USER MOD reduce.3.24.130724 H: found=0, std=0, add=661, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 660 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 65 LYS NZ :NH3+ 161:sc= 0.641 (180deg=-0.136) USER MOD Set 1.2: A 124 GLN : amide:sc= 0.578 K(o=1.2,f=-3) USER MOD Set 2.1: A 101 MET CE :methyl -170:sc= -5.16! (180deg=-5.86!) USER MOD Set 2.2: A 110 MET CE :methyl -177:sc= -0.576 (180deg=-0.6) USER MOD Single : A 58 SER OG : rot 180:sc= 0.346 USER MOD Single : A 62 HIS : no HE2:sc= -1.24 K(o=-1.2,f=-5.5!) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0.00126 USER MOD Single : A 77 SER OG : rot 80:sc= 1.21 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0.324 K(o=0.32,f=-0.5) USER MOD Single : A 90 MET CE :methyl 172:sc= 0 (180deg=-0.0271) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= 1.05 K(o=1,f=0) USER MOD Single : A 96 GLN : amide:sc= -0.425 K(o=-0.43,f=-1.2) USER MOD Single : A 102 ASN :FLIP amide:sc= -0.0179 F(o=-0.58,f=-0.018) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.806 USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 ASN : amide:sc= 0.373 X(o=0.37,f=-0.00014) USER MOD Single : A 113 TYR OH : rot -135:sc= 0.0185 USER MOD Single : A 114 TYR OH : rot 180:sc= -0.228 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 SER OG : rot 180:sc= 0.528 USER MOD Single : A 132 ASN : amide:sc= 0 X(o=0,f=-0.093) USER MOD Single : A 133 HIS : no HD1:sc= -0.299 X(o=-0.3,f=0.049) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 113 N SER A 58 -7.138 10.213 -1.006 1.00 0.00 N ATOM 114 CA SER A 58 -6.569 10.902 -2.178 1.00 0.00 C ATOM 115 C SER A 58 -5.481 10.057 -2.869 1.00 0.00 C ATOM 116 O SER A 58 -5.477 8.834 -2.753 1.00 0.00 O ATOM 117 CB SER A 58 -6.071 12.299 -1.764 1.00 0.00 C ATOM 118 OG SER A 58 -5.842 13.123 -2.895 1.00 0.00 O ATOM 0 HA SER A 58 -7.351 11.034 -2.926 1.00 0.00 H new ATOM 0 HB2 SER A 58 -6.806 12.770 -1.111 1.00 0.00 H new ATOM 0 HB3 SER A 58 -5.150 12.203 -1.189 1.00 0.00 H new ATOM 0 HG SER A 58 -5.528 14.003 -2.600 1.00 0.00 H new ATOM 124 N ARG A 59 -4.587 10.702 -3.628 1.00 0.00 N ATOM 125 CA ARG A 59 -3.608 10.184 -4.602 1.00 0.00 C ATOM 126 C ARG A 59 -2.733 8.975 -4.217 1.00 0.00 C ATOM 127 O ARG A 59 -2.242 8.325 -5.144 1.00 0.00 O ATOM 128 CB ARG A 59 -2.702 11.353 -5.006 1.00 0.00 C ATOM 129 CG ARG A 59 -3.345 12.321 -6.020 1.00 0.00 C ATOM 130 CD ARG A 59 -2.716 13.716 -5.915 1.00 0.00 C ATOM 131 NE ARG A 59 -1.241 13.659 -5.915 1.00 0.00 N ATOM 132 CZ ARG A 59 -0.365 14.313 -6.648 1.00 0.00 C ATOM 133 NH1 ARG A 59 -0.696 15.227 -7.515 1.00 0.00 N ATOM 134 NH2 ARG A 59 0.893 14.033 -6.501 1.00 0.00 N ATOM 0 H ARG A 59 -4.522 11.718 -3.570 1.00 0.00 H new ATOM 0 HA ARG A 59 -4.222 9.775 -5.404 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -2.425 11.911 -4.112 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -1.781 10.955 -5.432 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -3.216 11.934 -7.031 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -4.418 12.386 -5.838 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -3.055 14.330 -6.749 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -3.060 14.201 -5.001 1.00 0.00 H new ATOM 0 HE ARG A 59 -0.837 13.010 -5.240 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -1.678 15.468 -7.653 1.00 0.00 H new ATOM 0 HH12 ARG A 59 0.026 15.702 -8.056 1.00 0.00 H new ATOM 0 HH21 ARG A 59 1.182 13.321 -5.830 1.00 0.00 H new ATOM 0 HH22 ARG A 59 1.593 14.525 -7.056 1.00 0.00 H new ATOM 148 N VAL A 60 -2.532 8.633 -2.936 1.00 0.00 N ATOM 149 CA VAL A 60 -1.809 7.401 -2.544 1.00 0.00 C ATOM 150 C VAL A 60 -2.741 6.218 -2.294 1.00 0.00 C ATOM 151 O VAL A 60 -3.724 6.309 -1.567 1.00 0.00 O ATOM 152 CB VAL A 60 -0.723 7.590 -1.473 1.00 0.00 C ATOM 153 CG1 VAL A 60 -1.099 8.191 -0.130 1.00 0.00 C ATOM 154 CG2 VAL A 60 0.056 6.299 -1.265 1.00 0.00 C ATOM 0 H VAL A 60 -2.859 9.191 -2.147 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.228 7.135 -3.427 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.116 8.379 -1.918 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.213 8.251 0.502 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.507 9.191 -0.280 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -1.847 7.563 0.353 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.820 6.454 -0.503 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -0.625 5.511 -0.942 1.00 0.00 H new ATOM 0 HG23 VAL A 60 0.531 6.006 -2.201 1.00 0.00 H new ATOM 164 N ILE A 61 -2.411 5.081 -2.900 1.00 0.00 N ATOM 165 CA ILE A 61 -2.970 3.747 -2.649 1.00 0.00 C ATOM 166 C ILE A 61 -1.938 2.932 -1.864 1.00 0.00 C ATOM 167 O ILE A 61 -0.748 3.216 -1.927 1.00 0.00 O ATOM 168 CB ILE A 61 -3.315 3.114 -4.013 1.00 0.00 C ATOM 169 CG1 ILE A 61 -4.506 3.865 -4.647 1.00 0.00 C ATOM 170 CG2 ILE A 61 -3.597 1.600 -4.002 1.00 0.00 C ATOM 171 CD1 ILE A 61 -4.423 3.802 -6.166 1.00 0.00 C ATOM 0 H ILE A 61 -1.698 5.061 -3.629 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.882 3.784 -2.053 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.409 3.221 -4.609 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.444 3.425 -4.309 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.505 4.904 -4.319 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.828 1.265 -5.013 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -2.718 1.069 -3.636 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.445 1.393 -3.349 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.269 4.336 -6.599 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.494 4.264 -6.499 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.447 2.761 -6.489 1.00 0.00 H new ATOM 183 N HIS A 62 -2.375 1.909 -1.141 1.00 0.00 N ATOM 184 CA HIS A 62 -1.543 0.992 -0.378 1.00 0.00 C ATOM 185 C HIS A 62 -1.762 -0.454 -0.856 1.00 0.00 C ATOM 186 O HIS A 62 -2.889 -0.876 -1.124 1.00 0.00 O ATOM 187 CB HIS A 62 -1.828 1.208 1.116 1.00 0.00 C ATOM 188 CG HIS A 62 -1.541 0.028 1.995 1.00 0.00 C ATOM 189 ND1 HIS A 62 -2.235 -1.165 2.003 1.00 0.00 N ATOM 190 CD2 HIS A 62 -0.645 -0.005 3.022 1.00 0.00 C ATOM 191 CE1 HIS A 62 -1.743 -1.915 2.998 1.00 0.00 C ATOM 192 NE2 HIS A 62 -0.779 -1.248 3.646 1.00 0.00 N ATOM 0 H HIS A 62 -3.368 1.687 -1.068 1.00 0.00 H new ATOM 0 HA HIS A 62 -0.483 1.191 -0.540 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -1.235 2.054 1.465 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -2.876 1.483 1.234 1.00 0.00 H new ATOM 0 HD1 HIS A 62 -2.987 -1.428 1.366 1.00 0.00 H new ATOM 0 HD2 HIS A 62 0.040 0.782 3.301 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -2.076 -2.913 3.242 1.00 0.00 H new ATOM 200 N ILE A 63 -0.671 -1.218 -0.920 1.00 0.00 N ATOM 201 CA ILE A 63 -0.570 -2.598 -1.409 1.00 0.00 C ATOM 202 C ILE A 63 -0.045 -3.490 -0.270 1.00 0.00 C ATOM 203 O ILE A 63 0.853 -3.078 0.466 1.00 0.00 O ATOM 204 CB ILE A 63 0.373 -2.696 -2.639 1.00 0.00 C ATOM 205 CG1 ILE A 63 0.295 -1.484 -3.604 1.00 0.00 C ATOM 206 CG2 ILE A 63 0.093 -4.010 -3.391 1.00 0.00 C ATOM 207 CD1 ILE A 63 1.279 -1.555 -4.783 1.00 0.00 C ATOM 0 H ILE A 63 0.234 -0.864 -0.609 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.558 -2.932 -1.725 1.00 0.00 H new ATOM 0 HB ILE A 63 1.392 -2.685 -2.252 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -0.720 -1.410 -3.996 1.00 0.00 H new ATOM 0 HG13 ILE A 63 0.486 -0.571 -3.040 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.753 -4.082 -4.255 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.272 -4.855 -2.726 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -0.945 -4.024 -3.725 1.00 0.00 H new ATOM 0 HD11 ILE A 63 1.161 -0.671 -5.409 1.00 0.00 H new ATOM 0 HD12 ILE A 63 2.300 -1.596 -4.403 1.00 0.00 H new ATOM 0 HD13 ILE A 63 1.075 -2.448 -5.374 1.00 0.00 H new ATOM 219 N ARG A 64 -0.566 -4.713 -0.140 1.00 0.00 N ATOM 220 CA ARG A 64 -0.140 -5.734 0.848 1.00 0.00 C ATOM 221 C ARG A 64 0.448 -6.975 0.150 1.00 0.00 C ATOM 222 O ARG A 64 0.692 -6.940 -1.053 1.00 0.00 O ATOM 223 CB ARG A 64 -1.253 -6.026 1.896 1.00 0.00 C ATOM 224 CG ARG A 64 -2.619 -5.364 1.638 1.00 0.00 C ATOM 225 CD ARG A 64 -3.732 -5.670 2.646 1.00 0.00 C ATOM 226 NE ARG A 64 -4.969 -4.982 2.211 1.00 0.00 N ATOM 227 CZ ARG A 64 -6.193 -5.472 2.118 1.00 0.00 C ATOM 228 NH1 ARG A 64 -6.507 -6.621 2.636 1.00 0.00 N ATOM 229 NH2 ARG A 64 -7.133 -4.806 1.511 1.00 0.00 N ATOM 0 H ARG A 64 -1.325 -5.041 -0.737 1.00 0.00 H new ATOM 0 HA ARG A 64 0.682 -5.330 1.439 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -1.399 -7.105 1.949 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -0.896 -5.704 2.874 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -2.474 -4.284 1.608 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -2.963 -5.667 0.649 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -3.900 -6.745 2.709 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -3.443 -5.334 3.642 1.00 0.00 H new ATOM 0 HE ARG A 64 -4.863 -4.002 1.949 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -5.801 -7.168 3.129 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -7.459 -6.976 2.550 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -6.929 -3.895 1.100 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -8.074 -5.195 1.446 1.00 0.00 H new ATOM 243 N LYS A 65 0.722 -8.052 0.904 1.00 0.00 N ATOM 244 CA LYS A 65 1.084 -9.418 0.440 1.00 0.00 C ATOM 245 C LYS A 65 2.254 -9.541 -0.560 1.00 0.00 C ATOM 246 O LYS A 65 2.458 -10.615 -1.134 1.00 0.00 O ATOM 247 CB LYS A 65 -0.177 -10.125 -0.105 1.00 0.00 C ATOM 248 CG LYS A 65 -1.440 -9.966 0.750 1.00 0.00 C ATOM 249 CD LYS A 65 -1.366 -10.381 2.226 1.00 0.00 C ATOM 250 CE LYS A 65 -1.774 -11.842 2.475 1.00 0.00 C ATOM 251 NZ LYS A 65 -0.760 -12.823 2.002 1.00 0.00 N ATOM 0 H LYS A 65 0.697 -7.997 1.922 1.00 0.00 H new ATOM 0 HA LYS A 65 1.474 -9.911 1.330 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -0.384 -9.742 -1.104 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.039 -11.188 -0.209 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -1.740 -8.919 0.712 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -2.237 -10.543 0.280 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -0.349 -10.230 2.587 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -2.012 -9.727 2.812 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -1.942 -11.989 3.542 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -2.722 -12.038 1.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -0.920 -13.739 2.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -0.843 -12.938 0.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 0.193 -12.478 2.236 1.00 0.00 H new ATOM 265 N LEU A 66 3.024 -8.477 -0.776 1.00 0.00 N ATOM 266 CA LEU A 66 4.118 -8.420 -1.751 1.00 0.00 C ATOM 267 C LEU A 66 5.256 -9.414 -1.447 1.00 0.00 C ATOM 268 O LEU A 66 5.470 -9.775 -0.285 1.00 0.00 O ATOM 269 CB LEU A 66 4.694 -6.984 -1.821 1.00 0.00 C ATOM 270 CG LEU A 66 3.783 -5.932 -2.482 1.00 0.00 C ATOM 271 CD1 LEU A 66 4.562 -4.645 -2.707 1.00 0.00 C ATOM 272 CD2 LEU A 66 3.378 -6.357 -3.883 1.00 0.00 C ATOM 0 H LEU A 66 2.903 -7.603 -0.264 1.00 0.00 H new ATOM 0 HA LEU A 66 3.690 -8.706 -2.712 1.00 0.00 H new ATOM 0 HB2 LEU A 66 4.924 -6.654 -0.808 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.637 -7.016 -2.367 1.00 0.00 H new ATOM 0 HG LEU A 66 2.923 -5.812 -1.823 1.00 0.00 H new ATOM 0 HD11 LEU A 66 3.913 -3.904 -3.175 1.00 0.00 H new ATOM 0 HD12 LEU A 66 4.918 -4.263 -1.750 1.00 0.00 H new ATOM 0 HD13 LEU A 66 5.414 -4.844 -3.358 1.00 0.00 H new ATOM 0 HD21 LEU A 66 2.736 -5.594 -4.323 1.00 0.00 H new ATOM 0 HD22 LEU A 66 4.270 -6.480 -4.498 1.00 0.00 H new ATOM 0 HD23 LEU A 66 2.838 -7.302 -3.835 1.00 0.00 H new ATOM 284 N PRO A 67 6.042 -9.816 -2.465 1.00 0.00 N ATOM 285 CA PRO A 67 7.352 -10.430 -2.279 1.00 0.00 C ATOM 286 C PRO A 67 8.308 -9.639 -1.374 1.00 0.00 C ATOM 287 O PRO A 67 8.074 -8.496 -0.975 1.00 0.00 O ATOM 288 CB PRO A 67 7.952 -10.599 -3.677 1.00 0.00 C ATOM 289 CG PRO A 67 6.725 -10.658 -4.581 1.00 0.00 C ATOM 290 CD PRO A 67 5.712 -9.753 -3.876 1.00 0.00 C ATOM 0 HA PRO A 67 7.218 -11.379 -1.760 1.00 0.00 H new ATOM 0 HB2 PRO A 67 8.604 -9.766 -3.938 1.00 0.00 H new ATOM 0 HB3 PRO A 67 8.550 -11.507 -3.751 1.00 0.00 H new ATOM 0 HG2 PRO A 67 6.950 -10.301 -5.586 1.00 0.00 H new ATOM 0 HG3 PRO A 67 6.350 -11.677 -4.682 1.00 0.00 H new ATOM 0 HD2 PRO A 67 5.776 -8.730 -4.247 1.00 0.00 H new ATOM 0 HD3 PRO A 67 4.692 -10.094 -4.055 1.00 0.00 H new ATOM 298 N ILE A 68 9.438 -10.281 -1.099 1.00 0.00 N ATOM 299 CA ILE A 68 10.481 -9.855 -0.149 1.00 0.00 C ATOM 300 C ILE A 68 11.252 -8.618 -0.623 1.00 0.00 C ATOM 301 O ILE A 68 11.736 -7.820 0.179 1.00 0.00 O ATOM 302 CB ILE A 68 11.452 -11.031 0.106 1.00 0.00 C ATOM 303 CG1 ILE A 68 12.154 -11.526 -1.185 1.00 0.00 C ATOM 304 CG2 ILE A 68 10.651 -12.166 0.766 1.00 0.00 C ATOM 305 CD1 ILE A 68 13.151 -12.669 -0.957 1.00 0.00 C ATOM 0 H ILE A 68 9.672 -11.163 -1.554 1.00 0.00 H new ATOM 0 HA ILE A 68 9.984 -9.570 0.778 1.00 0.00 H new ATOM 0 HB ILE A 68 12.254 -10.689 0.761 1.00 0.00 H new ATOM 0 HG12 ILE A 68 11.395 -11.856 -1.894 1.00 0.00 H new ATOM 0 HG13 ILE A 68 12.678 -10.688 -1.645 1.00 0.00 H new ATOM 0 HG21 ILE A 68 11.310 -13.012 0.959 1.00 0.00 H new ATOM 0 HG22 ILE A 68 10.228 -11.814 1.707 1.00 0.00 H new ATOM 0 HG23 ILE A 68 9.846 -12.478 0.101 1.00 0.00 H new ATOM 0 HD11 ILE A 68 13.598 -12.957 -1.908 1.00 0.00 H new ATOM 0 HD12 ILE A 68 13.933 -12.339 -0.274 1.00 0.00 H new ATOM 0 HD13 ILE A 68 12.631 -13.525 -0.527 1.00 0.00 H new ATOM 317 N ASP A 69 11.376 -8.486 -1.942 1.00 0.00 N ATOM 318 CA ASP A 69 12.211 -7.515 -2.651 1.00 0.00 C ATOM 319 C ASP A 69 11.671 -7.269 -4.078 1.00 0.00 C ATOM 320 O ASP A 69 12.445 -7.101 -5.023 1.00 0.00 O ATOM 321 CB ASP A 69 13.667 -8.032 -2.643 1.00 0.00 C ATOM 322 CG ASP A 69 14.693 -6.985 -3.123 1.00 0.00 C ATOM 323 OD1 ASP A 69 14.606 -5.803 -2.711 1.00 0.00 O ATOM 324 OD2 ASP A 69 15.631 -7.350 -3.873 1.00 0.00 O ATOM 0 H ASP A 69 10.865 -9.091 -2.585 1.00 0.00 H new ATOM 0 HA ASP A 69 12.185 -6.547 -2.150 1.00 0.00 H new ATOM 0 HB2 ASP A 69 13.927 -8.347 -1.633 1.00 0.00 H new ATOM 0 HB3 ASP A 69 13.735 -8.914 -3.280 1.00 0.00 H new ATOM 329 N VAL A 70 10.338 -7.295 -4.267 1.00 0.00 N ATOM 330 CA VAL A 70 9.717 -6.956 -5.561 1.00 0.00 C ATOM 331 C VAL A 70 10.197 -5.586 -6.061 1.00 0.00 C ATOM 332 O VAL A 70 10.479 -4.691 -5.260 1.00 0.00 O ATOM 333 CB VAL A 70 8.178 -7.039 -5.474 1.00 0.00 C ATOM 334 CG1 VAL A 70 7.477 -5.719 -5.150 1.00 0.00 C ATOM 335 CG2 VAL A 70 7.608 -7.566 -6.785 1.00 0.00 C ATOM 0 H VAL A 70 9.670 -7.548 -3.539 1.00 0.00 H new ATOM 0 HA VAL A 70 10.036 -7.693 -6.298 1.00 0.00 H new ATOM 0 HB VAL A 70 7.984 -7.714 -4.641 1.00 0.00 H new ATOM 0 HG11 VAL A 70 6.400 -5.879 -5.111 1.00 0.00 H new ATOM 0 HG12 VAL A 70 7.825 -5.350 -4.185 1.00 0.00 H new ATOM 0 HG13 VAL A 70 7.707 -4.986 -5.923 1.00 0.00 H new ATOM 0 HG21 VAL A 70 6.522 -7.621 -6.713 1.00 0.00 H new ATOM 0 HG22 VAL A 70 7.885 -6.895 -7.598 1.00 0.00 H new ATOM 0 HG23 VAL A 70 8.009 -8.560 -6.983 1.00 0.00 H new ATOM 345 N THR A 71 10.299 -5.405 -7.379 1.00 0.00 N ATOM 346 CA THR A 71 10.889 -4.180 -7.936 1.00 0.00 C ATOM 347 C THR A 71 9.853 -3.087 -8.144 1.00 0.00 C ATOM 348 O THR A 71 8.746 -3.296 -8.648 1.00 0.00 O ATOM 349 CB THR A 71 11.753 -4.439 -9.179 1.00 0.00 C ATOM 350 OG1 THR A 71 12.220 -3.212 -9.694 1.00 0.00 O ATOM 351 CG2 THR A 71 11.056 -5.178 -10.315 1.00 0.00 C ATOM 0 H THR A 71 9.986 -6.081 -8.076 1.00 0.00 H new ATOM 0 HA THR A 71 11.581 -3.803 -7.182 1.00 0.00 H new ATOM 0 HB THR A 71 12.557 -5.085 -8.827 1.00 0.00 H new ATOM 0 HG1 THR A 71 12.773 -3.379 -10.486 1.00 0.00 H new ATOM 0 HG21 THR A 71 11.752 -5.310 -11.144 1.00 0.00 H new ATOM 0 HG22 THR A 71 10.721 -6.154 -9.963 1.00 0.00 H new ATOM 0 HG23 THR A 71 10.196 -4.599 -10.652 1.00 0.00 H new ATOM 359 N GLU A 72 10.245 -1.874 -7.766 1.00 0.00 N ATOM 360 CA GLU A 72 9.480 -0.667 -8.034 1.00 0.00 C ATOM 361 C GLU A 72 9.169 -0.474 -9.521 1.00 0.00 C ATOM 362 O GLU A 72 8.070 -0.038 -9.862 1.00 0.00 O ATOM 363 CB GLU A 72 10.191 0.562 -7.452 1.00 0.00 C ATOM 364 CG GLU A 72 11.707 0.606 -7.646 1.00 0.00 C ATOM 365 CD GLU A 72 12.297 1.955 -7.185 1.00 0.00 C ATOM 366 OE1 GLU A 72 12.632 2.098 -5.983 1.00 0.00 O ATOM 367 OE2 GLU A 72 12.444 2.873 -8.028 1.00 0.00 O ATOM 0 H GLU A 72 11.113 -1.703 -7.259 1.00 0.00 H new ATOM 0 HA GLU A 72 8.518 -0.785 -7.536 1.00 0.00 H new ATOM 0 HB2 GLU A 72 9.760 1.456 -7.903 1.00 0.00 H new ATOM 0 HB3 GLU A 72 9.979 0.610 -6.384 1.00 0.00 H new ATOM 0 HG2 GLU A 72 12.170 -0.206 -7.085 1.00 0.00 H new ATOM 0 HG3 GLU A 72 11.945 0.444 -8.697 1.00 0.00 H new ATOM 374 N GLY A 73 10.093 -0.883 -10.396 1.00 0.00 N ATOM 375 CA GLY A 73 9.906 -0.935 -11.849 1.00 0.00 C ATOM 376 C GLY A 73 8.681 -1.752 -12.273 1.00 0.00 C ATOM 377 O GLY A 73 7.935 -1.346 -13.162 1.00 0.00 O ATOM 0 H GLY A 73 11.019 -1.196 -10.104 1.00 0.00 H new ATOM 0 HA2 GLY A 73 9.807 0.081 -12.232 1.00 0.00 H new ATOM 0 HA3 GLY A 73 10.797 -1.364 -12.308 1.00 0.00 H new ATOM 381 N GLU A 74 8.431 -2.885 -11.613 1.00 0.00 N ATOM 382 CA GLU A 74 7.220 -3.693 -11.797 1.00 0.00 C ATOM 383 C GLU A 74 5.987 -2.945 -11.300 1.00 0.00 C ATOM 384 O GLU A 74 5.007 -2.800 -12.032 1.00 0.00 O ATOM 385 CB GLU A 74 7.359 -5.070 -11.109 1.00 0.00 C ATOM 386 CG GLU A 74 7.869 -6.115 -12.104 1.00 0.00 C ATOM 387 CD GLU A 74 7.850 -7.534 -11.506 1.00 0.00 C ATOM 388 OE1 GLU A 74 8.685 -7.841 -10.620 1.00 0.00 O ATOM 389 OE2 GLU A 74 7.009 -8.364 -11.933 1.00 0.00 O ATOM 0 H GLU A 74 9.074 -3.275 -10.924 1.00 0.00 H new ATOM 0 HA GLU A 74 7.093 -3.872 -12.865 1.00 0.00 H new ATOM 0 HB2 GLU A 74 8.047 -4.995 -10.267 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.395 -5.382 -10.707 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.253 -6.092 -13.003 1.00 0.00 H new ATOM 0 HG3 GLU A 74 8.885 -5.862 -12.407 1.00 0.00 H new ATOM 396 N VAL A 75 6.046 -2.438 -10.067 1.00 0.00 N ATOM 397 CA VAL A 75 4.916 -1.771 -9.406 1.00 0.00 C ATOM 398 C VAL A 75 4.401 -0.550 -10.192 1.00 0.00 C ATOM 399 O VAL A 75 3.200 -0.456 -10.462 1.00 0.00 O ATOM 400 CB VAL A 75 5.265 -1.473 -7.936 1.00 0.00 C ATOM 401 CG1 VAL A 75 4.141 -0.725 -7.215 1.00 0.00 C ATOM 402 CG2 VAL A 75 5.505 -2.801 -7.194 1.00 0.00 C ATOM 0 H VAL A 75 6.887 -2.478 -9.491 1.00 0.00 H new ATOM 0 HA VAL A 75 4.067 -2.454 -9.399 1.00 0.00 H new ATOM 0 HB VAL A 75 6.156 -0.845 -7.934 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.433 -0.537 -6.182 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.955 0.224 -7.718 1.00 0.00 H new ATOM 0 HG13 VAL A 75 3.233 -1.328 -7.231 1.00 0.00 H new ATOM 0 HG21 VAL A 75 5.753 -2.596 -6.152 1.00 0.00 H new ATOM 0 HG22 VAL A 75 4.603 -3.411 -7.239 1.00 0.00 H new ATOM 0 HG23 VAL A 75 6.330 -3.337 -7.664 1.00 0.00 H new ATOM 412 N ILE A 76 5.266 0.371 -10.638 1.00 0.00 N ATOM 413 CA ILE A 76 4.816 1.525 -11.429 1.00 0.00 C ATOM 414 C ILE A 76 4.585 1.225 -12.910 1.00 0.00 C ATOM 415 O ILE A 76 3.748 1.890 -13.512 1.00 0.00 O ATOM 416 CB ILE A 76 5.682 2.784 -11.252 1.00 0.00 C ATOM 417 CG1 ILE A 76 6.803 3.042 -12.280 1.00 0.00 C ATOM 418 CG2 ILE A 76 6.170 2.938 -9.809 1.00 0.00 C ATOM 419 CD1 ILE A 76 7.839 1.932 -12.322 1.00 0.00 C ATOM 0 H ILE A 76 6.271 0.341 -10.467 1.00 0.00 H new ATOM 0 HA ILE A 76 3.839 1.747 -11.000 1.00 0.00 H new ATOM 0 HB ILE A 76 4.980 3.585 -11.486 1.00 0.00 H new ATOM 0 HG12 ILE A 76 6.361 3.156 -13.270 1.00 0.00 H new ATOM 0 HG13 ILE A 76 7.297 3.984 -12.041 1.00 0.00 H new ATOM 0 HG21 ILE A 76 6.778 3.839 -9.725 1.00 0.00 H new ATOM 0 HG22 ILE A 76 5.312 3.016 -9.141 1.00 0.00 H new ATOM 0 HG23 ILE A 76 6.768 2.069 -9.532 1.00 0.00 H new ATOM 0 HD11 ILE A 76 8.600 2.173 -13.064 1.00 0.00 H new ATOM 0 HD12 ILE A 76 8.306 1.833 -11.342 1.00 0.00 H new ATOM 0 HD13 ILE A 76 7.355 0.993 -12.590 1.00 0.00 H new ATOM 431 N SER A 77 5.221 0.208 -13.502 1.00 0.00 N ATOM 432 CA SER A 77 4.830 -0.247 -14.853 1.00 0.00 C ATOM 433 C SER A 77 3.413 -0.801 -14.849 1.00 0.00 C ATOM 434 O SER A 77 2.699 -0.703 -15.850 1.00 0.00 O ATOM 435 CB SER A 77 5.761 -1.315 -15.430 1.00 0.00 C ATOM 436 OG SER A 77 7.053 -0.789 -15.653 1.00 0.00 O ATOM 0 H SER A 77 5.993 -0.310 -13.083 1.00 0.00 H new ATOM 0 HA SER A 77 4.898 0.638 -15.486 1.00 0.00 H new ATOM 0 HB2 SER A 77 5.821 -2.160 -14.744 1.00 0.00 H new ATOM 0 HB3 SER A 77 5.351 -1.693 -16.367 1.00 0.00 H new ATOM 0 HG SER A 77 7.547 -0.765 -14.807 1.00 0.00 H new ATOM 442 N LEU A 78 2.988 -1.307 -13.694 1.00 0.00 N ATOM 443 CA LEU A 78 1.612 -1.682 -13.450 1.00 0.00 C ATOM 444 C LEU A 78 0.697 -0.480 -13.167 1.00 0.00 C ATOM 445 O LEU A 78 -0.479 -0.548 -13.525 1.00 0.00 O ATOM 446 CB LEU A 78 1.588 -2.711 -12.317 1.00 0.00 C ATOM 447 CG LEU A 78 1.611 -4.150 -12.838 1.00 0.00 C ATOM 448 CD1 LEU A 78 2.084 -5.085 -11.723 1.00 0.00 C ATOM 449 CD2 LEU A 78 0.212 -4.555 -13.309 1.00 0.00 C ATOM 0 H LEU A 78 3.603 -1.467 -12.896 1.00 0.00 H new ATOM 0 HA LEU A 78 1.203 -2.125 -14.358 1.00 0.00 H new ATOM 0 HB2 LEU A 78 2.446 -2.550 -11.664 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.694 -2.561 -11.711 1.00 0.00 H new ATOM 0 HG LEU A 78 2.298 -4.221 -13.681 1.00 0.00 H new ATOM 0 HD11 LEU A 78 2.101 -6.111 -12.091 1.00 0.00 H new ATOM 0 HD12 LEU A 78 3.086 -4.796 -11.407 1.00 0.00 H new ATOM 0 HD13 LEU A 78 1.402 -5.015 -10.876 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.235 -5.580 -13.679 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.487 -4.485 -12.475 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.110 -3.888 -14.109 1.00 0.00 H new ATOM 461 N GLY A 79 1.204 0.634 -12.609 1.00 0.00 N ATOM 462 CA GLY A 79 0.387 1.838 -12.403 1.00 0.00 C ATOM 463 C GLY A 79 0.375 2.835 -13.572 1.00 0.00 C ATOM 464 O GLY A 79 -0.457 3.740 -13.600 1.00 0.00 O ATOM 0 H GLY A 79 2.170 0.723 -12.295 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -0.639 1.530 -12.200 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.747 2.353 -11.512 1.00 0.00 H new ATOM 468 N LEU A 80 1.280 2.711 -14.542 1.00 0.00 N ATOM 469 CA LEU A 80 1.499 3.728 -15.573 1.00 0.00 C ATOM 470 C LEU A 80 0.375 3.949 -16.601 1.00 0.00 C ATOM 471 O LEU A 80 0.132 5.113 -16.928 1.00 0.00 O ATOM 472 CB LEU A 80 2.863 3.502 -16.255 1.00 0.00 C ATOM 473 CG LEU A 80 3.967 4.371 -15.624 1.00 0.00 C ATOM 474 CD1 LEU A 80 5.331 3.976 -16.187 1.00 0.00 C ATOM 475 CD2 LEU A 80 3.702 5.851 -15.914 1.00 0.00 C ATOM 0 H LEU A 80 1.887 1.897 -14.636 1.00 0.00 H new ATOM 0 HA LEU A 80 1.492 4.670 -15.024 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.139 2.450 -16.177 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.781 3.732 -17.317 1.00 0.00 H new ATOM 0 HG LEU A 80 3.964 4.211 -14.546 1.00 0.00 H new ATOM 0 HD11 LEU A 80 6.105 4.596 -15.735 1.00 0.00 H new ATOM 0 HD12 LEU A 80 5.528 2.928 -15.962 1.00 0.00 H new ATOM 0 HD13 LEU A 80 5.335 4.122 -17.267 1.00 0.00 H new ATOM 0 HD21 LEU A 80 4.488 6.457 -15.463 1.00 0.00 H new ATOM 0 HD22 LEU A 80 3.691 6.014 -16.992 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.738 6.137 -15.494 1.00 0.00 H new ATOM 487 N PRO A 81 -0.349 2.922 -17.093 1.00 0.00 N ATOM 488 CA PRO A 81 -1.523 3.089 -17.966 1.00 0.00 C ATOM 489 C PRO A 81 -2.678 3.929 -17.431 1.00 0.00 C ATOM 490 O PRO A 81 -3.647 4.149 -18.159 1.00 0.00 O ATOM 491 CB PRO A 81 -1.978 1.673 -18.327 1.00 0.00 C ATOM 492 CG PRO A 81 -0.720 0.826 -18.156 1.00 0.00 C ATOM 493 CD PRO A 81 -0.005 1.507 -16.991 1.00 0.00 C ATOM 0 HA PRO A 81 -1.210 3.682 -18.826 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -2.780 1.333 -17.672 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -2.357 1.624 -19.348 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -0.960 -0.213 -17.931 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -0.109 0.823 -19.059 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -0.329 1.093 -16.036 1.00 0.00 H new ATOM 0 HD3 PRO A 81 1.073 1.360 -17.053 1.00 0.00 H new ATOM 501 N PHE A 82 -2.595 4.403 -16.186 1.00 0.00 N ATOM 502 CA PHE A 82 -3.747 4.921 -15.467 1.00 0.00 C ATOM 503 C PHE A 82 -3.763 6.446 -15.331 1.00 0.00 C ATOM 504 O PHE A 82 -4.832 7.054 -15.283 1.00 0.00 O ATOM 505 CB PHE A 82 -3.812 4.229 -14.100 1.00 0.00 C ATOM 506 CG PHE A 82 -4.029 2.740 -14.257 1.00 0.00 C ATOM 507 CD1 PHE A 82 -2.981 1.879 -14.650 1.00 0.00 C ATOM 508 CD2 PHE A 82 -5.333 2.243 -14.149 1.00 0.00 C ATOM 509 CE1 PHE A 82 -3.260 0.539 -14.967 1.00 0.00 C ATOM 510 CE2 PHE A 82 -5.622 0.923 -14.510 1.00 0.00 C ATOM 511 CZ PHE A 82 -4.584 0.073 -14.918 1.00 0.00 C ATOM 0 H PHE A 82 -1.726 4.436 -15.654 1.00 0.00 H new ATOM 0 HA PHE A 82 -4.638 4.694 -16.052 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -2.887 4.410 -13.552 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -4.621 4.658 -13.509 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -1.968 2.249 -14.707 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -6.122 2.884 -13.784 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -2.460 -0.130 -15.247 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -6.639 0.560 -14.475 1.00 0.00 H new ATOM 0 HZ PHE A 82 -4.804 -0.947 -15.196 1.00 0.00 H new ATOM 521 N GLY A 83 -2.582 7.070 -15.342 1.00 0.00 N ATOM 522 CA GLY A 83 -2.409 8.510 -15.451 1.00 0.00 C ATOM 523 C GLY A 83 -0.942 8.861 -15.626 1.00 0.00 C ATOM 524 O GLY A 83 -0.391 8.798 -16.725 1.00 0.00 O ATOM 0 H GLY A 83 -1.697 6.567 -15.273 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -2.982 8.887 -16.298 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -2.801 8.997 -14.558 1.00 0.00 H new ATOM 528 N LYS A 84 -0.306 9.177 -14.499 1.00 0.00 N ATOM 529 CA LYS A 84 1.138 9.162 -14.269 1.00 0.00 C ATOM 530 C LYS A 84 1.312 8.827 -12.791 1.00 0.00 C ATOM 531 O LYS A 84 0.379 9.061 -12.021 1.00 0.00 O ATOM 532 CB LYS A 84 1.710 10.539 -14.669 1.00 0.00 C ATOM 533 CG LYS A 84 3.088 10.475 -15.348 1.00 0.00 C ATOM 534 CD LYS A 84 3.095 9.746 -16.708 1.00 0.00 C ATOM 535 CE LYS A 84 2.211 10.447 -17.751 1.00 0.00 C ATOM 536 NZ LYS A 84 2.051 9.620 -18.974 1.00 0.00 N ATOM 0 H LYS A 84 -0.819 9.470 -13.668 1.00 0.00 H new ATOM 0 HA LYS A 84 1.680 8.427 -14.864 1.00 0.00 H new ATOM 0 HB2 LYS A 84 1.008 11.030 -15.343 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.785 11.162 -13.778 1.00 0.00 H new ATOM 0 HG2 LYS A 84 3.456 11.491 -15.492 1.00 0.00 H new ATOM 0 HG3 LYS A 84 3.787 9.975 -14.678 1.00 0.00 H new ATOM 0 HD2 LYS A 84 4.117 9.689 -17.081 1.00 0.00 H new ATOM 0 HD3 LYS A 84 2.748 8.722 -16.570 1.00 0.00 H new ATOM 0 HE2 LYS A 84 1.232 10.653 -17.319 1.00 0.00 H new ATOM 0 HE3 LYS A 84 2.652 11.408 -18.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 1.449 10.123 -19.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 2.984 9.444 -19.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 1.608 8.713 -18.724 1.00 0.00 H new ATOM 550 N VAL A 85 2.435 8.273 -12.358 1.00 0.00 N ATOM 551 CA VAL A 85 2.556 7.778 -10.974 1.00 0.00 C ATOM 552 C VAL A 85 3.849 8.298 -10.342 1.00 0.00 C ATOM 553 O VAL A 85 4.953 7.877 -10.677 1.00 0.00 O ATOM 554 CB VAL A 85 2.316 6.257 -10.858 1.00 0.00 C ATOM 555 CG1 VAL A 85 1.997 5.702 -9.467 1.00 0.00 C ATOM 556 CG2 VAL A 85 1.650 5.549 -12.041 1.00 0.00 C ATOM 0 H VAL A 85 3.272 8.151 -12.928 1.00 0.00 H new ATOM 0 HA VAL A 85 1.746 8.191 -10.373 1.00 0.00 H new ATOM 0 HB VAL A 85 3.344 5.919 -10.986 1.00 0.00 H new ATOM 0 HG11 VAL A 85 1.852 4.624 -9.530 1.00 0.00 H new ATOM 0 HG12 VAL A 85 2.824 5.918 -8.791 1.00 0.00 H new ATOM 0 HG13 VAL A 85 1.088 6.169 -9.089 1.00 0.00 H new ATOM 0 HG21 VAL A 85 1.546 4.487 -11.818 1.00 0.00 H new ATOM 0 HG22 VAL A 85 0.665 5.981 -12.216 1.00 0.00 H new ATOM 0 HG23 VAL A 85 2.264 5.674 -12.933 1.00 0.00 H new ATOM 566 N THR A 86 3.675 9.326 -9.505 1.00 0.00 N ATOM 567 CA THR A 86 4.665 10.287 -9.010 1.00 0.00 C ATOM 568 C THR A 86 5.692 9.636 -8.098 1.00 0.00 C ATOM 569 O THR A 86 6.890 9.870 -8.259 1.00 0.00 O ATOM 570 CB THR A 86 3.936 11.398 -8.234 1.00 0.00 C ATOM 571 OG1 THR A 86 2.909 11.948 -9.031 1.00 0.00 O ATOM 572 CG2 THR A 86 4.834 12.556 -7.807 1.00 0.00 C ATOM 0 H THR A 86 2.751 9.524 -9.121 1.00 0.00 H new ATOM 0 HA THR A 86 5.196 10.693 -9.871 1.00 0.00 H new ATOM 0 HB THR A 86 3.555 10.913 -7.335 1.00 0.00 H new ATOM 0 HG1 THR A 86 2.448 12.653 -8.530 1.00 0.00 H new ATOM 0 HG21 THR A 86 4.243 13.295 -7.266 1.00 0.00 H new ATOM 0 HG22 THR A 86 5.627 12.182 -7.160 1.00 0.00 H new ATOM 0 HG23 THR A 86 5.275 13.019 -8.690 1.00 0.00 H new ATOM 580 N ASN A 87 5.224 8.825 -7.146 1.00 0.00 N ATOM 581 CA ASN A 87 6.075 8.083 -6.220 1.00 0.00 C ATOM 582 C ASN A 87 5.496 6.703 -5.866 1.00 0.00 C ATOM 583 O ASN A 87 4.297 6.454 -5.953 1.00 0.00 O ATOM 584 CB ASN A 87 6.287 8.906 -4.925 1.00 0.00 C ATOM 585 CG ASN A 87 7.410 9.930 -4.978 1.00 0.00 C ATOM 586 OD1 ASN A 87 8.457 9.719 -5.571 1.00 0.00 O ATOM 587 ND2 ASN A 87 7.261 11.043 -4.294 1.00 0.00 N ATOM 0 H ASN A 87 4.228 8.665 -6.997 1.00 0.00 H new ATOM 0 HA ASN A 87 7.029 7.918 -6.721 1.00 0.00 H new ATOM 0 HB2 ASN A 87 5.358 9.424 -4.688 1.00 0.00 H new ATOM 0 HB3 ASN A 87 6.486 8.216 -4.105 1.00 0.00 H new ATOM 0 HD21 ASN A 87 8.018 11.726 -4.260 1.00 0.00 H new ATOM 0 HD22 ASN A 87 6.389 11.223 -3.797 1.00 0.00 H new ATOM 594 N LEU A 88 6.348 5.828 -5.345 1.00 0.00 N ATOM 595 CA LEU A 88 5.958 4.684 -4.534 1.00 0.00 C ATOM 596 C LEU A 88 6.867 4.548 -3.304 1.00 0.00 C ATOM 597 O LEU A 88 7.876 5.244 -3.170 1.00 0.00 O ATOM 598 CB LEU A 88 5.924 3.438 -5.434 1.00 0.00 C ATOM 599 CG LEU A 88 7.258 2.692 -5.563 1.00 0.00 C ATOM 600 CD1 LEU A 88 6.946 1.424 -6.334 1.00 0.00 C ATOM 601 CD2 LEU A 88 8.361 3.473 -6.278 1.00 0.00 C ATOM 0 H LEU A 88 7.357 5.898 -5.480 1.00 0.00 H new ATOM 0 HA LEU A 88 4.956 4.819 -4.126 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.176 2.748 -5.044 1.00 0.00 H new ATOM 0 HB3 LEU A 88 5.595 3.737 -6.429 1.00 0.00 H new ATOM 0 HG LEU A 88 7.655 2.512 -4.564 1.00 0.00 H new ATOM 0 HD11 LEU A 88 7.859 0.842 -6.462 1.00 0.00 H new ATOM 0 HD12 LEU A 88 6.214 0.834 -5.783 1.00 0.00 H new ATOM 0 HD13 LEU A 88 6.541 1.683 -7.312 1.00 0.00 H new ATOM 0 HD21 LEU A 88 9.266 2.867 -6.322 1.00 0.00 H new ATOM 0 HD22 LEU A 88 8.037 3.716 -7.290 1.00 0.00 H new ATOM 0 HD23 LEU A 88 8.567 4.394 -5.732 1.00 0.00 H new ATOM 613 N LEU A 89 6.504 3.643 -2.402 1.00 0.00 N ATOM 614 CA LEU A 89 7.214 3.353 -1.149 1.00 0.00 C ATOM 615 C LEU A 89 7.093 1.861 -0.839 1.00 0.00 C ATOM 616 O LEU A 89 6.108 1.236 -1.230 1.00 0.00 O ATOM 617 CB LEU A 89 6.677 4.338 -0.089 1.00 0.00 C ATOM 618 CG LEU A 89 6.481 3.902 1.364 1.00 0.00 C ATOM 619 CD1 LEU A 89 5.845 5.092 2.071 1.00 0.00 C ATOM 620 CD2 LEU A 89 5.523 2.757 1.576 1.00 0.00 C ATOM 0 H LEU A 89 5.673 3.064 -2.523 1.00 0.00 H new ATOM 0 HA LEU A 89 8.290 3.519 -1.192 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.352 5.194 -0.077 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.712 4.698 -0.447 1.00 0.00 H new ATOM 0 HG LEU A 89 7.456 3.578 1.728 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.677 4.845 3.119 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.509 5.953 2.003 1.00 0.00 H new ATOM 0 HD13 LEU A 89 4.892 5.330 1.598 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.458 2.529 2.640 1.00 0.00 H new ATOM 0 HD22 LEU A 89 4.537 3.034 1.203 1.00 0.00 H new ATOM 0 HD23 LEU A 89 5.881 1.879 1.038 1.00 0.00 H new ATOM 632 N MET A 90 8.071 1.292 -0.122 1.00 0.00 N ATOM 633 CA MET A 90 8.142 -0.146 0.183 1.00 0.00 C ATOM 634 C MET A 90 8.412 -0.415 1.663 1.00 0.00 C ATOM 635 O MET A 90 9.536 -0.275 2.151 1.00 0.00 O ATOM 636 CB MET A 90 9.171 -0.827 -0.732 1.00 0.00 C ATOM 637 CG MET A 90 8.739 -0.624 -2.183 1.00 0.00 C ATOM 638 SD MET A 90 9.392 -1.803 -3.378 1.00 0.00 S ATOM 639 CE MET A 90 7.903 -1.818 -4.401 1.00 0.00 C ATOM 0 H MET A 90 8.848 1.825 0.269 1.00 0.00 H new ATOM 0 HA MET A 90 7.165 -0.584 -0.020 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.162 -0.403 -0.569 1.00 0.00 H new ATOM 0 HB3 MET A 90 9.237 -1.890 -0.502 1.00 0.00 H new ATOM 0 HG2 MET A 90 7.650 -0.661 -2.225 1.00 0.00 H new ATOM 0 HG3 MET A 90 9.036 0.378 -2.492 1.00 0.00 H new ATOM 0 HE1 MET A 90 8.095 -2.381 -5.315 1.00 0.00 H new ATOM 0 HE2 MET A 90 7.088 -2.287 -3.850 1.00 0.00 H new ATOM 0 HE3 MET A 90 7.627 -0.795 -4.656 1.00 0.00 H new ATOM 649 N LEU A 91 7.361 -0.819 2.381 1.00 0.00 N ATOM 650 CA LEU A 91 7.425 -1.321 3.755 1.00 0.00 C ATOM 651 C LEU A 91 7.918 -2.780 3.757 1.00 0.00 C ATOM 652 O LEU A 91 7.151 -3.722 3.986 1.00 0.00 O ATOM 653 CB LEU A 91 6.057 -1.200 4.463 1.00 0.00 C ATOM 654 CG LEU A 91 5.298 0.137 4.551 1.00 0.00 C ATOM 655 CD1 LEU A 91 6.223 1.331 4.754 1.00 0.00 C ATOM 656 CD2 LEU A 91 4.360 0.341 3.368 1.00 0.00 C ATOM 0 H LEU A 91 6.411 -0.805 2.009 1.00 0.00 H new ATOM 0 HA LEU A 91 8.134 -0.709 4.312 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.388 -1.910 3.977 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.201 -1.547 5.486 1.00 0.00 H new ATOM 0 HG LEU A 91 4.679 0.074 5.446 1.00 0.00 H new ATOM 0 HD11 LEU A 91 5.631 2.245 4.808 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.782 1.205 5.681 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.919 1.399 3.918 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.846 1.296 3.472 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.936 0.338 2.442 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.626 -0.465 3.342 1.00 0.00 H new ATOM 668 N LYS A 92 9.219 -2.970 3.513 1.00 0.00 N ATOM 669 CA LYS A 92 9.844 -4.290 3.327 1.00 0.00 C ATOM 670 C LYS A 92 9.674 -5.257 4.514 1.00 0.00 C ATOM 671 O LYS A 92 9.577 -6.467 4.313 1.00 0.00 O ATOM 672 CB LYS A 92 11.311 -4.109 2.906 1.00 0.00 C ATOM 673 CG LYS A 92 12.220 -3.523 4.002 1.00 0.00 C ATOM 674 CD LYS A 92 13.693 -3.430 3.566 1.00 0.00 C ATOM 675 CE LYS A 92 13.904 -2.399 2.450 1.00 0.00 C ATOM 676 NZ LYS A 92 15.339 -2.299 2.065 1.00 0.00 N ATOM 0 H LYS A 92 9.882 -2.198 3.437 1.00 0.00 H new ATOM 0 HA LYS A 92 9.303 -4.789 2.523 1.00 0.00 H new ATOM 0 HB2 LYS A 92 11.710 -5.076 2.599 1.00 0.00 H new ATOM 0 HB3 LYS A 92 11.348 -3.457 2.033 1.00 0.00 H new ATOM 0 HG2 LYS A 92 11.862 -2.530 4.272 1.00 0.00 H new ATOM 0 HG3 LYS A 92 12.149 -4.142 4.897 1.00 0.00 H new ATOM 0 HD2 LYS A 92 14.308 -3.163 4.425 1.00 0.00 H new ATOM 0 HD3 LYS A 92 14.031 -4.408 3.223 1.00 0.00 H new ATOM 0 HE2 LYS A 92 13.311 -2.677 1.579 1.00 0.00 H new ATOM 0 HE3 LYS A 92 13.546 -1.424 2.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 15.447 -1.594 1.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 15.901 -2.010 2.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 15.673 -3.224 1.726 1.00 0.00 H new ATOM 690 N GLY A 93 9.551 -4.728 5.735 1.00 0.00 N ATOM 691 CA GLY A 93 9.291 -5.487 6.967 1.00 0.00 C ATOM 692 C GLY A 93 7.828 -5.910 7.188 1.00 0.00 C ATOM 693 O GLY A 93 7.552 -6.654 8.131 1.00 0.00 O ATOM 0 H GLY A 93 9.632 -3.725 5.901 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.913 -6.382 6.959 1.00 0.00 H new ATOM 0 HA3 GLY A 93 9.609 -4.885 7.818 1.00 0.00 H new ATOM 697 N LYS A 94 6.896 -5.454 6.336 1.00 0.00 N ATOM 698 CA LYS A 94 5.450 -5.749 6.384 1.00 0.00 C ATOM 699 C LYS A 94 4.904 -6.430 5.116 1.00 0.00 C ATOM 700 O LYS A 94 3.696 -6.645 5.026 1.00 0.00 O ATOM 701 CB LYS A 94 4.670 -4.454 6.718 1.00 0.00 C ATOM 702 CG LYS A 94 4.793 -4.049 8.200 1.00 0.00 C ATOM 703 CD LYS A 94 5.201 -2.589 8.439 1.00 0.00 C ATOM 704 CE LYS A 94 6.716 -2.391 8.265 1.00 0.00 C ATOM 705 NZ LYS A 94 7.137 -1.024 8.678 1.00 0.00 N ATOM 0 H LYS A 94 7.139 -4.841 5.558 1.00 0.00 H new ATOM 0 HA LYS A 94 5.301 -6.483 7.176 1.00 0.00 H new ATOM 0 HB2 LYS A 94 5.039 -3.641 6.092 1.00 0.00 H new ATOM 0 HB3 LYS A 94 3.618 -4.595 6.471 1.00 0.00 H new ATOM 0 HG2 LYS A 94 3.837 -4.229 8.691 1.00 0.00 H new ATOM 0 HG3 LYS A 94 5.525 -4.699 8.680 1.00 0.00 H new ATOM 0 HD2 LYS A 94 4.666 -1.942 7.743 1.00 0.00 H new ATOM 0 HD3 LYS A 94 4.907 -2.288 9.444 1.00 0.00 H new ATOM 0 HE2 LYS A 94 7.252 -3.133 8.858 1.00 0.00 H new ATOM 0 HE3 LYS A 94 6.989 -2.558 7.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 8.164 -0.923 8.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 6.643 -0.318 8.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 6.898 -0.875 9.679 1.00 0.00 H new ATOM 719 N ASN A 95 5.760 -6.777 4.140 1.00 0.00 N ATOM 720 CA ASN A 95 5.375 -7.244 2.793 1.00 0.00 C ATOM 721 C ASN A 95 4.429 -6.260 2.075 1.00 0.00 C ATOM 722 O ASN A 95 3.455 -6.650 1.424 1.00 0.00 O ATOM 723 CB ASN A 95 4.789 -8.664 2.862 1.00 0.00 C ATOM 724 CG ASN A 95 5.815 -9.709 3.263 1.00 0.00 C ATOM 725 OD1 ASN A 95 6.068 -9.950 4.435 1.00 0.00 O ATOM 726 ND2 ASN A 95 6.443 -10.362 2.312 1.00 0.00 N ATOM 0 H ASN A 95 6.771 -6.740 4.269 1.00 0.00 H new ATOM 0 HA ASN A 95 6.280 -7.282 2.187 1.00 0.00 H new ATOM 0 HB2 ASN A 95 3.966 -8.677 3.577 1.00 0.00 H new ATOM 0 HB3 ASN A 95 4.371 -8.927 1.890 1.00 0.00 H new ATOM 0 HD21 ASN A 95 7.139 -11.068 2.552 1.00 0.00 H new ATOM 0 HD22 ASN A 95 6.234 -10.163 1.334 1.00 0.00 H new ATOM 733 N GLN A 96 4.671 -4.961 2.246 1.00 0.00 N ATOM 734 CA GLN A 96 3.663 -3.935 2.026 1.00 0.00 C ATOM 735 C GLN A 96 4.261 -2.720 1.263 1.00 0.00 C ATOM 736 O GLN A 96 5.480 -2.544 1.241 1.00 0.00 O ATOM 737 CB GLN A 96 3.125 -3.653 3.420 1.00 0.00 C ATOM 738 CG GLN A 96 1.942 -2.715 3.507 1.00 0.00 C ATOM 739 CD GLN A 96 1.768 -2.314 4.959 1.00 0.00 C ATOM 740 OE1 GLN A 96 2.070 -1.206 5.372 1.00 0.00 O ATOM 741 NE2 GLN A 96 1.376 -3.248 5.791 1.00 0.00 N ATOM 0 H GLN A 96 5.575 -4.594 2.542 1.00 0.00 H new ATOM 0 HA GLN A 96 2.843 -4.232 1.372 1.00 0.00 H new ATOM 0 HB2 GLN A 96 2.843 -4.602 3.876 1.00 0.00 H new ATOM 0 HB3 GLN A 96 3.934 -3.239 4.021 1.00 0.00 H new ATOM 0 HG2 GLN A 96 2.107 -1.835 2.886 1.00 0.00 H new ATOM 0 HG3 GLN A 96 1.041 -3.203 3.136 1.00 0.00 H new ATOM 0 HE21 GLN A 96 1.125 -4.172 5.439 1.00 0.00 H new ATOM 0 HE22 GLN A 96 1.322 -3.051 6.790 1.00 0.00 H new ATOM 750 N ALA A 97 3.451 -1.876 0.622 1.00 0.00 N ATOM 751 CA ALA A 97 3.887 -0.718 -0.178 1.00 0.00 C ATOM 752 C ALA A 97 2.811 0.378 -0.269 1.00 0.00 C ATOM 753 O ALA A 97 1.640 0.142 0.028 1.00 0.00 O ATOM 754 CB ALA A 97 4.214 -1.236 -1.592 1.00 0.00 C ATOM 0 H ALA A 97 2.436 -1.979 0.643 1.00 0.00 H new ATOM 0 HA ALA A 97 4.754 -0.264 0.302 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.542 -0.405 -2.217 1.00 0.00 H new ATOM 0 HB2 ALA A 97 5.008 -1.980 -1.532 1.00 0.00 H new ATOM 0 HB3 ALA A 97 3.324 -1.689 -2.028 1.00 0.00 H new ATOM 760 N PHE A 98 3.202 1.556 -0.754 1.00 0.00 N ATOM 761 CA PHE A 98 2.331 2.649 -1.213 1.00 0.00 C ATOM 762 C PHE A 98 2.561 2.868 -2.716 1.00 0.00 C ATOM 763 O PHE A 98 3.672 2.636 -3.193 1.00 0.00 O ATOM 764 CB PHE A 98 2.686 3.979 -0.541 1.00 0.00 C ATOM 765 CG PHE A 98 2.254 4.239 0.887 1.00 0.00 C ATOM 766 CD1 PHE A 98 1.906 3.200 1.775 1.00 0.00 C ATOM 767 CD2 PHE A 98 2.213 5.571 1.340 1.00 0.00 C ATOM 768 CE1 PHE A 98 1.526 3.491 3.090 1.00 0.00 C ATOM 769 CE2 PHE A 98 1.807 5.870 2.645 1.00 0.00 C ATOM 770 CZ PHE A 98 1.468 4.823 3.506 1.00 0.00 C ATOM 0 H PHE A 98 4.190 1.791 -0.844 1.00 0.00 H new ATOM 0 HA PHE A 98 1.306 2.367 -0.973 1.00 0.00 H new ATOM 0 HB2 PHE A 98 3.771 4.082 -0.577 1.00 0.00 H new ATOM 0 HB3 PHE A 98 2.270 4.776 -1.157 1.00 0.00 H new ATOM 0 HD1 PHE A 98 1.933 2.174 1.438 1.00 0.00 H new ATOM 0 HD2 PHE A 98 2.498 6.371 0.673 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.280 2.694 3.776 1.00 0.00 H new ATOM 0 HE2 PHE A 98 1.756 6.895 2.982 1.00 0.00 H new ATOM 0 HZ PHE A 98 1.154 5.049 4.515 1.00 0.00 H new ATOM 780 N ILE A 99 1.586 3.423 -3.438 1.00 0.00 N ATOM 781 CA ILE A 99 1.721 3.910 -4.815 1.00 0.00 C ATOM 782 C ILE A 99 0.942 5.237 -4.965 1.00 0.00 C ATOM 783 O ILE A 99 -0.286 5.267 -5.011 1.00 0.00 O ATOM 784 CB ILE A 99 1.387 2.758 -5.797 1.00 0.00 C ATOM 785 CG1 ILE A 99 1.580 3.216 -7.250 1.00 0.00 C ATOM 786 CG2 ILE A 99 0.015 2.100 -5.577 1.00 0.00 C ATOM 787 CD1 ILE A 99 1.423 2.095 -8.291 1.00 0.00 C ATOM 0 H ILE A 99 0.645 3.551 -3.067 1.00 0.00 H new ATOM 0 HA ILE A 99 2.743 4.183 -5.077 1.00 0.00 H new ATOM 0 HB ILE A 99 2.101 1.964 -5.577 1.00 0.00 H new ATOM 0 HG12 ILE A 99 0.859 4.004 -7.469 1.00 0.00 H new ATOM 0 HG13 ILE A 99 2.573 3.655 -7.352 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.130 1.306 -6.310 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -0.030 1.679 -4.573 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -0.770 2.848 -5.692 1.00 0.00 H new ATOM 0 HD11 ILE A 99 1.575 2.503 -9.290 1.00 0.00 H new ATOM 0 HD12 ILE A 99 2.161 1.316 -8.101 1.00 0.00 H new ATOM 0 HD13 ILE A 99 0.422 1.671 -8.220 1.00 0.00 H new ATOM 799 N GLU A 100 1.673 6.353 -4.901 1.00 0.00 N ATOM 800 CA GLU A 100 1.226 7.753 -5.012 1.00 0.00 C ATOM 801 C GLU A 100 1.237 8.207 -6.469 1.00 0.00 C ATOM 802 O GLU A 100 2.285 8.208 -7.121 1.00 0.00 O ATOM 803 CB GLU A 100 2.169 8.659 -4.205 1.00 0.00 C ATOM 804 CG GLU A 100 2.139 10.177 -4.508 1.00 0.00 C ATOM 805 CD GLU A 100 0.860 10.922 -4.110 1.00 0.00 C ATOM 806 OE1 GLU A 100 0.034 10.384 -3.347 1.00 0.00 O ATOM 807 OE2 GLU A 100 0.714 12.092 -4.538 1.00 0.00 O ATOM 0 H GLU A 100 2.682 6.300 -4.758 1.00 0.00 H new ATOM 0 HA GLU A 100 0.210 7.822 -4.623 1.00 0.00 H new ATOM 0 HB2 GLU A 100 1.942 8.523 -3.148 1.00 0.00 H new ATOM 0 HB3 GLU A 100 3.188 8.306 -4.360 1.00 0.00 H new ATOM 0 HG2 GLU A 100 2.981 10.645 -3.997 1.00 0.00 H new ATOM 0 HG3 GLU A 100 2.298 10.316 -5.577 1.00 0.00 H new ATOM 814 N MET A 101 0.087 8.655 -6.968 1.00 0.00 N ATOM 815 CA MET A 101 -0.022 9.052 -8.377 1.00 0.00 C ATOM 816 C MET A 101 -0.406 10.507 -8.644 1.00 0.00 C ATOM 817 O MET A 101 -0.870 11.231 -7.773 1.00 0.00 O ATOM 818 CB MET A 101 -0.766 7.957 -9.144 1.00 0.00 C ATOM 819 CG MET A 101 -1.969 8.308 -9.999 1.00 0.00 C ATOM 820 SD MET A 101 -2.736 6.763 -10.523 1.00 0.00 S ATOM 821 CE MET A 101 -1.432 5.912 -11.416 1.00 0.00 C ATOM 0 H MET A 101 -0.774 8.753 -6.429 1.00 0.00 H new ATOM 0 HA MET A 101 0.979 9.103 -8.805 1.00 0.00 H new ATOM 0 HB2 MET A 101 -0.040 7.467 -9.793 1.00 0.00 H new ATOM 0 HB3 MET A 101 -1.093 7.216 -8.414 1.00 0.00 H new ATOM 0 HG2 MET A 101 -2.677 8.914 -9.433 1.00 0.00 H new ATOM 0 HG3 MET A 101 -1.665 8.897 -10.864 1.00 0.00 H new ATOM 0 HE1 MET A 101 -1.848 5.043 -11.926 1.00 0.00 H new ATOM 0 HE2 MET A 101 -0.992 6.588 -12.150 1.00 0.00 H new ATOM 0 HE3 MET A 101 -0.663 5.588 -10.715 1.00 0.00 H new ATOM 831 N ASN A 102 -0.126 10.957 -9.869 1.00 0.00 N ATOM 832 CA ASN A 102 -0.103 12.368 -10.271 1.00 0.00 C ATOM 833 C ASN A 102 -1.501 13.015 -10.308 1.00 0.00 C ATOM 834 O ASN A 102 -1.610 14.242 -10.313 1.00 0.00 O ATOM 835 CB ASN A 102 0.679 12.414 -11.604 1.00 0.00 C ATOM 836 CG ASN A 102 0.109 13.260 -12.724 1.00 0.00 C ATOM 837 OD1 ASN A 102 -0.518 12.614 -13.683 1.00 0.00 O flip ATOM 838 ND2 ASN A 102 0.268 14.469 -12.789 1.00 0.00 N flip ATOM 0 H ASN A 102 0.100 10.326 -10.638 1.00 0.00 H new ATOM 0 HA ASN A 102 0.402 12.988 -9.530 1.00 0.00 H new ATOM 0 HB2 ASN A 102 1.686 12.774 -11.390 1.00 0.00 H new ATOM 0 HB3 ASN A 102 0.777 11.392 -11.971 1.00 0.00 H new ATOM 0 HD21 ASN A 102 0.756 14.960 -12.040 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -0.087 14.988 -13.592 1.00 0.00 H new ATOM 845 N THR A 103 -2.569 12.213 -10.304 1.00 0.00 N ATOM 846 CA THR A 103 -3.959 12.692 -10.336 1.00 0.00 C ATOM 847 C THR A 103 -4.858 11.827 -9.456 1.00 0.00 C ATOM 848 O THR A 103 -4.684 10.608 -9.334 1.00 0.00 O ATOM 849 CB THR A 103 -4.523 12.844 -11.774 1.00 0.00 C ATOM 850 OG1 THR A 103 -5.514 11.900 -12.094 1.00 0.00 O ATOM 851 CG2 THR A 103 -3.471 12.746 -12.878 1.00 0.00 C ATOM 0 H THR A 103 -2.494 11.196 -10.278 1.00 0.00 H new ATOM 0 HA THR A 103 -3.950 13.699 -9.920 1.00 0.00 H new ATOM 0 HB THR A 103 -4.941 13.850 -11.745 1.00 0.00 H new ATOM 0 HG1 THR A 103 -5.827 12.052 -13.010 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.951 12.863 -13.850 1.00 0.00 H new ATOM 0 HG22 THR A 103 -2.728 13.532 -12.743 1.00 0.00 H new ATOM 0 HG23 THR A 103 -2.982 11.773 -12.830 1.00 0.00 H new ATOM 859 N GLU A 104 -5.833 12.483 -8.831 1.00 0.00 N ATOM 860 CA GLU A 104 -6.838 11.844 -7.980 1.00 0.00 C ATOM 861 C GLU A 104 -7.664 10.830 -8.781 1.00 0.00 C ATOM 862 O GLU A 104 -7.909 9.719 -8.318 1.00 0.00 O ATOM 863 CB GLU A 104 -7.764 12.915 -7.378 1.00 0.00 C ATOM 864 CG GLU A 104 -7.011 13.918 -6.493 1.00 0.00 C ATOM 865 CD GLU A 104 -7.958 15.023 -5.985 1.00 0.00 C ATOM 866 OE1 GLU A 104 -8.839 14.742 -5.135 1.00 0.00 O ATOM 867 OE2 GLU A 104 -7.836 16.186 -6.443 1.00 0.00 O ATOM 0 H GLU A 104 -5.950 13.494 -8.902 1.00 0.00 H new ATOM 0 HA GLU A 104 -6.327 11.313 -7.177 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -8.264 13.452 -8.184 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -8.541 12.428 -6.789 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -6.565 13.398 -5.645 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -6.194 14.366 -7.058 1.00 0.00 H new ATOM 874 N GLU A 105 -8.072 11.197 -10.000 1.00 0.00 N ATOM 875 CA GLU A 105 -8.901 10.362 -10.874 1.00 0.00 C ATOM 876 C GLU A 105 -8.148 9.188 -11.497 1.00 0.00 C ATOM 877 O GLU A 105 -8.718 8.108 -11.642 1.00 0.00 O ATOM 878 CB GLU A 105 -9.512 11.191 -12.010 1.00 0.00 C ATOM 879 CG GLU A 105 -10.582 12.167 -11.505 1.00 0.00 C ATOM 880 CD GLU A 105 -11.210 12.953 -12.675 1.00 0.00 C ATOM 881 OE1 GLU A 105 -12.221 12.486 -13.257 1.00 0.00 O ATOM 882 OE2 GLU A 105 -10.706 14.052 -13.015 1.00 0.00 O ATOM 0 H GLU A 105 -7.831 12.098 -10.414 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.678 9.960 -10.224 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.723 11.749 -12.515 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -9.953 10.522 -12.749 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -11.359 11.617 -10.973 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -10.138 12.862 -10.792 1.00 0.00 H new ATOM 889 N ALA A 106 -6.868 9.366 -11.835 1.00 0.00 N ATOM 890 CA ALA A 106 -5.992 8.276 -12.212 1.00 0.00 C ATOM 891 C ALA A 106 -5.945 7.249 -11.087 1.00 0.00 C ATOM 892 O ALA A 106 -6.261 6.089 -11.315 1.00 0.00 O ATOM 893 CB ALA A 106 -4.606 8.810 -12.550 1.00 0.00 C ATOM 0 H ALA A 106 -6.416 10.280 -11.852 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.378 7.783 -13.104 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -3.956 7.982 -12.832 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.679 9.513 -13.380 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.190 9.318 -11.680 1.00 0.00 H new ATOM 899 N ALA A 107 -5.615 7.641 -9.857 1.00 0.00 N ATOM 900 CA ALA A 107 -5.564 6.667 -8.779 1.00 0.00 C ATOM 901 C ALA A 107 -6.932 6.061 -8.438 1.00 0.00 C ATOM 902 O ALA A 107 -7.014 4.853 -8.246 1.00 0.00 O ATOM 903 CB ALA A 107 -4.919 7.329 -7.594 1.00 0.00 C ATOM 0 H ALA A 107 -5.386 8.599 -9.591 1.00 0.00 H new ATOM 0 HA ALA A 107 -4.970 5.812 -9.101 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -4.866 6.622 -6.766 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -3.913 7.652 -7.861 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -5.510 8.195 -7.294 1.00 0.00 H new ATOM 909 N ASN A 108 -8.026 6.827 -8.440 1.00 0.00 N ATOM 910 CA ASN A 108 -9.380 6.327 -8.380 1.00 0.00 C ATOM 911 C ASN A 108 -9.658 5.208 -9.396 1.00 0.00 C ATOM 912 O ASN A 108 -10.051 4.105 -9.020 1.00 0.00 O ATOM 913 CB ASN A 108 -10.275 7.548 -8.596 1.00 0.00 C ATOM 914 CG ASN A 108 -11.673 7.172 -8.241 1.00 0.00 C ATOM 915 OD1 ASN A 108 -12.498 6.784 -9.053 1.00 0.00 O ATOM 916 ND2 ASN A 108 -11.923 7.163 -6.963 1.00 0.00 N ATOM 0 H ASN A 108 -7.980 7.845 -8.485 1.00 0.00 H new ATOM 0 HA ASN A 108 -9.575 5.852 -7.418 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -9.937 8.380 -7.979 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -10.222 7.879 -9.633 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -12.824 6.827 -6.622 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -11.218 7.492 -6.303 1.00 0.00 H new ATOM 923 N THR A 109 -9.405 5.465 -10.676 1.00 0.00 N ATOM 924 CA THR A 109 -9.532 4.454 -11.728 1.00 0.00 C ATOM 925 C THR A 109 -8.554 3.297 -11.499 1.00 0.00 C ATOM 926 O THR A 109 -8.928 2.153 -11.738 1.00 0.00 O ATOM 927 CB THR A 109 -9.406 5.085 -13.132 1.00 0.00 C ATOM 928 OG1 THR A 109 -10.394 4.533 -13.980 1.00 0.00 O ATOM 929 CG2 THR A 109 -8.069 4.882 -13.845 1.00 0.00 C ATOM 0 H THR A 109 -9.106 6.379 -11.016 1.00 0.00 H new ATOM 0 HA THR A 109 -10.534 4.027 -11.677 1.00 0.00 H new ATOM 0 HB THR A 109 -9.514 6.155 -12.952 1.00 0.00 H new ATOM 0 HG1 THR A 109 -10.319 4.932 -14.872 1.00 0.00 H new ATOM 0 HG21 THR A 109 -8.099 5.368 -14.820 1.00 0.00 H new ATOM 0 HG22 THR A 109 -7.268 5.317 -13.247 1.00 0.00 H new ATOM 0 HG23 THR A 109 -7.885 3.816 -13.977 1.00 0.00 H new ATOM 937 N MET A 110 -7.350 3.559 -10.964 1.00 0.00 N ATOM 938 CA MET A 110 -6.324 2.559 -10.679 1.00 0.00 C ATOM 939 C MET A 110 -6.831 1.565 -9.619 1.00 0.00 C ATOM 940 O MET A 110 -6.899 0.359 -9.846 1.00 0.00 O ATOM 941 CB MET A 110 -4.962 3.198 -10.265 1.00 0.00 C ATOM 942 CG MET A 110 -3.856 2.209 -10.659 1.00 0.00 C ATOM 943 SD MET A 110 -2.130 2.647 -10.308 1.00 0.00 S ATOM 944 CE MET A 110 -2.217 3.421 -8.686 1.00 0.00 C ATOM 0 H MET A 110 -7.061 4.504 -10.712 1.00 0.00 H new ATOM 0 HA MET A 110 -6.131 2.014 -11.603 1.00 0.00 H new ATOM 0 HB2 MET A 110 -4.818 4.155 -10.766 1.00 0.00 H new ATOM 0 HB3 MET A 110 -4.939 3.393 -9.193 1.00 0.00 H new ATOM 0 HG2 MET A 110 -4.065 1.263 -10.159 1.00 0.00 H new ATOM 0 HG3 MET A 110 -3.940 2.029 -11.731 1.00 0.00 H new ATOM 0 HE1 MET A 110 -1.227 3.775 -8.398 1.00 0.00 H new ATOM 0 HE2 MET A 110 -2.907 4.264 -8.722 1.00 0.00 H new ATOM 0 HE3 MET A 110 -2.569 2.694 -7.954 1.00 0.00 H new ATOM 954 N VAL A 111 -7.243 2.078 -8.462 1.00 0.00 N ATOM 955 CA VAL A 111 -7.764 1.317 -7.321 1.00 0.00 C ATOM 956 C VAL A 111 -9.037 0.546 -7.679 1.00 0.00 C ATOM 957 O VAL A 111 -9.207 -0.592 -7.247 1.00 0.00 O ATOM 958 CB VAL A 111 -7.947 2.268 -6.117 1.00 0.00 C ATOM 959 CG1 VAL A 111 -9.353 2.806 -5.901 1.00 0.00 C ATOM 960 CG2 VAL A 111 -7.514 1.619 -4.805 1.00 0.00 C ATOM 0 H VAL A 111 -7.223 3.082 -8.283 1.00 0.00 H new ATOM 0 HA VAL A 111 -7.041 0.551 -7.039 1.00 0.00 H new ATOM 0 HB VAL A 111 -7.308 3.108 -6.389 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -9.362 3.461 -5.030 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -9.667 3.368 -6.781 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -10.039 1.975 -5.737 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -7.660 2.323 -3.985 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -8.112 0.725 -4.626 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.461 1.345 -4.865 1.00 0.00 H new ATOM 970 N ASN A 112 -9.918 1.126 -8.504 1.00 0.00 N ATOM 971 CA ASN A 112 -11.149 0.480 -8.962 1.00 0.00 C ATOM 972 C ASN A 112 -10.847 -0.671 -9.934 1.00 0.00 C ATOM 973 O ASN A 112 -11.319 -1.789 -9.726 1.00 0.00 O ATOM 974 CB ASN A 112 -12.109 1.526 -9.559 1.00 0.00 C ATOM 975 CG ASN A 112 -12.902 2.237 -8.473 1.00 0.00 C ATOM 976 OD1 ASN A 112 -14.089 2.004 -8.290 1.00 0.00 O ATOM 977 ND2 ASN A 112 -12.284 3.085 -7.683 1.00 0.00 N ATOM 0 H ASN A 112 -9.792 2.068 -8.875 1.00 0.00 H new ATOM 0 HA ASN A 112 -11.651 0.030 -8.105 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -11.541 2.257 -10.134 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -12.795 1.039 -10.252 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -12.794 3.541 -6.926 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -11.294 3.287 -7.826 1.00 0.00 H new ATOM 984 N TYR A 113 -9.969 -0.453 -10.917 1.00 0.00 N ATOM 985 CA TYR A 113 -9.385 -1.527 -11.735 1.00 0.00 C ATOM 986 C TYR A 113 -8.832 -2.669 -10.868 1.00 0.00 C ATOM 987 O TYR A 113 -9.049 -3.837 -11.182 1.00 0.00 O ATOM 988 CB TYR A 113 -8.318 -0.945 -12.683 1.00 0.00 C ATOM 989 CG TYR A 113 -7.093 -1.809 -12.938 1.00 0.00 C ATOM 990 CD1 TYR A 113 -7.199 -3.007 -13.669 1.00 0.00 C ATOM 991 CD2 TYR A 113 -5.836 -1.392 -12.449 1.00 0.00 C ATOM 992 CE1 TYR A 113 -6.059 -3.807 -13.883 1.00 0.00 C ATOM 993 CE2 TYR A 113 -4.702 -2.188 -12.672 1.00 0.00 C ATOM 994 CZ TYR A 113 -4.804 -3.404 -13.377 1.00 0.00 C ATOM 995 OH TYR A 113 -3.696 -4.168 -13.588 1.00 0.00 O ATOM 0 H TYR A 113 -9.640 0.478 -11.172 1.00 0.00 H new ATOM 0 HA TYR A 113 -10.175 -1.967 -12.344 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -8.792 -0.734 -13.642 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -7.984 0.009 -12.276 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -8.155 -3.314 -14.066 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -5.747 -0.463 -11.905 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -6.145 -4.731 -14.436 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -3.741 -1.865 -12.299 1.00 0.00 H new ATOM 0 HH TYR A 113 -3.191 -4.249 -12.752 1.00 0.00 H new ATOM 1005 N TYR A 114 -8.213 -2.375 -9.725 1.00 0.00 N ATOM 1006 CA TYR A 114 -7.558 -3.364 -8.893 1.00 0.00 C ATOM 1007 C TYR A 114 -8.512 -4.076 -7.953 1.00 0.00 C ATOM 1008 O TYR A 114 -8.224 -5.200 -7.538 1.00 0.00 O ATOM 1009 CB TYR A 114 -6.415 -2.736 -8.116 1.00 0.00 C ATOM 1010 CG TYR A 114 -5.153 -2.532 -8.911 1.00 0.00 C ATOM 1011 CD1 TYR A 114 -4.606 -3.593 -9.668 1.00 0.00 C ATOM 1012 CD2 TYR A 114 -4.478 -1.307 -8.797 1.00 0.00 C ATOM 1013 CE1 TYR A 114 -3.307 -3.446 -10.196 1.00 0.00 C ATOM 1014 CE2 TYR A 114 -3.200 -1.150 -9.351 1.00 0.00 C ATOM 1015 CZ TYR A 114 -2.598 -2.239 -10.010 1.00 0.00 C ATOM 1016 OH TYR A 114 -1.349 -2.098 -10.515 1.00 0.00 O ATOM 0 H TYR A 114 -8.156 -1.427 -9.352 1.00 0.00 H new ATOM 0 HA TYR A 114 -7.161 -4.123 -9.567 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -6.744 -1.772 -7.728 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -6.189 -3.366 -7.256 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -5.171 -4.497 -9.838 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -4.945 -0.482 -8.280 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -2.853 -4.258 -10.744 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -2.683 -0.205 -9.273 1.00 0.00 H new ATOM 0 HH TYR A 114 -1.007 -1.206 -10.297 1.00 0.00 H new ATOM 1026 N THR A 115 -9.671 -3.467 -7.682 1.00 0.00 N ATOM 1027 CA THR A 115 -10.731 -4.149 -6.945 1.00 0.00 C ATOM 1028 C THR A 115 -11.570 -5.045 -7.876 1.00 0.00 C ATOM 1029 O THR A 115 -12.296 -5.942 -7.440 1.00 0.00 O ATOM 1030 CB THR A 115 -11.549 -3.189 -6.058 1.00 0.00 C ATOM 1031 OG1 THR A 115 -12.007 -3.890 -4.919 1.00 0.00 O ATOM 1032 CG2 THR A 115 -12.775 -2.542 -6.702 1.00 0.00 C ATOM 0 H THR A 115 -9.895 -2.512 -7.961 1.00 0.00 H new ATOM 0 HA THR A 115 -10.264 -4.828 -6.231 1.00 0.00 H new ATOM 0 HB THR A 115 -10.855 -2.379 -5.836 1.00 0.00 H new ATOM 0 HG1 THR A 115 -12.527 -3.285 -4.350 1.00 0.00 H new ATOM 0 HG21 THR A 115 -13.265 -1.890 -5.979 1.00 0.00 H new ATOM 0 HG22 THR A 115 -12.465 -1.956 -7.567 1.00 0.00 H new ATOM 0 HG23 THR A 115 -13.471 -3.318 -7.020 1.00 0.00 H new ATOM 1040 N SER A 116 -11.399 -4.843 -9.188 1.00 0.00 N ATOM 1041 CA SER A 116 -11.970 -5.612 -10.294 1.00 0.00 C ATOM 1042 C SER A 116 -11.121 -6.838 -10.652 1.00 0.00 C ATOM 1043 O SER A 116 -11.628 -7.955 -10.759 1.00 0.00 O ATOM 1044 CB SER A 116 -12.034 -4.692 -11.525 1.00 0.00 C ATOM 1045 OG SER A 116 -13.301 -4.749 -12.164 1.00 0.00 O ATOM 0 H SER A 116 -10.813 -4.080 -9.527 1.00 0.00 H new ATOM 0 HA SER A 116 -12.955 -5.966 -9.991 1.00 0.00 H new ATOM 0 HB2 SER A 116 -11.826 -3.666 -11.222 1.00 0.00 H new ATOM 0 HB3 SER A 116 -11.257 -4.979 -12.233 1.00 0.00 H new ATOM 0 HG SER A 116 -13.303 -4.150 -12.940 1.00 0.00 H new ATOM 1051 N VAL A 117 -9.828 -6.603 -10.896 1.00 0.00 N ATOM 1052 CA VAL A 117 -8.931 -7.468 -11.678 1.00 0.00 C ATOM 1053 C VAL A 117 -8.459 -8.741 -10.948 1.00 0.00 C ATOM 1054 O VAL A 117 -8.394 -9.806 -11.562 1.00 0.00 O ATOM 1055 CB VAL A 117 -7.715 -6.631 -12.147 1.00 0.00 C ATOM 1056 CG1 VAL A 117 -6.820 -6.205 -11.016 1.00 0.00 C ATOM 1057 CG2 VAL A 117 -6.894 -7.349 -13.221 1.00 0.00 C ATOM 0 H VAL A 117 -9.356 -5.772 -10.541 1.00 0.00 H new ATOM 0 HA VAL A 117 -9.512 -7.833 -12.525 1.00 0.00 H new ATOM 0 HB VAL A 117 -8.145 -5.730 -12.585 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -5.987 -5.623 -11.410 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -7.388 -5.596 -10.312 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -6.435 -7.087 -10.504 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -6.053 -6.721 -13.516 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -6.520 -8.292 -12.823 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -7.523 -7.545 -14.089 1.00 0.00 H new ATOM 1067 N THR A 118 -8.099 -8.608 -9.666 1.00 0.00 N ATOM 1068 CA THR A 118 -6.803 -8.998 -9.047 1.00 0.00 C ATOM 1069 C THR A 118 -5.738 -9.595 -9.997 1.00 0.00 C ATOM 1070 O THR A 118 -5.937 -10.683 -10.532 1.00 0.00 O ATOM 1071 CB THR A 118 -6.930 -9.872 -7.782 1.00 0.00 C ATOM 1072 OG1 THR A 118 -8.178 -9.691 -7.140 1.00 0.00 O ATOM 1073 CG2 THR A 118 -5.863 -9.412 -6.781 1.00 0.00 C ATOM 0 H THR A 118 -8.736 -8.201 -8.981 1.00 0.00 H new ATOM 0 HA THR A 118 -6.428 -8.019 -8.749 1.00 0.00 H new ATOM 0 HB THR A 118 -6.821 -10.914 -8.082 1.00 0.00 H new ATOM 0 HG1 THR A 118 -8.222 -10.262 -6.345 1.00 0.00 H new ATOM 0 HG21 THR A 118 -5.930 -10.014 -5.875 1.00 0.00 H new ATOM 0 HG22 THR A 118 -4.874 -9.531 -7.223 1.00 0.00 H new ATOM 0 HG23 THR A 118 -6.026 -8.363 -6.532 1.00 0.00 H new ATOM 1081 N PRO A 119 -4.594 -8.917 -10.242 1.00 0.00 N ATOM 1082 CA PRO A 119 -3.692 -9.222 -11.360 1.00 0.00 C ATOM 1083 C PRO A 119 -2.822 -10.474 -11.116 1.00 0.00 C ATOM 1084 O PRO A 119 -2.311 -11.061 -12.070 1.00 0.00 O ATOM 1085 CB PRO A 119 -2.798 -7.977 -11.539 1.00 0.00 C ATOM 1086 CG PRO A 119 -3.285 -6.969 -10.501 1.00 0.00 C ATOM 1087 CD PRO A 119 -3.957 -7.866 -9.469 1.00 0.00 C ATOM 0 HA PRO A 119 -4.278 -9.448 -12.251 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -1.748 -8.223 -11.384 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -2.885 -7.574 -12.548 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -2.462 -6.399 -10.070 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -3.982 -6.249 -10.929 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -3.229 -8.277 -8.769 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -4.687 -7.311 -8.880 1.00 0.00 H new ATOM 1095 N VAL A 120 -2.690 -10.883 -9.842 1.00 0.00 N ATOM 1096 CA VAL A 120 -1.936 -12.025 -9.286 1.00 0.00 C ATOM 1097 C VAL A 120 -0.422 -11.921 -9.533 1.00 0.00 C ATOM 1098 O VAL A 120 0.051 -12.088 -10.655 1.00 0.00 O ATOM 1099 CB VAL A 120 -2.537 -13.358 -9.751 1.00 0.00 C ATOM 1100 CG1 VAL A 120 -2.055 -14.529 -8.897 1.00 0.00 C ATOM 1101 CG2 VAL A 120 -4.060 -13.344 -9.597 1.00 0.00 C ATOM 0 H VAL A 120 -3.158 -10.368 -9.096 1.00 0.00 H new ATOM 0 HA VAL A 120 -2.043 -11.989 -8.202 1.00 0.00 H new ATOM 0 HB VAL A 120 -2.227 -13.478 -10.789 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -2.504 -15.453 -9.260 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -0.969 -14.604 -8.961 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -2.347 -14.367 -7.859 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -4.468 -14.298 -9.932 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -4.318 -13.186 -8.550 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -4.479 -12.538 -10.200 1.00 0.00 H new ATOM 1111 N LEU A 121 0.341 -11.582 -8.484 1.00 0.00 N ATOM 1112 CA LEU A 121 1.716 -11.078 -8.617 1.00 0.00 C ATOM 1113 C LEU A 121 2.684 -12.187 -9.068 1.00 0.00 C ATOM 1114 O LEU A 121 3.239 -12.126 -10.168 1.00 0.00 O ATOM 1115 CB LEU A 121 2.136 -10.366 -7.309 1.00 0.00 C ATOM 1116 CG LEU A 121 3.336 -9.405 -7.479 1.00 0.00 C ATOM 1117 CD1 LEU A 121 3.370 -8.386 -6.334 1.00 0.00 C ATOM 1118 CD2 LEU A 121 4.664 -10.162 -7.499 1.00 0.00 C ATOM 0 H LEU A 121 0.022 -11.650 -7.518 1.00 0.00 H new ATOM 0 HA LEU A 121 1.759 -10.333 -9.411 1.00 0.00 H new ATOM 0 HB2 LEU A 121 1.285 -9.805 -6.922 1.00 0.00 H new ATOM 0 HB3 LEU A 121 2.388 -11.118 -6.562 1.00 0.00 H new ATOM 0 HG LEU A 121 3.206 -8.894 -8.433 1.00 0.00 H new ATOM 0 HD11 LEU A 121 4.220 -7.717 -6.468 1.00 0.00 H new ATOM 0 HD12 LEU A 121 2.447 -7.806 -6.336 1.00 0.00 H new ATOM 0 HD13 LEU A 121 3.467 -8.910 -5.383 1.00 0.00 H new ATOM 0 HD21 LEU A 121 5.484 -9.454 -7.620 1.00 0.00 H new ATOM 0 HD22 LEU A 121 4.788 -10.704 -6.562 1.00 0.00 H new ATOM 0 HD23 LEU A 121 4.668 -10.868 -8.330 1.00 0.00 H new ATOM 1130 N ARG A 122 2.864 -13.213 -8.223 1.00 0.00 N ATOM 1131 CA ARG A 122 3.617 -14.446 -8.521 1.00 0.00 C ATOM 1132 C ARG A 122 2.914 -15.653 -7.886 1.00 0.00 C ATOM 1133 O ARG A 122 3.359 -16.209 -6.884 1.00 0.00 O ATOM 1134 CB ARG A 122 5.098 -14.268 -8.105 1.00 0.00 C ATOM 1135 CG ARG A 122 6.078 -15.110 -8.946 1.00 0.00 C ATOM 1136 CD ARG A 122 5.891 -16.627 -8.829 1.00 0.00 C ATOM 1137 NE ARG A 122 6.897 -17.349 -9.635 1.00 0.00 N ATOM 1138 CZ ARG A 122 6.960 -18.652 -9.839 1.00 0.00 C ATOM 1139 NH1 ARG A 122 6.107 -19.478 -9.300 1.00 0.00 N ATOM 1140 NH2 ARG A 122 7.892 -19.157 -10.597 1.00 0.00 N ATOM 0 H ARG A 122 2.477 -13.209 -7.279 1.00 0.00 H new ATOM 0 HA ARG A 122 3.632 -14.645 -9.593 1.00 0.00 H new ATOM 0 HB2 ARG A 122 5.368 -13.216 -8.193 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.207 -14.539 -7.055 1.00 0.00 H new ATOM 0 HG2 ARG A 122 5.973 -14.825 -9.993 1.00 0.00 H new ATOM 0 HG3 ARG A 122 7.096 -14.860 -8.649 1.00 0.00 H new ATOM 0 HD2 ARG A 122 5.973 -16.927 -7.784 1.00 0.00 H new ATOM 0 HD3 ARG A 122 4.890 -16.900 -9.161 1.00 0.00 H new ATOM 0 HE ARG A 122 7.618 -16.782 -10.080 1.00 0.00 H new ATOM 0 HH11 ARG A 122 5.362 -19.123 -8.700 1.00 0.00 H new ATOM 0 HH12 ARG A 122 6.184 -20.479 -9.478 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.579 -18.545 -11.037 1.00 0.00 H new ATOM 0 HH22 ARG A 122 7.935 -20.165 -10.750 1.00 0.00 H new ATOM 1154 N GLY A 123 1.770 -16.025 -8.459 1.00 0.00 N ATOM 1155 CA GLY A 123 0.937 -17.144 -7.996 1.00 0.00 C ATOM 1156 C GLY A 123 0.069 -16.860 -6.759 1.00 0.00 C ATOM 1157 O GLY A 123 -0.529 -17.790 -6.215 1.00 0.00 O ATOM 0 H GLY A 123 1.385 -15.550 -9.275 1.00 0.00 H new ATOM 0 HA2 GLY A 123 0.284 -17.449 -8.813 1.00 0.00 H new ATOM 0 HA3 GLY A 123 1.587 -17.990 -7.775 1.00 0.00 H new ATOM 1161 N GLN A 124 -0.013 -15.601 -6.305 1.00 0.00 N ATOM 1162 CA GLN A 124 -0.829 -15.141 -5.186 1.00 0.00 C ATOM 1163 C GLN A 124 -1.502 -13.794 -5.528 1.00 0.00 C ATOM 1164 O GLN A 124 -0.856 -12.943 -6.152 1.00 0.00 O ATOM 1165 CB GLN A 124 0.055 -15.031 -3.939 1.00 0.00 C ATOM 1166 CG GLN A 124 -0.800 -14.822 -2.688 1.00 0.00 C ATOM 1167 CD GLN A 124 -0.007 -14.817 -1.383 1.00 0.00 C ATOM 1168 OE1 GLN A 124 -0.106 -13.909 -0.563 1.00 0.00 O ATOM 1169 NE2 GLN A 124 0.770 -15.845 -1.110 1.00 0.00 N ATOM 0 H GLN A 124 0.517 -14.842 -6.734 1.00 0.00 H new ATOM 0 HA GLN A 124 -1.626 -15.857 -4.987 1.00 0.00 H new ATOM 0 HB2 GLN A 124 0.653 -15.936 -3.830 1.00 0.00 H new ATOM 0 HB3 GLN A 124 0.751 -14.200 -4.053 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -1.333 -13.876 -2.780 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -1.553 -15.609 -2.640 1.00 0.00 H new ATOM 0 HE21 GLN A 124 0.862 -16.607 -1.782 1.00 0.00 H new ATOM 0 HE22 GLN A 124 1.279 -15.879 -0.227 1.00 0.00 H new ATOM 1178 N PRO A 125 -2.782 -13.580 -5.158 1.00 0.00 N ATOM 1179 CA PRO A 125 -3.449 -12.285 -5.283 1.00 0.00 C ATOM 1180 C PRO A 125 -2.715 -11.181 -4.491 1.00 0.00 C ATOM 1181 O PRO A 125 -1.898 -11.455 -3.610 1.00 0.00 O ATOM 1182 CB PRO A 125 -4.893 -12.501 -4.806 1.00 0.00 C ATOM 1183 CG PRO A 125 -5.085 -14.015 -4.780 1.00 0.00 C ATOM 1184 CD PRO A 125 -3.676 -14.547 -4.541 1.00 0.00 C ATOM 0 HA PRO A 125 -3.439 -11.932 -6.314 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -5.050 -12.067 -3.818 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -5.605 -12.025 -5.480 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -5.769 -14.320 -3.988 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -5.500 -14.383 -5.718 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -3.470 -14.646 -3.475 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -3.550 -15.535 -4.983 1.00 0.00 H new ATOM 1192 N ILE A 126 -2.993 -9.914 -4.809 1.00 0.00 N ATOM 1193 CA ILE A 126 -2.061 -8.795 -4.536 1.00 0.00 C ATOM 1194 C ILE A 126 -2.489 -7.896 -3.382 1.00 0.00 C ATOM 1195 O ILE A 126 -1.674 -7.581 -2.524 1.00 0.00 O ATOM 1196 CB ILE A 126 -1.847 -7.963 -5.804 1.00 0.00 C ATOM 1197 CG1 ILE A 126 -1.563 -8.953 -6.951 1.00 0.00 C ATOM 1198 CG2 ILE A 126 -0.748 -6.915 -5.548 1.00 0.00 C ATOM 1199 CD1 ILE A 126 -0.869 -8.349 -8.140 1.00 0.00 C ATOM 0 H ILE A 126 -3.862 -9.627 -5.260 1.00 0.00 H new ATOM 0 HA ILE A 126 -1.123 -9.255 -4.225 1.00 0.00 H new ATOM 0 HB ILE A 126 -2.722 -7.380 -6.093 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -0.952 -9.769 -6.566 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -2.507 -9.389 -7.280 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -0.594 -6.322 -6.449 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -1.052 -6.261 -4.731 1.00 0.00 H new ATOM 0 HG23 ILE A 126 0.181 -7.419 -5.283 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -0.710 -9.117 -8.897 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -1.486 -7.552 -8.556 1.00 0.00 H new ATOM 0 HD13 ILE A 126 0.093 -7.939 -7.831 1.00 0.00 H new ATOM 1211 N TYR A 127 -3.772 -7.534 -3.360 1.00 0.00 N ATOM 1212 CA TYR A 127 -4.475 -6.846 -2.275 1.00 0.00 C ATOM 1213 C TYR A 127 -4.151 -5.343 -2.237 1.00 0.00 C ATOM 1214 O TYR A 127 -3.050 -4.930 -1.867 1.00 0.00 O ATOM 1215 CB TYR A 127 -4.201 -7.471 -0.894 1.00 0.00 C ATOM 1216 CG TYR A 127 -4.488 -8.932 -0.593 1.00 0.00 C ATOM 1217 CD1 TYR A 127 -4.289 -9.986 -1.518 1.00 0.00 C ATOM 1218 CD2 TYR A 127 -4.777 -9.236 0.750 1.00 0.00 C ATOM 1219 CE1 TYR A 127 -4.442 -11.323 -1.095 1.00 0.00 C ATOM 1220 CE2 TYR A 127 -4.930 -10.563 1.165 1.00 0.00 C ATOM 1221 CZ TYR A 127 -4.778 -11.617 0.245 1.00 0.00 C ATOM 1222 OH TYR A 127 -4.879 -12.903 0.671 1.00 0.00 O ATOM 0 H TYR A 127 -4.388 -7.726 -4.150 1.00 0.00 H new ATOM 0 HA TYR A 127 -5.535 -6.970 -2.495 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -3.144 -7.310 -0.682 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -4.765 -6.885 -0.168 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -4.022 -9.767 -2.541 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -4.882 -8.436 1.468 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -4.301 -12.128 -1.801 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -5.166 -10.780 2.196 1.00 0.00 H new ATOM 0 HH TYR A 127 -5.117 -12.915 1.622 1.00 0.00 H new ATOM 1232 N ILE A 128 -5.134 -4.512 -2.586 1.00 0.00 N ATOM 1233 CA ILE A 128 -5.056 -3.049 -2.591 1.00 0.00 C ATOM 1234 C ILE A 128 -6.201 -2.428 -1.773 1.00 0.00 C ATOM 1235 O ILE A 128 -7.287 -3.000 -1.668 1.00 0.00 O ATOM 1236 CB ILE A 128 -5.009 -2.570 -4.072 1.00 0.00 C ATOM 1237 CG1 ILE A 128 -3.604 -2.006 -4.348 1.00 0.00 C ATOM 1238 CG2 ILE A 128 -6.117 -1.569 -4.445 1.00 0.00 C ATOM 1239 CD1 ILE A 128 -3.376 -1.592 -5.803 1.00 0.00 C ATOM 0 H ILE A 128 -6.047 -4.854 -2.886 1.00 0.00 H new ATOM 0 HA ILE A 128 -4.146 -2.708 -2.098 1.00 0.00 H new ATOM 0 HB ILE A 128 -5.206 -3.429 -4.713 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -3.437 -1.142 -3.705 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -2.862 -2.756 -4.074 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -6.014 -1.285 -5.492 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -7.092 -2.031 -4.289 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -6.031 -0.681 -3.819 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -2.363 -1.205 -5.917 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -3.509 -2.457 -6.453 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -4.093 -0.818 -6.078 1.00 0.00 H new ATOM 1251 N GLN A 129 -5.973 -1.221 -1.249 1.00 0.00 N ATOM 1252 CA GLN A 129 -6.990 -0.199 -0.963 1.00 0.00 C ATOM 1253 C GLN A 129 -6.346 1.190 -1.068 1.00 0.00 C ATOM 1254 O GLN A 129 -5.124 1.307 -1.002 1.00 0.00 O ATOM 1255 CB GLN A 129 -7.592 -0.389 0.448 1.00 0.00 C ATOM 1256 CG GLN A 129 -9.017 -0.969 0.405 1.00 0.00 C ATOM 1257 CD GLN A 129 -9.632 -1.095 1.798 1.00 0.00 C ATOM 1258 OE1 GLN A 129 -9.084 -1.713 2.699 1.00 0.00 O ATOM 1259 NE2 GLN A 129 -10.800 -0.535 2.036 1.00 0.00 N ATOM 0 H GLN A 129 -5.033 -0.913 -1.000 1.00 0.00 H new ATOM 0 HA GLN A 129 -7.797 -0.296 -1.689 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.950 -1.052 1.028 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.609 0.570 0.965 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.649 -0.330 -0.213 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -8.994 -1.950 -0.070 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -11.276 -0.014 1.299 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -11.229 -0.622 2.957 1.00 0.00 H new ATOM 1268 N PHE A 130 -7.140 2.258 -1.163 1.00 0.00 N ATOM 1269 CA PHE A 130 -6.634 3.618 -0.941 1.00 0.00 C ATOM 1270 C PHE A 130 -5.878 3.733 0.399 1.00 0.00 C ATOM 1271 O PHE A 130 -6.211 3.070 1.388 1.00 0.00 O ATOM 1272 CB PHE A 130 -7.782 4.634 -1.007 1.00 0.00 C ATOM 1273 CG PHE A 130 -8.027 5.268 -2.364 1.00 0.00 C ATOM 1274 CD1 PHE A 130 -6.979 5.928 -3.033 1.00 0.00 C ATOM 1275 CD2 PHE A 130 -9.317 5.269 -2.929 1.00 0.00 C ATOM 1276 CE1 PHE A 130 -7.211 6.577 -4.256 1.00 0.00 C ATOM 1277 CE2 PHE A 130 -9.553 5.933 -4.147 1.00 0.00 C ATOM 1278 CZ PHE A 130 -8.502 6.594 -4.805 1.00 0.00 C ATOM 0 H PHE A 130 -8.133 2.210 -1.391 1.00 0.00 H new ATOM 0 HA PHE A 130 -5.923 3.842 -1.736 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -8.699 4.139 -0.688 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -7.581 5.428 -0.287 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -5.989 5.935 -2.602 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -10.126 4.760 -2.427 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -6.397 7.063 -4.774 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -10.544 5.935 -4.577 1.00 0.00 H new ATOM 0 HZ PHE A 130 -8.688 7.115 -5.733 1.00 0.00 H new ATOM 1288 N SER A 131 -4.844 4.575 0.430 1.00 0.00 N ATOM 1289 CA SER A 131 -4.050 4.815 1.636 1.00 0.00 C ATOM 1290 C SER A 131 -4.859 5.566 2.705 1.00 0.00 C ATOM 1291 O SER A 131 -5.771 6.334 2.387 1.00 0.00 O ATOM 1292 CB SER A 131 -2.765 5.566 1.273 1.00 0.00 C ATOM 1293 OG SER A 131 -2.015 5.939 2.405 1.00 0.00 O ATOM 0 H SER A 131 -4.533 5.110 -0.381 1.00 0.00 H new ATOM 0 HA SER A 131 -3.778 3.852 2.068 1.00 0.00 H new ATOM 0 HB2 SER A 131 -2.152 4.937 0.627 1.00 0.00 H new ATOM 0 HB3 SER A 131 -3.020 6.458 0.701 1.00 0.00 H new ATOM 0 HG SER A 131 -1.206 6.413 2.120 1.00 0.00 H new ATOM 1299 N ASN A 132 -4.486 5.393 3.976 1.00 0.00 N ATOM 1300 CA ASN A 132 -4.930 6.241 5.088 1.00 0.00 C ATOM 1301 C ASN A 132 -4.454 7.702 4.944 1.00 0.00 C ATOM 1302 O ASN A 132 -5.030 8.609 5.552 1.00 0.00 O ATOM 1303 CB ASN A 132 -4.394 5.660 6.409 1.00 0.00 C ATOM 1304 CG ASN A 132 -4.937 4.281 6.746 1.00 0.00 C ATOM 1305 OD1 ASN A 132 -6.101 3.965 6.549 1.00 0.00 O ATOM 1306 ND2 ASN A 132 -4.114 3.422 7.298 1.00 0.00 N ATOM 0 H ASN A 132 -3.855 4.646 4.267 1.00 0.00 H new ATOM 0 HA ASN A 132 -6.020 6.251 5.080 1.00 0.00 H new ATOM 0 HB2 ASN A 132 -3.307 5.607 6.356 1.00 0.00 H new ATOM 0 HB3 ASN A 132 -4.641 6.344 7.221 1.00 0.00 H new ATOM 0 HD21 ASN A 132 -4.446 2.494 7.561 1.00 0.00 H new ATOM 0 HD22 ASN A 132 -3.142 3.682 7.464 1.00 0.00 H new ATOM 1313 N HIS A 133 -3.413 7.931 4.140 1.00 0.00 N ATOM 1314 CA HIS A 133 -2.813 9.226 3.827 1.00 0.00 C ATOM 1315 C HIS A 133 -3.286 9.726 2.444 1.00 0.00 C ATOM 1316 O HIS A 133 -4.054 9.062 1.742 1.00 0.00 O ATOM 1317 CB HIS A 133 -1.276 9.103 3.938 1.00 0.00 C ATOM 1318 CG HIS A 133 -0.821 8.320 5.156 1.00 0.00 C ATOM 1319 ND1 HIS A 133 -0.781 8.747 6.471 1.00 0.00 N ATOM 1320 CD2 HIS A 133 -0.517 6.986 5.163 1.00 0.00 C ATOM 1321 CE1 HIS A 133 -0.450 7.685 7.237 1.00 0.00 C ATOM 1322 NE2 HIS A 133 -0.251 6.601 6.476 1.00 0.00 N ATOM 0 H HIS A 133 -2.938 7.166 3.661 1.00 0.00 H new ATOM 0 HA HIS A 133 -3.139 9.981 4.543 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -0.892 8.619 3.040 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -0.841 10.102 3.974 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -0.488 6.341 4.298 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -0.359 7.707 8.313 1.00 0.00 H new ATOM 0 HE2 HIS A 133 0.038 5.676 6.794 1.00 0.00 H new ATOM 1330 N LYS A 134 -2.853 10.929 2.054 1.00 0.00 N ATOM 1331 CA LYS A 134 -3.372 11.680 0.889 1.00 0.00 C ATOM 1332 C LYS A 134 -2.277 12.171 -0.073 1.00 0.00 C ATOM 1333 O LYS A 134 -2.553 12.956 -0.981 1.00 0.00 O ATOM 1334 CB LYS A 134 -4.242 12.837 1.420 1.00 0.00 C ATOM 1335 CG LYS A 134 -5.539 12.333 2.085 1.00 0.00 C ATOM 1336 CD LYS A 134 -6.409 13.465 2.646 1.00 0.00 C ATOM 1337 CE LYS A 134 -5.781 14.101 3.900 1.00 0.00 C ATOM 1338 NZ LYS A 134 -6.684 15.119 4.498 1.00 0.00 N ATOM 0 H LYS A 134 -2.112 11.427 2.548 1.00 0.00 H new ATOM 0 HA LYS A 134 -3.972 11.003 0.280 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -3.668 13.419 2.141 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -4.494 13.507 0.598 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -6.117 11.766 1.355 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -5.283 11.646 2.892 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -6.548 14.229 1.882 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -7.397 13.076 2.892 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -5.566 13.325 4.635 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -4.830 14.564 3.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -6.234 15.530 5.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -6.869 15.870 3.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -7.582 14.670 4.769 1.00 0.00 H new ATOM 1352 N GLU A 135 -1.039 11.743 0.154 1.00 0.00 N ATOM 1353 CA GLU A 135 0.209 12.248 -0.430 1.00 0.00 C ATOM 1354 C GLU A 135 1.386 11.338 -0.008 1.00 0.00 C ATOM 1355 O GLU A 135 1.339 10.705 1.050 1.00 0.00 O ATOM 1356 CB GLU A 135 0.436 13.690 0.074 1.00 0.00 C ATOM 1357 CG GLU A 135 1.659 14.397 -0.523 1.00 0.00 C ATOM 1358 CD GLU A 135 1.673 15.887 -0.122 1.00 0.00 C ATOM 1359 OE1 GLU A 135 2.047 16.206 1.034 1.00 0.00 O ATOM 1360 OE2 GLU A 135 1.320 16.752 -0.961 1.00 0.00 O ATOM 0 H GLU A 135 -0.864 10.974 0.801 1.00 0.00 H new ATOM 0 HA GLU A 135 0.146 12.247 -1.518 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -0.452 14.281 -0.149 1.00 0.00 H new ATOM 0 HB3 GLU A 135 0.541 13.668 1.159 1.00 0.00 H new ATOM 0 HG2 GLU A 135 2.572 13.913 -0.176 1.00 0.00 H new ATOM 0 HG3 GLU A 135 1.644 14.307 -1.609 1.00 0.00 H new ATOM 1367 N LEU A 136 2.461 11.321 -0.800 1.00 0.00 N ATOM 1368 CA LEU A 136 3.753 10.695 -0.504 1.00 0.00 C ATOM 1369 C LEU A 136 4.900 11.653 -0.873 1.00 0.00 C ATOM 1370 O LEU A 136 5.569 11.496 -1.899 1.00 0.00 O ATOM 1371 CB LEU A 136 3.796 9.349 -1.240 1.00 0.00 C ATOM 1372 CG LEU A 136 5.040 8.476 -1.065 1.00 0.00 C ATOM 1373 CD1 LEU A 136 5.312 8.157 0.395 1.00 0.00 C ATOM 1374 CD2 LEU A 136 4.813 7.169 -1.816 1.00 0.00 C ATOM 0 H LEU A 136 2.453 11.769 -1.716 1.00 0.00 H new ATOM 0 HA LEU A 136 3.878 10.496 0.560 1.00 0.00 H new ATOM 0 HB2 LEU A 136 2.931 8.766 -0.922 1.00 0.00 H new ATOM 0 HB3 LEU A 136 3.673 9.546 -2.305 1.00 0.00 H new ATOM 0 HG LEU A 136 5.900 9.021 -1.454 1.00 0.00 H new ATOM 0 HD11 LEU A 136 6.204 7.535 0.472 1.00 0.00 H new ATOM 0 HD12 LEU A 136 5.467 9.084 0.947 1.00 0.00 H new ATOM 0 HD13 LEU A 136 4.460 7.622 0.815 1.00 0.00 H new ATOM 0 HD21 LEU A 136 5.688 6.529 -1.705 1.00 0.00 H new ATOM 0 HD22 LEU A 136 3.939 6.662 -1.408 1.00 0.00 H new ATOM 0 HD23 LEU A 136 4.649 7.380 -2.873 1.00 0.00 H new ATOM 1386 N LYS A 137 5.099 12.687 -0.045 1.00 0.00 N ATOM 1387 CA LYS A 137 6.183 13.671 -0.180 1.00 0.00 C ATOM 1388 C LYS A 137 7.480 13.092 0.398 1.00 0.00 C ATOM 1389 O LYS A 137 7.751 13.199 1.594 1.00 0.00 O ATOM 1390 CB LYS A 137 5.764 15.009 0.465 1.00 0.00 C ATOM 1391 CG LYS A 137 6.779 16.155 0.279 1.00 0.00 C ATOM 1392 CD LYS A 137 6.975 16.571 -1.193 1.00 0.00 C ATOM 1393 CE LYS A 137 7.912 17.779 -1.348 1.00 0.00 C ATOM 1394 NZ LYS A 137 7.290 19.047 -0.881 1.00 0.00 N ATOM 0 H LYS A 137 4.496 12.868 0.758 1.00 0.00 H new ATOM 0 HA LYS A 137 6.376 13.884 -1.231 1.00 0.00 H new ATOM 0 HB2 LYS A 137 4.807 15.317 0.044 1.00 0.00 H new ATOM 0 HB3 LYS A 137 5.607 14.850 1.532 1.00 0.00 H new ATOM 0 HG2 LYS A 137 6.446 17.021 0.852 1.00 0.00 H new ATOM 0 HG3 LYS A 137 7.740 15.849 0.693 1.00 0.00 H new ATOM 0 HD2 LYS A 137 7.380 15.728 -1.754 1.00 0.00 H new ATOM 0 HD3 LYS A 137 6.006 16.810 -1.631 1.00 0.00 H new ATOM 0 HE2 LYS A 137 8.828 17.599 -0.785 1.00 0.00 H new ATOM 0 HE3 LYS A 137 8.196 17.882 -2.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 7.962 19.830 -1.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 6.430 19.236 -1.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 7.042 18.962 0.125 1.00 0.00 H new