USER MOD reduce.3.24.130724 H: found=0, std=0, add=1668, rem=0, adj=56 USER MOD reduce.3.24.130724 removed 1668 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 84 LYS NZ :NH3+ -134:sc= 0.945 (180deg=-0.178) USER MOD Set 1.2: B 88 ASN :FLIP amide:sc= -5.61! C(o=-12!,f=-4.7!) USER MOD Set 2.1: A 79 ASN : amide:sc= -0.434 X(o=-0.43,f=0) USER MOD Set 2.2: B 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.1: B 33 SER OG : rot 180:sc= 0.0234 USER MOD Set 3.2: B 37 THR OG1 : rot -26:sc= 0.553 USER MOD Set 4.1: A 84 LYS NZ :NH3+ -136:sc= 0.762 (180deg=-0.143) USER MOD Set 4.2: A 88 ASN :FLIP amide:sc= -3.92! C(o=-10!,f=-3.2!) USER MOD Set 5.1: A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.2: B 79 ASN : amide:sc= -0.241 X(o=-0.24,f=-0.016) USER MOD Set 6.1: A 33 SER OG : rot 93:sc= 0.339 USER MOD Set 6.2: A 37 THR OG1 : rot -30:sc= 0.329 USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ -154:sc= -0.101 (180deg=-0.692) USER MOD Single : A 3 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0596) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 GLN :FLIP amide:sc= -0.155 F(o=-0.74,f=-0.16) USER MOD Single : A 17 CYS SG : rot 17:sc= -4.61! USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot -16:sc= 0.77 USER MOD Single : A 21 SER OG : rot 125:sc= 0.563 USER MOD Single : A 23 LYS NZ :NH3+ -112:sc= -0.964 (180deg=-2.8!) USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.202 USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot -30:sc= 1.18 USER MOD Single : A 42 LYS NZ :NH3+ -112:sc= 0.0752 (180deg=-0.691) USER MOD Single : A 43 MET CE :methyl -172:sc=-0.000773 (180deg=-0.0535) USER MOD Single : A 45 MET CE :methyl -152:sc= -0.0812 (180deg=-1.01) USER MOD Single : A 52 GLN :FLIP amide:sc= 1.09 F(o=-0.42,f=1.1) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 GLN :FLIP amide:sc= 0 F(o=-2.6!,f=0) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 60 THR OG1 : rot 104:sc= 0.696 USER MOD Single : A 61 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.231) USER MOD Single : A 62 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00836) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= -0.295 K(o=-0.3,f=-1.7!) USER MOD Single : A 78 LYS NZ :NH3+ -143:sc= -0.269 (180deg=-1.33!) USER MOD Single : A 80 MET CE :methyl -147:sc= 0 (180deg=-0.357) USER MOD Single : A 82 GLN : amide:sc= -0.0488 X(o=-0.049,f=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc=-0.00797 X(o=-0.008,f=-0.17) USER MOD Single : B 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 LYS NZ :NH3+ -156:sc= -0.0931 (180deg=-0.774) USER MOD Single : B 3 LYS NZ :NH3+ -131:sc= 0 (180deg=-0.0377) USER MOD Single : B 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 5 SER OG : rot 180:sc= 0 USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 11 GLN : amide:sc= -0.249 X(o=-0.25,f=-0.012) USER MOD Single : B 17 CYS SG : rot 9:sc= -4.71! USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 SER OG : rot -16:sc= 0.864 USER MOD Single : B 21 SER OG : rot 155:sc= 0.579 USER MOD Single : B 23 LYS NZ :NH3+ 153:sc= -0.0453 (180deg=-0.674) USER MOD Single : B 24 THR OG1 : rot 180:sc= -0.185 USER MOD Single : B 27 MET CE :methyl 161:sc= -0.0442 (180deg=-0.689) USER MOD Single : B 28 TYR OH : rot 180:sc= 0 USER MOD Single : B 31 ASN : amide:sc= 0.941 K(o=0.94,f=-0.0047) USER MOD Single : B 34 TYR OH : rot 180:sc= 0 USER MOD Single : B 40 TYR OH : rot -26:sc= 1.24 USER MOD Single : B 42 LYS NZ :NH3+ 143:sc= 0.102 (180deg=-0.566!) USER MOD Single : B 43 MET CE :methyl -173:sc= -0.0042 (180deg=-0.078) USER MOD Single : B 45 MET CE :methyl -170:sc= -0.165 (180deg=-0.208) USER MOD Single : B 52 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 GLN : amide:sc= -0.507 X(o=-0.51,f=-0.11) USER MOD Single : B 57 TYR OH : rot 180:sc= 0 USER MOD Single : B 58 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 60 THR OG1 : rot 180:sc= 0.572 USER MOD Single : B 61 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.242) USER MOD Single : B 62 LYS NZ :NH3+ -104:sc= -0.0513 (180deg=-0.103) USER MOD Single : B 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 74 ASN : amide:sc= -0.34 K(o=-0.34,f=-1.6!) USER MOD Single : B 78 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.188) USER MOD Single : B 80 MET CE :methyl -160:sc= 0 (180deg=-0.46) USER MOD Single : B 82 GLN : amide:sc=-0.00809 X(o=-0.0081,f=0) USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 89 SER OG : rot 180:sc= 0 USER MOD Single : B 92 SER OG : rot 180:sc= 0 USER MOD Single : B 95 GLN : amide:sc= 0 X(o=0,f=-0.073) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -10.904 14.340 0.565 1.00 5.35 N ATOM 2 CA ALA A 1 -11.471 13.413 1.585 1.00 4.76 C ATOM 3 C ALA A 1 -10.825 12.035 1.439 1.00 4.12 C ATOM 4 O ALA A 1 -10.016 11.629 2.250 1.00 3.94 O ATOM 5 CB ALA A 1 -12.983 13.292 1.379 1.00 4.81 C ATOM 0 H1 ALA A 1 -11.344 15.277 0.665 1.00 5.35 H new ATOM 0 H2 ALA A 1 -9.877 14.423 0.704 1.00 5.35 H new ATOM 0 H3 ALA A 1 -11.095 13.968 -0.387 1.00 5.35 H new ATOM 0 HA ALA A 1 -11.269 13.804 2.582 1.00 4.76 H new ATOM 0 HB1 ALA A 1 -13.399 12.614 2.125 1.00 4.81 H new ATOM 0 HB2 ALA A 1 -13.444 14.274 1.484 1.00 4.81 H new ATOM 0 HB3 ALA A 1 -13.184 12.902 0.381 1.00 4.81 H new ATOM 13 N LYS A 2 -11.174 11.310 0.411 1.00 4.22 N ATOM 14 CA LYS A 2 -10.578 9.959 0.215 1.00 4.07 C ATOM 15 C LYS A 2 -10.718 9.149 1.505 1.00 3.66 C ATOM 16 O LYS A 2 -9.775 8.543 1.975 1.00 4.35 O ATOM 17 CB LYS A 2 -9.096 10.099 -0.139 1.00 4.82 C ATOM 18 CG LYS A 2 -8.943 11.040 -1.335 1.00 5.66 C ATOM 19 CD LYS A 2 -7.974 10.425 -2.347 1.00 6.60 C ATOM 20 CE LYS A 2 -7.696 11.430 -3.466 1.00 7.50 C ATOM 21 NZ LYS A 2 -8.985 11.993 -3.959 1.00 7.90 N ATOM 0 H LYS A 2 -11.846 11.595 -0.301 1.00 4.22 H new ATOM 0 HA LYS A 2 -11.098 9.448 -0.595 1.00 4.07 H new ATOM 0 HB2 LYS A 2 -8.542 10.487 0.716 1.00 4.82 H new ATOM 0 HB3 LYS A 2 -8.674 9.122 -0.375 1.00 4.82 H new ATOM 0 HG2 LYS A 2 -9.913 11.212 -1.802 1.00 5.66 H new ATOM 0 HG3 LYS A 2 -8.572 12.010 -1.003 1.00 5.66 H new ATOM 0 HD2 LYS A 2 -7.043 10.149 -1.853 1.00 6.60 H new ATOM 0 HD3 LYS A 2 -8.398 9.511 -2.762 1.00 6.60 H new ATOM 0 HE2 LYS A 2 -7.054 12.231 -3.099 1.00 7.50 H new ATOM 0 HE3 LYS A 2 -7.163 10.943 -4.283 1.00 7.50 H new ATOM 0 HZ1 LYS A 2 -8.873 12.305 -4.945 1.00 7.90 H new ATOM 0 HZ2 LYS A 2 -9.724 11.263 -3.908 1.00 7.90 H new ATOM 0 HZ3 LYS A 2 -9.258 12.804 -3.368 1.00 7.90 H new ATOM 35 N LYS A 3 -11.888 9.132 2.083 1.00 2.85 N ATOM 36 CA LYS A 3 -12.086 8.362 3.342 1.00 2.88 C ATOM 37 C LYS A 3 -13.579 8.286 3.640 1.00 2.35 C ATOM 38 O LYS A 3 -14.050 7.389 4.311 1.00 2.83 O ATOM 39 CB LYS A 3 -11.367 9.067 4.494 1.00 3.31 C ATOM 40 CG LYS A 3 -10.278 8.152 5.055 1.00 3.76 C ATOM 41 CD LYS A 3 -9.530 8.874 6.178 1.00 4.46 C ATOM 42 CE LYS A 3 -8.681 7.867 6.956 1.00 5.18 C ATOM 43 NZ LYS A 3 -9.550 7.112 7.903 1.00 5.69 N ATOM 0 H LYS A 3 -12.715 9.618 1.737 1.00 2.85 H new ATOM 0 HA LYS A 3 -11.678 7.357 3.231 1.00 2.88 H new ATOM 0 HB2 LYS A 3 -10.927 10.001 4.144 1.00 3.31 H new ATOM 0 HB3 LYS A 3 -12.079 9.324 5.278 1.00 3.31 H new ATOM 0 HG2 LYS A 3 -10.722 7.231 5.433 1.00 3.76 H new ATOM 0 HG3 LYS A 3 -9.583 7.870 4.264 1.00 3.76 H new ATOM 0 HD2 LYS A 3 -8.895 9.656 5.762 1.00 4.46 H new ATOM 0 HD3 LYS A 3 -10.239 9.361 6.847 1.00 4.46 H new ATOM 0 HE2 LYS A 3 -8.192 7.179 6.267 1.00 5.18 H new ATOM 0 HE3 LYS A 3 -7.893 8.385 7.503 1.00 5.18 H new ATOM 0 HZ1 LYS A 3 -8.956 6.579 8.569 1.00 5.69 H new ATOM 0 HZ2 LYS A 3 -10.150 7.778 8.430 1.00 5.69 H new ATOM 0 HZ3 LYS A 3 -10.152 6.452 7.371 1.00 5.69 H new ATOM 57 N LYS A 4 -14.327 9.225 3.135 1.00 1.83 N ATOM 58 CA LYS A 4 -15.794 9.225 3.367 1.00 1.71 C ATOM 59 C LYS A 4 -16.491 9.727 2.103 1.00 1.52 C ATOM 60 O LYS A 4 -15.853 10.199 1.184 1.00 2.02 O ATOM 61 CB LYS A 4 -16.129 10.150 4.539 1.00 2.12 C ATOM 62 CG LYS A 4 -15.058 10.008 5.623 1.00 2.54 C ATOM 63 CD LYS A 4 -15.511 10.739 6.889 1.00 3.17 C ATOM 64 CE LYS A 4 -16.267 9.767 7.796 1.00 3.65 C ATOM 65 NZ LYS A 4 -17.007 10.534 8.839 1.00 4.24 N ATOM 0 H LYS A 4 -13.981 9.998 2.567 1.00 1.83 H new ATOM 0 HA LYS A 4 -16.132 8.216 3.602 1.00 1.71 H new ATOM 0 HB2 LYS A 4 -16.181 11.184 4.197 1.00 2.12 H new ATOM 0 HB3 LYS A 4 -17.109 9.899 4.946 1.00 2.12 H new ATOM 0 HG2 LYS A 4 -14.884 8.954 5.841 1.00 2.54 H new ATOM 0 HG3 LYS A 4 -14.113 10.421 5.271 1.00 2.54 H new ATOM 0 HD2 LYS A 4 -14.648 11.147 7.415 1.00 3.17 H new ATOM 0 HD3 LYS A 4 -16.151 11.581 6.626 1.00 3.17 H new ATOM 0 HE2 LYS A 4 -16.963 9.169 7.207 1.00 3.65 H new ATOM 0 HE3 LYS A 4 -15.569 9.074 8.266 1.00 3.65 H new ATOM 0 HZ1 LYS A 4 -17.521 9.874 9.456 1.00 4.24 H new ATOM 0 HZ2 LYS A 4 -16.333 11.086 9.408 1.00 4.24 H new ATOM 0 HZ3 LYS A 4 -17.683 11.178 8.382 1.00 4.24 H new ATOM 79 N SER A 5 -17.792 9.620 2.055 1.00 1.49 N ATOM 80 CA SER A 5 -18.552 10.084 0.858 1.00 1.72 C ATOM 81 C SER A 5 -18.517 9.015 -0.231 1.00 1.51 C ATOM 82 O SER A 5 -19.130 9.155 -1.271 1.00 1.76 O ATOM 83 CB SER A 5 -17.969 11.384 0.323 1.00 2.08 C ATOM 84 OG SER A 5 -19.016 12.182 -0.214 1.00 2.67 O ATOM 0 H SER A 5 -18.366 9.227 2.801 1.00 1.49 H new ATOM 0 HA SER A 5 -19.586 10.261 1.155 1.00 1.72 H new ATOM 0 HB2 SER A 5 -17.458 11.923 1.121 1.00 2.08 H new ATOM 0 HB3 SER A 5 -17.226 11.173 -0.446 1.00 2.08 H new ATOM 0 HG SER A 5 -18.644 13.021 -0.558 1.00 2.67 H new ATOM 90 N LYS A 6 -17.811 7.941 -0.004 1.00 1.38 N ATOM 91 CA LYS A 6 -17.749 6.866 -1.032 1.00 1.30 C ATOM 92 C LYS A 6 -16.937 5.687 -0.496 1.00 1.16 C ATOM 93 O LYS A 6 -17.134 4.557 -0.891 1.00 1.17 O ATOM 94 CB LYS A 6 -17.078 7.403 -2.300 1.00 1.59 C ATOM 95 CG LYS A 6 -18.000 7.180 -3.500 1.00 2.31 C ATOM 96 CD LYS A 6 -17.333 7.710 -4.769 1.00 2.60 C ATOM 97 CE LYS A 6 -18.011 9.014 -5.192 1.00 3.41 C ATOM 98 NZ LYS A 6 -17.319 9.571 -6.387 1.00 3.78 N ATOM 0 H LYS A 6 -17.276 7.763 0.846 1.00 1.38 H new ATOM 0 HA LYS A 6 -18.762 6.537 -1.265 1.00 1.30 H new ATOM 0 HB2 LYS A 6 -16.861 8.465 -2.187 1.00 1.59 H new ATOM 0 HB3 LYS A 6 -16.125 6.899 -2.461 1.00 1.59 H new ATOM 0 HG2 LYS A 6 -18.219 6.118 -3.610 1.00 2.31 H new ATOM 0 HG3 LYS A 6 -18.951 7.687 -3.339 1.00 2.31 H new ATOM 0 HD2 LYS A 6 -16.271 7.880 -4.591 1.00 2.60 H new ATOM 0 HD3 LYS A 6 -17.408 6.972 -5.568 1.00 2.60 H new ATOM 0 HE2 LYS A 6 -19.062 8.833 -5.419 1.00 3.41 H new ATOM 0 HE3 LYS A 6 -17.981 9.733 -4.374 1.00 3.41 H new ATOM 0 HZ1 LYS A 6 -17.781 10.458 -6.674 1.00 3.78 H new ATOM 0 HZ2 LYS A 6 -16.323 9.759 -6.155 1.00 3.78 H new ATOM 0 HZ3 LYS A 6 -17.369 8.886 -7.168 1.00 3.78 H new ATOM 112 N LEU A 7 -16.019 5.940 0.393 1.00 1.10 N ATOM 113 CA LEU A 7 -15.188 4.832 0.941 1.00 1.09 C ATOM 114 C LEU A 7 -15.775 4.328 2.261 1.00 1.01 C ATOM 115 O LEU A 7 -16.198 3.191 2.375 1.00 0.97 O ATOM 116 CB LEU A 7 -13.768 5.343 1.189 1.00 1.23 C ATOM 117 CG LEU A 7 -12.940 5.191 -0.087 1.00 1.37 C ATOM 118 CD1 LEU A 7 -13.621 5.945 -1.231 1.00 2.05 C ATOM 119 CD2 LEU A 7 -11.542 5.770 0.144 1.00 1.67 C ATOM 0 H LEU A 7 -15.808 6.866 0.764 1.00 1.10 H new ATOM 0 HA LEU A 7 -15.174 4.013 0.222 1.00 1.09 H new ATOM 0 HB2 LEU A 7 -13.795 6.389 1.495 1.00 1.23 H new ATOM 0 HB3 LEU A 7 -13.306 4.784 2.003 1.00 1.23 H new ATOM 0 HG LEU A 7 -12.860 4.135 -0.346 1.00 1.37 H new ATOM 0 HD11 LEU A 7 -13.030 5.836 -2.141 1.00 2.05 H new ATOM 0 HD12 LEU A 7 -14.618 5.535 -1.394 1.00 2.05 H new ATOM 0 HD13 LEU A 7 -13.701 7.001 -0.974 1.00 2.05 H new ATOM 0 HD21 LEU A 7 -10.949 5.663 -0.764 1.00 1.67 H new ATOM 0 HD22 LEU A 7 -11.624 6.826 0.402 1.00 1.67 H new ATOM 0 HD23 LEU A 7 -11.056 5.234 0.959 1.00 1.67 H new ATOM 131 N GLU A 8 -15.788 5.156 3.267 1.00 1.07 N ATOM 132 CA GLU A 8 -16.322 4.707 4.580 1.00 1.16 C ATOM 133 C GLU A 8 -17.848 4.662 4.547 1.00 1.10 C ATOM 134 O GLU A 8 -18.432 3.606 4.600 1.00 1.03 O ATOM 135 CB GLU A 8 -15.868 5.676 5.672 1.00 1.37 C ATOM 136 CG GLU A 8 -16.644 5.392 6.960 1.00 1.46 C ATOM 137 CD GLU A 8 -15.898 5.997 8.151 1.00 1.74 C ATOM 138 OE1 GLU A 8 -14.818 5.519 8.453 1.00 2.13 O ATOM 139 OE2 GLU A 8 -16.422 6.929 8.741 1.00 2.33 O ATOM 0 H GLU A 8 -15.454 6.119 3.237 1.00 1.07 H new ATOM 0 HA GLU A 8 -15.943 3.707 4.790 1.00 1.16 H new ATOM 0 HB2 GLU A 8 -14.798 5.567 5.848 1.00 1.37 H new ATOM 0 HB3 GLU A 8 -16.036 6.705 5.353 1.00 1.37 H new ATOM 0 HG2 GLU A 8 -17.647 5.814 6.893 1.00 1.46 H new ATOM 0 HG3 GLU A 8 -16.759 4.317 7.098 1.00 1.46 H new ATOM 146 N ILE A 9 -18.486 5.799 4.453 1.00 1.18 N ATOM 147 CA ILE A 9 -19.986 5.817 4.436 1.00 1.23 C ATOM 148 C ILE A 9 -20.475 4.540 3.744 1.00 1.11 C ATOM 149 O ILE A 9 -21.387 3.877 4.199 1.00 1.20 O ATOM 150 CB ILE A 9 -20.493 7.046 3.672 1.00 1.31 C ATOM 151 CG1 ILE A 9 -19.944 8.326 4.320 1.00 1.91 C ATOM 152 CG2 ILE A 9 -22.022 7.070 3.706 1.00 1.86 C ATOM 153 CD1 ILE A 9 -20.854 8.772 5.469 1.00 2.19 C ATOM 0 H ILE A 9 -18.040 6.714 4.387 1.00 1.18 H new ATOM 0 HA ILE A 9 -20.367 5.865 5.456 1.00 1.23 H new ATOM 0 HB ILE A 9 -20.151 6.994 2.638 1.00 1.31 H new ATOM 0 HG12 ILE A 9 -18.935 8.149 4.693 1.00 1.91 H new ATOM 0 HG13 ILE A 9 -19.873 9.118 3.574 1.00 1.91 H new ATOM 0 HG21 ILE A 9 -22.384 7.943 3.163 1.00 1.86 H new ATOM 0 HG22 ILE A 9 -22.411 6.165 3.239 1.00 1.86 H new ATOM 0 HG23 ILE A 9 -22.362 7.119 4.740 1.00 1.86 H new ATOM 0 HD11 ILE A 9 -20.453 9.680 5.919 1.00 2.19 H new ATOM 0 HD12 ILE A 9 -21.855 8.969 5.085 1.00 2.19 H new ATOM 0 HD13 ILE A 9 -20.902 7.985 6.221 1.00 2.19 H new ATOM 165 N ILE A 10 -19.847 4.184 2.662 1.00 0.96 N ATOM 166 CA ILE A 10 -20.235 2.939 1.939 1.00 0.91 C ATOM 167 C ILE A 10 -20.010 1.741 2.860 1.00 0.82 C ATOM 168 O ILE A 10 -20.912 0.972 3.119 1.00 0.85 O ATOM 169 CB ILE A 10 -19.411 2.792 0.647 1.00 0.92 C ATOM 170 CG1 ILE A 10 -20.205 3.428 -0.508 1.00 1.11 C ATOM 171 CG2 ILE A 10 -19.159 1.304 0.352 1.00 0.92 C ATOM 172 CD1 ILE A 10 -19.393 3.388 -1.808 1.00 1.39 C ATOM 0 H ILE A 10 -19.076 4.704 2.242 1.00 0.96 H new ATOM 0 HA ILE A 10 -21.288 2.989 1.662 1.00 0.91 H new ATOM 0 HB ILE A 10 -18.448 3.290 0.759 1.00 0.92 H new ATOM 0 HG12 ILE A 10 -21.147 2.897 -0.645 1.00 1.11 H new ATOM 0 HG13 ILE A 10 -20.454 4.460 -0.260 1.00 1.11 H new ATOM 0 HG21 ILE A 10 -18.575 1.208 -0.564 1.00 0.92 H new ATOM 0 HG22 ILE A 10 -18.610 0.857 1.181 1.00 0.92 H new ATOM 0 HG23 ILE A 10 -20.113 0.791 0.230 1.00 0.92 H new ATOM 0 HD11 ILE A 10 -19.971 3.842 -2.612 1.00 1.39 H new ATOM 0 HD12 ILE A 10 -18.463 3.940 -1.673 1.00 1.39 H new ATOM 0 HD13 ILE A 10 -19.166 2.353 -2.064 1.00 1.39 H new ATOM 184 N GLN A 11 -18.807 1.576 3.353 1.00 0.77 N ATOM 185 CA GLN A 11 -18.520 0.425 4.258 1.00 0.74 C ATOM 186 C GLN A 11 -19.669 0.264 5.255 1.00 0.80 C ATOM 187 O GLN A 11 -20.150 -0.826 5.493 1.00 0.78 O ATOM 188 CB GLN A 11 -17.219 0.688 5.019 1.00 0.77 C ATOM 189 CG GLN A 11 -16.026 0.415 4.102 1.00 1.36 C ATOM 190 CD GLN A 11 -14.746 0.927 4.765 1.00 1.62 C ATOM 191 OE1 GLN A 11 -14.214 2.045 4.353 1.00 2.31 O flip ATOM 192 NE2 GLN A 11 -14.225 0.304 5.668 1.00 1.94 N flip ATOM 0 H GLN A 11 -18.013 2.189 3.167 1.00 0.77 H new ATOM 0 HA GLN A 11 -18.419 -0.486 3.668 1.00 0.74 H new ATOM 0 HB2 GLN A 11 -17.193 1.720 5.370 1.00 0.77 H new ATOM 0 HB3 GLN A 11 -17.166 0.050 5.901 1.00 0.77 H new ATOM 0 HG2 GLN A 11 -15.943 -0.654 3.904 1.00 1.36 H new ATOM 0 HG3 GLN A 11 -16.172 0.907 3.141 1.00 1.36 H new ATOM 0 HE21 GLN A 11 -14.640 -0.570 5.991 1.00 1.94 H new ATOM 0 HE22 GLN A 11 -13.372 0.655 6.104 1.00 1.94 H new ATOM 201 N ALA A 12 -20.133 1.346 5.821 1.00 0.90 N ATOM 202 CA ALA A 12 -21.271 1.256 6.777 1.00 0.98 C ATOM 203 C ALA A 12 -22.505 0.749 6.030 1.00 0.94 C ATOM 204 O ALA A 12 -23.304 0.001 6.560 1.00 0.94 O ATOM 205 CB ALA A 12 -21.560 2.639 7.362 1.00 1.11 C ATOM 0 H ALA A 12 -19.773 2.287 5.662 1.00 0.90 H new ATOM 0 HA ALA A 12 -21.020 0.571 7.587 1.00 0.98 H new ATOM 0 HB1 ALA A 12 -22.393 2.571 8.061 1.00 1.11 H new ATOM 0 HB2 ALA A 12 -20.676 3.005 7.885 1.00 1.11 H new ATOM 0 HB3 ALA A 12 -21.817 3.328 6.557 1.00 1.11 H new ATOM 211 N ILE A 13 -22.654 1.140 4.792 1.00 0.90 N ATOM 212 CA ILE A 13 -23.826 0.671 4.000 1.00 0.86 C ATOM 213 C ILE A 13 -23.655 -0.815 3.691 1.00 0.75 C ATOM 214 O ILE A 13 -24.587 -1.598 3.773 1.00 0.72 O ATOM 215 CB ILE A 13 -23.930 1.464 2.696 1.00 0.87 C ATOM 216 CG1 ILE A 13 -24.270 2.921 3.015 1.00 1.03 C ATOM 217 CG2 ILE A 13 -25.032 0.864 1.823 1.00 0.85 C ATOM 218 CD1 ILE A 13 -24.062 3.777 1.766 1.00 1.06 C ATOM 0 H ILE A 13 -22.016 1.763 4.297 1.00 0.90 H new ATOM 0 HA ILE A 13 -24.739 0.825 4.575 1.00 0.86 H new ATOM 0 HB ILE A 13 -22.980 1.419 2.164 1.00 0.87 H new ATOM 0 HG12 ILE A 13 -25.303 2.999 3.355 1.00 1.03 H new ATOM 0 HG13 ILE A 13 -23.639 3.284 3.827 1.00 1.03 H new ATOM 0 HG21 ILE A 13 -25.107 1.428 0.893 1.00 0.85 H new ATOM 0 HG22 ILE A 13 -24.793 -0.175 1.598 1.00 0.85 H new ATOM 0 HG23 ILE A 13 -25.983 0.911 2.354 1.00 0.85 H new ATOM 0 HD11 ILE A 13 -24.304 4.815 1.992 1.00 1.06 H new ATOM 0 HD12 ILE A 13 -23.022 3.708 1.447 1.00 1.06 H new ATOM 0 HD13 ILE A 13 -24.711 3.419 0.967 1.00 1.06 H new ATOM 230 N LEU A 14 -22.462 -1.216 3.352 1.00 0.74 N ATOM 231 CA LEU A 14 -22.209 -2.645 3.046 1.00 0.65 C ATOM 232 C LEU A 14 -22.489 -3.488 4.291 1.00 0.67 C ATOM 233 O LEU A 14 -23.106 -4.527 4.230 1.00 0.64 O ATOM 234 CB LEU A 14 -20.739 -2.814 2.651 1.00 0.65 C ATOM 235 CG LEU A 14 -20.636 -3.425 1.251 1.00 0.67 C ATOM 236 CD1 LEU A 14 -19.176 -3.410 0.797 1.00 0.61 C ATOM 237 CD2 LEU A 14 -21.140 -4.869 1.290 1.00 1.04 C ATOM 0 H LEU A 14 -21.647 -0.608 3.274 1.00 0.74 H new ATOM 0 HA LEU A 14 -22.857 -2.968 2.231 1.00 0.65 H new ATOM 0 HB2 LEU A 14 -20.236 -1.847 2.672 1.00 0.65 H new ATOM 0 HB3 LEU A 14 -20.232 -3.454 3.373 1.00 0.65 H new ATOM 0 HG LEU A 14 -21.241 -2.845 0.554 1.00 0.67 H new ATOM 0 HD11 LEU A 14 -19.100 -3.845 -0.200 1.00 0.61 H new ATOM 0 HD12 LEU A 14 -18.813 -2.383 0.773 1.00 0.61 H new ATOM 0 HD13 LEU A 14 -18.572 -3.992 1.493 1.00 0.61 H new ATOM 0 HD21 LEU A 14 -21.068 -5.307 0.294 1.00 1.04 H new ATOM 0 HD22 LEU A 14 -20.532 -5.448 1.986 1.00 1.04 H new ATOM 0 HD23 LEU A 14 -22.179 -4.883 1.618 1.00 1.04 H new ATOM 249 N GLU A 15 -22.033 -3.040 5.420 1.00 0.75 N ATOM 250 CA GLU A 15 -22.261 -3.804 6.675 1.00 0.80 C ATOM 251 C GLU A 15 -23.730 -3.730 7.089 1.00 0.83 C ATOM 252 O GLU A 15 -24.225 -4.575 7.803 1.00 0.85 O ATOM 253 CB GLU A 15 -21.389 -3.233 7.793 1.00 0.87 C ATOM 254 CG GLU A 15 -20.219 -4.182 8.054 1.00 0.89 C ATOM 255 CD GLU A 15 -19.414 -3.681 9.254 1.00 1.01 C ATOM 256 OE1 GLU A 15 -20.005 -3.055 10.118 1.00 1.43 O ATOM 257 OE2 GLU A 15 -18.221 -3.934 9.288 1.00 1.53 O ATOM 0 H GLU A 15 -21.509 -2.172 5.531 1.00 0.75 H new ATOM 0 HA GLU A 15 -21.996 -4.847 6.499 1.00 0.80 H new ATOM 0 HB2 GLU A 15 -21.017 -2.247 7.513 1.00 0.87 H new ATOM 0 HB3 GLU A 15 -21.979 -3.105 8.701 1.00 0.87 H new ATOM 0 HG2 GLU A 15 -20.589 -5.189 8.246 1.00 0.89 H new ATOM 0 HG3 GLU A 15 -19.580 -4.240 7.173 1.00 0.89 H new ATOM 264 N ALA A 16 -24.434 -2.729 6.658 1.00 0.85 N ATOM 265 CA ALA A 16 -25.857 -2.627 7.047 1.00 0.88 C ATOM 266 C ALA A 16 -26.633 -3.712 6.327 1.00 0.83 C ATOM 267 O ALA A 16 -27.557 -4.292 6.860 1.00 0.86 O ATOM 268 CB ALA A 16 -26.391 -1.257 6.652 1.00 0.91 C ATOM 0 H ALA A 16 -24.087 -1.982 6.057 1.00 0.85 H new ATOM 0 HA ALA A 16 -25.965 -2.751 8.125 1.00 0.88 H new ATOM 0 HB1 ALA A 16 -27.440 -1.179 6.938 1.00 0.91 H new ATOM 0 HB2 ALA A 16 -25.818 -0.482 7.161 1.00 0.91 H new ATOM 0 HB3 ALA A 16 -26.298 -1.127 5.574 1.00 0.91 H new ATOM 274 N CYS A 17 -26.268 -3.989 5.109 1.00 0.76 N ATOM 275 CA CYS A 17 -26.988 -5.025 4.355 1.00 0.72 C ATOM 276 C CYS A 17 -26.439 -6.423 4.693 1.00 0.71 C ATOM 277 O CYS A 17 -26.991 -7.420 4.289 1.00 0.71 O ATOM 278 CB CYS A 17 -26.846 -4.737 2.865 1.00 0.65 C ATOM 279 SG CYS A 17 -25.140 -4.287 2.492 1.00 0.81 S ATOM 0 H CYS A 17 -25.501 -3.538 4.610 1.00 0.76 H new ATOM 0 HA CYS A 17 -28.043 -5.009 4.630 1.00 0.72 H new ATOM 0 HB2 CYS A 17 -27.136 -5.614 2.286 1.00 0.65 H new ATOM 0 HB3 CYS A 17 -27.517 -3.928 2.576 1.00 0.65 H new ATOM 0 HG CYS A 17 -24.370 -4.652 3.474 1.00 0.81 H new ATOM 285 N LYS A 18 -25.341 -6.520 5.403 1.00 0.72 N ATOM 286 CA LYS A 18 -24.775 -7.869 5.725 1.00 0.73 C ATOM 287 C LYS A 18 -25.848 -8.833 6.264 1.00 0.83 C ATOM 288 O LYS A 18 -25.555 -9.977 6.546 1.00 0.87 O ATOM 289 CB LYS A 18 -23.665 -7.727 6.768 1.00 0.78 C ATOM 290 CG LYS A 18 -24.275 -7.480 8.151 1.00 1.34 C ATOM 291 CD LYS A 18 -23.193 -6.959 9.100 1.00 1.96 C ATOM 292 CE LYS A 18 -22.151 -8.053 9.348 1.00 2.36 C ATOM 293 NZ LYS A 18 -21.323 -7.688 10.530 1.00 2.97 N ATOM 0 H LYS A 18 -24.814 -5.728 5.772 1.00 0.72 H new ATOM 0 HA LYS A 18 -24.379 -8.286 4.799 1.00 0.73 H new ATOM 0 HB2 LYS A 18 -23.054 -8.630 6.787 1.00 0.78 H new ATOM 0 HB3 LYS A 18 -23.006 -6.902 6.499 1.00 0.78 H new ATOM 0 HG2 LYS A 18 -25.088 -6.758 8.078 1.00 1.34 H new ATOM 0 HG3 LYS A 18 -24.703 -8.403 8.542 1.00 1.34 H new ATOM 0 HD2 LYS A 18 -22.714 -6.078 8.672 1.00 1.96 H new ATOM 0 HD3 LYS A 18 -23.642 -6.651 10.044 1.00 1.96 H new ATOM 0 HE2 LYS A 18 -22.645 -9.010 9.518 1.00 2.36 H new ATOM 0 HE3 LYS A 18 -21.517 -8.173 8.469 1.00 2.36 H new ATOM 0 HZ1 LYS A 18 -20.614 -8.430 10.700 1.00 2.97 H new ATOM 0 HZ2 LYS A 18 -20.841 -6.784 10.351 1.00 2.97 H new ATOM 0 HZ3 LYS A 18 -21.934 -7.595 11.366 1.00 2.97 H new ATOM 307 N SER A 19 -27.075 -8.408 6.429 1.00 0.88 N ATOM 308 CA SER A 19 -28.099 -9.352 6.967 1.00 0.99 C ATOM 309 C SER A 19 -29.515 -8.905 6.585 1.00 1.05 C ATOM 310 O SER A 19 -30.468 -9.190 7.282 1.00 1.21 O ATOM 311 CB SER A 19 -27.984 -9.405 8.490 1.00 1.07 C ATOM 312 OG SER A 19 -26.701 -9.902 8.847 1.00 1.10 O ATOM 0 H SER A 19 -27.407 -7.467 6.219 1.00 0.88 H new ATOM 0 HA SER A 19 -27.919 -10.338 6.538 1.00 0.99 H new ATOM 0 HB2 SER A 19 -28.132 -8.411 8.912 1.00 1.07 H new ATOM 0 HB3 SER A 19 -28.763 -10.046 8.903 1.00 1.07 H new ATOM 0 HG SER A 19 -26.292 -10.338 8.071 1.00 1.10 H new ATOM 318 N GLY A 20 -29.672 -8.221 5.484 1.00 0.94 N ATOM 319 CA GLY A 20 -31.040 -7.784 5.078 1.00 1.01 C ATOM 320 C GLY A 20 -31.514 -6.666 5.999 1.00 1.07 C ATOM 321 O GLY A 20 -31.952 -6.907 7.106 1.00 1.15 O ATOM 0 H GLY A 20 -28.919 -7.947 4.852 1.00 0.94 H new ATOM 0 HA2 GLY A 20 -31.030 -7.438 4.044 1.00 1.01 H new ATOM 0 HA3 GLY A 20 -31.731 -8.626 5.126 1.00 1.01 H new ATOM 325 N SER A 21 -31.399 -5.442 5.566 1.00 1.06 N ATOM 326 CA SER A 21 -31.809 -4.308 6.436 1.00 1.14 C ATOM 327 C SER A 21 -32.370 -3.163 5.570 1.00 1.14 C ATOM 328 O SER A 21 -31.708 -2.719 4.652 1.00 1.07 O ATOM 329 CB SER A 21 -30.566 -3.812 7.166 1.00 1.14 C ATOM 330 OG SER A 21 -29.744 -4.925 7.496 1.00 1.09 O ATOM 0 H SER A 21 -31.039 -5.179 4.648 1.00 1.06 H new ATOM 0 HA SER A 21 -32.576 -4.630 7.141 1.00 1.14 H new ATOM 0 HB2 SER A 21 -30.016 -3.111 6.538 1.00 1.14 H new ATOM 0 HB3 SER A 21 -30.851 -3.274 8.070 1.00 1.14 H new ATOM 0 HG SER A 21 -28.842 -4.782 7.141 1.00 1.09 H new ATOM 336 N PRO A 22 -33.567 -2.663 5.845 1.00 1.23 N ATOM 337 CA PRO A 22 -34.137 -1.538 5.050 1.00 1.26 C ATOM 338 C PRO A 22 -33.161 -0.362 4.995 1.00 1.26 C ATOM 339 O PRO A 22 -32.202 -0.322 5.736 1.00 1.25 O ATOM 340 CB PRO A 22 -35.403 -1.130 5.807 1.00 1.35 C ATOM 341 CG PRO A 22 -35.772 -2.298 6.657 1.00 1.47 C ATOM 342 CD PRO A 22 -34.494 -3.100 6.909 1.00 1.34 C ATOM 0 HA PRO A 22 -34.338 -1.830 4.019 1.00 1.26 H new ATOM 0 HB2 PRO A 22 -35.224 -0.245 6.418 1.00 1.35 H new ATOM 0 HB3 PRO A 22 -36.208 -0.882 5.115 1.00 1.35 H new ATOM 0 HG2 PRO A 22 -36.209 -1.965 7.599 1.00 1.47 H new ATOM 0 HG3 PRO A 22 -36.520 -2.914 6.159 1.00 1.47 H new ATOM 0 HD2 PRO A 22 -34.086 -2.896 7.899 1.00 1.34 H new ATOM 0 HD3 PRO A 22 -34.682 -4.172 6.856 1.00 1.34 H new ATOM 350 N LYS A 23 -33.384 0.591 4.132 1.00 1.27 N ATOM 351 CA LYS A 23 -32.443 1.746 4.056 1.00 1.28 C ATOM 352 C LYS A 23 -32.421 2.479 5.404 1.00 1.33 C ATOM 353 O LYS A 23 -31.426 3.063 5.782 1.00 1.35 O ATOM 354 CB LYS A 23 -32.900 2.713 2.949 1.00 1.31 C ATOM 355 CG LYS A 23 -31.753 3.662 2.546 1.00 1.27 C ATOM 356 CD LYS A 23 -32.209 5.114 2.697 1.00 1.83 C ATOM 357 CE LYS A 23 -33.335 5.409 1.701 1.00 1.76 C ATOM 358 NZ LYS A 23 -32.861 6.403 0.696 1.00 2.13 N ATOM 0 H LYS A 23 -34.169 0.621 3.482 1.00 1.27 H new ATOM 0 HA LYS A 23 -31.442 1.382 3.826 1.00 1.28 H new ATOM 0 HB2 LYS A 23 -33.233 2.147 2.079 1.00 1.31 H new ATOM 0 HB3 LYS A 23 -33.754 3.294 3.297 1.00 1.31 H new ATOM 0 HG2 LYS A 23 -30.879 3.478 3.171 1.00 1.27 H new ATOM 0 HG3 LYS A 23 -31.454 3.470 1.516 1.00 1.27 H new ATOM 0 HD2 LYS A 23 -32.555 5.292 3.715 1.00 1.83 H new ATOM 0 HD3 LYS A 23 -31.371 5.788 2.523 1.00 1.83 H new ATOM 0 HE2 LYS A 23 -33.644 4.490 1.202 1.00 1.76 H new ATOM 0 HE3 LYS A 23 -34.208 5.795 2.227 1.00 1.76 H new ATOM 0 HZ1 LYS A 23 -33.371 7.300 0.828 1.00 2.13 H new ATOM 0 HZ2 LYS A 23 -31.841 6.563 0.820 1.00 2.13 H new ATOM 0 HZ3 LYS A 23 -33.040 6.040 -0.262 1.00 2.13 H new ATOM 372 N THR A 24 -33.509 2.458 6.134 1.00 1.35 N ATOM 373 CA THR A 24 -33.551 3.155 7.458 1.00 1.41 C ATOM 374 C THR A 24 -32.602 2.494 8.469 1.00 1.43 C ATOM 375 O THR A 24 -31.896 3.167 9.194 1.00 1.48 O ATOM 376 CB THR A 24 -34.979 3.111 8.004 1.00 1.40 C ATOM 377 OG1 THR A 24 -35.248 1.814 8.518 1.00 1.42 O ATOM 378 CG2 THR A 24 -35.967 3.433 6.882 1.00 1.42 C ATOM 0 H THR A 24 -34.374 1.986 5.869 1.00 1.35 H new ATOM 0 HA THR A 24 -33.230 4.186 7.312 1.00 1.41 H new ATOM 0 HB THR A 24 -35.086 3.847 8.801 1.00 1.40 H new ATOM 0 HG1 THR A 24 -36.162 1.785 8.870 1.00 1.42 H new ATOM 0 HG21 THR A 24 -36.984 3.401 7.273 1.00 1.42 H new ATOM 0 HG22 THR A 24 -35.760 4.429 6.489 1.00 1.42 H new ATOM 0 HG23 THR A 24 -35.862 2.699 6.083 1.00 1.42 H new ATOM 386 N ARG A 25 -32.586 1.187 8.539 1.00 1.40 N ATOM 387 CA ARG A 25 -31.691 0.494 9.519 1.00 1.43 C ATOM 388 C ARG A 25 -30.238 0.866 9.231 1.00 1.44 C ATOM 389 O ARG A 25 -29.331 0.507 9.955 1.00 1.47 O ATOM 390 CB ARG A 25 -31.862 -1.023 9.363 1.00 1.39 C ATOM 391 CG ARG A 25 -32.814 -1.572 10.431 1.00 1.72 C ATOM 392 CD ARG A 25 -32.019 -1.934 11.686 1.00 1.56 C ATOM 393 NE ARG A 25 -32.943 -2.480 12.720 1.00 2.13 N ATOM 394 CZ ARG A 25 -32.469 -3.177 13.716 1.00 2.45 C ATOM 395 NH1 ARG A 25 -31.185 -3.399 13.806 1.00 2.53 N ATOM 396 NH2 ARG A 25 -33.278 -3.654 14.623 1.00 3.15 N ATOM 0 H ARG A 25 -33.154 0.568 7.960 1.00 1.40 H new ATOM 0 HA ARG A 25 -31.951 0.797 10.533 1.00 1.43 H new ATOM 0 HB2 ARG A 25 -32.251 -1.250 8.370 1.00 1.39 H new ATOM 0 HB3 ARG A 25 -30.892 -1.514 9.446 1.00 1.39 H new ATOM 0 HG2 ARG A 25 -33.575 -0.829 10.671 1.00 1.72 H new ATOM 0 HG3 ARG A 25 -33.335 -2.451 10.052 1.00 1.72 H new ATOM 0 HD2 ARG A 25 -31.252 -2.670 11.444 1.00 1.56 H new ATOM 0 HD3 ARG A 25 -31.506 -1.053 12.071 1.00 1.56 H new ATOM 0 HE ARG A 25 -33.946 -2.309 12.649 1.00 2.13 H new ATOM 0 HH11 ARG A 25 -30.552 -3.027 13.097 1.00 2.53 H new ATOM 0 HH12 ARG A 25 -30.815 -3.944 14.585 1.00 2.53 H new ATOM 0 HH21 ARG A 25 -34.281 -3.482 14.553 1.00 3.15 H new ATOM 0 HH22 ARG A 25 -32.907 -4.199 15.401 1.00 3.15 H new ATOM 410 N ILE A 26 -30.021 1.580 8.170 1.00 1.41 N ATOM 411 CA ILE A 26 -28.643 1.977 7.821 1.00 1.41 C ATOM 412 C ILE A 26 -28.304 3.284 8.540 1.00 1.49 C ATOM 413 O ILE A 26 -27.157 3.580 8.807 1.00 1.50 O ATOM 414 CB ILE A 26 -28.544 2.085 6.301 1.00 1.34 C ATOM 415 CG1 ILE A 26 -29.181 0.809 5.723 1.00 1.28 C ATOM 416 CG2 ILE A 26 -27.075 2.187 5.890 1.00 1.34 C ATOM 417 CD1 ILE A 26 -28.751 0.559 4.274 1.00 0.96 C ATOM 0 H ILE A 26 -30.744 1.906 7.528 1.00 1.41 H new ATOM 0 HA ILE A 26 -27.913 1.237 8.147 1.00 1.41 H new ATOM 0 HB ILE A 26 -29.057 2.971 5.928 1.00 1.34 H new ATOM 0 HG12 ILE A 26 -28.900 -0.047 6.337 1.00 1.28 H new ATOM 0 HG13 ILE A 26 -30.267 0.893 5.770 1.00 1.28 H new ATOM 0 HG21 ILE A 26 -27.005 2.264 4.805 1.00 1.34 H new ATOM 0 HG22 ILE A 26 -26.630 3.072 6.346 1.00 1.34 H new ATOM 0 HG23 ILE A 26 -26.541 1.298 6.226 1.00 1.34 H new ATOM 0 HD11 ILE A 26 -29.224 -0.351 3.906 1.00 0.96 H new ATOM 0 HD12 ILE A 26 -29.055 1.402 3.654 1.00 0.96 H new ATOM 0 HD13 ILE A 26 -27.668 0.448 4.230 1.00 0.96 H new ATOM 429 N MET A 27 -29.301 4.058 8.879 1.00 1.55 N ATOM 430 CA MET A 27 -29.035 5.331 9.610 1.00 1.64 C ATOM 431 C MET A 27 -28.311 4.995 10.916 1.00 1.70 C ATOM 432 O MET A 27 -27.369 5.658 11.305 1.00 1.74 O ATOM 433 CB MET A 27 -30.351 6.061 9.883 1.00 1.72 C ATOM 434 CG MET A 27 -30.064 7.459 10.421 1.00 2.02 C ATOM 435 SD MET A 27 -31.337 7.914 11.624 1.00 2.29 S ATOM 436 CE MET A 27 -32.535 8.594 10.451 1.00 1.90 C ATOM 0 H MET A 27 -30.283 3.865 8.682 1.00 1.55 H new ATOM 0 HA MET A 27 -28.408 5.991 9.010 1.00 1.64 H new ATOM 0 HB2 MET A 27 -30.938 6.127 8.967 1.00 1.72 H new ATOM 0 HB3 MET A 27 -30.947 5.499 10.603 1.00 1.72 H new ATOM 0 HG2 MET A 27 -29.080 7.485 10.889 1.00 2.02 H new ATOM 0 HG3 MET A 27 -30.047 8.179 9.603 1.00 2.02 H new ATOM 0 HE1 MET A 27 -33.416 8.941 10.991 1.00 1.90 H new ATOM 0 HE2 MET A 27 -32.085 9.430 9.915 1.00 1.90 H new ATOM 0 HE3 MET A 27 -32.826 7.821 9.739 1.00 1.90 H new ATOM 446 N TYR A 28 -28.725 3.949 11.582 1.00 1.72 N ATOM 447 CA TYR A 28 -28.043 3.545 12.845 1.00 1.80 C ATOM 448 C TYR A 28 -26.572 3.251 12.532 1.00 1.78 C ATOM 449 O TYR A 28 -25.773 2.987 13.408 1.00 2.09 O ATOM 450 CB TYR A 28 -28.706 2.280 13.390 1.00 1.82 C ATOM 451 CG TYR A 28 -28.104 1.921 14.726 1.00 2.02 C ATOM 452 CD1 TYR A 28 -28.632 2.467 15.902 1.00 2.25 C ATOM 453 CD2 TYR A 28 -27.019 1.037 14.791 1.00 2.64 C ATOM 454 CE1 TYR A 28 -28.078 2.128 17.143 1.00 2.48 C ATOM 455 CE2 TYR A 28 -26.464 0.701 16.031 1.00 3.00 C ATOM 456 CZ TYR A 28 -26.993 1.246 17.207 1.00 2.69 C ATOM 457 OH TYR A 28 -26.447 0.912 18.429 1.00 3.10 O ATOM 0 H TYR A 28 -29.508 3.357 11.304 1.00 1.72 H new ATOM 0 HA TYR A 28 -28.116 4.342 13.585 1.00 1.80 H new ATOM 0 HB2 TYR A 28 -29.779 2.438 13.495 1.00 1.82 H new ATOM 0 HB3 TYR A 28 -28.572 1.457 12.688 1.00 1.82 H new ATOM 0 HD1 TYR A 28 -29.467 3.150 15.852 1.00 2.25 H new ATOM 0 HD2 TYR A 28 -26.611 0.615 13.884 1.00 2.64 H new ATOM 0 HE1 TYR A 28 -28.488 2.547 18.050 1.00 2.48 H new ATOM 0 HE2 TYR A 28 -25.627 0.021 16.081 1.00 3.00 H new ATOM 0 HH TYR A 28 -25.703 0.289 18.295 1.00 3.10 H new ATOM 467 N GLY A 29 -26.223 3.309 11.278 1.00 1.51 N ATOM 468 CA GLY A 29 -24.812 3.051 10.870 1.00 1.48 C ATOM 469 C GLY A 29 -24.075 4.385 10.745 1.00 1.54 C ATOM 470 O GLY A 29 -22.876 4.468 10.926 1.00 1.61 O ATOM 0 H GLY A 29 -26.859 3.526 10.511 1.00 1.51 H new ATOM 0 HA2 GLY A 29 -24.318 2.416 11.606 1.00 1.48 H new ATOM 0 HA3 GLY A 29 -24.787 2.517 9.920 1.00 1.48 H new ATOM 474 N ALA A 30 -24.791 5.428 10.434 1.00 1.57 N ATOM 475 CA ALA A 30 -24.157 6.767 10.288 1.00 1.67 C ATOM 476 C ALA A 30 -25.193 7.736 9.723 1.00 1.71 C ATOM 477 O ALA A 30 -26.221 7.324 9.222 1.00 1.72 O ATOM 478 CB ALA A 30 -22.971 6.672 9.321 1.00 1.66 C ATOM 0 H ALA A 30 -25.798 5.410 10.273 1.00 1.57 H new ATOM 0 HA ALA A 30 -23.802 7.118 11.257 1.00 1.67 H new ATOM 0 HB1 ALA A 30 -22.508 7.653 9.215 1.00 1.66 H new ATOM 0 HB2 ALA A 30 -22.239 5.965 9.712 1.00 1.66 H new ATOM 0 HB3 ALA A 30 -23.322 6.330 8.347 1.00 1.66 H new ATOM 484 N ASN A 31 -24.937 9.014 9.786 1.00 1.82 N ATOM 485 CA ASN A 31 -25.918 9.986 9.230 1.00 1.87 C ATOM 486 C ASN A 31 -26.300 9.514 7.830 1.00 1.82 C ATOM 487 O ASN A 31 -25.494 9.540 6.923 1.00 2.17 O ATOM 488 CB ASN A 31 -25.273 11.373 9.145 1.00 2.00 C ATOM 489 CG ASN A 31 -26.134 12.390 9.896 1.00 2.22 C ATOM 490 OD1 ASN A 31 -25.743 12.886 10.934 1.00 2.79 O ATOM 491 ND2 ASN A 31 -27.297 12.726 9.409 1.00 2.38 N ATOM 0 H ASN A 31 -24.098 9.424 10.195 1.00 1.82 H new ATOM 0 HA ASN A 31 -26.800 10.046 9.867 1.00 1.87 H new ATOM 0 HB2 ASN A 31 -24.271 11.345 9.572 1.00 2.00 H new ATOM 0 HB3 ASN A 31 -25.167 11.672 8.102 1.00 2.00 H new ATOM 0 HD21 ASN A 31 -27.878 13.405 9.900 1.00 2.38 H new ATOM 0 HD22 ASN A 31 -27.625 12.309 8.538 1.00 2.38 H new ATOM 498 N LEU A 32 -27.507 9.056 7.638 1.00 1.81 N ATOM 499 CA LEU A 32 -27.885 8.558 6.293 1.00 1.70 C ATOM 500 C LEU A 32 -28.208 9.710 5.366 1.00 1.72 C ATOM 501 O LEU A 32 -29.133 10.472 5.547 1.00 1.84 O ATOM 502 CB LEU A 32 -29.083 7.612 6.411 1.00 1.75 C ATOM 503 CG LEU A 32 -28.774 6.254 5.748 1.00 1.74 C ATOM 504 CD1 LEU A 32 -28.634 6.424 4.239 1.00 1.67 C ATOM 505 CD2 LEU A 32 -27.463 5.661 6.289 1.00 1.69 C ATOM 0 H LEU A 32 -28.238 9.007 8.348 1.00 1.81 H new ATOM 0 HA LEU A 32 -27.041 8.013 5.870 1.00 1.70 H new ATOM 0 HB2 LEU A 32 -29.331 7.461 7.462 1.00 1.75 H new ATOM 0 HB3 LEU A 32 -29.956 8.062 5.939 1.00 1.75 H new ATOM 0 HG LEU A 32 -29.600 5.581 5.979 1.00 1.74 H new ATOM 0 HD11 LEU A 32 -28.416 5.458 3.783 1.00 1.67 H new ATOM 0 HD12 LEU A 32 -29.564 6.817 3.829 1.00 1.67 H new ATOM 0 HD13 LEU A 32 -27.821 7.118 4.025 1.00 1.67 H new ATOM 0 HD21 LEU A 32 -27.269 4.704 5.805 1.00 1.69 H new ATOM 0 HD22 LEU A 32 -26.641 6.346 6.081 1.00 1.69 H new ATOM 0 HD23 LEU A 32 -27.548 5.512 7.365 1.00 1.69 H new ATOM 517 N SER A 33 -27.444 9.760 4.330 1.00 1.63 N ATOM 518 CA SER A 33 -27.619 10.746 3.256 1.00 1.66 C ATOM 519 C SER A 33 -28.824 10.290 2.436 1.00 1.68 C ATOM 520 O SER A 33 -29.014 10.726 1.337 1.00 1.69 O ATOM 521 CB SER A 33 -26.356 10.805 2.393 1.00 1.58 C ATOM 522 OG SER A 33 -25.244 10.367 3.164 1.00 1.75 O ATOM 0 H SER A 33 -26.663 9.121 4.179 1.00 1.63 H new ATOM 0 HA SER A 33 -27.786 11.747 3.653 1.00 1.66 H new ATOM 0 HB2 SER A 33 -26.473 10.175 1.511 1.00 1.58 H new ATOM 0 HB3 SER A 33 -26.190 11.822 2.038 1.00 1.58 H new ATOM 0 HG SER A 33 -25.106 9.407 3.023 1.00 1.75 H new ATOM 528 N TYR A 34 -29.556 9.314 2.949 1.00 1.70 N ATOM 529 CA TYR A 34 -30.697 8.674 2.198 1.00 1.73 C ATOM 530 C TYR A 34 -31.225 9.552 1.074 1.00 1.77 C ATOM 531 O TYR A 34 -31.423 9.076 -0.026 1.00 1.71 O ATOM 532 CB TYR A 34 -31.862 8.406 3.158 1.00 1.92 C ATOM 533 CG TYR A 34 -32.557 9.701 3.519 1.00 1.73 C ATOM 534 CD1 TYR A 34 -33.588 10.193 2.707 1.00 1.94 C ATOM 535 CD2 TYR A 34 -32.181 10.403 4.670 1.00 2.49 C ATOM 536 CE1 TYR A 34 -34.237 11.387 3.045 1.00 2.57 C ATOM 537 CE2 TYR A 34 -32.830 11.598 5.007 1.00 3.01 C ATOM 538 CZ TYR A 34 -33.858 12.089 4.195 1.00 2.95 C ATOM 539 OH TYR A 34 -34.497 13.265 4.528 1.00 3.85 O ATOM 0 H TYR A 34 -29.404 8.927 3.880 1.00 1.70 H new ATOM 0 HA TYR A 34 -30.306 7.752 1.769 1.00 1.73 H new ATOM 0 HB2 TYR A 34 -32.573 7.721 2.695 1.00 1.92 H new ATOM 0 HB3 TYR A 34 -31.493 7.920 4.061 1.00 1.92 H new ATOM 0 HD1 TYR A 34 -33.882 9.651 1.820 1.00 1.94 H new ATOM 0 HD2 TYR A 34 -31.390 10.023 5.299 1.00 2.49 H new ATOM 0 HE1 TYR A 34 -35.030 11.766 2.418 1.00 2.57 H new ATOM 0 HE2 TYR A 34 -32.537 12.140 5.894 1.00 3.01 H new ATOM 0 HH TYR A 34 -34.113 13.623 5.355 1.00 3.85 H new ATOM 549 N ALA A 35 -31.429 10.809 1.286 1.00 1.88 N ATOM 550 CA ALA A 35 -31.902 11.628 0.146 1.00 1.95 C ATOM 551 C ALA A 35 -30.885 11.440 -0.984 1.00 1.82 C ATOM 552 O ALA A 35 -31.225 11.196 -2.125 1.00 1.78 O ATOM 553 CB ALA A 35 -31.968 13.100 0.556 1.00 2.11 C ATOM 0 H ALA A 35 -31.295 11.298 2.171 1.00 1.88 H new ATOM 0 HA ALA A 35 -32.899 11.324 -0.172 1.00 1.95 H new ATOM 0 HB1 ALA A 35 -32.316 13.697 -0.287 1.00 2.11 H new ATOM 0 HB2 ALA A 35 -32.658 13.214 1.392 1.00 2.11 H new ATOM 0 HB3 ALA A 35 -30.976 13.439 0.855 1.00 2.11 H new ATOM 559 N LEU A 36 -29.632 11.536 -0.639 1.00 1.76 N ATOM 560 CA LEU A 36 -28.526 11.351 -1.624 1.00 1.66 C ATOM 561 C LEU A 36 -27.969 9.911 -1.581 1.00 1.48 C ATOM 562 O LEU A 36 -27.784 9.281 -2.604 1.00 1.40 O ATOM 563 CB LEU A 36 -27.398 12.336 -1.288 1.00 1.73 C ATOM 564 CG LEU A 36 -27.065 13.209 -2.503 1.00 1.83 C ATOM 565 CD1 LEU A 36 -26.666 12.323 -3.685 1.00 2.23 C ATOM 566 CD2 LEU A 36 -28.287 14.053 -2.883 1.00 2.42 C ATOM 0 H LEU A 36 -29.319 11.740 0.310 1.00 1.76 H new ATOM 0 HA LEU A 36 -28.917 11.535 -2.625 1.00 1.66 H new ATOM 0 HB2 LEU A 36 -27.696 12.967 -0.451 1.00 1.73 H new ATOM 0 HB3 LEU A 36 -26.510 11.787 -0.973 1.00 1.73 H new ATOM 0 HG LEU A 36 -26.234 13.868 -2.252 1.00 1.83 H new ATOM 0 HD11 LEU A 36 -26.430 12.949 -4.546 1.00 2.23 H new ATOM 0 HD12 LEU A 36 -25.791 11.731 -3.417 1.00 2.23 H new ATOM 0 HD13 LEU A 36 -27.492 11.657 -3.936 1.00 2.23 H new ATOM 0 HD21 LEU A 36 -28.047 14.672 -3.747 1.00 2.42 H new ATOM 0 HD22 LEU A 36 -29.121 13.396 -3.128 1.00 2.42 H new ATOM 0 HD23 LEU A 36 -28.563 14.692 -2.044 1.00 2.42 H new ATOM 578 N THR A 37 -27.649 9.415 -0.400 1.00 1.43 N ATOM 579 CA THR A 37 -27.041 8.040 -0.271 1.00 1.30 C ATOM 580 C THR A 37 -27.680 7.068 -1.255 1.00 1.23 C ATOM 581 O THR A 37 -27.049 6.123 -1.698 1.00 1.15 O ATOM 582 CB THR A 37 -27.200 7.513 1.164 1.00 1.36 C ATOM 583 OG1 THR A 37 -26.057 7.883 1.924 1.00 1.49 O ATOM 584 CG2 THR A 37 -27.332 5.980 1.159 1.00 1.33 C ATOM 0 H THR A 37 -27.783 9.906 0.484 1.00 1.43 H new ATOM 0 HA THR A 37 -25.979 8.120 -0.503 1.00 1.30 H new ATOM 0 HB THR A 37 -28.099 7.943 1.604 1.00 1.36 H new ATOM 0 HG1 THR A 37 -25.276 7.936 1.335 1.00 1.49 H new ATOM 0 HG21 THR A 37 -27.444 5.621 2.182 1.00 1.33 H new ATOM 0 HG22 THR A 37 -28.207 5.692 0.576 1.00 1.33 H new ATOM 0 HG23 THR A 37 -26.439 5.539 0.716 1.00 1.33 H new ATOM 592 N GLY A 38 -28.910 7.287 -1.611 1.00 1.26 N ATOM 593 CA GLY A 38 -29.562 6.369 -2.595 1.00 1.21 C ATOM 594 C GLY A 38 -28.564 6.110 -3.733 1.00 1.17 C ATOM 595 O GLY A 38 -28.635 5.127 -4.442 1.00 1.12 O ATOM 0 H GLY A 38 -29.493 8.052 -1.271 1.00 1.26 H new ATOM 0 HA2 GLY A 38 -29.844 5.432 -2.114 1.00 1.21 H new ATOM 0 HA3 GLY A 38 -30.477 6.815 -2.984 1.00 1.21 H new ATOM 599 N ARG A 39 -27.618 7.003 -3.876 1.00 1.22 N ATOM 600 CA ARG A 39 -26.565 6.867 -4.924 1.00 1.23 C ATOM 601 C ARG A 39 -25.590 5.745 -4.542 1.00 1.13 C ATOM 602 O ARG A 39 -25.076 5.045 -5.391 1.00 1.10 O ATOM 603 CB ARG A 39 -25.796 8.189 -5.032 1.00 1.33 C ATOM 604 CG ARG A 39 -24.855 8.156 -6.242 1.00 1.36 C ATOM 605 CD ARG A 39 -23.587 8.957 -5.927 1.00 1.39 C ATOM 606 NE ARG A 39 -22.966 9.425 -7.199 1.00 1.58 N ATOM 607 CZ ARG A 39 -23.425 10.492 -7.795 1.00 2.13 C ATOM 608 NH1 ARG A 39 -24.431 11.144 -7.279 1.00 2.75 N ATOM 609 NH2 ARG A 39 -22.879 10.905 -8.906 1.00 2.58 N ATOM 0 H ARG A 39 -27.531 7.838 -3.297 1.00 1.22 H new ATOM 0 HA ARG A 39 -27.032 6.626 -5.879 1.00 1.23 H new ATOM 0 HB2 ARG A 39 -26.496 9.019 -5.129 1.00 1.33 H new ATOM 0 HB3 ARG A 39 -25.223 8.360 -4.121 1.00 1.33 H new ATOM 0 HG2 ARG A 39 -24.596 7.126 -6.486 1.00 1.36 H new ATOM 0 HG3 ARG A 39 -25.354 8.575 -7.116 1.00 1.36 H new ATOM 0 HD2 ARG A 39 -23.831 9.810 -5.294 1.00 1.39 H new ATOM 0 HD3 ARG A 39 -22.882 8.339 -5.372 1.00 1.39 H new ATOM 0 HE ARG A 39 -22.183 8.912 -7.603 1.00 1.58 H new ATOM 0 HH11 ARG A 39 -24.858 10.820 -6.411 1.00 2.75 H new ATOM 0 HH12 ARG A 39 -24.791 11.978 -7.744 1.00 2.75 H new ATOM 0 HH21 ARG A 39 -22.093 10.394 -9.309 1.00 2.58 H new ATOM 0 HH22 ARG A 39 -23.238 11.739 -9.371 1.00 2.58 H new ATOM 623 N TYR A 40 -25.336 5.563 -3.272 1.00 1.10 N ATOM 624 CA TYR A 40 -24.400 4.478 -2.857 1.00 1.01 C ATOM 625 C TYR A 40 -25.124 3.140 -2.968 1.00 0.91 C ATOM 626 O TYR A 40 -24.586 2.172 -3.468 1.00 0.85 O ATOM 627 CB TYR A 40 -23.931 4.684 -1.406 1.00 1.04 C ATOM 628 CG TYR A 40 -23.325 6.065 -1.214 1.00 1.24 C ATOM 629 CD1 TYR A 40 -22.339 6.550 -2.092 1.00 1.74 C ATOM 630 CD2 TYR A 40 -23.747 6.862 -0.141 1.00 1.92 C ATOM 631 CE1 TYR A 40 -21.791 7.822 -1.892 1.00 2.01 C ATOM 632 CE2 TYR A 40 -23.195 8.133 0.054 1.00 2.17 C ATOM 633 CZ TYR A 40 -22.219 8.613 -0.822 1.00 1.89 C ATOM 634 OH TYR A 40 -21.672 9.866 -0.631 1.00 2.27 O ATOM 0 H TYR A 40 -25.733 6.114 -2.511 1.00 1.10 H new ATOM 0 HA TYR A 40 -23.525 4.496 -3.507 1.00 1.01 H new ATOM 0 HB2 TYR A 40 -24.774 4.557 -0.727 1.00 1.04 H new ATOM 0 HB3 TYR A 40 -23.196 3.922 -1.147 1.00 1.04 H new ATOM 0 HD1 TYR A 40 -22.005 5.941 -2.919 1.00 1.74 H new ATOM 0 HD2 TYR A 40 -24.501 6.494 0.538 1.00 1.92 H new ATOM 0 HE1 TYR A 40 -21.034 8.194 -2.567 1.00 2.01 H new ATOM 0 HE2 TYR A 40 -23.524 8.743 0.882 1.00 2.17 H new ATOM 0 HH TYR A 40 -20.749 9.874 -0.960 1.00 2.27 H new ATOM 644 N ILE A 41 -26.341 3.075 -2.508 1.00 0.89 N ATOM 645 CA ILE A 41 -27.095 1.794 -2.591 1.00 0.80 C ATOM 646 C ILE A 41 -27.294 1.410 -4.061 1.00 0.77 C ATOM 647 O ILE A 41 -26.953 0.321 -4.481 1.00 0.70 O ATOM 648 CB ILE A 41 -28.453 1.956 -1.904 1.00 0.82 C ATOM 649 CG1 ILE A 41 -28.300 1.666 -0.408 1.00 0.92 C ATOM 650 CG2 ILE A 41 -29.461 0.976 -2.507 1.00 0.77 C ATOM 651 CD1 ILE A 41 -29.430 2.344 0.367 1.00 0.95 C ATOM 0 H ILE A 41 -26.845 3.851 -2.079 1.00 0.89 H new ATOM 0 HA ILE A 41 -26.533 1.006 -2.090 1.00 0.80 H new ATOM 0 HB ILE A 41 -28.811 2.975 -2.050 1.00 0.82 H new ATOM 0 HG12 ILE A 41 -28.320 0.590 -0.232 1.00 0.92 H new ATOM 0 HG13 ILE A 41 -27.335 2.029 -0.054 1.00 0.92 H new ATOM 0 HG21 ILE A 41 -30.425 1.096 -2.014 1.00 0.77 H new ATOM 0 HG22 ILE A 41 -29.571 1.177 -3.573 1.00 0.77 H new ATOM 0 HG23 ILE A 41 -29.106 -0.045 -2.365 1.00 0.77 H new ATOM 0 HD11 ILE A 41 -29.318 2.135 1.431 1.00 0.95 H new ATOM 0 HD12 ILE A 41 -29.389 3.421 0.202 1.00 0.95 H new ATOM 0 HD13 ILE A 41 -30.390 1.960 0.021 1.00 0.95 H new ATOM 663 N LYS A 42 -27.838 2.299 -4.844 1.00 0.85 N ATOM 664 CA LYS A 42 -28.052 1.993 -6.287 1.00 0.86 C ATOM 665 C LYS A 42 -26.715 1.585 -6.909 1.00 0.85 C ATOM 666 O LYS A 42 -26.605 0.574 -7.573 1.00 0.82 O ATOM 667 CB LYS A 42 -28.601 3.245 -6.986 1.00 0.98 C ATOM 668 CG LYS A 42 -28.587 3.067 -8.510 1.00 1.09 C ATOM 669 CD LYS A 42 -29.265 1.752 -8.897 1.00 1.05 C ATOM 670 CE LYS A 42 -29.731 1.832 -10.352 1.00 1.07 C ATOM 671 NZ LYS A 42 -29.610 0.491 -10.991 1.00 1.81 N ATOM 0 H LYS A 42 -28.144 3.226 -4.547 1.00 0.85 H new ATOM 0 HA LYS A 42 -28.766 1.177 -6.402 1.00 0.86 H new ATOM 0 HB2 LYS A 42 -29.619 3.440 -6.647 1.00 0.98 H new ATOM 0 HB3 LYS A 42 -28.002 4.113 -6.711 1.00 0.98 H new ATOM 0 HG2 LYS A 42 -29.101 3.903 -8.985 1.00 1.09 H new ATOM 0 HG3 LYS A 42 -27.560 3.075 -8.875 1.00 1.09 H new ATOM 0 HD2 LYS A 42 -28.571 0.921 -8.771 1.00 1.05 H new ATOM 0 HD3 LYS A 42 -30.114 1.561 -8.241 1.00 1.05 H new ATOM 0 HE2 LYS A 42 -30.765 2.174 -10.395 1.00 1.07 H new ATOM 0 HE3 LYS A 42 -29.131 2.561 -10.897 1.00 1.07 H new ATOM 0 HZ1 LYS A 42 -28.864 0.517 -11.715 1.00 1.81 H new ATOM 0 HZ2 LYS A 42 -29.367 -0.217 -10.269 1.00 1.81 H new ATOM 0 HZ3 LYS A 42 -30.515 0.235 -11.436 1.00 1.81 H new ATOM 685 N MET A 43 -25.695 2.367 -6.693 1.00 0.90 N ATOM 686 CA MET A 43 -24.359 2.040 -7.267 1.00 0.93 C ATOM 687 C MET A 43 -23.940 0.621 -6.870 1.00 0.80 C ATOM 688 O MET A 43 -23.533 -0.165 -7.698 1.00 0.79 O ATOM 689 CB MET A 43 -23.326 3.041 -6.742 1.00 1.02 C ATOM 690 CG MET A 43 -21.958 2.735 -7.346 1.00 1.13 C ATOM 691 SD MET A 43 -20.778 4.015 -6.851 1.00 2.14 S ATOM 692 CE MET A 43 -20.609 4.803 -8.470 1.00 2.36 C ATOM 0 H MET A 43 -25.729 3.224 -6.140 1.00 0.90 H new ATOM 0 HA MET A 43 -24.416 2.099 -8.354 1.00 0.93 H new ATOM 0 HB2 MET A 43 -23.628 4.057 -6.997 1.00 1.02 H new ATOM 0 HB3 MET A 43 -23.274 2.988 -5.655 1.00 1.02 H new ATOM 0 HG2 MET A 43 -21.612 1.757 -7.011 1.00 1.13 H new ATOM 0 HG3 MET A 43 -22.030 2.693 -8.433 1.00 1.13 H new ATOM 0 HE1 MET A 43 -19.810 5.543 -8.433 1.00 2.36 H new ATOM 0 HE2 MET A 43 -20.370 4.048 -9.219 1.00 2.36 H new ATOM 0 HE3 MET A 43 -21.546 5.293 -8.736 1.00 2.36 H new ATOM 702 N LEU A 44 -24.010 0.290 -5.610 1.00 0.73 N ATOM 703 CA LEU A 44 -23.581 -1.073 -5.176 1.00 0.61 C ATOM 704 C LEU A 44 -24.510 -2.150 -5.761 1.00 0.57 C ATOM 705 O LEU A 44 -24.078 -3.244 -6.069 1.00 0.54 O ATOM 706 CB LEU A 44 -23.583 -1.142 -3.646 1.00 0.57 C ATOM 707 CG LEU A 44 -22.392 -0.339 -3.098 1.00 0.69 C ATOM 708 CD1 LEU A 44 -22.687 0.134 -1.671 1.00 1.14 C ATOM 709 CD2 LEU A 44 -21.137 -1.217 -3.074 1.00 0.67 C ATOM 0 H LEU A 44 -24.344 0.900 -4.864 1.00 0.73 H new ATOM 0 HA LEU A 44 -22.573 -1.262 -5.546 1.00 0.61 H new ATOM 0 HB2 LEU A 44 -24.518 -0.741 -3.254 1.00 0.57 H new ATOM 0 HB3 LEU A 44 -23.519 -2.179 -3.317 1.00 0.57 H new ATOM 0 HG LEU A 44 -22.230 0.523 -3.745 1.00 0.69 H new ATOM 0 HD11 LEU A 44 -21.837 0.702 -1.293 1.00 1.14 H new ATOM 0 HD12 LEU A 44 -23.574 0.768 -1.674 1.00 1.14 H new ATOM 0 HD13 LEU A 44 -22.860 -0.730 -1.030 1.00 1.14 H new ATOM 0 HD21 LEU A 44 -20.297 -0.641 -2.685 1.00 0.67 H new ATOM 0 HD22 LEU A 44 -21.311 -2.083 -2.435 1.00 0.67 H new ATOM 0 HD23 LEU A 44 -20.908 -1.553 -4.085 1.00 0.67 H new ATOM 721 N MET A 45 -25.773 -1.863 -5.929 1.00 0.60 N ATOM 722 CA MET A 45 -26.690 -2.893 -6.510 1.00 0.58 C ATOM 723 C MET A 45 -26.434 -2.974 -8.015 1.00 0.62 C ATOM 724 O MET A 45 -26.328 -4.037 -8.594 1.00 0.59 O ATOM 725 CB MET A 45 -28.157 -2.481 -6.286 1.00 0.64 C ATOM 726 CG MET A 45 -28.804 -3.315 -5.171 1.00 1.07 C ATOM 727 SD MET A 45 -30.607 -3.201 -5.293 1.00 1.19 S ATOM 728 CE MET A 45 -30.744 -1.404 -5.139 1.00 1.04 C ATOM 0 H MET A 45 -26.208 -0.971 -5.693 1.00 0.60 H new ATOM 0 HA MET A 45 -26.507 -3.854 -6.030 1.00 0.58 H new ATOM 0 HB2 MET A 45 -28.205 -1.423 -6.027 1.00 0.64 H new ATOM 0 HB3 MET A 45 -28.719 -2.608 -7.211 1.00 0.64 H new ATOM 0 HG2 MET A 45 -28.489 -4.355 -5.252 1.00 1.07 H new ATOM 0 HG3 MET A 45 -28.472 -2.957 -4.196 1.00 1.07 H new ATOM 0 HE1 MET A 45 -31.709 -1.149 -4.701 1.00 1.04 H new ATOM 0 HE2 MET A 45 -29.945 -1.032 -4.498 1.00 1.04 H new ATOM 0 HE3 MET A 45 -30.661 -0.947 -6.125 1.00 1.04 H new ATOM 738 N ASP A 46 -26.324 -1.839 -8.633 1.00 0.69 N ATOM 739 CA ASP A 46 -26.061 -1.795 -10.099 1.00 0.76 C ATOM 740 C ASP A 46 -24.708 -2.445 -10.397 1.00 0.75 C ATOM 741 O ASP A 46 -24.463 -2.921 -11.488 1.00 0.81 O ATOM 742 CB ASP A 46 -26.037 -0.346 -10.576 1.00 0.85 C ATOM 743 CG ASP A 46 -26.630 -0.263 -11.984 1.00 1.03 C ATOM 744 OD1 ASP A 46 -27.763 -0.681 -12.153 1.00 1.71 O ATOM 745 OD2 ASP A 46 -25.940 0.217 -12.869 1.00 1.26 O ATOM 0 H ASP A 46 -26.405 -0.927 -8.184 1.00 0.69 H new ATOM 0 HA ASP A 46 -26.851 -2.336 -10.619 1.00 0.76 H new ATOM 0 HB2 ASP A 46 -26.607 0.283 -9.892 1.00 0.85 H new ATOM 0 HB3 ASP A 46 -25.014 0.031 -10.578 1.00 0.85 H new ATOM 750 N LEU A 47 -23.829 -2.459 -9.432 1.00 0.69 N ATOM 751 CA LEU A 47 -22.486 -3.065 -9.655 1.00 0.70 C ATOM 752 C LEU A 47 -22.494 -4.519 -9.182 1.00 0.62 C ATOM 753 O LEU A 47 -21.552 -5.255 -9.401 1.00 0.63 O ATOM 754 CB LEU A 47 -21.427 -2.265 -8.892 1.00 0.72 C ATOM 755 CG LEU A 47 -20.816 -1.191 -9.807 1.00 0.84 C ATOM 756 CD1 LEU A 47 -21.916 -0.397 -10.520 1.00 0.89 C ATOM 757 CD2 LEU A 47 -19.980 -0.229 -8.963 1.00 0.89 C ATOM 0 H LEU A 47 -23.983 -2.077 -8.499 1.00 0.69 H new ATOM 0 HA LEU A 47 -22.248 -3.041 -10.718 1.00 0.70 H new ATOM 0 HB2 LEU A 47 -21.875 -1.796 -8.016 1.00 0.72 H new ATOM 0 HB3 LEU A 47 -20.646 -2.933 -8.530 1.00 0.72 H new ATOM 0 HG LEU A 47 -20.193 -1.683 -10.554 1.00 0.84 H new ATOM 0 HD11 LEU A 47 -21.462 0.358 -11.162 1.00 0.89 H new ATOM 0 HD12 LEU A 47 -22.519 -1.074 -11.125 1.00 0.89 H new ATOM 0 HD13 LEU A 47 -22.551 0.091 -9.780 1.00 0.89 H new ATOM 0 HD21 LEU A 47 -19.544 0.535 -9.607 1.00 0.89 H new ATOM 0 HD22 LEU A 47 -20.616 0.246 -8.216 1.00 0.89 H new ATOM 0 HD23 LEU A 47 -19.183 -0.781 -8.464 1.00 0.89 H new ATOM 769 N GLU A 48 -23.551 -4.928 -8.528 1.00 0.55 N ATOM 770 CA GLU A 48 -23.645 -6.333 -8.027 1.00 0.50 C ATOM 771 C GLU A 48 -22.876 -6.450 -6.706 1.00 0.44 C ATOM 772 O GLU A 48 -21.807 -7.022 -6.634 1.00 0.46 O ATOM 773 CB GLU A 48 -23.082 -7.307 -9.072 1.00 0.56 C ATOM 774 CG GLU A 48 -23.852 -8.627 -9.004 1.00 1.22 C ATOM 775 CD GLU A 48 -25.219 -8.456 -9.670 1.00 1.27 C ATOM 776 OE1 GLU A 48 -25.248 -8.094 -10.835 1.00 1.79 O ATOM 777 OE2 GLU A 48 -26.215 -8.689 -9.004 1.00 1.73 O ATOM 0 H GLU A 48 -24.360 -4.344 -8.318 1.00 0.55 H new ATOM 0 HA GLU A 48 -24.690 -6.590 -7.854 1.00 0.50 H new ATOM 0 HB2 GLU A 48 -23.166 -6.876 -10.069 1.00 0.56 H new ATOM 0 HB3 GLU A 48 -22.022 -7.482 -8.888 1.00 0.56 H new ATOM 0 HG2 GLU A 48 -23.288 -9.415 -9.503 1.00 1.22 H new ATOM 0 HG3 GLU A 48 -23.977 -8.934 -7.966 1.00 1.22 H new ATOM 784 N ILE A 49 -23.424 -5.903 -5.659 1.00 0.40 N ATOM 785 CA ILE A 49 -22.752 -5.963 -4.334 1.00 0.37 C ATOM 786 C ILE A 49 -23.832 -6.004 -3.263 1.00 0.37 C ATOM 787 O ILE A 49 -23.739 -6.749 -2.303 1.00 0.40 O ATOM 788 CB ILE A 49 -21.883 -4.712 -4.144 1.00 0.39 C ATOM 789 CG1 ILE A 49 -20.560 -4.844 -4.918 1.00 0.44 C ATOM 790 CG2 ILE A 49 -21.580 -4.505 -2.657 1.00 0.37 C ATOM 791 CD1 ILE A 49 -20.643 -4.040 -6.216 1.00 0.82 C ATOM 0 H ILE A 49 -24.318 -5.412 -5.665 1.00 0.40 H new ATOM 0 HA ILE A 49 -22.117 -6.846 -4.266 1.00 0.37 H new ATOM 0 HB ILE A 49 -22.434 -3.854 -4.529 1.00 0.39 H new ATOM 0 HG12 ILE A 49 -19.732 -4.484 -4.307 1.00 0.44 H new ATOM 0 HG13 ILE A 49 -20.360 -5.892 -5.140 1.00 0.44 H new ATOM 0 HG21 ILE A 49 -20.963 -3.615 -2.532 1.00 0.37 H new ATOM 0 HG22 ILE A 49 -22.514 -4.379 -2.109 1.00 0.37 H new ATOM 0 HG23 ILE A 49 -21.047 -5.373 -2.270 1.00 0.37 H new ATOM 0 HD11 ILE A 49 -19.705 -4.135 -6.763 1.00 0.82 H new ATOM 0 HD12 ILE A 49 -21.460 -4.421 -6.828 1.00 0.82 H new ATOM 0 HD13 ILE A 49 -20.823 -2.991 -5.983 1.00 0.82 H new ATOM 803 N ILE A 50 -24.878 -5.234 -3.437 1.00 0.43 N ATOM 804 CA ILE A 50 -25.983 -5.254 -2.441 1.00 0.48 C ATOM 805 C ILE A 50 -27.138 -6.070 -3.000 1.00 0.43 C ATOM 806 O ILE A 50 -27.386 -6.095 -4.189 1.00 0.49 O ATOM 807 CB ILE A 50 -26.466 -3.832 -2.139 1.00 0.56 C ATOM 808 CG1 ILE A 50 -25.497 -3.166 -1.154 1.00 0.62 C ATOM 809 CG2 ILE A 50 -27.865 -3.893 -1.501 1.00 0.67 C ATOM 810 CD1 ILE A 50 -25.869 -1.690 -0.964 1.00 0.74 C ATOM 0 H ILE A 50 -25.010 -4.597 -4.223 1.00 0.43 H new ATOM 0 HA ILE A 50 -25.617 -5.700 -1.516 1.00 0.48 H new ATOM 0 HB ILE A 50 -26.507 -3.257 -3.064 1.00 0.56 H new ATOM 0 HG12 ILE A 50 -25.529 -3.683 -0.195 1.00 0.62 H new ATOM 0 HG13 ILE A 50 -24.476 -3.247 -1.526 1.00 0.62 H new ATOM 0 HG21 ILE A 50 -28.211 -2.882 -1.285 1.00 0.67 H new ATOM 0 HG22 ILE A 50 -28.559 -4.374 -2.190 1.00 0.67 H new ATOM 0 HG23 ILE A 50 -27.818 -4.466 -0.575 1.00 0.67 H new ATOM 0 HD11 ILE A 50 -25.175 -1.227 -0.263 1.00 0.74 H new ATOM 0 HD12 ILE A 50 -25.814 -1.175 -1.923 1.00 0.74 H new ATOM 0 HD13 ILE A 50 -26.883 -1.618 -0.571 1.00 0.74 H new ATOM 822 N ARG A 51 -27.849 -6.723 -2.140 1.00 0.58 N ATOM 823 CA ARG A 51 -29.013 -7.537 -2.575 1.00 0.56 C ATOM 824 C ARG A 51 -30.272 -6.748 -2.279 1.00 0.53 C ATOM 825 O ARG A 51 -30.236 -5.727 -1.625 1.00 0.53 O ATOM 826 CB ARG A 51 -29.097 -8.829 -1.777 1.00 0.60 C ATOM 827 CG ARG A 51 -29.128 -10.058 -2.686 1.00 0.83 C ATOM 828 CD ARG A 51 -30.455 -10.136 -3.440 1.00 0.87 C ATOM 829 NE ARG A 51 -30.600 -11.494 -4.040 1.00 1.02 N ATOM 830 CZ ARG A 51 -30.159 -11.736 -5.248 1.00 1.06 C ATOM 831 NH1 ARG A 51 -29.564 -10.800 -5.938 1.00 1.47 N ATOM 832 NH2 ARG A 51 -30.306 -12.926 -5.764 1.00 1.39 N ATOM 0 H ARG A 51 -27.674 -6.730 -1.135 1.00 0.58 H new ATOM 0 HA ARG A 51 -28.906 -7.766 -3.635 1.00 0.56 H new ATOM 0 HB2 ARG A 51 -28.242 -8.896 -1.104 1.00 0.60 H new ATOM 0 HB3 ARG A 51 -29.992 -8.814 -1.155 1.00 0.60 H new ATOM 0 HG2 ARG A 51 -28.302 -10.013 -3.396 1.00 0.83 H new ATOM 0 HG3 ARG A 51 -28.988 -10.961 -2.091 1.00 0.83 H new ATOM 0 HD2 ARG A 51 -31.284 -9.935 -2.762 1.00 0.87 H new ATOM 0 HD3 ARG A 51 -30.489 -9.375 -4.220 1.00 0.87 H new ATOM 0 HE ARG A 51 -31.046 -12.239 -3.505 1.00 1.02 H new ATOM 0 HH11 ARG A 51 -29.440 -9.871 -5.536 1.00 1.47 H new ATOM 0 HH12 ARG A 51 -29.224 -10.998 -6.879 1.00 1.47 H new ATOM 0 HH21 ARG A 51 -30.763 -13.662 -5.226 1.00 1.39 H new ATOM 0 HH22 ARG A 51 -29.964 -13.120 -6.705 1.00 1.39 H new ATOM 846 N GLN A 52 -31.385 -7.223 -2.735 1.00 0.59 N ATOM 847 CA GLN A 52 -32.660 -6.518 -2.461 1.00 0.59 C ATOM 848 C GLN A 52 -33.737 -7.570 -2.231 1.00 0.56 C ATOM 849 O GLN A 52 -34.247 -8.149 -3.170 1.00 0.58 O ATOM 850 CB GLN A 52 -33.035 -5.661 -3.674 1.00 0.68 C ATOM 851 CG GLN A 52 -32.465 -6.301 -4.942 1.00 1.47 C ATOM 852 CD GLN A 52 -33.181 -5.736 -6.170 1.00 1.71 C ATOM 853 OE1 GLN A 52 -34.234 -6.349 -6.635 1.00 2.42 O flip ATOM 854 NE2 GLN A 52 -32.777 -4.726 -6.712 1.00 1.84 N flip ATOM 0 H GLN A 52 -31.470 -8.075 -3.290 1.00 0.59 H new ATOM 0 HA GLN A 52 -32.563 -5.875 -1.586 1.00 0.59 H new ATOM 0 HB2 GLN A 52 -34.119 -5.575 -3.752 1.00 0.68 H new ATOM 0 HB3 GLN A 52 -32.643 -4.651 -3.555 1.00 0.68 H new ATOM 0 HG2 GLN A 52 -31.395 -6.105 -5.011 1.00 1.47 H new ATOM 0 HG3 GLN A 52 -32.589 -7.383 -4.902 1.00 1.47 H new ATOM 0 HE21 GLN A 52 -31.953 -4.247 -6.348 1.00 1.84 H new ATOM 0 HE22 GLN A 52 -33.262 -4.358 -7.531 1.00 1.84 H new ATOM 863 N GLU A 53 -34.102 -7.817 -0.987 1.00 0.67 N ATOM 864 CA GLU A 53 -35.164 -8.826 -0.709 1.00 0.78 C ATOM 865 C GLU A 53 -36.365 -8.153 -0.049 1.00 0.77 C ATOM 866 O GLU A 53 -36.345 -7.785 1.108 1.00 0.87 O ATOM 867 CB GLU A 53 -34.604 -9.919 0.200 1.00 1.04 C ATOM 868 CG GLU A 53 -34.071 -9.313 1.500 1.00 0.85 C ATOM 869 CD GLU A 53 -32.992 -10.227 2.081 1.00 1.59 C ATOM 870 OE1 GLU A 53 -32.094 -10.595 1.343 1.00 2.25 O ATOM 871 OE2 GLU A 53 -33.083 -10.544 3.257 1.00 2.30 O ATOM 0 H GLU A 53 -33.708 -7.362 -0.163 1.00 0.67 H new ATOM 0 HA GLU A 53 -35.490 -9.275 -1.647 1.00 0.78 H new ATOM 0 HB2 GLU A 53 -35.383 -10.648 0.424 1.00 1.04 H new ATOM 0 HB3 GLU A 53 -33.805 -10.453 -0.314 1.00 1.04 H new ATOM 0 HG2 GLU A 53 -33.660 -8.322 1.310 1.00 0.85 H new ATOM 0 HG3 GLU A 53 -34.883 -9.190 2.216 1.00 0.85 H new ATOM 878 N GLY A 54 -37.416 -8.010 -0.795 1.00 0.73 N ATOM 879 CA GLY A 54 -38.656 -7.385 -0.257 1.00 0.75 C ATOM 880 C GLY A 54 -38.438 -5.892 0.008 1.00 0.83 C ATOM 881 O GLY A 54 -39.026 -5.334 0.911 1.00 1.15 O ATOM 0 H GLY A 54 -37.473 -8.303 -1.770 1.00 0.73 H new ATOM 0 HA2 GLY A 54 -39.473 -7.518 -0.966 1.00 0.75 H new ATOM 0 HA3 GLY A 54 -38.950 -7.884 0.666 1.00 0.75 H new ATOM 885 N LYS A 55 -37.574 -5.257 -0.748 1.00 0.86 N ATOM 886 CA LYS A 55 -37.276 -3.804 -0.532 1.00 1.03 C ATOM 887 C LYS A 55 -36.238 -3.682 0.578 1.00 1.02 C ATOM 888 O LYS A 55 -35.889 -2.602 1.014 1.00 1.27 O ATOM 889 CB LYS A 55 -38.544 -3.039 -0.136 1.00 1.21 C ATOM 890 CG LYS A 55 -38.439 -1.593 -0.624 1.00 1.38 C ATOM 891 CD LYS A 55 -39.559 -0.760 0.004 1.00 1.67 C ATOM 892 CE LYS A 55 -40.114 0.218 -1.033 1.00 1.89 C ATOM 893 NZ LYS A 55 -41.190 1.042 -0.413 1.00 2.27 N ATOM 0 H LYS A 55 -37.057 -5.688 -1.514 1.00 0.86 H new ATOM 0 HA LYS A 55 -36.896 -3.374 -1.459 1.00 1.03 H new ATOM 0 HB2 LYS A 55 -39.421 -3.518 -0.570 1.00 1.21 H new ATOM 0 HB3 LYS A 55 -38.672 -3.061 0.946 1.00 1.21 H new ATOM 0 HG2 LYS A 55 -37.468 -1.177 -0.356 1.00 1.38 H new ATOM 0 HG3 LYS A 55 -38.511 -1.559 -1.711 1.00 1.38 H new ATOM 0 HD2 LYS A 55 -40.354 -1.413 0.364 1.00 1.67 H new ATOM 0 HD3 LYS A 55 -39.179 -0.214 0.867 1.00 1.67 H new ATOM 0 HE2 LYS A 55 -39.317 0.862 -1.405 1.00 1.89 H new ATOM 0 HE3 LYS A 55 -40.508 -0.329 -1.890 1.00 1.89 H new ATOM 0 HZ1 LYS A 55 -41.568 1.707 -1.118 1.00 2.27 H new ATOM 0 HZ2 LYS A 55 -41.954 0.421 -0.079 1.00 2.27 H new ATOM 0 HZ3 LYS A 55 -40.800 1.574 0.391 1.00 2.27 H new ATOM 907 N GLN A 56 -35.756 -4.797 1.038 1.00 0.87 N ATOM 908 CA GLN A 56 -34.756 -4.800 2.120 1.00 0.97 C ATOM 909 C GLN A 56 -33.392 -5.006 1.477 1.00 0.89 C ATOM 910 O GLN A 56 -33.296 -5.655 0.467 1.00 0.86 O ATOM 911 CB GLN A 56 -35.086 -5.961 3.045 1.00 1.04 C ATOM 912 CG GLN A 56 -34.904 -5.546 4.504 1.00 1.44 C ATOM 913 CD GLN A 56 -35.392 -6.668 5.423 1.00 1.38 C ATOM 914 OE1 GLN A 56 -34.524 -7.472 5.971 1.00 1.49 O flip ATOM 915 NE2 GLN A 56 -36.578 -6.811 5.646 1.00 2.04 N flip ATOM 0 H GLN A 56 -36.022 -5.722 0.699 1.00 0.87 H new ATOM 0 HA GLN A 56 -34.756 -3.870 2.689 1.00 0.97 H new ATOM 0 HB2 GLN A 56 -36.113 -6.287 2.878 1.00 1.04 H new ATOM 0 HB3 GLN A 56 -34.441 -6.810 2.818 1.00 1.04 H new ATOM 0 HG2 GLN A 56 -33.854 -5.330 4.703 1.00 1.44 H new ATOM 0 HG3 GLN A 56 -35.461 -4.631 4.704 1.00 1.44 H new ATOM 0 HE21 GLN A 56 -37.257 -6.182 5.217 1.00 2.04 H new ATOM 0 HE22 GLN A 56 -36.894 -7.560 6.262 1.00 2.04 H new ATOM 924 N TYR A 57 -32.345 -4.441 2.023 1.00 0.87 N ATOM 925 CA TYR A 57 -31.008 -4.587 1.377 1.00 0.80 C ATOM 926 C TYR A 57 -30.167 -5.633 2.091 1.00 0.79 C ATOM 927 O TYR A 57 -29.898 -5.544 3.273 1.00 0.95 O ATOM 928 CB TYR A 57 -30.301 -3.244 1.408 1.00 0.81 C ATOM 929 CG TYR A 57 -31.201 -2.215 0.765 1.00 0.85 C ATOM 930 CD1 TYR A 57 -32.141 -1.525 1.540 1.00 1.49 C ATOM 931 CD2 TYR A 57 -31.111 -1.966 -0.610 1.00 1.34 C ATOM 932 CE1 TYR A 57 -32.986 -0.585 0.941 1.00 1.56 C ATOM 933 CE2 TYR A 57 -31.959 -1.028 -1.208 1.00 1.35 C ATOM 934 CZ TYR A 57 -32.896 -0.337 -0.433 1.00 0.98 C ATOM 935 OH TYR A 57 -33.733 0.589 -1.023 1.00 1.06 O ATOM 0 H TYR A 57 -32.358 -3.890 2.881 1.00 0.87 H new ATOM 0 HA TYR A 57 -31.145 -4.916 0.347 1.00 0.80 H new ATOM 0 HB2 TYR A 57 -30.073 -2.959 2.435 1.00 0.81 H new ATOM 0 HB3 TYR A 57 -29.352 -3.303 0.876 1.00 0.81 H new ATOM 0 HD1 TYR A 57 -32.214 -1.719 2.600 1.00 1.49 H new ATOM 0 HD2 TYR A 57 -30.387 -2.498 -1.209 1.00 1.34 H new ATOM 0 HE1 TYR A 57 -33.709 -0.050 1.540 1.00 1.56 H new ATOM 0 HE2 TYR A 57 -31.890 -0.837 -2.269 1.00 1.35 H new ATOM 0 HH TYR A 57 -33.539 0.641 -1.982 1.00 1.06 H new ATOM 945 N MET A 58 -29.778 -6.635 1.352 1.00 0.66 N ATOM 946 CA MET A 58 -28.979 -7.754 1.909 1.00 0.67 C ATOM 947 C MET A 58 -27.642 -7.854 1.159 1.00 0.57 C ATOM 948 O MET A 58 -27.360 -7.081 0.263 1.00 0.51 O ATOM 949 CB MET A 58 -29.791 -9.059 1.842 1.00 0.73 C ATOM 950 CG MET A 58 -29.081 -10.187 2.596 1.00 0.90 C ATOM 951 SD MET A 58 -28.197 -11.241 1.424 1.00 1.22 S ATOM 952 CE MET A 58 -27.371 -12.291 2.644 1.00 1.60 C ATOM 0 H MET A 58 -29.989 -6.723 0.358 1.00 0.66 H new ATOM 0 HA MET A 58 -28.752 -7.570 2.959 1.00 0.67 H new ATOM 0 HB2 MET A 58 -30.781 -8.898 2.269 1.00 0.73 H new ATOM 0 HB3 MET A 58 -29.936 -9.348 0.801 1.00 0.73 H new ATOM 0 HG2 MET A 58 -28.383 -9.769 3.322 1.00 0.90 H new ATOM 0 HG3 MET A 58 -29.807 -10.777 3.155 1.00 0.90 H new ATOM 0 HE1 MET A 58 -26.757 -13.031 2.131 1.00 1.60 H new ATOM 0 HE2 MET A 58 -26.739 -11.676 3.284 1.00 1.60 H new ATOM 0 HE3 MET A 58 -28.119 -12.799 3.253 1.00 1.60 H new ATOM 962 N LEU A 59 -26.798 -8.749 1.568 1.00 0.59 N ATOM 963 CA LEU A 59 -25.440 -8.862 0.946 1.00 0.52 C ATOM 964 C LEU A 59 -25.427 -9.913 -0.171 1.00 0.46 C ATOM 965 O LEU A 59 -25.952 -10.997 -0.027 1.00 0.53 O ATOM 966 CB LEU A 59 -24.467 -9.354 2.022 1.00 0.63 C ATOM 967 CG LEU A 59 -23.283 -8.399 2.182 1.00 0.71 C ATOM 968 CD1 LEU A 59 -22.502 -8.308 0.873 1.00 1.03 C ATOM 969 CD2 LEU A 59 -23.789 -7.016 2.571 1.00 1.16 C ATOM 0 H LEU A 59 -26.984 -9.419 2.314 1.00 0.59 H new ATOM 0 HA LEU A 59 -25.165 -7.889 0.539 1.00 0.52 H new ATOM 0 HB2 LEU A 59 -24.991 -9.449 2.973 1.00 0.63 H new ATOM 0 HB3 LEU A 59 -24.103 -10.347 1.759 1.00 0.63 H new ATOM 0 HG LEU A 59 -22.625 -8.779 2.964 1.00 0.71 H new ATOM 0 HD11 LEU A 59 -21.661 -7.626 0.998 1.00 1.03 H new ATOM 0 HD12 LEU A 59 -22.130 -9.296 0.602 1.00 1.03 H new ATOM 0 HD13 LEU A 59 -23.156 -7.937 0.084 1.00 1.03 H new ATOM 0 HD21 LEU A 59 -22.943 -6.338 2.684 1.00 1.16 H new ATOM 0 HD22 LEU A 59 -24.454 -6.640 1.794 1.00 1.16 H new ATOM 0 HD23 LEU A 59 -24.332 -7.079 3.514 1.00 1.16 H new ATOM 981 N THR A 60 -24.800 -9.597 -1.282 1.00 0.39 N ATOM 982 CA THR A 60 -24.729 -10.580 -2.403 1.00 0.41 C ATOM 983 C THR A 60 -23.375 -11.286 -2.321 1.00 0.46 C ATOM 984 O THR A 60 -22.414 -10.729 -1.831 1.00 0.43 O ATOM 985 CB THR A 60 -24.812 -9.867 -3.761 1.00 0.40 C ATOM 986 OG1 THR A 60 -23.567 -9.240 -4.036 1.00 1.12 O ATOM 987 CG2 THR A 60 -25.918 -8.812 -3.760 1.00 1.04 C ATOM 0 H THR A 60 -24.338 -8.705 -1.457 1.00 0.39 H new ATOM 0 HA THR A 60 -25.560 -11.281 -2.319 1.00 0.41 H new ATOM 0 HB THR A 60 -25.041 -10.607 -4.528 1.00 0.40 H new ATOM 0 HG1 THR A 60 -23.076 -9.766 -4.701 1.00 1.12 H new ATOM 0 HG21 THR A 60 -25.955 -8.323 -4.733 1.00 1.04 H new ATOM 0 HG22 THR A 60 -26.877 -9.290 -3.558 1.00 1.04 H new ATOM 0 HG23 THR A 60 -25.712 -8.070 -2.988 1.00 1.04 H new ATOM 995 N LYS A 61 -23.285 -12.503 -2.790 1.00 0.54 N ATOM 996 CA LYS A 61 -21.979 -13.224 -2.730 1.00 0.61 C ATOM 997 C LYS A 61 -20.876 -12.283 -3.213 1.00 0.57 C ATOM 998 O LYS A 61 -19.867 -12.100 -2.562 1.00 0.56 O ATOM 999 CB LYS A 61 -22.026 -14.462 -3.631 1.00 0.70 C ATOM 1000 CG LYS A 61 -23.454 -15.013 -3.682 1.00 1.39 C ATOM 1001 CD LYS A 61 -24.223 -14.344 -4.826 1.00 0.99 C ATOM 1002 CE LYS A 61 -25.712 -14.303 -4.482 1.00 1.84 C ATOM 1003 NZ LYS A 61 -26.208 -15.690 -4.255 1.00 2.26 N ATOM 0 H LYS A 61 -24.054 -13.026 -3.209 1.00 0.54 H new ATOM 0 HA LYS A 61 -21.780 -13.539 -1.706 1.00 0.61 H new ATOM 0 HB2 LYS A 61 -21.690 -14.205 -4.635 1.00 0.70 H new ATOM 0 HB3 LYS A 61 -21.346 -15.225 -3.252 1.00 0.70 H new ATOM 0 HG2 LYS A 61 -23.433 -16.093 -3.827 1.00 1.39 H new ATOM 0 HG3 LYS A 61 -23.960 -14.829 -2.734 1.00 1.39 H new ATOM 0 HD2 LYS A 61 -23.848 -13.333 -4.989 1.00 0.99 H new ATOM 0 HD3 LYS A 61 -24.068 -14.895 -5.754 1.00 0.99 H new ATOM 0 HE2 LYS A 61 -25.874 -13.697 -3.590 1.00 1.84 H new ATOM 0 HE3 LYS A 61 -26.270 -13.834 -5.292 1.00 1.84 H new ATOM 0 HZ1 LYS A 61 -27.247 -15.700 -4.307 1.00 2.26 H new ATOM 0 HZ2 LYS A 61 -25.818 -16.322 -4.984 1.00 2.26 H new ATOM 0 HZ3 LYS A 61 -25.905 -16.017 -3.315 1.00 2.26 H new ATOM 1017 N LYS A 62 -21.076 -11.671 -4.345 1.00 0.57 N ATOM 1018 CA LYS A 62 -20.057 -10.723 -4.872 1.00 0.56 C ATOM 1019 C LYS A 62 -19.824 -9.614 -3.842 1.00 0.50 C ATOM 1020 O LYS A 62 -18.714 -9.161 -3.640 1.00 0.58 O ATOM 1021 CB LYS A 62 -20.557 -10.107 -6.179 1.00 0.59 C ATOM 1022 CG LYS A 62 -19.738 -10.656 -7.349 1.00 0.78 C ATOM 1023 CD LYS A 62 -20.243 -10.044 -8.656 1.00 1.25 C ATOM 1024 CE LYS A 62 -19.374 -10.529 -9.817 1.00 1.29 C ATOM 1025 NZ LYS A 62 -18.461 -9.432 -10.246 1.00 2.14 N ATOM 0 H LYS A 62 -21.904 -11.787 -4.930 1.00 0.57 H new ATOM 0 HA LYS A 62 -19.124 -11.255 -5.059 1.00 0.56 H new ATOM 0 HB2 LYS A 62 -21.613 -10.337 -6.321 1.00 0.59 H new ATOM 0 HB3 LYS A 62 -20.470 -9.021 -6.138 1.00 0.59 H new ATOM 0 HG2 LYS A 62 -18.683 -10.422 -7.209 1.00 0.78 H new ATOM 0 HG3 LYS A 62 -19.822 -11.742 -7.387 1.00 0.78 H new ATOM 0 HD2 LYS A 62 -21.283 -10.326 -8.824 1.00 1.25 H new ATOM 0 HD3 LYS A 62 -20.213 -8.956 -8.596 1.00 1.25 H new ATOM 0 HE2 LYS A 62 -18.795 -11.401 -9.512 1.00 1.29 H new ATOM 0 HE3 LYS A 62 -20.003 -10.840 -10.651 1.00 1.29 H new ATOM 0 HZ1 LYS A 62 -17.918 -9.738 -11.078 1.00 2.14 H new ATOM 0 HZ2 LYS A 62 -19.020 -8.589 -10.488 1.00 2.14 H new ATOM 0 HZ3 LYS A 62 -17.807 -9.202 -9.471 1.00 2.14 H new ATOM 1039 N GLY A 63 -20.867 -9.173 -3.186 1.00 0.43 N ATOM 1040 CA GLY A 63 -20.703 -8.096 -2.175 1.00 0.38 C ATOM 1041 C GLY A 63 -19.881 -8.616 -0.996 1.00 0.40 C ATOM 1042 O GLY A 63 -19.010 -7.937 -0.490 1.00 0.39 O ATOM 0 H GLY A 63 -21.821 -9.514 -3.309 1.00 0.43 H new ATOM 0 HA2 GLY A 63 -20.208 -7.235 -2.624 1.00 0.38 H new ATOM 0 HA3 GLY A 63 -21.680 -7.758 -1.829 1.00 0.38 H new ATOM 1046 N GLU A 64 -20.134 -9.821 -0.564 1.00 0.46 N ATOM 1047 CA GLU A 64 -19.343 -10.377 0.568 1.00 0.51 C ATOM 1048 C GLU A 64 -17.872 -10.470 0.153 1.00 0.51 C ATOM 1049 O GLU A 64 -16.975 -10.132 0.902 1.00 0.50 O ATOM 1050 CB GLU A 64 -19.868 -11.765 0.926 1.00 0.60 C ATOM 1051 CG GLU A 64 -21.274 -11.625 1.505 1.00 0.65 C ATOM 1052 CD GLU A 64 -21.745 -12.971 2.053 1.00 0.80 C ATOM 1053 OE1 GLU A 64 -21.026 -13.545 2.852 1.00 1.25 O ATOM 1054 OE2 GLU A 64 -22.819 -13.402 1.666 1.00 1.40 O ATOM 0 H GLU A 64 -20.850 -10.441 -0.944 1.00 0.46 H new ATOM 0 HA GLU A 64 -19.436 -9.726 1.437 1.00 0.51 H new ATOM 0 HB2 GLU A 64 -19.886 -12.402 0.041 1.00 0.60 H new ATOM 0 HB3 GLU A 64 -19.208 -12.243 1.650 1.00 0.60 H new ATOM 0 HG2 GLU A 64 -21.278 -10.878 2.299 1.00 0.65 H new ATOM 0 HG3 GLU A 64 -21.961 -11.275 0.735 1.00 0.65 H new ATOM 1061 N GLU A 65 -17.626 -10.924 -1.047 1.00 0.55 N ATOM 1062 CA GLU A 65 -16.222 -11.042 -1.531 1.00 0.58 C ATOM 1063 C GLU A 65 -15.572 -9.660 -1.527 1.00 0.52 C ATOM 1064 O GLU A 65 -14.387 -9.520 -1.300 1.00 0.53 O ATOM 1065 CB GLU A 65 -16.215 -11.600 -2.958 1.00 0.64 C ATOM 1066 CG GLU A 65 -16.734 -13.038 -2.945 1.00 0.72 C ATOM 1067 CD GLU A 65 -16.803 -13.568 -4.379 1.00 1.15 C ATOM 1068 OE1 GLU A 65 -15.758 -13.676 -5.000 1.00 1.82 O ATOM 1069 OE2 GLU A 65 -17.898 -13.857 -4.830 1.00 1.69 O ATOM 0 H GLU A 65 -18.340 -11.219 -1.714 1.00 0.55 H new ATOM 0 HA GLU A 65 -15.667 -11.714 -0.877 1.00 0.58 H new ATOM 0 HB2 GLU A 65 -16.839 -10.983 -3.604 1.00 0.64 H new ATOM 0 HB3 GLU A 65 -15.205 -11.570 -3.367 1.00 0.64 H new ATOM 0 HG2 GLU A 65 -16.077 -13.668 -2.344 1.00 0.72 H new ATOM 0 HG3 GLU A 65 -17.721 -13.076 -2.484 1.00 0.72 H new ATOM 1076 N LEU A 66 -16.339 -8.636 -1.781 1.00 0.50 N ATOM 1077 CA LEU A 66 -15.762 -7.264 -1.794 1.00 0.48 C ATOM 1078 C LEU A 66 -15.521 -6.795 -0.358 1.00 0.44 C ATOM 1079 O LEU A 66 -14.499 -6.214 -0.053 1.00 0.45 O ATOM 1080 CB LEU A 66 -16.738 -6.308 -2.494 1.00 0.46 C ATOM 1081 CG LEU A 66 -15.973 -5.303 -3.362 1.00 0.62 C ATOM 1082 CD1 LEU A 66 -14.946 -4.554 -2.511 1.00 0.77 C ATOM 1083 CD2 LEU A 66 -15.257 -6.028 -4.502 1.00 1.54 C ATOM 0 H LEU A 66 -17.338 -8.690 -1.980 1.00 0.50 H new ATOM 0 HA LEU A 66 -14.814 -7.272 -2.332 1.00 0.48 H new ATOM 0 HB2 LEU A 66 -17.433 -6.876 -3.112 1.00 0.46 H new ATOM 0 HB3 LEU A 66 -17.333 -5.777 -1.751 1.00 0.46 H new ATOM 0 HG LEU A 66 -16.685 -4.592 -3.781 1.00 0.62 H new ATOM 0 HD11 LEU A 66 -14.406 -3.842 -3.135 1.00 0.77 H new ATOM 0 HD12 LEU A 66 -15.457 -4.020 -1.710 1.00 0.77 H new ATOM 0 HD13 LEU A 66 -14.241 -5.266 -2.081 1.00 0.77 H new ATOM 0 HD21 LEU A 66 -14.717 -5.303 -5.112 1.00 1.54 H new ATOM 0 HD22 LEU A 66 -14.553 -6.750 -4.089 1.00 1.54 H new ATOM 0 HD23 LEU A 66 -15.990 -6.548 -5.120 1.00 1.54 H new ATOM 1095 N LEU A 67 -16.442 -7.050 0.531 1.00 0.43 N ATOM 1096 CA LEU A 67 -16.246 -6.623 1.944 1.00 0.43 C ATOM 1097 C LEU A 67 -14.901 -7.152 2.442 1.00 0.46 C ATOM 1098 O LEU A 67 -14.133 -6.441 3.060 1.00 0.48 O ATOM 1099 CB LEU A 67 -17.378 -7.192 2.810 1.00 0.46 C ATOM 1100 CG LEU A 67 -17.231 -6.711 4.259 1.00 0.61 C ATOM 1101 CD1 LEU A 67 -17.341 -5.185 4.320 1.00 0.89 C ATOM 1102 CD2 LEU A 67 -18.341 -7.330 5.112 1.00 1.39 C ATOM 0 H LEU A 67 -17.319 -7.534 0.340 1.00 0.43 H new ATOM 0 HA LEU A 67 -16.257 -5.535 2.008 1.00 0.43 H new ATOM 0 HB2 LEU A 67 -18.343 -6.879 2.411 1.00 0.46 H new ATOM 0 HB3 LEU A 67 -17.358 -8.281 2.777 1.00 0.46 H new ATOM 0 HG LEU A 67 -16.256 -7.015 4.639 1.00 0.61 H new ATOM 0 HD11 LEU A 67 -17.235 -4.854 5.353 1.00 0.89 H new ATOM 0 HD12 LEU A 67 -16.553 -4.739 3.713 1.00 0.89 H new ATOM 0 HD13 LEU A 67 -18.313 -4.875 3.937 1.00 0.89 H new ATOM 0 HD21 LEU A 67 -18.240 -6.990 6.143 1.00 1.39 H new ATOM 0 HD22 LEU A 67 -19.312 -7.024 4.723 1.00 1.39 H new ATOM 0 HD23 LEU A 67 -18.262 -8.417 5.079 1.00 1.39 H new ATOM 1114 N GLU A 68 -14.609 -8.396 2.174 1.00 0.50 N ATOM 1115 CA GLU A 68 -13.311 -8.966 2.628 1.00 0.55 C ATOM 1116 C GLU A 68 -12.175 -8.311 1.844 1.00 0.52 C ATOM 1117 O GLU A 68 -11.176 -7.906 2.401 1.00 0.52 O ATOM 1118 CB GLU A 68 -13.302 -10.476 2.382 1.00 0.62 C ATOM 1119 CG GLU A 68 -13.983 -11.188 3.552 1.00 1.34 C ATOM 1120 CD GLU A 68 -15.285 -10.465 3.901 1.00 1.80 C ATOM 1121 OE1 GLU A 68 -16.274 -10.711 3.231 1.00 2.26 O ATOM 1122 OE2 GLU A 68 -15.271 -9.677 4.833 1.00 2.26 O ATOM 0 H GLU A 68 -15.212 -9.040 1.662 1.00 0.50 H new ATOM 0 HA GLU A 68 -13.178 -8.775 3.693 1.00 0.55 H new ATOM 0 HB2 GLU A 68 -13.820 -10.707 1.451 1.00 0.62 H new ATOM 0 HB3 GLU A 68 -12.277 -10.831 2.273 1.00 0.62 H new ATOM 0 HG2 GLU A 68 -14.190 -12.226 3.290 1.00 1.34 H new ATOM 0 HG3 GLU A 68 -13.320 -11.204 4.417 1.00 1.34 H new ATOM 1129 N ASP A 69 -12.324 -8.195 0.552 1.00 0.51 N ATOM 1130 CA ASP A 69 -11.254 -7.557 -0.263 1.00 0.51 C ATOM 1131 C ASP A 69 -10.956 -6.169 0.303 1.00 0.46 C ATOM 1132 O ASP A 69 -9.820 -5.824 0.559 1.00 0.48 O ATOM 1133 CB ASP A 69 -11.722 -7.428 -1.714 1.00 0.53 C ATOM 1134 CG ASP A 69 -12.049 -8.813 -2.273 1.00 0.62 C ATOM 1135 OD1 ASP A 69 -11.515 -9.780 -1.755 1.00 1.13 O ATOM 1136 OD2 ASP A 69 -12.828 -8.884 -3.209 1.00 1.34 O ATOM 0 H ASP A 69 -13.139 -8.514 0.028 1.00 0.51 H new ATOM 0 HA ASP A 69 -10.353 -8.169 -0.230 1.00 0.51 H new ATOM 0 HB2 ASP A 69 -12.602 -6.786 -1.767 1.00 0.53 H new ATOM 0 HB3 ASP A 69 -10.946 -6.956 -2.316 1.00 0.53 H new ATOM 1141 N ILE A 70 -11.969 -5.370 0.510 1.00 0.43 N ATOM 1142 CA ILE A 70 -11.735 -4.009 1.068 1.00 0.43 C ATOM 1143 C ILE A 70 -10.992 -4.137 2.399 1.00 0.42 C ATOM 1144 O ILE A 70 -10.105 -3.367 2.706 1.00 0.43 O ATOM 1145 CB ILE A 70 -13.078 -3.306 1.290 1.00 0.48 C ATOM 1146 CG1 ILE A 70 -13.508 -2.618 -0.009 1.00 0.89 C ATOM 1147 CG2 ILE A 70 -12.940 -2.258 2.397 1.00 0.78 C ATOM 1148 CD1 ILE A 70 -14.977 -2.202 0.095 1.00 1.29 C ATOM 0 H ILE A 70 -12.944 -5.601 0.317 1.00 0.43 H new ATOM 0 HA ILE A 70 -11.138 -3.422 0.370 1.00 0.43 H new ATOM 0 HB ILE A 70 -13.826 -4.042 1.584 1.00 0.48 H new ATOM 0 HG12 ILE A 70 -12.884 -1.744 -0.194 1.00 0.89 H new ATOM 0 HG13 ILE A 70 -13.369 -3.293 -0.854 1.00 0.89 H new ATOM 0 HG21 ILE A 70 -13.898 -1.762 2.550 1.00 0.78 H new ATOM 0 HG22 ILE A 70 -12.632 -2.745 3.322 1.00 0.78 H new ATOM 0 HG23 ILE A 70 -12.191 -1.520 2.108 1.00 0.78 H new ATOM 0 HD11 ILE A 70 -15.283 -1.712 -0.830 1.00 1.29 H new ATOM 0 HD12 ILE A 70 -15.594 -3.085 0.259 1.00 1.29 H new ATOM 0 HD13 ILE A 70 -15.102 -1.512 0.929 1.00 1.29 H new ATOM 1160 N ARG A 71 -11.340 -5.115 3.186 1.00 0.43 N ATOM 1161 CA ARG A 71 -10.646 -5.304 4.490 1.00 0.47 C ATOM 1162 C ARG A 71 -9.145 -5.479 4.248 1.00 0.48 C ATOM 1163 O ARG A 71 -8.327 -4.773 4.801 1.00 0.51 O ATOM 1164 CB ARG A 71 -11.199 -6.552 5.182 1.00 0.51 C ATOM 1165 CG ARG A 71 -11.429 -6.256 6.665 1.00 0.81 C ATOM 1166 CD ARG A 71 -11.765 -7.556 7.398 1.00 1.02 C ATOM 1167 NE ARG A 71 -12.034 -7.261 8.834 1.00 1.58 N ATOM 1168 CZ ARG A 71 -11.048 -6.958 9.633 1.00 2.24 C ATOM 1169 NH1 ARG A 71 -9.827 -6.911 9.175 1.00 2.68 N ATOM 1170 NH2 ARG A 71 -11.284 -6.702 10.890 1.00 3.04 N ATOM 0 H ARG A 71 -12.075 -5.792 2.983 1.00 0.43 H new ATOM 0 HA ARG A 71 -10.813 -4.432 5.122 1.00 0.47 H new ATOM 0 HB2 ARG A 71 -12.134 -6.857 4.712 1.00 0.51 H new ATOM 0 HB3 ARG A 71 -10.501 -7.382 5.070 1.00 0.51 H new ATOM 0 HG2 ARG A 71 -10.538 -5.801 7.099 1.00 0.81 H new ATOM 0 HG3 ARG A 71 -12.242 -5.539 6.782 1.00 0.81 H new ATOM 0 HD2 ARG A 71 -12.636 -8.028 6.943 1.00 1.02 H new ATOM 0 HD3 ARG A 71 -10.938 -8.260 7.309 1.00 1.02 H new ATOM 0 HE ARG A 71 -12.988 -7.296 9.192 1.00 1.58 H new ATOM 0 HH11 ARG A 71 -9.643 -7.111 8.192 1.00 2.68 H new ATOM 0 HH12 ARG A 71 -9.057 -6.674 9.800 1.00 2.68 H new ATOM 0 HH21 ARG A 71 -12.239 -6.739 11.247 1.00 3.04 H new ATOM 0 HH22 ARG A 71 -10.514 -6.465 11.516 1.00 3.04 H new ATOM 1184 N LYS A 72 -8.782 -6.428 3.427 1.00 0.49 N ATOM 1185 CA LYS A 72 -7.339 -6.679 3.145 1.00 0.52 C ATOM 1186 C LYS A 72 -6.635 -5.379 2.728 1.00 0.49 C ATOM 1187 O LYS A 72 -5.752 -4.897 3.410 1.00 0.50 O ATOM 1188 CB LYS A 72 -7.220 -7.698 2.013 1.00 0.57 C ATOM 1189 CG LYS A 72 -7.952 -8.985 2.401 1.00 0.69 C ATOM 1190 CD LYS A 72 -7.833 -10.002 1.264 1.00 0.93 C ATOM 1191 CE LYS A 72 -8.564 -11.289 1.651 1.00 1.44 C ATOM 1192 NZ LYS A 72 -9.831 -11.392 0.874 1.00 1.87 N ATOM 0 H LYS A 72 -9.429 -7.045 2.936 1.00 0.49 H new ATOM 0 HA LYS A 72 -6.865 -7.061 4.049 1.00 0.52 H new ATOM 0 HB2 LYS A 72 -7.644 -7.289 1.096 1.00 0.57 H new ATOM 0 HB3 LYS A 72 -6.170 -7.911 1.811 1.00 0.57 H new ATOM 0 HG2 LYS A 72 -7.527 -9.396 3.317 1.00 0.69 H new ATOM 0 HG3 LYS A 72 -9.001 -8.772 2.604 1.00 0.69 H new ATOM 0 HD2 LYS A 72 -8.258 -9.591 0.348 1.00 0.93 H new ATOM 0 HD3 LYS A 72 -6.783 -10.215 1.060 1.00 0.93 H new ATOM 0 HE2 LYS A 72 -7.931 -12.154 1.452 1.00 1.44 H new ATOM 0 HE3 LYS A 72 -8.779 -11.291 2.720 1.00 1.44 H new ATOM 0 HZ1 LYS A 72 -10.329 -12.267 1.136 1.00 1.87 H new ATOM 0 HZ2 LYS A 72 -10.436 -10.573 1.086 1.00 1.87 H new ATOM 0 HZ3 LYS A 72 -9.614 -11.409 -0.143 1.00 1.87 H new ATOM 1206 N PHE A 73 -7.013 -4.826 1.606 1.00 0.48 N ATOM 1207 CA PHE A 73 -6.371 -3.565 1.110 1.00 0.47 C ATOM 1208 C PHE A 73 -6.126 -2.597 2.270 1.00 0.46 C ATOM 1209 O PHE A 73 -5.014 -2.190 2.530 1.00 0.46 O ATOM 1210 CB PHE A 73 -7.304 -2.913 0.090 1.00 0.45 C ATOM 1211 CG PHE A 73 -7.494 -1.453 0.424 1.00 0.46 C ATOM 1212 CD1 PHE A 73 -6.462 -0.540 0.184 1.00 1.35 C ATOM 1213 CD2 PHE A 73 -8.705 -1.012 0.972 1.00 1.20 C ATOM 1214 CE1 PHE A 73 -6.638 0.813 0.492 1.00 1.34 C ATOM 1215 CE2 PHE A 73 -8.881 0.343 1.280 1.00 1.27 C ATOM 1216 CZ PHE A 73 -7.848 1.255 1.040 1.00 0.58 C ATOM 0 H PHE A 73 -7.747 -5.196 1.003 1.00 0.48 H new ATOM 0 HA PHE A 73 -5.412 -3.803 0.650 1.00 0.47 H new ATOM 0 HB2 PHE A 73 -6.888 -3.014 -0.912 1.00 0.45 H new ATOM 0 HB3 PHE A 73 -8.268 -3.423 0.088 1.00 0.45 H new ATOM 0 HD1 PHE A 73 -5.528 -0.880 -0.239 1.00 1.35 H new ATOM 0 HD2 PHE A 73 -9.503 -1.716 1.157 1.00 1.20 H new ATOM 0 HE1 PHE A 73 -5.840 1.517 0.307 1.00 1.34 H new ATOM 0 HE2 PHE A 73 -9.815 0.684 1.703 1.00 1.27 H new ATOM 0 HZ PHE A 73 -7.984 2.300 1.277 1.00 0.58 H new ATOM 1226 N ASN A 74 -7.158 -2.233 2.966 1.00 0.47 N ATOM 1227 CA ASN A 74 -6.982 -1.297 4.111 1.00 0.48 C ATOM 1228 C ASN A 74 -6.053 -1.951 5.131 1.00 0.50 C ATOM 1229 O ASN A 74 -5.298 -1.292 5.815 1.00 0.52 O ATOM 1230 CB ASN A 74 -8.338 -1.003 4.758 1.00 0.48 C ATOM 1231 CG ASN A 74 -8.124 -0.210 6.049 1.00 0.67 C ATOM 1232 OD1 ASN A 74 -8.106 1.005 6.033 1.00 1.58 O ATOM 1233 ND2 ASN A 74 -7.958 -0.849 7.174 1.00 1.06 N ATOM 0 H ASN A 74 -8.116 -2.540 2.796 1.00 0.47 H new ATOM 0 HA ASN A 74 -6.553 -0.358 3.762 1.00 0.48 H new ATOM 0 HB2 ASN A 74 -8.966 -0.437 4.070 1.00 0.48 H new ATOM 0 HB3 ASN A 74 -8.860 -1.935 4.973 1.00 0.48 H new ATOM 0 HD21 ASN A 74 -7.813 -0.329 8.039 1.00 1.06 H new ATOM 0 HD22 ASN A 74 -7.973 -1.869 7.188 1.00 1.06 H new ATOM 1240 N GLU A 75 -6.114 -3.246 5.235 1.00 0.51 N ATOM 1241 CA GLU A 75 -5.250 -3.965 6.210 1.00 0.55 C ATOM 1242 C GLU A 75 -3.809 -3.989 5.704 1.00 0.55 C ATOM 1243 O GLU A 75 -2.878 -3.981 6.484 1.00 0.65 O ATOM 1244 CB GLU A 75 -5.751 -5.403 6.372 1.00 0.59 C ATOM 1245 CG GLU A 75 -5.105 -6.059 7.595 1.00 0.87 C ATOM 1246 CD GLU A 75 -3.633 -6.360 7.304 1.00 1.22 C ATOM 1247 OE1 GLU A 75 -3.371 -7.063 6.342 1.00 1.77 O ATOM 1248 OE2 GLU A 75 -2.794 -5.883 8.050 1.00 1.79 O ATOM 0 H GLU A 75 -6.730 -3.843 4.683 1.00 0.51 H new ATOM 0 HA GLU A 75 -5.289 -3.451 7.170 1.00 0.55 H new ATOM 0 HB2 GLU A 75 -6.836 -5.407 6.480 1.00 0.59 H new ATOM 0 HB3 GLU A 75 -5.518 -5.979 5.477 1.00 0.59 H new ATOM 0 HG2 GLU A 75 -5.187 -5.399 8.459 1.00 0.87 H new ATOM 0 HG3 GLU A 75 -5.631 -6.980 7.846 1.00 0.87 H new ATOM 1255 N MET A 76 -3.601 -4.015 4.410 1.00 0.52 N ATOM 1256 CA MET A 76 -2.212 -4.035 3.884 1.00 0.51 C ATOM 1257 C MET A 76 -1.794 -2.605 3.565 1.00 0.51 C ATOM 1258 O MET A 76 -0.663 -2.214 3.774 1.00 0.52 O ATOM 1259 CB MET A 76 -2.171 -4.875 2.605 1.00 0.50 C ATOM 1260 CG MET A 76 -2.413 -6.344 2.953 1.00 0.52 C ATOM 1261 SD MET A 76 -0.882 -7.280 2.711 1.00 0.55 S ATOM 1262 CE MET A 76 -1.552 -8.915 3.099 1.00 0.65 C ATOM 0 H MET A 76 -4.335 -4.023 3.702 1.00 0.52 H new ATOM 0 HA MET A 76 -1.535 -4.466 4.622 1.00 0.51 H new ATOM 0 HB2 MET A 76 -2.929 -4.527 1.904 1.00 0.50 H new ATOM 0 HB3 MET A 76 -1.205 -4.761 2.113 1.00 0.50 H new ATOM 0 HG2 MET A 76 -2.748 -6.434 3.986 1.00 0.52 H new ATOM 0 HG3 MET A 76 -3.205 -6.752 2.325 1.00 0.52 H new ATOM 0 HE1 MET A 76 -0.763 -9.662 3.011 1.00 0.65 H new ATOM 0 HE2 MET A 76 -1.941 -8.917 4.117 1.00 0.65 H new ATOM 0 HE3 MET A 76 -2.356 -9.153 2.403 1.00 0.65 H new ATOM 1272 N ARG A 77 -2.707 -1.810 3.068 1.00 0.50 N ATOM 1273 CA ARG A 77 -2.370 -0.398 2.749 1.00 0.50 C ATOM 1274 C ARG A 77 -1.901 0.307 4.020 1.00 0.51 C ATOM 1275 O ARG A 77 -0.887 0.977 4.036 1.00 0.52 O ATOM 1276 CB ARG A 77 -3.605 0.316 2.200 1.00 0.49 C ATOM 1277 CG ARG A 77 -3.265 1.783 1.928 1.00 0.52 C ATOM 1278 CD ARG A 77 -3.886 2.663 3.013 1.00 0.54 C ATOM 1279 NE ARG A 77 -5.370 2.554 2.950 1.00 0.85 N ATOM 1280 CZ ARG A 77 -6.100 3.034 3.919 1.00 1.35 C ATOM 1281 NH1 ARG A 77 -5.530 3.609 4.941 1.00 1.85 N ATOM 1282 NH2 ARG A 77 -7.401 2.940 3.863 1.00 1.84 N ATOM 0 H ARG A 77 -3.670 -2.082 2.871 1.00 0.50 H new ATOM 0 HA ARG A 77 -1.578 -0.375 2.000 1.00 0.50 H new ATOM 0 HB2 ARG A 77 -3.940 -0.167 1.282 1.00 0.49 H new ATOM 0 HB3 ARG A 77 -4.426 0.248 2.914 1.00 0.49 H new ATOM 0 HG2 ARG A 77 -2.184 1.919 1.910 1.00 0.52 H new ATOM 0 HG3 ARG A 77 -3.640 2.078 0.948 1.00 0.52 H new ATOM 0 HD2 ARG A 77 -3.529 2.354 3.996 1.00 0.54 H new ATOM 0 HD3 ARG A 77 -3.580 3.700 2.874 1.00 0.54 H new ATOM 0 HE ARG A 77 -5.815 2.104 2.150 1.00 0.85 H new ATOM 0 HH11 ARG A 77 -4.514 3.684 4.983 1.00 1.85 H new ATOM 0 HH12 ARG A 77 -6.101 3.984 5.699 1.00 1.85 H new ATOM 0 HH21 ARG A 77 -7.846 2.492 3.062 1.00 1.84 H new ATOM 0 HH22 ARG A 77 -7.972 3.315 4.620 1.00 1.84 H new ATOM 1296 N LYS A 78 -2.625 0.140 5.094 1.00 0.51 N ATOM 1297 CA LYS A 78 -2.213 0.776 6.372 1.00 0.52 C ATOM 1298 C LYS A 78 -0.854 0.203 6.755 1.00 0.53 C ATOM 1299 O LYS A 78 0.020 0.895 7.237 1.00 0.55 O ATOM 1300 CB LYS A 78 -3.249 0.458 7.457 1.00 0.52 C ATOM 1301 CG LYS A 78 -2.588 0.505 8.835 1.00 0.90 C ATOM 1302 CD LYS A 78 -3.662 0.623 9.919 1.00 1.04 C ATOM 1303 CE LYS A 78 -3.800 2.083 10.357 1.00 1.45 C ATOM 1304 NZ LYS A 78 -2.498 2.570 10.894 1.00 2.15 N ATOM 0 H LYS A 78 -3.483 -0.410 5.139 1.00 0.51 H new ATOM 0 HA LYS A 78 -2.148 1.859 6.266 1.00 0.52 H new ATOM 0 HB2 LYS A 78 -4.068 1.176 7.412 1.00 0.52 H new ATOM 0 HB3 LYS A 78 -3.679 -0.528 7.284 1.00 0.52 H new ATOM 0 HG2 LYS A 78 -1.994 -0.395 8.995 1.00 0.90 H new ATOM 0 HG3 LYS A 78 -1.905 1.352 8.893 1.00 0.90 H new ATOM 0 HD2 LYS A 78 -4.616 0.256 9.540 1.00 1.04 H new ATOM 0 HD3 LYS A 78 -3.398 0.001 10.774 1.00 1.04 H new ATOM 0 HE2 LYS A 78 -4.109 2.699 9.512 1.00 1.45 H new ATOM 0 HE3 LYS A 78 -4.575 2.173 11.118 1.00 1.45 H new ATOM 0 HZ1 LYS A 78 -2.670 3.208 11.697 1.00 2.15 H new ATOM 0 HZ2 LYS A 78 -1.929 1.760 11.212 1.00 2.15 H new ATOM 0 HZ3 LYS A 78 -1.985 3.083 10.149 1.00 2.15 H new ATOM 1318 N ASN A 79 -0.666 -1.064 6.510 1.00 0.52 N ATOM 1319 CA ASN A 79 0.644 -1.696 6.821 1.00 0.53 C ATOM 1320 C ASN A 79 1.709 -1.040 5.946 1.00 0.54 C ATOM 1321 O ASN A 79 2.746 -0.618 6.415 1.00 0.54 O ATOM 1322 CB ASN A 79 0.595 -3.195 6.516 1.00 0.54 C ATOM 1323 CG ASN A 79 1.223 -3.973 7.672 1.00 0.60 C ATOM 1324 OD1 ASN A 79 0.647 -4.923 8.165 1.00 1.17 O ATOM 1325 ND2 ASN A 79 2.390 -3.609 8.130 1.00 1.14 N ATOM 0 H ASN A 79 -1.365 -1.689 6.107 1.00 0.52 H new ATOM 0 HA ASN A 79 0.876 -1.562 7.878 1.00 0.53 H new ATOM 0 HB2 ASN A 79 -0.437 -3.513 6.368 1.00 0.54 H new ATOM 0 HB3 ASN A 79 1.129 -3.406 5.590 1.00 0.54 H new ATOM 0 HD21 ASN A 79 2.818 -4.122 8.901 1.00 1.14 H new ATOM 0 HD22 ASN A 79 2.874 -2.812 7.717 1.00 1.14 H new ATOM 1332 N MET A 80 1.449 -0.945 4.670 1.00 0.56 N ATOM 1333 CA MET A 80 2.434 -0.313 3.755 1.00 0.58 C ATOM 1334 C MET A 80 2.798 1.074 4.286 1.00 0.57 C ATOM 1335 O MET A 80 3.949 1.357 4.545 1.00 0.56 O ATOM 1336 CB MET A 80 1.832 -0.200 2.350 1.00 0.60 C ATOM 1337 CG MET A 80 2.608 0.834 1.529 1.00 0.64 C ATOM 1338 SD MET A 80 1.867 2.470 1.759 1.00 1.38 S ATOM 1339 CE MET A 80 3.148 3.431 0.916 1.00 1.16 C ATOM 0 H MET A 80 0.595 -1.279 4.224 1.00 0.56 H new ATOM 0 HA MET A 80 3.335 -0.925 3.704 1.00 0.58 H new ATOM 0 HB2 MET A 80 1.864 -1.169 1.853 1.00 0.60 H new ATOM 0 HB3 MET A 80 0.783 0.090 2.417 1.00 0.60 H new ATOM 0 HG2 MET A 80 3.653 0.850 1.839 1.00 0.64 H new ATOM 0 HG3 MET A 80 2.593 0.562 0.474 1.00 0.64 H new ATOM 0 HE1 MET A 80 3.245 4.406 1.394 1.00 1.16 H new ATOM 0 HE2 MET A 80 4.099 2.901 0.976 1.00 1.16 H new ATOM 0 HE3 MET A 80 2.873 3.565 -0.130 1.00 1.16 H new ATOM 1349 N ASP A 81 1.839 1.948 4.460 1.00 0.58 N ATOM 1350 CA ASP A 81 2.157 3.308 4.983 1.00 0.58 C ATOM 1351 C ASP A 81 2.871 3.193 6.327 1.00 0.56 C ATOM 1352 O ASP A 81 3.835 3.883 6.592 1.00 0.56 O ATOM 1353 CB ASP A 81 0.855 4.084 5.172 1.00 0.59 C ATOM 1354 CG ASP A 81 1.009 5.493 4.597 1.00 0.61 C ATOM 1355 OD1 ASP A 81 1.749 6.271 5.177 1.00 1.12 O ATOM 1356 OD2 ASP A 81 0.383 5.772 3.587 1.00 1.22 O ATOM 0 H ASP A 81 0.853 1.778 4.263 1.00 0.58 H new ATOM 0 HA ASP A 81 2.804 3.827 4.276 1.00 0.58 H new ATOM 0 HB2 ASP A 81 0.035 3.565 4.675 1.00 0.59 H new ATOM 0 HB3 ASP A 81 0.603 4.138 6.231 1.00 0.59 H new ATOM 1361 N GLN A 82 2.419 2.307 7.169 1.00 0.56 N ATOM 1362 CA GLN A 82 3.073 2.116 8.481 1.00 0.54 C ATOM 1363 C GLN A 82 4.514 1.680 8.213 1.00 0.53 C ATOM 1364 O GLN A 82 5.465 2.207 8.759 1.00 0.55 O ATOM 1365 CB GLN A 82 2.293 1.021 9.205 1.00 0.55 C ATOM 1366 CG GLN A 82 2.845 0.795 10.604 1.00 1.12 C ATOM 1367 CD GLN A 82 1.951 1.501 11.626 1.00 0.77 C ATOM 1368 OE1 GLN A 82 1.218 0.861 12.354 1.00 1.13 O ATOM 1369 NE2 GLN A 82 1.979 2.803 11.710 1.00 1.43 N ATOM 0 H GLN A 82 1.615 1.703 6.997 1.00 0.56 H new ATOM 0 HA GLN A 82 3.084 3.020 9.090 1.00 0.54 H new ATOM 0 HB2 GLN A 82 1.241 1.298 9.266 1.00 0.55 H new ATOM 0 HB3 GLN A 82 2.346 0.094 8.635 1.00 0.55 H new ATOM 0 HG2 GLN A 82 2.890 -0.272 10.821 1.00 1.12 H new ATOM 0 HG3 GLN A 82 3.864 1.177 10.671 1.00 1.12 H new ATOM 0 HE21 GLN A 82 2.594 3.340 11.099 1.00 1.43 H new ATOM 0 HE22 GLN A 82 1.386 3.283 12.387 1.00 1.43 H new ATOM 1378 N LEU A 83 4.658 0.732 7.336 1.00 0.51 N ATOM 1379 CA LEU A 83 6.015 0.252 6.967 1.00 0.51 C ATOM 1380 C LEU A 83 6.748 1.408 6.284 1.00 0.52 C ATOM 1381 O LEU A 83 7.894 1.691 6.570 1.00 0.53 O ATOM 1382 CB LEU A 83 5.898 -0.938 6.011 1.00 0.49 C ATOM 1383 CG LEU A 83 5.325 -2.147 6.765 1.00 0.47 C ATOM 1384 CD1 LEU A 83 4.802 -3.172 5.760 1.00 0.52 C ATOM 1385 CD2 LEU A 83 6.405 -2.800 7.643 1.00 0.48 C ATOM 0 H LEU A 83 3.889 0.265 6.855 1.00 0.51 H new ATOM 0 HA LEU A 83 6.564 -0.072 7.851 1.00 0.51 H new ATOM 0 HB2 LEU A 83 5.253 -0.681 5.171 1.00 0.49 H new ATOM 0 HB3 LEU A 83 6.876 -1.184 5.598 1.00 0.49 H new ATOM 0 HG LEU A 83 4.512 -1.805 7.406 1.00 0.47 H new ATOM 0 HD11 LEU A 83 4.395 -4.031 6.294 1.00 0.52 H new ATOM 0 HD12 LEU A 83 4.019 -2.719 5.152 1.00 0.52 H new ATOM 0 HD13 LEU A 83 5.618 -3.499 5.116 1.00 0.52 H new ATOM 0 HD21 LEU A 83 5.979 -3.654 8.169 1.00 0.48 H new ATOM 0 HD22 LEU A 83 7.231 -3.135 7.015 1.00 0.48 H new ATOM 0 HD23 LEU A 83 6.772 -2.074 8.368 1.00 0.48 H new ATOM 1397 N LYS A 84 6.077 2.087 5.392 1.00 0.53 N ATOM 1398 CA LYS A 84 6.703 3.241 4.689 1.00 0.56 C ATOM 1399 C LYS A 84 7.311 4.200 5.716 1.00 0.56 C ATOM 1400 O LYS A 84 8.437 4.638 5.583 1.00 0.57 O ATOM 1401 CB LYS A 84 5.631 3.980 3.885 1.00 0.57 C ATOM 1402 CG LYS A 84 6.298 4.946 2.904 1.00 0.58 C ATOM 1403 CD LYS A 84 5.557 6.284 2.924 1.00 0.75 C ATOM 1404 CE LYS A 84 6.087 7.180 1.802 1.00 0.77 C ATOM 1405 NZ LYS A 84 7.491 7.578 2.107 1.00 1.42 N ATOM 0 H LYS A 84 5.114 1.889 5.119 1.00 0.53 H new ATOM 0 HA LYS A 84 7.485 2.880 4.022 1.00 0.56 H new ATOM 0 HB2 LYS A 84 5.012 3.265 3.343 1.00 0.57 H new ATOM 0 HB3 LYS A 84 4.971 4.528 4.558 1.00 0.57 H new ATOM 0 HG2 LYS A 84 7.343 5.093 3.175 1.00 0.58 H new ATOM 0 HG3 LYS A 84 6.286 4.526 1.898 1.00 0.58 H new ATOM 0 HD2 LYS A 84 4.487 6.121 2.798 1.00 0.75 H new ATOM 0 HD3 LYS A 84 5.693 6.773 3.889 1.00 0.75 H new ATOM 0 HE2 LYS A 84 6.046 6.651 0.850 1.00 0.77 H new ATOM 0 HE3 LYS A 84 5.460 8.066 1.702 1.00 0.77 H new ATOM 0 HZ1 LYS A 84 7.615 8.592 1.910 1.00 1.42 H new ATOM 0 HZ2 LYS A 84 7.694 7.392 3.110 1.00 1.42 H new ATOM 0 HZ3 LYS A 84 8.144 7.028 1.514 1.00 1.42 H new ATOM 1419 N GLU A 85 6.566 4.538 6.734 1.00 0.55 N ATOM 1420 CA GLU A 85 7.084 5.478 7.768 1.00 0.55 C ATOM 1421 C GLU A 85 8.289 4.865 8.481 1.00 0.57 C ATOM 1422 O GLU A 85 9.237 5.548 8.816 1.00 0.57 O ATOM 1423 CB GLU A 85 5.989 5.756 8.798 1.00 0.55 C ATOM 1424 CG GLU A 85 6.631 6.204 10.113 1.00 0.56 C ATOM 1425 CD GLU A 85 5.598 6.950 10.958 1.00 0.56 C ATOM 1426 OE1 GLU A 85 4.693 6.304 11.459 1.00 1.18 O ATOM 1427 OE2 GLU A 85 5.730 8.156 11.089 1.00 1.12 O ATOM 0 H GLU A 85 5.617 4.201 6.894 1.00 0.55 H new ATOM 0 HA GLU A 85 7.385 6.406 7.281 1.00 0.55 H new ATOM 0 HB2 GLU A 85 5.314 6.528 8.428 1.00 0.55 H new ATOM 0 HB3 GLU A 85 5.390 4.860 8.960 1.00 0.55 H new ATOM 0 HG2 GLU A 85 7.007 5.339 10.659 1.00 0.56 H new ATOM 0 HG3 GLU A 85 7.486 6.850 9.911 1.00 0.56 H new ATOM 1434 N LYS A 86 8.268 3.585 8.708 1.00 0.58 N ATOM 1435 CA LYS A 86 9.422 2.937 9.390 1.00 0.61 C ATOM 1436 C LYS A 86 10.648 3.058 8.490 1.00 0.62 C ATOM 1437 O LYS A 86 11.758 3.275 8.944 1.00 0.63 O ATOM 1438 CB LYS A 86 9.111 1.458 9.637 1.00 0.62 C ATOM 1439 CG LYS A 86 9.255 1.147 11.127 1.00 0.65 C ATOM 1440 CD LYS A 86 9.114 -0.359 11.352 1.00 0.83 C ATOM 1441 CE LYS A 86 9.200 -0.663 12.848 1.00 1.01 C ATOM 1442 NZ LYS A 86 8.739 -2.057 13.100 1.00 1.24 N ATOM 0 H LYS A 86 7.505 2.959 8.452 1.00 0.58 H new ATOM 0 HA LYS A 86 9.610 3.424 10.347 1.00 0.61 H new ATOM 0 HB2 LYS A 86 8.099 1.228 9.303 1.00 0.62 H new ATOM 0 HB3 LYS A 86 9.789 0.831 9.057 1.00 0.62 H new ATOM 0 HG2 LYS A 86 10.225 1.490 11.488 1.00 0.65 H new ATOM 0 HG3 LYS A 86 8.495 1.683 11.696 1.00 0.65 H new ATOM 0 HD2 LYS A 86 8.162 -0.709 10.953 1.00 0.83 H new ATOM 0 HD3 LYS A 86 9.899 -0.892 10.816 1.00 0.83 H new ATOM 0 HE2 LYS A 86 10.225 -0.539 13.197 1.00 1.01 H new ATOM 0 HE3 LYS A 86 8.586 0.041 13.409 1.00 1.01 H new ATOM 0 HZ1 LYS A 86 8.798 -2.263 14.118 1.00 1.24 H new ATOM 0 HZ2 LYS A 86 7.754 -2.160 12.782 1.00 1.24 H new ATOM 0 HZ3 LYS A 86 9.343 -2.722 12.576 1.00 1.24 H new ATOM 1456 N ILE A 87 10.448 2.924 7.209 1.00 0.64 N ATOM 1457 CA ILE A 87 11.583 3.029 6.255 1.00 0.67 C ATOM 1458 C ILE A 87 12.181 4.430 6.321 1.00 0.65 C ATOM 1459 O ILE A 87 13.366 4.596 6.528 1.00 0.63 O ATOM 1460 CB ILE A 87 11.080 2.765 4.838 1.00 0.71 C ATOM 1461 CG1 ILE A 87 10.894 1.261 4.634 1.00 0.79 C ATOM 1462 CG2 ILE A 87 12.099 3.295 3.827 1.00 0.80 C ATOM 1463 CD1 ILE A 87 9.728 1.013 3.674 1.00 0.84 C ATOM 0 H ILE A 87 9.540 2.745 6.780 1.00 0.64 H new ATOM 0 HA ILE A 87 12.345 2.295 6.519 1.00 0.67 H new ATOM 0 HB ILE A 87 10.126 3.272 4.692 1.00 0.71 H new ATOM 0 HG12 ILE A 87 11.808 0.822 4.233 1.00 0.79 H new ATOM 0 HG13 ILE A 87 10.700 0.775 5.590 1.00 0.79 H new ATOM 0 HG21 ILE A 87 11.740 3.106 2.815 1.00 0.80 H new ATOM 0 HG22 ILE A 87 12.231 4.367 3.971 1.00 0.80 H new ATOM 0 HG23 ILE A 87 13.053 2.789 3.973 1.00 0.80 H new ATOM 0 HD11 ILE A 87 9.597 -0.059 3.530 1.00 0.84 H new ATOM 0 HD12 ILE A 87 8.815 1.437 4.093 1.00 0.84 H new ATOM 0 HD13 ILE A 87 9.940 1.485 2.715 1.00 0.84 H new ATOM 1475 N ASN A 88 11.377 5.444 6.162 1.00 0.66 N ATOM 1476 CA ASN A 88 11.909 6.829 6.232 1.00 0.65 C ATOM 1477 C ASN A 88 12.532 7.074 7.602 1.00 0.62 C ATOM 1478 O ASN A 88 13.443 7.859 7.746 1.00 0.62 O ATOM 1479 CB ASN A 88 10.770 7.825 6.011 1.00 0.69 C ATOM 1480 CG ASN A 88 10.037 7.482 4.713 1.00 1.66 C ATOM 1481 OD1 ASN A 88 8.736 7.392 4.717 1.00 2.38 O flip ATOM 1482 ND2 ASN A 88 10.656 7.291 3.684 1.00 2.46 N flip ATOM 0 H ASN A 88 10.375 5.371 5.987 1.00 0.66 H new ATOM 0 HA ASN A 88 12.667 6.961 5.460 1.00 0.65 H new ATOM 0 HB2 ASN A 88 10.077 7.794 6.852 1.00 0.69 H new ATOM 0 HB3 ASN A 88 11.165 8.840 5.961 1.00 0.69 H new ATOM 0 HD21 ASN A 88 11.674 7.361 3.680 1.00 2.46 H new ATOM 0 HD22 ASN A 88 10.158 7.061 2.824 1.00 2.46 H new ATOM 1489 N SER A 89 12.036 6.425 8.620 1.00 0.61 N ATOM 1490 CA SER A 89 12.592 6.647 9.982 1.00 0.61 C ATOM 1491 C SER A 89 14.059 6.209 10.052 1.00 0.63 C ATOM 1492 O SER A 89 14.941 7.015 10.269 1.00 0.71 O ATOM 1493 CB SER A 89 11.779 5.841 10.995 1.00 0.62 C ATOM 1494 OG SER A 89 12.306 6.057 12.297 1.00 1.29 O ATOM 0 H SER A 89 11.271 5.752 8.566 1.00 0.61 H new ATOM 0 HA SER A 89 12.535 7.711 10.211 1.00 0.61 H new ATOM 0 HB2 SER A 89 10.732 6.141 10.960 1.00 0.62 H new ATOM 0 HB3 SER A 89 11.815 4.780 10.747 1.00 0.62 H new ATOM 0 HG SER A 89 11.786 5.543 12.950 1.00 1.29 H new ATOM 1500 N VAL A 90 14.329 4.942 9.893 1.00 0.58 N ATOM 1501 CA VAL A 90 15.739 4.455 9.974 1.00 0.60 C ATOM 1502 C VAL A 90 16.523 4.805 8.703 1.00 0.59 C ATOM 1503 O VAL A 90 17.671 5.197 8.766 1.00 0.63 O ATOM 1504 CB VAL A 90 15.720 2.944 10.171 1.00 0.61 C ATOM 1505 CG1 VAL A 90 17.105 2.361 9.880 1.00 0.52 C ATOM 1506 CG2 VAL A 90 15.328 2.628 11.616 1.00 0.81 C ATOM 0 H VAL A 90 13.633 4.220 9.710 1.00 0.58 H new ATOM 0 HA VAL A 90 16.235 4.942 10.814 1.00 0.60 H new ATOM 0 HB VAL A 90 14.996 2.501 9.487 1.00 0.61 H new ATOM 0 HG11 VAL A 90 17.082 1.281 10.023 1.00 0.52 H new ATOM 0 HG12 VAL A 90 17.385 2.585 8.851 1.00 0.52 H new ATOM 0 HG13 VAL A 90 17.835 2.802 10.559 1.00 0.52 H new ATOM 0 HG21 VAL A 90 15.313 1.548 11.761 1.00 0.81 H new ATOM 0 HG22 VAL A 90 16.053 3.076 12.296 1.00 0.81 H new ATOM 0 HG23 VAL A 90 14.338 3.035 11.822 1.00 0.81 H new ATOM 1516 N LEU A 91 15.919 4.676 7.549 1.00 0.57 N ATOM 1517 CA LEU A 91 16.647 5.015 6.292 1.00 0.61 C ATOM 1518 C LEU A 91 16.773 6.531 6.204 1.00 0.67 C ATOM 1519 O LEU A 91 17.559 7.053 5.447 1.00 0.70 O ATOM 1520 CB LEU A 91 15.857 4.498 5.080 1.00 0.62 C ATOM 1521 CG LEU A 91 16.727 4.548 3.818 1.00 0.72 C ATOM 1522 CD1 LEU A 91 17.382 3.185 3.580 1.00 0.91 C ATOM 1523 CD2 LEU A 91 15.850 4.900 2.614 1.00 0.97 C ATOM 0 H LEU A 91 14.960 4.353 7.424 1.00 0.57 H new ATOM 0 HA LEU A 91 17.634 4.552 6.296 1.00 0.61 H new ATOM 0 HB2 LEU A 91 15.526 3.475 5.262 1.00 0.62 H new ATOM 0 HB3 LEU A 91 14.961 5.102 4.937 1.00 0.62 H new ATOM 0 HG LEU A 91 17.503 5.303 3.948 1.00 0.72 H new ATOM 0 HD11 LEU A 91 17.998 3.229 2.682 1.00 0.91 H new ATOM 0 HD12 LEU A 91 18.006 2.927 4.436 1.00 0.91 H new ATOM 0 HD13 LEU A 91 16.609 2.427 3.453 1.00 0.91 H new ATOM 0 HD21 LEU A 91 16.465 4.937 1.715 1.00 0.97 H new ATOM 0 HD22 LEU A 91 15.076 4.142 2.494 1.00 0.97 H new ATOM 0 HD23 LEU A 91 15.384 5.872 2.775 1.00 0.97 H new ATOM 1535 N SER A 92 16.028 7.236 7.013 1.00 0.71 N ATOM 1536 CA SER A 92 16.105 8.734 7.020 1.00 0.81 C ATOM 1537 C SER A 92 15.803 9.331 5.628 1.00 0.88 C ATOM 1538 O SER A 92 15.367 10.456 5.533 1.00 1.04 O ATOM 1539 CB SER A 92 17.503 9.162 7.456 1.00 0.85 C ATOM 1540 OG SER A 92 17.415 9.862 8.691 1.00 0.94 O ATOM 0 H SER A 92 15.363 6.839 7.676 1.00 0.71 H new ATOM 0 HA SER A 92 15.353 9.106 7.716 1.00 0.81 H new ATOM 0 HB2 SER A 92 18.146 8.289 7.565 1.00 0.85 H new ATOM 0 HB3 SER A 92 17.955 9.798 6.695 1.00 0.85 H new ATOM 0 HG SER A 92 18.311 10.137 8.976 1.00 0.94 H new ATOM 1546 N ILE A 93 16.085 8.608 4.566 1.00 0.85 N ATOM 1547 CA ILE A 93 15.880 9.117 3.166 1.00 0.92 C ATOM 1548 C ILE A 93 17.094 9.968 2.784 1.00 1.05 C ATOM 1549 O ILE A 93 17.954 9.534 2.044 1.00 1.13 O ATOM 1550 CB ILE A 93 14.596 9.958 3.022 1.00 1.02 C ATOM 1551 CG1 ILE A 93 13.406 9.245 3.680 1.00 1.07 C ATOM 1552 CG2 ILE A 93 14.299 10.144 1.531 1.00 1.16 C ATOM 1553 CD1 ILE A 93 12.100 9.753 3.059 1.00 1.65 C ATOM 0 H ILE A 93 16.459 7.660 4.613 1.00 0.85 H new ATOM 0 HA ILE A 93 15.771 8.258 2.504 1.00 0.92 H new ATOM 0 HB ILE A 93 14.743 10.921 3.511 1.00 1.02 H new ATOM 0 HG12 ILE A 93 13.492 8.167 3.542 1.00 1.07 H new ATOM 0 HG13 ILE A 93 13.406 9.429 4.754 1.00 1.07 H new ATOM 0 HG21 ILE A 93 13.393 10.738 1.412 1.00 1.16 H new ATOM 0 HG22 ILE A 93 15.134 10.658 1.055 1.00 1.16 H new ATOM 0 HG23 ILE A 93 14.158 9.169 1.064 1.00 1.16 H new ATOM 0 HD11 ILE A 93 11.255 9.247 3.525 1.00 1.65 H new ATOM 0 HD12 ILE A 93 12.014 10.828 3.220 1.00 1.65 H new ATOM 0 HD13 ILE A 93 12.101 9.546 1.989 1.00 1.65 H new ATOM 1565 N ARG A 94 17.183 11.162 3.292 1.00 1.20 N ATOM 1566 CA ARG A 94 18.357 12.020 2.967 1.00 1.42 C ATOM 1567 C ARG A 94 18.608 12.990 4.121 1.00 1.49 C ATOM 1568 O ARG A 94 19.287 13.987 3.975 1.00 1.74 O ATOM 1569 CB ARG A 94 18.111 12.787 1.656 1.00 1.79 C ATOM 1570 CG ARG A 94 17.145 13.958 1.871 1.00 2.10 C ATOM 1571 CD ARG A 94 15.864 13.449 2.521 1.00 2.55 C ATOM 1572 NE ARG A 94 14.794 14.476 2.382 1.00 3.16 N ATOM 1573 CZ ARG A 94 14.767 15.499 3.192 1.00 3.74 C ATOM 1574 NH1 ARG A 94 15.677 15.621 4.118 1.00 3.85 N ATOM 1575 NH2 ARG A 94 13.829 16.398 3.075 1.00 4.56 N ATOM 0 H ARG A 94 16.496 11.583 3.918 1.00 1.20 H new ATOM 0 HA ARG A 94 19.238 11.393 2.831 1.00 1.42 H new ATOM 0 HB2 ARG A 94 19.058 13.160 1.267 1.00 1.79 H new ATOM 0 HB3 ARG A 94 17.703 12.109 0.906 1.00 1.79 H new ATOM 0 HG2 ARG A 94 17.610 14.715 2.503 1.00 2.10 H new ATOM 0 HG3 ARG A 94 16.917 14.435 0.918 1.00 2.10 H new ATOM 0 HD2 ARG A 94 15.551 12.517 2.051 1.00 2.55 H new ATOM 0 HD3 ARG A 94 16.040 13.232 3.575 1.00 2.55 H new ATOM 0 HE ARG A 94 14.084 14.380 1.656 1.00 3.16 H new ATOM 0 HH11 ARG A 94 16.410 14.917 4.209 1.00 3.85 H new ATOM 0 HH12 ARG A 94 15.656 16.420 4.751 1.00 3.85 H new ATOM 0 HH21 ARG A 94 13.117 16.301 2.351 1.00 4.56 H new ATOM 0 HH22 ARG A 94 13.807 17.198 3.708 1.00 4.56 H new ATOM 1589 N GLN A 95 18.073 12.695 5.274 1.00 1.46 N ATOM 1590 CA GLN A 95 18.283 13.591 6.445 1.00 1.61 C ATOM 1591 C GLN A 95 19.695 13.384 6.994 1.00 2.21 C ATOM 1592 O GLN A 95 20.341 14.372 7.305 1.00 2.75 O ATOM 1593 CB GLN A 95 17.258 13.253 7.530 1.00 1.83 C ATOM 1594 CG GLN A 95 17.791 13.691 8.896 1.00 2.35 C ATOM 1595 CD GLN A 95 16.625 13.826 9.876 1.00 2.88 C ATOM 1596 OE1 GLN A 95 15.697 14.573 9.636 1.00 3.43 O ATOM 1597 NE2 GLN A 95 16.633 13.129 10.979 1.00 3.20 N ATOM 1598 OXT GLN A 95 20.109 12.240 7.094 1.00 2.78 O ATOM 0 H GLN A 95 17.499 11.871 5.455 1.00 1.46 H new ATOM 0 HA GLN A 95 18.161 14.630 6.139 1.00 1.61 H new ATOM 0 HB2 GLN A 95 16.313 13.754 7.320 1.00 1.83 H new ATOM 0 HB3 GLN A 95 17.057 12.182 7.533 1.00 1.83 H new ATOM 0 HG2 GLN A 95 18.511 12.962 9.268 1.00 2.35 H new ATOM 0 HG3 GLN A 95 18.317 14.642 8.806 1.00 2.35 H new ATOM 0 HE21 GLN A 95 17.412 12.502 11.180 1.00 3.20 H new ATOM 0 HE22 GLN A 95 15.860 13.211 11.640 1.00 3.20 H new TER 1607 GLN A 95 ATOM 1608 N ALA B 1 10.416 7.177 -12.848 1.00 5.31 N ATOM 1609 CA ALA B 1 11.038 5.847 -12.596 1.00 4.73 C ATOM 1610 C ALA B 1 10.440 5.236 -11.328 1.00 4.10 C ATOM 1611 O ALA B 1 9.701 4.272 -11.380 1.00 3.94 O ATOM 1612 CB ALA B 1 12.548 6.015 -12.418 1.00 4.76 C ATOM 0 H1 ALA B 1 10.823 7.593 -13.710 1.00 5.31 H new ATOM 0 H2 ALA B 1 9.389 7.063 -12.970 1.00 5.31 H new ATOM 0 H3 ALA B 1 10.601 7.805 -12.040 1.00 5.31 H new ATOM 0 HA ALA B 1 10.843 5.189 -13.443 1.00 4.73 H new ATOM 0 HB1 ALA B 1 13.003 5.042 -12.234 1.00 4.76 H new ATOM 0 HB2 ALA B 1 12.975 6.450 -13.322 1.00 4.76 H new ATOM 0 HB3 ALA B 1 12.744 6.673 -11.572 1.00 4.76 H new ATOM 1620 N LYS B 2 10.755 5.787 -10.188 1.00 4.19 N ATOM 1621 CA LYS B 2 10.205 5.234 -8.918 1.00 4.06 C ATOM 1622 C LYS B 2 10.381 3.716 -8.907 1.00 3.61 C ATOM 1623 O LYS B 2 9.435 2.973 -8.734 1.00 4.29 O ATOM 1624 CB LYS B 2 8.716 5.572 -8.815 1.00 4.79 C ATOM 1625 CG LYS B 2 8.517 7.077 -9.001 1.00 5.69 C ATOM 1626 CD LYS B 2 7.539 7.596 -7.945 1.00 6.62 C ATOM 1627 CE LYS B 2 7.208 9.063 -8.231 1.00 7.56 C ATOM 1628 NZ LYS B 2 8.470 9.813 -8.491 1.00 7.96 N ATOM 0 H LYS B 2 11.368 6.595 -10.081 1.00 4.19 H new ATOM 0 HA LYS B 2 10.737 5.670 -8.072 1.00 4.06 H new ATOM 0 HB2 LYS B 2 8.155 5.025 -9.573 1.00 4.79 H new ATOM 0 HB3 LYS B 2 8.328 5.261 -7.845 1.00 4.79 H new ATOM 0 HG2 LYS B 2 9.472 7.595 -8.913 1.00 5.69 H new ATOM 0 HG3 LYS B 2 8.133 7.283 -10.000 1.00 5.69 H new ATOM 0 HD2 LYS B 2 6.627 6.998 -7.954 1.00 6.62 H new ATOM 0 HD3 LYS B 2 7.975 7.498 -6.951 1.00 6.62 H new ATOM 0 HE2 LYS B 2 6.544 9.136 -9.092 1.00 7.56 H new ATOM 0 HE3 LYS B 2 6.680 9.500 -7.384 1.00 7.56 H new ATOM 0 HZ1 LYS B 2 8.323 10.822 -8.285 1.00 7.96 H new ATOM 0 HZ2 LYS B 2 9.226 9.442 -7.881 1.00 7.96 H new ATOM 0 HZ3 LYS B 2 8.742 9.699 -9.488 1.00 7.96 H new ATOM 1642 N LYS B 3 11.584 3.246 -9.090 1.00 2.84 N ATOM 1643 CA LYS B 3 11.818 1.777 -9.091 1.00 2.84 C ATOM 1644 C LYS B 3 13.318 1.524 -9.215 1.00 2.25 C ATOM 1645 O LYS B 3 13.823 0.494 -8.817 1.00 2.75 O ATOM 1646 CB LYS B 3 11.090 1.140 -10.278 1.00 3.27 C ATOM 1647 CG LYS B 3 10.059 0.133 -9.765 1.00 3.74 C ATOM 1648 CD LYS B 3 9.329 -0.501 -10.951 1.00 4.47 C ATOM 1649 CE LYS B 3 8.529 -1.713 -10.472 1.00 5.15 C ATOM 1650 NZ LYS B 3 9.441 -2.883 -10.326 1.00 5.62 N ATOM 0 H LYS B 3 12.415 3.818 -9.239 1.00 2.84 H new ATOM 0 HA LYS B 3 11.440 1.339 -8.167 1.00 2.84 H new ATOM 0 HB2 LYS B 3 10.597 1.910 -10.872 1.00 3.27 H new ATOM 0 HB3 LYS B 3 11.806 0.642 -10.932 1.00 3.27 H new ATOM 0 HG2 LYS B 3 10.552 -0.638 -9.173 1.00 3.74 H new ATOM 0 HG3 LYS B 3 9.345 0.630 -9.109 1.00 3.74 H new ATOM 0 HD2 LYS B 3 8.663 0.228 -11.413 1.00 4.47 H new ATOM 0 HD3 LYS B 3 10.047 -0.804 -11.713 1.00 4.47 H new ATOM 0 HE2 LYS B 3 8.048 -1.492 -9.519 1.00 5.15 H new ATOM 0 HE3 LYS B 3 7.736 -1.943 -11.183 1.00 5.15 H new ATOM 0 HZ1 LYS B 3 9.026 -3.708 -10.803 1.00 5.62 H new ATOM 0 HZ2 LYS B 3 10.362 -2.661 -10.756 1.00 5.62 H new ATOM 0 HZ3 LYS B 3 9.573 -3.097 -9.317 1.00 5.62 H new ATOM 1664 N LYS B 4 14.029 2.470 -9.762 1.00 1.66 N ATOM 1665 CA LYS B 4 15.498 2.313 -9.915 1.00 1.45 C ATOM 1666 C LYS B 4 16.172 3.664 -9.688 1.00 1.21 C ATOM 1667 O LYS B 4 15.519 4.674 -9.515 1.00 1.74 O ATOM 1668 CB LYS B 4 15.817 1.814 -11.327 1.00 1.77 C ATOM 1669 CG LYS B 4 14.801 0.746 -11.737 1.00 2.27 C ATOM 1670 CD LYS B 4 15.274 0.057 -13.018 1.00 2.87 C ATOM 1671 CE LYS B 4 16.066 -1.201 -12.658 1.00 3.35 C ATOM 1672 NZ LYS B 4 16.795 -1.690 -13.862 1.00 3.94 N ATOM 0 H LYS B 4 13.651 3.350 -10.111 1.00 1.66 H new ATOM 0 HA LYS B 4 15.867 1.591 -9.187 1.00 1.45 H new ATOM 0 HB2 LYS B 4 15.790 2.645 -12.032 1.00 1.77 H new ATOM 0 HB3 LYS B 4 16.826 1.402 -11.358 1.00 1.77 H new ATOM 0 HG2 LYS B 4 14.686 0.013 -10.939 1.00 2.27 H new ATOM 0 HG3 LYS B 4 13.823 1.201 -11.896 1.00 2.27 H new ATOM 0 HD2 LYS B 4 14.418 -0.205 -13.640 1.00 2.87 H new ATOM 0 HD3 LYS B 4 15.896 0.737 -13.601 1.00 2.87 H new ATOM 0 HE2 LYS B 4 16.771 -0.983 -11.856 1.00 3.35 H new ATOM 0 HE3 LYS B 4 15.393 -1.974 -12.288 1.00 3.35 H new ATOM 0 HZ1 LYS B 4 17.334 -2.545 -13.618 1.00 3.94 H new ATOM 0 HZ2 LYS B 4 16.112 -1.914 -14.614 1.00 3.94 H new ATOM 0 HZ3 LYS B 4 17.448 -0.953 -14.195 1.00 3.94 H new ATOM 1686 N SER B 5 17.474 3.684 -9.693 1.00 1.06 N ATOM 1687 CA SER B 5 18.211 4.962 -9.487 1.00 1.29 C ATOM 1688 C SER B 5 18.204 5.339 -8.007 1.00 1.14 C ATOM 1689 O SER B 5 18.836 6.293 -7.598 1.00 1.52 O ATOM 1690 CB SER B 5 17.565 6.071 -10.304 1.00 1.71 C ATOM 1691 OG SER B 5 18.572 6.959 -10.771 1.00 2.58 O ATOM 0 H SER B 5 18.065 2.864 -9.832 1.00 1.06 H new ATOM 0 HA SER B 5 19.242 4.831 -9.815 1.00 1.29 H new ATOM 0 HB2 SER B 5 17.019 5.647 -11.147 1.00 1.71 H new ATOM 0 HB3 SER B 5 16.841 6.612 -9.695 1.00 1.71 H new ATOM 0 HG SER B 5 18.159 7.674 -11.299 1.00 2.58 H new ATOM 1697 N LYS B 6 17.497 4.602 -7.197 1.00 1.03 N ATOM 1698 CA LYS B 6 17.459 4.927 -5.744 1.00 1.04 C ATOM 1699 C LYS B 6 16.711 3.829 -4.989 1.00 0.96 C ATOM 1700 O LYS B 6 16.950 3.593 -3.823 1.00 1.02 O ATOM 1701 CB LYS B 6 16.738 6.261 -5.539 1.00 1.37 C ATOM 1702 CG LYS B 6 17.614 7.192 -4.697 1.00 2.21 C ATOM 1703 CD LYS B 6 16.903 8.535 -4.516 1.00 2.52 C ATOM 1704 CE LYS B 6 17.555 9.585 -5.416 1.00 3.33 C ATOM 1705 NZ LYS B 6 16.813 10.871 -5.297 1.00 3.75 N ATOM 0 H LYS B 6 16.945 3.791 -7.477 1.00 1.03 H new ATOM 0 HA LYS B 6 18.479 4.998 -5.365 1.00 1.04 H new ATOM 0 HB2 LYS B 6 16.522 6.721 -6.503 1.00 1.37 H new ATOM 0 HB3 LYS B 6 15.782 6.097 -5.043 1.00 1.37 H new ATOM 0 HG2 LYS B 6 17.814 6.740 -3.725 1.00 2.21 H new ATOM 0 HG3 LYS B 6 18.578 7.341 -5.184 1.00 2.21 H new ATOM 0 HD2 LYS B 6 15.846 8.435 -4.763 1.00 2.52 H new ATOM 0 HD3 LYS B 6 16.958 8.850 -3.474 1.00 2.52 H new ATOM 0 HE2 LYS B 6 18.598 9.727 -5.131 1.00 3.33 H new ATOM 0 HE3 LYS B 6 17.551 9.245 -6.452 1.00 3.33 H new ATOM 0 HZ1 LYS B 6 17.256 11.585 -5.909 1.00 3.75 H new ATOM 0 HZ2 LYS B 6 15.825 10.730 -5.589 1.00 3.75 H new ATOM 0 HZ3 LYS B 6 16.839 11.197 -4.310 1.00 3.75 H new ATOM 1719 N LEU B 7 15.798 3.163 -5.639 1.00 0.91 N ATOM 1720 CA LEU B 7 15.025 2.090 -4.951 1.00 0.98 C ATOM 1721 C LEU B 7 15.659 0.721 -5.216 1.00 0.86 C ATOM 1722 O LEU B 7 16.083 0.033 -4.305 1.00 0.86 O ATOM 1723 CB LEU B 7 13.588 2.089 -5.476 1.00 1.15 C ATOM 1724 CG LEU B 7 12.751 3.085 -4.674 1.00 1.40 C ATOM 1725 CD1 LEU B 7 13.387 4.474 -4.758 1.00 2.06 C ATOM 1726 CD2 LEU B 7 11.335 3.139 -5.251 1.00 1.70 C ATOM 0 H LEU B 7 15.553 3.315 -6.617 1.00 0.91 H new ATOM 0 HA LEU B 7 15.032 2.282 -3.878 1.00 0.98 H new ATOM 0 HB2 LEU B 7 13.576 2.355 -6.533 1.00 1.15 H new ATOM 0 HB3 LEU B 7 13.160 1.090 -5.394 1.00 1.15 H new ATOM 0 HG LEU B 7 12.710 2.768 -3.632 1.00 1.40 H new ATOM 0 HD11 LEU B 7 12.789 5.183 -4.186 1.00 2.06 H new ATOM 0 HD12 LEU B 7 14.397 4.437 -4.349 1.00 2.06 H new ATOM 0 HD13 LEU B 7 13.429 4.793 -5.800 1.00 2.06 H new ATOM 0 HD21 LEU B 7 10.736 3.849 -4.680 1.00 1.70 H new ATOM 0 HD22 LEU B 7 11.379 3.456 -6.293 1.00 1.70 H new ATOM 0 HD23 LEU B 7 10.880 2.150 -5.191 1.00 1.70 H new ATOM 1738 N GLU B 8 15.711 0.308 -6.453 1.00 0.85 N ATOM 1739 CA GLU B 8 16.294 -1.030 -6.753 1.00 0.91 C ATOM 1740 C GLU B 8 17.821 -0.972 -6.697 1.00 0.79 C ATOM 1741 O GLU B 8 18.423 -1.537 -5.818 1.00 0.74 O ATOM 1742 CB GLU B 8 15.850 -1.476 -8.148 1.00 1.08 C ATOM 1743 CG GLU B 8 16.597 -2.753 -8.537 1.00 1.20 C ATOM 1744 CD GLU B 8 15.805 -3.497 -9.615 1.00 1.47 C ATOM 1745 OE1 GLU B 8 14.748 -4.014 -9.294 1.00 1.97 O ATOM 1746 OE2 GLU B 8 16.271 -3.538 -10.742 1.00 2.06 O ATOM 0 H GLU B 8 15.379 0.833 -7.262 1.00 0.85 H new ATOM 0 HA GLU B 8 15.943 -1.743 -6.007 1.00 0.91 H new ATOM 0 HB2 GLU B 8 14.775 -1.653 -8.160 1.00 1.08 H new ATOM 0 HB3 GLU B 8 16.051 -0.689 -8.874 1.00 1.08 H new ATOM 0 HG2 GLU B 8 17.593 -2.507 -8.906 1.00 1.20 H new ATOM 0 HG3 GLU B 8 16.730 -3.390 -7.663 1.00 1.20 H new ATOM 1753 N ILE B 9 18.439 -0.281 -7.619 1.00 0.80 N ATOM 1754 CA ILE B 9 19.940 -0.198 -7.618 1.00 0.81 C ATOM 1755 C ILE B 9 20.420 -0.266 -6.163 1.00 0.71 C ATOM 1756 O ILE B 9 21.335 -0.992 -5.825 1.00 0.82 O ATOM 1757 CB ILE B 9 20.377 1.129 -8.245 1.00 0.85 C ATOM 1758 CG1 ILE B 9 19.831 1.236 -9.680 1.00 1.52 C ATOM 1759 CG2 ILE B 9 21.905 1.220 -8.259 1.00 1.50 C ATOM 1760 CD1 ILE B 9 20.293 0.047 -10.535 1.00 1.88 C ATOM 0 H ILE B 9 17.977 0.229 -8.372 1.00 0.80 H new ATOM 0 HA ILE B 9 20.368 -1.018 -8.194 1.00 0.81 H new ATOM 0 HB ILE B 9 19.978 1.952 -7.652 1.00 0.85 H new ATOM 0 HG12 ILE B 9 18.742 1.270 -9.657 1.00 1.52 H new ATOM 0 HG13 ILE B 9 20.170 2.168 -10.133 1.00 1.52 H new ATOM 0 HG21 ILE B 9 22.209 2.166 -8.706 1.00 1.50 H new ATOM 0 HG22 ILE B 9 22.282 1.163 -7.238 1.00 1.50 H new ATOM 0 HG23 ILE B 9 22.313 0.395 -8.843 1.00 1.50 H new ATOM 0 HD11 ILE B 9 19.893 0.147 -11.544 1.00 1.88 H new ATOM 0 HD12 ILE B 9 21.382 0.030 -10.576 1.00 1.88 H new ATOM 0 HD13 ILE B 9 19.932 -0.881 -10.092 1.00 1.88 H new ATOM 1772 N ILE B 10 19.784 0.477 -5.307 1.00 0.59 N ATOM 1773 CA ILE B 10 20.162 0.468 -3.863 1.00 0.59 C ATOM 1774 C ILE B 10 19.958 -0.937 -3.298 1.00 0.51 C ATOM 1775 O ILE B 10 20.858 -1.524 -2.732 1.00 0.54 O ATOM 1776 CB ILE B 10 19.313 1.488 -3.084 1.00 0.67 C ATOM 1777 CG1 ILE B 10 20.064 2.830 -3.061 1.00 0.85 C ATOM 1778 CG2 ILE B 10 19.085 0.990 -1.646 1.00 0.74 C ATOM 1779 CD1 ILE B 10 19.219 3.912 -2.377 1.00 1.31 C ATOM 0 H ILE B 10 19.010 1.098 -5.544 1.00 0.59 H new ATOM 0 HA ILE B 10 21.210 0.748 -3.761 1.00 0.59 H new ATOM 0 HB ILE B 10 18.343 1.612 -3.566 1.00 0.67 H new ATOM 0 HG12 ILE B 10 21.011 2.714 -2.534 1.00 0.85 H new ATOM 0 HG13 ILE B 10 20.302 3.137 -4.079 1.00 0.85 H new ATOM 0 HG21 ILE B 10 18.483 1.717 -1.100 1.00 0.74 H new ATOM 0 HG22 ILE B 10 18.564 0.033 -1.671 1.00 0.74 H new ATOM 0 HG23 ILE B 10 20.046 0.867 -1.147 1.00 0.74 H new ATOM 0 HD11 ILE B 10 19.769 4.853 -2.371 1.00 1.31 H new ATOM 0 HD12 ILE B 10 18.283 4.041 -2.921 1.00 1.31 H new ATOM 0 HD13 ILE B 10 19.004 3.611 -1.352 1.00 1.31 H new ATOM 1791 N GLN B 11 18.774 -1.478 -3.441 1.00 0.50 N ATOM 1792 CA GLN B 11 18.509 -2.845 -2.908 1.00 0.50 C ATOM 1793 C GLN B 11 19.683 -3.764 -3.257 1.00 0.52 C ATOM 1794 O GLN B 11 20.163 -4.511 -2.428 1.00 0.52 O ATOM 1795 CB GLN B 11 17.223 -3.396 -3.529 1.00 0.55 C ATOM 1796 CG GLN B 11 16.013 -2.815 -2.794 1.00 1.24 C ATOM 1797 CD GLN B 11 14.733 -3.169 -3.552 1.00 1.53 C ATOM 1798 OE1 GLN B 11 14.255 -4.283 -3.474 1.00 2.22 O ATOM 1799 NE2 GLN B 11 14.152 -2.260 -4.287 1.00 1.91 N ATOM 0 H GLN B 11 17.982 -1.031 -3.903 1.00 0.50 H new ATOM 0 HA GLN B 11 18.395 -2.798 -1.825 1.00 0.50 H new ATOM 0 HB2 GLN B 11 17.178 -3.138 -4.587 1.00 0.55 H new ATOM 0 HB3 GLN B 11 17.213 -4.484 -3.465 1.00 0.55 H new ATOM 0 HG2 GLN B 11 15.967 -3.210 -1.779 1.00 1.24 H new ATOM 0 HG3 GLN B 11 16.111 -1.733 -2.711 1.00 1.24 H new ATOM 0 HE21 GLN B 11 14.553 -1.324 -4.353 1.00 1.91 H new ATOM 0 HE22 GLN B 11 13.297 -2.485 -4.796 1.00 1.91 H new ATOM 1808 N ALA B 12 20.165 -3.700 -4.469 1.00 0.57 N ATOM 1809 CA ALA B 12 21.324 -4.552 -4.856 1.00 0.62 C ATOM 1810 C ALA B 12 22.555 -4.129 -4.048 1.00 0.57 C ATOM 1811 O ALA B 12 23.371 -4.943 -3.663 1.00 0.57 O ATOM 1812 CB ALA B 12 21.611 -4.382 -6.350 1.00 0.71 C ATOM 0 H ALA B 12 19.806 -3.094 -5.207 1.00 0.57 H new ATOM 0 HA ALA B 12 21.092 -5.597 -4.650 1.00 0.62 H new ATOM 0 HB1 ALA B 12 22.459 -5.006 -6.631 1.00 0.71 H new ATOM 0 HB2 ALA B 12 20.735 -4.681 -6.925 1.00 0.71 H new ATOM 0 HB3 ALA B 12 21.844 -3.338 -6.559 1.00 0.71 H new ATOM 1818 N ILE B 13 22.682 -2.856 -3.777 1.00 0.55 N ATOM 1819 CA ILE B 13 23.849 -2.383 -2.982 1.00 0.51 C ATOM 1820 C ILE B 13 23.703 -2.898 -1.552 1.00 0.44 C ATOM 1821 O ILE B 13 24.650 -3.349 -0.933 1.00 0.45 O ATOM 1822 CB ILE B 13 23.896 -0.853 -2.987 1.00 0.52 C ATOM 1823 CG1 ILE B 13 24.200 -0.362 -4.405 1.00 0.65 C ATOM 1824 CG2 ILE B 13 24.995 -0.372 -2.039 1.00 0.52 C ATOM 1825 CD1 ILE B 13 23.931 1.140 -4.498 1.00 0.84 C ATOM 0 H ILE B 13 22.031 -2.128 -4.071 1.00 0.55 H new ATOM 0 HA ILE B 13 24.775 -2.759 -3.418 1.00 0.51 H new ATOM 0 HB ILE B 13 22.935 -0.458 -2.659 1.00 0.52 H new ATOM 0 HG12 ILE B 13 25.239 -0.572 -4.658 1.00 0.65 H new ATOM 0 HG13 ILE B 13 23.582 -0.897 -5.126 1.00 0.65 H new ATOM 0 HG21 ILE B 13 25.028 0.717 -2.043 1.00 0.52 H new ATOM 0 HG22 ILE B 13 24.785 -0.725 -1.029 1.00 0.52 H new ATOM 0 HG23 ILE B 13 25.957 -0.765 -2.368 1.00 0.52 H new ATOM 0 HD11 ILE B 13 24.148 1.487 -5.508 1.00 0.84 H new ATOM 0 HD12 ILE B 13 22.885 1.337 -4.264 1.00 0.84 H new ATOM 0 HD13 ILE B 13 24.568 1.668 -3.788 1.00 0.84 H new ATOM 1837 N LEU B 14 22.510 -2.844 -1.031 1.00 0.45 N ATOM 1838 CA LEU B 14 22.273 -3.334 0.351 1.00 0.41 C ATOM 1839 C LEU B 14 22.612 -4.828 0.425 1.00 0.42 C ATOM 1840 O LEU B 14 23.246 -5.290 1.347 1.00 0.41 O ATOM 1841 CB LEU B 14 20.797 -3.128 0.706 1.00 0.45 C ATOM 1842 CG LEU B 14 20.674 -2.113 1.846 1.00 0.57 C ATOM 1843 CD1 LEU B 14 19.195 -1.825 2.113 1.00 0.54 C ATOM 1844 CD2 LEU B 14 21.321 -2.672 3.117 1.00 1.01 C ATOM 0 H LEU B 14 21.685 -2.479 -1.507 1.00 0.45 H new ATOM 0 HA LEU B 14 22.901 -2.785 1.052 1.00 0.41 H new ATOM 0 HB2 LEU B 14 20.249 -2.775 -0.168 1.00 0.45 H new ATOM 0 HB3 LEU B 14 20.349 -4.077 1.002 1.00 0.45 H new ATOM 0 HG LEU B 14 21.183 -1.192 1.561 1.00 0.57 H new ATOM 0 HD11 LEU B 14 19.106 -1.103 2.924 1.00 0.54 H new ATOM 0 HD12 LEU B 14 18.735 -1.418 1.212 1.00 0.54 H new ATOM 0 HD13 LEU B 14 18.689 -2.749 2.393 1.00 0.54 H new ATOM 0 HD21 LEU B 14 21.229 -1.944 3.923 1.00 1.01 H new ATOM 0 HD22 LEU B 14 20.820 -3.596 3.404 1.00 1.01 H new ATOM 0 HD23 LEU B 14 22.376 -2.874 2.930 1.00 1.01 H new ATOM 1856 N GLU B 15 22.198 -5.579 -0.554 1.00 0.47 N ATOM 1857 CA GLU B 15 22.491 -7.042 -0.566 1.00 0.52 C ATOM 1858 C GLU B 15 23.972 -7.286 -0.850 1.00 0.53 C ATOM 1859 O GLU B 15 24.506 -8.332 -0.545 1.00 0.60 O ATOM 1860 CB GLU B 15 21.656 -7.725 -1.653 1.00 0.59 C ATOM 1861 CG GLU B 15 20.181 -7.747 -1.245 1.00 0.80 C ATOM 1862 CD GLU B 15 19.468 -8.887 -1.974 1.00 0.73 C ATOM 1863 OE1 GLU B 15 20.035 -9.403 -2.923 1.00 1.29 O ATOM 1864 OE2 GLU B 15 18.367 -9.225 -1.572 1.00 1.28 O ATOM 0 H GLU B 15 21.664 -5.241 -1.355 1.00 0.47 H new ATOM 0 HA GLU B 15 22.240 -7.455 0.411 1.00 0.52 H new ATOM 0 HB2 GLU B 15 21.772 -7.195 -2.599 1.00 0.59 H new ATOM 0 HB3 GLU B 15 22.013 -8.743 -1.812 1.00 0.59 H new ATOM 0 HG2 GLU B 15 20.093 -7.879 -0.167 1.00 0.80 H new ATOM 0 HG3 GLU B 15 19.711 -6.794 -1.489 1.00 0.80 H new ATOM 1871 N ALA B 16 24.646 -6.345 -1.437 1.00 0.49 N ATOM 1872 CA ALA B 16 26.078 -6.557 -1.731 1.00 0.52 C ATOM 1873 C ALA B 16 26.852 -6.494 -0.429 1.00 0.50 C ATOM 1874 O ALA B 16 27.781 -7.244 -0.201 1.00 0.54 O ATOM 1875 CB ALA B 16 26.561 -5.465 -2.680 1.00 0.53 C ATOM 0 H ALA B 16 24.267 -5.443 -1.724 1.00 0.49 H new ATOM 0 HA ALA B 16 26.231 -7.529 -2.201 1.00 0.52 H new ATOM 0 HB1 ALA B 16 27.618 -5.616 -2.901 1.00 0.53 H new ATOM 0 HB2 ALA B 16 25.987 -5.507 -3.606 1.00 0.53 H new ATOM 0 HB3 ALA B 16 26.424 -4.490 -2.213 1.00 0.53 H new ATOM 1881 N CYS B 17 26.486 -5.582 0.419 1.00 0.46 N ATOM 1882 CA CYS B 17 27.198 -5.434 1.695 1.00 0.46 C ATOM 1883 C CYS B 17 26.698 -6.464 2.726 1.00 0.47 C ATOM 1884 O CYS B 17 27.290 -6.643 3.762 1.00 0.49 O ATOM 1885 CB CYS B 17 26.975 -4.015 2.194 1.00 0.42 C ATOM 1886 SG CYS B 17 25.222 -3.599 2.069 1.00 0.42 S ATOM 0 H CYS B 17 25.715 -4.930 0.275 1.00 0.46 H new ATOM 0 HA CYS B 17 28.263 -5.617 1.552 1.00 0.46 H new ATOM 0 HB2 CYS B 17 27.308 -3.926 3.228 1.00 0.42 H new ATOM 0 HB3 CYS B 17 27.568 -3.314 1.607 1.00 0.42 H new ATOM 0 HG CYS B 17 24.545 -4.664 1.756 1.00 0.42 H new ATOM 1892 N LYS B 18 25.612 -7.137 2.469 1.00 0.49 N ATOM 1893 CA LYS B 18 25.103 -8.139 3.459 1.00 0.51 C ATOM 1894 C LYS B 18 26.222 -9.078 3.949 1.00 0.55 C ATOM 1895 O LYS B 18 25.984 -9.933 4.778 1.00 0.58 O ATOM 1896 CB LYS B 18 23.993 -8.976 2.821 1.00 0.56 C ATOM 1897 CG LYS B 18 24.603 -10.013 1.874 1.00 1.18 C ATOM 1898 CD LYS B 18 23.510 -10.576 0.961 1.00 1.89 C ATOM 1899 CE LYS B 18 22.511 -11.386 1.791 1.00 2.29 C ATOM 1900 NZ LYS B 18 21.673 -12.218 0.883 1.00 2.90 N ATOM 0 H LYS B 18 25.053 -7.041 1.621 1.00 0.49 H new ATOM 0 HA LYS B 18 24.719 -7.588 4.317 1.00 0.51 H new ATOM 0 HB2 LYS B 18 23.411 -9.476 3.596 1.00 0.56 H new ATOM 0 HB3 LYS B 18 23.307 -8.330 2.274 1.00 0.56 H new ATOM 0 HG2 LYS B 18 25.391 -9.556 1.276 1.00 1.18 H new ATOM 0 HG3 LYS B 18 25.064 -10.818 2.447 1.00 1.18 H new ATOM 0 HD2 LYS B 18 22.996 -9.763 0.448 1.00 1.89 H new ATOM 0 HD3 LYS B 18 23.955 -11.207 0.192 1.00 1.89 H new ATOM 0 HE2 LYS B 18 23.041 -12.022 2.499 1.00 2.29 H new ATOM 0 HE3 LYS B 18 21.879 -10.717 2.375 1.00 2.29 H new ATOM 0 HZ1 LYS B 18 20.994 -12.769 1.445 1.00 2.90 H new ATOM 0 HZ2 LYS B 18 21.157 -11.601 0.224 1.00 2.90 H new ATOM 0 HZ3 LYS B 18 22.283 -12.866 0.345 1.00 2.90 H new ATOM 1914 N SER B 19 27.430 -8.955 3.455 1.00 0.57 N ATOM 1915 CA SER B 19 28.505 -9.879 3.925 1.00 0.63 C ATOM 1916 C SER B 19 29.892 -9.265 3.699 1.00 0.66 C ATOM 1917 O SER B 19 30.852 -9.967 3.449 1.00 0.84 O ATOM 1918 CB SER B 19 28.407 -11.196 3.156 1.00 0.70 C ATOM 1919 OG SER B 19 27.160 -11.815 3.443 1.00 0.93 O ATOM 0 H SER B 19 27.714 -8.266 2.758 1.00 0.57 H new ATOM 0 HA SER B 19 28.372 -10.053 4.993 1.00 0.63 H new ATOM 0 HB2 SER B 19 28.497 -11.013 2.085 1.00 0.70 H new ATOM 0 HB3 SER B 19 29.227 -11.857 3.437 1.00 0.70 H new ATOM 0 HG SER B 19 26.766 -11.403 4.240 1.00 0.93 H new ATOM 1925 N GLY B 20 30.016 -7.971 3.804 1.00 0.65 N ATOM 1926 CA GLY B 20 31.354 -7.332 3.614 1.00 0.66 C ATOM 1927 C GLY B 20 31.842 -7.568 2.188 1.00 0.70 C ATOM 1928 O GLY B 20 32.250 -8.655 1.834 1.00 0.77 O ATOM 0 H GLY B 20 29.253 -7.328 4.013 1.00 0.65 H new ATOM 0 HA2 GLY B 20 31.288 -6.262 3.813 1.00 0.66 H new ATOM 0 HA3 GLY B 20 32.069 -7.745 4.326 1.00 0.66 H new ATOM 1932 N SER B 21 31.778 -6.566 1.358 1.00 0.67 N ATOM 1933 CA SER B 21 32.210 -6.747 -0.054 1.00 0.74 C ATOM 1934 C SER B 21 32.647 -5.388 -0.641 1.00 0.72 C ATOM 1935 O SER B 21 31.900 -4.434 -0.574 1.00 0.63 O ATOM 1936 CB SER B 21 31.018 -7.276 -0.852 1.00 0.74 C ATOM 1937 OG SER B 21 30.072 -7.845 0.044 1.00 0.72 O ATOM 0 H SER B 21 31.446 -5.631 1.596 1.00 0.67 H new ATOM 0 HA SER B 21 33.046 -7.444 -0.104 1.00 0.74 H new ATOM 0 HB2 SER B 21 30.558 -6.468 -1.421 1.00 0.74 H new ATOM 0 HB3 SER B 21 31.350 -8.024 -1.572 1.00 0.74 H new ATOM 0 HG SER B 21 29.181 -7.824 -0.364 1.00 0.72 H new ATOM 1943 N PRO B 22 33.834 -5.283 -1.220 1.00 0.82 N ATOM 1944 CA PRO B 22 34.303 -4.000 -1.826 1.00 0.83 C ATOM 1945 C PRO B 22 33.251 -3.401 -2.761 1.00 0.81 C ATOM 1946 O PRO B 22 32.294 -4.054 -3.122 1.00 0.80 O ATOM 1947 CB PRO B 22 35.547 -4.387 -2.627 1.00 0.93 C ATOM 1948 CG PRO B 22 36.041 -5.665 -2.032 1.00 1.08 C ATOM 1949 CD PRO B 22 34.851 -6.345 -1.353 1.00 0.95 C ATOM 0 HA PRO B 22 34.500 -3.247 -1.063 1.00 0.83 H new ATOM 0 HB2 PRO B 22 35.307 -4.516 -3.682 1.00 0.93 H new ATOM 0 HB3 PRO B 22 36.308 -3.609 -2.566 1.00 0.93 H new ATOM 0 HG2 PRO B 22 36.462 -6.310 -2.803 1.00 1.08 H new ATOM 0 HG3 PRO B 22 36.835 -5.471 -1.311 1.00 1.08 H new ATOM 0 HD2 PRO B 22 34.478 -7.177 -1.950 1.00 0.95 H new ATOM 0 HD3 PRO B 22 35.129 -6.750 -0.380 1.00 0.95 H new ATOM 1957 N LYS B 23 33.418 -2.169 -3.163 1.00 0.80 N ATOM 1958 CA LYS B 23 32.416 -1.555 -4.080 1.00 0.80 C ATOM 1959 C LYS B 23 32.397 -2.347 -5.395 1.00 0.79 C ATOM 1960 O LYS B 23 31.397 -2.403 -6.080 1.00 0.79 O ATOM 1961 CB LYS B 23 32.792 -0.091 -4.364 1.00 0.82 C ATOM 1962 CG LYS B 23 31.596 0.663 -4.978 1.00 0.78 C ATOM 1963 CD LYS B 23 32.005 1.264 -6.321 1.00 1.42 C ATOM 1964 CE LYS B 23 33.082 2.327 -6.096 1.00 1.27 C ATOM 1965 NZ LYS B 23 32.577 3.649 -6.561 1.00 1.83 N ATOM 0 H LYS B 23 34.198 -1.567 -2.899 1.00 0.80 H new ATOM 0 HA LYS B 23 31.430 -1.581 -3.616 1.00 0.80 H new ATOM 0 HB2 LYS B 23 33.102 0.397 -3.440 1.00 0.82 H new ATOM 0 HB3 LYS B 23 33.642 -0.053 -5.045 1.00 0.82 H new ATOM 0 HG2 LYS B 23 30.755 -0.017 -5.113 1.00 0.78 H new ATOM 0 HG3 LYS B 23 31.263 1.451 -4.302 1.00 0.78 H new ATOM 0 HD2 LYS B 23 32.382 0.483 -6.982 1.00 1.42 H new ATOM 0 HD3 LYS B 23 31.139 1.707 -6.813 1.00 1.42 H new ATOM 0 HE2 LYS B 23 33.344 2.377 -5.039 1.00 1.27 H new ATOM 0 HE3 LYS B 23 33.990 2.061 -6.638 1.00 1.27 H new ATOM 0 HZ1 LYS B 23 33.052 4.408 -6.031 1.00 1.83 H new ATOM 0 HZ2 LYS B 23 32.775 3.759 -7.576 1.00 1.83 H new ATOM 0 HZ3 LYS B 23 31.551 3.705 -6.401 1.00 1.83 H new ATOM 1979 N THR B 24 33.498 -2.965 -5.752 1.00 0.79 N ATOM 1980 CA THR B 24 33.550 -3.762 -7.016 1.00 0.79 C ATOM 1981 C THR B 24 32.663 -5.013 -6.916 1.00 0.82 C ATOM 1982 O THR B 24 31.948 -5.349 -7.839 1.00 0.84 O ATOM 1983 CB THR B 24 34.994 -4.189 -7.284 1.00 0.78 C ATOM 1984 OG1 THR B 24 35.337 -5.264 -6.421 1.00 0.85 O ATOM 1985 CG2 THR B 24 35.933 -3.010 -7.032 1.00 0.82 C ATOM 0 H THR B 24 34.367 -2.950 -5.218 1.00 0.79 H new ATOM 0 HA THR B 24 33.181 -3.140 -7.832 1.00 0.79 H new ATOM 0 HB THR B 24 35.091 -4.511 -8.321 1.00 0.78 H new ATOM 0 HG1 THR B 24 36.262 -5.539 -6.593 1.00 0.85 H new ATOM 0 HG21 THR B 24 36.961 -3.316 -7.224 1.00 0.82 H new ATOM 0 HG22 THR B 24 35.670 -2.187 -7.696 1.00 0.82 H new ATOM 0 HG23 THR B 24 35.838 -2.684 -5.996 1.00 0.82 H new ATOM 1993 N ARG B 25 32.708 -5.708 -5.807 1.00 0.84 N ATOM 1994 CA ARG B 25 31.875 -6.940 -5.651 1.00 0.89 C ATOM 1995 C ARG B 25 30.405 -6.574 -5.846 1.00 0.90 C ATOM 1996 O ARG B 25 29.535 -7.419 -5.929 1.00 0.96 O ATOM 1997 CB ARG B 25 32.082 -7.499 -4.237 1.00 0.90 C ATOM 1998 CG ARG B 25 33.040 -8.693 -4.273 1.00 1.33 C ATOM 1999 CD ARG B 25 32.254 -9.960 -4.604 1.00 1.07 C ATOM 2000 NE ARG B 25 33.193 -11.112 -4.717 1.00 1.67 N ATOM 2001 CZ ARG B 25 32.733 -12.332 -4.703 1.00 2.00 C ATOM 2002 NH1 ARG B 25 31.449 -12.544 -4.599 1.00 2.14 N ATOM 2003 NH2 ARG B 25 33.556 -13.341 -4.795 1.00 2.74 N ATOM 0 H ARG B 25 33.287 -5.475 -5.001 1.00 0.84 H new ATOM 0 HA ARG B 25 32.164 -7.688 -6.389 1.00 0.89 H new ATOM 0 HB2 ARG B 25 32.483 -6.722 -3.586 1.00 0.90 H new ATOM 0 HB3 ARG B 25 31.124 -7.805 -3.816 1.00 0.90 H new ATOM 0 HG2 ARG B 25 33.817 -8.528 -5.019 1.00 1.33 H new ATOM 0 HG3 ARG B 25 33.540 -8.802 -3.311 1.00 1.33 H new ATOM 0 HD2 ARG B 25 31.514 -10.155 -3.828 1.00 1.07 H new ATOM 0 HD3 ARG B 25 31.709 -9.829 -5.539 1.00 1.07 H new ATOM 0 HE ARG B 25 34.196 -10.946 -4.805 1.00 1.67 H new ATOM 0 HH11 ARG B 25 30.806 -11.755 -4.529 1.00 2.14 H new ATOM 0 HH12 ARG B 25 31.089 -13.498 -4.588 1.00 2.14 H new ATOM 0 HH21 ARG B 25 34.559 -13.175 -4.878 1.00 2.74 H new ATOM 0 HH22 ARG B 25 33.196 -14.295 -4.784 1.00 2.74 H new ATOM 2017 N ILE B 26 30.145 -5.311 -5.927 1.00 0.86 N ATOM 2018 CA ILE B 26 28.755 -4.856 -6.128 1.00 0.89 C ATOM 2019 C ILE B 26 28.451 -4.857 -7.623 1.00 0.93 C ATOM 2020 O ILE B 26 27.322 -5.033 -8.037 1.00 0.96 O ATOM 2021 CB ILE B 26 28.589 -3.474 -5.505 1.00 0.86 C ATOM 2022 CG1 ILE B 26 29.241 -3.523 -4.115 1.00 0.92 C ATOM 2023 CG2 ILE B 26 27.099 -3.145 -5.385 1.00 0.90 C ATOM 2024 CD1 ILE B 26 28.804 -2.337 -3.250 1.00 0.62 C ATOM 0 H ILE B 26 30.841 -4.568 -5.862 1.00 0.86 H new ATOM 0 HA ILE B 26 28.046 -5.525 -5.641 1.00 0.89 H new ATOM 0 HB ILE B 26 29.058 -2.704 -6.117 1.00 0.86 H new ATOM 0 HG12 ILE B 26 28.973 -4.456 -3.618 1.00 0.92 H new ATOM 0 HG13 ILE B 26 30.326 -3.518 -4.220 1.00 0.92 H new ATOM 0 HG21 ILE B 26 26.979 -2.157 -4.940 1.00 0.90 H new ATOM 0 HG22 ILE B 26 26.643 -3.154 -6.375 1.00 0.90 H new ATOM 0 HG23 ILE B 26 26.612 -3.889 -4.754 1.00 0.90 H new ATOM 0 HD11 ILE B 26 29.284 -2.403 -2.273 1.00 0.62 H new ATOM 0 HD12 ILE B 26 29.095 -1.406 -3.736 1.00 0.62 H new ATOM 0 HD13 ILE B 26 27.721 -2.357 -3.125 1.00 0.62 H new ATOM 2036 N MET B 27 29.451 -4.663 -8.443 1.00 0.94 N ATOM 2037 CA MET B 27 29.207 -4.658 -9.913 1.00 0.99 C ATOM 2038 C MET B 27 28.451 -5.933 -10.285 1.00 1.06 C ATOM 2039 O MET B 27 27.510 -5.910 -11.053 1.00 1.10 O ATOM 2040 CB MET B 27 30.540 -4.592 -10.666 1.00 0.98 C ATOM 2041 CG MET B 27 31.230 -3.247 -10.397 1.00 1.55 C ATOM 2042 SD MET B 27 32.942 -3.326 -10.981 1.00 1.89 S ATOM 2043 CE MET B 27 32.594 -3.481 -12.752 1.00 1.25 C ATOM 0 H MET B 27 30.419 -4.509 -8.160 1.00 0.94 H new ATOM 0 HA MET B 27 28.615 -3.785 -10.189 1.00 0.99 H new ATOM 0 HB2 MET B 27 31.186 -5.411 -10.350 1.00 0.98 H new ATOM 0 HB3 MET B 27 30.369 -4.715 -11.736 1.00 0.98 H new ATOM 0 HG2 MET B 27 30.697 -2.444 -10.905 1.00 1.55 H new ATOM 0 HG3 MET B 27 31.207 -3.020 -9.331 1.00 1.55 H new ATOM 0 HE1 MET B 27 33.482 -3.210 -13.322 1.00 1.25 H new ATOM 0 HE2 MET B 27 32.316 -4.510 -12.980 1.00 1.25 H new ATOM 0 HE3 MET B 27 31.773 -2.816 -13.021 1.00 1.25 H new ATOM 2053 N TYR B 28 28.842 -7.041 -9.721 1.00 1.07 N ATOM 2054 CA TYR B 28 28.135 -8.321 -10.007 1.00 1.14 C ATOM 2055 C TYR B 28 26.659 -8.162 -9.631 1.00 1.09 C ATOM 2056 O TYR B 28 25.850 -9.045 -9.838 1.00 1.20 O ATOM 2057 CB TYR B 28 28.761 -9.429 -9.160 1.00 1.17 C ATOM 2058 CG TYR B 28 28.208 -10.771 -9.573 1.00 1.43 C ATOM 2059 CD1 TYR B 28 28.760 -11.452 -10.665 1.00 1.71 C ATOM 2060 CD2 TYR B 28 27.147 -11.340 -8.858 1.00 2.20 C ATOM 2061 CE1 TYR B 28 28.251 -12.700 -11.041 1.00 1.98 C ATOM 2062 CE2 TYR B 28 26.637 -12.587 -9.235 1.00 2.58 C ATOM 2063 CZ TYR B 28 27.190 -13.268 -10.326 1.00 2.21 C ATOM 2064 OH TYR B 28 26.689 -14.500 -10.695 1.00 2.65 O ATOM 0 H TYR B 28 29.625 -7.116 -9.071 1.00 1.07 H new ATOM 0 HA TYR B 28 28.220 -8.575 -11.064 1.00 1.14 H new ATOM 0 HB2 TYR B 28 29.844 -9.421 -9.279 1.00 1.17 H new ATOM 0 HB3 TYR B 28 28.555 -9.251 -8.104 1.00 1.17 H new ATOM 0 HD1 TYR B 28 29.579 -11.014 -11.217 1.00 1.71 H new ATOM 0 HD2 TYR B 28 26.722 -10.816 -8.015 1.00 2.20 H new ATOM 0 HE1 TYR B 28 28.677 -13.225 -11.883 1.00 1.98 H new ATOM 0 HE2 TYR B 28 25.817 -13.024 -8.685 1.00 2.58 H new ATOM 0 HH TYR B 28 25.956 -14.749 -10.094 1.00 2.65 H new ATOM 2074 N GLY B 29 26.311 -7.031 -9.080 1.00 1.05 N ATOM 2075 CA GLY B 29 24.896 -6.784 -8.685 1.00 1.02 C ATOM 2076 C GLY B 29 24.166 -6.029 -9.801 1.00 1.05 C ATOM 2077 O GLY B 29 23.087 -6.406 -10.212 1.00 1.10 O ATOM 0 H GLY B 29 26.952 -6.262 -8.885 1.00 1.05 H new ATOM 0 HA2 GLY B 29 24.394 -7.731 -8.487 1.00 1.02 H new ATOM 0 HA3 GLY B 29 24.863 -6.206 -7.761 1.00 1.02 H new ATOM 2081 N ALA B 30 24.741 -4.962 -10.292 1.00 1.06 N ATOM 2082 CA ALA B 30 24.068 -4.186 -11.377 1.00 1.10 C ATOM 2083 C ALA B 30 25.122 -3.468 -12.234 1.00 1.16 C ATOM 2084 O ALA B 30 26.307 -3.705 -12.103 1.00 1.24 O ATOM 2085 CB ALA B 30 23.118 -3.157 -10.751 1.00 1.13 C ATOM 0 H ALA B 30 25.644 -4.595 -9.990 1.00 1.06 H new ATOM 0 HA ALA B 30 23.499 -4.866 -12.011 1.00 1.10 H new ATOM 0 HB1 ALA B 30 22.625 -2.589 -11.540 1.00 1.13 H new ATOM 0 HB2 ALA B 30 22.367 -3.672 -10.152 1.00 1.13 H new ATOM 0 HB3 ALA B 30 23.686 -2.477 -10.115 1.00 1.13 H new ATOM 2091 N ASN B 31 24.696 -2.598 -13.115 1.00 1.19 N ATOM 2092 CA ASN B 31 25.667 -1.869 -13.988 1.00 1.26 C ATOM 2093 C ASN B 31 26.484 -0.873 -13.157 1.00 1.28 C ATOM 2094 O ASN B 31 27.193 -0.046 -13.691 1.00 1.73 O ATOM 2095 CB ASN B 31 24.901 -1.114 -15.074 1.00 1.34 C ATOM 2096 CG ASN B 31 25.706 -1.138 -16.375 1.00 1.68 C ATOM 2097 OD1 ASN B 31 25.236 -1.623 -17.384 1.00 2.40 O ATOM 2098 ND2 ASN B 31 26.909 -0.634 -16.392 1.00 1.85 N ATOM 0 H ASN B 31 23.716 -2.361 -13.268 1.00 1.19 H new ATOM 0 HA ASN B 31 26.345 -2.590 -14.444 1.00 1.26 H new ATOM 0 HB2 ASN B 31 23.924 -1.571 -15.230 1.00 1.34 H new ATOM 0 HB3 ASN B 31 24.725 -0.085 -14.761 1.00 1.34 H new ATOM 0 HD21 ASN B 31 27.455 -0.647 -17.253 1.00 1.85 H new ATOM 0 HD22 ASN B 31 27.303 -0.227 -15.544 1.00 1.85 H new ATOM 2105 N LEU B 32 26.421 -0.992 -11.859 1.00 1.11 N ATOM 2106 CA LEU B 32 27.215 -0.114 -10.942 1.00 1.05 C ATOM 2107 C LEU B 32 27.525 1.252 -11.510 1.00 1.03 C ATOM 2108 O LEU B 32 28.473 1.464 -12.239 1.00 1.08 O ATOM 2109 CB LEU B 32 28.504 -0.822 -10.557 1.00 1.08 C ATOM 2110 CG LEU B 32 28.515 -1.109 -9.041 1.00 1.11 C ATOM 2111 CD1 LEU B 32 28.520 0.201 -8.259 1.00 1.07 C ATOM 2112 CD2 LEU B 32 27.269 -1.905 -8.633 1.00 1.16 C ATOM 0 H LEU B 32 25.838 -1.678 -11.380 1.00 1.11 H new ATOM 0 HA LEU B 32 26.592 0.063 -10.066 1.00 1.05 H new ATOM 0 HB2 LEU B 32 28.596 -1.755 -11.113 1.00 1.08 H new ATOM 0 HB3 LEU B 32 29.362 -0.205 -10.825 1.00 1.08 H new ATOM 0 HG LEU B 32 29.412 -1.687 -8.817 1.00 1.11 H new ATOM 0 HD11 LEU B 32 28.528 -0.013 -7.190 1.00 1.07 H new ATOM 0 HD12 LEU B 32 29.408 0.777 -8.520 1.00 1.07 H new ATOM 0 HD13 LEU B 32 27.628 0.776 -8.507 1.00 1.07 H new ATOM 0 HD21 LEU B 32 27.295 -2.097 -7.560 1.00 1.16 H new ATOM 0 HD22 LEU B 32 26.375 -1.331 -8.877 1.00 1.16 H new ATOM 0 HD23 LEU B 32 27.250 -2.853 -9.171 1.00 1.16 H new ATOM 2124 N SER B 33 26.772 2.187 -11.057 1.00 0.99 N ATOM 2125 CA SER B 33 26.991 3.603 -11.388 1.00 1.01 C ATOM 2126 C SER B 33 28.263 4.027 -10.644 1.00 0.96 C ATOM 2127 O SER B 33 28.500 5.184 -10.450 1.00 0.96 O ATOM 2128 CB SER B 33 25.789 4.436 -10.940 1.00 0.99 C ATOM 2129 OG SER B 33 24.610 3.652 -11.055 1.00 1.33 O ATOM 0 H SER B 33 25.976 2.022 -10.442 1.00 0.99 H new ATOM 0 HA SER B 33 27.104 3.755 -12.461 1.00 1.01 H new ATOM 0 HB2 SER B 33 25.923 4.765 -9.909 1.00 0.99 H new ATOM 0 HB3 SER B 33 25.705 5.334 -11.552 1.00 0.99 H new ATOM 0 HG SER B 33 23.836 4.180 -10.767 1.00 1.33 H new ATOM 2135 N TYR B 34 29.005 3.057 -10.130 1.00 0.95 N ATOM 2136 CA TYR B 34 30.212 3.312 -9.263 1.00 0.94 C ATOM 2137 C TYR B 34 30.760 4.730 -9.415 1.00 0.96 C ATOM 2138 O TYR B 34 31.008 5.394 -8.428 1.00 0.89 O ATOM 2139 CB TYR B 34 31.329 2.341 -9.654 1.00 1.10 C ATOM 2140 CG TYR B 34 32.042 2.827 -10.894 1.00 1.01 C ATOM 2141 CD1 TYR B 34 33.110 3.725 -10.779 1.00 1.77 C ATOM 2142 CD2 TYR B 34 31.642 2.374 -12.156 1.00 1.81 C ATOM 2143 CE1 TYR B 34 33.777 4.172 -11.925 1.00 2.53 C ATOM 2144 CE2 TYR B 34 32.310 2.819 -13.303 1.00 2.56 C ATOM 2145 CZ TYR B 34 33.376 3.719 -13.188 1.00 2.75 C ATOM 2146 OH TYR B 34 34.034 4.158 -14.318 1.00 3.76 O ATOM 0 H TYR B 34 28.813 2.067 -10.284 1.00 0.95 H new ATOM 0 HA TYR B 34 29.892 3.173 -8.230 1.00 0.94 H new ATOM 0 HB2 TYR B 34 32.039 2.245 -8.833 1.00 1.10 H new ATOM 0 HB3 TYR B 34 30.912 1.350 -9.832 1.00 1.10 H new ATOM 0 HD1 TYR B 34 33.419 4.073 -9.805 1.00 1.77 H new ATOM 0 HD2 TYR B 34 30.818 1.681 -12.245 1.00 1.81 H new ATOM 0 HE1 TYR B 34 34.600 4.866 -11.836 1.00 2.53 H new ATOM 0 HE2 TYR B 34 32.003 2.468 -14.277 1.00 2.56 H new ATOM 0 HH TYR B 34 33.632 3.747 -15.111 1.00 3.76 H new ATOM 2156 N ALA B 35 30.927 5.235 -10.594 1.00 1.07 N ATOM 2157 CA ALA B 35 31.424 6.630 -10.680 1.00 1.15 C ATOM 2158 C ALA B 35 30.428 7.507 -9.917 1.00 1.05 C ATOM 2159 O ALA B 35 30.788 8.362 -9.132 1.00 1.03 O ATOM 2160 CB ALA B 35 31.491 7.071 -12.145 1.00 1.30 C ATOM 0 H ALA B 35 30.748 4.763 -11.480 1.00 1.07 H new ATOM 0 HA ALA B 35 32.424 6.714 -10.255 1.00 1.15 H new ATOM 0 HB1 ALA B 35 31.857 8.096 -12.200 1.00 1.30 H new ATOM 0 HB2 ALA B 35 32.168 6.415 -12.692 1.00 1.30 H new ATOM 0 HB3 ALA B 35 30.496 7.016 -12.587 1.00 1.30 H new ATOM 2166 N LEU B 36 29.169 7.264 -10.149 1.00 1.02 N ATOM 2167 CA LEU B 36 28.082 8.022 -9.465 1.00 0.96 C ATOM 2168 C LEU B 36 27.558 7.255 -8.232 1.00 0.83 C ATOM 2169 O LEU B 36 27.389 7.821 -7.171 1.00 0.79 O ATOM 2170 CB LEU B 36 26.926 8.229 -10.454 1.00 1.03 C ATOM 2171 CG LEU B 36 26.568 9.717 -10.556 1.00 1.16 C ATOM 2172 CD1 LEU B 36 26.207 10.259 -9.172 1.00 1.74 C ATOM 2173 CD2 LEU B 36 27.759 10.498 -11.121 1.00 1.99 C ATOM 0 H LEU B 36 28.839 6.553 -10.801 1.00 1.02 H new ATOM 0 HA LEU B 36 28.482 8.979 -9.131 1.00 0.96 H new ATOM 0 HB2 LEU B 36 27.207 7.848 -11.436 1.00 1.03 H new ATOM 0 HB3 LEU B 36 26.055 7.660 -10.129 1.00 1.03 H new ATOM 0 HG LEU B 36 25.713 9.834 -11.221 1.00 1.16 H new ATOM 0 HD11 LEU B 36 25.954 11.316 -9.250 1.00 1.74 H new ATOM 0 HD12 LEU B 36 25.353 9.709 -8.777 1.00 1.74 H new ATOM 0 HD13 LEU B 36 27.057 10.138 -8.501 1.00 1.74 H new ATOM 0 HD21 LEU B 36 27.501 11.555 -11.192 1.00 1.99 H new ATOM 0 HD22 LEU B 36 28.619 10.378 -10.462 1.00 1.99 H new ATOM 0 HD23 LEU B 36 28.006 10.118 -12.112 1.00 1.99 H new ATOM 2185 N THR B 37 27.251 5.979 -8.389 1.00 0.80 N ATOM 2186 CA THR B 37 26.678 5.174 -7.251 1.00 0.71 C ATOM 2187 C THR B 37 27.346 5.550 -5.934 1.00 0.66 C ATOM 2188 O THR B 37 26.740 5.459 -4.883 1.00 0.61 O ATOM 2189 CB THR B 37 26.841 3.669 -7.517 1.00 0.80 C ATOM 2190 OG1 THR B 37 25.680 3.184 -8.176 1.00 0.93 O ATOM 2191 CG2 THR B 37 27.028 2.907 -6.193 1.00 0.81 C ATOM 0 H THR B 37 27.374 5.461 -9.259 1.00 0.80 H new ATOM 0 HA THR B 37 25.615 5.402 -7.178 1.00 0.71 H new ATOM 0 HB THR B 37 27.721 3.513 -8.141 1.00 0.80 H new ATOM 0 HG1 THR B 37 24.914 3.753 -7.951 1.00 0.93 H new ATOM 0 HG21 THR B 37 27.142 1.843 -6.399 1.00 0.81 H new ATOM 0 HG22 THR B 37 27.918 3.276 -5.684 1.00 0.81 H new ATOM 0 HG23 THR B 37 26.156 3.062 -5.558 1.00 0.81 H new ATOM 2199 N GLY B 38 28.570 5.984 -5.974 1.00 0.69 N ATOM 2200 CA GLY B 38 29.245 6.393 -4.701 1.00 0.68 C ATOM 2201 C GLY B 38 28.245 7.223 -3.879 1.00 0.65 C ATOM 2202 O GLY B 38 28.336 7.333 -2.673 1.00 0.64 O ATOM 0 H GLY B 38 29.133 6.075 -6.819 1.00 0.69 H new ATOM 0 HA2 GLY B 38 29.564 5.515 -4.139 1.00 0.68 H new ATOM 0 HA3 GLY B 38 30.140 6.977 -4.915 1.00 0.68 H new ATOM 2206 N ARG B 39 27.272 7.782 -4.555 1.00 0.67 N ATOM 2207 CA ARG B 39 26.212 8.589 -3.882 1.00 0.69 C ATOM 2208 C ARG B 39 25.270 7.662 -3.098 1.00 0.64 C ATOM 2209 O ARG B 39 24.780 8.012 -2.042 1.00 0.64 O ATOM 2210 CB ARG B 39 25.407 9.339 -4.951 1.00 0.76 C ATOM 2211 CG ARG B 39 24.454 10.342 -4.291 1.00 0.80 C ATOM 2212 CD ARG B 39 23.157 10.430 -5.103 1.00 0.82 C ATOM 2213 NE ARG B 39 22.490 11.736 -4.838 1.00 1.17 N ATOM 2214 CZ ARG B 39 22.884 12.810 -5.466 1.00 1.79 C ATOM 2215 NH1 ARG B 39 23.864 12.742 -6.325 1.00 2.44 N ATOM 2216 NH2 ARG B 39 22.297 13.953 -5.236 1.00 2.34 N ATOM 0 H ARG B 39 27.168 7.710 -5.567 1.00 0.67 H new ATOM 0 HA ARG B 39 26.674 9.297 -3.193 1.00 0.69 H new ATOM 0 HB2 ARG B 39 26.084 9.861 -5.627 1.00 0.76 H new ATOM 0 HB3 ARG B 39 24.840 8.630 -5.553 1.00 0.76 H new ATOM 0 HG2 ARG B 39 24.235 10.032 -3.269 1.00 0.80 H new ATOM 0 HG3 ARG B 39 24.926 11.323 -4.233 1.00 0.80 H new ATOM 0 HD2 ARG B 39 23.374 10.330 -6.166 1.00 0.82 H new ATOM 0 HD3 ARG B 39 22.492 9.609 -4.835 1.00 0.82 H new ATOM 0 HE ARG B 39 21.725 11.791 -4.165 1.00 1.17 H new ATOM 0 HH11 ARG B 39 24.323 11.849 -6.506 1.00 2.44 H new ATOM 0 HH12 ARG B 39 24.171 13.582 -6.816 1.00 2.44 H new ATOM 0 HH21 ARG B 39 21.530 14.007 -4.565 1.00 2.34 H new ATOM 0 HH22 ARG B 39 22.605 14.792 -5.727 1.00 2.34 H new ATOM 2230 N TYR B 40 25.023 6.477 -3.598 1.00 0.60 N ATOM 2231 CA TYR B 40 24.124 5.539 -2.863 1.00 0.56 C ATOM 2232 C TYR B 40 24.876 4.989 -1.659 1.00 0.48 C ATOM 2233 O TYR B 40 24.340 4.886 -0.574 1.00 0.47 O ATOM 2234 CB TYR B 40 23.688 4.366 -3.763 1.00 0.58 C ATOM 2235 CG TYR B 40 23.038 4.863 -5.046 1.00 0.81 C ATOM 2236 CD1 TYR B 40 22.024 5.838 -5.016 1.00 1.51 C ATOM 2237 CD2 TYR B 40 23.448 4.332 -6.277 1.00 1.61 C ATOM 2238 CE1 TYR B 40 21.436 6.274 -6.209 1.00 1.79 C ATOM 2239 CE2 TYR B 40 22.858 4.771 -7.467 1.00 1.88 C ATOM 2240 CZ TYR B 40 21.853 5.742 -7.433 1.00 1.59 C ATOM 2241 OH TYR B 40 21.271 6.174 -8.608 1.00 2.01 O ATOM 0 H TYR B 40 25.402 6.122 -4.476 1.00 0.60 H new ATOM 0 HA TYR B 40 23.232 6.081 -2.550 1.00 0.56 H new ATOM 0 HB2 TYR B 40 24.554 3.751 -4.007 1.00 0.58 H new ATOM 0 HB3 TYR B 40 22.988 3.730 -3.221 1.00 0.58 H new ATOM 0 HD1 TYR B 40 21.699 6.250 -4.072 1.00 1.51 H new ATOM 0 HD2 TYR B 40 24.223 3.580 -6.307 1.00 1.61 H new ATOM 0 HE1 TYR B 40 20.658 7.023 -6.184 1.00 1.79 H new ATOM 0 HE2 TYR B 40 23.179 4.360 -8.412 1.00 1.88 H new ATOM 0 HH TYR B 40 20.368 6.507 -8.423 1.00 2.01 H new ATOM 2251 N ILE B 41 26.120 4.643 -1.835 1.00 0.44 N ATOM 2252 CA ILE B 41 26.904 4.111 -0.689 1.00 0.40 C ATOM 2253 C ILE B 41 27.055 5.201 0.374 1.00 0.41 C ATOM 2254 O ILE B 41 26.630 5.045 1.499 1.00 0.41 O ATOM 2255 CB ILE B 41 28.283 3.664 -1.183 1.00 0.41 C ATOM 2256 CG1 ILE B 41 28.195 2.220 -1.686 1.00 0.53 C ATOM 2257 CG2 ILE B 41 29.296 3.741 -0.039 1.00 0.47 C ATOM 2258 CD1 ILE B 41 29.335 1.952 -2.670 1.00 0.54 C ATOM 0 H ILE B 41 26.625 4.705 -2.719 1.00 0.44 H new ATOM 0 HA ILE B 41 26.386 3.257 -0.252 1.00 0.40 H new ATOM 0 HB ILE B 41 28.606 4.319 -1.992 1.00 0.41 H new ATOM 0 HG12 ILE B 41 28.254 1.527 -0.847 1.00 0.53 H new ATOM 0 HG13 ILE B 41 27.234 2.051 -2.172 1.00 0.53 H new ATOM 0 HG21 ILE B 41 30.275 3.422 -0.397 1.00 0.47 H new ATOM 0 HG22 ILE B 41 29.359 4.767 0.323 1.00 0.47 H new ATOM 0 HG23 ILE B 41 28.977 3.089 0.774 1.00 0.47 H new ATOM 0 HD11 ILE B 41 29.273 0.924 -3.028 1.00 0.54 H new ATOM 0 HD12 ILE B 41 29.255 2.636 -3.515 1.00 0.54 H new ATOM 0 HD13 ILE B 41 30.291 2.104 -2.169 1.00 0.54 H new ATOM 2270 N LYS B 42 27.642 6.311 0.016 1.00 0.46 N ATOM 2271 CA LYS B 42 27.819 7.421 1.001 1.00 0.50 C ATOM 2272 C LYS B 42 26.480 7.723 1.676 1.00 0.51 C ATOM 2273 O LYS B 42 26.413 8.012 2.854 1.00 0.53 O ATOM 2274 CB LYS B 42 28.301 8.677 0.270 1.00 0.59 C ATOM 2275 CG LYS B 42 29.226 9.493 1.181 1.00 0.89 C ATOM 2276 CD LYS B 42 28.519 9.813 2.503 1.00 0.61 C ATOM 2277 CE LYS B 42 29.188 11.021 3.161 1.00 0.65 C ATOM 2278 NZ LYS B 42 29.182 10.848 4.642 1.00 1.61 N ATOM 0 H LYS B 42 28.008 6.499 -0.917 1.00 0.46 H new ATOM 0 HA LYS B 42 28.552 7.124 1.751 1.00 0.50 H new ATOM 0 HB2 LYS B 42 28.829 8.397 -0.641 1.00 0.59 H new ATOM 0 HB3 LYS B 42 27.446 9.283 -0.031 1.00 0.59 H new ATOM 0 HG2 LYS B 42 30.142 8.935 1.376 1.00 0.89 H new ATOM 0 HG3 LYS B 42 29.516 10.418 0.682 1.00 0.89 H new ATOM 0 HD2 LYS B 42 27.465 10.022 2.322 1.00 0.61 H new ATOM 0 HD3 LYS B 42 28.564 8.952 3.169 1.00 0.61 H new ATOM 0 HE2 LYS B 42 30.211 11.124 2.801 1.00 0.65 H new ATOM 0 HE3 LYS B 42 28.660 11.935 2.889 1.00 0.65 H new ATOM 0 HZ1 LYS B 42 30.067 11.223 5.039 1.00 1.61 H new ATOM 0 HZ2 LYS B 42 28.375 11.363 5.048 1.00 1.61 H new ATOM 0 HZ3 LYS B 42 29.100 9.837 4.873 1.00 1.61 H new ATOM 2292 N MET B 43 25.420 7.664 0.927 1.00 0.55 N ATOM 2293 CA MET B 43 24.071 7.954 1.496 1.00 0.60 C ATOM 2294 C MET B 43 23.713 6.913 2.552 1.00 0.50 C ATOM 2295 O MET B 43 23.318 7.237 3.650 1.00 0.52 O ATOM 2296 CB MET B 43 23.028 7.934 0.375 1.00 0.68 C ATOM 2297 CG MET B 43 21.620 8.029 0.966 1.00 0.78 C ATOM 2298 SD MET B 43 20.435 8.382 -0.357 1.00 1.39 S ATOM 2299 CE MET B 43 20.341 10.172 -0.111 1.00 2.16 C ATOM 0 H MET B 43 25.426 7.425 -0.065 1.00 0.55 H new ATOM 0 HA MET B 43 24.084 8.939 1.962 1.00 0.60 H new ATOM 0 HB2 MET B 43 23.201 8.765 -0.308 1.00 0.68 H new ATOM 0 HB3 MET B 43 23.126 7.018 -0.207 1.00 0.68 H new ATOM 0 HG2 MET B 43 21.359 7.095 1.464 1.00 0.78 H new ATOM 0 HG3 MET B 43 21.583 8.814 1.721 1.00 0.78 H new ATOM 0 HE1 MET B 43 19.561 10.587 -0.750 1.00 2.16 H new ATOM 0 HE2 MET B 43 20.106 10.384 0.932 1.00 2.16 H new ATOM 0 HE3 MET B 43 21.299 10.625 -0.367 1.00 2.16 H new ATOM 2309 N LEU B 44 23.839 5.662 2.224 1.00 0.43 N ATOM 2310 CA LEU B 44 23.490 4.600 3.202 1.00 0.35 C ATOM 2311 C LEU B 44 24.489 4.599 4.368 1.00 0.32 C ATOM 2312 O LEU B 44 24.174 4.173 5.461 1.00 0.35 O ATOM 2313 CB LEU B 44 23.490 3.247 2.491 1.00 0.33 C ATOM 2314 CG LEU B 44 22.285 3.184 1.536 1.00 0.49 C ATOM 2315 CD1 LEU B 44 22.573 2.233 0.370 1.00 0.90 C ATOM 2316 CD2 LEU B 44 21.051 2.679 2.290 1.00 0.68 C ATOM 0 H LEU B 44 24.169 5.328 1.319 1.00 0.43 H new ATOM 0 HA LEU B 44 22.498 4.791 3.610 1.00 0.35 H new ATOM 0 HB2 LEU B 44 24.418 3.113 1.935 1.00 0.33 H new ATOM 0 HB3 LEU B 44 23.436 2.438 3.220 1.00 0.33 H new ATOM 0 HG LEU B 44 22.103 4.186 1.148 1.00 0.49 H new ATOM 0 HD11 LEU B 44 21.710 2.201 -0.295 1.00 0.90 H new ATOM 0 HD12 LEU B 44 23.444 2.587 -0.182 1.00 0.90 H new ATOM 0 HD13 LEU B 44 22.771 1.233 0.756 1.00 0.90 H new ATOM 0 HD21 LEU B 44 20.201 2.636 1.609 1.00 0.68 H new ATOM 0 HD22 LEU B 44 21.249 1.683 2.686 1.00 0.68 H new ATOM 0 HD23 LEU B 44 20.824 3.358 3.112 1.00 0.68 H new ATOM 2328 N MET B 45 25.685 5.086 4.157 1.00 0.40 N ATOM 2329 CA MET B 45 26.682 5.120 5.272 1.00 0.42 C ATOM 2330 C MET B 45 26.352 6.297 6.188 1.00 0.44 C ATOM 2331 O MET B 45 26.249 6.172 7.392 1.00 0.43 O ATOM 2332 CB MET B 45 28.098 5.352 4.723 1.00 0.52 C ATOM 2333 CG MET B 45 28.383 4.452 3.520 1.00 1.13 C ATOM 2334 SD MET B 45 29.800 3.394 3.902 1.00 0.80 S ATOM 2335 CE MET B 45 31.062 4.433 3.123 1.00 0.83 C ATOM 0 H MET B 45 26.014 5.460 3.267 1.00 0.40 H new ATOM 0 HA MET B 45 26.640 4.169 5.804 1.00 0.42 H new ATOM 0 HB2 MET B 45 28.211 6.397 4.433 1.00 0.52 H new ATOM 0 HB3 MET B 45 28.830 5.158 5.507 1.00 0.52 H new ATOM 0 HG2 MET B 45 27.509 3.843 3.290 1.00 1.13 H new ATOM 0 HG3 MET B 45 28.591 5.057 2.638 1.00 1.13 H new ATOM 0 HE1 MET B 45 32.005 3.889 3.080 1.00 0.83 H new ATOM 0 HE2 MET B 45 30.746 4.693 2.113 1.00 0.83 H new ATOM 0 HE3 MET B 45 31.195 5.344 3.707 1.00 0.83 H new ATOM 2345 N ASP B 46 26.190 7.438 5.593 1.00 0.48 N ATOM 2346 CA ASP B 46 25.867 8.669 6.365 1.00 0.53 C ATOM 2347 C ASP B 46 24.526 8.506 7.084 1.00 0.51 C ATOM 2348 O ASP B 46 24.261 9.160 8.074 1.00 0.55 O ATOM 2349 CB ASP B 46 25.783 9.857 5.411 1.00 0.59 C ATOM 2350 CG ASP B 46 26.303 11.113 6.110 1.00 0.71 C ATOM 2351 OD1 ASP B 46 27.439 11.094 6.553 1.00 1.30 O ATOM 2352 OD2 ASP B 46 25.555 12.074 6.191 1.00 1.26 O ATOM 0 H ASP B 46 26.269 7.576 4.585 1.00 0.48 H new ATOM 0 HA ASP B 46 26.650 8.839 7.104 1.00 0.53 H new ATOM 0 HB2 ASP B 46 26.370 9.658 4.514 1.00 0.59 H new ATOM 0 HB3 ASP B 46 24.752 10.007 5.091 1.00 0.59 H new ATOM 2357 N LEU B 47 23.674 7.654 6.583 1.00 0.48 N ATOM 2358 CA LEU B 47 22.344 7.470 7.229 1.00 0.50 C ATOM 2359 C LEU B 47 22.397 6.306 8.221 1.00 0.46 C ATOM 2360 O LEU B 47 21.459 6.068 8.956 1.00 0.50 O ATOM 2361 CB LEU B 47 21.289 7.214 6.152 1.00 0.51 C ATOM 2362 CG LEU B 47 20.675 8.552 5.710 1.00 0.59 C ATOM 2363 CD1 LEU B 47 21.774 9.555 5.347 1.00 0.59 C ATOM 2364 CD2 LEU B 47 19.785 8.325 4.488 1.00 0.62 C ATOM 0 H LEU B 47 23.841 7.079 5.757 1.00 0.48 H new ATOM 0 HA LEU B 47 22.078 8.373 7.778 1.00 0.50 H new ATOM 0 HB2 LEU B 47 21.740 6.709 5.298 1.00 0.51 H new ATOM 0 HB3 LEU B 47 20.512 6.555 6.538 1.00 0.51 H new ATOM 0 HG LEU B 47 20.086 8.953 6.535 1.00 0.59 H new ATOM 0 HD11 LEU B 47 21.320 10.496 5.037 1.00 0.59 H new ATOM 0 HD12 LEU B 47 22.410 9.728 6.215 1.00 0.59 H new ATOM 0 HD13 LEU B 47 22.376 9.156 4.530 1.00 0.59 H new ATOM 0 HD21 LEU B 47 19.349 9.273 4.174 1.00 0.62 H new ATOM 0 HD22 LEU B 47 20.382 7.913 3.674 1.00 0.62 H new ATOM 0 HD23 LEU B 47 18.988 7.626 4.743 1.00 0.62 H new ATOM 2376 N GLU B 48 23.488 5.583 8.248 1.00 0.42 N ATOM 2377 CA GLU B 48 23.617 4.435 9.195 1.00 0.42 C ATOM 2378 C GLU B 48 22.867 3.222 8.634 1.00 0.39 C ATOM 2379 O GLU B 48 21.816 2.843 9.109 1.00 0.47 O ATOM 2380 CB GLU B 48 23.060 4.827 10.571 1.00 0.47 C ATOM 2381 CG GLU B 48 23.863 4.118 11.664 1.00 1.16 C ATOM 2382 CD GLU B 48 25.207 4.825 11.849 1.00 1.19 C ATOM 2383 OE1 GLU B 48 25.196 6.009 12.144 1.00 1.69 O ATOM 2384 OE2 GLU B 48 26.225 4.170 11.694 1.00 1.72 O ATOM 0 H GLU B 48 24.300 5.740 7.651 1.00 0.42 H new ATOM 0 HA GLU B 48 24.669 4.175 9.311 1.00 0.42 H new ATOM 0 HB2 GLU B 48 23.117 5.907 10.705 1.00 0.47 H new ATOM 0 HB3 GLU B 48 22.007 4.553 10.641 1.00 0.47 H new ATOM 0 HG2 GLU B 48 23.306 4.123 12.601 1.00 1.16 H new ATOM 0 HG3 GLU B 48 24.023 3.074 11.394 1.00 1.16 H new ATOM 2391 N ILE B 49 23.414 2.610 7.621 1.00 0.32 N ATOM 2392 CA ILE B 49 22.763 1.422 7.007 1.00 0.30 C ATOM 2393 C ILE B 49 23.865 0.529 6.455 1.00 0.30 C ATOM 2394 O ILE B 49 23.794 -0.684 6.538 1.00 0.31 O ATOM 2395 CB ILE B 49 21.844 1.875 5.857 1.00 0.29 C ATOM 2396 CG1 ILE B 49 20.530 2.457 6.405 1.00 0.35 C ATOM 2397 CG2 ILE B 49 21.517 0.691 4.937 1.00 0.29 C ATOM 2398 CD1 ILE B 49 20.588 3.986 6.364 1.00 0.51 C ATOM 0 H ILE B 49 24.295 2.887 7.188 1.00 0.32 H new ATOM 0 HA ILE B 49 22.165 0.886 7.744 1.00 0.30 H new ATOM 0 HB ILE B 49 22.371 2.645 5.293 1.00 0.29 H new ATOM 0 HG12 ILE B 49 19.687 2.099 5.813 1.00 0.35 H new ATOM 0 HG13 ILE B 49 20.369 2.117 7.428 1.00 0.35 H new ATOM 0 HG21 ILE B 49 20.867 1.027 4.129 1.00 0.29 H new ATOM 0 HG22 ILE B 49 22.440 0.291 4.517 1.00 0.29 H new ATOM 0 HG23 ILE B 49 21.012 -0.086 5.510 1.00 0.29 H new ATOM 0 HD11 ILE B 49 19.656 4.396 6.753 1.00 0.51 H new ATOM 0 HD12 ILE B 49 21.421 4.335 6.975 1.00 0.51 H new ATOM 0 HD13 ILE B 49 20.729 4.317 5.335 1.00 0.51 H new ATOM 2410 N ILE B 50 24.895 1.125 5.912 1.00 0.30 N ATOM 2411 CA ILE B 50 26.020 0.325 5.368 1.00 0.31 C ATOM 2412 C ILE B 50 27.202 0.399 6.331 1.00 0.36 C ATOM 2413 O ILE B 50 27.382 1.368 7.041 1.00 0.57 O ATOM 2414 CB ILE B 50 26.421 0.865 3.992 1.00 0.31 C ATOM 2415 CG1 ILE B 50 25.521 0.222 2.927 1.00 0.35 C ATOM 2416 CG2 ILE B 50 27.880 0.502 3.709 1.00 0.36 C ATOM 2417 CD1 ILE B 50 25.817 0.821 1.547 1.00 0.70 C ATOM 0 H ILE B 50 25.001 2.136 5.824 1.00 0.30 H new ATOM 0 HA ILE B 50 25.713 -0.715 5.258 1.00 0.31 H new ATOM 0 HB ILE B 50 26.307 1.949 3.971 1.00 0.31 H new ATOM 0 HG12 ILE B 50 25.684 -0.855 2.906 1.00 0.35 H new ATOM 0 HG13 ILE B 50 24.473 0.381 3.183 1.00 0.35 H new ATOM 0 HG21 ILE B 50 28.167 0.886 2.730 1.00 0.36 H new ATOM 0 HG22 ILE B 50 28.520 0.943 4.473 1.00 0.36 H new ATOM 0 HG23 ILE B 50 27.994 -0.582 3.722 1.00 0.36 H new ATOM 0 HD11 ILE B 50 25.171 0.355 0.802 1.00 0.70 H new ATOM 0 HD12 ILE B 50 25.630 1.895 1.569 1.00 0.70 H new ATOM 0 HD13 ILE B 50 26.860 0.639 1.288 1.00 0.70 H new ATOM 2429 N ARG B 51 28.012 -0.618 6.339 1.00 0.42 N ATOM 2430 CA ARG B 51 29.206 -0.635 7.230 1.00 0.44 C ATOM 2431 C ARG B 51 30.435 -0.354 6.388 1.00 0.44 C ATOM 2432 O ARG B 51 30.367 -0.309 5.181 1.00 0.54 O ATOM 2433 CB ARG B 51 29.383 -2.000 7.877 1.00 0.52 C ATOM 2434 CG ARG B 51 30.043 -1.849 9.257 1.00 0.75 C ATOM 2435 CD ARG B 51 28.984 -1.652 10.340 1.00 0.89 C ATOM 2436 NE ARG B 51 29.636 -1.688 11.683 1.00 0.89 N ATOM 2437 CZ ARG B 51 30.033 -0.584 12.264 1.00 0.95 C ATOM 2438 NH1 ARG B 51 29.910 0.568 11.660 1.00 1.50 N ATOM 2439 NH2 ARG B 51 30.568 -0.636 13.453 1.00 1.24 N ATOM 0 H ARG B 51 27.898 -1.450 5.760 1.00 0.42 H new ATOM 0 HA ARG B 51 29.071 0.115 8.009 1.00 0.44 H new ATOM 0 HB2 ARG B 51 28.415 -2.491 7.980 1.00 0.52 H new ATOM 0 HB3 ARG B 51 29.997 -2.636 7.239 1.00 0.52 H new ATOM 0 HG2 ARG B 51 30.639 -2.734 9.480 1.00 0.75 H new ATOM 0 HG3 ARG B 51 30.725 -0.999 9.249 1.00 0.75 H new ATOM 0 HD2 ARG B 51 28.474 -0.699 10.196 1.00 0.89 H new ATOM 0 HD3 ARG B 51 28.227 -2.433 10.270 1.00 0.89 H new ATOM 0 HE ARG B 51 29.774 -2.583 12.153 1.00 0.89 H new ATOM 0 HH11 ARG B 51 29.501 0.613 10.727 1.00 1.50 H new ATOM 0 HH12 ARG B 51 30.223 1.422 12.122 1.00 1.50 H new ATOM 0 HH21 ARG B 51 30.675 -1.534 13.925 1.00 1.24 H new ATOM 0 HH22 ARG B 51 30.879 0.221 13.910 1.00 1.24 H new ATOM 2453 N GLN B 52 31.556 -0.188 7.012 1.00 0.44 N ATOM 2454 CA GLN B 52 32.806 0.061 6.253 1.00 0.48 C ATOM 2455 C GLN B 52 33.936 -0.618 7.010 1.00 0.53 C ATOM 2456 O GLN B 52 34.391 -0.135 8.028 1.00 0.65 O ATOM 2457 CB GLN B 52 33.067 1.566 6.169 1.00 0.61 C ATOM 2458 CG GLN B 52 32.479 2.256 7.402 1.00 1.46 C ATOM 2459 CD GLN B 52 33.146 3.619 7.592 1.00 1.70 C ATOM 2460 OE1 GLN B 52 32.684 4.614 7.070 1.00 2.42 O ATOM 2461 NE2 GLN B 52 34.224 3.708 8.324 1.00 1.80 N ATOM 0 H GLN B 52 31.664 -0.214 8.026 1.00 0.44 H new ATOM 0 HA GLN B 52 32.730 -0.331 5.239 1.00 0.48 H new ATOM 0 HB2 GLN B 52 34.138 1.757 6.109 1.00 0.61 H new ATOM 0 HB3 GLN B 52 32.619 1.973 5.263 1.00 0.61 H new ATOM 0 HG2 GLN B 52 31.403 2.380 7.284 1.00 1.46 H new ATOM 0 HG3 GLN B 52 32.634 1.637 8.286 1.00 1.46 H new ATOM 0 HE21 GLN B 52 34.613 2.873 8.763 1.00 1.80 H new ATOM 0 HE22 GLN B 52 34.677 4.612 8.457 1.00 1.80 H new ATOM 2470 N GLU B 53 34.377 -1.753 6.525 1.00 0.57 N ATOM 2471 CA GLU B 53 35.464 -2.497 7.214 1.00 0.74 C ATOM 2472 C GLU B 53 36.595 -2.790 6.242 1.00 0.75 C ATOM 2473 O GLU B 53 36.429 -3.431 5.227 1.00 0.76 O ATOM 2474 CB GLU B 53 34.901 -3.800 7.760 1.00 0.90 C ATOM 2475 CG GLU B 53 34.623 -4.770 6.611 1.00 1.02 C ATOM 2476 CD GLU B 53 33.569 -5.791 7.049 1.00 1.37 C ATOM 2477 OE1 GLU B 53 32.596 -5.385 7.662 1.00 1.95 O ATOM 2478 OE2 GLU B 53 33.754 -6.963 6.763 1.00 2.11 O ATOM 0 H GLU B 53 34.025 -2.194 5.676 1.00 0.57 H new ATOM 0 HA GLU B 53 35.857 -1.893 8.032 1.00 0.74 H new ATOM 0 HB2 GLU B 53 35.607 -4.246 8.461 1.00 0.90 H new ATOM 0 HB3 GLU B 53 33.982 -3.606 8.313 1.00 0.90 H new ATOM 0 HG2 GLU B 53 34.273 -4.223 5.736 1.00 1.02 H new ATOM 0 HG3 GLU B 53 35.541 -5.281 6.322 1.00 1.02 H new ATOM 2485 N GLY B 54 37.744 -2.307 6.573 1.00 0.80 N ATOM 2486 CA GLY B 54 38.936 -2.522 5.713 1.00 0.85 C ATOM 2487 C GLY B 54 38.656 -2.014 4.296 1.00 0.74 C ATOM 2488 O GLY B 54 39.262 -2.466 3.345 1.00 0.88 O ATOM 0 H GLY B 54 37.918 -1.761 7.417 1.00 0.80 H new ATOM 0 HA2 GLY B 54 39.796 -2.000 6.132 1.00 0.85 H new ATOM 0 HA3 GLY B 54 39.189 -3.582 5.685 1.00 0.85 H new ATOM 2492 N LYS B 55 37.723 -1.100 4.158 1.00 0.78 N ATOM 2493 CA LYS B 55 37.349 -0.544 2.815 1.00 0.78 C ATOM 2494 C LYS B 55 36.231 -1.381 2.179 1.00 0.69 C ATOM 2495 O LYS B 55 35.780 -1.086 1.089 1.00 0.70 O ATOM 2496 CB LYS B 55 38.562 -0.488 1.878 1.00 0.91 C ATOM 2497 CG LYS B 55 38.377 0.658 0.879 1.00 1.13 C ATOM 2498 CD LYS B 55 39.563 0.696 -0.087 1.00 1.34 C ATOM 2499 CE LYS B 55 39.974 2.150 -0.332 1.00 1.60 C ATOM 2500 NZ LYS B 55 41.056 2.196 -1.357 1.00 2.11 N ATOM 0 H LYS B 55 37.194 -0.708 4.937 1.00 0.78 H new ATOM 0 HA LYS B 55 36.989 0.474 2.966 1.00 0.78 H new ATOM 0 HB2 LYS B 55 39.475 -0.339 2.455 1.00 0.91 H new ATOM 0 HB3 LYS B 55 38.670 -1.434 1.348 1.00 0.91 H new ATOM 0 HG2 LYS B 55 37.448 0.524 0.325 1.00 1.13 H new ATOM 0 HG3 LYS B 55 38.297 1.607 1.410 1.00 1.13 H new ATOM 0 HD2 LYS B 55 40.401 0.135 0.326 1.00 1.34 H new ATOM 0 HD3 LYS B 55 39.294 0.219 -1.029 1.00 1.34 H new ATOM 0 HE2 LYS B 55 39.115 2.730 -0.669 1.00 1.60 H new ATOM 0 HE3 LYS B 55 40.320 2.603 0.597 1.00 1.60 H new ATOM 0 HZ1 LYS B 55 41.335 3.184 -1.523 1.00 2.11 H new ATOM 0 HZ2 LYS B 55 41.878 1.656 -1.018 1.00 2.11 H new ATOM 0 HZ3 LYS B 55 40.711 1.780 -2.245 1.00 2.11 H new ATOM 2514 N GLN B 56 35.754 -2.396 2.860 1.00 0.70 N ATOM 2515 CA GLN B 56 34.636 -3.210 2.289 1.00 0.70 C ATOM 2516 C GLN B 56 33.350 -2.735 2.935 1.00 0.60 C ATOM 2517 O GLN B 56 33.373 -2.174 4.008 1.00 0.60 O ATOM 2518 CB GLN B 56 34.802 -4.702 2.577 1.00 0.85 C ATOM 2519 CG GLN B 56 36.279 -5.087 2.552 1.00 1.17 C ATOM 2520 CD GLN B 56 36.416 -6.528 2.056 1.00 1.15 C ATOM 2521 OE1 GLN B 56 37.389 -6.874 1.416 1.00 1.54 O ATOM 2522 NE2 GLN B 56 35.474 -7.391 2.330 1.00 1.66 N ATOM 0 H GLN B 56 36.087 -2.693 3.777 1.00 0.70 H new ATOM 0 HA GLN B 56 34.628 -3.081 1.207 1.00 0.70 H new ATOM 0 HB2 GLN B 56 34.374 -4.941 3.550 1.00 0.85 H new ATOM 0 HB3 GLN B 56 34.255 -5.285 1.836 1.00 0.85 H new ATOM 0 HG2 GLN B 56 36.832 -4.411 1.900 1.00 1.17 H new ATOM 0 HG3 GLN B 56 36.709 -4.991 3.549 1.00 1.17 H new ATOM 0 HE21 GLN B 56 34.657 -7.101 2.867 1.00 1.66 H new ATOM 0 HE22 GLN B 56 35.556 -8.355 2.007 1.00 1.66 H new ATOM 2531 N TYR B 57 32.236 -2.925 2.283 1.00 0.56 N ATOM 2532 CA TYR B 57 30.955 -2.434 2.860 1.00 0.48 C ATOM 2533 C TYR B 57 30.132 -3.580 3.440 1.00 0.47 C ATOM 2534 O TYR B 57 29.949 -4.608 2.820 1.00 0.53 O ATOM 2535 CB TYR B 57 30.165 -1.727 1.774 1.00 0.46 C ATOM 2536 CG TYR B 57 31.064 -0.713 1.102 1.00 0.49 C ATOM 2537 CD1 TYR B 57 31.935 -1.108 0.080 1.00 1.18 C ATOM 2538 CD2 TYR B 57 31.039 0.626 1.516 1.00 1.27 C ATOM 2539 CE1 TYR B 57 32.775 -0.169 -0.528 1.00 1.18 C ATOM 2540 CE2 TYR B 57 31.880 1.564 0.909 1.00 1.30 C ATOM 2541 CZ TYR B 57 32.749 1.168 -0.113 1.00 0.57 C ATOM 2542 OH TYR B 57 33.579 2.094 -0.711 1.00 0.63 O ATOM 0 H TYR B 57 32.158 -3.396 1.382 1.00 0.56 H new ATOM 0 HA TYR B 57 31.179 -1.743 3.672 1.00 0.48 H new ATOM 0 HB2 TYR B 57 29.797 -2.448 1.044 1.00 0.46 H new ATOM 0 HB3 TYR B 57 29.293 -1.233 2.202 1.00 0.46 H new ATOM 0 HD1 TYR B 57 31.959 -2.139 -0.240 1.00 1.18 H new ATOM 0 HD2 TYR B 57 30.369 0.934 2.305 1.00 1.27 H new ATOM 0 HE1 TYR B 57 33.444 -0.476 -1.318 1.00 1.18 H new ATOM 0 HE2 TYR B 57 31.859 2.595 1.230 1.00 1.30 H new ATOM 0 HH TYR B 57 33.433 2.974 -0.305 1.00 0.63 H new ATOM 2552 N MET B 58 29.667 -3.394 4.651 1.00 0.44 N ATOM 2553 CA MET B 58 28.876 -4.454 5.339 1.00 0.45 C ATOM 2554 C MET B 58 27.519 -3.922 5.767 1.00 0.42 C ATOM 2555 O MET B 58 27.171 -2.777 5.559 1.00 0.40 O ATOM 2556 CB MET B 58 29.602 -5.021 6.564 1.00 0.50 C ATOM 2557 CG MET B 58 29.509 -6.551 6.587 1.00 1.04 C ATOM 2558 SD MET B 58 29.759 -7.132 8.284 1.00 1.10 S ATOM 2559 CE MET B 58 28.079 -7.740 8.572 1.00 1.52 C ATOM 0 H MET B 58 29.805 -2.543 5.196 1.00 0.44 H new ATOM 0 HA MET B 58 28.747 -5.260 4.617 1.00 0.45 H new ATOM 0 HB2 MET B 58 30.648 -4.715 6.547 1.00 0.50 H new ATOM 0 HB3 MET B 58 29.165 -4.611 7.474 1.00 0.50 H new ATOM 0 HG2 MET B 58 28.536 -6.875 6.218 1.00 1.04 H new ATOM 0 HG3 MET B 58 30.260 -6.984 5.926 1.00 1.04 H new ATOM 0 HE1 MET B 58 28.008 -8.150 9.580 1.00 1.52 H new ATOM 0 HE2 MET B 58 27.371 -6.918 8.464 1.00 1.52 H new ATOM 0 HE3 MET B 58 27.844 -8.519 7.846 1.00 1.52 H new ATOM 2569 N LEU B 59 26.749 -4.788 6.337 1.00 0.44 N ATOM 2570 CA LEU B 59 25.380 -4.425 6.776 1.00 0.43 C ATOM 2571 C LEU B 59 25.401 -4.042 8.255 1.00 0.41 C ATOM 2572 O LEU B 59 25.931 -4.755 9.084 1.00 0.47 O ATOM 2573 CB LEU B 59 24.489 -5.661 6.642 1.00 0.51 C ATOM 2574 CG LEU B 59 23.322 -5.398 5.692 1.00 0.77 C ATOM 2575 CD1 LEU B 59 22.462 -4.250 6.222 1.00 1.05 C ATOM 2576 CD2 LEU B 59 23.854 -5.038 4.310 1.00 1.25 C ATOM 0 H LEU B 59 27.013 -5.755 6.523 1.00 0.44 H new ATOM 0 HA LEU B 59 25.013 -3.595 6.172 1.00 0.43 H new ATOM 0 HB2 LEU B 59 25.079 -6.500 6.274 1.00 0.51 H new ATOM 0 HB3 LEU B 59 24.107 -5.945 7.622 1.00 0.51 H new ATOM 0 HG LEU B 59 22.713 -6.299 5.624 1.00 0.77 H new ATOM 0 HD11 LEU B 59 21.633 -4.070 5.538 1.00 1.05 H new ATOM 0 HD12 LEU B 59 22.071 -4.512 7.205 1.00 1.05 H new ATOM 0 HD13 LEU B 59 23.068 -3.348 6.302 1.00 1.05 H new ATOM 0 HD21 LEU B 59 23.018 -4.851 3.636 1.00 1.25 H new ATOM 0 HD22 LEU B 59 24.471 -4.142 4.380 1.00 1.25 H new ATOM 0 HD23 LEU B 59 24.454 -5.863 3.925 1.00 1.25 H new ATOM 2588 N THR B 60 24.820 -2.921 8.593 1.00 0.38 N ATOM 2589 CA THR B 60 24.799 -2.497 10.020 1.00 0.41 C ATOM 2590 C THR B 60 23.458 -2.925 10.608 1.00 0.44 C ATOM 2591 O THR B 60 22.463 -2.933 9.913 1.00 0.43 O ATOM 2592 CB THR B 60 24.915 -0.974 10.118 1.00 0.40 C ATOM 2593 OG1 THR B 60 23.669 -0.383 9.778 1.00 1.04 O ATOM 2594 CG2 THR B 60 25.993 -0.474 9.162 1.00 1.01 C ATOM 0 H THR B 60 24.361 -2.283 7.943 1.00 0.38 H new ATOM 0 HA THR B 60 25.632 -2.951 10.557 1.00 0.41 H new ATOM 0 HB THR B 60 25.185 -0.699 11.138 1.00 0.40 H new ATOM 0 HG1 THR B 60 23.741 0.592 9.842 1.00 1.04 H new ATOM 0 HG21 THR B 60 26.071 0.611 9.236 1.00 1.01 H new ATOM 0 HG22 THR B 60 26.950 -0.925 9.425 1.00 1.01 H new ATOM 0 HG23 THR B 60 25.730 -0.750 8.141 1.00 1.01 H new ATOM 2602 N LYS B 61 23.429 -3.289 11.870 1.00 0.51 N ATOM 2603 CA LYS B 61 22.147 -3.727 12.506 1.00 0.54 C ATOM 2604 C LYS B 61 20.995 -2.911 11.925 1.00 0.51 C ATOM 2605 O LYS B 61 19.993 -3.441 11.492 1.00 0.50 O ATOM 2606 CB LYS B 61 22.222 -3.498 14.020 1.00 0.61 C ATOM 2607 CG LYS B 61 23.667 -3.674 14.496 1.00 1.28 C ATOM 2608 CD LYS B 61 24.408 -2.336 14.411 1.00 1.04 C ATOM 2609 CE LYS B 61 25.893 -2.591 14.144 1.00 1.73 C ATOM 2610 NZ LYS B 61 26.446 -3.468 15.214 1.00 2.19 N ATOM 0 H LYS B 61 24.241 -3.301 12.487 1.00 0.51 H new ATOM 0 HA LYS B 61 21.983 -4.786 12.309 1.00 0.54 H new ATOM 0 HB2 LYS B 61 21.868 -2.497 14.264 1.00 0.61 H new ATOM 0 HB3 LYS B 61 21.570 -4.202 14.537 1.00 0.61 H new ATOM 0 HG2 LYS B 61 23.679 -4.042 15.522 1.00 1.28 H new ATOM 0 HG3 LYS B 61 24.173 -4.420 13.883 1.00 1.28 H new ATOM 0 HD2 LYS B 61 23.984 -1.724 13.615 1.00 1.04 H new ATOM 0 HD3 LYS B 61 24.285 -1.780 15.341 1.00 1.04 H new ATOM 0 HE2 LYS B 61 26.023 -3.062 13.170 1.00 1.73 H new ATOM 0 HE3 LYS B 61 26.436 -1.646 14.116 1.00 1.73 H new ATOM 0 HZ1 LYS B 61 27.485 -3.438 15.185 1.00 2.19 H new ATOM 0 HZ2 LYS B 61 26.116 -3.134 16.142 1.00 2.19 H new ATOM 0 HZ3 LYS B 61 26.124 -4.445 15.063 1.00 2.19 H new ATOM 2624 N LYS B 62 21.157 -1.622 11.889 1.00 0.51 N ATOM 2625 CA LYS B 62 20.099 -0.755 11.309 1.00 0.49 C ATOM 2626 C LYS B 62 19.865 -1.186 9.862 1.00 0.45 C ATOM 2627 O LYS B 62 18.754 -1.463 9.456 1.00 0.53 O ATOM 2628 CB LYS B 62 20.550 0.708 11.349 1.00 0.54 C ATOM 2629 CG LYS B 62 19.810 1.436 12.475 1.00 0.75 C ATOM 2630 CD LYS B 62 20.292 2.887 12.550 1.00 1.16 C ATOM 2631 CE LYS B 62 19.494 3.634 13.620 1.00 1.17 C ATOM 2632 NZ LYS B 62 18.529 4.561 12.964 1.00 2.08 N ATOM 0 H LYS B 62 21.979 -1.129 12.237 1.00 0.51 H new ATOM 0 HA LYS B 62 19.177 -0.852 11.882 1.00 0.49 H new ATOM 0 HB2 LYS B 62 21.627 0.764 11.510 1.00 0.54 H new ATOM 0 HB3 LYS B 62 20.345 1.190 10.393 1.00 0.54 H new ATOM 0 HG2 LYS B 62 18.735 1.408 12.296 1.00 0.75 H new ATOM 0 HG3 LYS B 62 19.988 0.933 13.426 1.00 0.75 H new ATOM 0 HD2 LYS B 62 21.355 2.916 12.787 1.00 1.16 H new ATOM 0 HD3 LYS B 62 20.168 3.373 11.582 1.00 1.16 H new ATOM 0 HE2 LYS B 62 18.960 2.924 14.252 1.00 1.17 H new ATOM 0 HE3 LYS B 62 20.169 4.193 14.268 1.00 1.17 H new ATOM 0 HZ1 LYS B 62 18.883 5.536 13.032 1.00 2.08 H new ATOM 0 HZ2 LYS B 62 18.423 4.300 11.963 1.00 2.08 H new ATOM 0 HZ3 LYS B 62 17.606 4.494 13.438 1.00 2.08 H new ATOM 2646 N GLY B 63 20.910 -1.250 9.082 1.00 0.41 N ATOM 2647 CA GLY B 63 20.751 -1.669 7.664 1.00 0.39 C ATOM 2648 C GLY B 63 19.992 -2.994 7.612 1.00 0.38 C ATOM 2649 O GLY B 63 19.111 -3.183 6.796 1.00 0.39 O ATOM 0 H GLY B 63 21.865 -1.030 9.367 1.00 0.41 H new ATOM 0 HA2 GLY B 63 20.211 -0.905 7.105 1.00 0.39 H new ATOM 0 HA3 GLY B 63 21.728 -1.777 7.193 1.00 0.39 H new ATOM 2653 N GLU B 64 20.305 -3.904 8.492 1.00 0.40 N ATOM 2654 CA GLU B 64 19.574 -5.205 8.507 1.00 0.43 C ATOM 2655 C GLU B 64 18.087 -4.916 8.731 1.00 0.43 C ATOM 2656 O GLU B 64 17.219 -5.412 8.035 1.00 0.42 O ATOM 2657 CB GLU B 64 20.078 -6.080 9.666 1.00 0.52 C ATOM 2658 CG GLU B 64 21.611 -6.149 9.678 1.00 0.63 C ATOM 2659 CD GLU B 64 22.083 -7.195 8.668 1.00 0.88 C ATOM 2660 OE1 GLU B 64 21.340 -7.478 7.744 1.00 1.51 O ATOM 2661 OE2 GLU B 64 23.180 -7.703 8.843 1.00 1.45 O ATOM 0 H GLU B 64 21.033 -3.805 9.200 1.00 0.40 H new ATOM 0 HA GLU B 64 19.737 -5.726 7.563 1.00 0.43 H new ATOM 0 HB2 GLU B 64 19.721 -5.675 10.613 1.00 0.52 H new ATOM 0 HB3 GLU B 64 19.666 -7.085 9.573 1.00 0.52 H new ATOM 0 HG2 GLU B 64 22.031 -5.174 9.431 1.00 0.63 H new ATOM 0 HG3 GLU B 64 21.966 -6.406 10.676 1.00 0.63 H new ATOM 2668 N GLU B 65 17.807 -4.110 9.719 1.00 0.46 N ATOM 2669 CA GLU B 65 16.395 -3.760 10.043 1.00 0.49 C ATOM 2670 C GLU B 65 15.739 -3.068 8.847 1.00 0.45 C ATOM 2671 O GLU B 65 14.545 -3.163 8.646 1.00 0.48 O ATOM 2672 CB GLU B 65 16.371 -2.817 11.247 1.00 0.54 C ATOM 2673 CG GLU B 65 16.878 -3.554 12.487 1.00 0.62 C ATOM 2674 CD GLU B 65 17.002 -2.569 13.650 1.00 1.07 C ATOM 2675 OE1 GLU B 65 15.977 -2.087 14.102 1.00 1.68 O ATOM 2676 OE2 GLU B 65 18.119 -2.314 14.068 1.00 1.66 O ATOM 0 H GLU B 65 18.505 -3.674 10.322 1.00 0.46 H new ATOM 0 HA GLU B 65 15.845 -4.672 10.275 1.00 0.49 H new ATOM 0 HB2 GLU B 65 16.994 -1.944 11.050 1.00 0.54 H new ATOM 0 HB3 GLU B 65 15.357 -2.454 11.417 1.00 0.54 H new ATOM 0 HG2 GLU B 65 16.192 -4.359 12.750 1.00 0.62 H new ATOM 0 HG3 GLU B 65 17.845 -4.013 12.280 1.00 0.62 H new ATOM 2683 N LEU B 66 16.501 -2.367 8.056 1.00 0.44 N ATOM 2684 CA LEU B 66 15.901 -1.668 6.885 1.00 0.45 C ATOM 2685 C LEU B 66 15.676 -2.667 5.749 1.00 0.43 C ATOM 2686 O LEU B 66 14.653 -2.652 5.096 1.00 0.45 O ATOM 2687 CB LEU B 66 16.840 -0.547 6.415 1.00 0.46 C ATOM 2688 CG LEU B 66 16.033 0.687 5.997 1.00 0.64 C ATOM 2689 CD1 LEU B 66 15.014 0.302 4.924 1.00 0.72 C ATOM 2690 CD2 LEU B 66 15.304 1.268 7.209 1.00 1.57 C ATOM 0 H LEU B 66 17.508 -2.248 8.168 1.00 0.44 H new ATOM 0 HA LEU B 66 14.944 -1.235 7.175 1.00 0.45 H new ATOM 0 HB2 LEU B 66 17.531 -0.283 7.216 1.00 0.46 H new ATOM 0 HB3 LEU B 66 17.442 -0.896 5.576 1.00 0.46 H new ATOM 0 HG LEU B 66 16.715 1.436 5.595 1.00 0.64 H new ATOM 0 HD11 LEU B 66 14.444 1.183 4.631 1.00 0.72 H new ATOM 0 HD12 LEU B 66 15.535 -0.099 4.054 1.00 0.72 H new ATOM 0 HD13 LEU B 66 14.336 -0.454 5.321 1.00 0.72 H new ATOM 0 HD21 LEU B 66 14.733 2.145 6.904 1.00 1.57 H new ATOM 0 HD22 LEU B 66 14.627 0.519 7.620 1.00 1.57 H new ATOM 0 HD23 LEU B 66 16.032 1.555 7.968 1.00 1.57 H new ATOM 2702 N LEU B 67 16.610 -3.545 5.514 1.00 0.42 N ATOM 2703 CA LEU B 67 16.427 -4.548 4.431 1.00 0.43 C ATOM 2704 C LEU B 67 15.108 -5.285 4.656 1.00 0.45 C ATOM 2705 O LEU B 67 14.329 -5.484 3.744 1.00 0.48 O ATOM 2706 CB LEU B 67 17.594 -5.543 4.465 1.00 0.45 C ATOM 2707 CG LEU B 67 17.457 -6.562 3.327 1.00 0.51 C ATOM 2708 CD1 LEU B 67 17.507 -5.846 1.974 1.00 0.90 C ATOM 2709 CD2 LEU B 67 18.610 -7.565 3.410 1.00 1.26 C ATOM 0 H LEU B 67 17.491 -3.611 6.024 1.00 0.42 H new ATOM 0 HA LEU B 67 16.405 -4.054 3.460 1.00 0.43 H new ATOM 0 HB2 LEU B 67 18.539 -5.009 4.372 1.00 0.45 H new ATOM 0 HB3 LEU B 67 17.613 -6.060 5.425 1.00 0.45 H new ATOM 0 HG LEU B 67 16.503 -7.081 3.422 1.00 0.51 H new ATOM 0 HD11 LEU B 67 17.409 -6.577 1.172 1.00 0.90 H new ATOM 0 HD12 LEU B 67 16.690 -5.128 1.912 1.00 0.90 H new ATOM 0 HD13 LEU B 67 18.458 -5.323 1.874 1.00 0.90 H new ATOM 0 HD21 LEU B 67 18.518 -8.292 2.603 1.00 1.26 H new ATOM 0 HD22 LEU B 67 19.559 -7.037 3.316 1.00 1.26 H new ATOM 0 HD23 LEU B 67 18.575 -8.081 4.370 1.00 1.26 H new ATOM 2721 N GLU B 68 14.844 -5.684 5.872 1.00 0.44 N ATOM 2722 CA GLU B 68 13.571 -6.401 6.159 1.00 0.48 C ATOM 2723 C GLU B 68 12.398 -5.432 5.999 1.00 0.46 C ATOM 2724 O GLU B 68 11.398 -5.748 5.384 1.00 0.47 O ATOM 2725 CB GLU B 68 13.597 -6.937 7.592 1.00 0.52 C ATOM 2726 CG GLU B 68 14.328 -8.280 7.622 1.00 1.26 C ATOM 2727 CD GLU B 68 15.608 -8.184 6.790 1.00 1.77 C ATOM 2728 OE1 GLU B 68 16.598 -7.703 7.315 1.00 2.23 O ATOM 2729 OE2 GLU B 68 15.576 -8.593 5.641 1.00 2.25 O ATOM 0 H GLU B 68 15.455 -5.544 6.677 1.00 0.44 H new ATOM 0 HA GLU B 68 13.457 -7.233 5.464 1.00 0.48 H new ATOM 0 HB2 GLU B 68 14.096 -6.225 8.249 1.00 0.52 H new ATOM 0 HB3 GLU B 68 12.580 -7.056 7.965 1.00 0.52 H new ATOM 0 HG2 GLU B 68 14.569 -8.552 8.650 1.00 1.26 H new ATOM 0 HG3 GLU B 68 13.684 -9.066 7.228 1.00 1.26 H new ATOM 2736 N ASP B 69 12.516 -4.250 6.540 1.00 0.44 N ATOM 2737 CA ASP B 69 11.410 -3.261 6.412 1.00 0.45 C ATOM 2738 C ASP B 69 11.086 -3.062 4.931 1.00 0.45 C ATOM 2739 O ASP B 69 9.946 -3.147 4.518 1.00 0.46 O ATOM 2740 CB ASP B 69 11.841 -1.927 7.025 1.00 0.46 C ATOM 2741 CG ASP B 69 12.144 -2.121 8.512 1.00 0.51 C ATOM 2742 OD1 ASP B 69 11.628 -3.068 9.083 1.00 1.12 O ATOM 2743 OD2 ASP B 69 12.885 -1.319 9.055 1.00 1.25 O ATOM 0 H ASP B 69 13.329 -3.927 7.064 1.00 0.44 H new ATOM 0 HA ASP B 69 10.527 -3.628 6.936 1.00 0.45 H new ATOM 0 HB2 ASP B 69 12.723 -1.547 6.510 1.00 0.46 H new ATOM 0 HB3 ASP B 69 11.053 -1.185 6.898 1.00 0.46 H new ATOM 2748 N ILE B 70 12.081 -2.801 4.128 1.00 0.45 N ATOM 2749 CA ILE B 70 11.825 -2.602 2.673 1.00 0.49 C ATOM 2750 C ILE B 70 11.108 -3.833 2.116 1.00 0.48 C ATOM 2751 O ILE B 70 10.217 -3.732 1.294 1.00 0.50 O ATOM 2752 CB ILE B 70 13.154 -2.401 1.939 1.00 0.56 C ATOM 2753 CG1 ILE B 70 13.556 -0.926 2.018 1.00 0.90 C ATOM 2754 CG2 ILE B 70 13.000 -2.805 0.472 1.00 0.85 C ATOM 2755 CD1 ILE B 70 15.013 -0.768 1.581 1.00 1.29 C ATOM 0 H ILE B 70 13.056 -2.717 4.415 1.00 0.45 H new ATOM 0 HA ILE B 70 11.201 -1.720 2.528 1.00 0.49 H new ATOM 0 HB ILE B 70 13.922 -3.019 2.405 1.00 0.56 H new ATOM 0 HG12 ILE B 70 12.907 -0.327 1.379 1.00 0.90 H new ATOM 0 HG13 ILE B 70 13.429 -0.558 3.036 1.00 0.90 H new ATOM 0 HG21 ILE B 70 13.948 -2.660 -0.047 1.00 0.85 H new ATOM 0 HG22 ILE B 70 12.710 -3.854 0.412 1.00 0.85 H new ATOM 0 HG23 ILE B 70 12.232 -2.189 0.004 1.00 0.85 H new ATOM 0 HD11 ILE B 70 15.298 0.283 1.638 1.00 1.29 H new ATOM 0 HD12 ILE B 70 15.656 -1.354 2.238 1.00 1.29 H new ATOM 0 HD13 ILE B 70 15.125 -1.120 0.555 1.00 1.29 H new ATOM 2767 N ARG B 71 11.482 -4.997 2.566 1.00 0.47 N ATOM 2768 CA ARG B 71 10.818 -6.236 2.075 1.00 0.50 C ATOM 2769 C ARG B 71 9.312 -6.163 2.348 1.00 0.50 C ATOM 2770 O ARG B 71 8.499 -6.327 1.460 1.00 0.54 O ATOM 2771 CB ARG B 71 11.408 -7.448 2.801 1.00 0.52 C ATOM 2772 CG ARG B 71 11.699 -8.558 1.790 1.00 0.82 C ATOM 2773 CD ARG B 71 12.089 -9.837 2.535 1.00 1.02 C ATOM 2774 NE ARG B 71 12.382 -10.916 1.550 1.00 1.57 N ATOM 2775 CZ ARG B 71 11.406 -11.478 0.891 1.00 2.17 C ATOM 2776 NH1 ARG B 71 10.176 -11.096 1.094 1.00 2.58 N ATOM 2777 NH2 ARG B 71 11.663 -12.424 0.029 1.00 2.98 N ATOM 0 H ARG B 71 12.220 -5.144 3.254 1.00 0.47 H new ATOM 0 HA ARG B 71 10.984 -6.332 1.002 1.00 0.50 H new ATOM 0 HB2 ARG B 71 12.324 -7.164 3.319 1.00 0.52 H new ATOM 0 HB3 ARG B 71 10.711 -7.806 3.559 1.00 0.52 H new ATOM 0 HG2 ARG B 71 10.821 -8.739 1.170 1.00 0.82 H new ATOM 0 HG3 ARG B 71 12.504 -8.254 1.122 1.00 0.82 H new ATOM 0 HD2 ARG B 71 12.963 -9.654 3.161 1.00 1.02 H new ATOM 0 HD3 ARG B 71 11.281 -10.145 3.198 1.00 1.02 H new ATOM 0 HE ARG B 71 13.344 -11.215 1.391 1.00 1.57 H new ATOM 0 HH11 ARG B 71 9.976 -10.357 1.768 1.00 2.58 H new ATOM 0 HH12 ARG B 71 9.414 -11.536 0.578 1.00 2.58 H new ATOM 0 HH21 ARG B 71 12.625 -12.723 -0.128 1.00 2.98 H new ATOM 0 HH22 ARG B 71 10.901 -12.864 -0.487 1.00 2.98 H new ATOM 2791 N LYS B 72 8.938 -5.936 3.579 1.00 0.48 N ATOM 2792 CA LYS B 72 7.487 -5.871 3.931 1.00 0.49 C ATOM 2793 C LYS B 72 6.755 -4.848 3.052 1.00 0.48 C ATOM 2794 O LYS B 72 5.885 -5.198 2.282 1.00 0.51 O ATOM 2795 CB LYS B 72 7.344 -5.465 5.399 1.00 0.49 C ATOM 2796 CG LYS B 72 8.146 -6.426 6.279 1.00 0.65 C ATOM 2797 CD LYS B 72 8.068 -5.967 7.736 1.00 0.91 C ATOM 2798 CE LYS B 72 8.876 -6.921 8.617 1.00 1.46 C ATOM 2799 NZ LYS B 72 10.105 -6.230 9.100 1.00 1.81 N ATOM 0 H LYS B 72 9.577 -5.792 4.361 1.00 0.48 H new ATOM 0 HA LYS B 72 7.044 -6.853 3.764 1.00 0.49 H new ATOM 0 HB2 LYS B 72 7.699 -4.444 5.541 1.00 0.49 H new ATOM 0 HB3 LYS B 72 6.294 -5.480 5.690 1.00 0.49 H new ATOM 0 HG2 LYS B 72 7.752 -7.438 6.184 1.00 0.65 H new ATOM 0 HG3 LYS B 72 9.185 -6.456 5.951 1.00 0.65 H new ATOM 0 HD2 LYS B 72 8.456 -4.953 7.830 1.00 0.91 H new ATOM 0 HD3 LYS B 72 7.029 -5.943 8.065 1.00 0.91 H new ATOM 0 HE2 LYS B 72 8.274 -7.249 9.464 1.00 1.46 H new ATOM 0 HE3 LYS B 72 9.146 -7.814 8.053 1.00 1.46 H new ATOM 0 HZ1 LYS B 72 10.655 -6.878 9.699 1.00 1.81 H new ATOM 0 HZ2 LYS B 72 10.682 -5.938 8.285 1.00 1.81 H new ATOM 0 HZ3 LYS B 72 9.837 -5.391 9.653 1.00 1.81 H new ATOM 2813 N PHE B 73 7.090 -3.591 3.175 1.00 0.47 N ATOM 2814 CA PHE B 73 6.406 -2.536 2.362 1.00 0.48 C ATOM 2815 C PHE B 73 6.170 -3.038 0.935 1.00 0.51 C ATOM 2816 O PHE B 73 5.066 -3.022 0.432 1.00 0.52 O ATOM 2817 CB PHE B 73 7.293 -1.293 2.322 1.00 0.48 C ATOM 2818 CG PHE B 73 7.473 -0.838 0.893 1.00 0.52 C ATOM 2819 CD1 PHE B 73 6.430 -0.184 0.230 1.00 1.37 C ATOM 2820 CD2 PHE B 73 8.686 -1.068 0.233 1.00 1.25 C ATOM 2821 CE1 PHE B 73 6.598 0.239 -1.095 1.00 1.40 C ATOM 2822 CE2 PHE B 73 8.854 -0.645 -1.091 1.00 1.29 C ATOM 2823 CZ PHE B 73 7.810 0.009 -1.755 1.00 0.67 C ATOM 0 H PHE B 73 7.812 -3.245 3.807 1.00 0.47 H new ATOM 0 HA PHE B 73 5.443 -2.298 2.814 1.00 0.48 H new ATOM 0 HB2 PHE B 73 6.844 -0.495 2.913 1.00 0.48 H new ATOM 0 HB3 PHE B 73 8.263 -1.513 2.768 1.00 0.48 H new ATOM 0 HD1 PHE B 73 5.495 -0.005 0.739 1.00 1.37 H new ATOM 0 HD2 PHE B 73 9.492 -1.572 0.745 1.00 1.25 H new ATOM 0 HE1 PHE B 73 5.792 0.743 -1.607 1.00 1.40 H new ATOM 0 HE2 PHE B 73 9.790 -0.823 -1.600 1.00 1.29 H new ATOM 0 HZ PHE B 73 7.940 0.336 -2.776 1.00 0.67 H new ATOM 2833 N ASN B 74 7.204 -3.478 0.286 1.00 0.52 N ATOM 2834 CA ASN B 74 7.050 -3.978 -1.108 1.00 0.55 C ATOM 2835 C ASN B 74 6.150 -5.217 -1.124 1.00 0.57 C ATOM 2836 O ASN B 74 5.380 -5.418 -2.042 1.00 0.60 O ATOM 2837 CB ASN B 74 8.422 -4.340 -1.680 1.00 0.57 C ATOM 2838 CG ASN B 74 8.243 -5.047 -3.024 1.00 0.79 C ATOM 2839 OD1 ASN B 74 8.226 -4.412 -4.061 1.00 1.73 O ATOM 2840 ND2 ASN B 74 8.107 -6.345 -3.054 1.00 0.99 N ATOM 0 H ASN B 74 8.153 -3.515 0.658 1.00 0.52 H new ATOM 0 HA ASN B 74 6.595 -3.196 -1.716 1.00 0.55 H new ATOM 0 HB2 ASN B 74 9.024 -3.440 -1.808 1.00 0.57 H new ATOM 0 HB3 ASN B 74 8.959 -4.986 -0.985 1.00 0.57 H new ATOM 0 HD21 ASN B 74 7.987 -6.825 -3.946 1.00 0.99 H new ATOM 0 HD22 ASN B 74 8.121 -6.879 -2.185 1.00 0.99 H new ATOM 2847 N GLU B 75 6.244 -6.059 -0.131 1.00 0.55 N ATOM 2848 CA GLU B 75 5.399 -7.281 -0.126 1.00 0.59 C ATOM 2849 C GLU B 75 3.974 -6.927 0.304 1.00 0.57 C ATOM 2850 O GLU B 75 3.038 -7.631 -0.017 1.00 0.68 O ATOM 2851 CB GLU B 75 6.027 -8.346 0.794 1.00 0.62 C ATOM 2852 CG GLU B 75 5.342 -8.384 2.165 1.00 1.10 C ATOM 2853 CD GLU B 75 4.015 -9.145 2.073 1.00 1.46 C ATOM 2854 OE1 GLU B 75 3.716 -9.655 1.006 1.00 1.88 O ATOM 2855 OE2 GLU B 75 3.321 -9.204 3.075 1.00 2.12 O ATOM 0 H GLU B 75 6.866 -5.953 0.671 1.00 0.55 H new ATOM 0 HA GLU B 75 5.347 -7.698 -1.132 1.00 0.59 H new ATOM 0 HB2 GLU B 75 5.951 -9.325 0.322 1.00 0.62 H new ATOM 0 HB3 GLU B 75 7.089 -8.136 0.923 1.00 0.62 H new ATOM 0 HG2 GLU B 75 5.996 -8.865 2.893 1.00 1.10 H new ATOM 0 HG3 GLU B 75 5.163 -7.369 2.519 1.00 1.10 H new ATOM 2862 N MET B 76 3.781 -5.830 0.997 1.00 0.53 N ATOM 2863 CA MET B 76 2.406 -5.436 1.400 1.00 0.51 C ATOM 2864 C MET B 76 1.903 -4.437 0.367 1.00 0.52 C ATOM 2865 O MET B 76 0.758 -4.455 -0.039 1.00 0.53 O ATOM 2866 CB MET B 76 2.449 -4.764 2.776 1.00 0.48 C ATOM 2867 CG MET B 76 2.685 -5.822 3.855 1.00 0.48 C ATOM 2868 SD MET B 76 1.152 -6.093 4.778 1.00 0.51 S ATOM 2869 CE MET B 76 1.839 -7.198 6.037 1.00 0.60 C ATOM 0 H MET B 76 4.520 -5.195 1.298 1.00 0.53 H new ATOM 0 HA MET B 76 1.752 -6.307 1.454 1.00 0.51 H new ATOM 0 HB2 MET B 76 3.244 -4.018 2.803 1.00 0.48 H new ATOM 0 HB3 MET B 76 1.513 -4.239 2.965 1.00 0.48 H new ATOM 0 HG2 MET B 76 3.017 -6.755 3.399 1.00 0.48 H new ATOM 0 HG3 MET B 76 3.477 -5.498 4.531 1.00 0.48 H new ATOM 0 HE1 MET B 76 1.051 -7.496 6.728 1.00 0.60 H new ATOM 0 HE2 MET B 76 2.254 -8.084 5.556 1.00 0.60 H new ATOM 0 HE3 MET B 76 2.626 -6.680 6.585 1.00 0.60 H new ATOM 2879 N ARG B 77 2.776 -3.565 -0.067 1.00 0.52 N ATOM 2880 CA ARG B 77 2.392 -2.553 -1.084 1.00 0.54 C ATOM 2881 C ARG B 77 1.891 -3.260 -2.343 1.00 0.57 C ATOM 2882 O ARG B 77 0.878 -2.902 -2.910 1.00 0.57 O ATOM 2883 CB ARG B 77 3.605 -1.692 -1.437 1.00 0.54 C ATOM 2884 CG ARG B 77 3.226 -0.708 -2.545 1.00 0.57 C ATOM 2885 CD ARG B 77 3.829 -1.174 -3.873 1.00 0.62 C ATOM 2886 NE ARG B 77 5.316 -1.120 -3.793 1.00 0.86 N ATOM 2887 CZ ARG B 77 6.038 -1.668 -4.731 1.00 1.32 C ATOM 2888 NH1 ARG B 77 5.457 -2.264 -5.736 1.00 1.81 N ATOM 2889 NH2 ARG B 77 7.340 -1.620 -4.664 1.00 1.80 N ATOM 0 H ARG B 77 3.746 -3.514 0.245 1.00 0.52 H new ATOM 0 HA ARG B 77 1.602 -1.919 -0.681 1.00 0.54 H new ATOM 0 HB2 ARG B 77 3.948 -1.150 -0.556 1.00 0.54 H new ATOM 0 HB3 ARG B 77 4.431 -2.324 -1.764 1.00 0.54 H new ATOM 0 HG2 ARG B 77 2.141 -0.640 -2.630 1.00 0.57 H new ATOM 0 HG3 ARG B 77 3.589 0.290 -2.299 1.00 0.57 H new ATOM 0 HD2 ARG B 77 3.503 -2.190 -4.095 1.00 0.62 H new ATOM 0 HD3 ARG B 77 3.475 -0.541 -4.687 1.00 0.62 H new ATOM 0 HE ARG B 77 5.769 -0.655 -3.006 1.00 0.86 H new ATOM 0 HH11 ARG B 77 4.439 -2.301 -5.788 1.00 1.81 H new ATOM 0 HH12 ARG B 77 6.021 -2.693 -6.470 1.00 1.81 H new ATOM 0 HH21 ARG B 77 7.793 -1.154 -3.878 1.00 1.80 H new ATOM 0 HH22 ARG B 77 7.905 -2.049 -5.397 1.00 1.80 H new ATOM 2903 N LYS B 78 2.586 -4.280 -2.769 1.00 0.58 N ATOM 2904 CA LYS B 78 2.145 -5.029 -3.967 1.00 0.61 C ATOM 2905 C LYS B 78 0.832 -5.711 -3.628 1.00 0.60 C ATOM 2906 O LYS B 78 -0.066 -5.802 -4.438 1.00 0.62 O ATOM 2907 CB LYS B 78 3.195 -6.079 -4.335 1.00 0.63 C ATOM 2908 CG LYS B 78 2.857 -6.674 -5.701 1.00 1.17 C ATOM 2909 CD LYS B 78 3.513 -8.047 -5.843 1.00 1.22 C ATOM 2910 CE LYS B 78 3.926 -8.267 -7.299 1.00 1.57 C ATOM 2911 NZ LYS B 78 2.720 -8.196 -8.171 1.00 2.26 N ATOM 0 H LYS B 78 3.442 -4.623 -2.333 1.00 0.58 H new ATOM 0 HA LYS B 78 2.017 -4.355 -4.814 1.00 0.61 H new ATOM 0 HB2 LYS B 78 4.186 -5.626 -4.358 1.00 0.63 H new ATOM 0 HB3 LYS B 78 3.221 -6.864 -3.580 1.00 0.63 H new ATOM 0 HG2 LYS B 78 1.776 -6.764 -5.812 1.00 1.17 H new ATOM 0 HG3 LYS B 78 3.205 -6.011 -6.493 1.00 1.17 H new ATOM 0 HD2 LYS B 78 4.385 -8.114 -5.192 1.00 1.22 H new ATOM 0 HD3 LYS B 78 2.820 -8.827 -5.529 1.00 1.22 H new ATOM 0 HE2 LYS B 78 4.652 -7.512 -7.601 1.00 1.57 H new ATOM 0 HE3 LYS B 78 4.411 -9.237 -7.408 1.00 1.57 H new ATOM 0 HZ1 LYS B 78 2.945 -8.590 -9.107 1.00 2.26 H new ATOM 0 HZ2 LYS B 78 1.948 -8.744 -7.741 1.00 2.26 H new ATOM 0 HZ3 LYS B 78 2.424 -7.204 -8.274 1.00 2.26 H new ATOM 2925 N ASN B 79 0.701 -6.157 -2.412 1.00 0.58 N ATOM 2926 CA ASN B 79 -0.570 -6.802 -2.000 1.00 0.58 C ATOM 2927 C ASN B 79 -1.674 -5.759 -2.098 1.00 0.57 C ATOM 2928 O ASN B 79 -2.690 -5.967 -2.729 1.00 0.57 O ATOM 2929 CB ASN B 79 -0.457 -7.302 -0.559 1.00 0.57 C ATOM 2930 CG ASN B 79 -1.047 -8.709 -0.458 1.00 0.62 C ATOM 2931 OD1 ASN B 79 -0.450 -9.590 0.129 1.00 1.18 O ATOM 2932 ND2 ASN B 79 -2.204 -8.959 -1.008 1.00 1.16 N ATOM 0 H ASN B 79 1.418 -6.102 -1.689 1.00 0.58 H new ATOM 0 HA ASN B 79 -0.790 -7.653 -2.644 1.00 0.58 H new ATOM 0 HB2 ASN B 79 0.587 -7.311 -0.247 1.00 0.57 H new ATOM 0 HB3 ASN B 79 -0.985 -6.626 0.114 1.00 0.57 H new ATOM 0 HD21 ASN B 79 -2.607 -9.894 -0.945 1.00 1.16 H new ATOM 0 HD22 ASN B 79 -2.705 -8.220 -1.501 1.00 1.16 H new ATOM 2939 N MET B 80 -1.472 -4.623 -1.490 1.00 0.57 N ATOM 2940 CA MET B 80 -2.501 -3.557 -1.562 1.00 0.57 C ATOM 2941 C MET B 80 -2.858 -3.328 -3.031 1.00 0.58 C ATOM 2942 O MET B 80 -4.009 -3.394 -3.409 1.00 0.57 O ATOM 2943 CB MET B 80 -1.953 -2.268 -0.937 1.00 0.60 C ATOM 2944 CG MET B 80 -2.725 -1.055 -1.468 1.00 0.69 C ATOM 2945 SD MET B 80 -1.956 -0.468 -2.999 1.00 1.27 S ATOM 2946 CE MET B 80 -3.210 0.763 -3.433 1.00 1.05 C ATOM 0 H MET B 80 -0.640 -4.390 -0.948 1.00 0.57 H new ATOM 0 HA MET B 80 -3.394 -3.853 -1.011 1.00 0.57 H new ATOM 0 HB2 MET B 80 -2.038 -2.316 0.149 1.00 0.60 H new ATOM 0 HB3 MET B 80 -0.893 -2.164 -1.169 1.00 0.60 H new ATOM 0 HG2 MET B 80 -3.765 -1.325 -1.652 1.00 0.69 H new ATOM 0 HG3 MET B 80 -2.729 -0.259 -0.723 1.00 0.69 H new ATOM 0 HE1 MET B 80 -3.138 0.997 -4.495 1.00 1.05 H new ATOM 0 HE2 MET B 80 -4.201 0.365 -3.216 1.00 1.05 H new ATOM 0 HE3 MET B 80 -3.047 1.669 -2.850 1.00 1.05 H new ATOM 2956 N ASP B 81 -1.889 -3.072 -3.872 1.00 0.60 N ATOM 2957 CA ASP B 81 -2.192 -2.855 -5.315 1.00 0.62 C ATOM 2958 C ASP B 81 -2.898 -4.084 -5.887 1.00 0.63 C ATOM 2959 O ASP B 81 -3.863 -3.972 -6.617 1.00 0.64 O ATOM 2960 CB ASP B 81 -0.882 -2.617 -6.067 1.00 0.65 C ATOM 2961 CG ASP B 81 -1.084 -1.519 -7.113 1.00 0.67 C ATOM 2962 OD1 ASP B 81 -1.822 -1.754 -8.056 1.00 1.19 O ATOM 2963 OD2 ASP B 81 -0.498 -0.461 -6.952 1.00 1.23 O ATOM 0 H ASP B 81 -0.903 -3.004 -3.621 1.00 0.60 H new ATOM 0 HA ASP B 81 -2.844 -1.989 -5.426 1.00 0.62 H new ATOM 0 HB2 ASP B 81 -0.097 -2.328 -5.368 1.00 0.65 H new ATOM 0 HB3 ASP B 81 -0.555 -3.538 -6.550 1.00 0.65 H new ATOM 2968 N GLN B 82 -2.445 -5.260 -5.543 1.00 0.64 N ATOM 2969 CA GLN B 82 -3.117 -6.490 -6.045 1.00 0.66 C ATOM 2970 C GLN B 82 -4.560 -6.455 -5.553 1.00 0.63 C ATOM 2971 O GLN B 82 -5.504 -6.656 -6.291 1.00 0.65 O ATOM 2972 CB GLN B 82 -2.413 -7.720 -5.464 1.00 0.68 C ATOM 2973 CG GLN B 82 -0.979 -7.798 -5.983 1.00 1.09 C ATOM 2974 CD GLN B 82 -0.881 -8.902 -7.036 1.00 0.83 C ATOM 2975 OE1 GLN B 82 -0.270 -9.926 -6.805 1.00 1.28 O ATOM 2976 NE2 GLN B 82 -1.464 -8.735 -8.192 1.00 1.41 N ATOM 0 H GLN B 82 -1.640 -5.420 -4.937 1.00 0.64 H new ATOM 0 HA GLN B 82 -3.080 -6.538 -7.133 1.00 0.66 H new ATOM 0 HB2 GLN B 82 -2.412 -7.667 -4.375 1.00 0.68 H new ATOM 0 HB3 GLN B 82 -2.957 -8.624 -5.739 1.00 0.68 H new ATOM 0 HG2 GLN B 82 -0.684 -6.841 -6.414 1.00 1.09 H new ATOM 0 HG3 GLN B 82 -0.293 -8.002 -5.161 1.00 1.09 H new ATOM 0 HE21 GLN B 82 -1.977 -7.875 -8.385 1.00 1.41 H new ATOM 0 HE22 GLN B 82 -1.407 -9.465 -8.902 1.00 1.41 H new ATOM 2985 N LEU B 83 -4.707 -6.175 -4.295 1.00 0.59 N ATOM 2986 CA LEU B 83 -6.060 -6.089 -3.693 1.00 0.56 C ATOM 2987 C LEU B 83 -6.796 -4.913 -4.339 1.00 0.55 C ATOM 2988 O LEU B 83 -7.941 -5.020 -4.728 1.00 0.56 O ATOM 2989 CB LEU B 83 -5.930 -5.868 -2.187 1.00 0.53 C ATOM 2990 CG LEU B 83 -5.257 -7.094 -1.552 1.00 0.53 C ATOM 2991 CD1 LEU B 83 -4.709 -6.720 -0.175 1.00 0.55 C ATOM 2992 CD2 LEU B 83 -6.260 -8.248 -1.408 1.00 0.56 C ATOM 0 H LEU B 83 -3.938 -6.000 -3.649 1.00 0.59 H new ATOM 0 HA LEU B 83 -6.616 -7.011 -3.863 1.00 0.56 H new ATOM 0 HB2 LEU B 83 -5.342 -4.972 -1.988 1.00 0.53 H new ATOM 0 HB3 LEU B 83 -6.913 -5.708 -1.745 1.00 0.53 H new ATOM 0 HG LEU B 83 -4.442 -7.418 -2.199 1.00 0.53 H new ATOM 0 HD11 LEU B 83 -4.232 -7.590 0.275 1.00 0.55 H new ATOM 0 HD12 LEU B 83 -3.978 -5.919 -0.280 1.00 0.55 H new ATOM 0 HD13 LEU B 83 -5.526 -6.384 0.463 1.00 0.55 H new ATOM 0 HD21 LEU B 83 -5.764 -9.107 -0.956 1.00 0.56 H new ATOM 0 HD22 LEU B 83 -7.089 -7.933 -0.774 1.00 0.56 H new ATOM 0 HD23 LEU B 83 -6.640 -8.524 -2.391 1.00 0.56 H new ATOM 3004 N LYS B 84 -6.134 -3.795 -4.466 1.00 0.55 N ATOM 3005 CA LYS B 84 -6.775 -2.609 -5.098 1.00 0.55 C ATOM 3006 C LYS B 84 -7.385 -3.010 -6.445 1.00 0.58 C ATOM 3007 O LYS B 84 -8.506 -2.663 -6.759 1.00 0.58 O ATOM 3008 CB LYS B 84 -5.720 -1.522 -5.323 1.00 0.56 C ATOM 3009 CG LYS B 84 -6.412 -0.200 -5.663 1.00 0.57 C ATOM 3010 CD LYS B 84 -5.702 0.456 -6.851 1.00 0.80 C ATOM 3011 CE LYS B 84 -6.274 1.857 -7.080 1.00 0.80 C ATOM 3012 NZ LYS B 84 -7.688 1.748 -7.537 1.00 1.40 N ATOM 0 H LYS B 84 -5.172 -3.653 -4.157 1.00 0.55 H new ATOM 0 HA LYS B 84 -7.560 -2.230 -4.443 1.00 0.55 H new ATOM 0 HB2 LYS B 84 -5.108 -1.404 -4.429 1.00 0.56 H new ATOM 0 HB3 LYS B 84 -5.050 -1.813 -6.132 1.00 0.56 H new ATOM 0 HG2 LYS B 84 -7.460 -0.377 -5.904 1.00 0.57 H new ATOM 0 HG3 LYS B 84 -6.392 0.466 -4.800 1.00 0.57 H new ATOM 0 HD2 LYS B 84 -4.631 0.516 -6.659 1.00 0.80 H new ATOM 0 HD3 LYS B 84 -5.832 -0.152 -7.746 1.00 0.80 H new ATOM 0 HE2 LYS B 84 -6.222 2.438 -6.159 1.00 0.80 H new ATOM 0 HE3 LYS B 84 -5.680 2.387 -7.825 1.00 0.80 H new ATOM 0 HZ1 LYS B 84 -7.840 2.381 -8.348 1.00 1.40 H new ATOM 0 HZ2 LYS B 84 -7.886 0.767 -7.821 1.00 1.40 H new ATOM 0 HZ3 LYS B 84 -8.325 2.019 -6.761 1.00 1.40 H new ATOM 3026 N GLU B 85 -6.647 -3.733 -7.244 1.00 0.60 N ATOM 3027 CA GLU B 85 -7.171 -4.152 -8.576 1.00 0.63 C ATOM 3028 C GLU B 85 -8.340 -5.122 -8.400 1.00 0.63 C ATOM 3029 O GLU B 85 -9.290 -5.107 -9.157 1.00 0.64 O ATOM 3030 CB GLU B 85 -6.060 -4.852 -9.363 1.00 0.66 C ATOM 3031 CG GLU B 85 -6.683 -5.790 -10.401 1.00 0.69 C ATOM 3032 CD GLU B 85 -5.654 -6.105 -11.488 1.00 0.73 C ATOM 3033 OE1 GLU B 85 -4.721 -6.836 -11.199 1.00 1.21 O ATOM 3034 OE2 GLU B 85 -5.818 -5.613 -12.592 1.00 1.28 O ATOM 0 H GLU B 85 -5.702 -4.052 -7.031 1.00 0.60 H new ATOM 0 HA GLU B 85 -7.512 -3.268 -9.115 1.00 0.63 H new ATOM 0 HB2 GLU B 85 -5.429 -4.113 -9.857 1.00 0.66 H new ATOM 0 HB3 GLU B 85 -5.420 -5.416 -8.685 1.00 0.66 H new ATOM 0 HG2 GLU B 85 -7.015 -6.711 -9.922 1.00 0.69 H new ATOM 0 HG3 GLU B 85 -7.564 -5.326 -10.843 1.00 0.69 H new ATOM 3041 N LYS B 86 -8.286 -5.957 -7.404 1.00 0.63 N ATOM 3042 CA LYS B 86 -9.403 -6.915 -7.178 1.00 0.63 C ATOM 3043 C LYS B 86 -10.656 -6.127 -6.812 1.00 0.61 C ATOM 3044 O LYS B 86 -11.758 -6.461 -7.204 1.00 0.62 O ATOM 3045 CB LYS B 86 -9.042 -7.869 -6.037 1.00 0.64 C ATOM 3046 CG LYS B 86 -9.121 -9.315 -6.534 1.00 0.70 C ATOM 3047 CD LYS B 86 -8.920 -10.272 -5.358 1.00 0.89 C ATOM 3048 CE LYS B 86 -8.960 -11.716 -5.861 1.00 1.09 C ATOM 3049 NZ LYS B 86 -8.451 -12.628 -4.798 1.00 0.99 N ATOM 0 H LYS B 86 -7.518 -6.019 -6.736 1.00 0.63 H new ATOM 0 HA LYS B 86 -9.581 -7.497 -8.082 1.00 0.63 H new ATOM 0 HB2 LYS B 86 -8.038 -7.653 -5.673 1.00 0.64 H new ATOM 0 HB3 LYS B 86 -9.723 -7.724 -5.199 1.00 0.64 H new ATOM 0 HG2 LYS B 86 -10.088 -9.497 -7.003 1.00 0.70 H new ATOM 0 HG3 LYS B 86 -8.360 -9.491 -7.294 1.00 0.70 H new ATOM 0 HD2 LYS B 86 -7.965 -10.072 -4.872 1.00 0.89 H new ATOM 0 HD3 LYS B 86 -9.698 -10.115 -4.611 1.00 0.89 H new ATOM 0 HE2 LYS B 86 -9.980 -11.990 -6.132 1.00 1.09 H new ATOM 0 HE3 LYS B 86 -8.353 -11.815 -6.761 1.00 1.09 H new ATOM 0 HZ1 LYS B 86 -8.478 -13.610 -5.140 1.00 0.99 H new ATOM 0 HZ2 LYS B 86 -7.472 -12.371 -4.560 1.00 0.99 H new ATOM 0 HZ3 LYS B 86 -9.047 -12.540 -3.950 1.00 0.99 H new ATOM 3063 N ILE B 87 -10.489 -5.077 -6.057 1.00 0.59 N ATOM 3064 CA ILE B 87 -11.657 -4.252 -5.653 1.00 0.57 C ATOM 3065 C ILE B 87 -12.273 -3.596 -6.884 1.00 0.57 C ATOM 3066 O ILE B 87 -13.460 -3.689 -7.118 1.00 0.55 O ATOM 3067 CB ILE B 87 -11.197 -3.166 -4.681 1.00 0.59 C ATOM 3068 CG1 ILE B 87 -10.949 -3.787 -3.306 1.00 0.65 C ATOM 3069 CG2 ILE B 87 -12.279 -2.091 -4.566 1.00 0.68 C ATOM 3070 CD1 ILE B 87 -9.778 -3.076 -2.628 1.00 0.70 C ATOM 0 H ILE B 87 -9.589 -4.755 -5.702 1.00 0.59 H new ATOM 0 HA ILE B 87 -12.399 -4.888 -5.171 1.00 0.57 H new ATOM 0 HB ILE B 87 -10.276 -2.715 -5.050 1.00 0.59 H new ATOM 0 HG12 ILE B 87 -11.845 -3.703 -2.691 1.00 0.65 H new ATOM 0 HG13 ILE B 87 -10.732 -4.850 -3.409 1.00 0.65 H new ATOM 0 HG21 ILE B 87 -11.950 -1.317 -3.873 1.00 0.68 H new ATOM 0 HG22 ILE B 87 -12.458 -1.648 -5.546 1.00 0.68 H new ATOM 0 HG23 ILE B 87 -13.201 -2.541 -4.197 1.00 0.68 H new ATOM 0 HD11 ILE B 87 -9.602 -3.519 -1.648 1.00 0.70 H new ATOM 0 HD12 ILE B 87 -8.883 -3.183 -3.241 1.00 0.70 H new ATOM 0 HD13 ILE B 87 -10.013 -2.018 -2.511 1.00 0.70 H new ATOM 3082 N ASN B 88 -11.477 -2.942 -7.685 1.00 0.60 N ATOM 3083 CA ASN B 88 -12.024 -2.296 -8.905 1.00 0.63 C ATOM 3084 C ASN B 88 -12.627 -3.354 -9.826 1.00 0.63 C ATOM 3085 O ASN B 88 -13.538 -3.085 -10.576 1.00 0.64 O ATOM 3086 CB ASN B 88 -10.905 -1.564 -9.644 1.00 0.70 C ATOM 3087 CG ASN B 88 -10.254 -0.546 -8.707 1.00 1.78 C ATOM 3088 OD1 ASN B 88 -8.964 -0.589 -8.511 1.00 2.47 O flip ATOM 3089 ND2 ASN B 88 -10.925 0.298 -8.147 1.00 2.62 N flip ATOM 0 H ASN B 88 -10.473 -2.829 -7.545 1.00 0.60 H new ATOM 0 HA ASN B 88 -12.797 -1.585 -8.614 1.00 0.63 H new ATOM 0 HB2 ASN B 88 -10.160 -2.278 -9.996 1.00 0.70 H new ATOM 0 HB3 ASN B 88 -11.305 -1.060 -10.524 1.00 0.70 H new ATOM 0 HD21 ASN B 88 -11.933 0.332 -8.300 1.00 2.62 H new ATOM 0 HD22 ASN B 88 -10.480 0.972 -7.524 1.00 2.62 H new ATOM 3096 N SER B 89 -12.111 -4.552 -9.796 1.00 0.64 N ATOM 3097 CA SER B 89 -12.647 -5.611 -10.693 1.00 0.68 C ATOM 3098 C SER B 89 -14.090 -5.972 -10.324 1.00 0.67 C ATOM 3099 O SER B 89 -14.983 -5.897 -11.144 1.00 0.74 O ATOM 3100 CB SER B 89 -11.772 -6.860 -10.572 1.00 0.70 C ATOM 3101 OG SER B 89 -12.299 -7.884 -11.406 1.00 1.23 O ATOM 0 H SER B 89 -11.343 -4.842 -9.190 1.00 0.64 H new ATOM 0 HA SER B 89 -12.637 -5.234 -11.716 1.00 0.68 H new ATOM 0 HB2 SER B 89 -10.747 -6.630 -10.862 1.00 0.70 H new ATOM 0 HB3 SER B 89 -11.742 -7.198 -9.536 1.00 0.70 H new ATOM 0 HG SER B 89 -11.740 -8.686 -11.333 1.00 1.23 H new ATOM 3107 N VAL B 90 -14.329 -6.379 -9.107 1.00 0.63 N ATOM 3108 CA VAL B 90 -15.712 -6.763 -8.692 1.00 0.64 C ATOM 3109 C VAL B 90 -16.538 -5.521 -8.351 1.00 0.57 C ATOM 3110 O VAL B 90 -17.681 -5.400 -8.744 1.00 0.59 O ATOM 3111 CB VAL B 90 -15.620 -7.683 -7.479 1.00 0.66 C ATOM 3112 CG1 VAL B 90 -16.994 -7.815 -6.813 1.00 0.66 C ATOM 3113 CG2 VAL B 90 -15.140 -9.065 -7.929 1.00 0.89 C ATOM 0 H VAL B 90 -13.622 -6.463 -8.377 1.00 0.63 H new ATOM 0 HA VAL B 90 -16.207 -7.280 -9.514 1.00 0.64 H new ATOM 0 HB VAL B 90 -14.916 -7.261 -6.762 1.00 0.66 H new ATOM 0 HG11 VAL B 90 -16.917 -8.474 -5.948 1.00 0.66 H new ATOM 0 HG12 VAL B 90 -17.338 -6.832 -6.491 1.00 0.66 H new ATOM 0 HG13 VAL B 90 -17.705 -8.233 -7.526 1.00 0.66 H new ATOM 0 HG21 VAL B 90 -15.073 -9.726 -7.065 1.00 0.89 H new ATOM 0 HG22 VAL B 90 -15.846 -9.479 -8.648 1.00 0.89 H new ATOM 0 HG23 VAL B 90 -14.158 -8.975 -8.395 1.00 0.89 H new ATOM 3123 N LEU B 91 -15.966 -4.590 -7.633 1.00 0.51 N ATOM 3124 CA LEU B 91 -16.724 -3.358 -7.286 1.00 0.49 C ATOM 3125 C LEU B 91 -16.907 -2.557 -8.568 1.00 0.57 C ATOM 3126 O LEU B 91 -17.634 -1.588 -8.610 1.00 0.61 O ATOM 3127 CB LEU B 91 -15.926 -2.528 -6.269 1.00 0.47 C ATOM 3128 CG LEU B 91 -16.824 -1.462 -5.631 1.00 0.59 C ATOM 3129 CD1 LEU B 91 -17.473 -2.022 -4.366 1.00 0.91 C ATOM 3130 CD2 LEU B 91 -15.979 -0.242 -5.261 1.00 0.84 C ATOM 0 H LEU B 91 -15.012 -4.631 -7.275 1.00 0.51 H new ATOM 0 HA LEU B 91 -17.689 -3.611 -6.847 1.00 0.49 H new ATOM 0 HB2 LEU B 91 -15.519 -3.180 -5.496 1.00 0.47 H new ATOM 0 HB3 LEU B 91 -15.079 -2.052 -6.763 1.00 0.47 H new ATOM 0 HG LEU B 91 -17.599 -1.175 -6.341 1.00 0.59 H new ATOM 0 HD11 LEU B 91 -18.110 -1.261 -3.916 1.00 0.91 H new ATOM 0 HD12 LEU B 91 -18.075 -2.894 -4.621 1.00 0.91 H new ATOM 0 HD13 LEU B 91 -16.698 -2.311 -3.657 1.00 0.91 H new ATOM 0 HD21 LEU B 91 -16.616 0.517 -4.807 1.00 0.84 H new ATOM 0 HD22 LEU B 91 -15.205 -0.537 -4.553 1.00 0.84 H new ATOM 0 HD23 LEU B 91 -15.514 0.164 -6.159 1.00 0.84 H new ATOM 3142 N SER B 92 -16.264 -2.991 -9.623 1.00 0.63 N ATOM 3143 CA SER B 92 -16.388 -2.286 -10.938 1.00 0.76 C ATOM 3144 C SER B 92 -16.408 -0.768 -10.725 1.00 0.83 C ATOM 3145 O SER B 92 -16.858 -0.028 -11.571 1.00 1.11 O ATOM 3146 CB SER B 92 -17.690 -2.724 -11.614 1.00 0.72 C ATOM 3147 OG SER B 92 -17.382 -3.481 -12.777 1.00 0.89 O ATOM 0 H SER B 92 -15.654 -3.809 -9.631 1.00 0.63 H new ATOM 0 HA SER B 92 -15.535 -2.541 -11.567 1.00 0.76 H new ATOM 0 HB2 SER B 92 -18.288 -3.321 -10.925 1.00 0.72 H new ATOM 0 HB3 SER B 92 -18.286 -1.852 -11.881 1.00 0.72 H new ATOM 0 HG SER B 92 -18.213 -3.765 -13.212 1.00 0.89 H new ATOM 3153 N ILE B 93 -15.903 -0.310 -9.606 1.00 0.74 N ATOM 3154 CA ILE B 93 -15.875 1.166 -9.315 1.00 0.82 C ATOM 3155 C ILE B 93 -17.206 1.831 -9.711 1.00 1.03 C ATOM 3156 O ILE B 93 -18.064 2.062 -8.881 1.00 1.11 O ATOM 3157 CB ILE B 93 -14.723 1.831 -10.071 1.00 0.92 C ATOM 3158 CG1 ILE B 93 -13.446 1.012 -9.878 1.00 0.87 C ATOM 3159 CG2 ILE B 93 -14.499 3.243 -9.518 1.00 1.13 C ATOM 3160 CD1 ILE B 93 -12.228 1.899 -10.141 1.00 1.43 C ATOM 0 H ILE B 93 -15.505 -0.897 -8.873 1.00 0.74 H new ATOM 0 HA ILE B 93 -15.727 1.296 -8.243 1.00 0.82 H new ATOM 0 HB ILE B 93 -14.970 1.884 -11.131 1.00 0.92 H new ATOM 0 HG12 ILE B 93 -13.407 0.613 -8.864 1.00 0.87 H new ATOM 0 HG13 ILE B 93 -13.442 0.159 -10.557 1.00 0.87 H new ATOM 0 HG21 ILE B 93 -13.678 3.718 -10.056 1.00 1.13 H new ATOM 0 HG22 ILE B 93 -15.407 3.832 -9.647 1.00 1.13 H new ATOM 0 HG23 ILE B 93 -14.252 3.184 -8.458 1.00 1.13 H new ATOM 0 HD11 ILE B 93 -11.317 1.316 -10.004 1.00 1.43 H new ATOM 0 HD12 ILE B 93 -12.267 2.277 -11.163 1.00 1.43 H new ATOM 0 HD13 ILE B 93 -12.231 2.737 -9.444 1.00 1.43 H new ATOM 3172 N ARG B 94 -17.385 2.136 -10.970 1.00 1.25 N ATOM 3173 CA ARG B 94 -18.653 2.775 -11.429 1.00 1.52 C ATOM 3174 C ARG B 94 -18.945 2.313 -12.860 1.00 1.60 C ATOM 3175 O ARG B 94 -19.642 2.965 -13.613 1.00 1.76 O ATOM 3176 CB ARG B 94 -18.512 4.308 -11.382 1.00 1.97 C ATOM 3177 CG ARG B 94 -17.631 4.825 -12.534 1.00 2.23 C ATOM 3178 CD ARG B 94 -16.311 4.058 -12.566 1.00 2.52 C ATOM 3179 NE ARG B 94 -15.322 4.804 -13.395 1.00 3.12 N ATOM 3180 CZ ARG B 94 -15.307 4.652 -14.692 1.00 3.73 C ATOM 3181 NH1 ARG B 94 -16.166 3.857 -15.269 1.00 3.88 N ATOM 3182 NH2 ARG B 94 -14.431 5.297 -15.414 1.00 4.55 N ATOM 0 H ARG B 94 -16.700 1.968 -11.706 1.00 1.25 H new ATOM 0 HA ARG B 94 -19.476 2.484 -10.776 1.00 1.52 H new ATOM 0 HB2 ARG B 94 -19.498 4.768 -11.441 1.00 1.97 H new ATOM 0 HB3 ARG B 94 -18.078 4.606 -10.428 1.00 1.97 H new ATOM 0 HG2 ARG B 94 -18.153 4.707 -13.483 1.00 2.23 H new ATOM 0 HG3 ARG B 94 -17.439 5.890 -12.406 1.00 2.23 H new ATOM 0 HD2 ARG B 94 -15.929 3.929 -11.553 1.00 2.52 H new ATOM 0 HD3 ARG B 94 -16.468 3.061 -12.977 1.00 2.52 H new ATOM 0 HE ARG B 94 -14.656 5.434 -12.949 1.00 3.12 H new ATOM 0 HH11 ARG B 94 -16.851 3.352 -14.707 1.00 3.88 H new ATOM 0 HH12 ARG B 94 -16.152 3.740 -16.282 1.00 3.88 H new ATOM 0 HH21 ARG B 94 -13.759 5.919 -14.965 1.00 4.55 H new ATOM 0 HH22 ARG B 94 -14.419 5.179 -16.427 1.00 4.55 H new ATOM 3196 N GLN B 95 -18.425 1.173 -13.230 1.00 1.55 N ATOM 3197 CA GLN B 95 -18.668 0.646 -14.602 1.00 1.73 C ATOM 3198 C GLN B 95 -20.074 0.048 -14.679 1.00 2.40 C ATOM 3199 O GLN B 95 -20.739 0.273 -15.677 1.00 2.92 O ATOM 3200 CB GLN B 95 -17.632 -0.435 -14.919 1.00 1.94 C ATOM 3201 CG GLN B 95 -18.151 -1.329 -16.047 1.00 2.44 C ATOM 3202 CD GLN B 95 -16.974 -2.044 -16.713 1.00 2.98 C ATOM 3203 OE1 GLN B 95 -16.106 -1.410 -17.280 1.00 3.53 O ATOM 3204 NE2 GLN B 95 -16.907 -3.346 -16.670 1.00 3.31 N ATOM 3205 OXT GLN B 95 -20.462 -0.626 -13.739 1.00 3.00 O ATOM 0 H GLN B 95 -17.840 0.583 -12.638 1.00 1.55 H new ATOM 0 HA GLN B 95 -18.582 1.457 -15.326 1.00 1.73 H new ATOM 0 HB2 GLN B 95 -16.689 0.026 -15.212 1.00 1.94 H new ATOM 0 HB3 GLN B 95 -17.432 -1.033 -14.030 1.00 1.94 H new ATOM 0 HG2 GLN B 95 -18.857 -2.059 -15.651 1.00 2.44 H new ATOM 0 HG3 GLN B 95 -18.690 -0.730 -16.782 1.00 2.44 H new ATOM 0 HE21 GLN B 95 -17.635 -3.879 -16.194 1.00 3.31 H new ATOM 0 HE22 GLN B 95 -16.126 -3.831 -17.112 1.00 3.31 H new TER 3214 GLN B 95