USER MOD reduce.3.24.130724 H: found=0, std=0, add=901, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 903 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: B 30 ASN : amide:sc= 1.33! K(o=2.6!,f=-2.4) USER MOD Set 1.2: B 35 LYS NZ :NH3+ -172:sc= 1.23 (180deg=0) USER MOD Set 2.1: A 20 LYS NZ :NH3+ 162:sc= -4.03! (180deg=-4.01!) USER MOD Set 2.2: A 21 GLN : amide:sc= 0.421 K(o=-3.6,f=-5.2) USER MOD Single : A 6 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 LYS NZ :NH3+ 156:sc= -0.158 (180deg=-0.677) USER MOD Single : A 15 CYS SG : rot -96:sc= 1.25 USER MOD Single : A 19 MET CE :methyl -156:sc= -0.96 (180deg=-2.11!) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 84:sc= 1.21 USER MOD Single : A 30 ASN : amide:sc= -2.01! C(o=-2!,f=-4.1!) USER MOD Single : A 34 LYS NZ :NH3+ -139:sc= 0.713 (180deg=-2!) USER MOD Single : A 35 LYS NZ :NH3+ -159:sc= 1.31 (180deg=1.18) USER MOD Single : A 39 GLN : amide:sc= -1.39 K(o=-1.4,f=-0.063) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 HIS : no HD1:sc= -7.89! C(o=-7.9!,f=-8.7!) USER MOD Single : A 54 ASN : amide:sc= -0.238 K(o=-0.24,f=-4.5!) USER MOD Single : A 57 GLN : amide:sc= -2.94! K(o=-2.9!,f=-0.27) USER MOD Single : B 6 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 CYS SG : rot 180:sc= 0.358 USER MOD Single : B 19 MET CE :methyl -134:sc= -0.446 (180deg=-1.83) USER MOD Single : B 20 LYS NZ :NH3+ 162:sc= 1.02 (180deg=0.579) USER MOD Single : B 21 GLN : amide:sc= -2.11! C(o=-2.1!,f=-3.7!) USER MOD Single : B 25 TYR OH : rot 180:sc= 0 USER MOD Single : B 29 SER OG : rot 180:sc= 0 USER MOD Single : B 34 LYS NZ :NH3+ -169:sc= 0.995 (180deg=0.902) USER MOD Single : B 39 GLN : amide:sc= -0.0205 K(o=-0.021,f=-3.8!) USER MOD Single : B 44 THR OG1 : rot 170:sc=-0.00246 USER MOD Single : B 45 HIS : no HD1:sc= -6.21! C(o=-6.2!,f=-6.9!) USER MOD Single : B 54 ASN : amide:sc= -0.0611 K(o=-0.061,f=-2.4!) USER MOD Single : B 57 GLN : amide:sc= -1.57 K(o=-1.6,f=-0.45) USER MOD ----------------------------------------------------------------- ATOM 56 N VAL A 5 -6.223 -8.331 7.549 1.00 0.00 N ATOM 57 CA VAL A 5 -7.098 -7.189 7.200 1.00 0.00 C ATOM 58 C VAL A 5 -6.485 -5.851 7.602 1.00 0.00 C ATOM 59 O VAL A 5 -6.506 -5.458 8.771 1.00 0.00 O ATOM 60 CB VAL A 5 -8.525 -7.346 7.807 1.00 0.00 C ATOM 61 CG1 VAL A 5 -9.376 -6.095 7.587 1.00 0.00 C ATOM 62 CG2 VAL A 5 -9.217 -8.554 7.203 1.00 0.00 C ATOM 0 HA VAL A 5 -7.192 -7.195 6.114 1.00 0.00 H new ATOM 0 HB VAL A 5 -8.413 -7.488 8.882 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -10.363 -6.245 8.025 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -8.895 -5.240 8.061 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -9.478 -5.908 6.518 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -10.213 -8.655 7.633 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -9.299 -8.424 6.124 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -8.636 -9.451 7.417 1.00 0.00 H new ATOM 72 N ASN A 6 -5.936 -5.177 6.618 1.00 0.00 N ATOM 73 CA ASN A 6 -5.202 -3.953 6.811 1.00 0.00 C ATOM 74 C ASN A 6 -5.374 -3.055 5.652 1.00 0.00 C ATOM 75 O ASN A 6 -5.088 -3.423 4.505 1.00 0.00 O ATOM 76 CB ASN A 6 -3.696 -4.190 7.018 1.00 0.00 C ATOM 77 CG ASN A 6 -3.315 -4.520 8.446 1.00 0.00 C ATOM 78 OD1 ASN A 6 -3.005 -3.630 9.242 1.00 0.00 O ATOM 79 ND2 ASN A 6 -3.334 -5.769 8.785 1.00 0.00 N ATOM 0 H ASN A 6 -5.990 -5.472 5.643 1.00 0.00 H new ATOM 0 HA ASN A 6 -5.608 -3.498 7.714 1.00 0.00 H new ATOM 0 HB2 ASN A 6 -3.374 -5.005 6.369 1.00 0.00 H new ATOM 0 HB3 ASN A 6 -3.152 -3.299 6.704 1.00 0.00 H new ATOM 0 HD21 ASN A 6 -3.088 -6.043 9.736 1.00 0.00 H new ATOM 0 HD22 ASN A 6 -3.595 -6.479 8.101 1.00 0.00 H new ATOM 86 N VAL A 7 -5.892 -1.930 5.917 1.00 0.00 N ATOM 87 CA VAL A 7 -5.973 -0.899 4.948 1.00 0.00 C ATOM 88 C VAL A 7 -5.130 0.253 5.471 1.00 0.00 C ATOM 89 O VAL A 7 -5.264 0.658 6.630 1.00 0.00 O ATOM 90 CB VAL A 7 -7.453 -0.497 4.624 1.00 0.00 C ATOM 91 CG1 VAL A 7 -8.250 -0.227 5.895 1.00 0.00 C ATOM 92 CG2 VAL A 7 -7.524 0.715 3.711 1.00 0.00 C ATOM 0 H VAL A 7 -6.282 -1.684 6.827 1.00 0.00 H new ATOM 0 HA VAL A 7 -5.584 -1.235 3.987 1.00 0.00 H new ATOM 0 HB VAL A 7 -7.896 -1.347 4.104 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -9.271 0.049 5.632 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -8.264 -1.125 6.513 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -7.785 0.588 6.450 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -8.567 0.960 3.512 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -7.038 1.563 4.194 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -7.018 0.493 2.772 1.00 0.00 H new ATOM 102 N LEU A 8 -4.277 0.756 4.656 1.00 0.00 N ATOM 103 CA LEU A 8 -3.285 1.648 5.114 1.00 0.00 C ATOM 104 C LEU A 8 -3.046 2.770 4.093 1.00 0.00 C ATOM 105 O LEU A 8 -3.353 2.614 2.926 1.00 0.00 O ATOM 106 CB LEU A 8 -2.061 0.783 5.353 1.00 0.00 C ATOM 107 CG LEU A 8 -0.941 1.354 6.155 1.00 0.00 C ATOM 108 CD1 LEU A 8 -1.475 1.962 7.426 1.00 0.00 C ATOM 109 CD2 LEU A 8 0.008 0.241 6.492 1.00 0.00 C ATOM 0 H LEU A 8 -4.249 0.560 3.655 1.00 0.00 H new ATOM 0 HA LEU A 8 -3.570 2.167 6.029 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -2.391 -0.132 5.845 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -1.661 0.495 4.381 1.00 0.00 H new ATOM 0 HG LEU A 8 -0.431 2.130 5.584 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -0.650 2.377 8.006 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -2.181 2.755 7.181 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -1.980 1.194 8.012 1.00 0.00 H new ATOM 0 HD21 LEU A 8 0.837 0.635 7.080 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -0.515 -0.521 7.069 1.00 0.00 H new ATOM 0 HD23 LEU A 8 0.392 -0.200 5.572 1.00 0.00 H new ATOM 121 N LYS A 9 -2.535 3.893 4.546 1.00 0.00 N ATOM 122 CA LYS A 9 -2.350 5.071 3.699 1.00 0.00 C ATOM 123 C LYS A 9 -0.858 5.415 3.627 1.00 0.00 C ATOM 124 O LYS A 9 -0.215 5.619 4.661 1.00 0.00 O ATOM 125 CB LYS A 9 -3.196 6.211 4.307 1.00 0.00 C ATOM 126 CG LYS A 9 -3.267 7.553 3.554 1.00 0.00 C ATOM 127 CD LYS A 9 -1.984 8.369 3.663 1.00 0.00 C ATOM 128 CE LYS A 9 -2.171 9.772 3.130 1.00 0.00 C ATOM 129 NZ LYS A 9 -3.182 10.513 3.908 1.00 0.00 N ATOM 0 H LYS A 9 -2.233 4.025 5.511 1.00 0.00 H new ATOM 0 HA LYS A 9 -2.681 4.897 2.675 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -4.215 5.842 4.424 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -2.813 6.412 5.307 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -3.481 7.362 2.502 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -4.098 8.139 3.946 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -1.668 8.414 4.705 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -1.187 7.872 3.109 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -1.221 10.305 3.164 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -2.475 9.728 2.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -3.013 11.535 3.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -4.131 10.284 3.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -3.115 10.243 4.910 1.00 0.00 H new ATOM 143 N GLY A 10 -0.323 5.488 2.423 1.00 0.00 N ATOM 144 CA GLY A 10 1.093 5.701 2.230 1.00 0.00 C ATOM 145 C GLY A 10 1.486 5.430 0.792 1.00 0.00 C ATOM 146 O GLY A 10 0.751 5.804 -0.123 1.00 0.00 O ATOM 0 H GLY A 10 -0.857 5.402 1.558 1.00 0.00 H new ATOM 0 HA2 GLY A 10 1.351 6.726 2.495 1.00 0.00 H new ATOM 0 HA3 GLY A 10 1.658 5.048 2.895 1.00 0.00 H new ATOM 150 N VAL A 11 2.617 4.781 0.610 1.00 0.00 N ATOM 151 CA VAL A 11 3.164 4.409 -0.689 1.00 0.00 C ATOM 152 C VAL A 11 3.194 2.890 -0.840 1.00 0.00 C ATOM 153 O VAL A 11 3.591 2.161 0.079 1.00 0.00 O ATOM 154 CB VAL A 11 4.626 4.963 -0.880 1.00 0.00 C ATOM 155 CG1 VAL A 11 5.295 4.391 -2.119 1.00 0.00 C ATOM 156 CG2 VAL A 11 4.618 6.455 -0.993 1.00 0.00 C ATOM 0 H VAL A 11 3.206 4.485 1.388 1.00 0.00 H new ATOM 0 HA VAL A 11 2.516 4.848 -1.448 1.00 0.00 H new ATOM 0 HB VAL A 11 5.190 4.655 0.000 1.00 0.00 H new ATOM 0 HG11 VAL A 11 6.301 4.800 -2.211 1.00 0.00 H new ATOM 0 HG12 VAL A 11 5.351 3.306 -2.034 1.00 0.00 H new ATOM 0 HG13 VAL A 11 4.713 4.656 -3.002 1.00 0.00 H new ATOM 0 HG21 VAL A 11 5.638 6.815 -1.124 1.00 0.00 H new ATOM 0 HG22 VAL A 11 4.015 6.752 -1.851 1.00 0.00 H new ATOM 0 HG23 VAL A 11 4.195 6.886 -0.086 1.00 0.00 H new ATOM 166 N LEU A 12 2.765 2.449 -1.979 1.00 0.00 N ATOM 167 CA LEU A 12 2.808 1.068 -2.379 1.00 0.00 C ATOM 168 C LEU A 12 3.933 0.933 -3.382 1.00 0.00 C ATOM 169 O LEU A 12 3.938 1.656 -4.365 1.00 0.00 O ATOM 170 CB LEU A 12 1.503 0.727 -3.089 1.00 0.00 C ATOM 171 CG LEU A 12 1.457 -0.595 -3.849 1.00 0.00 C ATOM 172 CD1 LEU A 12 1.425 -1.776 -2.908 1.00 0.00 C ATOM 173 CD2 LEU A 12 0.292 -0.613 -4.811 1.00 0.00 C ATOM 0 H LEU A 12 2.358 3.060 -2.687 1.00 0.00 H new ATOM 0 HA LEU A 12 2.952 0.414 -1.519 1.00 0.00 H new ATOM 0 HB2 LEU A 12 0.705 0.720 -2.347 1.00 0.00 H new ATOM 0 HB3 LEU A 12 1.279 1.530 -3.791 1.00 0.00 H new ATOM 0 HG LEU A 12 2.374 -0.682 -4.432 1.00 0.00 H new ATOM 0 HD11 LEU A 12 1.393 -2.700 -3.485 1.00 0.00 H new ATOM 0 HD12 LEU A 12 2.319 -1.769 -2.284 1.00 0.00 H new ATOM 0 HD13 LEU A 12 0.540 -1.713 -2.274 1.00 0.00 H new ATOM 0 HD21 LEU A 12 0.275 -1.564 -5.344 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -0.639 -0.491 -4.257 1.00 0.00 H new ATOM 0 HD23 LEU A 12 0.398 0.202 -5.526 1.00 0.00 H new ATOM 185 N ILE A 13 4.873 0.050 -3.152 1.00 0.00 N ATOM 186 CA ILE A 13 5.960 -0.111 -4.103 1.00 0.00 C ATOM 187 C ILE A 13 6.077 -1.553 -4.635 1.00 0.00 C ATOM 188 O ILE A 13 6.076 -2.502 -3.859 1.00 0.00 O ATOM 189 CB ILE A 13 7.331 0.405 -3.513 1.00 0.00 C ATOM 190 CG1 ILE A 13 8.483 0.249 -4.525 1.00 0.00 C ATOM 191 CG2 ILE A 13 7.676 -0.281 -2.196 1.00 0.00 C ATOM 192 CD1 ILE A 13 9.804 0.842 -4.063 1.00 0.00 C ATOM 0 H ILE A 13 4.915 -0.559 -2.335 1.00 0.00 H new ATOM 0 HA ILE A 13 5.714 0.515 -4.961 1.00 0.00 H new ATOM 0 HB ILE A 13 7.203 1.469 -3.312 1.00 0.00 H new ATOM 0 HG12 ILE A 13 8.627 -0.811 -4.734 1.00 0.00 H new ATOM 0 HG13 ILE A 13 8.194 0.722 -5.463 1.00 0.00 H new ATOM 0 HG21 ILE A 13 8.626 0.102 -1.824 1.00 0.00 H new ATOM 0 HG22 ILE A 13 6.893 -0.080 -1.465 1.00 0.00 H new ATOM 0 HG23 ILE A 13 7.756 -1.356 -2.356 1.00 0.00 H new ATOM 0 HD11 ILE A 13 10.560 0.689 -4.833 1.00 0.00 H new ATOM 0 HD12 ILE A 13 9.680 1.910 -3.883 1.00 0.00 H new ATOM 0 HD13 ILE A 13 10.120 0.353 -3.142 1.00 0.00 H new ATOM 204 N GLU A 14 6.069 -1.703 -5.969 1.00 0.00 N ATOM 205 CA GLU A 14 6.393 -2.975 -6.625 1.00 0.00 C ATOM 206 C GLU A 14 7.452 -2.695 -7.626 1.00 0.00 C ATOM 207 O GLU A 14 7.289 -1.765 -8.440 1.00 0.00 O ATOM 208 CB GLU A 14 5.249 -3.611 -7.422 1.00 0.00 C ATOM 209 CG GLU A 14 5.661 -4.999 -7.980 1.00 0.00 C ATOM 210 CD GLU A 14 4.715 -5.627 -8.987 1.00 0.00 C ATOM 211 OE1 GLU A 14 3.694 -6.219 -8.583 1.00 0.00 O ATOM 212 OE2 GLU A 14 4.993 -5.587 -10.185 1.00 0.00 O ATOM 0 H GLU A 14 5.839 -0.950 -6.618 1.00 0.00 H new ATOM 0 HA GLU A 14 6.665 -3.662 -5.823 1.00 0.00 H new ATOM 0 HB2 GLU A 14 4.372 -3.718 -6.783 1.00 0.00 H new ATOM 0 HB3 GLU A 14 4.966 -2.954 -8.245 1.00 0.00 H new ATOM 0 HG2 GLU A 14 6.642 -4.903 -8.446 1.00 0.00 H new ATOM 0 HG3 GLU A 14 5.772 -5.686 -7.141 1.00 0.00 H new ATOM 219 N CYS A 15 8.481 -3.492 -7.611 1.00 0.00 N ATOM 220 CA CYS A 15 9.570 -3.347 -8.535 1.00 0.00 C ATOM 221 C CYS A 15 10.347 -4.635 -8.581 1.00 0.00 C ATOM 222 O CYS A 15 10.344 -5.350 -9.576 1.00 0.00 O ATOM 223 CB CYS A 15 10.477 -2.229 -8.072 1.00 0.00 C ATOM 224 SG CYS A 15 11.803 -1.775 -9.208 1.00 0.00 S ATOM 0 H CYS A 15 8.589 -4.265 -6.954 1.00 0.00 H new ATOM 0 HA CYS A 15 9.184 -3.112 -9.527 1.00 0.00 H new ATOM 0 HB2 CYS A 15 9.867 -1.346 -7.883 1.00 0.00 H new ATOM 0 HB3 CYS A 15 10.922 -2.518 -7.120 1.00 0.00 H new ATOM 0 HG CYS A 15 12.897 -2.388 -8.865 1.00 0.00 H new ATOM 230 N ASP A 16 10.973 -4.951 -7.476 1.00 0.00 N ATOM 231 CA ASP A 16 11.805 -6.101 -7.382 1.00 0.00 C ATOM 232 C ASP A 16 11.451 -6.859 -6.141 1.00 0.00 C ATOM 233 O ASP A 16 11.310 -6.269 -5.071 1.00 0.00 O ATOM 234 CB ASP A 16 13.296 -5.719 -7.319 1.00 0.00 C ATOM 235 CG ASP A 16 13.828 -5.084 -8.580 1.00 0.00 C ATOM 236 OD1 ASP A 16 14.316 -5.810 -9.470 1.00 0.00 O ATOM 237 OD2 ASP A 16 13.812 -3.847 -8.690 1.00 0.00 O ATOM 0 H ASP A 16 10.913 -4.407 -6.615 1.00 0.00 H new ATOM 0 HA ASP A 16 11.643 -6.710 -8.272 1.00 0.00 H new ATOM 0 HB2 ASP A 16 13.448 -5.031 -6.488 1.00 0.00 H new ATOM 0 HB3 ASP A 16 13.879 -6.614 -7.103 1.00 0.00 H new ATOM 242 N PRO A 17 11.301 -8.164 -6.232 1.00 0.00 N ATOM 243 CA PRO A 17 11.005 -9.004 -5.073 1.00 0.00 C ATOM 244 C PRO A 17 12.276 -9.190 -4.243 1.00 0.00 C ATOM 245 O PRO A 17 12.249 -9.439 -3.041 1.00 0.00 O ATOM 246 CB PRO A 17 10.552 -10.320 -5.726 1.00 0.00 C ATOM 247 CG PRO A 17 10.350 -9.967 -7.170 1.00 0.00 C ATOM 248 CD PRO A 17 11.368 -8.964 -7.454 1.00 0.00 C ATOM 0 HA PRO A 17 10.258 -8.597 -4.391 1.00 0.00 H new ATOM 0 HB2 PRO A 17 11.303 -11.101 -5.609 1.00 0.00 H new ATOM 0 HB3 PRO A 17 9.632 -10.692 -5.275 1.00 0.00 H new ATOM 0 HG2 PRO A 17 10.466 -10.841 -7.811 1.00 0.00 H new ATOM 0 HG3 PRO A 17 9.348 -9.574 -7.345 1.00 0.00 H new ATOM 0 HD2 PRO A 17 12.353 -9.405 -7.608 1.00 0.00 H new ATOM 0 HD3 PRO A 17 11.138 -8.380 -8.345 1.00 0.00 H new ATOM 256 N ALA A 18 13.381 -8.980 -4.909 1.00 0.00 N ATOM 257 CA ALA A 18 14.691 -9.039 -4.328 1.00 0.00 C ATOM 258 C ALA A 18 14.881 -7.860 -3.380 1.00 0.00 C ATOM 259 O ALA A 18 15.273 -8.023 -2.213 1.00 0.00 O ATOM 260 CB ALA A 18 15.689 -8.963 -5.449 1.00 0.00 C ATOM 0 H ALA A 18 13.391 -8.756 -5.904 1.00 0.00 H new ATOM 0 HA ALA A 18 14.824 -9.962 -3.763 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.699 -9.005 -5.041 1.00 0.00 H new ATOM 0 HB2 ALA A 18 15.537 -9.801 -6.129 1.00 0.00 H new ATOM 0 HB3 ALA A 18 15.556 -8.027 -5.992 1.00 0.00 H new ATOM 266 N MET A 19 14.500 -6.670 -3.863 1.00 0.00 N ATOM 267 CA MET A 19 14.621 -5.443 -3.081 1.00 0.00 C ATOM 268 C MET A 19 13.705 -5.552 -1.881 1.00 0.00 C ATOM 269 O MET A 19 13.957 -4.979 -0.868 1.00 0.00 O ATOM 270 CB MET A 19 14.208 -4.190 -3.900 1.00 0.00 C ATOM 271 CG MET A 19 12.726 -3.841 -3.752 1.00 0.00 C ATOM 272 SD MET A 19 12.051 -2.826 -5.056 1.00 0.00 S ATOM 273 CE MET A 19 10.347 -2.804 -4.512 1.00 0.00 C ATOM 0 H MET A 19 14.105 -6.536 -4.794 1.00 0.00 H new ATOM 0 HA MET A 19 15.664 -5.328 -2.786 1.00 0.00 H new ATOM 0 HB2 MET A 19 14.810 -3.339 -3.580 1.00 0.00 H new ATOM 0 HB3 MET A 19 14.432 -4.361 -4.953 1.00 0.00 H new ATOM 0 HG2 MET A 19 12.154 -4.768 -3.702 1.00 0.00 H new ATOM 0 HG3 MET A 19 12.583 -3.326 -2.802 1.00 0.00 H new ATOM 0 HE1 MET A 19 9.696 -2.604 -5.363 1.00 0.00 H new ATOM 0 HE2 MET A 19 10.091 -3.771 -4.078 1.00 0.00 H new ATOM 0 HE3 MET A 19 10.214 -2.024 -3.763 1.00 0.00 H new ATOM 283 N LYS A 20 12.617 -6.313 -2.041 1.00 0.00 N ATOM 284 CA LYS A 20 11.611 -6.464 -1.021 1.00 0.00 C ATOM 285 C LYS A 20 12.279 -6.994 0.239 1.00 0.00 C ATOM 286 O LYS A 20 12.031 -6.529 1.369 1.00 0.00 O ATOM 287 CB LYS A 20 10.549 -7.453 -1.513 1.00 0.00 C ATOM 288 CG LYS A 20 9.144 -7.234 -0.970 1.00 0.00 C ATOM 289 CD LYS A 20 9.031 -7.259 0.546 1.00 0.00 C ATOM 290 CE LYS A 20 9.166 -8.611 1.199 1.00 0.00 C ATOM 291 NZ LYS A 20 10.463 -9.250 1.062 1.00 0.00 N ATOM 0 H LYS A 20 12.422 -6.839 -2.893 1.00 0.00 H new ATOM 0 HA LYS A 20 11.133 -5.508 -0.805 1.00 0.00 H new ATOM 0 HB2 LYS A 20 10.510 -7.405 -2.601 1.00 0.00 H new ATOM 0 HB3 LYS A 20 10.868 -8.462 -1.250 1.00 0.00 H new ATOM 0 HG2 LYS A 20 8.777 -6.273 -1.331 1.00 0.00 H new ATOM 0 HG3 LYS A 20 8.488 -8.001 -1.381 1.00 0.00 H new ATOM 0 HD2 LYS A 20 9.796 -6.601 0.958 1.00 0.00 H new ATOM 0 HD3 LYS A 20 8.065 -6.838 0.825 1.00 0.00 H new ATOM 0 HE2 LYS A 20 8.944 -8.505 2.261 1.00 0.00 H new ATOM 0 HE3 LYS A 20 8.409 -9.274 0.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 10.557 -10.000 1.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 10.548 -9.664 0.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 11.214 -8.544 1.200 1.00 0.00 H new ATOM 305 N GLN A 21 13.103 -7.981 0.030 1.00 0.00 N ATOM 306 CA GLN A 21 13.845 -8.627 1.078 1.00 0.00 C ATOM 307 C GLN A 21 14.821 -7.638 1.685 1.00 0.00 C ATOM 308 O GLN A 21 14.989 -7.576 2.901 1.00 0.00 O ATOM 309 CB GLN A 21 14.532 -9.835 0.483 1.00 0.00 C ATOM 310 CG GLN A 21 13.529 -10.864 -0.030 1.00 0.00 C ATOM 311 CD GLN A 21 12.847 -11.609 1.079 1.00 0.00 C ATOM 312 OE1 GLN A 21 13.409 -11.802 2.153 1.00 0.00 O ATOM 313 NE2 GLN A 21 11.653 -12.042 0.837 1.00 0.00 N ATOM 0 H GLN A 21 13.283 -8.369 -0.896 1.00 0.00 H new ATOM 0 HA GLN A 21 13.195 -8.965 1.885 1.00 0.00 H new ATOM 0 HB2 GLN A 21 15.178 -9.519 -0.336 1.00 0.00 H new ATOM 0 HB3 GLN A 21 15.172 -10.296 1.235 1.00 0.00 H new ATOM 0 HG2 GLN A 21 12.778 -10.361 -0.640 1.00 0.00 H new ATOM 0 HG3 GLN A 21 14.042 -11.575 -0.678 1.00 0.00 H new ATOM 0 HE21 GLN A 21 11.219 -11.862 -0.068 1.00 0.00 H new ATOM 0 HE22 GLN A 21 11.145 -12.564 1.551 1.00 0.00 H new ATOM 322 N PHE A 22 15.396 -6.822 0.831 1.00 0.00 N ATOM 323 CA PHE A 22 16.267 -5.750 1.255 1.00 0.00 C ATOM 324 C PHE A 22 15.529 -4.703 2.128 1.00 0.00 C ATOM 325 O PHE A 22 16.098 -4.250 3.103 1.00 0.00 O ATOM 326 CB PHE A 22 17.027 -5.136 0.035 1.00 0.00 C ATOM 327 CG PHE A 22 17.054 -3.621 -0.076 1.00 0.00 C ATOM 328 CD1 PHE A 22 17.908 -2.845 0.693 1.00 0.00 C ATOM 329 CD2 PHE A 22 16.220 -2.985 -0.975 1.00 0.00 C ATOM 330 CE1 PHE A 22 17.911 -1.466 0.558 1.00 0.00 C ATOM 331 CE2 PHE A 22 16.224 -1.623 -1.115 1.00 0.00 C ATOM 332 CZ PHE A 22 17.065 -0.861 -0.352 1.00 0.00 C ATOM 0 H PHE A 22 15.272 -6.883 -0.180 1.00 0.00 H new ATOM 0 HA PHE A 22 17.029 -6.170 1.912 1.00 0.00 H new ATOM 0 HB2 PHE A 22 18.057 -5.491 0.066 1.00 0.00 H new ATOM 0 HB3 PHE A 22 16.580 -5.533 -0.876 1.00 0.00 H new ATOM 0 HD1 PHE A 22 18.574 -3.317 1.400 1.00 0.00 H new ATOM 0 HD2 PHE A 22 15.549 -3.576 -1.581 1.00 0.00 H new ATOM 0 HE1 PHE A 22 18.574 -0.865 1.163 1.00 0.00 H new ATOM 0 HE2 PHE A 22 15.564 -1.151 -1.827 1.00 0.00 H new ATOM 0 HZ PHE A 22 17.068 0.214 -0.461 1.00 0.00 H new ATOM 342 N LEU A 23 14.243 -4.361 1.813 1.00 0.00 N ATOM 343 CA LEU A 23 13.528 -3.356 2.632 1.00 0.00 C ATOM 344 C LEU A 23 13.394 -3.815 4.029 1.00 0.00 C ATOM 345 O LEU A 23 13.740 -3.101 4.948 1.00 0.00 O ATOM 346 CB LEU A 23 12.088 -3.003 2.167 1.00 0.00 C ATOM 347 CG LEU A 23 11.853 -2.282 0.846 1.00 0.00 C ATOM 348 CD1 LEU A 23 12.933 -1.273 0.511 1.00 0.00 C ATOM 349 CD2 LEU A 23 11.555 -3.233 -0.270 1.00 0.00 C ATOM 0 H LEU A 23 13.709 -4.749 1.035 1.00 0.00 H new ATOM 0 HA LEU A 23 14.151 -2.468 2.523 1.00 0.00 H new ATOM 0 HB2 LEU A 23 11.526 -3.936 2.128 1.00 0.00 H new ATOM 0 HB3 LEU A 23 11.638 -2.393 2.950 1.00 0.00 H new ATOM 0 HG LEU A 23 10.952 -1.684 0.981 1.00 0.00 H new ATOM 0 HD11 LEU A 23 12.703 -0.797 -0.442 1.00 0.00 H new ATOM 0 HD12 LEU A 23 12.979 -0.516 1.294 1.00 0.00 H new ATOM 0 HD13 LEU A 23 13.895 -1.780 0.440 1.00 0.00 H new ATOM 0 HD21 LEU A 23 11.395 -2.674 -1.192 1.00 0.00 H new ATOM 0 HD22 LEU A 23 12.395 -3.915 -0.401 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.658 -3.804 -0.031 1.00 0.00 H new ATOM 361 N LEU A 24 12.923 -5.015 4.203 1.00 0.00 N ATOM 362 CA LEU A 24 12.734 -5.501 5.539 1.00 0.00 C ATOM 363 C LEU A 24 14.002 -5.747 6.308 1.00 0.00 C ATOM 364 O LEU A 24 14.072 -5.416 7.488 1.00 0.00 O ATOM 365 CB LEU A 24 11.663 -6.559 5.658 1.00 0.00 C ATOM 366 CG LEU A 24 11.610 -7.620 4.596 1.00 0.00 C ATOM 367 CD1 LEU A 24 12.604 -8.739 4.819 1.00 0.00 C ATOM 368 CD2 LEU A 24 10.221 -8.120 4.494 1.00 0.00 C ATOM 0 H LEU A 24 12.668 -5.662 3.457 1.00 0.00 H new ATOM 0 HA LEU A 24 12.308 -4.660 6.085 1.00 0.00 H new ATOM 0 HB2 LEU A 24 11.786 -7.054 6.621 1.00 0.00 H new ATOM 0 HB3 LEU A 24 10.696 -6.057 5.679 1.00 0.00 H new ATOM 0 HG LEU A 24 11.908 -7.172 3.648 1.00 0.00 H new ATOM 0 HD11 LEU A 24 12.513 -9.471 4.017 1.00 0.00 H new ATOM 0 HD12 LEU A 24 13.615 -8.332 4.826 1.00 0.00 H new ATOM 0 HD13 LEU A 24 12.401 -9.221 5.775 1.00 0.00 H new ATOM 0 HD21 LEU A 24 10.168 -8.892 3.726 1.00 0.00 H new ATOM 0 HD22 LEU A 24 9.914 -8.540 5.452 1.00 0.00 H new ATOM 0 HD23 LEU A 24 9.557 -7.297 4.229 1.00 0.00 H new ATOM 380 N TYR A 25 15.027 -6.262 5.634 1.00 0.00 N ATOM 381 CA TYR A 25 16.318 -6.437 6.267 1.00 0.00 C ATOM 382 C TYR A 25 16.868 -5.084 6.692 1.00 0.00 C ATOM 383 O TYR A 25 17.358 -4.922 7.808 1.00 0.00 O ATOM 384 CB TYR A 25 17.322 -7.145 5.333 1.00 0.00 C ATOM 385 CG TYR A 25 18.752 -7.145 5.863 1.00 0.00 C ATOM 386 CD1 TYR A 25 19.154 -8.024 6.860 1.00 0.00 C ATOM 387 CD2 TYR A 25 19.691 -6.236 5.373 1.00 0.00 C ATOM 388 CE1 TYR A 25 20.449 -8.000 7.349 1.00 0.00 C ATOM 389 CE2 TYR A 25 20.981 -6.205 5.860 1.00 0.00 C ATOM 390 CZ TYR A 25 21.357 -7.086 6.844 1.00 0.00 C ATOM 391 OH TYR A 25 22.649 -7.051 7.334 1.00 0.00 O ATOM 0 H TYR A 25 14.984 -6.561 4.660 1.00 0.00 H new ATOM 0 HA TYR A 25 16.179 -7.070 7.143 1.00 0.00 H new ATOM 0 HB2 TYR A 25 17.000 -8.175 5.181 1.00 0.00 H new ATOM 0 HB3 TYR A 25 17.305 -6.658 4.358 1.00 0.00 H new ATOM 0 HD1 TYR A 25 18.447 -8.736 7.259 1.00 0.00 H new ATOM 0 HD2 TYR A 25 19.402 -5.543 4.597 1.00 0.00 H new ATOM 0 HE1 TYR A 25 20.749 -8.692 8.122 1.00 0.00 H new ATOM 0 HE2 TYR A 25 21.692 -5.492 5.470 1.00 0.00 H new ATOM 0 HH TYR A 25 23.156 -6.352 6.870 1.00 0.00 H new ATOM 401 N LEU A 26 16.753 -4.116 5.817 1.00 0.00 N ATOM 402 CA LEU A 26 17.272 -2.802 6.066 1.00 0.00 C ATOM 403 C LEU A 26 16.484 -2.141 7.190 1.00 0.00 C ATOM 404 O LEU A 26 17.064 -1.530 8.060 1.00 0.00 O ATOM 405 CB LEU A 26 17.218 -1.955 4.776 1.00 0.00 C ATOM 406 CG LEU A 26 18.131 -0.708 4.679 1.00 0.00 C ATOM 407 CD1 LEU A 26 17.891 0.317 5.775 1.00 0.00 C ATOM 408 CD2 LEU A 26 19.581 -1.134 4.614 1.00 0.00 C ATOM 0 H LEU A 26 16.295 -4.221 4.912 1.00 0.00 H new ATOM 0 HA LEU A 26 18.314 -2.878 6.375 1.00 0.00 H new ATOM 0 HB2 LEU A 26 17.458 -2.609 3.938 1.00 0.00 H new ATOM 0 HB3 LEU A 26 16.188 -1.625 4.638 1.00 0.00 H new ATOM 0 HG LEU A 26 17.868 -0.194 3.755 1.00 0.00 H new ATOM 0 HD11 LEU A 26 18.568 1.160 5.639 1.00 0.00 H new ATOM 0 HD12 LEU A 26 16.860 0.668 5.726 1.00 0.00 H new ATOM 0 HD13 LEU A 26 18.073 -0.141 6.747 1.00 0.00 H new ATOM 0 HD21 LEU A 26 20.217 -0.251 4.546 1.00 0.00 H new ATOM 0 HD22 LEU A 26 19.836 -1.696 5.512 1.00 0.00 H new ATOM 0 HD23 LEU A 26 19.737 -1.762 3.737 1.00 0.00 H new ATOM 420 N ASP A 27 15.179 -2.285 7.167 1.00 0.00 N ATOM 421 CA ASP A 27 14.301 -1.673 8.168 1.00 0.00 C ATOM 422 C ASP A 27 14.635 -2.154 9.568 1.00 0.00 C ATOM 423 O ASP A 27 14.712 -1.357 10.512 1.00 0.00 O ATOM 424 CB ASP A 27 12.846 -1.972 7.850 1.00 0.00 C ATOM 425 CG ASP A 27 11.864 -1.275 8.776 1.00 0.00 C ATOM 426 OD1 ASP A 27 11.538 -1.843 9.839 1.00 0.00 O ATOM 427 OD2 ASP A 27 11.381 -0.159 8.442 1.00 0.00 O ATOM 0 H ASP A 27 14.685 -2.828 6.458 1.00 0.00 H new ATOM 0 HA ASP A 27 14.461 -0.595 8.133 1.00 0.00 H new ATOM 0 HB2 ASP A 27 12.639 -1.672 6.823 1.00 0.00 H new ATOM 0 HB3 ASP A 27 12.684 -3.048 7.907 1.00 0.00 H new ATOM 432 N GLU A 28 14.859 -3.448 9.701 1.00 0.00 N ATOM 433 CA GLU A 28 15.182 -4.023 10.988 1.00 0.00 C ATOM 434 C GLU A 28 16.634 -3.747 11.401 1.00 0.00 C ATOM 435 O GLU A 28 16.912 -3.501 12.579 1.00 0.00 O ATOM 436 CB GLU A 28 14.839 -5.510 11.036 1.00 0.00 C ATOM 437 CG GLU A 28 15.551 -6.373 10.019 1.00 0.00 C ATOM 438 CD GLU A 28 15.066 -7.790 10.046 1.00 0.00 C ATOM 439 OE1 GLU A 28 14.033 -8.096 9.409 1.00 0.00 O ATOM 440 OE2 GLU A 28 15.698 -8.635 10.712 1.00 0.00 O ATOM 0 H GLU A 28 14.823 -4.118 8.933 1.00 0.00 H new ATOM 0 HA GLU A 28 14.556 -3.525 11.728 1.00 0.00 H new ATOM 0 HB2 GLU A 28 15.070 -5.887 12.032 1.00 0.00 H new ATOM 0 HB3 GLU A 28 13.764 -5.622 10.894 1.00 0.00 H new ATOM 0 HG2 GLU A 28 15.401 -5.958 9.023 1.00 0.00 H new ATOM 0 HG3 GLU A 28 16.623 -6.353 10.214 1.00 0.00 H new ATOM 447 N SER A 29 17.547 -3.749 10.440 1.00 0.00 N ATOM 448 CA SER A 29 18.950 -3.470 10.722 1.00 0.00 C ATOM 449 C SER A 29 19.137 -1.966 10.994 1.00 0.00 C ATOM 450 O SER A 29 19.986 -1.559 11.782 1.00 0.00 O ATOM 451 CB SER A 29 19.810 -3.941 9.557 1.00 0.00 C ATOM 452 OG SER A 29 19.542 -5.313 9.272 1.00 0.00 O ATOM 0 H SER A 29 17.343 -3.940 9.459 1.00 0.00 H new ATOM 0 HA SER A 29 19.265 -4.013 11.613 1.00 0.00 H new ATOM 0 HB2 SER A 29 19.607 -3.332 8.676 1.00 0.00 H new ATOM 0 HB3 SER A 29 20.865 -3.811 9.798 1.00 0.00 H new ATOM 0 HG SER A 29 18.755 -5.379 8.692 1.00 0.00 H new ATOM 458 N ASN A 30 18.302 -1.170 10.336 1.00 0.00 N ATOM 459 CA ASN A 30 18.202 0.278 10.514 1.00 0.00 C ATOM 460 C ASN A 30 19.474 1.012 10.037 1.00 0.00 C ATOM 461 O ASN A 30 20.142 1.735 10.778 1.00 0.00 O ATOM 462 CB ASN A 30 17.776 0.616 11.979 1.00 0.00 C ATOM 463 CG ASN A 30 17.561 2.091 12.292 1.00 0.00 C ATOM 464 OD1 ASN A 30 18.482 2.791 12.703 1.00 0.00 O ATOM 465 ND2 ASN A 30 16.342 2.566 12.132 1.00 0.00 N ATOM 0 H ASN A 30 17.650 -1.527 9.637 1.00 0.00 H new ATOM 0 HA ASN A 30 17.412 0.659 9.867 1.00 0.00 H new ATOM 0 HB2 ASN A 30 16.853 0.081 12.200 1.00 0.00 H new ATOM 0 HB3 ASN A 30 18.538 0.229 12.656 1.00 0.00 H new ATOM 0 HD21 ASN A 30 16.142 3.542 12.352 1.00 0.00 H new ATOM 0 HD22 ASN A 30 15.599 1.958 11.788 1.00 0.00 H new ATOM 472 N ALA A 31 19.826 0.774 8.789 1.00 0.00 N ATOM 473 CA ALA A 31 20.948 1.469 8.169 1.00 0.00 C ATOM 474 C ALA A 31 20.643 2.935 7.926 1.00 0.00 C ATOM 475 O ALA A 31 21.516 3.771 7.979 1.00 0.00 O ATOM 476 CB ALA A 31 21.381 0.802 6.883 1.00 0.00 C ATOM 0 H ALA A 31 19.354 0.105 8.180 1.00 0.00 H new ATOM 0 HA ALA A 31 21.775 1.410 8.877 1.00 0.00 H new ATOM 0 HB1 ALA A 31 22.219 1.351 6.453 1.00 0.00 H new ATOM 0 HB2 ALA A 31 21.687 -0.224 7.090 1.00 0.00 H new ATOM 0 HB3 ALA A 31 20.550 0.798 6.178 1.00 0.00 H new ATOM 482 N LEU A 32 19.387 3.222 7.681 1.00 0.00 N ATOM 483 CA LEU A 32 18.941 4.574 7.339 1.00 0.00 C ATOM 484 C LEU A 32 18.415 5.333 8.538 1.00 0.00 C ATOM 485 O LEU A 32 17.953 6.472 8.386 1.00 0.00 O ATOM 486 CB LEU A 32 17.835 4.484 6.299 1.00 0.00 C ATOM 487 CG LEU A 32 18.237 3.984 4.923 1.00 0.00 C ATOM 488 CD1 LEU A 32 17.002 3.608 4.143 1.00 0.00 C ATOM 489 CD2 LEU A 32 19.007 5.064 4.183 1.00 0.00 C ATOM 0 H LEU A 32 18.636 2.532 7.710 1.00 0.00 H new ATOM 0 HA LEU A 32 19.806 5.114 6.955 1.00 0.00 H new ATOM 0 HB2 LEU A 32 17.056 3.828 6.686 1.00 0.00 H new ATOM 0 HB3 LEU A 32 17.392 5.473 6.186 1.00 0.00 H new ATOM 0 HG LEU A 32 18.876 3.108 5.032 1.00 0.00 H new ATOM 0 HD11 LEU A 32 17.291 3.249 3.155 1.00 0.00 H new ATOM 0 HD12 LEU A 32 16.463 2.822 4.672 1.00 0.00 H new ATOM 0 HD13 LEU A 32 16.358 4.481 4.038 1.00 0.00 H new ATOM 0 HD21 LEU A 32 19.292 4.697 3.197 1.00 0.00 H new ATOM 0 HD22 LEU A 32 18.379 5.948 4.074 1.00 0.00 H new ATOM 0 HD23 LEU A 32 19.903 5.323 4.747 1.00 0.00 H new ATOM 501 N GLY A 33 18.450 4.701 9.714 1.00 0.00 N ATOM 502 CA GLY A 33 17.880 5.309 10.914 1.00 0.00 C ATOM 503 C GLY A 33 16.457 5.721 10.666 1.00 0.00 C ATOM 504 O GLY A 33 16.048 6.812 11.010 1.00 0.00 O ATOM 0 H GLY A 33 18.862 3.779 9.858 1.00 0.00 H new ATOM 0 HA2 GLY A 33 17.922 4.602 11.743 1.00 0.00 H new ATOM 0 HA3 GLY A 33 18.471 6.177 11.206 1.00 0.00 H new ATOM 508 N LYS A 34 15.729 4.865 10.002 1.00 0.00 N ATOM 509 CA LYS A 34 14.406 5.175 9.569 1.00 0.00 C ATOM 510 C LYS A 34 13.550 3.935 9.760 1.00 0.00 C ATOM 511 O LYS A 34 14.078 2.844 10.027 1.00 0.00 O ATOM 512 CB LYS A 34 14.472 5.537 8.076 1.00 0.00 C ATOM 513 CG LYS A 34 13.357 6.427 7.521 1.00 0.00 C ATOM 514 CD LYS A 34 13.299 7.837 8.149 1.00 0.00 C ATOM 515 CE LYS A 34 14.539 8.734 7.886 1.00 0.00 C ATOM 516 NZ LYS A 34 15.742 8.387 8.703 1.00 0.00 N ATOM 0 H LYS A 34 16.045 3.929 9.748 1.00 0.00 H new ATOM 0 HA LYS A 34 13.982 6.006 10.133 1.00 0.00 H new ATOM 0 HB2 LYS A 34 15.424 6.034 7.891 1.00 0.00 H new ATOM 0 HB3 LYS A 34 14.480 4.609 7.504 1.00 0.00 H new ATOM 0 HG2 LYS A 34 13.490 6.527 6.444 1.00 0.00 H new ATOM 0 HG3 LYS A 34 12.399 5.931 7.680 1.00 0.00 H new ATOM 0 HD2 LYS A 34 12.414 8.349 7.770 1.00 0.00 H new ATOM 0 HD3 LYS A 34 13.170 7.732 9.226 1.00 0.00 H new ATOM 0 HE2 LYS A 34 14.802 8.668 6.830 1.00 0.00 H new ATOM 0 HE3 LYS A 34 14.269 9.772 8.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 16.203 9.260 9.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 15.452 7.820 9.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 16.409 7.839 8.123 1.00 0.00 H new ATOM 530 N LYS A 35 12.281 4.106 9.594 1.00 0.00 N ATOM 531 CA LYS A 35 11.289 3.049 9.656 1.00 0.00 C ATOM 532 C LYS A 35 10.430 3.249 8.462 1.00 0.00 C ATOM 533 O LYS A 35 9.812 4.300 8.320 1.00 0.00 O ATOM 534 CB LYS A 35 10.437 3.141 10.934 1.00 0.00 C ATOM 535 CG LYS A 35 11.167 2.935 12.268 1.00 0.00 C ATOM 536 CD LYS A 35 11.403 1.461 12.648 1.00 0.00 C ATOM 537 CE LYS A 35 12.400 0.734 11.761 1.00 0.00 C ATOM 538 NZ LYS A 35 12.658 -0.638 12.232 1.00 0.00 N ATOM 0 H LYS A 35 11.874 5.022 9.402 1.00 0.00 H new ATOM 0 HA LYS A 35 11.765 2.069 9.674 1.00 0.00 H new ATOM 0 HB2 LYS A 35 9.961 4.121 10.955 1.00 0.00 H new ATOM 0 HB3 LYS A 35 9.640 2.401 10.865 1.00 0.00 H new ATOM 0 HG2 LYS A 35 12.130 3.444 12.223 1.00 0.00 H new ATOM 0 HG3 LYS A 35 10.591 3.413 13.060 1.00 0.00 H new ATOM 0 HD2 LYS A 35 11.753 1.416 13.679 1.00 0.00 H new ATOM 0 HD3 LYS A 35 10.450 0.932 12.612 1.00 0.00 H new ATOM 0 HE2 LYS A 35 12.021 0.702 10.740 1.00 0.00 H new ATOM 0 HE3 LYS A 35 13.337 1.291 11.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 13.565 -0.972 11.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 12.697 -0.647 13.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 11.894 -1.265 11.909 1.00 0.00 H new ATOM 552 N PHE A 36 10.405 2.301 7.601 1.00 0.00 N ATOM 553 CA PHE A 36 9.746 2.497 6.347 1.00 0.00 C ATOM 554 C PHE A 36 8.798 1.394 5.968 1.00 0.00 C ATOM 555 O PHE A 36 7.652 1.663 5.655 1.00 0.00 O ATOM 556 CB PHE A 36 10.761 2.822 5.238 1.00 0.00 C ATOM 557 CG PHE A 36 11.979 1.956 5.218 1.00 0.00 C ATOM 558 CD1 PHE A 36 13.084 2.294 5.983 1.00 0.00 C ATOM 559 CD2 PHE A 36 12.032 0.823 4.436 1.00 0.00 C ATOM 560 CE1 PHE A 36 14.209 1.519 5.968 1.00 0.00 C ATOM 561 CE2 PHE A 36 13.158 0.045 4.416 1.00 0.00 C ATOM 562 CZ PHE A 36 14.245 0.394 5.186 1.00 0.00 C ATOM 0 H PHE A 36 10.828 1.382 7.732 1.00 0.00 H new ATOM 0 HA PHE A 36 9.100 3.366 6.474 1.00 0.00 H new ATOM 0 HB2 PHE A 36 10.260 2.740 4.273 1.00 0.00 H new ATOM 0 HB3 PHE A 36 11.074 3.860 5.347 1.00 0.00 H new ATOM 0 HD1 PHE A 36 13.055 3.181 6.599 1.00 0.00 H new ATOM 0 HD2 PHE A 36 11.179 0.547 3.834 1.00 0.00 H new ATOM 0 HE1 PHE A 36 15.064 1.791 6.568 1.00 0.00 H new ATOM 0 HE2 PHE A 36 13.194 -0.840 3.798 1.00 0.00 H new ATOM 0 HZ PHE A 36 15.132 -0.223 5.174 1.00 0.00 H new ATOM 572 N ILE A 37 9.240 0.171 6.003 1.00 0.00 N ATOM 573 CA ILE A 37 8.371 -0.907 5.617 1.00 0.00 C ATOM 574 C ILE A 37 7.493 -1.329 6.778 1.00 0.00 C ATOM 575 O ILE A 37 7.978 -1.797 7.819 1.00 0.00 O ATOM 576 CB ILE A 37 9.133 -2.097 4.863 1.00 0.00 C ATOM 577 CG1 ILE A 37 8.323 -3.406 4.691 1.00 0.00 C ATOM 578 CG2 ILE A 37 10.473 -2.396 5.453 1.00 0.00 C ATOM 579 CD1 ILE A 37 8.290 -4.310 5.920 1.00 0.00 C ATOM 0 H ILE A 37 10.179 -0.105 6.289 1.00 0.00 H new ATOM 0 HA ILE A 37 7.690 -0.538 4.850 1.00 0.00 H new ATOM 0 HB ILE A 37 9.269 -1.695 3.859 1.00 0.00 H new ATOM 0 HG12 ILE A 37 7.299 -3.149 4.420 1.00 0.00 H new ATOM 0 HG13 ILE A 37 8.742 -3.968 3.856 1.00 0.00 H new ATOM 0 HG21 ILE A 37 10.940 -3.211 4.900 1.00 0.00 H new ATOM 0 HG22 ILE A 37 11.103 -1.509 5.393 1.00 0.00 H new ATOM 0 HG23 ILE A 37 10.354 -2.687 6.497 1.00 0.00 H new ATOM 0 HD11 ILE A 37 7.700 -5.200 5.701 1.00 0.00 H new ATOM 0 HD12 ILE A 37 9.306 -4.604 6.183 1.00 0.00 H new ATOM 0 HD13 ILE A 37 7.841 -3.773 6.755 1.00 0.00 H new ATOM 591 N ILE A 38 6.210 -1.066 6.635 1.00 0.00 N ATOM 592 CA ILE A 38 5.240 -1.460 7.640 1.00 0.00 C ATOM 593 C ILE A 38 4.868 -2.916 7.418 1.00 0.00 C ATOM 594 O ILE A 38 5.014 -3.759 8.314 1.00 0.00 O ATOM 595 CB ILE A 38 3.924 -0.577 7.624 1.00 0.00 C ATOM 596 CG1 ILE A 38 4.143 0.876 8.137 1.00 0.00 C ATOM 597 CG2 ILE A 38 2.778 -1.248 8.378 1.00 0.00 C ATOM 598 CD1 ILE A 38 4.873 1.814 7.188 1.00 0.00 C ATOM 0 H ILE A 38 5.813 -0.580 5.831 1.00 0.00 H new ATOM 0 HA ILE A 38 5.707 -1.311 8.614 1.00 0.00 H new ATOM 0 HB ILE A 38 3.646 -0.498 6.573 1.00 0.00 H new ATOM 0 HG12 ILE A 38 3.170 1.309 8.368 1.00 0.00 H new ATOM 0 HG13 ILE A 38 4.701 0.830 9.072 1.00 0.00 H new ATOM 0 HG21 ILE A 38 1.896 -0.609 8.342 1.00 0.00 H new ATOM 0 HG22 ILE A 38 2.550 -2.208 7.914 1.00 0.00 H new ATOM 0 HG23 ILE A 38 3.069 -1.407 9.416 1.00 0.00 H new ATOM 0 HD11 ILE A 38 4.968 2.797 7.650 1.00 0.00 H new ATOM 0 HD12 ILE A 38 5.865 1.416 6.974 1.00 0.00 H new ATOM 0 HD13 ILE A 38 4.310 1.903 6.259 1.00 0.00 H new ATOM 610 N GLN A 39 4.448 -3.216 6.209 1.00 0.00 N ATOM 611 CA GLN A 39 4.030 -4.543 5.869 1.00 0.00 C ATOM 612 C GLN A 39 4.572 -4.951 4.537 1.00 0.00 C ATOM 613 O GLN A 39 4.738 -4.110 3.629 1.00 0.00 O ATOM 614 CB GLN A 39 2.488 -4.700 5.870 1.00 0.00 C ATOM 615 CG GLN A 39 1.737 -3.702 4.984 1.00 0.00 C ATOM 616 CD GLN A 39 0.270 -4.078 4.710 1.00 0.00 C ATOM 617 OE1 GLN A 39 -0.572 -3.216 4.560 1.00 0.00 O ATOM 618 NE2 GLN A 39 -0.026 -5.363 4.571 1.00 0.00 N ATOM 0 H GLN A 39 4.390 -2.545 5.443 1.00 0.00 H new ATOM 0 HA GLN A 39 4.433 -5.197 6.642 1.00 0.00 H new ATOM 0 HB2 GLN A 39 2.240 -5.710 5.545 1.00 0.00 H new ATOM 0 HB3 GLN A 39 2.128 -4.597 6.894 1.00 0.00 H new ATOM 0 HG2 GLN A 39 1.766 -2.720 5.457 1.00 0.00 H new ATOM 0 HG3 GLN A 39 2.261 -3.613 4.032 1.00 0.00 H new ATOM 0 HE21 GLN A 39 0.697 -6.070 4.702 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -0.977 -5.644 4.333 1.00 0.00 H new ATOM 627 N ASP A 40 4.893 -6.206 4.433 1.00 0.00 N ATOM 628 CA ASP A 40 5.259 -6.784 3.179 1.00 0.00 C ATOM 629 C ASP A 40 3.999 -7.328 2.553 1.00 0.00 C ATOM 630 O ASP A 40 3.196 -8.002 3.202 1.00 0.00 O ATOM 631 CB ASP A 40 6.363 -7.867 3.296 1.00 0.00 C ATOM 632 CG ASP A 40 5.998 -9.076 4.137 1.00 0.00 C ATOM 633 OD1 ASP A 40 6.164 -9.025 5.376 1.00 0.00 O ATOM 634 OD2 ASP A 40 5.571 -10.099 3.590 1.00 0.00 O ATOM 0 H ASP A 40 4.908 -6.857 5.218 1.00 0.00 H new ATOM 0 HA ASP A 40 5.705 -6.016 2.547 1.00 0.00 H new ATOM 0 HB2 ASP A 40 6.623 -8.207 2.294 1.00 0.00 H new ATOM 0 HB3 ASP A 40 7.257 -7.407 3.718 1.00 0.00 H new ATOM 639 N ILE A 41 3.789 -6.971 1.339 1.00 0.00 N ATOM 640 CA ILE A 41 2.593 -7.311 0.614 1.00 0.00 C ATOM 641 C ILE A 41 2.955 -8.059 -0.677 1.00 0.00 C ATOM 642 O ILE A 41 3.554 -7.515 -1.568 1.00 0.00 O ATOM 643 CB ILE A 41 1.741 -6.020 0.291 1.00 0.00 C ATOM 644 CG1 ILE A 41 2.628 -4.768 0.298 1.00 0.00 C ATOM 645 CG2 ILE A 41 0.519 -5.820 1.212 1.00 0.00 C ATOM 646 CD1 ILE A 41 1.902 -3.473 0.094 1.00 0.00 C ATOM 0 H ILE A 41 4.454 -6.419 0.797 1.00 0.00 H new ATOM 0 HA ILE A 41 1.984 -7.964 1.239 1.00 0.00 H new ATOM 0 HB ILE A 41 1.337 -6.180 -0.709 1.00 0.00 H new ATOM 0 HG12 ILE A 41 3.159 -4.723 1.249 1.00 0.00 H new ATOM 0 HG13 ILE A 41 3.381 -4.871 -0.483 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -0.010 -4.912 0.922 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -0.150 -6.675 1.119 1.00 0.00 H new ATOM 0 HG23 ILE A 41 0.853 -5.731 2.246 1.00 0.00 H new ATOM 0 HD11 ILE A 41 2.615 -2.649 0.115 1.00 0.00 H new ATOM 0 HD12 ILE A 41 1.394 -3.489 -0.870 1.00 0.00 H new ATOM 0 HD13 ILE A 41 1.168 -3.338 0.889 1.00 0.00 H new ATOM 658 N ASP A 42 2.664 -9.329 -0.702 1.00 0.00 N ATOM 659 CA ASP A 42 2.877 -10.239 -1.878 1.00 0.00 C ATOM 660 C ASP A 42 4.375 -10.537 -2.102 1.00 0.00 C ATOM 661 O ASP A 42 4.796 -11.114 -3.098 1.00 0.00 O ATOM 662 CB ASP A 42 2.178 -9.666 -3.137 1.00 0.00 C ATOM 663 CG ASP A 42 2.343 -10.500 -4.389 1.00 0.00 C ATOM 664 OD1 ASP A 42 2.108 -11.708 -4.365 1.00 0.00 O ATOM 665 OD2 ASP A 42 2.687 -9.945 -5.429 1.00 0.00 O ATOM 0 H ASP A 42 2.258 -9.809 0.101 1.00 0.00 H new ATOM 0 HA ASP A 42 2.413 -11.201 -1.663 1.00 0.00 H new ATOM 0 HB2 ASP A 42 1.114 -9.558 -2.927 1.00 0.00 H new ATOM 0 HB3 ASP A 42 2.568 -8.667 -3.329 1.00 0.00 H new ATOM 670 N ASP A 43 5.161 -10.156 -1.116 1.00 0.00 N ATOM 671 CA ASP A 43 6.641 -10.290 -1.079 1.00 0.00 C ATOM 672 C ASP A 43 7.295 -9.647 -2.313 1.00 0.00 C ATOM 673 O ASP A 43 8.412 -9.949 -2.705 1.00 0.00 O ATOM 674 CB ASP A 43 7.103 -11.745 -0.913 1.00 0.00 C ATOM 675 CG ASP A 43 8.439 -11.850 -0.165 1.00 0.00 C ATOM 676 OD1 ASP A 43 9.454 -11.242 -0.587 1.00 0.00 O ATOM 677 OD2 ASP A 43 8.470 -12.500 0.902 1.00 0.00 O ATOM 0 H ASP A 43 4.789 -9.723 -0.271 1.00 0.00 H new ATOM 0 HA ASP A 43 6.973 -9.749 -0.193 1.00 0.00 H new ATOM 0 HB2 ASP A 43 6.341 -12.306 -0.372 1.00 0.00 H new ATOM 0 HB3 ASP A 43 7.202 -12.207 -1.895 1.00 0.00 H new ATOM 682 N THR A 44 6.586 -8.774 -2.922 1.00 0.00 N ATOM 683 CA THR A 44 7.114 -8.009 -4.002 1.00 0.00 C ATOM 684 C THR A 44 6.670 -6.582 -3.816 1.00 0.00 C ATOM 685 O THR A 44 7.234 -5.646 -4.385 1.00 0.00 O ATOM 686 CB THR A 44 6.649 -8.554 -5.364 1.00 0.00 C ATOM 687 OG1 THR A 44 6.828 -9.989 -5.366 1.00 0.00 O ATOM 688 CG2 THR A 44 7.507 -7.957 -6.474 1.00 0.00 C ATOM 0 H THR A 44 5.616 -8.563 -2.689 1.00 0.00 H new ATOM 0 HA THR A 44 8.202 -8.073 -3.998 1.00 0.00 H new ATOM 0 HB THR A 44 5.604 -8.293 -5.529 1.00 0.00 H new ATOM 0 HG1 THR A 44 6.535 -10.354 -6.227 1.00 0.00 H new ATOM 0 HG21 THR A 44 7.176 -8.344 -7.438 1.00 0.00 H new ATOM 0 HG22 THR A 44 7.409 -6.871 -6.466 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.550 -8.228 -6.313 1.00 0.00 H new ATOM 696 N HIS A 45 5.653 -6.405 -2.990 1.00 0.00 N ATOM 697 CA HIS A 45 5.200 -5.098 -2.695 1.00 0.00 C ATOM 698 C HIS A 45 5.548 -4.790 -1.286 1.00 0.00 C ATOM 699 O HIS A 45 5.576 -5.687 -0.431 1.00 0.00 O ATOM 700 CB HIS A 45 3.695 -4.943 -2.926 1.00 0.00 C ATOM 701 CG HIS A 45 3.257 -5.198 -4.321 1.00 0.00 C ATOM 702 ND1 HIS A 45 2.859 -4.208 -5.161 1.00 0.00 N ATOM 703 CD2 HIS A 45 3.123 -6.355 -5.016 1.00 0.00 C ATOM 704 CE1 HIS A 45 2.493 -4.737 -6.309 1.00 0.00 C ATOM 705 NE2 HIS A 45 2.645 -6.032 -6.246 1.00 0.00 N ATOM 0 H HIS A 45 5.143 -7.156 -2.526 1.00 0.00 H new ATOM 0 HA HIS A 45 5.690 -4.395 -3.369 1.00 0.00 H new ATOM 0 HB2 HIS A 45 3.166 -5.626 -2.262 1.00 0.00 H new ATOM 0 HB3 HIS A 45 3.399 -3.932 -2.645 1.00 0.00 H new ATOM 0 HD2 HIS A 45 3.353 -7.348 -4.658 1.00 0.00 H new ATOM 0 HE1 HIS A 45 2.126 -4.189 -7.164 1.00 0.00 H new ATOM 0 HE2 HIS A 45 2.439 -6.692 -6.996 1.00 0.00 H new ATOM 714 N VAL A 46 5.854 -3.583 -1.050 1.00 0.00 N ATOM 715 CA VAL A 46 6.137 -3.100 0.255 1.00 0.00 C ATOM 716 C VAL A 46 5.367 -1.846 0.481 1.00 0.00 C ATOM 717 O VAL A 46 5.137 -1.075 -0.463 1.00 0.00 O ATOM 718 CB VAL A 46 7.679 -2.903 0.479 1.00 0.00 C ATOM 719 CG1 VAL A 46 8.008 -1.763 1.437 1.00 0.00 C ATOM 720 CG2 VAL A 46 8.256 -4.176 1.036 1.00 0.00 C ATOM 0 H VAL A 46 5.920 -2.870 -1.776 1.00 0.00 H new ATOM 0 HA VAL A 46 5.824 -3.840 0.992 1.00 0.00 H new ATOM 0 HB VAL A 46 8.112 -2.650 -0.489 1.00 0.00 H new ATOM 0 HG11 VAL A 46 9.089 -1.681 1.547 1.00 0.00 H new ATOM 0 HG12 VAL A 46 7.612 -0.828 1.040 1.00 0.00 H new ATOM 0 HG13 VAL A 46 7.558 -1.964 2.409 1.00 0.00 H new ATOM 0 HG21 VAL A 46 9.327 -4.051 1.196 1.00 0.00 H new ATOM 0 HG22 VAL A 46 7.773 -4.410 1.985 1.00 0.00 H new ATOM 0 HG23 VAL A 46 8.087 -4.991 0.332 1.00 0.00 H new ATOM 730 N PHE A 47 4.876 -1.699 1.666 1.00 0.00 N ATOM 731 CA PHE A 47 4.234 -0.504 2.031 1.00 0.00 C ATOM 732 C PHE A 47 5.198 0.332 2.851 1.00 0.00 C ATOM 733 O PHE A 47 5.744 -0.140 3.866 1.00 0.00 O ATOM 734 CB PHE A 47 2.967 -0.771 2.842 1.00 0.00 C ATOM 735 CG PHE A 47 2.283 0.491 3.240 1.00 0.00 C ATOM 736 CD1 PHE A 47 2.627 1.129 4.412 1.00 0.00 C ATOM 737 CD2 PHE A 47 1.333 1.059 2.429 1.00 0.00 C ATOM 738 CE1 PHE A 47 2.040 2.305 4.767 1.00 0.00 C ATOM 739 CE2 PHE A 47 0.734 2.229 2.783 1.00 0.00 C ATOM 740 CZ PHE A 47 1.093 2.852 3.957 1.00 0.00 C ATOM 0 H PHE A 47 4.914 -2.408 2.399 1.00 0.00 H new ATOM 0 HA PHE A 47 3.940 0.026 1.125 1.00 0.00 H new ATOM 0 HB2 PHE A 47 2.283 -1.384 2.255 1.00 0.00 H new ATOM 0 HB3 PHE A 47 3.222 -1.342 3.735 1.00 0.00 H new ATOM 0 HD1 PHE A 47 3.373 0.690 5.058 1.00 0.00 H new ATOM 0 HD2 PHE A 47 1.059 0.575 1.504 1.00 0.00 H new ATOM 0 HE1 PHE A 47 2.324 2.800 5.684 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -0.020 2.667 2.145 1.00 0.00 H new ATOM 0 HZ PHE A 47 0.620 3.781 4.237 1.00 0.00 H new ATOM 750 N VAL A 48 5.385 1.534 2.425 1.00 0.00 N ATOM 751 CA VAL A 48 6.196 2.511 3.105 1.00 0.00 C ATOM 752 C VAL A 48 5.429 3.809 3.101 1.00 0.00 C ATOM 753 O VAL A 48 4.730 4.078 2.160 1.00 0.00 O ATOM 754 CB VAL A 48 7.601 2.669 2.426 1.00 0.00 C ATOM 755 CG1 VAL A 48 7.483 2.821 0.913 1.00 0.00 C ATOM 756 CG2 VAL A 48 8.365 3.851 3.003 1.00 0.00 C ATOM 0 H VAL A 48 4.967 1.886 1.564 1.00 0.00 H new ATOM 0 HA VAL A 48 6.394 2.192 4.128 1.00 0.00 H new ATOM 0 HB VAL A 48 8.156 1.755 2.638 1.00 0.00 H new ATOM 0 HG11 VAL A 48 8.477 2.928 0.479 1.00 0.00 H new ATOM 0 HG12 VAL A 48 6.998 1.939 0.495 1.00 0.00 H new ATOM 0 HG13 VAL A 48 6.889 3.705 0.681 1.00 0.00 H new ATOM 0 HG21 VAL A 48 9.334 3.933 2.511 1.00 0.00 H new ATOM 0 HG22 VAL A 48 7.797 4.767 2.839 1.00 0.00 H new ATOM 0 HG23 VAL A 48 8.512 3.702 4.073 1.00 0.00 H new ATOM 766 N ILE A 49 5.500 4.585 4.147 1.00 0.00 N ATOM 767 CA ILE A 49 4.733 5.818 4.158 1.00 0.00 C ATOM 768 C ILE A 49 5.425 6.869 3.279 1.00 0.00 C ATOM 769 O ILE A 49 6.663 6.910 3.198 1.00 0.00 O ATOM 770 CB ILE A 49 4.440 6.361 5.583 1.00 0.00 C ATOM 771 CG1 ILE A 49 3.313 7.420 5.528 1.00 0.00 C ATOM 772 CG2 ILE A 49 5.703 6.900 6.264 1.00 0.00 C ATOM 773 CD1 ILE A 49 3.007 8.103 6.850 1.00 0.00 C ATOM 0 H ILE A 49 6.058 4.403 4.981 1.00 0.00 H new ATOM 0 HA ILE A 49 3.753 5.588 3.740 1.00 0.00 H new ATOM 0 HB ILE A 49 4.096 5.530 6.199 1.00 0.00 H new ATOM 0 HG12 ILE A 49 3.586 8.182 4.798 1.00 0.00 H new ATOM 0 HG13 ILE A 49 2.403 6.942 5.164 1.00 0.00 H new ATOM 0 HG21 ILE A 49 5.451 7.269 7.258 1.00 0.00 H new ATOM 0 HG22 ILE A 49 6.439 6.101 6.350 1.00 0.00 H new ATOM 0 HG23 ILE A 49 6.118 7.714 5.669 1.00 0.00 H new ATOM 0 HD11 ILE A 49 2.204 8.827 6.708 1.00 0.00 H new ATOM 0 HD12 ILE A 49 2.698 7.357 7.582 1.00 0.00 H new ATOM 0 HD13 ILE A 49 3.899 8.616 7.210 1.00 0.00 H new ATOM 785 N ALA A 50 4.634 7.715 2.640 1.00 0.00 N ATOM 786 CA ALA A 50 5.145 8.636 1.640 1.00 0.00 C ATOM 787 C ALA A 50 6.111 9.656 2.188 1.00 0.00 C ATOM 788 O ALA A 50 7.062 10.034 1.511 1.00 0.00 O ATOM 789 CB ALA A 50 4.017 9.330 0.896 1.00 0.00 C ATOM 0 H ALA A 50 3.629 7.782 2.798 1.00 0.00 H new ATOM 0 HA ALA A 50 5.708 8.016 0.942 1.00 0.00 H new ATOM 0 HB1 ALA A 50 4.435 10.012 0.155 1.00 0.00 H new ATOM 0 HB2 ALA A 50 3.399 8.585 0.395 1.00 0.00 H new ATOM 0 HB3 ALA A 50 3.407 9.892 1.603 1.00 0.00 H new ATOM 795 N GLU A 51 5.900 10.054 3.415 1.00 0.00 N ATOM 796 CA GLU A 51 6.666 11.132 4.018 1.00 0.00 C ATOM 797 C GLU A 51 8.174 10.847 4.072 1.00 0.00 C ATOM 798 O GLU A 51 8.973 11.754 3.932 1.00 0.00 O ATOM 799 CB GLU A 51 6.130 11.464 5.407 1.00 0.00 C ATOM 800 CG GLU A 51 4.624 11.709 5.447 1.00 0.00 C ATOM 801 CD GLU A 51 4.135 12.686 4.391 1.00 0.00 C ATOM 802 OE1 GLU A 51 4.536 13.860 4.399 1.00 0.00 O ATOM 803 OE2 GLU A 51 3.292 12.293 3.560 1.00 0.00 O ATOM 0 H GLU A 51 5.196 9.646 4.030 1.00 0.00 H new ATOM 0 HA GLU A 51 6.539 11.999 3.369 1.00 0.00 H new ATOM 0 HB2 GLU A 51 6.373 10.646 6.085 1.00 0.00 H new ATOM 0 HB3 GLU A 51 6.642 12.350 5.781 1.00 0.00 H new ATOM 0 HG2 GLU A 51 4.107 10.758 5.317 1.00 0.00 H new ATOM 0 HG3 GLU A 51 4.353 12.087 6.433 1.00 0.00 H new ATOM 810 N LEU A 52 8.555 9.597 4.237 1.00 0.00 N ATOM 811 CA LEU A 52 9.971 9.270 4.346 1.00 0.00 C ATOM 812 C LEU A 52 10.478 8.347 3.224 1.00 0.00 C ATOM 813 O LEU A 52 11.585 7.828 3.291 1.00 0.00 O ATOM 814 CB LEU A 52 10.292 8.745 5.758 1.00 0.00 C ATOM 815 CG LEU A 52 9.407 7.619 6.312 1.00 0.00 C ATOM 816 CD1 LEU A 52 9.691 6.284 5.645 1.00 0.00 C ATOM 817 CD2 LEU A 52 9.552 7.522 7.816 1.00 0.00 C ATOM 0 H LEU A 52 7.921 8.800 4.298 1.00 0.00 H new ATOM 0 HA LEU A 52 10.531 10.194 4.201 1.00 0.00 H new ATOM 0 HB2 LEU A 52 11.324 8.394 5.760 1.00 0.00 H new ATOM 0 HB3 LEU A 52 10.240 9.586 6.450 1.00 0.00 H new ATOM 0 HG LEU A 52 8.373 7.871 6.079 1.00 0.00 H new ATOM 0 HD11 LEU A 52 9.041 5.519 6.070 1.00 0.00 H new ATOM 0 HD12 LEU A 52 9.504 6.365 4.574 1.00 0.00 H new ATOM 0 HD13 LEU A 52 10.732 6.008 5.811 1.00 0.00 H new ATOM 0 HD21 LEU A 52 8.918 6.719 8.192 1.00 0.00 H new ATOM 0 HD22 LEU A 52 10.591 7.312 8.069 1.00 0.00 H new ATOM 0 HD23 LEU A 52 9.251 8.465 8.272 1.00 0.00 H new ATOM 829 N VAL A 53 9.685 8.180 2.184 1.00 0.00 N ATOM 830 CA VAL A 53 10.067 7.313 1.056 1.00 0.00 C ATOM 831 C VAL A 53 11.229 7.920 0.262 1.00 0.00 C ATOM 832 O VAL A 53 11.994 7.211 -0.384 1.00 0.00 O ATOM 833 CB VAL A 53 8.881 6.897 0.131 1.00 0.00 C ATOM 834 CG1 VAL A 53 8.396 8.051 -0.710 1.00 0.00 C ATOM 835 CG2 VAL A 53 9.247 5.703 -0.743 1.00 0.00 C ATOM 0 H VAL A 53 8.773 8.626 2.084 1.00 0.00 H new ATOM 0 HA VAL A 53 10.407 6.379 1.505 1.00 0.00 H new ATOM 0 HB VAL A 53 8.060 6.596 0.782 1.00 0.00 H new ATOM 0 HG11 VAL A 53 7.570 7.720 -1.340 1.00 0.00 H new ATOM 0 HG12 VAL A 53 8.056 8.857 -0.060 1.00 0.00 H new ATOM 0 HG13 VAL A 53 9.210 8.410 -1.339 1.00 0.00 H new ATOM 0 HG21 VAL A 53 8.398 5.440 -1.374 1.00 0.00 H new ATOM 0 HG22 VAL A 53 10.100 5.960 -1.371 1.00 0.00 H new ATOM 0 HG23 VAL A 53 9.505 4.854 -0.110 1.00 0.00 H new ATOM 845 N ASN A 54 11.321 9.235 0.288 1.00 0.00 N ATOM 846 CA ASN A 54 12.387 9.981 -0.395 1.00 0.00 C ATOM 847 C ASN A 54 13.776 9.465 -0.010 1.00 0.00 C ATOM 848 O ASN A 54 14.667 9.387 -0.860 1.00 0.00 O ATOM 849 CB ASN A 54 12.292 11.493 -0.096 1.00 0.00 C ATOM 850 CG ASN A 54 12.370 11.851 1.395 1.00 0.00 C ATOM 851 OD1 ASN A 54 11.947 11.086 2.259 1.00 0.00 O ATOM 852 ND2 ASN A 54 12.894 13.003 1.695 1.00 0.00 N ATOM 0 H ASN A 54 10.658 9.830 0.785 1.00 0.00 H new ATOM 0 HA ASN A 54 12.246 9.823 -1.464 1.00 0.00 H new ATOM 0 HB2 ASN A 54 13.096 12.006 -0.623 1.00 0.00 H new ATOM 0 HB3 ASN A 54 11.353 11.873 -0.500 1.00 0.00 H new ATOM 0 HD21 ASN A 54 12.963 13.294 2.670 1.00 0.00 H new ATOM 0 HD22 ASN A 54 13.236 13.616 0.955 1.00 0.00 H new ATOM 859 N VAL A 55 13.942 9.061 1.248 1.00 0.00 N ATOM 860 CA VAL A 55 15.226 8.538 1.703 1.00 0.00 C ATOM 861 C VAL A 55 15.499 7.164 1.090 1.00 0.00 C ATOM 862 O VAL A 55 16.630 6.797 0.786 1.00 0.00 O ATOM 863 CB VAL A 55 15.401 8.525 3.250 1.00 0.00 C ATOM 864 CG1 VAL A 55 15.108 9.886 3.836 1.00 0.00 C ATOM 865 CG2 VAL A 55 14.574 7.464 3.942 1.00 0.00 C ATOM 0 H VAL A 55 13.213 9.085 1.961 1.00 0.00 H new ATOM 0 HA VAL A 55 15.979 9.239 1.344 1.00 0.00 H new ATOM 0 HB VAL A 55 16.445 8.270 3.431 1.00 0.00 H new ATOM 0 HG11 VAL A 55 15.237 9.852 4.918 1.00 0.00 H new ATOM 0 HG12 VAL A 55 15.793 10.620 3.412 1.00 0.00 H new ATOM 0 HG13 VAL A 55 14.082 10.170 3.602 1.00 0.00 H new ATOM 0 HG21 VAL A 55 14.745 7.513 5.017 1.00 0.00 H new ATOM 0 HG22 VAL A 55 13.517 7.634 3.735 1.00 0.00 H new ATOM 0 HG23 VAL A 55 14.862 6.480 3.573 1.00 0.00 H new ATOM 875 N LEU A 56 14.443 6.432 0.913 1.00 0.00 N ATOM 876 CA LEU A 56 14.475 5.139 0.262 1.00 0.00 C ATOM 877 C LEU A 56 14.816 5.292 -1.200 1.00 0.00 C ATOM 878 O LEU A 56 15.629 4.551 -1.730 1.00 0.00 O ATOM 879 CB LEU A 56 13.124 4.419 0.412 1.00 0.00 C ATOM 880 CG LEU A 56 12.905 3.588 1.676 1.00 0.00 C ATOM 881 CD1 LEU A 56 13.787 2.381 1.624 1.00 0.00 C ATOM 882 CD2 LEU A 56 13.224 4.374 2.927 1.00 0.00 C ATOM 0 H LEU A 56 13.512 6.713 1.219 1.00 0.00 H new ATOM 0 HA LEU A 56 15.246 4.538 0.744 1.00 0.00 H new ATOM 0 HB2 LEU A 56 12.335 5.170 0.362 1.00 0.00 H new ATOM 0 HB3 LEU A 56 12.995 3.763 -0.449 1.00 0.00 H new ATOM 0 HG LEU A 56 11.854 3.302 1.714 1.00 0.00 H new ATOM 0 HD11 LEU A 56 13.637 1.782 2.522 1.00 0.00 H new ATOM 0 HD12 LEU A 56 13.538 1.786 0.745 1.00 0.00 H new ATOM 0 HD13 LEU A 56 14.829 2.694 1.566 1.00 0.00 H new ATOM 0 HD21 LEU A 56 13.055 3.748 3.803 1.00 0.00 H new ATOM 0 HD22 LEU A 56 14.267 4.690 2.902 1.00 0.00 H new ATOM 0 HD23 LEU A 56 12.580 5.252 2.979 1.00 0.00 H new ATOM 894 N GLN A 57 14.213 6.284 -1.831 1.00 0.00 N ATOM 895 CA GLN A 57 14.407 6.539 -3.236 1.00 0.00 C ATOM 896 C GLN A 57 15.841 6.826 -3.558 1.00 0.00 C ATOM 897 O GLN A 57 16.398 6.259 -4.487 1.00 0.00 O ATOM 898 CB GLN A 57 13.579 7.684 -3.677 1.00 0.00 C ATOM 899 CG GLN A 57 13.031 7.419 -5.046 1.00 0.00 C ATOM 900 CD GLN A 57 11.801 6.504 -5.054 1.00 0.00 C ATOM 901 OE1 GLN A 57 10.936 6.622 -5.919 1.00 0.00 O ATOM 902 NE2 GLN A 57 11.702 5.613 -4.101 1.00 0.00 N ATOM 0 H GLN A 57 13.573 6.935 -1.376 1.00 0.00 H new ATOM 0 HA GLN A 57 14.105 5.635 -3.766 1.00 0.00 H new ATOM 0 HB2 GLN A 57 12.762 7.846 -2.974 1.00 0.00 H new ATOM 0 HB3 GLN A 57 14.177 8.595 -3.685 1.00 0.00 H new ATOM 0 HG2 GLN A 57 12.769 8.369 -5.512 1.00 0.00 H new ATOM 0 HG3 GLN A 57 13.812 6.968 -5.659 1.00 0.00 H new ATOM 0 HE21 GLN A 57 12.435 5.537 -3.396 1.00 0.00 H new ATOM 0 HE22 GLN A 57 10.892 4.994 -4.063 1.00 0.00 H new ATOM 1237 N VAL B 5 5.076 -3.118 -12.331 1.00 0.00 N ATOM 1238 CA VAL B 5 5.883 -2.178 -11.597 1.00 0.00 C ATOM 1239 C VAL B 5 5.151 -0.876 -11.293 1.00 0.00 C ATOM 1240 O VAL B 5 4.931 -0.026 -12.161 1.00 0.00 O ATOM 1241 CB VAL B 5 7.225 -1.937 -12.327 1.00 0.00 C ATOM 1242 CG1 VAL B 5 8.057 -3.200 -12.294 1.00 0.00 C ATOM 1243 CG2 VAL B 5 7.021 -1.500 -13.783 1.00 0.00 C ATOM 0 HA VAL B 5 6.098 -2.622 -10.625 1.00 0.00 H new ATOM 0 HB VAL B 5 7.740 -1.130 -11.806 1.00 0.00 H new ATOM 0 HG11 VAL B 5 9.002 -3.027 -12.809 1.00 0.00 H new ATOM 0 HG12 VAL B 5 8.254 -3.479 -11.259 1.00 0.00 H new ATOM 0 HG13 VAL B 5 7.516 -4.005 -12.790 1.00 0.00 H new ATOM 0 HG21 VAL B 5 7.991 -1.343 -14.255 1.00 0.00 H new ATOM 0 HG22 VAL B 5 6.476 -2.275 -14.323 1.00 0.00 H new ATOM 0 HG23 VAL B 5 6.451 -0.572 -13.808 1.00 0.00 H new ATOM 1253 N ASN B 6 4.763 -0.739 -10.054 1.00 0.00 N ATOM 1254 CA ASN B 6 3.913 0.360 -9.638 1.00 0.00 C ATOM 1255 C ASN B 6 4.194 0.794 -8.268 1.00 0.00 C ATOM 1256 O ASN B 6 3.931 0.064 -7.302 1.00 0.00 O ATOM 1257 CB ASN B 6 2.413 0.046 -9.766 1.00 0.00 C ATOM 1258 CG ASN B 6 1.881 0.310 -11.149 1.00 0.00 C ATOM 1259 OD1 ASN B 6 1.441 1.423 -11.451 1.00 0.00 O ATOM 1260 ND2 ASN B 6 1.917 -0.680 -11.990 1.00 0.00 N ATOM 0 H ASN B 6 5.022 -1.379 -9.303 1.00 0.00 H new ATOM 0 HA ASN B 6 4.153 1.170 -10.326 1.00 0.00 H new ATOM 0 HB2 ASN B 6 2.241 -0.999 -9.508 1.00 0.00 H new ATOM 0 HB3 ASN B 6 1.857 0.647 -9.046 1.00 0.00 H new ATOM 0 HD21 ASN B 6 1.573 -0.553 -12.942 1.00 0.00 H new ATOM 0 HD22 ASN B 6 2.289 -1.584 -11.698 1.00 0.00 H new ATOM 1267 N VAL B 7 4.804 1.910 -8.168 1.00 0.00 N ATOM 1268 CA VAL B 7 4.985 2.544 -6.916 1.00 0.00 C ATOM 1269 C VAL B 7 4.268 3.904 -6.930 1.00 0.00 C ATOM 1270 O VAL B 7 4.523 4.744 -7.806 1.00 0.00 O ATOM 1271 CB VAL B 7 6.488 2.661 -6.513 1.00 0.00 C ATOM 1272 CG1 VAL B 7 7.327 3.281 -7.617 1.00 0.00 C ATOM 1273 CG2 VAL B 7 6.661 3.449 -5.227 1.00 0.00 C ATOM 0 H VAL B 7 5.198 2.418 -8.960 1.00 0.00 H new ATOM 0 HA VAL B 7 4.536 1.921 -6.142 1.00 0.00 H new ATOM 0 HB VAL B 7 6.842 1.643 -6.348 1.00 0.00 H new ATOM 0 HG11 VAL B 7 8.366 3.343 -7.293 1.00 0.00 H new ATOM 0 HG12 VAL B 7 7.262 2.664 -8.513 1.00 0.00 H new ATOM 0 HG13 VAL B 7 6.956 4.282 -7.838 1.00 0.00 H new ATOM 0 HG21 VAL B 7 7.720 3.510 -4.977 1.00 0.00 H new ATOM 0 HG22 VAL B 7 6.261 4.454 -5.360 1.00 0.00 H new ATOM 0 HG23 VAL B 7 6.126 2.949 -4.419 1.00 0.00 H new ATOM 1283 N LEU B 8 3.385 4.116 -5.995 1.00 0.00 N ATOM 1284 CA LEU B 8 2.594 5.339 -5.953 1.00 0.00 C ATOM 1285 C LEU B 8 2.023 5.532 -4.570 1.00 0.00 C ATOM 1286 O LEU B 8 2.178 4.653 -3.708 1.00 0.00 O ATOM 1287 CB LEU B 8 1.435 5.306 -6.971 1.00 0.00 C ATOM 1288 CG LEU B 8 0.309 4.323 -6.720 1.00 0.00 C ATOM 1289 CD1 LEU B 8 -0.834 4.639 -7.630 1.00 0.00 C ATOM 1290 CD2 LEU B 8 0.745 2.879 -6.918 1.00 0.00 C ATOM 0 H LEU B 8 3.185 3.459 -5.241 1.00 0.00 H new ATOM 0 HA LEU B 8 3.256 6.166 -6.210 1.00 0.00 H new ATOM 0 HB2 LEU B 8 1.003 6.306 -7.021 1.00 0.00 H new ATOM 0 HB3 LEU B 8 1.856 5.091 -7.953 1.00 0.00 H new ATOM 0 HG LEU B 8 0.004 4.426 -5.679 1.00 0.00 H new ATOM 0 HD11 LEU B 8 -1.646 3.934 -7.452 1.00 0.00 H new ATOM 0 HD12 LEU B 8 -1.184 5.653 -7.435 1.00 0.00 H new ATOM 0 HD13 LEU B 8 -0.506 4.561 -8.667 1.00 0.00 H new ATOM 0 HD21 LEU B 8 -0.098 2.215 -6.726 1.00 0.00 H new ATOM 0 HD22 LEU B 8 1.090 2.740 -7.943 1.00 0.00 H new ATOM 0 HD23 LEU B 8 1.555 2.646 -6.227 1.00 0.00 H new ATOM 1302 N LYS B 9 1.353 6.647 -4.359 1.00 0.00 N ATOM 1303 CA LYS B 9 0.762 6.936 -3.085 1.00 0.00 C ATOM 1304 C LYS B 9 -0.762 7.084 -3.126 1.00 0.00 C ATOM 1305 O LYS B 9 -1.336 7.596 -4.088 1.00 0.00 O ATOM 1306 CB LYS B 9 1.505 8.059 -2.338 1.00 0.00 C ATOM 1307 CG LYS B 9 1.804 9.340 -3.125 1.00 0.00 C ATOM 1308 CD LYS B 9 0.569 10.160 -3.454 1.00 0.00 C ATOM 1309 CE LYS B 9 -0.131 10.655 -2.203 1.00 0.00 C ATOM 1310 NZ LYS B 9 -1.233 11.553 -2.529 1.00 0.00 N ATOM 0 H LYS B 9 1.208 7.368 -5.066 1.00 0.00 H new ATOM 0 HA LYS B 9 0.905 6.046 -2.472 1.00 0.00 H new ATOM 0 HB2 LYS B 9 0.916 8.330 -1.462 1.00 0.00 H new ATOM 0 HB3 LYS B 9 2.451 7.656 -1.975 1.00 0.00 H new ATOM 0 HG2 LYS B 9 2.495 9.956 -2.549 1.00 0.00 H new ATOM 0 HG3 LYS B 9 2.311 9.075 -4.053 1.00 0.00 H new ATOM 0 HD2 LYS B 9 0.853 11.012 -4.072 1.00 0.00 H new ATOM 0 HD3 LYS B 9 -0.122 9.556 -4.042 1.00 0.00 H new ATOM 0 HE2 LYS B 9 -0.509 9.805 -1.635 1.00 0.00 H new ATOM 0 HE3 LYS B 9 0.585 11.172 -1.564 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 -1.691 11.874 -1.652 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 -0.868 12.376 -3.050 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 -1.927 11.051 -3.118 1.00 0.00 H new ATOM 1324 N GLY B 10 -1.386 6.630 -2.074 1.00 0.00 N ATOM 1325 CA GLY B 10 -2.808 6.569 -1.967 1.00 0.00 C ATOM 1326 C GLY B 10 -3.181 5.668 -0.801 1.00 0.00 C ATOM 1327 O GLY B 10 -2.465 5.625 0.214 1.00 0.00 O ATOM 0 H GLY B 10 -0.900 6.284 -1.247 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -3.217 7.568 -1.816 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -3.239 6.185 -2.892 1.00 0.00 H new ATOM 1331 N VAL B 11 -4.237 4.925 -0.961 1.00 0.00 N ATOM 1332 CA VAL B 11 -4.741 4.033 0.050 1.00 0.00 C ATOM 1333 C VAL B 11 -4.646 2.570 -0.426 1.00 0.00 C ATOM 1334 O VAL B 11 -5.104 2.210 -1.516 1.00 0.00 O ATOM 1335 CB VAL B 11 -6.214 4.381 0.434 1.00 0.00 C ATOM 1336 CG1 VAL B 11 -6.762 3.418 1.475 1.00 0.00 C ATOM 1337 CG2 VAL B 11 -6.307 5.805 0.954 1.00 0.00 C ATOM 0 H VAL B 11 -4.788 4.920 -1.819 1.00 0.00 H new ATOM 0 HA VAL B 11 -4.123 4.157 0.939 1.00 0.00 H new ATOM 0 HB VAL B 11 -6.817 4.287 -0.469 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -7.789 3.691 1.718 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -6.740 2.403 1.079 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -6.150 3.469 2.376 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -7.341 6.030 1.217 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -5.677 5.912 1.837 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -5.970 6.497 0.182 1.00 0.00 H new ATOM 1347 N LEU B 12 -4.038 1.783 0.401 1.00 0.00 N ATOM 1348 CA LEU B 12 -3.813 0.364 0.227 1.00 0.00 C ATOM 1349 C LEU B 12 -4.872 -0.388 1.007 1.00 0.00 C ATOM 1350 O LEU B 12 -4.918 -0.268 2.203 1.00 0.00 O ATOM 1351 CB LEU B 12 -2.425 0.030 0.824 1.00 0.00 C ATOM 1352 CG LEU B 12 -2.086 -1.452 1.000 1.00 0.00 C ATOM 1353 CD1 LEU B 12 -2.133 -2.204 -0.325 1.00 0.00 C ATOM 1354 CD2 LEU B 12 -0.732 -1.599 1.639 1.00 0.00 C ATOM 0 H LEU B 12 -3.654 2.128 1.281 1.00 0.00 H new ATOM 0 HA LEU B 12 -3.857 0.087 -0.826 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -1.664 0.479 0.185 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -2.349 0.513 1.798 1.00 0.00 H new ATOM 0 HG LEU B 12 -2.841 -1.892 1.652 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -1.886 -3.252 -0.157 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -3.134 -2.130 -0.750 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -1.412 -1.768 -1.017 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -0.500 -2.657 1.760 1.00 0.00 H new ATOM 0 HD22 LEU B 12 0.022 -1.132 1.005 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -0.736 -1.114 2.615 1.00 0.00 H new ATOM 1366 N ILE B 13 -5.714 -1.150 0.364 1.00 0.00 N ATOM 1367 CA ILE B 13 -6.754 -1.841 1.108 1.00 0.00 C ATOM 1368 C ILE B 13 -6.695 -3.370 1.004 1.00 0.00 C ATOM 1369 O ILE B 13 -6.571 -3.921 -0.095 1.00 0.00 O ATOM 1370 CB ILE B 13 -8.198 -1.310 0.753 1.00 0.00 C ATOM 1371 CG1 ILE B 13 -9.278 -2.053 1.571 1.00 0.00 C ATOM 1372 CG2 ILE B 13 -8.483 -1.411 -0.747 1.00 0.00 C ATOM 1373 CD1 ILE B 13 -10.682 -1.511 1.395 1.00 0.00 C ATOM 0 H ILE B 13 -5.711 -1.312 -0.643 1.00 0.00 H new ATOM 0 HA ILE B 13 -6.546 -1.601 2.151 1.00 0.00 H new ATOM 0 HB ILE B 13 -8.233 -0.255 1.023 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -9.270 -3.106 1.288 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -9.013 -2.005 2.627 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -9.486 -1.036 -0.953 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -7.754 -0.816 -1.297 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -8.413 -2.452 -1.061 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -11.375 -2.091 2.005 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -10.711 -0.467 1.707 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -10.972 -1.585 0.347 1.00 0.00 H new ATOM 1385 N GLU B 14 -6.684 -4.033 2.166 1.00 0.00 N ATOM 1386 CA GLU B 14 -6.942 -5.452 2.253 1.00 0.00 C ATOM 1387 C GLU B 14 -8.024 -5.626 3.286 1.00 0.00 C ATOM 1388 O GLU B 14 -7.967 -5.004 4.359 1.00 0.00 O ATOM 1389 CB GLU B 14 -5.761 -6.310 2.723 1.00 0.00 C ATOM 1390 CG GLU B 14 -6.100 -7.817 2.615 1.00 0.00 C ATOM 1391 CD GLU B 14 -5.138 -8.775 3.271 1.00 0.00 C ATOM 1392 OE1 GLU B 14 -5.319 -9.092 4.422 1.00 0.00 O ATOM 1393 OE2 GLU B 14 -4.214 -9.281 2.602 1.00 0.00 O ATOM 0 H GLU B 14 -6.495 -3.590 3.065 1.00 0.00 H new ATOM 0 HA GLU B 14 -7.191 -5.784 1.245 1.00 0.00 H new ATOM 0 HB2 GLU B 14 -4.881 -6.086 2.121 1.00 0.00 H new ATOM 0 HB3 GLU B 14 -5.513 -6.061 3.755 1.00 0.00 H new ATOM 0 HG2 GLU B 14 -7.087 -7.976 3.048 1.00 0.00 H new ATOM 0 HG3 GLU B 14 -6.170 -8.075 1.558 1.00 0.00 H new ATOM 1400 N CYS B 15 -8.951 -6.452 2.988 1.00 0.00 N ATOM 1401 CA CYS B 15 -10.042 -6.762 3.851 1.00 0.00 C ATOM 1402 C CYS B 15 -10.330 -8.210 3.563 1.00 0.00 C ATOM 1403 O CYS B 15 -9.424 -8.923 3.126 1.00 0.00 O ATOM 1404 CB CYS B 15 -11.240 -5.882 3.471 1.00 0.00 C ATOM 1405 SG CYS B 15 -12.613 -5.896 4.653 1.00 0.00 S ATOM 0 H CYS B 15 -8.980 -6.956 2.102 1.00 0.00 H new ATOM 0 HA CYS B 15 -9.833 -6.589 4.907 1.00 0.00 H new ATOM 0 HB2 CYS B 15 -10.893 -4.855 3.353 1.00 0.00 H new ATOM 0 HB3 CYS B 15 -11.614 -6.205 2.500 1.00 0.00 H new ATOM 0 HG CYS B 15 -13.562 -5.117 4.226 1.00 0.00 H new ATOM 1411 N ASP B 16 -11.515 -8.681 3.819 1.00 0.00 N ATOM 1412 CA ASP B 16 -11.851 -9.994 3.352 1.00 0.00 C ATOM 1413 C ASP B 16 -12.208 -9.811 1.875 1.00 0.00 C ATOM 1414 O ASP B 16 -12.705 -8.748 1.511 1.00 0.00 O ATOM 1415 CB ASP B 16 -12.993 -10.647 4.164 1.00 0.00 C ATOM 1416 CG ASP B 16 -14.353 -10.060 3.918 1.00 0.00 C ATOM 1417 OD1 ASP B 16 -14.614 -8.917 4.355 1.00 0.00 O ATOM 1418 OD2 ASP B 16 -15.203 -10.759 3.328 1.00 0.00 O ATOM 0 H ASP B 16 -12.247 -8.192 4.334 1.00 0.00 H new ATOM 0 HA ASP B 16 -11.019 -10.686 3.481 1.00 0.00 H new ATOM 0 HB2 ASP B 16 -13.024 -11.711 3.931 1.00 0.00 H new ATOM 0 HB3 ASP B 16 -12.761 -10.560 5.226 1.00 0.00 H new ATOM 1423 N PRO B 17 -11.943 -10.806 1.006 1.00 0.00 N ATOM 1424 CA PRO B 17 -12.069 -10.685 -0.490 1.00 0.00 C ATOM 1425 C PRO B 17 -13.422 -10.185 -1.042 1.00 0.00 C ATOM 1426 O PRO B 17 -13.546 -9.930 -2.249 1.00 0.00 O ATOM 1427 CB PRO B 17 -11.773 -12.101 -0.969 1.00 0.00 C ATOM 1428 CG PRO B 17 -10.883 -12.636 0.089 1.00 0.00 C ATOM 1429 CD PRO B 17 -11.474 -12.155 1.373 1.00 0.00 C ATOM 0 HA PRO B 17 -11.393 -9.910 -0.853 1.00 0.00 H new ATOM 0 HB2 PRO B 17 -12.684 -12.692 -1.066 1.00 0.00 H new ATOM 0 HB3 PRO B 17 -11.286 -12.103 -1.944 1.00 0.00 H new ATOM 0 HG2 PRO B 17 -10.842 -13.725 0.057 1.00 0.00 H new ATOM 0 HG3 PRO B 17 -9.862 -12.275 -0.035 1.00 0.00 H new ATOM 0 HD2 PRO B 17 -12.290 -12.793 1.711 1.00 0.00 H new ATOM 0 HD3 PRO B 17 -10.738 -12.127 2.176 1.00 0.00 H new ATOM 1437 N ALA B 18 -14.392 -10.021 -0.175 1.00 0.00 N ATOM 1438 CA ALA B 18 -15.702 -9.529 -0.526 1.00 0.00 C ATOM 1439 C ALA B 18 -15.616 -8.143 -1.149 1.00 0.00 C ATOM 1440 O ALA B 18 -16.212 -7.892 -2.215 1.00 0.00 O ATOM 1441 CB ALA B 18 -16.538 -9.455 0.715 1.00 0.00 C ATOM 0 H ALA B 18 -14.290 -10.231 0.818 1.00 0.00 H new ATOM 0 HA ALA B 18 -16.148 -10.208 -1.253 1.00 0.00 H new ATOM 0 HB1 ALA B 18 -17.531 -9.084 0.463 1.00 0.00 H new ATOM 0 HB2 ALA B 18 -16.623 -10.448 1.156 1.00 0.00 H new ATOM 0 HB3 ALA B 18 -16.069 -8.779 1.430 1.00 0.00 H new ATOM 1447 N MET B 19 -14.829 -7.246 -0.517 1.00 0.00 N ATOM 1448 CA MET B 19 -14.733 -5.873 -1.005 1.00 0.00 C ATOM 1449 C MET B 19 -14.128 -5.862 -2.376 1.00 0.00 C ATOM 1450 O MET B 19 -14.542 -5.115 -3.227 1.00 0.00 O ATOM 1451 CB MET B 19 -13.932 -4.916 -0.066 1.00 0.00 C ATOM 1452 CG MET B 19 -12.411 -4.815 -0.310 1.00 0.00 C ATOM 1453 SD MET B 19 -11.494 -6.331 -0.011 1.00 0.00 S ATOM 1454 CE MET B 19 -9.851 -5.767 -0.413 1.00 0.00 C ATOM 0 H MET B 19 -14.268 -7.450 0.310 1.00 0.00 H new ATOM 0 HA MET B 19 -15.753 -5.489 -1.030 1.00 0.00 H new ATOM 0 HB2 MET B 19 -14.358 -3.917 -0.156 1.00 0.00 H new ATOM 0 HB3 MET B 19 -14.090 -5.238 0.963 1.00 0.00 H new ATOM 0 HG2 MET B 19 -12.243 -4.503 -1.341 1.00 0.00 H new ATOM 0 HG3 MET B 19 -12.006 -4.031 0.330 1.00 0.00 H new ATOM 0 HE1 MET B 19 -9.360 -6.502 -1.051 1.00 0.00 H new ATOM 0 HE2 MET B 19 -9.912 -4.813 -0.938 1.00 0.00 H new ATOM 0 HE3 MET B 19 -9.275 -5.641 0.504 1.00 0.00 H new ATOM 1464 N LYS B 20 -13.189 -6.759 -2.582 1.00 0.00 N ATOM 1465 CA LYS B 20 -12.446 -6.869 -3.799 1.00 0.00 C ATOM 1466 C LYS B 20 -13.360 -7.203 -4.969 1.00 0.00 C ATOM 1467 O LYS B 20 -13.251 -6.604 -6.042 1.00 0.00 O ATOM 1468 CB LYS B 20 -11.315 -7.911 -3.605 1.00 0.00 C ATOM 1469 CG LYS B 20 -10.531 -8.319 -4.852 1.00 0.00 C ATOM 1470 CD LYS B 20 -9.896 -7.142 -5.575 1.00 0.00 C ATOM 1471 CE LYS B 20 -10.470 -7.026 -6.955 1.00 0.00 C ATOM 1472 NZ LYS B 20 -10.031 -5.806 -7.631 1.00 0.00 N ATOM 0 H LYS B 20 -12.920 -7.449 -1.880 1.00 0.00 H new ATOM 0 HA LYS B 20 -11.987 -5.911 -4.043 1.00 0.00 H new ATOM 0 HB2 LYS B 20 -10.609 -7.514 -2.875 1.00 0.00 H new ATOM 0 HB3 LYS B 20 -11.752 -8.810 -3.170 1.00 0.00 H new ATOM 0 HG2 LYS B 20 -9.751 -9.025 -4.567 1.00 0.00 H new ATOM 0 HG3 LYS B 20 -11.199 -8.841 -5.538 1.00 0.00 H new ATOM 0 HD2 LYS B 20 -10.074 -6.222 -5.018 1.00 0.00 H new ATOM 0 HD3 LYS B 20 -8.816 -7.277 -5.630 1.00 0.00 H new ATOM 0 HE2 LYS B 20 -10.174 -7.894 -7.545 1.00 0.00 H new ATOM 0 HE3 LYS B 20 -11.558 -7.036 -6.897 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 -10.186 -5.902 -8.655 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 -10.575 -4.995 -7.273 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 -9.019 -5.652 -7.447 1.00 0.00 H new ATOM 1486 N GLN B 21 -14.291 -8.076 -4.751 1.00 0.00 N ATOM 1487 CA GLN B 21 -15.151 -8.511 -5.816 1.00 0.00 C ATOM 1488 C GLN B 21 -16.175 -7.455 -6.217 1.00 0.00 C ATOM 1489 O GLN B 21 -16.417 -7.246 -7.406 1.00 0.00 O ATOM 1490 CB GLN B 21 -15.742 -9.852 -5.493 1.00 0.00 C ATOM 1491 CG GLN B 21 -14.644 -10.888 -5.312 1.00 0.00 C ATOM 1492 CD GLN B 21 -13.857 -11.176 -6.576 1.00 0.00 C ATOM 1493 OE1 GLN B 21 -14.374 -11.085 -7.699 1.00 0.00 O ATOM 1494 NE2 GLN B 21 -12.609 -11.527 -6.411 1.00 0.00 N ATOM 0 H GLN B 21 -14.479 -8.505 -3.845 1.00 0.00 H new ATOM 0 HA GLN B 21 -14.547 -8.643 -6.714 1.00 0.00 H new ATOM 0 HB2 GLN B 21 -16.339 -9.783 -4.584 1.00 0.00 H new ATOM 0 HB3 GLN B 21 -16.414 -10.162 -6.293 1.00 0.00 H new ATOM 0 HG2 GLN B 21 -13.957 -10.544 -4.539 1.00 0.00 H new ATOM 0 HG3 GLN B 21 -15.089 -11.816 -4.953 1.00 0.00 H new ATOM 0 HE21 GLN B 21 -12.217 -11.591 -5.471 1.00 0.00 H new ATOM 0 HE22 GLN B 21 -12.027 -11.737 -7.222 1.00 0.00 H new ATOM 1503 N PHE B 22 -16.757 -6.756 -5.254 1.00 0.00 N ATOM 1504 CA PHE B 22 -17.620 -5.645 -5.629 1.00 0.00 C ATOM 1505 C PHE B 22 -16.808 -4.506 -6.242 1.00 0.00 C ATOM 1506 O PHE B 22 -17.266 -3.826 -7.125 1.00 0.00 O ATOM 1507 CB PHE B 22 -18.650 -5.176 -4.558 1.00 0.00 C ATOM 1508 CG PHE B 22 -18.132 -4.625 -3.252 1.00 0.00 C ATOM 1509 CD1 PHE B 22 -17.506 -3.389 -3.196 1.00 0.00 C ATOM 1510 CD2 PHE B 22 -18.331 -5.321 -2.072 1.00 0.00 C ATOM 1511 CE1 PHE B 22 -17.083 -2.866 -1.996 1.00 0.00 C ATOM 1512 CE2 PHE B 22 -17.904 -4.803 -0.866 1.00 0.00 C ATOM 1513 CZ PHE B 22 -17.281 -3.573 -0.827 1.00 0.00 C ATOM 0 H PHE B 22 -16.656 -6.925 -4.253 1.00 0.00 H new ATOM 0 HA PHE B 22 -18.277 -6.047 -6.400 1.00 0.00 H new ATOM 0 HB2 PHE B 22 -19.278 -4.411 -5.015 1.00 0.00 H new ATOM 0 HB3 PHE B 22 -19.297 -6.023 -4.327 1.00 0.00 H new ATOM 0 HD1 PHE B 22 -17.348 -2.830 -4.106 1.00 0.00 H new ATOM 0 HD2 PHE B 22 -18.826 -6.281 -2.095 1.00 0.00 H new ATOM 0 HE1 PHE B 22 -16.596 -1.902 -1.968 1.00 0.00 H new ATOM 0 HE2 PHE B 22 -18.058 -5.360 0.046 1.00 0.00 H new ATOM 0 HZ PHE B 22 -16.949 -3.164 0.116 1.00 0.00 H new ATOM 1523 N LEU B 23 -15.590 -4.339 -5.751 1.00 0.00 N ATOM 1524 CA LEU B 23 -14.663 -3.316 -6.187 1.00 0.00 C ATOM 1525 C LEU B 23 -14.353 -3.475 -7.675 1.00 0.00 C ATOM 1526 O LEU B 23 -14.374 -2.504 -8.423 1.00 0.00 O ATOM 1527 CB LEU B 23 -13.405 -3.490 -5.351 1.00 0.00 C ATOM 1528 CG LEU B 23 -12.543 -2.289 -5.048 1.00 0.00 C ATOM 1529 CD1 LEU B 23 -13.373 -1.188 -4.390 1.00 0.00 C ATOM 1530 CD2 LEU B 23 -11.470 -2.722 -4.085 1.00 0.00 C ATOM 0 H LEU B 23 -15.211 -4.933 -5.014 1.00 0.00 H new ATOM 0 HA LEU B 23 -15.083 -2.319 -6.055 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -13.704 -3.927 -4.398 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -12.777 -4.224 -5.855 1.00 0.00 H new ATOM 0 HG LEU B 23 -12.116 -1.903 -5.973 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -12.736 -0.329 -4.178 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -14.176 -0.887 -5.062 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -13.800 -1.561 -3.459 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -10.830 -1.872 -3.847 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -11.931 -3.096 -3.171 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -10.871 -3.512 -4.539 1.00 0.00 H new ATOM 1542 N LEU B 24 -14.085 -4.688 -8.106 1.00 0.00 N ATOM 1543 CA LEU B 24 -13.840 -4.933 -9.519 1.00 0.00 C ATOM 1544 C LEU B 24 -15.113 -4.732 -10.359 1.00 0.00 C ATOM 1545 O LEU B 24 -15.052 -4.257 -11.490 1.00 0.00 O ATOM 1546 CB LEU B 24 -13.137 -6.279 -9.744 1.00 0.00 C ATOM 1547 CG LEU B 24 -13.810 -7.534 -9.195 1.00 0.00 C ATOM 1548 CD1 LEU B 24 -14.820 -8.089 -10.133 1.00 0.00 C ATOM 1549 CD2 LEU B 24 -12.794 -8.562 -8.868 1.00 0.00 C ATOM 0 H LEU B 24 -14.030 -5.514 -7.510 1.00 0.00 H new ATOM 0 HA LEU B 24 -13.140 -4.181 -9.882 1.00 0.00 H new ATOM 0 HB2 LEU B 24 -13.005 -6.412 -10.818 1.00 0.00 H new ATOM 0 HB3 LEU B 24 -12.141 -6.214 -9.306 1.00 0.00 H new ATOM 0 HG LEU B 24 -14.337 -7.245 -8.286 1.00 0.00 H new ATOM 0 HD11 LEU B 24 -15.270 -8.981 -9.697 1.00 0.00 H new ATOM 0 HD12 LEU B 24 -15.594 -7.344 -10.316 1.00 0.00 H new ATOM 0 HD13 LEU B 24 -14.337 -8.350 -11.075 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -13.289 -9.451 -8.478 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -12.237 -8.822 -9.768 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -12.108 -8.170 -8.117 1.00 0.00 H new ATOM 1561 N TYR B 25 -16.269 -5.053 -9.767 1.00 0.00 N ATOM 1562 CA TYR B 25 -17.565 -4.819 -10.405 1.00 0.00 C ATOM 1563 C TYR B 25 -17.778 -3.314 -10.577 1.00 0.00 C ATOM 1564 O TYR B 25 -18.308 -2.840 -11.582 1.00 0.00 O ATOM 1565 CB TYR B 25 -18.699 -5.434 -9.562 1.00 0.00 C ATOM 1566 CG TYR B 25 -20.100 -5.143 -10.073 1.00 0.00 C ATOM 1567 CD1 TYR B 25 -20.594 -5.758 -11.217 1.00 0.00 C ATOM 1568 CD2 TYR B 25 -20.923 -4.238 -9.410 1.00 0.00 C ATOM 1569 CE1 TYR B 25 -21.867 -5.479 -11.683 1.00 0.00 C ATOM 1570 CE2 TYR B 25 -22.190 -3.952 -9.870 1.00 0.00 C ATOM 1571 CZ TYR B 25 -22.659 -4.575 -11.004 1.00 0.00 C ATOM 1572 OH TYR B 25 -23.921 -4.284 -11.464 1.00 0.00 O ATOM 0 H TYR B 25 -16.331 -5.478 -8.842 1.00 0.00 H new ATOM 0 HA TYR B 25 -17.577 -5.297 -11.385 1.00 0.00 H new ATOM 0 HB2 TYR B 25 -18.559 -6.514 -9.522 1.00 0.00 H new ATOM 0 HB3 TYR B 25 -18.615 -5.064 -8.540 1.00 0.00 H new ATOM 0 HD1 TYR B 25 -19.975 -6.464 -11.751 1.00 0.00 H new ATOM 0 HD2 TYR B 25 -20.562 -3.750 -8.517 1.00 0.00 H new ATOM 0 HE1 TYR B 25 -22.239 -5.966 -12.573 1.00 0.00 H new ATOM 0 HE2 TYR B 25 -22.812 -3.243 -9.344 1.00 0.00 H new ATOM 0 HH TYR B 25 -24.343 -3.630 -10.869 1.00 0.00 H new ATOM 1582 N LEU B 26 -17.358 -2.582 -9.592 1.00 0.00 N ATOM 1583 CA LEU B 26 -17.402 -1.153 -9.607 1.00 0.00 C ATOM 1584 C LEU B 26 -16.499 -0.536 -10.661 1.00 0.00 C ATOM 1585 O LEU B 26 -16.762 0.560 -11.108 1.00 0.00 O ATOM 1586 CB LEU B 26 -17.256 -0.517 -8.220 1.00 0.00 C ATOM 1587 CG LEU B 26 -18.556 -0.192 -7.475 1.00 0.00 C ATOM 1588 CD1 LEU B 26 -19.343 0.863 -8.244 1.00 0.00 C ATOM 1589 CD2 LEU B 26 -19.397 -1.439 -7.267 1.00 0.00 C ATOM 0 H LEU B 26 -16.966 -2.971 -8.735 1.00 0.00 H new ATOM 0 HA LEU B 26 -18.416 -0.902 -9.919 1.00 0.00 H new ATOM 0 HB2 LEU B 26 -16.665 -1.189 -7.597 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -16.684 0.405 -8.326 1.00 0.00 H new ATOM 0 HG LEU B 26 -18.300 0.201 -6.491 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -20.266 1.090 -7.710 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -18.744 1.769 -8.335 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -19.583 0.485 -9.238 1.00 0.00 H new ATOM 0 HD21 LEU B 26 -20.312 -1.176 -6.736 1.00 0.00 H new ATOM 0 HD22 LEU B 26 -19.650 -1.873 -8.234 1.00 0.00 H new ATOM 0 HD23 LEU B 26 -18.833 -2.165 -6.681 1.00 0.00 H new ATOM 1601 N ASP B 27 -15.394 -1.176 -10.980 1.00 0.00 N ATOM 1602 CA ASP B 27 -14.557 -0.699 -12.092 1.00 0.00 C ATOM 1603 C ASP B 27 -15.297 -0.847 -13.429 1.00 0.00 C ATOM 1604 O ASP B 27 -15.384 0.105 -14.218 1.00 0.00 O ATOM 1605 CB ASP B 27 -13.235 -1.477 -12.172 1.00 0.00 C ATOM 1606 CG ASP B 27 -12.447 -1.163 -13.445 1.00 0.00 C ATOM 1607 OD1 ASP B 27 -11.685 -0.172 -13.470 1.00 0.00 O ATOM 1608 OD2 ASP B 27 -12.580 -1.917 -14.447 1.00 0.00 O ATOM 0 H ASP B 27 -15.049 -2.010 -10.506 1.00 0.00 H new ATOM 0 HA ASP B 27 -14.341 0.352 -11.902 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -12.623 -1.238 -11.302 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -13.443 -2.546 -12.132 1.00 0.00 H new ATOM 1613 N GLU B 28 -15.889 -2.016 -13.636 1.00 0.00 N ATOM 1614 CA GLU B 28 -16.547 -2.336 -14.904 1.00 0.00 C ATOM 1615 C GLU B 28 -17.914 -1.656 -15.075 1.00 0.00 C ATOM 1616 O GLU B 28 -18.209 -1.102 -16.134 1.00 0.00 O ATOM 1617 CB GLU B 28 -16.658 -3.853 -15.094 1.00 0.00 C ATOM 1618 CG GLU B 28 -17.366 -4.575 -13.969 1.00 0.00 C ATOM 1619 CD GLU B 28 -17.583 -6.028 -14.246 1.00 0.00 C ATOM 1620 OE1 GLU B 28 -18.580 -6.364 -14.903 1.00 0.00 O ATOM 1621 OE2 GLU B 28 -16.783 -6.866 -13.793 1.00 0.00 O ATOM 0 H GLU B 28 -15.929 -2.763 -12.942 1.00 0.00 H new ATOM 0 HA GLU B 28 -15.910 -1.928 -15.688 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -17.187 -4.052 -16.026 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -15.656 -4.268 -15.201 1.00 0.00 H new ATOM 0 HG2 GLU B 28 -16.783 -4.469 -13.054 1.00 0.00 H new ATOM 0 HG3 GLU B 28 -18.330 -4.098 -13.790 1.00 0.00 H new ATOM 1628 N SER B 29 -18.723 -1.664 -14.041 1.00 0.00 N ATOM 1629 CA SER B 29 -20.026 -1.040 -14.104 1.00 0.00 C ATOM 1630 C SER B 29 -19.821 0.464 -13.928 1.00 0.00 C ATOM 1631 O SER B 29 -20.344 1.282 -14.682 1.00 0.00 O ATOM 1632 CB SER B 29 -20.932 -1.639 -13.002 1.00 0.00 C ATOM 1633 OG SER B 29 -22.267 -1.182 -13.087 1.00 0.00 O ATOM 0 H SER B 29 -18.502 -2.096 -13.144 1.00 0.00 H new ATOM 0 HA SER B 29 -20.519 -1.222 -15.059 1.00 0.00 H new ATOM 0 HB2 SER B 29 -20.919 -2.726 -13.077 1.00 0.00 H new ATOM 0 HB3 SER B 29 -20.526 -1.382 -12.024 1.00 0.00 H new ATOM 0 HG SER B 29 -22.798 -1.590 -12.372 1.00 0.00 H new ATOM 1639 N ASN B 30 -18.991 0.774 -12.962 1.00 0.00 N ATOM 1640 CA ASN B 30 -18.542 2.113 -12.612 1.00 0.00 C ATOM 1641 C ASN B 30 -19.666 3.098 -12.352 1.00 0.00 C ATOM 1642 O ASN B 30 -19.943 3.977 -13.161 1.00 0.00 O ATOM 1643 CB ASN B 30 -17.533 2.654 -13.622 1.00 0.00 C ATOM 1644 CG ASN B 30 -16.562 3.643 -13.013 1.00 0.00 C ATOM 1645 OD1 ASN B 30 -16.169 4.596 -13.653 1.00 0.00 O ATOM 1646 ND2 ASN B 30 -16.081 3.363 -11.819 1.00 0.00 N ATOM 0 H ASN B 30 -18.582 0.060 -12.359 1.00 0.00 H new ATOM 0 HA ASN B 30 -18.033 2.004 -11.655 1.00 0.00 H new ATOM 0 HB2 ASN B 30 -16.975 1.822 -14.052 1.00 0.00 H new ATOM 0 HB3 ASN B 30 -18.068 3.135 -14.441 1.00 0.00 H new ATOM 0 HD21 ASN B 30 -15.358 3.954 -11.409 1.00 0.00 H new ATOM 0 HD22 ASN B 30 -16.431 2.555 -11.305 1.00 0.00 H new ATOM 1653 N ALA B 31 -20.320 2.918 -11.222 1.00 0.00 N ATOM 1654 CA ALA B 31 -21.411 3.794 -10.784 1.00 0.00 C ATOM 1655 C ALA B 31 -20.892 5.178 -10.410 1.00 0.00 C ATOM 1656 O ALA B 31 -21.586 6.182 -10.538 1.00 0.00 O ATOM 1657 CB ALA B 31 -22.101 3.173 -9.591 1.00 0.00 C ATOM 0 H ALA B 31 -20.116 2.159 -10.572 1.00 0.00 H new ATOM 0 HA ALA B 31 -22.115 3.907 -11.609 1.00 0.00 H new ATOM 0 HB1 ALA B 31 -22.913 3.821 -9.262 1.00 0.00 H new ATOM 0 HB2 ALA B 31 -22.504 2.200 -9.870 1.00 0.00 H new ATOM 0 HB3 ALA B 31 -21.384 3.050 -8.779 1.00 0.00 H new ATOM 1663 N LEU B 32 -19.651 5.209 -9.999 1.00 0.00 N ATOM 1664 CA LEU B 32 -19.013 6.407 -9.488 1.00 0.00 C ATOM 1665 C LEU B 32 -18.492 7.292 -10.610 1.00 0.00 C ATOM 1666 O LEU B 32 -18.203 8.462 -10.399 1.00 0.00 O ATOM 1667 CB LEU B 32 -17.874 5.976 -8.580 1.00 0.00 C ATOM 1668 CG LEU B 32 -18.295 5.158 -7.370 1.00 0.00 C ATOM 1669 CD1 LEU B 32 -17.096 4.486 -6.755 1.00 0.00 C ATOM 1670 CD2 LEU B 32 -18.970 6.049 -6.350 1.00 0.00 C ATOM 0 H LEU B 32 -19.040 4.392 -10.008 1.00 0.00 H new ATOM 0 HA LEU B 32 -19.744 6.998 -8.937 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -17.163 5.393 -9.165 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -17.348 6.866 -8.234 1.00 0.00 H new ATOM 0 HG LEU B 32 -19.001 4.392 -7.692 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -17.410 3.903 -5.889 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -16.633 3.826 -7.488 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -16.376 5.242 -6.442 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -19.268 5.453 -5.487 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -18.277 6.828 -6.032 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -19.852 6.509 -6.796 1.00 0.00 H new ATOM 1682 N GLY B 33 -18.355 6.715 -11.786 1.00 0.00 N ATOM 1683 CA GLY B 33 -17.879 7.444 -12.954 1.00 0.00 C ATOM 1684 C GLY B 33 -16.374 7.726 -12.947 1.00 0.00 C ATOM 1685 O GLY B 33 -15.852 8.341 -13.877 1.00 0.00 O ATOM 0 H GLY B 33 -18.568 5.733 -11.964 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -18.126 6.874 -13.850 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -18.415 8.391 -13.020 1.00 0.00 H new ATOM 1689 N LYS B 34 -15.674 7.261 -11.930 1.00 0.00 N ATOM 1690 CA LYS B 34 -14.225 7.428 -11.842 1.00 0.00 C ATOM 1691 C LYS B 34 -13.579 6.111 -11.485 1.00 0.00 C ATOM 1692 O LYS B 34 -14.221 5.243 -10.858 1.00 0.00 O ATOM 1693 CB LYS B 34 -13.775 8.514 -10.817 1.00 0.00 C ATOM 1694 CG LYS B 34 -14.046 9.979 -11.213 1.00 0.00 C ATOM 1695 CD LYS B 34 -15.500 10.404 -11.051 1.00 0.00 C ATOM 1696 CE LYS B 34 -15.907 10.487 -9.583 1.00 0.00 C ATOM 1697 NZ LYS B 34 -17.306 10.926 -9.425 1.00 0.00 N ATOM 0 H LYS B 34 -16.085 6.759 -11.143 1.00 0.00 H new ATOM 0 HA LYS B 34 -13.901 7.770 -12.825 1.00 0.00 H new ATOM 0 HB2 LYS B 34 -14.275 8.318 -9.869 1.00 0.00 H new ATOM 0 HB3 LYS B 34 -12.705 8.399 -10.643 1.00 0.00 H new ATOM 0 HG2 LYS B 34 -13.417 10.631 -10.607 1.00 0.00 H new ATOM 0 HG3 LYS B 34 -13.749 10.125 -12.251 1.00 0.00 H new ATOM 0 HD2 LYS B 34 -15.650 11.374 -11.525 1.00 0.00 H new ATOM 0 HD3 LYS B 34 -16.146 9.694 -11.567 1.00 0.00 H new ATOM 0 HE2 LYS B 34 -15.777 9.511 -9.114 1.00 0.00 H new ATOM 0 HE3 LYS B 34 -15.248 11.181 -9.062 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 -17.489 11.149 -8.426 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 -17.472 11.773 -10.005 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 -17.945 10.166 -9.733 1.00 0.00 H new ATOM 1711 N LYS B 35 -12.345 5.943 -11.885 1.00 0.00 N ATOM 1712 CA LYS B 35 -11.597 4.744 -11.585 1.00 0.00 C ATOM 1713 C LYS B 35 -10.828 4.882 -10.314 1.00 0.00 C ATOM 1714 O LYS B 35 -9.759 5.470 -10.249 1.00 0.00 O ATOM 1715 CB LYS B 35 -10.726 4.251 -12.757 1.00 0.00 C ATOM 1716 CG LYS B 35 -11.473 3.400 -13.797 1.00 0.00 C ATOM 1717 CD LYS B 35 -12.656 4.124 -14.421 1.00 0.00 C ATOM 1718 CE LYS B 35 -13.434 3.212 -15.347 1.00 0.00 C ATOM 1719 NZ LYS B 35 -14.633 3.878 -15.890 1.00 0.00 N ATOM 0 H LYS B 35 -11.827 6.633 -12.429 1.00 0.00 H new ATOM 0 HA LYS B 35 -12.334 3.955 -11.433 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -10.292 5.116 -13.259 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -9.898 3.667 -12.356 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -10.778 3.106 -14.584 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -11.824 2.483 -13.323 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -13.314 4.495 -13.635 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -12.302 4.993 -14.976 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -12.792 2.894 -16.168 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -13.731 2.313 -14.807 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -15.210 3.185 -16.408 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -15.191 4.279 -15.109 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -14.344 4.640 -16.536 1.00 0.00 H new ATOM 1733 N PHE B 36 -11.431 4.352 -9.308 1.00 0.00 N ATOM 1734 CA PHE B 36 -10.916 4.330 -7.972 1.00 0.00 C ATOM 1735 C PHE B 36 -9.819 3.284 -7.856 1.00 0.00 C ATOM 1736 O PHE B 36 -8.826 3.493 -7.189 1.00 0.00 O ATOM 1737 CB PHE B 36 -12.078 4.030 -6.989 1.00 0.00 C ATOM 1738 CG PHE B 36 -12.885 2.822 -7.394 1.00 0.00 C ATOM 1739 CD1 PHE B 36 -13.900 2.948 -8.327 1.00 0.00 C ATOM 1740 CD2 PHE B 36 -12.589 1.558 -6.906 1.00 0.00 C ATOM 1741 CE1 PHE B 36 -14.597 1.861 -8.746 1.00 0.00 C ATOM 1742 CE2 PHE B 36 -13.283 0.475 -7.339 1.00 0.00 C ATOM 1743 CZ PHE B 36 -14.278 0.622 -8.254 1.00 0.00 C ATOM 0 H PHE B 36 -12.341 3.899 -9.392 1.00 0.00 H new ATOM 0 HA PHE B 36 -10.483 5.299 -7.723 1.00 0.00 H new ATOM 0 HB2 PHE B 36 -11.672 3.872 -5.990 1.00 0.00 H new ATOM 0 HB3 PHE B 36 -12.734 4.898 -6.933 1.00 0.00 H new ATOM 0 HD1 PHE B 36 -14.140 3.922 -8.726 1.00 0.00 H new ATOM 0 HD2 PHE B 36 -11.802 1.435 -6.177 1.00 0.00 H new ATOM 0 HE1 PHE B 36 -15.398 1.972 -9.462 1.00 0.00 H new ATOM 0 HE2 PHE B 36 -13.044 -0.506 -6.956 1.00 0.00 H new ATOM 0 HZ PHE B 36 -14.822 -0.246 -8.596 1.00 0.00 H new ATOM 1753 N ILE B 37 -9.990 2.179 -8.538 1.00 0.00 N ATOM 1754 CA ILE B 37 -9.028 1.135 -8.481 1.00 0.00 C ATOM 1755 C ILE B 37 -7.950 1.414 -9.527 1.00 0.00 C ATOM 1756 O ILE B 37 -8.180 1.317 -10.739 1.00 0.00 O ATOM 1757 CB ILE B 37 -9.712 -0.318 -8.556 1.00 0.00 C ATOM 1758 CG1 ILE B 37 -8.740 -1.512 -8.397 1.00 0.00 C ATOM 1759 CG2 ILE B 37 -10.594 -0.526 -9.763 1.00 0.00 C ATOM 1760 CD1 ILE B 37 -7.759 -1.733 -9.533 1.00 0.00 C ATOM 0 H ILE B 37 -10.793 1.990 -9.138 1.00 0.00 H new ATOM 0 HA ILE B 37 -8.529 1.118 -7.512 1.00 0.00 H new ATOM 0 HB ILE B 37 -10.350 -0.311 -7.672 1.00 0.00 H new ATOM 0 HG12 ILE B 37 -8.173 -1.372 -7.477 1.00 0.00 H new ATOM 0 HG13 ILE B 37 -9.330 -2.420 -8.272 1.00 0.00 H new ATOM 0 HG21 ILE B 37 -11.016 -1.531 -9.737 1.00 0.00 H new ATOM 0 HG22 ILE B 37 -11.401 0.207 -9.754 1.00 0.00 H new ATOM 0 HG23 ILE B 37 -10.003 -0.404 -10.671 1.00 0.00 H new ATOM 0 HD11 ILE B 37 -7.132 -2.596 -9.309 1.00 0.00 H new ATOM 0 HD12 ILE B 37 -8.308 -1.913 -10.458 1.00 0.00 H new ATOM 0 HD13 ILE B 37 -7.132 -0.849 -9.650 1.00 0.00 H new ATOM 1772 N ILE B 38 -6.816 1.851 -9.029 1.00 0.00 N ATOM 1773 CA ILE B 38 -5.655 2.167 -9.836 1.00 0.00 C ATOM 1774 C ILE B 38 -4.894 0.904 -10.164 1.00 0.00 C ATOM 1775 O ILE B 38 -4.574 0.613 -11.323 1.00 0.00 O ATOM 1776 CB ILE B 38 -4.666 3.145 -9.073 1.00 0.00 C ATOM 1777 CG1 ILE B 38 -5.074 4.633 -9.160 1.00 0.00 C ATOM 1778 CG2 ILE B 38 -3.193 2.939 -9.442 1.00 0.00 C ATOM 1779 CD1 ILE B 38 -6.246 5.030 -8.289 1.00 0.00 C ATOM 0 H ILE B 38 -6.670 2.001 -8.031 1.00 0.00 H new ATOM 0 HA ILE B 38 -6.015 2.651 -10.744 1.00 0.00 H new ATOM 0 HB ILE B 38 -4.765 2.860 -8.026 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -4.215 5.246 -8.887 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -5.316 4.867 -10.197 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -2.576 3.642 -8.882 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -2.896 1.919 -9.197 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -3.058 3.109 -10.510 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -6.454 6.092 -8.421 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -7.124 4.450 -8.574 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -6.005 4.835 -7.244 1.00 0.00 H new ATOM 1791 N GLN B 39 -4.632 0.171 -9.136 1.00 0.00 N ATOM 1792 CA GLN B 39 -3.751 -0.928 -9.180 1.00 0.00 C ATOM 1793 C GLN B 39 -4.303 -2.062 -8.346 1.00 0.00 C ATOM 1794 O GLN B 39 -4.792 -1.854 -7.222 1.00 0.00 O ATOM 1795 CB GLN B 39 -2.365 -0.414 -8.691 1.00 0.00 C ATOM 1796 CG GLN B 39 -1.422 -1.407 -8.078 1.00 0.00 C ATOM 1797 CD GLN B 39 -0.900 -2.513 -8.988 1.00 0.00 C ATOM 1798 OE1 GLN B 39 -1.540 -2.934 -9.914 1.00 0.00 O ATOM 1799 NE2 GLN B 39 0.281 -2.986 -8.686 1.00 0.00 N ATOM 0 H GLN B 39 -5.042 0.332 -8.216 1.00 0.00 H new ATOM 0 HA GLN B 39 -3.639 -1.332 -10.186 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -1.860 0.045 -9.541 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -2.540 0.375 -7.960 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -0.566 -0.862 -7.681 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -1.924 -1.873 -7.230 1.00 0.00 H new ATOM 0 HE21 GLN B 39 0.796 -2.604 -7.893 1.00 0.00 H new ATOM 0 HE22 GLN B 39 0.688 -3.737 -9.244 1.00 0.00 H new ATOM 1808 N ASP B 40 -4.267 -3.226 -8.918 1.00 0.00 N ATOM 1809 CA ASP B 40 -4.698 -4.437 -8.281 1.00 0.00 C ATOM 1810 C ASP B 40 -3.501 -5.117 -7.706 1.00 0.00 C ATOM 1811 O ASP B 40 -2.564 -5.482 -8.431 1.00 0.00 O ATOM 1812 CB ASP B 40 -5.340 -5.388 -9.285 1.00 0.00 C ATOM 1813 CG ASP B 40 -6.855 -5.391 -9.260 1.00 0.00 C ATOM 1814 OD1 ASP B 40 -7.454 -5.928 -8.280 1.00 0.00 O ATOM 1815 OD2 ASP B 40 -7.493 -4.933 -10.238 1.00 0.00 O ATOM 0 H ASP B 40 -3.927 -3.366 -9.869 1.00 0.00 H new ATOM 0 HA ASP B 40 -5.429 -4.185 -7.512 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -5.005 -5.120 -10.287 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -4.983 -6.399 -9.090 1.00 0.00 H new ATOM 1820 N ILE B 41 -3.485 -5.262 -6.433 1.00 0.00 N ATOM 1821 CA ILE B 41 -2.430 -5.954 -5.794 1.00 0.00 C ATOM 1822 C ILE B 41 -2.955 -7.296 -5.218 1.00 0.00 C ATOM 1823 O ILE B 41 -4.170 -7.505 -5.174 1.00 0.00 O ATOM 1824 CB ILE B 41 -1.563 -5.078 -4.779 1.00 0.00 C ATOM 1825 CG1 ILE B 41 -2.399 -4.131 -3.924 1.00 0.00 C ATOM 1826 CG2 ILE B 41 -0.523 -4.255 -5.523 1.00 0.00 C ATOM 1827 CD1 ILE B 41 -2.793 -2.840 -4.582 1.00 0.00 C ATOM 0 H ILE B 41 -4.204 -4.904 -5.804 1.00 0.00 H new ATOM 0 HA ILE B 41 -1.687 -6.192 -6.556 1.00 0.00 H new ATOM 0 HB ILE B 41 -1.085 -5.799 -4.116 1.00 0.00 H new ATOM 0 HG12 ILE B 41 -3.305 -4.653 -3.616 1.00 0.00 H new ATOM 0 HG13 ILE B 41 -1.840 -3.900 -3.017 1.00 0.00 H new ATOM 0 HG21 ILE B 41 0.054 -3.667 -4.809 1.00 0.00 H new ATOM 0 HG22 ILE B 41 0.145 -4.921 -6.069 1.00 0.00 H new ATOM 0 HG23 ILE B 41 -1.022 -3.586 -6.224 1.00 0.00 H new ATOM 0 HD11 ILE B 41 -3.384 -2.243 -3.887 1.00 0.00 H new ATOM 0 HD12 ILE B 41 -1.897 -2.287 -4.864 1.00 0.00 H new ATOM 0 HD13 ILE B 41 -3.385 -3.051 -5.473 1.00 0.00 H new ATOM 1839 N ASP B 42 -2.057 -8.146 -4.736 1.00 0.00 N ATOM 1840 CA ASP B 42 -2.330 -9.586 -4.437 1.00 0.00 C ATOM 1841 C ASP B 42 -3.668 -9.936 -3.856 1.00 0.00 C ATOM 1842 O ASP B 42 -3.927 -9.708 -2.669 1.00 0.00 O ATOM 1843 CB ASP B 42 -1.245 -10.238 -3.627 1.00 0.00 C ATOM 1844 CG ASP B 42 -1.604 -11.669 -3.217 1.00 0.00 C ATOM 1845 OD1 ASP B 42 -1.626 -12.567 -4.089 1.00 0.00 O ATOM 1846 OD2 ASP B 42 -1.909 -11.901 -2.028 1.00 0.00 O ATOM 0 H ASP B 42 -1.096 -7.871 -4.531 1.00 0.00 H new ATOM 0 HA ASP B 42 -2.347 -9.997 -5.447 1.00 0.00 H new ATOM 0 HB2 ASP B 42 -0.321 -10.249 -4.205 1.00 0.00 H new ATOM 0 HB3 ASP B 42 -1.055 -9.643 -2.733 1.00 0.00 H new ATOM 1851 N ASP B 43 -4.493 -10.415 -4.776 1.00 0.00 N ATOM 1852 CA ASP B 43 -5.840 -11.070 -4.675 1.00 0.00 C ATOM 1853 C ASP B 43 -6.886 -10.300 -3.913 1.00 0.00 C ATOM 1854 O ASP B 43 -8.062 -10.280 -4.264 1.00 0.00 O ATOM 1855 CB ASP B 43 -5.719 -12.477 -4.085 1.00 0.00 C ATOM 1856 CG ASP B 43 -7.018 -13.262 -4.167 1.00 0.00 C ATOM 1857 OD1 ASP B 43 -7.266 -13.891 -5.207 1.00 0.00 O ATOM 1858 OD2 ASP B 43 -7.810 -13.268 -3.192 1.00 0.00 O ATOM 0 H ASP B 43 -4.217 -10.357 -5.756 1.00 0.00 H new ATOM 0 HA ASP B 43 -6.192 -11.105 -5.706 1.00 0.00 H new ATOM 0 HB2 ASP B 43 -4.936 -13.022 -4.613 1.00 0.00 H new ATOM 0 HB3 ASP B 43 -5.409 -12.404 -3.043 1.00 0.00 H new ATOM 1863 N THR B 44 -6.463 -9.697 -2.912 1.00 0.00 N ATOM 1864 CA THR B 44 -7.304 -9.071 -1.951 1.00 0.00 C ATOM 1865 C THR B 44 -6.722 -7.698 -1.580 1.00 0.00 C ATOM 1866 O THR B 44 -7.063 -7.101 -0.575 1.00 0.00 O ATOM 1867 CB THR B 44 -7.390 -10.009 -0.707 1.00 0.00 C ATOM 1868 OG1 THR B 44 -7.743 -11.336 -1.142 1.00 0.00 O ATOM 1869 CG2 THR B 44 -8.432 -9.544 0.297 1.00 0.00 C ATOM 0 H THR B 44 -5.469 -9.604 -2.701 1.00 0.00 H new ATOM 0 HA THR B 44 -8.306 -8.909 -2.348 1.00 0.00 H new ATOM 0 HB THR B 44 -6.416 -9.993 -0.219 1.00 0.00 H new ATOM 0 HG1 THR B 44 -7.642 -11.963 -0.395 1.00 0.00 H new ATOM 0 HG21 THR B 44 -8.453 -10.230 1.144 1.00 0.00 H new ATOM 0 HG22 THR B 44 -8.179 -8.543 0.647 1.00 0.00 H new ATOM 0 HG23 THR B 44 -9.413 -9.525 -0.179 1.00 0.00 H new ATOM 1877 N HIS B 45 -5.840 -7.182 -2.394 1.00 0.00 N ATOM 1878 CA HIS B 45 -5.332 -5.887 -2.106 1.00 0.00 C ATOM 1879 C HIS B 45 -5.634 -4.959 -3.270 1.00 0.00 C ATOM 1880 O HIS B 45 -5.474 -5.329 -4.414 1.00 0.00 O ATOM 1881 CB HIS B 45 -3.828 -5.916 -1.782 1.00 0.00 C ATOM 1882 CG HIS B 45 -3.424 -6.594 -0.522 1.00 0.00 C ATOM 1883 ND1 HIS B 45 -3.210 -5.915 0.646 1.00 0.00 N ATOM 1884 CD2 HIS B 45 -3.121 -7.880 -0.266 1.00 0.00 C ATOM 1885 CE1 HIS B 45 -2.792 -6.754 1.561 1.00 0.00 C ATOM 1886 NE2 HIS B 45 -2.728 -7.950 1.035 1.00 0.00 N ATOM 0 H HIS B 45 -5.473 -7.629 -3.234 1.00 0.00 H new ATOM 0 HA HIS B 45 -5.828 -5.510 -1.212 1.00 0.00 H new ATOM 0 HB2 HIS B 45 -3.312 -6.403 -2.610 1.00 0.00 H new ATOM 0 HB3 HIS B 45 -3.469 -4.887 -1.744 1.00 0.00 H new ATOM 0 HD2 HIS B 45 -3.179 -8.703 -0.963 1.00 0.00 H new ATOM 0 HE1 HIS B 45 -2.542 -6.500 2.581 1.00 0.00 H new ATOM 0 HE2 HIS B 45 -2.432 -8.797 1.521 1.00 0.00 H new ATOM 1895 N VAL B 46 -6.108 -3.800 -2.989 1.00 0.00 N ATOM 1896 CA VAL B 46 -6.390 -2.821 -4.023 1.00 0.00 C ATOM 1897 C VAL B 46 -5.816 -1.488 -3.641 1.00 0.00 C ATOM 1898 O VAL B 46 -5.727 -1.169 -2.452 1.00 0.00 O ATOM 1899 CB VAL B 46 -7.924 -2.729 -4.355 1.00 0.00 C ATOM 1900 CG1 VAL B 46 -8.324 -1.359 -4.912 1.00 0.00 C ATOM 1901 CG2 VAL B 46 -8.285 -3.804 -5.370 1.00 0.00 C ATOM 0 H VAL B 46 -6.318 -3.485 -2.042 1.00 0.00 H new ATOM 0 HA VAL B 46 -5.905 -3.152 -4.941 1.00 0.00 H new ATOM 0 HB VAL B 46 -8.468 -2.876 -3.422 1.00 0.00 H new ATOM 0 HG11 VAL B 46 -9.393 -1.350 -5.124 1.00 0.00 H new ATOM 0 HG12 VAL B 46 -8.093 -0.587 -4.178 1.00 0.00 H new ATOM 0 HG13 VAL B 46 -7.770 -1.164 -5.830 1.00 0.00 H new ATOM 0 HG21 VAL B 46 -9.348 -3.743 -5.602 1.00 0.00 H new ATOM 0 HG22 VAL B 46 -7.705 -3.654 -6.281 1.00 0.00 H new ATOM 0 HG23 VAL B 46 -8.060 -4.786 -4.955 1.00 0.00 H new ATOM 1911 N PHE B 47 -5.344 -0.758 -4.626 1.00 0.00 N ATOM 1912 CA PHE B 47 -4.836 0.533 -4.390 1.00 0.00 C ATOM 1913 C PHE B 47 -5.778 1.535 -5.005 1.00 0.00 C ATOM 1914 O PHE B 47 -6.059 1.494 -6.223 1.00 0.00 O ATOM 1915 CB PHE B 47 -3.452 0.684 -4.985 1.00 0.00 C ATOM 1916 CG PHE B 47 -2.666 1.737 -4.312 1.00 0.00 C ATOM 1917 CD1 PHE B 47 -2.128 1.493 -3.061 1.00 0.00 C ATOM 1918 CD2 PHE B 47 -2.478 2.965 -4.889 1.00 0.00 C ATOM 1919 CE1 PHE B 47 -1.408 2.453 -2.407 1.00 0.00 C ATOM 1920 CE2 PHE B 47 -1.767 3.926 -4.241 1.00 0.00 C ATOM 1921 CZ PHE B 47 -1.226 3.670 -2.996 1.00 0.00 C ATOM 0 H PHE B 47 -5.311 -1.059 -5.600 1.00 0.00 H new ATOM 0 HA PHE B 47 -4.756 0.702 -3.316 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -2.922 -0.265 -4.912 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -3.538 0.920 -6.046 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -2.279 0.531 -2.595 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -2.896 3.171 -5.863 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -0.987 2.250 -1.433 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -1.625 4.893 -4.701 1.00 0.00 H new ATOM 0 HZ PHE B 47 -0.658 4.435 -2.488 1.00 0.00 H new ATOM 1931 N VAL B 48 -6.266 2.394 -4.185 1.00 0.00 N ATOM 1932 CA VAL B 48 -7.168 3.434 -4.571 1.00 0.00 C ATOM 1933 C VAL B 48 -6.569 4.736 -4.118 1.00 0.00 C ATOM 1934 O VAL B 48 -5.920 4.771 -3.103 1.00 0.00 O ATOM 1935 CB VAL B 48 -8.587 3.201 -3.949 1.00 0.00 C ATOM 1936 CG1 VAL B 48 -8.520 2.962 -2.446 1.00 0.00 C ATOM 1937 CG2 VAL B 48 -9.523 4.355 -4.243 1.00 0.00 C ATOM 0 H VAL B 48 -6.044 2.398 -3.189 1.00 0.00 H new ATOM 0 HA VAL B 48 -7.306 3.445 -5.652 1.00 0.00 H new ATOM 0 HB VAL B 48 -8.983 2.302 -4.421 1.00 0.00 H new ATOM 0 HG11 VAL B 48 -9.526 2.805 -2.057 1.00 0.00 H new ATOM 0 HG12 VAL B 48 -7.912 2.080 -2.245 1.00 0.00 H new ATOM 0 HG13 VAL B 48 -8.074 3.829 -1.959 1.00 0.00 H new ATOM 0 HG21 VAL B 48 -10.497 4.157 -3.795 1.00 0.00 H new ATOM 0 HG22 VAL B 48 -9.111 5.273 -3.824 1.00 0.00 H new ATOM 0 HG23 VAL B 48 -9.635 4.467 -5.321 1.00 0.00 H new ATOM 1947 N ILE B 49 -6.729 5.785 -4.864 1.00 0.00 N ATOM 1948 CA ILE B 49 -6.112 7.025 -4.456 1.00 0.00 C ATOM 1949 C ILE B 49 -6.922 7.662 -3.322 1.00 0.00 C ATOM 1950 O ILE B 49 -8.162 7.552 -3.276 1.00 0.00 O ATOM 1951 CB ILE B 49 -5.857 8.012 -5.620 1.00 0.00 C ATOM 1952 CG1 ILE B 49 -4.860 9.110 -5.193 1.00 0.00 C ATOM 1953 CG2 ILE B 49 -7.151 8.607 -6.158 1.00 0.00 C ATOM 1954 CD1 ILE B 49 -4.662 10.206 -6.224 1.00 0.00 C ATOM 0 H ILE B 49 -7.262 5.818 -5.733 1.00 0.00 H new ATOM 0 HA ILE B 49 -5.117 6.780 -4.085 1.00 0.00 H new ATOM 0 HB ILE B 49 -5.410 7.449 -6.439 1.00 0.00 H new ATOM 0 HG12 ILE B 49 -5.209 9.560 -4.263 1.00 0.00 H new ATOM 0 HG13 ILE B 49 -3.896 8.647 -4.981 1.00 0.00 H new ATOM 0 HG21 ILE B 49 -6.924 9.294 -6.973 1.00 0.00 H new ATOM 0 HG22 ILE B 49 -7.794 7.807 -6.525 1.00 0.00 H new ATOM 0 HG23 ILE B 49 -7.662 9.147 -5.361 1.00 0.00 H new ATOM 0 HD11 ILE B 49 -3.947 10.937 -5.846 1.00 0.00 H new ATOM 0 HD12 ILE B 49 -4.282 9.771 -7.149 1.00 0.00 H new ATOM 0 HD13 ILE B 49 -5.615 10.698 -6.419 1.00 0.00 H new ATOM 1966 N ALA B 50 -6.221 8.324 -2.436 1.00 0.00 N ATOM 1967 CA ALA B 50 -6.769 8.818 -1.192 1.00 0.00 C ATOM 1968 C ALA B 50 -7.930 9.797 -1.342 1.00 0.00 C ATOM 1969 O ALA B 50 -8.837 9.800 -0.526 1.00 0.00 O ATOM 1970 CB ALA B 50 -5.673 9.406 -0.328 1.00 0.00 C ATOM 0 H ALA B 50 -5.232 8.541 -2.560 1.00 0.00 H new ATOM 0 HA ALA B 50 -7.202 7.947 -0.701 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -6.102 9.773 0.604 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -4.931 8.638 -0.108 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -5.196 10.231 -0.857 1.00 0.00 H new ATOM 1976 N GLU B 51 -7.924 10.601 -2.375 1.00 0.00 N ATOM 1977 CA GLU B 51 -8.950 11.631 -2.515 1.00 0.00 C ATOM 1978 C GLU B 51 -10.331 11.074 -2.885 1.00 0.00 C ATOM 1979 O GLU B 51 -11.354 11.602 -2.449 1.00 0.00 O ATOM 1980 CB GLU B 51 -8.520 12.707 -3.492 1.00 0.00 C ATOM 1981 CG GLU B 51 -7.222 13.381 -3.103 1.00 0.00 C ATOM 1982 CD GLU B 51 -6.871 14.523 -4.003 1.00 0.00 C ATOM 1983 OE1 GLU B 51 -6.509 14.289 -5.172 1.00 0.00 O ATOM 1984 OE2 GLU B 51 -6.928 15.677 -3.559 1.00 0.00 O ATOM 0 H GLU B 51 -7.236 10.573 -3.127 1.00 0.00 H new ATOM 0 HA GLU B 51 -9.058 12.079 -1.527 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -8.410 12.266 -4.483 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -9.306 13.459 -3.563 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -7.298 13.742 -2.078 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -6.416 12.647 -3.123 1.00 0.00 H new ATOM 1991 N LEU B 52 -10.374 9.999 -3.645 1.00 0.00 N ATOM 1992 CA LEU B 52 -11.661 9.481 -4.079 1.00 0.00 C ATOM 1993 C LEU B 52 -12.100 8.217 -3.345 1.00 0.00 C ATOM 1994 O LEU B 52 -13.120 7.640 -3.661 1.00 0.00 O ATOM 1995 CB LEU B 52 -11.790 9.383 -5.625 1.00 0.00 C ATOM 1996 CG LEU B 52 -10.665 8.689 -6.415 1.00 0.00 C ATOM 1997 CD1 LEU B 52 -10.514 7.237 -6.030 1.00 0.00 C ATOM 1998 CD2 LEU B 52 -10.919 8.809 -7.910 1.00 0.00 C ATOM 0 H LEU B 52 -9.560 9.477 -3.969 1.00 0.00 H new ATOM 0 HA LEU B 52 -12.387 10.235 -3.776 1.00 0.00 H new ATOM 0 HB2 LEU B 52 -12.721 8.862 -5.847 1.00 0.00 H new ATOM 0 HB3 LEU B 52 -11.891 10.396 -6.014 1.00 0.00 H new ATOM 0 HG LEU B 52 -9.732 9.194 -6.164 1.00 0.00 H new ATOM 0 HD11 LEU B 52 -9.709 6.788 -6.612 1.00 0.00 H new ATOM 0 HD12 LEU B 52 -10.278 7.165 -4.968 1.00 0.00 H new ATOM 0 HD13 LEU B 52 -11.446 6.708 -6.231 1.00 0.00 H new ATOM 0 HD21 LEU B 52 -10.116 8.314 -8.456 1.00 0.00 H new ATOM 0 HD22 LEU B 52 -11.870 8.337 -8.156 1.00 0.00 H new ATOM 0 HD23 LEU B 52 -10.953 9.862 -8.190 1.00 0.00 H new ATOM 2010 N VAL B 53 -11.352 7.815 -2.335 1.00 0.00 N ATOM 2011 CA VAL B 53 -11.761 6.671 -1.501 1.00 0.00 C ATOM 2012 C VAL B 53 -13.029 7.037 -0.735 1.00 0.00 C ATOM 2013 O VAL B 53 -13.837 6.186 -0.394 1.00 0.00 O ATOM 2014 CB VAL B 53 -10.640 6.119 -0.559 1.00 0.00 C ATOM 2015 CG1 VAL B 53 -10.239 7.127 0.491 1.00 0.00 C ATOM 2016 CG2 VAL B 53 -11.047 4.797 0.091 1.00 0.00 C ATOM 0 H VAL B 53 -10.469 8.248 -2.065 1.00 0.00 H new ATOM 0 HA VAL B 53 -11.965 5.839 -2.175 1.00 0.00 H new ATOM 0 HB VAL B 53 -9.770 5.930 -1.188 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -9.459 6.703 1.123 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -9.863 8.028 0.006 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -11.105 7.379 1.103 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -10.242 4.446 0.737 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -11.950 4.946 0.683 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -11.240 4.055 -0.684 1.00 0.00 H new ATOM 2026 N ASN B 54 -13.172 8.324 -0.483 1.00 0.00 N ATOM 2027 CA ASN B 54 -14.324 8.907 0.195 1.00 0.00 C ATOM 2028 C ASN B 54 -15.641 8.462 -0.465 1.00 0.00 C ATOM 2029 O ASN B 54 -16.611 8.139 0.225 1.00 0.00 O ATOM 2030 CB ASN B 54 -14.237 10.443 0.158 1.00 0.00 C ATOM 2031 CG ASN B 54 -13.053 11.032 0.931 1.00 0.00 C ATOM 2032 OD1 ASN B 54 -11.992 10.412 1.068 1.00 0.00 O ATOM 2033 ND2 ASN B 54 -13.215 12.228 1.422 1.00 0.00 N ATOM 0 H ASN B 54 -12.472 9.016 -0.750 1.00 0.00 H new ATOM 0 HA ASN B 54 -14.313 8.559 1.228 1.00 0.00 H new ATOM 0 HB2 ASN B 54 -14.172 10.765 -0.881 1.00 0.00 H new ATOM 0 HB3 ASN B 54 -15.161 10.856 0.563 1.00 0.00 H new ATOM 0 HD21 ASN B 54 -12.455 12.676 1.935 1.00 0.00 H new ATOM 0 HD22 ASN B 54 -14.101 12.716 1.294 1.00 0.00 H new ATOM 2040 N VAL B 55 -15.658 8.365 -1.796 1.00 0.00 N ATOM 2041 CA VAL B 55 -16.874 7.934 -2.473 1.00 0.00 C ATOM 2042 C VAL B 55 -17.133 6.455 -2.232 1.00 0.00 C ATOM 2043 O VAL B 55 -18.269 6.015 -2.080 1.00 0.00 O ATOM 2044 CB VAL B 55 -16.934 8.287 -3.984 1.00 0.00 C ATOM 2045 CG1 VAL B 55 -16.809 9.779 -4.192 1.00 0.00 C ATOM 2046 CG2 VAL B 55 -15.896 7.543 -4.806 1.00 0.00 C ATOM 0 H VAL B 55 -14.868 8.573 -2.407 1.00 0.00 H new ATOM 0 HA VAL B 55 -17.680 8.513 -2.022 1.00 0.00 H new ATOM 0 HB VAL B 55 -17.910 7.960 -4.341 1.00 0.00 H new ATOM 0 HG11 VAL B 55 -16.854 10.003 -5.258 1.00 0.00 H new ATOM 0 HG12 VAL B 55 -17.626 10.287 -3.680 1.00 0.00 H new ATOM 0 HG13 VAL B 55 -15.857 10.124 -3.788 1.00 0.00 H new ATOM 0 HG21 VAL B 55 -15.987 7.831 -5.853 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -14.898 7.794 -4.446 1.00 0.00 H new ATOM 0 HG23 VAL B 55 -16.057 6.469 -4.709 1.00 0.00 H new ATOM 2056 N LEU B 56 -16.061 5.705 -2.146 1.00 0.00 N ATOM 2057 CA LEU B 56 -16.124 4.294 -1.834 1.00 0.00 C ATOM 2058 C LEU B 56 -16.640 4.104 -0.437 1.00 0.00 C ATOM 2059 O LEU B 56 -17.356 3.174 -0.181 1.00 0.00 O ATOM 2060 CB LEU B 56 -14.767 3.640 -1.955 1.00 0.00 C ATOM 2061 CG LEU B 56 -14.141 3.649 -3.328 1.00 0.00 C ATOM 2062 CD1 LEU B 56 -12.777 3.051 -3.243 1.00 0.00 C ATOM 2063 CD2 LEU B 56 -14.988 2.865 -4.300 1.00 0.00 C ATOM 0 H LEU B 56 -15.114 6.056 -2.291 1.00 0.00 H new ATOM 0 HA LEU B 56 -16.798 3.824 -2.550 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -14.085 4.137 -1.265 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -14.856 2.605 -1.626 1.00 0.00 H new ATOM 0 HG LEU B 56 -14.072 4.676 -3.686 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -12.317 3.053 -4.231 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -12.165 3.636 -2.556 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -12.851 2.026 -2.880 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -14.522 2.882 -5.285 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -15.075 1.834 -3.957 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -15.980 3.312 -4.361 1.00 0.00 H new ATOM 2075 N GLN B 57 -16.265 5.014 0.462 1.00 0.00 N ATOM 2076 CA GLN B 57 -16.716 4.977 1.859 1.00 0.00 C ATOM 2077 C GLN B 57 -18.190 4.992 1.905 1.00 0.00 C ATOM 2078 O GLN B 57 -18.808 4.240 2.663 1.00 0.00 O ATOM 2079 CB GLN B 57 -16.187 6.179 2.649 1.00 0.00 C ATOM 2080 CG GLN B 57 -14.698 6.291 2.630 1.00 0.00 C ATOM 2081 CD GLN B 57 -14.028 5.113 3.253 1.00 0.00 C ATOM 2082 OE1 GLN B 57 -13.692 5.128 4.436 1.00 0.00 O ATOM 2083 NE2 GLN B 57 -13.980 4.052 2.522 1.00 0.00 N ATOM 0 H GLN B 57 -15.644 5.794 0.247 1.00 0.00 H new ATOM 0 HA GLN B 57 -16.329 4.063 2.310 1.00 0.00 H new ATOM 0 HB2 GLN B 57 -16.618 7.092 2.239 1.00 0.00 H new ATOM 0 HB3 GLN B 57 -16.525 6.103 3.682 1.00 0.00 H new ATOM 0 HG2 GLN B 57 -14.358 6.395 1.600 1.00 0.00 H new ATOM 0 HG3 GLN B 57 -14.398 7.196 3.158 1.00 0.00 H new ATOM 0 HE21 GLN B 57 -14.270 4.092 1.545 1.00 0.00 H new ATOM 0 HE22 GLN B 57 -13.652 3.172 2.921 1.00 0.00 H new ATOM 2092 N GLU B 58 -18.765 5.814 1.058 1.00 0.00 N ATOM 2093 CA GLU B 58 -20.183 5.932 1.042 1.00 0.00 C ATOM 2094 C GLU B 58 -20.816 4.646 0.522 1.00 0.00 C ATOM 2095 O GLU B 58 -21.762 4.122 1.101 1.00 0.00 O ATOM 2096 CB GLU B 58 -20.677 7.096 0.198 1.00 0.00 C ATOM 2097 CG GLU B 58 -19.917 8.389 0.397 1.00 0.00 C ATOM 2098 CD GLU B 58 -20.504 9.540 -0.386 1.00 0.00 C ATOM 2099 OE1 GLU B 58 -20.172 9.713 -1.582 1.00 0.00 O ATOM 2100 OE2 GLU B 58 -21.299 10.310 0.188 1.00 0.00 O ATOM 0 H GLU B 58 -18.271 6.399 0.384 1.00 0.00 H new ATOM 0 HA GLU B 58 -20.482 6.119 2.073 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -20.619 6.815 -0.854 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -21.729 7.270 0.424 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -19.911 8.642 1.457 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -18.879 8.244 0.098 1.00 0.00 H new ATOM 2107 N ARG B 59 -20.265 4.135 -0.558 1.00 0.00 N ATOM 2108 CA ARG B 59 -20.806 2.956 -1.210 1.00 0.00 C ATOM 2109 C ARG B 59 -20.679 1.707 -0.313 1.00 0.00 C ATOM 2110 O ARG B 59 -21.649 0.981 -0.097 1.00 0.00 O ATOM 2111 CB ARG B 59 -20.097 2.744 -2.560 1.00 0.00 C ATOM 2112 CG ARG B 59 -20.229 3.926 -3.513 1.00 0.00 C ATOM 2113 CD ARG B 59 -21.659 4.124 -4.022 1.00 0.00 C ATOM 2114 NE ARG B 59 -21.814 5.380 -4.760 1.00 0.00 N ATOM 2115 CZ ARG B 59 -22.605 5.584 -5.830 1.00 0.00 C ATOM 2116 NH1 ARG B 59 -23.320 4.593 -6.356 1.00 0.00 N ATOM 2117 NH2 ARG B 59 -22.669 6.784 -6.375 1.00 0.00 N ATOM 0 H ARG B 59 -19.435 4.520 -1.008 1.00 0.00 H new ATOM 0 HA ARG B 59 -21.870 3.113 -1.388 1.00 0.00 H new ATOM 0 HB2 ARG B 59 -19.040 2.551 -2.379 1.00 0.00 H new ATOM 0 HB3 ARG B 59 -20.506 1.855 -3.039 1.00 0.00 H new ATOM 0 HG2 ARG B 59 -19.900 4.833 -3.006 1.00 0.00 H new ATOM 0 HG3 ARG B 59 -19.563 3.777 -4.363 1.00 0.00 H new ATOM 0 HD2 ARG B 59 -21.932 3.289 -4.667 1.00 0.00 H new ATOM 0 HD3 ARG B 59 -22.348 4.113 -3.178 1.00 0.00 H new ATOM 0 HE ARG B 59 -21.270 6.177 -4.431 1.00 0.00 H new ATOM 0 HH11 ARG B 59 -23.275 3.659 -5.948 1.00 0.00 H new ATOM 0 HH12 ARG B 59 -23.914 4.767 -7.167 1.00 0.00 H new ATOM 0 HH21 ARG B 59 -22.121 7.551 -5.985 1.00 0.00 H new ATOM 0 HH22 ARG B 59 -23.267 6.945 -7.186 1.00 0.00 H new ATOM 2131 N VAL B 60 -19.525 1.542 0.286 1.00 0.00 N ATOM 2132 CA VAL B 60 -19.235 0.394 1.143 1.00 0.00 C ATOM 2133 C VAL B 60 -20.018 0.491 2.454 1.00 0.00 C ATOM 2134 O VAL B 60 -20.407 -0.518 3.036 1.00 0.00 O ATOM 2135 CB VAL B 60 -17.693 0.285 1.436 1.00 0.00 C ATOM 2136 CG1 VAL B 60 -17.368 -0.869 2.376 1.00 0.00 C ATOM 2137 CG2 VAL B 60 -16.917 0.117 0.140 1.00 0.00 C ATOM 0 H VAL B 60 -18.749 2.198 0.199 1.00 0.00 H new ATOM 0 HA VAL B 60 -19.547 -0.507 0.615 1.00 0.00 H new ATOM 0 HB VAL B 60 -17.396 1.212 1.926 1.00 0.00 H new ATOM 0 HG11 VAL B 60 -16.292 -0.905 2.549 1.00 0.00 H new ATOM 0 HG12 VAL B 60 -17.884 -0.722 3.325 1.00 0.00 H new ATOM 0 HG13 VAL B 60 -17.695 -1.807 1.927 1.00 0.00 H new ATOM 0 HG21 VAL B 60 -15.852 0.043 0.361 1.00 0.00 H new ATOM 0 HG22 VAL B 60 -17.246 -0.790 -0.366 1.00 0.00 H new ATOM 0 HG23 VAL B 60 -17.095 0.977 -0.505 1.00 0.00 H new ATOM 2147 N GLY B 61 -20.257 1.702 2.896 1.00 0.00 N ATOM 2148 CA GLY B 61 -20.963 1.898 4.124 1.00 0.00 C ATOM 2149 C GLY B 61 -22.475 1.844 3.979 1.00 0.00 C ATOM 2150 O GLY B 61 -23.140 1.032 4.627 1.00 0.00 O ATOM 0 H GLY B 61 -19.972 2.559 2.421 1.00 0.00 H new ATOM 0 HA2 GLY B 61 -20.649 1.137 4.838 1.00 0.00 H new ATOM 0 HA3 GLY B 61 -20.682 2.864 4.543 1.00 0.00 H new