -0.646 -15.579 -0.542 1.00 0.00 H new ATOM 0 HG3 GLN A 98 0.521 -15.918 -1.804 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -0.090 -16.130 1.476 1.00 0.00 H new ATOM 0 HE22 GLN A 98 1.565 -16.324 2.063 1.00 0.00 H new ATOM 1565 N GLN A 99 0.125 -10.838 -1.363 1.00 0.00 N ATOM 1566 CA GLN A 99 0.686 -9.493 -1.394 1.00 0.00 C ATOM 1567 C GLN A 99 -0.194 -8.518 -0.619 1.00 0.00 C ATOM 1568 O GLN A 99 0.304 -7.684 0.137 1.00 0.00 O ATOM 1569 CB GLN A 99 0.844 -9.017 -2.840 1.00 0.00 C ATOM 1570 CG GLN A 99 1.720 -7.783 -2.981 1.00 0.00 C ATOM 1571 CD GLN A 99 3.193 -8.088 -2.792 1.00 0.00 C ATOM 1572 OE1 GLN A 99 3.559 -9.006 -2.058 1.00 0.00 O ATOM 1573 NE2 GLN A 99 4.047 -7.318 -3.456 1.00 0.00 N ATOM 0 H GLN A 99 -0.273 -11.150 -2.249 1.00 0.00 H new ATOM 0 HA GLN A 99 1.667 -9.525 -0.920 1.00 0.00 H new ATOM 0 HB2 GLN A 99 1.270 -9.825 -3.435 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -0.142 -8.802 -3.253 1.00 0.00 H new ATOM 0 HG2 GLN A 99 1.567 -7.345 -3.967 1.00 0.00 H new ATOM 0 HG3 GLN A 99 1.411 -7.037 -2.249 1.00 0.00 H new ATOM 0 HE21 GLN A 99 3.699 -6.568 -4.054 1.00 0.00 H new ATOM 0 HE22 GLN A 99 5.051 -7.476 -3.369 1.00 0.00 H new ATOM 1582 N TYR A 100 -1.504 -8.629 -0.812 1.00 0.00 N ATOM 1583 CA TYR A 100 -2.453 -7.755 -0.132 1.00 0.00 C ATOM 1584 C TYR A 100 -2.175 -7.710 1.367 1.00 0.00 C ATOM 1585 O TYR A 100 -1.911 -6.647 1.929 1.00 0.00 O ATOM 1586 CB TYR A 100 -3.885 -8.231 -0.383 1.00 0.00 C ATOM 1587 CG TYR A 100 -4.888 -7.676 0.603 1.00 0.00 C ATOM 1588 CD1 TYR A 100 -5.152 -6.314 0.664 1.00 0.00 C ATOM 1589 CD2 TYR A 100 -5.573 -8.516 1.474 1.00 0.00 C ATOM 1590 CE1 TYR A 100 -6.067 -5.803 1.564 1.00 0.00 C ATOM 1591 CE2 TYR A 100 -6.492 -8.014 2.376 1.00 0.00 C ATOM 1592 CZ TYR A 100 -6.735 -6.657 2.417 1.00 0.00 C ATOM 1593 OH TYR A 100 -7.648 -6.152 3.314 1.00 0.00 O ATOM 0 H TYR A 100 -1.933 -9.315 -1.433 1.00 0.00 H new ATOM 0 HA TYR A 100 -2.335 -6.749 -0.535 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -4.183 -7.945 -1.392 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -3.910 -9.320 -0.340 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -4.633 -5.643 -0.004 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -5.384 -9.579 1.445 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -6.258 -4.741 1.600 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -7.017 -8.680 3.045 1.00 0.00 H new ATOM 0 HH TYR A 100 -8.030 -6.885 3.840 1.00 0.00 H new ATOM 1603 N ALA A 101 -2.236 -8.872 2.009 1.00 0.00 N ATOM 1604 CA ALA A 101 -1.988 -8.967 3.442 1.00 0.00 C ATOM 1605 C ALA A 101 -0.671 -8.297 3.817 1.00 0.00 C ATOM 1606 O ALA A 101 -0.643 -7.371 4.628 1.00 0.00 O ATOM 1607 CB ALA A 101 -1.986 -10.424 3.882 1.00 0.00 C ATOM 0 H ALA A 101 -2.455 -9.761 1.559 1.00 0.00 H new ATOM 0 HA ALA A 101 -2.792 -8.444 3.960 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -1.800 -10.480 4.954 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -2.954 -10.873 3.658 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -1.203 -10.964 3.349 1.00 0.00 H new ATOM 1613 N ARG A 102 0.419 -8.771 3.223 1.00 0.00 N ATOM 1614 CA ARG A 102 1.740 -8.219 3.497 1.00 0.00 C ATOM 1615 C ARG A 102 1.690 -6.695 3.559 1.00 0.00 C ATOM 1616 O ARG A 102 1.889 -6.100 4.618 1.00 0.00 O ATOM 1617 CB ARG A 102 2.735 -8.663 2.423 1.00 0.00 C ATOM 1618 CG ARG A 102 3.333 -10.037 2.679 1.00 0.00 C ATOM 1619 CD ARG A 102 4.222 -10.481 1.528 1.00 0.00 C ATOM 1620 NE ARG A 102 4.534 -11.906 1.595 1.00 0.00 N ATOM 1621 CZ ARG A 102 5.094 -12.584 0.599 1.00 0.00 C ATOM 1622 NH1 ARG A 102 5.401 -11.969 -0.535 1.00 0.00 N ATOM 1623 NH2 ARG A 102 5.347 -13.879 0.736 1.00 0.00 N ATOM 0 H ARG A 102 0.413 -9.536 2.549 1.00 0.00 H new ATOM 0 HA ARG A 102 2.069 -8.595 4.466 1.00 0.00 H new ATOM 0 HB2 ARG A 102 2.234 -8.669 1.455 1.00 0.00 H new ATOM 0 HB3 ARG A 102 3.540 -7.931 2.361 1.00 0.00 H new ATOM 0 HG2 ARG A 102 3.913 -10.016 3.601 1.00 0.00 H new ATOM 0 HG3 ARG A 102 2.532 -10.763 2.823 1.00 0.00 H new ATOM 0 HD2 ARG A 102 3.726 -10.263 0.582 1.00 0.00 H new ATOM 0 HD3 ARG A 102 5.148 -9.906 1.543 1.00 0.00 H new ATOM 0 HE ARG A 102 4.310 -12.409 2.454 1.00 0.00 H new ATOM 0 HH11 ARG A 102 5.207 -10.974 -0.644 1.00 0.00 H new ATOM 0 HH12 ARG A 102 5.831 -12.491 -1.298 1.00 0.00 H new ATOM 0 HH21 ARG A 102 5.112 -14.355 1.607 1.00 0.00 H new ATOM 0 HH22 ARG A 102 5.777 -14.398 -0.029 1.00 0.00 H new ATOM 1637 N TRP A 103 1.424 -6.070 2.417 1.00 0.00 N ATOM 1638 CA TRP A 103 1.348 -4.616 2.342 1.00 0.00 C ATOM 1639 C TRP A 103 0.289 -4.075 3.296 1.00 0.00 C ATOM 1640 O TRP A 103 0.599 -3.327 4.222 1.00 0.00 O ATOM 1641 CB TRP A 103 1.036 -4.174 0.911 1.00 0.00 C ATOM 1642 CG TRP A 103 2.246 -4.127 0.027 1.00 0.00 C ATOM 1643 CD1 TRP A 103 2.807 -5.172 -0.651 1.00 0.00 C ATOM 1644 CD2 TRP A 103 3.044 -2.977 -0.274 1.00 0.00 C ATOM 1645 NE1 TRP A 103 3.905 -4.741 -1.354 1.00 0.00 N ATOM 1646 CE2 TRP A 103 4.071 -3.398 -1.140 1.00 0.00 C ATOM 1647 CE3 TRP A 103 2.989 -1.633 0.103 1.00 0.00 C ATOM 1648 CZ2 TRP A 103 5.035 -2.521 -1.633 1.00 0.00 C ATOM 1649 CZ3 TRP A 103 3.945 -0.764 -0.387 1.00 0.00 C ATOM 1650 CH2 TRP A 103 4.957 -1.211 -1.248 1.00 0.00 C ATOM 0 H TRP A 103 1.258 -6.548 1.531 1.00 0.00 H new ATOM 0 HA TRP A 103 2.316 -4.212 2.637 1.00 0.00 H new ATOM 0 HB2 TRP A 103 0.305 -4.857 0.478 1.00 0.00 H new ATOM 0 HB3 TRP A 103 0.574 -3.187 0.936 1.00 0.00 H new ATOM 0 HD1 TRP A 103 2.441 -6.188 -0.636 1.00 0.00 H new ATOM 0 HE1 TRP A 103 4.500 -5.326 -1.940 1.00 0.00 H new ATOM 0 HE3 TRP A 103 2.213 -1.279 0.766 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 5.816 -2.864 -2.296 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 3.912 0.277 -0.102 1.00 0.00 H new ATOM 0 HH2 TRP A 103 5.689 -0.507 -1.614 1.00 0.00 H new ATOM 1661 N MET A 104 -0.962 -4.460 3.064 1.00 0.00 N ATOM 1662 CA MET A 104 -2.066 -4.014 3.905 1.00 0.00 C ATOM 1663 C MET A 104 -1.634 -3.920 5.365 1.00 0.00 C ATOM 1664 O MET A 104 -1.624 -2.837 5.950 1.00 0.00 O ATOM 1665 CB MET A 104 -3.254 -4.970 3.773 1.00 0.00 C ATOM 1666 CG MET A 104 -4.298 -4.796 4.864 1.00 0.00 C ATOM 1667 SD MET A 104 -4.736 -3.068 5.137 1.00 0.00 S ATOM 1668 CE MET A 104 -6.241 -2.944 4.172 1.00 0.00 C ATOM 0 H MET A 104 -1.236 -5.079 2.301 1.00 0.00 H new ATOM 0 HA MET A 104 -2.368 -3.022 3.569 1.00 0.00 H new ATOM 0 HB2 MET A 104 -3.726 -4.818 2.802 1.00 0.00 H new ATOM 0 HB3 MET A 104 -2.888 -5.996 3.792 1.00 0.00 H new ATOM 0 HG2 MET A 104 -5.194 -5.356 4.597 1.00 0.00 H new ATOM 0 HG3 MET A 104 -3.921 -5.222 5.794 1.00 0.00 H new ATOM 0 HE1 MET A 104 -6.606 -1.917 4.197 1.00 0.00 H new ATOM 0 HE2 MET A 104 -6.037 -3.231 3.141 1.00 0.00 H new ATOM 0 HE3 MET A 104 -6.997 -3.608 4.590 1.00 0.00 H new ATOM 1678 N ALA A 105 -1.279 -5.061 5.947 1.00 0.00 N ATOM 1679 CA ALA A 105 -0.845 -5.106 7.338 1.00 0.00 C ATOM 1680 C ALA A 105 0.129 -3.973 7.646 1.00 0.00 C ATOM 1681 O ALA A 105 0.045 -3.338 8.696 1.00 0.00 O ATOM 1682 CB ALA A 105 -0.207 -6.452 7.648 1.00 0.00 C ATOM 0 H ALA A 105 -1.283 -5.966 5.477 1.00 0.00 H new ATOM 0 HA ALA A 105 -1.723 -4.978 7.971 1.00 0.00 H new ATOM 0 HB1 ALA A 105 0.113 -6.472 8.690 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -0.933 -7.247 7.476 1.00 0.00 H new ATOM 0 HB3 ALA A 105 0.657 -6.603 7.001 1.00 0.00 H new ATOM 1688 N GLY A 106 1.053 -3.726 6.723 1.00 0.00 N ATOM 1689 CA GLY A 106 2.030 -2.670 6.916 1.00 0.00 C ATOM 1690 C GLY A 106 1.385 -1.314 7.124 1.00 0.00 C ATOM 1691 O GLY A 106 1.757 -0.576 8.037 1.00 0.00 O ATOM 0 H GLY A 106 1.143 -4.238 5.845 1.00 0.00 H new ATOM 0 HA2 GLY A 106 2.653 -2.909 7.778 1.00 0.00 H new ATOM 0 HA3 GLY A 106 2.689 -2.626 6.049 1.00 0.00 H new ATOM 1695 N CYS A 107 0.417 -0.984 6.275 1.00 0.00 N ATOM 1696 CA CYS A 107 -0.279 0.293 6.370 1.00 0.00 C ATOM 1697 C CYS A 107 -1.076 0.384 7.667 1.00 0.00 C ATOM 1698 O CYS A 107 -1.012 1.388 8.377 1.00 0.00 O ATOM 1699 CB CYS A 107 -1.211 0.479 5.171 1.00 0.00 C ATOM 1700 SG CYS A 107 -0.353 0.678 3.592 1.00 0.00 S ATOM 0 H CYS A 107 0.097 -1.583 5.514 1.00 0.00 H new ATOM 0 HA CYS A 107 0.468 1.087 6.368 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -1.876 -0.382 5.105 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -1.838 1.354 5.344 1.00 0.00 H new ATOM 0 HG CYS A 107 -1.225 0.826 2.640 1.00 0.00 H new ATOM 1706 N ARG A 108 -1.827 -0.669 7.969 1.00 0.00 N ATOM 1707 CA ARG A 108 -2.638 -0.707 9.180 1.00 0.00 C ATOM 1708 C ARG A 108 -1.768 -0.549 10.423 1.00 0.00 C ATOM 1709 O ARG A 108 -2.107 0.201 11.340 1.00 0.00 O ATOM 1710 CB ARG A 108 -3.419 -2.021 9.256 1.00 0.00 C ATOM 1711 CG ARG A 108 -4.726 -1.998 8.480 1.00 0.00 C ATOM 1712 CD ARG A 108 -5.269 -3.401 8.262 1.00 0.00 C ATOM 1713 NE ARG A 108 -6.563 -3.388 7.584 1.00 0.00 N ATOM 1714 CZ ARG A 108 -7.339 -4.459 7.461 1.00 0.00 C ATOM 1715 NH1 ARG A 108 -6.954 -5.623 7.968 1.00 0.00 N ATOM 1716 NH2 ARG A 108 -8.502 -4.368 6.829 1.00 0.00 N ATOM 0 H ARG A 108 -1.891 -1.508 7.392 1.00 0.00 H new ATOM 0 HA ARG A 108 -3.341 0.125 9.141 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -2.794 -2.828 8.874 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -3.630 -2.248 10.301 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -5.461 -1.402 9.021 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -4.570 -1.513 7.516 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -4.557 -3.978 7.672 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -5.369 -3.905 9.224 1.00 0.00 H new ATOM 0 HE ARG A 108 -6.888 -2.508 7.183 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -6.060 -5.697 8.454 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -7.552 -6.444 7.872 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -8.801 -3.475 6.437 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -9.097 -5.191 6.735 1.00 0.00 H new ATOM 1730 N LEU A 109 -0.645 -1.258 10.447 1.00 0.00 N ATOM 1731 CA LEU A 109 0.275 -1.197 11.578 1.00 0.00 C ATOM 1732 C LEU A 109 0.862 0.203 11.727 1.00 0.00 C ATOM 1733 O LEU A 109 0.930 0.744 12.830 1.00 0.00 O ATOM 1734 CB LEU A 109 1.400 -2.218 11.401 1.00 0.00 C ATOM 1735 CG LEU A 109 1.067 -3.658 11.795 1.00 0.00 C ATOM 1736 CD1 LEU A 109 2.019 -4.630 11.115 1.00 0.00 C ATOM 1737 CD2 LEU A 109 1.122 -3.824 13.306 1.00 0.00 C ATOM 0 H LEU A 109 -0.349 -1.882 9.696 1.00 0.00 H new ATOM 0 HA LEU A 109 -0.284 -1.435 12.483 1.00 0.00 H new ATOM 0 HB2 LEU A 109 1.709 -2.211 10.356 1.00 0.00 H new ATOM 0 HB3 LEU A 109 2.257 -1.890 11.989 1.00 0.00 H new ATOM 0 HG LEU A 109 0.053 -3.881 11.462 1.00 0.00 H new ATOM 0 HD11 LEU A 109 1.768 -5.650 11.407 1.00 0.00 H new ATOM 0 HD12 LEU A 109 1.930 -4.530 10.033 1.00 0.00 H new ATOM 0 HD13 LEU A 109 3.043 -4.408 11.417 1.00 0.00 H new ATOM 0 HD21 LEU A 109 0.882 -4.855 13.568 1.00 0.00 H new ATOM 0 HD22 LEU A 109 2.123 -3.583 13.662 1.00 0.00 H new ATOM 0 HD23 LEU A 109 0.400 -3.154 13.772 1.00 0.00 H new ATOM 1749 N ALA A 110 1.283 0.784 10.609 1.00 0.00 N ATOM 1750 CA ALA A 110 1.860 2.123 10.614 1.00 0.00 C ATOM 1751 C ALA A 110 0.800 3.177 10.912 1.00 0.00 C ATOM 1752 O ALA A 110 1.099 4.232 11.471 1.00 0.00 O ATOM 1753 CB ALA A 110 2.535 2.412 9.281 1.00 0.00 C ATOM 0 H ALA A 110 1.235 0.349 9.688 1.00 0.00 H new ATOM 0 HA ALA A 110 2.609 2.166 11.405 1.00 0.00 H new ATOM 0 HB1 ALA A 110 2.961 3.415 9.299 1.00 0.00 H new ATOM 0 HB2 ALA A 110 3.328 1.684 9.109 1.00 0.00 H new ATOM 0 HB3 ALA A 110 1.800 2.344 8.479 1.00 0.00 H new ATOM 1759 N SER A 111 -0.441 2.885 10.535 1.00 0.00 N ATOM 1760 CA SER A 111 -1.546 3.810 10.759 1.00 0.00 C ATOM 1761 C SER A 111 -1.665 4.167 12.237 1.00 0.00 C ATOM 1762 O SER A 111 -1.962 5.308 12.591 1.00 0.00 O ATOM 1763 CB SER A 111 -2.858 3.199 10.263 1.00 0.00 C ATOM 1764 OG SER A 111 -3.967 3.733 10.966 1.00 0.00 O ATOM 0 H SER A 111 -0.706 2.015 10.073 1.00 0.00 H new ATOM 0 HA SER A 111 -1.343 4.722 10.198 1.00 0.00 H new ATOM 0 HB2 SER A 111 -2.972 3.392 9.196 1.00 0.00 H new ATOM 0 HB3 SER A 111 -2.830 2.117 10.390 1.00 0.00 H new ATOM 0 HG SER A 111 -4.793 3.328 10.630 1.00 0.00 H new ATOM 1770 N LYS A 112 -1.431 3.182 13.098 1.00 0.00 N ATOM 1771 CA LYS A 112 -1.510 3.390 14.539 1.00 0.00 C ATOM 1772 C LYS A 112 -0.133 3.696 15.121 1.00 0.00 C ATOM 1773 O LYS A 112 -0.019 4.204 16.236 1.00 0.00 O ATOM 1774 CB LYS A 112 -2.100 2.154 15.222 1.00 0.00 C ATOM 1775 CG LYS A 112 -3.530 1.854 14.805 1.00 0.00 C ATOM 1776 CD LYS A 112 -4.517 2.788 15.484 1.00 0.00 C ATOM 1777 CE LYS A 112 -5.948 2.297 15.326 1.00 0.00 C ATOM 1778 NZ LYS A 112 -6.921 3.194 16.009 1.00 0.00 N ATOM 0 H LYS A 112 -1.185 2.231 12.822 1.00 0.00 H new ATOM 0 HA LYS A 112 -2.161 4.245 14.722 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -1.475 1.290 14.995 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -2.067 2.296 16.302 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -3.622 1.950 13.723 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -3.774 0.821 15.055 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -4.274 2.868 16.543 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -4.425 3.788 15.059 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -6.195 2.233 14.266 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -6.034 1.290 15.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -7.884 2.825 15.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -6.701 3.235 17.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -6.858 4.149 15.602 1.00 0.00 H new ATOM 1792 N GLY A 113 0.910 3.385 14.357 1.00 0.00 N ATOM 1793 CA GLY A 113 2.264 3.636 14.814 1.00 0.00 C ATOM 1794 C GLY A 113 3.132 2.394 14.761 1.00 0.00 C ATOM 1795 O GLY A 113 4.317 2.470 14.433 1.00 0.00 O ATOM 0 H GLY A 113 0.841 2.964 13.430 1.00 0.00 H new ATOM 0 HA2 GLY A 113 2.713 4.416 14.199 1.00 0.00 H new ATOM 0 HA3 GLY A 113 2.235 4.013 15.837 1.00 0.00 H new ATOM 1799 N ARG A 114 2.544 1.248 15.088 1.00 0.00 N ATOM 1800 CA ARG A 114 3.273 -0.014 15.079 1.00 0.00 C ATOM 1801 C ARG A 114 4.022 -0.201 13.763 1.00 0.00 C ATOM 1802 O ARG A 114 3.688 0.418 12.752 1.00 0.00 O ATOM 1803 CB ARG A 114 2.312 -1.184 15.301 1.00 0.00 C ATOM 1804 CG ARG A 114 1.665 -1.189 16.676 1.00 0.00 C ATOM 1805 CD ARG A 114 0.381 -2.003 16.685 1.00 0.00 C ATOM 1806 NE ARG A 114 -0.043 -2.343 18.041 1.00 0.00 N ATOM 1807 CZ ARG A 114 -0.976 -3.247 18.315 1.00 0.00 C ATOM 1808 NH1 ARG A 114 -1.580 -3.899 17.331 1.00 0.00 N ATOM 1809 NH2 ARG A 114 -1.307 -3.501 19.574 1.00 0.00 N ATOM 0 H ARG A 114 1.565 1.168 15.362 1.00 0.00 H new ATOM 0 HA ARG A 114 4.000 0.010 15.891 1.00 0.00 H new ATOM 0 HB2 ARG A 114 1.531 -1.150 14.542 1.00 0.00 H new ATOM 0 HB3 ARG A 114 2.853 -2.119 15.160 1.00 0.00 H new ATOM 0 HG2 ARG A 114 2.363 -1.600 17.406 1.00 0.00 H new ATOM 0 HG3 ARG A 114 1.450 -0.165 16.982 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -0.409 -1.439 16.189 1.00 0.00 H new ATOM 0 HD3 ARG A 114 0.528 -2.918 16.111 1.00 0.00 H new ATOM 0 HE ARG A 114 0.402 -1.859 18.821 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -1.328 -3.706 16.362 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -2.297 -4.593 17.544 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -0.845 -3.001 20.334 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -2.024 -4.196 19.783 1.00 0.00 H new ATOM 1823 N THR A 115 5.039 -1.057 13.784 1.00 0.00 N ATOM 1824 CA THR A 115 5.838 -1.323 12.594 1.00 0.00 C ATOM 1825 C THR A 115 6.047 -2.820 12.396 1.00 0.00 C ATOM 1826 O THR A 115 5.878 -3.608 13.326 1.00 0.00 O ATOM 1827 CB THR A 115 7.212 -0.631 12.673 1.00 0.00 C ATOM 1828 OG1 THR A 115 7.998 -1.220 13.715 1.00 0.00 O ATOM 1829 CG2 THR A 115 7.052 0.860 12.931 1.00 0.00 C ATOM 0 H THR A 115 5.329 -1.578 14.612 1.00 0.00 H new ATOM 0 HA THR A 115 5.285 -0.920 11.746 1.00 0.00 H new ATOM 0 HB THR A 115 7.718 -0.766 11.717 1.00 0.00 H new ATOM 0 HG1 THR A 115 8.870 -0.776 13.758 1.00 0.00 H new ATOM 0 HG21 THR A 115 8.035 1.328 12.983 1.00 0.00 H new ATOM 0 HG22 THR A 115 6.478 1.310 12.121 1.00 0.00 H new ATOM 0 HG23 THR A 115 6.528 1.012 13.875 1.00 0.00 H new ATOM 1837 N MET A 116 6.416 -3.206 11.179 1.00 0.00 N ATOM 1838 CA MET A 116 6.649 -4.610 10.860 1.00 0.00 C ATOM 1839 C MET A 116 7.629 -5.235 11.848 1.00 0.00 C ATOM 1840 O MET A 116 7.460 -6.382 12.262 1.00 0.00 O ATOM 1841 CB MET A 116 7.186 -4.748 9.435 1.00 0.00 C ATOM 1842 CG MET A 116 6.111 -4.633 8.366 1.00 0.00 C ATOM 1843 SD MET A 116 6.664 -5.229 6.757 1.00 0.00 S ATOM 1844 CE MET A 116 7.798 -3.925 6.284 1.00 0.00 C ATOM 0 H MET A 116 6.560 -2.566 10.398 1.00 0.00 H new ATOM 0 HA MET A 116 5.698 -5.138 10.935 1.00 0.00 H new ATOM 0 HB2 MET A 116 7.940 -3.980 9.264 1.00 0.00 H new ATOM 0 HB3 MET A 116 7.684 -5.712 9.335 1.00 0.00 H new ATOM 0 HG2 MET A 116 5.233 -5.200 8.677 1.00 0.00 H new ATOM 0 HG3 MET A 116 5.803 -3.591 8.277 1.00 0.00 H new ATOM 0 HE1 MET A 116 7.519 -3.538 5.304 1.00 0.00 H new ATOM 0 HE2 MET A 116 7.753 -3.120 7.018 1.00 0.00 H new ATOM 0 HE3 MET A 116 8.812 -4.322 6.243 1.00 0.00 H new ATOM 1854 N ALA A 117 8.653 -4.475 12.221 1.00 0.00 N ATOM 1855 CA ALA A 117 9.658 -4.955 13.162 1.00 0.00 C ATOM 1856 C ALA A 117 9.009 -5.673 14.340 1.00 0.00 C ATOM 1857 O ALA A 117 9.620 -6.542 14.963 1.00 0.00 O ATOM 1858 CB ALA A 117 10.516 -3.799 13.654 1.00 0.00 C ATOM 0 H ALA A 117 8.809 -3.524 11.886 1.00 0.00 H new ATOM 0 HA ALA A 117 10.295 -5.670 12.641 1.00 0.00 H new ATOM 0 HB1 ALA A 117 11.262 -4.172 14.356 1.00 0.00 H new ATOM 0 HB2 ALA A 117 11.017 -3.331 12.806 1.00 0.00 H new ATOM 0 HB3 ALA A 117 9.885 -3.064 14.153 1.00 0.00 H new ATOM 1864 N ASP A 118 7.768 -5.305 14.640 1.00 0.00 N ATOM 1865 CA ASP A 118 7.036 -5.915 15.744 1.00 0.00 C ATOM 1866 C ASP A 118 6.424 -7.247 15.321 1.00 0.00 C ATOM 1867 O ASP A 118 6.068 -7.435 14.158 1.00 0.00 O ATOM 1868 CB ASP A 118 5.940 -4.971 16.240 1.00 0.00 C ATOM 1869 CG ASP A 118 5.373 -5.395 17.581 1.00 0.00 C ATOM 1870 OD1 ASP A 118 6.126 -5.373 18.578 1.00 0.00 O ATOM 1871 OD2 ASP A 118 4.177 -5.748 17.634 1.00 0.00 O ATOM 0 H ASP A 118 7.248 -4.588 14.134 1.00 0.00 H new ATOM 0 HA ASP A 118 7.740 -6.101 16.555 1.00 0.00 H new ATOM 0 HB2 ASP A 118 6.344 -3.962 16.322 1.00 0.00 H new ATOM 0 HB3 ASP A 118 5.136 -4.934 15.505 1.00 0.00 H new ATOM 1876 N SER A 119 6.307 -8.168 16.272 1.00 0.00 N ATOM 1877 CA SER A 119 5.743 -9.484 15.996 1.00 0.00 C ATOM 1878 C SER A 119 4.275 -9.373 15.596 1.00 0.00 C ATOM 1879 O SER A 119 3.805 -10.092 14.715 1.00 0.00 O ATOM 1880 CB SER A 119 5.883 -10.389 17.222 1.00 0.00 C ATOM 1881 OG SER A 119 5.325 -11.668 16.977 1.00 0.00 O ATOM 0 H SER A 119 6.595 -8.027 17.240 1.00 0.00 H new ATOM 0 HA SER A 119 6.295 -9.922 15.165 1.00 0.00 H new ATOM 0 HB2 SER A 119 6.936 -10.492 17.484 1.00 0.00 H new ATOM 0 HB3 SER A 119 5.386 -9.929 18.076 1.00 0.00 H new ATOM 0 HG SER A 119 5.428 -12.228 17.774 1.00 0.00 H new ATOM 1887 N SER A 120 3.557 -8.466 16.251 1.00 0.00 N ATOM 1888 CA SER A 120 2.141 -8.263 15.967 1.00 0.00 C ATOM 1889 C SER A 120 1.889 -8.223 14.463 1.00 0.00 C ATOM 1890 O SER A 120 0.783 -8.503 14.000 1.00 0.00 O ATOM 1891 CB SER A 120 1.652 -6.965 16.612 1.00 0.00 C ATOM 1892 OG SER A 120 0.255 -6.803 16.437 1.00 0.00 O ATOM 0 H SER A 120 3.932 -7.861 16.981 1.00 0.00 H new ATOM 0 HA SER A 120 1.587 -9.102 16.388 1.00 0.00 H new ATOM 0 HB2 SER A 120 1.890 -6.972 17.676 1.00 0.00 H new ATOM 0 HB3 SER A 120 2.177 -6.117 16.173 1.00 0.00 H new ATOM 0 HG SER A 120 -0.033 -5.967 16.859 1.00 0.00 H new ATOM 1898 N TYR A 121 2.922 -7.873 13.705 1.00 0.00 N ATOM 1899 CA TYR A 121 2.813 -7.794 12.254 1.00 0.00 C ATOM 1900 C TYR A 121 2.199 -9.069 11.683 1.00 0.00 C ATOM 1901 O TYR A 121 1.100 -9.049 11.128 1.00 0.00 O ATOM 1902 CB TYR A 121 4.189 -7.554 11.630 1.00 0.00 C ATOM 1903 CG TYR A 121 4.253 -7.890 10.157 1.00 0.00 C ATOM 1904 CD1 TYR A 121 3.743 -7.018 9.203 1.00 0.00 C ATOM 1905 CD2 TYR A 121 4.826 -9.078 9.720 1.00 0.00 C ATOM 1906 CE1 TYR A 121 3.799 -7.321 7.856 1.00 0.00 C ATOM 1907 CE2 TYR A 121 4.887 -9.388 8.375 1.00 0.00 C ATOM 1908 CZ TYR A 121 4.372 -8.507 7.447 1.00 0.00 C ATOM 1909 OH TYR A 121 4.431 -8.812 6.107 1.00 0.00 O ATOM 0 H TYR A 121 3.845 -7.639 14.072 1.00 0.00 H new ATOM 0 HA TYR A 121 2.159 -6.957 12.010 1.00 0.00 H new ATOM 0 HB2 TYR A 121 4.464 -6.508 11.768 1.00 0.00 H new ATOM 0 HB3 TYR A 121 4.929 -8.151 12.163 1.00 0.00 H new ATOM 0 HD1 TYR A 121 3.295 -6.088 9.520 1.00 0.00 H new ATOM 0 HD2 TYR A 121 5.230 -9.770 10.444 1.00 0.00 H new ATOM 0 HE1 TYR A 121 3.396 -6.633 7.127 1.00 0.00 H new ATOM 0 HE2 TYR A 121 5.336 -10.316 8.052 1.00 0.00 H new ATOM 0 HH TYR A 121 4.866 -9.682 5.988 1.00 0.00 H new ATOM 1919 N THR A 122 2.917 -10.178 11.824 1.00 0.00 N ATOM 1920 CA THR A 122 2.445 -11.463 11.324 1.00 0.00 C ATOM 1921 C THR A 122 1.023 -11.748 11.794 1.00 0.00 C ATOM 1922 O THR A 122 0.255 -12.421 11.107 1.00 0.00 O ATOM 1923 CB THR A 122 3.364 -12.614 11.776 1.00 0.00 C ATOM 1924 OG1 THR A 122 3.208 -13.738 10.902 1.00 0.00 O ATOM 1925 CG2 THR A 122 3.047 -13.029 13.205 1.00 0.00 C ATOM 0 H THR A 122 3.828 -10.212 12.281 1.00 0.00 H new ATOM 0 HA THR A 122 2.459 -11.403 10.236 1.00 0.00 H new ATOM 0 HB THR A 122 4.395 -12.264 11.736 1.00 0.00 H new ATOM 0 HG1 THR A 122 3.796 -14.465 11.195 1.00 0.00 H new ATOM 0 HG21 THR A 122 3.708 -13.843 13.503 1.00 0.00 H new ATOM 0 HG22 THR A 122 3.194 -12.179 13.872 1.00 0.00 H new ATOM 0 HG23 THR A 122 2.011 -13.362 13.266 1.00 0.00 H new ATOM 1933 N SER A 123 0.679 -11.231 12.969 1.00 0.00 N ATOM 1934 CA SER A 123 -0.651 -11.432 13.532 1.00 0.00 C ATOM 1935 C SER A 123 -1.730 -10.965 12.560 1.00 0.00 C ATOM 1936 O SER A 123 -2.839 -11.497 12.545 1.00 0.00 O ATOM 1937 CB SER A 123 -0.785 -10.682 14.859 1.00 0.00 C ATOM 1938 OG SER A 123 -1.743 -11.300 15.700 1.00 0.00 O ATOM 0 H SER A 123 1.303 -10.670 13.549 1.00 0.00 H new ATOM 0 HA SER A 123 -0.785 -12.499 13.710 1.00 0.00 H new ATOM 0 HB2 SER A 123 0.181 -10.653 15.363 1.00 0.00 H new ATOM 0 HB3 SER A 123 -1.076 -9.649 14.669 1.00 0.00 H new ATOM 0 HG SER A 123 -1.809 -10.803 16.542 1.00 0.00 H new ATOM 1944 N GLU A 124 -1.394 -9.966 11.749 1.00 0.00 N ATOM 1945 CA GLU A 124 -2.335 -9.427 10.774 1.00 0.00 C ATOM 1946 C GLU A 124 -2.349 -10.275 9.505 1.00 0.00 C ATOM 1947 O GLU A 124 -3.411 -10.654 9.011 1.00 0.00 O ATOM 1948 CB GLU A 124 -1.972 -7.981 10.429 1.00 0.00 C ATOM 1949 CG GLU A 124 -2.605 -6.957 11.357 1.00 0.00 C ATOM 1950 CD GLU A 124 -2.182 -7.139 12.802 1.00 0.00 C ATOM 1951 OE1 GLU A 124 -2.538 -8.176 13.399 1.00 0.00 O ATOM 1952 OE2 GLU A 124 -1.493 -6.244 13.335 1.00 0.00 O ATOM 0 H GLU A 124 -0.479 -9.515 11.748 1.00 0.00 H new ATOM 0 HA GLU A 124 -3.331 -9.450 11.217 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -0.888 -7.869 10.463 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -2.282 -7.772 9.405 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -2.332 -5.955 11.026 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -3.690 -7.031 11.288 1.00 0.00 H new ATOM 1959 N VAL A 125 -1.163 -10.569 8.983 1.00 0.00 N ATOM 1960 CA VAL A 125 -1.038 -11.372 7.773 1.00 0.00 C ATOM 1961 C VAL A 125 -1.857 -12.654 7.877 1.00 0.00 C ATOM 1962 O VAL A 125 -2.542 -13.043 6.931 1.00 0.00 O ATOM 1963 CB VAL A 125 0.431 -11.737 7.490 1.00 0.00 C ATOM 1964 CG1 VAL A 125 0.561 -12.424 6.139 1.00 0.00 C ATOM 1965 CG2 VAL A 125 1.309 -10.496 7.552 1.00 0.00 C ATOM 0 H VAL A 125 -0.274 -10.263 9.379 1.00 0.00 H new ATOM 0 HA VAL A 125 -1.419 -10.766 6.951 1.00 0.00 H new ATOM 0 HB VAL A 125 0.768 -12.433 8.258 1.00 0.00 H new ATOM 0 HG11 VAL A 125 1.606 -12.674 5.957 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -0.036 -13.336 6.136 1.00 0.00 H new ATOM 0 HG13 VAL A 125 0.206 -11.755 5.355 1.00 0.00 H new ATOM 0 HG21 VAL A 125 2.344 -10.772 7.350 1.00 0.00 H new ATOM 0 HG22 VAL A 125 0.973 -9.775 6.806 1.00 0.00 H new ATOM 0 HG23 VAL A 125 1.240 -10.050 8.544 1.00 0.00 H new ATOM 1975 N GLN A 126 -1.781 -13.306 9.033 1.00 0.00 N ATOM 1976 CA GLN A 126 -2.516 -14.545 9.261 1.00 0.00 C ATOM 1977 C GLN A 126 -4.018 -14.284 9.316 1.00 0.00 C ATOM 1978 O GLN A 126 -4.778 -14.807 8.502 1.00 0.00 O ATOM 1979 CB GLN A 126 -2.052 -15.206 10.560 1.00 0.00 C ATOM 1980 CG GLN A 126 -0.540 -15.276 10.701 1.00 0.00 C ATOM 1981 CD GLN A 126 0.044 -16.535 10.092 1.00 0.00 C ATOM 1982 OE1 GLN A 126 -0.669 -17.508 9.844 1.00 0.00 O ATOM 1983 NE2 GLN A 126 1.350 -16.524 9.848 1.00 0.00 N ATOM 0 H GLN A 126 -1.218 -12.997 9.826 1.00 0.00 H new ATOM 0 HA GLN A 126 -2.313 -15.218 8.428 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -2.462 -14.654 11.406 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -2.460 -16.215 10.610 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -0.093 -14.404 10.223 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -0.275 -15.231 11.757 1.00 0.00 H new ATOM 0 HE21 GLN A 126 1.903 -15.696 10.069 1.00 0.00 H new ATOM 0 HE22 GLN A 126 1.799 -17.343 9.439 1.00 0.00 H new ATOM 1992 N ALA A 127 -4.437 -13.474 10.282 1.00 0.00 N ATOM 1993 CA ALA A 127 -5.848 -13.143 10.442 1.00 0.00 C ATOM 1994 C ALA A 127 -6.487 -12.798 9.101 1.00 0.00 C ATOM 1995 O ALA A 127 -7.583 -13.263 8.788 1.00 0.00 O ATOM 1996 CB ALA A 127 -6.012 -11.989 11.420 1.00 0.00 C ATOM 0 H ALA A 127 -3.820 -13.035 10.965 1.00 0.00 H new ATOM 0 HA ALA A 127 -6.358 -14.019 10.842 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -7.070 -11.753 11.530 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -5.601 -12.272 12.389 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -5.482 -11.114 11.043 1.00 0.00 H new ATOM 2002 N ILE A 128 -5.796 -11.981 8.315 1.00 0.00 N ATOM 2003 CA ILE A 128 -6.296 -11.574 7.008 1.00 0.00 C ATOM 2004 C ILE A 128 -6.485 -12.779 6.092 1.00 0.00 C ATOM 2005 O ILE A 128 -7.592 -13.051 5.625 1.00 0.00 O ATOM 2006 CB ILE A 128 -5.346 -10.571 6.328 1.00 0.00 C ATOM 2007 CG1 ILE A 128 -5.209 -9.307 7.179 1.00 0.00 C ATOM 2008 CG2 ILE A 128 -5.849 -10.226 4.934 1.00 0.00 C ATOM 2009 CD1 ILE A 128 -3.921 -8.552 6.936 1.00 0.00 C ATOM 0 H ILE A 128 -4.888 -11.587 8.560 1.00 0.00 H new ATOM 0 HA ILE A 128 -7.259 -11.093 7.175 1.00 0.00 H new ATOM 0 HB ILE A 128 -4.362 -11.031 6.234 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -6.052 -8.647 6.973 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -5.268 -9.580 8.233 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -5.167 -9.516 4.466 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -5.899 -11.132 4.331 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -6.842 -9.782 5.005 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -3.892 -7.668 7.573 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -3.073 -9.195 7.169 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -3.869 -8.248 5.891 1.00 0.00 H new ATOM 2021 N LEU A 129 -5.398 -13.500 5.841 1.00 0.00 N ATOM 2022 CA LEU A 129 -5.444 -14.679 4.983 1.00 0.00 C ATOM 2023 C LEU A 129 -6.695 -15.506 5.259 1.00 0.00 C ATOM 2024 O LEU A 129 -7.394 -15.920 4.334 1.00 0.00 O ATOM 2025 CB LEU A 129 -4.195 -15.537 5.195 1.00 0.00 C ATOM 2026 CG LEU A 129 -2.895 -14.988 4.606 1.00 0.00 C ATOM 2027 CD1 LEU A 129 -1.694 -15.709 5.199 1.00 0.00 C ATOM 2028 CD2 LEU A 129 -2.901 -15.116 3.090 1.00 0.00 C ATOM 0 H LEU A 129 -4.474 -13.289 6.219 1.00 0.00 H new ATOM 0 HA LEU A 129 -5.475 -14.342 3.947 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -4.054 -15.679 6.266 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -4.378 -16.522 4.765 1.00 0.00 H new ATOM 0 HG LEU A 129 -2.821 -13.931 4.861 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -0.778 -15.305 4.768 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -1.681 -15.566 6.279 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -1.762 -16.774 4.975 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -1.968 -14.720 2.688 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -2.999 -16.166 2.814 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -3.740 -14.553 2.681 1.00 0.00 H new ATOM 2040 N ALA A 130 -6.974 -15.740 6.537 1.00 0.00 N ATOM 2041 CA ALA A 130 -8.144 -16.513 6.935 1.00 0.00 C ATOM 2042 C ALA A 130 -9.430 -15.734 6.679 1.00 0.00 C ATOM 2043 O ALA A 130 -10.284 -16.165 5.904 1.00 0.00 O ATOM 2044 CB ALA A 130 -8.045 -16.903 8.402 1.00 0.00 C ATOM 0 H ALA A 130 -6.405 -15.405 7.315 1.00 0.00 H new ATOM 0 HA ALA A 130 -8.172 -17.419 6.330 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -8.925 -17.480 8.685 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -7.150 -17.506 8.559 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -7.988 -16.003 9.015 1.00 0.00 H new ATOM 2050 N PHE A 131 -9.561 -14.585 7.334 1.00 0.00 N ATOM 2051 CA PHE A 131 -10.744 -13.747 7.178 1.00 0.00 C ATOM 2052 C PHE A 131 -11.222 -13.744 5.729 1.00 0.00 C ATOM 2053 O PHE A 131 -12.399 -13.976 5.451 1.00 0.00 O ATOM 2054 CB PHE A 131 -10.445 -12.317 7.631 1.00 0.00 C ATOM 2055 CG PHE A 131 -11.550 -11.347 7.325 1.00 0.00 C ATOM 2056 CD1 PHE A 131 -12.806 -11.507 7.889 1.00 0.00 C ATOM 2057 CD2 PHE A 131 -11.334 -10.276 6.472 1.00 0.00 C ATOM 2058 CE1 PHE A 131 -13.825 -10.616 7.609 1.00 0.00 C ATOM 2059 CE2 PHE A 131 -12.350 -9.382 6.190 1.00 0.00 C ATOM 2060 CZ PHE A 131 -13.597 -9.553 6.758 1.00 0.00 C ATOM 0 H PHE A 131 -8.863 -14.213 7.978 1.00 0.00 H new ATOM 0 HA PHE A 131 -11.536 -14.161 7.802 1.00 0.00 H new ATOM 0 HB2 PHE A 131 -10.259 -12.316 8.705 1.00 0.00 H new ATOM 0 HB3 PHE A 131 -9.529 -11.976 7.149 1.00 0.00 H new ATOM 0 HD1 PHE A 131 -12.991 -12.337 8.555 1.00 0.00 H new ATOM 0 HD2 PHE A 131 -10.361 -10.138 6.023 1.00 0.00 H new ATOM 0 HE1 PHE A 131 -14.799 -10.751 8.056 1.00 0.00 H new ATOM 0 HE2 PHE A 131 -12.169 -8.550 5.526 1.00 0.00 H new ATOM 0 HZ PHE A 131 -14.392 -8.857 6.537 1.00 0.00 H new ATOM 2070 N LEU A 132 -10.300 -13.480 4.809 1.00 0.00 N ATOM 2071 CA LEU A 132 -10.626 -13.446 3.388 1.00 0.00 C ATOM 2072 C LEU A 132 -11.439 -14.673 2.986 1.00 0.00 C ATOM 2073 O LEU A 132 -12.462 -14.558 2.311 1.00 0.00 O ATOM 2074 CB LEU A 132 -9.346 -13.373 2.553 1.00 0.00 C ATOM 2075 CG LEU A 132 -8.507 -12.105 2.720 1.00 0.00 C ATOM 2076 CD1 LEU A 132 -7.102 -12.320 2.180 1.00 0.00 C ATOM 2077 CD2 LEU A 132 -9.174 -10.929 2.023 1.00 0.00 C ATOM 0 H LEU A 132 -9.321 -13.287 5.022 1.00 0.00 H new ATOM 0 HA LEU A 132 -11.227 -12.557 3.200 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -8.723 -14.232 2.803 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -9.616 -13.470 1.501 1.00 0.00 H new ATOM 0 HG LEU A 132 -8.434 -11.878 3.784 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -6.520 -11.407 2.307 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -6.624 -13.134 2.724 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -7.154 -12.572 1.121 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -8.563 -10.035 2.152 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -9.278 -11.147 0.960 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -10.160 -10.761 2.457 1.00 0.00 H new ATOM 2089 N SER A 133 -10.977 -15.846 3.407 1.00 0.00 N ATOM 2090 CA SER A 133 -11.661 -17.095 3.090 1.00 0.00 C ATOM 2091 C SER A 133 -13.130 -17.028 3.496 1.00 0.00 C ATOM 2092 O SER A 133 -14.016 -17.414 2.732 1.00 0.00 O ATOM 2093 CB SER A 133 -10.978 -18.268 3.794 1.00 0.00 C ATOM 2094 OG SER A 133 -11.228 -19.486 3.115 1.00 0.00 O ATOM 0 H SER A 133 -10.133 -15.958 3.968 1.00 0.00 H new ATOM 0 HA SER A 133 -11.607 -17.247 2.012 1.00 0.00 H new ATOM 0 HB2 SER A 133 -9.904 -18.090 3.845 1.00 0.00 H new ATOM 0 HB3 SER A 133 -11.338 -18.340 4.820 1.00 0.00 H new ATOM 0 HG SER A 133 -10.779 -20.220 3.584 1.00 0.00 H new ATOM 2100 N LEU A 134 -13.381 -16.536 4.704 1.00 0.00 N ATOM 2101 CA LEU A 134 -14.743 -16.418 5.214 1.00 0.00 C ATOM 2102 C LEU A 134 -15.622 -15.637 4.243 1.00 0.00 C ATOM 2103 O LEU A 134 -16.762 -16.019 3.980 1.00 0.00 O ATOM 2104 CB LEU A 134 -14.739 -15.731 6.581 1.00 0.00 C ATOM 2105 CG LEU A 134 -13.750 -16.285 7.608 1.00 0.00 C ATOM 2106 CD1 LEU A 134 -13.719 -15.405 8.848 1.00 0.00 C ATOM 2107 CD2 LEU A 134 -14.110 -17.717 7.976 1.00 0.00 C ATOM 0 H LEU A 134 -12.660 -16.212 5.349 1.00 0.00 H new ATOM 0 HA LEU A 134 -15.153 -17.422 5.320 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -14.523 -14.673 6.433 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -15.743 -15.796 7.001 1.00 0.00 H new ATOM 0 HG LEU A 134 -12.755 -16.285 7.163 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -13.010 -15.815 9.567 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -13.413 -14.396 8.571 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -14.712 -15.372 9.296 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -13.396 -18.095 8.708 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -15.113 -17.742 8.402 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -14.079 -18.341 7.083 1.00 0.00 H new