USER MOD reduce.3.24.130724 H: found=0, std=0, add=879, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 883 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 143 CYS SG : rot -13:sc= -1.54! USER MOD Set 1.2: B 473 CYS SG : rot 69:sc= -0.509 USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 84 MET CE :methyl 167:sc= -0.0309 (180deg=-0.308) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 ASN : amide:sc= 0.486 K(o=0.49,f=-4.5!) USER MOD Single : A 93 LYS NZ :NH3+ -149:sc= -1.6 (180deg=-3.14!) USER MOD Single : A 94 ASN : amide:sc= -0.129 X(o=-0.13,f=-0.16) USER MOD Single : A 98 SER OG : rot -160:sc= 0.0528 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 107 ASN : amide:sc=-0.00262 K(o=-0.0026,f=-0.86) USER MOD Single : A 109 HIS : no HE2:sc= -3.75! C(o=-3.8!,f=-7.2!) USER MOD Single : A 112 GLN : amide:sc= -1.08 K(o=-1.1,f=-0.3) USER MOD Single : A 114 MET CE :methyl -174:sc= -0.268 (180deg=-0.359) USER MOD Single : A 116 ASN : amide:sc= -0.052 K(o=-0.052,f=-1.3!) USER MOD Single : A 119 GLN : amide:sc= 0.371 K(o=0.37,f=-0.62) USER MOD Single : A 123 LYS NZ :NH3+ 174:sc=-0.00122 (180deg=-0.063) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 MET CE :methyl 164:sc= -0.131 (180deg=-0.784) USER MOD Single : A 130 TYR OH : rot 150:sc= -0.346 USER MOD Single : A 131 MET CE :methyl 147:sc= -0.782 (180deg=-2.67!) USER MOD Single : A 132 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 142 CYS SG : rot 83:sc= -0.0035 USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 151 GLN : amide:sc= 0 X(o=0,f=-0.06) USER MOD Single : A 152 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD Single : B 465 HIS : no HE2:sc= 0.562 K(o=0.56,f=-6.1!) USER MOD Single : B 468 ASN : amide:sc= -5! C(o=-5!,f=-3.2!) USER MOD Single : B 472 GLN : amide:sc= -2.82! C(o=-2.8!,f=-6!) USER MOD Single : B 476 TYR OH : rot 180:sc= -0.101 USER MOD Single : B 479 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0246) USER MOD Single : B 480 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 487 THR OG1 : rot 180:sc= 0.0394 USER MOD Single : B 488 ASN : amide:sc= -2.59! C(o=-2.6!,f=-2.9!) USER MOD Single : B 489 SER OG : rot 180:sc= 0 USER MOD Single : B 491 LYS NZ :NH3+ -170:sc= -0.0103 (180deg=-0.124) USER MOD Single : B 492 SER OG : rot 180:sc= 0 USER MOD Single : B 493 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 81 11.866 -11.305 3.286 1.00 0.00 N ATOM 2 CA GLY A 81 10.901 -12.379 3.624 1.00 0.00 C ATOM 3 C GLY A 81 10.030 -12.752 2.442 1.00 0.00 C ATOM 4 O GLY A 81 10.072 -12.082 1.407 1.00 0.00 O ATOM 0 HA2 GLY A 81 11.444 -13.260 3.966 1.00 0.00 H new ATOM 0 HA3 GLY A 81 10.270 -12.052 4.451 1.00 0.00 H new ATOM 10 N PRO A 82 9.231 -13.824 2.561 1.00 0.00 N ATOM 11 CA PRO A 82 8.321 -14.268 1.501 1.00 0.00 C ATOM 12 C PRO A 82 7.147 -13.311 1.320 1.00 0.00 C ATOM 13 O PRO A 82 6.890 -12.456 2.170 1.00 0.00 O ATOM 14 CB PRO A 82 7.817 -15.635 1.987 1.00 0.00 C ATOM 15 CG PRO A 82 8.684 -15.996 3.148 1.00 0.00 C ATOM 16 CD PRO A 82 9.152 -14.698 3.736 1.00 0.00 C ATOM 0 HA PRO A 82 8.822 -14.310 0.534 1.00 0.00 H new ATOM 0 HB2 PRO A 82 6.769 -15.584 2.282 1.00 0.00 H new ATOM 0 HB3 PRO A 82 7.889 -16.382 1.197 1.00 0.00 H new ATOM 0 HG2 PRO A 82 8.129 -16.579 3.883 1.00 0.00 H new ATOM 0 HG3 PRO A 82 9.529 -16.607 2.829 1.00 0.00 H new ATOM 0 HD2 PRO A 82 8.453 -14.315 4.480 1.00 0.00 H new ATOM 0 HD3 PRO A 82 10.118 -14.802 4.230 1.00 0.00 H new ATOM 24 N HIS A 83 6.434 -13.457 0.216 1.00 0.00 N ATOM 25 CA HIS A 83 5.316 -12.575 -0.085 1.00 0.00 C ATOM 26 C HIS A 83 3.985 -13.305 0.058 1.00 0.00 C ATOM 27 O HIS A 83 3.303 -13.577 -0.932 1.00 0.00 O ATOM 28 CB HIS A 83 5.446 -11.998 -1.498 1.00 0.00 C ATOM 29 CG HIS A 83 6.592 -11.050 -1.668 1.00 0.00 C ATOM 30 ND1 HIS A 83 6.428 -9.695 -1.519 1.00 0.00 N ATOM 31 CD2 HIS A 83 7.883 -11.305 -1.990 1.00 0.00 C ATOM 32 CE1 HIS A 83 7.612 -9.158 -1.754 1.00 0.00 C ATOM 33 NE2 HIS A 83 8.525 -10.094 -2.043 1.00 0.00 N ATOM 0 H HIS A 83 6.608 -14.176 -0.486 1.00 0.00 H new ATOM 0 HA HIS A 83 5.339 -11.756 0.634 1.00 0.00 H new ATOM 0 HB2 HIS A 83 5.560 -12.820 -2.205 1.00 0.00 H new ATOM 0 HB3 HIS A 83 4.521 -11.482 -1.755 1.00 0.00 H new ATOM 0 HD2 HIS A 83 8.322 -12.275 -2.170 1.00 0.00 H new ATOM 0 HE1 HIS A 83 7.818 -8.098 -1.718 1.00 0.00 H new ATOM 0 HE2 HIS A 83 9.509 -9.937 -2.261 1.00 0.00 H new ATOM 41 N MET A 84 3.625 -13.626 1.293 1.00 0.00 N ATOM 42 CA MET A 84 2.336 -14.248 1.580 1.00 0.00 C ATOM 43 C MET A 84 1.250 -13.178 1.627 1.00 0.00 C ATOM 44 O MET A 84 1.536 -12.025 1.958 1.00 0.00 O ATOM 45 CB MET A 84 2.400 -15.015 2.906 1.00 0.00 C ATOM 46 CG MET A 84 1.086 -15.666 3.318 1.00 0.00 C ATOM 47 SD MET A 84 0.445 -16.819 2.085 1.00 0.00 S ATOM 48 CE MET A 84 1.732 -18.064 2.074 1.00 0.00 C ATOM 0 H MET A 84 4.207 -13.466 2.115 1.00 0.00 H new ATOM 0 HA MET A 84 2.095 -14.958 0.789 1.00 0.00 H new ATOM 0 HB2 MET A 84 3.166 -15.787 2.829 1.00 0.00 H new ATOM 0 HB3 MET A 84 2.715 -14.330 3.693 1.00 0.00 H new ATOM 0 HG2 MET A 84 1.230 -16.195 4.260 1.00 0.00 H new ATOM 0 HG3 MET A 84 0.344 -14.888 3.499 1.00 0.00 H new ATOM 0 HE1 MET A 84 1.379 -18.948 1.542 1.00 0.00 H new ATOM 0 HE2 MET A 84 2.616 -17.669 1.574 1.00 0.00 H new ATOM 0 HE3 MET A 84 1.985 -18.334 3.099 1.00 0.00 H new ATOM 58 N ASP A 85 0.015 -13.563 1.301 1.00 0.00 N ATOM 59 CA ASP A 85 -1.101 -12.632 1.210 1.00 0.00 C ATOM 60 C ASP A 85 -0.843 -11.603 0.119 1.00 0.00 C ATOM 61 O ASP A 85 -1.120 -10.411 0.284 1.00 0.00 O ATOM 62 CB ASP A 85 -1.346 -11.923 2.536 1.00 0.00 C ATOM 63 CG ASP A 85 -1.832 -12.839 3.638 1.00 0.00 C ATOM 64 OD1 ASP A 85 -1.014 -13.255 4.488 1.00 0.00 O ATOM 65 OD2 ASP A 85 -3.042 -13.127 3.678 1.00 0.00 O ATOM 0 H ASP A 85 -0.235 -14.530 1.093 1.00 0.00 H new ATOM 0 HA ASP A 85 -1.992 -13.209 0.962 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -0.422 -11.443 2.857 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -2.080 -11.132 2.384 1.00 0.00 H new ATOM 70 N ARG A 86 -0.298 -12.074 -0.991 1.00 0.00 N ATOM 71 CA ARG A 86 0.024 -11.213 -2.119 1.00 0.00 C ATOM 72 C ARG A 86 -1.239 -10.831 -2.884 1.00 0.00 C ATOM 73 O ARG A 86 -2.210 -11.588 -2.919 1.00 0.00 O ATOM 74 CB ARG A 86 1.006 -11.913 -3.062 1.00 0.00 C ATOM 75 CG ARG A 86 0.453 -13.194 -3.663 1.00 0.00 C ATOM 76 CD ARG A 86 1.434 -13.842 -4.620 1.00 0.00 C ATOM 77 NE ARG A 86 0.908 -15.089 -5.171 1.00 0.00 N ATOM 78 CZ ARG A 86 1.597 -15.906 -5.968 1.00 0.00 C ATOM 79 NH1 ARG A 86 2.842 -15.604 -6.320 1.00 0.00 N ATOM 80 NH2 ARG A 86 1.040 -17.023 -6.416 1.00 0.00 N ATOM 0 H ARG A 86 -0.067 -13.057 -1.136 1.00 0.00 H new ATOM 0 HA ARG A 86 0.487 -10.306 -1.730 1.00 0.00 H new ATOM 0 HB2 ARG A 86 1.276 -11.229 -3.867 1.00 0.00 H new ATOM 0 HB3 ARG A 86 1.922 -12.141 -2.517 1.00 0.00 H new ATOM 0 HG2 ARG A 86 0.210 -13.894 -2.864 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -0.476 -12.976 -4.189 1.00 0.00 H new ATOM 0 HD2 ARG A 86 1.660 -13.152 -5.433 1.00 0.00 H new ATOM 0 HD3 ARG A 86 2.372 -14.040 -4.101 1.00 0.00 H new ATOM 0 HE ARG A 86 -0.048 -15.351 -4.930 1.00 0.00 H new ATOM 0 HH11 ARG A 86 3.274 -14.745 -5.980 1.00 0.00 H new ATOM 0 HH12 ARG A 86 3.366 -16.232 -6.930 1.00 0.00 H new ATOM 0 HH21 ARG A 86 0.083 -17.258 -6.151 1.00 0.00 H new ATOM 0 HH22 ARG A 86 1.568 -17.647 -7.026 1.00 0.00 H new ATOM 94 N VAL A 87 -1.224 -9.655 -3.488 1.00 0.00 N ATOM 95 CA VAL A 87 -2.340 -9.199 -4.303 1.00 0.00 C ATOM 96 C VAL A 87 -1.939 -9.202 -5.771 1.00 0.00 C ATOM 97 O VAL A 87 -0.820 -8.820 -6.118 1.00 0.00 O ATOM 98 CB VAL A 87 -2.804 -7.786 -3.888 1.00 0.00 C ATOM 99 CG1 VAL A 87 -3.924 -7.292 -4.790 1.00 0.00 C ATOM 100 CG2 VAL A 87 -3.261 -7.788 -2.441 1.00 0.00 C ATOM 0 H VAL A 87 -0.448 -8.995 -3.430 1.00 0.00 H new ATOM 0 HA VAL A 87 -3.174 -9.884 -4.148 1.00 0.00 H new ATOM 0 HB VAL A 87 -1.958 -7.107 -3.993 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -4.232 -6.295 -4.475 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.571 -7.255 -5.821 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -4.773 -7.972 -4.721 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -3.586 -6.786 -2.161 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -4.091 -8.485 -2.322 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -2.435 -8.095 -1.799 1.00 0.00 H new ATOM 110 N SER A 88 -2.848 -9.659 -6.621 1.00 0.00 N ATOM 111 CA SER A 88 -2.593 -9.751 -8.050 1.00 0.00 C ATOM 112 C SER A 88 -2.363 -8.365 -8.653 1.00 0.00 C ATOM 113 O SER A 88 -3.033 -7.394 -8.298 1.00 0.00 O ATOM 114 CB SER A 88 -3.774 -10.445 -8.728 1.00 0.00 C ATOM 115 OG SER A 88 -4.029 -11.702 -8.123 1.00 0.00 O ATOM 0 H SER A 88 -3.777 -9.974 -6.341 1.00 0.00 H new ATOM 0 HA SER A 88 -1.688 -10.336 -8.214 1.00 0.00 H new ATOM 0 HB2 SER A 88 -4.661 -9.815 -8.659 1.00 0.00 H new ATOM 0 HB3 SER A 88 -3.562 -10.582 -9.788 1.00 0.00 H new ATOM 0 HG SER A 88 -4.789 -12.131 -8.568 1.00 0.00 H new ATOM 121 N LEU A 89 -1.401 -8.300 -9.570 1.00 0.00 N ATOM 122 CA LEU A 89 -0.999 -7.056 -10.212 1.00 0.00 C ATOM 123 C LEU A 89 -2.169 -6.409 -10.926 1.00 0.00 C ATOM 124 O LEU A 89 -2.329 -5.194 -10.895 1.00 0.00 O ATOM 125 CB LEU A 89 0.114 -7.325 -11.208 1.00 0.00 C ATOM 126 CG LEU A 89 0.799 -6.077 -11.764 1.00 0.00 C ATOM 127 CD1 LEU A 89 1.084 -5.068 -10.660 1.00 0.00 C ATOM 128 CD2 LEU A 89 2.085 -6.471 -12.444 1.00 0.00 C ATOM 0 H LEU A 89 -0.877 -9.115 -9.889 1.00 0.00 H new ATOM 0 HA LEU A 89 -0.645 -6.375 -9.438 1.00 0.00 H new ATOM 0 HB2 LEU A 89 0.867 -7.951 -10.729 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -0.294 -7.898 -12.040 1.00 0.00 H new ATOM 0 HG LEU A 89 0.130 -5.608 -12.485 1.00 0.00 H new ATOM 0 HD11 LEU A 89 1.571 -4.191 -11.086 1.00 0.00 H new ATOM 0 HD12 LEU A 89 0.147 -4.770 -10.189 1.00 0.00 H new ATOM 0 HD13 LEU A 89 1.738 -5.520 -9.914 1.00 0.00 H new ATOM 0 HD21 LEU A 89 2.574 -5.581 -12.841 1.00 0.00 H new ATOM 0 HD22 LEU A 89 2.744 -6.956 -11.724 1.00 0.00 H new ATOM 0 HD23 LEU A 89 1.869 -7.161 -13.260 1.00 0.00 H new ATOM 140 N GLN A 90 -2.976 -7.238 -11.569 1.00 0.00 N ATOM 141 CA GLN A 90 -4.166 -6.765 -12.268 1.00 0.00 C ATOM 142 C GLN A 90 -5.082 -6.002 -11.318 1.00 0.00 C ATOM 143 O GLN A 90 -5.674 -4.995 -11.697 1.00 0.00 O ATOM 144 CB GLN A 90 -4.920 -7.932 -12.915 1.00 0.00 C ATOM 145 CG GLN A 90 -5.432 -8.972 -11.929 1.00 0.00 C ATOM 146 CD GLN A 90 -6.024 -10.185 -12.616 1.00 0.00 C ATOM 147 OE1 GLN A 90 -7.215 -10.222 -12.928 1.00 0.00 O ATOM 148 NE2 GLN A 90 -5.200 -11.196 -12.841 1.00 0.00 N ATOM 0 H GLN A 90 -2.830 -8.246 -11.623 1.00 0.00 H new ATOM 0 HA GLN A 90 -3.844 -6.086 -13.058 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -5.765 -7.535 -13.478 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -4.261 -8.422 -13.632 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -4.613 -9.289 -11.283 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -6.187 -8.518 -11.287 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -4.220 -11.126 -12.567 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -5.545 -12.045 -13.288 1.00 0.00 H new ATOM 157 N ASN A 91 -5.166 -6.476 -10.077 1.00 0.00 N ATOM 158 CA ASN A 91 -5.964 -5.818 -9.046 1.00 0.00 C ATOM 159 C ASN A 91 -5.354 -4.477 -8.687 1.00 0.00 C ATOM 160 O ASN A 91 -6.062 -3.484 -8.529 1.00 0.00 O ATOM 161 CB ASN A 91 -6.056 -6.675 -7.778 1.00 0.00 C ATOM 162 CG ASN A 91 -6.910 -7.914 -7.945 1.00 0.00 C ATOM 163 OD1 ASN A 91 -6.992 -8.492 -9.027 1.00 0.00 O ATOM 164 ND2 ASN A 91 -7.550 -8.335 -6.865 1.00 0.00 N ATOM 0 H ASN A 91 -4.688 -7.319 -9.760 1.00 0.00 H new ATOM 0 HA ASN A 91 -6.967 -5.677 -9.450 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -5.052 -6.974 -7.478 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -6.464 -6.069 -6.969 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -8.137 -9.168 -6.912 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -7.456 -7.827 -5.986 1.00 0.00 H new ATOM 171 N LEU A 92 -4.032 -4.458 -8.581 1.00 0.00 N ATOM 172 CA LEU A 92 -3.305 -3.265 -8.172 1.00 0.00 C ATOM 173 C LEU A 92 -3.367 -2.198 -9.260 1.00 0.00 C ATOM 174 O LEU A 92 -3.394 -1.005 -8.973 1.00 0.00 O ATOM 175 CB LEU A 92 -1.846 -3.618 -7.852 1.00 0.00 C ATOM 176 CG LEU A 92 -1.659 -4.657 -6.746 1.00 0.00 C ATOM 177 CD1 LEU A 92 -0.189 -5.015 -6.598 1.00 0.00 C ATOM 178 CD2 LEU A 92 -2.216 -4.136 -5.430 1.00 0.00 C ATOM 0 H LEU A 92 -3.437 -5.264 -8.775 1.00 0.00 H new ATOM 0 HA LEU A 92 -3.774 -2.865 -7.273 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -1.370 -3.987 -8.760 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.322 -2.706 -7.565 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.207 -5.558 -7.020 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -0.073 -5.756 -5.807 1.00 0.00 H new ATOM 0 HD12 LEU A 92 0.182 -5.426 -7.537 1.00 0.00 H new ATOM 0 HD13 LEU A 92 0.380 -4.120 -6.344 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -2.075 -4.887 -4.653 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -1.693 -3.222 -5.150 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -3.279 -3.925 -5.543 1.00 0.00 H new ATOM 190 N LYS A 93 -3.410 -2.638 -10.510 1.00 0.00 N ATOM 191 CA LYS A 93 -3.439 -1.725 -11.649 1.00 0.00 C ATOM 192 C LYS A 93 -4.689 -0.840 -11.671 1.00 0.00 C ATOM 193 O LYS A 93 -4.657 0.260 -12.221 1.00 0.00 O ATOM 194 CB LYS A 93 -3.338 -2.513 -12.950 1.00 0.00 C ATOM 195 CG LYS A 93 -1.980 -3.162 -13.158 1.00 0.00 C ATOM 196 CD LYS A 93 -1.885 -3.879 -14.497 1.00 0.00 C ATOM 197 CE LYS A 93 -1.588 -2.923 -15.648 1.00 0.00 C ATOM 198 NZ LYS A 93 -2.705 -1.978 -15.926 1.00 0.00 N ATOM 0 H LYS A 93 -3.426 -3.626 -10.764 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.581 -1.061 -11.546 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -4.107 -3.286 -12.959 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -3.546 -1.847 -13.787 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -1.202 -2.400 -13.100 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -1.792 -3.872 -12.353 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -1.103 -4.636 -14.446 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -2.821 -4.401 -14.694 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -0.688 -2.354 -15.416 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -1.377 -3.501 -16.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -2.717 -1.743 -16.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -3.608 -2.421 -15.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -2.571 -1.109 -15.371 1.00 0.00 H new ATOM 212 N ASN A 94 -5.783 -1.305 -11.071 1.00 0.00 N ATOM 213 CA ASN A 94 -7.036 -0.540 -11.086 1.00 0.00 C ATOM 214 C ASN A 94 -6.924 0.713 -10.231 1.00 0.00 C ATOM 215 O ASN A 94 -7.687 1.664 -10.405 1.00 0.00 O ATOM 216 CB ASN A 94 -8.216 -1.363 -10.566 1.00 0.00 C ATOM 217 CG ASN A 94 -8.387 -2.692 -11.258 1.00 0.00 C ATOM 218 OD1 ASN A 94 -9.004 -2.786 -12.320 1.00 0.00 O ATOM 219 ND2 ASN A 94 -7.873 -3.735 -10.636 1.00 0.00 N ATOM 0 H ASN A 94 -5.832 -2.194 -10.574 1.00 0.00 H new ATOM 0 HA ASN A 94 -7.214 -0.271 -12.127 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -8.083 -1.535 -9.498 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -9.131 -0.783 -10.684 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -7.979 -4.669 -11.033 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -7.370 -3.608 -9.758 1.00 0.00 H new ATOM 226 N LEU A 95 -5.979 0.706 -9.304 1.00 0.00 N ATOM 227 CA LEU A 95 -5.827 1.789 -8.346 1.00 0.00 C ATOM 228 C LEU A 95 -5.449 3.091 -9.038 1.00 0.00 C ATOM 229 O LEU A 95 -5.960 4.156 -8.692 1.00 0.00 O ATOM 230 CB LEU A 95 -4.778 1.419 -7.302 1.00 0.00 C ATOM 231 CG LEU A 95 -5.224 0.410 -6.238 1.00 0.00 C ATOM 232 CD1 LEU A 95 -5.645 -0.908 -6.856 1.00 0.00 C ATOM 233 CD2 LEU A 95 -4.107 0.185 -5.246 1.00 0.00 C ATOM 0 H LEU A 95 -5.299 -0.047 -9.195 1.00 0.00 H new ATOM 0 HA LEU A 95 -6.786 1.941 -7.851 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -3.907 1.014 -7.817 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -4.456 2.331 -6.799 1.00 0.00 H new ATOM 0 HG LEU A 95 -6.091 0.825 -5.725 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -5.954 -1.596 -6.069 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -6.478 -0.740 -7.539 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -4.806 -1.337 -7.405 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -4.429 -0.533 -4.492 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -3.231 -0.203 -5.766 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -3.853 1.129 -4.763 1.00 0.00 H new ATOM 245 N GLY A 96 -4.560 2.997 -10.018 1.00 0.00 N ATOM 246 CA GLY A 96 -4.169 4.165 -10.784 1.00 0.00 C ATOM 247 C GLY A 96 -5.313 4.727 -11.608 1.00 0.00 C ATOM 248 O GLY A 96 -5.297 5.897 -11.994 1.00 0.00 O ATOM 0 H GLY A 96 -4.101 2.130 -10.297 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -3.801 4.935 -10.105 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -3.343 3.903 -11.445 1.00 0.00 H new ATOM 252 N GLU A 97 -6.317 3.898 -11.866 1.00 0.00 N ATOM 253 CA GLU A 97 -7.472 4.312 -12.651 1.00 0.00 C ATOM 254 C GLU A 97 -8.554 4.899 -11.757 1.00 0.00 C ATOM 255 O GLU A 97 -9.394 5.676 -12.213 1.00 0.00 O ATOM 256 CB GLU A 97 -8.039 3.125 -13.428 1.00 0.00 C ATOM 257 CG GLU A 97 -7.123 2.610 -14.518 1.00 0.00 C ATOM 258 CD GLU A 97 -6.851 3.649 -15.582 1.00 0.00 C ATOM 259 OE1 GLU A 97 -5.695 4.100 -15.696 1.00 0.00 O ATOM 260 OE2 GLU A 97 -7.798 4.034 -16.305 1.00 0.00 O ATOM 0 H GLU A 97 -6.354 2.932 -11.541 1.00 0.00 H new ATOM 0 HA GLU A 97 -7.143 5.079 -13.353 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -8.249 2.314 -12.731 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -8.990 3.416 -13.874 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -6.179 2.292 -14.075 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -7.571 1.730 -14.980 1.00 0.00 H new ATOM 267 N SER A 98 -8.519 4.529 -10.485 1.00 0.00 N ATOM 268 CA SER A 98 -9.522 4.961 -9.527 1.00 0.00 C ATOM 269 C SER A 98 -9.416 6.456 -9.282 1.00 0.00 C ATOM 270 O SER A 98 -8.449 6.927 -8.680 1.00 0.00 O ATOM 271 CB SER A 98 -9.356 4.202 -8.208 1.00 0.00 C ATOM 272 OG SER A 98 -10.267 4.670 -7.224 1.00 0.00 O ATOM 0 H SER A 98 -7.798 3.924 -10.091 1.00 0.00 H new ATOM 0 HA SER A 98 -10.507 4.744 -9.939 1.00 0.00 H new ATOM 0 HB2 SER A 98 -9.515 3.137 -8.377 1.00 0.00 H new ATOM 0 HB3 SER A 98 -8.335 4.318 -7.845 1.00 0.00 H new ATOM 0 HG SER A 98 -9.946 4.416 -6.334 1.00 0.00 H new ATOM 278 N ALA A 99 -10.421 7.193 -9.746 1.00 0.00 N ATOM 279 CA ALA A 99 -10.468 8.637 -9.569 1.00 0.00 C ATOM 280 C ALA A 99 -10.524 8.996 -8.090 1.00 0.00 C ATOM 281 O ALA A 99 -10.073 10.064 -7.676 1.00 0.00 O ATOM 282 CB ALA A 99 -11.665 9.221 -10.303 1.00 0.00 C ATOM 0 H ALA A 99 -11.219 6.808 -10.251 1.00 0.00 H new ATOM 0 HA ALA A 99 -9.558 9.065 -9.991 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -11.687 10.302 -10.161 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -11.585 8.996 -11.366 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -12.582 8.785 -9.908 1.00 0.00 H new ATOM 288 N THR A 100 -11.061 8.080 -7.300 1.00 0.00 N ATOM 289 CA THR A 100 -11.180 8.274 -5.870 1.00 0.00 C ATOM 290 C THR A 100 -9.818 8.185 -5.190 1.00 0.00 C ATOM 291 O THR A 100 -9.449 9.055 -4.401 1.00 0.00 O ATOM 292 CB THR A 100 -12.121 7.224 -5.254 1.00 0.00 C ATOM 293 OG1 THR A 100 -13.362 7.202 -5.973 1.00 0.00 O ATOM 294 CG2 THR A 100 -12.382 7.531 -3.789 1.00 0.00 C ATOM 0 H THR A 100 -11.424 7.187 -7.633 1.00 0.00 H new ATOM 0 HA THR A 100 -11.594 9.269 -5.709 1.00 0.00 H new ATOM 0 HB THR A 100 -11.643 6.247 -5.324 1.00 0.00 H new ATOM 0 HG1 THR A 100 -13.957 6.531 -5.578 1.00 0.00 H new ATOM 0 HG21 THR A 100 -13.050 6.777 -3.373 1.00 0.00 H new ATOM 0 HG22 THR A 100 -11.439 7.523 -3.242 1.00 0.00 H new ATOM 0 HG23 THR A 100 -12.845 8.514 -3.700 1.00 0.00 H new ATOM 302 N LEU A 101 -9.059 7.148 -5.523 1.00 0.00 N ATOM 303 CA LEU A 101 -7.804 6.888 -4.836 1.00 0.00 C ATOM 304 C LEU A 101 -6.761 7.930 -5.205 1.00 0.00 C ATOM 305 O LEU A 101 -6.095 8.484 -4.336 1.00 0.00 O ATOM 306 CB LEU A 101 -7.270 5.495 -5.163 1.00 0.00 C ATOM 307 CG LEU A 101 -6.052 5.076 -4.338 1.00 0.00 C ATOM 308 CD1 LEU A 101 -6.445 4.812 -2.896 1.00 0.00 C ATOM 309 CD2 LEU A 101 -5.380 3.862 -4.945 1.00 0.00 C ATOM 0 H LEU A 101 -9.289 6.480 -6.258 1.00 0.00 H new ATOM 0 HA LEU A 101 -8.003 6.943 -3.766 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -8.067 4.768 -5.007 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -7.008 5.459 -6.220 1.00 0.00 H new ATOM 0 HG LEU A 101 -5.336 5.898 -4.350 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -5.564 4.515 -2.327 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -6.869 5.718 -2.463 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -7.185 4.013 -2.861 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -4.517 3.584 -4.340 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -6.086 3.032 -4.974 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -5.053 4.096 -5.958 1.00 0.00 H new ATOM 321 N ARG A 102 -6.639 8.206 -6.498 1.00 0.00 N ATOM 322 CA ARG A 102 -5.671 9.187 -6.984 1.00 0.00 C ATOM 323 C ARG A 102 -5.923 10.556 -6.358 1.00 0.00 C ATOM 324 O ARG A 102 -4.992 11.329 -6.148 1.00 0.00 O ATOM 325 CB ARG A 102 -5.729 9.292 -8.508 1.00 0.00 C ATOM 326 CG ARG A 102 -7.126 9.546 -9.035 1.00 0.00 C ATOM 327 CD ARG A 102 -7.115 9.992 -10.483 1.00 0.00 C ATOM 328 NE ARG A 102 -6.693 8.922 -11.384 1.00 0.00 N ATOM 329 CZ ARG A 102 -7.179 8.753 -12.613 1.00 0.00 C ATOM 330 NH1 ARG A 102 -8.105 9.582 -13.088 1.00 0.00 N ATOM 331 NH2 ARG A 102 -6.745 7.749 -13.362 1.00 0.00 N ATOM 0 H ARG A 102 -7.197 7.766 -7.230 1.00 0.00 H new ATOM 0 HA ARG A 102 -4.677 8.849 -6.692 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -5.072 10.098 -8.836 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -5.345 8.370 -8.944 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -7.720 8.637 -8.940 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -7.611 10.308 -8.425 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -8.112 10.331 -10.765 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -6.445 10.845 -10.594 1.00 0.00 H new ATOM 0 HE ARG A 102 -5.985 8.266 -11.053 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -8.446 10.351 -12.511 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -8.474 9.449 -14.029 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -6.041 7.108 -12.997 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -7.116 7.618 -14.303 1.00 0.00 H new ATOM 345 N SER A 103 -7.183 10.835 -6.033 1.00 0.00 N ATOM 346 CA SER A 103 -7.559 12.102 -5.430 1.00 0.00 C ATOM 347 C SER A 103 -6.967 12.210 -4.027 1.00 0.00 C ATOM 348 O SER A 103 -6.750 13.308 -3.511 1.00 0.00 O ATOM 349 CB SER A 103 -9.086 12.223 -5.386 1.00 0.00 C ATOM 350 OG SER A 103 -9.500 13.480 -4.875 1.00 0.00 O ATOM 0 H SER A 103 -7.962 10.193 -6.180 1.00 0.00 H new ATOM 0 HA SER A 103 -7.163 12.919 -6.033 1.00 0.00 H new ATOM 0 HB2 SER A 103 -9.490 12.087 -6.389 1.00 0.00 H new ATOM 0 HB3 SER A 103 -9.496 11.426 -4.766 1.00 0.00 H new ATOM 0 HG SER A 103 -10.479 13.522 -4.863 1.00 0.00 H new ATOM 356 N LEU A 104 -6.694 11.059 -3.426 1.00 0.00 N ATOM 357 CA LEU A 104 -6.097 11.006 -2.102 1.00 0.00 C ATOM 358 C LEU A 104 -4.583 11.139 -2.216 1.00 0.00 C ATOM 359 O LEU A 104 -3.938 11.771 -1.380 1.00 0.00 O ATOM 360 CB LEU A 104 -6.462 9.689 -1.412 1.00 0.00 C ATOM 361 CG LEU A 104 -7.937 9.291 -1.507 1.00 0.00 C ATOM 362 CD1 LEU A 104 -8.185 7.988 -0.773 1.00 0.00 C ATOM 363 CD2 LEU A 104 -8.833 10.394 -0.963 1.00 0.00 C ATOM 0 H LEU A 104 -6.879 10.145 -3.840 1.00 0.00 H new ATOM 0 HA LEU A 104 -6.482 11.831 -1.503 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.858 8.891 -1.844 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -6.189 9.761 -0.359 1.00 0.00 H new ATOM 0 HG LEU A 104 -8.183 9.145 -2.559 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -9.239 7.721 -0.851 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -7.577 7.199 -1.216 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -7.918 8.105 0.277 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -9.876 10.087 -1.041 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -8.587 10.580 0.082 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -8.679 11.306 -1.540 1.00 0.00 H new ATOM 375 N LEU A 105 -4.027 10.555 -3.277 1.00 0.00 N ATOM 376 CA LEU A 105 -2.591 10.642 -3.549 1.00 0.00 C ATOM 377 C LEU A 105 -2.188 12.083 -3.817 1.00 0.00 C ATOM 378 O LEU A 105 -1.023 12.458 -3.672 1.00 0.00 O ATOM 379 CB LEU A 105 -2.207 9.782 -4.759 1.00 0.00 C ATOM 380 CG LEU A 105 -1.951 8.296 -4.485 1.00 0.00 C ATOM 381 CD1 LEU A 105 -3.199 7.601 -3.973 1.00 0.00 C ATOM 382 CD2 LEU A 105 -1.446 7.620 -5.748 1.00 0.00 C ATOM 0 H LEU A 105 -4.551 10.014 -3.965 1.00 0.00 H new ATOM 0 HA LEU A 105 -2.066 10.272 -2.669 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -3.002 9.861 -5.500 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -1.309 10.206 -5.209 1.00 0.00 H new ATOM 0 HG LEU A 105 -1.191 8.219 -3.707 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -2.980 6.549 -3.790 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -3.523 8.072 -3.045 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -3.992 7.682 -4.717 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -1.265 6.564 -5.548 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -2.192 7.718 -6.536 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -0.517 8.093 -6.067 1.00 0.00 H new ATOM 394 N LEU A 106 -3.167 12.885 -4.219 1.00 0.00 N ATOM 395 CA LEU A 106 -2.963 14.304 -4.465 1.00 0.00 C ATOM 396 C LEU A 106 -2.568 15.030 -3.181 1.00 0.00 C ATOM 397 O LEU A 106 -2.059 16.148 -3.220 1.00 0.00 O ATOM 398 CB LEU A 106 -4.230 14.918 -5.050 1.00 0.00 C ATOM 399 CG LEU A 106 -4.674 14.329 -6.388 1.00 0.00 C ATOM 400 CD1 LEU A 106 -5.892 15.063 -6.904 1.00 0.00 C ATOM 401 CD2 LEU A 106 -3.550 14.383 -7.409 1.00 0.00 C ATOM 0 H LEU A 106 -4.123 12.569 -4.383 1.00 0.00 H new ATOM 0 HA LEU A 106 -2.149 14.415 -5.181 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -5.040 14.798 -4.330 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -4.072 15.989 -5.176 1.00 0.00 H new ATOM 0 HG LEU A 106 -4.934 13.282 -6.229 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -6.198 14.634 -7.858 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -6.706 14.968 -6.185 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -5.651 16.117 -7.041 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -3.894 13.957 -8.352 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -3.251 15.419 -7.566 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -2.698 13.811 -7.042 1.00 0.00 H new ATOM 413 N ASN A 107 -2.807 14.387 -2.046 1.00 0.00 N ATOM 414 CA ASN A 107 -2.387 14.926 -0.761 1.00 0.00 C ATOM 415 C ASN A 107 -0.901 14.651 -0.552 1.00 0.00 C ATOM 416 O ASN A 107 -0.470 13.494 -0.538 1.00 0.00 O ATOM 417 CB ASN A 107 -3.207 14.316 0.378 1.00 0.00 C ATOM 418 CG ASN A 107 -4.666 14.735 0.341 1.00 0.00 C ATOM 419 OD1 ASN A 107 -4.999 15.832 -0.106 1.00 0.00 O ATOM 420 ND2 ASN A 107 -5.547 13.866 0.811 1.00 0.00 N ATOM 0 H ASN A 107 -3.290 13.490 -1.990 1.00 0.00 H new ATOM 0 HA ASN A 107 -2.557 16.003 -0.759 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -3.144 13.229 0.324 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -2.772 14.613 1.332 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -6.541 14.096 0.811 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -5.232 12.966 1.173 1.00 0.00 H new ATOM 427 N PRO A 108 -0.097 15.716 -0.385 1.00 0.00 N ATOM 428 CA PRO A 108 1.366 15.613 -0.294 1.00 0.00 C ATOM 429 C PRO A 108 1.833 14.797 0.908 1.00 0.00 C ATOM 430 O PRO A 108 2.943 14.267 0.913 1.00 0.00 O ATOM 431 CB PRO A 108 1.830 17.068 -0.164 1.00 0.00 C ATOM 432 CG PRO A 108 0.637 17.812 0.323 1.00 0.00 C ATOM 433 CD PRO A 108 -0.553 17.114 -0.269 1.00 0.00 C ATOM 0 HA PRO A 108 1.779 15.095 -1.160 1.00 0.00 H new ATOM 0 HB2 PRO A 108 2.662 17.156 0.535 1.00 0.00 H new ATOM 0 HB3 PRO A 108 2.175 17.459 -1.121 1.00 0.00 H new ATOM 0 HG2 PRO A 108 0.591 17.807 1.412 1.00 0.00 H new ATOM 0 HG3 PRO A 108 0.673 18.856 0.011 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -1.431 17.200 0.372 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -0.824 17.531 -1.239 1.00 0.00 H new ATOM 441 N HIS A 109 0.985 14.696 1.921 1.00 0.00 N ATOM 442 CA HIS A 109 1.310 13.909 3.099 1.00 0.00 C ATOM 443 C HIS A 109 1.160 12.415 2.818 1.00 0.00 C ATOM 444 O HIS A 109 2.063 11.633 3.103 1.00 0.00 O ATOM 445 CB HIS A 109 0.431 14.331 4.280 1.00 0.00 C ATOM 446 CG HIS A 109 0.516 13.412 5.460 1.00 0.00 C ATOM 447 ND1 HIS A 109 1.529 13.506 6.382 1.00 0.00 N ATOM 448 CD2 HIS A 109 -0.299 12.388 5.797 1.00 0.00 C ATOM 449 CE1 HIS A 109 1.306 12.535 7.255 1.00 0.00 C ATOM 450 NE2 HIS A 109 0.208 11.838 6.945 1.00 0.00 N ATOM 0 H HIS A 109 0.071 15.147 1.950 1.00 0.00 H new ATOM 0 HA HIS A 109 2.352 14.096 3.359 1.00 0.00 H new ATOM 0 HB2 HIS A 109 0.718 15.335 4.593 1.00 0.00 H new ATOM 0 HB3 HIS A 109 -0.606 14.384 3.948 1.00 0.00 H new ATOM 0 HD1 HIS A 109 2.293 14.182 6.393 1.00 0.00 H new ATOM 0 HD2 HIS A 109 -1.181 12.065 5.264 1.00 0.00 H new ATOM 0 HE1 HIS A 109 1.933 12.332 8.111 1.00 0.00 H new ATOM 458 N LEU A 110 0.032 12.027 2.237 1.00 0.00 N ATOM 459 CA LEU A 110 -0.268 10.621 2.010 1.00 0.00 C ATOM 460 C LEU A 110 0.758 9.983 1.083 1.00 0.00 C ATOM 461 O LEU A 110 1.148 8.829 1.269 1.00 0.00 O ATOM 462 CB LEU A 110 -1.670 10.478 1.422 1.00 0.00 C ATOM 463 CG LEU A 110 -2.035 9.072 0.953 1.00 0.00 C ATOM 464 CD1 LEU A 110 -1.976 8.085 2.106 1.00 0.00 C ATOM 465 CD2 LEU A 110 -3.411 9.065 0.316 1.00 0.00 C ATOM 0 H LEU A 110 -0.692 12.669 1.914 1.00 0.00 H new ATOM 0 HA LEU A 110 -0.224 10.103 2.968 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -2.396 10.794 2.172 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -1.765 11.162 0.578 1.00 0.00 H new ATOM 0 HG LEU A 110 -1.306 8.763 0.204 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -2.240 7.090 1.747 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -0.967 8.066 2.518 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -2.679 8.389 2.882 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -3.655 8.055 -0.012 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -4.151 9.398 1.044 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -3.418 9.737 -0.542 1.00 0.00 H new ATOM 477 N ARG A 111 1.207 10.741 0.094 1.00 0.00 N ATOM 478 CA ARG A 111 2.201 10.238 -0.843 1.00 0.00 C ATOM 479 C ARG A 111 3.543 10.031 -0.142 1.00 0.00 C ATOM 480 O ARG A 111 4.372 9.241 -0.592 1.00 0.00 O ATOM 481 CB ARG A 111 2.352 11.174 -2.047 1.00 0.00 C ATOM 482 CG ARG A 111 2.811 12.577 -1.699 1.00 0.00 C ATOM 483 CD ARG A 111 2.934 13.441 -2.943 1.00 0.00 C ATOM 484 NE ARG A 111 1.679 13.511 -3.692 1.00 0.00 N ATOM 485 CZ ARG A 111 1.533 14.154 -4.851 1.00 0.00 C ATOM 486 NH1 ARG A 111 2.557 14.799 -5.399 1.00 0.00 N ATOM 487 NH2 ARG A 111 0.360 14.139 -5.465 1.00 0.00 N ATOM 0 H ARG A 111 0.902 11.699 -0.080 1.00 0.00 H new ATOM 0 HA ARG A 111 1.856 9.273 -1.215 1.00 0.00 H new ATOM 0 HB2 ARG A 111 3.064 10.735 -2.745 1.00 0.00 H new ATOM 0 HB3 ARG A 111 1.395 11.236 -2.565 1.00 0.00 H new ATOM 0 HG2 ARG A 111 2.104 13.032 -1.006 1.00 0.00 H new ATOM 0 HG3 ARG A 111 3.773 12.531 -1.189 1.00 0.00 H new ATOM 0 HD2 ARG A 111 3.241 14.447 -2.656 1.00 0.00 H new ATOM 0 HD3 ARG A 111 3.717 13.040 -3.586 1.00 0.00 H new ATOM 0 HE ARG A 111 0.864 13.038 -3.303 1.00 0.00 H new ATOM 0 HH11 ARG A 111 3.464 14.805 -4.933 1.00 0.00 H new ATOM 0 HH12 ARG A 111 2.436 15.288 -6.286 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -0.426 13.637 -5.051 1.00 0.00 H new ATOM 0 HH22 ARG A 111 0.242 14.629 -6.352 1.00 0.00 H new ATOM 501 N GLN A 112 3.738 10.724 0.976 1.00 0.00 N ATOM 502 CA GLN A 112 4.943 10.556 1.772 1.00 0.00 C ATOM 503 C GLN A 112 4.897 9.251 2.549 1.00 0.00 C ATOM 504 O GLN A 112 5.891 8.535 2.615 1.00 0.00 O ATOM 505 CB GLN A 112 5.145 11.732 2.726 1.00 0.00 C ATOM 506 CG GLN A 112 5.757 12.949 2.056 1.00 0.00 C ATOM 507 CD GLN A 112 7.131 12.666 1.467 1.00 0.00 C ATOM 508 OE1 GLN A 112 7.518 13.252 0.456 1.00 0.00 O ATOM 509 NE2 GLN A 112 7.887 11.783 2.104 1.00 0.00 N ATOM 0 H GLN A 112 3.077 11.405 1.348 1.00 0.00 H new ATOM 0 HA GLN A 112 5.790 10.525 1.086 1.00 0.00 H new ATOM 0 HB2 GLN A 112 4.184 12.009 3.159 1.00 0.00 H new ATOM 0 HB3 GLN A 112 5.787 11.417 3.549 1.00 0.00 H new ATOM 0 HG2 GLN A 112 5.092 13.296 1.265 1.00 0.00 H new ATOM 0 HG3 GLN A 112 5.837 13.757 2.783 1.00 0.00 H new ATOM 0 HE21 GLN A 112 7.533 11.317 2.939 1.00 0.00 H new ATOM 0 HE22 GLN A 112 8.823 11.570 1.759 1.00 0.00 H new ATOM 518 N LEU A 113 3.745 8.942 3.138 1.00 0.00 N ATOM 519 CA LEU A 113 3.564 7.678 3.835 1.00 0.00 C ATOM 520 C LEU A 113 3.953 6.496 2.952 1.00 0.00 C ATOM 521 O LEU A 113 4.639 5.580 3.399 1.00 0.00 O ATOM 522 CB LEU A 113 2.117 7.524 4.300 1.00 0.00 C ATOM 523 CG LEU A 113 1.778 8.223 5.616 1.00 0.00 C ATOM 524 CD1 LEU A 113 1.807 9.721 5.481 1.00 0.00 C ATOM 525 CD2 LEU A 113 0.429 7.769 6.128 1.00 0.00 C ATOM 0 H LEU A 113 2.926 9.550 3.145 1.00 0.00 H new ATOM 0 HA LEU A 113 4.220 7.686 4.705 1.00 0.00 H new ATOM 0 HB2 LEU A 113 1.459 7.911 3.522 1.00 0.00 H new ATOM 0 HB3 LEU A 113 1.897 6.462 4.404 1.00 0.00 H new ATOM 0 HG LEU A 113 2.545 7.942 6.338 1.00 0.00 H new ATOM 0 HD11 LEU A 113 1.560 10.178 6.440 1.00 0.00 H new ATOM 0 HD12 LEU A 113 2.803 10.039 5.173 1.00 0.00 H new ATOM 0 HD13 LEU A 113 1.079 10.033 4.732 1.00 0.00 H new ATOM 0 HD21 LEU A 113 0.206 8.278 7.066 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -0.339 8.009 5.393 1.00 0.00 H new ATOM 0 HD23 LEU A 113 0.447 6.692 6.295 1.00 0.00 H new ATOM 537 N MET A 114 3.533 6.529 1.694 1.00 0.00 N ATOM 538 CA MET A 114 3.853 5.451 0.767 1.00 0.00 C ATOM 539 C MET A 114 5.363 5.291 0.602 1.00 0.00 C ATOM 540 O MET A 114 5.900 4.204 0.810 1.00 0.00 O ATOM 541 CB MET A 114 3.190 5.672 -0.596 1.00 0.00 C ATOM 542 CG MET A 114 1.698 5.369 -0.601 1.00 0.00 C ATOM 543 SD MET A 114 1.023 5.192 -2.264 1.00 0.00 S ATOM 544 CE MET A 114 1.447 6.771 -2.988 1.00 0.00 C ATOM 0 H MET A 114 2.975 7.283 1.294 1.00 0.00 H new ATOM 0 HA MET A 114 3.456 4.530 1.194 1.00 0.00 H new ATOM 0 HB2 MET A 114 3.344 6.707 -0.903 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.683 5.043 -1.337 1.00 0.00 H new ATOM 0 HG2 MET A 114 1.517 4.451 -0.041 1.00 0.00 H new ATOM 0 HG3 MET A 114 1.168 6.168 -0.083 1.00 0.00 H new ATOM 0 HE1 MET A 114 1.001 6.848 -3.979 1.00 0.00 H new ATOM 0 HE2 MET A 114 1.069 7.574 -2.356 1.00 0.00 H new ATOM 0 HE3 MET A 114 2.531 6.854 -3.071 1.00 0.00 H new ATOM 554 N VAL A 115 6.051 6.377 0.260 1.00 0.00 N ATOM 555 CA VAL A 115 7.491 6.313 0.015 1.00 0.00 C ATOM 556 C VAL A 115 8.266 6.041 1.301 1.00 0.00 C ATOM 557 O VAL A 115 9.384 5.539 1.266 1.00 0.00 O ATOM 558 CB VAL A 115 8.031 7.602 -0.643 1.00 0.00 C ATOM 559 CG1 VAL A 115 7.320 7.870 -1.960 1.00 0.00 C ATOM 560 CG2 VAL A 115 7.903 8.793 0.290 1.00 0.00 C ATOM 0 H VAL A 115 5.641 7.304 0.147 1.00 0.00 H new ATOM 0 HA VAL A 115 7.642 5.484 -0.677 1.00 0.00 H new ATOM 0 HB VAL A 115 9.091 7.454 -0.848 1.00 0.00 H new ATOM 0 HG11 VAL A 115 7.715 8.782 -2.408 1.00 0.00 H new ATOM 0 HG12 VAL A 115 7.483 7.033 -2.639 1.00 0.00 H new ATOM 0 HG13 VAL A 115 6.252 7.987 -1.779 1.00 0.00 H new ATOM 0 HG21 VAL A 115 8.292 9.684 -0.202 1.00 0.00 H new ATOM 0 HG22 VAL A 115 6.854 8.946 0.543 1.00 0.00 H new ATOM 0 HG23 VAL A 115 8.472 8.605 1.201 1.00 0.00 H new ATOM 570 N ASN A 116 7.667 6.386 2.431 1.00 0.00 N ATOM 571 CA ASN A 116 8.272 6.138 3.733 1.00 0.00 C ATOM 572 C ASN A 116 8.162 4.668 4.120 1.00 0.00 C ATOM 573 O ASN A 116 9.156 4.034 4.471 1.00 0.00 O ATOM 574 CB ASN A 116 7.610 7.005 4.806 1.00 0.00 C ATOM 575 CG ASN A 116 8.121 8.433 4.822 1.00 0.00 C ATOM 576 OD1 ASN A 116 9.270 8.708 4.466 1.00 0.00 O ATOM 577 ND2 ASN A 116 7.270 9.356 5.245 1.00 0.00 N ATOM 0 H ASN A 116 6.756 6.842 2.473 1.00 0.00 H new ATOM 0 HA ASN A 116 9.328 6.399 3.662 1.00 0.00 H new ATOM 0 HB2 ASN A 116 6.532 7.014 4.642 1.00 0.00 H new ATOM 0 HB3 ASN A 116 7.780 6.554 5.784 1.00 0.00 H new ATOM 0 HD21 ASN A 116 7.557 10.334 5.285 1.00 0.00 H new ATOM 0 HD22 ASN A 116 6.328 9.089 5.531 1.00 0.00 H new ATOM 584 N LEU A 117 6.950 4.129 4.049 1.00 0.00 N ATOM 585 CA LEU A 117 6.689 2.744 4.433 1.00 0.00 C ATOM 586 C LEU A 117 7.487 1.764 3.570 1.00 0.00 C ATOM 587 O LEU A 117 7.935 0.724 4.054 1.00 0.00 O ATOM 588 CB LEU A 117 5.191 2.450 4.315 1.00 0.00 C ATOM 589 CG LEU A 117 4.753 1.040 4.713 1.00 0.00 C ATOM 590 CD1 LEU A 117 5.068 0.769 6.177 1.00 0.00 C ATOM 591 CD2 LEU A 117 3.267 0.857 4.445 1.00 0.00 C ATOM 0 H LEU A 117 6.125 4.635 3.726 1.00 0.00 H new ATOM 0 HA LEU A 117 7.007 2.612 5.467 1.00 0.00 H new ATOM 0 HB2 LEU A 117 4.650 3.166 4.934 1.00 0.00 H new ATOM 0 HB3 LEU A 117 4.886 2.627 3.284 1.00 0.00 H new ATOM 0 HG LEU A 117 5.309 0.323 4.109 1.00 0.00 H new ATOM 0 HD11 LEU A 117 4.748 -0.240 6.437 1.00 0.00 H new ATOM 0 HD12 LEU A 117 6.141 0.863 6.342 1.00 0.00 H new ATOM 0 HD13 LEU A 117 4.541 1.490 6.802 1.00 0.00 H new ATOM 0 HD21 LEU A 117 2.967 -0.151 4.732 1.00 0.00 H new ATOM 0 HD22 LEU A 117 2.700 1.584 5.026 1.00 0.00 H new ATOM 0 HD23 LEU A 117 3.068 1.006 3.384 1.00 0.00 H new ATOM 603 N ASP A 118 7.675 2.113 2.300 1.00 0.00 N ATOM 604 CA ASP A 118 8.389 1.251 1.357 1.00 0.00 C ATOM 605 C ASP A 118 9.835 1.039 1.783 1.00 0.00 C ATOM 606 O ASP A 118 10.389 -0.049 1.610 1.00 0.00 O ATOM 607 CB ASP A 118 8.357 1.848 -0.051 1.00 0.00 C ATOM 608 CG ASP A 118 9.111 0.994 -1.052 1.00 0.00 C ATOM 609 OD1 ASP A 118 10.280 1.301 -1.348 1.00 0.00 O ATOM 610 OD2 ASP A 118 8.538 -0.001 -1.538 1.00 0.00 O ATOM 0 H ASP A 118 7.342 2.989 1.897 1.00 0.00 H new ATOM 0 HA ASP A 118 7.882 0.286 1.353 1.00 0.00 H new ATOM 0 HB2 ASP A 118 7.322 1.956 -0.375 1.00 0.00 H new ATOM 0 HB3 ASP A 118 8.790 2.848 -0.030 1.00 0.00 H new ATOM 615 N GLN A 119 10.430 2.080 2.359 1.00 0.00 N ATOM 616 CA GLN A 119 11.831 2.049 2.770 1.00 0.00 C ATOM 617 C GLN A 119 12.063 1.006 3.849 1.00 0.00 C ATOM 618 O GLN A 119 13.148 0.437 3.971 1.00 0.00 O ATOM 619 CB GLN A 119 12.251 3.415 3.296 1.00 0.00 C ATOM 620 CG GLN A 119 11.985 4.537 2.317 1.00 0.00 C ATOM 621 CD GLN A 119 12.423 5.887 2.839 1.00 0.00 C ATOM 622 OE1 GLN A 119 13.372 5.991 3.615 1.00 0.00 O ATOM 623 NE2 GLN A 119 11.722 6.928 2.429 1.00 0.00 N ATOM 0 H GLN A 119 9.959 2.963 2.553 1.00 0.00 H new ATOM 0 HA GLN A 119 12.429 1.788 1.897 1.00 0.00 H new ATOM 0 HB2 GLN A 119 11.719 3.619 4.226 1.00 0.00 H new ATOM 0 HB3 GLN A 119 13.314 3.394 3.535 1.00 0.00 H new ATOM 0 HG2 GLN A 119 12.505 4.328 1.382 1.00 0.00 H new ATOM 0 HG3 GLN A 119 10.920 4.569 2.089 1.00 0.00 H new ATOM 0 HE21 GLN A 119 10.942 6.796 1.785 1.00 0.00 H new ATOM 0 HE22 GLN A 119 11.960 7.864 2.757 1.00 0.00 H new ATOM 632 N GLY A 120 11.018 0.781 4.630 1.00 0.00 N ATOM 633 CA GLY A 120 11.025 -0.266 5.632 1.00 0.00 C ATOM 634 C GLY A 120 12.014 -0.036 6.759 1.00 0.00 C ATOM 635 O GLY A 120 12.455 -0.992 7.395 1.00 0.00 O ATOM 0 H GLY A 120 10.150 1.315 4.586 1.00 0.00 H new ATOM 0 HA2 GLY A 120 10.024 -0.357 6.054 1.00 0.00 H new ATOM 0 HA3 GLY A 120 11.255 -1.216 5.149 1.00 0.00 H new ATOM 639 N GLU A 121 12.359 1.218 7.019 1.00 0.00 N ATOM 640 CA GLU A 121 13.294 1.541 8.093 1.00 0.00 C ATOM 641 C GLU A 121 12.671 1.215 9.443 1.00 0.00 C ATOM 642 O GLU A 121 13.303 0.602 10.303 1.00 0.00 O ATOM 643 CB GLU A 121 13.691 3.017 8.049 1.00 0.00 C ATOM 644 CG GLU A 121 14.272 3.453 6.717 1.00 0.00 C ATOM 645 CD GLU A 121 14.834 4.857 6.761 1.00 0.00 C ATOM 646 OE1 GLU A 121 14.051 5.814 6.939 1.00 0.00 O ATOM 647 OE2 GLU A 121 16.063 5.009 6.608 1.00 0.00 O ATOM 0 H GLU A 121 12.008 2.026 6.505 1.00 0.00 H new ATOM 0 HA GLU A 121 14.192 0.939 7.954 1.00 0.00 H new ATOM 0 HB2 GLU A 121 12.815 3.626 8.270 1.00 0.00 H new ATOM 0 HB3 GLU A 121 14.421 3.211 8.835 1.00 0.00 H new ATOM 0 HG2 GLU A 121 15.060 2.759 6.423 1.00 0.00 H new ATOM 0 HG3 GLU A 121 13.498 3.399 5.952 1.00 0.00 H new ATOM 654 N ASP A 122 11.426 1.635 9.618 1.00 0.00 N ATOM 655 CA ASP A 122 10.671 1.335 10.828 1.00 0.00 C ATOM 656 C ASP A 122 9.227 1.049 10.471 1.00 0.00 C ATOM 657 O ASP A 122 8.299 1.568 11.092 1.00 0.00 O ATOM 658 CB ASP A 122 10.743 2.487 11.838 1.00 0.00 C ATOM 659 CG ASP A 122 12.114 2.658 12.457 1.00 0.00 C ATOM 660 OD1 ASP A 122 12.457 1.888 13.381 1.00 0.00 O ATOM 661 OD2 ASP A 122 12.848 3.577 12.042 1.00 0.00 O ATOM 0 H ASP A 122 10.913 2.189 8.932 1.00 0.00 H new ATOM 0 HA ASP A 122 11.116 0.456 11.294 1.00 0.00 H new ATOM 0 HB2 ASP A 122 10.458 3.414 11.341 1.00 0.00 H new ATOM 0 HB3 ASP A 122 10.014 2.313 12.630 1.00 0.00 H new ATOM 666 N LYS A 123 9.062 0.223 9.446 1.00 0.00 N ATOM 667 CA LYS A 123 7.748 -0.203 8.971 1.00 0.00 C ATOM 668 C LYS A 123 6.851 -0.675 10.115 1.00 0.00 C ATOM 669 O LYS A 123 5.635 -0.495 10.061 1.00 0.00 O ATOM 670 CB LYS A 123 7.883 -1.323 7.922 1.00 0.00 C ATOM 671 CG LYS A 123 8.532 -2.607 8.441 1.00 0.00 C ATOM 672 CD LYS A 123 10.028 -2.441 8.671 1.00 0.00 C ATOM 673 CE LYS A 123 10.644 -3.660 9.329 1.00 0.00 C ATOM 674 NZ LYS A 123 10.482 -4.886 8.505 1.00 0.00 N ATOM 0 H LYS A 123 9.839 -0.173 8.917 1.00 0.00 H new ATOM 0 HA LYS A 123 7.280 0.668 8.512 1.00 0.00 H new ATOM 0 HB2 LYS A 123 6.892 -1.563 7.536 1.00 0.00 H new ATOM 0 HB3 LYS A 123 8.470 -0.948 7.083 1.00 0.00 H new ATOM 0 HG2 LYS A 123 8.053 -2.903 9.374 1.00 0.00 H new ATOM 0 HG3 LYS A 123 8.363 -3.413 7.726 1.00 0.00 H new ATOM 0 HD2 LYS A 123 10.522 -2.256 7.717 1.00 0.00 H new ATOM 0 HD3 LYS A 123 10.203 -1.565 9.296 1.00 0.00 H new ATOM 0 HE2 LYS A 123 11.705 -3.479 9.503 1.00 0.00 H new ATOM 0 HE3 LYS A 123 10.183 -3.816 10.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 11.005 -5.671 8.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 9.474 -5.133 8.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 10.854 -4.714 7.549 1.00 0.00 H new ATOM 688 N ALA A 124 7.448 -1.259 11.152 1.00 0.00 N ATOM 689 CA ALA A 124 6.679 -1.787 12.268 1.00 0.00 C ATOM 690 C ALA A 124 5.865 -0.691 12.951 1.00 0.00 C ATOM 691 O ALA A 124 4.656 -0.843 13.154 1.00 0.00 O ATOM 692 CB ALA A 124 7.585 -2.488 13.268 1.00 0.00 C ATOM 0 H ALA A 124 8.457 -1.376 11.239 1.00 0.00 H new ATOM 0 HA ALA A 124 5.979 -2.521 11.868 1.00 0.00 H new ATOM 0 HB1 ALA A 124 6.986 -2.874 14.093 1.00 0.00 H new ATOM 0 HB2 ALA A 124 8.100 -3.313 12.776 1.00 0.00 H new ATOM 0 HB3 ALA A 124 8.319 -1.780 13.653 1.00 0.00 H new ATOM 698 N LYS A 125 6.513 0.422 13.283 1.00 0.00 N ATOM 699 CA LYS A 125 5.817 1.526 13.929 1.00 0.00 C ATOM 700 C LYS A 125 4.972 2.282 12.910 1.00 0.00 C ATOM 701 O LYS A 125 3.920 2.824 13.246 1.00 0.00 O ATOM 702 CB LYS A 125 6.794 2.490 14.619 1.00 0.00 C ATOM 703 CG LYS A 125 7.580 3.376 13.663 1.00 0.00 C ATOM 704 CD LYS A 125 8.372 4.437 14.409 1.00 0.00 C ATOM 705 CE LYS A 125 9.087 5.377 13.451 1.00 0.00 C ATOM 706 NZ LYS A 125 9.734 6.514 14.161 1.00 0.00 N ATOM 0 H LYS A 125 7.507 0.581 13.117 1.00 0.00 H new ATOM 0 HA LYS A 125 5.169 1.103 14.697 1.00 0.00 H new ATOM 0 HB2 LYS A 125 6.235 3.124 15.307 1.00 0.00 H new ATOM 0 HB3 LYS A 125 7.496 1.910 15.218 1.00 0.00 H new ATOM 0 HG2 LYS A 125 8.260 2.762 13.072 1.00 0.00 H new ATOM 0 HG3 LYS A 125 6.895 3.856 12.964 1.00 0.00 H new ATOM 0 HD2 LYS A 125 7.701 5.010 15.049 1.00 0.00 H new ATOM 0 HD3 LYS A 125 9.102 3.956 15.061 1.00 0.00 H new ATOM 0 HE2 LYS A 125 9.841 4.821 12.894 1.00 0.00 H new ATOM 0 HE3 LYS A 125 8.374 5.763 12.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 10.209 7.129 13.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 9.012 7.061 14.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 10.434 6.148 14.838 1.00 0.00 H new ATOM 720 N LEU A 126 5.429 2.299 11.659 1.00 0.00 N ATOM 721 CA LEU A 126 4.719 3.003 10.605 1.00 0.00 C ATOM 722 C LEU A 126 3.348 2.379 10.379 1.00 0.00 C ATOM 723 O LEU A 126 2.358 3.082 10.267 1.00 0.00 O ATOM 724 CB LEU A 126 5.528 3.002 9.304 1.00 0.00 C ATOM 725 CG LEU A 126 6.898 3.681 9.384 1.00 0.00 C ATOM 726 CD1 LEU A 126 7.618 3.584 8.049 1.00 0.00 C ATOM 727 CD2 LEU A 126 6.773 5.133 9.810 1.00 0.00 C ATOM 0 H LEU A 126 6.285 1.834 11.356 1.00 0.00 H new ATOM 0 HA LEU A 126 4.584 4.038 10.920 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.671 1.969 8.985 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.941 3.496 8.530 1.00 0.00 H new ATOM 0 HG LEU A 126 7.484 3.159 10.140 1.00 0.00 H new ATOM 0 HD11 LEU A 126 8.590 4.072 8.124 1.00 0.00 H new ATOM 0 HD12 LEU A 126 7.757 2.535 7.786 1.00 0.00 H new ATOM 0 HD13 LEU A 126 7.024 4.075 7.279 1.00 0.00 H new ATOM 0 HD21 LEU A 126 7.764 5.585 9.857 1.00 0.00 H new ATOM 0 HD22 LEU A 126 6.161 5.673 9.087 1.00 0.00 H new ATOM 0 HD23 LEU A 126 6.304 5.185 10.793 1.00 0.00 H new ATOM 739 N MET A 127 3.293 1.053 10.351 1.00 0.00 N ATOM 740 CA MET A 127 2.025 0.341 10.191 1.00 0.00 C ATOM 741 C MET A 127 0.981 0.844 11.185 1.00 0.00 C ATOM 742 O MET A 127 -0.199 0.946 10.863 1.00 0.00 O ATOM 743 CB MET A 127 2.222 -1.159 10.395 1.00 0.00 C ATOM 744 CG MET A 127 2.889 -1.885 9.235 1.00 0.00 C ATOM 745 SD MET A 127 1.704 -2.705 8.142 1.00 0.00 S ATOM 746 CE MET A 127 1.042 -1.320 7.217 1.00 0.00 C ATOM 0 H MET A 127 4.109 0.447 10.437 1.00 0.00 H new ATOM 0 HA MET A 127 1.671 0.530 9.177 1.00 0.00 H new ATOM 0 HB2 MET A 127 2.821 -1.313 11.292 1.00 0.00 H new ATOM 0 HB3 MET A 127 1.250 -1.616 10.579 1.00 0.00 H new ATOM 0 HG2 MET A 127 3.476 -1.172 8.656 1.00 0.00 H new ATOM 0 HG3 MET A 127 3.585 -2.626 9.629 1.00 0.00 H new ATOM 0 HE1 MET A 127 0.525 -1.688 6.331 1.00 0.00 H new ATOM 0 HE2 MET A 127 0.341 -0.767 7.842 1.00 0.00 H new ATOM 0 HE3 MET A 127 1.856 -0.662 6.915 1.00 0.00 H new ATOM 756 N ARG A 128 1.431 1.166 12.390 1.00 0.00 N ATOM 757 CA ARG A 128 0.545 1.652 13.433 1.00 0.00 C ATOM 758 C ARG A 128 0.267 3.142 13.265 1.00 0.00 C ATOM 759 O ARG A 128 -0.883 3.578 13.316 1.00 0.00 O ATOM 760 CB ARG A 128 1.161 1.386 14.805 1.00 0.00 C ATOM 761 CG ARG A 128 1.349 -0.092 15.114 1.00 0.00 C ATOM 762 CD ARG A 128 0.015 -0.818 15.175 1.00 0.00 C ATOM 763 NE ARG A 128 -0.902 -0.183 16.117 1.00 0.00 N ATOM 764 CZ ARG A 128 -2.222 -0.353 16.105 1.00 0.00 C ATOM 765 NH1 ARG A 128 -2.782 -1.181 15.235 1.00 0.00 N ATOM 766 NH2 ARG A 128 -2.982 0.294 16.975 1.00 0.00 N ATOM 0 H ARG A 128 2.410 1.098 12.668 1.00 0.00 H new ATOM 0 HA ARG A 128 -0.402 1.118 13.353 1.00 0.00 H new ATOM 0 HB2 ARG A 128 2.128 1.886 14.863 1.00 0.00 H new ATOM 0 HB3 ARG A 128 0.526 1.831 15.571 1.00 0.00 H new ATOM 0 HG2 ARG A 128 1.979 -0.548 14.350 1.00 0.00 H new ATOM 0 HG3 ARG A 128 1.870 -0.203 16.065 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -0.436 -0.835 14.183 1.00 0.00 H new ATOM 0 HD3 ARG A 128 0.178 -1.855 15.468 1.00 0.00 H new ATOM 0 HE ARG A 128 -0.506 0.430 16.830 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -2.201 -1.692 14.570 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -3.794 -1.308 15.230 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -2.556 0.923 17.655 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -3.994 0.163 16.965 1.00 0.00 H new ATOM 780 N ALA A 129 1.326 3.913 13.045 1.00 0.00 N ATOM 781 CA ALA A 129 1.222 5.364 12.930 1.00 0.00 C ATOM 782 C ALA A 129 0.449 5.784 11.683 1.00 0.00 C ATOM 783 O ALA A 129 -0.115 6.870 11.634 1.00 0.00 O ATOM 784 CB ALA A 129 2.608 5.987 12.920 1.00 0.00 C ATOM 0 H ALA A 129 2.275 3.554 12.942 1.00 0.00 H new ATOM 0 HA ALA A 129 0.667 5.724 13.797 1.00 0.00 H new ATOM 0 HB1 ALA A 129 2.520 7.070 12.834 1.00 0.00 H new ATOM 0 HB2 ALA A 129 3.126 5.738 13.846 1.00 0.00 H new ATOM 0 HB3 ALA A 129 3.174 5.601 12.073 1.00 0.00 H new ATOM 790 N TYR A 130 0.422 4.927 10.676 1.00 0.00 N ATOM 791 CA TYR A 130 -0.267 5.249 9.432 1.00 0.00 C ATOM 792 C TYR A 130 -1.772 5.057 9.573 1.00 0.00 C ATOM 793 O TYR A 130 -2.557 5.755 8.938 1.00 0.00 O ATOM 794 CB TYR A 130 0.265 4.393 8.281 1.00 0.00 C ATOM 795 CG TYR A 130 1.650 4.778 7.801 1.00 0.00 C ATOM 796 CD1 TYR A 130 2.044 4.513 6.500 1.00 0.00 C ATOM 797 CD2 TYR A 130 2.559 5.410 8.641 1.00 0.00 C ATOM 798 CE1 TYR A 130 3.301 4.856 6.054 1.00 0.00 C ATOM 799 CE2 TYR A 130 3.816 5.756 8.200 1.00 0.00 C ATOM 800 CZ TYR A 130 4.182 5.477 6.909 1.00 0.00 C ATOM 801 OH TYR A 130 5.437 5.818 6.469 1.00 0.00 O ATOM 0 H TYR A 130 0.865 4.008 10.692 1.00 0.00 H new ATOM 0 HA TYR A 130 -0.073 6.298 9.208 1.00 0.00 H new ATOM 0 HB2 TYR A 130 0.281 3.350 8.597 1.00 0.00 H new ATOM 0 HB3 TYR A 130 -0.429 4.462 7.443 1.00 0.00 H new ATOM 0 HD1 TYR A 130 1.354 4.029 5.824 1.00 0.00 H new ATOM 0 HD2 TYR A 130 2.274 5.634 9.658 1.00 0.00 H new ATOM 0 HE1 TYR A 130 3.594 4.638 5.037 1.00 0.00 H new ATOM 0 HE2 TYR A 130 4.510 6.245 8.868 1.00 0.00 H new ATOM 0 HH TYR A 130 5.748 6.613 6.951 1.00 0.00 H new ATOM 811 N MET A 131 -2.171 4.129 10.433 1.00 0.00 N ATOM 812 CA MET A 131 -3.584 3.807 10.607 1.00 0.00 C ATOM 813 C MET A 131 -4.316 4.909 11.374 1.00 0.00 C ATOM 814 O MET A 131 -5.545 4.910 11.451 1.00 0.00 O ATOM 815 CB MET A 131 -3.748 2.470 11.339 1.00 0.00 C ATOM 816 CG MET A 131 -3.253 1.252 10.563 1.00 0.00 C ATOM 817 SD MET A 131 -4.501 0.514 9.480 1.00 0.00 S ATOM 818 CE MET A 131 -4.554 1.676 8.121 1.00 0.00 C ATOM 0 H MET A 131 -1.538 3.586 11.021 1.00 0.00 H new ATOM 0 HA MET A 131 -4.026 3.727 9.614 1.00 0.00 H new ATOM 0 HB2 MET A 131 -3.212 2.522 12.287 1.00 0.00 H new ATOM 0 HB3 MET A 131 -4.802 2.328 11.576 1.00 0.00 H new ATOM 0 HG2 MET A 131 -2.391 1.542 9.962 1.00 0.00 H new ATOM 0 HG3 MET A 131 -2.909 0.498 11.271 1.00 0.00 H new ATOM 0 HE1 MET A 131 -4.767 1.143 7.195 1.00 0.00 H new ATOM 0 HE2 MET A 131 -5.335 2.414 8.303 1.00 0.00 H new ATOM 0 HE3 MET A 131 -3.592 2.181 8.036 1.00 0.00 H new ATOM 828 N GLN A 132 -3.563 5.849 11.938 1.00 0.00 N ATOM 829 CA GLN A 132 -4.163 6.932 12.707 1.00 0.00 C ATOM 830 C GLN A 132 -4.282 8.203 11.867 1.00 0.00 C ATOM 831 O GLN A 132 -5.006 9.130 12.237 1.00 0.00 O ATOM 832 CB GLN A 132 -3.354 7.217 13.974 1.00 0.00 C ATOM 833 CG GLN A 132 -1.973 7.773 13.697 1.00 0.00 C ATOM 834 CD GLN A 132 -1.223 8.143 14.956 1.00 0.00 C ATOM 835 OE1 GLN A 132 -1.408 7.539 16.010 1.00 0.00 O ATOM 836 NE2 GLN A 132 -0.373 9.148 14.853 1.00 0.00 N ATOM 0 H GLN A 132 -2.545 5.882 11.878 1.00 0.00 H new ATOM 0 HA GLN A 132 -5.164 6.613 12.996 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -3.904 7.924 14.595 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -3.258 6.296 14.549 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -1.395 7.036 13.140 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -2.063 8.654 13.062 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -0.250 9.622 13.958 1.00 0.00 H new ATOM 0 HE22 GLN A 132 0.161 9.450 15.668 1.00 0.00 H new ATOM 845 N GLU A 133 -3.574 8.250 10.741 1.00 0.00 N ATOM 846 CA GLU A 133 -3.635 9.408 9.869 1.00 0.00 C ATOM 847 C GLU A 133 -4.789 9.227 8.904 1.00 0.00 C ATOM 848 O GLU A 133 -4.803 8.279 8.117 1.00 0.00 O ATOM 849 CB GLU A 133 -2.326 9.591 9.096 1.00 0.00 C ATOM 850 CG GLU A 133 -1.096 9.255 9.916 1.00 0.00 C ATOM 851 CD GLU A 133 0.140 10.002 9.485 1.00 0.00 C ATOM 852 OE1 GLU A 133 0.761 9.603 8.489 1.00 0.00 O ATOM 853 OE2 GLU A 133 0.499 10.996 10.153 1.00 0.00 O ATOM 0 H GLU A 133 -2.958 7.504 10.418 1.00 0.00 H new ATOM 0 HA GLU A 133 -3.787 10.302 10.474 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -2.345 8.961 8.207 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -2.255 10.623 8.753 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -1.297 9.476 10.964 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -0.905 8.184 9.847 1.00 0.00 H new ATOM 860 N PRO A 134 -5.768 10.141 8.950 1.00 0.00 N ATOM 861 CA PRO A 134 -7.013 10.019 8.185 1.00 0.00 C ATOM 862 C PRO A 134 -6.765 9.865 6.693 1.00 0.00 C ATOM 863 O PRO A 134 -7.590 9.309 5.974 1.00 0.00 O ATOM 864 CB PRO A 134 -7.758 11.328 8.476 1.00 0.00 C ATOM 865 CG PRO A 134 -6.734 12.251 9.044 1.00 0.00 C ATOM 866 CD PRO A 134 -5.736 11.380 9.745 1.00 0.00 C ATOM 0 HA PRO A 134 -7.574 9.130 8.473 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -8.197 11.740 7.567 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -8.575 11.167 9.180 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -6.257 12.836 8.258 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -7.189 12.959 9.737 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -4.743 11.829 9.754 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -6.014 11.201 10.784 1.00 0.00 H new ATOM 874 N LEU A 135 -5.607 10.325 6.242 1.00 0.00 N ATOM 875 CA LEU A 135 -5.260 10.265 4.832 1.00 0.00 C ATOM 876 C LEU A 135 -4.949 8.833 4.425 1.00 0.00 C ATOM 877 O LEU A 135 -5.379 8.365 3.371 1.00 0.00 O ATOM 878 CB LEU A 135 -4.062 11.166 4.512 1.00 0.00 C ATOM 879 CG LEU A 135 -4.274 12.665 4.744 1.00 0.00 C ATOM 880 CD1 LEU A 135 -4.108 13.024 6.212 1.00 0.00 C ATOM 881 CD2 LEU A 135 -3.321 13.477 3.883 1.00 0.00 C ATOM 0 H LEU A 135 -4.891 10.745 6.835 1.00 0.00 H new ATOM 0 HA LEU A 135 -6.119 10.624 4.265 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -3.215 10.840 5.116 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -3.786 11.015 3.468 1.00 0.00 H new ATOM 0 HG LEU A 135 -5.296 12.908 4.455 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -4.264 14.095 6.345 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -4.838 12.474 6.806 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -3.102 12.761 6.539 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -3.486 14.540 4.061 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -2.293 13.222 4.138 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -3.500 13.253 2.831 1.00 0.00 H new ATOM 893 N PHE A 136 -4.219 8.125 5.278 1.00 0.00 N ATOM 894 CA PHE A 136 -3.846 6.752 4.986 1.00 0.00 C ATOM 895 C PHE A 136 -5.040 5.845 5.219 1.00 0.00 C ATOM 896 O PHE A 136 -5.188 4.815 4.565 1.00 0.00 O ATOM 897 CB PHE A 136 -2.677 6.312 5.861 1.00 0.00 C ATOM 898 CG PHE A 136 -1.981 5.078 5.361 1.00 0.00 C ATOM 899 CD1 PHE A 136 -1.048 5.164 4.341 1.00 0.00 C ATOM 900 CD2 PHE A 136 -2.249 3.839 5.918 1.00 0.00 C ATOM 901 CE1 PHE A 136 -0.394 4.039 3.884 1.00 0.00 C ATOM 902 CE2 PHE A 136 -1.599 2.707 5.463 1.00 0.00 C ATOM 903 CZ PHE A 136 -0.668 2.809 4.446 1.00 0.00 C ATOM 0 H PHE A 136 -3.877 8.478 6.171 1.00 0.00 H new ATOM 0 HA PHE A 136 -3.535 6.686 3.943 1.00 0.00 H new ATOM 0 HB2 PHE A 136 -1.955 7.126 5.924 1.00 0.00 H new ATOM 0 HB3 PHE A 136 -3.040 6.129 6.872 1.00 0.00 H new ATOM 0 HD1 PHE A 136 -0.830 6.124 3.898 1.00 0.00 H new ATOM 0 HD2 PHE A 136 -2.973 3.756 6.715 1.00 0.00 H new ATOM 0 HE1 PHE A 136 0.331 4.121 3.088 1.00 0.00 H new ATOM 0 HE2 PHE A 136 -1.818 1.745 5.901 1.00 0.00 H new ATOM 0 HZ PHE A 136 -0.156 1.927 4.092 1.00 0.00 H new ATOM 913 N VAL A 137 -5.891 6.247 6.151 1.00 0.00 N ATOM 914 CA VAL A 137 -7.120 5.522 6.422 1.00 0.00 C ATOM 915 C VAL A 137 -8.000 5.505 5.181 1.00 0.00 C ATOM 916 O VAL A 137 -8.532 4.465 4.807 1.00 0.00 O ATOM 917 CB VAL A 137 -7.897 6.144 7.601 1.00 0.00 C ATOM 918 CG1 VAL A 137 -9.175 5.364 7.880 1.00 0.00 C ATOM 919 CG2 VAL A 137 -7.024 6.197 8.843 1.00 0.00 C ATOM 0 H VAL A 137 -5.751 7.073 6.733 1.00 0.00 H new ATOM 0 HA VAL A 137 -6.850 4.502 6.695 1.00 0.00 H new ATOM 0 HB VAL A 137 -8.174 7.162 7.327 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -9.705 5.821 8.715 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -9.811 5.378 6.995 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -8.925 4.333 8.130 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -7.587 6.638 9.665 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -6.716 5.187 9.115 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -6.141 6.803 8.641 1.00 0.00 H new ATOM 929 N GLU A 138 -8.124 6.657 4.526 1.00 0.00 N ATOM 930 CA GLU A 138 -8.909 6.749 3.300 1.00 0.00 C ATOM 931 C GLU A 138 -8.238 5.967 2.184 1.00 0.00 C ATOM 932 O GLU A 138 -8.902 5.276 1.417 1.00 0.00 O ATOM 933 CB GLU A 138 -9.091 8.203 2.868 1.00 0.00 C ATOM 934 CG GLU A 138 -9.783 9.060 3.906 1.00 0.00 C ATOM 935 CD GLU A 138 -10.151 10.425 3.373 1.00 0.00 C ATOM 936 OE1 GLU A 138 -11.347 10.645 3.082 1.00 0.00 O ATOM 937 OE2 GLU A 138 -9.251 11.281 3.237 1.00 0.00 O ATOM 0 H GLU A 138 -7.694 7.533 4.822 1.00 0.00 H new ATOM 0 HA GLU A 138 -9.891 6.322 3.502 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -8.114 8.633 2.646 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -9.668 8.229 1.944 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -10.684 8.552 4.250 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -9.131 9.175 4.772 1.00 0.00 H new ATOM 944 N PHE A 139 -6.917 6.083 2.109 1.00 0.00 N ATOM 945 CA PHE A 139 -6.133 5.366 1.114 1.00 0.00 C ATOM 946 C PHE A 139 -6.376 3.869 1.236 1.00 0.00 C ATOM 947 O PHE A 139 -6.706 3.194 0.257 1.00 0.00 O ATOM 948 CB PHE A 139 -4.647 5.683 1.306 1.00 0.00 C ATOM 949 CG PHE A 139 -3.727 4.912 0.402 1.00 0.00 C ATOM 950 CD1 PHE A 139 -3.571 5.273 -0.925 1.00 0.00 C ATOM 951 CD2 PHE A 139 -3.014 3.829 0.886 1.00 0.00 C ATOM 952 CE1 PHE A 139 -2.719 4.566 -1.753 1.00 0.00 C ATOM 953 CE2 PHE A 139 -2.162 3.118 0.063 1.00 0.00 C ATOM 954 CZ PHE A 139 -2.015 3.487 -1.259 1.00 0.00 C ATOM 0 H PHE A 139 -6.364 6.672 2.732 1.00 0.00 H new ATOM 0 HA PHE A 139 -6.438 5.685 0.117 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -4.491 6.749 1.140 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -4.375 5.478 2.341 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -4.121 6.116 -1.318 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -3.125 3.536 1.920 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -2.604 4.858 -2.786 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -1.612 2.275 0.453 1.00 0.00 H new ATOM 0 HZ PHE A 139 -1.351 2.932 -1.905 1.00 0.00 H new ATOM 964 N ALA A 140 -6.239 3.369 2.454 1.00 0.00 N ATOM 965 CA ALA A 140 -6.442 1.962 2.736 1.00 0.00 C ATOM 966 C ALA A 140 -7.888 1.559 2.490 1.00 0.00 C ATOM 967 O ALA A 140 -8.161 0.554 1.836 1.00 0.00 O ATOM 968 CB ALA A 140 -6.044 1.658 4.171 1.00 0.00 C ATOM 0 H ALA A 140 -5.985 3.926 3.270 1.00 0.00 H new ATOM 0 HA ALA A 140 -5.812 1.382 2.062 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -6.200 0.599 4.375 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -4.992 1.905 4.317 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -6.654 2.252 4.851 1.00 0.00 H new ATOM 974 N ASP A 141 -8.807 2.383 2.970 1.00 0.00 N ATOM 975 CA ASP A 141 -10.234 2.080 2.915 1.00 0.00 C ATOM 976 C ASP A 141 -10.706 1.991 1.474 1.00 0.00 C ATOM 977 O ASP A 141 -11.626 1.242 1.146 1.00 0.00 O ATOM 978 CB ASP A 141 -11.019 3.158 3.671 1.00 0.00 C ATOM 979 CG ASP A 141 -12.513 2.925 3.663 1.00 0.00 C ATOM 980 OD1 ASP A 141 -12.965 1.926 4.260 1.00 0.00 O ATOM 981 OD2 ASP A 141 -13.244 3.755 3.083 1.00 0.00 O ATOM 0 H ASP A 141 -8.589 3.278 3.408 1.00 0.00 H new ATOM 0 HA ASP A 141 -10.409 1.114 3.389 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -10.670 3.196 4.703 1.00 0.00 H new ATOM 0 HB3 ASP A 141 -10.807 4.131 3.227 1.00 0.00 H new ATOM 986 N CYS A 142 -10.045 2.744 0.613 1.00 0.00 N ATOM 987 CA CYS A 142 -10.379 2.767 -0.795 1.00 0.00 C ATOM 988 C CYS A 142 -9.734 1.599 -1.539 1.00 0.00 C ATOM 989 O CYS A 142 -10.408 0.889 -2.283 1.00 0.00 O ATOM 990 CB CYS A 142 -9.942 4.095 -1.404 1.00 0.00 C ATOM 991 SG CYS A 142 -10.888 5.516 -0.812 1.00 0.00 S ATOM 0 H CYS A 142 -9.267 3.352 0.870 1.00 0.00 H new ATOM 0 HA CYS A 142 -11.459 2.663 -0.894 1.00 0.00 H new ATOM 0 HB2 CYS A 142 -8.887 4.255 -1.183 1.00 0.00 H new ATOM 0 HB3 CYS A 142 -10.035 4.035 -2.488 1.00 0.00 H new ATOM 0 HG CYS A 142 -10.401 5.919 0.324 1.00 0.00 H new ATOM 997 N CYS A 143 -8.437 1.378 -1.314 1.00 0.00 N ATOM 998 CA CYS A 143 -7.704 0.356 -2.057 1.00 0.00 C ATOM 999 C CYS A 143 -8.262 -1.038 -1.784 1.00 0.00 C ATOM 1000 O CYS A 143 -8.270 -1.892 -2.669 1.00 0.00 O ATOM 1001 CB CYS A 143 -6.208 0.408 -1.727 1.00 0.00 C ATOM 1002 SG CYS A 143 -5.808 0.083 0.006 1.00 0.00 S ATOM 0 H CYS A 143 -7.879 1.889 -0.630 1.00 0.00 H new ATOM 0 HA CYS A 143 -7.832 0.567 -3.119 1.00 0.00 H new ATOM 0 HB2 CYS A 143 -5.687 -0.319 -2.349 1.00 0.00 H new ATOM 0 HB3 CYS A 143 -5.824 1.392 -1.997 1.00 0.00 H new ATOM 0 HG CYS A 143 -6.893 0.139 0.720 1.00 0.00 H new ATOM 1008 N LEU A 144 -8.762 -1.251 -0.570 1.00 0.00 N ATOM 1009 CA LEU A 144 -9.300 -2.550 -0.180 1.00 0.00 C ATOM 1010 C LEU A 144 -10.551 -2.891 -0.986 1.00 0.00 C ATOM 1011 O LEU A 144 -10.867 -4.062 -1.194 1.00 0.00 O ATOM 1012 CB LEU A 144 -9.614 -2.570 1.317 1.00 0.00 C ATOM 1013 CG LEU A 144 -8.417 -2.294 2.230 1.00 0.00 C ATOM 1014 CD1 LEU A 144 -8.820 -2.387 3.691 1.00 0.00 C ATOM 1015 CD2 LEU A 144 -7.276 -3.249 1.923 1.00 0.00 C ATOM 0 H LEU A 144 -8.806 -0.540 0.160 1.00 0.00 H new ATOM 0 HA LEU A 144 -8.543 -3.305 -0.392 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -10.387 -1.829 1.521 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -10.031 -3.544 1.573 1.00 0.00 H new ATOM 0 HG LEU A 144 -8.071 -1.278 2.039 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -7.953 -2.187 4.321 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -9.598 -1.653 3.901 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -9.198 -3.387 3.901 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -6.435 -3.036 2.583 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -7.609 -4.275 2.079 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -6.964 -3.122 0.886 1.00 0.00 H new ATOM 1027 N GLY A 145 -11.253 -1.864 -1.443 1.00 0.00 N ATOM 1028 CA GLY A 145 -12.431 -2.076 -2.262 1.00 0.00 C ATOM 1029 C GLY A 145 -12.083 -2.228 -3.729 1.00 0.00 C ATOM 1030 O GLY A 145 -12.907 -2.662 -4.532 1.00 0.00 O ATOM 0 H GLY A 145 -11.028 -0.886 -1.261 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -12.955 -2.968 -1.919 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -13.115 -1.237 -2.137 1.00 0.00 H new ATOM 1034 N ILE A 146 -10.864 -1.852 -4.085 1.00 0.00 N ATOM 1035 CA ILE A 146 -10.407 -1.958 -5.459 1.00 0.00 C ATOM 1036 C ILE A 146 -9.716 -3.301 -5.702 1.00 0.00 C ATOM 1037 O ILE A 146 -9.952 -3.959 -6.717 1.00 0.00 O ATOM 1038 CB ILE A 146 -9.435 -0.811 -5.814 1.00 0.00 C ATOM 1039 CG1 ILE A 146 -10.021 0.535 -5.387 1.00 0.00 C ATOM 1040 CG2 ILE A 146 -9.149 -0.804 -7.309 1.00 0.00 C ATOM 1041 CD1 ILE A 146 -9.054 1.692 -5.517 1.00 0.00 C ATOM 0 H ILE A 146 -10.173 -1.470 -3.439 1.00 0.00 H new ATOM 0 HA ILE A 146 -11.286 -1.886 -6.099 1.00 0.00 H new ATOM 0 HB ILE A 146 -8.500 -0.973 -5.278 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -10.905 0.743 -5.990 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -10.351 0.464 -4.351 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -8.463 0.009 -7.544 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -8.699 -1.754 -7.598 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -10.081 -0.663 -7.857 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -9.542 2.612 -5.196 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -8.180 1.508 -4.892 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -8.743 1.791 -6.557 1.00 0.00 H new ATOM 1053 N VAL A 147 -8.879 -3.718 -4.754 1.00 0.00 N ATOM 1054 CA VAL A 147 -8.077 -4.929 -4.921 1.00 0.00 C ATOM 1055 C VAL A 147 -8.795 -6.161 -4.395 1.00 0.00 C ATOM 1056 O VAL A 147 -8.202 -7.238 -4.325 1.00 0.00 O ATOM 1057 CB VAL A 147 -6.711 -4.821 -4.206 1.00 0.00 C ATOM 1058 CG1 VAL A 147 -5.940 -3.612 -4.696 1.00 0.00 C ATOM 1059 CG2 VAL A 147 -6.888 -4.773 -2.696 1.00 0.00 C ATOM 0 H VAL A 147 -8.739 -3.237 -3.865 1.00 0.00 H new ATOM 0 HA VAL A 147 -7.917 -5.031 -5.994 1.00 0.00 H new ATOM 0 HB VAL A 147 -6.134 -5.713 -4.449 1.00 0.00 H new ATOM 0 HG11 VAL A 147 -4.982 -3.557 -4.179 1.00 0.00 H new ATOM 0 HG12 VAL A 147 -5.768 -3.700 -5.769 1.00 0.00 H new ATOM 0 HG13 VAL A 147 -6.514 -2.708 -4.494 1.00 0.00 H new ATOM 0 HG21 VAL A 147 -5.912 -4.697 -2.217 1.00 0.00 H new ATOM 0 HG22 VAL A 147 -7.492 -3.906 -2.428 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -7.387 -5.681 -2.359 1.00 0.00 H new ATOM 1069 N GLU A 148 -10.059 -6.006 -4.024 1.00 0.00 N ATOM 1070 CA GLU A 148 -10.835 -7.125 -3.513 1.00 0.00 C ATOM 1071 C GLU A 148 -10.900 -8.250 -4.548 1.00 0.00 C ATOM 1072 O GLU A 148 -11.360 -8.053 -5.677 1.00 0.00 O ATOM 1073 CB GLU A 148 -12.249 -6.686 -3.106 1.00 0.00 C ATOM 1074 CG GLU A 148 -13.051 -6.032 -4.220 1.00 0.00 C ATOM 1075 CD GLU A 148 -14.525 -5.935 -3.885 1.00 0.00 C ATOM 1076 OE1 GLU A 148 -15.267 -6.896 -4.185 1.00 0.00 O ATOM 1077 OE2 GLU A 148 -14.952 -4.911 -3.316 1.00 0.00 O ATOM 0 H GLU A 148 -10.565 -5.122 -4.067 1.00 0.00 H new ATOM 0 HA GLU A 148 -10.332 -7.499 -2.621 1.00 0.00 H new ATOM 0 HB2 GLU A 148 -12.796 -7.557 -2.744 1.00 0.00 H new ATOM 0 HB3 GLU A 148 -12.173 -5.988 -2.272 1.00 0.00 H new ATOM 0 HG2 GLU A 148 -12.657 -5.034 -4.410 1.00 0.00 H new ATOM 0 HG3 GLU A 148 -12.926 -6.605 -5.139 1.00 0.00 H new ATOM 1084 N PRO A 149 -10.389 -9.435 -4.182 1.00 0.00 N ATOM 1085 CA PRO A 149 -10.380 -10.600 -5.067 1.00 0.00 C ATOM 1086 C PRO A 149 -11.786 -11.128 -5.319 1.00 0.00 C ATOM 1087 O PRO A 149 -12.055 -11.697 -6.377 1.00 0.00 O ATOM 1088 CB PRO A 149 -9.537 -11.628 -4.305 1.00 0.00 C ATOM 1089 CG PRO A 149 -9.630 -11.219 -2.877 1.00 0.00 C ATOM 1090 CD PRO A 149 -9.762 -9.722 -2.880 1.00 0.00 C ATOM 0 HA PRO A 149 -9.980 -10.367 -6.054 1.00 0.00 H new ATOM 0 HB2 PRO A 149 -9.919 -12.638 -4.452 1.00 0.00 H new ATOM 0 HB3 PRO A 149 -8.503 -11.624 -4.650 1.00 0.00 H new ATOM 0 HG2 PRO A 149 -10.488 -11.685 -2.393 1.00 0.00 H new ATOM 0 HG3 PRO A 149 -8.744 -11.531 -2.324 1.00 0.00 H new ATOM 0 HD2 PRO A 149 -10.378 -9.372 -2.052 1.00 0.00 H new ATOM 0 HD3 PRO A 149 -8.792 -9.233 -2.785 1.00 0.00 H new ATOM 1098 N SER A 150 -12.670 -10.922 -4.344 1.00 0.00 N ATOM 1099 CA SER A 150 -14.081 -11.265 -4.482 1.00 0.00 C ATOM 1100 C SER A 150 -14.247 -12.714 -4.935 1.00 0.00 C ATOM 1101 O SER A 150 -14.714 -12.986 -6.043 1.00 0.00 O ATOM 1102 CB SER A 150 -14.752 -10.306 -5.474 1.00 0.00 C ATOM 1103 OG SER A 150 -16.160 -10.459 -5.474 1.00 0.00 O ATOM 0 H SER A 150 -12.428 -10.514 -3.441 1.00 0.00 H new ATOM 0 HA SER A 150 -14.564 -11.164 -3.510 1.00 0.00 H new ATOM 0 HB2 SER A 150 -14.497 -9.278 -5.217 1.00 0.00 H new ATOM 0 HB3 SER A 150 -14.365 -10.489 -6.477 1.00 0.00 H new ATOM 0 HG SER A 150 -16.557 -9.833 -6.115 1.00 0.00 H new ATOM 1109 N GLN A 151 -13.853 -13.640 -4.075 1.00 0.00 N ATOM 1110 CA GLN A 151 -13.905 -15.056 -4.408 1.00 0.00 C ATOM 1111 C GLN A 151 -14.985 -15.746 -3.592 1.00 0.00 C ATOM 1112 O GLN A 151 -14.862 -16.921 -3.247 1.00 0.00 O ATOM 1113 CB GLN A 151 -12.555 -15.714 -4.143 1.00 0.00 C ATOM 1114 CG GLN A 151 -11.402 -15.074 -4.891 1.00 0.00 C ATOM 1115 CD GLN A 151 -10.062 -15.603 -4.428 1.00 0.00 C ATOM 1116 OE1 GLN A 151 -9.457 -15.064 -3.503 1.00 0.00 O ATOM 1117 NE2 GLN A 151 -9.595 -16.665 -5.063 1.00 0.00 N ATOM 0 H GLN A 151 -13.494 -13.437 -3.142 1.00 0.00 H new ATOM 0 HA GLN A 151 -14.142 -15.154 -5.467 1.00 0.00 H new ATOM 0 HB2 GLN A 151 -12.347 -15.676 -3.074 1.00 0.00 H new ATOM 0 HB3 GLN A 151 -12.615 -16.767 -4.419 1.00 0.00 H new ATOM 0 HG2 GLN A 151 -11.515 -15.259 -5.959 1.00 0.00 H new ATOM 0 HG3 GLN A 151 -11.434 -13.994 -4.750 1.00 0.00 H new ATOM 0 HE21 GLN A 151 -10.131 -17.080 -5.825 1.00 0.00 H new ATOM 0 HE22 GLN A 151 -8.699 -17.069 -4.790 1.00 0.00 H new ATOM 1126 N ASN A 152 -16.042 -14.995 -3.294 1.00 0.00 N ATOM 1127 CA ASN A 152 -17.148 -15.466 -2.475 1.00 0.00 C ATOM 1128 C ASN A 152 -16.673 -15.803 -1.069 1.00 0.00 C ATOM 1129 O ASN A 152 -17.289 -16.594 -0.353 1.00 0.00 O ATOM 1130 CB ASN A 152 -17.819 -16.667 -3.122 1.00 0.00 C ATOM 1131 CG ASN A 152 -18.370 -16.357 -4.500 1.00 0.00 C ATOM 1132 OD1 ASN A 152 -19.513 -15.922 -4.650 1.00 0.00 O ATOM 1133 ND2 ASN A 152 -17.561 -16.591 -5.522 1.00 0.00 N ATOM 0 H ASN A 152 -16.153 -14.034 -3.619 1.00 0.00 H new ATOM 0 HA ASN A 152 -17.883 -14.665 -2.400 1.00 0.00 H new ATOM 0 HB2 ASN A 152 -17.100 -17.483 -3.198 1.00 0.00 H new ATOM 0 HB3 ASN A 152 -18.629 -17.015 -2.481 1.00 0.00 H new ATOM 0 HD21 ASN A 152 -17.878 -16.411 -6.475 1.00 0.00 H new ATOM 0 HD22 ASN A 152 -16.621 -16.951 -5.356 1.00 0.00 H new ATOM 1140 N GLU A 153 -15.578 -15.177 -0.680 1.00 0.00 N ATOM 1141 CA GLU A 153 -14.978 -15.397 0.626 1.00 0.00 C ATOM 1142 C GLU A 153 -15.148 -14.175 1.518 1.00 0.00 C ATOM 1143 O GLU A 153 -15.472 -13.084 1.045 1.00 0.00 O ATOM 1144 CB GLU A 153 -13.497 -15.769 0.481 1.00 0.00 C ATOM 1145 CG GLU A 153 -12.785 -15.110 -0.696 1.00 0.00 C ATOM 1146 CD GLU A 153 -12.551 -13.623 -0.525 1.00 0.00 C ATOM 1147 OE1 GLU A 153 -11.674 -13.245 0.282 1.00 0.00 O ATOM 1148 OE2 GLU A 153 -13.213 -12.829 -1.227 1.00 0.00 O ATOM 0 H GLU A 153 -15.078 -14.502 -1.259 1.00 0.00 H new ATOM 0 HA GLU A 153 -15.495 -16.230 1.102 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -12.977 -15.498 1.400 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -13.417 -16.851 0.376 1.00 0.00 H new ATOM 0 HG2 GLU A 153 -11.825 -15.603 -0.848 1.00 0.00 H new ATOM 0 HG3 GLU A 153 -13.373 -15.273 -1.599 1.00 0.00 H new ATOM 1155 N GLU A 154 -14.941 -14.369 2.812 1.00 0.00 N ATOM 1156 CA GLU A 154 -15.129 -13.311 3.780 1.00 0.00 C ATOM 1157 C GLU A 154 -13.800 -12.664 4.126 1.00 0.00 C ATOM 1158 O GLU A 154 -12.874 -13.326 4.599 1.00 0.00 O ATOM 1159 CB GLU A 154 -15.786 -13.844 5.051 1.00 0.00 C ATOM 1160 CG GLU A 154 -17.141 -14.487 4.824 1.00 0.00 C ATOM 1161 CD GLU A 154 -17.865 -14.768 6.123 1.00 0.00 C ATOM 1162 OE1 GLU A 154 -17.579 -15.800 6.764 1.00 0.00 O ATOM 1163 OE2 GLU A 154 -18.721 -13.948 6.514 1.00 0.00 O ATOM 0 H GLU A 154 -14.641 -15.258 3.213 1.00 0.00 H new ATOM 0 HA GLU A 154 -15.785 -12.564 3.334 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -15.121 -14.575 5.512 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -15.899 -13.024 5.760 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -17.753 -13.832 4.203 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -17.012 -15.419 4.273 1.00 0.00 H new ATOM 1170 N SER A 155 -13.722 -11.378 3.875 1.00 0.00 N ATOM 1171 CA SER A 155 -12.548 -10.594 4.205 1.00 0.00 C ATOM 1172 C SER A 155 -12.489 -10.345 5.711 1.00 0.00 C ATOM 1173 O SER A 155 -13.362 -9.616 6.227 1.00 0.00 O ATOM 1174 CB SER A 155 -12.587 -9.271 3.442 1.00 0.00 C ATOM 1175 OG SER A 155 -12.765 -9.503 2.052 1.00 0.00 O ATOM 1176 OXT SER A 155 -11.580 -10.887 6.373 1.00 0.00 O ATOM 0 H SER A 155 -14.470 -10.842 3.436 1.00 0.00 H new ATOM 0 HA SER A 155 -11.652 -11.143 3.914 1.00 0.00 H new ATOM 0 HB2 SER A 155 -13.399 -8.650 3.820 1.00 0.00 H new ATOM 0 HB3 SER A 155 -11.661 -8.721 3.609 1.00 0.00 H new ATOM 0 HG SER A 155 -12.790 -8.646 1.578 1.00 0.00 H new TER 1182 SER A 155 ATOM 1183 N ASP B 462 -9.868 -9.086 7.300 1.00 0.00 N ATOM 1184 CA ASP B 462 -8.895 -9.354 8.381 1.00 0.00 C ATOM 1185 C ASP B 462 -7.811 -8.299 8.382 1.00 0.00 C ATOM 1186 O ASP B 462 -7.110 -8.108 7.391 1.00 0.00 O ATOM 1187 CB ASP B 462 -8.284 -10.739 8.216 1.00 0.00 C ATOM 1188 CG ASP B 462 -7.043 -10.922 9.051 1.00 0.00 C ATOM 1189 OD1 ASP B 462 -7.157 -11.325 10.225 1.00 0.00 O ATOM 1190 OD2 ASP B 462 -5.945 -10.672 8.531 1.00 0.00 O ATOM 0 HA ASP B 462 -9.419 -9.319 9.336 1.00 0.00 H new ATOM 0 HB2 ASP B 462 -9.020 -11.493 8.494 1.00 0.00 H new ATOM 0 HB3 ASP B 462 -8.040 -10.903 7.166 1.00 0.00 H new ATOM 1197 N ILE B 463 -7.667 -7.645 9.520 1.00 0.00 N ATOM 1198 CA ILE B 463 -6.847 -6.447 9.632 1.00 0.00 C ATOM 1199 C ILE B 463 -5.373 -6.723 9.361 1.00 0.00 C ATOM 1200 O ILE B 463 -4.696 -5.894 8.758 1.00 0.00 O ATOM 1201 CB ILE B 463 -6.993 -5.787 11.021 1.00 0.00 C ATOM 1202 CG1 ILE B 463 -8.472 -5.576 11.354 1.00 0.00 C ATOM 1203 CG2 ILE B 463 -6.246 -4.457 11.062 1.00 0.00 C ATOM 1204 CD1 ILE B 463 -8.710 -5.033 12.745 1.00 0.00 C ATOM 0 H ILE B 463 -8.113 -7.927 10.393 1.00 0.00 H new ATOM 0 HA ILE B 463 -7.214 -5.763 8.867 1.00 0.00 H new ATOM 0 HB ILE B 463 -6.557 -6.451 11.768 1.00 0.00 H new ATOM 0 HG12 ILE B 463 -8.905 -4.889 10.626 1.00 0.00 H new ATOM 0 HG13 ILE B 463 -8.998 -6.525 11.249 1.00 0.00 H new ATOM 0 HG21 ILE B 463 -6.360 -4.006 12.048 1.00 0.00 H new ATOM 0 HG22 ILE B 463 -5.188 -4.627 10.861 1.00 0.00 H new ATOM 0 HG23 ILE B 463 -6.656 -3.786 10.307 1.00 0.00 H new ATOM 0 HD11 ILE B 463 -9.780 -4.910 12.909 1.00 0.00 H new ATOM 0 HD12 ILE B 463 -8.308 -5.729 13.481 1.00 0.00 H new ATOM 0 HD13 ILE B 463 -8.213 -4.068 12.849 1.00 0.00 H new ATOM 1216 N ARG B 464 -4.865 -7.882 9.774 1.00 0.00 N ATOM 1217 CA ARG B 464 -3.437 -8.140 9.603 1.00 0.00 C ATOM 1218 C ARG B 464 -3.121 -8.457 8.147 1.00 0.00 C ATOM 1219 O ARG B 464 -2.026 -8.174 7.665 1.00 0.00 O ATOM 1220 CB ARG B 464 -2.902 -9.225 10.569 1.00 0.00 C ATOM 1221 CG ARG B 464 -3.599 -10.584 10.536 1.00 0.00 C ATOM 1222 CD ARG B 464 -3.251 -11.402 9.296 1.00 0.00 C ATOM 1223 NE ARG B 464 -1.822 -11.390 8.988 1.00 0.00 N ATOM 1224 CZ ARG B 464 -1.312 -11.811 7.829 1.00 0.00 C ATOM 1225 NH1 ARG B 464 -2.103 -12.367 6.914 1.00 0.00 N ATOM 1226 NH2 ARG B 464 -0.012 -11.691 7.592 1.00 0.00 N ATOM 0 H ARG B 464 -5.397 -8.633 10.214 1.00 0.00 H new ATOM 0 HA ARG B 464 -2.907 -7.226 9.871 1.00 0.00 H new ATOM 0 HB2 ARG B 464 -1.845 -9.380 10.353 1.00 0.00 H new ATOM 0 HB3 ARG B 464 -2.966 -8.836 11.585 1.00 0.00 H new ATOM 0 HG2 ARG B 464 -3.324 -11.149 11.426 1.00 0.00 H new ATOM 0 HG3 ARG B 464 -4.678 -10.434 10.575 1.00 0.00 H new ATOM 0 HD2 ARG B 464 -3.577 -12.432 9.443 1.00 0.00 H new ATOM 0 HD3 ARG B 464 -3.805 -11.011 8.442 1.00 0.00 H new ATOM 0 HE ARG B 464 -1.179 -11.040 9.698 1.00 0.00 H new ATOM 0 HH11 ARG B 464 -3.101 -12.472 7.098 1.00 0.00 H new ATOM 0 HH12 ARG B 464 -1.711 -12.688 6.029 1.00 0.00 H new ATOM 0 HH21 ARG B 464 0.599 -11.277 8.296 1.00 0.00 H new ATOM 0 HH22 ARG B 464 0.377 -12.013 6.706 1.00 0.00 H new ATOM 1240 N HIS B 465 -4.097 -9.024 7.448 1.00 0.00 N ATOM 1241 CA HIS B 465 -3.986 -9.253 6.016 1.00 0.00 C ATOM 1242 C HIS B 465 -4.188 -7.945 5.258 1.00 0.00 C ATOM 1243 O HIS B 465 -3.446 -7.628 4.333 1.00 0.00 O ATOM 1244 CB HIS B 465 -5.012 -10.309 5.568 1.00 0.00 C ATOM 1245 CG HIS B 465 -5.330 -10.288 4.103 1.00 0.00 C ATOM 1246 ND1 HIS B 465 -4.738 -11.123 3.187 1.00 0.00 N ATOM 1247 CD2 HIS B 465 -6.189 -9.510 3.402 1.00 0.00 C ATOM 1248 CE1 HIS B 465 -5.210 -10.857 1.985 1.00 0.00 C ATOM 1249 NE2 HIS B 465 -6.095 -9.884 2.089 1.00 0.00 N ATOM 0 H HIS B 465 -4.979 -9.335 7.855 1.00 0.00 H new ATOM 0 HA HIS B 465 -2.987 -9.628 5.792 1.00 0.00 H new ATOM 0 HB2 HIS B 465 -4.635 -11.297 5.830 1.00 0.00 H new ATOM 0 HB3 HIS B 465 -5.935 -10.161 6.129 1.00 0.00 H new ATOM 0 HD1 HIS B 465 -4.042 -11.837 3.403 1.00 0.00 H new ATOM 0 HD2 HIS B 465 -6.829 -8.738 3.804 1.00 0.00 H new ATOM 0 HE1 HIS B 465 -4.921 -11.352 1.070 1.00 0.00 H new ATOM 1258 N GLU B 466 -5.206 -7.194 5.654 1.00 0.00 N ATOM 1259 CA GLU B 466 -5.524 -5.935 4.998 1.00 0.00 C ATOM 1260 C GLU B 466 -4.379 -4.941 5.160 1.00 0.00 C ATOM 1261 O GLU B 466 -4.146 -4.113 4.287 1.00 0.00 O ATOM 1262 CB GLU B 466 -6.836 -5.368 5.551 1.00 0.00 C ATOM 1263 CG GLU B 466 -8.045 -6.231 5.210 1.00 0.00 C ATOM 1264 CD GLU B 466 -9.321 -5.773 5.887 1.00 0.00 C ATOM 1265 OE1 GLU B 466 -10.010 -4.894 5.333 1.00 0.00 O ATOM 1266 OE2 GLU B 466 -9.655 -6.304 6.966 1.00 0.00 O ATOM 0 H GLU B 466 -5.826 -7.436 6.427 1.00 0.00 H new ATOM 0 HA GLU B 466 -5.656 -6.117 3.931 1.00 0.00 H new ATOM 0 HB2 GLU B 466 -6.757 -5.273 6.634 1.00 0.00 H new ATOM 0 HB3 GLU B 466 -6.988 -4.365 5.154 1.00 0.00 H new ATOM 0 HG2 GLU B 466 -8.193 -6.225 4.130 1.00 0.00 H new ATOM 0 HG3 GLU B 466 -7.839 -7.262 5.498 1.00 0.00 H new ATOM 1273 N ARG B 467 -3.655 -5.050 6.270 1.00 0.00 N ATOM 1274 CA ARG B 467 -2.481 -4.219 6.505 1.00 0.00 C ATOM 1275 C ARG B 467 -1.392 -4.483 5.475 1.00 0.00 C ATOM 1276 O ARG B 467 -0.963 -3.563 4.790 1.00 0.00 O ATOM 1277 CB ARG B 467 -1.927 -4.442 7.912 1.00 0.00 C ATOM 1278 CG ARG B 467 -2.479 -3.477 8.945 1.00 0.00 C ATOM 1279 CD ARG B 467 -1.953 -3.790 10.338 1.00 0.00 C ATOM 1280 NE ARG B 467 -0.494 -3.920 10.366 1.00 0.00 N ATOM 1281 CZ ARG B 467 0.206 -4.227 11.458 1.00 0.00 C ATOM 1282 NH1 ARG B 467 -0.400 -4.367 12.630 1.00 0.00 N ATOM 1283 NH2 ARG B 467 1.521 -4.384 11.381 1.00 0.00 N ATOM 0 H ARG B 467 -3.862 -5.707 7.022 1.00 0.00 H new ATOM 0 HA ARG B 467 -2.799 -3.181 6.409 1.00 0.00 H new ATOM 0 HB2 ARG B 467 -2.152 -5.462 8.224 1.00 0.00 H new ATOM 0 HB3 ARG B 467 -0.841 -4.349 7.884 1.00 0.00 H new ATOM 0 HG2 ARG B 467 -2.207 -2.457 8.673 1.00 0.00 H new ATOM 0 HG3 ARG B 467 -3.568 -3.527 8.946 1.00 0.00 H new ATOM 0 HD2 ARG B 467 -2.258 -3.001 11.025 1.00 0.00 H new ATOM 0 HD3 ARG B 467 -2.405 -4.716 10.695 1.00 0.00 H new ATOM 0 HE ARG B 467 0.017 -3.766 9.497 1.00 0.00 H new ATOM 0 HH11 ARG B 467 -1.410 -4.240 12.701 1.00 0.00 H new ATOM 0 HH12 ARG B 467 0.144 -4.602 13.460 1.00 0.00 H new ATOM 0 HH21 ARG B 467 1.997 -4.270 10.486 1.00 0.00 H new ATOM 0 HH22 ARG B 467 2.056 -4.619 12.217 1.00 0.00 H new ATOM 1297 N ASN B 468 -0.974 -5.742 5.332 1.00 0.00 N ATOM 1298 CA ASN B 468 0.143 -6.076 4.447 1.00 0.00 C ATOM 1299 C ASN B 468 -0.278 -5.914 2.994 1.00 0.00 C ATOM 1300 O ASN B 468 0.546 -5.812 2.088 1.00 0.00 O ATOM 1301 CB ASN B 468 0.658 -7.502 4.700 1.00 0.00 C ATOM 1302 CG ASN B 468 -0.328 -8.582 4.294 1.00 0.00 C ATOM 1303 OD1 ASN B 468 -1.116 -9.056 5.104 1.00 0.00 O ATOM 1304 ND2 ASN B 468 -0.285 -8.987 3.035 1.00 0.00 N ATOM 0 H ASN B 468 -1.388 -6.541 5.813 1.00 0.00 H new ATOM 0 HA ASN B 468 0.961 -5.388 4.663 1.00 0.00 H new ATOM 0 HB2 ASN B 468 1.589 -7.646 4.152 1.00 0.00 H new ATOM 0 HB3 ASN B 468 0.891 -7.613 5.759 1.00 0.00 H new ATOM 0 HD21 ASN B 468 -0.921 -9.716 2.712 1.00 0.00 H new ATOM 0 HD22 ASN B 468 0.384 -8.570 2.388 1.00 0.00 H new ATOM 1311 N VAL B 469 -1.579 -5.899 2.794 1.00 0.00 N ATOM 1312 CA VAL B 469 -2.168 -5.715 1.484 1.00 0.00 C ATOM 1313 C VAL B 469 -2.032 -4.262 1.004 1.00 0.00 C ATOM 1314 O VAL B 469 -2.084 -3.984 -0.199 1.00 0.00 O ATOM 1315 CB VAL B 469 -3.641 -6.192 1.486 1.00 0.00 C ATOM 1316 CG1 VAL B 469 -4.537 -5.309 0.635 1.00 0.00 C ATOM 1317 CG2 VAL B 469 -3.703 -7.631 1.009 1.00 0.00 C ATOM 0 H VAL B 469 -2.263 -6.015 3.542 1.00 0.00 H new ATOM 0 HA VAL B 469 -1.619 -6.329 0.770 1.00 0.00 H new ATOM 0 HB VAL B 469 -4.015 -6.123 2.508 1.00 0.00 H new ATOM 0 HG11 VAL B 469 -5.559 -5.686 0.670 1.00 0.00 H new ATOM 0 HG12 VAL B 469 -4.513 -4.289 1.019 1.00 0.00 H new ATOM 0 HG13 VAL B 469 -4.183 -5.317 -0.396 1.00 0.00 H new ATOM 0 HG21 VAL B 469 -4.739 -7.970 1.009 1.00 0.00 H new ATOM 0 HG22 VAL B 469 -3.300 -7.697 -0.002 1.00 0.00 H new ATOM 0 HG23 VAL B 469 -3.115 -8.261 1.676 1.00 0.00 H new ATOM 1327 N ILE B 470 -1.813 -3.340 1.932 1.00 0.00 N ATOM 1328 CA ILE B 470 -1.697 -1.932 1.564 1.00 0.00 C ATOM 1329 C ILE B 470 -0.365 -1.727 0.870 1.00 0.00 C ATOM 1330 O ILE B 470 -0.236 -0.969 -0.086 1.00 0.00 O ATOM 1331 CB ILE B 470 -1.764 -0.998 2.789 1.00 0.00 C ATOM 1332 CG1 ILE B 470 -2.979 -1.323 3.661 1.00 0.00 C ATOM 1333 CG2 ILE B 470 -1.822 0.450 2.336 1.00 0.00 C ATOM 1334 CD1 ILE B 470 -4.303 -1.209 2.936 1.00 0.00 C ATOM 0 H ILE B 470 -1.713 -3.534 2.928 1.00 0.00 H new ATOM 0 HA ILE B 470 -2.534 -1.684 0.912 1.00 0.00 H new ATOM 0 HB ILE B 470 -0.865 -1.153 3.385 1.00 0.00 H new ATOM 0 HG12 ILE B 470 -2.875 -2.336 4.049 1.00 0.00 H new ATOM 0 HG13 ILE B 470 -2.987 -0.652 4.520 1.00 0.00 H new ATOM 0 HG21 ILE B 470 -1.869 1.102 3.208 1.00 0.00 H new ATOM 0 HG22 ILE B 470 -0.931 0.685 1.754 1.00 0.00 H new ATOM 0 HG23 ILE B 470 -2.708 0.603 1.720 1.00 0.00 H new ATOM 0 HD11 ILE B 470 -5.115 -1.455 3.620 1.00 0.00 H new ATOM 0 HD12 ILE B 470 -4.432 -0.190 2.571 1.00 0.00 H new ATOM 0 HD13 ILE B 470 -4.317 -1.900 2.093 1.00 0.00 H new ATOM 1346 N LEU B 471 0.607 -2.449 1.390 1.00 0.00 N ATOM 1347 CA LEU B 471 1.963 -2.494 0.889 1.00 0.00 C ATOM 1348 C LEU B 471 1.971 -2.782 -0.604 1.00 0.00 C ATOM 1349 O LEU B 471 2.657 -2.115 -1.375 1.00 0.00 O ATOM 1350 CB LEU B 471 2.704 -3.614 1.620 1.00 0.00 C ATOM 1351 CG LEU B 471 2.917 -3.456 3.138 1.00 0.00 C ATOM 1352 CD1 LEU B 471 4.055 -2.510 3.414 1.00 0.00 C ATOM 1353 CD2 LEU B 471 1.696 -2.953 3.881 1.00 0.00 C ATOM 0 H LEU B 471 0.466 -3.044 2.206 1.00 0.00 H new ATOM 0 HA LEU B 471 2.446 -1.532 1.059 1.00 0.00 H new ATOM 0 HB2 LEU B 471 2.159 -4.543 1.452 1.00 0.00 H new ATOM 0 HB3 LEU B 471 3.682 -3.730 1.154 1.00 0.00 H new ATOM 0 HG LEU B 471 3.137 -4.460 3.502 1.00 0.00 H new ATOM 0 HD11 LEU B 471 4.192 -2.410 4.491 1.00 0.00 H new ATOM 0 HD12 LEU B 471 4.969 -2.900 2.967 1.00 0.00 H new ATOM 0 HD13 LEU B 471 3.829 -1.534 2.985 1.00 0.00 H new ATOM 0 HD21 LEU B 471 1.926 -2.868 4.943 1.00 0.00 H new ATOM 0 HD22 LEU B 471 1.411 -1.975 3.492 1.00 0.00 H new ATOM 0 HD23 LEU B 471 0.872 -3.653 3.743 1.00 0.00 H new ATOM 1365 N GLN B 472 1.214 -3.810 -0.978 1.00 0.00 N ATOM 1366 CA GLN B 472 1.006 -4.176 -2.386 1.00 0.00 C ATOM 1367 C GLN B 472 0.675 -2.944 -3.213 1.00 0.00 C ATOM 1368 O GLN B 472 1.325 -2.647 -4.215 1.00 0.00 O ATOM 1369 CB GLN B 472 -0.147 -5.162 -2.514 1.00 0.00 C ATOM 1370 CG GLN B 472 -0.244 -6.128 -1.368 1.00 0.00 C ATOM 1371 CD GLN B 472 0.901 -7.097 -1.325 1.00 0.00 C ATOM 1372 OE1 GLN B 472 2.022 -6.801 -1.729 1.00 0.00 O ATOM 1373 NE2 GLN B 472 0.611 -8.268 -0.838 1.00 0.00 N ATOM 0 H GLN B 472 0.726 -4.416 -0.318 1.00 0.00 H new ATOM 0 HA GLN B 472 1.927 -4.631 -2.751 1.00 0.00 H new ATOM 0 HB2 GLN B 472 -1.082 -4.607 -2.590 1.00 0.00 H new ATOM 0 HB3 GLN B 472 -0.033 -5.723 -3.442 1.00 0.00 H new ATOM 0 HG2 GLN B 472 -0.278 -5.571 -0.432 1.00 0.00 H new ATOM 0 HG3 GLN B 472 -1.180 -6.682 -1.444 1.00 0.00 H new ATOM 0 HE21 GLN B 472 -0.336 -8.466 -0.515 1.00 0.00 H new ATOM 0 HE22 GLN B 472 1.331 -8.988 -0.779 1.00 0.00 H new ATOM 1382 N CYS B 473 -0.347 -2.235 -2.759 1.00 0.00 N ATOM 1383 CA CYS B 473 -0.829 -1.032 -3.420 1.00 0.00 C ATOM 1384 C CYS B 473 0.266 0.031 -3.470 1.00 0.00 C ATOM 1385 O CYS B 473 0.606 0.538 -4.539 1.00 0.00 O ATOM 1386 CB CYS B 473 -2.049 -0.508 -2.663 1.00 0.00 C ATOM 1387 SG CYS B 473 -3.312 -1.771 -2.355 1.00 0.00 S ATOM 0 H CYS B 473 -0.868 -2.479 -1.917 1.00 0.00 H new ATOM 0 HA CYS B 473 -1.109 -1.269 -4.446 1.00 0.00 H new ATOM 0 HB2 CYS B 473 -1.723 -0.092 -1.709 1.00 0.00 H new ATOM 0 HB3 CYS B 473 -2.495 0.309 -3.231 1.00 0.00 H new ATOM 0 HG CYS B 473 -2.859 -2.638 -1.499 1.00 0.00 H new ATOM 1393 N VAL B 474 0.815 0.342 -2.300 1.00 0.00 N ATOM 1394 CA VAL B 474 1.903 1.300 -2.157 1.00 0.00 C ATOM 1395 C VAL B 474 3.034 1.032 -3.152 1.00 0.00 C ATOM 1396 O VAL B 474 3.413 1.907 -3.932 1.00 0.00 O ATOM 1397 CB VAL B 474 2.481 1.246 -0.722 1.00 0.00 C ATOM 1398 CG1 VAL B 474 3.708 2.130 -0.587 1.00 0.00 C ATOM 1399 CG2 VAL B 474 1.424 1.640 0.298 1.00 0.00 C ATOM 0 H VAL B 474 0.513 -0.069 -1.416 1.00 0.00 H new ATOM 0 HA VAL B 474 1.487 2.287 -2.360 1.00 0.00 H new ATOM 0 HB VAL B 474 2.786 0.218 -0.526 1.00 0.00 H new ATOM 0 HG11 VAL B 474 4.090 2.070 0.432 1.00 0.00 H new ATOM 0 HG12 VAL B 474 4.477 1.794 -1.283 1.00 0.00 H new ATOM 0 HG13 VAL B 474 3.440 3.162 -0.813 1.00 0.00 H new ATOM 0 HG21 VAL B 474 1.851 1.595 1.300 1.00 0.00 H new ATOM 0 HG22 VAL B 474 1.082 2.655 0.094 1.00 0.00 H new ATOM 0 HG23 VAL B 474 0.581 0.953 0.232 1.00 0.00 H new ATOM 1409 N ARG B 475 3.543 -0.190 -3.133 1.00 0.00 N ATOM 1410 CA ARG B 475 4.738 -0.536 -3.886 1.00 0.00 C ATOM 1411 C ARG B 475 4.469 -0.653 -5.379 1.00 0.00 C ATOM 1412 O ARG B 475 5.396 -0.576 -6.183 1.00 0.00 O ATOM 1413 CB ARG B 475 5.365 -1.812 -3.326 1.00 0.00 C ATOM 1414 CG ARG B 475 5.941 -1.588 -1.940 1.00 0.00 C ATOM 1415 CD ARG B 475 6.746 -2.769 -1.436 1.00 0.00 C ATOM 1416 NE ARG B 475 7.726 -2.332 -0.445 1.00 0.00 N ATOM 1417 CZ ARG B 475 8.214 -3.089 0.532 1.00 0.00 C ATOM 1418 NH1 ARG B 475 7.805 -4.340 0.677 1.00 0.00 N ATOM 1419 NH2 ARG B 475 9.115 -2.591 1.367 1.00 0.00 N ATOM 0 H ARG B 475 3.144 -0.963 -2.601 1.00 0.00 H new ATOM 0 HA ARG B 475 5.451 0.280 -3.769 1.00 0.00 H new ATOM 0 HB2 ARG B 475 4.613 -2.600 -3.285 1.00 0.00 H new ATOM 0 HB3 ARG B 475 6.152 -2.156 -3.997 1.00 0.00 H new ATOM 0 HG2 ARG B 475 6.576 -0.702 -1.955 1.00 0.00 H new ATOM 0 HG3 ARG B 475 5.128 -1.385 -1.243 1.00 0.00 H new ATOM 0 HD2 ARG B 475 6.079 -3.510 -0.995 1.00 0.00 H new ATOM 0 HD3 ARG B 475 7.254 -3.253 -2.270 1.00 0.00 H new ATOM 0 HE ARG B 475 8.062 -1.371 -0.508 1.00 0.00 H new ATOM 0 HH11 ARG B 475 7.112 -4.727 0.037 1.00 0.00 H new ATOM 0 HH12 ARG B 475 8.183 -4.916 1.429 1.00 0.00 H new ATOM 0 HH21 ARG B 475 9.433 -1.628 1.259 1.00 0.00 H new ATOM 0 HH22 ARG B 475 9.490 -3.171 2.117 1.00 0.00 H new ATOM 1433 N TYR B 476 3.212 -0.837 -5.755 1.00 0.00 N ATOM 1434 CA TYR B 476 2.841 -0.796 -7.158 1.00 0.00 C ATOM 1435 C TYR B 476 2.845 0.651 -7.650 1.00 0.00 C ATOM 1436 O TYR B 476 3.388 0.959 -8.714 1.00 0.00 O ATOM 1437 CB TYR B 476 1.460 -1.435 -7.375 1.00 0.00 C ATOM 1438 CG TYR B 476 0.658 -0.782 -8.482 1.00 0.00 C ATOM 1439 CD1 TYR B 476 -0.312 0.162 -8.179 1.00 0.00 C ATOM 1440 CD2 TYR B 476 0.889 -1.083 -9.818 1.00 0.00 C ATOM 1441 CE1 TYR B 476 -1.030 0.793 -9.176 1.00 0.00 C ATOM 1442 CE2 TYR B 476 0.170 -0.460 -10.824 1.00 0.00 C ATOM 1443 CZ TYR B 476 -0.788 0.479 -10.496 1.00 0.00 C ATOM 1444 OH TYR B 476 -1.496 1.116 -11.491 1.00 0.00 O ATOM 0 H TYR B 476 2.439 -1.014 -5.113 1.00 0.00 H new ATOM 0 HA TYR B 476 3.570 -1.369 -7.731 1.00 0.00 H new ATOM 0 HB2 TYR B 476 1.590 -2.492 -7.607 1.00 0.00 H new ATOM 0 HB3 TYR B 476 0.893 -1.380 -6.446 1.00 0.00 H new ATOM 0 HD1 TYR B 476 -0.509 0.408 -7.146 1.00 0.00 H new ATOM 0 HD2 TYR B 476 1.641 -1.814 -10.076 1.00 0.00 H new ATOM 0 HE1 TYR B 476 -1.778 1.529 -8.922 1.00 0.00 H new ATOM 0 HE2 TYR B 476 0.357 -0.707 -11.859 1.00 0.00 H new ATOM 0 HH TYR B 476 -1.205 0.781 -12.365 1.00 0.00 H new ATOM 1454 N ILE B 477 2.252 1.534 -6.858 1.00 0.00 N ATOM 1455 CA ILE B 477 2.128 2.936 -7.228 1.00 0.00 C ATOM 1456 C ILE B 477 3.496 3.590 -7.328 1.00 0.00 C ATOM 1457 O ILE B 477 3.852 4.138 -8.367 1.00 0.00 O ATOM 1458 CB ILE B 477 1.251 3.704 -6.221 1.00 0.00 C ATOM 1459 CG1 ILE B 477 -0.152 3.099 -6.198 1.00 0.00 C ATOM 1460 CG2 ILE B 477 1.193 5.182 -6.582 1.00 0.00 C ATOM 1461 CD1 ILE B 477 -1.040 3.659 -5.116 1.00 0.00 C ATOM 0 H ILE B 477 1.848 1.302 -5.951 1.00 0.00 H new ATOM 0 HA ILE B 477 1.645 2.976 -8.205 1.00 0.00 H new ATOM 0 HB ILE B 477 1.690 3.617 -5.227 1.00 0.00 H new ATOM 0 HG12 ILE B 477 -0.625 3.266 -7.166 1.00 0.00 H new ATOM 0 HG13 ILE B 477 -0.070 2.020 -6.065 1.00 0.00 H new ATOM 0 HG21 ILE B 477 0.569 5.709 -5.860 1.00 0.00 H new ATOM 0 HG22 ILE B 477 2.199 5.600 -6.565 1.00 0.00 H new ATOM 0 HG23 ILE B 477 0.769 5.297 -7.580 1.00 0.00 H new ATOM 0 HD11 ILE B 477 -2.018 3.181 -5.164 1.00 0.00 H new ATOM 0 HD12 ILE B 477 -0.590 3.468 -4.141 1.00 0.00 H new ATOM 0 HD13 ILE B 477 -1.154 4.734 -5.259 1.00 0.00 H new ATOM 1473 N ILE B 478 4.275 3.500 -6.257 1.00 0.00 N ATOM 1474 CA ILE B 478 5.634 4.042 -6.246 1.00 0.00 C ATOM 1475 C ILE B 478 6.454 3.493 -7.412 1.00 0.00 C ATOM 1476 O ILE B 478 7.386 4.144 -7.899 1.00 0.00 O ATOM 1477 CB ILE B 478 6.369 3.700 -4.935 1.00 0.00 C ATOM 1478 CG1 ILE B 478 5.559 4.167 -3.726 1.00 0.00 C ATOM 1479 CG2 ILE B 478 7.753 4.336 -4.913 1.00 0.00 C ATOM 1480 CD1 ILE B 478 6.219 3.840 -2.407 1.00 0.00 C ATOM 0 H ILE B 478 3.992 3.057 -5.383 1.00 0.00 H new ATOM 0 HA ILE B 478 5.538 5.124 -6.337 1.00 0.00 H new ATOM 0 HB ILE B 478 6.482 2.617 -4.883 1.00 0.00 H new ATOM 0 HG12 ILE B 478 5.407 5.244 -3.792 1.00 0.00 H new ATOM 0 HG13 ILE B 478 4.573 3.704 -3.756 1.00 0.00 H new ATOM 0 HG21 ILE B 478 8.255 4.082 -3.979 1.00 0.00 H new ATOM 0 HG22 ILE B 478 8.339 3.962 -5.753 1.00 0.00 H new ATOM 0 HG23 ILE B 478 7.657 5.419 -4.991 1.00 0.00 H new ATOM 0 HD11 ILE B 478 5.594 4.198 -1.589 1.00 0.00 H new ATOM 0 HD12 ILE B 478 6.346 2.761 -2.321 1.00 0.00 H new ATOM 0 HD13 ILE B 478 7.194 4.325 -2.358 1.00 0.00 H new ATOM 1492 N LYS B 479 6.077 2.310 -7.875 1.00 0.00 N ATOM 1493 CA LYS B 479 6.851 1.597 -8.873 1.00 0.00 C ATOM 1494 C LYS B 479 6.725 2.233 -10.252 1.00 0.00 C ATOM 1495 O LYS B 479 7.712 2.367 -10.971 1.00 0.00 O ATOM 1496 CB LYS B 479 6.416 0.130 -8.927 1.00 0.00 C ATOM 1497 CG LYS B 479 7.418 -0.796 -9.600 1.00 0.00 C ATOM 1498 CD LYS B 479 8.764 -0.789 -8.884 1.00 0.00 C ATOM 1499 CE LYS B 479 8.637 -1.143 -7.407 1.00 0.00 C ATOM 1500 NZ LYS B 479 8.076 -2.502 -7.201 1.00 0.00 N ATOM 0 H LYS B 479 5.234 1.823 -7.571 1.00 0.00 H new ATOM 0 HA LYS B 479 7.899 1.654 -8.580 1.00 0.00 H new ATOM 0 HB2 LYS B 479 6.239 -0.222 -7.911 1.00 0.00 H new ATOM 0 HB3 LYS B 479 5.466 0.064 -9.457 1.00 0.00 H new ATOM 0 HG2 LYS B 479 7.021 -1.811 -9.617 1.00 0.00 H new ATOM 0 HG3 LYS B 479 7.556 -0.490 -10.637 1.00 0.00 H new ATOM 0 HD2 LYS B 479 9.434 -1.499 -9.369 1.00 0.00 H new ATOM 0 HD3 LYS B 479 9.219 0.197 -8.981 1.00 0.00 H new ATOM 0 HE2 LYS B 479 9.618 -1.081 -6.935 1.00 0.00 H new ATOM 0 HE3 LYS B 479 7.999 -0.410 -6.913 1.00 0.00 H new ATOM 0 HZ1 LYS B 479 8.071 -2.725 -6.185 1.00 0.00 H new ATOM 0 HZ2 LYS B 479 7.103 -2.535 -7.568 1.00 0.00 H new ATOM 0 HZ3 LYS B 479 8.660 -3.199 -7.706 1.00 0.00 H new ATOM 1514 N LYS B 480 5.523 2.634 -10.622 1.00 0.00 N ATOM 1515 CA LYS B 480 5.306 3.184 -11.951 1.00 0.00 C ATOM 1516 C LYS B 480 4.973 4.670 -11.903 1.00 0.00 C ATOM 1517 O LYS B 480 5.035 5.363 -12.920 1.00 0.00 O ATOM 1518 CB LYS B 480 4.215 2.385 -12.684 1.00 0.00 C ATOM 1519 CG LYS B 480 3.017 2.014 -11.817 1.00 0.00 C ATOM 1520 CD LYS B 480 2.092 3.194 -11.578 1.00 0.00 C ATOM 1521 CE LYS B 480 1.284 3.529 -12.822 1.00 0.00 C ATOM 1522 NZ LYS B 480 0.285 4.600 -12.574 1.00 0.00 N ATOM 0 H LYS B 480 4.692 2.591 -10.032 1.00 0.00 H new ATOM 0 HA LYS B 480 6.237 3.091 -12.511 1.00 0.00 H new ATOM 0 HB2 LYS B 480 3.865 2.968 -13.536 1.00 0.00 H new ATOM 0 HB3 LYS B 480 4.656 1.472 -13.083 1.00 0.00 H new ATOM 0 HG2 LYS B 480 2.460 1.209 -12.296 1.00 0.00 H new ATOM 0 HG3 LYS B 480 3.369 1.631 -10.859 1.00 0.00 H new ATOM 0 HD2 LYS B 480 1.416 2.967 -10.754 1.00 0.00 H new ATOM 0 HD3 LYS B 480 2.678 4.063 -11.279 1.00 0.00 H new ATOM 0 HE2 LYS B 480 1.960 3.843 -13.618 1.00 0.00 H new ATOM 0 HE3 LYS B 480 0.773 2.633 -13.173 1.00 0.00 H new ATOM 0 HZ1 LYS B 480 -0.241 4.794 -13.450 1.00 0.00 H new ATOM 0 HZ2 LYS B 480 -0.377 4.292 -11.833 1.00 0.00 H new ATOM 0 HZ3 LYS B 480 0.773 5.465 -12.265 1.00 0.00 H new ATOM 1536 N ASP B 481 4.616 5.160 -10.728 1.00 0.00 N ATOM 1537 CA ASP B 481 4.274 6.572 -10.577 1.00 0.00 C ATOM 1538 C ASP B 481 5.487 7.398 -10.160 1.00 0.00 C ATOM 1539 O ASP B 481 5.909 8.312 -10.868 1.00 0.00 O ATOM 1540 CB ASP B 481 3.141 6.766 -9.566 1.00 0.00 C ATOM 1541 CG ASP B 481 2.598 8.183 -9.574 1.00 0.00 C ATOM 1542 OD1 ASP B 481 3.219 9.077 -8.964 1.00 0.00 O ATOM 1543 OD2 ASP B 481 1.543 8.410 -10.201 1.00 0.00 O ATOM 0 H ASP B 481 4.554 4.611 -9.870 1.00 0.00 H new ATOM 0 HA ASP B 481 3.935 6.922 -11.552 1.00 0.00 H new ATOM 0 HB2 ASP B 481 2.334 6.069 -9.790 1.00 0.00 H new ATOM 0 HB3 ASP B 481 3.503 6.524 -8.567 1.00 0.00 H new ATOM 1548 N PHE B 482 6.052 7.047 -9.010 1.00 0.00 N ATOM 1549 CA PHE B 482 7.062 7.878 -8.366 1.00 0.00 C ATOM 1550 C PHE B 482 8.469 7.597 -8.884 1.00 0.00 C ATOM 1551 O PHE B 482 8.946 8.261 -9.803 1.00 0.00 O ATOM 1552 CB PHE B 482 7.022 7.686 -6.845 1.00 0.00 C ATOM 1553 CG PHE B 482 5.794 8.251 -6.185 1.00 0.00 C ATOM 1554 CD1 PHE B 482 4.581 7.587 -6.254 1.00 0.00 C ATOM 1555 CD2 PHE B 482 5.858 9.447 -5.489 1.00 0.00 C ATOM 1556 CE1 PHE B 482 3.456 8.105 -5.645 1.00 0.00 C ATOM 1557 CE2 PHE B 482 4.735 9.970 -4.877 1.00 0.00 C ATOM 1558 CZ PHE B 482 3.533 9.299 -4.956 1.00 0.00 C ATOM 0 H PHE B 482 5.827 6.191 -8.504 1.00 0.00 H new ATOM 0 HA PHE B 482 6.823 8.912 -8.614 1.00 0.00 H new ATOM 0 HB2 PHE B 482 7.083 6.621 -6.623 1.00 0.00 H new ATOM 0 HB3 PHE B 482 7.904 8.154 -6.408 1.00 0.00 H new ATOM 0 HD1 PHE B 482 4.514 6.652 -6.791 1.00 0.00 H new ATOM 0 HD2 PHE B 482 6.797 9.977 -5.424 1.00 0.00 H new ATOM 0 HE1 PHE B 482 2.516 7.577 -5.707 1.00 0.00 H new ATOM 0 HE2 PHE B 482 4.799 10.903 -4.337 1.00 0.00 H new ATOM 0 HZ PHE B 482 2.653 9.707 -4.480 1.00 0.00 H new ATOM 1568 N PHE B 483 9.131 6.607 -8.302 1.00 0.00 N ATOM 1569 CA PHE B 483 10.549 6.394 -8.565 1.00 0.00 C ATOM 1570 C PHE B 483 10.789 5.122 -9.362 1.00 0.00 C ATOM 1571 O PHE B 483 11.550 5.112 -10.330 1.00 0.00 O ATOM 1572 CB PHE B 483 11.334 6.323 -7.253 1.00 0.00 C ATOM 1573 CG PHE B 483 11.143 7.513 -6.355 1.00 0.00 C ATOM 1574 CD1 PHE B 483 11.863 8.678 -6.559 1.00 0.00 C ATOM 1575 CD2 PHE B 483 10.243 7.461 -5.301 1.00 0.00 C ATOM 1576 CE1 PHE B 483 11.690 9.768 -5.730 1.00 0.00 C ATOM 1577 CE2 PHE B 483 10.067 8.549 -4.470 1.00 0.00 C ATOM 1578 CZ PHE B 483 10.791 9.704 -4.684 1.00 0.00 C ATOM 0 H PHE B 483 8.714 5.943 -7.650 1.00 0.00 H new ATOM 0 HA PHE B 483 10.896 7.242 -9.155 1.00 0.00 H new ATOM 0 HB2 PHE B 483 11.037 5.424 -6.713 1.00 0.00 H new ATOM 0 HB3 PHE B 483 12.395 6.222 -7.482 1.00 0.00 H new ATOM 0 HD1 PHE B 483 12.568 8.734 -7.376 1.00 0.00 H new ATOM 0 HD2 PHE B 483 9.674 6.560 -5.129 1.00 0.00 H new ATOM 0 HE1 PHE B 483 12.258 10.671 -5.900 1.00 0.00 H new ATOM 0 HE2 PHE B 483 9.363 8.496 -3.653 1.00 0.00 H new ATOM 0 HZ PHE B 483 10.655 10.556 -4.035 1.00 0.00 H new ATOM 1588 N GLY B 484 10.137 4.048 -8.946 1.00 0.00 N ATOM 1589 CA GLY B 484 10.320 2.769 -9.597 1.00 0.00 C ATOM 1590 C GLY B 484 11.376 1.920 -8.921 1.00 0.00 C ATOM 1591 O GLY B 484 11.659 0.804 -9.358 1.00 0.00 O ATOM 0 H GLY B 484 9.481 4.040 -8.165 1.00 0.00 H new ATOM 0 HA2 GLY B 484 9.373 2.229 -9.603 1.00 0.00 H new ATOM 0 HA3 GLY B 484 10.600 2.931 -10.638 1.00 0.00 H new ATOM 1595 N LEU B 485 11.949 2.443 -7.849 1.00 0.00 N ATOM 1596 CA LEU B 485 12.954 1.713 -7.092 1.00 0.00 C ATOM 1597 C LEU B 485 12.311 0.973 -5.927 1.00 0.00 C ATOM 1598 O LEU B 485 11.120 1.142 -5.657 1.00 0.00 O ATOM 1599 CB LEU B 485 14.069 2.657 -6.605 1.00 0.00 C ATOM 1600 CG LEU B 485 13.617 3.962 -5.930 1.00 0.00 C ATOM 1601 CD1 LEU B 485 13.073 3.712 -4.529 1.00 0.00 C ATOM 1602 CD2 LEU B 485 14.770 4.953 -5.883 1.00 0.00 C ATOM 0 H LEU B 485 11.735 3.371 -7.483 1.00 0.00 H new ATOM 0 HA LEU B 485 13.411 0.975 -7.751 1.00 0.00 H new ATOM 0 HB2 LEU B 485 14.697 2.109 -5.902 1.00 0.00 H new ATOM 0 HB3 LEU B 485 14.696 2.914 -7.459 1.00 0.00 H new ATOM 0 HG LEU B 485 12.807 4.383 -6.526 1.00 0.00 H new ATOM 0 HD11 LEU B 485 12.764 4.658 -4.085 1.00 0.00 H new ATOM 0 HD12 LEU B 485 12.216 3.041 -4.586 1.00 0.00 H new ATOM 0 HD13 LEU B 485 13.849 3.258 -3.913 1.00 0.00 H new ATOM 0 HD21 LEU B 485 14.439 5.874 -5.403 1.00 0.00 H new ATOM 0 HD22 LEU B 485 15.595 4.524 -5.315 1.00 0.00 H new ATOM 0 HD23 LEU B 485 15.103 5.172 -6.897 1.00 0.00 H new ATOM 1614 N ASP B 486 13.100 0.158 -5.249 1.00 0.00 N ATOM 1615 CA ASP B 486 12.613 -0.629 -4.124 1.00 0.00 C ATOM 1616 C ASP B 486 13.695 -0.744 -3.057 1.00 0.00 C ATOM 1617 O ASP B 486 14.235 -1.819 -2.794 1.00 0.00 O ATOM 1618 CB ASP B 486 12.140 -2.013 -4.593 1.00 0.00 C ATOM 1619 CG ASP B 486 13.219 -2.831 -5.284 1.00 0.00 C ATOM 1620 OD1 ASP B 486 13.668 -2.439 -6.383 1.00 0.00 O ATOM 1621 OD2 ASP B 486 13.606 -3.889 -4.746 1.00 0.00 O ATOM 0 H ASP B 486 14.089 0.022 -5.458 1.00 0.00 H new ATOM 0 HA ASP B 486 11.755 -0.121 -3.684 1.00 0.00 H new ATOM 0 HB2 ASP B 486 11.770 -2.571 -3.733 1.00 0.00 H new ATOM 0 HB3 ASP B 486 11.300 -1.887 -5.276 1.00 0.00 H new ATOM 1626 N THR B 487 13.988 0.384 -2.432 1.00 0.00 N ATOM 1627 CA THR B 487 15.065 0.479 -1.459 1.00 0.00 C ATOM 1628 C THR B 487 14.654 -0.080 -0.100 1.00 0.00 C ATOM 1629 O THR B 487 14.627 0.633 0.906 1.00 0.00 O ATOM 1630 CB THR B 487 15.529 1.935 -1.306 1.00 0.00 C ATOM 1631 OG1 THR B 487 14.389 2.804 -1.248 1.00 0.00 O ATOM 1632 CG2 THR B 487 16.430 2.345 -2.462 1.00 0.00 C ATOM 0 H THR B 487 13.487 1.259 -2.584 1.00 0.00 H new ATOM 0 HA THR B 487 15.892 -0.124 -1.834 1.00 0.00 H new ATOM 0 HB THR B 487 16.099 2.017 -0.381 1.00 0.00 H new ATOM 0 HG1 THR B 487 14.689 3.732 -1.149 1.00 0.00 H new ATOM 0 HG21 THR B 487 16.744 3.380 -2.329 1.00 0.00 H new ATOM 0 HG22 THR B 487 17.308 1.699 -2.486 1.00 0.00 H new ATOM 0 HG23 THR B 487 15.884 2.249 -3.401 1.00 0.00 H new ATOM 1640 N ASN B 488 14.323 -1.360 -0.086 1.00 0.00 N ATOM 1641 CA ASN B 488 13.949 -2.042 1.126 1.00 0.00 C ATOM 1642 C ASN B 488 14.936 -3.163 1.440 1.00 0.00 C ATOM 1643 O ASN B 488 14.958 -3.698 2.548 1.00 0.00 O ATOM 1644 CB ASN B 488 12.544 -2.620 0.975 1.00 0.00 C ATOM 1645 CG ASN B 488 12.001 -3.123 2.285 1.00 0.00 C ATOM 1646 OD1 ASN B 488 11.257 -4.105 2.338 1.00 0.00 O ATOM 1647 ND2 ASN B 488 12.347 -2.434 3.351 1.00 0.00 N ATOM 0 H ASN B 488 14.308 -1.949 -0.918 1.00 0.00 H new ATOM 0 HA ASN B 488 13.965 -1.326 1.948 1.00 0.00 H new ATOM 0 HB2 ASN B 488 11.878 -1.855 0.575 1.00 0.00 H new ATOM 0 HB3 ASN B 488 12.563 -3.436 0.252 1.00 0.00 H new ATOM 0 HD21 ASN B 488 11.997 -2.706 4.270 1.00 0.00 H new ATOM 0 HD22 ASN B 488 12.965 -1.628 3.259 1.00 0.00 H new ATOM 1654 N SER B 489 15.758 -3.514 0.465 1.00 0.00 N ATOM 1655 CA SER B 489 16.680 -4.624 0.623 1.00 0.00 C ATOM 1656 C SER B 489 17.962 -4.169 1.312 1.00 0.00 C ATOM 1657 O SER B 489 18.845 -3.577 0.689 1.00 0.00 O ATOM 1658 CB SER B 489 16.995 -5.239 -0.739 1.00 0.00 C ATOM 1659 OG SER B 489 15.799 -5.535 -1.450 1.00 0.00 O ATOM 0 H SER B 489 15.805 -3.048 -0.441 1.00 0.00 H new ATOM 0 HA SER B 489 16.209 -5.380 1.251 1.00 0.00 H new ATOM 0 HB2 SER B 489 17.608 -4.550 -1.321 1.00 0.00 H new ATOM 0 HB3 SER B 489 17.578 -6.150 -0.605 1.00 0.00 H new ATOM 0 HG SER B 489 16.024 -5.926 -2.320 1.00 0.00 H new ATOM 1665 N ALA B 490 18.049 -4.443 2.602 1.00 0.00 N ATOM 1666 CA ALA B 490 19.211 -4.071 3.385 1.00 0.00 C ATOM 1667 C ALA B 490 19.936 -5.316 3.873 1.00 0.00 C ATOM 1668 O ALA B 490 19.723 -5.777 4.994 1.00 0.00 O ATOM 1669 CB ALA B 490 18.804 -3.195 4.556 1.00 0.00 C ATOM 0 H ALA B 490 17.322 -4.925 3.131 1.00 0.00 H new ATOM 0 HA ALA B 490 19.891 -3.500 2.752 1.00 0.00 H new ATOM 0 HB1 ALA B 490 19.688 -2.925 5.133 1.00 0.00 H new ATOM 0 HB2 ALA B 490 18.323 -2.290 4.184 1.00 0.00 H new ATOM 0 HB3 ALA B 490 18.107 -3.740 5.193 1.00 0.00 H new ATOM 1675 N LYS B 491 20.785 -5.862 3.019 1.00 0.00 N ATOM 1676 CA LYS B 491 21.501 -7.091 3.331 1.00 0.00 C ATOM 1677 C LYS B 491 22.991 -6.825 3.530 1.00 0.00 C ATOM 1678 O LYS B 491 23.814 -7.736 3.456 1.00 0.00 O ATOM 1679 CB LYS B 491 21.282 -8.131 2.225 1.00 0.00 C ATOM 1680 CG LYS B 491 21.705 -7.660 0.841 1.00 0.00 C ATOM 1681 CD LYS B 491 21.383 -8.690 -0.233 1.00 0.00 C ATOM 1682 CE LYS B 491 22.156 -9.988 -0.033 1.00 0.00 C ATOM 1683 NZ LYS B 491 23.625 -9.788 -0.142 1.00 0.00 N ATOM 0 H LYS B 491 20.997 -5.473 2.100 1.00 0.00 H new ATOM 0 HA LYS B 491 21.104 -7.486 4.266 1.00 0.00 H new ATOM 0 HB2 LYS B 491 21.837 -9.035 2.475 1.00 0.00 H new ATOM 0 HB3 LYS B 491 20.227 -8.402 2.199 1.00 0.00 H new ATOM 0 HG2 LYS B 491 21.201 -6.722 0.607 1.00 0.00 H new ATOM 0 HG3 LYS B 491 22.776 -7.456 0.839 1.00 0.00 H new ATOM 0 HD2 LYS B 491 20.314 -8.900 -0.224 1.00 0.00 H new ATOM 0 HD3 LYS B 491 21.618 -8.276 -1.214 1.00 0.00 H new ATOM 0 HE2 LYS B 491 21.919 -10.403 0.947 1.00 0.00 H new ATOM 0 HE3 LYS B 491 21.834 -10.719 -0.775 1.00 0.00 H new ATOM 0 HZ1 LYS B 491 24.100 -10.713 -0.169 1.00 0.00 H new ATOM 0 HZ2 LYS B 491 23.840 -9.262 -1.013 1.00 0.00 H new ATOM 0 HZ3 LYS B 491 23.964 -9.249 0.680 1.00 0.00 H new ATOM 1697 N SER B 492 23.330 -5.571 3.780 1.00 0.00 N ATOM 1698 CA SER B 492 24.709 -5.190 4.040 1.00 0.00 C ATOM 1699 C SER B 492 24.822 -4.545 5.420 1.00 0.00 C ATOM 1700 O SER B 492 25.287 -3.414 5.558 1.00 0.00 O ATOM 1701 CB SER B 492 25.202 -4.226 2.959 1.00 0.00 C ATOM 1702 OG SER B 492 24.971 -4.756 1.660 1.00 0.00 O ATOM 0 H SER B 492 22.667 -4.797 3.808 1.00 0.00 H new ATOM 0 HA SER B 492 25.333 -6.083 4.020 1.00 0.00 H new ATOM 0 HB2 SER B 492 24.692 -3.268 3.061 1.00 0.00 H new ATOM 0 HB3 SER B 492 26.267 -4.036 3.094 1.00 0.00 H new ATOM 0 HG SER B 492 25.293 -4.122 0.986 1.00 0.00 H new ATOM 1708 N LYS B 493 24.376 -5.265 6.440 1.00 0.00 N ATOM 1709 CA LYS B 493 24.400 -4.750 7.800 1.00 0.00 C ATOM 1710 C LYS B 493 25.615 -5.261 8.568 1.00 0.00 C ATOM 1711 O LYS B 493 25.493 -5.713 9.708 1.00 0.00 O ATOM 1712 CB LYS B 493 23.121 -5.143 8.538 1.00 0.00 C ATOM 1713 CG LYS B 493 21.855 -4.644 7.867 1.00 0.00 C ATOM 1714 CD LYS B 493 20.623 -4.979 8.686 1.00 0.00 C ATOM 1715 CE LYS B 493 19.360 -4.500 7.996 1.00 0.00 C ATOM 1716 NZ LYS B 493 18.152 -4.717 8.832 1.00 0.00 N ATOM 0 H LYS B 493 23.994 -6.206 6.351 1.00 0.00 H new ATOM 0 HA LYS B 493 24.466 -3.664 7.741 1.00 0.00 H new ATOM 0 HB2 LYS B 493 23.076 -6.229 8.617 1.00 0.00 H new ATOM 0 HB3 LYS B 493 23.163 -4.751 9.554 1.00 0.00 H new ATOM 0 HG2 LYS B 493 21.917 -3.565 7.726 1.00 0.00 H new ATOM 0 HG3 LYS B 493 21.767 -5.090 6.876 1.00 0.00 H new ATOM 0 HD2 LYS B 493 20.569 -6.056 8.843 1.00 0.00 H new ATOM 0 HD3 LYS B 493 20.701 -4.517 9.670 1.00 0.00 H new ATOM 0 HE2 LYS B 493 19.454 -3.439 7.764 1.00 0.00 H new ATOM 0 HE3 LYS B 493 19.244 -5.025 7.048 1.00 0.00 H new ATOM 0 HZ1 LYS B 493 17.312 -4.376 8.323 1.00 0.00 H new ATOM 0 HZ2 LYS B 493 18.047 -5.732 9.033 1.00 0.00 H new ATOM 0 HZ3 LYS B 493 18.250 -4.195 9.726 1.00 0.00 H new ATOM 1730 N ASP B 494 26.782 -5.215 7.944 1.00 0.00 N ATOM 1731 CA ASP B 494 28.015 -5.587 8.629 1.00 0.00 C ATOM 1732 C ASP B 494 28.638 -4.357 9.260 1.00 0.00 C ATOM 1733 O ASP B 494 28.977 -4.354 10.442 1.00 0.00 O ATOM 1734 CB ASP B 494 29.020 -6.248 7.677 1.00 0.00 C ATOM 1735 CG ASP B 494 28.565 -7.609 7.197 1.00 0.00 C ATOM 1736 OD1 ASP B 494 28.526 -8.550 8.017 1.00 0.00 O ATOM 1737 OD2 ASP B 494 28.255 -7.752 5.996 1.00 0.00 O ATOM 0 H ASP B 494 26.904 -4.927 6.973 1.00 0.00 H new ATOM 0 HA ASP B 494 27.762 -6.314 9.401 1.00 0.00 H new ATOM 0 HB2 ASP B 494 29.179 -5.599 6.816 1.00 0.00 H new ATOM 0 HB3 ASP B 494 29.980 -6.348 8.182 1.00 0.00 H new ATOM 1742 N VAL B 495 28.776 -3.308 8.466 1.00 0.00 N ATOM 1743 CA VAL B 495 29.321 -2.052 8.951 1.00 0.00 C ATOM 1744 C VAL B 495 28.191 -1.079 9.255 1.00 0.00 C ATOM 1745 O VAL B 495 27.886 -0.873 10.446 1.00 0.00 O ATOM 1746 CB VAL B 495 30.287 -1.413 7.933 1.00 0.00 C ATOM 1747 CG1 VAL B 495 30.898 -0.139 8.500 1.00 0.00 C ATOM 1748 CG2 VAL B 495 31.372 -2.401 7.533 1.00 0.00 C ATOM 1749 OXT VAL B 495 27.588 -0.546 8.302 1.00 0.00 O ATOM 0 H VAL B 495 28.517 -3.302 7.479 1.00 0.00 H new ATOM 0 HA VAL B 495 29.883 -2.268 9.860 1.00 0.00 H new ATOM 0 HB VAL B 495 29.720 -1.149 7.040 1.00 0.00 H new ATOM 0 HG11 VAL B 495 31.577 0.297 7.767 1.00 0.00 H new ATOM 0 HG12 VAL B 495 30.106 0.574 8.730 1.00 0.00 H new ATOM 0 HG13 VAL B 495 31.450 -0.374 9.410 1.00 0.00 H new ATOM 0 HG21 VAL B 495 32.044 -1.932 6.814 1.00 0.00 H new ATOM 0 HG22 VAL B 495 31.936 -2.699 8.417 1.00 0.00 H new ATOM 0 HG23 VAL B 495 30.914 -3.281 7.081 1.00 0.00 H new TER 1759 VAL B 495