USER MOD reduce.3.24.130724 H: found=0, std=0, add=1296, rem=0, adj=28 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: A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: B 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER N :NH3+ -121:sc= 0.0957 (180deg=-0.0169) USER MOD Single : A 1 SER OG : rot 180:sc= 0.186 USER MOD Single : A 5 LYS NZ :NH3+ 150:sc= -0.0949 (180deg=-0.767) USER MOD Single : A 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 HIS : no HD1:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 16 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot -80:sc= 0.49 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HD1:sc= -1.29 X(o=-1.3,f=-1.3) USER MOD Single : A 26 LYS NZ :NH3+ -169:sc= 0.954 (180deg=0.81) USER MOD Single : A 28 LYS NZ :NH3+ -164:sc= -0.081 (180deg=-0.569) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= -1.53 K(o=-1.5,f=-3.9!) USER MOD Single : A 38 ASN : amide:sc= -1.9! C(o=-1.9!,f=-3.1!) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= -1.5 X(o=-1.5,f=-1.5) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= -0.0815 K(o=-0.081,f=-1.1) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 83:sc= 0.821 USER MOD Single : A 68 CYS SG : rot -84:sc= -0.148 USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0.049) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot 84:sc= 0.949 USER MOD Single : A 82 THR OG1 : rot -83:sc= 0.424 USER MOD Single : B 1 SER N :NH3+ -117:sc= 0.131 (180deg=-0.0149) USER MOD Single : B 1 SER OG : rot 180:sc= 0.189 USER MOD Single : B 5 LYS NZ :NH3+ 148:sc= -0.0871 (180deg=-0.801) USER MOD Single : B 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 15 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : B 16 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : B 17 TYR OH : rot 180:sc= 0 USER MOD Single : B 18 SER OG : rot -80:sc= 0.489 USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 HIS : no HD1:sc= -1.36 X(o=-1.4,f=-1.3) USER MOD Single : B 26 LYS NZ :NH3+ -165:sc= 0.94 (180deg=0.785) USER MOD Single : B 28 LYS NZ :NH3+ -163:sc= -0.0495 (180deg=-0.554) USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 37 ASN : amide:sc= -1.51 K(o=-1.5,f=-4!) USER MOD Single : B 38 ASN : amide:sc= -1.99! C(o=-2!,f=-3.2!) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 42 HIS : no HD1:sc= -1.35 X(o=-1.4,f=-1.4) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 GLN : amide:sc= -0.0964 K(o=-0.096,f=-1.2) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 59 THR OG1 : rot 90:sc= 0.905 USER MOD Single : B 68 CYS SG : rot -86:sc= -0.215 USER MOD Single : B 71 GLN : amide:sc= 0 X(o=0,f=0.052) USER MOD Single : B 78 SER OG : rot 180:sc= 0 USER MOD Single : B 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 81 THR OG1 : rot 84:sc= 0.953 USER MOD Single : B 82 THR OG1 : rot -92:sc= 0.4 USER MOD ----------------------------------------------------------------- ATOM 20 N SER A 1 -10.096 5.160 12.822 1.00 0.00 N ATOM 21 CA SER A 1 -10.326 3.690 12.746 1.00 0.00 C ATOM 22 C SER A 1 -8.989 2.959 12.888 1.00 0.00 C ATOM 23 O SER A 1 -7.935 3.563 12.843 1.00 0.00 O ATOM 24 CB SER A 1 -10.969 3.336 11.403 1.00 0.00 C ATOM 25 OG SER A 1 -9.954 3.195 10.418 1.00 0.00 O ATOM 0 H1 SER A 1 -10.641 5.556 13.615 1.00 0.00 H new ATOM 0 H2 SER A 1 -9.084 5.346 12.971 1.00 0.00 H new ATOM 0 H3 SER A 1 -10.403 5.606 11.934 1.00 0.00 H new ATOM 0 HA SER A 1 -10.994 3.385 13.552 1.00 0.00 H new ATOM 0 HB2 SER A 1 -11.537 2.410 11.492 1.00 0.00 H new ATOM 0 HB3 SER A 1 -11.673 4.114 11.108 1.00 0.00 H new ATOM 0 HG SER A 1 -10.363 2.967 9.557 1.00 0.00 H new ATOM 31 N GLU A 2 -9.017 1.666 13.069 1.00 0.00 N ATOM 32 CA GLU A 2 -7.739 0.915 13.222 1.00 0.00 C ATOM 33 C GLU A 2 -6.906 1.061 11.945 1.00 0.00 C ATOM 34 O GLU A 2 -5.696 1.171 11.989 1.00 0.00 O ATOM 35 CB GLU A 2 -8.048 -0.563 13.479 1.00 0.00 C ATOM 36 CG GLU A 2 -9.245 -0.673 14.426 1.00 0.00 C ATOM 37 CD GLU A 2 -9.346 -2.103 14.958 1.00 0.00 C ATOM 38 OE1 GLU A 2 -9.684 -2.981 14.182 1.00 0.00 O ATOM 39 OE2 GLU A 2 -9.082 -2.297 16.134 1.00 0.00 O ATOM 0 H GLU A 2 -9.865 1.101 13.117 1.00 0.00 H new ATOM 0 HA GLU A 2 -7.174 1.316 14.064 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -8.266 -1.069 12.539 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -7.179 -1.058 13.914 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -9.133 0.027 15.254 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -10.162 -0.403 13.903 1.00 0.00 H new ATOM 46 N LEU A 3 -7.545 1.065 10.807 1.00 0.00 N ATOM 47 CA LEU A 3 -6.794 1.206 9.528 1.00 0.00 C ATOM 48 C LEU A 3 -6.130 2.587 9.489 1.00 0.00 C ATOM 49 O LEU A 3 -4.949 2.715 9.232 1.00 0.00 O ATOM 50 CB LEU A 3 -7.771 1.054 8.345 1.00 0.00 C ATOM 51 CG LEU A 3 -7.039 0.506 7.113 1.00 0.00 C ATOM 52 CD1 LEU A 3 -7.994 0.494 5.918 1.00 0.00 C ATOM 53 CD2 LEU A 3 -5.829 1.390 6.791 1.00 0.00 C ATOM 0 H LEU A 3 -8.556 0.977 10.708 1.00 0.00 H new ATOM 0 HA LEU A 3 -6.027 0.435 9.456 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -8.584 0.383 8.621 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -8.220 2.019 8.110 1.00 0.00 H new ATOM 0 HG LEU A 3 -6.697 -0.508 7.319 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -7.475 0.105 5.042 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -8.851 -0.140 6.144 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -8.337 1.509 5.716 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -5.313 0.996 5.915 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -6.165 2.407 6.587 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -5.147 1.397 7.641 1.00 0.00 H new ATOM 65 N GLU A 4 -6.880 3.622 9.757 1.00 0.00 N ATOM 66 CA GLU A 4 -6.294 4.991 9.747 1.00 0.00 C ATOM 67 C GLU A 4 -5.035 4.999 10.615 1.00 0.00 C ATOM 68 O GLU A 4 -3.998 5.502 10.233 1.00 0.00 O ATOM 69 CB GLU A 4 -7.320 5.975 10.316 1.00 0.00 C ATOM 70 CG GLU A 4 -6.837 7.411 10.112 1.00 0.00 C ATOM 71 CD GLU A 4 -7.840 8.375 10.748 1.00 0.00 C ATOM 72 OE1 GLU A 4 -8.954 7.952 11.009 1.00 0.00 O ATOM 73 OE2 GLU A 4 -7.476 9.519 10.965 1.00 0.00 O ATOM 0 H GLU A 4 -7.874 3.577 9.982 1.00 0.00 H new ATOM 0 HA GLU A 4 -6.035 5.283 8.729 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -8.283 5.833 9.825 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -7.472 5.781 11.378 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -5.853 7.543 10.561 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -6.734 7.625 9.048 1.00 0.00 H new ATOM 80 N LYS A 5 -5.130 4.430 11.785 1.00 0.00 N ATOM 81 CA LYS A 5 -3.962 4.374 12.705 1.00 0.00 C ATOM 82 C LYS A 5 -2.737 3.840 11.960 1.00 0.00 C ATOM 83 O LYS A 5 -1.630 4.311 12.131 1.00 0.00 O ATOM 84 CB LYS A 5 -4.292 3.417 13.852 1.00 0.00 C ATOM 85 CG LYS A 5 -3.248 3.570 14.959 1.00 0.00 C ATOM 86 CD LYS A 5 -3.448 2.474 16.008 1.00 0.00 C ATOM 87 CE LYS A 5 -2.365 2.594 17.082 1.00 0.00 C ATOM 88 NZ LYS A 5 -2.336 3.989 17.604 1.00 0.00 N ATOM 0 H LYS A 5 -5.979 3.996 12.146 1.00 0.00 H new ATOM 0 HA LYS A 5 -3.749 5.373 13.084 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -5.287 3.630 14.243 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -4.306 2.389 13.490 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -2.245 3.506 14.538 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -3.337 4.552 15.423 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -4.436 2.564 16.460 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -3.401 1.492 15.537 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -2.564 1.895 17.894 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -1.393 2.330 16.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -2.025 3.982 18.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -1.674 4.558 17.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -3.288 4.403 17.543 1.00 0.00 H new ATOM 102 N ALA A 6 -2.941 2.842 11.144 1.00 0.00 N ATOM 103 CA ALA A 6 -1.818 2.230 10.379 1.00 0.00 C ATOM 104 C ALA A 6 -1.413 3.110 9.190 1.00 0.00 C ATOM 105 O ALA A 6 -0.264 3.123 8.795 1.00 0.00 O ATOM 106 CB ALA A 6 -2.255 0.847 9.879 1.00 0.00 C ATOM 0 H ALA A 6 -3.853 2.419 10.973 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.953 2.137 11.036 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -1.441 0.389 9.317 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -2.508 0.216 10.731 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -3.127 0.952 9.233 1.00 0.00 H new ATOM 112 N MET A 7 -2.314 3.861 8.624 1.00 0.00 N ATOM 113 CA MET A 7 -1.907 4.734 7.485 1.00 0.00 C ATOM 114 C MET A 7 -0.895 5.762 8.016 1.00 0.00 C ATOM 115 O MET A 7 0.171 5.958 7.456 1.00 0.00 O ATOM 116 CB MET A 7 -3.153 5.448 6.907 1.00 0.00 C ATOM 117 CG MET A 7 -3.632 4.740 5.633 1.00 0.00 C ATOM 118 SD MET A 7 -2.610 5.276 4.234 1.00 0.00 S ATOM 119 CE MET A 7 -2.483 3.678 3.394 1.00 0.00 C ATOM 0 H MET A 7 -3.297 3.910 8.892 1.00 0.00 H new ATOM 0 HA MET A 7 -1.453 4.144 6.689 1.00 0.00 H new ATOM 0 HB2 MET A 7 -3.952 5.456 7.648 1.00 0.00 H new ATOM 0 HB3 MET A 7 -2.914 6.488 6.685 1.00 0.00 H new ATOM 0 HG2 MET A 7 -3.564 3.659 5.756 1.00 0.00 H new ATOM 0 HG3 MET A 7 -4.680 4.974 5.444 1.00 0.00 H new ATOM 0 HE1 MET A 7 -1.883 3.788 2.491 1.00 0.00 H new ATOM 0 HE2 MET A 7 -2.010 2.955 4.058 1.00 0.00 H new ATOM 0 HE3 MET A 7 -3.480 3.327 3.127 1.00 0.00 H new ATOM 129 N VAL A 8 -1.219 6.410 9.100 1.00 0.00 N ATOM 130 CA VAL A 8 -0.283 7.414 9.674 1.00 0.00 C ATOM 131 C VAL A 8 0.960 6.697 10.207 1.00 0.00 C ATOM 132 O VAL A 8 2.064 7.190 10.098 1.00 0.00 O ATOM 133 CB VAL A 8 -0.978 8.167 10.810 1.00 0.00 C ATOM 134 CG1 VAL A 8 -0.204 9.448 11.127 1.00 0.00 C ATOM 135 CG2 VAL A 8 -2.402 8.529 10.380 1.00 0.00 C ATOM 0 H VAL A 8 -2.092 6.287 9.613 1.00 0.00 H new ATOM 0 HA VAL A 8 0.014 8.126 8.903 1.00 0.00 H new ATOM 0 HB VAL A 8 -1.011 7.535 11.697 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -0.701 9.983 11.936 1.00 0.00 H new ATOM 0 HG12 VAL A 8 0.812 9.194 11.430 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -0.170 10.082 10.241 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -2.900 9.066 11.187 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -2.365 9.161 9.493 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -2.956 7.618 10.153 1.00 0.00 H new ATOM 145 N ALA A 9 0.793 5.530 10.771 1.00 0.00 N ATOM 146 CA ALA A 9 1.972 4.784 11.292 1.00 0.00 C ATOM 147 C ALA A 9 2.950 4.551 10.141 1.00 0.00 C ATOM 148 O ALA A 9 4.132 4.788 10.263 1.00 0.00 O ATOM 149 CB ALA A 9 1.514 3.435 11.855 1.00 0.00 C ATOM 0 H ALA A 9 -0.106 5.064 10.892 1.00 0.00 H new ATOM 0 HA ALA A 9 2.457 5.356 12.083 1.00 0.00 H new ATOM 0 HB1 ALA A 9 2.376 2.888 12.237 1.00 0.00 H new ATOM 0 HB2 ALA A 9 0.803 3.601 12.664 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.037 2.854 11.066 1.00 0.00 H new ATOM 155 N LEU A 10 2.464 4.077 9.026 1.00 0.00 N ATOM 156 CA LEU A 10 3.369 3.820 7.866 1.00 0.00 C ATOM 157 C LEU A 10 4.305 5.016 7.696 1.00 0.00 C ATOM 158 O LEU A 10 5.492 4.868 7.478 1.00 0.00 O ATOM 159 CB LEU A 10 2.515 3.662 6.591 1.00 0.00 C ATOM 160 CG LEU A 10 2.030 2.207 6.442 1.00 0.00 C ATOM 161 CD1 LEU A 10 0.961 2.150 5.344 1.00 0.00 C ATOM 162 CD2 LEU A 10 3.208 1.273 6.074 1.00 0.00 C ATOM 0 H LEU A 10 1.481 3.856 8.867 1.00 0.00 H new ATOM 0 HA LEU A 10 3.950 2.914 8.037 1.00 0.00 H new ATOM 0 HB2 LEU A 10 1.658 4.334 6.635 1.00 0.00 H new ATOM 0 HB3 LEU A 10 3.100 3.948 5.717 1.00 0.00 H new ATOM 0 HG LEU A 10 1.611 1.871 7.390 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.611 1.124 5.230 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.123 2.791 5.618 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.388 2.494 4.402 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.844 0.251 5.974 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.647 1.596 5.130 1.00 0.00 H new ATOM 0 HD23 LEU A 10 3.963 1.314 6.859 1.00 0.00 H new ATOM 174 N ILE A 11 3.780 6.204 7.820 1.00 0.00 N ATOM 175 CA ILE A 11 4.649 7.402 7.690 1.00 0.00 C ATOM 176 C ILE A 11 5.648 7.397 8.851 1.00 0.00 C ATOM 177 O ILE A 11 6.810 7.712 8.692 1.00 0.00 O ATOM 178 CB ILE A 11 3.785 8.664 7.738 1.00 0.00 C ATOM 179 CG1 ILE A 11 2.782 8.630 6.580 1.00 0.00 C ATOM 180 CG2 ILE A 11 4.678 9.898 7.603 1.00 0.00 C ATOM 181 CD1 ILE A 11 1.766 9.762 6.745 1.00 0.00 C ATOM 0 H ILE A 11 2.795 6.394 8.004 1.00 0.00 H new ATOM 0 HA ILE A 11 5.187 7.386 6.742 1.00 0.00 H new ATOM 0 HB ILE A 11 3.250 8.707 8.686 1.00 0.00 H new ATOM 0 HG12 ILE A 11 3.305 8.734 5.630 1.00 0.00 H new ATOM 0 HG13 ILE A 11 2.269 7.668 6.558 1.00 0.00 H new ATOM 0 HG21 ILE A 11 4.063 10.797 7.637 1.00 0.00 H new ATOM 0 HG22 ILE A 11 5.397 9.918 8.422 1.00 0.00 H new ATOM 0 HG23 ILE A 11 5.211 9.859 6.653 1.00 0.00 H new ATOM 0 HD11 ILE A 11 1.054 9.735 5.920 1.00 0.00 H new ATOM 0 HD12 ILE A 11 1.233 9.638 7.688 1.00 0.00 H new ATOM 0 HD13 ILE A 11 2.286 10.720 6.745 1.00 0.00 H new ATOM 193 N ASP A 12 5.193 7.022 10.021 1.00 0.00 N ATOM 194 CA ASP A 12 6.095 6.970 11.208 1.00 0.00 C ATOM 195 C ASP A 12 7.352 6.176 10.867 1.00 0.00 C ATOM 196 O ASP A 12 8.463 6.627 11.062 1.00 0.00 O ATOM 197 CB ASP A 12 5.376 6.255 12.364 1.00 0.00 C ATOM 198 CG ASP A 12 6.134 6.515 13.669 1.00 0.00 C ATOM 199 OD1 ASP A 12 6.205 7.665 14.071 1.00 0.00 O ATOM 200 OD2 ASP A 12 6.633 5.561 14.242 1.00 0.00 O ATOM 0 H ASP A 12 4.228 6.748 10.204 1.00 0.00 H new ATOM 0 HA ASP A 12 6.361 7.988 11.494 1.00 0.00 H new ATOM 0 HB2 ASP A 12 4.350 6.615 12.448 1.00 0.00 H new ATOM 0 HB3 ASP A 12 5.323 5.184 12.168 1.00 0.00 H new ATOM 205 N VAL A 13 7.175 4.974 10.379 1.00 0.00 N ATOM 206 CA VAL A 13 8.349 4.119 10.047 1.00 0.00 C ATOM 207 C VAL A 13 9.015 4.582 8.748 1.00 0.00 C ATOM 208 O VAL A 13 10.222 4.695 8.683 1.00 0.00 O ATOM 209 CB VAL A 13 7.901 2.660 9.919 1.00 0.00 C ATOM 210 CG1 VAL A 13 9.075 1.802 9.443 1.00 0.00 C ATOM 211 CG2 VAL A 13 7.419 2.151 11.280 1.00 0.00 C ATOM 0 H VAL A 13 6.266 4.550 10.197 1.00 0.00 H new ATOM 0 HA VAL A 13 9.081 4.206 10.850 1.00 0.00 H new ATOM 0 HB VAL A 13 7.087 2.595 9.197 1.00 0.00 H new ATOM 0 HG11 VAL A 13 8.754 0.764 9.353 1.00 0.00 H new ATOM 0 HG12 VAL A 13 9.419 2.161 8.473 1.00 0.00 H new ATOM 0 HG13 VAL A 13 9.890 1.868 10.164 1.00 0.00 H new ATOM 0 HG21 VAL A 13 7.100 1.113 11.188 1.00 0.00 H new ATOM 0 HG22 VAL A 13 8.232 2.218 12.003 1.00 0.00 H new ATOM 0 HG23 VAL A 13 6.581 2.759 11.620 1.00 0.00 H new ATOM 221 N PHE A 14 8.273 4.836 7.709 1.00 0.00 N ATOM 222 CA PHE A 14 8.938 5.265 6.446 1.00 0.00 C ATOM 223 C PHE A 14 9.850 6.463 6.733 1.00 0.00 C ATOM 224 O PHE A 14 10.898 6.622 6.134 1.00 0.00 O ATOM 225 CB PHE A 14 7.890 5.655 5.404 1.00 0.00 C ATOM 226 CG PHE A 14 8.585 5.973 4.101 1.00 0.00 C ATOM 227 CD1 PHE A 14 9.132 7.245 3.894 1.00 0.00 C ATOM 228 CD2 PHE A 14 8.689 4.995 3.104 1.00 0.00 C ATOM 229 CE1 PHE A 14 9.782 7.540 2.690 1.00 0.00 C ATOM 230 CE2 PHE A 14 9.339 5.291 1.899 1.00 0.00 C ATOM 231 CZ PHE A 14 9.885 6.564 1.692 1.00 0.00 C ATOM 0 H PHE A 14 7.256 4.768 7.676 1.00 0.00 H new ATOM 0 HA PHE A 14 9.531 4.438 6.056 1.00 0.00 H new ATOM 0 HB2 PHE A 14 7.179 4.841 5.262 1.00 0.00 H new ATOM 0 HB3 PHE A 14 7.321 6.519 5.748 1.00 0.00 H new ATOM 0 HD1 PHE A 14 9.052 7.999 4.663 1.00 0.00 H new ATOM 0 HD2 PHE A 14 8.268 4.013 3.264 1.00 0.00 H new ATOM 0 HE1 PHE A 14 10.204 8.521 2.531 1.00 0.00 H new ATOM 0 HE2 PHE A 14 9.419 4.537 1.129 1.00 0.00 H new ATOM 0 HZ PHE A 14 10.385 6.793 0.763 1.00 0.00 H new ATOM 241 N HIS A 15 9.451 7.312 7.643 1.00 0.00 N ATOM 242 CA HIS A 15 10.279 8.508 7.970 1.00 0.00 C ATOM 243 C HIS A 15 11.395 8.131 8.946 1.00 0.00 C ATOM 244 O HIS A 15 12.449 8.736 8.962 1.00 0.00 O ATOM 245 CB HIS A 15 9.395 9.585 8.603 1.00 0.00 C ATOM 246 CG HIS A 15 10.192 10.848 8.772 1.00 0.00 C ATOM 247 ND1 HIS A 15 10.604 11.613 7.690 1.00 0.00 N ATOM 248 CD2 HIS A 15 10.670 11.491 9.887 1.00 0.00 C ATOM 249 CE1 HIS A 15 11.296 12.661 8.173 1.00 0.00 C ATOM 250 NE2 HIS A 15 11.366 12.636 9.507 1.00 0.00 N ATOM 0 H HIS A 15 8.585 7.228 8.175 1.00 0.00 H new ATOM 0 HA HIS A 15 10.724 8.889 7.051 1.00 0.00 H new ATOM 0 HB2 HIS A 15 8.524 9.772 7.974 1.00 0.00 H new ATOM 0 HB3 HIS A 15 9.023 9.244 9.569 1.00 0.00 H new ATOM 0 HD2 HIS A 15 10.528 11.159 10.905 1.00 0.00 H new ATOM 0 HE1 HIS A 15 11.741 13.429 7.557 1.00 0.00 H new ATOM 0 HE2 HIS A 15 11.829 13.310 10.116 1.00 0.00 H new ATOM 258 N GLN A 16 11.166 7.147 9.776 1.00 0.00 N ATOM 259 CA GLN A 16 12.210 6.751 10.763 1.00 0.00 C ATOM 260 C GLN A 16 13.526 6.487 10.030 1.00 0.00 C ATOM 261 O GLN A 16 14.577 6.925 10.455 1.00 0.00 O ATOM 262 CB GLN A 16 11.754 5.492 11.514 1.00 0.00 C ATOM 263 CG GLN A 16 12.900 4.944 12.372 1.00 0.00 C ATOM 264 CD GLN A 16 12.371 3.833 13.282 1.00 0.00 C ATOM 265 OE1 GLN A 16 11.223 3.446 13.183 1.00 0.00 O ATOM 266 NE2 GLN A 16 13.165 3.301 14.171 1.00 0.00 N ATOM 0 H GLN A 16 10.304 6.603 9.812 1.00 0.00 H new ATOM 0 HA GLN A 16 12.361 7.554 11.484 1.00 0.00 H new ATOM 0 HB2 GLN A 16 10.897 5.727 12.145 1.00 0.00 H new ATOM 0 HB3 GLN A 16 11.428 4.733 10.803 1.00 0.00 H new ATOM 0 HG2 GLN A 16 13.694 4.558 11.733 1.00 0.00 H new ATOM 0 HG3 GLN A 16 13.334 5.744 12.972 1.00 0.00 H new ATOM 0 HE21 GLN A 16 14.128 3.626 14.254 1.00 0.00 H new ATOM 0 HE22 GLN A 16 12.822 2.560 14.783 1.00 0.00 H new ATOM 275 N TYR A 17 13.486 5.785 8.932 1.00 0.00 N ATOM 276 CA TYR A 17 14.744 5.511 8.183 1.00 0.00 C ATOM 277 C TYR A 17 15.186 6.786 7.466 1.00 0.00 C ATOM 278 O TYR A 17 16.354 7.121 7.436 1.00 0.00 O ATOM 279 CB TYR A 17 14.496 4.403 7.152 1.00 0.00 C ATOM 280 CG TYR A 17 14.465 3.060 7.845 1.00 0.00 C ATOM 281 CD1 TYR A 17 13.396 2.736 8.687 1.00 0.00 C ATOM 282 CD2 TYR A 17 15.505 2.141 7.648 1.00 0.00 C ATOM 283 CE1 TYR A 17 13.365 1.494 9.333 1.00 0.00 C ATOM 284 CE2 TYR A 17 15.474 0.899 8.294 1.00 0.00 C ATOM 285 CZ TYR A 17 14.404 0.575 9.136 1.00 0.00 C ATOM 286 OH TYR A 17 14.371 -0.650 9.772 1.00 0.00 O ATOM 0 H TYR A 17 12.640 5.390 8.522 1.00 0.00 H new ATOM 0 HA TYR A 17 15.522 5.190 8.876 1.00 0.00 H new ATOM 0 HB2 TYR A 17 13.552 4.578 6.635 1.00 0.00 H new ATOM 0 HB3 TYR A 17 15.281 4.415 6.395 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.595 3.444 8.839 1.00 0.00 H new ATOM 0 HD2 TYR A 17 16.330 2.391 6.998 1.00 0.00 H new ATOM 0 HE1 TYR A 17 12.540 1.244 9.983 1.00 0.00 H new ATOM 0 HE2 TYR A 17 16.276 0.191 8.143 1.00 0.00 H new ATOM 0 HH TYR A 17 15.166 -1.168 9.526 1.00 0.00 H new ATOM 296 N SER A 18 14.261 7.499 6.881 1.00 0.00 N ATOM 297 CA SER A 18 14.624 8.753 6.154 1.00 0.00 C ATOM 298 C SER A 18 14.396 9.971 7.054 1.00 0.00 C ATOM 299 O SER A 18 13.624 10.850 6.725 1.00 0.00 O ATOM 300 CB SER A 18 13.746 8.877 4.908 1.00 0.00 C ATOM 301 OG SER A 18 12.380 8.917 5.297 1.00 0.00 O ATOM 0 H SER A 18 13.268 7.268 6.875 1.00 0.00 H new ATOM 0 HA SER A 18 15.676 8.713 5.871 1.00 0.00 H new ATOM 0 HB2 SER A 18 14.005 9.780 4.355 1.00 0.00 H new ATOM 0 HB3 SER A 18 13.921 8.033 4.240 1.00 0.00 H new ATOM 0 HG SER A 18 12.065 8.007 5.480 1.00 0.00 H new ATOM 307 N GLY A 19 15.076 10.047 8.177 1.00 0.00 N ATOM 308 CA GLY A 19 14.925 11.225 9.097 1.00 0.00 C ATOM 309 C GLY A 19 16.291 11.902 9.218 1.00 0.00 C ATOM 310 O GLY A 19 16.416 12.991 9.743 1.00 0.00 O ATOM 0 H GLY A 19 15.735 9.337 8.498 1.00 0.00 H new ATOM 0 HA2 GLY A 19 14.186 11.924 8.705 1.00 0.00 H new ATOM 0 HA3 GLY A 19 14.571 10.902 10.076 1.00 0.00 H new ATOM 314 N ARG A 20 17.310 11.274 8.704 1.00 0.00 N ATOM 315 CA ARG A 20 18.672 11.875 8.746 1.00 0.00 C ATOM 316 C ARG A 20 18.699 13.129 7.870 1.00 0.00 C ATOM 317 O ARG A 20 19.395 14.076 8.176 1.00 0.00 O ATOM 318 CB ARG A 20 19.695 10.860 8.228 1.00 0.00 C ATOM 319 CG ARG A 20 19.428 9.492 8.863 1.00 0.00 C ATOM 320 CD ARG A 20 19.438 9.620 10.388 1.00 0.00 C ATOM 321 NE ARG A 20 19.526 8.262 10.996 1.00 0.00 N ATOM 322 CZ ARG A 20 19.879 8.125 12.245 1.00 0.00 C ATOM 323 NH1 ARG A 20 21.097 8.414 12.614 1.00 0.00 N ATOM 324 NH2 ARG A 20 19.015 7.695 13.125 1.00 0.00 N ATOM 0 H ARG A 20 17.257 10.361 8.252 1.00 0.00 H new ATOM 0 HA ARG A 20 18.922 12.145 9.772 1.00 0.00 H new ATOM 0 HB2 ARG A 20 19.632 10.787 7.142 1.00 0.00 H new ATOM 0 HB3 ARG A 20 20.705 11.192 8.467 1.00 0.00 H new ATOM 0 HG2 ARG A 20 18.465 9.106 8.527 1.00 0.00 H new ATOM 0 HG3 ARG A 20 20.187 8.778 8.543 1.00 0.00 H new ATOM 0 HD2 ARG A 20 20.283 10.230 10.708 1.00 0.00 H new ATOM 0 HD3 ARG A 20 18.534 10.125 10.728 1.00 0.00 H new ATOM 0 HE ARG A 20 19.310 7.438 10.435 1.00 0.00 H new ATOM 0 HH11 ARG A 20 21.773 8.747 11.926 1.00 0.00 H new ATOM 0 HH12 ARG A 20 21.373 8.307 13.590 1.00 0.00 H new ATOM 0 HH21 ARG A 20 18.064 7.466 12.836 1.00 0.00 H new ATOM 0 HH22 ARG A 20 19.291 7.588 14.101 1.00 0.00 H new ATOM 338 N GLU A 21 17.944 13.175 6.800 1.00 0.00 N ATOM 339 CA GLU A 21 17.946 14.414 5.957 1.00 0.00 C ATOM 340 C GLU A 21 16.567 14.618 5.331 1.00 0.00 C ATOM 341 O GLU A 21 16.049 15.718 5.301 1.00 0.00 O ATOM 342 CB GLU A 21 18.990 14.288 4.838 1.00 0.00 C ATOM 343 CG GLU A 21 20.412 14.325 5.420 1.00 0.00 C ATOM 344 CD GLU A 21 20.803 12.938 5.939 1.00 0.00 C ATOM 345 OE1 GLU A 21 20.458 11.964 5.290 1.00 0.00 O ATOM 346 OE2 GLU A 21 21.440 12.874 6.978 1.00 0.00 O ATOM 0 H GLU A 21 17.336 12.423 6.476 1.00 0.00 H new ATOM 0 HA GLU A 21 18.192 15.266 6.590 1.00 0.00 H new ATOM 0 HB2 GLU A 21 18.838 13.356 4.294 1.00 0.00 H new ATOM 0 HB3 GLU A 21 18.863 15.099 4.121 1.00 0.00 H new ATOM 0 HG2 GLU A 21 21.118 14.648 4.655 1.00 0.00 H new ATOM 0 HG3 GLU A 21 20.463 15.053 6.230 1.00 0.00 H new ATOM 353 N GLY A 22 15.965 13.578 4.824 1.00 0.00 N ATOM 354 CA GLY A 22 14.620 13.733 4.199 1.00 0.00 C ATOM 355 C GLY A 22 14.650 14.917 3.229 1.00 0.00 C ATOM 356 O GLY A 22 13.623 15.382 2.776 1.00 0.00 O ATOM 0 H GLY A 22 16.344 12.631 4.815 1.00 0.00 H new ATOM 0 HA2 GLY A 22 14.344 12.821 3.670 1.00 0.00 H new ATOM 0 HA3 GLY A 22 13.865 13.896 4.968 1.00 0.00 H new ATOM 360 N ASP A 23 15.816 15.405 2.901 1.00 0.00 N ATOM 361 CA ASP A 23 15.895 16.554 1.952 1.00 0.00 C ATOM 362 C ASP A 23 15.030 16.234 0.731 1.00 0.00 C ATOM 363 O ASP A 23 14.060 16.910 0.451 1.00 0.00 O ATOM 364 CB ASP A 23 17.346 16.759 1.512 1.00 0.00 C ATOM 365 CG ASP A 23 17.476 18.097 0.782 1.00 0.00 C ATOM 366 OD1 ASP A 23 16.507 18.840 0.770 1.00 0.00 O ATOM 367 OD2 ASP A 23 18.542 18.359 0.250 1.00 0.00 O ATOM 0 H ASP A 23 16.712 15.061 3.246 1.00 0.00 H new ATOM 0 HA ASP A 23 15.540 17.464 2.436 1.00 0.00 H new ATOM 0 HB2 ASP A 23 18.006 16.741 2.379 1.00 0.00 H new ATOM 0 HB3 ASP A 23 17.657 15.944 0.858 1.00 0.00 H new ATOM 372 N LYS A 24 15.356 15.189 0.018 1.00 0.00 N ATOM 373 CA LYS A 24 14.533 14.805 -1.164 1.00 0.00 C ATOM 374 C LYS A 24 13.426 13.859 -0.691 1.00 0.00 C ATOM 375 O LYS A 24 13.462 13.352 0.413 1.00 0.00 O ATOM 376 CB LYS A 24 15.411 14.087 -2.193 1.00 0.00 C ATOM 377 CG LYS A 24 16.465 15.055 -2.740 1.00 0.00 C ATOM 378 CD LYS A 24 17.482 14.278 -3.580 1.00 0.00 C ATOM 379 CE LYS A 24 18.639 15.202 -3.966 1.00 0.00 C ATOM 380 NZ LYS A 24 19.610 14.454 -4.815 1.00 0.00 N ATOM 0 H LYS A 24 16.157 14.585 0.204 1.00 0.00 H new ATOM 0 HA LYS A 24 14.102 15.694 -1.625 1.00 0.00 H new ATOM 0 HB2 LYS A 24 15.898 13.227 -1.733 1.00 0.00 H new ATOM 0 HB3 LYS A 24 14.795 13.707 -3.008 1.00 0.00 H new ATOM 0 HG2 LYS A 24 15.988 15.825 -3.347 1.00 0.00 H new ATOM 0 HG3 LYS A 24 16.969 15.564 -1.918 1.00 0.00 H new ATOM 0 HD2 LYS A 24 17.858 13.424 -3.017 1.00 0.00 H new ATOM 0 HD3 LYS A 24 17.003 13.883 -4.476 1.00 0.00 H new ATOM 0 HE2 LYS A 24 18.261 16.070 -4.506 1.00 0.00 H new ATOM 0 HE3 LYS A 24 19.135 15.575 -3.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 20.397 15.081 -5.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 19.979 13.639 -4.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 19.132 14.119 -5.676 1.00 0.00 H new ATOM 394 N HIS A 25 12.460 13.593 -1.534 1.00 0.00 N ATOM 395 CA HIS A 25 11.355 12.649 -1.175 1.00 0.00 C ATOM 396 C HIS A 25 11.444 11.465 -2.132 1.00 0.00 C ATOM 397 O HIS A 25 10.466 11.047 -2.720 1.00 0.00 O ATOM 398 CB HIS A 25 10.005 13.349 -1.342 1.00 0.00 C ATOM 399 CG HIS A 25 9.847 13.814 -2.763 1.00 0.00 C ATOM 400 ND1 HIS A 25 10.322 15.042 -3.195 1.00 0.00 N ATOM 401 CD2 HIS A 25 9.266 13.230 -3.860 1.00 0.00 C ATOM 402 CE1 HIS A 25 10.022 15.157 -4.501 1.00 0.00 C ATOM 403 NE2 HIS A 25 9.378 14.079 -4.957 1.00 0.00 N ATOM 0 H HIS A 25 12.388 13.995 -2.469 1.00 0.00 H new ATOM 0 HA HIS A 25 11.446 12.319 -0.140 1.00 0.00 H new ATOM 0 HB2 HIS A 25 9.196 12.667 -1.080 1.00 0.00 H new ATOM 0 HB3 HIS A 25 9.938 14.198 -0.662 1.00 0.00 H new ATOM 0 HD2 HIS A 25 8.793 12.259 -3.871 1.00 0.00 H new ATOM 0 HE1 HIS A 25 10.271 16.016 -5.107 1.00 0.00 H new ATOM 0 HE2 HIS A 25 9.041 13.914 -5.905 1.00 0.00 H new ATOM 411 N LYS A 26 12.626 10.923 -2.282 1.00 0.00 N ATOM 412 CA LYS A 26 12.831 9.757 -3.192 1.00 0.00 C ATOM 413 C LYS A 26 13.607 8.661 -2.454 1.00 0.00 C ATOM 414 O LYS A 26 14.420 8.939 -1.595 1.00 0.00 O ATOM 415 CB LYS A 26 13.637 10.203 -4.414 1.00 0.00 C ATOM 416 CG LYS A 26 12.861 11.276 -5.177 1.00 0.00 C ATOM 417 CD LYS A 26 13.776 11.923 -6.217 1.00 0.00 C ATOM 418 CE LYS A 26 12.958 12.863 -7.104 1.00 0.00 C ATOM 419 NZ LYS A 26 13.840 13.453 -8.150 1.00 0.00 N ATOM 0 H LYS A 26 13.469 11.244 -1.806 1.00 0.00 H new ATOM 0 HA LYS A 26 11.862 9.371 -3.508 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.605 10.594 -4.101 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.833 9.350 -5.064 1.00 0.00 H new ATOM 0 HG2 LYS A 26 11.993 10.834 -5.666 1.00 0.00 H new ATOM 0 HG3 LYS A 26 12.488 12.031 -4.485 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.573 12.476 -5.721 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.252 11.155 -6.826 1.00 0.00 H new ATOM 0 HE2 LYS A 26 12.138 12.318 -7.570 1.00 0.00 H new ATOM 0 HE3 LYS A 26 12.513 13.654 -6.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 13.338 14.226 -8.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 14.704 13.825 -7.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 14.095 12.720 -8.843 1.00 0.00 H new ATOM 433 N LEU A 27 13.362 7.419 -2.787 1.00 0.00 N ATOM 434 CA LEU A 27 14.080 6.283 -2.123 1.00 0.00 C ATOM 435 C LEU A 27 14.746 5.441 -3.212 1.00 0.00 C ATOM 436 O LEU A 27 14.203 5.273 -4.284 1.00 0.00 O ATOM 437 CB LEU A 27 13.063 5.431 -1.352 1.00 0.00 C ATOM 438 CG LEU A 27 13.790 4.389 -0.480 1.00 0.00 C ATOM 439 CD1 LEU A 27 14.314 5.036 0.811 1.00 0.00 C ATOM 440 CD2 LEU A 27 12.817 3.263 -0.109 1.00 0.00 C ATOM 0 H LEU A 27 12.688 7.138 -3.499 1.00 0.00 H new ATOM 0 HA LEU A 27 14.833 6.654 -1.427 1.00 0.00 H new ATOM 0 HB2 LEU A 27 12.443 6.072 -0.725 1.00 0.00 H new ATOM 0 HB3 LEU A 27 12.395 4.928 -2.051 1.00 0.00 H new ATOM 0 HG LEU A 27 14.631 3.990 -1.047 1.00 0.00 H new ATOM 0 HD11 LEU A 27 14.824 4.284 1.413 1.00 0.00 H new ATOM 0 HD12 LEU A 27 15.012 5.835 0.560 1.00 0.00 H new ATOM 0 HD13 LEU A 27 13.478 5.448 1.377 1.00 0.00 H new ATOM 0 HD21 LEU A 27 13.331 2.526 0.508 1.00 0.00 H new ATOM 0 HD22 LEU A 27 11.976 3.677 0.447 1.00 0.00 H new ATOM 0 HD23 LEU A 27 12.451 2.784 -1.017 1.00 0.00 H new ATOM 452 N LYS A 28 15.924 4.922 -2.965 1.00 0.00 N ATOM 453 CA LYS A 28 16.615 4.105 -4.013 1.00 0.00 C ATOM 454 C LYS A 28 16.298 2.620 -3.807 1.00 0.00 C ATOM 455 O LYS A 28 16.018 2.183 -2.709 1.00 0.00 O ATOM 456 CB LYS A 28 18.129 4.325 -3.921 1.00 0.00 C ATOM 457 CG LYS A 28 18.455 5.815 -4.120 1.00 0.00 C ATOM 458 CD LYS A 28 19.903 5.976 -4.604 1.00 0.00 C ATOM 459 CE LYS A 28 20.867 5.348 -3.593 1.00 0.00 C ATOM 460 NZ LYS A 28 20.620 5.921 -2.239 1.00 0.00 N ATOM 0 H LYS A 28 16.435 5.027 -2.089 1.00 0.00 H new ATOM 0 HA LYS A 28 16.263 4.413 -4.997 1.00 0.00 H new ATOM 0 HB2 LYS A 28 18.496 3.990 -2.951 1.00 0.00 H new ATOM 0 HB3 LYS A 28 18.639 3.728 -4.677 1.00 0.00 H new ATOM 0 HG2 LYS A 28 17.770 6.252 -4.846 1.00 0.00 H new ATOM 0 HG3 LYS A 28 18.314 6.355 -3.184 1.00 0.00 H new ATOM 0 HD2 LYS A 28 20.024 5.501 -5.578 1.00 0.00 H new ATOM 0 HD3 LYS A 28 20.136 7.033 -4.733 1.00 0.00 H new ATOM 0 HE2 LYS A 28 20.732 4.267 -3.571 1.00 0.00 H new ATOM 0 HE3 LYS A 28 21.898 5.534 -3.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 21.428 5.710 -1.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 20.502 6.952 -2.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 19.757 5.502 -1.837 1.00 0.00 H new ATOM 474 N LYS A 29 16.344 1.840 -4.854 1.00 0.00 N ATOM 475 CA LYS A 29 16.052 0.384 -4.721 1.00 0.00 C ATOM 476 C LYS A 29 17.002 -0.256 -3.700 1.00 0.00 C ATOM 477 O LYS A 29 16.618 -1.117 -2.934 1.00 0.00 O ATOM 478 CB LYS A 29 16.209 -0.304 -6.094 1.00 0.00 C ATOM 479 CG LYS A 29 17.670 -0.290 -6.590 1.00 0.00 C ATOM 480 CD LYS A 29 18.140 1.151 -6.847 1.00 0.00 C ATOM 481 CE LYS A 29 19.328 1.147 -7.816 1.00 0.00 C ATOM 482 NZ LYS A 29 19.939 2.505 -7.857 1.00 0.00 N ATOM 0 H LYS A 29 16.572 2.150 -5.799 1.00 0.00 H new ATOM 0 HA LYS A 29 15.028 0.257 -4.371 1.00 0.00 H new ATOM 0 HB2 LYS A 29 15.861 -1.335 -6.024 1.00 0.00 H new ATOM 0 HB3 LYS A 29 15.574 0.198 -6.824 1.00 0.00 H new ATOM 0 HG2 LYS A 29 18.316 -0.762 -5.850 1.00 0.00 H new ATOM 0 HG3 LYS A 29 17.754 -0.875 -7.506 1.00 0.00 H new ATOM 0 HD2 LYS A 29 17.323 1.741 -7.262 1.00 0.00 H new ATOM 0 HD3 LYS A 29 18.428 1.622 -5.907 1.00 0.00 H new ATOM 0 HE2 LYS A 29 20.068 0.413 -7.498 1.00 0.00 H new ATOM 0 HE3 LYS A 29 18.997 0.855 -8.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 20.745 2.503 -8.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 19.231 3.195 -8.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 20.268 2.766 -6.906 1.00 0.00 H new ATOM 496 N SER A 30 18.241 0.143 -3.704 1.00 0.00 N ATOM 497 CA SER A 30 19.232 -0.448 -2.761 1.00 0.00 C ATOM 498 C SER A 30 18.812 -0.212 -1.308 1.00 0.00 C ATOM 499 O SER A 30 18.955 -1.076 -0.455 1.00 0.00 O ATOM 500 CB SER A 30 20.590 0.211 -2.998 1.00 0.00 C ATOM 501 OG SER A 30 21.033 -0.089 -4.315 1.00 0.00 O ATOM 0 H SER A 30 18.615 0.860 -4.326 1.00 0.00 H new ATOM 0 HA SER A 30 19.287 -1.522 -2.937 1.00 0.00 H new ATOM 0 HB2 SER A 30 20.512 1.290 -2.865 1.00 0.00 H new ATOM 0 HB3 SER A 30 21.314 -0.149 -2.267 1.00 0.00 H new ATOM 0 HG SER A 30 21.903 0.333 -4.472 1.00 0.00 H new ATOM 507 N GLU A 31 18.306 0.955 -1.011 1.00 0.00 N ATOM 508 CA GLU A 31 17.907 1.240 0.393 1.00 0.00 C ATOM 509 C GLU A 31 16.622 0.483 0.715 1.00 0.00 C ATOM 510 O GLU A 31 16.404 0.032 1.822 1.00 0.00 O ATOM 511 CB GLU A 31 17.678 2.743 0.574 1.00 0.00 C ATOM 512 CG GLU A 31 18.988 3.495 0.335 1.00 0.00 C ATOM 513 CD GLU A 31 19.974 3.172 1.460 1.00 0.00 C ATOM 514 OE1 GLU A 31 19.574 3.244 2.610 1.00 0.00 O ATOM 515 OE2 GLU A 31 21.112 2.860 1.151 1.00 0.00 O ATOM 0 H GLU A 31 18.154 1.715 -1.674 1.00 0.00 H new ATOM 0 HA GLU A 31 18.700 0.918 1.067 1.00 0.00 H new ATOM 0 HB2 GLU A 31 16.915 3.091 -0.122 1.00 0.00 H new ATOM 0 HB3 GLU A 31 17.309 2.946 1.579 1.00 0.00 H new ATOM 0 HG2 GLU A 31 19.412 3.211 -0.628 1.00 0.00 H new ATOM 0 HG3 GLU A 31 18.802 4.568 0.297 1.00 0.00 H new ATOM 522 N LEU A 32 15.771 0.343 -0.266 1.00 0.00 N ATOM 523 CA LEU A 32 14.492 -0.384 -0.057 1.00 0.00 C ATOM 524 C LEU A 32 14.793 -1.853 0.231 1.00 0.00 C ATOM 525 O LEU A 32 14.186 -2.457 1.091 1.00 0.00 O ATOM 526 CB LEU A 32 13.630 -0.265 -1.319 1.00 0.00 C ATOM 527 CG LEU A 32 12.396 -1.172 -1.220 1.00 0.00 C ATOM 528 CD1 LEU A 32 11.637 -0.888 0.084 1.00 0.00 C ATOM 529 CD2 LEU A 32 11.479 -0.895 -2.415 1.00 0.00 C ATOM 0 H LEU A 32 15.911 0.705 -1.209 1.00 0.00 H new ATOM 0 HA LEU A 32 13.953 0.046 0.787 1.00 0.00 H new ATOM 0 HB2 LEU A 32 13.317 0.770 -1.455 1.00 0.00 H new ATOM 0 HB3 LEU A 32 14.219 -0.538 -2.195 1.00 0.00 H new ATOM 0 HG LEU A 32 12.711 -2.215 -1.225 1.00 0.00 H new ATOM 0 HD11 LEU A 32 10.763 -1.537 0.145 1.00 0.00 H new ATOM 0 HD12 LEU A 32 12.291 -1.079 0.935 1.00 0.00 H new ATOM 0 HD13 LEU A 32 11.317 0.154 0.099 1.00 0.00 H new ATOM 0 HD21 LEU A 32 10.599 -1.535 -2.354 1.00 0.00 H new ATOM 0 HD22 LEU A 32 11.170 0.150 -2.402 1.00 0.00 H new ATOM 0 HD23 LEU A 32 12.015 -1.103 -3.341 1.00 0.00 H new ATOM 541 N LYS A 33 15.699 -2.457 -0.490 1.00 0.00 N ATOM 542 CA LYS A 33 15.972 -3.897 -0.240 1.00 0.00 C ATOM 543 C LYS A 33 16.219 -4.097 1.251 1.00 0.00 C ATOM 544 O LYS A 33 15.552 -4.870 1.911 1.00 0.00 O ATOM 545 CB LYS A 33 17.210 -4.331 -1.029 1.00 0.00 C ATOM 546 CG LYS A 33 17.363 -5.852 -0.949 1.00 0.00 C ATOM 547 CD LYS A 33 18.583 -6.282 -1.766 1.00 0.00 C ATOM 548 CE LYS A 33 18.720 -7.805 -1.720 1.00 0.00 C ATOM 549 NZ LYS A 33 20.043 -8.202 -2.280 1.00 0.00 N ATOM 0 H LYS A 33 16.252 -2.023 -1.229 1.00 0.00 H new ATOM 0 HA LYS A 33 15.120 -4.497 -0.559 1.00 0.00 H new ATOM 0 HB2 LYS A 33 17.118 -4.019 -2.069 1.00 0.00 H new ATOM 0 HB3 LYS A 33 18.099 -3.844 -0.627 1.00 0.00 H new ATOM 0 HG2 LYS A 33 17.478 -6.163 0.089 1.00 0.00 H new ATOM 0 HG3 LYS A 33 16.466 -6.340 -1.330 1.00 0.00 H new ATOM 0 HD2 LYS A 33 18.479 -5.947 -2.798 1.00 0.00 H new ATOM 0 HD3 LYS A 33 19.483 -5.814 -1.368 1.00 0.00 H new ATOM 0 HE2 LYS A 33 18.627 -8.158 -0.693 1.00 0.00 H new ATOM 0 HE3 LYS A 33 17.917 -8.271 -2.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 20.137 -9.237 -2.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 20.114 -7.877 -3.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 20.802 -7.769 -1.717 1.00 0.00 H new ATOM 563 N GLU A 34 17.189 -3.406 1.778 1.00 0.00 N ATOM 564 CA GLU A 34 17.499 -3.557 3.230 1.00 0.00 C ATOM 565 C GLU A 34 16.206 -3.412 4.045 1.00 0.00 C ATOM 566 O GLU A 34 16.021 -4.082 5.041 1.00 0.00 O ATOM 567 CB GLU A 34 18.511 -2.489 3.657 1.00 0.00 C ATOM 568 CG GLU A 34 18.956 -2.738 5.104 1.00 0.00 C ATOM 569 CD GLU A 34 17.877 -2.243 6.070 1.00 0.00 C ATOM 570 OE1 GLU A 34 17.548 -1.070 6.008 1.00 0.00 O ATOM 571 OE2 GLU A 34 17.399 -3.045 6.856 1.00 0.00 O ATOM 0 H GLU A 34 17.779 -2.746 1.272 1.00 0.00 H new ATOM 0 HA GLU A 34 17.929 -4.542 3.410 1.00 0.00 H new ATOM 0 HB2 GLU A 34 19.375 -2.509 2.993 1.00 0.00 H new ATOM 0 HB3 GLU A 34 18.065 -1.498 3.570 1.00 0.00 H new ATOM 0 HG2 GLU A 34 19.137 -3.801 5.261 1.00 0.00 H new ATOM 0 HG3 GLU A 34 19.896 -2.222 5.299 1.00 0.00 H new ATOM 578 N LEU A 35 15.308 -2.554 3.640 1.00 0.00 N ATOM 579 CA LEU A 35 14.038 -2.397 4.412 1.00 0.00 C ATOM 580 C LEU A 35 13.200 -3.679 4.285 1.00 0.00 C ATOM 581 O LEU A 35 12.709 -4.197 5.268 1.00 0.00 O ATOM 582 CB LEU A 35 13.251 -1.181 3.884 1.00 0.00 C ATOM 583 CG LEU A 35 13.707 0.106 4.606 1.00 0.00 C ATOM 584 CD1 LEU A 35 13.422 1.325 3.723 1.00 0.00 C ATOM 585 CD2 LEU A 35 12.947 0.263 5.930 1.00 0.00 C ATOM 0 H LEU A 35 15.396 -1.959 2.816 1.00 0.00 H new ATOM 0 HA LEU A 35 14.268 -2.229 5.464 1.00 0.00 H new ATOM 0 HB2 LEU A 35 13.405 -1.078 2.810 1.00 0.00 H new ATOM 0 HB3 LEU A 35 12.183 -1.335 4.040 1.00 0.00 H new ATOM 0 HG LEU A 35 14.776 0.035 4.804 1.00 0.00 H new ATOM 0 HD11 LEU A 35 13.745 2.230 4.237 1.00 0.00 H new ATOM 0 HD12 LEU A 35 13.965 1.228 2.783 1.00 0.00 H new ATOM 0 HD13 LEU A 35 12.353 1.385 3.520 1.00 0.00 H new ATOM 0 HD21 LEU A 35 13.275 1.173 6.432 1.00 0.00 H new ATOM 0 HD22 LEU A 35 11.877 0.324 5.730 1.00 0.00 H new ATOM 0 HD23 LEU A 35 13.148 -0.597 6.569 1.00 0.00 H new ATOM 597 N ILE A 36 13.044 -4.212 3.103 1.00 0.00 N ATOM 598 CA ILE A 36 12.255 -5.470 2.952 1.00 0.00 C ATOM 599 C ILE A 36 12.810 -6.539 3.896 1.00 0.00 C ATOM 600 O ILE A 36 12.080 -7.350 4.431 1.00 0.00 O ATOM 601 CB ILE A 36 12.384 -5.965 1.508 1.00 0.00 C ATOM 602 CG1 ILE A 36 11.872 -4.873 0.561 1.00 0.00 C ATOM 603 CG2 ILE A 36 11.544 -7.235 1.326 1.00 0.00 C ATOM 604 CD1 ILE A 36 12.082 -5.303 -0.892 1.00 0.00 C ATOM 0 H ILE A 36 13.427 -3.832 2.237 1.00 0.00 H new ATOM 0 HA ILE A 36 11.209 -5.278 3.193 1.00 0.00 H new ATOM 0 HB ILE A 36 13.427 -6.189 1.285 1.00 0.00 H new ATOM 0 HG12 ILE A 36 10.814 -4.687 0.745 1.00 0.00 H new ATOM 0 HG13 ILE A 36 12.398 -3.938 0.752 1.00 0.00 H new ATOM 0 HG21 ILE A 36 11.635 -7.588 0.299 1.00 0.00 H new ATOM 0 HG22 ILE A 36 11.900 -8.007 2.008 1.00 0.00 H new ATOM 0 HG23 ILE A 36 10.499 -7.014 1.542 1.00 0.00 H new ATOM 0 HD11 ILE A 36 11.716 -4.522 -1.559 1.00 0.00 H new ATOM 0 HD12 ILE A 36 13.144 -5.466 -1.073 1.00 0.00 H new ATOM 0 HD13 ILE A 36 11.536 -6.227 -1.081 1.00 0.00 H new ATOM 616 N ASN A 37 14.100 -6.565 4.076 1.00 0.00 N ATOM 617 CA ASN A 37 14.719 -7.600 4.951 1.00 0.00 C ATOM 618 C ASN A 37 14.249 -7.456 6.403 1.00 0.00 C ATOM 619 O ASN A 37 13.986 -8.434 7.074 1.00 0.00 O ATOM 620 CB ASN A 37 16.241 -7.447 4.900 1.00 0.00 C ATOM 621 CG ASN A 37 16.900 -8.607 5.647 1.00 0.00 C ATOM 622 OD1 ASN A 37 16.399 -9.059 6.658 1.00 0.00 O ATOM 623 ND2 ASN A 37 18.013 -9.111 5.189 1.00 0.00 N ATOM 0 H ASN A 37 14.757 -5.910 3.652 1.00 0.00 H new ATOM 0 HA ASN A 37 14.418 -8.583 4.590 1.00 0.00 H new ATOM 0 HB2 ASN A 37 16.580 -7.429 3.864 1.00 0.00 H new ATOM 0 HB3 ASN A 37 16.536 -6.498 5.348 1.00 0.00 H new ATOM 0 HD21 ASN A 37 18.463 -9.884 5.679 1.00 0.00 H new ATOM 0 HD22 ASN A 37 18.433 -8.732 4.341 1.00 0.00 H new ATOM 630 N ASN A 38 14.170 -6.251 6.907 1.00 0.00 N ATOM 631 CA ASN A 38 13.750 -6.054 8.333 1.00 0.00 C ATOM 632 C ASN A 38 12.264 -5.692 8.431 1.00 0.00 C ATOM 633 O ASN A 38 11.669 -5.805 9.485 1.00 0.00 O ATOM 634 CB ASN A 38 14.574 -4.918 8.940 1.00 0.00 C ATOM 635 CG ASN A 38 14.250 -4.794 10.429 1.00 0.00 C ATOM 636 OD1 ASN A 38 13.136 -4.477 10.796 1.00 0.00 O ATOM 637 ND2 ASN A 38 15.183 -5.035 11.309 1.00 0.00 N ATOM 0 H ASN A 38 14.378 -5.393 6.395 1.00 0.00 H new ATOM 0 HA ASN A 38 13.916 -6.987 8.872 1.00 0.00 H new ATOM 0 HB2 ASN A 38 15.638 -5.112 8.803 1.00 0.00 H new ATOM 0 HB3 ASN A 38 14.353 -3.981 8.429 1.00 0.00 H new ATOM 0 HD21 ASN A 38 14.977 -4.957 12.305 1.00 0.00 H new ATOM 0 HD22 ASN A 38 16.118 -5.301 11.001 1.00 0.00 H new ATOM 644 N GLU A 39 11.657 -5.240 7.366 1.00 0.00 N ATOM 645 CA GLU A 39 10.211 -4.854 7.443 1.00 0.00 C ATOM 646 C GLU A 39 9.315 -6.027 7.038 1.00 0.00 C ATOM 647 O GLU A 39 8.203 -6.148 7.512 1.00 0.00 O ATOM 648 CB GLU A 39 9.953 -3.681 6.495 1.00 0.00 C ATOM 649 CG GLU A 39 10.753 -2.463 6.958 1.00 0.00 C ATOM 650 CD GLU A 39 10.095 -1.861 8.200 1.00 0.00 C ATOM 651 OE1 GLU A 39 9.069 -2.376 8.611 1.00 0.00 O ATOM 652 OE2 GLU A 39 10.630 -0.896 8.721 1.00 0.00 O ATOM 0 H GLU A 39 12.093 -5.121 6.451 1.00 0.00 H new ATOM 0 HA GLU A 39 9.979 -4.572 8.470 1.00 0.00 H new ATOM 0 HB2 GLU A 39 10.239 -3.952 5.479 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.889 -3.444 6.474 1.00 0.00 H new ATOM 0 HG2 GLU A 39 11.780 -2.753 7.182 1.00 0.00 H new ATOM 0 HG3 GLU A 39 10.798 -1.720 6.161 1.00 0.00 H new ATOM 659 N LEU A 40 9.789 -6.895 6.178 1.00 0.00 N ATOM 660 CA LEU A 40 8.967 -8.074 5.741 1.00 0.00 C ATOM 661 C LEU A 40 9.686 -9.363 6.165 1.00 0.00 C ATOM 662 O LEU A 40 9.578 -10.394 5.530 1.00 0.00 O ATOM 663 CB LEU A 40 8.797 -8.029 4.203 1.00 0.00 C ATOM 664 CG LEU A 40 7.450 -7.387 3.832 1.00 0.00 C ATOM 665 CD1 LEU A 40 7.384 -5.958 4.382 1.00 0.00 C ATOM 666 CD2 LEU A 40 7.307 -7.357 2.308 1.00 0.00 C ATOM 0 H LEU A 40 10.716 -6.840 5.756 1.00 0.00 H new ATOM 0 HA LEU A 40 7.981 -8.046 6.205 1.00 0.00 H new ATOM 0 HB2 LEU A 40 9.613 -7.461 3.757 1.00 0.00 H new ATOM 0 HB3 LEU A 40 8.851 -9.038 3.795 1.00 0.00 H new ATOM 0 HG LEU A 40 6.639 -7.973 4.265 1.00 0.00 H new ATOM 0 HD11 LEU A 40 6.427 -5.509 4.115 1.00 0.00 H new ATOM 0 HD12 LEU A 40 7.484 -5.981 5.467 1.00 0.00 H new ATOM 0 HD13 LEU A 40 8.194 -5.366 3.955 1.00 0.00 H new ATOM 0 HD21 LEU A 40 6.353 -6.902 2.041 1.00 0.00 H new ATOM 0 HD22 LEU A 40 8.120 -6.773 1.878 1.00 0.00 H new ATOM 0 HD23 LEU A 40 7.346 -8.374 1.919 1.00 0.00 H new ATOM 678 N SER A 41 10.421 -9.304 7.243 1.00 0.00 N ATOM 679 CA SER A 41 11.152 -10.510 7.724 1.00 0.00 C ATOM 680 C SER A 41 10.155 -11.555 8.233 1.00 0.00 C ATOM 681 O SER A 41 10.415 -12.741 8.190 1.00 0.00 O ATOM 682 CB SER A 41 12.092 -10.108 8.866 1.00 0.00 C ATOM 683 OG SER A 41 11.397 -10.203 10.103 1.00 0.00 O ATOM 0 H SER A 41 10.547 -8.468 7.813 1.00 0.00 H new ATOM 0 HA SER A 41 11.728 -10.934 6.902 1.00 0.00 H new ATOM 0 HB2 SER A 41 12.968 -10.757 8.877 1.00 0.00 H new ATOM 0 HB3 SER A 41 12.452 -9.090 8.715 1.00 0.00 H new ATOM 0 HG SER A 41 11.996 -9.948 10.835 1.00 0.00 H new ATOM 689 N HIS A 42 9.018 -11.135 8.716 1.00 0.00 N ATOM 690 CA HIS A 42 8.022 -12.123 9.221 1.00 0.00 C ATOM 691 C HIS A 42 7.358 -12.834 8.040 1.00 0.00 C ATOM 692 O HIS A 42 7.290 -14.046 7.992 1.00 0.00 O ATOM 693 CB HIS A 42 6.954 -11.404 10.046 1.00 0.00 C ATOM 694 CG HIS A 42 6.063 -12.424 10.700 1.00 0.00 C ATOM 695 ND1 HIS A 42 4.785 -12.694 10.237 1.00 0.00 N ATOM 696 CD2 HIS A 42 6.254 -13.253 11.778 1.00 0.00 C ATOM 697 CE1 HIS A 42 4.261 -13.650 11.027 1.00 0.00 C ATOM 698 NE2 HIS A 42 5.115 -14.026 11.982 1.00 0.00 N ATOM 0 H HIS A 42 8.736 -10.157 8.783 1.00 0.00 H new ATOM 0 HA HIS A 42 8.531 -12.856 9.847 1.00 0.00 H new ATOM 0 HB2 HIS A 42 7.424 -10.776 10.803 1.00 0.00 H new ATOM 0 HB3 HIS A 42 6.365 -10.746 9.407 1.00 0.00 H new ATOM 0 HD2 HIS A 42 7.152 -13.298 12.377 1.00 0.00 H new ATOM 0 HE1 HIS A 42 3.271 -14.062 10.903 1.00 0.00 H new ATOM 0 HE2 HIS A 42 4.965 -14.729 12.706 1.00 0.00 H new ATOM 706 N PHE A 43 6.864 -12.091 7.087 1.00 0.00 N ATOM 707 CA PHE A 43 6.203 -12.727 5.913 1.00 0.00 C ATOM 708 C PHE A 43 7.211 -13.610 5.177 1.00 0.00 C ATOM 709 O PHE A 43 6.853 -14.584 4.547 1.00 0.00 O ATOM 710 CB PHE A 43 5.681 -11.641 4.970 1.00 0.00 C ATOM 711 CG PHE A 43 4.488 -10.963 5.601 1.00 0.00 C ATOM 712 CD1 PHE A 43 3.225 -11.565 5.538 1.00 0.00 C ATOM 713 CD2 PHE A 43 4.644 -9.734 6.253 1.00 0.00 C ATOM 714 CE1 PHE A 43 2.120 -10.939 6.126 1.00 0.00 C ATOM 715 CE2 PHE A 43 3.539 -9.107 6.841 1.00 0.00 C ATOM 716 CZ PHE A 43 2.277 -9.710 6.778 1.00 0.00 C ATOM 0 H PHE A 43 6.890 -11.071 7.071 1.00 0.00 H new ATOM 0 HA PHE A 43 5.368 -13.340 6.252 1.00 0.00 H new ATOM 0 HB2 PHE A 43 6.465 -10.911 4.769 1.00 0.00 H new ATOM 0 HB3 PHE A 43 5.400 -12.079 4.012 1.00 0.00 H new ATOM 0 HD1 PHE A 43 3.104 -12.513 5.035 1.00 0.00 H new ATOM 0 HD2 PHE A 43 5.618 -9.269 6.302 1.00 0.00 H new ATOM 0 HE1 PHE A 43 1.146 -11.404 6.077 1.00 0.00 H new ATOM 0 HE2 PHE A 43 3.660 -8.158 7.343 1.00 0.00 H new ATOM 0 HZ PHE A 43 1.425 -9.227 7.232 1.00 0.00 H new ATOM 726 N LEU A 44 8.470 -13.270 5.248 1.00 0.00 N ATOM 727 CA LEU A 44 9.510 -14.080 4.547 1.00 0.00 C ATOM 728 C LEU A 44 9.275 -15.570 4.832 1.00 0.00 C ATOM 729 O LEU A 44 9.562 -16.423 4.016 1.00 0.00 O ATOM 730 CB LEU A 44 10.901 -13.646 5.055 1.00 0.00 C ATOM 731 CG LEU A 44 11.968 -13.796 3.950 1.00 0.00 C ATOM 732 CD1 LEU A 44 11.973 -15.235 3.417 1.00 0.00 C ATOM 733 CD2 LEU A 44 11.696 -12.806 2.793 1.00 0.00 C ATOM 0 H LEU A 44 8.825 -12.464 5.763 1.00 0.00 H new ATOM 0 HA LEU A 44 9.453 -13.919 3.470 1.00 0.00 H new ATOM 0 HB2 LEU A 44 10.862 -12.609 5.389 1.00 0.00 H new ATOM 0 HB3 LEU A 44 11.180 -14.249 5.919 1.00 0.00 H new ATOM 0 HG LEU A 44 12.944 -13.569 4.379 1.00 0.00 H new ATOM 0 HD11 LEU A 44 12.729 -15.332 2.638 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.201 -15.924 4.231 1.00 0.00 H new ATOM 0 HD13 LEU A 44 10.993 -15.473 3.003 1.00 0.00 H new ATOM 0 HD21 LEU A 44 12.459 -12.927 2.024 1.00 0.00 H new ATOM 0 HD22 LEU A 44 10.714 -13.007 2.365 1.00 0.00 H new ATOM 0 HD23 LEU A 44 11.723 -11.785 3.174 1.00 0.00 H new ATOM 745 N GLU A 45 8.747 -15.889 5.978 1.00 0.00 N ATOM 746 CA GLU A 45 8.493 -17.319 6.300 1.00 0.00 C ATOM 747 C GLU A 45 7.236 -17.790 5.565 1.00 0.00 C ATOM 748 O GLU A 45 7.156 -18.913 5.107 1.00 0.00 O ATOM 749 CB GLU A 45 8.297 -17.475 7.810 1.00 0.00 C ATOM 750 CG GLU A 45 9.632 -17.243 8.521 1.00 0.00 C ATOM 751 CD GLU A 45 9.478 -17.548 10.012 1.00 0.00 C ATOM 752 OE1 GLU A 45 9.104 -18.664 10.333 1.00 0.00 O ATOM 753 OE2 GLU A 45 9.737 -16.660 10.808 1.00 0.00 O ATOM 0 H GLU A 45 8.481 -15.224 6.704 1.00 0.00 H new ATOM 0 HA GLU A 45 9.344 -17.922 5.983 1.00 0.00 H new ATOM 0 HB2 GLU A 45 7.553 -16.763 8.167 1.00 0.00 H new ATOM 0 HB3 GLU A 45 7.919 -18.472 8.038 1.00 0.00 H new ATOM 0 HG2 GLU A 45 10.403 -17.880 8.087 1.00 0.00 H new ATOM 0 HG3 GLU A 45 9.955 -16.211 8.382 1.00 0.00 H new ATOM 760 N GLU A 46 6.250 -16.941 5.455 1.00 0.00 N ATOM 761 CA GLU A 46 4.988 -17.332 4.757 1.00 0.00 C ATOM 762 C GLU A 46 5.087 -16.993 3.265 1.00 0.00 C ATOM 763 O GLU A 46 4.292 -16.238 2.741 1.00 0.00 O ATOM 764 CB GLU A 46 3.813 -16.570 5.372 1.00 0.00 C ATOM 765 CG GLU A 46 3.787 -16.806 6.884 1.00 0.00 C ATOM 766 CD GLU A 46 2.569 -16.107 7.490 1.00 0.00 C ATOM 767 OE1 GLU A 46 1.829 -15.491 6.739 1.00 0.00 O ATOM 768 OE2 GLU A 46 2.395 -16.199 8.694 1.00 0.00 O ATOM 0 H GLU A 46 6.263 -15.989 5.820 1.00 0.00 H new ATOM 0 HA GLU A 46 4.834 -18.405 4.871 1.00 0.00 H new ATOM 0 HB2 GLU A 46 3.906 -15.505 5.161 1.00 0.00 H new ATOM 0 HB3 GLU A 46 2.876 -16.903 4.925 1.00 0.00 H new ATOM 0 HG2 GLU A 46 3.748 -17.875 7.095 1.00 0.00 H new ATOM 0 HG3 GLU A 46 4.702 -16.424 7.338 1.00 0.00 H new ATOM 775 N ILE A 47 6.050 -17.558 2.577 1.00 0.00 N ATOM 776 CA ILE A 47 6.210 -17.292 1.108 1.00 0.00 C ATOM 777 C ILE A 47 6.082 -18.615 0.352 1.00 0.00 C ATOM 778 O ILE A 47 6.939 -19.472 0.442 1.00 0.00 O ATOM 779 CB ILE A 47 7.601 -16.708 0.837 1.00 0.00 C ATOM 780 CG1 ILE A 47 7.801 -15.409 1.635 1.00 0.00 C ATOM 781 CG2 ILE A 47 7.756 -16.428 -0.659 1.00 0.00 C ATOM 782 CD1 ILE A 47 6.679 -14.405 1.342 1.00 0.00 C ATOM 0 H ILE A 47 6.739 -18.198 2.972 1.00 0.00 H new ATOM 0 HA ILE A 47 5.446 -16.587 0.781 1.00 0.00 H new ATOM 0 HB ILE A 47 8.355 -17.429 1.152 1.00 0.00 H new ATOM 0 HG12 ILE A 47 7.824 -15.633 2.701 1.00 0.00 H new ATOM 0 HG13 ILE A 47 8.765 -14.967 1.381 1.00 0.00 H new ATOM 0 HG21 ILE A 47 8.745 -16.013 -0.851 1.00 0.00 H new ATOM 0 HG22 ILE A 47 7.638 -17.357 -1.217 1.00 0.00 H new ATOM 0 HG23 ILE A 47 6.995 -15.715 -0.976 1.00 0.00 H new ATOM 0 HD11 ILE A 47 6.845 -13.495 1.919 1.00 0.00 H new ATOM 0 HD12 ILE A 47 6.674 -14.164 0.279 1.00 0.00 H new ATOM 0 HD13 ILE A 47 5.719 -14.841 1.619 1.00 0.00 H new ATOM 794 N LYS A 48 5.022 -18.798 -0.392 1.00 0.00 N ATOM 795 CA LYS A 48 4.856 -20.078 -1.146 1.00 0.00 C ATOM 796 C LYS A 48 5.497 -19.932 -2.532 1.00 0.00 C ATOM 797 O LYS A 48 6.361 -20.696 -2.912 1.00 0.00 O ATOM 798 CB LYS A 48 3.356 -20.396 -1.285 1.00 0.00 C ATOM 799 CG LYS A 48 3.147 -21.908 -1.452 1.00 0.00 C ATOM 800 CD LYS A 48 3.799 -22.384 -2.756 1.00 0.00 C ATOM 801 CE LYS A 48 3.232 -23.751 -3.148 1.00 0.00 C ATOM 802 NZ LYS A 48 3.862 -24.202 -4.422 1.00 0.00 N ATOM 0 H LYS A 48 4.268 -18.121 -0.510 1.00 0.00 H new ATOM 0 HA LYS A 48 5.343 -20.893 -0.611 1.00 0.00 H new ATOM 0 HB2 LYS A 48 2.819 -20.042 -0.405 1.00 0.00 H new ATOM 0 HB3 LYS A 48 2.943 -19.867 -2.144 1.00 0.00 H new ATOM 0 HG2 LYS A 48 3.579 -22.440 -0.604 1.00 0.00 H new ATOM 0 HG3 LYS A 48 2.082 -22.138 -1.463 1.00 0.00 H new ATOM 0 HD2 LYS A 48 3.614 -21.662 -3.551 1.00 0.00 H new ATOM 0 HD3 LYS A 48 4.880 -22.450 -2.630 1.00 0.00 H new ATOM 0 HE2 LYS A 48 3.424 -24.477 -2.358 1.00 0.00 H new ATOM 0 HE3 LYS A 48 2.150 -23.688 -3.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 3.478 -25.131 -4.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 3.657 -23.513 -5.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 4.891 -24.277 -4.293 1.00 0.00 H new ATOM 816 N GLU A 49 5.082 -18.948 -3.286 1.00 0.00 N ATOM 817 CA GLU A 49 5.666 -18.749 -4.643 1.00 0.00 C ATOM 818 C GLU A 49 7.063 -18.137 -4.513 1.00 0.00 C ATOM 819 O GLU A 49 7.209 -16.969 -4.215 1.00 0.00 O ATOM 820 CB GLU A 49 4.769 -17.809 -5.452 1.00 0.00 C ATOM 821 CG GLU A 49 3.432 -18.496 -5.741 1.00 0.00 C ATOM 822 CD GLU A 49 2.605 -18.570 -4.455 1.00 0.00 C ATOM 823 OE1 GLU A 49 2.918 -17.842 -3.528 1.00 0.00 O ATOM 824 OE2 GLU A 49 1.672 -19.356 -4.420 1.00 0.00 O ATOM 0 H GLU A 49 4.364 -18.274 -3.020 1.00 0.00 H new ATOM 0 HA GLU A 49 5.737 -19.710 -5.152 1.00 0.00 H new ATOM 0 HB2 GLU A 49 4.602 -16.884 -4.899 1.00 0.00 H new ATOM 0 HB3 GLU A 49 5.259 -17.538 -6.387 1.00 0.00 H new ATOM 0 HG2 GLU A 49 2.886 -17.944 -6.506 1.00 0.00 H new ATOM 0 HG3 GLU A 49 3.604 -19.498 -6.133 1.00 0.00 H new ATOM 831 N GLN A 50 8.092 -18.907 -4.744 1.00 0.00 N ATOM 832 CA GLN A 50 9.474 -18.353 -4.643 1.00 0.00 C ATOM 833 C GLN A 50 9.831 -17.634 -5.946 1.00 0.00 C ATOM 834 O GLN A 50 10.677 -16.763 -5.973 1.00 0.00 O ATOM 835 CB GLN A 50 10.465 -19.496 -4.408 1.00 0.00 C ATOM 836 CG GLN A 50 10.094 -20.239 -3.124 1.00 0.00 C ATOM 837 CD GLN A 50 10.421 -19.363 -1.914 1.00 0.00 C ATOM 838 OE1 GLN A 50 11.415 -18.664 -1.906 1.00 0.00 O ATOM 839 NE2 GLN A 50 9.620 -19.369 -0.884 1.00 0.00 N ATOM 0 H GLN A 50 8.036 -19.893 -4.998 1.00 0.00 H new ATOM 0 HA GLN A 50 9.523 -17.649 -3.812 1.00 0.00 H new ATOM 0 HB2 GLN A 50 10.452 -20.183 -5.255 1.00 0.00 H new ATOM 0 HB3 GLN A 50 11.479 -19.103 -4.333 1.00 0.00 H new ATOM 0 HG2 GLN A 50 9.033 -20.488 -3.129 1.00 0.00 H new ATOM 0 HG3 GLN A 50 10.642 -21.179 -3.064 1.00 0.00 H new ATOM 0 HE21 GLN A 50 8.786 -19.956 -0.890 1.00 0.00 H new ATOM 0 HE22 GLN A 50 9.828 -18.787 -0.073 1.00 0.00 H new ATOM 848 N GLU A 51 9.199 -17.996 -7.028 1.00 0.00 N ATOM 849 CA GLU A 51 9.510 -17.335 -8.328 1.00 0.00 C ATOM 850 C GLU A 51 8.907 -15.926 -8.366 1.00 0.00 C ATOM 851 O GLU A 51 9.370 -15.074 -9.097 1.00 0.00 O ATOM 852 CB GLU A 51 8.971 -18.171 -9.491 1.00 0.00 C ATOM 853 CG GLU A 51 9.527 -19.594 -9.398 1.00 0.00 C ATOM 854 CD GLU A 51 11.047 -19.561 -9.562 1.00 0.00 C ATOM 855 OE1 GLU A 51 11.537 -18.634 -10.186 1.00 0.00 O ATOM 856 OE2 GLU A 51 11.697 -20.464 -9.061 1.00 0.00 O ATOM 0 H GLU A 51 8.482 -18.720 -7.069 1.00 0.00 H new ATOM 0 HA GLU A 51 10.593 -17.255 -8.427 1.00 0.00 H new ATOM 0 HB2 GLU A 51 7.882 -18.192 -9.463 1.00 0.00 H new ATOM 0 HB3 GLU A 51 9.257 -17.719 -10.441 1.00 0.00 H new ATOM 0 HG2 GLU A 51 9.264 -20.036 -8.437 1.00 0.00 H new ATOM 0 HG3 GLU A 51 9.081 -20.221 -10.170 1.00 0.00 H new ATOM 863 N VAL A 52 7.907 -15.654 -7.575 1.00 0.00 N ATOM 864 CA VAL A 52 7.331 -14.277 -7.573 1.00 0.00 C ATOM 865 C VAL A 52 8.277 -13.354 -6.800 1.00 0.00 C ATOM 866 O VAL A 52 8.668 -12.313 -7.288 1.00 0.00 O ATOM 867 CB VAL A 52 5.957 -14.292 -6.889 1.00 0.00 C ATOM 868 CG1 VAL A 52 5.475 -12.857 -6.648 1.00 0.00 C ATOM 869 CG2 VAL A 52 4.949 -15.014 -7.784 1.00 0.00 C ATOM 0 H VAL A 52 7.466 -16.316 -6.936 1.00 0.00 H new ATOM 0 HA VAL A 52 7.214 -13.922 -8.597 1.00 0.00 H new ATOM 0 HB VAL A 52 6.043 -14.810 -5.934 1.00 0.00 H new ATOM 0 HG11 VAL A 52 4.499 -12.878 -6.162 1.00 0.00 H new ATOM 0 HG12 VAL A 52 6.188 -12.336 -6.008 1.00 0.00 H new ATOM 0 HG13 VAL A 52 5.395 -12.335 -7.602 1.00 0.00 H new ATOM 0 HG21 VAL A 52 3.973 -15.025 -7.298 1.00 0.00 H new ATOM 0 HG22 VAL A 52 4.873 -14.495 -8.739 1.00 0.00 H new ATOM 0 HG23 VAL A 52 5.281 -16.038 -7.953 1.00 0.00 H new ATOM 879 N VAL A 53 8.656 -13.718 -5.609 1.00 0.00 N ATOM 880 CA VAL A 53 9.582 -12.841 -4.838 1.00 0.00 C ATOM 881 C VAL A 53 10.906 -12.725 -5.594 1.00 0.00 C ATOM 882 O VAL A 53 11.566 -11.705 -5.556 1.00 0.00 O ATOM 883 CB VAL A 53 9.827 -13.445 -3.451 1.00 0.00 C ATOM 884 CG1 VAL A 53 10.908 -12.642 -2.725 1.00 0.00 C ATOM 885 CG2 VAL A 53 8.530 -13.400 -2.638 1.00 0.00 C ATOM 0 H VAL A 53 8.369 -14.576 -5.138 1.00 0.00 H new ATOM 0 HA VAL A 53 9.141 -11.851 -4.722 1.00 0.00 H new ATOM 0 HB VAL A 53 10.154 -14.479 -3.560 1.00 0.00 H new ATOM 0 HG11 VAL A 53 11.081 -13.073 -1.739 1.00 0.00 H new ATOM 0 HG12 VAL A 53 11.833 -12.672 -3.301 1.00 0.00 H new ATOM 0 HG13 VAL A 53 10.582 -11.608 -2.617 1.00 0.00 H new ATOM 0 HG21 VAL A 53 8.704 -13.830 -1.651 1.00 0.00 H new ATOM 0 HG22 VAL A 53 8.203 -12.366 -2.531 1.00 0.00 H new ATOM 0 HG23 VAL A 53 7.758 -13.973 -3.152 1.00 0.00 H new ATOM 895 N ASP A 54 11.302 -13.762 -6.276 1.00 0.00 N ATOM 896 CA ASP A 54 12.585 -13.711 -7.030 1.00 0.00 C ATOM 897 C ASP A 54 12.536 -12.588 -8.070 1.00 0.00 C ATOM 898 O ASP A 54 13.492 -11.860 -8.255 1.00 0.00 O ATOM 899 CB ASP A 54 12.815 -15.048 -7.736 1.00 0.00 C ATOM 900 CG ASP A 54 13.136 -16.124 -6.697 1.00 0.00 C ATOM 901 OD1 ASP A 54 12.892 -15.882 -5.526 1.00 0.00 O ATOM 902 OD2 ASP A 54 13.621 -17.172 -7.090 1.00 0.00 O ATOM 0 H ASP A 54 10.793 -14.643 -6.344 1.00 0.00 H new ATOM 0 HA ASP A 54 13.401 -13.519 -6.333 1.00 0.00 H new ATOM 0 HB2 ASP A 54 11.928 -15.329 -8.304 1.00 0.00 H new ATOM 0 HB3 ASP A 54 13.635 -14.959 -8.449 1.00 0.00 H new ATOM 907 N LYS A 55 11.437 -12.451 -8.767 1.00 0.00 N ATOM 908 CA LYS A 55 11.346 -11.386 -9.808 1.00 0.00 C ATOM 909 C LYS A 55 11.289 -10.008 -9.147 1.00 0.00 C ATOM 910 O LYS A 55 11.718 -9.026 -9.718 1.00 0.00 O ATOM 911 CB LYS A 55 10.107 -11.609 -10.674 1.00 0.00 C ATOM 912 CG LYS A 55 10.289 -12.892 -11.488 1.00 0.00 C ATOM 913 CD LYS A 55 9.048 -13.139 -12.348 1.00 0.00 C ATOM 914 CE LYS A 55 9.292 -14.341 -13.263 1.00 0.00 C ATOM 915 NZ LYS A 55 8.196 -14.432 -14.269 1.00 0.00 N ATOM 0 H LYS A 55 10.603 -13.028 -8.660 1.00 0.00 H new ATOM 0 HA LYS A 55 12.232 -11.432 -10.442 1.00 0.00 H new ATOM 0 HB2 LYS A 55 9.219 -11.684 -10.047 1.00 0.00 H new ATOM 0 HB3 LYS A 55 9.956 -10.759 -11.340 1.00 0.00 H new ATOM 0 HG2 LYS A 55 11.172 -12.809 -12.122 1.00 0.00 H new ATOM 0 HG3 LYS A 55 10.454 -13.737 -10.820 1.00 0.00 H new ATOM 0 HD2 LYS A 55 8.182 -13.323 -11.712 1.00 0.00 H new ATOM 0 HD3 LYS A 55 8.824 -12.254 -12.944 1.00 0.00 H new ATOM 0 HE2 LYS A 55 10.254 -14.239 -13.766 1.00 0.00 H new ATOM 0 HE3 LYS A 55 9.336 -15.257 -12.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 8.362 -15.249 -14.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 7.285 -14.548 -13.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 8.175 -13.562 -14.839 1.00 0.00 H new ATOM 929 N VAL A 56 10.806 -9.920 -7.939 1.00 0.00 N ATOM 930 CA VAL A 56 10.780 -8.601 -7.249 1.00 0.00 C ATOM 931 C VAL A 56 12.221 -8.160 -7.007 1.00 0.00 C ATOM 932 O VAL A 56 12.635 -7.095 -7.422 1.00 0.00 O ATOM 933 CB VAL A 56 10.067 -8.747 -5.903 1.00 0.00 C ATOM 934 CG1 VAL A 56 10.060 -7.397 -5.183 1.00 0.00 C ATOM 935 CG2 VAL A 56 8.624 -9.204 -6.140 1.00 0.00 C ATOM 0 H VAL A 56 10.430 -10.701 -7.402 1.00 0.00 H new ATOM 0 HA VAL A 56 10.254 -7.866 -7.859 1.00 0.00 H new ATOM 0 HB VAL A 56 10.588 -9.484 -5.292 1.00 0.00 H new ATOM 0 HG11 VAL A 56 9.552 -7.499 -4.224 1.00 0.00 H new ATOM 0 HG12 VAL A 56 11.086 -7.068 -5.018 1.00 0.00 H new ATOM 0 HG13 VAL A 56 9.537 -6.661 -5.794 1.00 0.00 H new ATOM 0 HG21 VAL A 56 8.114 -9.309 -5.183 1.00 0.00 H new ATOM 0 HG22 VAL A 56 8.104 -8.465 -6.749 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.627 -10.164 -6.657 1.00 0.00 H new ATOM 945 N MET A 57 12.988 -8.971 -6.333 1.00 0.00 N ATOM 946 CA MET A 57 14.401 -8.599 -6.056 1.00 0.00 C ATOM 947 C MET A 57 15.122 -8.280 -7.366 1.00 0.00 C ATOM 948 O MET A 57 16.063 -7.512 -7.392 1.00 0.00 O ATOM 949 CB MET A 57 15.103 -9.763 -5.351 1.00 0.00 C ATOM 950 CG MET A 57 14.418 -10.034 -4.008 1.00 0.00 C ATOM 951 SD MET A 57 15.519 -11.006 -2.951 1.00 0.00 S ATOM 952 CE MET A 57 14.854 -10.444 -1.365 1.00 0.00 C ATOM 0 H MET A 57 12.696 -9.875 -5.962 1.00 0.00 H new ATOM 0 HA MET A 57 14.423 -7.717 -5.415 1.00 0.00 H new ATOM 0 HB2 MET A 57 15.068 -10.655 -5.976 1.00 0.00 H new ATOM 0 HB3 MET A 57 16.155 -9.526 -5.193 1.00 0.00 H new ATOM 0 HG2 MET A 57 14.166 -9.092 -3.520 1.00 0.00 H new ATOM 0 HG3 MET A 57 13.483 -10.571 -4.167 1.00 0.00 H new ATOM 0 HE1 MET A 57 15.396 -10.926 -0.552 1.00 0.00 H new ATOM 0 HE2 MET A 57 14.967 -9.363 -1.286 1.00 0.00 H new ATOM 0 HE3 MET A 57 13.797 -10.704 -1.301 1.00 0.00 H new ATOM 962 N GLU A 58 14.675 -8.841 -8.464 1.00 0.00 N ATOM 963 CA GLU A 58 15.321 -8.541 -9.776 1.00 0.00 C ATOM 964 C GLU A 58 14.696 -7.276 -10.362 1.00 0.00 C ATOM 965 O GLU A 58 15.370 -6.480 -10.985 1.00 0.00 O ATOM 966 CB GLU A 58 15.153 -9.721 -10.737 1.00 0.00 C ATOM 967 CG GLU A 58 16.074 -9.534 -11.944 1.00 0.00 C ATOM 968 CD GLU A 58 17.519 -9.821 -11.533 1.00 0.00 C ATOM 969 OE1 GLU A 58 17.825 -10.976 -11.286 1.00 0.00 O ATOM 970 OE2 GLU A 58 18.295 -8.882 -11.472 1.00 0.00 O ATOM 0 H GLU A 58 13.891 -9.493 -8.506 1.00 0.00 H new ATOM 0 HA GLU A 58 16.389 -8.380 -9.627 1.00 0.00 H new ATOM 0 HB2 GLU A 58 15.390 -10.655 -10.227 1.00 0.00 H new ATOM 0 HB3 GLU A 58 14.116 -9.791 -11.065 1.00 0.00 H new ATOM 0 HG2 GLU A 58 15.774 -10.203 -12.750 1.00 0.00 H new ATOM 0 HG3 GLU A 58 15.989 -8.517 -12.326 1.00 0.00 H new ATOM 977 N THR A 59 13.424 -7.059 -10.161 1.00 0.00 N ATOM 978 CA THR A 59 12.813 -5.818 -10.708 1.00 0.00 C ATOM 979 C THR A 59 13.360 -4.636 -9.910 1.00 0.00 C ATOM 980 O THR A 59 13.758 -3.637 -10.475 1.00 0.00 O ATOM 981 CB THR A 59 11.284 -5.876 -10.614 1.00 0.00 C ATOM 982 OG1 THR A 59 10.843 -7.187 -10.938 1.00 0.00 O ATOM 983 CG2 THR A 59 10.670 -4.874 -11.596 1.00 0.00 C ATOM 0 H THR A 59 12.792 -7.676 -9.651 1.00 0.00 H new ATOM 0 HA THR A 59 13.066 -5.709 -11.763 1.00 0.00 H new ATOM 0 HB THR A 59 10.972 -5.625 -9.600 1.00 0.00 H new ATOM 0 HG1 THR A 59 10.919 -7.762 -10.148 1.00 0.00 H new ATOM 0 HG21 THR A 59 9.583 -4.917 -11.528 1.00 0.00 H new ATOM 0 HG22 THR A 59 11.010 -3.868 -11.349 1.00 0.00 H new ATOM 0 HG23 THR A 59 10.980 -5.123 -12.611 1.00 0.00 H new ATOM 991 N LEU A 60 13.440 -4.744 -8.612 1.00 0.00 N ATOM 992 CA LEU A 60 14.025 -3.629 -7.822 1.00 0.00 C ATOM 993 C LEU A 60 15.475 -3.447 -8.265 1.00 0.00 C ATOM 994 O LEU A 60 15.869 -2.387 -8.710 1.00 0.00 O ATOM 995 CB LEU A 60 13.998 -3.984 -6.331 1.00 0.00 C ATOM 996 CG LEU A 60 12.556 -4.247 -5.876 1.00 0.00 C ATOM 997 CD1 LEU A 60 12.573 -4.799 -4.447 1.00 0.00 C ATOM 998 CD2 LEU A 60 11.745 -2.941 -5.912 1.00 0.00 C ATOM 0 H LEU A 60 13.128 -5.550 -8.070 1.00 0.00 H new ATOM 0 HA LEU A 60 13.454 -2.714 -7.982 1.00 0.00 H new ATOM 0 HB2 LEU A 60 14.612 -4.866 -6.148 1.00 0.00 H new ATOM 0 HB3 LEU A 60 14.429 -3.170 -5.748 1.00 0.00 H new ATOM 0 HG LEU A 60 12.093 -4.970 -6.547 1.00 0.00 H new ATOM 0 HD11 LEU A 60 11.551 -4.988 -4.118 1.00 0.00 H new ATOM 0 HD12 LEU A 60 13.140 -5.730 -4.423 1.00 0.00 H new ATOM 0 HD13 LEU A 60 13.040 -4.073 -3.782 1.00 0.00 H new ATOM 0 HD21 LEU A 60 10.723 -3.138 -5.587 1.00 0.00 H new ATOM 0 HD22 LEU A 60 12.203 -2.210 -5.246 1.00 0.00 H new ATOM 0 HD23 LEU A 60 11.733 -2.548 -6.929 1.00 0.00 H new ATOM 1010 N ASP A 61 16.275 -4.475 -8.159 1.00 0.00 N ATOM 1011 CA ASP A 61 17.695 -4.354 -8.589 1.00 0.00 C ATOM 1012 C ASP A 61 17.739 -3.737 -9.990 1.00 0.00 C ATOM 1013 O ASP A 61 18.744 -3.201 -10.412 1.00 0.00 O ATOM 1014 CB ASP A 61 18.340 -5.742 -8.620 1.00 0.00 C ATOM 1015 CG ASP A 61 18.637 -6.201 -7.191 1.00 0.00 C ATOM 1016 OD1 ASP A 61 17.732 -6.151 -6.374 1.00 0.00 O ATOM 1017 OD2 ASP A 61 19.763 -6.595 -6.938 1.00 0.00 O ATOM 0 H ASP A 61 16.006 -5.389 -7.795 1.00 0.00 H new ATOM 0 HA ASP A 61 18.240 -3.721 -7.889 1.00 0.00 H new ATOM 0 HB2 ASP A 61 17.675 -6.453 -9.110 1.00 0.00 H new ATOM 0 HB3 ASP A 61 19.261 -5.713 -9.203 1.00 0.00 H new ATOM 1022 N GLU A 62 16.644 -3.808 -10.709 1.00 0.00 N ATOM 1023 CA GLU A 62 16.592 -3.226 -12.088 1.00 0.00 C ATOM 1024 C GLU A 62 15.827 -1.912 -12.043 1.00 0.00 C ATOM 1025 O GLU A 62 15.013 -1.607 -12.891 1.00 0.00 O ATOM 1026 CB GLU A 62 15.872 -4.168 -13.006 1.00 0.00 C ATOM 1027 CG GLU A 62 16.746 -5.386 -13.299 1.00 0.00 C ATOM 1028 CD GLU A 62 15.909 -6.460 -13.997 1.00 0.00 C ATOM 1029 OE1 GLU A 62 14.701 -6.300 -14.049 1.00 0.00 O ATOM 1030 OE2 GLU A 62 16.491 -7.424 -14.467 1.00 0.00 O ATOM 0 H GLU A 62 15.778 -4.247 -10.397 1.00 0.00 H new ATOM 0 HA GLU A 62 17.607 -3.062 -12.450 1.00 0.00 H new ATOM 0 HB2 GLU A 62 14.934 -4.485 -12.551 1.00 0.00 H new ATOM 0 HB3 GLU A 62 15.620 -3.660 -13.936 1.00 0.00 H new ATOM 0 HG2 GLU A 62 17.588 -5.099 -13.929 1.00 0.00 H new ATOM 0 HG3 GLU A 62 17.162 -5.780 -12.372 1.00 0.00 H new ATOM 1037 N ASP A 63 16.102 -1.152 -11.056 1.00 0.00 N ATOM 1038 CA ASP A 63 15.433 0.173 -10.881 1.00 0.00 C ATOM 1039 C ASP A 63 15.365 0.895 -12.227 1.00 0.00 C ATOM 1040 O ASP A 63 14.395 1.550 -12.549 1.00 0.00 O ATOM 1041 CB ASP A 63 16.293 1.012 -9.928 1.00 0.00 C ATOM 1042 CG ASP A 63 15.528 2.271 -9.512 1.00 0.00 C ATOM 1043 OD1 ASP A 63 14.309 2.214 -9.466 1.00 0.00 O ATOM 1044 OD2 ASP A 63 16.174 3.269 -9.242 1.00 0.00 O ATOM 0 H ASP A 63 16.780 -1.382 -10.330 1.00 0.00 H new ATOM 0 HA ASP A 63 14.426 0.034 -10.488 1.00 0.00 H new ATOM 0 HB2 ASP A 63 16.553 0.426 -9.047 1.00 0.00 H new ATOM 0 HB3 ASP A 63 17.228 1.288 -10.415 1.00 0.00 H new ATOM 1049 N GLY A 64 16.380 0.728 -13.024 1.00 0.00 N ATOM 1050 CA GLY A 64 16.413 1.346 -14.385 1.00 0.00 C ATOM 1051 C GLY A 64 16.132 2.858 -14.350 1.00 0.00 C ATOM 1052 O GLY A 64 16.321 3.532 -15.343 1.00 0.00 O ATOM 0 H GLY A 64 17.207 0.179 -12.789 1.00 0.00 H new ATOM 0 HA2 GLY A 64 17.389 1.171 -14.837 1.00 0.00 H new ATOM 0 HA3 GLY A 64 15.675 0.857 -15.021 1.00 0.00 H new ATOM 1056 N ASP A 65 15.691 3.410 -13.236 1.00 0.00 N ATOM 1057 CA ASP A 65 15.412 4.898 -13.185 1.00 0.00 C ATOM 1058 C ASP A 65 16.489 5.667 -12.374 1.00 0.00 C ATOM 1059 O ASP A 65 16.756 6.812 -12.680 1.00 0.00 O ATOM 1060 CB ASP A 65 14.042 5.124 -12.536 1.00 0.00 C ATOM 1061 CG ASP A 65 13.898 4.226 -11.305 1.00 0.00 C ATOM 1062 OD1 ASP A 65 14.488 4.551 -10.289 1.00 0.00 O ATOM 1063 OD2 ASP A 65 13.198 3.232 -11.400 1.00 0.00 O ATOM 0 H ASP A 65 15.513 2.905 -12.368 1.00 0.00 H new ATOM 0 HA ASP A 65 15.430 5.278 -14.206 1.00 0.00 H new ATOM 0 HB2 ASP A 65 13.933 6.170 -12.249 1.00 0.00 H new ATOM 0 HB3 ASP A 65 13.250 4.905 -13.252 1.00 0.00 H new ATOM 1068 N GLY A 66 17.110 5.094 -11.356 1.00 0.00 N ATOM 1069 CA GLY A 66 18.144 5.852 -10.576 1.00 0.00 C ATOM 1070 C GLY A 66 17.537 6.299 -9.245 1.00 0.00 C ATOM 1071 O GLY A 66 18.233 6.466 -8.263 1.00 0.00 O ATOM 0 H GLY A 66 16.943 4.140 -11.038 1.00 0.00 H new ATOM 0 HA2 GLY A 66 19.017 5.224 -10.399 1.00 0.00 H new ATOM 0 HA3 GLY A 66 18.484 6.718 -11.144 1.00 0.00 H new ATOM 1075 N GLU A 67 16.239 6.477 -9.193 1.00 0.00 N ATOM 1076 CA GLU A 67 15.593 6.893 -7.913 1.00 0.00 C ATOM 1077 C GLU A 67 14.167 6.330 -7.840 1.00 0.00 C ATOM 1078 O GLU A 67 13.384 6.484 -8.757 1.00 0.00 O ATOM 1079 CB GLU A 67 15.563 8.418 -7.849 1.00 0.00 C ATOM 1080 CG GLU A 67 14.653 8.969 -8.956 1.00 0.00 C ATOM 1081 CD GLU A 67 14.994 10.439 -9.219 1.00 0.00 C ATOM 1082 OE1 GLU A 67 16.169 10.737 -9.362 1.00 0.00 O ATOM 1083 OE2 GLU A 67 14.076 11.240 -9.274 1.00 0.00 O ATOM 0 H GLU A 67 15.602 6.352 -9.980 1.00 0.00 H new ATOM 0 HA GLU A 67 16.161 6.504 -7.068 1.00 0.00 H new ATOM 0 HB2 GLU A 67 15.201 8.743 -6.873 1.00 0.00 H new ATOM 0 HB3 GLU A 67 16.571 8.816 -7.964 1.00 0.00 H new ATOM 0 HG2 GLU A 67 14.781 8.387 -9.869 1.00 0.00 H new ATOM 0 HG3 GLU A 67 13.608 8.875 -8.662 1.00 0.00 H new ATOM 1090 N CYS A 68 13.823 5.683 -6.753 1.00 0.00 N ATOM 1091 CA CYS A 68 12.446 5.108 -6.606 1.00 0.00 C ATOM 1092 C CYS A 68 11.613 6.008 -5.686 1.00 0.00 C ATOM 1093 O CYS A 68 12.020 6.339 -4.589 1.00 0.00 O ATOM 1094 CB CYS A 68 12.546 3.695 -6.006 1.00 0.00 C ATOM 1095 SG CYS A 68 14.054 2.895 -6.607 1.00 0.00 S ATOM 0 H CYS A 68 14.440 5.527 -5.956 1.00 0.00 H new ATOM 0 HA CYS A 68 11.965 5.051 -7.582 1.00 0.00 H new ATOM 0 HB2 CYS A 68 12.559 3.750 -4.917 1.00 0.00 H new ATOM 0 HB3 CYS A 68 11.672 3.106 -6.285 1.00 0.00 H new ATOM 0 HG CYS A 68 13.829 2.365 -7.773 1.00 0.00 H new ATOM 1101 N ASP A 69 10.451 6.408 -6.128 1.00 0.00 N ATOM 1102 CA ASP A 69 9.589 7.289 -5.288 1.00 0.00 C ATOM 1103 C ASP A 69 8.792 6.439 -4.292 1.00 0.00 C ATOM 1104 O ASP A 69 8.970 5.241 -4.201 1.00 0.00 O ATOM 1105 CB ASP A 69 8.621 8.056 -6.192 1.00 0.00 C ATOM 1106 CG ASP A 69 7.973 9.192 -5.400 1.00 0.00 C ATOM 1107 OD1 ASP A 69 8.705 9.962 -4.800 1.00 0.00 O ATOM 1108 OD2 ASP A 69 6.756 9.272 -5.406 1.00 0.00 O ATOM 0 H ASP A 69 10.060 6.162 -7.038 1.00 0.00 H new ATOM 0 HA ASP A 69 10.216 7.991 -4.738 1.00 0.00 H new ATOM 0 HB2 ASP A 69 9.153 8.457 -7.054 1.00 0.00 H new ATOM 0 HB3 ASP A 69 7.854 7.383 -6.576 1.00 0.00 H new ATOM 1113 N PHE A 70 7.908 7.053 -3.552 1.00 0.00 N ATOM 1114 CA PHE A 70 7.089 6.283 -2.569 1.00 0.00 C ATOM 1115 C PHE A 70 6.007 5.500 -3.320 1.00 0.00 C ATOM 1116 O PHE A 70 5.610 4.428 -2.909 1.00 0.00 O ATOM 1117 CB PHE A 70 6.445 7.252 -1.574 1.00 0.00 C ATOM 1118 CG PHE A 70 5.628 6.486 -0.561 1.00 0.00 C ATOM 1119 CD1 PHE A 70 4.348 6.026 -0.895 1.00 0.00 C ATOM 1120 CD2 PHE A 70 6.147 6.241 0.717 1.00 0.00 C ATOM 1121 CE1 PHE A 70 3.589 5.321 0.047 1.00 0.00 C ATOM 1122 CE2 PHE A 70 5.389 5.536 1.658 1.00 0.00 C ATOM 1123 CZ PHE A 70 4.109 5.076 1.323 1.00 0.00 C ATOM 0 H PHE A 70 7.717 8.054 -3.585 1.00 0.00 H new ATOM 0 HA PHE A 70 7.723 5.584 -2.023 1.00 0.00 H new ATOM 0 HB2 PHE A 70 7.217 7.832 -1.067 1.00 0.00 H new ATOM 0 HB3 PHE A 70 5.810 7.961 -2.104 1.00 0.00 H new ATOM 0 HD1 PHE A 70 3.946 6.215 -1.879 1.00 0.00 H new ATOM 0 HD2 PHE A 70 7.133 6.597 0.976 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.602 4.966 -0.211 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.791 5.346 2.642 1.00 0.00 H new ATOM 0 HZ PHE A 70 3.523 4.532 2.049 1.00 0.00 H new ATOM 1133 N GLN A 71 5.536 6.011 -4.420 1.00 0.00 N ATOM 1134 CA GLN A 71 4.494 5.275 -5.191 1.00 0.00 C ATOM 1135 C GLN A 71 5.042 3.900 -5.586 1.00 0.00 C ATOM 1136 O GLN A 71 4.329 2.917 -5.590 1.00 0.00 O ATOM 1137 CB GLN A 71 4.143 6.069 -6.450 1.00 0.00 C ATOM 1138 CG GLN A 71 3.392 7.343 -6.056 1.00 0.00 C ATOM 1139 CD GLN A 71 3.311 8.285 -7.258 1.00 0.00 C ATOM 1140 OE1 GLN A 71 4.180 9.111 -7.458 1.00 0.00 O ATOM 1141 NE2 GLN A 71 2.296 8.197 -8.073 1.00 0.00 N ATOM 0 H GLN A 71 5.825 6.904 -4.820 1.00 0.00 H new ATOM 0 HA GLN A 71 3.599 5.150 -4.581 1.00 0.00 H new ATOM 0 HB2 GLN A 71 5.051 6.323 -6.997 1.00 0.00 H new ATOM 0 HB3 GLN A 71 3.529 5.463 -7.116 1.00 0.00 H new ATOM 0 HG2 GLN A 71 2.389 7.093 -5.709 1.00 0.00 H new ATOM 0 HG3 GLN A 71 3.902 7.836 -5.229 1.00 0.00 H new ATOM 0 HE21 GLN A 71 1.566 7.504 -7.906 1.00 0.00 H new ATOM 0 HE22 GLN A 71 2.232 8.821 -8.877 1.00 0.00 H new ATOM 1150 N GLU A 72 6.303 3.820 -5.908 1.00 0.00 N ATOM 1151 CA GLU A 72 6.893 2.504 -6.289 1.00 0.00 C ATOM 1152 C GLU A 72 7.030 1.621 -5.042 1.00 0.00 C ATOM 1153 O GLU A 72 7.076 0.412 -5.125 1.00 0.00 O ATOM 1154 CB GLU A 72 8.266 2.716 -6.938 1.00 0.00 C ATOM 1155 CG GLU A 72 8.086 3.135 -8.400 1.00 0.00 C ATOM 1156 CD GLU A 72 7.352 4.476 -8.462 1.00 0.00 C ATOM 1157 OE1 GLU A 72 7.828 5.418 -7.850 1.00 0.00 O ATOM 1158 OE2 GLU A 72 6.327 4.537 -9.120 1.00 0.00 O ATOM 0 H GLU A 72 6.951 4.608 -5.924 1.00 0.00 H new ATOM 0 HA GLU A 72 6.238 2.009 -7.006 1.00 0.00 H new ATOM 0 HB2 GLU A 72 8.821 3.482 -6.396 1.00 0.00 H new ATOM 0 HB3 GLU A 72 8.851 1.798 -6.882 1.00 0.00 H new ATOM 0 HG2 GLU A 72 9.057 3.218 -8.888 1.00 0.00 H new ATOM 0 HG3 GLU A 72 7.522 2.375 -8.940 1.00 0.00 H new ATOM 1165 N PHE A 73 7.064 2.222 -3.886 1.00 0.00 N ATOM 1166 CA PHE A 73 7.167 1.432 -2.622 1.00 0.00 C ATOM 1167 C PHE A 73 5.810 0.791 -2.303 1.00 0.00 C ATOM 1168 O PHE A 73 5.753 -0.350 -1.893 1.00 0.00 O ATOM 1169 CB PHE A 73 7.627 2.345 -1.477 1.00 0.00 C ATOM 1170 CG PHE A 73 7.475 1.645 -0.147 1.00 0.00 C ATOM 1171 CD1 PHE A 73 8.512 0.846 0.341 1.00 0.00 C ATOM 1172 CD2 PHE A 73 6.301 1.804 0.600 1.00 0.00 C ATOM 1173 CE1 PHE A 73 8.379 0.203 1.577 1.00 0.00 C ATOM 1174 CE2 PHE A 73 6.168 1.162 1.838 1.00 0.00 C ATOM 1175 CZ PHE A 73 7.207 0.361 2.327 1.00 0.00 C ATOM 0 H PHE A 73 7.025 3.233 -3.759 1.00 0.00 H new ATOM 0 HA PHE A 73 7.903 0.637 -2.743 1.00 0.00 H new ATOM 0 HB2 PHE A 73 8.668 2.630 -1.627 1.00 0.00 H new ATOM 0 HB3 PHE A 73 7.041 3.264 -1.480 1.00 0.00 H new ATOM 0 HD1 PHE A 73 9.417 0.724 -0.236 1.00 0.00 H new ATOM 0 HD2 PHE A 73 5.499 2.421 0.222 1.00 0.00 H new ATOM 0 HE1 PHE A 73 9.181 -0.415 1.953 1.00 0.00 H new ATOM 0 HE2 PHE A 73 5.264 1.285 2.415 1.00 0.00 H new ATOM 0 HZ PHE A 73 7.105 -0.134 3.281 1.00 0.00 H new ATOM 1185 N MET A 74 4.722 1.475 -2.483 1.00 0.00 N ATOM 1186 CA MET A 74 3.417 0.821 -2.173 1.00 0.00 C ATOM 1187 C MET A 74 3.162 -0.305 -3.193 1.00 0.00 C ATOM 1188 O MET A 74 2.795 -1.400 -2.814 1.00 0.00 O ATOM 1189 CB MET A 74 2.279 1.868 -2.202 1.00 0.00 C ATOM 1190 CG MET A 74 1.326 1.650 -1.017 1.00 0.00 C ATOM 1191 SD MET A 74 2.107 2.267 0.501 1.00 0.00 S ATOM 1192 CE MET A 74 1.843 0.806 1.542 1.00 0.00 C ATOM 0 H MET A 74 4.672 2.435 -2.823 1.00 0.00 H new ATOM 0 HA MET A 74 3.447 0.388 -1.173 1.00 0.00 H new ATOM 0 HB2 MET A 74 2.699 2.873 -2.160 1.00 0.00 H new ATOM 0 HB3 MET A 74 1.728 1.791 -3.140 1.00 0.00 H new ATOM 0 HG2 MET A 74 0.384 2.170 -1.192 1.00 0.00 H new ATOM 0 HG3 MET A 74 1.091 0.591 -0.914 1.00 0.00 H new ATOM 0 HE1 MET A 74 2.258 0.986 2.534 1.00 0.00 H new ATOM 0 HE2 MET A 74 0.775 0.608 1.627 1.00 0.00 H new ATOM 0 HE3 MET A 74 2.337 -0.055 1.092 1.00 0.00 H new ATOM 1202 N ALA A 75 3.329 -0.073 -4.464 1.00 0.00 N ATOM 1203 CA ALA A 75 3.069 -1.163 -5.454 1.00 0.00 C ATOM 1204 C ALA A 75 4.031 -2.346 -5.258 1.00 0.00 C ATOM 1205 O ALA A 75 3.603 -3.470 -5.090 1.00 0.00 O ATOM 1206 CB ALA A 75 3.241 -0.601 -6.867 1.00 0.00 C ATOM 0 H ALA A 75 3.632 0.816 -4.862 1.00 0.00 H new ATOM 0 HA ALA A 75 2.052 -1.527 -5.305 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.054 -1.388 -7.597 1.00 0.00 H new ATOM 0 HB2 ALA A 75 2.534 0.214 -7.023 1.00 0.00 H new ATOM 0 HB3 ALA A 75 4.258 -0.228 -6.989 1.00 0.00 H new ATOM 1212 N PHE A 76 5.317 -2.124 -5.297 1.00 0.00 N ATOM 1213 CA PHE A 76 6.264 -3.274 -5.133 1.00 0.00 C ATOM 1214 C PHE A 76 6.009 -3.973 -3.791 1.00 0.00 C ATOM 1215 O PHE A 76 6.074 -5.182 -3.690 1.00 0.00 O ATOM 1216 CB PHE A 76 7.723 -2.774 -5.198 1.00 0.00 C ATOM 1217 CG PHE A 76 8.194 -2.737 -6.639 1.00 0.00 C ATOM 1218 CD1 PHE A 76 8.266 -3.926 -7.378 1.00 0.00 C ATOM 1219 CD2 PHE A 76 8.552 -1.521 -7.237 1.00 0.00 C ATOM 1220 CE1 PHE A 76 8.694 -3.899 -8.709 1.00 0.00 C ATOM 1221 CE2 PHE A 76 8.981 -1.496 -8.569 1.00 0.00 C ATOM 1222 CZ PHE A 76 9.052 -2.684 -9.305 1.00 0.00 C ATOM 0 H PHE A 76 5.752 -1.212 -5.433 1.00 0.00 H new ATOM 0 HA PHE A 76 6.099 -3.985 -5.942 1.00 0.00 H new ATOM 0 HB2 PHE A 76 7.795 -1.780 -4.757 1.00 0.00 H new ATOM 0 HB3 PHE A 76 8.367 -3.430 -4.613 1.00 0.00 H new ATOM 0 HD1 PHE A 76 7.991 -4.864 -6.919 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.497 -0.603 -6.670 1.00 0.00 H new ATOM 0 HE1 PHE A 76 8.748 -4.816 -9.277 1.00 0.00 H new ATOM 0 HE2 PHE A 76 9.258 -0.559 -9.029 1.00 0.00 H new ATOM 0 HZ PHE A 76 9.383 -2.664 -10.333 1.00 0.00 H new ATOM 1232 N VAL A 77 5.709 -3.228 -2.771 1.00 0.00 N ATOM 1233 CA VAL A 77 5.440 -3.865 -1.451 1.00 0.00 C ATOM 1234 C VAL A 77 4.201 -4.756 -1.578 1.00 0.00 C ATOM 1235 O VAL A 77 4.083 -5.769 -0.917 1.00 0.00 O ATOM 1236 CB VAL A 77 5.211 -2.776 -0.395 1.00 0.00 C ATOM 1237 CG1 VAL A 77 4.608 -3.392 0.875 1.00 0.00 C ATOM 1238 CG2 VAL A 77 6.553 -2.110 -0.054 1.00 0.00 C ATOM 0 H VAL A 77 5.638 -2.211 -2.789 1.00 0.00 H new ATOM 0 HA VAL A 77 6.291 -4.473 -1.144 1.00 0.00 H new ATOM 0 HB VAL A 77 4.520 -2.032 -0.791 1.00 0.00 H new ATOM 0 HG11 VAL A 77 4.449 -2.611 1.618 1.00 0.00 H new ATOM 0 HG12 VAL A 77 3.655 -3.863 0.634 1.00 0.00 H new ATOM 0 HG13 VAL A 77 5.291 -4.141 1.276 1.00 0.00 H new ATOM 0 HG21 VAL A 77 6.394 -1.335 0.696 1.00 0.00 H new ATOM 0 HG22 VAL A 77 7.242 -2.859 0.337 1.00 0.00 H new ATOM 0 HG23 VAL A 77 6.976 -1.663 -0.953 1.00 0.00 H new ATOM 1248 N SER A 78 3.279 -4.390 -2.425 1.00 0.00 N ATOM 1249 CA SER A 78 2.052 -5.219 -2.595 1.00 0.00 C ATOM 1250 C SER A 78 2.410 -6.538 -3.293 1.00 0.00 C ATOM 1251 O SER A 78 2.037 -7.606 -2.849 1.00 0.00 O ATOM 1252 CB SER A 78 1.035 -4.448 -3.441 1.00 0.00 C ATOM 1253 OG SER A 78 -0.260 -4.995 -3.231 1.00 0.00 O ATOM 0 H SER A 78 3.322 -3.553 -3.007 1.00 0.00 H new ATOM 0 HA SER A 78 1.623 -5.438 -1.617 1.00 0.00 H new ATOM 0 HB2 SER A 78 1.045 -3.392 -3.170 1.00 0.00 H new ATOM 0 HB3 SER A 78 1.302 -4.509 -4.496 1.00 0.00 H new ATOM 0 HG SER A 78 -0.914 -4.503 -3.770 1.00 0.00 H new ATOM 1259 N MET A 79 3.111 -6.471 -4.394 1.00 0.00 N ATOM 1260 CA MET A 79 3.469 -7.719 -5.132 1.00 0.00 C ATOM 1261 C MET A 79 4.076 -8.749 -4.179 1.00 0.00 C ATOM 1262 O MET A 79 3.810 -9.928 -4.287 1.00 0.00 O ATOM 1263 CB MET A 79 4.486 -7.389 -6.228 1.00 0.00 C ATOM 1264 CG MET A 79 3.798 -6.610 -7.351 1.00 0.00 C ATOM 1265 SD MET A 79 2.755 -7.733 -8.314 1.00 0.00 S ATOM 1266 CE MET A 79 4.008 -8.227 -9.524 1.00 0.00 C ATOM 0 H MET A 79 3.451 -5.606 -4.815 1.00 0.00 H new ATOM 0 HA MET A 79 2.564 -8.135 -5.575 1.00 0.00 H new ATOM 0 HB2 MET A 79 5.305 -6.801 -5.813 1.00 0.00 H new ATOM 0 HB3 MET A 79 4.921 -8.307 -6.623 1.00 0.00 H new ATOM 0 HG2 MET A 79 3.194 -5.805 -6.932 1.00 0.00 H new ATOM 0 HG3 MET A 79 4.544 -6.146 -7.996 1.00 0.00 H new ATOM 0 HE1 MET A 79 3.573 -8.933 -10.231 1.00 0.00 H new ATOM 0 HE2 MET A 79 4.362 -7.347 -10.061 1.00 0.00 H new ATOM 0 HE3 MET A 79 4.845 -8.698 -9.009 1.00 0.00 H new ATOM 1276 N VAL A 80 4.883 -8.326 -3.249 1.00 0.00 N ATOM 1277 CA VAL A 80 5.492 -9.308 -2.304 1.00 0.00 C ATOM 1278 C VAL A 80 4.425 -9.801 -1.327 1.00 0.00 C ATOM 1279 O VAL A 80 4.244 -10.988 -1.142 1.00 0.00 O ATOM 1280 CB VAL A 80 6.623 -8.642 -1.518 1.00 0.00 C ATOM 1281 CG1 VAL A 80 7.236 -9.656 -0.550 1.00 0.00 C ATOM 1282 CG2 VAL A 80 7.701 -8.150 -2.485 1.00 0.00 C ATOM 0 H VAL A 80 5.147 -7.352 -3.100 1.00 0.00 H new ATOM 0 HA VAL A 80 5.892 -10.149 -2.871 1.00 0.00 H new ATOM 0 HB VAL A 80 6.224 -7.796 -0.959 1.00 0.00 H new ATOM 0 HG11 VAL A 80 8.042 -9.183 0.011 1.00 0.00 H new ATOM 0 HG12 VAL A 80 6.470 -10.007 0.142 1.00 0.00 H new ATOM 0 HG13 VAL A 80 7.633 -10.502 -1.112 1.00 0.00 H new ATOM 0 HG21 VAL A 80 8.505 -7.676 -1.923 1.00 0.00 H new ATOM 0 HG22 VAL A 80 8.100 -8.995 -3.046 1.00 0.00 H new ATOM 0 HG23 VAL A 80 7.267 -7.428 -3.176 1.00 0.00 H new ATOM 1292 N THR A 81 3.708 -8.906 -0.708 1.00 0.00 N ATOM 1293 CA THR A 81 2.649 -9.341 0.242 1.00 0.00 C ATOM 1294 C THR A 81 1.659 -10.239 -0.504 1.00 0.00 C ATOM 1295 O THR A 81 1.218 -11.253 0.001 1.00 0.00 O ATOM 1296 CB THR A 81 1.915 -8.113 0.789 1.00 0.00 C ATOM 1297 OG1 THR A 81 2.865 -7.142 1.205 1.00 0.00 O ATOM 1298 CG2 THR A 81 1.045 -8.521 1.979 1.00 0.00 C ATOM 0 H THR A 81 3.809 -7.897 -0.818 1.00 0.00 H new ATOM 0 HA THR A 81 3.096 -9.889 1.072 1.00 0.00 H new ATOM 0 HB THR A 81 1.282 -7.692 0.008 1.00 0.00 H new ATOM 0 HG1 THR A 81 3.145 -6.606 0.433 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.524 -7.645 2.366 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.316 -9.265 1.658 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.675 -8.944 2.762 1.00 0.00 H new ATOM 1306 N THR A 82 1.313 -9.870 -1.708 1.00 0.00 N ATOM 1307 CA THR A 82 0.358 -10.690 -2.506 1.00 0.00 C ATOM 1308 C THR A 82 1.054 -11.958 -3.010 1.00 0.00 C ATOM 1309 O THR A 82 0.414 -12.934 -3.347 1.00 0.00 O ATOM 1310 CB THR A 82 -0.138 -9.874 -3.703 1.00 0.00 C ATOM 1311 OG1 THR A 82 0.976 -9.425 -4.459 1.00 0.00 O ATOM 1312 CG2 THR A 82 -0.941 -8.671 -3.207 1.00 0.00 C ATOM 0 H THR A 82 1.654 -9.030 -2.176 1.00 0.00 H new ATOM 0 HA THR A 82 -0.486 -10.970 -1.876 1.00 0.00 H new ATOM 0 HB THR A 82 -0.776 -10.497 -4.330 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.342 -8.612 -4.051 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.293 -8.092 -4.061 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.796 -9.018 -2.627 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.307 -8.044 -2.580 1.00 0.00 H new ATOM 1320 N ALA A 83 2.360 -11.953 -3.067 1.00 0.00 N ATOM 1321 CA ALA A 83 3.088 -13.161 -3.551 1.00 0.00 C ATOM 1322 C ALA A 83 2.702 -14.365 -2.695 1.00 0.00 C ATOM 1323 O ALA A 83 2.747 -15.496 -3.139 1.00 0.00 O ATOM 1324 CB ALA A 83 4.597 -12.930 -3.443 1.00 0.00 C ATOM 0 H ALA A 83 2.952 -11.166 -2.800 1.00 0.00 H new ATOM 0 HA ALA A 83 2.821 -13.349 -4.591 1.00 0.00 H new ATOM 0 HB1 ALA A 83 5.127 -13.814 -3.797 1.00 0.00 H new ATOM 0 HB2 ALA A 83 4.878 -12.071 -4.052 1.00 0.00 H new ATOM 0 HB3 ALA A 83 4.863 -12.740 -2.403 1.00 0.00 H new ATOM 1481 N SER B 1 7.659 -5.778 14.306 1.00 0.00 N ATOM 1482 CA SER B 1 7.898 -4.305 14.311 1.00 0.00 C ATOM 1483 C SER B 1 6.556 -3.576 14.227 1.00 0.00 C ATOM 1484 O SER B 1 5.530 -4.178 13.978 1.00 0.00 O ATOM 1485 CB SER B 1 8.774 -3.921 13.117 1.00 0.00 C ATOM 1486 OG SER B 1 7.954 -3.755 11.968 1.00 0.00 O ATOM 0 H1 SER B 1 7.990 -6.186 15.203 1.00 0.00 H new ATOM 0 H2 SER B 1 6.642 -5.964 14.195 1.00 0.00 H new ATOM 0 H3 SER B 1 8.178 -6.211 13.516 1.00 0.00 H new ATOM 0 HA SER B 1 8.408 -4.020 15.231 1.00 0.00 H new ATOM 0 HB2 SER B 1 9.314 -2.998 13.329 1.00 0.00 H new ATOM 0 HB3 SER B 1 9.522 -4.693 12.936 1.00 0.00 H new ATOM 0 HG SER B 1 8.512 -3.507 11.201 1.00 0.00 H new ATOM 1492 N GLU B 2 6.548 -2.289 14.442 1.00 0.00 N ATOM 1493 CA GLU B 2 5.263 -1.538 14.380 1.00 0.00 C ATOM 1494 C GLU B 2 4.675 -1.651 12.972 1.00 0.00 C ATOM 1495 O GLU B 2 3.477 -1.758 12.794 1.00 0.00 O ATOM 1496 CB GLU B 2 5.518 -0.068 14.726 1.00 0.00 C ATOM 1497 CG GLU B 2 6.524 0.016 15.876 1.00 0.00 C ATOM 1498 CD GLU B 2 6.524 1.432 16.453 1.00 0.00 C ATOM 1499 OE1 GLU B 2 6.996 2.328 15.772 1.00 0.00 O ATOM 1500 OE2 GLU B 2 6.052 1.597 17.566 1.00 0.00 O ATOM 0 H GLU B 2 7.372 -1.727 14.657 1.00 0.00 H new ATOM 0 HA GLU B 2 4.556 -1.957 15.096 1.00 0.00 H new ATOM 0 HB2 GLU B 2 5.901 0.461 13.854 1.00 0.00 H new ATOM 0 HB3 GLU B 2 4.584 0.418 15.009 1.00 0.00 H new ATOM 0 HG2 GLU B 2 6.266 -0.704 16.652 1.00 0.00 H new ATOM 0 HG3 GLU B 2 7.521 -0.243 15.520 1.00 0.00 H new ATOM 1507 N LEU B 3 5.509 -1.628 11.968 1.00 0.00 N ATOM 1508 CA LEU B 3 5.001 -1.736 10.571 1.00 0.00 C ATOM 1509 C LEU B 3 4.356 -3.113 10.379 1.00 0.00 C ATOM 1510 O LEU B 3 3.243 -3.231 9.909 1.00 0.00 O ATOM 1511 CB LEU B 3 6.175 -1.557 9.589 1.00 0.00 C ATOM 1512 CG LEU B 3 5.677 -0.976 8.258 1.00 0.00 C ATOM 1513 CD1 LEU B 3 6.833 -0.938 7.256 1.00 0.00 C ATOM 1514 CD2 LEU B 3 4.547 -1.849 7.701 1.00 0.00 C ATOM 0 H LEU B 3 6.521 -1.539 12.055 1.00 0.00 H new ATOM 0 HA LEU B 3 4.258 -0.962 10.380 1.00 0.00 H new ATOM 0 HB2 LEU B 3 6.924 -0.895 10.024 1.00 0.00 H new ATOM 0 HB3 LEU B 3 6.661 -2.517 9.415 1.00 0.00 H new ATOM 0 HG LEU B 3 5.302 0.034 8.423 1.00 0.00 H new ATOM 0 HD11 LEU B 3 6.481 -0.526 6.310 1.00 0.00 H new ATOM 0 HD12 LEU B 3 7.635 -0.312 7.649 1.00 0.00 H new ATOM 0 HD13 LEU B 3 7.208 -1.949 7.094 1.00 0.00 H new ATOM 0 HD21 LEU B 3 4.197 -1.432 6.756 1.00 0.00 H new ATOM 0 HD22 LEU B 3 4.917 -2.861 7.536 1.00 0.00 H new ATOM 0 HD23 LEU B 3 3.723 -1.875 8.413 1.00 0.00 H new ATOM 1526 N GLU B 4 5.047 -4.156 10.752 1.00 0.00 N ATOM 1527 CA GLU B 4 4.475 -5.523 10.602 1.00 0.00 C ATOM 1528 C GLU B 4 3.080 -5.550 11.228 1.00 0.00 C ATOM 1529 O GLU B 4 2.130 -6.040 10.653 1.00 0.00 O ATOM 1530 CB GLU B 4 5.384 -6.522 11.321 1.00 0.00 C ATOM 1531 CG GLU B 4 4.948 -7.952 10.998 1.00 0.00 C ATOM 1532 CD GLU B 4 5.820 -8.935 11.782 1.00 0.00 C ATOM 1533 OE1 GLU B 4 6.869 -8.522 12.251 1.00 0.00 O ATOM 1534 OE2 GLU B 4 5.425 -10.084 11.901 1.00 0.00 O ATOM 0 H GLU B 4 5.984 -4.120 11.154 1.00 0.00 H new ATOM 0 HA GLU B 4 4.404 -5.789 9.547 1.00 0.00 H new ATOM 0 HB2 GLU B 4 6.419 -6.371 11.014 1.00 0.00 H new ATOM 0 HB3 GLU B 4 5.343 -6.355 12.397 1.00 0.00 H new ATOM 0 HG2 GLU B 4 3.899 -8.092 11.257 1.00 0.00 H new ATOM 0 HG3 GLU B 4 5.040 -8.140 9.928 1.00 0.00 H new ATOM 1541 N LYS B 5 2.962 -5.009 12.409 1.00 0.00 N ATOM 1542 CA LYS B 5 1.647 -4.973 13.104 1.00 0.00 C ATOM 1543 C LYS B 5 0.576 -4.418 12.163 1.00 0.00 C ATOM 1544 O LYS B 5 -0.543 -4.889 12.119 1.00 0.00 O ATOM 1545 CB LYS B 5 1.763 -4.046 14.316 1.00 0.00 C ATOM 1546 CG LYS B 5 0.536 -4.222 15.211 1.00 0.00 C ATOM 1547 CD LYS B 5 0.541 -3.153 16.306 1.00 0.00 C ATOM 1548 CE LYS B 5 -0.718 -3.296 17.163 1.00 0.00 C ATOM 1549 NZ LYS B 5 -0.838 -4.704 17.637 1.00 0.00 N ATOM 0 H LYS B 5 3.731 -4.585 12.928 1.00 0.00 H new ATOM 0 HA LYS B 5 1.370 -5.981 13.414 1.00 0.00 H new ATOM 0 HB2 LYS B 5 2.670 -4.273 14.876 1.00 0.00 H new ATOM 0 HB3 LYS B 5 1.842 -3.009 13.988 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -0.374 -4.144 14.617 1.00 0.00 H new ATOM 0 HG3 LYS B 5 0.540 -5.216 15.659 1.00 0.00 H new ATOM 0 HD2 LYS B 5 1.431 -3.257 16.927 1.00 0.00 H new ATOM 0 HD3 LYS B 5 0.579 -2.159 15.859 1.00 0.00 H new ATOM 0 HE2 LYS B 5 -0.671 -2.617 18.014 1.00 0.00 H new ATOM 0 HE3 LYS B 5 -1.599 -3.020 16.584 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 -1.293 -4.718 18.572 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 -1.414 -5.249 16.964 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 0.109 -5.129 17.706 1.00 0.00 H new ATOM 1563 N ALA B 6 0.923 -3.400 11.423 1.00 0.00 N ATOM 1564 CA ALA B 6 -0.046 -2.766 10.483 1.00 0.00 C ATOM 1565 C ALA B 6 -0.227 -3.615 9.219 1.00 0.00 C ATOM 1566 O ALA B 6 -1.286 -3.614 8.623 1.00 0.00 O ATOM 1567 CB ALA B 6 0.473 -1.373 10.105 1.00 0.00 C ATOM 0 H ALA B 6 1.850 -2.975 11.430 1.00 0.00 H new ATOM 0 HA ALA B 6 -1.016 -2.687 10.974 1.00 0.00 H new ATOM 0 HB1 ALA B 6 -0.227 -0.898 9.417 1.00 0.00 H new ATOM 0 HB2 ALA B 6 0.568 -0.764 11.004 1.00 0.00 H new ATOM 0 HB3 ALA B 6 1.447 -1.466 9.625 1.00 0.00 H new ATOM 1573 N MET B 7 0.762 -4.354 8.806 1.00 0.00 N ATOM 1574 CA MET B 7 0.569 -5.197 7.591 1.00 0.00 C ATOM 1575 C MET B 7 -0.520 -6.235 7.905 1.00 0.00 C ATOM 1576 O MET B 7 -1.467 -6.415 7.158 1.00 0.00 O ATOM 1577 CB MET B 7 1.900 -5.900 7.231 1.00 0.00 C ATOM 1578 CG MET B 7 2.600 -5.162 6.082 1.00 0.00 C ATOM 1579 SD MET B 7 1.851 -5.662 4.509 1.00 0.00 S ATOM 1580 CE MET B 7 1.874 -4.042 3.699 1.00 0.00 C ATOM 0 H MET B 7 1.680 -4.413 9.246 1.00 0.00 H new ATOM 0 HA MET B 7 0.265 -4.587 6.741 1.00 0.00 H new ATOM 0 HB2 MET B 7 2.552 -5.928 8.104 1.00 0.00 H new ATOM 0 HB3 MET B 7 1.707 -6.934 6.944 1.00 0.00 H new ATOM 0 HG2 MET B 7 2.508 -4.084 6.216 1.00 0.00 H new ATOM 0 HG3 MET B 7 3.665 -5.393 6.081 1.00 0.00 H new ATOM 0 HE1 MET B 7 1.448 -4.129 2.699 1.00 0.00 H new ATOM 0 HE2 MET B 7 1.286 -3.335 4.284 1.00 0.00 H new ATOM 0 HE3 MET B 7 2.902 -3.686 3.626 1.00 0.00 H new ATOM 1590 N VAL B 8 -0.397 -6.911 9.015 1.00 0.00 N ATOM 1591 CA VAL B 8 -1.419 -7.926 9.384 1.00 0.00 C ATOM 1592 C VAL B 8 -2.739 -7.219 9.701 1.00 0.00 C ATOM 1593 O VAL B 8 -3.806 -7.706 9.381 1.00 0.00 O ATOM 1594 CB VAL B 8 -0.939 -8.709 10.608 1.00 0.00 C ATOM 1595 CG1 VAL B 8 -1.756 -9.995 10.748 1.00 0.00 C ATOM 1596 CG2 VAL B 8 0.539 -9.064 10.434 1.00 0.00 C ATOM 0 H VAL B 8 0.368 -6.803 9.681 1.00 0.00 H new ATOM 0 HA VAL B 8 -1.570 -8.617 8.555 1.00 0.00 H new ATOM 0 HB VAL B 8 -1.068 -8.099 11.502 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -1.413 -10.551 11.620 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -2.810 -9.745 10.869 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -1.628 -10.606 9.855 1.00 0.00 H new ATOM 0 HG21 VAL B 8 0.884 -9.622 11.304 1.00 0.00 H new ATOM 0 HG22 VAL B 8 0.664 -9.674 9.539 1.00 0.00 H new ATOM 0 HG23 VAL B 8 1.124 -8.149 10.334 1.00 0.00 H new ATOM 1606 N ALA B 9 -2.678 -6.067 10.315 1.00 0.00 N ATOM 1607 CA ALA B 9 -3.933 -5.330 10.633 1.00 0.00 C ATOM 1608 C ALA B 9 -4.687 -5.066 9.330 1.00 0.00 C ATOM 1609 O ALA B 9 -5.872 -5.304 9.230 1.00 0.00 O ATOM 1610 CB ALA B 9 -3.588 -3.998 11.302 1.00 0.00 C ATOM 0 H ALA B 9 -1.816 -5.607 10.609 1.00 0.00 H new ATOM 0 HA ALA B 9 -4.551 -5.920 11.309 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -4.506 -3.459 11.535 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -3.034 -4.186 12.222 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -2.977 -3.399 10.627 1.00 0.00 H new ATOM 1616 N LEU B 10 -4.009 -4.567 8.333 1.00 0.00 N ATOM 1617 CA LEU B 10 -4.691 -4.279 7.035 1.00 0.00 C ATOM 1618 C LEU B 10 -5.579 -5.468 6.669 1.00 0.00 C ATOM 1619 O LEU B 10 -6.705 -5.310 6.242 1.00 0.00 O ATOM 1620 CB LEU B 10 -3.620 -4.091 5.939 1.00 0.00 C ATOM 1621 CG LEU B 10 -3.118 -2.634 5.918 1.00 0.00 C ATOM 1622 CD1 LEU B 10 -1.868 -2.552 5.032 1.00 0.00 C ATOM 1623 CD2 LEU B 10 -4.212 -1.688 5.366 1.00 0.00 C ATOM 0 H LEU B 10 -3.014 -4.346 8.359 1.00 0.00 H new ATOM 0 HA LEU B 10 -5.296 -3.376 7.121 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -2.784 -4.767 6.119 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -4.037 -4.352 4.966 1.00 0.00 H new ATOM 0 HG LEU B 10 -2.877 -2.324 6.935 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -1.504 -1.525 5.010 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -1.093 -3.203 5.436 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -2.118 -2.870 4.020 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -3.838 -0.664 5.359 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -4.472 -1.986 4.350 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -5.097 -1.747 5.999 1.00 0.00 H new ATOM 1635 N ILE B 11 -5.082 -6.660 6.857 1.00 0.00 N ATOM 1636 CA ILE B 11 -5.910 -7.851 6.542 1.00 0.00 C ATOM 1637 C ILE B 11 -7.102 -7.872 7.504 1.00 0.00 C ATOM 1638 O ILE B 11 -8.215 -8.180 7.129 1.00 0.00 O ATOM 1639 CB ILE B 11 -5.068 -9.116 6.714 1.00 0.00 C ATOM 1640 CG1 ILE B 11 -3.872 -9.056 5.758 1.00 0.00 C ATOM 1641 CG2 ILE B 11 -5.920 -10.345 6.389 1.00 0.00 C ATOM 1642 CD1 ILE B 11 -2.901 -10.195 6.076 1.00 0.00 C ATOM 0 H ILE B 11 -4.146 -6.857 7.212 1.00 0.00 H new ATOM 0 HA ILE B 11 -6.267 -7.809 5.513 1.00 0.00 H new ATOM 0 HB ILE B 11 -4.714 -9.185 7.743 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -4.214 -9.134 4.726 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -3.365 -8.096 5.854 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -5.320 -11.247 6.512 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -6.775 -10.384 7.064 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -6.273 -10.281 5.360 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -2.051 -10.150 5.395 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -2.548 -10.096 7.103 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -3.411 -11.151 5.958 1.00 0.00 H new ATOM 1654 N ASP B 12 -6.868 -7.527 8.746 1.00 0.00 N ATOM 1655 CA ASP B 12 -7.970 -7.502 9.750 1.00 0.00 C ATOM 1656 C ASP B 12 -9.146 -6.696 9.207 1.00 0.00 C ATOM 1657 O ASP B 12 -10.273 -7.148 9.188 1.00 0.00 O ATOM 1658 CB ASP B 12 -7.473 -6.819 11.035 1.00 0.00 C ATOM 1659 CG ASP B 12 -8.453 -7.108 12.176 1.00 0.00 C ATOM 1660 OD1 ASP B 12 -8.594 -8.267 12.529 1.00 0.00 O ATOM 1661 OD2 ASP B 12 -9.051 -6.166 12.671 1.00 0.00 O ATOM 0 H ASP B 12 -5.952 -7.260 9.108 1.00 0.00 H new ATOM 0 HA ASP B 12 -8.282 -8.526 9.957 1.00 0.00 H new ATOM 0 HB2 ASP B 12 -6.479 -7.184 11.293 1.00 0.00 H new ATOM 0 HB3 ASP B 12 -7.387 -5.744 10.879 1.00 0.00 H new ATOM 1666 N VAL B 13 -8.886 -5.483 8.790 1.00 0.00 N ATOM 1667 CA VAL B 13 -9.981 -4.617 8.273 1.00 0.00 C ATOM 1668 C VAL B 13 -10.401 -5.046 6.863 1.00 0.00 C ATOM 1669 O VAL B 13 -11.577 -5.153 6.577 1.00 0.00 O ATOM 1670 CB VAL B 13 -9.520 -3.156 8.264 1.00 0.00 C ATOM 1671 CG1 VAL B 13 -10.589 -2.283 7.604 1.00 0.00 C ATOM 1672 CG2 VAL B 13 -9.293 -2.683 9.702 1.00 0.00 C ATOM 0 H VAL B 13 -7.959 -5.057 8.786 1.00 0.00 H new ATOM 0 HA VAL B 13 -10.845 -4.721 8.929 1.00 0.00 H new ATOM 0 HB VAL B 13 -8.589 -3.075 7.702 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -10.258 -1.244 7.599 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -10.750 -2.617 6.579 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -11.521 -2.364 8.163 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -8.965 -1.644 9.696 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -10.223 -2.766 10.264 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -8.529 -3.302 10.172 1.00 0.00 H new ATOM 1682 N PHE B 14 -9.483 -5.277 5.970 1.00 0.00 N ATOM 1683 CA PHE B 14 -9.908 -5.672 4.597 1.00 0.00 C ATOM 1684 C PHE B 14 -10.855 -6.873 4.684 1.00 0.00 C ATOM 1685 O PHE B 14 -11.777 -7.015 3.903 1.00 0.00 O ATOM 1686 CB PHE B 14 -8.688 -6.040 3.751 1.00 0.00 C ATOM 1687 CG PHE B 14 -9.136 -6.323 2.337 1.00 0.00 C ATOM 1688 CD1 PHE B 14 -9.634 -7.587 2.004 1.00 0.00 C ATOM 1689 CD2 PHE B 14 -9.059 -5.321 1.362 1.00 0.00 C ATOM 1690 CE1 PHE B 14 -10.055 -7.851 0.695 1.00 0.00 C ATOM 1691 CE2 PHE B 14 -9.480 -5.585 0.053 1.00 0.00 C ATOM 1692 CZ PHE B 14 -9.978 -6.850 -0.280 1.00 0.00 C ATOM 0 H PHE B 14 -8.477 -5.212 6.123 1.00 0.00 H new ATOM 0 HA PHE B 14 -10.421 -4.833 4.128 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -7.964 -5.225 3.760 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -8.189 -6.914 4.170 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -9.694 -8.359 2.757 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -8.675 -4.345 1.620 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -10.439 -8.827 0.438 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -9.420 -4.813 -0.700 1.00 0.00 H new ATOM 0 HZ PHE B 14 -10.303 -7.054 -1.290 1.00 0.00 H new ATOM 1702 N HIS B 15 -10.626 -7.746 5.631 1.00 0.00 N ATOM 1703 CA HIS B 15 -11.497 -8.947 5.773 1.00 0.00 C ATOM 1704 C HIS B 15 -12.773 -8.591 6.540 1.00 0.00 C ATOM 1705 O HIS B 15 -13.811 -9.194 6.350 1.00 0.00 O ATOM 1706 CB HIS B 15 -10.740 -10.042 6.528 1.00 0.00 C ATOM 1707 CG HIS B 15 -11.553 -11.307 6.518 1.00 0.00 C ATOM 1708 ND1 HIS B 15 -11.761 -12.043 5.362 1.00 0.00 N ATOM 1709 CD2 HIS B 15 -12.222 -11.976 7.513 1.00 0.00 C ATOM 1710 CE1 HIS B 15 -12.527 -13.101 5.686 1.00 0.00 C ATOM 1711 NE2 HIS B 15 -12.836 -13.109 6.985 1.00 0.00 N ATOM 0 H HIS B 15 -9.871 -7.677 6.313 1.00 0.00 H new ATOM 0 HA HIS B 15 -11.768 -9.304 4.779 1.00 0.00 H new ATOM 0 HB2 HIS B 15 -9.770 -10.216 6.063 1.00 0.00 H new ATOM 0 HB3 HIS B 15 -10.549 -9.727 7.554 1.00 0.00 H new ATOM 0 HD2 HIS B 15 -12.265 -11.670 8.548 1.00 0.00 H new ATOM 0 HE1 HIS B 15 -12.852 -13.852 4.981 1.00 0.00 H new ATOM 0 HE2 HIS B 15 -13.400 -13.797 7.483 1.00 0.00 H new ATOM 1719 N GLN B 16 -12.699 -7.629 7.421 1.00 0.00 N ATOM 1720 CA GLN B 16 -13.904 -7.253 8.214 1.00 0.00 C ATOM 1721 C GLN B 16 -15.067 -6.969 7.262 1.00 0.00 C ATOM 1722 O GLN B 16 -16.176 -7.413 7.480 1.00 0.00 O ATOM 1723 CB GLN B 16 -13.593 -6.016 9.065 1.00 0.00 C ATOM 1724 CG GLN B 16 -14.876 -5.485 9.714 1.00 0.00 C ATOM 1725 CD GLN B 16 -14.522 -4.400 10.734 1.00 0.00 C ATOM 1726 OE1 GLN B 16 -13.377 -4.013 10.855 1.00 0.00 O ATOM 1727 NE2 GLN B 16 -15.465 -3.887 11.476 1.00 0.00 N ATOM 0 H GLN B 16 -11.858 -7.089 7.625 1.00 0.00 H new ATOM 0 HA GLN B 16 -14.182 -8.072 8.877 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -12.865 -6.269 9.835 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -13.143 -5.242 8.444 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -15.541 -5.079 8.951 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -15.412 -6.298 10.204 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -16.427 -4.211 11.375 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -15.240 -3.162 12.157 1.00 0.00 H new ATOM 1736 N TYR B 17 -14.830 -6.240 6.206 1.00 0.00 N ATOM 1737 CA TYR B 17 -15.932 -5.943 5.250 1.00 0.00 C ATOM 1738 C TYR B 17 -16.235 -7.199 4.433 1.00 0.00 C ATOM 1739 O TYR B 17 -17.378 -7.529 4.184 1.00 0.00 O ATOM 1740 CB TYR B 17 -15.504 -4.812 4.307 1.00 0.00 C ATOM 1741 CG TYR B 17 -15.601 -3.485 5.028 1.00 0.00 C ATOM 1742 CD1 TYR B 17 -14.702 -3.185 6.058 1.00 0.00 C ATOM 1743 CD2 TYR B 17 -16.589 -2.559 4.670 1.00 0.00 C ATOM 1744 CE1 TYR B 17 -14.790 -1.960 6.729 1.00 0.00 C ATOM 1745 CE2 TYR B 17 -16.677 -1.334 5.340 1.00 0.00 C ATOM 1746 CZ TYR B 17 -15.777 -1.034 6.370 1.00 0.00 C ATOM 1747 OH TYR B 17 -15.862 0.174 7.032 1.00 0.00 O ATOM 0 H TYR B 17 -13.924 -5.839 5.965 1.00 0.00 H new ATOM 0 HA TYR B 17 -16.822 -5.636 5.800 1.00 0.00 H new ATOM 0 HB2 TYR B 17 -14.482 -4.977 3.965 1.00 0.00 H new ATOM 0 HB3 TYR B 17 -16.139 -4.803 3.421 1.00 0.00 H new ATOM 0 HD1 TYR B 17 -13.940 -3.899 6.335 1.00 0.00 H new ATOM 0 HD2 TYR B 17 -17.283 -2.791 3.876 1.00 0.00 H new ATOM 0 HE1 TYR B 17 -14.096 -1.729 7.524 1.00 0.00 H new ATOM 0 HE2 TYR B 17 -17.439 -0.620 5.063 1.00 0.00 H new ATOM 0 HH TYR B 17 -16.600 0.700 6.659 1.00 0.00 H new ATOM 1757 N SER B 18 -15.218 -7.901 4.006 1.00 0.00 N ATOM 1758 CA SER B 18 -15.441 -9.135 3.195 1.00 0.00 C ATOM 1759 C SER B 18 -15.378 -10.375 4.092 1.00 0.00 C ATOM 1760 O SER B 18 -14.559 -11.248 3.886 1.00 0.00 O ATOM 1761 CB SER B 18 -14.353 -9.231 2.125 1.00 0.00 C ATOM 1762 OG SER B 18 -13.080 -9.283 2.755 1.00 0.00 O ATOM 0 H SER B 18 -14.240 -7.672 4.184 1.00 0.00 H new ATOM 0 HA SER B 18 -16.424 -9.085 2.727 1.00 0.00 H new ATOM 0 HB2 SER B 18 -14.506 -10.120 1.513 1.00 0.00 H new ATOM 0 HB3 SER B 18 -14.406 -8.371 1.457 1.00 0.00 H new ATOM 0 HG SER B 18 -12.806 -8.378 3.014 1.00 0.00 H new ATOM 1768 N GLY B 19 -16.250 -10.477 5.071 1.00 0.00 N ATOM 1769 CA GLY B 19 -16.265 -11.677 5.973 1.00 0.00 C ATOM 1770 C GLY B 19 -17.629 -12.353 5.829 1.00 0.00 C ATOM 1771 O GLY B 19 -17.845 -13.454 6.295 1.00 0.00 O ATOM 0 H GLY B 19 -16.958 -9.774 5.285 1.00 0.00 H new ATOM 0 HA2 GLY B 19 -15.466 -12.368 5.703 1.00 0.00 H new ATOM 0 HA3 GLY B 19 -16.093 -11.379 7.007 1.00 0.00 H new ATOM 1775 N ARG B 20 -18.540 -11.710 5.155 1.00 0.00 N ATOM 1776 CA ARG B 20 -19.886 -12.308 4.934 1.00 0.00 C ATOM 1777 C ARG B 20 -19.752 -13.541 4.038 1.00 0.00 C ATOM 1778 O ARG B 20 -20.492 -14.493 4.190 1.00 0.00 O ATOM 1779 CB ARG B 20 -20.800 -11.279 4.266 1.00 0.00 C ATOM 1780 CG ARG B 20 -20.655 -9.927 4.972 1.00 0.00 C ATOM 1781 CD ARG B 20 -20.940 -10.092 6.467 1.00 0.00 C ATOM 1782 NE ARG B 20 -21.139 -8.749 7.082 1.00 0.00 N ATOM 1783 CZ ARG B 20 -21.712 -8.641 8.250 1.00 0.00 C ATOM 1784 NH1 ARG B 20 -22.976 -8.936 8.386 1.00 0.00 N ATOM 1785 NH2 ARG B 20 -21.022 -8.236 9.282 1.00 0.00 N ATOM 0 H ARG B 20 -18.408 -10.786 4.743 1.00 0.00 H new ATOM 0 HA ARG B 20 -20.317 -12.602 5.891 1.00 0.00 H new ATOM 0 HB2 ARG B 20 -20.543 -11.179 3.212 1.00 0.00 H new ATOM 0 HB3 ARG B 20 -21.836 -11.615 4.311 1.00 0.00 H new ATOM 0 HG2 ARG B 20 -19.649 -9.535 4.825 1.00 0.00 H new ATOM 0 HG3 ARG B 20 -21.345 -9.203 4.538 1.00 0.00 H new ATOM 0 HD2 ARG B 20 -21.828 -10.707 6.614 1.00 0.00 H new ATOM 0 HD3 ARG B 20 -20.111 -10.608 6.952 1.00 0.00 H new ATOM 0 HE ARG B 20 -20.827 -7.912 6.589 1.00 0.00 H new ATOM 0 HH11 ARG B 20 -23.516 -9.251 7.580 1.00 0.00 H new ATOM 0 HH12 ARG B 20 -23.424 -8.852 9.298 1.00 0.00 H new ATOM 0 HH21 ARG B 20 -20.034 -8.004 9.176 1.00 0.00 H new ATOM 0 HH22 ARG B 20 -21.471 -8.152 10.194 1.00 0.00 H new ATOM 1799 N GLU B 21 -18.817 -13.563 3.122 1.00 0.00 N ATOM 1800 CA GLU B 21 -18.664 -14.780 2.261 1.00 0.00 C ATOM 1801 C GLU B 21 -17.195 -14.973 1.890 1.00 0.00 C ATOM 1802 O GLU B 21 -16.678 -16.072 1.929 1.00 0.00 O ATOM 1803 CB GLU B 21 -19.488 -14.623 0.976 1.00 0.00 C ATOM 1804 CG GLU B 21 -20.993 -14.670 1.290 1.00 0.00 C ATOM 1805 CD GLU B 21 -21.473 -13.296 1.764 1.00 0.00 C ATOM 1806 OE1 GLU B 21 -21.019 -12.308 1.213 1.00 0.00 O ATOM 1807 OE2 GLU B 21 -22.288 -13.256 2.672 1.00 0.00 O ATOM 0 H GLU B 21 -18.161 -12.805 2.933 1.00 0.00 H new ATOM 0 HA GLU B 21 -19.019 -15.647 2.818 1.00 0.00 H new ATOM 0 HB2 GLU B 21 -19.241 -13.678 0.492 1.00 0.00 H new ATOM 0 HB3 GLU B 21 -19.232 -15.417 0.274 1.00 0.00 H new ATOM 0 HG2 GLU B 21 -21.549 -14.972 0.402 1.00 0.00 H new ATOM 0 HG3 GLU B 21 -21.189 -15.418 2.058 1.00 0.00 H new ATOM 1814 N GLY B 22 -16.512 -13.922 1.526 1.00 0.00 N ATOM 1815 CA GLY B 22 -15.076 -14.066 1.150 1.00 0.00 C ATOM 1816 C GLY B 22 -14.928 -15.224 0.162 1.00 0.00 C ATOM 1817 O GLY B 22 -13.836 -15.681 -0.110 1.00 0.00 O ATOM 0 H GLY B 22 -16.884 -12.974 1.473 1.00 0.00 H new ATOM 0 HA2 GLY B 22 -14.711 -13.142 0.703 1.00 0.00 H new ATOM 0 HA3 GLY B 22 -14.472 -14.251 2.038 1.00 0.00 H new ATOM 1821 N ASP B 23 -16.016 -15.702 -0.384 1.00 0.00 N ATOM 1822 CA ASP B 23 -15.920 -16.827 -1.359 1.00 0.00 C ATOM 1823 C ASP B 23 -14.848 -16.479 -2.394 1.00 0.00 C ATOM 1824 O ASP B 23 -13.843 -17.152 -2.511 1.00 0.00 O ATOM 1825 CB ASP B 23 -17.268 -17.017 -2.059 1.00 0.00 C ATOM 1826 CG ASP B 23 -17.261 -18.337 -2.834 1.00 0.00 C ATOM 1827 OD1 ASP B 23 -16.305 -19.082 -2.688 1.00 0.00 O ATOM 1828 OD2 ASP B 23 -18.212 -18.582 -3.558 1.00 0.00 O ATOM 0 H ASP B 23 -16.960 -15.364 -0.198 1.00 0.00 H new ATOM 0 HA ASP B 23 -15.657 -17.750 -0.842 1.00 0.00 H new ATOM 0 HB2 ASP B 23 -18.074 -17.019 -1.325 1.00 0.00 H new ATOM 0 HB3 ASP B 23 -17.457 -16.186 -2.738 1.00 0.00 H new ATOM 1833 N LYS B 24 -15.042 -15.416 -3.128 1.00 0.00 N ATOM 1834 CA LYS B 24 -14.019 -15.005 -4.133 1.00 0.00 C ATOM 1835 C LYS B 24 -13.018 -14.074 -3.444 1.00 0.00 C ATOM 1836 O LYS B 24 -13.254 -13.595 -2.353 1.00 0.00 O ATOM 1837 CB LYS B 24 -14.699 -14.260 -5.286 1.00 0.00 C ATOM 1838 CG LYS B 24 -15.633 -15.210 -6.038 1.00 0.00 C ATOM 1839 CD LYS B 24 -16.484 -14.410 -7.029 1.00 0.00 C ATOM 1840 CE LYS B 24 -17.550 -15.321 -7.641 1.00 0.00 C ATOM 1841 NZ LYS B 24 -18.353 -14.550 -8.632 1.00 0.00 N ATOM 0 H LYS B 24 -15.864 -14.815 -3.075 1.00 0.00 H new ATOM 0 HA LYS B 24 -13.509 -15.883 -4.531 1.00 0.00 H new ATOM 0 HB2 LYS B 24 -15.263 -13.411 -4.900 1.00 0.00 H new ATOM 0 HB3 LYS B 24 -13.947 -13.860 -5.966 1.00 0.00 H new ATOM 0 HG2 LYS B 24 -15.052 -15.965 -6.568 1.00 0.00 H new ATOM 0 HG3 LYS B 24 -16.276 -15.738 -5.334 1.00 0.00 H new ATOM 0 HD2 LYS B 24 -16.957 -13.569 -6.522 1.00 0.00 H new ATOM 0 HD3 LYS B 24 -15.852 -13.994 -7.814 1.00 0.00 H new ATOM 0 HE2 LYS B 24 -17.078 -16.176 -8.125 1.00 0.00 H new ATOM 0 HE3 LYS B 24 -18.199 -15.716 -6.859 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 -19.078 -15.169 -9.048 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 -18.814 -13.748 -8.157 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 -17.728 -14.194 -9.384 1.00 0.00 H new ATOM 1855 N HIS B 25 -11.916 -13.791 -4.092 1.00 0.00 N ATOM 1856 CA HIS B 25 -10.895 -12.859 -3.517 1.00 0.00 C ATOM 1857 C HIS B 25 -10.812 -11.650 -4.444 1.00 0.00 C ATOM 1858 O HIS B 25 -9.745 -11.220 -4.836 1.00 0.00 O ATOM 1859 CB HIS B 25 -9.535 -13.558 -3.454 1.00 0.00 C ATOM 1860 CG HIS B 25 -9.123 -13.989 -4.834 1.00 0.00 C ATOM 1861 ND1 HIS B 25 -9.510 -15.204 -5.374 1.00 0.00 N ATOM 1862 CD2 HIS B 25 -8.355 -13.378 -5.793 1.00 0.00 C ATOM 1863 CE1 HIS B 25 -8.978 -15.287 -6.606 1.00 0.00 C ATOM 1864 NE2 HIS B 25 -8.265 -14.201 -6.912 1.00 0.00 N ATOM 0 H HIS B 25 -11.676 -14.171 -5.008 1.00 0.00 H new ATOM 0 HA HIS B 25 -11.172 -12.554 -2.508 1.00 0.00 H new ATOM 0 HB2 HIS B 25 -8.788 -12.884 -3.035 1.00 0.00 H new ATOM 0 HB3 HIS B 25 -9.590 -14.423 -2.793 1.00 0.00 H new ATOM 0 HD2 HIS B 25 -7.891 -12.407 -5.695 1.00 0.00 H new ATOM 0 HE1 HIS B 25 -9.111 -16.130 -7.268 1.00 0.00 H new ATOM 0 HE2 HIS B 25 -7.762 -14.014 -7.780 1.00 0.00 H new ATOM 1872 N LYS B 26 -11.949 -11.102 -4.792 1.00 0.00 N ATOM 1873 CA LYS B 26 -11.988 -9.913 -5.694 1.00 0.00 C ATOM 1874 C LYS B 26 -12.886 -8.834 -5.082 1.00 0.00 C ATOM 1875 O LYS B 26 -13.841 -9.132 -4.392 1.00 0.00 O ATOM 1876 CB LYS B 26 -12.559 -10.326 -7.052 1.00 0.00 C ATOM 1877 CG LYS B 26 -11.655 -11.383 -7.689 1.00 0.00 C ATOM 1878 CD LYS B 26 -12.367 -12.002 -8.894 1.00 0.00 C ATOM 1879 CE LYS B 26 -11.400 -12.921 -9.641 1.00 0.00 C ATOM 1880 NZ LYS B 26 -12.078 -13.482 -10.845 1.00 0.00 N ATOM 0 H LYS B 26 -12.863 -11.433 -4.485 1.00 0.00 H new ATOM 0 HA LYS B 26 -10.978 -9.522 -5.820 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -13.567 -10.722 -6.929 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -12.635 -9.457 -7.705 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -10.713 -10.931 -8.002 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -11.411 -12.156 -6.960 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -13.240 -12.566 -8.564 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -12.727 -11.217 -9.559 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -10.510 -12.366 -9.937 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -11.070 -13.728 -8.987 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -11.530 -14.288 -11.208 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -13.034 -13.801 -10.588 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -12.144 -12.749 -11.580 1.00 0.00 H new ATOM 1894 N LEU B 27 -12.586 -7.585 -5.335 1.00 0.00 N ATOM 1895 CA LEU B 27 -13.414 -6.463 -4.783 1.00 0.00 C ATOM 1896 C LEU B 27 -13.873 -5.592 -5.953 1.00 0.00 C ATOM 1897 O LEU B 27 -13.147 -5.400 -6.906 1.00 0.00 O ATOM 1898 CB LEU B 27 -12.555 -5.634 -3.820 1.00 0.00 C ATOM 1899 CG LEU B 27 -13.429 -4.611 -3.069 1.00 0.00 C ATOM 1900 CD1 LEU B 27 -14.178 -5.288 -1.910 1.00 0.00 C ATOM 1901 CD2 LEU B 27 -12.541 -3.497 -2.500 1.00 0.00 C ATOM 0 H LEU B 27 -11.795 -7.289 -5.906 1.00 0.00 H new ATOM 0 HA LEU B 27 -14.279 -6.849 -4.244 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -12.059 -6.292 -3.106 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -11.772 -5.116 -4.374 1.00 0.00 H new ATOM 0 HG LEU B 27 -14.153 -4.195 -3.770 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -14.790 -4.550 -1.392 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -14.818 -6.078 -2.303 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -13.458 -5.717 -1.213 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -13.160 -2.774 -1.969 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -11.814 -3.927 -1.811 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -12.017 -2.997 -3.315 1.00 0.00 H new ATOM 1913 N LYS B 28 -15.078 -5.077 -5.910 1.00 0.00 N ATOM 1914 CA LYS B 28 -15.569 -4.232 -7.045 1.00 0.00 C ATOM 1915 C LYS B 28 -15.297 -2.753 -6.749 1.00 0.00 C ATOM 1916 O LYS B 28 -15.221 -2.344 -5.607 1.00 0.00 O ATOM 1917 CB LYS B 28 -17.075 -4.450 -7.233 1.00 0.00 C ATOM 1918 CG LYS B 28 -17.358 -5.933 -7.526 1.00 0.00 C ATOM 1919 CD LYS B 28 -18.694 -6.079 -8.267 1.00 0.00 C ATOM 1920 CE LYS B 28 -19.825 -5.473 -7.432 1.00 0.00 C ATOM 1921 NZ LYS B 28 -19.827 -6.079 -6.070 1.00 0.00 N ATOM 0 H LYS B 28 -15.739 -5.204 -5.144 1.00 0.00 H new ATOM 0 HA LYS B 28 -15.044 -4.517 -7.957 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -17.611 -4.139 -6.336 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -17.441 -3.832 -8.053 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -16.552 -6.353 -8.128 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -17.387 -6.497 -6.594 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -18.639 -5.581 -9.235 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -18.898 -7.132 -8.461 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -19.697 -4.393 -7.359 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -20.784 -5.649 -7.920 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -20.741 -5.894 -5.609 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -19.679 -7.106 -6.147 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -19.062 -5.661 -5.503 1.00 0.00 H new ATOM 1935 N LYS B 29 -15.155 -1.948 -7.768 1.00 0.00 N ATOM 1936 CA LYS B 29 -14.894 -0.496 -7.547 1.00 0.00 C ATOM 1937 C LYS B 29 -16.015 0.121 -6.699 1.00 0.00 C ATOM 1938 O LYS B 29 -15.778 0.962 -5.855 1.00 0.00 O ATOM 1939 CB LYS B 29 -14.802 0.226 -8.910 1.00 0.00 C ATOM 1940 CG LYS B 29 -16.149 0.228 -9.661 1.00 0.00 C ATOM 1941 CD LYS B 29 -16.563 -1.205 -10.035 1.00 0.00 C ATOM 1942 CE LYS B 29 -17.555 -1.173 -11.202 1.00 0.00 C ATOM 1943 NZ LYS B 29 -18.147 -2.528 -11.386 1.00 0.00 N ATOM 0 H LYS B 29 -15.209 -2.234 -8.746 1.00 0.00 H new ATOM 0 HA LYS B 29 -13.950 -0.380 -7.014 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -14.474 1.254 -8.753 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -14.045 -0.260 -9.526 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -16.918 0.683 -9.037 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -16.068 0.836 -10.562 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -15.683 -1.787 -10.310 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -17.016 -1.698 -9.175 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -18.341 -0.444 -11.005 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -17.049 -0.858 -12.115 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -18.821 -2.508 -12.178 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -17.391 -3.212 -11.592 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -18.643 -2.811 -10.517 1.00 0.00 H new ATOM 1957 N SER B 30 -17.232 -0.274 -6.937 1.00 0.00 N ATOM 1958 CA SER B 30 -18.377 0.296 -6.175 1.00 0.00 C ATOM 1959 C SER B 30 -18.227 0.024 -4.676 1.00 0.00 C ATOM 1960 O SER B 30 -18.523 0.866 -3.841 1.00 0.00 O ATOM 1961 CB SER B 30 -19.669 -0.353 -6.670 1.00 0.00 C ATOM 1962 OG SER B 30 -19.867 -0.020 -8.037 1.00 0.00 O ATOM 0 H SER B 30 -17.486 -0.974 -7.634 1.00 0.00 H new ATOM 0 HA SER B 30 -18.401 1.374 -6.332 1.00 0.00 H new ATOM 0 HB2 SER B 30 -19.615 -1.435 -6.551 1.00 0.00 H new ATOM 0 HB3 SER B 30 -20.514 -0.009 -6.074 1.00 0.00 H new ATOM 0 HG SER B 30 -20.694 -0.436 -8.359 1.00 0.00 H new ATOM 1968 N GLU B 31 -17.780 -1.152 -4.322 1.00 0.00 N ATOM 1969 CA GLU B 31 -17.642 -1.473 -2.876 1.00 0.00 C ATOM 1970 C GLU B 31 -16.437 -0.728 -2.308 1.00 0.00 C ATOM 1971 O GLU B 31 -16.424 -0.305 -1.169 1.00 0.00 O ATOM 1972 CB GLU B 31 -17.446 -2.980 -2.694 1.00 0.00 C ATOM 1973 CG GLU B 31 -18.691 -3.722 -3.184 1.00 0.00 C ATOM 1974 CD GLU B 31 -19.864 -3.425 -2.249 1.00 0.00 C ATOM 1975 OE1 GLU B 31 -19.678 -3.525 -1.047 1.00 0.00 O ATOM 1976 OE2 GLU B 31 -20.929 -3.103 -2.750 1.00 0.00 O ATOM 0 H GLU B 31 -17.508 -1.895 -4.965 1.00 0.00 H new ATOM 0 HA GLU B 31 -18.545 -1.166 -2.349 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -16.570 -3.313 -3.250 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -17.263 -3.209 -1.644 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -18.935 -3.413 -4.200 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -18.499 -4.795 -3.215 1.00 0.00 H new ATOM 1983 N LEU B 32 -15.423 -0.566 -3.115 1.00 0.00 N ATOM 1984 CA LEU B 32 -14.204 0.152 -2.661 1.00 0.00 C ATOM 1985 C LEU B 32 -14.555 1.614 -2.396 1.00 0.00 C ATOM 1986 O LEU B 32 -14.115 2.195 -1.426 1.00 0.00 O ATOM 1987 CB LEU B 32 -13.128 0.061 -3.750 1.00 0.00 C ATOM 1988 CG LEU B 32 -11.934 0.962 -3.406 1.00 0.00 C ATOM 1989 CD1 LEU B 32 -11.422 0.644 -1.995 1.00 0.00 C ATOM 1990 CD2 LEU B 32 -10.815 0.712 -4.422 1.00 0.00 C ATOM 0 H LEU B 32 -15.390 -0.904 -4.077 1.00 0.00 H new ATOM 0 HA LEU B 32 -13.824 -0.300 -1.744 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -12.794 -0.971 -3.853 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -13.549 0.357 -4.711 1.00 0.00 H new ATOM 0 HG LEU B 32 -12.246 2.006 -3.441 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -10.575 1.289 -1.761 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -12.219 0.815 -1.272 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -11.108 -0.399 -1.948 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -9.961 1.348 -4.187 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -10.512 -0.334 -4.379 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -11.175 0.944 -5.424 1.00 0.00 H new ATOM 2002 N LYS B 33 -15.317 2.239 -3.254 1.00 0.00 N ATOM 2003 CA LYS B 33 -15.633 3.673 -3.021 1.00 0.00 C ATOM 2004 C LYS B 33 -16.145 3.837 -1.595 1.00 0.00 C ATOM 2005 O LYS B 33 -15.610 4.591 -0.807 1.00 0.00 O ATOM 2006 CB LYS B 33 -16.708 4.130 -4.010 1.00 0.00 C ATOM 2007 CG LYS B 33 -16.876 5.648 -3.921 1.00 0.00 C ATOM 2008 CD LYS B 33 -17.929 6.103 -4.934 1.00 0.00 C ATOM 2009 CE LYS B 33 -18.074 7.624 -4.876 1.00 0.00 C ATOM 2010 NZ LYS B 33 -19.274 8.039 -5.656 1.00 0.00 N ATOM 0 H LYS B 33 -15.727 1.825 -4.091 1.00 0.00 H new ATOM 0 HA LYS B 33 -14.738 4.278 -3.165 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -16.429 3.844 -5.024 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -17.654 3.636 -3.788 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -17.178 5.933 -2.913 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -15.925 6.143 -4.121 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -17.640 5.793 -5.938 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -18.886 5.628 -4.717 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -18.169 7.952 -3.841 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -17.181 8.101 -5.281 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -19.373 9.074 -5.617 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -19.165 7.739 -6.646 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -20.122 7.595 -5.251 1.00 0.00 H new ATOM 2024 N GLU B 34 -17.193 3.135 -1.270 1.00 0.00 N ATOM 2025 CA GLU B 34 -17.761 3.251 0.105 1.00 0.00 C ATOM 2026 C GLU B 34 -16.638 3.082 1.137 1.00 0.00 C ATOM 2027 O GLU B 34 -16.637 3.727 2.167 1.00 0.00 O ATOM 2028 CB GLU B 34 -18.832 2.176 0.316 1.00 0.00 C ATOM 2029 CG GLU B 34 -19.531 2.391 1.664 1.00 0.00 C ATOM 2030 CD GLU B 34 -18.644 1.868 2.797 1.00 0.00 C ATOM 2031 OE1 GLU B 34 -18.307 0.696 2.767 1.00 0.00 O ATOM 2032 OE2 GLU B 34 -18.318 2.649 3.676 1.00 0.00 O ATOM 0 H GLU B 34 -17.680 2.489 -1.891 1.00 0.00 H new ATOM 0 HA GLU B 34 -18.217 4.233 0.228 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -19.562 2.215 -0.492 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -18.376 1.186 0.287 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -19.738 3.451 1.812 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -20.491 1.874 1.673 1.00 0.00 H new ATOM 2039 N LEU B 35 -15.679 2.233 0.880 1.00 0.00 N ATOM 2040 CA LEU B 35 -14.569 2.053 1.865 1.00 0.00 C ATOM 2041 C LEU B 35 -13.724 3.335 1.923 1.00 0.00 C ATOM 2042 O LEU B 35 -13.420 3.827 2.992 1.00 0.00 O ATOM 2043 CB LEU B 35 -13.697 0.848 1.458 1.00 0.00 C ATOM 2044 CG LEU B 35 -14.274 -0.455 2.053 1.00 0.00 C ATOM 2045 CD1 LEU B 35 -13.832 -1.653 1.207 1.00 0.00 C ATOM 2046 CD2 LEU B 35 -13.766 -0.647 3.489 1.00 0.00 C ATOM 0 H LEU B 35 -15.614 1.660 0.039 1.00 0.00 H new ATOM 0 HA LEU B 35 -14.985 1.859 2.854 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -13.654 0.772 0.372 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -12.675 0.995 1.808 1.00 0.00 H new ATOM 0 HG LEU B 35 -15.362 -0.386 2.055 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -14.242 -2.569 1.632 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -14.195 -1.532 0.187 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -12.744 -1.712 1.200 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -14.178 -1.568 3.901 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -12.678 -0.706 3.485 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -14.081 0.197 4.102 1.00 0.00 H new ATOM 2058 N ILE B 36 -13.357 3.896 0.803 1.00 0.00 N ATOM 2059 CA ILE B 36 -12.556 5.156 0.828 1.00 0.00 C ATOM 2060 C ILE B 36 -13.274 6.203 1.682 1.00 0.00 C ATOM 2061 O ILE B 36 -12.654 6.998 2.360 1.00 0.00 O ATOM 2062 CB ILE B 36 -12.423 5.686 -0.603 1.00 0.00 C ATOM 2063 CG1 ILE B 36 -11.747 4.617 -1.469 1.00 0.00 C ATOM 2064 CG2 ILE B 36 -11.566 6.958 -0.599 1.00 0.00 C ATOM 2065 CD1 ILE B 36 -11.691 5.083 -2.925 1.00 0.00 C ATOM 0 H ILE B 36 -13.576 3.538 -0.127 1.00 0.00 H new ATOM 0 HA ILE B 36 -11.571 4.956 1.249 1.00 0.00 H new ATOM 0 HB ILE B 36 -13.409 5.917 -1.005 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -10.739 4.423 -1.101 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -12.298 3.679 -1.400 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -11.471 7.336 -1.617 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -12.041 7.715 0.026 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -10.577 6.729 -0.203 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -11.209 4.318 -3.534 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -12.703 5.254 -3.291 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -11.121 6.010 -2.989 1.00 0.00 H new ATOM 2077 N ASN B 37 -14.576 6.228 1.626 1.00 0.00 N ATOM 2078 CA ASN B 37 -15.345 7.243 2.401 1.00 0.00 C ATOM 2079 C ASN B 37 -15.145 7.061 3.910 1.00 0.00 C ATOM 2080 O ASN B 37 -15.009 8.022 4.641 1.00 0.00 O ATOM 2081 CB ASN B 37 -16.832 7.096 2.071 1.00 0.00 C ATOM 2082 CG ASN B 37 -17.617 8.239 2.716 1.00 0.00 C ATOM 2083 OD1 ASN B 37 -17.308 8.664 3.810 1.00 0.00 O ATOM 2084 ND2 ASN B 37 -18.630 8.757 2.077 1.00 0.00 N ATOM 0 H ASN B 37 -15.144 5.586 1.074 1.00 0.00 H new ATOM 0 HA ASN B 37 -14.985 8.234 2.126 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -16.978 7.106 0.991 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -17.202 6.137 2.434 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -19.162 9.519 2.497 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -18.890 8.400 1.158 1.00 0.00 H new ATOM 2091 N ASN B 38 -15.155 5.844 4.390 1.00 0.00 N ATOM 2092 CA ASN B 38 -15.000 5.611 5.863 1.00 0.00 C ATOM 2093 C ASN B 38 -13.556 5.243 6.219 1.00 0.00 C ATOM 2094 O ASN B 38 -13.161 5.327 7.365 1.00 0.00 O ATOM 2095 CB ASN B 38 -15.918 4.462 6.282 1.00 0.00 C ATOM 2096 CG ASN B 38 -15.869 4.301 7.802 1.00 0.00 C ATOM 2097 OD1 ASN B 38 -14.839 3.972 8.357 1.00 0.00 O ATOM 2098 ND2 ASN B 38 -16.945 4.524 8.505 1.00 0.00 N ATOM 0 H ASN B 38 -15.264 5.000 3.828 1.00 0.00 H new ATOM 0 HA ASN B 38 -15.263 6.530 6.386 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -16.940 4.662 5.959 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -15.606 3.537 5.797 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -16.921 4.422 9.520 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -17.810 4.800 8.040 1.00 0.00 H new ATOM 2105 N GLU B 39 -12.765 4.815 5.270 1.00 0.00 N ATOM 2106 CA GLU B 39 -11.357 4.423 5.597 1.00 0.00 C ATOM 2107 C GLU B 39 -10.404 5.603 5.391 1.00 0.00 C ATOM 2108 O GLU B 39 -9.396 5.710 6.061 1.00 0.00 O ATOM 2109 CB GLU B 39 -10.930 3.273 4.683 1.00 0.00 C ATOM 2110 CG GLU B 39 -11.798 2.046 4.963 1.00 0.00 C ATOM 2111 CD GLU B 39 -11.375 1.412 6.289 1.00 0.00 C ATOM 2112 OE1 GLU B 39 -10.440 1.914 6.891 1.00 0.00 O ATOM 2113 OE2 GLU B 39 -11.992 0.436 6.680 1.00 0.00 O ATOM 0 H GLU B 39 -13.028 4.719 4.289 1.00 0.00 H new ATOM 0 HA GLU B 39 -11.315 4.114 6.642 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -11.028 3.570 3.639 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -9.880 3.034 4.849 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -12.849 2.333 5.004 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -11.696 1.323 4.154 1.00 0.00 H new ATOM 2120 N LEU B 40 -10.716 6.493 4.480 1.00 0.00 N ATOM 2121 CA LEU B 40 -9.831 7.680 4.229 1.00 0.00 C ATOM 2122 C LEU B 40 -10.617 8.961 4.547 1.00 0.00 C ATOM 2123 O LEU B 40 -10.397 10.006 3.968 1.00 0.00 O ATOM 2124 CB LEU B 40 -9.385 7.673 2.746 1.00 0.00 C ATOM 2125 CG LEU B 40 -7.993 7.037 2.609 1.00 0.00 C ATOM 2126 CD1 LEU B 40 -8.025 5.594 3.126 1.00 0.00 C ATOM 2127 CD2 LEU B 40 -7.576 7.044 1.136 1.00 0.00 C ATOM 0 H LEU B 40 -11.550 6.450 3.895 1.00 0.00 H new ATOM 0 HA LEU B 40 -8.946 7.638 4.864 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -10.106 7.119 2.145 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -9.366 8.692 2.360 1.00 0.00 H new ATOM 0 HG LEU B 40 -7.276 7.610 3.196 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -7.035 5.150 3.026 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -8.320 5.590 4.175 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -8.743 5.015 2.545 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -6.589 6.593 1.035 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -8.297 6.473 0.551 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -7.545 8.071 0.771 1.00 0.00 H new ATOM 2139 N SER B 41 -11.534 8.878 5.473 1.00 0.00 N ATOM 2140 CA SER B 41 -12.342 10.073 5.844 1.00 0.00 C ATOM 2141 C SER B 41 -11.456 11.102 6.551 1.00 0.00 C ATOM 2142 O SER B 41 -11.706 12.290 6.490 1.00 0.00 O ATOM 2143 CB SER B 41 -13.472 9.646 6.787 1.00 0.00 C ATOM 2144 OG SER B 41 -13.013 9.708 8.131 1.00 0.00 O ATOM 0 H SER B 41 -11.759 8.028 5.991 1.00 0.00 H new ATOM 0 HA SER B 41 -12.760 10.519 4.941 1.00 0.00 H new ATOM 0 HB2 SER B 41 -14.336 10.297 6.656 1.00 0.00 H new ATOM 0 HB3 SER B 41 -13.797 8.633 6.548 1.00 0.00 H new ATOM 0 HG SER B 41 -13.735 9.437 8.736 1.00 0.00 H new ATOM 2150 N HIS B 42 -10.423 10.667 7.220 1.00 0.00 N ATOM 2151 CA HIS B 42 -9.537 11.640 7.921 1.00 0.00 C ATOM 2152 C HIS B 42 -8.671 12.378 6.898 1.00 0.00 C ATOM 2153 O HIS B 42 -8.598 13.590 6.893 1.00 0.00 O ATOM 2154 CB HIS B 42 -8.634 10.898 8.908 1.00 0.00 C ATOM 2155 CG HIS B 42 -7.878 11.899 9.737 1.00 0.00 C ATOM 2156 ND1 HIS B 42 -6.537 12.176 9.520 1.00 0.00 N ATOM 2157 CD2 HIS B 42 -8.262 12.701 10.783 1.00 0.00 C ATOM 2158 CE1 HIS B 42 -6.167 13.111 10.415 1.00 0.00 C ATOM 2159 NE2 HIS B 42 -7.180 13.466 11.209 1.00 0.00 N ATOM 0 H HIS B 42 -10.155 9.687 7.311 1.00 0.00 H new ATOM 0 HA HIS B 42 -10.153 12.358 8.462 1.00 0.00 H new ATOM 0 HB2 HIS B 42 -9.232 10.253 9.552 1.00 0.00 H new ATOM 0 HB3 HIS B 42 -7.938 10.255 8.369 1.00 0.00 H new ATOM 0 HD2 HIS B 42 -9.253 12.733 11.210 1.00 0.00 H new ATOM 0 HE1 HIS B 42 -5.171 13.524 10.483 1.00 0.00 H new ATOM 0 HE2 HIS B 42 -7.164 14.150 11.965 1.00 0.00 H new ATOM 2167 N PHE B 43 -8.013 11.656 6.032 1.00 0.00 N ATOM 2168 CA PHE B 43 -7.151 12.319 5.013 1.00 0.00 C ATOM 2169 C PHE B 43 -8.011 13.223 4.129 1.00 0.00 C ATOM 2170 O PHE B 43 -7.546 14.212 3.599 1.00 0.00 O ATOM 2171 CB PHE B 43 -6.465 11.256 4.153 1.00 0.00 C ATOM 2172 CG PHE B 43 -5.405 10.559 4.973 1.00 0.00 C ATOM 2173 CD1 PHE B 43 -4.153 11.160 5.153 1.00 0.00 C ATOM 2174 CD2 PHE B 43 -5.675 9.315 5.555 1.00 0.00 C ATOM 2175 CE1 PHE B 43 -3.171 10.515 5.916 1.00 0.00 C ATOM 2176 CE2 PHE B 43 -4.693 8.671 6.317 1.00 0.00 C ATOM 2177 CZ PHE B 43 -3.441 9.271 6.497 1.00 0.00 C ATOM 0 H PHE B 43 -8.035 10.637 5.986 1.00 0.00 H new ATOM 0 HA PHE B 43 -6.392 12.920 5.513 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -7.198 10.533 3.795 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -6.016 11.717 3.273 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -3.945 12.120 4.704 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -6.641 8.852 5.416 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -2.205 10.978 6.056 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -4.901 7.711 6.766 1.00 0.00 H new ATOM 0 HZ PHE B 43 -2.683 8.774 7.084 1.00 0.00 H new ATOM 2187 N LEU B 44 -9.261 12.886 3.963 1.00 0.00 N ATOM 2188 CA LEU B 44 -10.158 13.716 3.105 1.00 0.00 C ATOM 2189 C LEU B 44 -9.981 15.198 3.464 1.00 0.00 C ATOM 2190 O LEU B 44 -10.118 16.072 2.632 1.00 0.00 O ATOM 2191 CB LEU B 44 -11.618 13.274 3.342 1.00 0.00 C ATOM 2192 CG LEU B 44 -12.468 13.454 2.067 1.00 0.00 C ATOM 2193 CD1 LEU B 44 -12.379 14.905 1.578 1.00 0.00 C ATOM 2194 CD2 LEU B 44 -11.990 12.492 0.954 1.00 0.00 C ATOM 0 H LEU B 44 -9.702 12.069 4.386 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.907 13.581 2.053 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -11.639 12.229 3.652 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -12.050 13.857 4.156 1.00 0.00 H new ATOM 0 HG LEU B 44 -13.505 13.220 2.307 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -12.982 15.023 0.678 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -12.751 15.574 2.354 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -11.341 15.151 1.354 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -12.602 12.634 0.063 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -10.947 12.701 0.715 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -12.084 11.462 1.298 1.00 0.00 H new ATOM 2206 N GLU B 45 -9.670 15.487 4.695 1.00 0.00 N ATOM 2207 CA GLU B 45 -9.480 16.908 5.093 1.00 0.00 C ATOM 2208 C GLU B 45 -8.112 17.393 4.610 1.00 0.00 C ATOM 2209 O GLU B 45 -7.953 18.527 4.201 1.00 0.00 O ATOM 2210 CB GLU B 45 -9.561 17.026 6.617 1.00 0.00 C ATOM 2211 CG GLU B 45 -11.003 16.781 7.069 1.00 0.00 C ATOM 2212 CD GLU B 45 -11.120 17.048 8.571 1.00 0.00 C ATOM 2213 OE1 GLU B 45 -10.812 18.155 8.981 1.00 0.00 O ATOM 2214 OE2 GLU B 45 -11.518 16.142 9.285 1.00 0.00 O ATOM 0 H GLU B 45 -9.539 14.803 5.441 1.00 0.00 H new ATOM 0 HA GLU B 45 -10.260 17.521 4.642 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -8.893 16.302 7.085 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -9.232 18.015 6.934 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -11.683 17.432 6.519 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -11.295 15.755 6.848 1.00 0.00 H new ATOM 2221 N GLU B 46 -7.121 16.544 4.659 1.00 0.00 N ATOM 2222 CA GLU B 46 -5.755 16.949 4.209 1.00 0.00 C ATOM 2223 C GLU B 46 -5.581 16.647 2.717 1.00 0.00 C ATOM 2224 O GLU B 46 -4.703 15.903 2.327 1.00 0.00 O ATOM 2225 CB GLU B 46 -4.709 16.168 5.008 1.00 0.00 C ATOM 2226 CG GLU B 46 -4.957 16.367 6.505 1.00 0.00 C ATOM 2227 CD GLU B 46 -3.867 15.649 7.303 1.00 0.00 C ATOM 2228 OE1 GLU B 46 -3.004 15.051 6.684 1.00 0.00 O ATOM 2229 OE2 GLU B 46 -3.914 15.712 8.521 1.00 0.00 O ATOM 0 H GLU B 46 -7.198 15.583 4.992 1.00 0.00 H new ATOM 0 HA GLU B 46 -5.627 18.019 4.374 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -4.761 15.108 4.758 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -3.707 16.508 4.746 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -4.958 17.430 6.746 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -5.938 15.977 6.777 1.00 0.00 H new ATOM 2236 N ILE B 47 -6.405 17.231 1.880 1.00 0.00 N ATOM 2237 CA ILE B 47 -6.297 17.002 0.400 1.00 0.00 C ATOM 2238 C ILE B 47 -6.037 18.343 -0.287 1.00 0.00 C ATOM 2239 O ILE B 47 -6.897 19.200 -0.332 1.00 0.00 O ATOM 2240 CB ILE B 47 -7.615 16.429 -0.132 1.00 0.00 C ATOM 2241 CG1 ILE B 47 -7.953 15.112 0.584 1.00 0.00 C ATOM 2242 CG2 ILE B 47 -7.496 16.186 -1.638 1.00 0.00 C ATOM 2243 CD1 ILE B 47 -6.795 14.111 0.474 1.00 0.00 C ATOM 0 H ILE B 47 -7.155 17.863 2.160 1.00 0.00 H new ATOM 0 HA ILE B 47 -5.485 16.303 0.198 1.00 0.00 H new ATOM 0 HB ILE B 47 -8.415 17.144 0.059 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -8.168 15.310 1.634 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -8.854 14.679 0.150 1.00 0.00 H new ATOM 0 HG21 ILE B 47 -8.434 15.778 -2.016 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -7.280 17.128 -2.143 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -6.689 15.478 -1.830 1.00 0.00 H new ATOM 0 HD11 ILE B 47 -7.061 13.188 0.989 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -6.598 13.896 -0.576 1.00 0.00 H new ATOM 0 HD13 ILE B 47 -5.902 14.537 0.931 1.00 0.00 H new ATOM 2255 N LYS B 48 -4.860 18.541 -0.823 1.00 0.00 N ATOM 2256 CA LYS B 48 -4.562 19.839 -1.502 1.00 0.00 C ATOM 2257 C LYS B 48 -4.943 19.729 -2.984 1.00 0.00 C ATOM 2258 O LYS B 48 -5.724 20.505 -3.496 1.00 0.00 O ATOM 2259 CB LYS B 48 -3.063 20.156 -1.360 1.00 0.00 C ATOM 2260 CG LYS B 48 -2.829 21.671 -1.449 1.00 0.00 C ATOM 2261 CD LYS B 48 -3.235 22.181 -2.837 1.00 0.00 C ATOM 2262 CE LYS B 48 -2.609 23.556 -3.087 1.00 0.00 C ATOM 2263 NZ LYS B 48 -2.999 24.039 -4.442 1.00 0.00 N ATOM 0 H LYS B 48 -4.096 17.865 -0.821 1.00 0.00 H new ATOM 0 HA LYS B 48 -5.138 20.642 -1.043 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -2.693 19.779 -0.406 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -2.501 19.647 -2.143 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -3.408 22.183 -0.680 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -1.779 21.897 -1.261 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -2.908 21.478 -3.603 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -4.321 22.247 -2.907 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -2.942 24.263 -2.327 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -1.524 23.493 -3.010 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -2.574 24.973 -4.613 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -2.660 23.368 -5.161 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -4.035 24.114 -4.499 1.00 0.00 H new ATOM 2277 N GLU B 49 -4.396 18.763 -3.675 1.00 0.00 N ATOM 2278 CA GLU B 49 -4.725 18.599 -5.120 1.00 0.00 C ATOM 2279 C GLU B 49 -6.121 17.988 -5.260 1.00 0.00 C ATOM 2280 O GLU B 49 -6.317 16.813 -5.022 1.00 0.00 O ATOM 2281 CB GLU B 49 -3.694 17.676 -5.776 1.00 0.00 C ATOM 2282 CG GLU B 49 -2.328 18.366 -5.801 1.00 0.00 C ATOM 2283 CD GLU B 49 -1.747 18.407 -4.386 1.00 0.00 C ATOM 2284 OE1 GLU B 49 -2.222 17.657 -3.550 1.00 0.00 O ATOM 2285 OE2 GLU B 49 -0.838 19.188 -4.164 1.00 0.00 O ATOM 0 H GLU B 49 -3.736 18.081 -3.300 1.00 0.00 H new ATOM 0 HA GLU B 49 -4.705 19.572 -5.610 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -3.629 16.738 -5.225 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -4.006 17.429 -6.791 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -1.651 17.831 -6.467 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -2.428 19.378 -6.193 1.00 0.00 H new ATOM 2292 N GLN B 50 -7.093 18.767 -5.654 1.00 0.00 N ATOM 2293 CA GLN B 50 -8.469 18.214 -5.818 1.00 0.00 C ATOM 2294 C GLN B 50 -8.584 17.529 -7.182 1.00 0.00 C ATOM 2295 O GLN B 50 -9.409 16.660 -7.383 1.00 0.00 O ATOM 2296 CB GLN B 50 -9.488 19.353 -5.738 1.00 0.00 C ATOM 2297 CG GLN B 50 -9.356 20.064 -4.390 1.00 0.00 C ATOM 2298 CD GLN B 50 -9.895 19.159 -3.281 1.00 0.00 C ATOM 2299 OE1 GLN B 50 -10.873 18.463 -3.470 1.00 0.00 O ATOM 2300 NE2 GLN B 50 -9.294 19.137 -2.123 1.00 0.00 N ATOM 0 H GLN B 50 -6.994 19.759 -5.869 1.00 0.00 H new ATOM 0 HA GLN B 50 -8.666 17.490 -5.027 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -9.323 20.060 -6.551 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -10.498 18.960 -5.856 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -8.312 20.310 -4.198 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -9.907 21.004 -4.407 1.00 0.00 H new ATOM 0 HE21 GLN B 50 -8.473 19.721 -1.963 1.00 0.00 H new ATOM 0 HE22 GLN B 50 -9.645 18.536 -1.377 1.00 0.00 H new ATOM 2309 N GLU B 51 -7.767 17.915 -8.122 1.00 0.00 N ATOM 2310 CA GLU B 51 -7.837 17.287 -9.473 1.00 0.00 C ATOM 2311 C GLU B 51 -7.235 15.879 -9.436 1.00 0.00 C ATOM 2312 O GLU B 51 -7.557 15.045 -10.260 1.00 0.00 O ATOM 2313 CB GLU B 51 -7.098 18.151 -10.498 1.00 0.00 C ATOM 2314 CG GLU B 51 -7.664 19.572 -10.471 1.00 0.00 C ATOM 2315 CD GLU B 51 -9.129 19.548 -10.909 1.00 0.00 C ATOM 2316 OE1 GLU B 51 -9.496 18.638 -11.634 1.00 0.00 O ATOM 2317 OE2 GLU B 51 -9.860 20.440 -10.511 1.00 0.00 O ATOM 0 H GLU B 51 -7.055 18.637 -8.015 1.00 0.00 H new ATOM 0 HA GLU B 51 -8.884 17.212 -9.768 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -6.032 18.169 -10.273 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -7.206 17.724 -11.495 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -7.581 19.989 -9.467 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -7.086 20.217 -11.133 1.00 0.00 H new ATOM 2324 N VAL B 52 -6.394 15.583 -8.484 1.00 0.00 N ATOM 2325 CA VAL B 52 -5.825 14.205 -8.412 1.00 0.00 C ATOM 2326 C VAL B 52 -6.894 13.266 -7.846 1.00 0.00 C ATOM 2327 O VAL B 52 -7.189 12.239 -8.423 1.00 0.00 O ATOM 2328 CB VAL B 52 -4.597 14.200 -7.491 1.00 0.00 C ATOM 2329 CG1 VAL B 52 -4.165 12.758 -7.203 1.00 0.00 C ATOM 2330 CG2 VAL B 52 -3.446 14.941 -8.171 1.00 0.00 C ATOM 0 H VAL B 52 -6.078 16.227 -7.759 1.00 0.00 H new ATOM 0 HA VAL B 52 -5.524 13.874 -9.406 1.00 0.00 H new ATOM 0 HB VAL B 52 -4.854 14.695 -6.554 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -3.293 12.763 -6.549 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -4.981 12.224 -6.716 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -3.913 12.260 -8.139 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -2.574 14.937 -7.517 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -3.198 14.445 -9.109 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -3.744 15.970 -8.372 1.00 0.00 H new ATOM 2340 N VAL B 53 -7.483 13.601 -6.735 1.00 0.00 N ATOM 2341 CA VAL B 53 -8.531 12.709 -6.165 1.00 0.00 C ATOM 2342 C VAL B 53 -9.697 12.615 -7.151 1.00 0.00 C ATOM 2343 O VAL B 53 -10.351 11.597 -7.258 1.00 0.00 O ATOM 2344 CB VAL B 53 -9.024 13.279 -4.831 1.00 0.00 C ATOM 2345 CG1 VAL B 53 -10.217 12.461 -4.332 1.00 0.00 C ATOM 2346 CG2 VAL B 53 -7.895 13.210 -3.799 1.00 0.00 C ATOM 0 H VAL B 53 -7.288 14.447 -6.199 1.00 0.00 H new ATOM 0 HA VAL B 53 -8.116 11.716 -5.994 1.00 0.00 H new ATOM 0 HB VAL B 53 -9.329 14.316 -4.972 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -10.566 12.868 -3.383 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -11.022 12.508 -5.065 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -9.914 11.423 -4.192 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -8.245 13.615 -2.850 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -7.591 12.172 -3.661 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -7.044 13.793 -4.151 1.00 0.00 H new ATOM 2356 N ASP B 54 -9.965 13.670 -7.868 1.00 0.00 N ATOM 2357 CA ASP B 54 -11.090 13.641 -8.842 1.00 0.00 C ATOM 2358 C ASP B 54 -10.852 12.544 -9.884 1.00 0.00 C ATOM 2359 O ASP B 54 -11.757 11.824 -10.256 1.00 0.00 O ATOM 2360 CB ASP B 54 -11.191 14.996 -9.544 1.00 0.00 C ATOM 2361 CG ASP B 54 -11.696 16.048 -8.555 1.00 0.00 C ATOM 2362 OD1 ASP B 54 -11.668 15.776 -7.366 1.00 0.00 O ATOM 2363 OD2 ASP B 54 -12.104 17.106 -9.003 1.00 0.00 O ATOM 0 H ASP B 54 -9.453 14.551 -7.821 1.00 0.00 H new ATOM 0 HA ASP B 54 -12.018 13.433 -8.310 1.00 0.00 H new ATOM 0 HB2 ASP B 54 -10.217 15.288 -9.935 1.00 0.00 H new ATOM 0 HB3 ASP B 54 -11.869 14.927 -10.395 1.00 0.00 H new ATOM 2368 N LYS B 55 -9.644 12.421 -10.374 1.00 0.00 N ATOM 2369 CA LYS B 55 -9.365 11.382 -11.407 1.00 0.00 C ATOM 2370 C LYS B 55 -9.426 9.988 -10.781 1.00 0.00 C ATOM 2371 O LYS B 55 -9.744 9.021 -11.445 1.00 0.00 O ATOM 2372 CB LYS B 55 -7.991 11.623 -12.029 1.00 0.00 C ATOM 2373 CG LYS B 55 -8.024 12.926 -12.831 1.00 0.00 C ATOM 2374 CD LYS B 55 -6.649 13.190 -13.445 1.00 0.00 C ATOM 2375 CE LYS B 55 -6.725 14.415 -14.360 1.00 0.00 C ATOM 2376 NZ LYS B 55 -5.466 14.528 -15.149 1.00 0.00 N ATOM 0 H LYS B 55 -8.844 12.993 -10.104 1.00 0.00 H new ATOM 0 HA LYS B 55 -10.122 11.446 -12.189 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -7.231 11.680 -11.250 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -7.721 10.790 -12.677 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -8.777 12.862 -13.616 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -8.309 13.755 -12.184 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -5.913 13.356 -12.658 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -6.319 12.319 -14.012 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -7.580 14.328 -15.031 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -6.876 15.316 -13.766 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -5.519 15.361 -15.770 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -4.659 14.630 -14.502 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -5.340 13.672 -15.727 1.00 0.00 H new ATOM 2390 N VAL B 56 -9.170 9.869 -9.508 1.00 0.00 N ATOM 2391 CA VAL B 56 -9.267 8.533 -8.857 1.00 0.00 C ATOM 2392 C VAL B 56 -10.727 8.091 -8.892 1.00 0.00 C ATOM 2393 O VAL B 56 -11.057 7.038 -9.400 1.00 0.00 O ATOM 2394 CB VAL B 56 -8.809 8.644 -7.402 1.00 0.00 C ATOM 2395 CG1 VAL B 56 -8.930 7.276 -6.727 1.00 0.00 C ATOM 2396 CG2 VAL B 56 -7.348 9.102 -7.363 1.00 0.00 C ATOM 0 H VAL B 56 -8.899 10.636 -8.892 1.00 0.00 H new ATOM 0 HA VAL B 56 -8.638 7.811 -9.378 1.00 0.00 H new ATOM 0 HB VAL B 56 -9.433 9.367 -6.877 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -8.604 7.352 -5.690 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -9.968 6.946 -6.758 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -8.304 6.555 -7.252 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -7.019 9.182 -6.327 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -6.725 8.377 -7.886 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -7.258 10.074 -7.848 1.00 0.00 H new ATOM 2406 N MET B 57 -11.604 8.886 -8.347 1.00 0.00 N ATOM 2407 CA MET B 57 -13.044 8.512 -8.339 1.00 0.00 C ATOM 2408 C MET B 57 -13.516 8.228 -9.765 1.00 0.00 C ATOM 2409 O MET B 57 -14.435 7.463 -9.980 1.00 0.00 O ATOM 2410 CB MET B 57 -13.863 9.660 -7.744 1.00 0.00 C ATOM 2411 CG MET B 57 -13.433 9.896 -6.293 1.00 0.00 C ATOM 2412 SD MET B 57 -14.708 10.845 -5.429 1.00 0.00 S ATOM 2413 CE MET B 57 -14.340 10.242 -3.763 1.00 0.00 C ATOM 0 H MET B 57 -11.385 9.779 -7.906 1.00 0.00 H new ATOM 0 HA MET B 57 -13.180 7.615 -7.735 1.00 0.00 H new ATOM 0 HB2 MET B 57 -13.716 10.567 -8.330 1.00 0.00 H new ATOM 0 HB3 MET B 57 -14.926 9.422 -7.785 1.00 0.00 H new ATOM 0 HG2 MET B 57 -13.273 8.942 -5.791 1.00 0.00 H new ATOM 0 HG3 MET B 57 -12.485 10.433 -6.267 1.00 0.00 H new ATOM 0 HE1 MET B 57 -15.021 10.706 -3.049 1.00 0.00 H new ATOM 0 HE2 MET B 57 -14.464 9.160 -3.732 1.00 0.00 H new ATOM 0 HE3 MET B 57 -13.313 10.497 -3.502 1.00 0.00 H new ATOM 2423 N GLU B 58 -12.879 8.814 -10.751 1.00 0.00 N ATOM 2424 CA GLU B 58 -13.276 8.549 -12.165 1.00 0.00 C ATOM 2425 C GLU B 58 -12.553 7.296 -12.659 1.00 0.00 C ATOM 2426 O GLU B 58 -13.102 6.518 -13.413 1.00 0.00 O ATOM 2427 CB GLU B 58 -12.939 9.751 -13.050 1.00 0.00 C ATOM 2428 CG GLU B 58 -13.626 9.597 -14.408 1.00 0.00 C ATOM 2429 CD GLU B 58 -15.122 9.878 -14.258 1.00 0.00 C ATOM 2430 OE1 GLU B 58 -15.470 11.027 -14.042 1.00 0.00 O ATOM 2431 OE2 GLU B 58 -15.895 8.940 -14.362 1.00 0.00 O ATOM 0 H GLU B 58 -12.102 9.464 -10.635 1.00 0.00 H new ATOM 0 HA GLU B 58 -14.353 8.388 -12.217 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -13.265 10.673 -12.568 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -11.860 9.826 -13.183 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -13.187 10.285 -15.130 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -13.471 8.589 -14.793 1.00 0.00 H new ATOM 2438 N THR B 59 -11.339 7.071 -12.237 1.00 0.00 N ATOM 2439 CA THR B 59 -10.637 5.842 -12.695 1.00 0.00 C ATOM 2440 C THR B 59 -11.317 4.643 -12.038 1.00 0.00 C ATOM 2441 O THR B 59 -11.605 3.659 -12.691 1.00 0.00 O ATOM 2442 CB THR B 59 -9.150 5.894 -12.325 1.00 0.00 C ATOM 2443 OG1 THR B 59 -8.660 7.211 -12.531 1.00 0.00 O ATOM 2444 CG2 THR B 59 -8.367 4.914 -13.204 1.00 0.00 C ATOM 0 H THR B 59 -10.811 7.674 -11.606 1.00 0.00 H new ATOM 0 HA THR B 59 -10.695 5.759 -13.780 1.00 0.00 H new ATOM 0 HB THR B 59 -9.026 5.617 -11.278 1.00 0.00 H new ATOM 0 HG1 THR B 59 -8.779 7.736 -11.712 1.00 0.00 H new ATOM 0 HG21 THR B 59 -7.310 4.952 -12.940 1.00 0.00 H new ATOM 0 HG22 THR B 59 -8.744 3.903 -13.047 1.00 0.00 H new ATOM 0 HG23 THR B 59 -8.489 5.188 -14.252 1.00 0.00 H new ATOM 2452 N LEU B 60 -11.631 4.719 -10.774 1.00 0.00 N ATOM 2453 CA LEU B 60 -12.347 3.586 -10.131 1.00 0.00 C ATOM 2454 C LEU B 60 -13.693 3.419 -10.833 1.00 0.00 C ATOM 2455 O LEU B 60 -13.998 2.372 -11.369 1.00 0.00 O ATOM 2456 CB LEU B 60 -12.590 3.904 -8.651 1.00 0.00 C ATOM 2457 CG LEU B 60 -11.255 4.151 -7.937 1.00 0.00 C ATOM 2458 CD1 LEU B 60 -11.530 4.668 -6.521 1.00 0.00 C ATOM 2459 CD2 LEU B 60 -10.448 2.845 -7.858 1.00 0.00 C ATOM 0 H LEU B 60 -11.424 5.510 -10.164 1.00 0.00 H new ATOM 0 HA LEU B 60 -11.755 2.674 -10.209 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -13.228 4.783 -8.560 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -13.118 3.077 -8.176 1.00 0.00 H new ATOM 0 HG LEU B 60 -10.680 4.889 -8.496 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -10.585 4.845 -6.008 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -12.093 5.600 -6.577 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -12.108 3.927 -5.969 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -9.502 3.032 -7.349 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -11.017 2.099 -7.304 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -10.252 2.477 -8.865 1.00 0.00 H new ATOM 2471 N ASP B 61 -14.500 4.447 -10.849 1.00 0.00 N ATOM 2472 CA ASP B 61 -15.819 4.340 -11.532 1.00 0.00 C ATOM 2473 C ASP B 61 -15.609 3.758 -12.932 1.00 0.00 C ATOM 2474 O ASP B 61 -16.519 3.234 -13.543 1.00 0.00 O ATOM 2475 CB ASP B 61 -16.450 5.730 -11.644 1.00 0.00 C ATOM 2476 CG ASP B 61 -17.000 6.155 -10.281 1.00 0.00 C ATOM 2477 OD1 ASP B 61 -16.258 6.082 -9.315 1.00 0.00 O ATOM 2478 OD2 ASP B 61 -18.155 6.545 -10.225 1.00 0.00 O ATOM 0 H ASP B 61 -14.303 5.351 -10.420 1.00 0.00 H new ATOM 0 HA ASP B 61 -16.480 3.690 -10.959 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -15.708 6.450 -11.989 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -17.251 5.718 -12.383 1.00 0.00 H new ATOM 2483 N GLU B 62 -14.403 3.842 -13.439 1.00 0.00 N ATOM 2484 CA GLU B 62 -14.102 3.292 -14.797 1.00 0.00 C ATOM 2485 C GLU B 62 -13.361 1.974 -14.652 1.00 0.00 C ATOM 2486 O GLU B 62 -12.402 1.691 -15.343 1.00 0.00 O ATOM 2487 CB GLU B 62 -13.223 4.256 -15.542 1.00 0.00 C ATOM 2488 CG GLU B 62 -14.034 5.485 -15.963 1.00 0.00 C ATOM 2489 CD GLU B 62 -13.088 6.573 -16.472 1.00 0.00 C ATOM 2490 OE1 GLU B 62 -11.890 6.411 -16.310 1.00 0.00 O ATOM 2491 OE2 GLU B 62 -13.577 7.550 -17.015 1.00 0.00 O ATOM 0 H GLU B 62 -13.608 4.272 -12.966 1.00 0.00 H new ATOM 0 HA GLU B 62 -15.035 3.140 -15.340 1.00 0.00 H new ATOM 0 HB2 GLU B 62 -12.387 4.560 -14.912 1.00 0.00 H new ATOM 0 HB3 GLU B 62 -12.800 3.770 -16.421 1.00 0.00 H new ATOM 0 HG2 GLU B 62 -14.746 5.214 -16.743 1.00 0.00 H new ATOM 0 HG3 GLU B 62 -14.613 5.858 -15.118 1.00 0.00 H new ATOM 2498 N ASP B 63 -13.808 1.190 -13.750 1.00 0.00 N ATOM 2499 CA ASP B 63 -13.176 -0.139 -13.484 1.00 0.00 C ATOM 2500 C ASP B 63 -12.865 -0.825 -14.816 1.00 0.00 C ATOM 2501 O ASP B 63 -11.852 -1.476 -14.973 1.00 0.00 O ATOM 2502 CB ASP B 63 -14.184 -0.997 -12.718 1.00 0.00 C ATOM 2503 CG ASP B 63 -13.506 -2.267 -12.206 1.00 0.00 C ATOM 2504 OD1 ASP B 63 -12.317 -2.215 -11.942 1.00 0.00 O ATOM 2505 OD2 ASP B 63 -14.190 -3.270 -12.085 1.00 0.00 O ATOM 0 H ASP B 63 -14.609 1.403 -13.156 1.00 0.00 H new ATOM 0 HA ASP B 63 -12.257 -0.013 -12.911 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -14.594 -0.431 -11.881 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -15.020 -1.257 -13.367 1.00 0.00 H new ATOM 2510 N GLY B 64 -13.717 -0.633 -15.779 1.00 0.00 N ATOM 2511 CA GLY B 64 -13.502 -1.218 -17.136 1.00 0.00 C ATOM 2512 C GLY B 64 -13.232 -2.733 -17.089 1.00 0.00 C ATOM 2513 O GLY B 64 -13.237 -3.382 -18.117 1.00 0.00 O ATOM 0 H GLY B 64 -14.572 -0.085 -15.685 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -14.380 -1.028 -17.753 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -12.661 -0.717 -17.615 1.00 0.00 H new ATOM 2517 N ASP B 65 -12.997 -3.313 -15.932 1.00 0.00 N ATOM 2518 CA ASP B 65 -12.728 -4.800 -15.867 1.00 0.00 C ATOM 2519 C ASP B 65 -13.933 -5.587 -15.283 1.00 0.00 C ATOM 2520 O ASP B 65 -14.139 -6.724 -15.659 1.00 0.00 O ATOM 2521 CB ASP B 65 -11.498 -5.046 -14.986 1.00 0.00 C ATOM 2522 CG ASP B 65 -11.581 -4.181 -13.727 1.00 0.00 C ATOM 2523 OD1 ASP B 65 -12.342 -4.530 -12.842 1.00 0.00 O ATOM 2524 OD2 ASP B 65 -10.876 -3.187 -13.668 1.00 0.00 O ATOM 0 H ASP B 65 -12.979 -2.830 -15.034 1.00 0.00 H new ATOM 0 HA ASP B 65 -12.559 -5.154 -16.884 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -11.441 -6.099 -14.711 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -10.589 -4.811 -15.540 1.00 0.00 H new ATOM 2529 N GLY B 66 -14.727 -5.040 -14.383 1.00 0.00 N ATOM 2530 CA GLY B 66 -15.883 -5.810 -13.821 1.00 0.00 C ATOM 2531 C GLY B 66 -15.527 -6.289 -12.410 1.00 0.00 C ATOM 2532 O GLY B 66 -16.390 -6.479 -11.575 1.00 0.00 O ATOM 0 H GLY B 66 -14.621 -4.094 -14.016 1.00 0.00 H new ATOM 0 HA2 GLY B 66 -16.774 -5.183 -13.792 1.00 0.00 H new ATOM 0 HA3 GLY B 66 -16.114 -6.662 -14.460 1.00 0.00 H new ATOM 2536 N GLU B 67 -14.260 -6.475 -12.129 1.00 0.00 N ATOM 2537 CA GLU B 67 -13.855 -6.925 -10.764 1.00 0.00 C ATOM 2538 C GLU B 67 -12.466 -6.369 -10.421 1.00 0.00 C ATOM 2539 O GLU B 67 -11.530 -6.503 -11.184 1.00 0.00 O ATOM 2540 CB GLU B 67 -13.835 -8.452 -10.735 1.00 0.00 C ATOM 2541 CG GLU B 67 -12.739 -8.978 -11.672 1.00 0.00 C ATOM 2542 CD GLU B 67 -13.024 -10.440 -12.029 1.00 0.00 C ATOM 2543 OE1 GLU B 67 -14.153 -10.731 -12.389 1.00 0.00 O ATOM 2544 OE2 GLU B 67 -12.110 -11.242 -11.937 1.00 0.00 O ATOM 0 H GLU B 67 -13.492 -6.335 -12.785 1.00 0.00 H new ATOM 0 HA GLU B 67 -14.566 -6.555 -10.025 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -13.656 -8.803 -9.719 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -14.805 -8.843 -11.041 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -12.700 -8.373 -12.578 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -11.765 -8.894 -11.191 1.00 0.00 H new ATOM 2551 N CYS B 68 -12.325 -5.750 -9.274 1.00 0.00 N ATOM 2552 CA CYS B 68 -10.999 -5.183 -8.866 1.00 0.00 C ATOM 2553 C CYS B 68 -10.346 -6.108 -7.833 1.00 0.00 C ATOM 2554 O CYS B 68 -10.943 -6.464 -6.837 1.00 0.00 O ATOM 2555 CB CYS B 68 -11.208 -3.785 -8.259 1.00 0.00 C ATOM 2556 SG CYS B 68 -12.584 -2.966 -9.103 1.00 0.00 S ATOM 0 H CYS B 68 -13.076 -5.612 -8.598 1.00 0.00 H new ATOM 0 HA CYS B 68 -10.349 -5.103 -9.737 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -11.417 -3.867 -7.192 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -10.299 -3.192 -8.361 1.00 0.00 H new ATOM 0 HG CYS B 68 -12.145 -2.372 -10.173 1.00 0.00 H new ATOM 2562 N ASP B 69 -9.122 -6.500 -8.068 1.00 0.00 N ATOM 2563 CA ASP B 69 -8.424 -7.404 -7.108 1.00 0.00 C ATOM 2564 C ASP B 69 -7.822 -6.581 -5.964 1.00 0.00 C ATOM 2565 O ASP B 69 -8.015 -5.385 -5.877 1.00 0.00 O ATOM 2566 CB ASP B 69 -7.307 -8.150 -7.841 1.00 0.00 C ATOM 2567 CG ASP B 69 -6.811 -9.308 -6.973 1.00 0.00 C ATOM 2568 OD1 ASP B 69 -7.638 -10.091 -6.535 1.00 0.00 O ATOM 2569 OD2 ASP B 69 -5.612 -9.392 -6.762 1.00 0.00 O ATOM 0 H ASP B 69 -8.574 -6.232 -8.886 1.00 0.00 H new ATOM 0 HA ASP B 69 -9.138 -8.118 -6.698 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -7.673 -8.528 -8.795 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -6.485 -7.469 -8.062 1.00 0.00 H new ATOM 2574 N PHE B 70 -7.084 -7.216 -5.091 1.00 0.00 N ATOM 2575 CA PHE B 70 -6.458 -6.472 -3.958 1.00 0.00 C ATOM 2576 C PHE B 70 -5.260 -5.674 -4.481 1.00 0.00 C ATOM 2577 O PHE B 70 -4.945 -4.614 -3.979 1.00 0.00 O ATOM 2578 CB PHE B 70 -6.003 -7.468 -2.887 1.00 0.00 C ATOM 2579 CG PHE B 70 -5.384 -6.729 -1.724 1.00 0.00 C ATOM 2580 CD1 PHE B 70 -4.066 -6.265 -1.811 1.00 0.00 C ATOM 2581 CD2 PHE B 70 -6.126 -6.514 -0.557 1.00 0.00 C ATOM 2582 CE1 PHE B 70 -3.490 -5.586 -0.730 1.00 0.00 C ATOM 2583 CE2 PHE B 70 -5.551 -5.835 0.524 1.00 0.00 C ATOM 2584 CZ PHE B 70 -4.233 -5.371 0.437 1.00 0.00 C ATOM 0 H PHE B 70 -6.888 -8.217 -5.114 1.00 0.00 H new ATOM 0 HA PHE B 70 -7.181 -5.785 -3.519 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -6.852 -8.058 -2.543 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -5.281 -8.166 -3.311 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -3.493 -6.431 -2.712 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -7.143 -6.872 -0.490 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -2.473 -5.228 -0.797 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -6.124 -5.669 1.424 1.00 0.00 H new ATOM 0 HZ PHE B 70 -3.789 -4.847 1.271 1.00 0.00 H new ATOM 2594 N GLN B 71 -4.597 -6.160 -5.491 1.00 0.00 N ATOM 2595 CA GLN B 71 -3.433 -5.408 -6.042 1.00 0.00 C ATOM 2596 C GLN B 71 -3.904 -4.022 -6.496 1.00 0.00 C ATOM 2597 O GLN B 71 -3.203 -3.040 -6.346 1.00 0.00 O ATOM 2598 CB GLN B 71 -2.859 -6.171 -7.237 1.00 0.00 C ATOM 2599 CG GLN B 71 -2.190 -7.457 -6.744 1.00 0.00 C ATOM 2600 CD GLN B 71 -1.892 -8.369 -7.935 1.00 0.00 C ATOM 2601 OE1 GLN B 71 -2.709 -9.187 -8.309 1.00 0.00 O ATOM 2602 NE2 GLN B 71 -0.746 -8.263 -8.551 1.00 0.00 N ATOM 0 H GLN B 71 -4.808 -7.042 -5.959 1.00 0.00 H new ATOM 0 HA GLN B 71 -2.663 -5.301 -5.277 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -3.652 -6.409 -7.946 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -2.135 -5.551 -7.765 1.00 0.00 H new ATOM 0 HG2 GLN B 71 -1.267 -7.219 -6.215 1.00 0.00 H new ATOM 0 HG3 GLN B 71 -2.841 -7.969 -6.035 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -0.060 -7.576 -8.237 1.00 0.00 H new ATOM 0 HE22 GLN B 71 -0.537 -8.867 -9.346 1.00 0.00 H new ATOM 2611 N GLU B 72 -5.085 -3.930 -7.038 1.00 0.00 N ATOM 2612 CA GLU B 72 -5.599 -2.603 -7.487 1.00 0.00 C ATOM 2613 C GLU B 72 -5.961 -1.751 -6.263 1.00 0.00 C ATOM 2614 O GLU B 72 -5.993 -0.541 -6.324 1.00 0.00 O ATOM 2615 CB GLU B 72 -6.832 -2.795 -8.379 1.00 0.00 C ATOM 2616 CG GLU B 72 -6.390 -3.179 -9.794 1.00 0.00 C ATOM 2617 CD GLU B 72 -5.655 -4.519 -9.755 1.00 0.00 C ATOM 2618 OE1 GLU B 72 -6.232 -5.475 -9.262 1.00 0.00 O ATOM 2619 OE2 GLU B 72 -4.528 -4.568 -10.219 1.00 0.00 O ATOM 0 H GLU B 72 -5.718 -4.715 -7.190 1.00 0.00 H new ATOM 0 HA GLU B 72 -4.826 -2.092 -8.062 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -7.475 -3.572 -7.965 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -7.419 -1.877 -8.407 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -7.257 -3.247 -10.451 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -5.739 -2.407 -10.205 1.00 0.00 H new ATOM 2626 N PHE B 73 -6.203 -2.380 -5.148 1.00 0.00 N ATOM 2627 CA PHE B 73 -6.533 -1.621 -3.904 1.00 0.00 C ATOM 2628 C PHE B 73 -5.257 -0.992 -3.329 1.00 0.00 C ATOM 2629 O PHE B 73 -5.276 0.137 -2.887 1.00 0.00 O ATOM 2630 CB PHE B 73 -7.191 -2.561 -2.884 1.00 0.00 C ATOM 2631 CG PHE B 73 -7.283 -1.894 -1.532 1.00 0.00 C ATOM 2632 CD1 PHE B 73 -8.392 -1.105 -1.219 1.00 0.00 C ATOM 2633 CD2 PHE B 73 -6.264 -2.075 -0.589 1.00 0.00 C ATOM 2634 CE1 PHE B 73 -8.487 -0.493 0.037 1.00 0.00 C ATOM 2635 CE2 PHE B 73 -6.357 -1.465 0.668 1.00 0.00 C ATOM 2636 CZ PHE B 73 -7.469 -0.673 0.981 1.00 0.00 C ATOM 0 H PHE B 73 -6.187 -3.394 -5.041 1.00 0.00 H new ATOM 0 HA PHE B 73 -7.236 -0.821 -4.137 1.00 0.00 H new ATOM 0 HB2 PHE B 73 -8.187 -2.839 -3.227 1.00 0.00 H new ATOM 0 HB3 PHE B 73 -6.613 -3.482 -2.803 1.00 0.00 H new ATOM 0 HD1 PHE B 73 -9.178 -0.967 -1.947 1.00 0.00 H new ATOM 0 HD2 PHE B 73 -5.406 -2.685 -0.831 1.00 0.00 H new ATOM 0 HE1 PHE B 73 -9.345 0.117 0.277 1.00 0.00 H new ATOM 0 HE2 PHE B 73 -5.572 -1.605 1.396 1.00 0.00 H new ATOM 0 HZ PHE B 73 -7.541 -0.201 1.950 1.00 0.00 H new ATOM 2646 N MET B 74 -4.154 -1.675 -3.327 1.00 0.00 N ATOM 2647 CA MET B 74 -2.927 -1.033 -2.769 1.00 0.00 C ATOM 2648 C MET B 74 -2.493 0.117 -3.698 1.00 0.00 C ATOM 2649 O MET B 74 -2.203 1.202 -3.233 1.00 0.00 O ATOM 2650 CB MET B 74 -1.801 -2.081 -2.619 1.00 0.00 C ATOM 2651 CG MET B 74 -1.078 -1.896 -1.276 1.00 0.00 C ATOM 2652 SD MET B 74 -2.120 -2.547 0.060 1.00 0.00 S ATOM 2653 CE MET B 74 -2.050 -1.114 1.168 1.00 0.00 C ATOM 0 H MET B 74 -4.042 -2.627 -3.677 1.00 0.00 H new ATOM 0 HA MET B 74 -3.139 -0.626 -1.780 1.00 0.00 H new ATOM 0 HB2 MET B 74 -2.219 -3.086 -2.680 1.00 0.00 H new ATOM 0 HB3 MET B 74 -1.090 -1.982 -3.439 1.00 0.00 H new ATOM 0 HG2 MET B 74 -0.120 -2.415 -1.291 1.00 0.00 H new ATOM 0 HG3 MET B 74 -0.866 -0.840 -1.106 1.00 0.00 H new ATOM 0 HE1 MET B 74 -2.638 -1.317 2.063 1.00 0.00 H new ATOM 0 HE2 MET B 74 -1.015 -0.922 1.450 1.00 0.00 H new ATOM 0 HE3 MET B 74 -2.455 -0.240 0.658 1.00 0.00 H new ATOM 2663 N ALA B 75 -2.428 -0.082 -4.985 1.00 0.00 N ATOM 2664 CA ALA B 75 -1.995 1.031 -5.883 1.00 0.00 C ATOM 2665 C ALA B 75 -2.979 2.211 -5.835 1.00 0.00 C ATOM 2666 O ALA B 75 -2.590 3.330 -5.565 1.00 0.00 O ATOM 2667 CB ALA B 75 -1.908 0.505 -7.318 1.00 0.00 C ATOM 0 H ALA B 75 -2.654 -0.959 -5.454 1.00 0.00 H new ATOM 0 HA ALA B 75 -1.023 1.388 -5.543 1.00 0.00 H new ATOM 0 HB1 ALA B 75 -1.593 1.310 -7.982 1.00 0.00 H new ATOM 0 HB2 ALA B 75 -1.184 -0.308 -7.364 1.00 0.00 H new ATOM 0 HB3 ALA B 75 -2.886 0.138 -7.631 1.00 0.00 H new ATOM 2673 N PHE B 76 -4.236 1.994 -6.111 1.00 0.00 N ATOM 2674 CA PHE B 76 -5.199 3.143 -6.093 1.00 0.00 C ATOM 2675 C PHE B 76 -5.192 3.807 -4.711 1.00 0.00 C ATOM 2676 O PHE B 76 -5.276 5.014 -4.593 1.00 0.00 O ATOM 2677 CB PHE B 76 -6.622 2.648 -6.433 1.00 0.00 C ATOM 2678 CG PHE B 76 -6.824 2.649 -7.936 1.00 0.00 C ATOM 2679 CD1 PHE B 76 -6.764 3.855 -8.646 1.00 0.00 C ATOM 2680 CD2 PHE B 76 -7.066 1.449 -8.619 1.00 0.00 C ATOM 2681 CE1 PHE B 76 -6.944 3.862 -10.033 1.00 0.00 C ATOM 2682 CE2 PHE B 76 -7.248 1.457 -10.007 1.00 0.00 C ATOM 2683 CZ PHE B 76 -7.186 2.664 -10.714 1.00 0.00 C ATOM 0 H PHE B 76 -4.638 1.086 -6.346 1.00 0.00 H new ATOM 0 HA PHE B 76 -4.892 3.874 -6.841 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -6.771 1.643 -6.038 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -7.363 3.290 -5.957 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -6.578 4.781 -8.122 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -7.112 0.518 -8.074 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -6.896 4.793 -10.579 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -7.436 0.532 -10.532 1.00 0.00 H new ATOM 0 HZ PHE B 76 -7.325 2.670 -11.785 1.00 0.00 H new ATOM 2693 N VAL B 77 -5.080 3.037 -3.672 1.00 0.00 N ATOM 2694 CA VAL B 77 -5.055 3.640 -2.310 1.00 0.00 C ATOM 2695 C VAL B 77 -3.815 4.531 -2.189 1.00 0.00 C ATOM 2696 O VAL B 77 -3.820 5.526 -1.492 1.00 0.00 O ATOM 2697 CB VAL B 77 -5.019 2.525 -1.257 1.00 0.00 C ATOM 2698 CG1 VAL B 77 -4.657 3.108 0.116 1.00 0.00 C ATOM 2699 CG2 VAL B 77 -6.399 1.855 -1.180 1.00 0.00 C ATOM 0 H VAL B 77 -5.005 2.020 -3.702 1.00 0.00 H new ATOM 0 HA VAL B 77 -5.949 4.242 -2.147 1.00 0.00 H new ATOM 0 HB VAL B 77 -4.266 1.789 -1.540 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -4.634 2.308 0.856 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -3.677 3.582 0.063 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -5.403 3.849 0.405 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -6.377 1.062 -0.433 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -7.148 2.596 -0.901 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -6.652 1.431 -2.152 1.00 0.00 H new ATOM 2709 N SER B 78 -2.755 4.183 -2.863 1.00 0.00 N ATOM 2710 CA SER B 78 -1.519 5.012 -2.788 1.00 0.00 C ATOM 2711 C SER B 78 -1.747 6.349 -3.507 1.00 0.00 C ATOM 2712 O SER B 78 -1.462 7.405 -2.976 1.00 0.00 O ATOM 2713 CB SER B 78 -0.364 4.260 -3.455 1.00 0.00 C ATOM 2714 OG SER B 78 0.871 4.798 -3.001 1.00 0.00 O ATOM 0 H SER B 78 -2.691 3.360 -3.463 1.00 0.00 H new ATOM 0 HA SER B 78 -1.274 5.205 -1.744 1.00 0.00 H new ATOM 0 HB2 SER B 78 -0.421 3.198 -3.217 1.00 0.00 H new ATOM 0 HB3 SER B 78 -0.436 4.348 -4.539 1.00 0.00 H new ATOM 0 HG SER B 78 1.613 4.318 -3.425 1.00 0.00 H new ATOM 2720 N MET B 79 -2.237 6.312 -4.717 1.00 0.00 N ATOM 2721 CA MET B 79 -2.458 7.578 -5.477 1.00 0.00 C ATOM 2722 C MET B 79 -3.228 8.586 -4.624 1.00 0.00 C ATOM 2723 O MET B 79 -2.949 9.766 -4.652 1.00 0.00 O ATOM 2724 CB MET B 79 -3.259 7.278 -6.747 1.00 0.00 C ATOM 2725 CG MET B 79 -2.379 6.525 -7.746 1.00 0.00 C ATOM 2726 SD MET B 79 -1.180 7.669 -8.476 1.00 0.00 S ATOM 2727 CE MET B 79 -2.194 8.195 -9.880 1.00 0.00 C ATOM 0 H MET B 79 -2.494 5.459 -5.213 1.00 0.00 H new ATOM 0 HA MET B 79 -1.489 8.002 -5.739 1.00 0.00 H new ATOM 0 HB2 MET B 79 -4.138 6.683 -6.502 1.00 0.00 H new ATOM 0 HB3 MET B 79 -3.617 8.207 -7.191 1.00 0.00 H new ATOM 0 HG2 MET B 79 -1.860 5.708 -7.246 1.00 0.00 H new ATOM 0 HG3 MET B 79 -2.996 6.080 -8.527 1.00 0.00 H new ATOM 0 HE1 MET B 79 -1.639 8.917 -10.479 1.00 0.00 H new ATOM 0 HE2 MET B 79 -2.443 7.329 -10.494 1.00 0.00 H new ATOM 0 HE3 MET B 79 -3.111 8.656 -9.514 1.00 0.00 H new ATOM 2737 N VAL B 80 -4.190 8.142 -3.866 1.00 0.00 N ATOM 2738 CA VAL B 80 -4.961 9.102 -3.023 1.00 0.00 C ATOM 2739 C VAL B 80 -4.089 9.568 -1.856 1.00 0.00 C ATOM 2740 O VAL B 80 -3.946 10.749 -1.613 1.00 0.00 O ATOM 2741 CB VAL B 80 -6.214 8.420 -2.471 1.00 0.00 C ATOM 2742 CG1 VAL B 80 -6.993 9.413 -1.605 1.00 0.00 C ATOM 2743 CG2 VAL B 80 -7.099 7.956 -3.629 1.00 0.00 C ATOM 0 H VAL B 80 -4.476 7.166 -3.792 1.00 0.00 H new ATOM 0 HA VAL B 80 -5.253 9.957 -3.632 1.00 0.00 H new ATOM 0 HB VAL B 80 -5.922 7.559 -1.870 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -7.886 8.929 -1.211 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -6.365 9.745 -0.778 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -7.283 10.273 -2.209 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -7.991 7.470 -3.233 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -7.391 8.816 -4.231 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -6.546 7.250 -4.249 1.00 0.00 H new ATOM 2753 N THR B 81 -3.494 8.656 -1.140 1.00 0.00 N ATOM 2754 CA THR B 81 -2.625 9.065 -0.004 1.00 0.00 C ATOM 2755 C THR B 81 -1.518 9.978 -0.537 1.00 0.00 C ATOM 2756 O THR B 81 -1.177 10.978 0.065 1.00 0.00 O ATOM 2757 CB THR B 81 -2.000 7.822 0.635 1.00 0.00 C ATOM 2758 OG1 THR B 81 -3.007 6.843 0.849 1.00 0.00 O ATOM 2759 CG2 THR B 81 -1.360 8.198 1.973 1.00 0.00 C ATOM 0 H THR B 81 -3.571 7.650 -1.291 1.00 0.00 H new ATOM 0 HA THR B 81 -3.215 9.594 0.745 1.00 0.00 H new ATOM 0 HB THR B 81 -1.236 7.419 -0.030 1.00 0.00 H new ATOM 0 HG1 THR B 81 -3.142 6.327 0.027 1.00 0.00 H new ATOM 0 HG21 THR B 81 -0.916 7.312 2.426 1.00 0.00 H new ATOM 0 HG22 THR B 81 -0.586 8.948 1.808 1.00 0.00 H new ATOM 0 HG23 THR B 81 -2.121 8.603 2.640 1.00 0.00 H new ATOM 2767 N THR B 82 -0.960 9.638 -1.667 1.00 0.00 N ATOM 2768 CA THR B 82 0.123 10.474 -2.259 1.00 0.00 C ATOM 2769 C THR B 82 -0.473 11.756 -2.849 1.00 0.00 C ATOM 2770 O THR B 82 0.216 12.739 -3.041 1.00 0.00 O ATOM 2771 CB THR B 82 0.829 9.687 -3.366 1.00 0.00 C ATOM 2772 OG1 THR B 82 -0.130 9.260 -4.322 1.00 0.00 O ATOM 2773 CG2 THR B 82 1.531 8.469 -2.763 1.00 0.00 C ATOM 0 H THR B 82 -1.210 8.811 -2.209 1.00 0.00 H new ATOM 0 HA THR B 82 0.840 10.735 -1.480 1.00 0.00 H new ATOM 0 HB THR B 82 1.569 10.324 -3.851 1.00 0.00 H new ATOM 0 HG1 THR B 82 -0.458 8.369 -4.081 1.00 0.00 H new ATOM 0 HG21 THR B 82 2.033 7.910 -3.553 1.00 0.00 H new ATOM 0 HG22 THR B 82 2.266 8.799 -2.029 1.00 0.00 H new ATOM 0 HG23 THR B 82 0.795 7.829 -2.277 1.00 0.00 H new ATOM 2781 N ALA B 83 -1.746 11.756 -3.141 1.00 0.00 N ATOM 2782 CA ALA B 83 -2.378 12.978 -3.719 1.00 0.00 C ATOM 2783 C ALA B 83 -2.154 14.160 -2.777 1.00 0.00 C ATOM 2784 O ALA B 83 -2.120 15.301 -3.193 1.00 0.00 O ATOM 2785 CB ALA B 83 -3.880 12.749 -3.891 1.00 0.00 C ATOM 0 H ALA B 83 -2.375 10.965 -3.005 1.00 0.00 H new ATOM 0 HA ALA B 83 -1.929 13.190 -4.689 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -4.338 13.643 -4.313 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -4.045 11.906 -4.561 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -4.329 12.535 -2.921 1.00 0.00 H new