USER MOD reduce.3.24.130724 H: found=0, std=0, add=1306, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1306 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 57 MET CE :methyl -173:sc= -0.0393 (180deg=-0.141) USER MOD Set 1.2: B 68 CYS SG : rot -14:sc= 0.96 USER MOD Set 2.1: B 15 HIS : no HD1:sc= -0.901 X(o=-0.99,f=-1.4) USER MOD Set 2.2: B 25 HIS : no HD1:sc= -0.0852 X(o=-0.99,f=-0.82) USER MOD Set 3.1: A 81 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: B 74 MET CE :methyl -152:sc= -0.182 (180deg=-1) USER MOD Set 4.1: A 74 MET CE :methyl -155:sc= -0.175 (180deg=-0.949) USER MOD Set 4.2: B 81 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 57 MET CE :methyl -176:sc= -0.0365 (180deg=-0.0885) USER MOD Set 5.2: A 68 CYS SG : rot 2:sc= 0.995 USER MOD Set 6.1: A 15 HIS : no HD1:sc= -0.842 X(o=-0.88,f=-1.2) USER MOD Set 6.2: A 25 HIS : no HD1:sc= -0.0408 X(o=-0.88,f=-0.79) USER MOD Single : A 1 SER N :NH3+ 145:sc= 0.0779 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0374 USER MOD Single : A 5 LYS NZ :NH3+ -126:sc= -0.851 (180deg=-2.73!) USER MOD Single : A 7 MET CE :methyl -139:sc= -0.407 (180deg=-2.36!) USER MOD Single : A 16 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 17 TYR OH : rot 1:sc= -3.43! USER MOD Single : A 18 SER OG : rot 82:sc= 1.03 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 147:sc= -0.166 (180deg=-0.85) USER MOD Single : A 29 LYS NZ :NH3+ 176:sc= -0.641 (180deg=-0.652) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 158:sc= -0.794 (180deg=-1.43) USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=-0.03) USER MOD Single : A 38 ASN : amide:sc= -0.479 K(o=-0.48,f=-2.5!) USER MOD Single : A 41 SER OG : rot -146:sc= 0.052 USER MOD Single : A 42 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc=-0.000778 K(o=-0.00078,f=-1.5!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 80:sc= 0.0152 USER MOD Single : A 71 GLN : amide:sc= -0.0477 K(o=-0.048,f=-1.7!) USER MOD Single : A 78 SER OG : rot -50:sc= 0.398! USER MOD Single : A 79 MET CE :methyl -130:sc= -0.108 (180deg=-0.857) USER MOD Single : A 82 THR OG1 : rot 180:sc= -0.505 USER MOD Single : A 84 CYS SG : rot 180:sc= 0 USER MOD Single : B 1 SER N :NH3+ 150:sc= 0.0686 (180deg=0) USER MOD Single : B 1 SER OG : rot 180:sc= 0.0338 USER MOD Single : B 5 LYS NZ :NH3+ -126:sc= -1 (180deg=-3.2!) USER MOD Single : B 7 MET CE :methyl -140:sc= -0.484 (180deg=-2.72!) USER MOD Single : B 16 GLN : amide:sc=-0.00403 K(o=-0.004,f=-1.5!) USER MOD Single : B 17 TYR OH : rot 8:sc= -3.52! USER MOD Single : B 18 SER OG : rot 81:sc= 1.11 USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 LYS NZ :NH3+ 158:sc= -0.201 (180deg=-0.991) USER MOD Single : B 29 LYS NZ :NH3+ 179:sc= -0.869 (180deg=-0.875) USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 33 LYS NZ :NH3+ 159:sc= -0.922 (180deg=-1.58) USER MOD Single : B 37 ASN : amide:sc= 0 X(o=0,f=-0.059) USER MOD Single : B 38 ASN : amide:sc= -0.531 K(o=-0.53,f=-2.3!) USER MOD Single : B 41 SER OG : rot -149:sc= 0.00876 USER MOD Single : B 42 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 GLN : amide:sc=-0.00692 K(o=-0.0069,f=-1.8!) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 59 THR OG1 : rot 81:sc= 0.013 USER MOD Single : B 71 GLN : amide:sc= -0.0446 K(o=-0.045,f=-2!) USER MOD Single : B 78 SER OG : rot -50:sc= 0.408 USER MOD Single : B 79 MET CE :methyl -153:sc= -0.156 (180deg=-1.08) USER MOD Single : B 82 THR OG1 : rot -20:sc= -0.468 USER MOD Single : B 84 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 66.819 13.102 -10.020 1.00 0.00 N ATOM 2 CA SER A 1 67.898 12.150 -10.410 1.00 0.00 C ATOM 3 C SER A 1 67.425 10.713 -10.174 1.00 0.00 C ATOM 4 O SER A 1 66.739 10.425 -9.214 1.00 0.00 O ATOM 5 CB SER A 1 69.146 12.422 -9.568 1.00 0.00 C ATOM 6 OG SER A 1 69.478 13.802 -9.651 1.00 0.00 O ATOM 0 H1 SER A 1 67.243 13.959 -9.612 1.00 0.00 H new ATOM 0 H2 SER A 1 66.261 13.357 -10.860 1.00 0.00 H new ATOM 0 H3 SER A 1 66.199 12.654 -9.316 1.00 0.00 H new ATOM 0 HA SER A 1 68.135 12.283 -11.466 1.00 0.00 H new ATOM 0 HB2 SER A 1 68.967 12.141 -8.530 1.00 0.00 H new ATOM 0 HB3 SER A 1 69.978 11.814 -9.923 1.00 0.00 H new ATOM 0 HG SER A 1 70.276 13.979 -9.111 1.00 0.00 H new ATOM 14 N GLU A 2 67.771 9.811 -11.054 1.00 0.00 N ATOM 15 CA GLU A 2 67.323 8.397 -10.900 1.00 0.00 C ATOM 16 C GLU A 2 67.840 7.816 -9.582 1.00 0.00 C ATOM 17 O GLU A 2 67.166 7.033 -8.944 1.00 0.00 O ATOM 18 CB GLU A 2 67.860 7.561 -12.069 1.00 0.00 C ATOM 19 CG GLU A 2 67.397 6.108 -11.914 1.00 0.00 C ATOM 20 CD GLU A 2 67.791 5.305 -13.154 1.00 0.00 C ATOM 21 OE1 GLU A 2 68.259 5.910 -14.105 1.00 0.00 O ATOM 22 OE2 GLU A 2 67.614 4.098 -13.135 1.00 0.00 O ATOM 0 H GLU A 2 68.347 9.994 -11.876 1.00 0.00 H new ATOM 0 HA GLU A 2 66.233 8.371 -10.896 1.00 0.00 H new ATOM 0 HB2 GLU A 2 67.504 7.968 -13.015 1.00 0.00 H new ATOM 0 HB3 GLU A 2 68.949 7.606 -12.092 1.00 0.00 H new ATOM 0 HG2 GLU A 2 67.847 5.666 -11.025 1.00 0.00 H new ATOM 0 HG3 GLU A 2 66.316 6.074 -11.775 1.00 0.00 H new ATOM 29 N LEU A 3 69.021 8.178 -9.159 1.00 0.00 N ATOM 30 CA LEU A 3 69.545 7.623 -7.876 1.00 0.00 C ATOM 31 C LEU A 3 68.715 8.153 -6.702 1.00 0.00 C ATOM 32 O LEU A 3 68.514 7.469 -5.719 1.00 0.00 O ATOM 33 CB LEU A 3 71.012 8.043 -7.679 1.00 0.00 C ATOM 34 CG LEU A 3 71.948 7.245 -8.604 1.00 0.00 C ATOM 35 CD1 LEU A 3 72.057 5.782 -8.141 1.00 0.00 C ATOM 36 CD2 LEU A 3 71.426 7.292 -10.043 1.00 0.00 C ATOM 0 H LEU A 3 69.642 8.828 -9.641 1.00 0.00 H new ATOM 0 HA LEU A 3 69.478 6.536 -7.914 1.00 0.00 H new ATOM 0 HB2 LEU A 3 71.118 9.109 -7.881 1.00 0.00 H new ATOM 0 HB3 LEU A 3 71.302 7.885 -6.640 1.00 0.00 H new ATOM 0 HG LEU A 3 72.938 7.698 -8.562 1.00 0.00 H new ATOM 0 HD11 LEU A 3 72.724 5.237 -8.810 1.00 0.00 H new ATOM 0 HD12 LEU A 3 72.455 5.750 -7.127 1.00 0.00 H new ATOM 0 HD13 LEU A 3 71.070 5.320 -8.158 1.00 0.00 H new ATOM 0 HD21 LEU A 3 72.094 6.725 -10.691 1.00 0.00 H new ATOM 0 HD22 LEU A 3 70.427 6.857 -10.082 1.00 0.00 H new ATOM 0 HD23 LEU A 3 71.385 8.327 -10.381 1.00 0.00 H new ATOM 48 N GLU A 4 68.226 9.360 -6.794 1.00 0.00 N ATOM 49 CA GLU A 4 67.406 9.917 -5.680 1.00 0.00 C ATOM 50 C GLU A 4 66.172 9.043 -5.456 1.00 0.00 C ATOM 51 O GLU A 4 65.806 8.740 -4.339 1.00 0.00 O ATOM 52 CB GLU A 4 66.981 11.345 -6.039 1.00 0.00 C ATOM 53 CG GLU A 4 66.133 11.945 -4.914 1.00 0.00 C ATOM 54 CD GLU A 4 65.760 13.383 -5.277 1.00 0.00 C ATOM 55 OE1 GLU A 4 66.305 13.890 -6.245 1.00 0.00 O ATOM 56 OE2 GLU A 4 64.936 13.955 -4.582 1.00 0.00 O ATOM 0 H GLU A 4 68.358 9.983 -7.590 1.00 0.00 H new ATOM 0 HA GLU A 4 67.994 9.932 -4.762 1.00 0.00 H new ATOM 0 HB2 GLU A 4 67.863 11.963 -6.208 1.00 0.00 H new ATOM 0 HB3 GLU A 4 66.413 11.340 -6.969 1.00 0.00 H new ATOM 0 HG2 GLU A 4 65.232 11.350 -4.764 1.00 0.00 H new ATOM 0 HG3 GLU A 4 66.687 11.926 -3.975 1.00 0.00 H new ATOM 63 N LYS A 5 65.520 8.650 -6.512 1.00 0.00 N ATOM 64 CA LYS A 5 64.300 7.807 -6.377 1.00 0.00 C ATOM 65 C LYS A 5 64.642 6.487 -5.686 1.00 0.00 C ATOM 66 O LYS A 5 63.879 5.974 -4.893 1.00 0.00 O ATOM 67 CB LYS A 5 63.729 7.516 -7.767 1.00 0.00 C ATOM 68 CG LYS A 5 63.153 8.801 -8.365 1.00 0.00 C ATOM 69 CD LYS A 5 62.593 8.511 -9.765 1.00 0.00 C ATOM 70 CE LYS A 5 61.343 7.617 -9.677 1.00 0.00 C ATOM 71 NZ LYS A 5 61.749 6.184 -9.738 1.00 0.00 N ATOM 0 H LYS A 5 65.781 8.878 -7.471 1.00 0.00 H new ATOM 0 HA LYS A 5 63.564 8.342 -5.777 1.00 0.00 H new ATOM 0 HB2 LYS A 5 64.510 7.119 -8.416 1.00 0.00 H new ATOM 0 HB3 LYS A 5 62.952 6.754 -7.700 1.00 0.00 H new ATOM 0 HG2 LYS A 5 62.366 9.193 -7.721 1.00 0.00 H new ATOM 0 HG3 LYS A 5 63.927 9.566 -8.423 1.00 0.00 H new ATOM 0 HD2 LYS A 5 62.342 9.448 -10.263 1.00 0.00 H new ATOM 0 HD3 LYS A 5 63.354 8.021 -10.372 1.00 0.00 H new ATOM 0 HE2 LYS A 5 60.807 7.814 -8.749 1.00 0.00 H new ATOM 0 HE3 LYS A 5 60.660 7.847 -10.495 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 61.225 5.707 -10.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 62.770 6.120 -9.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 61.536 5.724 -8.830 1.00 0.00 H new ATOM 85 N ALA A 6 65.774 5.923 -5.997 1.00 0.00 N ATOM 86 CA ALA A 6 66.147 4.625 -5.372 1.00 0.00 C ATOM 87 C ALA A 6 66.218 4.787 -3.854 1.00 0.00 C ATOM 88 O ALA A 6 65.652 4.005 -3.114 1.00 0.00 O ATOM 89 CB ALA A 6 67.514 4.178 -5.901 1.00 0.00 C ATOM 0 H ALA A 6 66.455 6.303 -6.654 1.00 0.00 H new ATOM 0 HA ALA A 6 65.396 3.875 -5.621 1.00 0.00 H new ATOM 0 HB1 ALA A 6 67.788 3.227 -5.444 1.00 0.00 H new ATOM 0 HB2 ALA A 6 67.464 4.059 -6.983 1.00 0.00 H new ATOM 0 HB3 ALA A 6 68.264 4.929 -5.653 1.00 0.00 H new ATOM 95 N MET A 7 66.903 5.789 -3.375 1.00 0.00 N ATOM 96 CA MET A 7 66.992 5.976 -1.899 1.00 0.00 C ATOM 97 C MET A 7 65.618 6.363 -1.343 1.00 0.00 C ATOM 98 O MET A 7 65.184 5.858 -0.327 1.00 0.00 O ATOM 99 CB MET A 7 67.993 7.090 -1.586 1.00 0.00 C ATOM 100 CG MET A 7 69.404 6.616 -1.938 1.00 0.00 C ATOM 101 SD MET A 7 70.599 7.928 -1.570 1.00 0.00 S ATOM 102 CE MET A 7 70.098 9.089 -2.869 1.00 0.00 C ATOM 0 H MET A 7 67.401 6.481 -3.936 1.00 0.00 H new ATOM 0 HA MET A 7 67.321 5.045 -1.439 1.00 0.00 H new ATOM 0 HB2 MET A 7 67.746 7.987 -2.154 1.00 0.00 H new ATOM 0 HB3 MET A 7 67.939 7.357 -0.530 1.00 0.00 H new ATOM 0 HG2 MET A 7 69.649 5.718 -1.370 1.00 0.00 H new ATOM 0 HG3 MET A 7 69.456 6.349 -2.994 1.00 0.00 H new ATOM 0 HE1 MET A 7 70.984 9.537 -3.318 1.00 0.00 H new ATOM 0 HE2 MET A 7 69.533 8.557 -3.634 1.00 0.00 H new ATOM 0 HE3 MET A 7 69.475 9.872 -2.437 1.00 0.00 H new ATOM 112 N VAL A 8 64.938 7.273 -1.990 1.00 0.00 N ATOM 113 CA VAL A 8 63.603 7.707 -1.483 1.00 0.00 C ATOM 114 C VAL A 8 62.642 6.514 -1.432 1.00 0.00 C ATOM 115 O VAL A 8 61.865 6.379 -0.507 1.00 0.00 O ATOM 116 CB VAL A 8 63.025 8.787 -2.413 1.00 0.00 C ATOM 117 CG1 VAL A 8 61.563 9.074 -2.035 1.00 0.00 C ATOM 118 CG2 VAL A 8 63.852 10.070 -2.276 1.00 0.00 C ATOM 0 H VAL A 8 65.249 7.733 -2.846 1.00 0.00 H new ATOM 0 HA VAL A 8 63.722 8.112 -0.478 1.00 0.00 H new ATOM 0 HB VAL A 8 63.064 8.434 -3.444 1.00 0.00 H new ATOM 0 HG11 VAL A 8 61.160 9.840 -2.697 1.00 0.00 H new ATOM 0 HG12 VAL A 8 60.975 8.161 -2.135 1.00 0.00 H new ATOM 0 HG13 VAL A 8 61.516 9.425 -1.004 1.00 0.00 H new ATOM 0 HG21 VAL A 8 63.445 10.837 -2.934 1.00 0.00 H new ATOM 0 HG22 VAL A 8 63.814 10.419 -1.244 1.00 0.00 H new ATOM 0 HG23 VAL A 8 64.887 9.867 -2.552 1.00 0.00 H new ATOM 128 N ALA A 9 62.665 5.658 -2.416 1.00 0.00 N ATOM 129 CA ALA A 9 61.726 4.499 -2.404 1.00 0.00 C ATOM 130 C ALA A 9 61.967 3.631 -1.168 1.00 0.00 C ATOM 131 O ALA A 9 61.039 3.180 -0.528 1.00 0.00 O ATOM 132 CB ALA A 9 61.925 3.655 -3.664 1.00 0.00 C ATOM 0 H ALA A 9 63.288 5.709 -3.222 1.00 0.00 H new ATOM 0 HA ALA A 9 60.705 4.880 -2.378 1.00 0.00 H new ATOM 0 HB1 ALA A 9 61.236 2.810 -3.649 1.00 0.00 H new ATOM 0 HB2 ALA A 9 61.731 4.266 -4.546 1.00 0.00 H new ATOM 0 HB3 ALA A 9 62.950 3.286 -3.697 1.00 0.00 H new ATOM 138 N LEU A 10 63.201 3.379 -0.838 1.00 0.00 N ATOM 139 CA LEU A 10 63.489 2.524 0.348 1.00 0.00 C ATOM 140 C LEU A 10 62.903 3.161 1.613 1.00 0.00 C ATOM 141 O LEU A 10 62.276 2.495 2.415 1.00 0.00 O ATOM 142 CB LEU A 10 65.004 2.380 0.509 1.00 0.00 C ATOM 143 CG LEU A 10 65.592 1.599 -0.681 1.00 0.00 C ATOM 144 CD1 LEU A 10 67.122 1.686 -0.640 1.00 0.00 C ATOM 145 CD2 LEU A 10 65.168 0.117 -0.619 1.00 0.00 C ATOM 0 H LEU A 10 64.021 3.726 -1.335 1.00 0.00 H new ATOM 0 HA LEU A 10 63.035 1.544 0.201 1.00 0.00 H new ATOM 0 HB2 LEU A 10 65.466 3.365 0.571 1.00 0.00 H new ATOM 0 HB3 LEU A 10 65.231 1.862 1.441 1.00 0.00 H new ATOM 0 HG LEU A 10 65.216 2.036 -1.606 1.00 0.00 H new ATOM 0 HD11 LEU A 10 67.541 1.134 -1.481 1.00 0.00 H new ATOM 0 HD12 LEU A 10 67.429 2.730 -0.702 1.00 0.00 H new ATOM 0 HD13 LEU A 10 67.486 1.256 0.293 1.00 0.00 H new ATOM 0 HD21 LEU A 10 65.593 -0.419 -1.468 1.00 0.00 H new ATOM 0 HD22 LEU A 10 65.530 -0.327 0.308 1.00 0.00 H new ATOM 0 HD23 LEU A 10 64.081 0.048 -0.654 1.00 0.00 H new ATOM 157 N ILE A 11 63.099 4.440 1.808 1.00 0.00 N ATOM 158 CA ILE A 11 62.548 5.093 3.032 1.00 0.00 C ATOM 159 C ILE A 11 61.025 4.941 3.041 1.00 0.00 C ATOM 160 O ILE A 11 60.439 4.518 4.019 1.00 0.00 O ATOM 161 CB ILE A 11 62.917 6.585 3.028 1.00 0.00 C ATOM 162 CG1 ILE A 11 64.428 6.742 3.223 1.00 0.00 C ATOM 163 CG2 ILE A 11 62.192 7.303 4.169 1.00 0.00 C ATOM 164 CD1 ILE A 11 64.828 8.199 2.966 1.00 0.00 C ATOM 0 H ILE A 11 63.613 5.056 1.178 1.00 0.00 H new ATOM 0 HA ILE A 11 62.968 4.621 3.920 1.00 0.00 H new ATOM 0 HB ILE A 11 62.620 7.020 2.074 1.00 0.00 H new ATOM 0 HG12 ILE A 11 64.707 6.450 4.236 1.00 0.00 H new ATOM 0 HG13 ILE A 11 64.964 6.081 2.542 1.00 0.00 H new ATOM 0 HG21 ILE A 11 62.458 8.360 4.161 1.00 0.00 H new ATOM 0 HG22 ILE A 11 61.115 7.199 4.038 1.00 0.00 H new ATOM 0 HG23 ILE A 11 62.486 6.862 5.121 1.00 0.00 H new ATOM 0 HD11 ILE A 11 65.903 8.311 3.105 1.00 0.00 H new ATOM 0 HD12 ILE A 11 64.563 8.474 1.945 1.00 0.00 H new ATOM 0 HD13 ILE A 11 64.302 8.849 3.665 1.00 0.00 H new ATOM 176 N ASP A 12 60.380 5.295 1.964 1.00 0.00 N ATOM 177 CA ASP A 12 58.895 5.177 1.920 1.00 0.00 C ATOM 178 C ASP A 12 58.494 3.716 2.133 1.00 0.00 C ATOM 179 O ASP A 12 57.552 3.417 2.839 1.00 0.00 O ATOM 180 CB ASP A 12 58.381 5.658 0.559 1.00 0.00 C ATOM 181 CG ASP A 12 58.545 7.177 0.448 1.00 0.00 C ATOM 182 OD1 ASP A 12 58.776 7.806 1.467 1.00 0.00 O ATOM 183 OD2 ASP A 12 58.438 7.684 -0.658 1.00 0.00 O ATOM 0 H ASP A 12 60.814 5.659 1.116 1.00 0.00 H new ATOM 0 HA ASP A 12 58.459 5.792 2.707 1.00 0.00 H new ATOM 0 HB2 ASP A 12 58.931 5.164 -0.242 1.00 0.00 H new ATOM 0 HB3 ASP A 12 57.332 5.387 0.440 1.00 0.00 H new ATOM 188 N VAL A 13 59.204 2.802 1.530 1.00 0.00 N ATOM 189 CA VAL A 13 58.859 1.362 1.710 1.00 0.00 C ATOM 190 C VAL A 13 59.194 0.933 3.141 1.00 0.00 C ATOM 191 O VAL A 13 58.459 0.197 3.769 1.00 0.00 O ATOM 192 CB VAL A 13 59.663 0.507 0.718 1.00 0.00 C ATOM 193 CG1 VAL A 13 59.499 -0.981 1.066 1.00 0.00 C ATOM 194 CG2 VAL A 13 59.166 0.761 -0.715 1.00 0.00 C ATOM 0 H VAL A 13 60.003 2.988 0.924 1.00 0.00 H new ATOM 0 HA VAL A 13 57.794 1.221 1.526 1.00 0.00 H new ATOM 0 HB VAL A 13 60.716 0.780 0.784 1.00 0.00 H new ATOM 0 HG11 VAL A 13 60.070 -1.585 0.361 1.00 0.00 H new ATOM 0 HG12 VAL A 13 59.865 -1.161 2.077 1.00 0.00 H new ATOM 0 HG13 VAL A 13 58.445 -1.254 1.007 1.00 0.00 H new ATOM 0 HG21 VAL A 13 59.740 0.152 -1.413 1.00 0.00 H new ATOM 0 HG22 VAL A 13 58.111 0.497 -0.786 1.00 0.00 H new ATOM 0 HG23 VAL A 13 59.294 1.815 -0.963 1.00 0.00 H new ATOM 204 N PHE A 14 60.312 1.371 3.649 1.00 0.00 N ATOM 205 CA PHE A 14 60.716 0.973 5.025 1.00 0.00 C ATOM 206 C PHE A 14 59.722 1.500 6.067 1.00 0.00 C ATOM 207 O PHE A 14 59.170 0.746 6.844 1.00 0.00 O ATOM 208 CB PHE A 14 62.098 1.561 5.313 1.00 0.00 C ATOM 209 CG PHE A 14 62.504 1.250 6.734 1.00 0.00 C ATOM 210 CD1 PHE A 14 62.114 2.105 7.770 1.00 0.00 C ATOM 211 CD2 PHE A 14 63.271 0.113 7.013 1.00 0.00 C ATOM 212 CE1 PHE A 14 62.489 1.824 9.088 1.00 0.00 C ATOM 213 CE2 PHE A 14 63.650 -0.166 8.333 1.00 0.00 C ATOM 214 CZ PHE A 14 63.258 0.690 9.370 1.00 0.00 C ATOM 0 H PHE A 14 60.965 1.990 3.168 1.00 0.00 H new ATOM 0 HA PHE A 14 60.733 -0.115 5.087 1.00 0.00 H new ATOM 0 HB2 PHE A 14 62.830 1.149 4.618 1.00 0.00 H new ATOM 0 HB3 PHE A 14 62.083 2.640 5.158 1.00 0.00 H new ATOM 0 HD1 PHE A 14 61.523 2.982 7.552 1.00 0.00 H new ATOM 0 HD2 PHE A 14 63.570 -0.548 6.213 1.00 0.00 H new ATOM 0 HE1 PHE A 14 62.185 2.483 9.888 1.00 0.00 H new ATOM 0 HE2 PHE A 14 64.244 -1.041 8.551 1.00 0.00 H new ATOM 0 HZ PHE A 14 63.549 0.475 10.387 1.00 0.00 H new ATOM 224 N HIS A 15 59.528 2.790 6.129 1.00 0.00 N ATOM 225 CA HIS A 15 58.615 3.356 7.166 1.00 0.00 C ATOM 226 C HIS A 15 57.192 2.815 7.025 1.00 0.00 C ATOM 227 O HIS A 15 56.545 2.529 8.012 1.00 0.00 O ATOM 228 CB HIS A 15 58.590 4.883 7.053 1.00 0.00 C ATOM 229 CG HIS A 15 59.884 5.451 7.572 1.00 0.00 C ATOM 230 ND1 HIS A 15 60.619 6.391 6.863 1.00 0.00 N ATOM 231 CD2 HIS A 15 60.575 5.236 8.738 1.00 0.00 C ATOM 232 CE1 HIS A 15 61.696 6.707 7.606 1.00 0.00 C ATOM 233 NE2 HIS A 15 61.715 6.029 8.755 1.00 0.00 N ATOM 0 H HIS A 15 59.960 3.475 5.509 1.00 0.00 H new ATOM 0 HA HIS A 15 58.996 3.056 8.142 1.00 0.00 H new ATOM 0 HB2 HIS A 15 58.443 5.178 6.014 1.00 0.00 H new ATOM 0 HB3 HIS A 15 57.751 5.286 7.621 1.00 0.00 H new ATOM 0 HD2 HIS A 15 60.278 4.555 9.522 1.00 0.00 H new ATOM 0 HE1 HIS A 15 62.451 7.420 7.309 1.00 0.00 H new ATOM 0 HE2 HIS A 15 62.419 6.082 9.491 1.00 0.00 H new ATOM 242 N GLN A 16 56.680 2.668 5.836 1.00 0.00 N ATOM 243 CA GLN A 16 55.293 2.144 5.705 1.00 0.00 C ATOM 244 C GLN A 16 55.258 0.664 6.095 1.00 0.00 C ATOM 245 O GLN A 16 54.351 0.203 6.759 1.00 0.00 O ATOM 246 CB GLN A 16 54.849 2.290 4.250 1.00 0.00 C ATOM 247 CG GLN A 16 54.644 3.768 3.911 1.00 0.00 C ATOM 248 CD GLN A 16 54.262 3.890 2.435 1.00 0.00 C ATOM 249 OE1 GLN A 16 54.642 3.063 1.629 1.00 0.00 O ATOM 250 NE2 GLN A 16 53.522 4.891 2.042 1.00 0.00 N ATOM 0 H GLN A 16 57.154 2.885 4.959 1.00 0.00 H new ATOM 0 HA GLN A 16 54.627 2.703 6.362 1.00 0.00 H new ATOM 0 HB2 GLN A 16 55.598 1.857 3.587 1.00 0.00 H new ATOM 0 HB3 GLN A 16 53.923 1.739 4.087 1.00 0.00 H new ATOM 0 HG2 GLN A 16 53.862 4.194 4.539 1.00 0.00 H new ATOM 0 HG3 GLN A 16 55.556 4.331 4.112 1.00 0.00 H new ATOM 0 HE21 GLN A 16 53.203 5.585 2.718 1.00 0.00 H new ATOM 0 HE22 GLN A 16 53.263 4.979 1.059 1.00 0.00 H new ATOM 259 N TYR A 17 56.247 -0.082 5.683 1.00 0.00 N ATOM 260 CA TYR A 17 56.276 -1.532 6.030 1.00 0.00 C ATOM 261 C TYR A 17 56.661 -1.700 7.500 1.00 0.00 C ATOM 262 O TYR A 17 56.109 -2.517 8.210 1.00 0.00 O ATOM 263 CB TYR A 17 57.290 -2.276 5.158 1.00 0.00 C ATOM 264 CG TYR A 17 57.252 -3.742 5.528 1.00 0.00 C ATOM 265 CD1 TYR A 17 58.012 -4.208 6.604 1.00 0.00 C ATOM 266 CD2 TYR A 17 56.435 -4.629 4.811 1.00 0.00 C ATOM 267 CE1 TYR A 17 57.963 -5.560 6.966 1.00 0.00 C ATOM 268 CE2 TYR A 17 56.383 -5.981 5.174 1.00 0.00 C ATOM 269 CZ TYR A 17 57.147 -6.447 6.251 1.00 0.00 C ATOM 270 OH TYR A 17 57.095 -7.779 6.611 1.00 0.00 O ATOM 0 H TYR A 17 57.033 0.248 5.123 1.00 0.00 H new ATOM 0 HA TYR A 17 55.284 -1.949 5.854 1.00 0.00 H new ATOM 0 HB2 TYR A 17 57.051 -2.145 4.103 1.00 0.00 H new ATOM 0 HB3 TYR A 17 58.291 -1.872 5.311 1.00 0.00 H new ATOM 0 HD1 TYR A 17 58.638 -3.524 7.158 1.00 0.00 H new ATOM 0 HD2 TYR A 17 55.847 -4.270 3.980 1.00 0.00 H new ATOM 0 HE1 TYR A 17 58.554 -5.919 7.796 1.00 0.00 H new ATOM 0 HE2 TYR A 17 55.754 -6.664 4.623 1.00 0.00 H new ATOM 0 HH TYR A 17 57.669 -7.930 7.391 1.00 0.00 H new ATOM 280 N SER A 18 57.611 -0.932 7.957 1.00 0.00 N ATOM 281 CA SER A 18 58.049 -1.041 9.375 1.00 0.00 C ATOM 282 C SER A 18 56.949 -0.508 10.291 1.00 0.00 C ATOM 283 O SER A 18 56.886 -0.836 11.459 1.00 0.00 O ATOM 284 CB SER A 18 59.324 -0.222 9.573 1.00 0.00 C ATOM 285 OG SER A 18 60.347 -0.740 8.733 1.00 0.00 O ATOM 0 H SER A 18 58.105 -0.230 7.405 1.00 0.00 H new ATOM 0 HA SER A 18 58.245 -2.085 9.619 1.00 0.00 H new ATOM 0 HB2 SER A 18 59.138 0.826 9.336 1.00 0.00 H new ATOM 0 HB3 SER A 18 59.638 -0.262 10.616 1.00 0.00 H new ATOM 0 HG SER A 18 60.241 -0.379 7.828 1.00 0.00 H new ATOM 291 N GLY A 19 56.072 0.305 9.770 1.00 0.00 N ATOM 292 CA GLY A 19 54.965 0.850 10.605 1.00 0.00 C ATOM 293 C GLY A 19 53.790 -0.125 10.565 1.00 0.00 C ATOM 294 O GLY A 19 52.658 0.240 10.816 1.00 0.00 O ATOM 0 H GLY A 19 56.075 0.616 8.799 1.00 0.00 H new ATOM 0 HA2 GLY A 19 55.302 0.992 11.632 1.00 0.00 H new ATOM 0 HA3 GLY A 19 54.657 1.827 10.232 1.00 0.00 H new ATOM 298 N ARG A 20 54.050 -1.369 10.264 1.00 0.00 N ATOM 299 CA ARG A 20 52.951 -2.372 10.225 1.00 0.00 C ATOM 300 C ARG A 20 52.475 -2.662 11.651 1.00 0.00 C ATOM 301 O ARG A 20 51.296 -2.808 11.904 1.00 0.00 O ATOM 302 CB ARG A 20 53.464 -3.658 9.569 1.00 0.00 C ATOM 303 CG ARG A 20 52.338 -4.693 9.509 1.00 0.00 C ATOM 304 CD ARG A 20 52.812 -5.913 8.714 1.00 0.00 C ATOM 305 NE ARG A 20 51.723 -6.929 8.658 1.00 0.00 N ATOM 306 CZ ARG A 20 51.505 -7.702 9.685 1.00 0.00 C ATOM 307 NH1 ARG A 20 52.212 -7.551 10.771 1.00 0.00 N ATOM 308 NH2 ARG A 20 50.580 -8.622 9.629 1.00 0.00 N ATOM 0 H ARG A 20 54.977 -1.733 10.044 1.00 0.00 H new ATOM 0 HA ARG A 20 52.115 -1.983 9.644 1.00 0.00 H new ATOM 0 HB2 ARG A 20 53.828 -3.444 8.564 1.00 0.00 H new ATOM 0 HB3 ARG A 20 54.306 -4.055 10.136 1.00 0.00 H new ATOM 0 HG2 ARG A 20 52.049 -4.991 10.517 1.00 0.00 H new ATOM 0 HG3 ARG A 20 51.455 -4.260 9.039 1.00 0.00 H new ATOM 0 HD2 ARG A 20 53.096 -5.614 7.705 1.00 0.00 H new ATOM 0 HD3 ARG A 20 53.699 -6.341 9.181 1.00 0.00 H new ATOM 0 HE ARG A 20 51.150 -7.019 7.819 1.00 0.00 H new ATOM 0 HH11 ARG A 20 52.932 -6.830 10.814 1.00 0.00 H new ATOM 0 HH12 ARG A 20 52.044 -8.154 11.577 1.00 0.00 H new ATOM 0 HH21 ARG A 20 50.026 -8.737 8.780 1.00 0.00 H new ATOM 0 HH22 ARG A 20 50.412 -9.225 10.434 1.00 0.00 H new ATOM 322 N GLU A 21 53.394 -2.750 12.585 1.00 0.00 N ATOM 323 CA GLU A 21 53.027 -3.036 14.006 1.00 0.00 C ATOM 324 C GLU A 21 53.216 -1.774 14.850 1.00 0.00 C ATOM 325 O GLU A 21 53.921 -0.860 14.473 1.00 0.00 O ATOM 326 CB GLU A 21 53.928 -4.150 14.551 1.00 0.00 C ATOM 327 CG GLU A 21 53.576 -5.477 13.873 1.00 0.00 C ATOM 328 CD GLU A 21 52.171 -5.917 14.295 1.00 0.00 C ATOM 329 OE1 GLU A 21 51.747 -5.526 15.369 1.00 0.00 O ATOM 330 OE2 GLU A 21 51.541 -6.632 13.532 1.00 0.00 O ATOM 0 H GLU A 21 54.394 -2.634 12.419 1.00 0.00 H new ATOM 0 HA GLU A 21 51.985 -3.351 14.053 1.00 0.00 H new ATOM 0 HB2 GLU A 21 54.975 -3.905 14.371 1.00 0.00 H new ATOM 0 HB3 GLU A 21 53.802 -4.237 15.630 1.00 0.00 H new ATOM 0 HG2 GLU A 21 53.623 -5.366 12.790 1.00 0.00 H new ATOM 0 HG3 GLU A 21 54.304 -6.241 14.147 1.00 0.00 H new ATOM 337 N GLY A 22 52.582 -1.719 15.990 1.00 0.00 N ATOM 338 CA GLY A 22 52.711 -0.521 16.868 1.00 0.00 C ATOM 339 C GLY A 22 54.180 -0.104 16.981 1.00 0.00 C ATOM 340 O GLY A 22 54.490 0.996 17.391 1.00 0.00 O ATOM 0 H GLY A 22 51.977 -2.456 16.352 1.00 0.00 H new ATOM 0 HA2 GLY A 22 52.122 0.302 16.462 1.00 0.00 H new ATOM 0 HA3 GLY A 22 52.311 -0.742 17.858 1.00 0.00 H new ATOM 344 N ASP A 23 55.091 -0.971 16.624 1.00 0.00 N ATOM 345 CA ASP A 23 56.539 -0.612 16.720 1.00 0.00 C ATOM 346 C ASP A 23 56.969 0.116 15.442 1.00 0.00 C ATOM 347 O ASP A 23 57.097 -0.482 14.392 1.00 0.00 O ATOM 348 CB ASP A 23 57.368 -1.889 16.882 1.00 0.00 C ATOM 349 CG ASP A 23 57.119 -2.488 18.268 1.00 0.00 C ATOM 350 OD1 ASP A 23 56.606 -1.776 19.115 1.00 0.00 O ATOM 351 OD2 ASP A 23 57.452 -3.646 18.460 1.00 0.00 O ATOM 0 H ASP A 23 54.897 -1.908 16.271 1.00 0.00 H new ATOM 0 HA ASP A 23 56.698 0.038 17.580 1.00 0.00 H new ATOM 0 HB2 ASP A 23 57.100 -2.610 16.109 1.00 0.00 H new ATOM 0 HB3 ASP A 23 58.427 -1.666 16.756 1.00 0.00 H new ATOM 356 N LYS A 24 57.191 1.407 15.525 1.00 0.00 N ATOM 357 CA LYS A 24 57.610 2.187 14.314 1.00 0.00 C ATOM 358 C LYS A 24 59.125 2.425 14.329 1.00 0.00 C ATOM 359 O LYS A 24 59.674 2.942 15.281 1.00 0.00 O ATOM 360 CB LYS A 24 56.888 3.541 14.304 1.00 0.00 C ATOM 361 CG LYS A 24 57.221 4.290 13.008 1.00 0.00 C ATOM 362 CD LYS A 24 56.505 5.644 12.992 1.00 0.00 C ATOM 363 CE LYS A 24 56.847 6.380 11.693 1.00 0.00 C ATOM 364 NZ LYS A 24 56.101 7.671 11.634 1.00 0.00 N ATOM 0 H LYS A 24 57.100 1.956 16.380 1.00 0.00 H new ATOM 0 HA LYS A 24 57.348 1.618 13.422 1.00 0.00 H new ATOM 0 HB2 LYS A 24 55.811 3.391 14.383 1.00 0.00 H new ATOM 0 HB3 LYS A 24 57.192 4.133 15.167 1.00 0.00 H new ATOM 0 HG2 LYS A 24 58.298 4.437 12.929 1.00 0.00 H new ATOM 0 HG3 LYS A 24 56.916 3.697 12.146 1.00 0.00 H new ATOM 0 HD2 LYS A 24 55.427 5.500 13.069 1.00 0.00 H new ATOM 0 HD3 LYS A 24 56.809 6.240 13.852 1.00 0.00 H new ATOM 0 HE2 LYS A 24 57.920 6.566 11.641 1.00 0.00 H new ATOM 0 HE3 LYS A 24 56.589 5.760 10.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 56.336 8.168 10.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 55.079 7.483 11.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 56.368 8.264 12.446 1.00 0.00 H new ATOM 378 N HIS A 25 59.796 2.051 13.269 1.00 0.00 N ATOM 379 CA HIS A 25 61.273 2.243 13.179 1.00 0.00 C ATOM 380 C HIS A 25 61.989 1.164 13.999 1.00 0.00 C ATOM 381 O HIS A 25 62.962 1.425 14.680 1.00 0.00 O ATOM 382 CB HIS A 25 61.639 3.647 13.695 1.00 0.00 C ATOM 383 CG HIS A 25 62.858 4.170 12.973 1.00 0.00 C ATOM 384 ND1 HIS A 25 64.130 4.119 13.528 1.00 0.00 N ATOM 385 CD2 HIS A 25 63.014 4.748 11.735 1.00 0.00 C ATOM 386 CE1 HIS A 25 64.986 4.648 12.633 1.00 0.00 C ATOM 387 NE2 HIS A 25 64.356 5.045 11.526 1.00 0.00 N ATOM 0 H HIS A 25 59.374 1.614 12.450 1.00 0.00 H new ATOM 0 HA HIS A 25 61.591 2.155 12.140 1.00 0.00 H new ATOM 0 HB2 HIS A 25 60.800 4.327 13.546 1.00 0.00 H new ATOM 0 HB3 HIS A 25 61.832 3.609 14.767 1.00 0.00 H new ATOM 0 HD2 HIS A 25 62.216 4.942 11.033 1.00 0.00 H new ATOM 0 HE1 HIS A 25 66.050 4.740 12.792 1.00 0.00 H new ATOM 0 HE2 HIS A 25 64.772 5.476 10.700 1.00 0.00 H new ATOM 396 N LYS A 26 61.522 -0.050 13.921 1.00 0.00 N ATOM 397 CA LYS A 26 62.174 -1.158 14.672 1.00 0.00 C ATOM 398 C LYS A 26 61.738 -2.480 14.035 1.00 0.00 C ATOM 399 O LYS A 26 60.563 -2.779 13.964 1.00 0.00 O ATOM 400 CB LYS A 26 61.745 -1.108 16.150 1.00 0.00 C ATOM 401 CG LYS A 26 62.776 -1.844 17.028 1.00 0.00 C ATOM 402 CD LYS A 26 63.967 -0.918 17.332 1.00 0.00 C ATOM 403 CE LYS A 26 64.891 -1.578 18.356 1.00 0.00 C ATOM 404 NZ LYS A 26 65.964 -0.616 18.736 1.00 0.00 N ATOM 0 H LYS A 26 60.711 -0.324 13.366 1.00 0.00 H new ATOM 0 HA LYS A 26 63.259 -1.064 14.629 1.00 0.00 H new ATOM 0 HB2 LYS A 26 61.653 -0.072 16.475 1.00 0.00 H new ATOM 0 HB3 LYS A 26 60.763 -1.567 16.267 1.00 0.00 H new ATOM 0 HG2 LYS A 26 62.309 -2.166 17.959 1.00 0.00 H new ATOM 0 HG3 LYS A 26 63.124 -2.742 16.518 1.00 0.00 H new ATOM 0 HD2 LYS A 26 64.518 -0.707 16.415 1.00 0.00 H new ATOM 0 HD3 LYS A 26 63.608 0.037 17.716 1.00 0.00 H new ATOM 0 HE2 LYS A 26 64.323 -1.876 19.238 1.00 0.00 H new ATOM 0 HE3 LYS A 26 65.329 -2.484 17.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 66.596 -1.059 19.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 66.510 -0.353 17.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 65.535 0.236 19.150 1.00 0.00 H new ATOM 418 N LEU A 27 62.669 -3.264 13.544 1.00 0.00 N ATOM 419 CA LEU A 27 62.289 -4.555 12.883 1.00 0.00 C ATOM 420 C LEU A 27 62.437 -5.714 13.871 1.00 0.00 C ATOM 421 O LEU A 27 63.524 -6.066 14.286 1.00 0.00 O ATOM 422 CB LEU A 27 63.204 -4.800 11.672 1.00 0.00 C ATOM 423 CG LEU A 27 62.774 -3.926 10.477 1.00 0.00 C ATOM 424 CD1 LEU A 27 61.434 -4.415 9.894 1.00 0.00 C ATOM 425 CD2 LEU A 27 62.639 -2.467 10.919 1.00 0.00 C ATOM 0 H LEU A 27 63.670 -3.068 13.572 1.00 0.00 H new ATOM 0 HA LEU A 27 61.251 -4.494 12.555 1.00 0.00 H new ATOM 0 HB2 LEU A 27 64.237 -4.576 11.939 1.00 0.00 H new ATOM 0 HB3 LEU A 27 63.169 -5.852 11.390 1.00 0.00 H new ATOM 0 HG LEU A 27 63.539 -4.004 9.704 1.00 0.00 H new ATOM 0 HD11 LEU A 27 61.151 -3.783 9.052 1.00 0.00 H new ATOM 0 HD12 LEU A 27 61.539 -5.446 9.555 1.00 0.00 H new ATOM 0 HD13 LEU A 27 60.662 -4.363 10.662 1.00 0.00 H new ATOM 0 HD21 LEU A 27 62.335 -1.856 10.069 1.00 0.00 H new ATOM 0 HD22 LEU A 27 61.888 -2.393 11.706 1.00 0.00 H new ATOM 0 HD23 LEU A 27 63.597 -2.111 11.297 1.00 0.00 H new ATOM 437 N LYS A 28 61.337 -6.316 14.235 1.00 0.00 N ATOM 438 CA LYS A 28 61.376 -7.467 15.184 1.00 0.00 C ATOM 439 C LYS A 28 61.584 -8.768 14.395 1.00 0.00 C ATOM 440 O LYS A 28 61.348 -8.827 13.205 1.00 0.00 O ATOM 441 CB LYS A 28 60.059 -7.529 15.967 1.00 0.00 C ATOM 442 CG LYS A 28 60.187 -8.544 17.107 1.00 0.00 C ATOM 443 CD LYS A 28 58.879 -8.608 17.892 1.00 0.00 C ATOM 444 CE LYS A 28 59.026 -9.625 19.025 1.00 0.00 C ATOM 445 NZ LYS A 28 60.194 -9.256 19.874 1.00 0.00 N ATOM 0 H LYS A 28 60.404 -6.058 13.913 1.00 0.00 H new ATOM 0 HA LYS A 28 62.200 -7.339 15.886 1.00 0.00 H new ATOM 0 HB2 LYS A 28 59.816 -6.545 16.368 1.00 0.00 H new ATOM 0 HB3 LYS A 28 59.242 -7.813 15.303 1.00 0.00 H new ATOM 0 HG2 LYS A 28 60.429 -9.528 16.705 1.00 0.00 H new ATOM 0 HG3 LYS A 28 61.005 -8.260 17.769 1.00 0.00 H new ATOM 0 HD2 LYS A 28 58.635 -7.626 18.297 1.00 0.00 H new ATOM 0 HD3 LYS A 28 58.059 -8.894 17.234 1.00 0.00 H new ATOM 0 HE2 LYS A 28 58.118 -9.649 19.627 1.00 0.00 H new ATOM 0 HE3 LYS A 28 59.162 -10.626 18.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 60.004 -9.524 20.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 61.041 -9.756 19.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 60.353 -8.230 19.818 1.00 0.00 H new ATOM 459 N LYS A 29 62.030 -9.807 15.050 1.00 0.00 N ATOM 460 CA LYS A 29 62.265 -11.101 14.343 1.00 0.00 C ATOM 461 C LYS A 29 60.977 -11.543 13.634 1.00 0.00 C ATOM 462 O LYS A 29 60.982 -11.854 12.460 1.00 0.00 O ATOM 463 CB LYS A 29 62.653 -12.152 15.387 1.00 0.00 C ATOM 464 CG LYS A 29 62.943 -13.494 14.711 1.00 0.00 C ATOM 465 CD LYS A 29 63.318 -14.518 15.782 1.00 0.00 C ATOM 466 CE LYS A 29 63.561 -15.883 15.133 1.00 0.00 C ATOM 467 NZ LYS A 29 63.471 -16.945 16.176 1.00 0.00 N ATOM 0 H LYS A 29 62.242 -9.816 16.048 1.00 0.00 H new ATOM 0 HA LYS A 29 63.057 -10.986 13.603 1.00 0.00 H new ATOM 0 HB2 LYS A 29 63.532 -11.818 15.939 1.00 0.00 H new ATOM 0 HB3 LYS A 29 61.847 -12.269 16.111 1.00 0.00 H new ATOM 0 HG2 LYS A 29 62.069 -13.833 14.156 1.00 0.00 H new ATOM 0 HG3 LYS A 29 63.755 -13.386 13.992 1.00 0.00 H new ATOM 0 HD2 LYS A 29 64.213 -14.192 16.312 1.00 0.00 H new ATOM 0 HD3 LYS A 29 62.520 -14.593 16.521 1.00 0.00 H new ATOM 0 HE2 LYS A 29 62.825 -16.063 14.350 1.00 0.00 H new ATOM 0 HE3 LYS A 29 64.542 -15.904 14.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 63.568 -17.879 15.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 64.232 -16.813 16.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 62.550 -16.884 16.655 1.00 0.00 H new ATOM 481 N SER A 30 59.870 -11.553 14.327 1.00 0.00 N ATOM 482 CA SER A 30 58.587 -11.952 13.677 1.00 0.00 C ATOM 483 C SER A 30 58.302 -10.972 12.538 1.00 0.00 C ATOM 484 O SER A 30 57.859 -11.343 11.468 1.00 0.00 O ATOM 485 CB SER A 30 57.452 -11.898 14.703 1.00 0.00 C ATOM 486 OG SER A 30 56.279 -12.471 14.139 1.00 0.00 O ATOM 0 H SER A 30 59.798 -11.303 15.313 1.00 0.00 H new ATOM 0 HA SER A 30 58.660 -12.968 13.288 1.00 0.00 H new ATOM 0 HB2 SER A 30 57.737 -12.439 15.606 1.00 0.00 H new ATOM 0 HB3 SER A 30 57.261 -10.866 14.997 1.00 0.00 H new ATOM 0 HG SER A 30 55.551 -12.439 14.795 1.00 0.00 H new ATOM 492 N GLU A 31 58.572 -9.720 12.775 1.00 0.00 N ATOM 493 CA GLU A 31 58.353 -8.678 11.734 1.00 0.00 C ATOM 494 C GLU A 31 59.384 -8.867 10.617 1.00 0.00 C ATOM 495 O GLU A 31 59.125 -8.600 9.459 1.00 0.00 O ATOM 496 CB GLU A 31 58.506 -7.294 12.371 1.00 0.00 C ATOM 497 CG GLU A 31 58.254 -6.204 11.326 1.00 0.00 C ATOM 498 CD GLU A 31 58.402 -4.833 11.987 1.00 0.00 C ATOM 499 OE1 GLU A 31 58.537 -4.794 13.198 1.00 0.00 O ATOM 500 OE2 GLU A 31 58.378 -3.845 11.270 1.00 0.00 O ATOM 0 H GLU A 31 58.941 -9.369 13.659 1.00 0.00 H new ATOM 0 HA GLU A 31 57.351 -8.766 11.314 1.00 0.00 H new ATOM 0 HB2 GLU A 31 57.804 -7.186 13.198 1.00 0.00 H new ATOM 0 HB3 GLU A 31 59.507 -7.185 12.787 1.00 0.00 H new ATOM 0 HG2 GLU A 31 58.961 -6.302 10.502 1.00 0.00 H new ATOM 0 HG3 GLU A 31 57.255 -6.312 10.904 1.00 0.00 H new ATOM 507 N LEU A 32 60.547 -9.345 10.964 1.00 0.00 N ATOM 508 CA LEU A 32 61.601 -9.577 9.936 1.00 0.00 C ATOM 509 C LEU A 32 61.185 -10.755 9.048 1.00 0.00 C ATOM 510 O LEU A 32 61.363 -10.737 7.847 1.00 0.00 O ATOM 511 CB LEU A 32 62.930 -9.888 10.641 1.00 0.00 C ATOM 512 CG LEU A 32 64.052 -10.146 9.622 1.00 0.00 C ATOM 513 CD1 LEU A 32 64.344 -8.878 8.810 1.00 0.00 C ATOM 514 CD2 LEU A 32 65.316 -10.565 10.381 1.00 0.00 C ATOM 0 H LEU A 32 60.814 -9.586 11.919 1.00 0.00 H new ATOM 0 HA LEU A 32 61.725 -8.689 9.316 1.00 0.00 H new ATOM 0 HB2 LEU A 32 63.206 -9.054 11.287 1.00 0.00 H new ATOM 0 HB3 LEU A 32 62.809 -10.761 11.282 1.00 0.00 H new ATOM 0 HG LEU A 32 63.741 -10.933 8.936 1.00 0.00 H new ATOM 0 HD11 LEU A 32 65.141 -9.080 8.094 1.00 0.00 H new ATOM 0 HD12 LEU A 32 63.444 -8.573 8.275 1.00 0.00 H new ATOM 0 HD13 LEU A 32 64.655 -8.079 9.483 1.00 0.00 H new ATOM 0 HD21 LEU A 32 66.122 -10.752 9.671 1.00 0.00 H new ATOM 0 HD22 LEU A 32 65.611 -9.768 11.064 1.00 0.00 H new ATOM 0 HD23 LEU A 32 65.115 -11.473 10.949 1.00 0.00 H new ATOM 526 N LYS A 33 60.629 -11.778 9.638 1.00 0.00 N ATOM 527 CA LYS A 33 60.201 -12.962 8.837 1.00 0.00 C ATOM 528 C LYS A 33 59.097 -12.566 7.848 1.00 0.00 C ATOM 529 O LYS A 33 59.071 -13.017 6.721 1.00 0.00 O ATOM 530 CB LYS A 33 59.680 -14.055 9.780 1.00 0.00 C ATOM 531 CG LYS A 33 59.237 -15.271 8.961 1.00 0.00 C ATOM 532 CD LYS A 33 58.977 -16.460 9.894 1.00 0.00 C ATOM 533 CE LYS A 33 57.881 -16.106 10.902 1.00 0.00 C ATOM 534 NZ LYS A 33 56.803 -15.334 10.224 1.00 0.00 N ATOM 0 H LYS A 33 60.452 -11.846 10.640 1.00 0.00 H new ATOM 0 HA LYS A 33 61.056 -13.338 8.276 1.00 0.00 H new ATOM 0 HB2 LYS A 33 60.460 -14.343 10.485 1.00 0.00 H new ATOM 0 HB3 LYS A 33 58.844 -13.675 10.367 1.00 0.00 H new ATOM 0 HG2 LYS A 33 58.333 -15.033 8.400 1.00 0.00 H new ATOM 0 HG3 LYS A 33 60.006 -15.530 8.233 1.00 0.00 H new ATOM 0 HD2 LYS A 33 58.679 -17.331 9.311 1.00 0.00 H new ATOM 0 HD3 LYS A 33 59.894 -16.727 10.420 1.00 0.00 H new ATOM 0 HE2 LYS A 33 57.469 -17.015 11.340 1.00 0.00 H new ATOM 0 HE3 LYS A 33 58.301 -15.520 11.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 55.922 -15.413 10.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 57.081 -14.334 10.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 56.652 -15.715 9.268 1.00 0.00 H new ATOM 548 N GLU A 34 58.182 -11.732 8.262 1.00 0.00 N ATOM 549 CA GLU A 34 57.077 -11.320 7.347 1.00 0.00 C ATOM 550 C GLU A 34 57.642 -10.626 6.105 1.00 0.00 C ATOM 551 O GLU A 34 57.216 -10.873 4.994 1.00 0.00 O ATOM 552 CB GLU A 34 56.143 -10.352 8.081 1.00 0.00 C ATOM 553 CG GLU A 34 54.951 -9.999 7.184 1.00 0.00 C ATOM 554 CD GLU A 34 54.017 -9.045 7.929 1.00 0.00 C ATOM 555 OE1 GLU A 34 54.269 -8.790 9.095 1.00 0.00 O ATOM 556 OE2 GLU A 34 53.067 -8.581 7.320 1.00 0.00 O ATOM 0 H GLU A 34 58.151 -11.318 9.194 1.00 0.00 H new ATOM 0 HA GLU A 34 56.528 -12.209 7.038 1.00 0.00 H new ATOM 0 HB2 GLU A 34 55.791 -10.805 9.008 1.00 0.00 H new ATOM 0 HB3 GLU A 34 56.685 -9.447 8.354 1.00 0.00 H new ATOM 0 HG2 GLU A 34 55.301 -9.536 6.262 1.00 0.00 H new ATOM 0 HG3 GLU A 34 54.414 -10.905 6.902 1.00 0.00 H new ATOM 563 N LEU A 35 58.573 -9.738 6.290 1.00 0.00 N ATOM 564 CA LEU A 35 59.142 -8.990 5.132 1.00 0.00 C ATOM 565 C LEU A 35 59.781 -9.950 4.127 1.00 0.00 C ATOM 566 O LEU A 35 59.525 -9.876 2.943 1.00 0.00 O ATOM 567 CB LEU A 35 60.202 -8.013 5.656 1.00 0.00 C ATOM 568 CG LEU A 35 60.821 -7.190 4.490 1.00 0.00 C ATOM 569 CD1 LEU A 35 61.012 -5.732 4.933 1.00 0.00 C ATOM 570 CD2 LEU A 35 62.190 -7.770 4.093 1.00 0.00 C ATOM 0 H LEU A 35 58.969 -9.494 7.198 1.00 0.00 H new ATOM 0 HA LEU A 35 58.343 -8.449 4.625 1.00 0.00 H new ATOM 0 HB2 LEU A 35 59.752 -7.338 6.384 1.00 0.00 H new ATOM 0 HB3 LEU A 35 60.987 -8.564 6.174 1.00 0.00 H new ATOM 0 HG LEU A 35 60.146 -7.238 3.635 1.00 0.00 H new ATOM 0 HD11 LEU A 35 61.446 -5.157 4.115 1.00 0.00 H new ATOM 0 HD12 LEU A 35 60.047 -5.305 5.205 1.00 0.00 H new ATOM 0 HD13 LEU A 35 61.679 -5.698 5.794 1.00 0.00 H new ATOM 0 HD21 LEU A 35 62.611 -7.184 3.276 1.00 0.00 H new ATOM 0 HD22 LEU A 35 62.863 -7.734 4.950 1.00 0.00 H new ATOM 0 HD23 LEU A 35 62.068 -8.804 3.772 1.00 0.00 H new ATOM 582 N ILE A 36 60.615 -10.840 4.577 1.00 0.00 N ATOM 583 CA ILE A 36 61.260 -11.783 3.624 1.00 0.00 C ATOM 584 C ILE A 36 60.190 -12.615 2.909 1.00 0.00 C ATOM 585 O ILE A 36 60.190 -12.743 1.702 1.00 0.00 O ATOM 586 CB ILE A 36 62.200 -12.714 4.393 1.00 0.00 C ATOM 587 CG1 ILE A 36 63.291 -11.886 5.075 1.00 0.00 C ATOM 588 CG2 ILE A 36 62.851 -13.714 3.432 1.00 0.00 C ATOM 589 CD1 ILE A 36 64.076 -12.781 6.033 1.00 0.00 C ATOM 0 H ILE A 36 60.878 -10.956 5.556 1.00 0.00 H new ATOM 0 HA ILE A 36 61.826 -11.217 2.884 1.00 0.00 H new ATOM 0 HB ILE A 36 61.626 -13.259 5.143 1.00 0.00 H new ATOM 0 HG12 ILE A 36 63.960 -11.458 4.328 1.00 0.00 H new ATOM 0 HG13 ILE A 36 62.846 -11.053 5.619 1.00 0.00 H new ATOM 0 HG21 ILE A 36 63.518 -14.372 3.989 1.00 0.00 H new ATOM 0 HG22 ILE A 36 62.077 -14.308 2.946 1.00 0.00 H new ATOM 0 HG23 ILE A 36 63.422 -13.174 2.676 1.00 0.00 H new ATOM 0 HD11 ILE A 36 64.855 -12.196 6.522 1.00 0.00 H new ATOM 0 HD12 ILE A 36 63.401 -13.188 6.786 1.00 0.00 H new ATOM 0 HD13 ILE A 36 64.533 -13.599 5.475 1.00 0.00 H new ATOM 601 N ASN A 37 59.289 -13.193 3.654 1.00 0.00 N ATOM 602 CA ASN A 37 58.226 -14.039 3.038 1.00 0.00 C ATOM 603 C ASN A 37 57.356 -13.223 2.074 1.00 0.00 C ATOM 604 O ASN A 37 56.966 -13.699 1.027 1.00 0.00 O ATOM 605 CB ASN A 37 57.340 -14.607 4.147 1.00 0.00 C ATOM 606 CG ASN A 37 56.280 -15.527 3.541 1.00 0.00 C ATOM 607 OD1 ASN A 37 55.163 -15.112 3.299 1.00 0.00 O ATOM 608 ND2 ASN A 37 56.586 -16.769 3.285 1.00 0.00 N ATOM 0 H ASN A 37 59.242 -13.116 4.670 1.00 0.00 H new ATOM 0 HA ASN A 37 58.705 -14.841 2.476 1.00 0.00 H new ATOM 0 HB2 ASN A 37 57.948 -15.159 4.864 1.00 0.00 H new ATOM 0 HB3 ASN A 37 56.861 -13.795 4.694 1.00 0.00 H new ATOM 0 HD21 ASN A 37 55.888 -17.393 2.881 1.00 0.00 H new ATOM 0 HD22 ASN A 37 57.523 -17.116 3.489 1.00 0.00 H new ATOM 615 N ASN A 38 57.017 -12.010 2.426 1.00 0.00 N ATOM 616 CA ASN A 38 56.139 -11.195 1.530 1.00 0.00 C ATOM 617 C ASN A 38 56.941 -10.463 0.452 1.00 0.00 C ATOM 618 O ASN A 38 56.672 -10.597 -0.725 1.00 0.00 O ATOM 619 CB ASN A 38 55.375 -10.162 2.359 1.00 0.00 C ATOM 620 CG ASN A 38 54.320 -9.496 1.472 1.00 0.00 C ATOM 621 OD1 ASN A 38 54.239 -9.777 0.292 1.00 0.00 O ATOM 622 ND2 ASN A 38 53.506 -8.618 1.989 1.00 0.00 N ATOM 0 H ASN A 38 57.307 -11.550 3.289 1.00 0.00 H new ATOM 0 HA ASN A 38 55.450 -11.882 1.038 1.00 0.00 H new ATOM 0 HB2 ASN A 38 54.900 -10.642 3.214 1.00 0.00 H new ATOM 0 HB3 ASN A 38 56.062 -9.414 2.755 1.00 0.00 H new ATOM 0 HD21 ASN A 38 52.802 -8.168 1.403 1.00 0.00 H new ATOM 0 HD22 ASN A 38 53.573 -8.381 2.979 1.00 0.00 H new ATOM 629 N GLU A 39 57.890 -9.653 0.833 1.00 0.00 N ATOM 630 CA GLU A 39 58.653 -8.878 -0.189 1.00 0.00 C ATOM 631 C GLU A 39 59.738 -9.733 -0.849 1.00 0.00 C ATOM 632 O GLU A 39 59.649 -10.060 -2.016 1.00 0.00 O ATOM 633 CB GLU A 39 59.293 -7.661 0.478 1.00 0.00 C ATOM 634 CG GLU A 39 58.193 -6.677 0.884 1.00 0.00 C ATOM 635 CD GLU A 39 58.814 -5.454 1.561 1.00 0.00 C ATOM 636 OE1 GLU A 39 59.337 -4.608 0.854 1.00 0.00 O ATOM 637 OE2 GLU A 39 58.750 -5.381 2.777 1.00 0.00 O ATOM 0 H GLU A 39 58.170 -9.494 1.801 1.00 0.00 H new ATOM 0 HA GLU A 39 57.958 -8.561 -0.967 1.00 0.00 H new ATOM 0 HB2 GLU A 39 59.864 -7.969 1.354 1.00 0.00 H new ATOM 0 HB3 GLU A 39 59.993 -7.181 -0.206 1.00 0.00 H new ATOM 0 HG2 GLU A 39 57.626 -6.369 0.006 1.00 0.00 H new ATOM 0 HG3 GLU A 39 57.491 -7.162 1.562 1.00 0.00 H new ATOM 644 N LEU A 40 60.777 -10.074 -0.135 1.00 0.00 N ATOM 645 CA LEU A 40 61.874 -10.876 -0.759 1.00 0.00 C ATOM 646 C LEU A 40 61.624 -12.370 -0.567 1.00 0.00 C ATOM 647 O LEU A 40 62.122 -12.982 0.358 1.00 0.00 O ATOM 648 CB LEU A 40 63.198 -10.500 -0.100 1.00 0.00 C ATOM 649 CG LEU A 40 63.463 -9.003 -0.297 1.00 0.00 C ATOM 650 CD1 LEU A 40 64.695 -8.605 0.520 1.00 0.00 C ATOM 651 CD2 LEU A 40 63.701 -8.692 -1.789 1.00 0.00 C ATOM 0 H LEU A 40 60.915 -9.835 0.847 1.00 0.00 H new ATOM 0 HA LEU A 40 61.907 -10.662 -1.827 1.00 0.00 H new ATOM 0 HB2 LEU A 40 63.167 -10.737 0.963 1.00 0.00 H new ATOM 0 HB3 LEU A 40 64.010 -11.084 -0.533 1.00 0.00 H new ATOM 0 HG LEU A 40 62.596 -8.435 0.040 1.00 0.00 H new ATOM 0 HD11 LEU A 40 64.892 -7.541 0.387 1.00 0.00 H new ATOM 0 HD12 LEU A 40 64.514 -8.811 1.575 1.00 0.00 H new ATOM 0 HD13 LEU A 40 65.557 -9.179 0.181 1.00 0.00 H new ATOM 0 HD21 LEU A 40 63.888 -7.625 -1.913 1.00 0.00 H new ATOM 0 HD22 LEU A 40 64.564 -9.255 -2.145 1.00 0.00 H new ATOM 0 HD23 LEU A 40 62.820 -8.975 -2.365 1.00 0.00 H new ATOM 663 N SER A 41 60.869 -12.962 -1.454 1.00 0.00 N ATOM 664 CA SER A 41 60.584 -14.426 -1.366 1.00 0.00 C ATOM 665 C SER A 41 60.707 -15.053 -2.761 1.00 0.00 C ATOM 666 O SER A 41 60.885 -16.247 -2.903 1.00 0.00 O ATOM 667 CB SER A 41 59.165 -14.632 -0.834 1.00 0.00 C ATOM 668 OG SER A 41 58.236 -14.006 -1.711 1.00 0.00 O ATOM 0 H SER A 41 60.432 -12.489 -2.245 1.00 0.00 H new ATOM 0 HA SER A 41 61.298 -14.900 -0.692 1.00 0.00 H new ATOM 0 HB2 SER A 41 58.946 -15.697 -0.754 1.00 0.00 H new ATOM 0 HB3 SER A 41 59.076 -14.212 0.168 1.00 0.00 H new ATOM 0 HG SER A 41 57.483 -13.653 -1.192 1.00 0.00 H new ATOM 674 N HIS A 42 60.601 -14.256 -3.792 1.00 0.00 N ATOM 675 CA HIS A 42 60.692 -14.793 -5.181 1.00 0.00 C ATOM 676 C HIS A 42 62.124 -15.243 -5.484 1.00 0.00 C ATOM 677 O HIS A 42 62.363 -15.957 -6.438 1.00 0.00 O ATOM 678 CB HIS A 42 60.277 -13.703 -6.173 1.00 0.00 C ATOM 679 CG HIS A 42 58.800 -13.451 -6.044 1.00 0.00 C ATOM 680 ND1 HIS A 42 57.852 -14.295 -6.606 1.00 0.00 N ATOM 681 CD2 HIS A 42 58.091 -12.458 -5.410 1.00 0.00 C ATOM 682 CE1 HIS A 42 56.637 -13.800 -6.301 1.00 0.00 C ATOM 683 NE2 HIS A 42 56.729 -12.685 -5.575 1.00 0.00 N ATOM 0 H HIS A 42 60.454 -13.249 -3.730 1.00 0.00 H new ATOM 0 HA HIS A 42 60.027 -15.651 -5.275 1.00 0.00 H new ATOM 0 HB2 HIS A 42 60.833 -12.786 -5.977 1.00 0.00 H new ATOM 0 HB3 HIS A 42 60.518 -14.010 -7.191 1.00 0.00 H new ATOM 0 HD2 HIS A 42 58.524 -11.630 -4.868 1.00 0.00 H new ATOM 0 HE1 HIS A 42 55.704 -14.250 -6.606 1.00 0.00 H new ATOM 0 HE2 HIS A 42 55.961 -12.118 -5.216 1.00 0.00 H new ATOM 692 N PHE A 43 63.079 -14.848 -4.678 1.00 0.00 N ATOM 693 CA PHE A 43 64.498 -15.267 -4.914 1.00 0.00 C ATOM 694 C PHE A 43 64.876 -16.360 -3.912 1.00 0.00 C ATOM 695 O PHE A 43 65.834 -17.085 -4.103 1.00 0.00 O ATOM 696 CB PHE A 43 65.421 -14.064 -4.713 1.00 0.00 C ATOM 697 CG PHE A 43 65.269 -13.109 -5.871 1.00 0.00 C ATOM 698 CD1 PHE A 43 64.298 -12.102 -5.821 1.00 0.00 C ATOM 699 CD2 PHE A 43 66.093 -13.233 -6.997 1.00 0.00 C ATOM 700 CE1 PHE A 43 64.152 -11.218 -6.896 1.00 0.00 C ATOM 701 CE2 PHE A 43 65.946 -12.348 -8.072 1.00 0.00 C ATOM 702 CZ PHE A 43 64.976 -11.341 -8.021 1.00 0.00 C ATOM 0 H PHE A 43 62.937 -14.251 -3.863 1.00 0.00 H new ATOM 0 HA PHE A 43 64.602 -15.646 -5.931 1.00 0.00 H new ATOM 0 HB2 PHE A 43 65.178 -13.559 -3.778 1.00 0.00 H new ATOM 0 HB3 PHE A 43 66.456 -14.396 -4.636 1.00 0.00 H new ATOM 0 HD1 PHE A 43 63.662 -12.007 -4.953 1.00 0.00 H new ATOM 0 HD2 PHE A 43 66.841 -14.011 -7.036 1.00 0.00 H new ATOM 0 HE1 PHE A 43 63.403 -10.441 -6.858 1.00 0.00 H new ATOM 0 HE2 PHE A 43 66.581 -12.443 -8.940 1.00 0.00 H new ATOM 0 HZ PHE A 43 64.863 -10.658 -8.850 1.00 0.00 H new ATOM 712 N LEU A 44 64.134 -16.486 -2.841 1.00 0.00 N ATOM 713 CA LEU A 44 64.451 -17.528 -1.824 1.00 0.00 C ATOM 714 C LEU A 44 63.157 -18.031 -1.172 1.00 0.00 C ATOM 715 O LEU A 44 62.188 -17.308 -1.050 1.00 0.00 O ATOM 716 CB LEU A 44 65.372 -16.909 -0.764 1.00 0.00 C ATOM 717 CG LEU A 44 64.599 -15.886 0.116 1.00 0.00 C ATOM 718 CD1 LEU A 44 64.198 -16.527 1.453 1.00 0.00 C ATOM 719 CD2 LEU A 44 65.484 -14.660 0.407 1.00 0.00 C ATOM 0 H LEU A 44 63.320 -15.909 -2.629 1.00 0.00 H new ATOM 0 HA LEU A 44 64.949 -18.374 -2.297 1.00 0.00 H new ATOM 0 HB2 LEU A 44 65.787 -17.695 -0.134 1.00 0.00 H new ATOM 0 HB3 LEU A 44 66.212 -16.414 -1.251 1.00 0.00 H new ATOM 0 HG LEU A 44 63.706 -15.579 -0.428 1.00 0.00 H new ATOM 0 HD11 LEU A 44 63.658 -15.799 2.058 1.00 0.00 H new ATOM 0 HD12 LEU A 44 63.558 -17.389 1.266 1.00 0.00 H new ATOM 0 HD13 LEU A 44 65.093 -16.848 1.985 1.00 0.00 H new ATOM 0 HD21 LEU A 44 64.932 -13.951 1.024 1.00 0.00 H new ATOM 0 HD22 LEU A 44 66.383 -14.977 0.935 1.00 0.00 H new ATOM 0 HD23 LEU A 44 65.764 -14.183 -0.532 1.00 0.00 H new ATOM 731 N GLU A 45 63.139 -19.269 -0.751 1.00 0.00 N ATOM 732 CA GLU A 45 61.918 -19.830 -0.102 1.00 0.00 C ATOM 733 C GLU A 45 62.327 -21.063 0.717 1.00 0.00 C ATOM 734 O GLU A 45 61.549 -21.965 0.947 1.00 0.00 O ATOM 735 CB GLU A 45 60.895 -20.219 -1.184 1.00 0.00 C ATOM 736 CG GLU A 45 59.511 -20.441 -0.553 1.00 0.00 C ATOM 737 CD GLU A 45 58.458 -20.564 -1.658 1.00 0.00 C ATOM 738 OE1 GLU A 45 58.291 -21.658 -2.171 1.00 0.00 O ATOM 739 OE2 GLU A 45 57.833 -19.562 -1.968 1.00 0.00 O ATOM 0 H GLU A 45 63.922 -19.918 -0.830 1.00 0.00 H new ATOM 0 HA GLU A 45 61.461 -19.091 0.556 1.00 0.00 H new ATOM 0 HB2 GLU A 45 60.837 -19.434 -1.938 1.00 0.00 H new ATOM 0 HB3 GLU A 45 61.220 -21.127 -1.693 1.00 0.00 H new ATOM 0 HG2 GLU A 45 59.519 -21.344 0.058 1.00 0.00 H new ATOM 0 HG3 GLU A 45 59.264 -19.611 0.108 1.00 0.00 H new ATOM 746 N GLU A 46 63.560 -21.102 1.157 1.00 0.00 N ATOM 747 CA GLU A 46 64.050 -22.263 1.958 1.00 0.00 C ATOM 748 C GLU A 46 63.807 -22.018 3.447 1.00 0.00 C ATOM 749 O GLU A 46 64.105 -22.855 4.277 1.00 0.00 O ATOM 750 CB GLU A 46 65.550 -22.449 1.719 1.00 0.00 C ATOM 751 CG GLU A 46 65.777 -22.992 0.309 1.00 0.00 C ATOM 752 CD GLU A 46 67.276 -23.178 0.068 1.00 0.00 C ATOM 753 OE1 GLU A 46 68.049 -22.765 0.916 1.00 0.00 O ATOM 754 OE2 GLU A 46 67.625 -23.729 -0.963 1.00 0.00 O ATOM 0 H GLU A 46 64.253 -20.372 0.993 1.00 0.00 H new ATOM 0 HA GLU A 46 63.509 -23.158 1.649 1.00 0.00 H new ATOM 0 HB2 GLU A 46 66.069 -21.499 1.842 1.00 0.00 H new ATOM 0 HB3 GLU A 46 65.964 -23.137 2.456 1.00 0.00 H new ATOM 0 HG2 GLU A 46 65.258 -23.942 0.186 1.00 0.00 H new ATOM 0 HG3 GLU A 46 65.362 -22.304 -0.428 1.00 0.00 H new ATOM 761 N ILE A 47 63.270 -20.881 3.800 1.00 0.00 N ATOM 762 CA ILE A 47 63.014 -20.589 5.242 1.00 0.00 C ATOM 763 C ILE A 47 61.576 -20.968 5.599 1.00 0.00 C ATOM 764 O ILE A 47 60.629 -20.435 5.056 1.00 0.00 O ATOM 765 CB ILE A 47 63.225 -19.098 5.502 1.00 0.00 C ATOM 766 CG1 ILE A 47 64.675 -18.737 5.166 1.00 0.00 C ATOM 767 CG2 ILE A 47 62.941 -18.783 6.974 1.00 0.00 C ATOM 768 CD1 ILE A 47 64.858 -17.218 5.205 1.00 0.00 C ATOM 0 H ILE A 47 62.997 -20.141 3.153 1.00 0.00 H new ATOM 0 HA ILE A 47 63.703 -21.170 5.855 1.00 0.00 H new ATOM 0 HB ILE A 47 62.546 -18.516 4.879 1.00 0.00 H new ATOM 0 HG12 ILE A 47 65.351 -19.211 5.877 1.00 0.00 H new ATOM 0 HG13 ILE A 47 64.934 -19.118 4.178 1.00 0.00 H new ATOM 0 HG21 ILE A 47 63.093 -17.719 7.154 1.00 0.00 H new ATOM 0 HG22 ILE A 47 61.910 -19.048 7.210 1.00 0.00 H new ATOM 0 HG23 ILE A 47 63.617 -19.358 7.606 1.00 0.00 H new ATOM 0 HD11 ILE A 47 65.892 -16.970 4.965 1.00 0.00 H new ATOM 0 HD12 ILE A 47 64.194 -16.753 4.476 1.00 0.00 H new ATOM 0 HD13 ILE A 47 64.618 -16.848 6.202 1.00 0.00 H new ATOM 780 N LYS A 48 61.411 -21.881 6.520 1.00 0.00 N ATOM 781 CA LYS A 48 60.039 -22.306 6.943 1.00 0.00 C ATOM 782 C LYS A 48 60.002 -22.452 8.469 1.00 0.00 C ATOM 783 O LYS A 48 58.971 -22.294 9.092 1.00 0.00 O ATOM 784 CB LYS A 48 59.700 -23.650 6.293 1.00 0.00 C ATOM 785 CG LYS A 48 58.223 -23.977 6.534 1.00 0.00 C ATOM 786 CD LYS A 48 57.909 -25.385 6.015 1.00 0.00 C ATOM 787 CE LYS A 48 57.973 -25.413 4.483 1.00 0.00 C ATOM 788 NZ LYS A 48 57.286 -26.639 3.987 1.00 0.00 N ATOM 0 H LYS A 48 62.174 -22.356 7.003 1.00 0.00 H new ATOM 0 HA LYS A 48 59.311 -21.558 6.630 1.00 0.00 H new ATOM 0 HB2 LYS A 48 59.905 -23.610 5.223 1.00 0.00 H new ATOM 0 HB3 LYS A 48 60.330 -24.436 6.709 1.00 0.00 H new ATOM 0 HG2 LYS A 48 57.996 -23.913 7.598 1.00 0.00 H new ATOM 0 HG3 LYS A 48 57.592 -23.245 6.029 1.00 0.00 H new ATOM 0 HD2 LYS A 48 58.620 -26.100 6.429 1.00 0.00 H new ATOM 0 HD3 LYS A 48 56.918 -25.691 6.350 1.00 0.00 H new ATOM 0 HE2 LYS A 48 57.497 -24.523 4.071 1.00 0.00 H new ATOM 0 HE3 LYS A 48 59.011 -25.403 4.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 57.326 -26.663 2.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 57.759 -27.482 4.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 56.293 -26.629 4.295 1.00 0.00 H new ATOM 802 N GLU A 49 61.122 -22.761 9.072 1.00 0.00 N ATOM 803 CA GLU A 49 61.177 -22.928 10.558 1.00 0.00 C ATOM 804 C GLU A 49 61.779 -21.665 11.185 1.00 0.00 C ATOM 805 O GLU A 49 62.712 -21.091 10.667 1.00 0.00 O ATOM 806 CB GLU A 49 62.058 -24.141 10.882 1.00 0.00 C ATOM 807 CG GLU A 49 62.083 -24.391 12.393 1.00 0.00 C ATOM 808 CD GLU A 49 60.675 -24.730 12.883 1.00 0.00 C ATOM 809 OE1 GLU A 49 59.904 -25.255 12.096 1.00 0.00 O ATOM 810 OE2 GLU A 49 60.389 -24.455 14.038 1.00 0.00 O ATOM 0 H GLU A 49 62.011 -22.906 8.593 1.00 0.00 H new ATOM 0 HA GLU A 49 60.176 -23.084 10.959 1.00 0.00 H new ATOM 0 HB2 GLU A 49 61.678 -25.023 10.367 1.00 0.00 H new ATOM 0 HB3 GLU A 49 63.071 -23.971 10.518 1.00 0.00 H new ATOM 0 HG2 GLU A 49 62.766 -25.209 12.625 1.00 0.00 H new ATOM 0 HG3 GLU A 49 62.456 -23.508 12.911 1.00 0.00 H new ATOM 817 N GLN A 50 61.247 -21.219 12.289 1.00 0.00 N ATOM 818 CA GLN A 50 61.790 -19.989 12.936 1.00 0.00 C ATOM 819 C GLN A 50 63.259 -20.205 13.296 1.00 0.00 C ATOM 820 O GLN A 50 64.086 -19.327 13.149 1.00 0.00 O ATOM 821 CB GLN A 50 60.997 -19.701 14.206 1.00 0.00 C ATOM 822 CG GLN A 50 59.587 -19.249 13.830 1.00 0.00 C ATOM 823 CD GLN A 50 58.744 -19.115 15.097 1.00 0.00 C ATOM 824 OE1 GLN A 50 59.057 -19.700 16.116 1.00 0.00 O ATOM 825 NE2 GLN A 50 57.679 -18.361 15.077 1.00 0.00 N ATOM 0 H GLN A 50 60.460 -21.652 12.772 1.00 0.00 H new ATOM 0 HA GLN A 50 61.706 -19.148 12.248 1.00 0.00 H new ATOM 0 HB2 GLN A 50 60.951 -20.594 14.830 1.00 0.00 H new ATOM 0 HB3 GLN A 50 61.495 -18.928 14.792 1.00 0.00 H new ATOM 0 HG2 GLN A 50 59.627 -18.295 13.304 1.00 0.00 H new ATOM 0 HG3 GLN A 50 59.131 -19.969 13.151 1.00 0.00 H new ATOM 0 HE21 GLN A 50 57.417 -17.871 14.222 1.00 0.00 H new ATOM 0 HE22 GLN A 50 57.108 -18.262 15.917 1.00 0.00 H new ATOM 834 N GLU A 51 63.584 -21.372 13.771 1.00 0.00 N ATOM 835 CA GLU A 51 64.993 -21.659 14.157 1.00 0.00 C ATOM 836 C GLU A 51 65.917 -21.260 13.002 1.00 0.00 C ATOM 837 O GLU A 51 67.025 -20.808 13.212 1.00 0.00 O ATOM 838 CB GLU A 51 65.139 -23.155 14.459 1.00 0.00 C ATOM 839 CG GLU A 51 66.532 -23.440 15.030 1.00 0.00 C ATOM 840 CD GLU A 51 67.569 -23.426 13.903 1.00 0.00 C ATOM 841 OE1 GLU A 51 67.205 -23.740 12.781 1.00 0.00 O ATOM 842 OE2 GLU A 51 68.712 -23.104 14.183 1.00 0.00 O ATOM 0 H GLU A 51 62.932 -22.144 13.910 1.00 0.00 H new ATOM 0 HA GLU A 51 65.263 -21.090 15.046 1.00 0.00 H new ATOM 0 HB2 GLU A 51 64.374 -23.467 15.170 1.00 0.00 H new ATOM 0 HB3 GLU A 51 64.984 -23.735 13.549 1.00 0.00 H new ATOM 0 HG2 GLU A 51 66.787 -22.692 15.780 1.00 0.00 H new ATOM 0 HG3 GLU A 51 66.539 -24.408 15.530 1.00 0.00 H new ATOM 849 N VAL A 52 65.457 -21.389 11.787 1.00 0.00 N ATOM 850 CA VAL A 52 66.291 -20.981 10.618 1.00 0.00 C ATOM 851 C VAL A 52 66.424 -19.454 10.609 1.00 0.00 C ATOM 852 O VAL A 52 67.459 -18.907 10.288 1.00 0.00 O ATOM 853 CB VAL A 52 65.623 -21.445 9.311 1.00 0.00 C ATOM 854 CG1 VAL A 52 66.332 -20.816 8.106 1.00 0.00 C ATOM 855 CG2 VAL A 52 65.712 -22.970 9.200 1.00 0.00 C ATOM 0 H VAL A 52 64.537 -21.761 11.552 1.00 0.00 H new ATOM 0 HA VAL A 52 67.277 -21.440 10.696 1.00 0.00 H new ATOM 0 HB VAL A 52 64.578 -21.134 9.321 1.00 0.00 H new ATOM 0 HG11 VAL A 52 65.852 -21.150 7.186 1.00 0.00 H new ATOM 0 HG12 VAL A 52 66.270 -19.730 8.174 1.00 0.00 H new ATOM 0 HG13 VAL A 52 67.379 -21.120 8.100 1.00 0.00 H new ATOM 0 HG21 VAL A 52 65.238 -23.296 8.274 1.00 0.00 H new ATOM 0 HG22 VAL A 52 66.759 -23.274 9.199 1.00 0.00 H new ATOM 0 HG23 VAL A 52 65.202 -23.427 10.048 1.00 0.00 H new ATOM 865 N VAL A 53 65.377 -18.769 10.975 1.00 0.00 N ATOM 866 CA VAL A 53 65.439 -17.280 11.004 1.00 0.00 C ATOM 867 C VAL A 53 66.349 -16.839 12.154 1.00 0.00 C ATOM 868 O VAL A 53 67.121 -15.908 12.030 1.00 0.00 O ATOM 869 CB VAL A 53 64.032 -16.701 11.201 1.00 0.00 C ATOM 870 CG1 VAL A 53 64.122 -15.195 11.478 1.00 0.00 C ATOM 871 CG2 VAL A 53 63.208 -16.934 9.933 1.00 0.00 C ATOM 0 H VAL A 53 64.483 -19.174 11.255 1.00 0.00 H new ATOM 0 HA VAL A 53 65.840 -16.913 10.059 1.00 0.00 H new ATOM 0 HB VAL A 53 63.555 -17.194 12.048 1.00 0.00 H new ATOM 0 HG11 VAL A 53 63.120 -14.790 11.617 1.00 0.00 H new ATOM 0 HG12 VAL A 53 64.710 -15.025 12.380 1.00 0.00 H new ATOM 0 HG13 VAL A 53 64.600 -14.698 10.634 1.00 0.00 H new ATOM 0 HG21 VAL A 53 62.207 -16.524 10.069 1.00 0.00 H new ATOM 0 HG22 VAL A 53 63.691 -16.441 9.090 1.00 0.00 H new ATOM 0 HG23 VAL A 53 63.138 -18.004 9.736 1.00 0.00 H new ATOM 881 N ASP A 54 66.243 -17.490 13.279 1.00 0.00 N ATOM 882 CA ASP A 54 67.079 -17.105 14.452 1.00 0.00 C ATOM 883 C ASP A 54 68.566 -17.234 14.122 1.00 0.00 C ATOM 884 O ASP A 54 69.354 -16.362 14.428 1.00 0.00 O ATOM 885 CB ASP A 54 66.745 -18.013 15.636 1.00 0.00 C ATOM 886 CG ASP A 54 67.537 -17.558 16.864 1.00 0.00 C ATOM 887 OD1 ASP A 54 68.382 -16.692 16.710 1.00 0.00 O ATOM 888 OD2 ASP A 54 67.277 -18.074 17.937 1.00 0.00 O ATOM 0 H ASP A 54 65.611 -18.275 13.438 1.00 0.00 H new ATOM 0 HA ASP A 54 66.864 -16.067 14.705 1.00 0.00 H new ATOM 0 HB2 ASP A 54 65.676 -17.978 15.845 1.00 0.00 H new ATOM 0 HB3 ASP A 54 66.989 -19.048 15.395 1.00 0.00 H new ATOM 893 N LYS A 55 68.962 -18.311 13.507 1.00 0.00 N ATOM 894 CA LYS A 55 70.404 -18.473 13.171 1.00 0.00 C ATOM 895 C LYS A 55 70.824 -17.351 12.221 1.00 0.00 C ATOM 896 O LYS A 55 71.864 -16.742 12.380 1.00 0.00 O ATOM 897 CB LYS A 55 70.629 -19.840 12.511 1.00 0.00 C ATOM 898 CG LYS A 55 72.116 -20.020 12.184 1.00 0.00 C ATOM 899 CD LYS A 55 72.335 -21.392 11.541 1.00 0.00 C ATOM 900 CE LYS A 55 73.811 -21.552 11.171 1.00 0.00 C ATOM 901 NZ LYS A 55 74.027 -22.891 10.551 1.00 0.00 N ATOM 0 H LYS A 55 68.356 -19.081 13.224 1.00 0.00 H new ATOM 0 HA LYS A 55 71.005 -18.420 14.079 1.00 0.00 H new ATOM 0 HB2 LYS A 55 70.295 -20.635 13.177 1.00 0.00 H new ATOM 0 HB3 LYS A 55 70.035 -19.917 11.600 1.00 0.00 H new ATOM 0 HG2 LYS A 55 72.448 -19.232 11.508 1.00 0.00 H new ATOM 0 HG3 LYS A 55 72.712 -19.933 13.092 1.00 0.00 H new ATOM 0 HD2 LYS A 55 72.034 -22.181 12.231 1.00 0.00 H new ATOM 0 HD3 LYS A 55 71.713 -21.492 10.651 1.00 0.00 H new ATOM 0 HE2 LYS A 55 74.110 -20.766 10.478 1.00 0.00 H new ATOM 0 HE3 LYS A 55 74.433 -21.447 12.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 75.030 -22.999 10.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 73.757 -23.634 11.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 73.444 -22.975 9.694 1.00 0.00 H new ATOM 915 N VAL A 56 70.021 -17.081 11.230 1.00 0.00 N ATOM 916 CA VAL A 56 70.370 -16.003 10.260 1.00 0.00 C ATOM 917 C VAL A 56 70.275 -14.644 10.957 1.00 0.00 C ATOM 918 O VAL A 56 71.091 -13.768 10.747 1.00 0.00 O ATOM 919 CB VAL A 56 69.398 -16.036 9.073 1.00 0.00 C ATOM 920 CG1 VAL A 56 69.607 -14.796 8.193 1.00 0.00 C ATOM 921 CG2 VAL A 56 69.647 -17.297 8.244 1.00 0.00 C ATOM 0 H VAL A 56 69.138 -17.559 11.049 1.00 0.00 H new ATOM 0 HA VAL A 56 71.386 -16.160 9.897 1.00 0.00 H new ATOM 0 HB VAL A 56 68.375 -16.041 9.448 1.00 0.00 H new ATOM 0 HG11 VAL A 56 68.914 -14.826 7.352 1.00 0.00 H new ATOM 0 HG12 VAL A 56 69.425 -13.897 8.782 1.00 0.00 H new ATOM 0 HG13 VAL A 56 70.631 -14.784 7.819 1.00 0.00 H new ATOM 0 HG21 VAL A 56 68.957 -17.320 7.401 1.00 0.00 H new ATOM 0 HG22 VAL A 56 70.672 -17.292 7.874 1.00 0.00 H new ATOM 0 HG23 VAL A 56 69.490 -18.178 8.866 1.00 0.00 H new ATOM 931 N MET A 57 69.281 -14.464 11.776 1.00 0.00 N ATOM 932 CA MET A 57 69.122 -13.163 12.481 1.00 0.00 C ATOM 933 C MET A 57 70.319 -12.917 13.404 1.00 0.00 C ATOM 934 O MET A 57 70.839 -11.822 13.486 1.00 0.00 O ATOM 935 CB MET A 57 67.836 -13.196 13.305 1.00 0.00 C ATOM 936 CG MET A 57 67.575 -11.808 13.881 1.00 0.00 C ATOM 937 SD MET A 57 65.952 -11.776 14.674 1.00 0.00 S ATOM 938 CE MET A 57 65.780 -9.978 14.709 1.00 0.00 C ATOM 0 H MET A 57 68.569 -15.163 11.989 1.00 0.00 H new ATOM 0 HA MET A 57 69.071 -12.357 11.749 1.00 0.00 H new ATOM 0 HB2 MET A 57 66.998 -13.508 12.681 1.00 0.00 H new ATOM 0 HB3 MET A 57 67.924 -13.926 14.109 1.00 0.00 H new ATOM 0 HG2 MET A 57 68.349 -11.552 14.604 1.00 0.00 H new ATOM 0 HG3 MET A 57 67.619 -11.060 13.089 1.00 0.00 H new ATOM 0 HE1 MET A 57 64.861 -9.710 15.231 1.00 0.00 H new ATOM 0 HE2 MET A 57 66.633 -9.541 15.228 1.00 0.00 H new ATOM 0 HE3 MET A 57 65.742 -9.596 13.689 1.00 0.00 H new ATOM 948 N GLU A 58 70.758 -13.931 14.094 1.00 0.00 N ATOM 949 CA GLU A 58 71.921 -13.766 15.016 1.00 0.00 C ATOM 950 C GLU A 58 73.139 -13.317 14.212 1.00 0.00 C ATOM 951 O GLU A 58 73.844 -12.402 14.589 1.00 0.00 O ATOM 952 CB GLU A 58 72.222 -15.111 15.691 1.00 0.00 C ATOM 953 CG GLU A 58 73.411 -14.973 16.652 1.00 0.00 C ATOM 954 CD GLU A 58 73.071 -13.977 17.763 1.00 0.00 C ATOM 955 OE1 GLU A 58 71.895 -13.807 18.041 1.00 0.00 O ATOM 956 OE2 GLU A 58 73.994 -13.407 18.321 1.00 0.00 O ATOM 0 H GLU A 58 70.362 -14.871 14.061 1.00 0.00 H new ATOM 0 HA GLU A 58 71.689 -13.019 15.775 1.00 0.00 H new ATOM 0 HB2 GLU A 58 71.344 -15.456 16.236 1.00 0.00 H new ATOM 0 HB3 GLU A 58 72.443 -15.864 14.934 1.00 0.00 H new ATOM 0 HG2 GLU A 58 73.655 -15.944 17.084 1.00 0.00 H new ATOM 0 HG3 GLU A 58 74.293 -14.636 16.107 1.00 0.00 H new ATOM 963 N THR A 59 73.387 -13.952 13.103 1.00 0.00 N ATOM 964 CA THR A 59 74.554 -13.561 12.267 1.00 0.00 C ATOM 965 C THR A 59 74.298 -12.178 11.679 1.00 0.00 C ATOM 966 O THR A 59 75.181 -11.348 11.598 1.00 0.00 O ATOM 967 CB THR A 59 74.740 -14.576 11.131 1.00 0.00 C ATOM 968 OG1 THR A 59 74.964 -15.865 11.684 1.00 0.00 O ATOM 969 CG2 THR A 59 75.939 -14.176 10.264 1.00 0.00 C ATOM 0 H THR A 59 72.832 -14.726 12.739 1.00 0.00 H new ATOM 0 HA THR A 59 75.456 -13.543 12.879 1.00 0.00 H new ATOM 0 HB THR A 59 73.842 -14.592 10.513 1.00 0.00 H new ATOM 0 HG1 THR A 59 74.109 -16.255 11.962 1.00 0.00 H new ATOM 0 HG21 THR A 59 76.065 -14.901 9.460 1.00 0.00 H new ATOM 0 HG22 THR A 59 75.766 -13.188 9.838 1.00 0.00 H new ATOM 0 HG23 THR A 59 76.840 -14.154 10.877 1.00 0.00 H new ATOM 977 N LEU A 60 73.089 -11.928 11.269 1.00 0.00 N ATOM 978 CA LEU A 60 72.754 -10.603 10.682 1.00 0.00 C ATOM 979 C LEU A 60 72.974 -9.494 11.711 1.00 0.00 C ATOM 980 O LEU A 60 73.533 -8.458 11.407 1.00 0.00 O ATOM 981 CB LEU A 60 71.287 -10.611 10.237 1.00 0.00 C ATOM 982 CG LEU A 60 70.883 -9.244 9.663 1.00 0.00 C ATOM 983 CD1 LEU A 60 71.774 -8.883 8.465 1.00 0.00 C ATOM 984 CD2 LEU A 60 69.422 -9.314 9.205 1.00 0.00 C ATOM 0 H LEU A 60 72.313 -12.588 11.315 1.00 0.00 H new ATOM 0 HA LEU A 60 73.402 -10.415 9.826 1.00 0.00 H new ATOM 0 HB2 LEU A 60 71.135 -11.385 9.485 1.00 0.00 H new ATOM 0 HB3 LEU A 60 70.647 -10.858 11.084 1.00 0.00 H new ATOM 0 HG LEU A 60 71.003 -8.481 10.432 1.00 0.00 H new ATOM 0 HD11 LEU A 60 71.476 -7.912 8.069 1.00 0.00 H new ATOM 0 HD12 LEU A 60 72.815 -8.840 8.786 1.00 0.00 H new ATOM 0 HD13 LEU A 60 71.665 -9.640 7.689 1.00 0.00 H new ATOM 0 HD21 LEU A 60 69.123 -8.349 8.795 1.00 0.00 H new ATOM 0 HD22 LEU A 60 69.317 -10.082 8.439 1.00 0.00 H new ATOM 0 HD23 LEU A 60 68.786 -9.560 10.055 1.00 0.00 H new ATOM 996 N ASP A 61 72.514 -9.686 12.916 1.00 0.00 N ATOM 997 CA ASP A 61 72.667 -8.620 13.948 1.00 0.00 C ATOM 998 C ASP A 61 74.139 -8.448 14.330 1.00 0.00 C ATOM 999 O ASP A 61 74.709 -9.251 15.042 1.00 0.00 O ATOM 1000 CB ASP A 61 71.863 -8.997 15.194 1.00 0.00 C ATOM 1001 CG ASP A 61 70.366 -8.914 14.884 1.00 0.00 C ATOM 1002 OD1 ASP A 61 70.003 -8.142 14.013 1.00 0.00 O ATOM 1003 OD2 ASP A 61 69.610 -9.629 15.520 1.00 0.00 O ATOM 0 H ASP A 61 72.040 -10.532 13.231 1.00 0.00 H new ATOM 0 HA ASP A 61 72.298 -7.681 13.536 1.00 0.00 H new ATOM 0 HB2 ASP A 61 72.123 -10.006 15.515 1.00 0.00 H new ATOM 0 HB3 ASP A 61 72.112 -8.326 16.016 1.00 0.00 H new ATOM 1008 N GLU A 62 74.750 -7.402 13.853 1.00 0.00 N ATOM 1009 CA GLU A 62 76.185 -7.162 14.176 1.00 0.00 C ATOM 1010 C GLU A 62 76.345 -7.025 15.694 1.00 0.00 C ATOM 1011 O GLU A 62 77.266 -7.558 16.280 1.00 0.00 O ATOM 1012 CB GLU A 62 76.655 -5.874 13.480 1.00 0.00 C ATOM 1013 CG GLU A 62 78.134 -5.598 13.793 1.00 0.00 C ATOM 1014 CD GLU A 62 79.009 -6.677 13.152 1.00 0.00 C ATOM 1015 OE1 GLU A 62 78.522 -7.360 12.266 1.00 0.00 O ATOM 1016 OE2 GLU A 62 80.155 -6.796 13.553 1.00 0.00 O ATOM 0 H GLU A 62 74.318 -6.700 13.252 1.00 0.00 H new ATOM 0 HA GLU A 62 76.789 -7.999 13.825 1.00 0.00 H new ATOM 0 HB2 GLU A 62 76.517 -5.965 12.403 1.00 0.00 H new ATOM 0 HB3 GLU A 62 76.045 -5.033 13.810 1.00 0.00 H new ATOM 0 HG2 GLU A 62 78.418 -4.615 13.416 1.00 0.00 H new ATOM 0 HG3 GLU A 62 78.290 -5.583 14.872 1.00 0.00 H new ATOM 1023 N ASP A 63 75.463 -6.305 16.336 1.00 0.00 N ATOM 1024 CA ASP A 63 75.575 -6.117 17.815 1.00 0.00 C ATOM 1025 C ASP A 63 74.767 -7.186 18.565 1.00 0.00 C ATOM 1026 O ASP A 63 74.872 -7.314 19.769 1.00 0.00 O ATOM 1027 CB ASP A 63 75.047 -4.728 18.179 1.00 0.00 C ATOM 1028 CG ASP A 63 73.583 -4.610 17.754 1.00 0.00 C ATOM 1029 OD1 ASP A 63 73.109 -5.502 17.069 1.00 0.00 O ATOM 1030 OD2 ASP A 63 72.959 -3.628 18.123 1.00 0.00 O ATOM 0 H ASP A 63 74.668 -5.838 15.900 1.00 0.00 H new ATOM 0 HA ASP A 63 76.621 -6.212 18.106 1.00 0.00 H new ATOM 0 HB2 ASP A 63 75.139 -4.562 19.252 1.00 0.00 H new ATOM 0 HB3 ASP A 63 75.643 -3.960 17.685 1.00 0.00 H new ATOM 1035 N GLY A 64 73.968 -7.957 17.877 1.00 0.00 N ATOM 1036 CA GLY A 64 73.173 -9.014 18.574 1.00 0.00 C ATOM 1037 C GLY A 64 72.118 -8.368 19.478 1.00 0.00 C ATOM 1038 O GLY A 64 71.761 -8.902 20.509 1.00 0.00 O ATOM 0 H GLY A 64 73.831 -7.903 16.868 1.00 0.00 H new ATOM 0 HA2 GLY A 64 72.689 -9.659 17.841 1.00 0.00 H new ATOM 0 HA3 GLY A 64 73.834 -9.646 19.167 1.00 0.00 H new ATOM 1042 N ASP A 65 71.625 -7.219 19.108 1.00 0.00 N ATOM 1043 CA ASP A 65 70.606 -6.535 19.955 1.00 0.00 C ATOM 1044 C ASP A 65 69.268 -7.282 19.895 1.00 0.00 C ATOM 1045 O ASP A 65 68.329 -6.937 20.585 1.00 0.00 O ATOM 1046 CB ASP A 65 70.416 -5.104 19.451 1.00 0.00 C ATOM 1047 CG ASP A 65 69.980 -5.138 17.985 1.00 0.00 C ATOM 1048 OD1 ASP A 65 70.074 -6.197 17.386 1.00 0.00 O ATOM 1049 OD2 ASP A 65 69.567 -4.105 17.485 1.00 0.00 O ATOM 0 H ASP A 65 71.883 -6.723 18.255 1.00 0.00 H new ATOM 0 HA ASP A 65 70.952 -6.524 20.989 1.00 0.00 H new ATOM 0 HB2 ASP A 65 69.667 -4.591 20.053 1.00 0.00 H new ATOM 0 HB3 ASP A 65 71.345 -4.544 19.553 1.00 0.00 H new ATOM 1054 N GLY A 66 69.173 -8.319 19.102 1.00 0.00 N ATOM 1055 CA GLY A 66 67.896 -9.097 19.037 1.00 0.00 C ATOM 1056 C GLY A 66 66.946 -8.502 17.994 1.00 0.00 C ATOM 1057 O GLY A 66 65.941 -9.095 17.656 1.00 0.00 O ATOM 0 H GLY A 66 69.921 -8.661 18.498 1.00 0.00 H new ATOM 0 HA2 GLY A 66 68.111 -10.136 18.788 1.00 0.00 H new ATOM 0 HA3 GLY A 66 67.415 -9.096 20.015 1.00 0.00 H new ATOM 1061 N GLU A 67 67.250 -7.344 17.473 1.00 0.00 N ATOM 1062 CA GLU A 67 66.366 -6.714 16.443 1.00 0.00 C ATOM 1063 C GLU A 67 67.256 -6.055 15.390 1.00 0.00 C ATOM 1064 O GLU A 67 68.414 -5.790 15.640 1.00 0.00 O ATOM 1065 CB GLU A 67 65.465 -5.661 17.100 1.00 0.00 C ATOM 1066 CG GLU A 67 64.461 -6.358 18.021 1.00 0.00 C ATOM 1067 CD GLU A 67 63.512 -5.326 18.635 1.00 0.00 C ATOM 1068 OE1 GLU A 67 63.781 -4.144 18.496 1.00 0.00 O ATOM 1069 OE2 GLU A 67 62.533 -5.735 19.237 1.00 0.00 O ATOM 0 H GLU A 67 68.079 -6.801 17.717 1.00 0.00 H new ATOM 0 HA GLU A 67 65.731 -7.469 15.980 1.00 0.00 H new ATOM 0 HB2 GLU A 67 66.068 -4.954 17.669 1.00 0.00 H new ATOM 0 HB3 GLU A 67 64.939 -5.088 16.336 1.00 0.00 H new ATOM 0 HG2 GLU A 67 63.892 -7.098 17.459 1.00 0.00 H new ATOM 0 HG3 GLU A 67 64.989 -6.894 18.810 1.00 0.00 H new ATOM 1076 N CYS A 68 66.740 -5.784 14.211 1.00 0.00 N ATOM 1077 CA CYS A 68 67.583 -5.138 13.149 1.00 0.00 C ATOM 1078 C CYS A 68 67.201 -3.663 13.012 1.00 0.00 C ATOM 1079 O CYS A 68 66.113 -3.328 12.582 1.00 0.00 O ATOM 1080 CB CYS A 68 67.347 -5.845 11.812 1.00 0.00 C ATOM 1081 SG CYS A 68 68.132 -7.474 11.843 1.00 0.00 S ATOM 0 H CYS A 68 65.777 -5.981 13.939 1.00 0.00 H new ATOM 0 HA CYS A 68 68.634 -5.217 13.428 1.00 0.00 H new ATOM 0 HB2 CYS A 68 66.278 -5.948 11.627 1.00 0.00 H new ATOM 0 HB3 CYS A 68 67.755 -5.248 10.996 1.00 0.00 H new ATOM 0 HG CYS A 68 68.673 -7.673 13.008 1.00 0.00 H new ATOM 1087 N ASP A 69 68.082 -2.781 13.395 1.00 0.00 N ATOM 1088 CA ASP A 69 67.776 -1.326 13.309 1.00 0.00 C ATOM 1089 C ASP A 69 67.756 -0.865 11.849 1.00 0.00 C ATOM 1090 O ASP A 69 67.920 -1.639 10.928 1.00 0.00 O ATOM 1091 CB ASP A 69 68.830 -0.520 14.072 1.00 0.00 C ATOM 1092 CG ASP A 69 70.191 -0.676 13.394 1.00 0.00 C ATOM 1093 OD1 ASP A 69 70.317 -1.551 12.557 1.00 0.00 O ATOM 1094 OD2 ASP A 69 71.086 0.085 13.724 1.00 0.00 O ATOM 0 H ASP A 69 69.005 -3.007 13.766 1.00 0.00 H new ATOM 0 HA ASP A 69 66.794 -1.160 13.752 1.00 0.00 H new ATOM 0 HB2 ASP A 69 68.546 0.532 14.101 1.00 0.00 H new ATOM 0 HB3 ASP A 69 68.886 -0.863 15.105 1.00 0.00 H new ATOM 1099 N PHE A 70 67.558 0.408 11.656 1.00 0.00 N ATOM 1100 CA PHE A 70 67.529 0.970 10.278 1.00 0.00 C ATOM 1101 C PHE A 70 68.874 0.723 9.587 1.00 0.00 C ATOM 1102 O PHE A 70 68.938 0.285 8.457 1.00 0.00 O ATOM 1103 CB PHE A 70 67.276 2.476 10.341 1.00 0.00 C ATOM 1104 CG PHE A 70 67.050 3.006 8.943 1.00 0.00 C ATOM 1105 CD1 PHE A 70 68.133 3.452 8.176 1.00 0.00 C ATOM 1106 CD2 PHE A 70 65.756 3.054 8.418 1.00 0.00 C ATOM 1107 CE1 PHE A 70 67.918 3.946 6.882 1.00 0.00 C ATOM 1108 CE2 PHE A 70 65.540 3.547 7.126 1.00 0.00 C ATOM 1109 CZ PHE A 70 66.621 3.992 6.357 1.00 0.00 C ATOM 0 H PHE A 70 67.414 1.090 12.401 1.00 0.00 H new ATOM 0 HA PHE A 70 66.732 0.484 9.716 1.00 0.00 H new ATOM 0 HB2 PHE A 70 66.407 2.684 10.966 1.00 0.00 H new ATOM 0 HB3 PHE A 70 68.127 2.980 10.800 1.00 0.00 H new ATOM 0 HD1 PHE A 70 69.133 3.415 8.581 1.00 0.00 H new ATOM 0 HD2 PHE A 70 64.921 2.710 9.010 1.00 0.00 H new ATOM 0 HE1 PHE A 70 68.753 4.291 6.290 1.00 0.00 H new ATOM 0 HE2 PHE A 70 64.539 3.584 6.723 1.00 0.00 H new ATOM 0 HZ PHE A 70 66.455 4.371 5.359 1.00 0.00 H new ATOM 1119 N GLN A 71 69.948 1.060 10.243 1.00 0.00 N ATOM 1120 CA GLN A 71 71.281 0.906 9.598 1.00 0.00 C ATOM 1121 C GLN A 71 71.503 -0.557 9.208 1.00 0.00 C ATOM 1122 O GLN A 71 71.825 -0.853 8.075 1.00 0.00 O ATOM 1123 CB GLN A 71 72.369 1.355 10.572 1.00 0.00 C ATOM 1124 CG GLN A 71 72.292 2.870 10.746 1.00 0.00 C ATOM 1125 CD GLN A 71 73.221 3.299 11.881 1.00 0.00 C ATOM 1126 OE1 GLN A 71 73.631 2.488 12.688 1.00 0.00 O ATOM 1127 NE2 GLN A 71 73.570 4.552 11.977 1.00 0.00 N ATOM 0 H GLN A 71 69.961 1.433 11.192 1.00 0.00 H new ATOM 0 HA GLN A 71 71.323 1.521 8.699 1.00 0.00 H new ATOM 0 HB2 GLN A 71 72.240 0.859 11.534 1.00 0.00 H new ATOM 0 HB3 GLN A 71 73.351 1.069 10.196 1.00 0.00 H new ATOM 0 HG2 GLN A 71 72.578 3.368 9.820 1.00 0.00 H new ATOM 0 HG3 GLN A 71 71.268 3.170 10.967 1.00 0.00 H new ATOM 0 HE21 GLN A 71 73.225 5.231 11.299 1.00 0.00 H new ATOM 0 HE22 GLN A 71 74.188 4.853 12.730 1.00 0.00 H new ATOM 1136 N GLU A 72 71.338 -1.478 10.115 1.00 0.00 N ATOM 1137 CA GLU A 72 71.547 -2.908 9.735 1.00 0.00 C ATOM 1138 C GLU A 72 70.560 -3.253 8.621 1.00 0.00 C ATOM 1139 O GLU A 72 70.887 -3.907 7.652 1.00 0.00 O ATOM 1140 CB GLU A 72 71.295 -3.813 10.941 1.00 0.00 C ATOM 1141 CG GLU A 72 72.413 -3.616 11.965 1.00 0.00 C ATOM 1142 CD GLU A 72 72.168 -4.517 13.176 1.00 0.00 C ATOM 1143 OE1 GLU A 72 71.075 -5.047 13.284 1.00 0.00 O ATOM 1144 OE2 GLU A 72 73.082 -4.670 13.970 1.00 0.00 O ATOM 0 H GLU A 72 71.073 -1.311 11.086 1.00 0.00 H new ATOM 0 HA GLU A 72 72.572 -3.058 9.396 1.00 0.00 H new ATOM 0 HB2 GLU A 72 70.330 -3.579 11.390 1.00 0.00 H new ATOM 0 HB3 GLU A 72 71.255 -4.856 10.625 1.00 0.00 H new ATOM 0 HG2 GLU A 72 73.377 -3.851 11.514 1.00 0.00 H new ATOM 0 HG3 GLU A 72 72.453 -2.573 12.278 1.00 0.00 H new ATOM 1151 N PHE A 73 69.345 -2.812 8.774 1.00 0.00 N ATOM 1152 CA PHE A 73 68.311 -3.108 7.746 1.00 0.00 C ATOM 1153 C PHE A 73 68.880 -2.740 6.374 1.00 0.00 C ATOM 1154 O PHE A 73 68.695 -3.446 5.403 1.00 0.00 O ATOM 1155 CB PHE A 73 67.035 -2.311 8.019 1.00 0.00 C ATOM 1156 CG PHE A 73 66.012 -2.655 6.966 1.00 0.00 C ATOM 1157 CD1 PHE A 73 65.143 -3.733 7.167 1.00 0.00 C ATOM 1158 CD2 PHE A 73 65.945 -1.912 5.783 1.00 0.00 C ATOM 1159 CE1 PHE A 73 64.203 -4.066 6.188 1.00 0.00 C ATOM 1160 CE2 PHE A 73 65.004 -2.246 4.800 1.00 0.00 C ATOM 1161 CZ PHE A 73 64.133 -3.324 5.002 1.00 0.00 C ATOM 0 H PHE A 73 69.022 -2.258 9.568 1.00 0.00 H new ATOM 0 HA PHE A 73 68.055 -4.167 7.776 1.00 0.00 H new ATOM 0 HB2 PHE A 73 66.649 -2.545 9.011 1.00 0.00 H new ATOM 0 HB3 PHE A 73 67.247 -1.242 8.004 1.00 0.00 H new ATOM 0 HD1 PHE A 73 65.199 -4.308 8.079 1.00 0.00 H new ATOM 0 HD2 PHE A 73 66.618 -1.082 5.627 1.00 0.00 H new ATOM 0 HE1 PHE A 73 63.530 -4.896 6.346 1.00 0.00 H new ATOM 0 HE2 PHE A 73 64.950 -1.672 3.887 1.00 0.00 H new ATOM 0 HZ PHE A 73 63.408 -3.583 4.244 1.00 0.00 H new ATOM 1171 N MET A 74 69.594 -1.651 6.296 1.00 0.00 N ATOM 1172 CA MET A 74 70.205 -1.245 4.998 1.00 0.00 C ATOM 1173 C MET A 74 71.304 -2.248 4.623 1.00 0.00 C ATOM 1174 O MET A 74 71.589 -2.467 3.462 1.00 0.00 O ATOM 1175 CB MET A 74 70.823 0.151 5.129 1.00 0.00 C ATOM 1176 CG MET A 74 69.715 1.197 5.275 1.00 0.00 C ATOM 1177 SD MET A 74 68.785 1.331 3.725 1.00 0.00 S ATOM 1178 CE MET A 74 70.071 2.120 2.719 1.00 0.00 C ATOM 0 H MET A 74 69.781 -1.023 7.077 1.00 0.00 H new ATOM 0 HA MET A 74 69.435 -1.229 4.226 1.00 0.00 H new ATOM 0 HB2 MET A 74 71.485 0.186 5.994 1.00 0.00 H new ATOM 0 HB3 MET A 74 71.432 0.373 4.253 1.00 0.00 H new ATOM 0 HG2 MET A 74 69.045 0.919 6.088 1.00 0.00 H new ATOM 0 HG3 MET A 74 70.147 2.163 5.535 1.00 0.00 H new ATOM 0 HE1 MET A 74 69.606 2.680 1.908 1.00 0.00 H new ATOM 0 HE2 MET A 74 70.654 2.799 3.341 1.00 0.00 H new ATOM 0 HE3 MET A 74 70.727 1.356 2.302 1.00 0.00 H new ATOM 1188 N ALA A 75 71.920 -2.865 5.598 1.00 0.00 N ATOM 1189 CA ALA A 75 72.990 -3.858 5.287 1.00 0.00 C ATOM 1190 C ALA A 75 72.361 -5.037 4.544 1.00 0.00 C ATOM 1191 O ALA A 75 72.766 -5.394 3.456 1.00 0.00 O ATOM 1192 CB ALA A 75 73.630 -4.352 6.585 1.00 0.00 C ATOM 0 H ALA A 75 71.730 -2.725 6.590 1.00 0.00 H new ATOM 0 HA ALA A 75 73.758 -3.394 4.669 1.00 0.00 H new ATOM 0 HB1 ALA A 75 74.410 -5.077 6.353 1.00 0.00 H new ATOM 0 HB2 ALA A 75 74.066 -3.508 7.120 1.00 0.00 H new ATOM 0 HB3 ALA A 75 72.871 -4.824 7.209 1.00 0.00 H new ATOM 1198 N PHE A 76 71.374 -5.646 5.140 1.00 0.00 N ATOM 1199 CA PHE A 76 70.712 -6.812 4.485 1.00 0.00 C ATOM 1200 C PHE A 76 70.331 -6.407 3.063 1.00 0.00 C ATOM 1201 O PHE A 76 70.487 -7.158 2.122 1.00 0.00 O ATOM 1202 CB PHE A 76 69.441 -7.185 5.248 1.00 0.00 C ATOM 1203 CG PHE A 76 68.900 -8.482 4.700 1.00 0.00 C ATOM 1204 CD1 PHE A 76 68.005 -8.468 3.625 1.00 0.00 C ATOM 1205 CD2 PHE A 76 69.295 -9.699 5.268 1.00 0.00 C ATOM 1206 CE1 PHE A 76 67.505 -9.674 3.115 1.00 0.00 C ATOM 1207 CE2 PHE A 76 68.796 -10.903 4.759 1.00 0.00 C ATOM 1208 CZ PHE A 76 67.902 -10.892 3.683 1.00 0.00 C ATOM 0 H PHE A 76 70.996 -5.388 6.052 1.00 0.00 H new ATOM 0 HA PHE A 76 71.390 -7.666 4.478 1.00 0.00 H new ATOM 0 HB2 PHE A 76 69.657 -7.287 6.312 1.00 0.00 H new ATOM 0 HB3 PHE A 76 68.697 -6.395 5.148 1.00 0.00 H new ATOM 0 HD1 PHE A 76 67.700 -7.529 3.188 1.00 0.00 H new ATOM 0 HD2 PHE A 76 69.985 -9.709 6.099 1.00 0.00 H new ATOM 0 HE1 PHE A 76 66.814 -9.665 2.285 1.00 0.00 H new ATOM 0 HE2 PHE A 76 69.101 -11.842 5.197 1.00 0.00 H new ATOM 0 HZ PHE A 76 67.518 -11.822 3.290 1.00 0.00 H new ATOM 1218 N VAL A 77 69.863 -5.204 2.907 1.00 0.00 N ATOM 1219 CA VAL A 77 69.506 -4.728 1.548 1.00 0.00 C ATOM 1220 C VAL A 77 70.775 -4.777 0.689 1.00 0.00 C ATOM 1221 O VAL A 77 70.759 -5.244 -0.432 1.00 0.00 O ATOM 1222 CB VAL A 77 68.971 -3.291 1.611 1.00 0.00 C ATOM 1223 CG1 VAL A 77 68.826 -2.736 0.191 1.00 0.00 C ATOM 1224 CG2 VAL A 77 67.605 -3.279 2.305 1.00 0.00 C ATOM 0 H VAL A 77 69.713 -4.532 3.660 1.00 0.00 H new ATOM 0 HA VAL A 77 68.728 -5.359 1.119 1.00 0.00 H new ATOM 0 HB VAL A 77 69.669 -2.672 2.175 1.00 0.00 H new ATOM 0 HG11 VAL A 77 68.446 -1.715 0.236 1.00 0.00 H new ATOM 0 HG12 VAL A 77 69.798 -2.740 -0.302 1.00 0.00 H new ATOM 0 HG13 VAL A 77 68.131 -3.357 -0.373 1.00 0.00 H new ATOM 0 HG21 VAL A 77 67.228 -2.257 2.348 1.00 0.00 H new ATOM 0 HG22 VAL A 77 66.907 -3.900 1.744 1.00 0.00 H new ATOM 0 HG23 VAL A 77 67.708 -3.671 3.317 1.00 0.00 H new ATOM 1234 N SER A 78 71.882 -4.308 1.216 1.00 0.00 N ATOM 1235 CA SER A 78 73.155 -4.338 0.436 1.00 0.00 C ATOM 1236 C SER A 78 73.546 -5.791 0.158 1.00 0.00 C ATOM 1237 O SER A 78 73.951 -6.139 -0.933 1.00 0.00 O ATOM 1238 CB SER A 78 74.262 -3.654 1.241 1.00 0.00 C ATOM 1239 OG SER A 78 74.636 -4.486 2.331 1.00 0.00 O ATOM 0 H SER A 78 71.956 -3.907 2.151 1.00 0.00 H new ATOM 0 HA SER A 78 73.017 -3.812 -0.509 1.00 0.00 H new ATOM 0 HB2 SER A 78 75.125 -3.462 0.603 1.00 0.00 H new ATOM 0 HB3 SER A 78 73.916 -2.688 1.609 1.00 0.00 H new ATOM 0 HG SER A 78 73.833 -4.773 2.814 1.00 0.00 H new ATOM 1245 N MET A 79 73.448 -6.641 1.147 1.00 0.00 N ATOM 1246 CA MET A 79 73.835 -8.069 0.948 1.00 0.00 C ATOM 1247 C MET A 79 73.160 -8.595 -0.316 1.00 0.00 C ATOM 1248 O MET A 79 73.766 -9.272 -1.123 1.00 0.00 O ATOM 1249 CB MET A 79 73.373 -8.890 2.155 1.00 0.00 C ATOM 1250 CG MET A 79 73.910 -10.320 2.052 1.00 0.00 C ATOM 1251 SD MET A 79 73.348 -11.284 3.481 1.00 0.00 S ATOM 1252 CE MET A 79 74.355 -10.469 4.749 1.00 0.00 C ATOM 0 H MET A 79 73.117 -6.408 2.083 1.00 0.00 H new ATOM 0 HA MET A 79 74.917 -8.151 0.847 1.00 0.00 H new ATOM 0 HB2 MET A 79 73.724 -8.426 3.077 1.00 0.00 H new ATOM 0 HB3 MET A 79 72.284 -8.904 2.200 1.00 0.00 H new ATOM 0 HG2 MET A 79 73.564 -10.784 1.128 1.00 0.00 H new ATOM 0 HG3 MET A 79 74.999 -10.308 2.014 1.00 0.00 H new ATOM 0 HE1 MET A 79 74.876 -11.222 5.340 1.00 0.00 H new ATOM 0 HE2 MET A 79 75.084 -9.816 4.270 1.00 0.00 H new ATOM 0 HE3 MET A 79 73.711 -9.878 5.401 1.00 0.00 H new ATOM 1262 N VAL A 80 71.920 -8.263 -0.503 1.00 0.00 N ATOM 1263 CA VAL A 80 71.206 -8.712 -1.724 1.00 0.00 C ATOM 1264 C VAL A 80 71.899 -8.104 -2.945 1.00 0.00 C ATOM 1265 O VAL A 80 71.948 -8.694 -4.007 1.00 0.00 O ATOM 1266 CB VAL A 80 69.752 -8.252 -1.660 1.00 0.00 C ATOM 1267 CG1 VAL A 80 69.045 -8.614 -2.966 1.00 0.00 C ATOM 1268 CG2 VAL A 80 69.055 -8.956 -0.495 1.00 0.00 C ATOM 0 H VAL A 80 71.366 -7.697 0.140 1.00 0.00 H new ATOM 0 HA VAL A 80 71.226 -9.799 -1.796 1.00 0.00 H new ATOM 0 HB VAL A 80 69.715 -7.172 -1.515 1.00 0.00 H new ATOM 0 HG11 VAL A 80 68.007 -8.286 -2.921 1.00 0.00 H new ATOM 0 HG12 VAL A 80 69.545 -8.121 -3.799 1.00 0.00 H new ATOM 0 HG13 VAL A 80 69.078 -9.694 -3.110 1.00 0.00 H new ATOM 0 HG21 VAL A 80 68.016 -8.632 -0.443 1.00 0.00 H new ATOM 0 HG22 VAL A 80 69.092 -10.035 -0.647 1.00 0.00 H new ATOM 0 HG23 VAL A 80 69.560 -8.704 0.437 1.00 0.00 H new ATOM 1278 N THR A 81 72.464 -6.937 -2.787 1.00 0.00 N ATOM 1279 CA THR A 81 73.189 -6.301 -3.921 1.00 0.00 C ATOM 1280 C THR A 81 74.567 -6.961 -4.054 1.00 0.00 C ATOM 1281 O THR A 81 74.983 -7.347 -5.127 1.00 0.00 O ATOM 1282 CB THR A 81 73.353 -4.804 -3.655 1.00 0.00 C ATOM 1283 OG1 THR A 81 72.082 -4.231 -3.377 1.00 0.00 O ATOM 1284 CG2 THR A 81 73.950 -4.134 -4.892 1.00 0.00 C ATOM 0 H THR A 81 72.454 -6.398 -1.921 1.00 0.00 H new ATOM 0 HA THR A 81 72.625 -6.433 -4.844 1.00 0.00 H new ATOM 0 HB THR A 81 74.014 -4.655 -2.802 1.00 0.00 H new ATOM 0 HG1 THR A 81 72.186 -3.272 -3.205 1.00 0.00 H new ATOM 0 HG21 THR A 81 74.068 -3.067 -4.706 1.00 0.00 H new ATOM 0 HG22 THR A 81 74.923 -4.574 -5.111 1.00 0.00 H new ATOM 0 HG23 THR A 81 73.285 -4.283 -5.743 1.00 0.00 H new ATOM 1292 N THR A 82 75.271 -7.100 -2.958 1.00 0.00 N ATOM 1293 CA THR A 82 76.614 -7.742 -2.995 1.00 0.00 C ATOM 1294 C THR A 82 76.453 -9.242 -3.257 1.00 0.00 C ATOM 1295 O THR A 82 77.396 -9.927 -3.599 1.00 0.00 O ATOM 1296 CB THR A 82 77.324 -7.540 -1.653 1.00 0.00 C ATOM 1297 OG1 THR A 82 76.690 -8.327 -0.657 1.00 0.00 O ATOM 1298 CG2 THR A 82 77.274 -6.066 -1.246 1.00 0.00 C ATOM 0 H THR A 82 74.967 -6.793 -2.034 1.00 0.00 H new ATOM 0 HA THR A 82 77.206 -7.288 -3.790 1.00 0.00 H new ATOM 0 HB THR A 82 78.365 -7.846 -1.754 1.00 0.00 H new ATOM 0 HG1 THR A 82 77.146 -8.198 0.201 1.00 0.00 H new ATOM 0 HG21 THR A 82 77.782 -5.935 -0.291 1.00 0.00 H new ATOM 0 HG22 THR A 82 77.769 -5.462 -2.006 1.00 0.00 H new ATOM 0 HG23 THR A 82 76.235 -5.750 -1.151 1.00 0.00 H new ATOM 1306 N ALA A 83 75.260 -9.754 -3.107 1.00 0.00 N ATOM 1307 CA ALA A 83 75.032 -11.207 -3.354 1.00 0.00 C ATOM 1308 C ALA A 83 75.340 -11.523 -4.817 1.00 0.00 C ATOM 1309 O ALA A 83 75.925 -12.540 -5.135 1.00 0.00 O ATOM 1310 CB ALA A 83 73.570 -11.543 -3.057 1.00 0.00 C ATOM 0 H ALA A 83 74.433 -9.228 -2.824 1.00 0.00 H new ATOM 0 HA ALA A 83 75.682 -11.798 -2.709 1.00 0.00 H new ATOM 0 HB1 ALA A 83 73.397 -12.604 -3.236 1.00 0.00 H new ATOM 0 HB2 ALA A 83 73.347 -11.309 -2.016 1.00 0.00 H new ATOM 0 HB3 ALA A 83 72.922 -10.955 -3.707 1.00 0.00 H new ATOM 1316 N CYS A 84 74.948 -10.660 -5.712 1.00 0.00 N ATOM 1317 CA CYS A 84 75.216 -10.913 -7.154 1.00 0.00 C ATOM 1318 C CYS A 84 76.671 -10.564 -7.458 1.00 0.00 C ATOM 1319 O CYS A 84 76.974 -9.495 -7.952 1.00 0.00 O ATOM 1320 CB CYS A 84 74.292 -10.043 -8.010 1.00 0.00 C ATOM 1321 SG CYS A 84 72.610 -10.713 -7.966 1.00 0.00 S ATOM 0 H CYS A 84 74.454 -9.791 -5.507 1.00 0.00 H new ATOM 0 HA CYS A 84 75.032 -11.963 -7.383 1.00 0.00 H new ATOM 0 HB2 CYS A 84 74.295 -9.018 -7.639 1.00 0.00 H new ATOM 0 HB3 CYS A 84 74.655 -10.012 -9.037 1.00 0.00 H new ATOM 0 HG CYS A 84 71.828 -9.970 -8.692 1.00 0.00 H new ATOM 1450 N SER B 1 59.694 -6.937 -8.824 1.00 0.00 N ATOM 1451 CA SER B 1 59.388 -6.218 -7.556 1.00 0.00 C ATOM 1452 C SER B 1 60.030 -4.829 -7.589 1.00 0.00 C ATOM 1453 O SER B 1 61.119 -4.653 -8.097 1.00 0.00 O ATOM 1454 CB SER B 1 59.957 -7.011 -6.379 1.00 0.00 C ATOM 1455 OG SER B 1 59.472 -8.347 -6.434 1.00 0.00 O ATOM 0 H1 SER B 1 59.733 -7.960 -8.642 1.00 0.00 H new ATOM 0 H2 SER B 1 58.951 -6.738 -9.524 1.00 0.00 H new ATOM 0 H3 SER B 1 60.612 -6.616 -9.192 1.00 0.00 H new ATOM 0 HA SER B 1 58.309 -6.116 -7.444 1.00 0.00 H new ATOM 0 HB2 SER B 1 61.046 -7.006 -6.415 1.00 0.00 H new ATOM 0 HB3 SER B 1 59.667 -6.545 -5.437 1.00 0.00 H new ATOM 0 HG SER B 1 59.836 -8.859 -5.682 1.00 0.00 H new ATOM 1463 N GLU B 2 59.360 -3.836 -7.065 1.00 0.00 N ATOM 1464 CA GLU B 2 59.927 -2.456 -7.084 1.00 0.00 C ATOM 1465 C GLU B 2 61.263 -2.419 -6.339 1.00 0.00 C ATOM 1466 O GLU B 2 62.166 -1.703 -6.724 1.00 0.00 O ATOM 1467 CB GLU B 2 58.943 -1.488 -6.419 1.00 0.00 C ATOM 1468 CG GLU B 2 59.533 -0.073 -6.411 1.00 0.00 C ATOM 1469 CD GLU B 2 58.483 0.922 -5.912 1.00 0.00 C ATOM 1470 OE1 GLU B 2 57.353 0.507 -5.707 1.00 0.00 O ATOM 1471 OE2 GLU B 2 58.826 2.080 -5.739 1.00 0.00 O ATOM 0 H GLU B 2 58.444 -3.922 -6.625 1.00 0.00 H new ATOM 0 HA GLU B 2 60.092 -2.158 -8.119 1.00 0.00 H new ATOM 0 HB2 GLU B 2 57.994 -1.493 -6.956 1.00 0.00 H new ATOM 0 HB3 GLU B 2 58.734 -1.811 -5.399 1.00 0.00 H new ATOM 0 HG2 GLU B 2 60.413 -0.040 -5.769 1.00 0.00 H new ATOM 0 HG3 GLU B 2 59.859 0.201 -7.414 1.00 0.00 H new ATOM 1478 N LEU B 3 61.415 -3.169 -5.283 1.00 0.00 N ATOM 1479 CA LEU B 3 62.710 -3.146 -4.547 1.00 0.00 C ATOM 1480 C LEU B 3 63.814 -3.757 -5.419 1.00 0.00 C ATOM 1481 O LEU B 3 64.959 -3.356 -5.353 1.00 0.00 O ATOM 1482 CB LEU B 3 62.595 -3.958 -3.248 1.00 0.00 C ATOM 1483 CG LEU B 3 61.783 -3.192 -2.186 1.00 0.00 C ATOM 1484 CD1 LEU B 3 62.573 -1.980 -1.663 1.00 0.00 C ATOM 1485 CD2 LEU B 3 60.452 -2.720 -2.781 1.00 0.00 C ATOM 0 H LEU B 3 60.704 -3.792 -4.900 1.00 0.00 H new ATOM 0 HA LEU B 3 62.956 -2.111 -4.309 1.00 0.00 H new ATOM 0 HB2 LEU B 3 62.117 -4.916 -3.455 1.00 0.00 H new ATOM 0 HB3 LEU B 3 63.591 -4.176 -2.862 1.00 0.00 H new ATOM 0 HG LEU B 3 61.589 -3.868 -1.353 1.00 0.00 H new ATOM 0 HD11 LEU B 3 61.980 -1.455 -0.914 1.00 0.00 H new ATOM 0 HD12 LEU B 3 63.506 -2.320 -1.213 1.00 0.00 H new ATOM 0 HD13 LEU B 3 62.794 -1.305 -2.490 1.00 0.00 H new ATOM 0 HD21 LEU B 3 59.886 -2.180 -2.022 1.00 0.00 H new ATOM 0 HD22 LEU B 3 60.645 -2.061 -3.628 1.00 0.00 H new ATOM 0 HD23 LEU B 3 59.877 -3.583 -3.117 1.00 0.00 H new ATOM 1497 N GLU B 4 63.483 -4.722 -6.237 1.00 0.00 N ATOM 1498 CA GLU B 4 64.521 -5.350 -7.105 1.00 0.00 C ATOM 1499 C GLU B 4 65.129 -4.290 -8.025 1.00 0.00 C ATOM 1500 O GLU B 4 66.330 -4.227 -8.209 1.00 0.00 O ATOM 1501 CB GLU B 4 63.864 -6.446 -7.952 1.00 0.00 C ATOM 1502 CG GLU B 4 64.917 -7.137 -8.820 1.00 0.00 C ATOM 1503 CD GLU B 4 64.257 -8.261 -9.620 1.00 0.00 C ATOM 1504 OE1 GLU B 4 63.124 -8.591 -9.312 1.00 0.00 O ATOM 1505 OE2 GLU B 4 64.902 -8.784 -10.514 1.00 0.00 O ATOM 0 H GLU B 4 62.542 -5.101 -6.341 1.00 0.00 H new ATOM 0 HA GLU B 4 65.307 -5.782 -6.486 1.00 0.00 H new ATOM 0 HB2 GLU B 4 63.379 -7.176 -7.304 1.00 0.00 H new ATOM 0 HB3 GLU B 4 63.087 -6.013 -8.583 1.00 0.00 H new ATOM 0 HG2 GLU B 4 65.377 -6.416 -9.496 1.00 0.00 H new ATOM 0 HG3 GLU B 4 65.713 -7.540 -8.194 1.00 0.00 H new ATOM 1512 N LYS B 5 64.308 -3.469 -8.609 1.00 0.00 N ATOM 1513 CA LYS B 5 64.812 -2.409 -9.530 1.00 0.00 C ATOM 1514 C LYS B 5 65.761 -1.470 -8.785 1.00 0.00 C ATOM 1515 O LYS B 5 66.756 -1.024 -9.322 1.00 0.00 O ATOM 1516 CB LYS B 5 63.623 -1.612 -10.077 1.00 0.00 C ATOM 1517 CG LYS B 5 62.825 -2.493 -11.041 1.00 0.00 C ATOM 1518 CD LYS B 5 61.618 -1.716 -11.589 1.00 0.00 C ATOM 1519 CE LYS B 5 62.077 -0.583 -12.525 1.00 0.00 C ATOM 1520 NZ LYS B 5 62.360 0.645 -11.729 1.00 0.00 N ATOM 0 H LYS B 5 63.295 -3.484 -8.488 1.00 0.00 H new ATOM 0 HA LYS B 5 65.354 -2.875 -10.353 1.00 0.00 H new ATOM 0 HB2 LYS B 5 62.986 -1.279 -9.258 1.00 0.00 H new ATOM 0 HB3 LYS B 5 63.975 -0.717 -10.590 1.00 0.00 H new ATOM 0 HG2 LYS B 5 63.463 -2.817 -11.863 1.00 0.00 H new ATOM 0 HG3 LYS B 5 62.486 -3.393 -10.528 1.00 0.00 H new ATOM 0 HD2 LYS B 5 60.957 -2.395 -12.129 1.00 0.00 H new ATOM 0 HD3 LYS B 5 61.042 -1.300 -10.763 1.00 0.00 H new ATOM 0 HE2 LYS B 5 62.970 -0.888 -13.070 1.00 0.00 H new ATOM 0 HE3 LYS B 5 61.306 -0.377 -13.267 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 61.816 1.442 -12.116 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 62.086 0.487 -10.738 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 63.376 0.863 -11.777 1.00 0.00 H new ATOM 1534 N ALA B 6 65.450 -1.146 -7.563 1.00 0.00 N ATOM 1535 CA ALA B 6 66.328 -0.215 -6.800 1.00 0.00 C ATOM 1536 C ALA B 6 67.736 -0.808 -6.682 1.00 0.00 C ATOM 1537 O ALA B 6 68.718 -0.147 -6.962 1.00 0.00 O ATOM 1538 CB ALA B 6 65.740 0.015 -5.404 1.00 0.00 C ATOM 0 H ALA B 6 64.629 -1.483 -7.060 1.00 0.00 H new ATOM 0 HA ALA B 6 66.388 0.738 -7.326 1.00 0.00 H new ATOM 0 HB1 ALA B 6 66.383 0.696 -4.846 1.00 0.00 H new ATOM 0 HB2 ALA B 6 64.744 0.449 -5.496 1.00 0.00 H new ATOM 0 HB3 ALA B 6 65.674 -0.936 -4.876 1.00 0.00 H new ATOM 1544 N MET B 7 67.853 -2.043 -6.274 1.00 0.00 N ATOM 1545 CA MET B 7 69.209 -2.653 -6.150 1.00 0.00 C ATOM 1546 C MET B 7 69.836 -2.823 -7.539 1.00 0.00 C ATOM 1547 O MET B 7 70.996 -2.528 -7.748 1.00 0.00 O ATOM 1548 CB MET B 7 69.084 -4.024 -5.479 1.00 0.00 C ATOM 1549 CG MET B 7 68.700 -3.837 -4.008 1.00 0.00 C ATOM 1550 SD MET B 7 68.554 -5.454 -3.206 1.00 0.00 S ATOM 1551 CE MET B 7 67.096 -6.046 -4.100 1.00 0.00 C ATOM 0 H MET B 7 67.075 -2.652 -6.023 1.00 0.00 H new ATOM 0 HA MET B 7 69.843 -2.001 -5.549 1.00 0.00 H new ATOM 0 HB2 MET B 7 68.331 -4.624 -5.990 1.00 0.00 H new ATOM 0 HB3 MET B 7 70.027 -4.565 -5.554 1.00 0.00 H new ATOM 0 HG2 MET B 7 69.453 -3.234 -3.499 1.00 0.00 H new ATOM 0 HG3 MET B 7 67.756 -3.297 -3.934 1.00 0.00 H new ATOM 0 HE1 MET B 7 66.437 -6.574 -3.411 1.00 0.00 H new ATOM 0 HE2 MET B 7 66.565 -5.198 -4.532 1.00 0.00 H new ATOM 0 HE3 MET B 7 67.407 -6.723 -4.896 1.00 0.00 H new ATOM 1561 N VAL B 8 69.081 -3.309 -8.489 1.00 0.00 N ATOM 1562 CA VAL B 8 69.640 -3.519 -9.859 1.00 0.00 C ATOM 1563 C VAL B 8 70.118 -2.185 -10.443 1.00 0.00 C ATOM 1564 O VAL B 8 71.143 -2.122 -11.094 1.00 0.00 O ATOM 1565 CB VAL B 8 68.547 -4.107 -10.765 1.00 0.00 C ATOM 1566 CG1 VAL B 8 69.036 -4.162 -12.218 1.00 0.00 C ATOM 1567 CG2 VAL B 8 68.204 -5.524 -10.293 1.00 0.00 C ATOM 0 H VAL B 8 68.101 -3.570 -8.376 1.00 0.00 H new ATOM 0 HA VAL B 8 70.485 -4.205 -9.800 1.00 0.00 H new ATOM 0 HB VAL B 8 67.662 -3.473 -10.711 1.00 0.00 H new ATOM 0 HG11 VAL B 8 68.253 -4.580 -12.850 1.00 0.00 H new ATOM 0 HG12 VAL B 8 69.278 -3.155 -12.559 1.00 0.00 H new ATOM 0 HG13 VAL B 8 69.925 -4.789 -12.279 1.00 0.00 H new ATOM 0 HG21 VAL B 8 67.429 -5.943 -10.934 1.00 0.00 H new ATOM 0 HG22 VAL B 8 69.095 -6.150 -10.344 1.00 0.00 H new ATOM 0 HG23 VAL B 8 67.844 -5.488 -9.265 1.00 0.00 H new ATOM 1577 N ALA B 9 69.387 -1.123 -10.237 1.00 0.00 N ATOM 1578 CA ALA B 9 69.814 0.186 -10.809 1.00 0.00 C ATOM 1579 C ALA B 9 71.183 0.580 -10.262 1.00 0.00 C ATOM 1580 O ALA B 9 72.038 1.053 -10.982 1.00 0.00 O ATOM 1581 CB ALA B 9 68.797 1.264 -10.424 1.00 0.00 C ATOM 0 H ALA B 9 68.519 -1.104 -9.702 1.00 0.00 H new ATOM 0 HA ALA B 9 69.872 0.094 -11.894 1.00 0.00 H new ATOM 0 HB1 ALA B 9 69.107 2.222 -10.841 1.00 0.00 H new ATOM 0 HB2 ALA B 9 67.817 0.997 -10.818 1.00 0.00 H new ATOM 0 HB3 ALA B 9 68.742 1.342 -9.338 1.00 0.00 H new ATOM 1587 N LEU B 10 71.394 0.403 -8.990 1.00 0.00 N ATOM 1588 CA LEU B 10 72.704 0.788 -8.398 1.00 0.00 C ATOM 1589 C LEU B 10 73.836 -0.002 -9.060 1.00 0.00 C ATOM 1590 O LEU B 10 74.856 0.550 -9.422 1.00 0.00 O ATOM 1591 CB LEU B 10 72.690 0.490 -6.897 1.00 0.00 C ATOM 1592 CG LEU B 10 71.684 1.409 -6.185 1.00 0.00 C ATOM 1593 CD1 LEU B 10 71.505 0.932 -4.740 1.00 0.00 C ATOM 1594 CD2 LEU B 10 72.188 2.867 -6.186 1.00 0.00 C ATOM 0 H LEU B 10 70.718 0.009 -8.335 1.00 0.00 H new ATOM 0 HA LEU B 10 72.869 1.853 -8.563 1.00 0.00 H new ATOM 0 HB2 LEU B 10 72.424 -0.553 -6.728 1.00 0.00 H new ATOM 0 HB3 LEU B 10 73.686 0.636 -6.480 1.00 0.00 H new ATOM 0 HG LEU B 10 70.731 1.369 -6.713 1.00 0.00 H new ATOM 0 HD11 LEU B 10 70.793 1.579 -4.229 1.00 0.00 H new ATOM 0 HD12 LEU B 10 71.131 -0.092 -4.739 1.00 0.00 H new ATOM 0 HD13 LEU B 10 72.464 0.969 -4.223 1.00 0.00 H new ATOM 0 HD21 LEU B 10 71.463 3.503 -5.678 1.00 0.00 H new ATOM 0 HD22 LEU B 10 73.145 2.921 -5.667 1.00 0.00 H new ATOM 0 HD23 LEU B 10 72.312 3.208 -7.214 1.00 0.00 H new ATOM 1606 N ILE B 11 73.675 -1.289 -9.218 1.00 0.00 N ATOM 1607 CA ILE B 11 74.757 -2.093 -9.853 1.00 0.00 C ATOM 1608 C ILE B 11 75.017 -1.573 -11.269 1.00 0.00 C ATOM 1609 O ILE B 11 76.140 -1.302 -11.645 1.00 0.00 O ATOM 1610 CB ILE B 11 74.330 -3.562 -9.915 1.00 0.00 C ATOM 1611 CG1 ILE B 11 74.248 -4.124 -8.493 1.00 0.00 C ATOM 1612 CG2 ILE B 11 75.350 -4.362 -10.729 1.00 0.00 C ATOM 1613 CD1 ILE B 11 73.606 -5.513 -8.526 1.00 0.00 C ATOM 0 H ILE B 11 72.847 -1.814 -8.937 1.00 0.00 H new ATOM 0 HA ILE B 11 75.670 -2.005 -9.264 1.00 0.00 H new ATOM 0 HB ILE B 11 73.354 -3.638 -10.394 1.00 0.00 H new ATOM 0 HG12 ILE B 11 75.245 -4.183 -8.057 1.00 0.00 H new ATOM 0 HG13 ILE B 11 73.663 -3.457 -7.861 1.00 0.00 H new ATOM 0 HG21 ILE B 11 75.043 -5.407 -10.771 1.00 0.00 H new ATOM 0 HG22 ILE B 11 75.405 -3.959 -11.740 1.00 0.00 H new ATOM 0 HG23 ILE B 11 76.329 -4.290 -10.256 1.00 0.00 H new ATOM 0 HD11 ILE B 11 73.549 -5.911 -7.513 1.00 0.00 H new ATOM 0 HD12 ILE B 11 72.602 -5.440 -8.945 1.00 0.00 H new ATOM 0 HD13 ILE B 11 74.209 -6.178 -9.144 1.00 0.00 H new ATOM 1625 N ASP B 12 73.987 -1.440 -12.058 1.00 0.00 N ATOM 1626 CA ASP B 12 74.184 -0.944 -13.447 1.00 0.00 C ATOM 1627 C ASP B 12 74.807 0.453 -13.405 1.00 0.00 C ATOM 1628 O ASP B 12 75.686 0.773 -14.179 1.00 0.00 O ATOM 1629 CB ASP B 12 72.833 -0.881 -14.168 1.00 0.00 C ATOM 1630 CG ASP B 12 72.321 -2.299 -14.437 1.00 0.00 C ATOM 1631 OD1 ASP B 12 73.109 -3.224 -14.334 1.00 0.00 O ATOM 1632 OD2 ASP B 12 71.146 -2.434 -14.741 1.00 0.00 O ATOM 0 H ASP B 12 73.023 -1.652 -11.802 1.00 0.00 H new ATOM 0 HA ASP B 12 74.847 -1.623 -13.983 1.00 0.00 H new ATOM 0 HB2 ASP B 12 72.112 -0.333 -13.561 1.00 0.00 H new ATOM 0 HB3 ASP B 12 72.937 -0.338 -15.107 1.00 0.00 H new ATOM 1637 N VAL B 13 74.365 1.285 -12.503 1.00 0.00 N ATOM 1638 CA VAL B 13 74.948 2.655 -12.417 1.00 0.00 C ATOM 1639 C VAL B 13 76.382 2.568 -11.889 1.00 0.00 C ATOM 1640 O VAL B 13 77.268 3.262 -12.347 1.00 0.00 O ATOM 1641 CB VAL B 13 74.110 3.527 -11.469 1.00 0.00 C ATOM 1642 CG1 VAL B 13 74.846 4.845 -11.194 1.00 0.00 C ATOM 1643 CG2 VAL B 13 72.753 3.829 -12.109 1.00 0.00 C ATOM 0 H VAL B 13 73.631 1.079 -11.826 1.00 0.00 H new ATOM 0 HA VAL B 13 74.947 3.103 -13.411 1.00 0.00 H new ATOM 0 HB VAL B 13 73.959 2.992 -10.532 1.00 0.00 H new ATOM 0 HG11 VAL B 13 74.249 5.461 -10.521 1.00 0.00 H new ATOM 0 HG12 VAL B 13 75.811 4.634 -10.733 1.00 0.00 H new ATOM 0 HG13 VAL B 13 75.001 5.378 -12.132 1.00 0.00 H new ATOM 0 HG21 VAL B 13 72.162 4.447 -11.434 1.00 0.00 H new ATOM 0 HG22 VAL B 13 72.904 4.360 -13.049 1.00 0.00 H new ATOM 0 HG23 VAL B 13 72.225 2.895 -12.301 1.00 0.00 H new ATOM 1653 N PHE B 14 76.609 1.738 -10.910 1.00 0.00 N ATOM 1654 CA PHE B 14 77.973 1.624 -10.325 1.00 0.00 C ATOM 1655 C PHE B 14 78.969 1.089 -11.360 1.00 0.00 C ATOM 1656 O PHE B 14 79.980 1.708 -11.631 1.00 0.00 O ATOM 1657 CB PHE B 14 77.912 0.665 -9.134 1.00 0.00 C ATOM 1658 CG PHE B 14 79.295 0.442 -8.574 1.00 0.00 C ATOM 1659 CD1 PHE B 14 80.128 -0.534 -9.135 1.00 0.00 C ATOM 1660 CD2 PHE B 14 79.742 1.205 -7.489 1.00 0.00 C ATOM 1661 CE1 PHE B 14 81.408 -0.746 -8.611 1.00 0.00 C ATOM 1662 CE2 PHE B 14 81.022 0.991 -6.964 1.00 0.00 C ATOM 1663 CZ PHE B 14 81.856 0.016 -7.526 1.00 0.00 C ATOM 0 H PHE B 14 75.906 1.131 -10.488 1.00 0.00 H new ATOM 0 HA PHE B 14 78.309 2.611 -10.007 1.00 0.00 H new ATOM 0 HB2 PHE B 14 77.260 1.074 -8.362 1.00 0.00 H new ATOM 0 HB3 PHE B 14 77.480 -0.286 -9.445 1.00 0.00 H new ATOM 0 HD1 PHE B 14 79.783 -1.123 -9.972 1.00 0.00 H new ATOM 0 HD2 PHE B 14 79.100 1.958 -7.057 1.00 0.00 H new ATOM 0 HE1 PHE B 14 82.051 -1.498 -9.044 1.00 0.00 H new ATOM 0 HE2 PHE B 14 81.367 1.578 -6.125 1.00 0.00 H new ATOM 0 HZ PHE B 14 82.844 -0.148 -7.122 1.00 0.00 H new ATOM 1673 N HIS B 15 78.728 -0.073 -11.900 1.00 0.00 N ATOM 1674 CA HIS B 15 79.698 -0.660 -12.873 1.00 0.00 C ATOM 1675 C HIS B 15 79.892 0.241 -14.094 1.00 0.00 C ATOM 1676 O HIS B 15 81.000 0.398 -14.569 1.00 0.00 O ATOM 1677 CB HIS B 15 79.194 -2.035 -13.326 1.00 0.00 C ATOM 1678 CG HIS B 15 79.381 -3.033 -12.214 1.00 0.00 C ATOM 1679 ND1 HIS B 15 78.364 -3.880 -11.797 1.00 0.00 N ATOM 1680 CD2 HIS B 15 80.465 -3.334 -11.425 1.00 0.00 C ATOM 1681 CE1 HIS B 15 78.854 -4.644 -10.802 1.00 0.00 C ATOM 1682 NE2 HIS B 15 80.127 -4.349 -10.539 1.00 0.00 N ATOM 0 H HIS B 15 77.903 -0.643 -11.712 1.00 0.00 H new ATOM 0 HA HIS B 15 80.661 -0.756 -12.372 1.00 0.00 H new ATOM 0 HB2 HIS B 15 78.141 -1.975 -13.601 1.00 0.00 H new ATOM 0 HB3 HIS B 15 79.738 -2.358 -14.214 1.00 0.00 H new ATOM 0 HD2 HIS B 15 81.431 -2.855 -11.485 1.00 0.00 H new ATOM 0 HE1 HIS B 15 78.286 -5.401 -10.282 1.00 0.00 H new ATOM 0 HE2 HIS B 15 80.727 -4.779 -9.835 1.00 0.00 H new ATOM 1691 N GLN B 16 78.859 0.847 -14.614 1.00 0.00 N ATOM 1692 CA GLN B 16 79.058 1.730 -15.798 1.00 0.00 C ATOM 1693 C GLN B 16 79.811 2.996 -15.391 1.00 0.00 C ATOM 1694 O GLN B 16 80.686 3.466 -16.091 1.00 0.00 O ATOM 1695 CB GLN B 16 77.692 2.121 -16.367 1.00 0.00 C ATOM 1696 CG GLN B 16 77.041 0.910 -17.036 1.00 0.00 C ATOM 1697 CD GLN B 16 75.628 1.282 -17.487 1.00 0.00 C ATOM 1698 OE1 GLN B 16 75.017 2.173 -16.933 1.00 0.00 O ATOM 1699 NE2 GLN B 16 75.082 0.638 -18.481 1.00 0.00 N ATOM 0 H GLN B 16 77.900 0.771 -14.276 1.00 0.00 H new ATOM 0 HA GLN B 16 79.639 1.195 -16.549 1.00 0.00 H new ATOM 0 HB2 GLN B 16 77.050 2.496 -15.570 1.00 0.00 H new ATOM 0 HB3 GLN B 16 77.807 2.929 -17.090 1.00 0.00 H new ATOM 0 HG2 GLN B 16 77.636 0.589 -17.891 1.00 0.00 H new ATOM 0 HG3 GLN B 16 77.004 0.072 -16.340 1.00 0.00 H new ATOM 0 HE21 GLN B 16 75.595 -0.111 -18.947 1.00 0.00 H new ATOM 0 HE22 GLN B 16 74.142 0.883 -18.793 1.00 0.00 H new ATOM 1708 N TYR B 17 79.474 3.548 -14.258 1.00 0.00 N ATOM 1709 CA TYR B 17 80.172 4.782 -13.802 1.00 0.00 C ATOM 1710 C TYR B 17 81.571 4.426 -13.297 1.00 0.00 C ATOM 1711 O TYR B 17 82.533 5.119 -13.560 1.00 0.00 O ATOM 1712 CB TYR B 17 79.391 5.458 -12.674 1.00 0.00 C ATOM 1713 CG TYR B 17 80.118 6.724 -12.287 1.00 0.00 C ATOM 1714 CD1 TYR B 17 81.166 6.663 -11.364 1.00 0.00 C ATOM 1715 CD2 TYR B 17 79.764 7.950 -12.866 1.00 0.00 C ATOM 1716 CE1 TYR B 17 81.859 7.825 -11.014 1.00 0.00 C ATOM 1717 CE2 TYR B 17 80.460 9.116 -12.517 1.00 0.00 C ATOM 1718 CZ TYR B 17 81.507 9.052 -11.590 1.00 0.00 C ATOM 1719 OH TYR B 17 82.195 10.197 -11.245 1.00 0.00 O ATOM 0 H TYR B 17 78.749 3.200 -13.631 1.00 0.00 H new ATOM 0 HA TYR B 17 80.244 5.468 -14.646 1.00 0.00 H new ATOM 0 HB2 TYR B 17 78.376 5.687 -12.999 1.00 0.00 H new ATOM 0 HB3 TYR B 17 79.308 4.790 -11.816 1.00 0.00 H new ATOM 0 HD1 TYR B 17 81.440 5.717 -10.921 1.00 0.00 H new ATOM 0 HD2 TYR B 17 78.956 7.997 -13.581 1.00 0.00 H new ATOM 0 HE1 TYR B 17 82.667 7.777 -10.299 1.00 0.00 H new ATOM 0 HE2 TYR B 17 80.189 10.062 -12.963 1.00 0.00 H new ATOM 0 HH TYR B 17 82.970 9.960 -10.694 1.00 0.00 H new ATOM 1729 N SER B 18 81.686 3.350 -12.565 1.00 0.00 N ATOM 1730 CA SER B 18 83.018 2.946 -12.030 1.00 0.00 C ATOM 1731 C SER B 18 83.902 2.466 -13.178 1.00 0.00 C ATOM 1732 O SER B 18 85.113 2.454 -13.078 1.00 0.00 O ATOM 1733 CB SER B 18 82.844 1.822 -11.009 1.00 0.00 C ATOM 1734 OG SER B 18 81.986 2.265 -9.965 1.00 0.00 O ATOM 0 H SER B 18 80.914 2.733 -12.314 1.00 0.00 H new ATOM 0 HA SER B 18 83.488 3.801 -11.544 1.00 0.00 H new ATOM 0 HB2 SER B 18 82.424 0.939 -11.491 1.00 0.00 H new ATOM 0 HB3 SER B 18 83.812 1.532 -10.601 1.00 0.00 H new ATOM 0 HG SER B 18 81.053 2.195 -10.257 1.00 0.00 H new ATOM 1740 N GLY B 19 83.310 2.082 -14.276 1.00 0.00 N ATOM 1741 CA GLY B 19 84.115 1.617 -15.441 1.00 0.00 C ATOM 1742 C GLY B 19 84.486 2.827 -16.297 1.00 0.00 C ATOM 1743 O GLY B 19 84.795 2.703 -17.466 1.00 0.00 O ATOM 0 H GLY B 19 82.300 2.070 -14.417 1.00 0.00 H new ATOM 0 HA2 GLY B 19 85.015 1.107 -15.098 1.00 0.00 H new ATOM 0 HA3 GLY B 19 83.546 0.898 -16.030 1.00 0.00 H new ATOM 1747 N ARG B 20 84.473 4.000 -15.720 1.00 0.00 N ATOM 1748 CA ARG B 20 84.841 5.219 -16.494 1.00 0.00 C ATOM 1749 C ARG B 20 86.344 5.208 -16.779 1.00 0.00 C ATOM 1750 O ARG B 20 86.786 5.569 -17.851 1.00 0.00 O ATOM 1751 CB ARG B 20 84.477 6.462 -15.680 1.00 0.00 C ATOM 1752 CG ARG B 20 84.826 7.720 -16.474 1.00 0.00 C ATOM 1753 CD ARG B 20 84.322 8.952 -15.720 1.00 0.00 C ATOM 1754 NE ARG B 20 84.657 10.181 -16.491 1.00 0.00 N ATOM 1755 CZ ARG B 20 85.863 10.673 -16.434 1.00 0.00 C ATOM 1756 NH1 ARG B 20 86.775 10.071 -15.723 1.00 0.00 N ATOM 1757 NH2 ARG B 20 86.157 11.763 -17.090 1.00 0.00 N ATOM 0 H ARG B 20 84.223 4.165 -14.745 1.00 0.00 H new ATOM 0 HA ARG B 20 84.298 5.233 -17.439 1.00 0.00 H new ATOM 0 HB2 ARG B 20 83.413 6.454 -15.443 1.00 0.00 H new ATOM 0 HB3 ARG B 20 85.015 6.458 -14.732 1.00 0.00 H new ATOM 0 HG2 ARG B 20 85.904 7.785 -16.619 1.00 0.00 H new ATOM 0 HG3 ARG B 20 84.373 7.676 -17.465 1.00 0.00 H new ATOM 0 HD2 ARG B 20 83.244 8.885 -15.573 1.00 0.00 H new ATOM 0 HD3 ARG B 20 84.776 8.996 -14.730 1.00 0.00 H new ATOM 0 HE ARG B 20 83.945 10.637 -17.062 1.00 0.00 H new ATOM 0 HH11 ARG B 20 86.544 9.218 -15.214 1.00 0.00 H new ATOM 0 HH12 ARG B 20 87.720 10.453 -15.676 1.00 0.00 H new ATOM 0 HH21 ARG B 20 85.443 12.231 -17.648 1.00 0.00 H new ATOM 0 HH22 ARG B 20 87.101 12.147 -17.044 1.00 0.00 H new ATOM 1771 N GLU B 21 87.135 4.798 -15.814 1.00 0.00 N ATOM 1772 CA GLU B 21 88.618 4.757 -15.998 1.00 0.00 C ATOM 1773 C GLU B 21 89.079 3.305 -16.116 1.00 0.00 C ATOM 1774 O GLU B 21 88.389 2.387 -15.719 1.00 0.00 O ATOM 1775 CB GLU B 21 89.307 5.409 -14.794 1.00 0.00 C ATOM 1776 CG GLU B 21 89.049 6.920 -14.803 1.00 0.00 C ATOM 1777 CD GLU B 21 89.752 7.557 -16.002 1.00 0.00 C ATOM 1778 OE1 GLU B 21 90.742 7.002 -16.448 1.00 0.00 O ATOM 1779 OE2 GLU B 21 89.286 8.588 -16.457 1.00 0.00 O ATOM 0 H GLU B 21 86.810 4.487 -14.898 1.00 0.00 H new ATOM 0 HA GLU B 21 88.881 5.300 -16.906 1.00 0.00 H new ATOM 0 HB2 GLU B 21 88.932 4.972 -13.868 1.00 0.00 H new ATOM 0 HB3 GLU B 21 90.379 5.214 -14.827 1.00 0.00 H new ATOM 0 HG2 GLU B 21 87.978 7.115 -14.852 1.00 0.00 H new ATOM 0 HG3 GLU B 21 89.412 7.366 -13.877 1.00 0.00 H new ATOM 1786 N GLY B 22 90.240 3.090 -16.669 1.00 0.00 N ATOM 1787 CA GLY B 22 90.751 1.700 -16.828 1.00 0.00 C ATOM 1788 C GLY B 22 90.570 0.918 -15.522 1.00 0.00 C ATOM 1789 O GLY B 22 90.649 -0.294 -15.503 1.00 0.00 O ATOM 0 H GLY B 22 90.860 3.821 -17.019 1.00 0.00 H new ATOM 0 HA2 GLY B 22 90.219 1.199 -17.637 1.00 0.00 H new ATOM 0 HA3 GLY B 22 91.805 1.721 -17.105 1.00 0.00 H new ATOM 1793 N ASP B 23 90.324 1.595 -14.432 1.00 0.00 N ATOM 1794 CA ASP B 23 90.137 0.875 -13.136 1.00 0.00 C ATOM 1795 C ASP B 23 88.672 0.447 -13.004 1.00 0.00 C ATOM 1796 O ASP B 23 87.797 1.260 -12.784 1.00 0.00 O ATOM 1797 CB ASP B 23 90.500 1.816 -11.984 1.00 0.00 C ATOM 1798 CG ASP B 23 92.015 2.026 -11.953 1.00 0.00 C ATOM 1799 OD1 ASP B 23 92.715 1.248 -12.580 1.00 0.00 O ATOM 1800 OD2 ASP B 23 92.450 2.959 -11.298 1.00 0.00 O ATOM 0 H ASP B 23 90.245 2.611 -14.381 1.00 0.00 H new ATOM 0 HA ASP B 23 90.778 -0.006 -13.105 1.00 0.00 H new ATOM 0 HB2 ASP B 23 89.992 2.773 -12.108 1.00 0.00 H new ATOM 0 HB3 ASP B 23 90.161 1.396 -11.037 1.00 0.00 H new ATOM 1805 N LYS B 24 88.396 -0.829 -13.146 1.00 0.00 N ATOM 1806 CA LYS B 24 86.982 -1.320 -13.039 1.00 0.00 C ATOM 1807 C LYS B 24 86.725 -1.922 -11.655 1.00 0.00 C ATOM 1808 O LYS B 24 87.429 -2.808 -11.213 1.00 0.00 O ATOM 1809 CB LYS B 24 86.735 -2.398 -14.101 1.00 0.00 C ATOM 1810 CG LYS B 24 85.254 -2.799 -14.093 1.00 0.00 C ATOM 1811 CD LYS B 24 85.009 -3.883 -15.145 1.00 0.00 C ATOM 1812 CE LYS B 24 83.530 -4.279 -15.138 1.00 0.00 C ATOM 1813 NZ LYS B 24 83.270 -5.260 -16.230 1.00 0.00 N ATOM 0 H LYS B 24 89.090 -1.553 -13.332 1.00 0.00 H new ATOM 0 HA LYS B 24 86.309 -0.476 -13.193 1.00 0.00 H new ATOM 0 HB2 LYS B 24 87.015 -2.024 -15.086 1.00 0.00 H new ATOM 0 HB3 LYS B 24 87.359 -3.269 -13.901 1.00 0.00 H new ATOM 0 HG2 LYS B 24 84.972 -3.166 -13.106 1.00 0.00 H new ATOM 0 HG3 LYS B 24 84.630 -1.929 -14.300 1.00 0.00 H new ATOM 0 HD2 LYS B 24 85.294 -3.518 -16.132 1.00 0.00 H new ATOM 0 HD3 LYS B 24 85.630 -4.754 -14.936 1.00 0.00 H new ATOM 0 HE2 LYS B 24 83.264 -4.713 -14.174 1.00 0.00 H new ATOM 0 HE3 LYS B 24 82.906 -3.396 -15.273 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 82.265 -5.528 -16.224 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 83.508 -4.830 -17.147 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 83.855 -6.107 -16.082 1.00 0.00 H new ATOM 1827 N HIS B 25 85.713 -1.445 -10.977 1.00 0.00 N ATOM 1828 CA HIS B 25 85.370 -1.968 -9.621 1.00 0.00 C ATOM 1829 C HIS B 25 86.330 -1.384 -8.579 1.00 0.00 C ATOM 1830 O HIS B 25 86.779 -2.063 -7.678 1.00 0.00 O ATOM 1831 CB HIS B 25 85.451 -3.503 -9.633 1.00 0.00 C ATOM 1832 CG HIS B 25 84.466 -4.095 -8.652 1.00 0.00 C ATOM 1833 ND1 HIS B 25 84.849 -4.535 -7.392 1.00 0.00 N ATOM 1834 CD2 HIS B 25 83.115 -4.341 -8.739 1.00 0.00 C ATOM 1835 CE1 HIS B 25 83.753 -5.020 -6.780 1.00 0.00 C ATOM 1836 NE2 HIS B 25 82.673 -4.925 -7.557 1.00 0.00 N ATOM 0 H HIS B 25 85.100 -0.702 -11.312 1.00 0.00 H new ATOM 0 HA HIS B 25 84.355 -1.670 -9.358 1.00 0.00 H new ATOM 0 HB2 HIS B 25 85.242 -3.876 -10.636 1.00 0.00 H new ATOM 0 HB3 HIS B 25 86.462 -3.821 -9.378 1.00 0.00 H new ATOM 0 HD2 HIS B 25 82.494 -4.115 -9.593 1.00 0.00 H new ATOM 0 HE1 HIS B 25 83.748 -5.435 -5.783 1.00 0.00 H new ATOM 0 HE2 HIS B 25 81.723 -5.219 -7.332 1.00 0.00 H new ATOM 1845 N LYS B 26 86.630 -0.119 -8.692 1.00 0.00 N ATOM 1846 CA LYS B 26 87.538 0.532 -7.707 1.00 0.00 C ATOM 1847 C LYS B 26 87.322 2.045 -7.799 1.00 0.00 C ATOM 1848 O LYS B 26 87.493 2.637 -8.847 1.00 0.00 O ATOM 1849 CB LYS B 26 89.000 0.178 -8.033 1.00 0.00 C ATOM 1850 CG LYS B 26 89.881 0.344 -6.782 1.00 0.00 C ATOM 1851 CD LYS B 26 89.742 -0.884 -5.862 1.00 0.00 C ATOM 1852 CE LYS B 26 90.813 -0.834 -4.771 1.00 0.00 C ATOM 1853 NZ LYS B 26 90.759 -2.087 -3.965 1.00 0.00 N ATOM 0 H LYS B 26 86.283 0.495 -9.429 1.00 0.00 H new ATOM 0 HA LYS B 26 87.322 0.184 -6.697 1.00 0.00 H new ATOM 0 HB2 LYS B 26 89.061 -0.848 -8.395 1.00 0.00 H new ATOM 0 HB3 LYS B 26 89.367 0.821 -8.833 1.00 0.00 H new ATOM 0 HG2 LYS B 26 90.923 0.470 -7.077 1.00 0.00 H new ATOM 0 HG3 LYS B 26 89.592 1.246 -6.242 1.00 0.00 H new ATOM 0 HD2 LYS B 26 88.750 -0.902 -5.411 1.00 0.00 H new ATOM 0 HD3 LYS B 26 89.844 -1.800 -6.444 1.00 0.00 H new ATOM 0 HE2 LYS B 26 91.800 -0.720 -5.220 1.00 0.00 H new ATOM 0 HE3 LYS B 26 90.653 0.032 -4.128 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 91.487 -2.054 -3.223 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 89.821 -2.177 -3.526 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 90.932 -2.905 -4.583 1.00 0.00 H new ATOM 1867 N LEU B 27 86.920 2.677 -6.721 1.00 0.00 N ATOM 1868 CA LEU B 27 86.664 4.153 -6.769 1.00 0.00 C ATOM 1869 C LEU B 27 87.884 4.914 -6.248 1.00 0.00 C ATOM 1870 O LEU B 27 88.230 4.844 -5.085 1.00 0.00 O ATOM 1871 CB LEU B 27 85.447 4.491 -5.894 1.00 0.00 C ATOM 1872 CG LEU B 27 84.139 4.107 -6.611 1.00 0.00 C ATOM 1873 CD1 LEU B 27 83.876 5.041 -7.809 1.00 0.00 C ATOM 1874 CD2 LEU B 27 84.220 2.656 -7.097 1.00 0.00 C ATOM 0 H LEU B 27 86.759 2.238 -5.815 1.00 0.00 H new ATOM 0 HA LEU B 27 86.471 4.446 -7.801 1.00 0.00 H new ATOM 0 HB2 LEU B 27 85.517 3.960 -4.944 1.00 0.00 H new ATOM 0 HB3 LEU B 27 85.443 5.556 -5.664 1.00 0.00 H new ATOM 0 HG LEU B 27 83.316 4.210 -5.904 1.00 0.00 H new ATOM 0 HD11 LEU B 27 82.947 4.751 -8.300 1.00 0.00 H new ATOM 0 HD12 LEU B 27 83.794 6.070 -7.457 1.00 0.00 H new ATOM 0 HD13 LEU B 27 84.700 4.964 -8.518 1.00 0.00 H new ATOM 0 HD21 LEU B 27 83.292 2.390 -7.603 1.00 0.00 H new ATOM 0 HD22 LEU B 27 85.055 2.550 -7.790 1.00 0.00 H new ATOM 0 HD23 LEU B 27 84.371 1.994 -6.244 1.00 0.00 H new ATOM 1886 N LYS B 28 88.530 5.653 -7.113 1.00 0.00 N ATOM 1887 CA LYS B 28 89.724 6.443 -6.697 1.00 0.00 C ATOM 1888 C LYS B 28 89.274 7.816 -6.182 1.00 0.00 C ATOM 1889 O LYS B 28 88.181 8.265 -6.461 1.00 0.00 O ATOM 1890 CB LYS B 28 90.679 6.603 -7.891 1.00 0.00 C ATOM 1891 CG LYS B 28 92.001 7.216 -7.416 1.00 0.00 C ATOM 1892 CD LYS B 28 92.972 7.364 -8.589 1.00 0.00 C ATOM 1893 CE LYS B 28 94.303 7.920 -8.071 1.00 0.00 C ATOM 1894 NZ LYS B 28 94.833 7.030 -6.998 1.00 0.00 N ATOM 0 H LYS B 28 88.278 5.743 -8.097 1.00 0.00 H new ATOM 0 HA LYS B 28 90.250 5.922 -5.897 1.00 0.00 H new ATOM 0 HB2 LYS B 28 90.862 5.634 -8.355 1.00 0.00 H new ATOM 0 HB3 LYS B 28 90.224 7.239 -8.650 1.00 0.00 H new ATOM 0 HG2 LYS B 28 91.816 8.190 -6.964 1.00 0.00 H new ATOM 0 HG3 LYS B 28 92.445 6.586 -6.645 1.00 0.00 H new ATOM 0 HD2 LYS B 28 93.130 6.399 -9.071 1.00 0.00 H new ATOM 0 HD3 LYS B 28 92.553 8.032 -9.342 1.00 0.00 H new ATOM 0 HE2 LYS B 28 95.022 7.990 -8.887 1.00 0.00 H new ATOM 0 HE3 LYS B 28 94.161 8.929 -7.684 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 95.860 7.169 -6.907 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 94.371 7.261 -6.095 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 94.638 6.038 -7.242 1.00 0.00 H new ATOM 1908 N LYS B 29 90.108 8.480 -5.425 1.00 0.00 N ATOM 1909 CA LYS B 29 89.731 9.816 -4.879 1.00 0.00 C ATOM 1910 C LYS B 29 89.342 10.750 -6.032 1.00 0.00 C ATOM 1911 O LYS B 29 88.294 11.366 -6.011 1.00 0.00 O ATOM 1912 CB LYS B 29 90.943 10.391 -4.134 1.00 0.00 C ATOM 1913 CG LYS B 29 90.591 11.744 -3.513 1.00 0.00 C ATOM 1914 CD LYS B 29 91.815 12.296 -2.774 1.00 0.00 C ATOM 1915 CE LYS B 29 91.506 13.695 -2.228 1.00 0.00 C ATOM 1916 NZ LYS B 29 92.782 14.412 -1.942 1.00 0.00 N ATOM 0 H LYS B 29 91.037 8.153 -5.161 1.00 0.00 H new ATOM 0 HA LYS B 29 88.884 9.722 -4.200 1.00 0.00 H new ATOM 0 HB2 LYS B 29 91.262 9.698 -3.356 1.00 0.00 H new ATOM 0 HB3 LYS B 29 91.781 10.506 -4.822 1.00 0.00 H new ATOM 0 HG2 LYS B 29 90.275 12.442 -4.288 1.00 0.00 H new ATOM 0 HG3 LYS B 29 89.754 11.634 -2.823 1.00 0.00 H new ATOM 0 HD2 LYS B 29 92.089 11.629 -1.956 1.00 0.00 H new ATOM 0 HD3 LYS B 29 92.669 12.340 -3.449 1.00 0.00 H new ATOM 0 HE2 LYS B 29 90.915 14.257 -2.952 1.00 0.00 H new ATOM 0 HE3 LYS B 29 90.908 13.618 -1.320 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 92.572 15.367 -1.588 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 93.322 13.887 -1.224 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 93.344 14.482 -2.814 1.00 0.00 H new ATOM 1930 N SER B 30 90.155 10.843 -7.049 1.00 0.00 N ATOM 1931 CA SER B 30 89.803 11.717 -8.208 1.00 0.00 C ATOM 1932 C SER B 30 88.501 11.199 -8.824 1.00 0.00 C ATOM 1933 O SER B 30 87.630 11.953 -9.211 1.00 0.00 O ATOM 1934 CB SER B 30 90.926 11.672 -9.249 1.00 0.00 C ATOM 1935 OG SER B 30 90.665 12.632 -10.263 1.00 0.00 O ATOM 0 H SER B 30 91.046 10.353 -7.129 1.00 0.00 H new ATOM 0 HA SER B 30 89.675 12.748 -7.877 1.00 0.00 H new ATOM 0 HB2 SER B 30 91.885 11.879 -8.775 1.00 0.00 H new ATOM 0 HB3 SER B 30 90.994 10.675 -9.685 1.00 0.00 H new ATOM 0 HG SER B 30 91.383 12.607 -10.930 1.00 0.00 H new ATOM 1941 N GLU B 31 88.374 9.904 -8.894 1.00 0.00 N ATOM 1942 CA GLU B 31 87.141 9.282 -9.459 1.00 0.00 C ATOM 1943 C GLU B 31 85.976 9.511 -8.491 1.00 0.00 C ATOM 1944 O GLU B 31 84.837 9.660 -8.889 1.00 0.00 O ATOM 1945 CB GLU B 31 87.375 7.782 -9.641 1.00 0.00 C ATOM 1946 CG GLU B 31 86.149 7.137 -10.292 1.00 0.00 C ATOM 1947 CD GLU B 31 86.409 5.642 -10.483 1.00 0.00 C ATOM 1948 OE1 GLU B 31 87.540 5.228 -10.287 1.00 0.00 O ATOM 1949 OE2 GLU B 31 85.475 4.935 -10.822 1.00 0.00 O ATOM 0 H GLU B 31 89.081 9.240 -8.580 1.00 0.00 H new ATOM 0 HA GLU B 31 86.904 9.731 -10.424 1.00 0.00 H new ATOM 0 HB2 GLU B 31 88.256 7.615 -10.261 1.00 0.00 H new ATOM 0 HB3 GLU B 31 87.572 7.316 -8.675 1.00 0.00 H new ATOM 0 HG2 GLU B 31 85.269 7.288 -9.667 1.00 0.00 H new ATOM 0 HG3 GLU B 31 85.943 7.608 -11.253 1.00 0.00 H new ATOM 1956 N LEU B 32 86.268 9.562 -7.223 1.00 0.00 N ATOM 1957 CA LEU B 32 85.195 9.801 -6.217 1.00 0.00 C ATOM 1958 C LEU B 32 84.704 11.246 -6.341 1.00 0.00 C ATOM 1959 O LEU B 32 83.526 11.523 -6.247 1.00 0.00 O ATOM 1960 CB LEU B 32 85.767 9.553 -4.815 1.00 0.00 C ATOM 1961 CG LEU B 32 84.709 9.797 -3.730 1.00 0.00 C ATOM 1962 CD1 LEU B 32 83.566 8.779 -3.852 1.00 0.00 C ATOM 1963 CD2 LEU B 32 85.379 9.650 -2.362 1.00 0.00 C ATOM 0 H LEU B 32 87.206 9.448 -6.838 1.00 0.00 H new ATOM 0 HA LEU B 32 84.357 9.126 -6.388 1.00 0.00 H new ATOM 0 HB2 LEU B 32 86.133 8.529 -4.745 1.00 0.00 H new ATOM 0 HB3 LEU B 32 86.621 10.209 -4.647 1.00 0.00 H new ATOM 0 HG LEU B 32 84.292 10.797 -3.847 1.00 0.00 H new ATOM 0 HD11 LEU B 32 82.826 8.968 -3.074 1.00 0.00 H new ATOM 0 HD12 LEU B 32 83.096 8.875 -4.831 1.00 0.00 H new ATOM 0 HD13 LEU B 32 83.963 7.770 -3.737 1.00 0.00 H new ATOM 0 HD21 LEU B 32 84.643 9.820 -1.576 1.00 0.00 H new ATOM 0 HD22 LEU B 32 85.789 8.645 -2.264 1.00 0.00 H new ATOM 0 HD23 LEU B 32 86.183 10.380 -2.270 1.00 0.00 H new ATOM 1975 N LYS B 33 85.603 12.166 -6.550 1.00 0.00 N ATOM 1976 CA LYS B 33 85.196 13.596 -6.677 1.00 0.00 C ATOM 1977 C LYS B 33 84.299 13.781 -7.909 1.00 0.00 C ATOM 1978 O LYS B 33 83.336 14.521 -7.880 1.00 0.00 O ATOM 1979 CB LYS B 33 86.441 14.478 -6.804 1.00 0.00 C ATOM 1980 CG LYS B 33 86.021 15.945 -6.930 1.00 0.00 C ATOM 1981 CD LYS B 33 87.252 16.845 -6.780 1.00 0.00 C ATOM 1982 CE LYS B 33 88.276 16.521 -7.872 1.00 0.00 C ATOM 1983 NZ LYS B 33 87.577 16.251 -9.161 1.00 0.00 N ATOM 0 H LYS B 33 86.604 11.991 -6.639 1.00 0.00 H new ATOM 0 HA LYS B 33 84.638 13.887 -5.787 1.00 0.00 H new ATOM 0 HB2 LYS B 33 87.082 14.347 -5.933 1.00 0.00 H new ATOM 0 HB3 LYS B 33 87.023 14.180 -7.676 1.00 0.00 H new ATOM 0 HG2 LYS B 33 85.548 16.117 -7.897 1.00 0.00 H new ATOM 0 HG3 LYS B 33 85.283 16.190 -6.166 1.00 0.00 H new ATOM 0 HD2 LYS B 33 86.957 17.892 -6.846 1.00 0.00 H new ATOM 0 HD3 LYS B 33 87.700 16.702 -5.797 1.00 0.00 H new ATOM 0 HE2 LYS B 33 88.969 17.354 -7.992 1.00 0.00 H new ATOM 0 HE3 LYS B 33 88.868 15.653 -7.581 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 88.241 16.383 -9.950 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 87.224 15.273 -9.166 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 86.778 16.908 -9.267 1.00 0.00 H new ATOM 1997 N GLU B 34 84.617 13.127 -8.991 1.00 0.00 N ATOM 1998 CA GLU B 34 83.786 13.277 -10.225 1.00 0.00 C ATOM 1999 C GLU B 34 82.345 12.838 -9.954 1.00 0.00 C ATOM 2000 O GLU B 34 81.400 13.485 -10.361 1.00 0.00 O ATOM 2001 CB GLU B 34 84.371 12.409 -11.343 1.00 0.00 C ATOM 2002 CG GLU B 34 83.594 12.645 -12.642 1.00 0.00 C ATOM 2003 CD GLU B 34 84.183 11.774 -13.754 1.00 0.00 C ATOM 2004 OE1 GLU B 34 85.200 11.145 -13.511 1.00 0.00 O ATOM 2005 OE2 GLU B 34 83.602 11.745 -14.826 1.00 0.00 O ATOM 0 H GLU B 34 85.414 12.496 -9.077 1.00 0.00 H new ATOM 0 HA GLU B 34 83.790 14.325 -10.524 1.00 0.00 H new ATOM 0 HB2 GLU B 34 85.424 12.649 -11.489 1.00 0.00 H new ATOM 0 HB3 GLU B 34 84.320 11.357 -11.064 1.00 0.00 H new ATOM 0 HG2 GLU B 34 82.541 12.405 -12.497 1.00 0.00 H new ATOM 0 HG3 GLU B 34 83.646 13.697 -12.923 1.00 0.00 H new ATOM 2012 N LEU B 35 82.171 11.724 -9.302 1.00 0.00 N ATOM 2013 CA LEU B 35 80.794 11.213 -9.038 1.00 0.00 C ATOM 2014 C LEU B 35 79.991 12.221 -8.218 1.00 0.00 C ATOM 2015 O LEU B 35 78.867 12.543 -8.548 1.00 0.00 O ATOM 2016 CB LEU B 35 80.897 9.886 -8.271 1.00 0.00 C ATOM 2017 CG LEU B 35 79.483 9.304 -7.978 1.00 0.00 C ATOM 2018 CD1 LEU B 35 79.498 7.781 -8.178 1.00 0.00 C ATOM 2019 CD2 LEU B 35 79.066 9.608 -6.528 1.00 0.00 C ATOM 0 H LEU B 35 82.925 11.141 -8.938 1.00 0.00 H new ATOM 0 HA LEU B 35 80.281 11.060 -9.988 1.00 0.00 H new ATOM 0 HB2 LEU B 35 81.477 9.169 -8.852 1.00 0.00 H new ATOM 0 HB3 LEU B 35 81.432 10.043 -7.334 1.00 0.00 H new ATOM 0 HG LEU B 35 78.772 9.766 -8.663 1.00 0.00 H new ATOM 0 HD11 LEU B 35 78.507 7.377 -7.972 1.00 0.00 H new ATOM 0 HD12 LEU B 35 79.777 7.552 -9.207 1.00 0.00 H new ATOM 0 HD13 LEU B 35 80.221 7.332 -7.497 1.00 0.00 H new ATOM 0 HD21 LEU B 35 78.075 9.194 -6.340 1.00 0.00 H new ATOM 0 HD22 LEU B 35 79.783 9.159 -5.841 1.00 0.00 H new ATOM 0 HD23 LEU B 35 79.044 10.687 -6.374 1.00 0.00 H new ATOM 2031 N ILE B 36 80.539 12.717 -7.146 1.00 0.00 N ATOM 2032 CA ILE B 36 79.775 13.692 -6.322 1.00 0.00 C ATOM 2033 C ILE B 36 79.445 14.935 -7.159 1.00 0.00 C ATOM 2034 O ILE B 36 78.320 15.388 -7.200 1.00 0.00 O ATOM 2035 CB ILE B 36 80.608 14.099 -5.106 1.00 0.00 C ATOM 2036 CG1 ILE B 36 80.884 12.865 -4.240 1.00 0.00 C ATOM 2037 CG2 ILE B 36 79.835 15.136 -4.283 1.00 0.00 C ATOM 2038 CD1 ILE B 36 81.916 13.217 -3.167 1.00 0.00 C ATOM 0 H ILE B 36 81.474 12.492 -6.807 1.00 0.00 H new ATOM 0 HA ILE B 36 78.847 13.229 -5.987 1.00 0.00 H new ATOM 0 HB ILE B 36 81.553 14.528 -5.439 1.00 0.00 H new ATOM 0 HG12 ILE B 36 79.961 12.521 -3.773 1.00 0.00 H new ATOM 0 HG13 ILE B 36 81.252 12.047 -4.860 1.00 0.00 H new ATOM 0 HG21 ILE B 36 80.427 15.427 -3.416 1.00 0.00 H new ATOM 0 HG22 ILE B 36 79.636 16.014 -4.898 1.00 0.00 H new ATOM 0 HG23 ILE B 36 78.891 14.705 -3.949 1.00 0.00 H new ATOM 0 HD11 ILE B 36 82.113 12.340 -2.550 1.00 0.00 H new ATOM 0 HD12 ILE B 36 82.841 13.541 -3.644 1.00 0.00 H new ATOM 0 HD13 ILE B 36 81.530 14.021 -2.541 1.00 0.00 H new ATOM 2050 N ASN B 37 80.429 15.496 -7.810 1.00 0.00 N ATOM 2051 CA ASN B 37 80.193 16.721 -8.630 1.00 0.00 C ATOM 2052 C ASN B 37 79.188 16.451 -9.757 1.00 0.00 C ATOM 2053 O ASN B 37 78.362 17.286 -10.070 1.00 0.00 O ATOM 2054 CB ASN B 37 81.523 17.174 -9.243 1.00 0.00 C ATOM 2055 CG ASN B 37 81.308 18.448 -10.063 1.00 0.00 C ATOM 2056 OD1 ASN B 37 81.140 18.391 -11.265 1.00 0.00 O ATOM 2057 ND2 ASN B 37 81.307 19.605 -9.460 1.00 0.00 N ATOM 0 H ASN B 37 81.391 15.157 -7.809 1.00 0.00 H new ATOM 0 HA ASN B 37 79.783 17.496 -7.983 1.00 0.00 H new ATOM 0 HB2 ASN B 37 82.254 17.357 -8.455 1.00 0.00 H new ATOM 0 HB3 ASN B 37 81.929 16.386 -9.878 1.00 0.00 H new ATOM 0 HD21 ASN B 37 81.165 20.460 -9.998 1.00 0.00 H new ATOM 0 HD22 ASN B 37 81.448 19.654 -8.451 1.00 0.00 H new ATOM 2064 N ASN B 38 79.263 15.314 -10.395 1.00 0.00 N ATOM 2065 CA ASN B 38 78.320 15.034 -11.523 1.00 0.00 C ATOM 2066 C ASN B 38 76.992 14.452 -11.031 1.00 0.00 C ATOM 2067 O ASN B 38 75.935 14.970 -11.328 1.00 0.00 O ATOM 2068 CB ASN B 38 78.963 14.047 -12.496 1.00 0.00 C ATOM 2069 CG ASN B 38 78.077 13.924 -13.737 1.00 0.00 C ATOM 2070 OD1 ASN B 38 77.018 14.519 -13.802 1.00 0.00 O ATOM 2071 ND2 ASN B 38 78.464 13.177 -14.733 1.00 0.00 N ATOM 0 H ASN B 38 79.930 14.570 -10.188 1.00 0.00 H new ATOM 0 HA ASN B 38 78.112 15.983 -12.018 1.00 0.00 H new ATOM 0 HB2 ASN B 38 79.959 14.389 -12.777 1.00 0.00 H new ATOM 0 HB3 ASN B 38 79.083 13.073 -12.021 1.00 0.00 H new ATOM 0 HD21 ASN B 38 77.879 13.092 -15.564 1.00 0.00 H new ATOM 0 HD22 ASN B 38 79.352 12.677 -14.681 1.00 0.00 H new ATOM 2078 N GLU B 39 77.025 13.355 -10.328 1.00 0.00 N ATOM 2079 CA GLU B 39 75.748 12.726 -9.878 1.00 0.00 C ATOM 2080 C GLU B 39 75.179 13.428 -8.640 1.00 0.00 C ATOM 2081 O GLU B 39 74.153 14.075 -8.709 1.00 0.00 O ATOM 2082 CB GLU B 39 75.997 11.249 -9.571 1.00 0.00 C ATOM 2083 CG GLU B 39 76.231 10.492 -10.880 1.00 0.00 C ATOM 2084 CD GLU B 39 76.525 9.022 -10.580 1.00 0.00 C ATOM 2085 OE1 GLU B 39 75.580 8.288 -10.340 1.00 0.00 O ATOM 2086 OE2 GLU B 39 77.687 8.652 -10.601 1.00 0.00 O ATOM 0 H GLU B 39 77.875 12.867 -10.046 1.00 0.00 H new ATOM 0 HA GLU B 39 75.015 12.824 -10.679 1.00 0.00 H new ATOM 0 HB2 GLU B 39 76.862 11.143 -8.917 1.00 0.00 H new ATOM 0 HB3 GLU B 39 75.143 10.827 -9.041 1.00 0.00 H new ATOM 0 HG2 GLU B 39 75.353 10.574 -11.521 1.00 0.00 H new ATOM 0 HG3 GLU B 39 77.065 10.936 -11.424 1.00 0.00 H new ATOM 2093 N LEU B 40 75.806 13.284 -7.503 1.00 0.00 N ATOM 2094 CA LEU B 40 75.257 13.924 -6.268 1.00 0.00 C ATOM 2095 C LEU B 40 75.851 15.317 -6.075 1.00 0.00 C ATOM 2096 O LEU B 40 76.825 15.499 -5.371 1.00 0.00 O ATOM 2097 CB LEU B 40 75.610 13.053 -5.065 1.00 0.00 C ATOM 2098 CG LEU B 40 75.007 11.656 -5.250 1.00 0.00 C ATOM 2099 CD1 LEU B 40 75.500 10.749 -4.121 1.00 0.00 C ATOM 2100 CD2 LEU B 40 73.469 11.728 -5.227 1.00 0.00 C ATOM 0 H LEU B 40 76.669 12.755 -7.374 1.00 0.00 H new ATOM 0 HA LEU B 40 74.175 14.018 -6.365 1.00 0.00 H new ATOM 0 HB2 LEU B 40 76.693 12.982 -4.959 1.00 0.00 H new ATOM 0 HB3 LEU B 40 75.229 13.507 -4.150 1.00 0.00 H new ATOM 0 HG LEU B 40 75.319 11.253 -6.213 1.00 0.00 H new ATOM 0 HD11 LEU B 40 75.076 9.752 -4.244 1.00 0.00 H new ATOM 0 HD12 LEU B 40 76.588 10.687 -4.153 1.00 0.00 H new ATOM 0 HD13 LEU B 40 75.188 11.160 -3.161 1.00 0.00 H new ATOM 0 HD21 LEU B 40 73.056 10.728 -5.360 1.00 0.00 H new ATOM 0 HD22 LEU B 40 73.138 12.134 -4.271 1.00 0.00 H new ATOM 0 HD23 LEU B 40 73.123 12.374 -6.034 1.00 0.00 H new ATOM 2112 N SER B 41 75.252 16.302 -6.687 1.00 0.00 N ATOM 2113 CA SER B 41 75.745 17.706 -6.547 1.00 0.00 C ATOM 2114 C SER B 41 74.550 18.647 -6.341 1.00 0.00 C ATOM 2115 O SER B 41 74.693 19.747 -5.845 1.00 0.00 O ATOM 2116 CB SER B 41 76.497 18.099 -7.817 1.00 0.00 C ATOM 2117 OG SER B 41 75.604 18.059 -8.922 1.00 0.00 O ATOM 0 H SER B 41 74.433 16.194 -7.285 1.00 0.00 H new ATOM 0 HA SER B 41 76.413 17.781 -5.689 1.00 0.00 H new ATOM 0 HB2 SER B 41 76.917 19.099 -7.710 1.00 0.00 H new ATOM 0 HB3 SER B 41 77.332 17.419 -7.984 1.00 0.00 H new ATOM 0 HG SER B 41 76.098 17.820 -9.734 1.00 0.00 H new ATOM 2123 N HIS B 42 73.377 18.228 -6.736 1.00 0.00 N ATOM 2124 CA HIS B 42 72.174 19.096 -6.584 1.00 0.00 C ATOM 2125 C HIS B 42 71.798 19.236 -5.107 1.00 0.00 C ATOM 2126 O HIS B 42 71.034 20.107 -4.741 1.00 0.00 O ATOM 2127 CB HIS B 42 71.002 18.478 -7.347 1.00 0.00 C ATOM 2128 CG HIS B 42 71.261 18.573 -8.823 1.00 0.00 C ATOM 2129 ND1 HIS B 42 71.084 19.754 -9.533 1.00 0.00 N ATOM 2130 CD2 HIS B 42 71.686 17.644 -9.740 1.00 0.00 C ATOM 2131 CE1 HIS B 42 71.397 19.504 -10.820 1.00 0.00 C ATOM 2132 NE2 HIS B 42 71.770 18.235 -10.995 1.00 0.00 N ATOM 0 H HIS B 42 73.200 17.317 -7.159 1.00 0.00 H new ATOM 0 HA HIS B 42 72.401 20.084 -6.986 1.00 0.00 H new ATOM 0 HB2 HIS B 42 70.874 17.436 -7.056 1.00 0.00 H new ATOM 0 HB3 HIS B 42 70.076 18.996 -7.095 1.00 0.00 H new ATOM 0 HD2 HIS B 42 71.919 16.613 -9.520 1.00 0.00 H new ATOM 0 HE1 HIS B 42 71.352 20.239 -11.610 1.00 0.00 H new ATOM 0 HE2 HIS B 42 72.057 17.791 -11.868 1.00 0.00 H new ATOM 2141 N PHE B 43 72.333 18.401 -4.251 1.00 0.00 N ATOM 2142 CA PHE B 43 72.013 18.502 -2.791 1.00 0.00 C ATOM 2143 C PHE B 43 73.197 19.135 -2.056 1.00 0.00 C ATOM 2144 O PHE B 43 73.068 19.604 -0.944 1.00 0.00 O ATOM 2145 CB PHE B 43 71.764 17.101 -2.225 1.00 0.00 C ATOM 2146 CG PHE B 43 70.434 16.578 -2.714 1.00 0.00 C ATOM 2147 CD1 PHE B 43 70.357 15.871 -3.920 1.00 0.00 C ATOM 2148 CD2 PHE B 43 69.277 16.800 -1.957 1.00 0.00 C ATOM 2149 CE1 PHE B 43 69.122 15.387 -4.369 1.00 0.00 C ATOM 2150 CE2 PHE B 43 68.043 16.315 -2.406 1.00 0.00 C ATOM 2151 CZ PHE B 43 67.966 15.609 -3.612 1.00 0.00 C ATOM 0 H PHE B 43 72.979 17.652 -4.500 1.00 0.00 H new ATOM 0 HA PHE B 43 71.123 19.116 -2.656 1.00 0.00 H new ATOM 0 HB2 PHE B 43 72.564 16.428 -2.532 1.00 0.00 H new ATOM 0 HB3 PHE B 43 71.774 17.132 -1.135 1.00 0.00 H new ATOM 0 HD1 PHE B 43 71.249 15.699 -4.504 1.00 0.00 H new ATOM 0 HD2 PHE B 43 69.337 17.345 -1.027 1.00 0.00 H new ATOM 0 HE1 PHE B 43 69.062 14.842 -5.300 1.00 0.00 H new ATOM 0 HE2 PHE B 43 67.151 16.486 -1.822 1.00 0.00 H new ATOM 0 HZ PHE B 43 67.014 15.235 -3.959 1.00 0.00 H new ATOM 2161 N LEU B 44 74.354 19.153 -2.669 1.00 0.00 N ATOM 2162 CA LEU B 44 75.547 19.753 -2.006 1.00 0.00 C ATOM 2163 C LEU B 44 76.480 20.357 -3.062 1.00 0.00 C ATOM 2164 O LEU B 44 76.552 19.891 -4.181 1.00 0.00 O ATOM 2165 CB LEU B 44 76.276 18.654 -1.222 1.00 0.00 C ATOM 2166 CG LEU B 44 76.982 17.657 -2.187 1.00 0.00 C ATOM 2167 CD1 LEU B 44 78.482 17.972 -2.277 1.00 0.00 C ATOM 2168 CD2 LEU B 44 76.822 16.219 -1.667 1.00 0.00 C ATOM 0 H LEU B 44 74.522 18.777 -3.602 1.00 0.00 H new ATOM 0 HA LEU B 44 75.237 20.546 -1.325 1.00 0.00 H new ATOM 0 HB2 LEU B 44 77.012 19.104 -0.556 1.00 0.00 H new ATOM 0 HB3 LEU B 44 75.565 18.117 -0.595 1.00 0.00 H new ATOM 0 HG LEU B 44 76.523 17.755 -3.171 1.00 0.00 H new ATOM 0 HD11 LEU B 44 78.962 17.267 -2.955 1.00 0.00 H new ATOM 0 HD12 LEU B 44 78.619 18.986 -2.652 1.00 0.00 H new ATOM 0 HD13 LEU B 44 78.932 17.887 -1.288 1.00 0.00 H new ATOM 0 HD21 LEU B 44 77.319 15.528 -2.348 1.00 0.00 H new ATOM 0 HD22 LEU B 44 77.271 16.138 -0.677 1.00 0.00 H new ATOM 0 HD23 LEU B 44 75.763 15.970 -1.607 1.00 0.00 H new ATOM 2180 N GLU B 45 77.197 21.391 -2.708 1.00 0.00 N ATOM 2181 CA GLU B 45 78.131 22.029 -3.680 1.00 0.00 C ATOM 2182 C GLU B 45 79.169 22.842 -2.893 1.00 0.00 C ATOM 2183 O GLU B 45 79.719 23.813 -3.373 1.00 0.00 O ATOM 2184 CB GLU B 45 77.332 22.940 -4.628 1.00 0.00 C ATOM 2185 CG GLU B 45 78.179 23.311 -5.853 1.00 0.00 C ATOM 2186 CD GLU B 45 77.297 24.003 -6.896 1.00 0.00 C ATOM 2187 OE1 GLU B 45 77.104 25.203 -6.782 1.00 0.00 O ATOM 2188 OE2 GLU B 45 76.828 23.320 -7.793 1.00 0.00 O ATOM 0 H GLU B 45 77.175 21.822 -1.784 1.00 0.00 H new ATOM 0 HA GLU B 45 78.642 21.274 -4.277 1.00 0.00 H new ATOM 0 HB2 GLU B 45 76.421 22.434 -4.947 1.00 0.00 H new ATOM 0 HB3 GLU B 45 77.026 23.844 -4.102 1.00 0.00 H new ATOM 0 HG2 GLU B 45 78.995 23.970 -5.557 1.00 0.00 H new ATOM 0 HG3 GLU B 45 78.631 22.416 -6.280 1.00 0.00 H new ATOM 2195 N GLU B 46 79.433 22.444 -1.672 1.00 0.00 N ATOM 2196 CA GLU B 46 80.425 23.176 -0.830 1.00 0.00 C ATOM 2197 C GLU B 46 81.823 22.595 -1.033 1.00 0.00 C ATOM 2198 O GLU B 46 82.787 23.064 -0.461 1.00 0.00 O ATOM 2199 CB GLU B 46 80.042 23.043 0.645 1.00 0.00 C ATOM 2200 CG GLU B 46 78.773 23.849 0.918 1.00 0.00 C ATOM 2201 CD GLU B 46 78.396 23.725 2.395 1.00 0.00 C ATOM 2202 OE1 GLU B 46 79.011 22.921 3.078 1.00 0.00 O ATOM 2203 OE2 GLU B 46 77.503 24.439 2.820 1.00 0.00 O ATOM 0 H GLU B 46 79.000 21.638 -1.222 1.00 0.00 H new ATOM 0 HA GLU B 46 80.425 24.226 -1.123 1.00 0.00 H new ATOM 0 HB2 GLU B 46 79.881 21.995 0.896 1.00 0.00 H new ATOM 0 HB3 GLU B 46 80.855 23.401 1.276 1.00 0.00 H new ATOM 0 HG2 GLU B 46 78.932 24.896 0.659 1.00 0.00 H new ATOM 0 HG3 GLU B 46 77.958 23.486 0.292 1.00 0.00 H new ATOM 2210 N ILE B 47 81.948 21.574 -1.836 1.00 0.00 N ATOM 2211 CA ILE B 47 83.292 20.965 -2.067 1.00 0.00 C ATOM 2212 C ILE B 47 83.925 21.574 -3.320 1.00 0.00 C ATOM 2213 O ILE B 47 83.395 21.471 -4.409 1.00 0.00 O ATOM 2214 CB ILE B 47 83.135 19.461 -2.270 1.00 0.00 C ATOM 2215 CG1 ILE B 47 82.517 18.834 -1.016 1.00 0.00 C ATOM 2216 CG2 ILE B 47 84.510 18.841 -2.525 1.00 0.00 C ATOM 2217 CD1 ILE B 47 82.122 17.388 -1.318 1.00 0.00 C ATOM 0 H ILE B 47 81.179 21.134 -2.342 1.00 0.00 H new ATOM 0 HA ILE B 47 83.929 21.160 -1.204 1.00 0.00 H new ATOM 0 HB ILE B 47 82.484 19.275 -3.124 1.00 0.00 H new ATOM 0 HG12 ILE B 47 83.229 18.864 -0.191 1.00 0.00 H new ATOM 0 HG13 ILE B 47 81.643 19.404 -0.703 1.00 0.00 H new ATOM 0 HG21 ILE B 47 84.403 17.766 -2.671 1.00 0.00 H new ATOM 0 HG22 ILE B 47 84.950 19.286 -3.417 1.00 0.00 H new ATOM 0 HG23 ILE B 47 85.158 19.028 -1.669 1.00 0.00 H new ATOM 0 HD11 ILE B 47 81.682 16.938 -0.428 1.00 0.00 H new ATOM 0 HD12 ILE B 47 81.396 17.371 -2.130 1.00 0.00 H new ATOM 0 HD13 ILE B 47 83.007 16.823 -1.611 1.00 0.00 H new ATOM 2229 N LYS B 48 85.063 22.200 -3.171 1.00 0.00 N ATOM 2230 CA LYS B 48 85.760 22.817 -4.343 1.00 0.00 C ATOM 2231 C LYS B 48 87.265 22.538 -4.242 1.00 0.00 C ATOM 2232 O LYS B 48 87.964 22.476 -5.234 1.00 0.00 O ATOM 2233 CB LYS B 48 85.514 24.329 -4.338 1.00 0.00 C ATOM 2234 CG LYS B 48 86.055 24.946 -5.634 1.00 0.00 C ATOM 2235 CD LYS B 48 85.939 26.476 -5.572 1.00 0.00 C ATOM 2236 CE LYS B 48 84.467 26.904 -5.642 1.00 0.00 C ATOM 2237 NZ LYS B 48 84.391 28.355 -5.973 1.00 0.00 N ATOM 0 H LYS B 48 85.545 22.312 -2.279 1.00 0.00 H new ATOM 0 HA LYS B 48 85.374 22.390 -5.269 1.00 0.00 H new ATOM 0 HB2 LYS B 48 84.447 24.533 -4.244 1.00 0.00 H new ATOM 0 HB3 LYS B 48 86.002 24.784 -3.476 1.00 0.00 H new ATOM 0 HG2 LYS B 48 87.096 24.657 -5.778 1.00 0.00 H new ATOM 0 HG3 LYS B 48 85.497 24.565 -6.489 1.00 0.00 H new ATOM 0 HD2 LYS B 48 86.388 26.844 -4.649 1.00 0.00 H new ATOM 0 HD3 LYS B 48 86.494 26.923 -6.397 1.00 0.00 H new ATOM 0 HE2 LYS B 48 83.942 26.319 -6.397 1.00 0.00 H new ATOM 0 HE3 LYS B 48 83.974 26.710 -4.689 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 83.394 28.648 -6.021 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 84.879 28.905 -5.237 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 84.847 28.526 -6.892 1.00 0.00 H new ATOM 2251 N GLU B 49 87.765 22.370 -3.043 1.00 0.00 N ATOM 2252 CA GLU B 49 89.223 22.097 -2.847 1.00 0.00 C ATOM 2253 C GLU B 49 89.421 20.600 -2.583 1.00 0.00 C ATOM 2254 O GLU B 49 88.653 19.982 -1.878 1.00 0.00 O ATOM 2255 CB GLU B 49 89.712 22.903 -1.638 1.00 0.00 C ATOM 2256 CG GLU B 49 91.222 22.719 -1.445 1.00 0.00 C ATOM 2257 CD GLU B 49 91.970 23.239 -2.675 1.00 0.00 C ATOM 2258 OE1 GLU B 49 91.454 24.136 -3.322 1.00 0.00 O ATOM 2259 OE2 GLU B 49 93.044 22.729 -2.950 1.00 0.00 O ATOM 0 H GLU B 49 87.219 22.411 -2.182 1.00 0.00 H new ATOM 0 HA GLU B 49 89.786 22.384 -3.735 1.00 0.00 H new ATOM 0 HB2 GLU B 49 89.484 23.959 -1.781 1.00 0.00 H new ATOM 0 HB3 GLU B 49 89.183 22.581 -0.741 1.00 0.00 H new ATOM 0 HG2 GLU B 49 91.552 23.254 -0.555 1.00 0.00 H new ATOM 0 HG3 GLU B 49 91.452 21.665 -1.287 1.00 0.00 H new ATOM 2266 N GLN B 50 90.436 20.007 -3.148 1.00 0.00 N ATOM 2267 CA GLN B 50 90.661 18.548 -2.925 1.00 0.00 C ATOM 2268 C GLN B 50 90.861 18.284 -1.433 1.00 0.00 C ATOM 2269 O GLN B 50 90.383 17.308 -0.891 1.00 0.00 O ATOM 2270 CB GLN B 50 91.912 18.111 -3.676 1.00 0.00 C ATOM 2271 CG GLN B 50 91.640 18.151 -5.178 1.00 0.00 C ATOM 2272 CD GLN B 50 92.944 17.912 -5.938 1.00 0.00 C ATOM 2273 OE1 GLN B 50 94.018 18.086 -5.395 1.00 0.00 O ATOM 2274 NE2 GLN B 50 92.896 17.521 -7.179 1.00 0.00 N ATOM 0 H GLN B 50 91.118 20.466 -3.752 1.00 0.00 H new ATOM 0 HA GLN B 50 89.797 17.990 -3.285 1.00 0.00 H new ATOM 0 HB2 GLN B 50 92.746 18.767 -3.428 1.00 0.00 H new ATOM 0 HB3 GLN B 50 92.198 17.104 -3.374 1.00 0.00 H new ATOM 0 HG2 GLN B 50 90.906 17.391 -5.446 1.00 0.00 H new ATOM 0 HG3 GLN B 50 91.216 19.116 -5.456 1.00 0.00 H new ATOM 0 HE21 GLN B 50 91.994 17.375 -7.633 1.00 0.00 H new ATOM 0 HE22 GLN B 50 93.760 17.360 -7.697 1.00 0.00 H new ATOM 2283 N GLU B 51 91.575 19.148 -0.771 1.00 0.00 N ATOM 2284 CA GLU B 51 91.822 18.955 0.685 1.00 0.00 C ATOM 2285 C GLU B 51 90.487 18.678 1.386 1.00 0.00 C ATOM 2286 O GLU B 51 90.422 17.926 2.338 1.00 0.00 O ATOM 2287 CB GLU B 51 92.473 20.217 1.262 1.00 0.00 C ATOM 2288 CG GLU B 51 92.896 19.971 2.714 1.00 0.00 C ATOM 2289 CD GLU B 51 91.670 20.020 3.630 1.00 0.00 C ATOM 2290 OE1 GLU B 51 90.732 20.727 3.298 1.00 0.00 O ATOM 2291 OE2 GLU B 51 91.692 19.350 4.649 1.00 0.00 O ATOM 0 H GLU B 51 92.000 19.982 -1.176 1.00 0.00 H new ATOM 0 HA GLU B 51 92.492 18.110 0.843 1.00 0.00 H new ATOM 0 HB2 GLU B 51 93.341 20.495 0.664 1.00 0.00 H new ATOM 0 HB3 GLU B 51 91.773 21.051 1.215 1.00 0.00 H new ATOM 0 HG2 GLU B 51 93.386 19.001 2.800 1.00 0.00 H new ATOM 0 HG3 GLU B 51 93.622 20.723 3.023 1.00 0.00 H new ATOM 2298 N VAL B 52 89.420 19.252 0.901 1.00 0.00 N ATOM 2299 CA VAL B 52 88.080 18.995 1.512 1.00 0.00 C ATOM 2300 C VAL B 52 87.672 17.546 1.216 1.00 0.00 C ATOM 2301 O VAL B 52 87.086 16.870 2.038 1.00 0.00 O ATOM 2302 CB VAL B 52 87.034 19.953 0.913 1.00 0.00 C ATOM 2303 CG1 VAL B 52 85.625 19.535 1.346 1.00 0.00 C ATOM 2304 CG2 VAL B 52 87.295 21.380 1.403 1.00 0.00 C ATOM 0 H VAL B 52 89.416 19.890 0.105 1.00 0.00 H new ATOM 0 HA VAL B 52 88.133 19.158 2.588 1.00 0.00 H new ATOM 0 HB VAL B 52 87.110 19.913 -0.174 1.00 0.00 H new ATOM 0 HG11 VAL B 52 84.894 20.220 0.916 1.00 0.00 H new ATOM 0 HG12 VAL B 52 85.422 18.522 0.997 1.00 0.00 H new ATOM 0 HG13 VAL B 52 85.555 19.565 2.433 1.00 0.00 H new ATOM 0 HG21 VAL B 52 86.552 22.053 0.976 1.00 0.00 H new ATOM 0 HG22 VAL B 52 87.228 21.409 2.491 1.00 0.00 H new ATOM 0 HG23 VAL B 52 88.291 21.695 1.092 1.00 0.00 H new ATOM 2314 N VAL B 53 87.994 17.072 0.045 1.00 0.00 N ATOM 2315 CA VAL B 53 87.643 15.668 -0.309 1.00 0.00 C ATOM 2316 C VAL B 53 88.507 14.705 0.511 1.00 0.00 C ATOM 2317 O VAL B 53 88.046 13.687 0.988 1.00 0.00 O ATOM 2318 CB VAL B 53 87.869 15.438 -1.809 1.00 0.00 C ATOM 2319 CG1 VAL B 53 87.750 13.945 -2.132 1.00 0.00 C ATOM 2320 CG2 VAL B 53 86.806 16.208 -2.597 1.00 0.00 C ATOM 0 H VAL B 53 88.484 17.595 -0.681 1.00 0.00 H new ATOM 0 HA VAL B 53 86.593 15.486 -0.082 1.00 0.00 H new ATOM 0 HB VAL B 53 88.865 15.786 -2.082 1.00 0.00 H new ATOM 0 HG11 VAL B 53 87.912 13.789 -3.199 1.00 0.00 H new ATOM 0 HG12 VAL B 53 88.499 13.390 -1.567 1.00 0.00 H new ATOM 0 HG13 VAL B 53 86.755 13.592 -1.861 1.00 0.00 H new ATOM 0 HG21 VAL B 53 86.959 16.050 -3.665 1.00 0.00 H new ATOM 0 HG22 VAL B 53 85.815 15.851 -2.316 1.00 0.00 H new ATOM 0 HG23 VAL B 53 86.886 17.272 -2.372 1.00 0.00 H new ATOM 2330 N ASP B 54 89.767 15.016 0.661 1.00 0.00 N ATOM 2331 CA ASP B 54 90.677 14.116 1.427 1.00 0.00 C ATOM 2332 C ASP B 54 90.190 13.962 2.871 1.00 0.00 C ATOM 2333 O ASP B 54 90.138 12.870 3.399 1.00 0.00 O ATOM 2334 CB ASP B 54 92.089 14.705 1.427 1.00 0.00 C ATOM 2335 CG ASP B 54 93.038 13.750 2.152 1.00 0.00 C ATOM 2336 OD1 ASP B 54 92.555 12.776 2.706 1.00 0.00 O ATOM 2337 OD2 ASP B 54 94.232 13.999 2.128 1.00 0.00 O ATOM 0 H ASP B 54 90.206 15.856 0.285 1.00 0.00 H new ATOM 0 HA ASP B 54 90.683 13.135 0.953 1.00 0.00 H new ATOM 0 HB2 ASP B 54 92.428 14.865 0.404 1.00 0.00 H new ATOM 0 HB3 ASP B 54 92.089 15.678 1.918 1.00 0.00 H new ATOM 2342 N LYS B 55 89.832 15.035 3.515 1.00 0.00 N ATOM 2343 CA LYS B 55 89.351 14.915 4.921 1.00 0.00 C ATOM 2344 C LYS B 55 88.101 14.032 4.945 1.00 0.00 C ATOM 2345 O LYS B 55 87.962 13.152 5.771 1.00 0.00 O ATOM 2346 CB LYS B 55 89.025 16.306 5.481 1.00 0.00 C ATOM 2347 CG LYS B 55 88.539 16.186 6.931 1.00 0.00 C ATOM 2348 CD LYS B 55 88.231 17.581 7.480 1.00 0.00 C ATOM 2349 CE LYS B 55 87.715 17.470 8.917 1.00 0.00 C ATOM 2350 NZ LYS B 55 87.439 18.834 9.451 1.00 0.00 N ATOM 0 H LYS B 55 89.850 15.982 3.136 1.00 0.00 H new ATOM 0 HA LYS B 55 90.127 14.464 5.539 1.00 0.00 H new ATOM 0 HB2 LYS B 55 89.909 16.942 5.436 1.00 0.00 H new ATOM 0 HB3 LYS B 55 88.259 16.783 4.870 1.00 0.00 H new ATOM 0 HG2 LYS B 55 87.648 15.560 6.977 1.00 0.00 H new ATOM 0 HG3 LYS B 55 89.300 15.702 7.543 1.00 0.00 H new ATOM 0 HD2 LYS B 55 89.129 18.199 7.453 1.00 0.00 H new ATOM 0 HD3 LYS B 55 87.487 18.072 6.853 1.00 0.00 H new ATOM 0 HE2 LYS B 55 86.808 16.867 8.944 1.00 0.00 H new ATOM 0 HE3 LYS B 55 88.452 16.965 9.542 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 87.088 18.760 10.427 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 88.315 19.395 9.439 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 86.721 19.300 8.860 1.00 0.00 H new ATOM 2364 N VAL B 56 87.189 14.270 4.045 1.00 0.00 N ATOM 2365 CA VAL B 56 85.940 13.455 4.012 1.00 0.00 C ATOM 2366 C VAL B 56 86.270 12.024 3.583 1.00 0.00 C ATOM 2367 O VAL B 56 85.734 11.067 4.106 1.00 0.00 O ATOM 2368 CB VAL B 56 84.952 14.077 3.019 1.00 0.00 C ATOM 2369 CG1 VAL B 56 83.759 13.137 2.815 1.00 0.00 C ATOM 2370 CG2 VAL B 56 84.458 15.416 3.572 1.00 0.00 C ATOM 0 H VAL B 56 87.253 14.994 3.329 1.00 0.00 H new ATOM 0 HA VAL B 56 85.492 13.437 5.006 1.00 0.00 H new ATOM 0 HB VAL B 56 85.450 14.235 2.063 1.00 0.00 H new ATOM 0 HG11 VAL B 56 83.060 13.584 2.108 1.00 0.00 H new ATOM 0 HG12 VAL B 56 84.111 12.183 2.423 1.00 0.00 H new ATOM 0 HG13 VAL B 56 83.257 12.975 3.769 1.00 0.00 H new ATOM 0 HG21 VAL B 56 83.755 15.863 2.869 1.00 0.00 H new ATOM 0 HG22 VAL B 56 83.961 15.254 4.529 1.00 0.00 H new ATOM 0 HG23 VAL B 56 85.306 16.087 3.713 1.00 0.00 H new ATOM 2380 N MET B 57 87.144 11.872 2.630 1.00 0.00 N ATOM 2381 CA MET B 57 87.507 10.505 2.160 1.00 0.00 C ATOM 2382 C MET B 57 88.166 9.718 3.295 1.00 0.00 C ATOM 2383 O MET B 57 87.896 8.550 3.493 1.00 0.00 O ATOM 2384 CB MET B 57 88.479 10.628 0.990 1.00 0.00 C ATOM 2385 CG MET B 57 88.736 9.245 0.396 1.00 0.00 C ATOM 2386 SD MET B 57 89.712 9.416 -1.115 1.00 0.00 S ATOM 2387 CE MET B 57 89.320 7.797 -1.815 1.00 0.00 C ATOM 0 H MET B 57 87.624 12.636 2.154 1.00 0.00 H new ATOM 0 HA MET B 57 86.608 9.977 1.843 1.00 0.00 H new ATOM 0 HB2 MET B 57 88.068 11.292 0.230 1.00 0.00 H new ATOM 0 HB3 MET B 57 89.416 11.071 1.327 1.00 0.00 H new ATOM 0 HG2 MET B 57 89.265 8.620 1.116 1.00 0.00 H new ATOM 0 HG3 MET B 57 87.790 8.749 0.178 1.00 0.00 H new ATOM 0 HE1 MET B 57 89.922 7.631 -2.708 1.00 0.00 H new ATOM 0 HE2 MET B 57 89.538 7.021 -1.081 1.00 0.00 H new ATOM 0 HE3 MET B 57 88.263 7.761 -2.079 1.00 0.00 H new ATOM 2397 N GLU B 58 89.026 10.353 4.039 1.00 0.00 N ATOM 2398 CA GLU B 58 89.709 9.653 5.165 1.00 0.00 C ATOM 2399 C GLU B 58 88.658 9.158 6.158 1.00 0.00 C ATOM 2400 O GLU B 58 88.690 8.028 6.603 1.00 0.00 O ATOM 2401 CB GLU B 58 90.655 10.641 5.858 1.00 0.00 C ATOM 2402 CG GLU B 58 91.382 9.962 7.026 1.00 0.00 C ATOM 2403 CD GLU B 58 92.238 8.806 6.505 1.00 0.00 C ATOM 2404 OE1 GLU B 58 92.622 8.852 5.350 1.00 0.00 O ATOM 2405 OE2 GLU B 58 92.503 7.896 7.276 1.00 0.00 O ATOM 0 H GLU B 58 89.288 11.331 3.917 1.00 0.00 H new ATOM 0 HA GLU B 58 90.279 8.802 4.791 1.00 0.00 H new ATOM 0 HB2 GLU B 58 91.383 11.020 5.141 1.00 0.00 H new ATOM 0 HB3 GLU B 58 90.090 11.499 6.223 1.00 0.00 H new ATOM 0 HG2 GLU B 58 92.010 10.686 7.545 1.00 0.00 H new ATOM 0 HG3 GLU B 58 90.657 9.591 7.751 1.00 0.00 H new ATOM 2412 N THR B 59 87.723 9.996 6.499 1.00 0.00 N ATOM 2413 CA THR B 59 86.662 9.578 7.455 1.00 0.00 C ATOM 2414 C THR B 59 85.779 8.526 6.784 1.00 0.00 C ATOM 2415 O THR B 59 85.373 7.556 7.393 1.00 0.00 O ATOM 2416 CB THR B 59 85.811 10.791 7.843 1.00 0.00 C ATOM 2417 OG1 THR B 59 86.641 11.769 8.455 1.00 0.00 O ATOM 2418 CG2 THR B 59 84.722 10.362 8.828 1.00 0.00 C ATOM 0 H THR B 59 87.647 10.954 6.157 1.00 0.00 H new ATOM 0 HA THR B 59 87.118 9.161 8.353 1.00 0.00 H new ATOM 0 HB THR B 59 85.346 11.209 6.950 1.00 0.00 H new ATOM 0 HG1 THR B 59 87.115 12.275 7.763 1.00 0.00 H new ATOM 0 HG21 THR B 59 84.118 11.227 9.102 1.00 0.00 H new ATOM 0 HG22 THR B 59 84.086 9.609 8.362 1.00 0.00 H new ATOM 0 HG23 THR B 59 85.184 9.944 9.722 1.00 0.00 H new ATOM 2426 N LEU B 60 85.490 8.713 5.527 1.00 0.00 N ATOM 2427 CA LEU B 60 84.640 7.731 4.797 1.00 0.00 C ATOM 2428 C LEU B 60 85.314 6.359 4.779 1.00 0.00 C ATOM 2429 O LEU B 60 84.687 5.347 5.021 1.00 0.00 O ATOM 2430 CB LEU B 60 84.431 8.214 3.357 1.00 0.00 C ATOM 2431 CG LEU B 60 83.564 7.217 2.569 1.00 0.00 C ATOM 2432 CD1 LEU B 60 82.206 7.015 3.264 1.00 0.00 C ATOM 2433 CD2 LEU B 60 83.337 7.775 1.160 1.00 0.00 C ATOM 0 H LEU B 60 85.807 9.507 4.971 1.00 0.00 H new ATOM 0 HA LEU B 60 83.679 7.647 5.304 1.00 0.00 H new ATOM 0 HB2 LEU B 60 83.953 9.194 3.363 1.00 0.00 H new ATOM 0 HB3 LEU B 60 85.396 8.333 2.864 1.00 0.00 H new ATOM 0 HG LEU B 60 84.074 6.255 2.521 1.00 0.00 H new ATOM 0 HD11 LEU B 60 81.606 6.307 2.692 1.00 0.00 H new ATOM 0 HD12 LEU B 60 82.366 6.626 4.270 1.00 0.00 H new ATOM 0 HD13 LEU B 60 81.682 7.969 3.323 1.00 0.00 H new ATOM 0 HD21 LEU B 60 82.723 7.079 0.588 1.00 0.00 H new ATOM 0 HD22 LEU B 60 82.829 8.737 1.227 1.00 0.00 H new ATOM 0 HD23 LEU B 60 84.297 7.906 0.662 1.00 0.00 H new ATOM 2445 N ASP B 61 86.576 6.310 4.455 1.00 0.00 N ATOM 2446 CA ASP B 61 87.277 4.997 4.379 1.00 0.00 C ATOM 2447 C ASP B 61 87.402 4.366 5.768 1.00 0.00 C ATOM 2448 O ASP B 61 88.209 4.769 6.582 1.00 0.00 O ATOM 2449 CB ASP B 61 88.677 5.201 3.795 1.00 0.00 C ATOM 2450 CG ASP B 61 88.567 5.592 2.320 1.00 0.00 C ATOM 2451 OD1 ASP B 61 87.590 5.208 1.695 1.00 0.00 O ATOM 2452 OD2 ASP B 61 89.459 6.271 1.838 1.00 0.00 O ATOM 0 H ASP B 61 87.153 7.123 4.239 1.00 0.00 H new ATOM 0 HA ASP B 61 86.695 4.331 3.741 1.00 0.00 H new ATOM 0 HB2 ASP B 61 89.203 5.978 4.349 1.00 0.00 H new ATOM 0 HB3 ASP B 61 89.261 4.286 3.896 1.00 0.00 H new ATOM 2457 N GLU B 62 86.600 3.372 6.030 1.00 0.00 N ATOM 2458 CA GLU B 62 86.653 2.696 7.358 1.00 0.00 C ATOM 2459 C GLU B 62 88.053 2.107 7.564 1.00 0.00 C ATOM 2460 O GLU B 62 88.624 2.206 8.632 1.00 0.00 O ATOM 2461 CB GLU B 62 85.612 1.567 7.393 1.00 0.00 C ATOM 2462 CG GLU B 62 85.630 0.855 8.755 1.00 0.00 C ATOM 2463 CD GLU B 62 85.162 1.815 9.852 1.00 0.00 C ATOM 2464 OE1 GLU B 62 84.538 2.808 9.518 1.00 0.00 O ATOM 2465 OE2 GLU B 62 85.432 1.535 11.010 1.00 0.00 O ATOM 0 H GLU B 62 85.908 2.997 5.381 1.00 0.00 H new ATOM 0 HA GLU B 62 86.437 3.414 8.149 1.00 0.00 H new ATOM 0 HB2 GLU B 62 84.619 1.975 7.203 1.00 0.00 H new ATOM 0 HB3 GLU B 62 85.819 0.850 6.599 1.00 0.00 H new ATOM 0 HG2 GLU B 62 84.982 -0.021 8.726 1.00 0.00 H new ATOM 0 HG3 GLU B 62 86.636 0.500 8.976 1.00 0.00 H new ATOM 2472 N ASP B 63 88.602 1.477 6.559 1.00 0.00 N ATOM 2473 CA ASP B 63 89.958 0.861 6.705 1.00 0.00 C ATOM 2474 C ASP B 63 91.056 1.845 6.278 1.00 0.00 C ATOM 2475 O ASP B 63 92.227 1.604 6.499 1.00 0.00 O ATOM 2476 CB ASP B 63 90.028 -0.393 5.830 1.00 0.00 C ATOM 2477 CG ASP B 63 89.797 -0.013 4.367 1.00 0.00 C ATOM 2478 OD1 ASP B 63 89.439 1.127 4.122 1.00 0.00 O ATOM 2479 OD2 ASP B 63 89.983 -0.867 3.518 1.00 0.00 O ATOM 0 H ASP B 63 88.171 1.361 5.642 1.00 0.00 H new ATOM 0 HA ASP B 63 90.118 0.603 7.752 1.00 0.00 H new ATOM 0 HB2 ASP B 63 91.000 -0.873 5.942 1.00 0.00 H new ATOM 0 HB3 ASP B 63 89.277 -1.115 6.151 1.00 0.00 H new ATOM 2484 N GLY B 64 90.701 2.950 5.679 1.00 0.00 N ATOM 2485 CA GLY B 64 91.744 3.936 5.259 1.00 0.00 C ATOM 2486 C GLY B 64 92.599 3.350 4.128 1.00 0.00 C ATOM 2487 O GLY B 64 93.769 3.652 4.003 1.00 0.00 O ATOM 0 H GLY B 64 89.740 3.214 5.462 1.00 0.00 H new ATOM 0 HA2 GLY B 64 91.270 4.859 4.926 1.00 0.00 H new ATOM 0 HA3 GLY B 64 92.377 4.192 6.109 1.00 0.00 H new ATOM 2491 N ASP B 65 92.027 2.509 3.310 1.00 0.00 N ATOM 2492 CA ASP B 65 92.803 1.893 2.193 1.00 0.00 C ATOM 2493 C ASP B 65 93.119 2.942 1.120 1.00 0.00 C ATOM 2494 O ASP B 65 93.815 2.668 0.164 1.00 0.00 O ATOM 2495 CB ASP B 65 91.976 0.766 1.575 1.00 0.00 C ATOM 2496 CG ASP B 65 90.638 1.326 1.090 1.00 0.00 C ATOM 2497 OD1 ASP B 65 90.322 2.447 1.454 1.00 0.00 O ATOM 2498 OD2 ASP B 65 89.950 0.623 0.370 1.00 0.00 O ATOM 0 H ASP B 65 91.050 2.220 3.367 1.00 0.00 H new ATOM 0 HA ASP B 65 93.741 1.499 2.584 1.00 0.00 H new ATOM 0 HB2 ASP B 65 92.518 0.316 0.743 1.00 0.00 H new ATOM 0 HB3 ASP B 65 91.808 -0.022 2.309 1.00 0.00 H new ATOM 2503 N GLY B 66 92.636 4.146 1.277 1.00 0.00 N ATOM 2504 CA GLY B 66 92.938 5.214 0.273 1.00 0.00 C ATOM 2505 C GLY B 66 91.918 5.197 -0.871 1.00 0.00 C ATOM 2506 O GLY B 66 91.874 6.102 -1.681 1.00 0.00 O ATOM 0 H GLY B 66 92.046 4.438 2.056 1.00 0.00 H new ATOM 0 HA2 GLY B 66 92.927 6.189 0.760 1.00 0.00 H new ATOM 0 HA3 GLY B 66 93.941 5.068 -0.127 1.00 0.00 H new ATOM 2510 N GLU B 67 91.089 4.187 -0.945 1.00 0.00 N ATOM 2511 CA GLU B 67 90.062 4.121 -2.032 1.00 0.00 C ATOM 2512 C GLU B 67 88.765 3.581 -1.431 1.00 0.00 C ATOM 2513 O GLU B 67 88.780 2.970 -0.381 1.00 0.00 O ATOM 2514 CB GLU B 67 90.542 3.196 -3.158 1.00 0.00 C ATOM 2515 CG GLU B 67 91.723 3.850 -3.880 1.00 0.00 C ATOM 2516 CD GLU B 67 92.205 2.946 -5.018 1.00 0.00 C ATOM 2517 OE1 GLU B 67 91.751 1.819 -5.088 1.00 0.00 O ATOM 2518 OE2 GLU B 67 93.018 3.403 -5.805 1.00 0.00 O ATOM 0 H GLU B 67 91.078 3.400 -0.296 1.00 0.00 H new ATOM 0 HA GLU B 67 89.899 5.114 -2.452 1.00 0.00 H new ATOM 0 HB2 GLU B 67 90.840 2.231 -2.749 1.00 0.00 H new ATOM 0 HB3 GLU B 67 89.730 3.008 -3.861 1.00 0.00 H new ATOM 0 HG2 GLU B 67 91.425 4.821 -4.277 1.00 0.00 H new ATOM 0 HG3 GLU B 67 92.536 4.029 -3.177 1.00 0.00 H new ATOM 2525 N CYS B 68 87.637 3.791 -2.074 1.00 0.00 N ATOM 2526 CA CYS B 68 86.342 3.277 -1.514 1.00 0.00 C ATOM 2527 C CYS B 68 85.890 2.047 -2.303 1.00 0.00 C ATOM 2528 O CYS B 68 85.544 2.131 -3.467 1.00 0.00 O ATOM 2529 CB CYS B 68 85.270 4.362 -1.630 1.00 0.00 C ATOM 2530 SG CYS B 68 85.615 5.685 -0.443 1.00 0.00 S ATOM 0 H CYS B 68 87.557 4.294 -2.958 1.00 0.00 H new ATOM 0 HA CYS B 68 86.487 3.009 -0.468 1.00 0.00 H new ATOM 0 HB2 CYS B 68 85.253 4.764 -2.643 1.00 0.00 H new ATOM 0 HB3 CYS B 68 84.285 3.936 -1.439 1.00 0.00 H new ATOM 0 HG CYS B 68 86.505 5.279 0.413 1.00 0.00 H new ATOM 2536 N ASP B 69 85.913 0.902 -1.680 1.00 0.00 N ATOM 2537 CA ASP B 69 85.506 -0.346 -2.383 1.00 0.00 C ATOM 2538 C ASP B 69 83.992 -0.363 -2.621 1.00 0.00 C ATOM 2539 O ASP B 69 83.281 0.570 -2.307 1.00 0.00 O ATOM 2540 CB ASP B 69 85.901 -1.563 -1.545 1.00 0.00 C ATOM 2541 CG ASP B 69 85.089 -1.581 -0.249 1.00 0.00 C ATOM 2542 OD1 ASP B 69 84.485 -0.569 0.060 1.00 0.00 O ATOM 2543 OD2 ASP B 69 85.090 -2.605 0.413 1.00 0.00 O ATOM 0 H ASP B 69 86.198 0.777 -0.709 1.00 0.00 H new ATOM 0 HA ASP B 69 86.014 -0.381 -3.347 1.00 0.00 H new ATOM 0 HB2 ASP B 69 85.724 -2.478 -2.109 1.00 0.00 H new ATOM 0 HB3 ASP B 69 86.967 -1.530 -1.318 1.00 0.00 H new ATOM 2548 N PHE B 70 83.514 -1.438 -3.180 1.00 0.00 N ATOM 2549 CA PHE B 70 82.054 -1.565 -3.454 1.00 0.00 C ATOM 2550 C PHE B 70 81.267 -1.482 -2.141 1.00 0.00 C ATOM 2551 O PHE B 70 80.288 -0.773 -2.033 1.00 0.00 O ATOM 2552 CB PHE B 70 81.771 -2.915 -4.116 1.00 0.00 C ATOM 2553 CG PHE B 70 80.333 -2.959 -4.576 1.00 0.00 C ATOM 2554 CD1 PHE B 70 79.332 -3.436 -3.719 1.00 0.00 C ATOM 2555 CD2 PHE B 70 80.001 -2.527 -5.864 1.00 0.00 C ATOM 2556 CE1 PHE B 70 78.001 -3.480 -4.153 1.00 0.00 C ATOM 2557 CE2 PHE B 70 78.670 -2.571 -6.298 1.00 0.00 C ATOM 2558 CZ PHE B 70 77.670 -3.048 -5.443 1.00 0.00 C ATOM 0 H PHE B 70 84.076 -2.241 -3.462 1.00 0.00 H new ATOM 0 HA PHE B 70 81.748 -0.755 -4.116 1.00 0.00 H new ATOM 0 HB2 PHE B 70 82.440 -3.064 -4.964 1.00 0.00 H new ATOM 0 HB3 PHE B 70 81.964 -3.725 -3.412 1.00 0.00 H new ATOM 0 HD1 PHE B 70 79.587 -3.770 -2.724 1.00 0.00 H new ATOM 0 HD2 PHE B 70 80.772 -2.159 -6.525 1.00 0.00 H new ATOM 0 HE1 PHE B 70 77.230 -3.847 -3.492 1.00 0.00 H new ATOM 0 HE2 PHE B 70 78.415 -2.237 -7.293 1.00 0.00 H new ATOM 0 HZ PHE B 70 76.644 -3.083 -5.778 1.00 0.00 H new ATOM 2568 N GLN B 71 81.661 -2.247 -1.164 1.00 0.00 N ATOM 2569 CA GLN B 71 80.897 -2.258 0.115 1.00 0.00 C ATOM 2570 C GLN B 71 80.863 -0.849 0.711 1.00 0.00 C ATOM 2571 O GLN B 71 79.809 -0.335 1.024 1.00 0.00 O ATOM 2572 CB GLN B 71 81.561 -3.222 1.100 1.00 0.00 C ATOM 2573 CG GLN B 71 81.382 -4.657 0.602 1.00 0.00 C ATOM 2574 CD GLN B 71 82.245 -5.596 1.444 1.00 0.00 C ATOM 2575 OE1 GLN B 71 83.161 -5.160 2.112 1.00 0.00 O ATOM 2576 NE2 GLN B 71 81.994 -6.875 1.442 1.00 0.00 N ATOM 0 H GLN B 71 82.474 -2.862 -1.193 1.00 0.00 H new ATOM 0 HA GLN B 71 79.876 -2.587 -0.078 1.00 0.00 H new ATOM 0 HB2 GLN B 71 82.621 -2.988 1.197 1.00 0.00 H new ATOM 0 HB3 GLN B 71 81.118 -3.111 2.090 1.00 0.00 H new ATOM 0 HG2 GLN B 71 80.334 -4.949 0.669 1.00 0.00 H new ATOM 0 HG3 GLN B 71 81.666 -4.728 -0.448 1.00 0.00 H new ATOM 0 HE21 GLN B 71 81.225 -7.243 0.882 1.00 0.00 H new ATOM 0 HE22 GLN B 71 82.566 -7.508 2.001 1.00 0.00 H new ATOM 2585 N GLU B 72 81.987 -0.209 0.870 1.00 0.00 N ATOM 2586 CA GLU B 72 81.955 1.171 1.441 1.00 0.00 C ATOM 2587 C GLU B 72 81.113 2.049 0.517 1.00 0.00 C ATOM 2588 O GLU B 72 80.308 2.848 0.950 1.00 0.00 O ATOM 2589 CB GLU B 72 83.374 1.735 1.528 1.00 0.00 C ATOM 2590 CG GLU B 72 84.149 0.978 2.608 1.00 0.00 C ATOM 2591 CD GLU B 72 85.572 1.533 2.704 1.00 0.00 C ATOM 2592 OE1 GLU B 72 85.962 2.271 1.814 1.00 0.00 O ATOM 2593 OE2 GLU B 72 86.244 1.219 3.673 1.00 0.00 O ATOM 0 H GLU B 72 82.911 -0.570 0.635 1.00 0.00 H new ATOM 0 HA GLU B 72 81.526 1.150 2.443 1.00 0.00 H new ATOM 0 HB2 GLU B 72 83.877 1.637 0.566 1.00 0.00 H new ATOM 0 HB3 GLU B 72 83.342 2.799 1.764 1.00 0.00 H new ATOM 0 HG2 GLU B 72 83.644 1.077 3.569 1.00 0.00 H new ATOM 0 HG3 GLU B 72 84.178 -0.086 2.371 1.00 0.00 H new ATOM 2600 N PHE B 73 81.315 1.900 -0.760 1.00 0.00 N ATOM 2601 CA PHE B 73 80.547 2.723 -1.733 1.00 0.00 C ATOM 2602 C PHE B 73 79.061 2.624 -1.379 1.00 0.00 C ATOM 2603 O PHE B 73 78.336 3.596 -1.429 1.00 0.00 O ATOM 2604 CB PHE B 73 80.781 2.230 -3.162 1.00 0.00 C ATOM 2605 CG PHE B 73 80.000 3.103 -4.112 1.00 0.00 C ATOM 2606 CD1 PHE B 73 80.586 4.259 -4.635 1.00 0.00 C ATOM 2607 CD2 PHE B 73 78.688 2.765 -4.459 1.00 0.00 C ATOM 2608 CE1 PHE B 73 79.863 5.076 -5.509 1.00 0.00 C ATOM 2609 CE2 PHE B 73 77.962 3.583 -5.334 1.00 0.00 C ATOM 2610 CZ PHE B 73 78.550 4.739 -5.860 1.00 0.00 C ATOM 0 H PHE B 73 81.978 1.244 -1.173 1.00 0.00 H new ATOM 0 HA PHE B 73 80.880 3.760 -1.679 1.00 0.00 H new ATOM 0 HB2 PHE B 73 81.843 2.265 -3.404 1.00 0.00 H new ATOM 0 HB3 PHE B 73 80.466 1.191 -3.259 1.00 0.00 H new ATOM 0 HD1 PHE B 73 81.598 4.521 -4.364 1.00 0.00 H new ATOM 0 HD2 PHE B 73 78.235 1.873 -4.052 1.00 0.00 H new ATOM 0 HE1 PHE B 73 80.318 5.968 -5.914 1.00 0.00 H new ATOM 0 HE2 PHE B 73 76.949 3.322 -5.603 1.00 0.00 H new ATOM 0 HZ PHE B 73 77.992 5.370 -6.536 1.00 0.00 H new ATOM 2620 N MET B 74 78.611 1.460 -0.996 1.00 0.00 N ATOM 2621 CA MET B 74 77.179 1.295 -0.609 1.00 0.00 C ATOM 2622 C MET B 74 76.919 2.052 0.701 1.00 0.00 C ATOM 2623 O MET B 74 75.825 2.512 0.957 1.00 0.00 O ATOM 2624 CB MET B 74 76.868 -0.190 -0.404 1.00 0.00 C ATOM 2625 CG MET B 74 76.907 -0.920 -1.748 1.00 0.00 C ATOM 2626 SD MET B 74 75.528 -0.365 -2.787 1.00 0.00 S ATOM 2627 CE MET B 74 74.176 -1.131 -1.854 1.00 0.00 C ATOM 0 H MET B 74 79.175 0.612 -0.934 1.00 0.00 H new ATOM 0 HA MET B 74 76.542 1.693 -1.399 1.00 0.00 H new ATOM 0 HB2 MET B 74 77.592 -0.631 0.281 1.00 0.00 H new ATOM 0 HB3 MET B 74 75.886 -0.305 0.054 1.00 0.00 H new ATOM 0 HG2 MET B 74 77.854 -0.726 -2.251 1.00 0.00 H new ATOM 0 HG3 MET B 74 76.845 -1.997 -1.590 1.00 0.00 H new ATOM 0 HE1 MET B 74 73.347 -1.348 -2.527 1.00 0.00 H new ATOM 0 HE2 MET B 74 74.527 -2.058 -1.400 1.00 0.00 H new ATOM 0 HE3 MET B 74 73.840 -0.449 -1.073 1.00 0.00 H new ATOM 2637 N ALA B 75 77.920 2.191 1.528 1.00 0.00 N ATOM 2638 CA ALA B 75 77.728 2.929 2.811 1.00 0.00 C ATOM 2639 C ALA B 75 77.406 4.391 2.492 1.00 0.00 C ATOM 2640 O ALA B 75 76.401 4.929 2.912 1.00 0.00 O ATOM 2641 CB ALA B 75 79.012 2.853 3.639 1.00 0.00 C ATOM 0 H ALA B 75 78.860 1.827 1.372 1.00 0.00 H new ATOM 0 HA ALA B 75 76.910 2.486 3.379 1.00 0.00 H new ATOM 0 HB1 ALA B 75 78.873 3.392 4.576 1.00 0.00 H new ATOM 0 HB2 ALA B 75 79.247 1.810 3.851 1.00 0.00 H new ATOM 0 HB3 ALA B 75 79.832 3.303 3.080 1.00 0.00 H new ATOM 2647 N PHE B 76 78.266 5.032 1.753 1.00 0.00 N ATOM 2648 CA PHE B 76 78.029 6.464 1.403 1.00 0.00 C ATOM 2649 C PHE B 76 76.620 6.584 0.832 1.00 0.00 C ATOM 2650 O PHE B 76 75.887 7.507 1.127 1.00 0.00 O ATOM 2651 CB PHE B 76 79.037 6.915 0.345 1.00 0.00 C ATOM 2652 CG PHE B 76 78.912 8.407 0.140 1.00 0.00 C ATOM 2653 CD1 PHE B 76 77.986 8.916 -0.779 1.00 0.00 C ATOM 2654 CD2 PHE B 76 79.725 9.279 0.871 1.00 0.00 C ATOM 2655 CE1 PHE B 76 77.875 10.301 -0.966 1.00 0.00 C ATOM 2656 CE2 PHE B 76 79.614 10.662 0.685 1.00 0.00 C ATOM 2657 CZ PHE B 76 78.690 11.174 -0.233 1.00 0.00 C ATOM 0 H PHE B 76 79.123 4.629 1.375 1.00 0.00 H new ATOM 0 HA PHE B 76 78.142 7.088 2.290 1.00 0.00 H new ATOM 0 HB2 PHE B 76 80.050 6.663 0.660 1.00 0.00 H new ATOM 0 HB3 PHE B 76 78.856 6.391 -0.593 1.00 0.00 H new ATOM 0 HD1 PHE B 76 77.358 8.242 -1.343 1.00 0.00 H new ATOM 0 HD2 PHE B 76 80.439 8.885 1.579 1.00 0.00 H new ATOM 0 HE1 PHE B 76 77.162 10.695 -1.675 1.00 0.00 H new ATOM 0 HE2 PHE B 76 80.242 11.335 1.250 1.00 0.00 H new ATOM 0 HZ PHE B 76 78.605 12.241 -0.376 1.00 0.00 H new ATOM 2667 N VAL B 77 76.232 5.631 0.039 1.00 0.00 N ATOM 2668 CA VAL B 77 74.861 5.662 -0.527 1.00 0.00 C ATOM 2669 C VAL B 77 73.872 5.631 0.644 1.00 0.00 C ATOM 2670 O VAL B 77 72.922 6.387 0.685 1.00 0.00 O ATOM 2671 CB VAL B 77 74.644 4.452 -1.441 1.00 0.00 C ATOM 2672 CG1 VAL B 77 73.170 4.369 -1.841 1.00 0.00 C ATOM 2673 CG2 VAL B 77 75.506 4.608 -2.698 1.00 0.00 C ATOM 0 H VAL B 77 76.803 4.834 -0.241 1.00 0.00 H new ATOM 0 HA VAL B 77 74.712 6.563 -1.122 1.00 0.00 H new ATOM 0 HB VAL B 77 74.926 3.541 -0.913 1.00 0.00 H new ATOM 0 HG11 VAL B 77 73.017 3.508 -2.491 1.00 0.00 H new ATOM 0 HG12 VAL B 77 72.556 4.262 -0.947 1.00 0.00 H new ATOM 0 HG13 VAL B 77 72.885 5.278 -2.370 1.00 0.00 H new ATOM 0 HG21 VAL B 77 75.355 3.749 -3.352 1.00 0.00 H new ATOM 0 HG22 VAL B 77 75.221 5.519 -3.224 1.00 0.00 H new ATOM 0 HG23 VAL B 77 76.557 4.667 -2.414 1.00 0.00 H new ATOM 2683 N SER B 78 74.096 4.767 1.608 1.00 0.00 N ATOM 2684 CA SER B 78 73.174 4.702 2.781 1.00 0.00 C ATOM 2685 C SER B 78 73.232 6.025 3.545 1.00 0.00 C ATOM 2686 O SER B 78 72.223 6.555 3.964 1.00 0.00 O ATOM 2687 CB SER B 78 73.602 3.566 3.713 1.00 0.00 C ATOM 2688 OG SER B 78 74.827 3.912 4.347 1.00 0.00 O ATOM 0 H SER B 78 74.875 4.108 1.630 1.00 0.00 H new ATOM 0 HA SER B 78 72.158 4.521 2.430 1.00 0.00 H new ATOM 0 HB2 SER B 78 72.831 3.385 4.462 1.00 0.00 H new ATOM 0 HB3 SER B 78 73.721 2.642 3.147 1.00 0.00 H new ATOM 0 HG SER B 78 75.473 4.207 3.672 1.00 0.00 H new ATOM 2694 N MET B 79 74.409 6.552 3.750 1.00 0.00 N ATOM 2695 CA MET B 79 74.531 7.830 4.510 1.00 0.00 C ATOM 2696 C MET B 79 73.550 8.844 3.934 1.00 0.00 C ATOM 2697 O MET B 79 72.869 9.549 4.654 1.00 0.00 O ATOM 2698 CB MET B 79 75.960 8.364 4.381 1.00 0.00 C ATOM 2699 CG MET B 79 76.136 9.595 5.272 1.00 0.00 C ATOM 2700 SD MET B 79 77.830 10.219 5.110 1.00 0.00 S ATOM 2701 CE MET B 79 78.680 8.836 5.920 1.00 0.00 C ATOM 0 H MET B 79 75.290 6.154 3.425 1.00 0.00 H new ATOM 0 HA MET B 79 74.306 7.659 5.563 1.00 0.00 H new ATOM 0 HB2 MET B 79 76.674 7.592 4.667 1.00 0.00 H new ATOM 0 HB3 MET B 79 76.169 8.622 3.343 1.00 0.00 H new ATOM 0 HG2 MET B 79 75.423 10.369 4.987 1.00 0.00 H new ATOM 0 HG3 MET B 79 75.929 9.338 6.311 1.00 0.00 H new ATOM 0 HE1 MET B 79 79.615 9.188 6.355 1.00 0.00 H new ATOM 0 HE2 MET B 79 78.044 8.429 6.706 1.00 0.00 H new ATOM 0 HE3 MET B 79 78.892 8.059 5.186 1.00 0.00 H new ATOM 2711 N VAL B 80 73.450 8.898 2.643 1.00 0.00 N ATOM 2712 CA VAL B 80 72.493 9.837 2.007 1.00 0.00 C ATOM 2713 C VAL B 80 71.075 9.445 2.424 1.00 0.00 C ATOM 2714 O VAL B 80 70.202 10.277 2.566 1.00 0.00 O ATOM 2715 CB VAL B 80 72.637 9.756 0.490 1.00 0.00 C ATOM 2716 CG1 VAL B 80 71.571 10.633 -0.169 1.00 0.00 C ATOM 2717 CG2 VAL B 80 74.029 10.254 0.099 1.00 0.00 C ATOM 0 H VAL B 80 73.993 8.329 1.994 1.00 0.00 H new ATOM 0 HA VAL B 80 72.697 10.859 2.325 1.00 0.00 H new ATOM 0 HB VAL B 80 72.508 8.726 0.157 1.00 0.00 H new ATOM 0 HG11 VAL B 80 71.672 10.576 -1.253 1.00 0.00 H new ATOM 0 HG12 VAL B 80 70.581 10.282 0.122 1.00 0.00 H new ATOM 0 HG13 VAL B 80 71.699 11.666 0.154 1.00 0.00 H new ATOM 0 HG21 VAL B 80 74.144 10.201 -0.984 1.00 0.00 H new ATOM 0 HG22 VAL B 80 74.151 11.286 0.427 1.00 0.00 H new ATOM 0 HG23 VAL B 80 74.786 9.630 0.575 1.00 0.00 H new ATOM 2727 N THR B 81 70.854 8.179 2.650 1.00 0.00 N ATOM 2728 CA THR B 81 69.509 7.725 3.093 1.00 0.00 C ATOM 2729 C THR B 81 69.359 8.023 4.589 1.00 0.00 C ATOM 2730 O THR B 81 68.365 8.566 5.031 1.00 0.00 O ATOM 2731 CB THR B 81 69.366 6.223 2.848 1.00 0.00 C ATOM 2732 OG1 THR B 81 69.683 5.932 1.494 1.00 0.00 O ATOM 2733 CG2 THR B 81 67.928 5.801 3.134 1.00 0.00 C ATOM 0 H THR B 81 71.549 7.440 2.546 1.00 0.00 H new ATOM 0 HA THR B 81 68.736 8.249 2.531 1.00 0.00 H new ATOM 0 HB THR B 81 70.045 5.679 3.505 1.00 0.00 H new ATOM 0 HG1 THR B 81 69.593 4.969 1.337 1.00 0.00 H new ATOM 0 HG21 THR B 81 67.822 4.730 2.960 1.00 0.00 H new ATOM 0 HG22 THR B 81 67.682 6.027 4.172 1.00 0.00 H new ATOM 0 HG23 THR B 81 67.251 6.344 2.474 1.00 0.00 H new ATOM 2741 N THR B 82 70.353 7.677 5.370 1.00 0.00 N ATOM 2742 CA THR B 82 70.296 7.940 6.834 1.00 0.00 C ATOM 2743 C THR B 82 70.439 9.442 7.082 1.00 0.00 C ATOM 2744 O THR B 82 70.161 9.934 8.158 1.00 0.00 O ATOM 2745 CB THR B 82 71.441 7.209 7.541 1.00 0.00 C ATOM 2746 OG1 THR B 82 72.672 7.826 7.205 1.00 0.00 O ATOM 2747 CG2 THR B 82 71.477 5.739 7.116 1.00 0.00 C ATOM 0 H THR B 82 71.207 7.220 5.049 1.00 0.00 H new ATOM 0 HA THR B 82 69.342 7.584 7.224 1.00 0.00 H new ATOM 0 HB THR B 82 71.282 7.262 8.618 1.00 0.00 H new ATOM 0 HG1 THR B 82 72.564 8.345 6.381 1.00 0.00 H new ATOM 0 HG21 THR B 82 72.296 5.233 7.627 1.00 0.00 H new ATOM 0 HG22 THR B 82 70.534 5.261 7.380 1.00 0.00 H new ATOM 0 HG23 THR B 82 71.627 5.675 6.038 1.00 0.00 H new ATOM 2755 N ALA B 83 70.871 10.175 6.091 1.00 0.00 N ATOM 2756 CA ALA B 83 71.030 11.646 6.267 1.00 0.00 C ATOM 2757 C ALA B 83 69.666 12.271 6.553 1.00 0.00 C ATOM 2758 O ALA B 83 69.535 13.152 7.380 1.00 0.00 O ATOM 2759 CB ALA B 83 71.617 12.244 4.986 1.00 0.00 C ATOM 0 H ALA B 83 71.120 9.818 5.168 1.00 0.00 H new ATOM 0 HA ALA B 83 71.700 11.850 7.102 1.00 0.00 H new ATOM 0 HB1 ALA B 83 71.736 13.321 5.108 1.00 0.00 H new ATOM 0 HB2 ALA B 83 72.588 11.792 4.785 1.00 0.00 H new ATOM 0 HB3 ALA B 83 70.945 12.046 4.151 1.00 0.00 H new ATOM 2765 N CYS B 84 68.647 11.820 5.875 1.00 0.00 N ATOM 2766 CA CYS B 84 67.293 12.388 6.111 1.00 0.00 C ATOM 2767 C CYS B 84 66.720 11.784 7.391 1.00 0.00 C ATOM 2768 O CYS B 84 65.950 10.845 7.355 1.00 0.00 O ATOM 2769 CB CYS B 84 66.381 12.038 4.932 1.00 0.00 C ATOM 2770 SG CYS B 84 66.808 13.073 3.510 1.00 0.00 S ATOM 0 H CYS B 84 68.694 11.085 5.170 1.00 0.00 H new ATOM 0 HA CYS B 84 67.358 13.472 6.208 1.00 0.00 H new ATOM 0 HB2 CYS B 84 66.490 10.985 4.674 1.00 0.00 H new ATOM 0 HB3 CYS B 84 65.338 12.192 5.207 1.00 0.00 H new ATOM 0 HG CYS B 84 66.035 12.774 2.508 1.00 0.00 H new