USER MOD reduce.3.24.130724 H: found=0, std=0, add=1296, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1286 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 33 LYS NZ :NH3+ 146:sc= 1.45 (180deg=1.1) USER MOD Set 1.2: B 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 5 LYS NZ :NH3+ -152:sc= -0.131 (180deg=-0.861) USER MOD Set 2.2: B 5 LYS NZ :NH3+ -130:sc= -0.134 (180deg=-0.828) USER MOD Set 3.1: A 33 LYS NZ :NH3+ 154:sc= 1.39 (180deg=0.978) USER MOD Set 3.2: A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER N :NH3+ -124:sc= 0.149 (180deg=-0.00824) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 7 MET CE :methyl 170:sc= -0.028 (180deg=-0.0893) USER MOD Single : A 15 HIS : no HD1:sc= -0.326 K(o=-0.33,f=-1.1) USER MOD Single : A 16 GLN : amide:sc=-0.00236 K(o=-0.0024,f=-1.6!) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot -75:sc= 0.705 USER MOD Single : A 24 LYS NZ :NH3+ -145:sc= -1.62 (180deg=-2.33!) USER MOD Single : A 25 HIS : no HD1:sc= -2.35! K(o=-2.3!,f=-1.4) USER MOD Single : A 26 LYS NZ :NH3+ -167:sc=-0.00474 (180deg=-0.229) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 156:sc= 0.558 (180deg=0.295) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= 0.758 K(o=0.76,f=-0.49) USER MOD Single : A 38 ASN : amide:sc= -1.08 X(o=-1.1,f=-1.4!) USER MOD Single : A 41 SER OG : rot 180:sc= -0.726 USER MOD Single : A 42 HIS : no HD1:sc=-0.00464 X(o=-0.0046,f=-0.092) USER MOD Single : A 48 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.199) USER MOD Single : A 50 GLN : amide:sc= -0.172 X(o=-0.17,f=0) USER MOD Single : A 55 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00553) USER MOD Single : A 59 THR OG1 : rot 86:sc= 1 USER MOD Single : A 68 CYS SG : rot 180:sc= -0.0319 USER MOD Single : A 71 GLN : amide:sc= -0.0914 K(o=-0.091,f=-1.7!) USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 80:sc= -1.33 USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot 103:sc= 1.21 USER MOD Single : A 82 THR OG1 : rot -68:sc= -0.254 USER MOD Single : B 1 SER N :NH3+ -118:sc= 0.14 (180deg=-0.00473) USER MOD Single : B 1 SER OG : rot 180:sc= 0 USER MOD Single : B 7 MET CE :methyl 176:sc=-0.00291 (180deg=-0.0149) USER MOD Single : B 15 HIS : no HD1:sc= -0.331 K(o=-0.33,f=-1.1) USER MOD Single : B 16 GLN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Single : B 17 TYR OH : rot 180:sc= 0 USER MOD Single : B 18 SER OG : rot -76:sc= 0.713 USER MOD Single : B 24 LYS NZ :NH3+ -153:sc= -1.59! (180deg=-2.22!) USER MOD Single : B 25 HIS : no HD1:sc= -2.31! K(o=-2.3!,f=-1.2) USER MOD Single : B 26 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.235) USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 LYS NZ :NH3+ 156:sc= 0.563 (180deg=0.294) USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 37 ASN : amide:sc= 0.792 K(o=0.79,f=-0.47) USER MOD Single : B 38 ASN : amide:sc= -1.14 X(o=-1.1,f=-1.3!) USER MOD Single : B 41 SER OG : rot 180:sc= -0.752 USER MOD Single : B 42 HIS : no HD1:sc= -0.0103 X(o=-0.01,f=-0.089) USER MOD Single : B 48 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.171) USER MOD Single : B 50 GLN : amide:sc= -0.18 X(o=-0.18,f=0) USER MOD Single : B 55 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00501) USER MOD Single : B 59 THR OG1 : rot 81:sc= 1.1 USER MOD Single : B 68 CYS SG : rot 180:sc= -0.0353 USER MOD Single : B 71 GLN : amide:sc= -0.0562 K(o=-0.056,f=-1.7!) USER MOD Single : B 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 78 SER OG : rot 79:sc= -1.37 USER MOD Single : B 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 81 THR OG1 : rot 103:sc= 1.2 USER MOD Single : B 82 THR OG1 : rot -61:sc= -0.257 USER MOD ----------------------------------------------------------------- ATOM 20 N SER A 1 -10.560 4.707 12.446 1.00 0.00 N ATOM 21 CA SER A 1 -10.649 3.224 12.563 1.00 0.00 C ATOM 22 C SER A 1 -9.256 2.655 12.827 1.00 0.00 C ATOM 23 O SER A 1 -8.269 3.362 12.780 1.00 0.00 O ATOM 24 CB SER A 1 -11.194 2.642 11.258 1.00 0.00 C ATOM 25 OG SER A 1 -10.176 2.691 10.265 1.00 0.00 O ATOM 0 H1 SER A 1 -11.203 5.149 13.134 1.00 0.00 H new ATOM 0 H2 SER A 1 -9.585 5.012 12.638 1.00 0.00 H new ATOM 0 H3 SER A 1 -10.830 4.996 11.484 1.00 0.00 H new ATOM 0 HA SER A 1 -11.315 2.962 13.385 1.00 0.00 H new ATOM 0 HB2 SER A 1 -11.520 1.613 11.412 1.00 0.00 H new ATOM 0 HB3 SER A 1 -12.067 3.207 10.930 1.00 0.00 H new ATOM 0 HG SER A 1 -10.519 2.318 9.426 1.00 0.00 H new ATOM 31 N GLU A 2 -9.162 1.384 13.103 1.00 0.00 N ATOM 32 CA GLU A 2 -7.825 0.784 13.365 1.00 0.00 C ATOM 33 C GLU A 2 -6.931 1.003 12.145 1.00 0.00 C ATOM 34 O GLU A 2 -5.734 1.182 12.261 1.00 0.00 O ATOM 35 CB GLU A 2 -7.979 -0.716 13.622 1.00 0.00 C ATOM 36 CG GLU A 2 -8.677 -0.936 14.966 1.00 0.00 C ATOM 37 CD GLU A 2 -10.134 -0.481 14.865 1.00 0.00 C ATOM 38 OE1 GLU A 2 -10.730 -0.696 13.822 1.00 0.00 O ATOM 39 OE2 GLU A 2 -10.630 0.076 15.830 1.00 0.00 O ATOM 0 H GLU A 2 -9.949 0.738 13.158 1.00 0.00 H new ATOM 0 HA GLU A 2 -7.376 1.255 14.240 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -8.558 -1.175 12.821 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -7.001 -1.197 13.625 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -8.632 -1.989 15.243 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -8.164 -0.378 15.750 1.00 0.00 H new ATOM 46 N LEU A 3 -7.506 0.982 10.973 1.00 0.00 N ATOM 47 CA LEU A 3 -6.698 1.180 9.738 1.00 0.00 C ATOM 48 C LEU A 3 -6.024 2.557 9.781 1.00 0.00 C ATOM 49 O LEU A 3 -4.839 2.684 9.544 1.00 0.00 O ATOM 50 CB LEU A 3 -7.621 1.075 8.504 1.00 0.00 C ATOM 51 CG LEU A 3 -6.858 0.472 7.317 1.00 0.00 C ATOM 52 CD1 LEU A 3 -7.778 0.412 6.097 1.00 0.00 C ATOM 53 CD2 LEU A 3 -5.641 1.342 6.992 1.00 0.00 C ATOM 0 H LEU A 3 -8.504 0.836 10.818 1.00 0.00 H new ATOM 0 HA LEU A 3 -5.926 0.413 9.674 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -8.487 0.456 8.741 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -7.998 2.063 8.239 1.00 0.00 H new ATOM 0 HG LEU A 3 -6.527 -0.534 7.575 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -7.236 -0.016 5.254 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -8.644 -0.209 6.325 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -8.110 1.418 5.842 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -5.101 0.912 6.149 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -5.971 2.349 6.736 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -4.983 1.386 7.860 1.00 0.00 H new ATOM 65 N GLU A 4 -6.766 3.592 10.073 1.00 0.00 N ATOM 66 CA GLU A 4 -6.151 4.949 10.116 1.00 0.00 C ATOM 67 C GLU A 4 -4.909 4.913 11.009 1.00 0.00 C ATOM 68 O GLU A 4 -3.850 5.389 10.651 1.00 0.00 O ATOM 69 CB GLU A 4 -7.160 5.954 10.670 1.00 0.00 C ATOM 70 CG GLU A 4 -8.351 6.053 9.714 1.00 0.00 C ATOM 71 CD GLU A 4 -9.209 7.264 10.085 1.00 0.00 C ATOM 72 OE1 GLU A 4 -8.642 8.271 10.475 1.00 0.00 O ATOM 73 OE2 GLU A 4 -10.420 7.162 9.973 1.00 0.00 O ATOM 0 H GLU A 4 -7.764 3.557 10.282 1.00 0.00 H new ATOM 0 HA GLU A 4 -5.864 5.252 9.109 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -7.497 5.641 11.658 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -6.691 6.931 10.787 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -7.999 6.146 8.687 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -8.948 5.142 9.765 1.00 0.00 H new ATOM 80 N LYS A 5 -5.042 4.331 12.169 1.00 0.00 N ATOM 81 CA LYS A 5 -3.889 4.226 13.106 1.00 0.00 C ATOM 82 C LYS A 5 -2.680 3.653 12.366 1.00 0.00 C ATOM 83 O LYS A 5 -1.567 4.119 12.499 1.00 0.00 O ATOM 84 CB LYS A 5 -4.265 3.268 14.240 1.00 0.00 C ATOM 85 CG LYS A 5 -3.200 3.330 15.337 1.00 0.00 C ATOM 86 CD LYS A 5 -3.647 2.484 16.532 1.00 0.00 C ATOM 87 CE LYS A 5 -2.473 2.298 17.494 1.00 0.00 C ATOM 88 NZ LYS A 5 -1.407 1.497 16.828 1.00 0.00 N ATOM 0 H LYS A 5 -5.910 3.919 12.511 1.00 0.00 H new ATOM 0 HA LYS A 5 -3.646 5.212 13.501 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -5.239 3.537 14.649 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -4.349 2.251 13.858 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -2.247 2.964 14.955 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -3.043 4.363 15.648 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -4.477 2.970 17.045 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -4.007 1.514 16.190 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -2.079 3.268 17.795 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -2.808 1.794 18.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -0.864 0.976 17.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -1.842 0.823 16.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -0.770 2.132 16.306 1.00 0.00 H new ATOM 102 N ALA A 6 -2.909 2.622 11.597 1.00 0.00 N ATOM 103 CA ALA A 6 -1.809 1.963 10.837 1.00 0.00 C ATOM 104 C ALA A 6 -1.403 2.802 9.618 1.00 0.00 C ATOM 105 O ALA A 6 -0.236 2.880 9.286 1.00 0.00 O ATOM 106 CB ALA A 6 -2.296 0.576 10.386 1.00 0.00 C ATOM 0 H ALA A 6 -3.829 2.202 11.462 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.933 1.867 11.478 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -1.505 0.076 9.827 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -2.555 -0.021 11.261 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -3.174 0.688 9.750 1.00 0.00 H new ATOM 112 N MET A 7 -2.321 3.441 8.952 1.00 0.00 N ATOM 113 CA MET A 7 -1.909 4.264 7.780 1.00 0.00 C ATOM 114 C MET A 7 -0.941 5.345 8.284 1.00 0.00 C ATOM 115 O MET A 7 0.133 5.543 7.741 1.00 0.00 O ATOM 116 CB MET A 7 -3.163 4.906 7.132 1.00 0.00 C ATOM 117 CG MET A 7 -3.451 4.262 5.768 1.00 0.00 C ATOM 118 SD MET A 7 -2.135 4.702 4.606 1.00 0.00 S ATOM 119 CE MET A 7 -2.608 3.564 3.281 1.00 0.00 C ATOM 0 H MET A 7 -3.319 3.432 9.161 1.00 0.00 H new ATOM 0 HA MET A 7 -1.416 3.651 7.025 1.00 0.00 H new ATOM 0 HB2 MET A 7 -4.024 4.781 7.789 1.00 0.00 H new ATOM 0 HB3 MET A 7 -3.008 5.978 7.010 1.00 0.00 H new ATOM 0 HG2 MET A 7 -3.513 3.179 5.871 1.00 0.00 H new ATOM 0 HG3 MET A 7 -4.415 4.602 5.389 1.00 0.00 H new ATOM 0 HE1 MET A 7 -2.032 3.791 2.384 1.00 0.00 H new ATOM 0 HE2 MET A 7 -2.406 2.539 3.592 1.00 0.00 H new ATOM 0 HE3 MET A 7 -3.671 3.676 3.068 1.00 0.00 H new ATOM 129 N VAL A 8 -1.306 6.033 9.330 1.00 0.00 N ATOM 130 CA VAL A 8 -0.406 7.085 9.873 1.00 0.00 C ATOM 131 C VAL A 8 0.896 6.426 10.328 1.00 0.00 C ATOM 132 O VAL A 8 1.968 6.980 10.186 1.00 0.00 O ATOM 133 CB VAL A 8 -1.077 7.777 11.064 1.00 0.00 C ATOM 134 CG1 VAL A 8 -0.208 8.943 11.535 1.00 0.00 C ATOM 135 CG2 VAL A 8 -2.452 8.307 10.644 1.00 0.00 C ATOM 0 H VAL A 8 -2.187 5.912 9.830 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.199 7.829 9.104 1.00 0.00 H new ATOM 0 HB VAL A 8 -1.196 7.059 11.876 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -0.686 9.434 12.382 1.00 0.00 H new ATOM 0 HG12 VAL A 8 0.770 8.569 11.837 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -0.087 9.658 10.722 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -2.927 8.799 11.493 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -2.333 9.022 9.830 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -3.075 7.477 10.310 1.00 0.00 H new ATOM 145 N ALA A 9 0.809 5.240 10.871 1.00 0.00 N ATOM 146 CA ALA A 9 2.039 4.538 11.330 1.00 0.00 C ATOM 147 C ALA A 9 2.993 4.358 10.145 1.00 0.00 C ATOM 148 O ALA A 9 4.173 4.615 10.246 1.00 0.00 O ATOM 149 CB ALA A 9 1.660 3.166 11.891 1.00 0.00 C ATOM 0 H ALA A 9 -0.062 4.729 11.016 1.00 0.00 H new ATOM 0 HA ALA A 9 2.528 5.127 12.106 1.00 0.00 H new ATOM 0 HB1 ALA A 9 2.559 2.650 12.228 1.00 0.00 H new ATOM 0 HB2 ALA A 9 0.978 3.292 12.732 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.173 2.577 11.114 1.00 0.00 H new ATOM 155 N LEU A 10 2.497 3.897 9.030 1.00 0.00 N ATOM 156 CA LEU A 10 3.391 3.683 7.850 1.00 0.00 C ATOM 157 C LEU A 10 4.294 4.907 7.673 1.00 0.00 C ATOM 158 O LEU A 10 5.481 4.787 7.445 1.00 0.00 O ATOM 159 CB LEU A 10 2.518 3.496 6.582 1.00 0.00 C ATOM 160 CG LEU A 10 2.283 2.003 6.294 1.00 0.00 C ATOM 161 CD1 LEU A 10 1.418 1.393 7.398 1.00 0.00 C ATOM 162 CD2 LEU A 10 1.566 1.854 4.949 1.00 0.00 C ATOM 0 H LEU A 10 1.516 3.659 8.882 1.00 0.00 H new ATOM 0 HA LEU A 10 4.007 2.797 8.006 1.00 0.00 H new ATOM 0 HB2 LEU A 10 1.561 4.000 6.717 1.00 0.00 H new ATOM 0 HB3 LEU A 10 3.006 3.963 5.727 1.00 0.00 H new ATOM 0 HG LEU A 10 3.242 1.487 6.260 1.00 0.00 H new ATOM 0 HD11 LEU A 10 1.254 0.336 7.190 1.00 0.00 H new ATOM 0 HD12 LEU A 10 1.924 1.500 8.357 1.00 0.00 H new ATOM 0 HD13 LEU A 10 0.458 1.908 7.435 1.00 0.00 H new ATOM 0 HD21 LEU A 10 1.398 0.797 4.741 1.00 0.00 H new ATOM 0 HD22 LEU A 10 0.608 2.373 4.988 1.00 0.00 H new ATOM 0 HD23 LEU A 10 2.181 2.285 4.159 1.00 0.00 H new ATOM 174 N ILE A 11 3.743 6.084 7.795 1.00 0.00 N ATOM 175 CA ILE A 11 4.592 7.301 7.649 1.00 0.00 C ATOM 176 C ILE A 11 5.610 7.309 8.796 1.00 0.00 C ATOM 177 O ILE A 11 6.764 7.646 8.622 1.00 0.00 O ATOM 178 CB ILE A 11 3.710 8.560 7.711 1.00 0.00 C ATOM 179 CG1 ILE A 11 2.968 8.729 6.380 1.00 0.00 C ATOM 180 CG2 ILE A 11 4.578 9.802 7.954 1.00 0.00 C ATOM 181 CD1 ILE A 11 2.051 7.529 6.135 1.00 0.00 C ATOM 0 H ILE A 11 2.756 6.255 7.987 1.00 0.00 H new ATOM 0 HA ILE A 11 5.110 7.293 6.690 1.00 0.00 H new ATOM 0 HB ILE A 11 2.997 8.450 8.528 1.00 0.00 H new ATOM 0 HG12 ILE A 11 2.382 9.648 6.395 1.00 0.00 H new ATOM 0 HG13 ILE A 11 3.685 8.822 5.564 1.00 0.00 H new ATOM 0 HG21 ILE A 11 3.943 10.687 7.996 1.00 0.00 H new ATOM 0 HG22 ILE A 11 5.112 9.694 8.898 1.00 0.00 H new ATOM 0 HG23 ILE A 11 5.296 9.909 7.141 1.00 0.00 H new ATOM 0 HD11 ILE A 11 1.528 7.658 5.187 1.00 0.00 H new ATOM 0 HD12 ILE A 11 2.647 6.617 6.099 1.00 0.00 H new ATOM 0 HD13 ILE A 11 1.324 7.456 6.944 1.00 0.00 H new ATOM 193 N ASP A 12 5.175 6.929 9.968 1.00 0.00 N ATOM 194 CA ASP A 12 6.084 6.893 11.148 1.00 0.00 C ATOM 195 C ASP A 12 7.352 6.112 10.807 1.00 0.00 C ATOM 196 O ASP A 12 8.457 6.584 10.987 1.00 0.00 O ATOM 197 CB ASP A 12 5.365 6.182 12.306 1.00 0.00 C ATOM 198 CG ASP A 12 6.061 6.513 13.631 1.00 0.00 C ATOM 199 OD1 ASP A 12 7.134 7.092 13.586 1.00 0.00 O ATOM 200 OD2 ASP A 12 5.508 6.181 14.666 1.00 0.00 O ATOM 0 H ASP A 12 4.216 6.639 10.159 1.00 0.00 H new ATOM 0 HA ASP A 12 6.350 7.912 11.429 1.00 0.00 H new ATOM 0 HB2 ASP A 12 4.321 6.495 12.345 1.00 0.00 H new ATOM 0 HB3 ASP A 12 5.369 5.104 12.142 1.00 0.00 H new ATOM 205 N VAL A 13 7.193 4.903 10.336 1.00 0.00 N ATOM 206 CA VAL A 13 8.381 4.067 10.007 1.00 0.00 C ATOM 207 C VAL A 13 9.012 4.518 8.688 1.00 0.00 C ATOM 208 O VAL A 13 10.216 4.643 8.591 1.00 0.00 O ATOM 209 CB VAL A 13 7.963 2.598 9.924 1.00 0.00 C ATOM 210 CG1 VAL A 13 9.147 1.752 9.451 1.00 0.00 C ATOM 211 CG2 VAL A 13 7.522 2.126 11.311 1.00 0.00 C ATOM 0 H VAL A 13 6.290 4.460 10.165 1.00 0.00 H new ATOM 0 HA VAL A 13 9.126 4.185 10.794 1.00 0.00 H new ATOM 0 HB VAL A 13 7.140 2.491 9.217 1.00 0.00 H new ATOM 0 HG11 VAL A 13 8.846 0.706 9.393 1.00 0.00 H new ATOM 0 HG12 VAL A 13 9.467 2.093 8.466 1.00 0.00 H new ATOM 0 HG13 VAL A 13 9.972 1.854 10.156 1.00 0.00 H new ATOM 0 HG21 VAL A 13 7.222 1.079 11.261 1.00 0.00 H new ATOM 0 HG22 VAL A 13 8.350 2.233 12.012 1.00 0.00 H new ATOM 0 HG23 VAL A 13 6.679 2.729 11.650 1.00 0.00 H new ATOM 221 N PHE A 14 8.237 4.755 7.670 1.00 0.00 N ATOM 222 CA PHE A 14 8.858 5.180 6.386 1.00 0.00 C ATOM 223 C PHE A 14 9.741 6.403 6.642 1.00 0.00 C ATOM 224 O PHE A 14 10.763 6.592 6.010 1.00 0.00 O ATOM 225 CB PHE A 14 7.775 5.533 5.367 1.00 0.00 C ATOM 226 CG PHE A 14 8.422 5.859 4.040 1.00 0.00 C ATOM 227 CD1 PHE A 14 8.952 7.135 3.813 1.00 0.00 C ATOM 228 CD2 PHE A 14 8.488 4.886 3.035 1.00 0.00 C ATOM 229 CE1 PHE A 14 9.546 7.438 2.581 1.00 0.00 C ATOM 230 CE2 PHE A 14 9.081 5.190 1.804 1.00 0.00 C ATOM 231 CZ PHE A 14 9.610 6.465 1.578 1.00 0.00 C ATOM 0 H PHE A 14 7.220 4.675 7.668 1.00 0.00 H new ATOM 0 HA PHE A 14 9.460 4.363 5.988 1.00 0.00 H new ATOM 0 HB2 PHE A 14 7.083 4.699 5.252 1.00 0.00 H new ATOM 0 HB3 PHE A 14 7.192 6.384 5.719 1.00 0.00 H new ATOM 0 HD1 PHE A 14 8.903 7.886 4.588 1.00 0.00 H new ATOM 0 HD2 PHE A 14 8.081 3.901 3.210 1.00 0.00 H new ATOM 0 HE1 PHE A 14 9.954 8.422 2.406 1.00 0.00 H new ATOM 0 HE2 PHE A 14 9.130 4.440 1.029 1.00 0.00 H new ATOM 0 HZ PHE A 14 10.068 6.698 0.628 1.00 0.00 H new ATOM 241 N HIS A 15 9.345 7.238 7.566 1.00 0.00 N ATOM 242 CA HIS A 15 10.144 8.458 7.873 1.00 0.00 C ATOM 243 C HIS A 15 11.298 8.107 8.817 1.00 0.00 C ATOM 244 O HIS A 15 12.343 8.726 8.793 1.00 0.00 O ATOM 245 CB HIS A 15 9.243 9.501 8.537 1.00 0.00 C ATOM 246 CG HIS A 15 10.038 10.745 8.821 1.00 0.00 C ATOM 247 ND1 HIS A 15 10.334 11.154 10.112 1.00 0.00 N ATOM 248 CD2 HIS A 15 10.605 11.680 7.992 1.00 0.00 C ATOM 249 CE1 HIS A 15 11.049 12.290 10.023 1.00 0.00 C ATOM 250 NE2 HIS A 15 11.243 12.655 8.753 1.00 0.00 N ATOM 0 H HIS A 15 8.498 7.126 8.123 1.00 0.00 H new ATOM 0 HA HIS A 15 10.552 8.860 6.946 1.00 0.00 H new ATOM 0 HB2 HIS A 15 8.401 9.736 7.886 1.00 0.00 H new ATOM 0 HB3 HIS A 15 8.829 9.102 9.463 1.00 0.00 H new ATOM 0 HD2 HIS A 15 10.563 11.662 6.913 1.00 0.00 H new ATOM 0 HE1 HIS A 15 11.421 12.840 10.875 1.00 0.00 H new ATOM 0 HE2 HIS A 15 11.750 13.473 8.414 1.00 0.00 H new ATOM 258 N GLN A 16 11.108 7.128 9.664 1.00 0.00 N ATOM 259 CA GLN A 16 12.185 6.753 10.624 1.00 0.00 C ATOM 260 C GLN A 16 13.483 6.486 9.862 1.00 0.00 C ATOM 261 O GLN A 16 14.543 6.935 10.252 1.00 0.00 O ATOM 262 CB GLN A 16 11.772 5.498 11.398 1.00 0.00 C ATOM 263 CG GLN A 16 12.715 5.295 12.587 1.00 0.00 C ATOM 264 CD GLN A 16 12.183 4.171 13.476 1.00 0.00 C ATOM 265 OE1 GLN A 16 11.107 3.656 13.245 1.00 0.00 O ATOM 266 NE2 GLN A 16 12.895 3.767 14.492 1.00 0.00 N ATOM 0 H GLN A 16 10.254 6.574 9.731 1.00 0.00 H new ATOM 0 HA GLN A 16 12.343 7.572 11.326 1.00 0.00 H new ATOM 0 HB2 GLN A 16 10.745 5.596 11.748 1.00 0.00 H new ATOM 0 HB3 GLN A 16 11.804 4.627 10.743 1.00 0.00 H new ATOM 0 HG2 GLN A 16 13.716 5.049 12.233 1.00 0.00 H new ATOM 0 HG3 GLN A 16 12.798 6.218 13.161 1.00 0.00 H new ATOM 0 HE21 GLN A 16 13.798 4.199 14.686 1.00 0.00 H new ATOM 0 HE22 GLN A 16 12.548 3.019 15.092 1.00 0.00 H new ATOM 275 N TYR A 17 13.414 5.764 8.777 1.00 0.00 N ATOM 276 CA TYR A 17 14.647 5.480 7.994 1.00 0.00 C ATOM 277 C TYR A 17 15.062 6.748 7.252 1.00 0.00 C ATOM 278 O TYR A 17 16.213 7.136 7.257 1.00 0.00 O ATOM 279 CB TYR A 17 14.367 4.366 6.979 1.00 0.00 C ATOM 280 CG TYR A 17 14.318 3.031 7.689 1.00 0.00 C ATOM 281 CD1 TYR A 17 13.261 2.742 8.558 1.00 0.00 C ATOM 282 CD2 TYR A 17 15.330 2.083 7.479 1.00 0.00 C ATOM 283 CE1 TYR A 17 13.213 1.509 9.219 1.00 0.00 C ATOM 284 CE2 TYR A 17 15.282 0.850 8.140 1.00 0.00 C ATOM 285 CZ TYR A 17 14.224 0.563 9.010 1.00 0.00 C ATOM 286 OH TYR A 17 14.177 -0.653 9.662 1.00 0.00 O ATOM 0 H TYR A 17 12.557 5.359 8.400 1.00 0.00 H new ATOM 0 HA TYR A 17 15.445 5.162 8.665 1.00 0.00 H new ATOM 0 HB2 TYR A 17 13.421 4.553 6.470 1.00 0.00 H new ATOM 0 HB3 TYR A 17 15.143 4.354 6.214 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.481 3.471 8.719 1.00 0.00 H new ATOM 0 HD2 TYR A 17 16.146 2.304 6.807 1.00 0.00 H new ATOM 0 HE1 TYR A 17 12.396 1.287 9.890 1.00 0.00 H new ATOM 0 HE2 TYR A 17 16.061 0.120 7.979 1.00 0.00 H new ATOM 0 HH TYR A 17 14.954 -1.192 9.404 1.00 0.00 H new ATOM 296 N SER A 18 14.126 7.397 6.608 1.00 0.00 N ATOM 297 CA SER A 18 14.446 8.644 5.853 1.00 0.00 C ATOM 298 C SER A 18 14.064 9.872 6.687 1.00 0.00 C ATOM 299 O SER A 18 13.300 10.709 6.249 1.00 0.00 O ATOM 300 CB SER A 18 13.650 8.656 4.548 1.00 0.00 C ATOM 301 OG SER A 18 12.261 8.687 4.847 1.00 0.00 O ATOM 0 H SER A 18 13.147 7.114 6.573 1.00 0.00 H new ATOM 0 HA SER A 18 15.515 8.673 5.640 1.00 0.00 H new ATOM 0 HB2 SER A 18 13.924 9.524 3.949 1.00 0.00 H new ATOM 0 HB3 SER A 18 13.887 7.772 3.956 1.00 0.00 H new ATOM 0 HG SER A 18 11.973 7.802 5.153 1.00 0.00 H new ATOM 307 N GLY A 19 14.608 10.001 7.876 1.00 0.00 N ATOM 308 CA GLY A 19 14.305 11.190 8.741 1.00 0.00 C ATOM 309 C GLY A 19 15.620 11.926 9.001 1.00 0.00 C ATOM 310 O GLY A 19 15.636 13.063 9.427 1.00 0.00 O ATOM 0 H GLY A 19 15.254 9.328 8.288 1.00 0.00 H new ATOM 0 HA2 GLY A 19 13.590 11.848 8.248 1.00 0.00 H new ATOM 0 HA3 GLY A 19 13.852 10.873 9.681 1.00 0.00 H new ATOM 314 N ARG A 20 16.722 11.294 8.706 1.00 0.00 N ATOM 315 CA ARG A 20 18.044 11.954 8.886 1.00 0.00 C ATOM 316 C ARG A 20 18.129 13.152 7.942 1.00 0.00 C ATOM 317 O ARG A 20 18.777 14.132 8.254 1.00 0.00 O ATOM 318 CB ARG A 20 19.170 10.963 8.581 1.00 0.00 C ATOM 319 CG ARG A 20 20.497 11.517 9.104 1.00 0.00 C ATOM 320 CD ARG A 20 21.657 10.715 8.510 1.00 0.00 C ATOM 321 NE ARG A 20 21.706 10.930 7.037 1.00 0.00 N ATOM 322 CZ ARG A 20 22.348 10.085 6.276 1.00 0.00 C ATOM 323 NH1 ARG A 20 21.877 8.882 6.094 1.00 0.00 N ATOM 324 NH2 ARG A 20 23.461 10.444 5.698 1.00 0.00 N ATOM 0 H ARG A 20 16.763 10.341 8.345 1.00 0.00 H new ATOM 0 HA ARG A 20 18.150 12.291 9.917 1.00 0.00 H new ATOM 0 HB2 ARG A 20 18.957 10.001 9.047 1.00 0.00 H new ATOM 0 HB3 ARG A 20 19.235 10.790 7.507 1.00 0.00 H new ATOM 0 HG2 ARG A 20 20.594 12.569 8.836 1.00 0.00 H new ATOM 0 HG3 ARG A 20 20.522 11.461 10.192 1.00 0.00 H new ATOM 0 HD2 ARG A 20 22.598 11.025 8.965 1.00 0.00 H new ATOM 0 HD3 ARG A 20 21.530 9.655 8.730 1.00 0.00 H new ATOM 0 HE ARG A 20 21.239 11.737 6.623 1.00 0.00 H new ATOM 0 HH11 ARG A 20 21.007 8.601 6.546 1.00 0.00 H new ATOM 0 HH12 ARG A 20 22.379 8.222 5.499 1.00 0.00 H new ATOM 0 HH21 ARG A 20 23.829 11.384 5.841 1.00 0.00 H new ATOM 0 HH22 ARG A 20 23.963 9.784 5.104 1.00 0.00 H new ATOM 338 N GLU A 21 17.464 13.122 6.814 1.00 0.00 N ATOM 339 CA GLU A 21 17.512 14.314 5.910 1.00 0.00 C ATOM 340 C GLU A 21 16.184 14.457 5.164 1.00 0.00 C ATOM 341 O GLU A 21 15.630 15.536 5.079 1.00 0.00 O ATOM 342 CB GLU A 21 18.650 14.157 4.899 1.00 0.00 C ATOM 343 CG GLU A 21 19.986 14.083 5.636 1.00 0.00 C ATOM 344 CD GLU A 21 21.130 14.183 4.624 1.00 0.00 C ATOM 345 OE1 GLU A 21 21.378 15.278 4.147 1.00 0.00 O ATOM 346 OE2 GLU A 21 21.736 13.162 4.342 1.00 0.00 O ATOM 0 H GLU A 21 16.899 12.339 6.483 1.00 0.00 H new ATOM 0 HA GLU A 21 17.685 15.206 6.513 1.00 0.00 H new ATOM 0 HB2 GLU A 21 18.500 13.255 4.306 1.00 0.00 H new ATOM 0 HB3 GLU A 21 18.652 14.998 4.206 1.00 0.00 H new ATOM 0 HG2 GLU A 21 20.058 14.891 6.364 1.00 0.00 H new ATOM 0 HG3 GLU A 21 20.057 13.147 6.191 1.00 0.00 H new ATOM 353 N GLY A 22 15.663 13.388 4.622 1.00 0.00 N ATOM 354 CA GLY A 22 14.368 13.482 3.882 1.00 0.00 C ATOM 355 C GLY A 22 14.412 14.680 2.931 1.00 0.00 C ATOM 356 O GLY A 22 13.397 15.119 2.426 1.00 0.00 O ATOM 0 H GLY A 22 16.076 12.456 4.659 1.00 0.00 H new ATOM 0 HA2 GLY A 22 14.190 12.565 3.321 1.00 0.00 H new ATOM 0 HA3 GLY A 22 13.542 13.592 4.585 1.00 0.00 H new ATOM 360 N ASP A 23 15.579 15.216 2.682 1.00 0.00 N ATOM 361 CA ASP A 23 15.678 16.386 1.762 1.00 0.00 C ATOM 362 C ASP A 23 14.878 16.081 0.495 1.00 0.00 C ATOM 363 O ASP A 23 14.000 16.826 0.108 1.00 0.00 O ATOM 364 CB ASP A 23 17.145 16.626 1.398 1.00 0.00 C ATOM 365 CG ASP A 23 17.267 17.917 0.590 1.00 0.00 C ATOM 366 OD1 ASP A 23 16.606 18.879 0.943 1.00 0.00 O ATOM 367 OD2 ASP A 23 18.019 17.921 -0.370 1.00 0.00 O ATOM 0 H ASP A 23 16.464 14.895 3.075 1.00 0.00 H new ATOM 0 HA ASP A 23 15.280 17.278 2.247 1.00 0.00 H new ATOM 0 HB2 ASP A 23 17.749 16.693 2.303 1.00 0.00 H new ATOM 0 HB3 ASP A 23 17.529 15.785 0.820 1.00 0.00 H new ATOM 372 N LYS A 24 15.155 14.973 -0.135 1.00 0.00 N ATOM 373 CA LYS A 24 14.392 14.595 -1.357 1.00 0.00 C ATOM 374 C LYS A 24 13.173 13.772 -0.930 1.00 0.00 C ATOM 375 O LYS A 24 12.964 13.518 0.240 1.00 0.00 O ATOM 376 CB LYS A 24 15.285 13.758 -2.276 1.00 0.00 C ATOM 377 CG LYS A 24 16.667 14.411 -2.376 1.00 0.00 C ATOM 378 CD LYS A 24 17.455 13.783 -3.529 1.00 0.00 C ATOM 379 CE LYS A 24 17.479 12.260 -3.373 1.00 0.00 C ATOM 380 NZ LYS A 24 17.717 11.907 -1.945 1.00 0.00 N ATOM 0 H LYS A 24 15.879 14.311 0.145 1.00 0.00 H new ATOM 0 HA LYS A 24 14.070 15.488 -1.893 1.00 0.00 H new ATOM 0 HB2 LYS A 24 15.377 12.744 -1.887 1.00 0.00 H new ATOM 0 HB3 LYS A 24 14.835 13.680 -3.266 1.00 0.00 H new ATOM 0 HG2 LYS A 24 16.562 15.484 -2.537 1.00 0.00 H new ATOM 0 HG3 LYS A 24 17.209 14.281 -1.439 1.00 0.00 H new ATOM 0 HD2 LYS A 24 17.000 14.053 -4.482 1.00 0.00 H new ATOM 0 HD3 LYS A 24 18.473 14.173 -3.540 1.00 0.00 H new ATOM 0 HE2 LYS A 24 16.534 11.835 -3.710 1.00 0.00 H new ATOM 0 HE3 LYS A 24 18.262 11.833 -3.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 18.295 11.044 -1.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 18.217 12.687 -1.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 16.806 11.743 -1.471 1.00 0.00 H new ATOM 394 N HIS A 25 12.380 13.340 -1.874 1.00 0.00 N ATOM 395 CA HIS A 25 11.176 12.509 -1.552 1.00 0.00 C ATOM 396 C HIS A 25 11.182 11.299 -2.482 1.00 0.00 C ATOM 397 O HIS A 25 10.167 10.918 -3.032 1.00 0.00 O ATOM 398 CB HIS A 25 9.907 13.333 -1.787 1.00 0.00 C ATOM 399 CG HIS A 25 8.701 12.498 -1.462 1.00 0.00 C ATOM 400 ND1 HIS A 25 7.410 12.933 -1.715 1.00 0.00 N ATOM 401 CD2 HIS A 25 8.574 11.250 -0.905 1.00 0.00 C ATOM 402 CE1 HIS A 25 6.569 11.962 -1.315 1.00 0.00 C ATOM 403 NE2 HIS A 25 7.227 10.913 -0.813 1.00 0.00 N ATOM 0 H HIS A 25 12.514 13.528 -2.867 1.00 0.00 H new ATOM 0 HA HIS A 25 11.198 12.189 -0.510 1.00 0.00 H new ATOM 0 HB2 HIS A 25 9.921 14.228 -1.165 1.00 0.00 H new ATOM 0 HB3 HIS A 25 9.863 13.666 -2.824 1.00 0.00 H new ATOM 0 HD2 HIS A 25 9.395 10.625 -0.586 1.00 0.00 H new ATOM 0 HE1 HIS A 25 5.493 12.023 -1.390 1.00 0.00 H new ATOM 0 HE2 HIS A 25 6.828 10.051 -0.442 1.00 0.00 H new ATOM 411 N LYS A 26 12.327 10.689 -2.653 1.00 0.00 N ATOM 412 CA LYS A 26 12.431 9.491 -3.535 1.00 0.00 C ATOM 413 C LYS A 26 13.274 8.418 -2.837 1.00 0.00 C ATOM 414 O LYS A 26 14.148 8.722 -2.049 1.00 0.00 O ATOM 415 CB LYS A 26 13.101 9.887 -4.852 1.00 0.00 C ATOM 416 CG LYS A 26 12.455 11.166 -5.390 1.00 0.00 C ATOM 417 CD LYS A 26 13.103 11.544 -6.723 1.00 0.00 C ATOM 418 CE LYS A 26 12.544 12.886 -7.201 1.00 0.00 C ATOM 419 NZ LYS A 26 11.103 12.732 -7.548 1.00 0.00 N ATOM 0 H LYS A 26 13.202 10.974 -2.214 1.00 0.00 H new ATOM 0 HA LYS A 26 11.435 9.098 -3.737 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.168 10.044 -4.696 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.000 9.082 -5.580 1.00 0.00 H new ATOM 0 HG2 LYS A 26 11.384 11.016 -5.524 1.00 0.00 H new ATOM 0 HG3 LYS A 26 12.576 11.977 -4.672 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.185 11.609 -6.608 1.00 0.00 H new ATOM 0 HD3 LYS A 26 12.908 10.771 -7.466 1.00 0.00 H new ATOM 0 HE2 LYS A 26 12.662 13.639 -6.422 1.00 0.00 H new ATOM 0 HE3 LYS A 26 13.102 13.235 -8.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 10.781 13.570 -8.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 10.976 11.884 -8.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 10.544 12.635 -6.676 1.00 0.00 H new ATOM 433 N LEU A 27 13.019 7.165 -3.125 1.00 0.00 N ATOM 434 CA LEU A 27 13.799 6.050 -2.492 1.00 0.00 C ATOM 435 C LEU A 27 14.467 5.235 -3.602 1.00 0.00 C ATOM 436 O LEU A 27 13.910 5.055 -4.665 1.00 0.00 O ATOM 437 CB LEU A 27 12.836 5.157 -1.695 1.00 0.00 C ATOM 438 CG LEU A 27 13.615 4.248 -0.724 1.00 0.00 C ATOM 439 CD1 LEU A 27 14.304 5.087 0.376 1.00 0.00 C ATOM 440 CD2 LEU A 27 12.636 3.256 -0.078 1.00 0.00 C ATOM 0 H LEU A 27 12.297 6.862 -3.778 1.00 0.00 H new ATOM 0 HA LEU A 27 14.559 6.447 -1.819 1.00 0.00 H new ATOM 0 HB2 LEU A 27 12.134 5.777 -1.137 1.00 0.00 H new ATOM 0 HB3 LEU A 27 12.247 4.547 -2.380 1.00 0.00 H new ATOM 0 HG LEU A 27 14.384 3.711 -1.279 1.00 0.00 H new ATOM 0 HD11 LEU A 27 14.848 4.426 1.051 1.00 0.00 H new ATOM 0 HD12 LEU A 27 15.000 5.789 -0.084 1.00 0.00 H new ATOM 0 HD13 LEU A 27 13.551 5.639 0.938 1.00 0.00 H new ATOM 0 HD21 LEU A 27 13.177 2.608 0.611 1.00 0.00 H new ATOM 0 HD22 LEU A 27 11.868 3.805 0.467 1.00 0.00 H new ATOM 0 HD23 LEU A 27 12.167 2.650 -0.853 1.00 0.00 H new ATOM 452 N LYS A 28 15.665 4.752 -3.380 1.00 0.00 N ATOM 453 CA LYS A 28 16.361 3.961 -4.444 1.00 0.00 C ATOM 454 C LYS A 28 16.078 2.468 -4.248 1.00 0.00 C ATOM 455 O LYS A 28 15.795 2.019 -3.155 1.00 0.00 O ATOM 456 CB LYS A 28 17.871 4.204 -4.358 1.00 0.00 C ATOM 457 CG LYS A 28 18.195 5.642 -4.779 1.00 0.00 C ATOM 458 CD LYS A 28 19.693 5.765 -5.079 1.00 0.00 C ATOM 459 CE LYS A 28 20.495 5.522 -3.799 1.00 0.00 C ATOM 460 NZ LYS A 28 21.900 5.974 -4.002 1.00 0.00 N ATOM 0 H LYS A 28 16.189 4.870 -2.513 1.00 0.00 H new ATOM 0 HA LYS A 28 15.994 4.275 -5.421 1.00 0.00 H new ATOM 0 HB2 LYS A 28 18.219 4.027 -3.340 1.00 0.00 H new ATOM 0 HB3 LYS A 28 18.398 3.500 -5.002 1.00 0.00 H new ATOM 0 HG2 LYS A 28 17.614 5.913 -5.660 1.00 0.00 H new ATOM 0 HG3 LYS A 28 17.914 6.336 -3.986 1.00 0.00 H new ATOM 0 HD2 LYS A 28 19.981 5.043 -5.843 1.00 0.00 H new ATOM 0 HD3 LYS A 28 19.914 6.756 -5.476 1.00 0.00 H new ATOM 0 HE2 LYS A 28 20.044 6.062 -2.966 1.00 0.00 H new ATOM 0 HE3 LYS A 28 20.476 4.463 -3.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 22.447 5.809 -3.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 22.327 5.440 -4.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 21.909 6.989 -4.230 1.00 0.00 H new ATOM 474 N LYS A 29 16.157 1.695 -5.298 1.00 0.00 N ATOM 475 CA LYS A 29 15.899 0.230 -5.175 1.00 0.00 C ATOM 476 C LYS A 29 16.875 -0.390 -4.163 1.00 0.00 C ATOM 477 O LYS A 29 16.514 -1.244 -3.378 1.00 0.00 O ATOM 478 CB LYS A 29 16.109 -0.430 -6.550 1.00 0.00 C ATOM 479 CG LYS A 29 17.297 0.237 -7.277 1.00 0.00 C ATOM 480 CD LYS A 29 17.945 -0.754 -8.252 1.00 0.00 C ATOM 481 CE LYS A 29 19.096 -0.066 -8.988 1.00 0.00 C ATOM 482 NZ LYS A 29 19.857 -1.078 -9.776 1.00 0.00 N ATOM 0 H LYS A 29 16.390 2.015 -6.238 1.00 0.00 H new ATOM 0 HA LYS A 29 14.877 0.068 -4.832 1.00 0.00 H new ATOM 0 HB2 LYS A 29 16.299 -1.496 -6.426 1.00 0.00 H new ATOM 0 HB3 LYS A 29 15.204 -0.335 -7.151 1.00 0.00 H new ATOM 0 HG2 LYS A 29 16.953 1.119 -7.818 1.00 0.00 H new ATOM 0 HG3 LYS A 29 18.034 0.577 -6.549 1.00 0.00 H new ATOM 0 HD2 LYS A 29 18.314 -1.625 -7.710 1.00 0.00 H new ATOM 0 HD3 LYS A 29 17.205 -1.114 -8.967 1.00 0.00 H new ATOM 0 HE2 LYS A 29 18.708 0.709 -9.649 1.00 0.00 H new ATOM 0 HE3 LYS A 29 19.756 0.426 -8.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 20.349 -0.607 -10.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 20.554 -1.544 -9.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 19.199 -1.789 -10.155 1.00 0.00 H new ATOM 496 N SER A 30 18.111 0.020 -4.198 1.00 0.00 N ATOM 497 CA SER A 30 19.129 -0.549 -3.268 1.00 0.00 C ATOM 498 C SER A 30 18.722 -0.335 -1.807 1.00 0.00 C ATOM 499 O SER A 30 18.903 -1.200 -0.965 1.00 0.00 O ATOM 500 CB SER A 30 20.469 0.146 -3.515 1.00 0.00 C ATOM 501 OG SER A 30 20.963 -0.226 -4.796 1.00 0.00 O ATOM 0 H SER A 30 18.465 0.732 -4.837 1.00 0.00 H new ATOM 0 HA SER A 30 19.208 -1.620 -3.453 1.00 0.00 H new ATOM 0 HB2 SER A 30 20.346 1.228 -3.460 1.00 0.00 H new ATOM 0 HB3 SER A 30 21.184 -0.133 -2.742 1.00 0.00 H new ATOM 0 HG SER A 30 21.821 0.219 -4.958 1.00 0.00 H new ATOM 507 N GLU A 31 18.181 0.812 -1.487 1.00 0.00 N ATOM 508 CA GLU A 31 17.791 1.059 -0.069 1.00 0.00 C ATOM 509 C GLU A 31 16.471 0.349 0.213 1.00 0.00 C ATOM 510 O GLU A 31 16.247 -0.181 1.283 1.00 0.00 O ATOM 511 CB GLU A 31 17.642 2.561 0.182 1.00 0.00 C ATOM 512 CG GLU A 31 18.982 3.259 -0.068 1.00 0.00 C ATOM 513 CD GLU A 31 18.906 4.702 0.433 1.00 0.00 C ATOM 514 OE1 GLU A 31 18.464 5.549 -0.325 1.00 0.00 O ATOM 515 OE2 GLU A 31 19.292 4.936 1.567 1.00 0.00 O ATOM 0 H GLU A 31 17.995 1.577 -2.136 1.00 0.00 H new ATOM 0 HA GLU A 31 18.564 0.673 0.595 1.00 0.00 H new ATOM 0 HB2 GLU A 31 16.877 2.975 -0.474 1.00 0.00 H new ATOM 0 HB3 GLU A 31 17.314 2.738 1.206 1.00 0.00 H new ATOM 0 HG2 GLU A 31 19.783 2.726 0.445 1.00 0.00 H new ATOM 0 HG3 GLU A 31 19.219 3.244 -1.132 1.00 0.00 H new ATOM 522 N LEU A 32 15.600 0.319 -0.761 1.00 0.00 N ATOM 523 CA LEU A 32 14.298 -0.372 -0.580 1.00 0.00 C ATOM 524 C LEU A 32 14.579 -1.841 -0.265 1.00 0.00 C ATOM 525 O LEU A 32 13.964 -2.418 0.610 1.00 0.00 O ATOM 526 CB LEU A 32 13.470 -0.235 -1.868 1.00 0.00 C ATOM 527 CG LEU A 32 12.277 -1.202 -1.870 1.00 0.00 C ATOM 528 CD1 LEU A 32 11.409 -0.974 -0.632 1.00 0.00 C ATOM 529 CD2 LEU A 32 11.438 -0.951 -3.123 1.00 0.00 C ATOM 0 H LEU A 32 15.739 0.746 -1.677 1.00 0.00 H new ATOM 0 HA LEU A 32 13.731 0.070 0.239 1.00 0.00 H new ATOM 0 HB2 LEU A 32 13.111 0.789 -1.965 1.00 0.00 H new ATOM 0 HB3 LEU A 32 14.103 -0.433 -2.733 1.00 0.00 H new ATOM 0 HG LEU A 32 12.646 -2.227 -1.861 1.00 0.00 H new ATOM 0 HD11 LEU A 32 10.567 -1.666 -0.646 1.00 0.00 H new ATOM 0 HD12 LEU A 32 12.004 -1.144 0.266 1.00 0.00 H new ATOM 0 HD13 LEU A 32 11.037 0.051 -0.632 1.00 0.00 H new ATOM 0 HD21 LEU A 32 10.588 -1.633 -3.134 1.00 0.00 H new ATOM 0 HD22 LEU A 32 11.078 0.078 -3.120 1.00 0.00 H new ATOM 0 HD23 LEU A 32 12.049 -1.119 -4.010 1.00 0.00 H new ATOM 541 N LYS A 33 15.487 -2.470 -0.965 1.00 0.00 N ATOM 542 CA LYS A 33 15.751 -3.903 -0.676 1.00 0.00 C ATOM 543 C LYS A 33 16.037 -4.052 0.815 1.00 0.00 C ATOM 544 O LYS A 33 15.367 -4.779 1.521 1.00 0.00 O ATOM 545 CB LYS A 33 16.955 -4.379 -1.491 1.00 0.00 C ATOM 546 CG LYS A 33 17.207 -5.865 -1.218 1.00 0.00 C ATOM 547 CD LYS A 33 18.152 -6.427 -2.284 1.00 0.00 C ATOM 548 CE LYS A 33 18.716 -7.769 -1.814 1.00 0.00 C ATOM 549 NZ LYS A 33 17.595 -8.696 -1.494 1.00 0.00 N ATOM 0 H LYS A 33 16.047 -2.058 -1.712 1.00 0.00 H new ATOM 0 HA LYS A 33 14.885 -4.507 -0.948 1.00 0.00 H new ATOM 0 HB2 LYS A 33 16.773 -4.220 -2.554 1.00 0.00 H new ATOM 0 HB3 LYS A 33 17.838 -3.796 -1.228 1.00 0.00 H new ATOM 0 HG2 LYS A 33 17.641 -5.995 -0.227 1.00 0.00 H new ATOM 0 HG3 LYS A 33 16.264 -6.412 -1.227 1.00 0.00 H new ATOM 0 HD2 LYS A 33 17.619 -6.555 -3.226 1.00 0.00 H new ATOM 0 HD3 LYS A 33 18.965 -5.725 -2.471 1.00 0.00 H new ATOM 0 HE2 LYS A 33 19.349 -8.201 -2.589 1.00 0.00 H new ATOM 0 HE3 LYS A 33 19.344 -7.624 -0.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 17.915 -9.679 -1.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 17.286 -8.541 -0.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 16.800 -8.516 -2.140 1.00 0.00 H new ATOM 563 N GLU A 34 17.027 -3.357 1.303 1.00 0.00 N ATOM 564 CA GLU A 34 17.344 -3.455 2.758 1.00 0.00 C ATOM 565 C GLU A 34 16.061 -3.213 3.561 1.00 0.00 C ATOM 566 O GLU A 34 15.817 -3.852 4.565 1.00 0.00 O ATOM 567 CB GLU A 34 18.385 -2.396 3.129 1.00 0.00 C ATOM 568 CG GLU A 34 19.657 -2.617 2.309 1.00 0.00 C ATOM 569 CD GLU A 34 20.777 -1.736 2.863 1.00 0.00 C ATOM 570 OE1 GLU A 34 21.468 -2.186 3.762 1.00 0.00 O ATOM 571 OE2 GLU A 34 20.925 -0.626 2.379 1.00 0.00 O ATOM 0 H GLU A 34 17.626 -2.731 0.765 1.00 0.00 H new ATOM 0 HA GLU A 34 17.743 -4.444 2.983 1.00 0.00 H new ATOM 0 HB2 GLU A 34 17.987 -1.399 2.940 1.00 0.00 H new ATOM 0 HB3 GLU A 34 18.612 -2.452 4.194 1.00 0.00 H new ATOM 0 HG2 GLU A 34 19.951 -3.666 2.349 1.00 0.00 H new ATOM 0 HG3 GLU A 34 19.474 -2.376 1.262 1.00 0.00 H new ATOM 578 N LEU A 35 15.238 -2.297 3.125 1.00 0.00 N ATOM 579 CA LEU A 35 13.971 -2.018 3.862 1.00 0.00 C ATOM 580 C LEU A 35 13.032 -3.227 3.748 1.00 0.00 C ATOM 581 O LEU A 35 12.361 -3.586 4.695 1.00 0.00 O ATOM 582 CB LEU A 35 13.302 -0.764 3.273 1.00 0.00 C ATOM 583 CG LEU A 35 12.371 -0.109 4.316 1.00 0.00 C ATOM 584 CD1 LEU A 35 13.173 0.824 5.233 1.00 0.00 C ATOM 585 CD2 LEU A 35 11.293 0.712 3.598 1.00 0.00 C ATOM 0 H LEU A 35 15.388 -1.730 2.291 1.00 0.00 H new ATOM 0 HA LEU A 35 14.190 -1.841 4.915 1.00 0.00 H new ATOM 0 HB2 LEU A 35 14.064 -0.051 2.959 1.00 0.00 H new ATOM 0 HB3 LEU A 35 12.731 -1.032 2.384 1.00 0.00 H new ATOM 0 HG LEU A 35 11.909 -0.895 4.913 1.00 0.00 H new ATOM 0 HD11 LEU A 35 12.504 1.279 5.964 1.00 0.00 H new ATOM 0 HD12 LEU A 35 13.942 0.251 5.752 1.00 0.00 H new ATOM 0 HD13 LEU A 35 13.643 1.605 4.636 1.00 0.00 H new ATOM 0 HD21 LEU A 35 10.636 1.174 4.335 1.00 0.00 H new ATOM 0 HD22 LEU A 35 11.767 1.488 2.997 1.00 0.00 H new ATOM 0 HD23 LEU A 35 10.709 0.058 2.951 1.00 0.00 H new ATOM 597 N ILE A 36 12.989 -3.870 2.612 1.00 0.00 N ATOM 598 CA ILE A 36 12.108 -5.066 2.457 1.00 0.00 C ATOM 599 C ILE A 36 12.520 -6.133 3.480 1.00 0.00 C ATOM 600 O ILE A 36 11.705 -6.901 3.952 1.00 0.00 O ATOM 601 CB ILE A 36 12.273 -5.617 1.023 1.00 0.00 C ATOM 602 CG1 ILE A 36 11.498 -4.713 0.051 1.00 0.00 C ATOM 603 CG2 ILE A 36 11.722 -7.048 0.928 1.00 0.00 C ATOM 604 CD1 ILE A 36 11.806 -5.092 -1.405 1.00 0.00 C ATOM 0 H ILE A 36 13.527 -3.619 1.782 1.00 0.00 H new ATOM 0 HA ILE A 36 11.066 -4.795 2.627 1.00 0.00 H new ATOM 0 HB ILE A 36 13.333 -5.632 0.767 1.00 0.00 H new ATOM 0 HG12 ILE A 36 10.428 -4.804 0.237 1.00 0.00 H new ATOM 0 HG13 ILE A 36 11.765 -3.671 0.225 1.00 0.00 H new ATOM 0 HG21 ILE A 36 11.847 -7.419 -0.089 1.00 0.00 H new ATOM 0 HG22 ILE A 36 12.264 -7.693 1.619 1.00 0.00 H new ATOM 0 HG23 ILE A 36 10.663 -7.048 1.187 1.00 0.00 H new ATOM 0 HD11 ILE A 36 11.247 -4.440 -2.077 1.00 0.00 H new ATOM 0 HD12 ILE A 36 12.874 -4.977 -1.593 1.00 0.00 H new ATOM 0 HD13 ILE A 36 11.516 -6.128 -1.580 1.00 0.00 H new ATOM 616 N ASN A 37 13.785 -6.214 3.788 1.00 0.00 N ATOM 617 CA ASN A 37 14.263 -7.262 4.736 1.00 0.00 C ATOM 618 C ASN A 37 13.742 -7.031 6.160 1.00 0.00 C ATOM 619 O ASN A 37 13.320 -7.956 6.825 1.00 0.00 O ATOM 620 CB ASN A 37 15.792 -7.249 4.761 1.00 0.00 C ATOM 621 CG ASN A 37 16.330 -7.785 3.432 1.00 0.00 C ATOM 622 OD1 ASN A 37 16.738 -8.926 3.345 1.00 0.00 O ATOM 623 ND2 ASN A 37 16.346 -7.004 2.386 1.00 0.00 N ATOM 0 H ASN A 37 14.511 -5.598 3.423 1.00 0.00 H new ATOM 0 HA ASN A 37 13.884 -8.224 4.391 1.00 0.00 H new ATOM 0 HB2 ASN A 37 16.155 -6.235 4.930 1.00 0.00 H new ATOM 0 HB3 ASN A 37 16.158 -7.860 5.586 1.00 0.00 H new ATOM 0 HD21 ASN A 37 16.701 -7.352 1.495 1.00 0.00 H new ATOM 0 HD22 ASN A 37 16.003 -6.046 2.459 1.00 0.00 H new ATOM 630 N ASN A 38 13.808 -5.822 6.657 1.00 0.00 N ATOM 631 CA ASN A 38 13.357 -5.566 8.064 1.00 0.00 C ATOM 632 C ASN A 38 11.865 -5.215 8.126 1.00 0.00 C ATOM 633 O ASN A 38 11.360 -4.880 9.179 1.00 0.00 O ATOM 634 CB ASN A 38 14.169 -4.408 8.648 1.00 0.00 C ATOM 635 CG ASN A 38 13.998 -4.378 10.167 1.00 0.00 C ATOM 636 OD1 ASN A 38 13.030 -3.844 10.670 1.00 0.00 O ATOM 637 ND2 ASN A 38 14.902 -4.934 10.925 1.00 0.00 N ATOM 0 H ASN A 38 14.152 -5.004 6.155 1.00 0.00 H new ATOM 0 HA ASN A 38 13.515 -6.477 8.641 1.00 0.00 H new ATOM 0 HB2 ASN A 38 15.222 -4.524 8.393 1.00 0.00 H new ATOM 0 HB3 ASN A 38 13.838 -3.464 8.216 1.00 0.00 H new ATOM 0 HD21 ASN A 38 14.796 -4.920 11.939 1.00 0.00 H new ATOM 0 HD22 ASN A 38 15.715 -5.383 10.503 1.00 0.00 H new ATOM 644 N GLU A 39 11.153 -5.275 7.025 1.00 0.00 N ATOM 645 CA GLU A 39 9.689 -4.926 7.050 1.00 0.00 C ATOM 646 C GLU A 39 8.851 -6.096 6.531 1.00 0.00 C ATOM 647 O GLU A 39 7.692 -6.230 6.874 1.00 0.00 O ATOM 648 CB GLU A 39 9.446 -3.707 6.156 1.00 0.00 C ATOM 649 CG GLU A 39 10.117 -2.475 6.770 1.00 0.00 C ATOM 650 CD GLU A 39 9.583 -1.212 6.092 1.00 0.00 C ATOM 651 OE1 GLU A 39 8.775 -1.346 5.187 1.00 0.00 O ATOM 652 OE2 GLU A 39 9.990 -0.133 6.489 1.00 0.00 O ATOM 0 H GLU A 39 11.517 -5.549 6.112 1.00 0.00 H new ATOM 0 HA GLU A 39 9.398 -4.707 8.077 1.00 0.00 H new ATOM 0 HB2 GLU A 39 9.844 -3.891 5.158 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.376 -3.533 6.045 1.00 0.00 H new ATOM 0 HG2 GLU A 39 9.920 -2.436 7.841 1.00 0.00 H new ATOM 0 HG3 GLU A 39 11.198 -2.537 6.647 1.00 0.00 H new ATOM 659 N LEU A 40 9.419 -6.944 5.710 1.00 0.00 N ATOM 660 CA LEU A 40 8.653 -8.112 5.164 1.00 0.00 C ATOM 661 C LEU A 40 9.332 -9.418 5.585 1.00 0.00 C ATOM 662 O LEU A 40 9.260 -10.418 4.898 1.00 0.00 O ATOM 663 CB LEU A 40 8.624 -8.018 3.635 1.00 0.00 C ATOM 664 CG LEU A 40 7.651 -6.901 3.192 1.00 0.00 C ATOM 665 CD1 LEU A 40 8.063 -6.365 1.816 1.00 0.00 C ATOM 666 CD2 LEU A 40 6.218 -7.448 3.107 1.00 0.00 C ATOM 0 H LEU A 40 10.386 -6.879 5.391 1.00 0.00 H new ATOM 0 HA LEU A 40 7.635 -8.098 5.554 1.00 0.00 H new ATOM 0 HB2 LEU A 40 9.625 -7.811 3.256 1.00 0.00 H new ATOM 0 HB3 LEU A 40 8.313 -8.972 3.210 1.00 0.00 H new ATOM 0 HG LEU A 40 7.689 -6.097 3.927 1.00 0.00 H new ATOM 0 HD11 LEU A 40 7.373 -5.578 1.510 1.00 0.00 H new ATOM 0 HD12 LEU A 40 9.074 -5.960 1.871 1.00 0.00 H new ATOM 0 HD13 LEU A 40 8.036 -7.175 1.087 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.543 -6.652 2.794 1.00 0.00 H new ATOM 0 HD22 LEU A 40 6.181 -8.261 2.382 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.912 -7.820 4.085 1.00 0.00 H new ATOM 678 N SER A 41 9.992 -9.414 6.712 1.00 0.00 N ATOM 679 CA SER A 41 10.677 -10.650 7.185 1.00 0.00 C ATOM 680 C SER A 41 9.634 -11.666 7.657 1.00 0.00 C ATOM 681 O SER A 41 9.628 -12.804 7.231 1.00 0.00 O ATOM 682 CB SER A 41 11.609 -10.300 8.350 1.00 0.00 C ATOM 683 OG SER A 41 10.890 -10.399 9.574 1.00 0.00 O ATOM 0 H SER A 41 10.086 -8.605 7.327 1.00 0.00 H new ATOM 0 HA SER A 41 11.257 -11.079 6.368 1.00 0.00 H new ATOM 0 HB2 SER A 41 12.464 -10.975 8.362 1.00 0.00 H new ATOM 0 HB3 SER A 41 12.001 -9.291 8.226 1.00 0.00 H new ATOM 0 HG SER A 41 11.484 -10.177 10.321 1.00 0.00 H new ATOM 689 N HIS A 42 8.758 -11.270 8.540 1.00 0.00 N ATOM 690 CA HIS A 42 7.725 -12.217 9.047 1.00 0.00 C ATOM 691 C HIS A 42 6.945 -12.819 7.876 1.00 0.00 C ATOM 692 O HIS A 42 6.783 -14.019 7.779 1.00 0.00 O ATOM 693 CB HIS A 42 6.761 -11.465 9.965 1.00 0.00 C ATOM 694 CG HIS A 42 5.845 -12.444 10.645 1.00 0.00 C ATOM 695 ND1 HIS A 42 6.324 -13.484 11.425 1.00 0.00 N ATOM 696 CD2 HIS A 42 4.477 -12.552 10.673 1.00 0.00 C ATOM 697 CE1 HIS A 42 5.260 -14.167 11.886 1.00 0.00 C ATOM 698 NE2 HIS A 42 4.110 -13.641 11.457 1.00 0.00 N ATOM 0 H HIS A 42 8.713 -10.330 8.933 1.00 0.00 H new ATOM 0 HA HIS A 42 8.214 -13.020 9.599 1.00 0.00 H new ATOM 0 HB2 HIS A 42 7.320 -10.897 10.709 1.00 0.00 H new ATOM 0 HB3 HIS A 42 6.178 -10.747 9.388 1.00 0.00 H new ATOM 0 HD2 HIS A 42 3.790 -11.892 10.164 1.00 0.00 H new ATOM 0 HE1 HIS A 42 5.328 -15.035 12.525 1.00 0.00 H new ATOM 0 HE2 HIS A 42 3.165 -13.968 11.660 1.00 0.00 H new ATOM 706 N PHE A 43 6.457 -11.996 6.989 1.00 0.00 N ATOM 707 CA PHE A 43 5.684 -12.528 5.831 1.00 0.00 C ATOM 708 C PHE A 43 6.582 -13.444 4.998 1.00 0.00 C ATOM 709 O PHE A 43 6.122 -14.368 4.357 1.00 0.00 O ATOM 710 CB PHE A 43 5.188 -11.363 4.973 1.00 0.00 C ATOM 711 CG PHE A 43 4.143 -10.590 5.742 1.00 0.00 C ATOM 712 CD1 PHE A 43 2.833 -11.077 5.823 1.00 0.00 C ATOM 713 CD2 PHE A 43 4.484 -9.392 6.380 1.00 0.00 C ATOM 714 CE1 PHE A 43 1.865 -10.365 6.541 1.00 0.00 C ATOM 715 CE2 PHE A 43 3.516 -8.680 7.097 1.00 0.00 C ATOM 716 CZ PHE A 43 2.206 -9.166 7.178 1.00 0.00 C ATOM 0 H PHE A 43 6.559 -10.982 7.015 1.00 0.00 H new ATOM 0 HA PHE A 43 4.827 -13.098 6.191 1.00 0.00 H new ATOM 0 HB2 PHE A 43 6.020 -10.710 4.709 1.00 0.00 H new ATOM 0 HB3 PHE A 43 4.768 -11.736 4.039 1.00 0.00 H new ATOM 0 HD1 PHE A 43 2.569 -12.002 5.332 1.00 0.00 H new ATOM 0 HD2 PHE A 43 5.495 -9.017 6.319 1.00 0.00 H new ATOM 0 HE1 PHE A 43 0.854 -10.741 6.604 1.00 0.00 H new ATOM 0 HE2 PHE A 43 3.780 -7.755 7.588 1.00 0.00 H new ATOM 0 HZ PHE A 43 1.459 -8.617 7.731 1.00 0.00 H new ATOM 726 N LEU A 44 7.860 -13.187 4.999 1.00 0.00 N ATOM 727 CA LEU A 44 8.799 -14.030 4.205 1.00 0.00 C ATOM 728 C LEU A 44 8.517 -15.514 4.481 1.00 0.00 C ATOM 729 O LEU A 44 8.744 -16.366 3.646 1.00 0.00 O ATOM 730 CB LEU A 44 10.245 -13.673 4.611 1.00 0.00 C ATOM 731 CG LEU A 44 11.195 -13.799 3.412 1.00 0.00 C ATOM 732 CD1 LEU A 44 12.629 -13.517 3.872 1.00 0.00 C ATOM 733 CD2 LEU A 44 11.115 -15.215 2.826 1.00 0.00 C ATOM 0 H LEU A 44 8.297 -12.426 5.518 1.00 0.00 H new ATOM 0 HA LEU A 44 8.664 -13.845 3.139 1.00 0.00 H new ATOM 0 HB2 LEU A 44 10.277 -12.656 5.001 1.00 0.00 H new ATOM 0 HB3 LEU A 44 10.576 -14.333 5.413 1.00 0.00 H new ATOM 0 HG LEU A 44 10.905 -13.080 2.646 1.00 0.00 H new ATOM 0 HD11 LEU A 44 13.307 -13.605 3.023 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.688 -12.508 4.280 1.00 0.00 H new ATOM 0 HD13 LEU A 44 12.913 -14.237 4.640 1.00 0.00 H new ATOM 0 HD21 LEU A 44 11.792 -15.296 1.976 1.00 0.00 H new ATOM 0 HD22 LEU A 44 11.401 -15.941 3.588 1.00 0.00 H new ATOM 0 HD23 LEU A 44 10.095 -15.416 2.498 1.00 0.00 H new ATOM 745 N GLU A 45 8.031 -15.829 5.649 1.00 0.00 N ATOM 746 CA GLU A 45 7.748 -17.255 5.979 1.00 0.00 C ATOM 747 C GLU A 45 6.419 -17.693 5.358 1.00 0.00 C ATOM 748 O GLU A 45 6.286 -18.797 4.868 1.00 0.00 O ATOM 749 CB GLU A 45 7.672 -17.415 7.499 1.00 0.00 C ATOM 750 CG GLU A 45 8.999 -16.983 8.126 1.00 0.00 C ATOM 751 CD GLU A 45 10.086 -17.999 7.773 1.00 0.00 C ATOM 752 OE1 GLU A 45 9.785 -19.182 7.770 1.00 0.00 O ATOM 753 OE2 GLU A 45 11.201 -17.578 7.512 1.00 0.00 O ATOM 0 H GLU A 45 7.817 -15.161 6.390 1.00 0.00 H new ATOM 0 HA GLU A 45 8.548 -17.877 5.577 1.00 0.00 H new ATOM 0 HB2 GLU A 45 6.856 -16.812 7.898 1.00 0.00 H new ATOM 0 HB3 GLU A 45 7.457 -18.452 7.756 1.00 0.00 H new ATOM 0 HG2 GLU A 45 9.280 -15.994 7.764 1.00 0.00 H new ATOM 0 HG3 GLU A 45 8.894 -16.908 9.208 1.00 0.00 H new ATOM 760 N GLU A 46 5.428 -16.847 5.392 1.00 0.00 N ATOM 761 CA GLU A 46 4.098 -17.226 4.824 1.00 0.00 C ATOM 762 C GLU A 46 4.065 -16.977 3.312 1.00 0.00 C ATOM 763 O GLU A 46 3.222 -16.253 2.819 1.00 0.00 O ATOM 764 CB GLU A 46 3.005 -16.387 5.492 1.00 0.00 C ATOM 765 CG GLU A 46 3.102 -16.531 7.013 1.00 0.00 C ATOM 766 CD GLU A 46 2.144 -15.543 7.680 1.00 0.00 C ATOM 767 OE1 GLU A 46 1.714 -14.619 7.009 1.00 0.00 O ATOM 768 OE2 GLU A 46 1.857 -15.726 8.852 1.00 0.00 O ATOM 0 H GLU A 46 5.478 -15.908 5.788 1.00 0.00 H new ATOM 0 HA GLU A 46 3.928 -18.286 5.011 1.00 0.00 H new ATOM 0 HB2 GLU A 46 3.112 -15.340 5.208 1.00 0.00 H new ATOM 0 HB3 GLU A 46 2.023 -16.711 5.148 1.00 0.00 H new ATOM 0 HG2 GLU A 46 2.855 -17.550 7.309 1.00 0.00 H new ATOM 0 HG3 GLU A 46 4.124 -16.342 7.343 1.00 0.00 H new ATOM 775 N ILE A 47 4.965 -17.580 2.569 1.00 0.00 N ATOM 776 CA ILE A 47 4.979 -17.394 1.079 1.00 0.00 C ATOM 777 C ILE A 47 5.006 -18.766 0.394 1.00 0.00 C ATOM 778 O ILE A 47 5.854 -19.593 0.664 1.00 0.00 O ATOM 779 CB ILE A 47 6.211 -16.568 0.677 1.00 0.00 C ATOM 780 CG1 ILE A 47 5.978 -15.108 1.090 1.00 0.00 C ATOM 781 CG2 ILE A 47 6.422 -16.648 -0.844 1.00 0.00 C ATOM 782 CD1 ILE A 47 7.235 -14.276 0.832 1.00 0.00 C ATOM 0 H ILE A 47 5.693 -18.195 2.931 1.00 0.00 H new ATOM 0 HA ILE A 47 4.082 -16.861 0.764 1.00 0.00 H new ATOM 0 HB ILE A 47 7.097 -16.961 1.175 1.00 0.00 H new ATOM 0 HG12 ILE A 47 5.139 -14.694 0.531 1.00 0.00 H new ATOM 0 HG13 ILE A 47 5.712 -15.060 2.146 1.00 0.00 H new ATOM 0 HG21 ILE A 47 7.297 -16.060 -1.121 1.00 0.00 H new ATOM 0 HG22 ILE A 47 6.575 -17.687 -1.136 1.00 0.00 H new ATOM 0 HG23 ILE A 47 5.543 -16.254 -1.354 1.00 0.00 H new ATOM 0 HD11 ILE A 47 7.055 -13.243 1.130 1.00 0.00 H new ATOM 0 HD12 ILE A 47 8.065 -14.681 1.411 1.00 0.00 H new ATOM 0 HD13 ILE A 47 7.482 -14.310 -0.229 1.00 0.00 H new ATOM 794 N LYS A 48 4.081 -19.004 -0.499 1.00 0.00 N ATOM 795 CA LYS A 48 4.036 -20.311 -1.222 1.00 0.00 C ATOM 796 C LYS A 48 4.813 -20.189 -2.539 1.00 0.00 C ATOM 797 O LYS A 48 5.757 -20.914 -2.783 1.00 0.00 O ATOM 798 CB LYS A 48 2.573 -20.672 -1.524 1.00 0.00 C ATOM 799 CG LYS A 48 1.922 -21.290 -0.281 1.00 0.00 C ATOM 800 CD LYS A 48 2.090 -20.347 0.910 1.00 0.00 C ATOM 801 CE LYS A 48 1.159 -20.786 2.043 1.00 0.00 C ATOM 802 NZ LYS A 48 1.512 -22.170 2.470 1.00 0.00 N ATOM 0 H LYS A 48 3.349 -18.344 -0.761 1.00 0.00 H new ATOM 0 HA LYS A 48 4.485 -21.089 -0.604 1.00 0.00 H new ATOM 0 HB2 LYS A 48 2.024 -19.780 -1.828 1.00 0.00 H new ATOM 0 HB3 LYS A 48 2.527 -21.374 -2.357 1.00 0.00 H new ATOM 0 HG2 LYS A 48 0.864 -21.473 -0.466 1.00 0.00 H new ATOM 0 HG3 LYS A 48 2.379 -22.255 -0.061 1.00 0.00 H new ATOM 0 HD2 LYS A 48 3.125 -20.356 1.251 1.00 0.00 H new ATOM 0 HD3 LYS A 48 1.861 -19.324 0.613 1.00 0.00 H new ATOM 0 HE2 LYS A 48 1.247 -20.101 2.886 1.00 0.00 H new ATOM 0 HE3 LYS A 48 0.122 -20.750 1.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 1.080 -22.369 3.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 1.157 -22.851 1.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 2.546 -22.257 2.544 1.00 0.00 H new ATOM 816 N GLU A 49 4.420 -19.279 -3.390 1.00 0.00 N ATOM 817 CA GLU A 49 5.133 -19.115 -4.691 1.00 0.00 C ATOM 818 C GLU A 49 6.505 -18.477 -4.454 1.00 0.00 C ATOM 819 O GLU A 49 6.609 -17.304 -4.155 1.00 0.00 O ATOM 820 CB GLU A 49 4.305 -18.218 -5.613 1.00 0.00 C ATOM 821 CG GLU A 49 2.956 -18.884 -5.903 1.00 0.00 C ATOM 822 CD GLU A 49 2.301 -18.215 -7.113 1.00 0.00 C ATOM 823 OE1 GLU A 49 1.790 -17.118 -6.956 1.00 0.00 O ATOM 824 OE2 GLU A 49 2.321 -18.812 -8.177 1.00 0.00 O ATOM 0 H GLU A 49 3.637 -18.643 -3.241 1.00 0.00 H new ATOM 0 HA GLU A 49 5.268 -20.092 -5.155 1.00 0.00 H new ATOM 0 HB2 GLU A 49 4.149 -17.245 -5.146 1.00 0.00 H new ATOM 0 HB3 GLU A 49 4.843 -18.042 -6.545 1.00 0.00 H new ATOM 0 HG2 GLU A 49 3.098 -19.947 -6.096 1.00 0.00 H new ATOM 0 HG3 GLU A 49 2.304 -18.802 -5.033 1.00 0.00 H new ATOM 831 N GLN A 50 7.559 -19.235 -4.598 1.00 0.00 N ATOM 832 CA GLN A 50 8.926 -18.667 -4.398 1.00 0.00 C ATOM 833 C GLN A 50 9.390 -17.989 -5.691 1.00 0.00 C ATOM 834 O GLN A 50 10.245 -17.124 -5.677 1.00 0.00 O ATOM 835 CB GLN A 50 9.893 -19.795 -4.034 1.00 0.00 C ATOM 836 CG GLN A 50 9.540 -20.340 -2.648 1.00 0.00 C ATOM 837 CD GLN A 50 10.550 -21.417 -2.246 1.00 0.00 C ATOM 838 OE1 GLN A 50 11.066 -21.403 -1.146 1.00 0.00 O ATOM 839 NE2 GLN A 50 10.857 -22.358 -3.098 1.00 0.00 N ATOM 0 H GLN A 50 7.533 -20.224 -4.846 1.00 0.00 H new ATOM 0 HA GLN A 50 8.904 -17.933 -3.593 1.00 0.00 H new ATOM 0 HB2 GLN A 50 9.835 -20.592 -4.776 1.00 0.00 H new ATOM 0 HB3 GLN A 50 10.919 -19.426 -4.041 1.00 0.00 H new ATOM 0 HG2 GLN A 50 9.545 -19.532 -1.917 1.00 0.00 H new ATOM 0 HG3 GLN A 50 8.533 -20.757 -2.656 1.00 0.00 H new ATOM 0 HE21 GLN A 50 10.424 -22.371 -4.022 1.00 0.00 H new ATOM 0 HE22 GLN A 50 11.529 -23.080 -2.840 1.00 0.00 H new ATOM 848 N GLU A 51 8.837 -18.374 -6.809 1.00 0.00 N ATOM 849 CA GLU A 51 9.248 -17.750 -8.100 1.00 0.00 C ATOM 850 C GLU A 51 8.698 -16.324 -8.189 1.00 0.00 C ATOM 851 O GLU A 51 9.220 -15.502 -8.915 1.00 0.00 O ATOM 852 CB GLU A 51 8.746 -18.588 -9.278 1.00 0.00 C ATOM 853 CG GLU A 51 7.250 -18.860 -9.111 1.00 0.00 C ATOM 854 CD GLU A 51 6.672 -19.377 -10.429 1.00 0.00 C ATOM 855 OE1 GLU A 51 7.407 -19.414 -11.402 1.00 0.00 O ATOM 856 OE2 GLU A 51 5.503 -19.726 -10.443 1.00 0.00 O ATOM 0 H GLU A 51 8.118 -19.094 -6.885 1.00 0.00 H new ATOM 0 HA GLU A 51 10.336 -17.711 -8.143 1.00 0.00 H new ATOM 0 HB2 GLU A 51 8.928 -18.063 -10.215 1.00 0.00 H new ATOM 0 HB3 GLU A 51 9.294 -19.529 -9.328 1.00 0.00 H new ATOM 0 HG2 GLU A 51 7.089 -19.592 -8.320 1.00 0.00 H new ATOM 0 HG3 GLU A 51 6.736 -17.947 -8.810 1.00 0.00 H new ATOM 863 N VAL A 52 7.686 -16.000 -7.435 1.00 0.00 N ATOM 864 CA VAL A 52 7.170 -14.602 -7.466 1.00 0.00 C ATOM 865 C VAL A 52 8.191 -13.715 -6.756 1.00 0.00 C ATOM 866 O VAL A 52 8.563 -12.669 -7.249 1.00 0.00 O ATOM 867 CB VAL A 52 5.829 -14.533 -6.724 1.00 0.00 C ATOM 868 CG1 VAL A 52 5.428 -13.071 -6.504 1.00 0.00 C ATOM 869 CG2 VAL A 52 4.750 -15.230 -7.552 1.00 0.00 C ATOM 0 H VAL A 52 7.197 -16.635 -6.804 1.00 0.00 H new ATOM 0 HA VAL A 52 7.021 -14.271 -8.494 1.00 0.00 H new ATOM 0 HB VAL A 52 5.932 -15.029 -5.759 1.00 0.00 H new ATOM 0 HG11 VAL A 52 4.475 -13.031 -5.977 1.00 0.00 H new ATOM 0 HG12 VAL A 52 6.193 -12.569 -5.911 1.00 0.00 H new ATOM 0 HG13 VAL A 52 5.331 -12.571 -7.468 1.00 0.00 H new ATOM 0 HG21 VAL A 52 3.798 -15.181 -7.024 1.00 0.00 H new ATOM 0 HG22 VAL A 52 4.656 -14.734 -8.518 1.00 0.00 H new ATOM 0 HG23 VAL A 52 5.026 -16.273 -7.705 1.00 0.00 H new ATOM 879 N VAL A 53 8.651 -14.116 -5.606 1.00 0.00 N ATOM 880 CA VAL A 53 9.647 -13.285 -4.879 1.00 0.00 C ATOM 881 C VAL A 53 10.916 -13.156 -5.723 1.00 0.00 C ATOM 882 O VAL A 53 11.608 -12.158 -5.678 1.00 0.00 O ATOM 883 CB VAL A 53 9.990 -13.959 -3.550 1.00 0.00 C ATOM 884 CG1 VAL A 53 11.063 -13.145 -2.824 1.00 0.00 C ATOM 885 CG2 VAL A 53 8.736 -14.034 -2.678 1.00 0.00 C ATOM 0 H VAL A 53 8.381 -14.982 -5.139 1.00 0.00 H new ATOM 0 HA VAL A 53 9.231 -12.295 -4.693 1.00 0.00 H new ATOM 0 HB VAL A 53 10.364 -14.965 -3.741 1.00 0.00 H new ATOM 0 HG11 VAL A 53 11.306 -13.627 -1.877 1.00 0.00 H new ATOM 0 HG12 VAL A 53 11.958 -13.089 -3.443 1.00 0.00 H new ATOM 0 HG13 VAL A 53 10.690 -12.139 -2.634 1.00 0.00 H new ATOM 0 HG21 VAL A 53 8.980 -14.514 -1.730 1.00 0.00 H new ATOM 0 HG22 VAL A 53 8.363 -13.027 -2.489 1.00 0.00 H new ATOM 0 HG23 VAL A 53 7.970 -14.614 -3.192 1.00 0.00 H new ATOM 895 N ASP A 54 11.233 -14.170 -6.482 1.00 0.00 N ATOM 896 CA ASP A 54 12.464 -14.124 -7.320 1.00 0.00 C ATOM 897 C ASP A 54 12.365 -12.996 -8.351 1.00 0.00 C ATOM 898 O ASP A 54 13.302 -12.250 -8.555 1.00 0.00 O ATOM 899 CB ASP A 54 12.628 -15.459 -8.049 1.00 0.00 C ATOM 900 CG ASP A 54 13.980 -15.487 -8.764 1.00 0.00 C ATOM 901 OD1 ASP A 54 14.771 -14.588 -8.530 1.00 0.00 O ATOM 902 OD2 ASP A 54 14.201 -16.406 -9.534 1.00 0.00 O ATOM 0 H ASP A 54 10.690 -15.030 -6.557 1.00 0.00 H new ATOM 0 HA ASP A 54 13.324 -13.941 -6.676 1.00 0.00 H new ATOM 0 HB2 ASP A 54 12.563 -16.284 -7.339 1.00 0.00 H new ATOM 0 HB3 ASP A 54 11.821 -15.594 -8.769 1.00 0.00 H new ATOM 907 N LYS A 55 11.247 -12.880 -9.022 1.00 0.00 N ATOM 908 CA LYS A 55 11.112 -11.813 -10.058 1.00 0.00 C ATOM 909 C LYS A 55 11.059 -10.437 -9.392 1.00 0.00 C ATOM 910 O LYS A 55 11.449 -9.448 -9.980 1.00 0.00 O ATOM 911 CB LYS A 55 9.847 -12.047 -10.890 1.00 0.00 C ATOM 912 CG LYS A 55 9.994 -13.328 -11.733 1.00 0.00 C ATOM 913 CD LYS A 55 10.715 -13.015 -13.052 1.00 0.00 C ATOM 914 CE LYS A 55 10.787 -14.280 -13.913 1.00 0.00 C ATOM 915 NZ LYS A 55 11.865 -15.170 -13.398 1.00 0.00 N ATOM 0 H LYS A 55 10.427 -13.474 -8.898 1.00 0.00 H new ATOM 0 HA LYS A 55 11.979 -11.849 -10.718 1.00 0.00 H new ATOM 0 HB2 LYS A 55 8.982 -12.133 -10.233 1.00 0.00 H new ATOM 0 HB3 LYS A 55 9.669 -11.192 -11.542 1.00 0.00 H new ATOM 0 HG2 LYS A 55 10.553 -14.078 -11.174 1.00 0.00 H new ATOM 0 HG3 LYS A 55 9.011 -13.751 -11.939 1.00 0.00 H new ATOM 0 HD2 LYS A 55 10.186 -12.228 -13.589 1.00 0.00 H new ATOM 0 HD3 LYS A 55 11.720 -12.643 -12.849 1.00 0.00 H new ATOM 0 HE2 LYS A 55 9.830 -14.801 -13.893 1.00 0.00 H new ATOM 0 HE3 LYS A 55 10.984 -14.015 -14.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 11.937 -16.013 -14.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 12.771 -14.659 -13.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 11.641 -15.460 -12.425 1.00 0.00 H new ATOM 929 N VAL A 56 10.620 -10.355 -8.167 1.00 0.00 N ATOM 930 CA VAL A 56 10.598 -9.033 -7.481 1.00 0.00 C ATOM 931 C VAL A 56 12.040 -8.556 -7.305 1.00 0.00 C ATOM 932 O VAL A 56 12.409 -7.483 -7.740 1.00 0.00 O ATOM 933 CB VAL A 56 9.942 -9.190 -6.108 1.00 0.00 C ATOM 934 CG1 VAL A 56 10.077 -7.884 -5.321 1.00 0.00 C ATOM 935 CG2 VAL A 56 8.459 -9.518 -6.293 1.00 0.00 C ATOM 0 H VAL A 56 10.278 -11.141 -7.614 1.00 0.00 H new ATOM 0 HA VAL A 56 10.034 -8.310 -8.070 1.00 0.00 H new ATOM 0 HB VAL A 56 10.433 -9.995 -5.561 1.00 0.00 H new ATOM 0 HG11 VAL A 56 9.609 -7.998 -4.343 1.00 0.00 H new ATOM 0 HG12 VAL A 56 11.132 -7.644 -5.192 1.00 0.00 H new ATOM 0 HG13 VAL A 56 9.586 -7.078 -5.866 1.00 0.00 H new ATOM 0 HG21 VAL A 56 7.987 -9.631 -5.317 1.00 0.00 H new ATOM 0 HG22 VAL A 56 7.973 -8.710 -6.840 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.359 -10.447 -6.854 1.00 0.00 H new ATOM 945 N MET A 57 12.857 -9.345 -6.664 1.00 0.00 N ATOM 946 CA MET A 57 14.274 -8.938 -6.454 1.00 0.00 C ATOM 947 C MET A 57 14.911 -8.554 -7.790 1.00 0.00 C ATOM 948 O MET A 57 15.831 -7.762 -7.838 1.00 0.00 O ATOM 949 CB MET A 57 15.050 -10.098 -5.829 1.00 0.00 C ATOM 950 CG MET A 57 14.552 -10.340 -4.403 1.00 0.00 C ATOM 951 SD MET A 57 15.129 -9.005 -3.325 1.00 0.00 S ATOM 952 CE MET A 57 14.336 -9.585 -1.805 1.00 0.00 C ATOM 0 H MET A 57 12.604 -10.254 -6.277 1.00 0.00 H new ATOM 0 HA MET A 57 14.304 -8.077 -5.786 1.00 0.00 H new ATOM 0 HB2 MET A 57 14.921 -11.000 -6.428 1.00 0.00 H new ATOM 0 HB3 MET A 57 16.116 -9.872 -5.819 1.00 0.00 H new ATOM 0 HG2 MET A 57 13.463 -10.387 -4.390 1.00 0.00 H new ATOM 0 HG3 MET A 57 14.917 -11.300 -4.037 1.00 0.00 H new ATOM 0 HE1 MET A 57 14.563 -8.897 -0.991 1.00 0.00 H new ATOM 0 HE2 MET A 57 13.257 -9.630 -1.952 1.00 0.00 H new ATOM 0 HE3 MET A 57 14.710 -10.578 -1.556 1.00 0.00 H new ATOM 962 N GLU A 58 14.419 -9.078 -8.885 1.00 0.00 N ATOM 963 CA GLU A 58 14.990 -8.703 -10.215 1.00 0.00 C ATOM 964 C GLU A 58 14.289 -7.444 -10.728 1.00 0.00 C ATOM 965 O GLU A 58 14.898 -6.611 -11.370 1.00 0.00 O ATOM 966 CB GLU A 58 14.823 -9.853 -11.210 1.00 0.00 C ATOM 967 CG GLU A 58 15.884 -10.921 -10.938 1.00 0.00 C ATOM 968 CD GLU A 58 17.253 -10.413 -11.396 1.00 0.00 C ATOM 969 OE1 GLU A 58 17.286 -9.533 -12.241 1.00 0.00 O ATOM 970 OE2 GLU A 58 18.246 -10.912 -10.893 1.00 0.00 O ATOM 0 H GLU A 58 13.649 -9.747 -8.916 1.00 0.00 H new ATOM 0 HA GLU A 58 16.056 -8.502 -10.107 1.00 0.00 H new ATOM 0 HB2 GLU A 58 13.826 -10.284 -11.120 1.00 0.00 H new ATOM 0 HB3 GLU A 58 14.918 -9.482 -12.230 1.00 0.00 H new ATOM 0 HG2 GLU A 58 15.910 -11.159 -9.875 1.00 0.00 H new ATOM 0 HG3 GLU A 58 15.632 -11.841 -11.465 1.00 0.00 H new ATOM 977 N THR A 59 13.027 -7.278 -10.443 1.00 0.00 N ATOM 978 CA THR A 59 12.336 -6.049 -10.918 1.00 0.00 C ATOM 979 C THR A 59 12.900 -4.859 -10.144 1.00 0.00 C ATOM 980 O THR A 59 13.293 -3.871 -10.731 1.00 0.00 O ATOM 981 CB THR A 59 10.823 -6.168 -10.706 1.00 0.00 C ATOM 982 OG1 THR A 59 10.409 -7.493 -11.010 1.00 0.00 O ATOM 983 CG2 THR A 59 10.096 -5.183 -11.625 1.00 0.00 C ATOM 0 H THR A 59 12.452 -7.930 -9.910 1.00 0.00 H new ATOM 0 HA THR A 59 12.506 -5.911 -11.986 1.00 0.00 H new ATOM 0 HB THR A 59 10.582 -5.938 -9.668 1.00 0.00 H new ATOM 0 HG1 THR A 59 10.511 -8.058 -10.216 1.00 0.00 H new ATOM 0 HG21 THR A 59 9.020 -5.269 -11.473 1.00 0.00 H new ATOM 0 HG22 THR A 59 10.415 -4.167 -11.394 1.00 0.00 H new ATOM 0 HG23 THR A 59 10.335 -5.411 -12.664 1.00 0.00 H new ATOM 991 N LEU A 60 12.996 -4.941 -8.847 1.00 0.00 N ATOM 992 CA LEU A 60 13.597 -3.807 -8.095 1.00 0.00 C ATOM 993 C LEU A 60 15.013 -3.593 -8.629 1.00 0.00 C ATOM 994 O LEU A 60 15.357 -2.523 -9.087 1.00 0.00 O ATOM 995 CB LEU A 60 13.657 -4.157 -6.597 1.00 0.00 C ATOM 996 CG LEU A 60 12.341 -3.772 -5.916 1.00 0.00 C ATOM 997 CD1 LEU A 60 11.188 -4.543 -6.559 1.00 0.00 C ATOM 998 CD2 LEU A 60 12.419 -4.114 -4.426 1.00 0.00 C ATOM 0 H LEU A 60 12.689 -5.733 -8.282 1.00 0.00 H new ATOM 0 HA LEU A 60 13.000 -2.904 -8.221 1.00 0.00 H new ATOM 0 HB2 LEU A 60 13.842 -5.224 -6.472 1.00 0.00 H new ATOM 0 HB3 LEU A 60 14.487 -3.632 -6.125 1.00 0.00 H new ATOM 0 HG LEU A 60 12.170 -2.702 -6.034 1.00 0.00 H new ATOM 0 HD11 LEU A 60 10.251 -4.268 -6.074 1.00 0.00 H new ATOM 0 HD12 LEU A 60 11.133 -4.297 -7.620 1.00 0.00 H new ATOM 0 HD13 LEU A 60 11.357 -5.614 -6.443 1.00 0.00 H new ATOM 0 HD21 LEU A 60 11.482 -3.840 -3.940 1.00 0.00 H new ATOM 0 HD22 LEU A 60 12.590 -5.184 -4.307 1.00 0.00 H new ATOM 0 HD23 LEU A 60 13.240 -3.562 -3.968 1.00 0.00 H new ATOM 1010 N ASP A 61 15.835 -4.607 -8.583 1.00 0.00 N ATOM 1011 CA ASP A 61 17.222 -4.459 -9.098 1.00 0.00 C ATOM 1012 C ASP A 61 17.175 -3.853 -10.502 1.00 0.00 C ATOM 1013 O ASP A 61 18.128 -3.256 -10.962 1.00 0.00 O ATOM 1014 CB ASP A 61 17.890 -5.834 -9.155 1.00 0.00 C ATOM 1015 CG ASP A 61 19.386 -5.666 -9.426 1.00 0.00 C ATOM 1016 OD1 ASP A 61 20.128 -5.515 -8.470 1.00 0.00 O ATOM 1017 OD2 ASP A 61 19.764 -5.693 -10.586 1.00 0.00 O ATOM 0 H ASP A 61 15.604 -5.529 -8.211 1.00 0.00 H new ATOM 0 HA ASP A 61 17.793 -3.806 -8.438 1.00 0.00 H new ATOM 0 HB2 ASP A 61 17.738 -6.363 -8.214 1.00 0.00 H new ATOM 0 HB3 ASP A 61 17.434 -6.439 -9.938 1.00 0.00 H new ATOM 1022 N GLU A 62 16.065 -4.002 -11.188 1.00 0.00 N ATOM 1023 CA GLU A 62 15.940 -3.438 -12.571 1.00 0.00 C ATOM 1024 C GLU A 62 15.121 -2.155 -12.522 1.00 0.00 C ATOM 1025 O GLU A 62 14.306 -1.876 -13.379 1.00 0.00 O ATOM 1026 CB GLU A 62 15.234 -4.422 -13.453 1.00 0.00 C ATOM 1027 CG GLU A 62 16.151 -5.606 -13.759 1.00 0.00 C ATOM 1028 CD GLU A 62 17.224 -5.174 -14.760 1.00 0.00 C ATOM 1029 OE1 GLU A 62 16.870 -4.895 -15.894 1.00 0.00 O ATOM 1030 OE2 GLU A 62 18.381 -5.129 -14.375 1.00 0.00 O ATOM 0 H GLU A 62 15.238 -4.492 -10.848 1.00 0.00 H new ATOM 0 HA GLU A 62 16.935 -3.233 -12.965 1.00 0.00 H new ATOM 0 HB2 GLU A 62 14.325 -4.773 -12.965 1.00 0.00 H new ATOM 0 HB3 GLU A 62 14.931 -3.938 -14.381 1.00 0.00 H new ATOM 0 HG2 GLU A 62 16.618 -5.965 -12.842 1.00 0.00 H new ATOM 0 HG3 GLU A 62 15.570 -6.434 -14.166 1.00 0.00 H new ATOM 1037 N ASP A 63 15.357 -1.387 -11.531 1.00 0.00 N ATOM 1038 CA ASP A 63 14.637 -0.090 -11.364 1.00 0.00 C ATOM 1039 C ASP A 63 14.583 0.643 -12.704 1.00 0.00 C ATOM 1040 O ASP A 63 13.603 1.276 -13.045 1.00 0.00 O ATOM 1041 CB ASP A 63 15.439 0.775 -10.380 1.00 0.00 C ATOM 1042 CG ASP A 63 14.824 2.176 -10.302 1.00 0.00 C ATOM 1043 OD1 ASP A 63 13.694 2.331 -10.734 1.00 0.00 O ATOM 1044 OD2 ASP A 63 15.495 3.070 -9.811 1.00 0.00 O ATOM 0 H ASP A 63 16.035 -1.592 -10.797 1.00 0.00 H new ATOM 0 HA ASP A 63 13.625 -0.271 -11.001 1.00 0.00 H new ATOM 0 HB2 ASP A 63 15.441 0.313 -9.393 1.00 0.00 H new ATOM 0 HB3 ASP A 63 16.478 0.841 -10.703 1.00 0.00 H new ATOM 1049 N GLY A 64 15.625 0.521 -13.474 1.00 0.00 N ATOM 1050 CA GLY A 64 15.671 1.163 -14.823 1.00 0.00 C ATOM 1051 C GLY A 64 15.341 2.663 -14.757 1.00 0.00 C ATOM 1052 O GLY A 64 15.488 3.360 -15.740 1.00 0.00 O ATOM 0 H GLY A 64 16.463 -0.005 -13.225 1.00 0.00 H new ATOM 0 HA2 GLY A 64 16.663 1.028 -15.255 1.00 0.00 H new ATOM 0 HA3 GLY A 64 14.964 0.665 -15.486 1.00 0.00 H new ATOM 1056 N ASP A 65 14.905 3.180 -13.624 1.00 0.00 N ATOM 1057 CA ASP A 65 14.582 4.655 -13.540 1.00 0.00 C ATOM 1058 C ASP A 65 15.673 5.444 -12.772 1.00 0.00 C ATOM 1059 O ASP A 65 15.893 6.601 -13.072 1.00 0.00 O ATOM 1060 CB ASP A 65 13.247 4.827 -12.813 1.00 0.00 C ATOM 1061 CG ASP A 65 12.725 6.249 -13.032 1.00 0.00 C ATOM 1062 OD1 ASP A 65 13.143 7.132 -12.300 1.00 0.00 O ATOM 1063 OD2 ASP A 65 11.917 6.431 -13.928 1.00 0.00 O ATOM 0 H ASP A 65 14.759 2.654 -12.762 1.00 0.00 H new ATOM 0 HA ASP A 65 14.532 5.048 -14.556 1.00 0.00 H new ATOM 0 HB2 ASP A 65 12.523 4.101 -13.184 1.00 0.00 H new ATOM 0 HB3 ASP A 65 13.374 4.635 -11.748 1.00 0.00 H new ATOM 1068 N GLY A 66 16.360 4.874 -11.795 1.00 0.00 N ATOM 1069 CA GLY A 66 17.410 5.645 -11.055 1.00 0.00 C ATOM 1070 C GLY A 66 16.847 6.107 -9.709 1.00 0.00 C ATOM 1071 O GLY A 66 17.577 6.291 -8.756 1.00 0.00 O ATOM 0 H GLY A 66 16.234 3.911 -11.484 1.00 0.00 H new ATOM 0 HA2 GLY A 66 18.291 5.023 -10.899 1.00 0.00 H new ATOM 0 HA3 GLY A 66 17.728 6.506 -11.644 1.00 0.00 H new ATOM 1075 N GLU A 67 15.550 6.280 -9.615 1.00 0.00 N ATOM 1076 CA GLU A 67 14.939 6.715 -8.316 1.00 0.00 C ATOM 1077 C GLU A 67 13.546 6.089 -8.168 1.00 0.00 C ATOM 1078 O GLU A 67 12.722 6.196 -9.055 1.00 0.00 O ATOM 1079 CB GLU A 67 14.801 8.244 -8.292 1.00 0.00 C ATOM 1080 CG GLU A 67 16.177 8.910 -8.438 1.00 0.00 C ATOM 1081 CD GLU A 67 16.585 8.949 -9.913 1.00 0.00 C ATOM 1082 OE1 GLU A 67 15.739 9.265 -10.733 1.00 0.00 O ATOM 1083 OE2 GLU A 67 17.736 8.663 -10.197 1.00 0.00 O ATOM 0 H GLU A 67 14.889 6.140 -10.379 1.00 0.00 H new ATOM 0 HA GLU A 67 15.581 6.391 -7.497 1.00 0.00 H new ATOM 0 HB2 GLU A 67 14.146 8.569 -9.100 1.00 0.00 H new ATOM 0 HB3 GLU A 67 14.335 8.559 -7.358 1.00 0.00 H new ATOM 0 HG2 GLU A 67 16.145 9.922 -8.034 1.00 0.00 H new ATOM 0 HG3 GLU A 67 16.920 8.359 -7.861 1.00 0.00 H new ATOM 1090 N CYS A 68 13.262 5.454 -7.053 1.00 0.00 N ATOM 1091 CA CYS A 68 11.906 4.840 -6.850 1.00 0.00 C ATOM 1092 C CYS A 68 11.082 5.744 -5.925 1.00 0.00 C ATOM 1093 O CYS A 68 11.507 6.090 -4.840 1.00 0.00 O ATOM 1094 CB CYS A 68 12.055 3.449 -6.221 1.00 0.00 C ATOM 1095 SG CYS A 68 13.463 2.597 -6.972 1.00 0.00 S ATOM 0 H CYS A 68 13.910 5.334 -6.274 1.00 0.00 H new ATOM 0 HA CYS A 68 11.400 4.740 -7.810 1.00 0.00 H new ATOM 0 HB2 CYS A 68 12.202 3.538 -5.145 1.00 0.00 H new ATOM 0 HB3 CYS A 68 11.144 2.870 -6.371 1.00 0.00 H new ATOM 0 HG CYS A 68 13.592 1.419 -6.439 1.00 0.00 H new ATOM 1101 N ASP A 69 9.913 6.138 -6.353 1.00 0.00 N ATOM 1102 CA ASP A 69 9.063 7.033 -5.510 1.00 0.00 C ATOM 1103 C ASP A 69 8.267 6.207 -4.494 1.00 0.00 C ATOM 1104 O ASP A 69 8.447 5.012 -4.369 1.00 0.00 O ATOM 1105 CB ASP A 69 8.092 7.800 -6.408 1.00 0.00 C ATOM 1106 CG ASP A 69 7.285 6.808 -7.249 1.00 0.00 C ATOM 1107 OD1 ASP A 69 6.837 5.818 -6.693 1.00 0.00 O ATOM 1108 OD2 ASP A 69 7.130 7.054 -8.434 1.00 0.00 O ATOM 0 H ASP A 69 9.507 5.879 -7.252 1.00 0.00 H new ATOM 0 HA ASP A 69 9.706 7.731 -4.974 1.00 0.00 H new ATOM 0 HB2 ASP A 69 7.422 8.409 -5.801 1.00 0.00 H new ATOM 0 HB3 ASP A 69 8.641 8.482 -7.057 1.00 0.00 H new ATOM 1113 N PHE A 70 7.376 6.841 -3.776 1.00 0.00 N ATOM 1114 CA PHE A 70 6.548 6.105 -2.776 1.00 0.00 C ATOM 1115 C PHE A 70 5.477 5.303 -3.520 1.00 0.00 C ATOM 1116 O PHE A 70 5.114 4.216 -3.117 1.00 0.00 O ATOM 1117 CB PHE A 70 5.896 7.115 -1.824 1.00 0.00 C ATOM 1118 CG PHE A 70 5.449 6.435 -0.548 1.00 0.00 C ATOM 1119 CD1 PHE A 70 4.353 5.564 -0.563 1.00 0.00 C ATOM 1120 CD2 PHE A 70 6.119 6.692 0.656 1.00 0.00 C ATOM 1121 CE1 PHE A 70 3.929 4.952 0.624 1.00 0.00 C ATOM 1122 CE2 PHE A 70 5.695 6.078 1.839 1.00 0.00 C ATOM 1123 CZ PHE A 70 4.601 5.209 1.824 1.00 0.00 C ATOM 0 H PHE A 70 7.186 7.841 -3.840 1.00 0.00 H new ATOM 0 HA PHE A 70 7.168 5.422 -2.194 1.00 0.00 H new ATOM 0 HB2 PHE A 70 6.603 7.910 -1.590 1.00 0.00 H new ATOM 0 HB3 PHE A 70 5.041 7.583 -2.312 1.00 0.00 H new ATOM 0 HD1 PHE A 70 3.835 5.364 -1.489 1.00 0.00 H new ATOM 0 HD2 PHE A 70 6.964 7.365 0.670 1.00 0.00 H new ATOM 0 HE1 PHE A 70 3.083 4.281 0.613 1.00 0.00 H new ATOM 0 HE2 PHE A 70 6.214 6.276 2.765 1.00 0.00 H new ATOM 0 HZ PHE A 70 4.274 4.736 2.738 1.00 0.00 H new ATOM 1133 N GLN A 71 4.978 5.815 -4.610 1.00 0.00 N ATOM 1134 CA GLN A 71 3.947 5.057 -5.374 1.00 0.00 C ATOM 1135 C GLN A 71 4.538 3.706 -5.786 1.00 0.00 C ATOM 1136 O GLN A 71 3.868 2.693 -5.765 1.00 0.00 O ATOM 1137 CB GLN A 71 3.555 5.850 -6.623 1.00 0.00 C ATOM 1138 CG GLN A 71 2.365 5.178 -7.313 1.00 0.00 C ATOM 1139 CD GLN A 71 1.752 6.145 -8.328 1.00 0.00 C ATOM 1140 OE1 GLN A 71 1.786 7.345 -8.137 1.00 0.00 O ATOM 1141 NE2 GLN A 71 1.191 5.672 -9.406 1.00 0.00 N ATOM 0 H GLN A 71 5.237 6.720 -5.004 1.00 0.00 H new ATOM 0 HA GLN A 71 3.062 4.902 -4.757 1.00 0.00 H new ATOM 0 HB2 GLN A 71 3.298 6.873 -6.349 1.00 0.00 H new ATOM 0 HB3 GLN A 71 4.400 5.907 -7.309 1.00 0.00 H new ATOM 0 HG2 GLN A 71 2.689 4.266 -7.814 1.00 0.00 H new ATOM 0 HG3 GLN A 71 1.618 4.888 -6.574 1.00 0.00 H new ATOM 0 HE21 GLN A 71 1.162 4.665 -9.566 1.00 0.00 H new ATOM 0 HE22 GLN A 71 0.781 6.309 -10.089 1.00 0.00 H new ATOM 1150 N GLU A 72 5.792 3.682 -6.146 1.00 0.00 N ATOM 1151 CA GLU A 72 6.431 2.395 -6.542 1.00 0.00 C ATOM 1152 C GLU A 72 6.630 1.520 -5.299 1.00 0.00 C ATOM 1153 O GLU A 72 6.663 0.311 -5.375 1.00 0.00 O ATOM 1154 CB GLU A 72 7.780 2.667 -7.212 1.00 0.00 C ATOM 1155 CG GLU A 72 7.550 3.318 -8.577 1.00 0.00 C ATOM 1156 CD GLU A 72 6.968 2.285 -9.543 1.00 0.00 C ATOM 1157 OE1 GLU A 72 7.730 1.471 -10.037 1.00 0.00 O ATOM 1158 OE2 GLU A 72 5.770 2.325 -9.772 1.00 0.00 O ATOM 0 H GLU A 72 6.402 4.499 -6.183 1.00 0.00 H new ATOM 0 HA GLU A 72 5.786 1.874 -7.249 1.00 0.00 H new ATOM 0 HB2 GLU A 72 8.385 3.320 -6.583 1.00 0.00 H new ATOM 0 HB3 GLU A 72 8.334 1.736 -7.330 1.00 0.00 H new ATOM 0 HG2 GLU A 72 6.869 4.164 -8.478 1.00 0.00 H new ATOM 0 HG3 GLU A 72 8.489 3.709 -8.968 1.00 0.00 H new ATOM 1165 N PHE A 73 6.710 2.127 -4.148 1.00 0.00 N ATOM 1166 CA PHE A 73 6.858 1.342 -2.887 1.00 0.00 C ATOM 1167 C PHE A 73 5.527 0.655 -2.577 1.00 0.00 C ATOM 1168 O PHE A 73 5.503 -0.492 -2.184 1.00 0.00 O ATOM 1169 CB PHE A 73 7.277 2.268 -1.741 1.00 0.00 C ATOM 1170 CG PHE A 73 7.331 1.499 -0.440 1.00 0.00 C ATOM 1171 CD1 PHE A 73 8.252 0.459 -0.285 1.00 0.00 C ATOM 1172 CD2 PHE A 73 6.469 1.833 0.614 1.00 0.00 C ATOM 1173 CE1 PHE A 73 8.314 -0.249 0.923 1.00 0.00 C ATOM 1174 CE2 PHE A 73 6.530 1.125 1.821 1.00 0.00 C ATOM 1175 CZ PHE A 73 7.453 0.084 1.976 1.00 0.00 C ATOM 0 H PHE A 73 6.679 3.139 -4.024 1.00 0.00 H new ATOM 0 HA PHE A 73 7.632 0.584 -3.005 1.00 0.00 H new ATOM 0 HB2 PHE A 73 8.253 2.704 -1.955 1.00 0.00 H new ATOM 0 HB3 PHE A 73 6.571 3.094 -1.655 1.00 0.00 H new ATOM 0 HD1 PHE A 73 8.916 0.201 -1.097 1.00 0.00 H new ATOM 0 HD2 PHE A 73 5.757 2.637 0.495 1.00 0.00 H new ATOM 0 HE1 PHE A 73 9.026 -1.052 1.042 1.00 0.00 H new ATOM 0 HE2 PHE A 73 5.865 1.382 2.632 1.00 0.00 H new ATOM 0 HZ PHE A 73 7.501 -0.462 2.907 1.00 0.00 H new ATOM 1185 N MET A 74 4.423 1.305 -2.771 1.00 0.00 N ATOM 1186 CA MET A 74 3.134 0.610 -2.499 1.00 0.00 C ATOM 1187 C MET A 74 2.968 -0.524 -3.521 1.00 0.00 C ATOM 1188 O MET A 74 2.758 -1.661 -3.147 1.00 0.00 O ATOM 1189 CB MET A 74 1.967 1.608 -2.599 1.00 0.00 C ATOM 1190 CG MET A 74 1.762 2.311 -1.248 1.00 0.00 C ATOM 1191 SD MET A 74 0.712 1.278 -0.189 1.00 0.00 S ATOM 1192 CE MET A 74 1.849 1.099 1.212 1.00 0.00 C ATOM 0 H MET A 74 4.350 2.268 -3.099 1.00 0.00 H new ATOM 0 HA MET A 74 3.135 0.194 -1.491 1.00 0.00 H new ATOM 0 HB2 MET A 74 2.173 2.345 -3.375 1.00 0.00 H new ATOM 0 HB3 MET A 74 1.055 1.086 -2.889 1.00 0.00 H new ATOM 0 HG2 MET A 74 2.724 2.486 -0.766 1.00 0.00 H new ATOM 0 HG3 MET A 74 1.299 3.286 -1.399 1.00 0.00 H new ATOM 0 HE1 MET A 74 1.382 0.487 1.983 1.00 0.00 H new ATOM 0 HE2 MET A 74 2.768 0.620 0.875 1.00 0.00 H new ATOM 0 HE3 MET A 74 2.081 2.083 1.620 1.00 0.00 H new ATOM 1202 N ALA A 75 3.048 -0.253 -4.792 1.00 0.00 N ATOM 1203 CA ALA A 75 2.881 -1.346 -5.794 1.00 0.00 C ATOM 1204 C ALA A 75 3.839 -2.509 -5.511 1.00 0.00 C ATOM 1205 O ALA A 75 3.440 -3.657 -5.525 1.00 0.00 O ATOM 1206 CB ALA A 75 3.163 -0.793 -7.192 1.00 0.00 C ATOM 0 H ALA A 75 3.221 0.674 -5.182 1.00 0.00 H new ATOM 0 HA ALA A 75 1.859 -1.718 -5.730 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.043 -1.587 -7.929 1.00 0.00 H new ATOM 0 HB2 ALA A 75 2.465 0.014 -7.412 1.00 0.00 H new ATOM 0 HB3 ALA A 75 4.183 -0.412 -7.233 1.00 0.00 H new ATOM 1212 N PHE A 76 5.095 -2.244 -5.275 1.00 0.00 N ATOM 1213 CA PHE A 76 6.039 -3.376 -5.021 1.00 0.00 C ATOM 1214 C PHE A 76 5.715 -4.027 -3.672 1.00 0.00 C ATOM 1215 O PHE A 76 5.820 -5.227 -3.512 1.00 0.00 O ATOM 1216 CB PHE A 76 7.498 -2.868 -5.027 1.00 0.00 C ATOM 1217 CG PHE A 76 8.034 -2.826 -6.449 1.00 0.00 C ATOM 1218 CD1 PHE A 76 8.088 -3.999 -7.217 1.00 0.00 C ATOM 1219 CD2 PHE A 76 8.469 -1.613 -7.005 1.00 0.00 C ATOM 1220 CE1 PHE A 76 8.568 -3.956 -8.529 1.00 0.00 C ATOM 1221 CE2 PHE A 76 8.953 -1.575 -8.317 1.00 0.00 C ATOM 1222 CZ PHE A 76 9.001 -2.745 -9.079 1.00 0.00 C ATOM 0 H PHE A 76 5.506 -1.311 -5.247 1.00 0.00 H new ATOM 0 HA PHE A 76 5.925 -4.116 -5.813 1.00 0.00 H new ATOM 0 HB2 PHE A 76 7.546 -1.874 -4.583 1.00 0.00 H new ATOM 0 HB3 PHE A 76 8.121 -3.521 -4.415 1.00 0.00 H new ATOM 0 HD1 PHE A 76 7.758 -4.936 -6.794 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.430 -0.707 -6.419 1.00 0.00 H new ATOM 0 HE1 PHE A 76 8.605 -4.860 -9.119 1.00 0.00 H new ATOM 0 HE2 PHE A 76 9.290 -0.641 -8.741 1.00 0.00 H new ATOM 0 HZ PHE A 76 9.372 -2.714 -10.093 1.00 0.00 H new ATOM 1232 N VAL A 77 5.311 -3.252 -2.710 1.00 0.00 N ATOM 1233 CA VAL A 77 4.970 -3.838 -1.383 1.00 0.00 C ATOM 1234 C VAL A 77 3.771 -4.776 -1.560 1.00 0.00 C ATOM 1235 O VAL A 77 3.645 -5.774 -0.879 1.00 0.00 O ATOM 1236 CB VAL A 77 4.631 -2.706 -0.397 1.00 0.00 C ATOM 1237 CG1 VAL A 77 3.894 -3.267 0.828 1.00 0.00 C ATOM 1238 CG2 VAL A 77 5.929 -2.019 0.060 1.00 0.00 C ATOM 0 H VAL A 77 5.201 -2.240 -2.782 1.00 0.00 H new ATOM 0 HA VAL A 77 5.814 -4.401 -0.985 1.00 0.00 H new ATOM 0 HB VAL A 77 3.986 -1.984 -0.898 1.00 0.00 H new ATOM 0 HG11 VAL A 77 3.661 -2.454 1.516 1.00 0.00 H new ATOM 0 HG12 VAL A 77 2.970 -3.748 0.508 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.528 -3.998 1.331 1.00 0.00 H new ATOM 0 HG21 VAL A 77 5.690 -1.217 0.758 1.00 0.00 H new ATOM 0 HG22 VAL A 77 6.573 -2.748 0.552 1.00 0.00 H new ATOM 0 HG23 VAL A 77 6.445 -1.604 -0.806 1.00 0.00 H new ATOM 1248 N SER A 78 2.894 -4.464 -2.473 1.00 0.00 N ATOM 1249 CA SER A 78 1.708 -5.338 -2.699 1.00 0.00 C ATOM 1250 C SER A 78 2.143 -6.643 -3.380 1.00 0.00 C ATOM 1251 O SER A 78 1.823 -7.726 -2.931 1.00 0.00 O ATOM 1252 CB SER A 78 0.701 -4.604 -3.589 1.00 0.00 C ATOM 1253 OG SER A 78 0.673 -3.229 -3.226 1.00 0.00 O ATOM 0 H SER A 78 2.947 -3.641 -3.073 1.00 0.00 H new ATOM 0 HA SER A 78 1.245 -5.574 -1.741 1.00 0.00 H new ATOM 0 HB2 SER A 78 0.979 -4.710 -4.638 1.00 0.00 H new ATOM 0 HB3 SER A 78 -0.290 -5.043 -3.476 1.00 0.00 H new ATOM 0 HG SER A 78 1.436 -2.768 -3.633 1.00 0.00 H new ATOM 1259 N MET A 79 2.847 -6.545 -4.474 1.00 0.00 N ATOM 1260 CA MET A 79 3.277 -7.774 -5.203 1.00 0.00 C ATOM 1261 C MET A 79 3.923 -8.768 -4.239 1.00 0.00 C ATOM 1262 O MET A 79 3.708 -9.958 -4.336 1.00 0.00 O ATOM 1263 CB MET A 79 4.285 -7.395 -6.291 1.00 0.00 C ATOM 1264 CG MET A 79 3.554 -6.703 -7.443 1.00 0.00 C ATOM 1265 SD MET A 79 4.759 -6.134 -8.672 1.00 0.00 S ATOM 1266 CE MET A 79 4.729 -7.597 -9.740 1.00 0.00 C ATOM 0 H MET A 79 3.144 -5.665 -4.896 1.00 0.00 H new ATOM 0 HA MET A 79 2.401 -8.239 -5.655 1.00 0.00 H new ATOM 0 HB2 MET A 79 5.048 -6.734 -5.881 1.00 0.00 H new ATOM 0 HB3 MET A 79 4.797 -8.286 -6.654 1.00 0.00 H new ATOM 0 HG2 MET A 79 2.846 -7.392 -7.904 1.00 0.00 H new ATOM 0 HG3 MET A 79 2.977 -5.858 -7.066 1.00 0.00 H new ATOM 0 HE1 MET A 79 5.415 -7.452 -10.575 1.00 0.00 H new ATOM 0 HE2 MET A 79 5.035 -8.472 -9.167 1.00 0.00 H new ATOM 0 HE3 MET A 79 3.719 -7.748 -10.122 1.00 0.00 H new ATOM 1276 N VAL A 80 4.709 -8.302 -3.312 1.00 0.00 N ATOM 1277 CA VAL A 80 5.356 -9.248 -2.358 1.00 0.00 C ATOM 1278 C VAL A 80 4.316 -9.742 -1.352 1.00 0.00 C ATOM 1279 O VAL A 80 4.201 -10.923 -1.092 1.00 0.00 O ATOM 1280 CB VAL A 80 6.493 -8.536 -1.618 1.00 0.00 C ATOM 1281 CG1 VAL A 80 7.041 -9.449 -0.516 1.00 0.00 C ATOM 1282 CG2 VAL A 80 7.614 -8.204 -2.606 1.00 0.00 C ATOM 0 H VAL A 80 4.932 -7.316 -3.172 1.00 0.00 H new ATOM 0 HA VAL A 80 5.763 -10.097 -2.907 1.00 0.00 H new ATOM 0 HB VAL A 80 6.114 -7.617 -1.172 1.00 0.00 H new ATOM 0 HG11 VAL A 80 7.850 -8.941 0.009 1.00 0.00 H new ATOM 0 HG12 VAL A 80 6.244 -9.687 0.189 1.00 0.00 H new ATOM 0 HG13 VAL A 80 7.419 -10.369 -0.961 1.00 0.00 H new ATOM 0 HG21 VAL A 80 8.424 -7.697 -2.081 1.00 0.00 H new ATOM 0 HG22 VAL A 80 7.991 -9.125 -3.052 1.00 0.00 H new ATOM 0 HG23 VAL A 80 7.227 -7.553 -3.390 1.00 0.00 H new ATOM 1292 N THR A 81 3.547 -8.848 -0.793 1.00 0.00 N ATOM 1293 CA THR A 81 2.507 -9.273 0.182 1.00 0.00 C ATOM 1294 C THR A 81 1.492 -10.160 -0.541 1.00 0.00 C ATOM 1295 O THR A 81 1.042 -11.162 -0.023 1.00 0.00 O ATOM 1296 CB THR A 81 1.802 -8.036 0.746 1.00 0.00 C ATOM 1297 OG1 THR A 81 2.774 -7.060 1.094 1.00 0.00 O ATOM 1298 CG2 THR A 81 0.996 -8.422 1.987 1.00 0.00 C ATOM 0 H THR A 81 3.595 -7.845 -0.970 1.00 0.00 H new ATOM 0 HA THR A 81 2.965 -9.827 1.001 1.00 0.00 H new ATOM 0 HB THR A 81 1.127 -7.628 -0.006 1.00 0.00 H new ATOM 0 HG1 THR A 81 2.796 -6.361 0.407 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.496 -7.539 2.385 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.251 -9.171 1.719 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.666 -8.832 2.743 1.00 0.00 H new ATOM 1306 N THR A 82 1.135 -9.794 -1.742 1.00 0.00 N ATOM 1307 CA THR A 82 0.156 -10.605 -2.518 1.00 0.00 C ATOM 1308 C THR A 82 0.829 -11.883 -3.029 1.00 0.00 C ATOM 1309 O THR A 82 0.170 -12.854 -3.342 1.00 0.00 O ATOM 1310 CB THR A 82 -0.362 -9.790 -3.704 1.00 0.00 C ATOM 1311 OG1 THR A 82 0.736 -9.340 -4.480 1.00 0.00 O ATOM 1312 CG2 THR A 82 -1.156 -8.588 -3.193 1.00 0.00 C ATOM 0 H THR A 82 1.482 -8.963 -2.221 1.00 0.00 H new ATOM 0 HA THR A 82 -0.679 -10.873 -1.870 1.00 0.00 H new ATOM 0 HB THR A 82 -1.011 -10.414 -4.319 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.253 -8.684 -3.967 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.524 -8.009 -4.040 1.00 0.00 H new ATOM 0 HG22 THR A 82 -2.000 -8.936 -2.597 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.511 -7.961 -2.577 1.00 0.00 H new ATOM 1320 N ALA A 83 2.135 -11.901 -3.110 1.00 0.00 N ATOM 1321 CA ALA A 83 2.822 -13.132 -3.596 1.00 0.00 C ATOM 1322 C ALA A 83 2.354 -14.312 -2.749 1.00 0.00 C ATOM 1323 O ALA A 83 2.272 -15.433 -3.210 1.00 0.00 O ATOM 1324 CB ALA A 83 4.340 -12.978 -3.454 1.00 0.00 C ATOM 0 H ALA A 83 2.749 -11.125 -2.863 1.00 0.00 H new ATOM 0 HA ALA A 83 2.581 -13.297 -4.646 1.00 0.00 H new ATOM 0 HB1 ALA A 83 4.832 -13.882 -3.812 1.00 0.00 H new ATOM 0 HB2 ALA A 83 4.676 -12.125 -4.043 1.00 0.00 H new ATOM 0 HB3 ALA A 83 4.593 -12.817 -2.406 1.00 0.00 H new ATOM 1481 N SER B 1 8.457 -5.102 13.891 1.00 0.00 N ATOM 1482 CA SER B 1 8.522 -3.620 14.045 1.00 0.00 C ATOM 1483 C SER B 1 7.102 -3.058 14.097 1.00 0.00 C ATOM 1484 O SER B 1 6.137 -3.765 13.884 1.00 0.00 O ATOM 1485 CB SER B 1 9.263 -3.015 12.854 1.00 0.00 C ATOM 1486 OG SER B 1 8.413 -3.048 11.713 1.00 0.00 O ATOM 0 H1 SER B 1 8.898 -5.556 14.716 1.00 0.00 H new ATOM 0 H2 SER B 1 7.463 -5.401 13.821 1.00 0.00 H new ATOM 0 H3 SER B 1 8.965 -5.384 13.028 1.00 0.00 H new ATOM 0 HA SER B 1 9.051 -3.371 14.965 1.00 0.00 H new ATOM 0 HB2 SER B 1 9.556 -1.989 13.075 1.00 0.00 H new ATOM 0 HB3 SER B 1 10.179 -3.573 12.658 1.00 0.00 H new ATOM 0 HG SER B 1 8.881 -2.660 10.945 1.00 0.00 H new ATOM 1492 N GLU B 2 6.961 -1.792 14.377 1.00 0.00 N ATOM 1493 CA GLU B 2 5.597 -1.199 14.436 1.00 0.00 C ATOM 1494 C GLU B 2 4.906 -1.397 13.088 1.00 0.00 C ATOM 1495 O GLU B 2 3.707 -1.579 13.011 1.00 0.00 O ATOM 1496 CB GLU B 2 5.703 0.297 14.741 1.00 0.00 C ATOM 1497 CG GLU B 2 6.180 0.493 16.181 1.00 0.00 C ATOM 1498 CD GLU B 2 7.637 0.042 16.302 1.00 0.00 C ATOM 1499 OE1 GLU B 2 8.388 0.277 15.369 1.00 0.00 O ATOM 1500 OE2 GLU B 2 7.977 -0.530 17.324 1.00 0.00 O ATOM 0 H GLU B 2 7.727 -1.146 14.566 1.00 0.00 H new ATOM 0 HA GLU B 2 5.018 -1.687 15.220 1.00 0.00 H new ATOM 0 HB2 GLU B 2 6.399 0.771 14.049 1.00 0.00 H new ATOM 0 HB3 GLU B 2 4.735 0.777 14.599 1.00 0.00 H new ATOM 0 HG2 GLU B 2 6.088 1.541 16.466 1.00 0.00 H new ATOM 0 HG3 GLU B 2 5.553 -0.080 16.864 1.00 0.00 H new ATOM 1507 N LEU B 3 5.658 -1.355 12.022 1.00 0.00 N ATOM 1508 CA LEU B 3 5.055 -1.532 10.672 1.00 0.00 C ATOM 1509 C LEU B 3 4.388 -2.910 10.584 1.00 0.00 C ATOM 1510 O LEU B 3 3.256 -3.034 10.163 1.00 0.00 O ATOM 1511 CB LEU B 3 6.159 -1.406 9.599 1.00 0.00 C ATOM 1512 CG LEU B 3 5.590 -0.782 8.318 1.00 0.00 C ATOM 1513 CD1 LEU B 3 6.690 -0.699 7.259 1.00 0.00 C ATOM 1514 CD2 LEU B 3 4.442 -1.648 7.791 1.00 0.00 C ATOM 0 H LEU B 3 6.667 -1.205 12.029 1.00 0.00 H new ATOM 0 HA LEU B 3 4.301 -0.763 10.502 1.00 0.00 H new ATOM 0 HB2 LEU B 3 6.976 -0.792 9.979 1.00 0.00 H new ATOM 0 HB3 LEU B 3 6.575 -2.389 9.379 1.00 0.00 H new ATOM 0 HG LEU B 3 5.219 0.219 8.538 1.00 0.00 H new ATOM 0 HD11 LEU B 3 6.286 -0.256 6.349 1.00 0.00 H new ATOM 0 HD12 LEU B 3 7.508 -0.082 7.631 1.00 0.00 H new ATOM 0 HD13 LEU B 3 7.061 -1.700 7.041 1.00 0.00 H new ATOM 0 HD21 LEU B 3 4.039 -1.203 6.881 1.00 0.00 H new ATOM 0 HD22 LEU B 3 4.813 -2.649 7.572 1.00 0.00 H new ATOM 0 HD23 LEU B 3 3.656 -1.708 8.544 1.00 0.00 H new ATOM 1526 N GLU B 4 5.079 -3.950 10.971 1.00 0.00 N ATOM 1527 CA GLU B 4 4.470 -5.308 10.894 1.00 0.00 C ATOM 1528 C GLU B 4 3.103 -5.289 11.581 1.00 0.00 C ATOM 1529 O GLU B 4 2.115 -5.760 11.054 1.00 0.00 O ATOM 1530 CB GLU B 4 5.384 -6.321 11.582 1.00 0.00 C ATOM 1531 CG GLU B 4 6.710 -6.402 10.824 1.00 0.00 C ATOM 1532 CD GLU B 4 7.504 -7.618 11.305 1.00 0.00 C ATOM 1533 OE1 GLU B 4 6.886 -8.632 11.583 1.00 0.00 O ATOM 1534 OE2 GLU B 4 8.717 -7.514 11.385 1.00 0.00 O ATOM 0 H GLU B 4 6.032 -3.918 11.334 1.00 0.00 H new ATOM 0 HA GLU B 4 4.346 -5.594 9.850 1.00 0.00 H new ATOM 0 HB2 GLU B 4 5.561 -6.025 12.616 1.00 0.00 H new ATOM 0 HB3 GLU B 4 4.906 -7.300 11.608 1.00 0.00 H new ATOM 0 HG2 GLU B 4 6.524 -6.477 9.753 1.00 0.00 H new ATOM 0 HG3 GLU B 4 7.288 -5.492 10.984 1.00 0.00 H new ATOM 1541 N LYS B 5 3.050 -4.727 12.758 1.00 0.00 N ATOM 1542 CA LYS B 5 1.763 -4.640 13.504 1.00 0.00 C ATOM 1543 C LYS B 5 0.684 -4.055 12.593 1.00 0.00 C ATOM 1544 O LYS B 5 -0.435 -4.526 12.541 1.00 0.00 O ATOM 1545 CB LYS B 5 1.954 -3.702 14.699 1.00 0.00 C ATOM 1546 CG LYS B 5 0.730 -3.785 15.614 1.00 0.00 C ATOM 1547 CD LYS B 5 0.980 -2.959 16.878 1.00 0.00 C ATOM 1548 CE LYS B 5 -0.332 -2.791 17.647 1.00 0.00 C ATOM 1549 NZ LYS B 5 -1.283 -1.980 16.836 1.00 0.00 N ATOM 0 H LYS B 5 3.852 -4.320 13.239 1.00 0.00 H new ATOM 0 HA LYS B 5 1.464 -5.633 13.839 1.00 0.00 H new ATOM 0 HB2 LYS B 5 2.853 -3.977 15.251 1.00 0.00 H new ATOM 0 HB3 LYS B 5 2.093 -2.678 14.352 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -0.153 -3.414 15.093 1.00 0.00 H new ATOM 0 HG3 LYS B 5 0.531 -4.823 15.879 1.00 0.00 H new ATOM 0 HD2 LYS B 5 1.721 -3.452 17.507 1.00 0.00 H new ATOM 0 HD3 LYS B 5 1.386 -1.983 16.613 1.00 0.00 H new ATOM 0 HE2 LYS B 5 -0.765 -3.767 17.866 1.00 0.00 H new ATOM 0 HE3 LYS B 5 -0.145 -2.303 18.604 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 -1.670 -1.212 17.420 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 -0.784 -1.575 16.018 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 -2.060 -2.586 16.503 1.00 0.00 H new ATOM 1563 N ALA B 6 1.026 -3.011 11.887 1.00 0.00 N ATOM 1564 CA ALA B 6 0.057 -2.340 10.976 1.00 0.00 C ATOM 1565 C ALA B 6 -0.150 -3.158 9.693 1.00 0.00 C ATOM 1566 O ALA B 6 -1.249 -3.231 9.182 1.00 0.00 O ATOM 1567 CB ALA B 6 0.604 -0.944 10.630 1.00 0.00 C ATOM 0 H ALA B 6 1.954 -2.588 11.904 1.00 0.00 H new ATOM 0 HA ALA B 6 -0.909 -2.256 11.474 1.00 0.00 H new ATOM 0 HB1 ALA B 6 -0.092 -0.436 9.963 1.00 0.00 H new ATOM 0 HB2 ALA B 6 0.721 -0.362 11.544 1.00 0.00 H new ATOM 0 HB3 ALA B 6 1.571 -1.044 10.137 1.00 0.00 H new ATOM 1573 N MET B 7 0.864 -3.784 9.169 1.00 0.00 N ATOM 1574 CA MET B 7 0.644 -4.587 7.933 1.00 0.00 C ATOM 1575 C MET B 7 -0.387 -5.678 8.260 1.00 0.00 C ATOM 1576 O MET B 7 -1.361 -5.867 7.552 1.00 0.00 O ATOM 1577 CB MET B 7 1.987 -5.216 7.479 1.00 0.00 C ATOM 1578 CG MET B 7 2.483 -4.548 6.189 1.00 0.00 C ATOM 1579 SD MET B 7 1.367 -4.969 4.827 1.00 0.00 S ATOM 1580 CE MET B 7 2.038 -3.807 3.612 1.00 0.00 C ATOM 0 H MET B 7 1.817 -3.777 9.532 1.00 0.00 H new ATOM 0 HA MET B 7 0.273 -3.962 7.121 1.00 0.00 H new ATOM 0 HB2 MET B 7 2.733 -5.102 8.265 1.00 0.00 H new ATOM 0 HB3 MET B 7 1.858 -6.286 7.315 1.00 0.00 H new ATOM 0 HG2 MET B 7 2.524 -3.467 6.319 1.00 0.00 H new ATOM 0 HG3 MET B 7 3.496 -4.880 5.960 1.00 0.00 H new ATOM 0 HE1 MET B 7 1.533 -3.948 2.656 1.00 0.00 H new ATOM 0 HE2 MET B 7 1.879 -2.786 3.959 1.00 0.00 H new ATOM 0 HE3 MET B 7 3.106 -3.986 3.488 1.00 0.00 H new ATOM 1590 N VAL B 8 -0.188 -6.384 9.339 1.00 0.00 N ATOM 1591 CA VAL B 8 -1.158 -7.446 9.716 1.00 0.00 C ATOM 1592 C VAL B 8 -2.517 -6.797 9.971 1.00 0.00 C ATOM 1593 O VAL B 8 -3.552 -7.349 9.653 1.00 0.00 O ATOM 1594 CB VAL B 8 -0.679 -8.158 10.985 1.00 0.00 C ATOM 1595 CG1 VAL B 8 -1.607 -9.333 11.294 1.00 0.00 C ATOM 1596 CG2 VAL B 8 0.747 -8.678 10.777 1.00 0.00 C ATOM 0 H VAL B 8 0.603 -6.271 9.973 1.00 0.00 H new ATOM 0 HA VAL B 8 -1.240 -8.177 8.912 1.00 0.00 H new ATOM 0 HB VAL B 8 -0.691 -7.455 11.818 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -1.265 -9.839 12.197 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -2.622 -8.965 11.446 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -1.597 -10.034 10.459 1.00 0.00 H new ATOM 0 HG21 VAL B 8 1.085 -9.184 11.681 1.00 0.00 H new ATOM 0 HG22 VAL B 8 0.761 -9.379 9.942 1.00 0.00 H new ATOM 0 HG23 VAL B 8 1.411 -7.842 10.559 1.00 0.00 H new ATOM 1606 N ALA B 9 -2.522 -5.620 10.541 1.00 0.00 N ATOM 1607 CA ALA B 9 -3.811 -4.928 10.813 1.00 0.00 C ATOM 1608 C ALA B 9 -4.568 -4.727 9.497 1.00 0.00 C ATOM 1609 O ALA B 9 -5.748 -4.988 9.407 1.00 0.00 O ATOM 1610 CB ALA B 9 -3.530 -3.565 11.451 1.00 0.00 C ATOM 0 H ALA B 9 -1.687 -5.110 10.829 1.00 0.00 H new ATOM 0 HA ALA B 9 -4.414 -5.532 11.491 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -4.473 -3.056 11.651 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -2.988 -3.706 12.386 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -2.929 -2.962 10.770 1.00 0.00 H new ATOM 1616 N LEU B 10 -3.905 -4.247 8.482 1.00 0.00 N ATOM 1617 CA LEU B 10 -4.603 -4.013 7.180 1.00 0.00 C ATOM 1618 C LEU B 10 -5.462 -5.234 6.842 1.00 0.00 C ATOM 1619 O LEU B 10 -6.600 -5.112 6.433 1.00 0.00 O ATOM 1620 CB LEU B 10 -3.543 -3.803 6.068 1.00 0.00 C ATOM 1621 CG LEU B 10 -3.271 -2.305 5.846 1.00 0.00 C ATOM 1622 CD1 LEU B 10 -2.593 -1.713 7.082 1.00 0.00 C ATOM 1623 CD2 LEU B 10 -2.353 -2.131 4.633 1.00 0.00 C ATOM 0 H LEU B 10 -2.914 -4.006 8.494 1.00 0.00 H new ATOM 0 HA LEU B 10 -5.238 -3.130 7.253 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -2.617 -4.308 6.342 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -3.890 -4.256 5.139 1.00 0.00 H new ATOM 0 HG LEU B 10 -4.215 -1.790 5.671 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -2.403 -0.652 6.920 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -3.243 -1.837 7.948 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -1.649 -2.228 7.261 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -2.158 -1.070 4.473 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -1.411 -2.650 4.812 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -2.835 -2.549 3.749 1.00 0.00 H new ATOM 1635 N ILE B 11 -4.933 -6.413 7.028 1.00 0.00 N ATOM 1636 CA ILE B 11 -5.743 -7.629 6.730 1.00 0.00 C ATOM 1637 C ILE B 11 -6.929 -7.658 7.703 1.00 0.00 C ATOM 1638 O ILE B 11 -8.040 -7.993 7.344 1.00 0.00 O ATOM 1639 CB ILE B 11 -4.877 -8.888 6.908 1.00 0.00 C ATOM 1640 CG1 ILE B 11 -3.934 -9.032 5.708 1.00 0.00 C ATOM 1641 CG2 ILE B 11 -5.768 -10.134 6.991 1.00 0.00 C ATOM 1642 CD1 ILE B 11 -2.996 -7.827 5.631 1.00 0.00 C ATOM 0 H ILE B 11 -3.987 -6.586 7.369 1.00 0.00 H new ATOM 0 HA ILE B 11 -6.104 -7.605 5.702 1.00 0.00 H new ATOM 0 HB ILE B 11 -4.301 -8.792 7.828 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -3.353 -9.950 5.800 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -4.513 -9.112 4.788 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -5.145 -11.019 7.117 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -6.444 -10.042 7.841 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -6.350 -10.227 6.074 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -2.330 -7.938 4.775 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -3.583 -6.916 5.518 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -2.405 -7.767 6.545 1.00 0.00 H new ATOM 1654 N ASP B 12 -6.685 -7.297 8.935 1.00 0.00 N ATOM 1655 CA ASP B 12 -7.768 -7.283 9.958 1.00 0.00 C ATOM 1656 C ASP B 12 -8.969 -6.498 9.436 1.00 0.00 C ATOM 1657 O ASP B 12 -10.087 -6.974 9.432 1.00 0.00 O ATOM 1658 CB ASP B 12 -7.242 -6.592 11.227 1.00 0.00 C ATOM 1659 CG ASP B 12 -8.136 -6.946 12.420 1.00 0.00 C ATOM 1660 OD1 ASP B 12 -9.186 -7.526 12.198 1.00 0.00 O ATOM 1661 OD2 ASP B 12 -7.754 -6.633 13.535 1.00 0.00 O ATOM 0 H ASP B 12 -5.769 -7.008 9.279 1.00 0.00 H new ATOM 0 HA ASP B 12 -8.071 -8.307 10.176 1.00 0.00 H new ATOM 0 HB2 ASP B 12 -6.217 -6.905 11.424 1.00 0.00 H new ATOM 0 HB3 ASP B 12 -7.224 -5.512 11.083 1.00 0.00 H new ATOM 1666 N VAL B 13 -8.744 -5.281 9.017 1.00 0.00 N ATOM 1667 CA VAL B 13 -9.868 -4.441 8.519 1.00 0.00 C ATOM 1668 C VAL B 13 -10.282 -4.869 7.110 1.00 0.00 C ATOM 1669 O VAL B 13 -11.456 -4.994 6.823 1.00 0.00 O ATOM 1670 CB VAL B 13 -9.449 -2.970 8.529 1.00 0.00 C ATOM 1671 CG1 VAL B 13 -10.547 -2.116 7.890 1.00 0.00 C ATOM 1672 CG2 VAL B 13 -9.232 -2.521 9.975 1.00 0.00 C ATOM 0 H VAL B 13 -7.828 -4.833 8.999 1.00 0.00 H new ATOM 0 HA VAL B 13 -10.727 -4.574 9.176 1.00 0.00 H new ATOM 0 HB VAL B 13 -8.526 -2.850 7.962 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -10.245 -1.069 7.899 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -10.707 -2.439 6.861 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -11.472 -2.231 8.454 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -8.933 -1.473 9.990 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -10.158 -2.642 10.536 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -8.450 -3.128 10.431 1.00 0.00 H new ATOM 1682 N PHE B 14 -9.357 -5.087 6.222 1.00 0.00 N ATOM 1683 CA PHE B 14 -9.767 -5.491 4.850 1.00 0.00 C ATOM 1684 C PHE B 14 -10.674 -6.719 4.943 1.00 0.00 C ATOM 1685 O PHE B 14 -11.583 -6.898 4.155 1.00 0.00 O ATOM 1686 CB PHE B 14 -8.536 -5.824 4.008 1.00 0.00 C ATOM 1687 CG PHE B 14 -8.966 -6.127 2.591 1.00 0.00 C ATOM 1688 CD1 PHE B 14 -9.448 -7.400 2.261 1.00 0.00 C ATOM 1689 CD2 PHE B 14 -8.876 -5.137 1.604 1.00 0.00 C ATOM 1690 CE1 PHE B 14 -9.840 -7.682 0.946 1.00 0.00 C ATOM 1691 CE2 PHE B 14 -9.267 -5.420 0.290 1.00 0.00 C ATOM 1692 CZ PHE B 14 -9.749 -6.692 -0.039 1.00 0.00 C ATOM 0 H PHE B 14 -8.353 -5.005 6.380 1.00 0.00 H new ATOM 0 HA PHE B 14 -10.303 -4.669 4.376 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -7.838 -4.987 4.017 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -8.012 -6.681 4.432 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -9.517 -8.165 3.021 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -8.505 -4.155 1.857 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -10.212 -8.663 0.692 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -9.197 -4.656 -0.470 1.00 0.00 H new ATOM 0 HZ PHE B 14 -10.051 -6.910 -1.053 1.00 0.00 H new ATOM 1702 N HIS B 15 -10.425 -7.570 5.904 1.00 0.00 N ATOM 1703 CA HIS B 15 -11.257 -8.795 6.060 1.00 0.00 C ATOM 1704 C HIS B 15 -12.546 -8.463 6.818 1.00 0.00 C ATOM 1705 O HIS B 15 -13.573 -9.081 6.619 1.00 0.00 O ATOM 1706 CB HIS B 15 -10.467 -9.849 6.840 1.00 0.00 C ATOM 1707 CG HIS B 15 -11.293 -11.098 6.974 1.00 0.00 C ATOM 1708 ND1 HIS B 15 -11.786 -11.530 8.195 1.00 0.00 N ATOM 1709 CD2 HIS B 15 -11.719 -12.020 6.050 1.00 0.00 C ATOM 1710 CE1 HIS B 15 -12.474 -12.666 7.975 1.00 0.00 C ATOM 1711 NE2 HIS B 15 -12.465 -13.009 6.684 1.00 0.00 N ATOM 0 H HIS B 15 -9.677 -7.467 6.590 1.00 0.00 H new ATOM 0 HA HIS B 15 -11.513 -9.180 5.073 1.00 0.00 H new ATOM 0 HB2 HIS B 15 -9.532 -10.072 6.326 1.00 0.00 H new ATOM 0 HB3 HIS B 15 -10.205 -9.466 7.826 1.00 0.00 H new ATOM 0 HD2 HIS B 15 -11.507 -11.983 4.992 1.00 0.00 H new ATOM 0 HE1 HIS B 15 -12.973 -13.231 8.748 1.00 0.00 H new ATOM 0 HE2 HIS B 15 -12.909 -13.821 6.255 1.00 0.00 H new ATOM 1719 N GLN B 16 -12.496 -7.498 7.700 1.00 0.00 N ATOM 1720 CA GLN B 16 -13.712 -7.141 8.485 1.00 0.00 C ATOM 1721 C GLN B 16 -14.875 -6.862 7.534 1.00 0.00 C ATOM 1722 O GLN B 16 -15.981 -7.320 7.743 1.00 0.00 O ATOM 1723 CB GLN B 16 -13.430 -5.900 9.336 1.00 0.00 C ATOM 1724 CG GLN B 16 -14.549 -5.719 10.365 1.00 0.00 C ATOM 1725 CD GLN B 16 -14.167 -4.610 11.346 1.00 0.00 C ATOM 1726 OE1 GLN B 16 -13.070 -4.089 11.296 1.00 0.00 O ATOM 1727 NE2 GLN B 16 -15.031 -4.224 12.245 1.00 0.00 N ATOM 0 H GLN B 16 -11.666 -6.943 7.909 1.00 0.00 H new ATOM 0 HA GLN B 16 -13.975 -7.972 9.139 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -12.470 -6.004 9.842 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -13.361 -5.018 8.699 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -15.483 -5.468 9.862 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -14.717 -6.652 10.903 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -15.952 -4.661 12.288 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -14.785 -3.486 12.905 1.00 0.00 H new ATOM 1736 N TYR B 17 -14.639 -6.121 6.485 1.00 0.00 N ATOM 1737 CA TYR B 17 -15.735 -5.825 5.523 1.00 0.00 C ATOM 1738 C TYR B 17 -16.024 -7.081 4.704 1.00 0.00 C ATOM 1739 O TYR B 17 -17.160 -7.470 4.522 1.00 0.00 O ATOM 1740 CB TYR B 17 -15.303 -4.693 4.584 1.00 0.00 C ATOM 1741 CG TYR B 17 -15.372 -3.371 5.316 1.00 0.00 C ATOM 1742 CD1 TYR B 17 -14.465 -3.096 6.345 1.00 0.00 C ATOM 1743 CD2 TYR B 17 -16.342 -2.421 4.966 1.00 0.00 C ATOM 1744 CE1 TYR B 17 -14.526 -1.875 7.027 1.00 0.00 C ATOM 1745 CE2 TYR B 17 -16.403 -1.199 5.647 1.00 0.00 C ATOM 1746 CZ TYR B 17 -15.496 -0.926 6.678 1.00 0.00 C ATOM 1747 OH TYR B 17 -15.557 0.278 7.349 1.00 0.00 O ATOM 0 H TYR B 17 -13.735 -5.709 6.254 1.00 0.00 H new ATOM 0 HA TYR B 17 -16.630 -5.520 6.065 1.00 0.00 H new ATOM 0 HB2 TYR B 17 -14.288 -4.870 4.228 1.00 0.00 H new ATOM 0 HB3 TYR B 17 -15.949 -4.668 3.707 1.00 0.00 H new ATOM 0 HD1 TYR B 17 -13.717 -3.827 6.614 1.00 0.00 H new ATOM 0 HD2 TYR B 17 -17.042 -2.632 4.171 1.00 0.00 H new ATOM 0 HE1 TYR B 17 -13.826 -1.665 7.822 1.00 0.00 H new ATOM 0 HE2 TYR B 17 -17.150 -0.467 5.377 1.00 0.00 H new ATOM 0 HH TYR B 17 -16.286 0.821 6.982 1.00 0.00 H new ATOM 1757 N SER B 18 -14.995 -7.716 4.204 1.00 0.00 N ATOM 1758 CA SER B 18 -15.188 -8.951 3.387 1.00 0.00 C ATOM 1759 C SER B 18 -14.937 -10.193 4.249 1.00 0.00 C ATOM 1760 O SER B 18 -14.110 -11.021 3.922 1.00 0.00 O ATOM 1761 CB SER B 18 -14.197 -8.939 2.223 1.00 0.00 C ATOM 1762 OG SER B 18 -12.872 -8.974 2.736 1.00 0.00 O ATOM 0 H SER B 18 -14.024 -7.430 4.328 1.00 0.00 H new ATOM 0 HA SER B 18 -16.210 -8.978 3.009 1.00 0.00 H new ATOM 0 HB2 SER B 18 -14.371 -9.797 1.573 1.00 0.00 H new ATOM 0 HB3 SER B 18 -14.341 -8.045 1.616 1.00 0.00 H new ATOM 0 HG SER B 18 -12.633 -8.090 3.084 1.00 0.00 H new ATOM 1768 N GLY B 19 -15.660 -10.343 5.336 1.00 0.00 N ATOM 1769 CA GLY B 19 -15.493 -11.547 6.217 1.00 0.00 C ATOM 1770 C GLY B 19 -16.829 -12.289 6.254 1.00 0.00 C ATOM 1771 O GLY B 19 -16.907 -13.434 6.653 1.00 0.00 O ATOM 0 H GLY B 19 -16.365 -9.677 5.653 1.00 0.00 H new ATOM 0 HA2 GLY B 19 -14.706 -12.196 5.832 1.00 0.00 H new ATOM 0 HA3 GLY B 19 -15.195 -11.247 7.222 1.00 0.00 H new ATOM 1775 N ARG B 20 -17.874 -11.653 5.801 1.00 0.00 N ATOM 1776 CA ARG B 20 -19.205 -12.318 5.759 1.00 0.00 C ATOM 1777 C ARG B 20 -19.136 -13.499 4.794 1.00 0.00 C ATOM 1778 O ARG B 20 -19.821 -14.484 4.983 1.00 0.00 O ATOM 1779 CB ARG B 20 -20.273 -11.323 5.299 1.00 0.00 C ATOM 1780 CG ARG B 20 -21.663 -11.887 5.597 1.00 0.00 C ATOM 1781 CD ARG B 20 -22.719 -11.076 4.843 1.00 0.00 C ATOM 1782 NE ARG B 20 -22.535 -11.265 3.377 1.00 0.00 N ATOM 1783 CZ ARG B 20 -23.052 -10.408 2.539 1.00 0.00 C ATOM 1784 NH1 ARG B 20 -22.563 -9.202 2.453 1.00 0.00 N ATOM 1785 NH2 ARG B 20 -24.059 -10.758 1.787 1.00 0.00 N ATOM 0 H ARG B 20 -17.862 -10.693 5.456 1.00 0.00 H new ATOM 0 HA ARG B 20 -19.471 -12.674 6.754 1.00 0.00 H new ATOM 0 HB2 ARG B 20 -20.140 -10.369 5.809 1.00 0.00 H new ATOM 0 HB3 ARG B 20 -20.169 -11.130 4.231 1.00 0.00 H new ATOM 0 HG2 ARG B 20 -21.713 -12.934 5.299 1.00 0.00 H new ATOM 0 HG3 ARG B 20 -21.859 -11.851 6.669 1.00 0.00 H new ATOM 0 HD2 ARG B 20 -23.718 -11.395 5.139 1.00 0.00 H new ATOM 0 HD3 ARG B 20 -22.633 -10.020 5.098 1.00 0.00 H new ATOM 0 HE ARG B 20 -22.005 -12.064 3.028 1.00 0.00 H new ATOM 0 HH11 ARG B 20 -21.776 -8.928 3.041 1.00 0.00 H new ATOM 0 HH12 ARG B 20 -22.968 -8.533 1.798 1.00 0.00 H new ATOM 0 HH21 ARG B 20 -24.442 -11.701 1.854 1.00 0.00 H new ATOM 0 HH22 ARG B 20 -24.463 -10.089 1.132 1.00 0.00 H new ATOM 1799 N GLU B 21 -18.302 -13.448 3.785 1.00 0.00 N ATOM 1800 CA GLU B 21 -18.202 -14.625 2.864 1.00 0.00 C ATOM 1801 C GLU B 21 -16.774 -14.753 2.333 1.00 0.00 C ATOM 1802 O GLU B 21 -16.210 -15.829 2.318 1.00 0.00 O ATOM 1803 CB GLU B 21 -19.169 -14.451 1.690 1.00 0.00 C ATOM 1804 CG GLU B 21 -20.604 -14.392 2.209 1.00 0.00 C ATOM 1805 CD GLU B 21 -21.574 -14.475 1.029 1.00 0.00 C ATOM 1806 OE1 GLU B 21 -21.741 -15.562 0.500 1.00 0.00 O ATOM 1807 OE2 GLU B 21 -22.132 -13.450 0.673 1.00 0.00 O ATOM 0 H GLU B 21 -17.696 -12.659 3.560 1.00 0.00 H new ATOM 0 HA GLU B 21 -18.463 -15.528 3.417 1.00 0.00 H new ATOM 0 HB2 GLU B 21 -18.932 -13.538 1.143 1.00 0.00 H new ATOM 0 HB3 GLU B 21 -19.059 -15.279 0.990 1.00 0.00 H new ATOM 0 HG2 GLU B 21 -20.786 -15.213 2.902 1.00 0.00 H new ATOM 0 HG3 GLU B 21 -20.765 -13.467 2.762 1.00 0.00 H new ATOM 1814 N GLY B 22 -16.178 -13.673 1.899 1.00 0.00 N ATOM 1815 CA GLY B 22 -14.783 -13.754 1.370 1.00 0.00 C ATOM 1816 C GLY B 22 -14.673 -14.935 0.403 1.00 0.00 C ATOM 1817 O GLY B 22 -13.589 -15.364 0.057 1.00 0.00 O ATOM 0 H GLY B 22 -16.594 -12.742 1.888 1.00 0.00 H new ATOM 0 HA2 GLY B 22 -14.521 -12.827 0.860 1.00 0.00 H new ATOM 0 HA3 GLY B 22 -14.077 -13.876 2.192 1.00 0.00 H new ATOM 1821 N ASP B 23 -15.784 -15.467 -0.036 1.00 0.00 N ATOM 1822 CA ASP B 23 -15.733 -16.621 -0.979 1.00 0.00 C ATOM 1823 C ASP B 23 -14.745 -16.294 -2.099 1.00 0.00 C ATOM 1824 O ASP B 23 -13.814 -17.031 -2.357 1.00 0.00 O ATOM 1825 CB ASP B 23 -17.123 -16.856 -1.573 1.00 0.00 C ATOM 1826 CG ASP B 23 -17.111 -18.133 -2.413 1.00 0.00 C ATOM 1827 OD1 ASP B 23 -16.511 -19.101 -1.976 1.00 0.00 O ATOM 1828 OD2 ASP B 23 -17.704 -18.122 -3.478 1.00 0.00 O ATOM 0 H ASP B 23 -16.721 -15.153 0.217 1.00 0.00 H new ATOM 0 HA ASP B 23 -15.413 -17.520 -0.452 1.00 0.00 H new ATOM 0 HB2 ASP B 23 -17.861 -16.940 -0.775 1.00 0.00 H new ATOM 0 HB3 ASP B 23 -17.415 -16.006 -2.189 1.00 0.00 H new ATOM 1833 N LYS B 24 -14.923 -15.175 -2.746 1.00 0.00 N ATOM 1834 CA LYS B 24 -13.980 -14.774 -3.827 1.00 0.00 C ATOM 1835 C LYS B 24 -12.846 -13.958 -3.199 1.00 0.00 C ATOM 1836 O LYS B 24 -12.825 -13.724 -2.006 1.00 0.00 O ATOM 1837 CB LYS B 24 -14.721 -13.922 -4.860 1.00 0.00 C ATOM 1838 CG LYS B 24 -16.067 -14.575 -5.186 1.00 0.00 C ATOM 1839 CD LYS B 24 -16.667 -13.928 -6.438 1.00 0.00 C ATOM 1840 CE LYS B 24 -16.721 -12.408 -6.262 1.00 0.00 C ATOM 1841 NZ LYS B 24 -17.182 -12.080 -4.883 1.00 0.00 N ATOM 0 H LYS B 24 -15.684 -14.519 -2.571 1.00 0.00 H new ATOM 0 HA LYS B 24 -13.575 -15.656 -4.323 1.00 0.00 H new ATOM 0 HB2 LYS B 24 -14.877 -12.915 -4.473 1.00 0.00 H new ATOM 0 HB3 LYS B 24 -14.122 -13.826 -5.766 1.00 0.00 H new ATOM 0 HG2 LYS B 24 -15.933 -15.645 -5.347 1.00 0.00 H new ATOM 0 HG3 LYS B 24 -16.750 -14.462 -4.344 1.00 0.00 H new ATOM 0 HD2 LYS B 24 -16.067 -14.181 -7.312 1.00 0.00 H new ATOM 0 HD3 LYS B 24 -17.669 -14.318 -6.615 1.00 0.00 H new ATOM 0 HE2 LYS B 24 -15.736 -11.976 -6.439 1.00 0.00 H new ATOM 0 HE3 LYS B 24 -17.398 -11.971 -6.996 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 -17.648 -11.150 -4.885 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 -17.855 -12.804 -4.561 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 -16.365 -12.057 -4.240 1.00 0.00 H new ATOM 1855 N HIS B 25 -11.917 -13.508 -3.999 1.00 0.00 N ATOM 1856 CA HIS B 25 -10.781 -12.682 -3.478 1.00 0.00 C ATOM 1857 C HIS B 25 -10.645 -11.456 -4.377 1.00 0.00 C ATOM 1858 O HIS B 25 -9.559 -11.064 -4.754 1.00 0.00 O ATOM 1859 CB HIS B 25 -9.488 -13.500 -3.525 1.00 0.00 C ATOM 1860 CG HIS B 25 -8.351 -12.669 -3.000 1.00 0.00 C ATOM 1861 ND1 HIS B 25 -7.035 -13.099 -3.055 1.00 0.00 N ATOM 1862 CD2 HIS B 25 -8.318 -11.431 -2.409 1.00 0.00 C ATOM 1863 CE1 HIS B 25 -6.271 -12.134 -2.511 1.00 0.00 C ATOM 1864 NE2 HIS B 25 -7.003 -11.094 -2.101 1.00 0.00 N ATOM 0 H HIS B 25 -11.894 -13.678 -5.004 1.00 0.00 H new ATOM 0 HA HIS B 25 -10.968 -12.381 -2.447 1.00 0.00 H new ATOM 0 HB2 HIS B 25 -9.596 -14.406 -2.929 1.00 0.00 H new ATOM 0 HB3 HIS B 25 -9.281 -13.815 -4.548 1.00 0.00 H new ATOM 0 HD2 HIS B 25 -9.181 -10.812 -2.213 1.00 0.00 H new ATOM 0 HE1 HIS B 25 -5.197 -12.193 -2.417 1.00 0.00 H new ATOM 0 HE2 HIS B 25 -6.670 -10.238 -1.658 1.00 0.00 H new ATOM 1872 N LYS B 26 -11.752 -10.844 -4.714 1.00 0.00 N ATOM 1873 CA LYS B 26 -11.721 -9.630 -5.581 1.00 0.00 C ATOM 1874 C LYS B 26 -12.667 -8.571 -5.006 1.00 0.00 C ATOM 1875 O LYS B 26 -13.653 -8.890 -4.371 1.00 0.00 O ATOM 1876 CB LYS B 26 -12.174 -10.004 -6.993 1.00 0.00 C ATOM 1877 CG LYS B 26 -11.447 -11.273 -7.446 1.00 0.00 C ATOM 1878 CD LYS B 26 -11.876 -11.628 -8.870 1.00 0.00 C ATOM 1879 CE LYS B 26 -11.244 -12.962 -9.278 1.00 0.00 C ATOM 1880 NZ LYS B 26 -9.767 -12.799 -9.391 1.00 0.00 N ATOM 0 H LYS B 26 -12.684 -11.138 -4.422 1.00 0.00 H new ATOM 0 HA LYS B 26 -10.707 -9.232 -5.617 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -13.252 -10.165 -7.009 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -11.963 -9.186 -7.682 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -10.368 -11.120 -7.408 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -11.676 -12.097 -6.770 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -12.962 -11.696 -8.927 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -11.569 -10.842 -9.560 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -11.480 -13.729 -8.541 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -11.657 -13.296 -10.230 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -9.364 -13.618 -9.889 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -9.553 -11.931 -9.923 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -9.351 -12.734 -8.440 1.00 0.00 H new ATOM 1894 N LEU B 27 -12.375 -7.313 -5.229 1.00 0.00 N ATOM 1895 CA LEU B 27 -13.249 -6.210 -4.707 1.00 0.00 C ATOM 1896 C LEU B 27 -13.738 -5.376 -5.894 1.00 0.00 C ATOM 1897 O LEU B 27 -13.022 -5.177 -6.853 1.00 0.00 O ATOM 1898 CB LEU B 27 -12.426 -5.330 -3.753 1.00 0.00 C ATOM 1899 CG LEU B 27 -13.352 -4.439 -2.902 1.00 0.00 C ATOM 1900 CD1 LEU B 27 -14.201 -5.298 -1.938 1.00 0.00 C ATOM 1901 CD2 LEU B 27 -12.491 -3.457 -2.093 1.00 0.00 C ATOM 0 H LEU B 27 -11.560 -6.998 -5.756 1.00 0.00 H new ATOM 0 HA LEU B 27 -14.104 -6.620 -4.169 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -11.819 -5.959 -3.102 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -11.739 -4.707 -4.326 1.00 0.00 H new ATOM 0 HG LEU B 27 -14.027 -3.893 -3.562 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -14.848 -4.650 -1.347 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -14.812 -5.993 -2.513 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -13.543 -5.858 -1.274 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -13.136 -2.821 -1.487 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -11.817 -4.015 -1.443 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -11.908 -2.837 -2.775 1.00 0.00 H new ATOM 1913 N LYS B 28 -14.957 -4.899 -5.855 1.00 0.00 N ATOM 1914 CA LYS B 28 -15.481 -4.090 -7.001 1.00 0.00 C ATOM 1915 C LYS B 28 -15.238 -2.601 -6.738 1.00 0.00 C ATOM 1916 O LYS B 28 -15.132 -2.171 -5.607 1.00 0.00 O ATOM 1917 CB LYS B 28 -16.985 -4.336 -7.157 1.00 0.00 C ATOM 1918 CG LYS B 28 -17.233 -5.767 -7.649 1.00 0.00 C ATOM 1919 CD LYS B 28 -18.665 -5.886 -8.182 1.00 0.00 C ATOM 1920 CE LYS B 28 -19.659 -5.667 -7.040 1.00 0.00 C ATOM 1921 NZ LYS B 28 -21.013 -6.117 -7.469 1.00 0.00 N ATOM 0 H LYS B 28 -15.610 -5.033 -5.083 1.00 0.00 H new ATOM 0 HA LYS B 28 -14.964 -4.387 -7.914 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -17.489 -4.178 -6.203 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -17.408 -3.621 -7.863 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -16.520 -6.022 -8.433 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -17.077 -6.475 -6.835 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -18.833 -5.151 -8.969 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -18.818 -6.870 -8.626 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -19.343 -6.221 -6.156 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -19.685 -4.613 -6.763 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -21.690 -5.969 -6.694 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -21.314 -5.569 -8.300 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -20.982 -7.128 -7.713 1.00 0.00 H new ATOM 1935 N LYS B 29 -15.154 -1.809 -7.774 1.00 0.00 N ATOM 1936 CA LYS B 29 -14.925 -0.346 -7.587 1.00 0.00 C ATOM 1937 C LYS B 29 -16.049 0.255 -6.730 1.00 0.00 C ATOM 1938 O LYS B 29 -15.819 1.095 -5.884 1.00 0.00 O ATOM 1939 CB LYS B 29 -14.918 0.338 -8.966 1.00 0.00 C ATOM 1940 CG LYS B 29 -15.974 -0.318 -9.882 1.00 0.00 C ATOM 1941 CD LYS B 29 -16.465 0.689 -10.929 1.00 0.00 C ATOM 1942 CE LYS B 29 -17.484 0.013 -11.849 1.00 0.00 C ATOM 1943 NZ LYS B 29 -18.116 1.037 -12.729 1.00 0.00 N ATOM 0 H LYS B 29 -15.234 -2.113 -8.744 1.00 0.00 H new ATOM 0 HA LYS B 29 -13.970 -0.189 -7.085 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -15.130 1.401 -8.855 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -13.930 0.255 -9.418 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -15.546 -1.189 -10.377 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -16.814 -0.672 -9.285 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -16.918 1.550 -10.437 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -15.624 1.062 -11.513 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -16.994 -0.749 -12.454 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -18.246 -0.492 -11.256 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -18.476 0.579 -13.591 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -18.903 1.491 -12.223 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -17.410 1.756 -12.988 1.00 0.00 H new ATOM 1957 N SER B 30 -17.263 -0.156 -6.966 1.00 0.00 N ATOM 1958 CA SER B 30 -18.417 0.395 -6.198 1.00 0.00 C ATOM 1959 C SER B 30 -18.244 0.156 -4.695 1.00 0.00 C ATOM 1960 O SER B 30 -18.557 1.006 -3.877 1.00 0.00 O ATOM 1961 CB SER B 30 -19.698 -0.296 -6.664 1.00 0.00 C ATOM 1962 OG SER B 30 -19.987 0.097 -8.000 1.00 0.00 O ATOM 0 H SER B 30 -17.509 -0.857 -7.665 1.00 0.00 H new ATOM 0 HA SER B 30 -18.470 1.469 -6.375 1.00 0.00 H new ATOM 0 HB2 SER B 30 -19.581 -1.378 -6.609 1.00 0.00 H new ATOM 0 HB3 SER B 30 -20.527 -0.031 -6.008 1.00 0.00 H new ATOM 0 HG SER B 30 -20.807 -0.347 -8.301 1.00 0.00 H new ATOM 1968 N GLU B 31 -17.755 -0.996 -4.314 1.00 0.00 N ATOM 1969 CA GLU B 31 -17.591 -1.267 -2.856 1.00 0.00 C ATOM 1970 C GLU B 31 -16.334 -0.560 -2.359 1.00 0.00 C ATOM 1971 O GLU B 31 -16.284 -0.049 -1.258 1.00 0.00 O ATOM 1972 CB GLU B 31 -17.478 -2.773 -2.611 1.00 0.00 C ATOM 1973 CG GLU B 31 -18.759 -3.468 -3.079 1.00 0.00 C ATOM 1974 CD GLU B 31 -18.757 -4.919 -2.598 1.00 0.00 C ATOM 1975 OE1 GLU B 31 -18.198 -5.752 -3.292 1.00 0.00 O ATOM 1976 OE2 GLU B 31 -19.315 -5.173 -1.543 1.00 0.00 O ATOM 0 H GLU B 31 -17.467 -1.749 -4.938 1.00 0.00 H new ATOM 0 HA GLU B 31 -18.460 -0.893 -2.314 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -16.618 -3.175 -3.146 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -17.313 -2.968 -1.551 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -19.632 -2.946 -2.688 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -18.827 -3.434 -4.166 1.00 0.00 H new ATOM 1983 N LEU B 32 -15.322 -0.513 -3.183 1.00 0.00 N ATOM 1984 CA LEU B 32 -14.067 0.177 -2.788 1.00 0.00 C ATOM 1985 C LEU B 32 -14.399 1.640 -2.495 1.00 0.00 C ATOM 1986 O LEU B 32 -13.931 2.202 -1.525 1.00 0.00 O ATOM 1987 CB LEU B 32 -13.046 0.063 -3.931 1.00 0.00 C ATOM 1988 CG LEU B 32 -11.872 1.032 -3.730 1.00 0.00 C ATOM 1989 CD1 LEU B 32 -11.208 0.783 -2.376 1.00 0.00 C ATOM 1990 CD2 LEU B 32 -10.845 0.803 -4.840 1.00 0.00 C ATOM 0 H LEU B 32 -15.314 -0.925 -4.116 1.00 0.00 H new ATOM 0 HA LEU B 32 -13.634 -0.279 -1.897 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -12.671 -0.959 -3.986 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -13.536 0.274 -4.881 1.00 0.00 H new ATOM 0 HG LEU B 32 -12.243 2.057 -3.762 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -10.377 1.476 -2.245 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -11.937 0.936 -1.580 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -10.836 -0.241 -2.336 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -10.007 1.487 -4.707 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -10.485 -0.225 -4.797 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -11.310 0.984 -5.809 1.00 0.00 H new ATOM 2002 N LYS B 33 -15.188 2.280 -3.318 1.00 0.00 N ATOM 2003 CA LYS B 33 -15.501 3.708 -3.050 1.00 0.00 C ATOM 2004 C LYS B 33 -16.018 3.830 -1.620 1.00 0.00 C ATOM 2005 O LYS B 33 -15.470 4.545 -0.805 1.00 0.00 O ATOM 2006 CB LYS B 33 -16.564 4.196 -4.035 1.00 0.00 C ATOM 2007 CG LYS B 33 -16.861 5.676 -3.781 1.00 0.00 C ATOM 2008 CD LYS B 33 -17.629 6.256 -4.972 1.00 0.00 C ATOM 2009 CE LYS B 33 -18.265 7.589 -4.573 1.00 0.00 C ATOM 2010 NZ LYS B 33 -17.212 8.512 -4.065 1.00 0.00 N ATOM 0 H LYS B 33 -15.622 1.881 -4.150 1.00 0.00 H new ATOM 0 HA LYS B 33 -14.606 4.318 -3.173 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -16.217 4.055 -5.059 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -17.475 3.608 -3.923 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -17.446 5.789 -2.868 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -15.931 6.224 -3.633 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -16.955 6.401 -5.816 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -18.400 5.557 -5.296 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -18.770 8.034 -5.430 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -19.022 7.427 -3.806 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -17.451 9.489 -4.328 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -17.155 8.437 -3.029 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -16.295 8.255 -4.482 1.00 0.00 H new ATOM 2024 N GLU B 34 -17.069 3.125 -1.306 1.00 0.00 N ATOM 2025 CA GLU B 34 -17.611 3.197 0.083 1.00 0.00 C ATOM 2026 C GLU B 34 -16.469 2.942 1.073 1.00 0.00 C ATOM 2027 O GLU B 34 -16.388 3.564 2.114 1.00 0.00 O ATOM 2028 CB GLU B 34 -18.693 2.131 0.268 1.00 0.00 C ATOM 2029 CG GLU B 34 -19.821 2.364 -0.738 1.00 0.00 C ATOM 2030 CD GLU B 34 -21.012 1.473 -0.382 1.00 0.00 C ATOM 2031 OE1 GLU B 34 -21.837 1.906 0.405 1.00 0.00 O ATOM 2032 OE2 GLU B 34 -21.077 0.371 -0.903 1.00 0.00 O ATOM 0 H GLU B 34 -17.573 2.508 -1.942 1.00 0.00 H new ATOM 0 HA GLU B 34 -18.044 4.181 0.260 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -18.267 1.138 0.128 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -19.085 2.169 1.284 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -20.121 3.412 -0.728 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -19.475 2.141 -1.747 1.00 0.00 H new ATOM 2039 N LEU B 35 -15.585 2.036 0.757 1.00 0.00 N ATOM 2040 CA LEU B 35 -14.448 1.744 1.679 1.00 0.00 C ATOM 2041 C LEU B 35 -13.507 2.956 1.734 1.00 0.00 C ATOM 2042 O LEU B 35 -12.995 3.300 2.780 1.00 0.00 O ATOM 2043 CB LEU B 35 -13.690 0.502 1.180 1.00 0.00 C ATOM 2044 CG LEU B 35 -12.931 -0.170 2.345 1.00 0.00 C ATOM 2045 CD1 LEU B 35 -13.864 -1.119 3.108 1.00 0.00 C ATOM 2046 CD2 LEU B 35 -11.750 -0.977 1.791 1.00 0.00 C ATOM 0 H LEU B 35 -15.600 1.484 -0.101 1.00 0.00 H new ATOM 0 HA LEU B 35 -14.828 1.548 2.681 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -14.391 -0.206 0.738 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -12.988 0.787 0.397 1.00 0.00 H new ATOM 0 HG LEU B 35 -12.571 0.606 3.021 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -13.317 -1.587 3.927 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -14.707 -0.556 3.509 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -14.232 -1.890 2.431 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -11.215 -1.451 2.614 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -12.120 -1.743 1.110 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -11.074 -0.311 1.255 1.00 0.00 H new ATOM 2058 N ILE B 36 -13.288 3.620 0.630 1.00 0.00 N ATOM 2059 CA ILE B 36 -12.399 4.819 0.636 1.00 0.00 C ATOM 2060 C ILE B 36 -12.970 5.868 1.600 1.00 0.00 C ATOM 2061 O ILE B 36 -12.243 6.629 2.207 1.00 0.00 O ATOM 2062 CB ILE B 36 -12.339 5.395 -0.797 1.00 0.00 C ATOM 2063 CG1 ILE B 36 -11.418 4.510 -1.651 1.00 0.00 C ATOM 2064 CG2 ILE B 36 -11.785 6.828 -0.780 1.00 0.00 C ATOM 2065 CD1 ILE B 36 -11.495 4.913 -3.130 1.00 0.00 C ATOM 0 H ILE B 36 -13.688 3.383 -0.278 1.00 0.00 H new ATOM 0 HA ILE B 36 -11.396 4.546 0.963 1.00 0.00 H new ATOM 0 HB ILE B 36 -13.346 5.412 -1.215 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -10.391 4.599 -1.298 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -11.704 3.464 -1.539 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -11.750 7.217 -1.798 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -12.431 7.461 -0.172 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -10.780 6.825 -0.358 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -10.835 4.273 -3.716 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -12.519 4.800 -3.485 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -11.185 5.952 -3.241 1.00 0.00 H new ATOM 2077 N ASN B 37 -14.268 5.942 1.707 1.00 0.00 N ATOM 2078 CA ASN B 37 -14.894 6.972 2.585 1.00 0.00 C ATOM 2079 C ASN B 37 -14.602 6.717 4.069 1.00 0.00 C ATOM 2080 O ASN B 37 -14.292 7.630 4.808 1.00 0.00 O ATOM 2081 CB ASN B 37 -16.408 6.958 2.369 1.00 0.00 C ATOM 2082 CG ASN B 37 -16.732 7.516 0.982 1.00 0.00 C ATOM 2083 OD1 ASN B 37 -17.126 8.658 0.852 1.00 0.00 O ATOM 2084 ND2 ASN B 37 -16.581 6.754 -0.067 1.00 0.00 N ATOM 0 H ASN B 37 -14.925 5.331 1.222 1.00 0.00 H new ATOM 0 HA ASN B 37 -14.469 7.940 2.320 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -16.790 5.941 2.462 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -16.901 7.555 3.137 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -16.794 7.117 -0.996 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -16.250 5.795 0.042 1.00 0.00 H new ATOM 2091 N ASN B 38 -14.740 5.500 4.529 1.00 0.00 N ATOM 2092 CA ASN B 38 -14.514 5.219 5.984 1.00 0.00 C ATOM 2093 C ASN B 38 -13.049 4.869 6.274 1.00 0.00 C ATOM 2094 O ASN B 38 -12.715 4.516 7.388 1.00 0.00 O ATOM 2095 CB ASN B 38 -15.404 4.050 6.414 1.00 0.00 C ATOM 2096 CG ASN B 38 -15.473 3.994 7.940 1.00 0.00 C ATOM 2097 OD1 ASN B 38 -14.594 3.452 8.580 1.00 0.00 O ATOM 2098 ND2 ASN B 38 -16.488 4.536 8.556 1.00 0.00 N ATOM 0 H ASN B 38 -14.998 4.690 3.965 1.00 0.00 H new ATOM 0 HA ASN B 38 -14.764 6.120 6.545 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -16.405 4.169 5.999 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -15.006 3.114 6.023 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -16.543 4.504 9.574 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -17.226 4.991 8.019 1.00 0.00 H new ATOM 2105 N GLU B 39 -12.174 4.949 5.300 1.00 0.00 N ATOM 2106 CA GLU B 39 -10.730 4.602 5.548 1.00 0.00 C ATOM 2107 C GLU B 39 -9.826 5.782 5.187 1.00 0.00 C ATOM 2108 O GLU B 39 -8.736 5.910 5.710 1.00 0.00 O ATOM 2109 CB GLU B 39 -10.346 3.399 4.683 1.00 0.00 C ATOM 2110 CG GLU B 39 -11.100 2.156 5.163 1.00 0.00 C ATOM 2111 CD GLU B 39 -10.461 0.906 4.556 1.00 0.00 C ATOM 2112 OE1 GLU B 39 -9.522 1.056 3.791 1.00 0.00 O ATOM 2113 OE2 GLU B 39 -10.921 -0.181 4.866 1.00 0.00 O ATOM 0 H GLU B 39 -12.392 5.238 4.346 1.00 0.00 H new ATOM 0 HA GLU B 39 -10.602 4.366 6.604 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -10.584 3.599 3.638 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -9.271 3.228 4.738 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -11.073 2.099 6.251 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -12.149 2.219 4.873 1.00 0.00 H new ATOM 2120 N LEU B 40 -10.262 6.643 4.302 1.00 0.00 N ATOM 2121 CA LEU B 40 -9.423 7.821 3.903 1.00 0.00 C ATOM 2122 C LEU B 40 -10.165 9.118 4.235 1.00 0.00 C ATOM 2123 O LEU B 40 -9.990 10.131 3.586 1.00 0.00 O ATOM 2124 CB LEU B 40 -9.155 7.754 2.396 1.00 0.00 C ATOM 2125 CG LEU B 40 -8.120 6.646 2.092 1.00 0.00 C ATOM 2126 CD1 LEU B 40 -8.309 6.134 0.660 1.00 0.00 C ATOM 2127 CD2 LEU B 40 -6.693 7.196 2.243 1.00 0.00 C ATOM 0 H LEU B 40 -11.167 6.583 3.835 1.00 0.00 H new ATOM 0 HA LEU B 40 -8.479 7.801 4.447 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -10.083 7.552 1.862 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -8.785 8.716 2.041 1.00 0.00 H new ATOM 0 HG LEU B 40 -8.270 5.829 2.798 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -7.577 5.354 0.453 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -9.314 5.727 0.549 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -8.171 6.957 -0.042 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -5.974 6.406 2.026 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -6.546 8.022 1.547 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -6.546 7.551 3.263 1.00 0.00 H new ATOM 2139 N SER B 41 -10.994 9.094 5.244 1.00 0.00 N ATOM 2140 CA SER B 41 -11.750 10.320 5.625 1.00 0.00 C ATOM 2141 C SER B 41 -10.798 11.330 6.271 1.00 0.00 C ATOM 2142 O SER B 41 -10.729 12.475 5.871 1.00 0.00 O ATOM 2143 CB SER B 41 -12.851 9.949 6.623 1.00 0.00 C ATOM 2144 OG SER B 41 -12.335 10.028 7.946 1.00 0.00 O ATOM 0 H SER B 41 -11.180 8.275 5.822 1.00 0.00 H new ATOM 0 HA SER B 41 -12.197 10.761 4.734 1.00 0.00 H new ATOM 0 HB2 SER B 41 -13.701 10.623 6.511 1.00 0.00 H new ATOM 0 HB3 SER B 41 -13.215 8.941 6.422 1.00 0.00 H new ATOM 0 HG SER B 41 -13.039 9.793 8.586 1.00 0.00 H new ATOM 2150 N HIS B 42 -10.070 10.919 7.274 1.00 0.00 N ATOM 2151 CA HIS B 42 -9.133 11.859 7.953 1.00 0.00 C ATOM 2152 C HIS B 42 -8.181 12.481 6.930 1.00 0.00 C ATOM 2153 O HIS B 42 -8.010 13.684 6.880 1.00 0.00 O ATOM 2154 CB HIS B 42 -8.321 11.091 8.999 1.00 0.00 C ATOM 2155 CG HIS B 42 -7.528 12.059 9.830 1.00 0.00 C ATOM 2156 ND1 HIS B 42 -8.127 13.086 10.543 1.00 0.00 N ATOM 2157 CD2 HIS B 42 -6.182 12.169 10.074 1.00 0.00 C ATOM 2158 CE1 HIS B 42 -7.151 13.762 11.177 1.00 0.00 C ATOM 2159 NE2 HIS B 42 -5.946 13.245 10.925 1.00 0.00 N ATOM 0 H HIS B 42 -10.084 9.972 7.653 1.00 0.00 H new ATOM 0 HA HIS B 42 -9.706 12.652 8.435 1.00 0.00 H new ATOM 0 HB2 HIS B 42 -8.987 10.509 9.636 1.00 0.00 H new ATOM 0 HB3 HIS B 42 -7.652 10.384 8.508 1.00 0.00 H new ATOM 0 HD2 HIS B 42 -5.421 11.519 9.667 1.00 0.00 H new ATOM 0 HE1 HIS B 42 -7.322 14.619 11.812 1.00 0.00 H new ATOM 0 HE2 HIS B 42 -5.046 13.569 11.280 1.00 0.00 H new ATOM 2167 N PHE B 43 -7.557 11.676 6.117 1.00 0.00 N ATOM 2168 CA PHE B 43 -6.613 12.228 5.104 1.00 0.00 C ATOM 2169 C PHE B 43 -7.373 13.158 4.156 1.00 0.00 C ATOM 2170 O PHE B 43 -6.821 14.094 3.612 1.00 0.00 O ATOM 2171 CB PHE B 43 -5.984 11.078 4.314 1.00 0.00 C ATOM 2172 CG PHE B 43 -5.070 10.294 5.225 1.00 0.00 C ATOM 2173 CD1 PHE B 43 -3.791 10.781 5.519 1.00 0.00 C ATOM 2174 CD2 PHE B 43 -5.503 9.084 5.781 1.00 0.00 C ATOM 2175 CE1 PHE B 43 -2.944 10.057 6.368 1.00 0.00 C ATOM 2176 CE2 PHE B 43 -4.656 8.361 6.629 1.00 0.00 C ATOM 2177 CZ PHE B 43 -3.377 8.847 6.923 1.00 0.00 C ATOM 0 H PHE B 43 -7.659 10.661 6.109 1.00 0.00 H new ATOM 0 HA PHE B 43 -5.825 12.791 5.604 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -6.762 10.428 3.912 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -5.424 11.468 3.464 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -3.457 11.715 5.091 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -6.490 8.709 5.556 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -1.957 10.432 6.594 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -4.990 7.427 7.057 1.00 0.00 H new ATOM 0 HZ PHE B 43 -2.724 8.289 7.578 1.00 0.00 H new ATOM 2187 N LEU B 44 -8.634 12.899 3.952 1.00 0.00 N ATOM 2188 CA LEU B 44 -9.440 13.754 3.035 1.00 0.00 C ATOM 2189 C LEU B 44 -9.211 15.234 3.377 1.00 0.00 C ATOM 2190 O LEU B 44 -9.307 16.100 2.531 1.00 0.00 O ATOM 2191 CB LEU B 44 -10.930 13.389 3.202 1.00 0.00 C ATOM 2192 CG LEU B 44 -11.681 13.535 1.871 1.00 0.00 C ATOM 2193 CD1 LEU B 44 -13.168 13.243 2.095 1.00 0.00 C ATOM 2194 CD2 LEU B 44 -11.515 14.961 1.330 1.00 0.00 C ATOM 0 H LEU B 44 -9.144 12.128 4.383 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.139 13.586 2.001 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -11.019 12.365 3.564 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -11.385 14.034 3.954 1.00 0.00 H new ATOM 0 HG LEU B 44 -11.272 12.830 1.147 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -13.705 13.346 1.152 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -13.287 12.227 2.471 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -13.572 13.948 2.821 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -12.051 15.056 0.386 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -11.919 15.673 2.050 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -10.457 15.168 1.170 1.00 0.00 H new ATOM 2206 N GLU B 45 -8.915 15.530 4.612 1.00 0.00 N ATOM 2207 CA GLU B 45 -8.693 16.950 5.007 1.00 0.00 C ATOM 2208 C GLU B 45 -7.284 17.400 4.610 1.00 0.00 C ATOM 2209 O GLU B 45 -7.081 18.512 4.166 1.00 0.00 O ATOM 2210 CB GLU B 45 -8.857 17.083 6.523 1.00 0.00 C ATOM 2211 CG GLU B 45 -10.264 16.639 6.926 1.00 0.00 C ATOM 2212 CD GLU B 45 -11.287 17.660 6.424 1.00 0.00 C ATOM 2213 OE1 GLU B 45 -10.994 18.843 6.488 1.00 0.00 O ATOM 2214 OE2 GLU B 45 -12.345 17.241 5.985 1.00 0.00 O ATOM 0 H GLU B 45 -8.817 14.850 5.366 1.00 0.00 H new ATOM 0 HA GLU B 45 -9.422 17.578 4.495 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -8.112 16.474 7.035 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -8.689 18.116 6.828 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -10.480 15.656 6.507 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -10.330 16.545 8.010 1.00 0.00 H new ATOM 2221 N GLU B 46 -6.308 16.554 4.785 1.00 0.00 N ATOM 2222 CA GLU B 46 -4.907 16.945 4.439 1.00 0.00 C ATOM 2223 C GLU B 46 -4.636 16.722 2.947 1.00 0.00 C ATOM 2224 O GLU B 46 -3.723 16.008 2.580 1.00 0.00 O ATOM 2225 CB GLU B 46 -3.929 16.095 5.256 1.00 0.00 C ATOM 2226 CG GLU B 46 -4.264 16.212 6.745 1.00 0.00 C ATOM 2227 CD GLU B 46 -3.419 15.214 7.538 1.00 0.00 C ATOM 2228 OE1 GLU B 46 -2.886 14.303 6.926 1.00 0.00 O ATOM 2229 OE2 GLU B 46 -3.320 15.377 8.743 1.00 0.00 O ATOM 0 H GLU B 46 -6.416 15.609 5.152 1.00 0.00 H new ATOM 0 HA GLU B 46 -4.773 18.002 4.668 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -3.987 15.053 4.941 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -2.906 16.426 5.076 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -4.070 17.226 7.094 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -5.324 16.016 6.907 1.00 0.00 H new ATOM 2236 N ILE B 47 -5.411 17.337 2.083 1.00 0.00 N ATOM 2237 CA ILE B 47 -5.190 17.178 0.606 1.00 0.00 C ATOM 2238 C ILE B 47 -5.114 18.562 -0.051 1.00 0.00 C ATOM 2239 O ILE B 47 -5.998 19.383 0.096 1.00 0.00 O ATOM 2240 CB ILE B 47 -6.341 16.358 0.001 1.00 0.00 C ATOM 2241 CG1 ILE B 47 -6.169 14.891 0.420 1.00 0.00 C ATOM 2242 CG2 ILE B 47 -6.310 16.464 -1.532 1.00 0.00 C ATOM 2243 CD1 ILE B 47 -7.367 14.063 -0.046 1.00 0.00 C ATOM 0 H ILE B 47 -6.190 17.944 2.337 1.00 0.00 H new ATOM 0 HA ILE B 47 -4.252 16.652 0.427 1.00 0.00 H new ATOM 0 HB ILE B 47 -7.296 16.741 0.360 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -5.251 14.488 -0.008 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -6.071 14.824 1.504 1.00 0.00 H new ATOM 0 HG21 ILE B 47 -7.128 15.880 -1.954 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -6.419 17.508 -1.827 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -5.361 16.079 -1.904 1.00 0.00 H new ATOM 0 HD11 ILE B 47 -7.232 13.025 0.258 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -8.279 14.457 0.403 1.00 0.00 H new ATOM 0 HD13 ILE B 47 -7.446 14.116 -1.132 1.00 0.00 H new ATOM 2255 N LYS B 48 -4.061 18.816 -0.784 1.00 0.00 N ATOM 2256 CA LYS B 48 -3.908 20.135 -1.469 1.00 0.00 C ATOM 2257 C LYS B 48 -4.469 20.035 -2.893 1.00 0.00 C ATOM 2258 O LYS B 48 -5.365 20.764 -3.270 1.00 0.00 O ATOM 2259 CB LYS B 48 -2.418 20.504 -1.530 1.00 0.00 C ATOM 2260 CG LYS B 48 -1.972 21.100 -0.191 1.00 0.00 C ATOM 2261 CD LYS B 48 -2.321 20.136 0.944 1.00 0.00 C ATOM 2262 CE LYS B 48 -1.582 20.557 2.215 1.00 0.00 C ATOM 2263 NZ LYS B 48 -2.003 21.932 2.605 1.00 0.00 N ATOM 0 H LYS B 48 -3.294 18.161 -0.939 1.00 0.00 H new ATOM 0 HA LYS B 48 -4.452 20.902 -0.917 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -1.825 19.619 -1.759 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -2.245 21.221 -2.333 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -0.898 21.287 -0.205 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -2.461 22.061 -0.029 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -3.397 20.137 1.119 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -2.044 19.118 0.669 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -1.798 19.857 3.022 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -0.505 20.529 2.048 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -1.707 22.121 3.584 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -1.558 22.625 1.969 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -3.038 22.011 2.534 1.00 0.00 H new ATOM 2277 N GLU B 49 -3.944 19.141 -3.687 1.00 0.00 N ATOM 2278 CA GLU B 49 -4.442 18.999 -5.086 1.00 0.00 C ATOM 2279 C GLU B 49 -5.832 18.356 -5.078 1.00 0.00 C ATOM 2280 O GLU B 49 -5.978 17.178 -4.820 1.00 0.00 O ATOM 2281 CB GLU B 49 -3.477 18.119 -5.883 1.00 0.00 C ATOM 2282 CG GLU B 49 -2.102 18.792 -5.945 1.00 0.00 C ATOM 2283 CD GLU B 49 -1.262 18.145 -7.049 1.00 0.00 C ATOM 2284 OE1 GLU B 49 -0.777 17.047 -6.833 1.00 0.00 O ATOM 2285 OE2 GLU B 49 -1.117 18.761 -8.093 1.00 0.00 O ATOM 0 H GLU B 49 -3.192 18.503 -3.428 1.00 0.00 H new ATOM 0 HA GLU B 49 -4.504 19.984 -5.548 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -3.392 17.138 -5.415 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -3.861 17.960 -6.891 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -2.216 19.858 -6.139 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -1.595 18.695 -4.985 1.00 0.00 H new ATOM 2292 N GLN B 50 -6.854 19.115 -5.374 1.00 0.00 N ATOM 2293 CA GLN B 50 -8.232 18.542 -5.400 1.00 0.00 C ATOM 2294 C GLN B 50 -8.486 17.886 -6.762 1.00 0.00 C ATOM 2295 O GLN B 50 -9.328 17.021 -6.898 1.00 0.00 O ATOM 2296 CB GLN B 50 -9.250 19.662 -5.173 1.00 0.00 C ATOM 2297 CG GLN B 50 -9.121 20.184 -3.740 1.00 0.00 C ATOM 2298 CD GLN B 50 -10.186 21.253 -3.484 1.00 0.00 C ATOM 2299 OE1 GLN B 50 -10.868 21.218 -2.479 1.00 0.00 O ATOM 2300 NE2 GLN B 50 -10.358 22.207 -4.357 1.00 0.00 N ATOM 0 H GLN B 50 -6.794 20.108 -5.599 1.00 0.00 H new ATOM 0 HA GLN B 50 -8.332 17.794 -4.614 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -9.081 20.471 -5.883 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -10.260 19.291 -5.347 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -9.237 19.364 -3.032 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -8.127 20.602 -3.583 1.00 0.00 H new ATOM 0 HE21 GLN B 50 -9.785 22.236 -5.200 1.00 0.00 H new ATOM 0 HE22 GLN B 50 -11.065 22.924 -4.196 1.00 0.00 H new ATOM 2309 N GLU B 51 -7.765 18.291 -7.772 1.00 0.00 N ATOM 2310 CA GLU B 51 -7.967 17.690 -9.122 1.00 0.00 C ATOM 2311 C GLU B 51 -7.403 16.267 -9.149 1.00 0.00 C ATOM 2312 O GLU B 51 -7.802 15.456 -9.962 1.00 0.00 O ATOM 2313 CB GLU B 51 -7.289 18.548 -10.193 1.00 0.00 C ATOM 2314 CG GLU B 51 -5.838 18.819 -9.787 1.00 0.00 C ATOM 2315 CD GLU B 51 -5.063 19.360 -10.989 1.00 0.00 C ATOM 2316 OE1 GLU B 51 -5.636 19.413 -12.065 1.00 0.00 O ATOM 2317 OE2 GLU B 51 -3.908 19.711 -10.814 1.00 0.00 O ATOM 0 H GLU B 51 -7.045 19.012 -7.721 1.00 0.00 H new ATOM 0 HA GLU B 51 -9.036 17.652 -9.334 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -7.319 18.038 -11.156 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -7.826 19.489 -10.314 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -5.807 19.537 -8.968 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -5.374 17.902 -9.425 1.00 0.00 H new ATOM 2324 N VAL B 52 -6.521 15.930 -8.251 1.00 0.00 N ATOM 2325 CA VAL B 52 -6.001 14.534 -8.224 1.00 0.00 C ATOM 2326 C VAL B 52 -7.118 13.633 -7.698 1.00 0.00 C ATOM 2327 O VAL B 52 -7.404 12.596 -8.262 1.00 0.00 O ATOM 2328 CB VAL B 52 -4.793 14.453 -7.282 1.00 0.00 C ATOM 2329 CG1 VAL B 52 -4.426 12.987 -7.027 1.00 0.00 C ATOM 2330 CG2 VAL B 52 -3.600 15.165 -7.918 1.00 0.00 C ATOM 0 H VAL B 52 -6.140 16.554 -7.540 1.00 0.00 H new ATOM 0 HA VAL B 52 -5.691 14.221 -9.221 1.00 0.00 H new ATOM 0 HB VAL B 52 -5.048 14.932 -6.337 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -3.567 12.938 -6.357 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -5.272 12.474 -6.570 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -4.177 12.505 -7.972 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -2.742 15.107 -7.248 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -3.353 14.686 -8.866 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -3.852 16.211 -8.095 1.00 0.00 H new ATOM 2340 N VAL B 53 -7.753 14.013 -6.628 1.00 0.00 N ATOM 2341 CA VAL B 53 -8.848 13.169 -6.081 1.00 0.00 C ATOM 2342 C VAL B 53 -9.969 13.053 -7.116 1.00 0.00 C ATOM 2343 O VAL B 53 -10.655 12.053 -7.196 1.00 0.00 O ATOM 2344 CB VAL B 53 -9.398 13.818 -4.810 1.00 0.00 C ATOM 2345 CG1 VAL B 53 -10.569 12.991 -4.277 1.00 0.00 C ATOM 2346 CG2 VAL B 53 -8.297 13.879 -3.752 1.00 0.00 C ATOM 0 H VAL B 53 -7.562 14.870 -6.109 1.00 0.00 H new ATOM 0 HA VAL B 53 -8.462 12.176 -5.850 1.00 0.00 H new ATOM 0 HB VAL B 53 -9.741 14.827 -5.039 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -10.960 13.455 -3.371 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -11.356 12.947 -5.030 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -10.227 11.981 -4.049 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -8.688 14.341 -2.846 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -7.954 12.870 -3.525 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -7.462 14.470 -4.129 1.00 0.00 H new ATOM 2356 N ASP B 54 -10.167 14.079 -7.898 1.00 0.00 N ATOM 2357 CA ASP B 54 -11.250 14.047 -8.919 1.00 0.00 C ATOM 2358 C ASP B 54 -10.987 12.938 -9.941 1.00 0.00 C ATOM 2359 O ASP B 54 -11.876 12.194 -10.303 1.00 0.00 O ATOM 2360 CB ASP B 54 -11.304 15.394 -9.642 1.00 0.00 C ATOM 2361 CG ASP B 54 -12.526 15.433 -10.560 1.00 0.00 C ATOM 2362 OD1 ASP B 54 -13.341 14.529 -10.468 1.00 0.00 O ATOM 2363 OD2 ASP B 54 -12.627 16.366 -11.339 1.00 0.00 O ATOM 0 H ASP B 54 -9.622 14.941 -7.873 1.00 0.00 H new ATOM 0 HA ASP B 54 -12.199 13.852 -8.420 1.00 0.00 H new ATOM 0 HB2 ASP B 54 -11.355 16.206 -8.917 1.00 0.00 H new ATOM 0 HB3 ASP B 54 -10.394 15.543 -10.224 1.00 0.00 H new ATOM 2368 N LYS B 55 -9.777 12.834 -10.431 1.00 0.00 N ATOM 2369 CA LYS B 55 -9.477 11.786 -11.450 1.00 0.00 C ATOM 2370 C LYS B 55 -9.523 10.399 -10.808 1.00 0.00 C ATOM 2371 O LYS B 55 -9.812 9.420 -11.467 1.00 0.00 O ATOM 2372 CB LYS B 55 -8.098 12.035 -12.069 1.00 0.00 C ATOM 2373 CG LYS B 55 -8.116 13.331 -12.902 1.00 0.00 C ATOM 2374 CD LYS B 55 -8.619 13.040 -14.324 1.00 0.00 C ATOM 2375 CE LYS B 55 -8.560 14.320 -15.163 1.00 0.00 C ATOM 2376 NZ LYS B 55 -9.709 15.200 -14.808 1.00 0.00 N ATOM 0 H LYS B 55 -8.989 13.427 -10.170 1.00 0.00 H new ATOM 0 HA LYS B 55 -10.230 11.834 -12.237 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -7.346 12.109 -11.283 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -7.817 11.192 -12.700 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -8.760 14.070 -12.425 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -7.115 13.760 -12.943 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -8.009 12.263 -14.784 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -9.641 12.663 -14.289 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -7.620 14.842 -14.984 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -8.591 14.074 -16.224 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -9.698 16.046 -15.413 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -10.600 14.683 -14.952 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -9.632 15.486 -13.811 1.00 0.00 H new ATOM 2390 N VAL B 56 -9.282 10.295 -9.531 1.00 0.00 N ATOM 2391 CA VAL B 56 -9.363 8.962 -8.872 1.00 0.00 C ATOM 2392 C VAL B 56 -10.813 8.480 -8.933 1.00 0.00 C ATOM 2393 O VAL B 56 -11.104 7.415 -9.440 1.00 0.00 O ATOM 2394 CB VAL B 56 -8.931 9.095 -7.411 1.00 0.00 C ATOM 2395 CG1 VAL B 56 -9.183 7.776 -6.677 1.00 0.00 C ATOM 2396 CG2 VAL B 56 -7.439 9.427 -7.355 1.00 0.00 C ATOM 0 H VAL B 56 -9.034 11.071 -8.918 1.00 0.00 H new ATOM 0 HA VAL B 56 -8.710 8.250 -9.377 1.00 0.00 H new ATOM 0 HB VAL B 56 -9.505 9.890 -6.934 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -8.874 7.874 -5.636 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -10.245 7.533 -6.719 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -8.610 6.980 -7.152 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -7.126 9.523 -6.315 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -6.871 8.629 -7.833 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -7.255 10.366 -7.877 1.00 0.00 H new ATOM 2406 N MET B 57 -11.723 9.257 -8.415 1.00 0.00 N ATOM 2407 CA MET B 57 -13.154 8.844 -8.437 1.00 0.00 C ATOM 2408 C MET B 57 -13.572 8.483 -9.864 1.00 0.00 C ATOM 2409 O MET B 57 -14.470 7.691 -10.069 1.00 0.00 O ATOM 2410 CB MET B 57 -14.023 9.993 -7.922 1.00 0.00 C ATOM 2411 CG MET B 57 -13.756 10.211 -6.432 1.00 0.00 C ATOM 2412 SD MET B 57 -14.489 8.856 -5.481 1.00 0.00 S ATOM 2413 CE MET B 57 -13.948 9.410 -3.845 1.00 0.00 C ATOM 0 H MET B 57 -11.538 10.160 -7.978 1.00 0.00 H new ATOM 0 HA MET B 57 -13.286 7.972 -7.797 1.00 0.00 H new ATOM 0 HB2 MET B 57 -13.805 10.905 -8.478 1.00 0.00 H new ATOM 0 HB3 MET B 57 -15.077 9.766 -8.083 1.00 0.00 H new ATOM 0 HG2 MET B 57 -12.683 10.260 -6.248 1.00 0.00 H new ATOM 0 HG3 MET B 57 -14.178 11.164 -6.112 1.00 0.00 H new ATOM 0 HE1 MET B 57 -14.297 8.707 -3.089 1.00 0.00 H new ATOM 0 HE2 MET B 57 -12.859 9.460 -3.819 1.00 0.00 H new ATOM 0 HE3 MET B 57 -14.361 10.398 -3.640 1.00 0.00 H new ATOM 2423 N GLU B 58 -12.916 9.027 -10.858 1.00 0.00 N ATOM 2424 CA GLU B 58 -13.269 8.675 -12.267 1.00 0.00 C ATOM 2425 C GLU B 58 -12.492 7.425 -12.685 1.00 0.00 C ATOM 2426 O GLU B 58 -12.989 6.603 -13.430 1.00 0.00 O ATOM 2427 CB GLU B 58 -12.953 9.842 -13.204 1.00 0.00 C ATOM 2428 CG GLU B 58 -14.048 10.904 -13.084 1.00 0.00 C ATOM 2429 CD GLU B 58 -15.326 10.402 -13.760 1.00 0.00 C ATOM 2430 OE1 GLU B 58 -15.223 9.538 -14.615 1.00 0.00 O ATOM 2431 OE2 GLU B 58 -16.388 10.892 -13.411 1.00 0.00 O ATOM 0 H GLU B 58 -12.154 9.697 -10.755 1.00 0.00 H new ATOM 0 HA GLU B 58 -14.338 8.471 -12.331 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -11.984 10.273 -12.951 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -12.886 9.488 -14.233 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -14.242 11.124 -12.034 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -13.720 11.834 -13.549 1.00 0.00 H new ATOM 2438 N THR B 59 -11.290 7.256 -12.209 1.00 0.00 N ATOM 2439 CA THR B 59 -10.528 6.037 -12.590 1.00 0.00 C ATOM 2440 C THR B 59 -11.202 4.833 -11.935 1.00 0.00 C ATOM 2441 O THR B 59 -11.494 3.855 -12.594 1.00 0.00 O ATOM 2442 CB THR B 59 -9.068 6.154 -12.141 1.00 0.00 C ATOM 2443 OG1 THR B 59 -8.616 7.483 -12.354 1.00 0.00 O ATOM 2444 CG2 THR B 59 -8.202 5.185 -12.952 1.00 0.00 C ATOM 0 H THR B 59 -10.808 7.900 -11.581 1.00 0.00 H new ATOM 0 HA THR B 59 -10.527 5.918 -13.673 1.00 0.00 H new ATOM 0 HB THR B 59 -8.992 5.907 -11.082 1.00 0.00 H new ATOM 0 HG1 THR B 59 -8.913 8.052 -11.614 1.00 0.00 H new ATOM 0 HG21 THR B 59 -7.164 5.269 -12.631 1.00 0.00 H new ATOM 0 HG22 THR B 59 -8.550 4.165 -12.791 1.00 0.00 H new ATOM 0 HG23 THR B 59 -8.276 5.431 -14.011 1.00 0.00 H new ATOM 2452 N LEU B 60 -11.501 4.892 -10.668 1.00 0.00 N ATOM 2453 CA LEU B 60 -12.208 3.744 -10.039 1.00 0.00 C ATOM 2454 C LEU B 60 -13.522 3.537 -10.792 1.00 0.00 C ATOM 2455 O LEU B 60 -13.785 2.475 -11.318 1.00 0.00 O ATOM 2456 CB LEU B 60 -12.504 4.067 -8.564 1.00 0.00 C ATOM 2457 CG LEU B 60 -11.309 3.672 -7.691 1.00 0.00 C ATOM 2458 CD1 LEU B 60 -10.073 4.456 -8.132 1.00 0.00 C ATOM 2459 CD2 LEU B 60 -11.622 3.987 -6.226 1.00 0.00 C ATOM 0 H LEU B 60 -11.290 5.674 -10.048 1.00 0.00 H new ATOM 0 HA LEU B 60 -11.595 2.844 -10.085 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -12.712 5.131 -8.451 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -13.396 3.532 -8.238 1.00 0.00 H new ATOM 0 HG LEU B 60 -11.117 2.605 -7.799 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -9.223 4.175 -7.511 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -9.851 4.229 -9.175 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -10.263 5.524 -8.026 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -10.772 3.706 -5.604 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -11.815 5.054 -6.117 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -12.502 3.425 -5.913 1.00 0.00 H new ATOM 2471 N ASP B 61 -14.345 4.550 -10.859 1.00 0.00 N ATOM 2472 CA ASP B 61 -15.633 4.409 -11.588 1.00 0.00 C ATOM 2473 C ASP B 61 -15.364 3.827 -12.977 1.00 0.00 C ATOM 2474 O ASP B 61 -16.230 3.238 -13.591 1.00 0.00 O ATOM 2475 CB ASP B 61 -16.289 5.784 -11.726 1.00 0.00 C ATOM 2476 CG ASP B 61 -17.723 5.620 -12.231 1.00 0.00 C ATOM 2477 OD1 ASP B 61 -18.605 5.451 -11.406 1.00 0.00 O ATOM 2478 OD2 ASP B 61 -17.915 5.666 -13.435 1.00 0.00 O ATOM 0 H ASP B 61 -14.179 5.465 -10.441 1.00 0.00 H new ATOM 0 HA ASP B 61 -16.298 3.744 -11.037 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -16.288 6.297 -10.764 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -15.718 6.403 -12.418 1.00 0.00 H new ATOM 2483 N GLU B 62 -14.162 3.989 -13.477 1.00 0.00 N ATOM 2484 CA GLU B 62 -13.820 3.446 -14.830 1.00 0.00 C ATOM 2485 C GLU B 62 -13.016 2.163 -14.680 1.00 0.00 C ATOM 2486 O GLU B 62 -12.072 1.904 -15.401 1.00 0.00 O ATOM 2487 CB GLU B 62 -12.984 4.449 -15.573 1.00 0.00 C ATOM 2488 CG GLU B 62 -13.848 5.638 -16.001 1.00 0.00 C ATOM 2489 CD GLU B 62 -14.748 5.223 -17.166 1.00 0.00 C ATOM 2490 OE1 GLU B 62 -14.220 4.964 -18.235 1.00 0.00 O ATOM 2491 OE2 GLU B 62 -15.951 5.170 -16.969 1.00 0.00 O ATOM 0 H GLU B 62 -13.400 4.476 -13.004 1.00 0.00 H new ATOM 0 HA GLU B 62 -14.742 3.245 -15.376 1.00 0.00 H new ATOM 0 HB2 GLU B 62 -12.166 4.793 -14.940 1.00 0.00 H new ATOM 0 HB3 GLU B 62 -12.534 3.982 -16.449 1.00 0.00 H new ATOM 0 HG2 GLU B 62 -14.455 5.980 -15.163 1.00 0.00 H new ATOM 0 HG3 GLU B 62 -13.214 6.474 -16.297 1.00 0.00 H new ATOM 2498 N ASP B 63 -13.402 1.378 -13.751 1.00 0.00 N ATOM 2499 CA ASP B 63 -12.712 0.076 -13.488 1.00 0.00 C ATOM 2500 C ASP B 63 -12.443 -0.628 -14.820 1.00 0.00 C ATOM 2501 O ASP B 63 -11.420 -1.253 -15.014 1.00 0.00 O ATOM 2502 CB ASP B 63 -13.648 -0.801 -12.657 1.00 0.00 C ATOM 2503 CG ASP B 63 -13.050 -2.202 -12.511 1.00 0.00 C ATOM 2504 OD1 ASP B 63 -11.865 -2.348 -12.765 1.00 0.00 O ATOM 2505 OD2 ASP B 63 -13.786 -3.105 -12.149 1.00 0.00 O ATOM 0 H ASP B 63 -14.189 1.571 -13.132 1.00 0.00 H new ATOM 0 HA ASP B 63 -11.773 0.248 -12.962 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -13.801 -0.356 -11.674 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -14.626 -0.861 -13.135 1.00 0.00 H new ATOM 2510 N GLY B 64 -13.350 -0.490 -15.741 1.00 0.00 N ATOM 2511 CA GLY B 64 -13.182 -1.107 -17.087 1.00 0.00 C ATOM 2512 C GLY B 64 -12.862 -2.610 -17.000 1.00 0.00 C ATOM 2513 O GLY B 64 -12.850 -3.290 -18.008 1.00 0.00 O ATOM 0 H GLY B 64 -14.217 0.033 -15.618 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -14.094 -0.964 -17.667 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -12.381 -0.597 -17.622 1.00 0.00 H new ATOM 2517 N ASP B 65 -12.606 -3.146 -15.825 1.00 0.00 N ATOM 2518 CA ASP B 65 -12.293 -4.619 -15.716 1.00 0.00 C ATOM 2519 C ASP B 65 -13.489 -5.425 -15.142 1.00 0.00 C ATOM 2520 O ASP B 65 -13.655 -6.577 -15.493 1.00 0.00 O ATOM 2521 CB ASP B 65 -11.088 -4.805 -14.791 1.00 0.00 C ATOM 2522 CG ASP B 65 -10.533 -6.223 -14.949 1.00 0.00 C ATOM 2523 OD1 ASP B 65 -11.057 -7.119 -14.308 1.00 0.00 O ATOM 2524 OD2 ASP B 65 -9.594 -6.389 -15.710 1.00 0.00 O ATOM 0 H ASP B 65 -12.599 -2.635 -14.942 1.00 0.00 H new ATOM 0 HA ASP B 65 -12.081 -4.991 -16.718 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -10.317 -4.073 -15.030 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -11.381 -4.632 -13.756 1.00 0.00 H new ATOM 2529 N GLY B 66 -14.321 -4.874 -14.277 1.00 0.00 N ATOM 2530 CA GLY B 66 -15.471 -5.658 -13.725 1.00 0.00 C ATOM 2531 C GLY B 66 -15.126 -6.142 -12.314 1.00 0.00 C ATOM 2532 O GLY B 66 -15.996 -6.344 -11.491 1.00 0.00 O ATOM 0 H GLY B 66 -14.248 -3.916 -13.934 1.00 0.00 H new ATOM 0 HA2 GLY B 66 -16.368 -5.040 -13.700 1.00 0.00 H new ATOM 0 HA3 GLY B 66 -15.688 -6.509 -14.370 1.00 0.00 H new ATOM 2536 N GLU B 67 -13.859 -6.316 -12.020 1.00 0.00 N ATOM 2537 CA GLU B 67 -13.458 -6.773 -10.649 1.00 0.00 C ATOM 2538 C GLU B 67 -12.108 -6.150 -10.273 1.00 0.00 C ATOM 2539 O GLU B 67 -11.155 -6.239 -11.022 1.00 0.00 O ATOM 2540 CB GLU B 67 -13.320 -8.303 -10.630 1.00 0.00 C ATOM 2541 CG GLU B 67 -14.653 -8.968 -11.001 1.00 0.00 C ATOM 2542 CD GLU B 67 -14.824 -8.982 -12.523 1.00 0.00 C ATOM 2543 OE1 GLU B 67 -13.858 -9.283 -13.205 1.00 0.00 O ATOM 2544 OE2 GLU B 67 -15.918 -8.692 -12.978 1.00 0.00 O ATOM 0 H GLU B 67 -13.086 -6.162 -12.668 1.00 0.00 H new ATOM 0 HA GLU B 67 -14.222 -6.463 -9.935 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -12.545 -8.613 -11.331 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -13.005 -8.633 -9.640 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -14.681 -9.987 -10.614 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -15.479 -8.428 -10.539 1.00 0.00 H new ATOM 2551 N CYS B 68 -12.005 -5.534 -9.116 1.00 0.00 N ATOM 2552 CA CYS B 68 -10.700 -4.922 -8.693 1.00 0.00 C ATOM 2553 C CYS B 68 -10.029 -5.841 -7.666 1.00 0.00 C ATOM 2554 O CYS B 68 -10.617 -6.207 -6.667 1.00 0.00 O ATOM 2555 CB CYS B 68 -10.951 -3.542 -8.071 1.00 0.00 C ATOM 2556 SG CYS B 68 -12.227 -2.679 -9.019 1.00 0.00 S ATOM 0 H CYS B 68 -12.767 -5.428 -8.447 1.00 0.00 H new ATOM 0 HA CYS B 68 -10.050 -4.804 -9.560 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -11.265 -3.650 -7.033 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -10.029 -2.960 -8.066 1.00 0.00 H new ATOM 0 HG CYS B 68 -12.443 -1.510 -8.492 1.00 0.00 H new ATOM 2562 N ASP B 69 -8.804 -6.226 -7.911 1.00 0.00 N ATOM 2563 CA ASP B 69 -8.095 -7.134 -6.960 1.00 0.00 C ATOM 2564 C ASP B 69 -7.471 -6.325 -5.818 1.00 0.00 C ATOM 2565 O ASP B 69 -7.673 -5.133 -5.703 1.00 0.00 O ATOM 2566 CB ASP B 69 -6.991 -7.884 -7.708 1.00 0.00 C ATOM 2567 CG ASP B 69 -6.066 -6.877 -8.394 1.00 0.00 C ATOM 2568 OD1 ASP B 69 -5.715 -5.897 -7.758 1.00 0.00 O ATOM 2569 OD2 ASP B 69 -5.726 -7.103 -9.544 1.00 0.00 O ATOM 0 H ASP B 69 -8.262 -5.950 -8.730 1.00 0.00 H new ATOM 0 HA ASP B 69 -8.812 -7.841 -6.543 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -6.422 -8.503 -7.014 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -7.429 -8.555 -8.447 1.00 0.00 H new ATOM 2574 N PHE B 70 -6.701 -6.971 -4.981 1.00 0.00 N ATOM 2575 CA PHE B 70 -6.044 -6.252 -3.850 1.00 0.00 C ATOM 2576 C PHE B 70 -4.872 -5.436 -4.403 1.00 0.00 C ATOM 2577 O PHE B 70 -4.581 -4.356 -3.929 1.00 0.00 O ATOM 2578 CB PHE B 70 -5.545 -7.277 -2.825 1.00 0.00 C ATOM 2579 CG PHE B 70 -5.306 -6.620 -1.483 1.00 0.00 C ATOM 2580 CD1 PHE B 70 -4.224 -5.748 -1.311 1.00 0.00 C ATOM 2581 CD2 PHE B 70 -6.156 -6.899 -0.404 1.00 0.00 C ATOM 2582 CE1 PHE B 70 -3.995 -5.156 -0.062 1.00 0.00 C ATOM 2583 CE2 PHE B 70 -5.925 -6.305 0.841 1.00 0.00 C ATOM 2584 CZ PHE B 70 -4.846 -5.435 1.013 1.00 0.00 C ATOM 0 H PHE B 70 -6.499 -7.969 -5.033 1.00 0.00 H new ATOM 0 HA PHE B 70 -6.751 -5.581 -3.361 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -6.277 -8.078 -2.718 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -4.622 -7.735 -3.181 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -3.567 -5.532 -2.140 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -6.990 -7.573 -0.534 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -3.161 -4.483 0.071 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -6.582 -6.519 1.671 1.00 0.00 H new ATOM 0 HZ PHE B 70 -4.669 -4.978 1.975 1.00 0.00 H new ATOM 2594 N GLN B 71 -4.206 -5.927 -5.409 1.00 0.00 N ATOM 2595 CA GLN B 71 -3.071 -5.156 -5.989 1.00 0.00 C ATOM 2596 C GLN B 71 -3.595 -3.799 -6.465 1.00 0.00 C ATOM 2597 O GLN B 71 -2.940 -2.785 -6.322 1.00 0.00 O ATOM 2598 CB GLN B 71 -2.485 -5.926 -7.175 1.00 0.00 C ATOM 2599 CG GLN B 71 -1.204 -5.240 -7.658 1.00 0.00 C ATOM 2600 CD GLN B 71 -0.435 -6.189 -8.580 1.00 0.00 C ATOM 2601 OE1 GLN B 71 -0.494 -7.392 -8.417 1.00 0.00 O ATOM 2602 NE2 GLN B 71 0.287 -5.697 -9.549 1.00 0.00 N ATOM 0 H GLN B 71 -4.397 -6.825 -5.854 1.00 0.00 H new ATOM 0 HA GLN B 71 -2.294 -5.012 -5.239 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -2.270 -6.954 -6.882 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -3.212 -5.971 -7.986 1.00 0.00 H new ATOM 0 HG2 GLN B 71 -1.449 -4.320 -8.188 1.00 0.00 H new ATOM 0 HG3 GLN B 71 -0.584 -4.962 -6.806 1.00 0.00 H new ATOM 0 HE21 GLN B 71 0.337 -4.687 -9.686 1.00 0.00 H new ATOM 0 HE22 GLN B 71 0.802 -6.322 -10.169 1.00 0.00 H new ATOM 2611 N GLU B 72 -4.777 -3.769 -7.017 1.00 0.00 N ATOM 2612 CA GLU B 72 -5.351 -2.477 -7.487 1.00 0.00 C ATOM 2613 C GLU B 72 -5.746 -1.624 -6.276 1.00 0.00 C ATOM 2614 O GLU B 72 -5.772 -0.413 -6.336 1.00 0.00 O ATOM 2615 CB GLU B 72 -6.577 -2.738 -8.365 1.00 0.00 C ATOM 2616 CG GLU B 72 -6.133 -3.365 -9.688 1.00 0.00 C ATOM 2617 CD GLU B 72 -5.411 -2.315 -10.532 1.00 0.00 C ATOM 2618 OE1 GLU B 72 -6.089 -1.493 -11.126 1.00 0.00 O ATOM 2619 OE2 GLU B 72 -4.192 -2.350 -10.571 1.00 0.00 O ATOM 0 H GLU B 72 -5.371 -4.585 -7.163 1.00 0.00 H new ATOM 0 HA GLU B 72 -4.605 -1.944 -8.076 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -7.271 -3.402 -7.850 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -7.108 -1.805 -8.553 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -5.473 -4.211 -9.498 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -6.998 -3.750 -10.229 1.00 0.00 H new ATOM 2626 N PHE B 73 -6.004 -2.251 -5.162 1.00 0.00 N ATOM 2627 CA PHE B 73 -6.351 -1.488 -3.927 1.00 0.00 C ATOM 2628 C PHE B 73 -5.087 -0.806 -3.399 1.00 0.00 C ATOM 2629 O PHE B 73 -5.129 0.335 -2.988 1.00 0.00 O ATOM 2630 CB PHE B 73 -6.941 -2.435 -2.877 1.00 0.00 C ATOM 2631 CG PHE B 73 -7.201 -1.689 -1.587 1.00 0.00 C ATOM 2632 CD1 PHE B 73 -8.139 -0.652 -1.561 1.00 0.00 C ATOM 2633 CD2 PHE B 73 -6.514 -2.040 -0.416 1.00 0.00 C ATOM 2634 CE1 PHE B 73 -8.393 0.035 -0.366 1.00 0.00 C ATOM 2635 CE2 PHE B 73 -6.766 -1.353 0.777 1.00 0.00 C ATOM 2636 CZ PHE B 73 -7.706 -0.316 0.803 1.00 0.00 C ATOM 0 H PHE B 73 -5.990 -3.265 -5.052 1.00 0.00 H new ATOM 0 HA PHE B 73 -7.099 -0.728 -4.153 1.00 0.00 H new ATOM 0 HB2 PHE B 73 -7.870 -2.868 -3.248 1.00 0.00 H new ATOM 0 HB3 PHE B 73 -6.254 -3.262 -2.695 1.00 0.00 H new ATOM 0 HD1 PHE B 73 -8.668 -0.380 -2.462 1.00 0.00 H new ATOM 0 HD2 PHE B 73 -5.790 -2.841 -0.435 1.00 0.00 H new ATOM 0 HE1 PHE B 73 -9.118 0.835 -0.347 1.00 0.00 H new ATOM 0 HE2 PHE B 73 -6.235 -1.623 1.678 1.00 0.00 H new ATOM 0 HZ PHE B 73 -7.901 0.213 1.724 1.00 0.00 H new ATOM 2646 N MET B 74 -3.964 -1.451 -3.429 1.00 0.00 N ATOM 2647 CA MET B 74 -2.736 -0.759 -2.946 1.00 0.00 C ATOM 2648 C MET B 74 -2.416 0.393 -3.909 1.00 0.00 C ATOM 2649 O MET B 74 -2.272 1.523 -3.488 1.00 0.00 O ATOM 2650 CB MET B 74 -1.564 -1.754 -2.879 1.00 0.00 C ATOM 2651 CG MET B 74 -1.571 -2.480 -1.525 1.00 0.00 C ATOM 2652 SD MET B 74 -0.704 -1.464 -0.296 1.00 0.00 S ATOM 2653 CE MET B 74 -2.047 -1.311 0.911 1.00 0.00 C ATOM 0 H MET B 74 -3.837 -2.408 -3.759 1.00 0.00 H new ATOM 0 HA MET B 74 -2.897 -0.361 -1.944 1.00 0.00 H new ATOM 0 HB2 MET B 74 -1.643 -2.478 -3.690 1.00 0.00 H new ATOM 0 HB3 MET B 74 -0.620 -1.227 -3.014 1.00 0.00 H new ATOM 0 HG2 MET B 74 -2.596 -2.665 -1.203 1.00 0.00 H new ATOM 0 HG3 MET B 74 -1.086 -3.452 -1.618 1.00 0.00 H new ATOM 0 HE1 MET B 74 -1.710 -0.712 1.757 1.00 0.00 H new ATOM 0 HE2 MET B 74 -2.904 -0.827 0.442 1.00 0.00 H new ATOM 0 HE3 MET B 74 -2.336 -2.302 1.261 1.00 0.00 H new ATOM 2663 N ALA B 75 -2.295 0.144 -5.183 1.00 0.00 N ATOM 2664 CA ALA B 75 -1.977 1.255 -6.127 1.00 0.00 C ATOM 2665 C ALA B 75 -2.972 2.412 -5.978 1.00 0.00 C ATOM 2666 O ALA B 75 -2.580 3.560 -5.909 1.00 0.00 O ATOM 2667 CB ALA B 75 -2.034 0.726 -7.561 1.00 0.00 C ATOM 0 H ALA B 75 -2.402 -0.776 -5.611 1.00 0.00 H new ATOM 0 HA ALA B 75 -0.979 1.628 -5.896 1.00 0.00 H new ATOM 0 HB1 ALA B 75 -1.803 1.533 -8.256 1.00 0.00 H new ATOM 0 HB2 ALA B 75 -1.307 -0.077 -7.682 1.00 0.00 H new ATOM 0 HB3 ALA B 75 -3.034 0.344 -7.768 1.00 0.00 H new ATOM 2673 N PHE B 76 -4.248 2.141 -5.946 1.00 0.00 N ATOM 2674 CA PHE B 76 -5.225 3.268 -5.825 1.00 0.00 C ATOM 2675 C PHE B 76 -5.119 3.896 -4.430 1.00 0.00 C ATOM 2676 O PHE B 76 -5.253 5.092 -4.268 1.00 0.00 O ATOM 2677 CB PHE B 76 -6.663 2.758 -6.068 1.00 0.00 C ATOM 2678 CG PHE B 76 -6.969 2.740 -7.558 1.00 0.00 C ATOM 2679 CD1 PHE B 76 -6.905 3.927 -8.304 1.00 0.00 C ATOM 2680 CD2 PHE B 76 -7.306 1.537 -8.195 1.00 0.00 C ATOM 2681 CE1 PHE B 76 -7.174 3.906 -9.676 1.00 0.00 C ATOM 2682 CE2 PHE B 76 -7.578 1.521 -9.567 1.00 0.00 C ATOM 2683 CZ PHE B 76 -7.510 2.704 -10.308 1.00 0.00 C ATOM 0 H PHE B 76 -4.654 1.207 -5.997 1.00 0.00 H new ATOM 0 HA PHE B 76 -4.991 4.022 -6.577 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -6.776 1.756 -5.654 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -7.376 3.399 -5.550 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -6.648 4.857 -7.818 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -7.356 0.621 -7.625 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -7.122 4.820 -10.249 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -7.841 0.594 -10.054 1.00 0.00 H new ATOM 0 HZ PHE B 76 -7.717 2.690 -11.368 1.00 0.00 H new ATOM 2693 N VAL B 77 -4.869 3.104 -3.430 1.00 0.00 N ATOM 2694 CA VAL B 77 -4.742 3.667 -2.056 1.00 0.00 C ATOM 2695 C VAL B 77 -3.534 4.609 -2.026 1.00 0.00 C ATOM 2696 O VAL B 77 -3.520 5.595 -1.317 1.00 0.00 O ATOM 2697 CB VAL B 77 -4.558 2.518 -1.049 1.00 0.00 C ATOM 2698 CG1 VAL B 77 -4.024 3.058 0.286 1.00 0.00 C ATOM 2699 CG2 VAL B 77 -5.909 1.822 -0.813 1.00 0.00 C ATOM 0 H VAL B 77 -4.747 2.094 -3.501 1.00 0.00 H new ATOM 0 HA VAL B 77 -5.640 4.223 -1.785 1.00 0.00 H new ATOM 0 HB VAL B 77 -3.840 1.805 -1.455 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -3.899 2.234 0.988 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -3.062 3.545 0.123 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -4.731 3.779 0.696 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -5.779 1.008 -0.100 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -6.625 2.542 -0.416 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -6.282 1.422 -1.756 1.00 0.00 H new ATOM 2709 N SER B 78 -2.523 4.315 -2.796 1.00 0.00 N ATOM 2710 CA SER B 78 -1.319 5.194 -2.817 1.00 0.00 C ATOM 2711 C SER B 78 -1.647 6.509 -3.536 1.00 0.00 C ATOM 2712 O SER B 78 -1.405 7.585 -3.024 1.00 0.00 O ATOM 2713 CB SER B 78 -0.182 4.476 -3.551 1.00 0.00 C ATOM 2714 OG SER B 78 -0.207 3.096 -3.213 1.00 0.00 O ATOM 0 H SER B 78 -2.478 3.503 -3.412 1.00 0.00 H new ATOM 0 HA SER B 78 -1.013 5.414 -1.794 1.00 0.00 H new ATOM 0 HB2 SER B 78 -0.292 4.601 -4.628 1.00 0.00 H new ATOM 0 HB3 SER B 78 0.778 4.913 -3.276 1.00 0.00 H new ATOM 0 HG SER B 78 -0.906 2.645 -3.731 1.00 0.00 H new ATOM 2720 N MET B 79 -2.171 6.430 -4.729 1.00 0.00 N ATOM 2721 CA MET B 79 -2.485 7.671 -5.495 1.00 0.00 C ATOM 2722 C MET B 79 -3.279 8.648 -4.627 1.00 0.00 C ATOM 2723 O MET B 79 -3.056 9.839 -4.669 1.00 0.00 O ATOM 2724 CB MET B 79 -3.308 7.311 -6.734 1.00 0.00 C ATOM 2725 CG MET B 79 -2.403 6.640 -7.768 1.00 0.00 C ATOM 2726 SD MET B 79 -3.398 6.090 -9.181 1.00 0.00 S ATOM 2727 CE MET B 79 -3.206 7.572 -10.206 1.00 0.00 C ATOM 0 H MET B 79 -2.396 5.558 -5.208 1.00 0.00 H new ATOM 0 HA MET B 79 -1.550 8.144 -5.795 1.00 0.00 H new ATOM 0 HB2 MET B 79 -4.124 6.642 -6.460 1.00 0.00 H new ATOM 0 HB3 MET B 79 -3.760 8.208 -7.157 1.00 0.00 H new ATOM 0 HG2 MET B 79 -1.635 7.338 -8.101 1.00 0.00 H new ATOM 0 HG3 MET B 79 -1.889 5.790 -7.319 1.00 0.00 H new ATOM 0 HE1 MET B 79 -3.751 7.441 -11.141 1.00 0.00 H new ATOM 0 HE2 MET B 79 -3.602 8.437 -9.673 1.00 0.00 H new ATOM 0 HE3 MET B 79 -2.149 7.731 -10.421 1.00 0.00 H new ATOM 2737 N VAL B 80 -4.199 8.164 -3.844 1.00 0.00 N ATOM 2738 CA VAL B 80 -4.991 9.093 -2.987 1.00 0.00 C ATOM 2739 C VAL B 80 -4.124 9.570 -1.822 1.00 0.00 C ATOM 2740 O VAL B 80 -4.056 10.747 -1.527 1.00 0.00 O ATOM 2741 CB VAL B 80 -6.227 8.367 -2.447 1.00 0.00 C ATOM 2742 CG1 VAL B 80 -6.945 9.259 -1.429 1.00 0.00 C ATOM 2743 CG2 VAL B 80 -7.179 8.051 -3.604 1.00 0.00 C ATOM 0 H VAL B 80 -4.437 7.176 -3.758 1.00 0.00 H new ATOM 0 HA VAL B 80 -5.310 9.952 -3.578 1.00 0.00 H new ATOM 0 HB VAL B 80 -5.918 7.440 -1.963 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -7.824 8.740 -1.047 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -6.270 9.486 -0.604 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -7.253 10.187 -1.911 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -8.059 7.534 -3.221 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -7.485 8.979 -4.087 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -6.672 7.414 -4.329 1.00 0.00 H new ATOM 2753 N THR B 81 -3.449 8.668 -1.165 1.00 0.00 N ATOM 2754 CA THR B 81 -2.576 9.076 -0.031 1.00 0.00 C ATOM 2755 C THR B 81 -1.464 9.977 -0.571 1.00 0.00 C ATOM 2756 O THR B 81 -1.105 10.971 0.029 1.00 0.00 O ATOM 2757 CB THR B 81 -1.964 7.830 0.615 1.00 0.00 C ATOM 2758 OG1 THR B 81 -2.974 6.847 0.790 1.00 0.00 O ATOM 2759 CG2 THR B 81 -1.364 8.196 1.974 1.00 0.00 C ATOM 0 H THR B 81 -3.465 7.668 -1.364 1.00 0.00 H new ATOM 0 HA THR B 81 -3.159 9.614 0.717 1.00 0.00 H new ATOM 0 HB THR B 81 -1.178 7.436 -0.029 1.00 0.00 H new ATOM 0 HG1 THR B 81 -2.886 6.160 0.097 1.00 0.00 H new ATOM 0 HG21 THR B 81 -0.929 7.307 2.431 1.00 0.00 H new ATOM 0 HG22 THR B 81 -0.589 8.950 1.838 1.00 0.00 H new ATOM 0 HG23 THR B 81 -2.146 8.592 2.622 1.00 0.00 H new ATOM 2767 N THR B 82 -0.922 9.632 -1.707 1.00 0.00 N ATOM 2768 CA THR B 82 0.164 10.458 -2.305 1.00 0.00 C ATOM 2769 C THR B 82 -0.425 11.744 -2.893 1.00 0.00 C ATOM 2770 O THR B 82 0.271 12.722 -3.082 1.00 0.00 O ATOM 2771 CB THR B 82 0.865 9.665 -3.409 1.00 0.00 C ATOM 2772 OG1 THR B 82 -0.096 9.227 -4.355 1.00 0.00 O ATOM 2773 CG2 THR B 82 1.574 8.454 -2.800 1.00 0.00 C ATOM 0 H THR B 82 -1.186 8.809 -2.249 1.00 0.00 H new ATOM 0 HA THR B 82 0.885 10.715 -1.529 1.00 0.00 H new ATOM 0 HB THR B 82 1.600 10.301 -3.903 1.00 0.00 H new ATOM 0 HG1 THR B 82 -0.751 8.648 -3.912 1.00 0.00 H new ATOM 0 HG21 THR B 82 2.073 7.890 -3.588 1.00 0.00 H new ATOM 0 HG22 THR B 82 2.312 8.792 -2.073 1.00 0.00 H new ATOM 0 HG23 THR B 82 0.843 7.815 -2.304 1.00 0.00 H new ATOM 2781 N ALA B 83 -1.702 11.762 -3.178 1.00 0.00 N ATOM 2782 CA ALA B 83 -2.310 13.001 -3.745 1.00 0.00 C ATOM 2783 C ALA B 83 -1.985 14.166 -2.815 1.00 0.00 C ATOM 2784 O ALA B 83 -1.836 15.296 -3.238 1.00 0.00 O ATOM 2785 CB ALA B 83 -3.830 12.842 -3.845 1.00 0.00 C ATOM 0 H ALA B 83 -2.344 10.980 -3.044 1.00 0.00 H new ATOM 0 HA ALA B 83 -1.909 13.185 -4.742 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -4.264 13.752 -4.260 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -4.066 11.999 -4.494 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -4.243 12.663 -2.852 1.00 0.00 H new