USER MOD reduce.3.24.130724 H: found=0, std=0, add=1410, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1410 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: B 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: B 33 LYS NZ :NH3+ -116:sc= -1.11 (180deg=-3.41!) USER MOD Set 2.2: B 50 GLN : amide:sc= 0 K(o=-1.1,f=-2.1) USER MOD Set 3.1: B 17 TYR OH : rot -175:sc= 1.22 USER MOD Set 3.2: B 38 ASN : amide:sc= 0.879 K(o=2.1,f=-3!) USER MOD Set 4.1: A 17 TYR OH : rot 178:sc= 1.29 USER MOD Set 4.2: A 38 ASN : amide:sc= 0.84 K(o=2.1,f=-2.9!) USER MOD Set 5.1: A 33 LYS NZ :NH3+ -116:sc= -1.13 (180deg=-3.41!) USER MOD Set 5.2: A 50 GLN : amide:sc= 0 K(o=-1.1,f=-2.1) USER MOD Single : A 1 SER N :NH3+ -114:sc= 0.0834 (180deg=0) USER MOD Single : A 1 SER OG : rot 130:sc= 0.363 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 MET CE :methyl -150:sc= -0.267 (180deg=-1.54!) USER MOD Single : A 15 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 16 GLN : amide:sc= -0.233 X(o=-0.23,f=-0.23) USER MOD Single : A 18 SER OG : rot -19:sc= 0.0663 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HD1:sc= -0.509 X(o=-0.51,f=-0.33) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 162:sc= -0.0376 (180deg=-0.51) USER MOD Single : A 29 LYS NZ :NH3+ -140:sc= 0 (180deg=-0.604) USER MOD Single : A 30 SER OG : rot 180:sc= -0.119 USER MOD Single : A 37 ASN : amide:sc= -0.293 K(o=-0.29,f=-1.7!) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 48 LYS NZ :NH3+ -132:sc= 1.1 (180deg=-0.539) USER MOD Single : A 55 LYS NZ :NH3+ -119:sc= -1.04 (180deg=-3.09!) USER MOD Single : A 57 MET CE :methyl 155:sc= -0.255 (180deg=-1.23) USER MOD Single : A 59 THR OG1 : rot 81:sc= 0.0359 USER MOD Single : A 68 CYS SG : rot 180:sc= -0.419 USER MOD Single : A 71 GLN : amide:sc= -0.0204 K(o=-0.02,f=-1.6!) USER MOD Single : A 78 SER OG : rot -53:sc= 0.162 USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot 74:sc= 0.645 USER MOD Single : A 82 THR OG1 : rot 180:sc= -0.462 USER MOD Single : A 84 CYS SG : rot 180:sc= 0 USER MOD Single : A 85 HIS : no HD1:sc= 0 X(o=0,f=-0.0041) USER MOD Single : A 90 HIS : no HD1:sc= 0 X(o=0,f=-0.026) USER MOD Single : B 1 SER N :NH3+ -102:sc= 0.099 (180deg=0) USER MOD Single : B 1 SER OG : rot 180:sc= 0.394 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 MET CE :methyl -153:sc= -0.245 (180deg=-1.26!) USER MOD Single : B 15 HIS : no HD1:sc= 0 X(o=0,f=-0.022) USER MOD Single : B 16 GLN : amide:sc= -0.28 X(o=-0.28,f=-0.28) USER MOD Single : B 18 SER OG : rot 150:sc= 0 USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 HIS : no HD1:sc= -2.35! K(o=-2.4!,f=-1.7) USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 LYS NZ :NH3+ 164:sc= -0.0348 (180deg=-0.55) USER MOD Single : B 29 LYS NZ :NH3+ -140:sc= 0 (180deg=-0.573) USER MOD Single : B 30 SER OG : rot 180:sc= -0.115 USER MOD Single : B 37 ASN : amide:sc= -0.338 K(o=-0.34,f=-1.8!) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 42 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 48 LYS NZ :NH3+ -132:sc= 1.16 (180deg=-0.519) USER MOD Single : B 55 LYS NZ :NH3+ -120:sc= -1.17 (180deg=-3.29!) USER MOD Single : B 57 MET CE :methyl 155:sc= -0.322 (180deg=-1.39!) USER MOD Single : B 59 THR OG1 : rot 81:sc= 0.0345 USER MOD Single : B 68 CYS SG : rot 180:sc= -0.441 USER MOD Single : B 71 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : B 78 SER OG : rot -48:sc= 0.203 USER MOD Single : B 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 81 THR OG1 : rot 75:sc= 0.633 USER MOD Single : B 82 THR OG1 : rot 180:sc= -0.474 USER MOD Single : B 84 CYS SG : rot 180:sc= 0 USER MOD Single : B 85 HIS : no HD1:sc= 0 X(o=0,f=-0.0095) USER MOD Single : B 90 HIS : no HD1:sc= 0 X(o=0,f=-0.021) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 67.240 12.950 -10.160 1.00 0.00 N ATOM 2 CA SER A 1 68.088 11.919 -10.826 1.00 0.00 C ATOM 3 C SER A 1 67.497 10.532 -10.578 1.00 0.00 C ATOM 4 O SER A 1 66.738 10.328 -9.653 1.00 0.00 O ATOM 5 CB SER A 1 69.498 11.969 -10.243 1.00 0.00 C ATOM 6 OG SER A 1 69.481 11.403 -8.939 1.00 0.00 O ATOM 0 H1 SER A 1 66.795 13.552 -10.882 1.00 0.00 H new ATOM 0 H2 SER A 1 66.502 12.481 -9.597 1.00 0.00 H new ATOM 0 H3 SER A 1 67.831 13.536 -9.536 1.00 0.00 H new ATOM 0 HA SER A 1 68.122 12.118 -11.897 1.00 0.00 H new ATOM 0 HB2 SER A 1 70.189 11.420 -10.882 1.00 0.00 H new ATOM 0 HB3 SER A 1 69.852 12.999 -10.202 1.00 0.00 H new ATOM 0 HG SER A 1 70.195 10.736 -8.863 1.00 0.00 H new ATOM 14 N GLU A 2 67.833 9.577 -11.399 1.00 0.00 N ATOM 15 CA GLU A 2 67.290 8.202 -11.213 1.00 0.00 C ATOM 16 C GLU A 2 67.836 7.594 -9.924 1.00 0.00 C ATOM 17 O GLU A 2 67.182 6.799 -9.279 1.00 0.00 O ATOM 18 CB GLU A 2 67.708 7.342 -12.408 1.00 0.00 C ATOM 19 CG GLU A 2 69.237 7.293 -12.502 1.00 0.00 C ATOM 20 CD GLU A 2 69.646 6.447 -13.710 1.00 0.00 C ATOM 21 OE1 GLU A 2 68.802 5.729 -14.218 1.00 0.00 O ATOM 22 OE2 GLU A 2 70.797 6.534 -14.108 1.00 0.00 O ATOM 0 H GLU A 2 68.462 9.690 -12.194 1.00 0.00 H new ATOM 0 HA GLU A 2 66.203 8.243 -11.146 1.00 0.00 H new ATOM 0 HB2 GLU A 2 67.309 6.334 -12.300 1.00 0.00 H new ATOM 0 HB3 GLU A 2 67.291 7.753 -13.327 1.00 0.00 H new ATOM 0 HG2 GLU A 2 69.639 8.302 -12.598 1.00 0.00 H new ATOM 0 HG3 GLU A 2 69.655 6.869 -11.589 1.00 0.00 H new ATOM 29 N LEU A 3 69.023 7.964 -9.533 1.00 0.00 N ATOM 30 CA LEU A 3 69.614 7.423 -8.278 1.00 0.00 C ATOM 31 C LEU A 3 68.871 7.985 -7.063 1.00 0.00 C ATOM 32 O LEU A 3 68.674 7.307 -6.075 1.00 0.00 O ATOM 33 CB LEU A 3 71.092 7.831 -8.212 1.00 0.00 C ATOM 34 CG LEU A 3 71.753 7.295 -6.931 1.00 0.00 C ATOM 35 CD1 LEU A 3 71.744 5.760 -6.925 1.00 0.00 C ATOM 36 CD2 LEU A 3 73.200 7.805 -6.873 1.00 0.00 C ATOM 0 H LEU A 3 69.615 8.625 -10.035 1.00 0.00 H new ATOM 0 HA LEU A 3 69.526 6.337 -8.271 1.00 0.00 H new ATOM 0 HB2 LEU A 3 71.619 7.447 -9.086 1.00 0.00 H new ATOM 0 HB3 LEU A 3 71.175 8.917 -8.242 1.00 0.00 H new ATOM 0 HG LEU A 3 71.196 7.646 -6.062 1.00 0.00 H new ATOM 0 HD11 LEU A 3 72.215 5.397 -6.012 1.00 0.00 H new ATOM 0 HD12 LEU A 3 70.715 5.402 -6.969 1.00 0.00 H new ATOM 0 HD13 LEU A 3 72.295 5.390 -7.790 1.00 0.00 H new ATOM 0 HD21 LEU A 3 73.681 7.432 -5.969 1.00 0.00 H new ATOM 0 HD22 LEU A 3 73.746 7.450 -7.747 1.00 0.00 H new ATOM 0 HD23 LEU A 3 73.201 8.895 -6.862 1.00 0.00 H new ATOM 48 N GLU A 4 68.472 9.226 -7.123 1.00 0.00 N ATOM 49 CA GLU A 4 67.757 9.835 -5.968 1.00 0.00 C ATOM 50 C GLU A 4 66.424 9.119 -5.745 1.00 0.00 C ATOM 51 O GLU A 4 66.033 8.857 -4.625 1.00 0.00 O ATOM 52 CB GLU A 4 67.517 11.318 -6.263 1.00 0.00 C ATOM 53 CG GLU A 4 66.825 11.987 -5.073 1.00 0.00 C ATOM 54 CD GLU A 4 66.608 13.468 -5.387 1.00 0.00 C ATOM 55 OE1 GLU A 4 67.148 13.928 -6.379 1.00 0.00 O ATOM 56 OE2 GLU A 4 65.908 14.118 -4.628 1.00 0.00 O ATOM 0 H GLU A 4 68.611 9.844 -7.923 1.00 0.00 H new ATOM 0 HA GLU A 4 68.359 9.735 -5.065 1.00 0.00 H new ATOM 0 HB2 GLU A 4 68.466 11.814 -6.467 1.00 0.00 H new ATOM 0 HB3 GLU A 4 66.903 11.424 -7.157 1.00 0.00 H new ATOM 0 HG2 GLU A 4 65.870 11.502 -4.872 1.00 0.00 H new ATOM 0 HG3 GLU A 4 67.433 11.878 -4.175 1.00 0.00 H new ATOM 63 N LYS A 5 65.722 8.803 -6.798 1.00 0.00 N ATOM 64 CA LYS A 5 64.412 8.109 -6.637 1.00 0.00 C ATOM 65 C LYS A 5 64.618 6.771 -5.922 1.00 0.00 C ATOM 66 O LYS A 5 63.831 6.378 -5.082 1.00 0.00 O ATOM 67 CB LYS A 5 63.787 7.870 -8.019 1.00 0.00 C ATOM 68 CG LYS A 5 62.426 7.185 -7.859 1.00 0.00 C ATOM 69 CD LYS A 5 61.790 6.965 -9.234 1.00 0.00 C ATOM 70 CE LYS A 5 60.433 6.280 -9.061 1.00 0.00 C ATOM 71 NZ LYS A 5 59.658 6.374 -10.332 1.00 0.00 N ATOM 0 H LYS A 5 65.997 8.995 -7.761 1.00 0.00 H new ATOM 0 HA LYS A 5 63.744 8.731 -6.041 1.00 0.00 H new ATOM 0 HB2 LYS A 5 63.668 8.818 -8.544 1.00 0.00 H new ATOM 0 HB3 LYS A 5 64.448 7.250 -8.625 1.00 0.00 H new ATOM 0 HG2 LYS A 5 62.547 6.230 -7.348 1.00 0.00 H new ATOM 0 HG3 LYS A 5 61.771 7.798 -7.239 1.00 0.00 H new ATOM 0 HD2 LYS A 5 61.666 7.919 -9.747 1.00 0.00 H new ATOM 0 HD3 LYS A 5 62.443 6.352 -9.855 1.00 0.00 H new ATOM 0 HE2 LYS A 5 60.575 5.235 -8.786 1.00 0.00 H new ATOM 0 HE3 LYS A 5 59.878 6.750 -8.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 58.736 5.908 -10.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 59.511 7.374 -10.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 60.186 5.906 -11.096 1.00 0.00 H new ATOM 85 N ALA A 6 65.666 6.068 -6.248 1.00 0.00 N ATOM 86 CA ALA A 6 65.912 4.757 -5.585 1.00 0.00 C ATOM 87 C ALA A 6 66.065 4.968 -4.079 1.00 0.00 C ATOM 88 O ALA A 6 65.424 4.316 -3.282 1.00 0.00 O ATOM 89 CB ALA A 6 67.192 4.130 -6.145 1.00 0.00 C ATOM 0 H ALA A 6 66.361 6.343 -6.942 1.00 0.00 H new ATOM 0 HA ALA A 6 65.070 4.092 -5.776 1.00 0.00 H new ATOM 0 HB1 ALA A 6 67.370 3.171 -5.659 1.00 0.00 H new ATOM 0 HB2 ALA A 6 67.083 3.978 -7.219 1.00 0.00 H new ATOM 0 HB3 ALA A 6 68.035 4.795 -5.957 1.00 0.00 H new ATOM 95 N MET A 7 66.910 5.881 -3.685 1.00 0.00 N ATOM 96 CA MET A 7 67.105 6.144 -2.232 1.00 0.00 C ATOM 97 C MET A 7 65.777 6.578 -1.611 1.00 0.00 C ATOM 98 O MET A 7 65.353 6.069 -0.594 1.00 0.00 O ATOM 99 CB MET A 7 68.131 7.263 -2.069 1.00 0.00 C ATOM 100 CG MET A 7 68.539 7.389 -0.602 1.00 0.00 C ATOM 101 SD MET A 7 69.684 8.779 -0.422 1.00 0.00 S ATOM 102 CE MET A 7 71.043 8.087 -1.397 1.00 0.00 C ATOM 0 H MET A 7 67.475 6.457 -4.309 1.00 0.00 H new ATOM 0 HA MET A 7 67.457 5.240 -1.734 1.00 0.00 H new ATOM 0 HB2 MET A 7 69.008 7.056 -2.682 1.00 0.00 H new ATOM 0 HB3 MET A 7 67.712 8.206 -2.421 1.00 0.00 H new ATOM 0 HG2 MET A 7 67.658 7.544 0.021 1.00 0.00 H new ATOM 0 HG3 MET A 7 69.011 6.467 -0.263 1.00 0.00 H new ATOM 0 HE1 MET A 7 71.992 8.466 -1.018 1.00 0.00 H new ATOM 0 HE2 MET A 7 71.029 7.000 -1.320 1.00 0.00 H new ATOM 0 HE3 MET A 7 70.927 8.378 -2.441 1.00 0.00 H new ATOM 112 N VAL A 8 65.128 7.532 -2.220 1.00 0.00 N ATOM 113 CA VAL A 8 63.833 8.034 -1.683 1.00 0.00 C ATOM 114 C VAL A 8 62.826 6.884 -1.636 1.00 0.00 C ATOM 115 O VAL A 8 62.050 6.764 -0.708 1.00 0.00 O ATOM 116 CB VAL A 8 63.313 9.149 -2.593 1.00 0.00 C ATOM 117 CG1 VAL A 8 61.892 9.540 -2.174 1.00 0.00 C ATOM 118 CG2 VAL A 8 64.234 10.370 -2.483 1.00 0.00 C ATOM 0 H VAL A 8 65.444 7.989 -3.075 1.00 0.00 H new ATOM 0 HA VAL A 8 63.973 8.427 -0.676 1.00 0.00 H new ATOM 0 HB VAL A 8 63.299 8.795 -3.624 1.00 0.00 H new ATOM 0 HG11 VAL A 8 61.526 10.334 -2.825 1.00 0.00 H new ATOM 0 HG12 VAL A 8 61.237 8.673 -2.256 1.00 0.00 H new ATOM 0 HG13 VAL A 8 61.901 9.892 -1.142 1.00 0.00 H new ATOM 0 HG21 VAL A 8 63.864 11.164 -3.131 1.00 0.00 H new ATOM 0 HG22 VAL A 8 64.251 10.721 -1.451 1.00 0.00 H new ATOM 0 HG23 VAL A 8 65.243 10.093 -2.788 1.00 0.00 H new ATOM 128 N ALA A 9 62.817 6.046 -2.635 1.00 0.00 N ATOM 129 CA ALA A 9 61.847 4.919 -2.643 1.00 0.00 C ATOM 130 C ALA A 9 62.074 4.029 -1.418 1.00 0.00 C ATOM 131 O ALA A 9 61.138 3.555 -0.806 1.00 0.00 O ATOM 132 CB ALA A 9 62.043 4.094 -3.921 1.00 0.00 C ATOM 0 H ALA A 9 63.438 6.093 -3.443 1.00 0.00 H new ATOM 0 HA ALA A 9 60.832 5.314 -2.613 1.00 0.00 H new ATOM 0 HB1 ALA A 9 61.334 3.266 -3.932 1.00 0.00 H new ATOM 0 HB2 ALA A 9 61.875 4.727 -4.792 1.00 0.00 H new ATOM 0 HB3 ALA A 9 63.060 3.702 -3.948 1.00 0.00 H new ATOM 138 N LEU A 10 63.304 3.780 -1.067 1.00 0.00 N ATOM 139 CA LEU A 10 63.586 2.901 0.108 1.00 0.00 C ATOM 140 C LEU A 10 62.980 3.481 1.391 1.00 0.00 C ATOM 141 O LEU A 10 62.395 2.769 2.184 1.00 0.00 O ATOM 142 CB LEU A 10 65.101 2.772 0.294 1.00 0.00 C ATOM 143 CG LEU A 10 65.715 1.939 -0.843 1.00 0.00 C ATOM 144 CD1 LEU A 10 67.245 2.002 -0.744 1.00 0.00 C ATOM 145 CD2 LEU A 10 65.251 0.472 -0.746 1.00 0.00 C ATOM 0 H LEU A 10 64.129 4.146 -1.542 1.00 0.00 H new ATOM 0 HA LEU A 10 63.138 1.926 -0.082 1.00 0.00 H new ATOM 0 HB2 LEU A 10 65.556 3.762 0.314 1.00 0.00 H new ATOM 0 HB3 LEU A 10 65.317 2.303 1.254 1.00 0.00 H new ATOM 0 HG LEU A 10 65.388 2.346 -1.800 1.00 0.00 H new ATOM 0 HD11 LEU A 10 67.686 1.413 -1.548 1.00 0.00 H new ATOM 0 HD12 LEU A 10 67.573 3.038 -0.831 1.00 0.00 H new ATOM 0 HD13 LEU A 10 67.564 1.600 0.218 1.00 0.00 H new ATOM 0 HD21 LEU A 10 65.694 -0.104 -1.558 1.00 0.00 H new ATOM 0 HD22 LEU A 10 65.566 0.053 0.210 1.00 0.00 H new ATOM 0 HD23 LEU A 10 64.164 0.428 -0.821 1.00 0.00 H new ATOM 157 N ILE A 11 63.122 4.759 1.618 1.00 0.00 N ATOM 158 CA ILE A 11 62.558 5.351 2.867 1.00 0.00 C ATOM 159 C ILE A 11 61.048 5.128 2.891 1.00 0.00 C ATOM 160 O ILE A 11 60.493 4.670 3.868 1.00 0.00 O ATOM 161 CB ILE A 11 62.863 6.848 2.913 1.00 0.00 C ATOM 162 CG1 ILE A 11 64.377 7.045 3.027 1.00 0.00 C ATOM 163 CG2 ILE A 11 62.176 7.471 4.133 1.00 0.00 C ATOM 164 CD1 ILE A 11 64.720 8.519 2.815 1.00 0.00 C ATOM 0 H ILE A 11 63.600 5.414 0.999 1.00 0.00 H new ATOM 0 HA ILE A 11 63.010 4.871 3.735 1.00 0.00 H new ATOM 0 HB ILE A 11 62.495 7.327 2.006 1.00 0.00 H new ATOM 0 HG12 ILE A 11 64.724 6.718 4.007 1.00 0.00 H new ATOM 0 HG13 ILE A 11 64.890 6.432 2.287 1.00 0.00 H new ATOM 0 HG21 ILE A 11 62.393 8.539 4.167 1.00 0.00 H new ATOM 0 HG22 ILE A 11 61.099 7.322 4.060 1.00 0.00 H new ATOM 0 HG23 ILE A 11 62.547 6.996 5.041 1.00 0.00 H new ATOM 0 HD11 ILE A 11 65.798 8.657 2.897 1.00 0.00 H new ATOM 0 HD12 ILE A 11 64.388 8.831 1.825 1.00 0.00 H new ATOM 0 HD13 ILE A 11 64.219 9.122 3.572 1.00 0.00 H new ATOM 176 N ASP A 12 60.379 5.453 1.823 1.00 0.00 N ATOM 177 CA ASP A 12 58.904 5.271 1.789 1.00 0.00 C ATOM 178 C ASP A 12 58.590 3.789 2.004 1.00 0.00 C ATOM 179 O ASP A 12 57.657 3.435 2.696 1.00 0.00 O ATOM 180 CB ASP A 12 58.372 5.713 0.422 1.00 0.00 C ATOM 181 CG ASP A 12 58.490 7.233 0.299 1.00 0.00 C ATOM 182 OD1 ASP A 12 58.589 7.883 1.327 1.00 0.00 O ATOM 183 OD2 ASP A 12 58.473 7.722 -0.819 1.00 0.00 O ATOM 0 H ASP A 12 60.790 5.837 0.972 1.00 0.00 H new ATOM 0 HA ASP A 12 58.433 5.868 2.570 1.00 0.00 H new ATOM 0 HB2 ASP A 12 58.936 5.228 -0.374 1.00 0.00 H new ATOM 0 HB3 ASP A 12 57.332 5.407 0.308 1.00 0.00 H new ATOM 188 N VAL A 13 59.368 2.922 1.417 1.00 0.00 N ATOM 189 CA VAL A 13 59.123 1.462 1.590 1.00 0.00 C ATOM 190 C VAL A 13 59.459 1.035 3.031 1.00 0.00 C ATOM 191 O VAL A 13 58.728 0.289 3.651 1.00 0.00 O ATOM 192 CB VAL A 13 59.999 0.683 0.598 1.00 0.00 C ATOM 193 CG1 VAL A 13 59.953 -0.816 0.919 1.00 0.00 C ATOM 194 CG2 VAL A 13 59.483 0.911 -0.824 1.00 0.00 C ATOM 0 H VAL A 13 60.163 3.161 0.825 1.00 0.00 H new ATOM 0 HA VAL A 13 58.072 1.247 1.398 1.00 0.00 H new ATOM 0 HB VAL A 13 61.027 1.035 0.679 1.00 0.00 H new ATOM 0 HG11 VAL A 13 60.577 -1.359 0.210 1.00 0.00 H new ATOM 0 HG12 VAL A 13 60.323 -0.983 1.931 1.00 0.00 H new ATOM 0 HG13 VAL A 13 58.926 -1.173 0.845 1.00 0.00 H new ATOM 0 HG21 VAL A 13 60.104 0.359 -1.529 1.00 0.00 H new ATOM 0 HG22 VAL A 13 58.453 0.563 -0.897 1.00 0.00 H new ATOM 0 HG23 VAL A 13 59.524 1.974 -1.060 1.00 0.00 H new ATOM 204 N PHE A 14 60.569 1.482 3.561 1.00 0.00 N ATOM 205 CA PHE A 14 60.950 1.074 4.949 1.00 0.00 C ATOM 206 C PHE A 14 59.884 1.518 5.954 1.00 0.00 C ATOM 207 O PHE A 14 59.397 0.733 6.741 1.00 0.00 O ATOM 208 CB PHE A 14 62.282 1.732 5.322 1.00 0.00 C ATOM 209 CG PHE A 14 62.699 1.305 6.714 1.00 0.00 C ATOM 210 CD1 PHE A 14 62.169 1.954 7.838 1.00 0.00 C ATOM 211 CD2 PHE A 14 63.626 0.268 6.880 1.00 0.00 C ATOM 212 CE1 PHE A 14 62.566 1.564 9.125 1.00 0.00 C ATOM 213 CE2 PHE A 14 64.022 -0.121 8.167 1.00 0.00 C ATOM 214 CZ PHE A 14 63.493 0.527 9.289 1.00 0.00 C ATOM 0 H PHE A 14 61.226 2.109 3.096 1.00 0.00 H new ATOM 0 HA PHE A 14 61.039 -0.012 4.979 1.00 0.00 H new ATOM 0 HB2 PHE A 14 63.050 1.451 4.601 1.00 0.00 H new ATOM 0 HB3 PHE A 14 62.186 2.817 5.279 1.00 0.00 H new ATOM 0 HD1 PHE A 14 61.455 2.754 7.713 1.00 0.00 H new ATOM 0 HD2 PHE A 14 64.036 -0.232 6.015 1.00 0.00 H new ATOM 0 HE1 PHE A 14 62.157 2.064 9.991 1.00 0.00 H new ATOM 0 HE2 PHE A 14 64.736 -0.921 8.293 1.00 0.00 H new ATOM 0 HZ PHE A 14 63.799 0.228 10.280 1.00 0.00 H new ATOM 224 N HIS A 15 59.563 2.783 5.975 1.00 0.00 N ATOM 225 CA HIS A 15 58.587 3.294 6.981 1.00 0.00 C ATOM 226 C HIS A 15 57.235 2.591 6.846 1.00 0.00 C ATOM 227 O HIS A 15 56.605 2.280 7.837 1.00 0.00 O ATOM 228 CB HIS A 15 58.401 4.801 6.779 1.00 0.00 C ATOM 229 CG HIS A 15 57.417 5.337 7.786 1.00 0.00 C ATOM 230 ND1 HIS A 15 57.613 5.209 9.157 1.00 0.00 N ATOM 231 CD2 HIS A 15 56.239 6.029 7.641 1.00 0.00 C ATOM 232 CE1 HIS A 15 56.579 5.811 9.773 1.00 0.00 C ATOM 233 NE2 HIS A 15 55.717 6.326 8.895 1.00 0.00 N ATOM 0 H HIS A 15 59.935 3.487 5.337 1.00 0.00 H new ATOM 0 HA HIS A 15 58.978 3.091 7.978 1.00 0.00 H new ATOM 0 HB2 HIS A 15 59.358 5.312 6.886 1.00 0.00 H new ATOM 0 HB3 HIS A 15 58.045 5.000 5.768 1.00 0.00 H new ATOM 0 HD2 HIS A 15 55.788 6.301 6.698 1.00 0.00 H new ATOM 0 HE1 HIS A 15 56.462 5.870 10.845 1.00 0.00 H new ATOM 0 HE2 HIS A 15 54.855 6.832 9.100 1.00 0.00 H new ATOM 242 N GLN A 16 56.763 2.334 5.661 1.00 0.00 N ATOM 243 CA GLN A 16 55.442 1.653 5.542 1.00 0.00 C ATOM 244 C GLN A 16 55.551 0.205 6.034 1.00 0.00 C ATOM 245 O GLN A 16 54.666 -0.302 6.695 1.00 0.00 O ATOM 246 CB GLN A 16 55.010 1.666 4.071 1.00 0.00 C ATOM 247 CG GLN A 16 53.578 1.143 3.939 1.00 0.00 C ATOM 248 CD GLN A 16 52.612 2.104 4.637 1.00 0.00 C ATOM 249 OE1 GLN A 16 52.459 3.237 4.228 1.00 0.00 O ATOM 250 NE2 GLN A 16 51.951 1.694 5.685 1.00 0.00 N ATOM 0 H GLN A 16 57.225 2.561 4.780 1.00 0.00 H new ATOM 0 HA GLN A 16 54.705 2.176 6.152 1.00 0.00 H new ATOM 0 HB2 GLN A 16 55.073 2.679 3.674 1.00 0.00 H new ATOM 0 HB3 GLN A 16 55.687 1.049 3.480 1.00 0.00 H new ATOM 0 HG2 GLN A 16 53.312 1.045 2.887 1.00 0.00 H new ATOM 0 HG3 GLN A 16 53.501 0.150 4.381 1.00 0.00 H new ATOM 0 HE21 GLN A 16 52.079 0.742 6.029 1.00 0.00 H new ATOM 0 HE22 GLN A 16 51.306 2.325 6.160 1.00 0.00 H new ATOM 259 N TYR A 17 56.627 -0.463 5.717 1.00 0.00 N ATOM 260 CA TYR A 17 56.789 -1.879 6.165 1.00 0.00 C ATOM 261 C TYR A 17 57.105 -1.932 7.667 1.00 0.00 C ATOM 262 O TYR A 17 56.564 -2.744 8.391 1.00 0.00 O ATOM 263 CB TYR A 17 57.924 -2.547 5.358 1.00 0.00 C ATOM 264 CG TYR A 17 57.362 -3.186 4.103 1.00 0.00 C ATOM 265 CD1 TYR A 17 57.006 -2.391 3.007 1.00 0.00 C ATOM 266 CD2 TYR A 17 57.192 -4.575 4.042 1.00 0.00 C ATOM 267 CE1 TYR A 17 56.482 -2.983 1.852 1.00 0.00 C ATOM 268 CE2 TYR A 17 56.669 -5.168 2.888 1.00 0.00 C ATOM 269 CZ TYR A 17 56.313 -4.373 1.793 1.00 0.00 C ATOM 270 OH TYR A 17 55.796 -4.957 0.656 1.00 0.00 O ATOM 0 H TYR A 17 57.402 -0.091 5.167 1.00 0.00 H new ATOM 0 HA TYR A 17 55.857 -2.417 5.991 1.00 0.00 H new ATOM 0 HB2 TYR A 17 58.677 -1.805 5.092 1.00 0.00 H new ATOM 0 HB3 TYR A 17 58.420 -3.301 5.969 1.00 0.00 H new ATOM 0 HD1 TYR A 17 57.136 -1.320 3.053 1.00 0.00 H new ATOM 0 HD2 TYR A 17 57.465 -5.189 4.887 1.00 0.00 H new ATOM 0 HE1 TYR A 17 56.208 -2.369 1.007 1.00 0.00 H new ATOM 0 HE2 TYR A 17 56.540 -6.239 2.842 1.00 0.00 H new ATOM 0 HH TYR A 17 55.775 -5.930 0.769 1.00 0.00 H new ATOM 280 N SER A 18 57.981 -1.089 8.142 1.00 0.00 N ATOM 281 CA SER A 18 58.325 -1.120 9.589 1.00 0.00 C ATOM 282 C SER A 18 57.136 -0.625 10.411 1.00 0.00 C ATOM 283 O SER A 18 57.041 -0.878 11.596 1.00 0.00 O ATOM 284 CB SER A 18 59.543 -0.236 9.855 1.00 0.00 C ATOM 285 OG SER A 18 59.869 -0.293 11.237 1.00 0.00 O ATOM 0 H SER A 18 58.471 -0.383 7.592 1.00 0.00 H new ATOM 0 HA SER A 18 58.561 -2.144 9.878 1.00 0.00 H new ATOM 0 HB2 SER A 18 60.389 -0.572 9.255 1.00 0.00 H new ATOM 0 HB3 SER A 18 59.332 0.792 9.561 1.00 0.00 H new ATOM 0 HG SER A 18 59.095 -0.619 11.742 1.00 0.00 H new ATOM 291 N GLY A 19 56.221 0.071 9.794 1.00 0.00 N ATOM 292 CA GLY A 19 55.030 0.572 10.539 1.00 0.00 C ATOM 293 C GLY A 19 53.943 -0.507 10.534 1.00 0.00 C ATOM 294 O GLY A 19 52.775 -0.222 10.707 1.00 0.00 O ATOM 0 H GLY A 19 56.246 0.315 8.804 1.00 0.00 H new ATOM 0 HA2 GLY A 19 55.306 0.823 11.563 1.00 0.00 H new ATOM 0 HA3 GLY A 19 54.655 1.485 10.077 1.00 0.00 H new ATOM 298 N ARG A 20 54.318 -1.747 10.341 1.00 0.00 N ATOM 299 CA ARG A 20 53.309 -2.845 10.329 1.00 0.00 C ATOM 300 C ARG A 20 53.068 -3.331 11.766 1.00 0.00 C ATOM 301 O ARG A 20 51.968 -3.265 12.277 1.00 0.00 O ATOM 302 CB ARG A 20 53.844 -4.007 9.484 1.00 0.00 C ATOM 303 CG ARG A 20 52.736 -5.046 9.238 1.00 0.00 C ATOM 304 CD ARG A 20 51.850 -4.620 8.062 1.00 0.00 C ATOM 305 NE ARG A 20 50.946 -5.749 7.704 1.00 0.00 N ATOM 306 CZ ARG A 20 51.420 -6.778 7.054 1.00 0.00 C ATOM 307 NH1 ARG A 20 52.684 -6.814 6.726 1.00 0.00 N ATOM 308 NH2 ARG A 20 50.633 -7.771 6.737 1.00 0.00 N ATOM 0 H ARG A 20 55.282 -2.045 10.191 1.00 0.00 H new ATOM 0 HA ARG A 20 52.373 -2.481 9.906 1.00 0.00 H new ATOM 0 HB2 ARG A 20 54.217 -3.631 8.531 1.00 0.00 H new ATOM 0 HB3 ARG A 20 54.686 -4.477 9.992 1.00 0.00 H new ATOM 0 HG2 ARG A 20 53.182 -6.019 9.031 1.00 0.00 H new ATOM 0 HG3 ARG A 20 52.129 -5.158 10.136 1.00 0.00 H new ATOM 0 HD2 ARG A 20 51.266 -3.740 8.330 1.00 0.00 H new ATOM 0 HD3 ARG A 20 52.466 -4.345 7.206 1.00 0.00 H new ATOM 0 HE ARG A 20 49.961 -5.718 7.966 1.00 0.00 H new ATOM 0 HH11 ARG A 20 53.298 -6.040 6.978 1.00 0.00 H new ATOM 0 HH12 ARG A 20 53.057 -7.616 6.218 1.00 0.00 H new ATOM 0 HH21 ARG A 20 49.647 -7.743 6.997 1.00 0.00 H new ATOM 0 HH22 ARG A 20 51.004 -8.574 6.229 1.00 0.00 H new ATOM 322 N GLU A 21 54.097 -3.817 12.419 1.00 0.00 N ATOM 323 CA GLU A 21 53.957 -4.312 13.826 1.00 0.00 C ATOM 324 C GLU A 21 55.175 -3.886 14.647 1.00 0.00 C ATOM 325 O GLU A 21 56.215 -3.556 14.112 1.00 0.00 O ATOM 326 CB GLU A 21 53.858 -5.840 13.841 1.00 0.00 C ATOM 327 CG GLU A 21 52.519 -6.279 13.252 1.00 0.00 C ATOM 328 CD GLU A 21 52.509 -7.800 13.077 1.00 0.00 C ATOM 329 OE1 GLU A 21 53.506 -8.421 13.407 1.00 0.00 O ATOM 330 OE2 GLU A 21 51.506 -8.317 12.615 1.00 0.00 O ATOM 0 H GLU A 21 55.038 -3.893 12.033 1.00 0.00 H new ATOM 0 HA GLU A 21 53.051 -3.885 14.257 1.00 0.00 H new ATOM 0 HB2 GLU A 21 54.677 -6.272 13.266 1.00 0.00 H new ATOM 0 HB3 GLU A 21 53.955 -6.210 14.862 1.00 0.00 H new ATOM 0 HG2 GLU A 21 51.704 -5.973 13.908 1.00 0.00 H new ATOM 0 HG3 GLU A 21 52.355 -5.791 12.291 1.00 0.00 H new ATOM 337 N GLY A 22 55.051 -3.892 15.950 1.00 0.00 N ATOM 338 CA GLY A 22 56.195 -3.493 16.824 1.00 0.00 C ATOM 339 C GLY A 22 56.083 -2.008 17.162 1.00 0.00 C ATOM 340 O GLY A 22 55.264 -1.296 16.614 1.00 0.00 O ATOM 0 H GLY A 22 54.202 -4.158 16.448 1.00 0.00 H new ATOM 0 HA2 GLY A 22 56.192 -4.086 17.738 1.00 0.00 H new ATOM 0 HA3 GLY A 22 57.140 -3.692 16.318 1.00 0.00 H new ATOM 344 N ASP A 23 56.898 -1.533 18.064 1.00 0.00 N ATOM 345 CA ASP A 23 56.834 -0.093 18.436 1.00 0.00 C ATOM 346 C ASP A 23 56.856 0.762 17.168 1.00 0.00 C ATOM 347 O ASP A 23 55.836 1.001 16.554 1.00 0.00 O ATOM 348 CB ASP A 23 58.035 0.259 19.316 1.00 0.00 C ATOM 349 CG ASP A 23 57.980 1.742 19.690 1.00 0.00 C ATOM 350 OD1 ASP A 23 58.143 2.562 18.801 1.00 0.00 O ATOM 351 OD2 ASP A 23 57.773 2.031 20.857 1.00 0.00 O ATOM 0 H ASP A 23 57.604 -2.079 18.558 1.00 0.00 H new ATOM 0 HA ASP A 23 55.914 0.102 18.986 1.00 0.00 H new ATOM 0 HB2 ASP A 23 58.030 -0.354 20.217 1.00 0.00 H new ATOM 0 HB3 ASP A 23 58.963 0.041 18.787 1.00 0.00 H new ATOM 356 N LYS A 24 58.010 1.226 16.771 1.00 0.00 N ATOM 357 CA LYS A 24 58.086 2.062 15.542 1.00 0.00 C ATOM 358 C LYS A 24 59.545 2.189 15.091 1.00 0.00 C ATOM 359 O LYS A 24 60.394 2.616 15.846 1.00 0.00 O ATOM 360 CB LYS A 24 57.511 3.445 15.847 1.00 0.00 C ATOM 361 CG LYS A 24 57.381 4.251 14.554 1.00 0.00 C ATOM 362 CD LYS A 24 56.956 5.687 14.884 1.00 0.00 C ATOM 363 CE LYS A 24 55.595 5.685 15.592 1.00 0.00 C ATOM 364 NZ LYS A 24 54.952 7.020 15.436 1.00 0.00 N ATOM 0 H LYS A 24 58.899 1.062 17.243 1.00 0.00 H new ATOM 0 HA LYS A 24 57.511 1.596 14.742 1.00 0.00 H new ATOM 0 HB2 LYS A 24 56.536 3.346 16.324 1.00 0.00 H new ATOM 0 HB3 LYS A 24 58.158 3.970 16.550 1.00 0.00 H new ATOM 0 HG2 LYS A 24 58.331 4.256 14.019 1.00 0.00 H new ATOM 0 HG3 LYS A 24 56.647 3.786 13.896 1.00 0.00 H new ATOM 0 HD2 LYS A 24 57.705 6.159 15.520 1.00 0.00 H new ATOM 0 HD3 LYS A 24 56.898 6.277 13.969 1.00 0.00 H new ATOM 0 HE2 LYS A 24 54.955 4.910 15.171 1.00 0.00 H new ATOM 0 HE3 LYS A 24 55.723 5.453 16.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 54.029 7.019 15.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 55.561 7.750 15.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 54.816 7.224 14.425 1.00 0.00 H new ATOM 378 N HIS A 25 59.833 1.817 13.868 1.00 0.00 N ATOM 379 CA HIS A 25 61.229 1.909 13.339 1.00 0.00 C ATOM 380 C HIS A 25 62.067 0.725 13.848 1.00 0.00 C ATOM 381 O HIS A 25 63.234 0.604 13.535 1.00 0.00 O ATOM 382 CB HIS A 25 61.851 3.245 13.783 1.00 0.00 C ATOM 383 CG HIS A 25 62.827 3.748 12.750 1.00 0.00 C ATOM 384 ND1 HIS A 25 64.193 3.805 12.988 1.00 0.00 N ATOM 385 CD2 HIS A 25 62.648 4.226 11.475 1.00 0.00 C ATOM 386 CE1 HIS A 25 64.778 4.304 11.883 1.00 0.00 C ATOM 387 NE2 HIS A 25 63.880 4.575 10.935 1.00 0.00 N ATOM 0 H HIS A 25 59.151 1.449 13.205 1.00 0.00 H new ATOM 0 HA HIS A 25 61.211 1.868 12.250 1.00 0.00 H new ATOM 0 HB2 HIS A 25 61.065 3.984 13.938 1.00 0.00 H new ATOM 0 HB3 HIS A 25 62.360 3.115 14.738 1.00 0.00 H new ATOM 0 HD2 HIS A 25 61.697 4.317 10.970 1.00 0.00 H new ATOM 0 HE1 HIS A 25 65.841 4.465 11.777 1.00 0.00 H new ATOM 0 HE2 HIS A 25 64.060 4.958 10.007 1.00 0.00 H new ATOM 396 N LYS A 26 61.471 -0.159 14.609 1.00 0.00 N ATOM 397 CA LYS A 26 62.214 -1.357 15.124 1.00 0.00 C ATOM 398 C LYS A 26 61.702 -2.593 14.380 1.00 0.00 C ATOM 399 O LYS A 26 60.515 -2.848 14.347 1.00 0.00 O ATOM 400 CB LYS A 26 61.950 -1.515 16.625 1.00 0.00 C ATOM 401 CG LYS A 26 62.558 -0.330 17.382 1.00 0.00 C ATOM 402 CD LYS A 26 62.292 -0.492 18.881 1.00 0.00 C ATOM 403 CE LYS A 26 62.899 0.689 19.644 1.00 0.00 C ATOM 404 NZ LYS A 26 62.414 0.673 21.054 1.00 0.00 N ATOM 0 H LYS A 26 60.495 -0.104 14.899 1.00 0.00 H new ATOM 0 HA LYS A 26 63.285 -1.237 14.963 1.00 0.00 H new ATOM 0 HB2 LYS A 26 60.877 -1.567 16.812 1.00 0.00 H new ATOM 0 HB3 LYS A 26 62.382 -2.449 16.984 1.00 0.00 H new ATOM 0 HG2 LYS A 26 63.631 -0.277 17.196 1.00 0.00 H new ATOM 0 HG3 LYS A 26 62.126 0.604 17.024 1.00 0.00 H new ATOM 0 HD2 LYS A 26 61.219 -0.544 19.066 1.00 0.00 H new ATOM 0 HD3 LYS A 26 62.723 -1.428 19.237 1.00 0.00 H new ATOM 0 HE2 LYS A 26 63.987 0.629 19.622 1.00 0.00 H new ATOM 0 HE3 LYS A 26 62.622 1.627 19.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 62.826 1.475 21.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 61.377 0.750 21.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 62.700 -0.217 21.509 1.00 0.00 H new ATOM 418 N LEU A 27 62.575 -3.360 13.763 1.00 0.00 N ATOM 419 CA LEU A 27 62.097 -4.564 13.005 1.00 0.00 C ATOM 420 C LEU A 27 62.193 -5.819 13.877 1.00 0.00 C ATOM 421 O LEU A 27 63.256 -6.210 14.318 1.00 0.00 O ATOM 422 CB LEU A 27 62.961 -4.755 11.759 1.00 0.00 C ATOM 423 CG LEU A 27 62.865 -3.521 10.852 1.00 0.00 C ATOM 424 CD1 LEU A 27 63.811 -3.704 9.663 1.00 0.00 C ATOM 425 CD2 LEU A 27 61.422 -3.348 10.341 1.00 0.00 C ATOM 0 H LEU A 27 63.583 -3.207 13.751 1.00 0.00 H new ATOM 0 HA LEU A 27 61.057 -4.407 12.720 1.00 0.00 H new ATOM 0 HB2 LEU A 27 63.998 -4.922 12.049 1.00 0.00 H new ATOM 0 HB3 LEU A 27 62.636 -5.641 11.215 1.00 0.00 H new ATOM 0 HG LEU A 27 63.145 -2.633 11.418 1.00 0.00 H new ATOM 0 HD11 LEU A 27 63.750 -2.832 9.012 1.00 0.00 H new ATOM 0 HD12 LEU A 27 64.833 -3.816 10.025 1.00 0.00 H new ATOM 0 HD13 LEU A 27 63.525 -4.595 9.104 1.00 0.00 H new ATOM 0 HD21 LEU A 27 61.366 -2.469 9.699 1.00 0.00 H new ATOM 0 HD22 LEU A 27 61.129 -4.231 9.774 1.00 0.00 H new ATOM 0 HD23 LEU A 27 60.749 -3.221 11.189 1.00 0.00 H new ATOM 437 N LYS A 28 61.072 -6.449 14.120 1.00 0.00 N ATOM 438 CA LYS A 28 61.042 -7.687 14.957 1.00 0.00 C ATOM 439 C LYS A 28 61.117 -8.921 14.045 1.00 0.00 C ATOM 440 O LYS A 28 60.944 -8.825 12.846 1.00 0.00 O ATOM 441 CB LYS A 28 59.737 -7.708 15.759 1.00 0.00 C ATOM 442 CG LYS A 28 59.785 -8.826 16.799 1.00 0.00 C ATOM 443 CD LYS A 28 58.585 -8.706 17.741 1.00 0.00 C ATOM 444 CE LYS A 28 58.553 -9.915 18.676 1.00 0.00 C ATOM 445 NZ LYS A 28 59.820 -9.972 19.457 1.00 0.00 N ATOM 0 H LYS A 28 60.162 -6.153 13.768 1.00 0.00 H new ATOM 0 HA LYS A 28 61.891 -7.699 15.640 1.00 0.00 H new ATOM 0 HB2 LYS A 28 59.587 -6.747 16.252 1.00 0.00 H new ATOM 0 HB3 LYS A 28 58.890 -7.858 15.089 1.00 0.00 H new ATOM 0 HG2 LYS A 28 59.775 -9.797 16.304 1.00 0.00 H new ATOM 0 HG3 LYS A 28 60.713 -8.767 17.367 1.00 0.00 H new ATOM 0 HD2 LYS A 28 58.654 -7.785 18.321 1.00 0.00 H new ATOM 0 HD3 LYS A 28 57.661 -8.652 17.166 1.00 0.00 H new ATOM 0 HE2 LYS A 28 57.700 -9.844 19.351 1.00 0.00 H new ATOM 0 HE3 LYS A 28 58.427 -10.831 18.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 59.689 -10.584 20.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 60.579 -10.357 18.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 60.078 -9.014 19.770 1.00 0.00 H new ATOM 459 N LYS A 29 61.401 -10.077 14.594 1.00 0.00 N ATOM 460 CA LYS A 29 61.517 -11.298 13.742 1.00 0.00 C ATOM 461 C LYS A 29 60.212 -11.524 12.967 1.00 0.00 C ATOM 462 O LYS A 29 60.226 -11.881 11.805 1.00 0.00 O ATOM 463 CB LYS A 29 61.801 -12.519 14.632 1.00 0.00 C ATOM 464 CG LYS A 29 60.568 -12.877 15.471 1.00 0.00 C ATOM 465 CD LYS A 29 60.955 -13.925 16.518 1.00 0.00 C ATOM 466 CE LYS A 29 59.695 -14.475 17.193 1.00 0.00 C ATOM 467 NZ LYS A 29 59.151 -13.453 18.133 1.00 0.00 N ATOM 0 H LYS A 29 61.557 -10.226 15.591 1.00 0.00 H new ATOM 0 HA LYS A 29 62.334 -11.162 13.034 1.00 0.00 H new ATOM 0 HB2 LYS A 29 62.084 -13.369 14.012 1.00 0.00 H new ATOM 0 HB3 LYS A 29 62.645 -12.308 15.289 1.00 0.00 H new ATOM 0 HG2 LYS A 29 60.175 -11.985 15.960 1.00 0.00 H new ATOM 0 HG3 LYS A 29 59.776 -13.263 14.829 1.00 0.00 H new ATOM 0 HD2 LYS A 29 61.509 -14.736 16.046 1.00 0.00 H new ATOM 0 HD3 LYS A 29 61.614 -13.481 17.264 1.00 0.00 H new ATOM 0 HE2 LYS A 29 58.947 -14.728 16.441 1.00 0.00 H new ATOM 0 HE3 LYS A 29 59.929 -15.393 17.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 58.819 -13.921 19.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 59.897 -12.769 18.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 58.357 -12.955 17.683 1.00 0.00 H new ATOM 481 N SER A 30 59.086 -11.305 13.589 1.00 0.00 N ATOM 482 CA SER A 30 57.792 -11.496 12.872 1.00 0.00 C ATOM 483 C SER A 30 57.748 -10.555 11.667 1.00 0.00 C ATOM 484 O SER A 30 57.301 -10.911 10.596 1.00 0.00 O ATOM 485 CB SER A 30 56.630 -11.181 13.812 1.00 0.00 C ATOM 486 OG SER A 30 56.634 -9.792 14.115 1.00 0.00 O ATOM 0 H SER A 30 59.005 -11.003 14.560 1.00 0.00 H new ATOM 0 HA SER A 30 57.707 -12.530 12.536 1.00 0.00 H new ATOM 0 HB2 SER A 30 55.685 -11.461 13.347 1.00 0.00 H new ATOM 0 HB3 SER A 30 56.720 -11.765 14.728 1.00 0.00 H new ATOM 0 HG SER A 30 55.888 -9.586 14.717 1.00 0.00 H new ATOM 492 N GLU A 31 58.228 -9.357 11.842 1.00 0.00 N ATOM 493 CA GLU A 31 58.244 -8.380 10.719 1.00 0.00 C ATOM 494 C GLU A 31 59.263 -8.847 9.677 1.00 0.00 C ATOM 495 O GLU A 31 59.040 -8.770 8.485 1.00 0.00 O ATOM 496 CB GLU A 31 58.645 -7.002 11.251 1.00 0.00 C ATOM 497 CG GLU A 31 57.515 -6.449 12.120 1.00 0.00 C ATOM 498 CD GLU A 31 57.930 -5.097 12.699 1.00 0.00 C ATOM 499 OE1 GLU A 31 57.790 -4.109 11.999 1.00 0.00 O ATOM 500 OE2 GLU A 31 58.381 -5.073 13.833 1.00 0.00 O ATOM 0 H GLU A 31 58.613 -9.010 12.721 1.00 0.00 H new ATOM 0 HA GLU A 31 57.255 -8.314 10.265 1.00 0.00 H new ATOM 0 HB2 GLU A 31 59.564 -7.077 11.833 1.00 0.00 H new ATOM 0 HB3 GLU A 31 58.847 -6.324 10.422 1.00 0.00 H new ATOM 0 HG2 GLU A 31 56.607 -6.339 11.527 1.00 0.00 H new ATOM 0 HG3 GLU A 31 57.287 -7.147 12.926 1.00 0.00 H new ATOM 507 N LEU A 32 60.377 -9.346 10.137 1.00 0.00 N ATOM 508 CA LEU A 32 61.421 -9.839 9.197 1.00 0.00 C ATOM 509 C LEU A 32 60.829 -10.984 8.366 1.00 0.00 C ATOM 510 O LEU A 32 61.010 -11.055 7.167 1.00 0.00 O ATOM 511 CB LEU A 32 62.635 -10.336 9.995 1.00 0.00 C ATOM 512 CG LEU A 32 63.734 -10.854 9.051 1.00 0.00 C ATOM 513 CD1 LEU A 32 64.306 -9.698 8.211 1.00 0.00 C ATOM 514 CD2 LEU A 32 64.853 -11.477 9.889 1.00 0.00 C ATOM 0 H LEU A 32 60.609 -9.434 11.126 1.00 0.00 H new ATOM 0 HA LEU A 32 61.743 -9.036 8.535 1.00 0.00 H new ATOM 0 HB2 LEU A 32 63.029 -9.526 10.609 1.00 0.00 H new ATOM 0 HB3 LEU A 32 62.328 -11.131 10.675 1.00 0.00 H new ATOM 0 HG LEU A 32 63.309 -11.599 8.378 1.00 0.00 H new ATOM 0 HD11 LEU A 32 65.082 -10.080 7.548 1.00 0.00 H new ATOM 0 HD12 LEU A 32 63.509 -9.251 7.617 1.00 0.00 H new ATOM 0 HD13 LEU A 32 64.732 -8.944 8.872 1.00 0.00 H new ATOM 0 HD21 LEU A 32 65.638 -11.848 9.230 1.00 0.00 H new ATOM 0 HD22 LEU A 32 65.268 -10.724 10.559 1.00 0.00 H new ATOM 0 HD23 LEU A 32 64.451 -12.303 10.475 1.00 0.00 H new ATOM 526 N LYS A 33 60.120 -11.876 9.003 1.00 0.00 N ATOM 527 CA LYS A 33 59.506 -13.019 8.264 1.00 0.00 C ATOM 528 C LYS A 33 58.520 -12.487 7.217 1.00 0.00 C ATOM 529 O LYS A 33 58.444 -12.987 6.112 1.00 0.00 O ATOM 530 CB LYS A 33 58.762 -13.924 9.258 1.00 0.00 C ATOM 531 CG LYS A 33 58.165 -15.132 8.524 1.00 0.00 C ATOM 532 CD LYS A 33 57.413 -16.034 9.516 1.00 0.00 C ATOM 533 CE LYS A 33 58.391 -16.701 10.498 1.00 0.00 C ATOM 534 NZ LYS A 33 58.619 -15.799 11.664 1.00 0.00 N ATOM 0 H LYS A 33 59.938 -11.863 10.007 1.00 0.00 H new ATOM 0 HA LYS A 33 60.287 -13.590 7.763 1.00 0.00 H new ATOM 0 HB2 LYS A 33 59.446 -14.263 10.036 1.00 0.00 H new ATOM 0 HB3 LYS A 33 57.970 -13.361 9.752 1.00 0.00 H new ATOM 0 HG2 LYS A 33 57.486 -14.793 7.742 1.00 0.00 H new ATOM 0 HG3 LYS A 33 58.958 -15.698 8.034 1.00 0.00 H new ATOM 0 HD2 LYS A 33 56.682 -15.444 10.069 1.00 0.00 H new ATOM 0 HD3 LYS A 33 56.859 -16.799 8.971 1.00 0.00 H new ATOM 0 HE2 LYS A 33 57.988 -17.656 10.837 1.00 0.00 H new ATOM 0 HE3 LYS A 33 59.336 -16.913 9.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 59.616 -15.505 11.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 58.013 -14.959 11.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 58.387 -16.303 12.544 1.00 0.00 H new ATOM 548 N GLU A 34 57.757 -11.483 7.558 1.00 0.00 N ATOM 549 CA GLU A 34 56.771 -10.931 6.583 1.00 0.00 C ATOM 550 C GLU A 34 57.499 -10.278 5.408 1.00 0.00 C ATOM 551 O GLU A 34 57.129 -10.447 4.263 1.00 0.00 O ATOM 552 CB GLU A 34 55.901 -9.882 7.279 1.00 0.00 C ATOM 553 CG GLU A 34 54.971 -10.569 8.281 1.00 0.00 C ATOM 554 CD GLU A 34 54.103 -9.519 8.976 1.00 0.00 C ATOM 555 OE1 GLU A 34 54.378 -8.344 8.803 1.00 0.00 O ATOM 556 OE2 GLU A 34 53.178 -9.909 9.670 1.00 0.00 O ATOM 0 H GLU A 34 57.773 -11.022 8.468 1.00 0.00 H new ATOM 0 HA GLU A 34 56.148 -11.745 6.211 1.00 0.00 H new ATOM 0 HB2 GLU A 34 56.531 -9.155 7.792 1.00 0.00 H new ATOM 0 HB3 GLU A 34 55.316 -9.333 6.541 1.00 0.00 H new ATOM 0 HG2 GLU A 34 54.341 -11.296 7.769 1.00 0.00 H new ATOM 0 HG3 GLU A 34 55.556 -11.118 9.019 1.00 0.00 H new ATOM 563 N LEU A 35 58.511 -9.508 5.685 1.00 0.00 N ATOM 564 CA LEU A 35 59.244 -8.812 4.589 1.00 0.00 C ATOM 565 C LEU A 35 59.827 -9.839 3.616 1.00 0.00 C ATOM 566 O LEU A 35 59.676 -9.726 2.417 1.00 0.00 O ATOM 567 CB LEU A 35 60.375 -7.970 5.200 1.00 0.00 C ATOM 568 CG LEU A 35 61.162 -7.230 4.106 1.00 0.00 C ATOM 569 CD1 LEU A 35 60.258 -6.207 3.403 1.00 0.00 C ATOM 570 CD2 LEU A 35 62.347 -6.501 4.751 1.00 0.00 C ATOM 0 H LEU A 35 58.865 -9.329 6.625 1.00 0.00 H new ATOM 0 HA LEU A 35 58.558 -8.164 4.044 1.00 0.00 H new ATOM 0 HB2 LEU A 35 59.958 -7.250 5.904 1.00 0.00 H new ATOM 0 HB3 LEU A 35 61.049 -8.614 5.765 1.00 0.00 H new ATOM 0 HG LEU A 35 61.520 -7.950 3.370 1.00 0.00 H new ATOM 0 HD11 LEU A 35 60.827 -5.689 2.630 1.00 0.00 H new ATOM 0 HD12 LEU A 35 59.412 -6.722 2.948 1.00 0.00 H new ATOM 0 HD13 LEU A 35 59.893 -5.483 4.131 1.00 0.00 H new ATOM 0 HD21 LEU A 35 62.911 -5.973 3.982 1.00 0.00 H new ATOM 0 HD22 LEU A 35 61.978 -5.786 5.486 1.00 0.00 H new ATOM 0 HD23 LEU A 35 62.995 -7.226 5.244 1.00 0.00 H new ATOM 582 N ILE A 36 60.499 -10.835 4.121 1.00 0.00 N ATOM 583 CA ILE A 36 61.098 -11.864 3.221 1.00 0.00 C ATOM 584 C ILE A 36 59.996 -12.554 2.410 1.00 0.00 C ATOM 585 O ILE A 36 60.136 -12.790 1.228 1.00 0.00 O ATOM 586 CB ILE A 36 61.826 -12.906 4.072 1.00 0.00 C ATOM 587 CG1 ILE A 36 62.946 -12.225 4.863 1.00 0.00 C ATOM 588 CG2 ILE A 36 62.426 -13.982 3.161 1.00 0.00 C ATOM 589 CD1 ILE A 36 63.511 -13.201 5.900 1.00 0.00 C ATOM 0 H ILE A 36 60.660 -10.983 5.117 1.00 0.00 H new ATOM 0 HA ILE A 36 61.798 -11.384 2.537 1.00 0.00 H new ATOM 0 HB ILE A 36 61.121 -13.368 4.763 1.00 0.00 H new ATOM 0 HG12 ILE A 36 63.736 -11.900 4.187 1.00 0.00 H new ATOM 0 HG13 ILE A 36 62.564 -11.333 5.359 1.00 0.00 H new ATOM 0 HG21 ILE A 36 62.945 -14.724 3.768 1.00 0.00 H new ATOM 0 HG22 ILE A 36 61.629 -14.467 2.597 1.00 0.00 H new ATOM 0 HG23 ILE A 36 63.132 -13.521 2.470 1.00 0.00 H new ATOM 0 HD11 ILE A 36 64.308 -12.714 6.462 1.00 0.00 H new ATOM 0 HD12 ILE A 36 62.718 -13.504 6.584 1.00 0.00 H new ATOM 0 HD13 ILE A 36 63.909 -14.080 5.393 1.00 0.00 H new ATOM 601 N ASN A 37 58.908 -12.895 3.039 1.00 0.00 N ATOM 602 CA ASN A 37 57.807 -13.587 2.312 1.00 0.00 C ATOM 603 C ASN A 37 57.173 -12.671 1.258 1.00 0.00 C ATOM 604 O ASN A 37 56.815 -13.112 0.184 1.00 0.00 O ATOM 605 CB ASN A 37 56.733 -14.009 3.319 1.00 0.00 C ATOM 606 CG ASN A 37 57.270 -15.139 4.198 1.00 0.00 C ATOM 607 OD1 ASN A 37 58.184 -15.841 3.813 1.00 0.00 O ATOM 608 ND2 ASN A 37 56.735 -15.351 5.368 1.00 0.00 N ATOM 0 H ASN A 37 58.732 -12.724 4.029 1.00 0.00 H new ATOM 0 HA ASN A 37 58.223 -14.457 1.805 1.00 0.00 H new ATOM 0 HB2 ASN A 37 56.446 -13.159 3.937 1.00 0.00 H new ATOM 0 HB3 ASN A 37 55.837 -14.338 2.793 1.00 0.00 H new ATOM 0 HD21 ASN A 37 57.084 -16.106 5.959 1.00 0.00 H new ATOM 0 HD22 ASN A 37 55.968 -14.762 5.692 1.00 0.00 H new ATOM 615 N ASN A 38 56.989 -11.413 1.564 1.00 0.00 N ATOM 616 CA ASN A 38 56.327 -10.488 0.592 1.00 0.00 C ATOM 617 C ASN A 38 57.309 -9.910 -0.436 1.00 0.00 C ATOM 618 O ASN A 38 56.888 -9.325 -1.414 1.00 0.00 O ATOM 619 CB ASN A 38 55.693 -9.330 1.368 1.00 0.00 C ATOM 620 CG ASN A 38 54.864 -8.467 0.415 1.00 0.00 C ATOM 621 OD1 ASN A 38 55.237 -7.353 0.105 1.00 0.00 O ATOM 622 ND2 ASN A 38 53.747 -8.936 -0.067 1.00 0.00 N ATOM 0 H ASN A 38 57.269 -10.984 2.446 1.00 0.00 H new ATOM 0 HA ASN A 38 55.579 -11.064 0.047 1.00 0.00 H new ATOM 0 HB2 ASN A 38 55.061 -9.717 2.167 1.00 0.00 H new ATOM 0 HB3 ASN A 38 56.469 -8.727 1.839 1.00 0.00 H new ATOM 0 HD21 ASN A 38 53.188 -8.368 -0.703 1.00 0.00 H new ATOM 0 HD22 ASN A 38 53.432 -9.871 0.192 1.00 0.00 H new ATOM 629 N GLU A 39 58.602 -10.034 -0.227 1.00 0.00 N ATOM 630 CA GLU A 39 59.581 -9.448 -1.216 1.00 0.00 C ATOM 631 C GLU A 39 60.623 -10.472 -1.677 1.00 0.00 C ATOM 632 O GLU A 39 60.446 -11.143 -2.673 1.00 0.00 O ATOM 633 CB GLU A 39 60.293 -8.255 -0.576 1.00 0.00 C ATOM 634 CG GLU A 39 59.300 -7.101 -0.417 1.00 0.00 C ATOM 635 CD GLU A 39 60.004 -5.903 0.222 1.00 0.00 C ATOM 636 OE1 GLU A 39 61.144 -6.058 0.629 1.00 0.00 O ATOM 637 OE2 GLU A 39 59.390 -4.851 0.299 1.00 0.00 O ATOM 0 H GLU A 39 59.021 -10.508 0.573 1.00 0.00 H new ATOM 0 HA GLU A 39 59.016 -9.134 -2.094 1.00 0.00 H new ATOM 0 HB2 GLU A 39 60.699 -8.537 0.395 1.00 0.00 H new ATOM 0 HB3 GLU A 39 61.134 -7.944 -1.195 1.00 0.00 H new ATOM 0 HG2 GLU A 39 58.894 -6.821 -1.389 1.00 0.00 H new ATOM 0 HG3 GLU A 39 58.459 -7.414 0.202 1.00 0.00 H new ATOM 644 N LEU A 40 61.728 -10.566 -0.989 1.00 0.00 N ATOM 645 CA LEU A 40 62.799 -11.510 -1.426 1.00 0.00 C ATOM 646 C LEU A 40 62.423 -12.956 -1.101 1.00 0.00 C ATOM 647 O LEU A 40 62.072 -13.289 0.012 1.00 0.00 O ATOM 648 CB LEU A 40 64.099 -11.157 -0.703 1.00 0.00 C ATOM 649 CG LEU A 40 64.520 -9.721 -1.040 1.00 0.00 C ATOM 650 CD1 LEU A 40 65.743 -9.346 -0.196 1.00 0.00 C ATOM 651 CD2 LEU A 40 64.868 -9.605 -2.537 1.00 0.00 C ATOM 0 H LEU A 40 61.936 -10.032 -0.145 1.00 0.00 H new ATOM 0 HA LEU A 40 62.924 -11.419 -2.505 1.00 0.00 H new ATOM 0 HB2 LEU A 40 63.965 -11.261 0.374 1.00 0.00 H new ATOM 0 HB3 LEU A 40 64.886 -11.852 -0.995 1.00 0.00 H new ATOM 0 HG LEU A 40 63.696 -9.043 -0.819 1.00 0.00 H new ATOM 0 HD11 LEU A 40 66.048 -8.326 -0.430 1.00 0.00 H new ATOM 0 HD12 LEU A 40 65.490 -9.415 0.862 1.00 0.00 H new ATOM 0 HD13 LEU A 40 66.562 -10.030 -0.418 1.00 0.00 H new ATOM 0 HD21 LEU A 40 65.165 -8.581 -2.763 1.00 0.00 H new ATOM 0 HD22 LEU A 40 65.689 -10.282 -2.773 1.00 0.00 H new ATOM 0 HD23 LEU A 40 63.996 -9.870 -3.135 1.00 0.00 H new ATOM 663 N SER A 41 62.518 -13.823 -2.075 1.00 0.00 N ATOM 664 CA SER A 41 62.191 -15.261 -1.852 1.00 0.00 C ATOM 665 C SER A 41 63.041 -16.116 -2.797 1.00 0.00 C ATOM 666 O SER A 41 63.538 -17.164 -2.434 1.00 0.00 O ATOM 667 CB SER A 41 60.708 -15.498 -2.140 1.00 0.00 C ATOM 668 OG SER A 41 60.493 -16.881 -2.384 1.00 0.00 O ATOM 0 H SER A 41 62.811 -13.593 -3.024 1.00 0.00 H new ATOM 0 HA SER A 41 62.403 -15.533 -0.818 1.00 0.00 H new ATOM 0 HB2 SER A 41 60.104 -15.168 -1.295 1.00 0.00 H new ATOM 0 HB3 SER A 41 60.395 -14.911 -3.004 1.00 0.00 H new ATOM 0 HG SER A 41 59.543 -17.037 -2.568 1.00 0.00 H new ATOM 674 N HIS A 42 63.203 -15.668 -4.013 1.00 0.00 N ATOM 675 CA HIS A 42 64.012 -16.436 -5.003 1.00 0.00 C ATOM 676 C HIS A 42 65.504 -16.267 -4.702 1.00 0.00 C ATOM 677 O HIS A 42 66.329 -17.029 -5.164 1.00 0.00 O ATOM 678 CB HIS A 42 63.720 -15.914 -6.411 1.00 0.00 C ATOM 679 CG HIS A 42 62.317 -16.282 -6.803 1.00 0.00 C ATOM 680 ND1 HIS A 42 62.003 -17.508 -7.376 1.00 0.00 N ATOM 681 CD2 HIS A 42 61.130 -15.597 -6.710 1.00 0.00 C ATOM 682 CE1 HIS A 42 60.676 -17.522 -7.603 1.00 0.00 C ATOM 683 NE2 HIS A 42 60.101 -16.382 -7.216 1.00 0.00 N ATOM 0 H HIS A 42 62.807 -14.797 -4.365 1.00 0.00 H new ATOM 0 HA HIS A 42 63.749 -17.492 -4.937 1.00 0.00 H new ATOM 0 HB2 HIS A 42 63.845 -14.832 -6.442 1.00 0.00 H new ATOM 0 HB3 HIS A 42 64.430 -16.337 -7.121 1.00 0.00 H new ATOM 0 HD2 HIS A 42 61.014 -14.602 -6.306 1.00 0.00 H new ATOM 0 HE1 HIS A 42 60.144 -18.352 -8.043 1.00 0.00 H new ATOM 0 HE2 HIS A 42 59.113 -16.138 -7.278 1.00 0.00 H new ATOM 692 N PHE A 43 65.859 -15.257 -3.949 1.00 0.00 N ATOM 693 CA PHE A 43 67.302 -15.015 -3.637 1.00 0.00 C ATOM 694 C PHE A 43 67.636 -15.566 -2.249 1.00 0.00 C ATOM 695 O PHE A 43 68.789 -15.686 -1.885 1.00 0.00 O ATOM 696 CB PHE A 43 67.568 -13.510 -3.659 1.00 0.00 C ATOM 697 CG PHE A 43 67.319 -12.981 -5.051 1.00 0.00 C ATOM 698 CD1 PHE A 43 66.042 -12.532 -5.410 1.00 0.00 C ATOM 699 CD2 PHE A 43 68.362 -12.943 -5.983 1.00 0.00 C ATOM 700 CE1 PHE A 43 65.809 -12.044 -6.701 1.00 0.00 C ATOM 701 CE2 PHE A 43 68.129 -12.456 -7.274 1.00 0.00 C ATOM 702 CZ PHE A 43 66.852 -12.007 -7.634 1.00 0.00 C ATOM 0 H PHE A 43 65.210 -14.587 -3.535 1.00 0.00 H new ATOM 0 HA PHE A 43 67.923 -15.517 -4.379 1.00 0.00 H new ATOM 0 HB2 PHE A 43 66.920 -13.004 -2.944 1.00 0.00 H new ATOM 0 HB3 PHE A 43 68.596 -13.306 -3.358 1.00 0.00 H new ATOM 0 HD1 PHE A 43 65.237 -12.562 -4.691 1.00 0.00 H new ATOM 0 HD2 PHE A 43 69.347 -13.289 -5.706 1.00 0.00 H new ATOM 0 HE1 PHE A 43 64.825 -11.696 -6.977 1.00 0.00 H new ATOM 0 HE2 PHE A 43 68.934 -12.426 -7.993 1.00 0.00 H new ATOM 0 HZ PHE A 43 66.672 -11.632 -8.631 1.00 0.00 H new ATOM 712 N LEU A 44 66.638 -15.917 -1.478 1.00 0.00 N ATOM 713 CA LEU A 44 66.886 -16.480 -0.112 1.00 0.00 C ATOM 714 C LEU A 44 66.572 -17.980 -0.150 1.00 0.00 C ATOM 715 O LEU A 44 67.288 -18.756 -0.749 1.00 0.00 O ATOM 716 CB LEU A 44 65.971 -15.783 0.912 1.00 0.00 C ATOM 717 CG LEU A 44 66.562 -14.425 1.345 1.00 0.00 C ATOM 718 CD1 LEU A 44 67.807 -14.628 2.233 1.00 0.00 C ATOM 719 CD2 LEU A 44 66.936 -13.596 0.110 1.00 0.00 C ATOM 0 H LEU A 44 65.654 -15.838 -1.737 1.00 0.00 H new ATOM 0 HA LEU A 44 67.924 -16.319 0.180 1.00 0.00 H new ATOM 0 HB2 LEU A 44 64.982 -15.632 0.479 1.00 0.00 H new ATOM 0 HB3 LEU A 44 65.842 -16.423 1.785 1.00 0.00 H new ATOM 0 HG LEU A 44 65.806 -13.892 1.922 1.00 0.00 H new ATOM 0 HD11 LEU A 44 68.207 -13.657 2.526 1.00 0.00 H new ATOM 0 HD12 LEU A 44 67.530 -15.191 3.124 1.00 0.00 H new ATOM 0 HD13 LEU A 44 68.565 -15.179 1.676 1.00 0.00 H new ATOM 0 HD21 LEU A 44 67.352 -12.639 0.426 1.00 0.00 H new ATOM 0 HD22 LEU A 44 67.676 -14.136 -0.480 1.00 0.00 H new ATOM 0 HD23 LEU A 44 66.046 -13.422 -0.495 1.00 0.00 H new ATOM 731 N GLU A 45 65.499 -18.387 0.475 1.00 0.00 N ATOM 732 CA GLU A 45 65.115 -19.826 0.483 1.00 0.00 C ATOM 733 C GLU A 45 63.786 -19.957 1.225 1.00 0.00 C ATOM 734 O GLU A 45 63.541 -19.264 2.191 1.00 0.00 O ATOM 735 CB GLU A 45 66.184 -20.649 1.215 1.00 0.00 C ATOM 736 CG GLU A 45 65.799 -22.135 1.219 1.00 0.00 C ATOM 737 CD GLU A 45 65.730 -22.660 -0.218 1.00 0.00 C ATOM 738 OE1 GLU A 45 66.324 -22.040 -1.085 1.00 0.00 O ATOM 739 OE2 GLU A 45 65.083 -23.673 -0.427 1.00 0.00 O ATOM 0 H GLU A 45 64.865 -17.774 0.987 1.00 0.00 H new ATOM 0 HA GLU A 45 65.025 -20.194 -0.539 1.00 0.00 H new ATOM 0 HB2 GLU A 45 67.151 -20.518 0.729 1.00 0.00 H new ATOM 0 HB3 GLU A 45 66.291 -20.291 2.239 1.00 0.00 H new ATOM 0 HG2 GLU A 45 66.530 -22.707 1.790 1.00 0.00 H new ATOM 0 HG3 GLU A 45 64.835 -22.269 1.711 1.00 0.00 H new ATOM 746 N GLU A 46 62.924 -20.835 0.799 1.00 0.00 N ATOM 747 CA GLU A 46 61.631 -20.982 1.515 1.00 0.00 C ATOM 748 C GLU A 46 61.926 -21.508 2.922 1.00 0.00 C ATOM 749 O GLU A 46 62.618 -22.494 3.089 1.00 0.00 O ATOM 750 CB GLU A 46 60.731 -21.964 0.756 1.00 0.00 C ATOM 751 CG GLU A 46 59.369 -22.054 1.447 1.00 0.00 C ATOM 752 CD GLU A 46 58.471 -23.025 0.679 1.00 0.00 C ATOM 753 OE1 GLU A 46 58.855 -23.421 -0.409 1.00 0.00 O ATOM 754 OE2 GLU A 46 57.412 -23.349 1.189 1.00 0.00 O ATOM 0 H GLU A 46 63.057 -21.450 -0.004 1.00 0.00 H new ATOM 0 HA GLU A 46 61.115 -20.024 1.578 1.00 0.00 H new ATOM 0 HB2 GLU A 46 60.605 -21.635 -0.275 1.00 0.00 H new ATOM 0 HB3 GLU A 46 61.198 -22.948 0.722 1.00 0.00 H new ATOM 0 HG2 GLU A 46 59.493 -22.393 2.476 1.00 0.00 H new ATOM 0 HG3 GLU A 46 58.905 -21.069 1.489 1.00 0.00 H new ATOM 761 N ILE A 47 61.425 -20.848 3.938 1.00 0.00 N ATOM 762 CA ILE A 47 61.693 -21.291 5.347 1.00 0.00 C ATOM 763 C ILE A 47 60.425 -21.886 5.956 1.00 0.00 C ATOM 764 O ILE A 47 59.363 -21.297 5.906 1.00 0.00 O ATOM 765 CB ILE A 47 62.136 -20.079 6.173 1.00 0.00 C ATOM 766 CG1 ILE A 47 63.410 -19.491 5.562 1.00 0.00 C ATOM 767 CG2 ILE A 47 62.409 -20.514 7.616 1.00 0.00 C ATOM 768 CD1 ILE A 47 63.727 -18.144 6.218 1.00 0.00 C ATOM 0 H ILE A 47 60.839 -20.017 3.854 1.00 0.00 H new ATOM 0 HA ILE A 47 62.476 -22.049 5.348 1.00 0.00 H new ATOM 0 HB ILE A 47 61.349 -19.325 6.169 1.00 0.00 H new ATOM 0 HG12 ILE A 47 64.243 -20.180 5.703 1.00 0.00 H new ATOM 0 HG13 ILE A 47 63.282 -19.361 4.487 1.00 0.00 H new ATOM 0 HG21 ILE A 47 62.724 -19.651 8.203 1.00 0.00 H new ATOM 0 HG22 ILE A 47 61.500 -20.934 8.047 1.00 0.00 H new ATOM 0 HG23 ILE A 47 63.197 -21.267 7.626 1.00 0.00 H new ATOM 0 HD11 ILE A 47 64.635 -17.730 5.779 1.00 0.00 H new ATOM 0 HD12 ILE A 47 62.898 -17.455 6.054 1.00 0.00 H new ATOM 0 HD13 ILE A 47 63.874 -18.286 7.289 1.00 0.00 H new ATOM 780 N LYS A 48 60.535 -23.055 6.534 1.00 0.00 N ATOM 781 CA LYS A 48 59.348 -23.716 7.159 1.00 0.00 C ATOM 782 C LYS A 48 59.468 -23.647 8.685 1.00 0.00 C ATOM 783 O LYS A 48 58.482 -23.688 9.393 1.00 0.00 O ATOM 784 CB LYS A 48 59.319 -25.189 6.739 1.00 0.00 C ATOM 785 CG LYS A 48 59.221 -25.309 5.211 1.00 0.00 C ATOM 786 CD LYS A 48 57.837 -24.859 4.721 1.00 0.00 C ATOM 787 CE LYS A 48 57.580 -25.421 3.319 1.00 0.00 C ATOM 788 NZ LYS A 48 56.201 -25.063 2.882 1.00 0.00 N ATOM 0 H LYS A 48 61.404 -23.585 6.600 1.00 0.00 H new ATOM 0 HA LYS A 48 58.438 -23.210 6.835 1.00 0.00 H new ATOM 0 HB2 LYS A 48 60.219 -25.692 7.093 1.00 0.00 H new ATOM 0 HB3 LYS A 48 58.470 -25.690 7.205 1.00 0.00 H new ATOM 0 HG2 LYS A 48 59.994 -24.700 4.743 1.00 0.00 H new ATOM 0 HG3 LYS A 48 59.402 -26.341 4.910 1.00 0.00 H new ATOM 0 HD2 LYS A 48 57.066 -25.205 5.409 1.00 0.00 H new ATOM 0 HD3 LYS A 48 57.783 -23.771 4.703 1.00 0.00 H new ATOM 0 HE2 LYS A 48 58.311 -25.021 2.616 1.00 0.00 H new ATOM 0 HE3 LYS A 48 57.702 -26.504 3.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 55.726 -25.908 2.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 55.664 -24.697 3.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 56.250 -24.334 2.142 1.00 0.00 H new ATOM 802 N GLU A 49 60.676 -23.562 9.196 1.00 0.00 N ATOM 803 CA GLU A 49 60.881 -23.514 10.682 1.00 0.00 C ATOM 804 C GLU A 49 61.373 -22.126 11.109 1.00 0.00 C ATOM 805 O GLU A 49 62.288 -21.573 10.533 1.00 0.00 O ATOM 806 CB GLU A 49 61.936 -24.553 11.069 1.00 0.00 C ATOM 807 CG GLU A 49 61.382 -25.960 10.842 1.00 0.00 C ATOM 808 CD GLU A 49 62.454 -26.992 11.200 1.00 0.00 C ATOM 809 OE1 GLU A 49 62.566 -27.322 12.368 1.00 0.00 O ATOM 810 OE2 GLU A 49 63.146 -27.434 10.296 1.00 0.00 O ATOM 0 H GLU A 49 61.533 -23.524 8.644 1.00 0.00 H new ATOM 0 HA GLU A 49 59.934 -23.725 11.179 1.00 0.00 H new ATOM 0 HB2 GLU A 49 62.839 -24.407 10.476 1.00 0.00 H new ATOM 0 HB3 GLU A 49 62.218 -24.427 12.114 1.00 0.00 H new ATOM 0 HG2 GLU A 49 60.493 -26.116 11.453 1.00 0.00 H new ATOM 0 HG3 GLU A 49 61.079 -26.080 9.802 1.00 0.00 H new ATOM 817 N GLN A 50 60.779 -21.573 12.133 1.00 0.00 N ATOM 818 CA GLN A 50 61.210 -20.233 12.630 1.00 0.00 C ATOM 819 C GLN A 50 62.645 -20.326 13.163 1.00 0.00 C ATOM 820 O GLN A 50 63.446 -19.430 12.994 1.00 0.00 O ATOM 821 CB GLN A 50 60.268 -19.782 13.751 1.00 0.00 C ATOM 822 CG GLN A 50 60.696 -18.404 14.269 1.00 0.00 C ATOM 823 CD GLN A 50 59.718 -17.934 15.349 1.00 0.00 C ATOM 824 OE1 GLN A 50 58.733 -17.288 15.053 1.00 0.00 O ATOM 825 NE2 GLN A 50 59.955 -18.225 16.600 1.00 0.00 N ATOM 0 H GLN A 50 60.008 -21.995 12.650 1.00 0.00 H new ATOM 0 HA GLN A 50 61.175 -19.509 11.816 1.00 0.00 H new ATOM 0 HB2 GLN A 50 59.243 -19.739 13.382 1.00 0.00 H new ATOM 0 HB3 GLN A 50 60.284 -20.507 14.565 1.00 0.00 H new ATOM 0 HG2 GLN A 50 61.706 -18.455 14.676 1.00 0.00 H new ATOM 0 HG3 GLN A 50 60.719 -17.687 13.448 1.00 0.00 H new ATOM 0 HE21 GLN A 50 60.782 -18.767 16.850 1.00 0.00 H new ATOM 0 HE22 GLN A 50 59.313 -17.910 17.327 1.00 0.00 H new ATOM 834 N GLU A 51 62.961 -21.404 13.822 1.00 0.00 N ATOM 835 CA GLU A 51 64.332 -21.568 14.393 1.00 0.00 C ATOM 836 C GLU A 51 65.378 -21.160 13.350 1.00 0.00 C ATOM 837 O GLU A 51 66.417 -20.618 13.672 1.00 0.00 O ATOM 838 CB GLU A 51 64.546 -23.029 14.784 1.00 0.00 C ATOM 839 CG GLU A 51 63.675 -23.360 15.997 1.00 0.00 C ATOM 840 CD GLU A 51 63.884 -24.822 16.394 1.00 0.00 C ATOM 841 OE1 GLU A 51 64.526 -25.534 15.640 1.00 0.00 O ATOM 842 OE2 GLU A 51 63.401 -25.204 17.448 1.00 0.00 O ATOM 0 H GLU A 51 62.327 -22.185 13.992 1.00 0.00 H new ATOM 0 HA GLU A 51 64.436 -20.934 15.274 1.00 0.00 H new ATOM 0 HB2 GLU A 51 64.291 -23.682 13.949 1.00 0.00 H new ATOM 0 HB3 GLU A 51 65.596 -23.205 15.017 1.00 0.00 H new ATOM 0 HG2 GLU A 51 63.931 -22.706 16.831 1.00 0.00 H new ATOM 0 HG3 GLU A 51 62.625 -23.182 15.763 1.00 0.00 H new ATOM 849 N VAL A 52 65.097 -21.391 12.101 1.00 0.00 N ATOM 850 CA VAL A 52 66.056 -20.993 11.032 1.00 0.00 C ATOM 851 C VAL A 52 66.083 -19.463 10.939 1.00 0.00 C ATOM 852 O VAL A 52 67.094 -18.864 10.634 1.00 0.00 O ATOM 853 CB VAL A 52 65.614 -21.592 9.694 1.00 0.00 C ATOM 854 CG1 VAL A 52 66.467 -21.013 8.561 1.00 0.00 C ATOM 855 CG2 VAL A 52 65.793 -23.111 9.738 1.00 0.00 C ATOM 0 H VAL A 52 64.242 -21.840 11.771 1.00 0.00 H new ATOM 0 HA VAL A 52 67.053 -21.363 11.269 1.00 0.00 H new ATOM 0 HB VAL A 52 64.566 -21.349 9.517 1.00 0.00 H new ATOM 0 HG11 VAL A 52 66.149 -21.442 7.611 1.00 0.00 H new ATOM 0 HG12 VAL A 52 66.344 -19.930 8.530 1.00 0.00 H new ATOM 0 HG13 VAL A 52 67.516 -21.254 8.735 1.00 0.00 H new ATOM 0 HG21 VAL A 52 65.479 -23.542 8.787 1.00 0.00 H new ATOM 0 HG22 VAL A 52 66.842 -23.349 9.916 1.00 0.00 H new ATOM 0 HG23 VAL A 52 65.185 -23.526 10.542 1.00 0.00 H new ATOM 865 N VAL A 53 64.971 -18.831 11.207 1.00 0.00 N ATOM 866 CA VAL A 53 64.921 -17.341 11.144 1.00 0.00 C ATOM 867 C VAL A 53 65.735 -16.749 12.301 1.00 0.00 C ATOM 868 O VAL A 53 66.459 -15.788 12.137 1.00 0.00 O ATOM 869 CB VAL A 53 63.462 -16.869 11.249 1.00 0.00 C ATOM 870 CG1 VAL A 53 63.416 -15.345 11.398 1.00 0.00 C ATOM 871 CG2 VAL A 53 62.698 -17.285 9.990 1.00 0.00 C ATOM 0 H VAL A 53 64.094 -19.283 11.467 1.00 0.00 H new ATOM 0 HA VAL A 53 65.343 -17.006 10.196 1.00 0.00 H new ATOM 0 HB VAL A 53 62.999 -17.327 12.123 1.00 0.00 H new ATOM 0 HG11 VAL A 53 62.379 -15.018 11.472 1.00 0.00 H new ATOM 0 HG12 VAL A 53 63.954 -15.051 12.299 1.00 0.00 H new ATOM 0 HG13 VAL A 53 63.882 -14.880 10.529 1.00 0.00 H new ATOM 0 HG21 VAL A 53 61.663 -16.950 10.065 1.00 0.00 H new ATOM 0 HG22 VAL A 53 63.164 -16.831 9.115 1.00 0.00 H new ATOM 0 HG23 VAL A 53 62.722 -18.370 9.892 1.00 0.00 H new ATOM 881 N ASP A 54 65.603 -17.305 13.475 1.00 0.00 N ATOM 882 CA ASP A 54 66.349 -16.763 14.651 1.00 0.00 C ATOM 883 C ASP A 54 67.859 -16.844 14.419 1.00 0.00 C ATOM 884 O ASP A 54 68.594 -15.938 14.754 1.00 0.00 O ATOM 885 CB ASP A 54 65.986 -17.573 15.897 1.00 0.00 C ATOM 886 CG ASP A 54 64.541 -17.273 16.300 1.00 0.00 C ATOM 887 OD1 ASP A 54 64.030 -16.250 15.876 1.00 0.00 O ATOM 888 OD2 ASP A 54 63.970 -18.073 17.023 1.00 0.00 O ATOM 0 H ASP A 54 65.011 -18.112 13.672 1.00 0.00 H new ATOM 0 HA ASP A 54 66.072 -15.718 14.788 1.00 0.00 H new ATOM 0 HB2 ASP A 54 66.105 -18.638 15.698 1.00 0.00 H new ATOM 0 HB3 ASP A 54 66.662 -17.324 16.715 1.00 0.00 H new ATOM 893 N LYS A 55 68.330 -17.912 13.842 1.00 0.00 N ATOM 894 CA LYS A 55 69.796 -18.027 13.588 1.00 0.00 C ATOM 895 C LYS A 55 70.225 -16.878 12.674 1.00 0.00 C ATOM 896 O LYS A 55 71.228 -16.229 12.891 1.00 0.00 O ATOM 897 CB LYS A 55 70.098 -19.369 12.911 1.00 0.00 C ATOM 898 CG LYS A 55 71.608 -19.513 12.699 1.00 0.00 C ATOM 899 CD LYS A 55 71.913 -20.853 12.015 1.00 0.00 C ATOM 900 CE LYS A 55 71.469 -22.026 12.907 1.00 0.00 C ATOM 901 NZ LYS A 55 70.051 -22.369 12.605 1.00 0.00 N ATOM 0 H LYS A 55 67.769 -18.707 13.536 1.00 0.00 H new ATOM 0 HA LYS A 55 70.343 -17.976 14.529 1.00 0.00 H new ATOM 0 HB2 LYS A 55 69.728 -20.189 13.526 1.00 0.00 H new ATOM 0 HB3 LYS A 55 69.579 -19.429 11.954 1.00 0.00 H new ATOM 0 HG2 LYS A 55 71.979 -18.690 12.088 1.00 0.00 H new ATOM 0 HG3 LYS A 55 72.126 -19.457 13.657 1.00 0.00 H new ATOM 0 HD2 LYS A 55 71.399 -20.903 11.055 1.00 0.00 H new ATOM 0 HD3 LYS A 55 72.981 -20.928 11.809 1.00 0.00 H new ATOM 0 HE2 LYS A 55 72.109 -22.891 12.734 1.00 0.00 H new ATOM 0 HE3 LYS A 55 71.574 -21.758 13.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 69.473 -22.240 13.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 69.697 -21.748 11.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 69.992 -23.360 12.294 1.00 0.00 H new ATOM 915 N VAL A 56 69.463 -16.641 11.647 1.00 0.00 N ATOM 916 CA VAL A 56 69.799 -15.551 10.689 1.00 0.00 C ATOM 917 C VAL A 56 69.821 -14.200 11.413 1.00 0.00 C ATOM 918 O VAL A 56 70.655 -13.358 11.149 1.00 0.00 O ATOM 919 CB VAL A 56 68.744 -15.523 9.575 1.00 0.00 C ATOM 920 CG1 VAL A 56 68.925 -14.269 8.710 1.00 0.00 C ATOM 921 CG2 VAL A 56 68.897 -16.775 8.705 1.00 0.00 C ATOM 0 H VAL A 56 68.613 -17.160 11.426 1.00 0.00 H new ATOM 0 HA VAL A 56 70.785 -15.735 10.262 1.00 0.00 H new ATOM 0 HB VAL A 56 67.749 -15.503 10.021 1.00 0.00 H new ATOM 0 HG11 VAL A 56 68.172 -14.258 7.922 1.00 0.00 H new ATOM 0 HG12 VAL A 56 68.814 -13.380 9.331 1.00 0.00 H new ATOM 0 HG13 VAL A 56 69.918 -14.277 8.262 1.00 0.00 H new ATOM 0 HG21 VAL A 56 68.150 -16.760 7.912 1.00 0.00 H new ATOM 0 HG22 VAL A 56 69.894 -16.792 8.264 1.00 0.00 H new ATOM 0 HG23 VAL A 56 68.757 -17.664 9.319 1.00 0.00 H new ATOM 931 N MET A 57 68.901 -13.982 12.310 1.00 0.00 N ATOM 932 CA MET A 57 68.858 -12.679 13.030 1.00 0.00 C ATOM 933 C MET A 57 70.077 -12.524 13.946 1.00 0.00 C ATOM 934 O MET A 57 70.651 -11.459 14.049 1.00 0.00 O ATOM 935 CB MET A 57 67.579 -12.614 13.860 1.00 0.00 C ATOM 936 CG MET A 57 66.384 -12.483 12.917 1.00 0.00 C ATOM 937 SD MET A 57 64.854 -12.415 13.877 1.00 0.00 S ATOM 938 CE MET A 57 65.149 -10.830 14.697 1.00 0.00 C ATOM 0 H MET A 57 68.177 -14.649 12.576 1.00 0.00 H new ATOM 0 HA MET A 57 68.873 -11.869 12.301 1.00 0.00 H new ATOM 0 HB2 MET A 57 67.480 -13.511 14.471 1.00 0.00 H new ATOM 0 HB3 MET A 57 67.615 -11.765 14.543 1.00 0.00 H new ATOM 0 HG2 MET A 57 66.484 -11.583 12.310 1.00 0.00 H new ATOM 0 HG3 MET A 57 66.356 -13.329 12.230 1.00 0.00 H new ATOM 0 HE1 MET A 57 64.195 -10.381 14.976 1.00 0.00 H new ATOM 0 HE2 MET A 57 65.750 -10.990 15.592 1.00 0.00 H new ATOM 0 HE3 MET A 57 65.679 -10.162 14.018 1.00 0.00 H new ATOM 948 N GLU A 58 70.482 -13.572 14.606 1.00 0.00 N ATOM 949 CA GLU A 58 71.667 -13.460 15.504 1.00 0.00 C ATOM 950 C GLU A 58 72.908 -13.195 14.657 1.00 0.00 C ATOM 951 O GLU A 58 73.723 -12.350 14.971 1.00 0.00 O ATOM 952 CB GLU A 58 71.847 -14.768 16.276 1.00 0.00 C ATOM 953 CG GLU A 58 70.718 -14.921 17.297 1.00 0.00 C ATOM 954 CD GLU A 58 70.872 -16.255 18.030 1.00 0.00 C ATOM 955 OE1 GLU A 58 71.600 -16.290 19.009 1.00 0.00 O ATOM 956 OE2 GLU A 58 70.262 -17.218 17.597 1.00 0.00 O ATOM 0 H GLU A 58 70.049 -14.495 14.564 1.00 0.00 H new ATOM 0 HA GLU A 58 71.520 -12.642 16.209 1.00 0.00 H new ATOM 0 HB2 GLU A 58 71.844 -15.612 15.587 1.00 0.00 H new ATOM 0 HB3 GLU A 58 72.812 -14.773 16.783 1.00 0.00 H new ATOM 0 HG2 GLU A 58 70.744 -14.097 18.010 1.00 0.00 H new ATOM 0 HG3 GLU A 58 69.751 -14.879 16.795 1.00 0.00 H new ATOM 963 N THR A 59 73.041 -13.899 13.569 1.00 0.00 N ATOM 964 CA THR A 59 74.210 -13.684 12.676 1.00 0.00 C ATOM 965 C THR A 59 74.067 -12.325 11.992 1.00 0.00 C ATOM 966 O THR A 59 75.020 -11.589 11.834 1.00 0.00 O ATOM 967 CB THR A 59 74.260 -14.794 11.620 1.00 0.00 C ATOM 968 OG1 THR A 59 74.383 -16.053 12.269 1.00 0.00 O ATOM 969 CG2 THR A 59 75.458 -14.572 10.695 1.00 0.00 C ATOM 0 H THR A 59 72.387 -14.617 13.259 1.00 0.00 H new ATOM 0 HA THR A 59 75.131 -13.706 13.258 1.00 0.00 H new ATOM 0 HB THR A 59 73.345 -14.776 11.029 1.00 0.00 H new ATOM 0 HG1 THR A 59 73.501 -16.350 12.577 1.00 0.00 H new ATOM 0 HG21 THR A 59 75.491 -15.363 9.946 1.00 0.00 H new ATOM 0 HG22 THR A 59 75.361 -13.606 10.199 1.00 0.00 H new ATOM 0 HG23 THR A 59 76.377 -14.589 11.280 1.00 0.00 H new ATOM 977 N LEU A 60 72.872 -11.992 11.596 1.00 0.00 N ATOM 978 CA LEU A 60 72.638 -10.684 10.925 1.00 0.00 C ATOM 979 C LEU A 60 72.799 -9.546 11.937 1.00 0.00 C ATOM 980 O LEU A 60 73.336 -8.501 11.627 1.00 0.00 O ATOM 981 CB LEU A 60 71.223 -10.659 10.342 1.00 0.00 C ATOM 982 CG LEU A 60 70.951 -9.320 9.641 1.00 0.00 C ATOM 983 CD1 LEU A 60 71.954 -9.107 8.495 1.00 0.00 C ATOM 984 CD2 LEU A 60 69.524 -9.343 9.084 1.00 0.00 C ATOM 0 H LEU A 60 72.042 -12.573 11.709 1.00 0.00 H new ATOM 0 HA LEU A 60 73.365 -10.553 10.123 1.00 0.00 H new ATOM 0 HB2 LEU A 60 71.101 -11.478 9.633 1.00 0.00 H new ATOM 0 HB3 LEU A 60 70.494 -10.814 11.137 1.00 0.00 H new ATOM 0 HG LEU A 60 71.062 -8.503 10.353 1.00 0.00 H new ATOM 0 HD11 LEU A 60 71.751 -8.154 8.006 1.00 0.00 H new ATOM 0 HD12 LEU A 60 72.968 -9.100 8.895 1.00 0.00 H new ATOM 0 HD13 LEU A 60 71.855 -9.915 7.770 1.00 0.00 H new ATOM 0 HD21 LEU A 60 69.314 -8.398 8.582 1.00 0.00 H new ATOM 0 HD22 LEU A 60 69.425 -10.162 8.372 1.00 0.00 H new ATOM 0 HD23 LEU A 60 68.817 -9.485 9.901 1.00 0.00 H new ATOM 996 N ASP A 61 72.320 -9.730 13.139 1.00 0.00 N ATOM 997 CA ASP A 61 72.428 -8.648 14.157 1.00 0.00 C ATOM 998 C ASP A 61 73.889 -8.427 14.538 1.00 0.00 C ATOM 999 O ASP A 61 74.486 -9.209 15.250 1.00 0.00 O ATOM 1000 CB ASP A 61 71.636 -9.036 15.407 1.00 0.00 C ATOM 1001 CG ASP A 61 70.139 -8.987 15.102 1.00 0.00 C ATOM 1002 OD1 ASP A 61 69.772 -8.331 14.140 1.00 0.00 O ATOM 1003 OD2 ASP A 61 69.384 -9.601 15.837 1.00 0.00 O ATOM 0 H ASP A 61 71.859 -10.582 13.458 1.00 0.00 H new ATOM 0 HA ASP A 61 72.024 -7.728 13.735 1.00 0.00 H new ATOM 0 HB2 ASP A 61 71.918 -10.037 15.732 1.00 0.00 H new ATOM 0 HB3 ASP A 61 71.873 -8.356 16.225 1.00 0.00 H new ATOM 1008 N GLU A 62 74.464 -7.361 14.072 1.00 0.00 N ATOM 1009 CA GLU A 62 75.884 -7.073 14.406 1.00 0.00 C ATOM 1010 C GLU A 62 76.028 -6.906 15.921 1.00 0.00 C ATOM 1011 O GLU A 62 76.996 -7.339 16.515 1.00 0.00 O ATOM 1012 CB GLU A 62 76.314 -5.782 13.711 1.00 0.00 C ATOM 1013 CG GLU A 62 76.408 -6.016 12.201 1.00 0.00 C ATOM 1014 CD GLU A 62 77.600 -6.924 11.898 1.00 0.00 C ATOM 1015 OE1 GLU A 62 78.463 -7.039 12.752 1.00 0.00 O ATOM 1016 OE2 GLU A 62 77.630 -7.489 10.816 1.00 0.00 O ATOM 0 H GLU A 62 74.012 -6.672 13.471 1.00 0.00 H new ATOM 0 HA GLU A 62 76.513 -7.898 14.070 1.00 0.00 H new ATOM 0 HB2 GLU A 62 75.598 -4.988 13.922 1.00 0.00 H new ATOM 0 HB3 GLU A 62 77.278 -5.453 14.098 1.00 0.00 H new ATOM 0 HG2 GLU A 62 75.488 -6.472 11.835 1.00 0.00 H new ATOM 0 HG3 GLU A 62 76.521 -5.065 11.681 1.00 0.00 H new ATOM 1023 N ASP A 63 75.081 -6.258 16.550 1.00 0.00 N ATOM 1024 CA ASP A 63 75.166 -6.034 18.026 1.00 0.00 C ATOM 1025 C ASP A 63 74.381 -7.107 18.794 1.00 0.00 C ATOM 1026 O ASP A 63 74.467 -7.190 20.004 1.00 0.00 O ATOM 1027 CB ASP A 63 74.586 -4.656 18.351 1.00 0.00 C ATOM 1028 CG ASP A 63 73.133 -4.589 17.880 1.00 0.00 C ATOM 1029 OD1 ASP A 63 72.676 -5.557 17.293 1.00 0.00 O ATOM 1030 OD2 ASP A 63 72.501 -3.574 18.116 1.00 0.00 O ATOM 0 H ASP A 63 74.249 -5.873 16.103 1.00 0.00 H new ATOM 0 HA ASP A 63 76.211 -6.091 18.329 1.00 0.00 H new ATOM 0 HB2 ASP A 63 74.640 -4.471 19.424 1.00 0.00 H new ATOM 0 HB3 ASP A 63 75.174 -3.878 17.863 1.00 0.00 H new ATOM 1035 N GLY A 64 73.618 -7.924 18.121 1.00 0.00 N ATOM 1036 CA GLY A 64 72.846 -8.973 18.849 1.00 0.00 C ATOM 1037 C GLY A 64 71.755 -8.315 19.698 1.00 0.00 C ATOM 1038 O GLY A 64 71.367 -8.825 20.729 1.00 0.00 O ATOM 0 H GLY A 64 73.496 -7.912 17.108 1.00 0.00 H new ATOM 0 HA2 GLY A 64 72.398 -9.667 18.138 1.00 0.00 H new ATOM 0 HA3 GLY A 64 73.514 -9.554 19.485 1.00 0.00 H new ATOM 1042 N ASP A 65 71.257 -7.185 19.277 1.00 0.00 N ATOM 1043 CA ASP A 65 70.195 -6.495 20.066 1.00 0.00 C ATOM 1044 C ASP A 65 68.893 -7.292 19.978 1.00 0.00 C ATOM 1045 O ASP A 65 67.913 -6.968 20.618 1.00 0.00 O ATOM 1046 CB ASP A 65 69.970 -5.095 19.493 1.00 0.00 C ATOM 1047 CG ASP A 65 69.502 -5.213 18.039 1.00 0.00 C ATOM 1048 OD1 ASP A 65 69.726 -6.258 17.448 1.00 0.00 O ATOM 1049 OD2 ASP A 65 68.930 -4.258 17.540 1.00 0.00 O ATOM 0 H ASP A 65 71.539 -6.709 18.420 1.00 0.00 H new ATOM 0 HA ASP A 65 70.506 -6.421 21.108 1.00 0.00 H new ATOM 0 HB2 ASP A 65 69.225 -4.563 20.085 1.00 0.00 H new ATOM 0 HB3 ASP A 65 70.892 -4.516 19.545 1.00 0.00 H new ATOM 1054 N GLY A 66 68.881 -8.347 19.206 1.00 0.00 N ATOM 1055 CA GLY A 66 67.650 -9.187 19.090 1.00 0.00 C ATOM 1056 C GLY A 66 66.745 -8.677 17.961 1.00 0.00 C ATOM 1057 O GLY A 66 65.880 -9.390 17.494 1.00 0.00 O ATOM 0 H GLY A 66 69.674 -8.665 18.648 1.00 0.00 H new ATOM 0 HA2 GLY A 66 67.928 -10.223 18.899 1.00 0.00 H new ATOM 0 HA3 GLY A 66 67.105 -9.173 20.034 1.00 0.00 H new ATOM 1061 N GLU A 67 66.938 -7.460 17.507 1.00 0.00 N ATOM 1062 CA GLU A 67 66.094 -6.907 16.397 1.00 0.00 C ATOM 1063 C GLU A 67 67.012 -6.315 15.334 1.00 0.00 C ATOM 1064 O GLU A 67 68.181 -6.085 15.575 1.00 0.00 O ATOM 1065 CB GLU A 67 65.179 -5.796 16.922 1.00 0.00 C ATOM 1066 CG GLU A 67 64.098 -6.393 17.824 1.00 0.00 C ATOM 1067 CD GLU A 67 64.706 -6.779 19.174 1.00 0.00 C ATOM 1068 OE1 GLU A 67 65.831 -6.386 19.434 1.00 0.00 O ATOM 1069 OE2 GLU A 67 64.029 -7.459 19.929 1.00 0.00 O ATOM 0 H GLU A 67 67.650 -6.821 17.861 1.00 0.00 H new ATOM 0 HA GLU A 67 65.483 -7.709 15.982 1.00 0.00 H new ATOM 0 HB2 GLU A 67 65.764 -5.063 17.478 1.00 0.00 H new ATOM 0 HB3 GLU A 67 64.718 -5.268 16.087 1.00 0.00 H new ATOM 0 HG2 GLU A 67 63.294 -5.672 17.970 1.00 0.00 H new ATOM 0 HG3 GLU A 67 63.658 -7.270 17.349 1.00 0.00 H new ATOM 1076 N CYS A 68 66.497 -6.057 14.158 1.00 0.00 N ATOM 1077 CA CYS A 68 67.347 -5.471 13.076 1.00 0.00 C ATOM 1078 C CYS A 68 67.094 -3.959 12.982 1.00 0.00 C ATOM 1079 O CYS A 68 66.030 -3.514 12.579 1.00 0.00 O ATOM 1080 CB CYS A 68 66.992 -6.135 11.742 1.00 0.00 C ATOM 1081 SG CYS A 68 68.180 -5.621 10.479 1.00 0.00 S ATOM 0 H CYS A 68 65.525 -6.227 13.900 1.00 0.00 H new ATOM 0 HA CYS A 68 68.399 -5.644 13.303 1.00 0.00 H new ATOM 0 HB2 CYS A 68 67.005 -7.220 11.849 1.00 0.00 H new ATOM 0 HB3 CYS A 68 65.982 -5.856 11.442 1.00 0.00 H new ATOM 0 HG CYS A 68 67.881 -6.185 9.347 1.00 0.00 H new ATOM 1087 N ASP A 69 68.056 -3.169 13.394 1.00 0.00 N ATOM 1088 CA ASP A 69 67.897 -1.684 13.373 1.00 0.00 C ATOM 1089 C ASP A 69 67.917 -1.160 11.932 1.00 0.00 C ATOM 1090 O ASP A 69 68.132 -1.892 10.988 1.00 0.00 O ATOM 1091 CB ASP A 69 69.040 -1.038 14.166 1.00 0.00 C ATOM 1092 CG ASP A 69 68.659 0.393 14.559 1.00 0.00 C ATOM 1093 OD1 ASP A 69 67.650 0.872 14.071 1.00 0.00 O ATOM 1094 OD2 ASP A 69 69.382 0.982 15.347 1.00 0.00 O ATOM 0 H ASP A 69 68.955 -3.496 13.748 1.00 0.00 H new ATOM 0 HA ASP A 69 66.939 -1.428 13.826 1.00 0.00 H new ATOM 0 HB2 ASP A 69 69.252 -1.626 15.059 1.00 0.00 H new ATOM 0 HB3 ASP A 69 69.950 -1.030 13.567 1.00 0.00 H new ATOM 1099 N PHE A 70 67.693 0.117 11.779 1.00 0.00 N ATOM 1100 CA PHE A 70 67.691 0.730 10.419 1.00 0.00 C ATOM 1101 C PHE A 70 69.073 0.602 9.765 1.00 0.00 C ATOM 1102 O PHE A 70 69.197 0.198 8.627 1.00 0.00 O ATOM 1103 CB PHE A 70 67.330 2.212 10.522 1.00 0.00 C ATOM 1104 CG PHE A 70 67.285 2.806 9.134 1.00 0.00 C ATOM 1105 CD1 PHE A 70 68.466 3.238 8.516 1.00 0.00 C ATOM 1106 CD2 PHE A 70 66.062 2.927 8.463 1.00 0.00 C ATOM 1107 CE1 PHE A 70 68.423 3.787 7.228 1.00 0.00 C ATOM 1108 CE2 PHE A 70 66.018 3.476 7.176 1.00 0.00 C ATOM 1109 CZ PHE A 70 67.199 3.906 6.559 1.00 0.00 C ATOM 0 H PHE A 70 67.510 0.767 12.543 1.00 0.00 H new ATOM 0 HA PHE A 70 66.956 0.206 9.809 1.00 0.00 H new ATOM 0 HB2 PHE A 70 66.364 2.331 11.014 1.00 0.00 H new ATOM 0 HB3 PHE A 70 68.065 2.737 11.132 1.00 0.00 H new ATOM 0 HD1 PHE A 70 69.410 3.148 9.033 1.00 0.00 H new ATOM 0 HD2 PHE A 70 65.151 2.596 8.939 1.00 0.00 H new ATOM 0 HE1 PHE A 70 69.334 4.118 6.751 1.00 0.00 H new ATOM 0 HE2 PHE A 70 65.074 3.568 6.660 1.00 0.00 H new ATOM 0 HZ PHE A 70 67.166 4.330 5.566 1.00 0.00 H new ATOM 1119 N GLN A 71 70.110 0.984 10.461 1.00 0.00 N ATOM 1120 CA GLN A 71 71.468 0.924 9.844 1.00 0.00 C ATOM 1121 C GLN A 71 71.788 -0.523 9.454 1.00 0.00 C ATOM 1122 O GLN A 71 72.123 -0.801 8.320 1.00 0.00 O ATOM 1123 CB GLN A 71 72.511 1.437 10.837 1.00 0.00 C ATOM 1124 CG GLN A 71 72.315 2.939 11.059 1.00 0.00 C ATOM 1125 CD GLN A 71 73.282 3.422 12.141 1.00 0.00 C ATOM 1126 OE1 GLN A 71 73.770 2.638 12.930 1.00 0.00 O ATOM 1127 NE2 GLN A 71 73.583 4.690 12.214 1.00 0.00 N ATOM 0 H GLN A 71 70.078 1.331 11.419 1.00 0.00 H new ATOM 0 HA GLN A 71 71.489 1.551 8.953 1.00 0.00 H new ATOM 0 HB2 GLN A 71 72.419 0.904 11.784 1.00 0.00 H new ATOM 0 HB3 GLN A 71 73.515 1.243 10.458 1.00 0.00 H new ATOM 0 HG2 GLN A 71 72.491 3.481 10.130 1.00 0.00 H new ATOM 0 HG3 GLN A 71 71.287 3.143 11.357 1.00 0.00 H new ATOM 0 HE21 GLN A 71 73.174 5.350 11.552 1.00 0.00 H new ATOM 0 HE22 GLN A 71 74.227 5.021 12.933 1.00 0.00 H new ATOM 1136 N GLU A 72 71.688 -1.449 10.367 1.00 0.00 N ATOM 1137 CA GLU A 72 71.992 -2.866 10.004 1.00 0.00 C ATOM 1138 C GLU A 72 71.028 -3.282 8.895 1.00 0.00 C ATOM 1139 O GLU A 72 71.402 -3.895 7.915 1.00 0.00 O ATOM 1140 CB GLU A 72 71.786 -3.761 11.229 1.00 0.00 C ATOM 1141 CG GLU A 72 72.883 -3.477 12.258 1.00 0.00 C ATOM 1142 CD GLU A 72 72.572 -4.231 13.553 1.00 0.00 C ATOM 1143 OE1 GLU A 72 72.989 -5.372 13.667 1.00 0.00 O ATOM 1144 OE2 GLU A 72 71.921 -3.655 14.410 1.00 0.00 O ATOM 0 H GLU A 72 71.413 -1.292 11.337 1.00 0.00 H new ATOM 0 HA GLU A 72 73.024 -2.963 9.667 1.00 0.00 H new ATOM 0 HB2 GLU A 72 70.805 -3.576 11.667 1.00 0.00 H new ATOM 0 HB3 GLU A 72 71.811 -4.810 10.935 1.00 0.00 H new ATOM 0 HG2 GLU A 72 73.852 -3.787 11.868 1.00 0.00 H new ATOM 0 HG3 GLU A 72 72.945 -2.406 12.453 1.00 0.00 H new ATOM 1151 N PHE A 73 69.783 -2.935 9.054 1.00 0.00 N ATOM 1152 CA PHE A 73 68.776 -3.294 8.018 1.00 0.00 C ATOM 1153 C PHE A 73 69.336 -2.881 6.654 1.00 0.00 C ATOM 1154 O PHE A 73 69.216 -3.595 5.677 1.00 0.00 O ATOM 1155 CB PHE A 73 67.454 -2.573 8.284 1.00 0.00 C ATOM 1156 CG PHE A 73 66.508 -2.843 7.142 1.00 0.00 C ATOM 1157 CD1 PHE A 73 65.652 -3.946 7.188 1.00 0.00 C ATOM 1158 CD2 PHE A 73 66.492 -1.987 6.035 1.00 0.00 C ATOM 1159 CE1 PHE A 73 64.776 -4.196 6.126 1.00 0.00 C ATOM 1160 CE2 PHE A 73 65.617 -2.235 4.973 1.00 0.00 C ATOM 1161 CZ PHE A 73 64.758 -3.340 5.018 1.00 0.00 C ATOM 0 H PHE A 73 69.419 -2.419 9.855 1.00 0.00 H new ATOM 0 HA PHE A 73 68.582 -4.366 8.041 1.00 0.00 H new ATOM 0 HB2 PHE A 73 67.019 -2.918 9.222 1.00 0.00 H new ATOM 0 HB3 PHE A 73 67.624 -1.501 8.386 1.00 0.00 H new ATOM 0 HD1 PHE A 73 65.666 -4.606 8.043 1.00 0.00 H new ATOM 0 HD2 PHE A 73 67.155 -1.135 6.001 1.00 0.00 H new ATOM 0 HE1 PHE A 73 64.114 -5.049 6.161 1.00 0.00 H new ATOM 0 HE2 PHE A 73 65.604 -1.575 4.118 1.00 0.00 H new ATOM 0 HZ PHE A 73 64.082 -3.532 4.198 1.00 0.00 H new ATOM 1171 N MET A 74 69.976 -1.745 6.595 1.00 0.00 N ATOM 1172 CA MET A 74 70.585 -1.292 5.313 1.00 0.00 C ATOM 1173 C MET A 74 71.681 -2.290 4.918 1.00 0.00 C ATOM 1174 O MET A 74 71.940 -2.520 3.755 1.00 0.00 O ATOM 1175 CB MET A 74 71.195 0.102 5.497 1.00 0.00 C ATOM 1176 CG MET A 74 71.590 0.673 4.135 1.00 0.00 C ATOM 1177 SD MET A 74 70.101 1.180 3.241 1.00 0.00 S ATOM 1178 CE MET A 74 70.728 0.891 1.570 1.00 0.00 C ATOM 0 H MET A 74 70.103 -1.109 7.382 1.00 0.00 H new ATOM 0 HA MET A 74 69.826 -1.243 4.533 1.00 0.00 H new ATOM 0 HB2 MET A 74 70.478 0.762 5.985 1.00 0.00 H new ATOM 0 HB3 MET A 74 72.069 0.045 6.146 1.00 0.00 H new ATOM 0 HG2 MET A 74 72.257 1.525 4.265 1.00 0.00 H new ATOM 0 HG3 MET A 74 72.136 -0.074 3.560 1.00 0.00 H new ATOM 0 HE1 MET A 74 69.956 1.144 0.843 1.00 0.00 H new ATOM 0 HE2 MET A 74 71.606 1.513 1.398 1.00 0.00 H new ATOM 0 HE3 MET A 74 71.000 -0.159 1.460 1.00 0.00 H new ATOM 1188 N ALA A 75 72.308 -2.909 5.885 1.00 0.00 N ATOM 1189 CA ALA A 75 73.357 -3.917 5.558 1.00 0.00 C ATOM 1190 C ALA A 75 72.668 -5.087 4.853 1.00 0.00 C ATOM 1191 O ALA A 75 73.065 -5.520 3.789 1.00 0.00 O ATOM 1192 CB ALA A 75 74.026 -4.407 6.845 1.00 0.00 C ATOM 0 H ALA A 75 72.140 -2.761 6.880 1.00 0.00 H new ATOM 0 HA ALA A 75 74.123 -3.480 4.918 1.00 0.00 H new ATOM 0 HB1 ALA A 75 74.791 -5.143 6.600 1.00 0.00 H new ATOM 0 HB2 ALA A 75 74.486 -3.563 7.360 1.00 0.00 H new ATOM 0 HB3 ALA A 75 73.278 -4.864 7.493 1.00 0.00 H new ATOM 1198 N PHE A 76 71.631 -5.592 5.459 1.00 0.00 N ATOM 1199 CA PHE A 76 70.885 -6.734 4.861 1.00 0.00 C ATOM 1200 C PHE A 76 70.517 -6.360 3.430 1.00 0.00 C ATOM 1201 O PHE A 76 70.611 -7.157 2.517 1.00 0.00 O ATOM 1202 CB PHE A 76 69.612 -6.985 5.674 1.00 0.00 C ATOM 1203 CG PHE A 76 68.843 -8.141 5.080 1.00 0.00 C ATOM 1204 CD1 PHE A 76 69.205 -9.454 5.399 1.00 0.00 C ATOM 1205 CD2 PHE A 76 67.771 -7.901 4.211 1.00 0.00 C ATOM 1206 CE1 PHE A 76 68.495 -10.529 4.850 1.00 0.00 C ATOM 1207 CE2 PHE A 76 67.059 -8.976 3.663 1.00 0.00 C ATOM 1208 CZ PHE A 76 67.422 -10.291 3.983 1.00 0.00 C ATOM 0 H PHE A 76 71.265 -5.260 6.351 1.00 0.00 H new ATOM 0 HA PHE A 76 71.494 -7.638 4.868 1.00 0.00 H new ATOM 0 HB2 PHE A 76 69.869 -7.202 6.711 1.00 0.00 H new ATOM 0 HB3 PHE A 76 68.991 -6.089 5.680 1.00 0.00 H new ATOM 0 HD1 PHE A 76 70.032 -9.639 6.069 1.00 0.00 H new ATOM 0 HD2 PHE A 76 67.493 -6.887 3.963 1.00 0.00 H new ATOM 0 HE1 PHE A 76 68.776 -11.543 5.096 1.00 0.00 H new ATOM 0 HE2 PHE A 76 66.231 -8.791 2.995 1.00 0.00 H new ATOM 0 HZ PHE A 76 66.874 -11.121 3.561 1.00 0.00 H new ATOM 1218 N VAL A 77 70.133 -5.134 3.230 1.00 0.00 N ATOM 1219 CA VAL A 77 69.799 -4.694 1.852 1.00 0.00 C ATOM 1220 C VAL A 77 71.060 -4.880 1.004 1.00 0.00 C ATOM 1221 O VAL A 77 71.010 -5.350 -0.115 1.00 0.00 O ATOM 1222 CB VAL A 77 69.366 -3.223 1.845 1.00 0.00 C ATOM 1223 CG1 VAL A 77 69.270 -2.725 0.400 1.00 0.00 C ATOM 1224 CG2 VAL A 77 67.998 -3.092 2.521 1.00 0.00 C ATOM 0 H VAL A 77 70.036 -4.423 3.955 1.00 0.00 H new ATOM 0 HA VAL A 77 68.971 -5.279 1.452 1.00 0.00 H new ATOM 0 HB VAL A 77 70.099 -2.626 2.387 1.00 0.00 H new ATOM 0 HG11 VAL A 77 68.962 -1.679 0.395 1.00 0.00 H new ATOM 0 HG12 VAL A 77 70.243 -2.819 -0.083 1.00 0.00 H new ATOM 0 HG13 VAL A 77 68.537 -3.322 -0.142 1.00 0.00 H new ATOM 0 HG21 VAL A 77 67.689 -2.047 2.517 1.00 0.00 H new ATOM 0 HG22 VAL A 77 67.265 -3.689 1.978 1.00 0.00 H new ATOM 0 HG23 VAL A 77 68.065 -3.446 3.550 1.00 0.00 H new ATOM 1234 N SER A 78 72.198 -4.515 1.542 1.00 0.00 N ATOM 1235 CA SER A 78 73.477 -4.668 0.788 1.00 0.00 C ATOM 1236 C SER A 78 73.844 -6.149 0.667 1.00 0.00 C ATOM 1237 O SER A 78 74.229 -6.618 -0.386 1.00 0.00 O ATOM 1238 CB SER A 78 74.592 -3.936 1.532 1.00 0.00 C ATOM 1239 OG SER A 78 74.994 -4.708 2.656 1.00 0.00 O ATOM 0 H SER A 78 72.294 -4.116 2.476 1.00 0.00 H new ATOM 0 HA SER A 78 73.354 -4.247 -0.210 1.00 0.00 H new ATOM 0 HB2 SER A 78 75.440 -3.771 0.868 1.00 0.00 H new ATOM 0 HB3 SER A 78 74.245 -2.955 1.856 1.00 0.00 H new ATOM 0 HG SER A 78 74.208 -4.935 3.195 1.00 0.00 H new ATOM 1245 N MET A 79 73.759 -6.885 1.742 1.00 0.00 N ATOM 1246 CA MET A 79 74.138 -8.327 1.688 1.00 0.00 C ATOM 1247 C MET A 79 73.394 -8.993 0.535 1.00 0.00 C ATOM 1248 O MET A 79 73.944 -9.795 -0.194 1.00 0.00 O ATOM 1249 CB MET A 79 73.761 -9.010 3.006 1.00 0.00 C ATOM 1250 CG MET A 79 74.292 -10.445 3.011 1.00 0.00 C ATOM 1251 SD MET A 79 73.860 -11.242 4.579 1.00 0.00 S ATOM 1252 CE MET A 79 74.784 -12.776 4.318 1.00 0.00 C ATOM 0 H MET A 79 73.444 -6.552 2.653 1.00 0.00 H new ATOM 0 HA MET A 79 75.213 -8.418 1.535 1.00 0.00 H new ATOM 0 HB2 MET A 79 74.177 -8.455 3.847 1.00 0.00 H new ATOM 0 HB3 MET A 79 72.678 -9.012 3.129 1.00 0.00 H new ATOM 0 HG2 MET A 79 73.868 -11.004 2.177 1.00 0.00 H new ATOM 0 HG3 MET A 79 75.374 -10.445 2.877 1.00 0.00 H new ATOM 0 HE1 MET A 79 74.656 -13.429 5.181 1.00 0.00 H new ATOM 0 HE2 MET A 79 74.412 -13.278 3.425 1.00 0.00 H new ATOM 0 HE3 MET A 79 75.842 -12.546 4.191 1.00 0.00 H new ATOM 1262 N VAL A 80 72.159 -8.648 0.347 1.00 0.00 N ATOM 1263 CA VAL A 80 71.389 -9.234 -0.780 1.00 0.00 C ATOM 1264 C VAL A 80 71.991 -8.715 -2.089 1.00 0.00 C ATOM 1265 O VAL A 80 71.947 -9.370 -3.111 1.00 0.00 O ATOM 1266 CB VAL A 80 69.921 -8.817 -0.665 1.00 0.00 C ATOM 1267 CG1 VAL A 80 69.170 -9.209 -1.940 1.00 0.00 C ATOM 1268 CG2 VAL A 80 69.288 -9.525 0.535 1.00 0.00 C ATOM 0 H VAL A 80 71.645 -7.983 0.926 1.00 0.00 H new ATOM 0 HA VAL A 80 71.441 -10.323 -0.757 1.00 0.00 H new ATOM 0 HB VAL A 80 69.861 -7.737 -0.530 1.00 0.00 H new ATOM 0 HG11 VAL A 80 68.125 -8.910 -1.853 1.00 0.00 H new ATOM 0 HG12 VAL A 80 69.621 -8.708 -2.797 1.00 0.00 H new ATOM 0 HG13 VAL A 80 69.228 -10.289 -2.079 1.00 0.00 H new ATOM 0 HG21 VAL A 80 68.242 -9.231 0.621 1.00 0.00 H new ATOM 0 HG22 VAL A 80 69.351 -10.604 0.396 1.00 0.00 H new ATOM 0 HG23 VAL A 80 69.819 -9.245 1.445 1.00 0.00 H new ATOM 1278 N THR A 81 72.582 -7.549 -2.048 1.00 0.00 N ATOM 1279 CA THR A 81 73.222 -6.990 -3.273 1.00 0.00 C ATOM 1280 C THR A 81 74.594 -7.646 -3.456 1.00 0.00 C ATOM 1281 O THR A 81 74.931 -8.127 -4.519 1.00 0.00 O ATOM 1282 CB THR A 81 73.395 -5.475 -3.117 1.00 0.00 C ATOM 1283 OG1 THR A 81 72.160 -4.897 -2.722 1.00 0.00 O ATOM 1284 CG2 THR A 81 73.837 -4.871 -4.451 1.00 0.00 C ATOM 0 H THR A 81 72.648 -6.960 -1.218 1.00 0.00 H new ATOM 0 HA THR A 81 72.596 -7.190 -4.142 1.00 0.00 H new ATOM 0 HB THR A 81 74.151 -5.272 -2.359 1.00 0.00 H new ATOM 0 HG1 THR A 81 71.986 -5.109 -1.781 1.00 0.00 H new ATOM 0 HG21 THR A 81 73.960 -3.794 -4.340 1.00 0.00 H new ATOM 0 HG22 THR A 81 74.785 -5.315 -4.755 1.00 0.00 H new ATOM 0 HG23 THR A 81 73.082 -5.073 -5.210 1.00 0.00 H new ATOM 1292 N THR A 82 75.381 -7.675 -2.412 1.00 0.00 N ATOM 1293 CA THR A 82 76.728 -8.301 -2.490 1.00 0.00 C ATOM 1294 C THR A 82 76.576 -9.816 -2.620 1.00 0.00 C ATOM 1295 O THR A 82 77.509 -10.517 -2.958 1.00 0.00 O ATOM 1296 CB THR A 82 77.511 -7.985 -1.214 1.00 0.00 C ATOM 1297 OG1 THR A 82 76.872 -8.600 -0.107 1.00 0.00 O ATOM 1298 CG2 THR A 82 77.561 -6.474 -0.997 1.00 0.00 C ATOM 0 H THR A 82 75.142 -7.286 -1.500 1.00 0.00 H new ATOM 0 HA THR A 82 77.261 -7.908 -3.356 1.00 0.00 H new ATOM 0 HB THR A 82 78.527 -8.367 -1.311 1.00 0.00 H new ATOM 0 HG1 THR A 82 77.372 -8.400 0.712 1.00 0.00 H new ATOM 0 HG21 THR A 82 78.120 -6.255 -0.087 1.00 0.00 H new ATOM 0 HG22 THR A 82 78.052 -6.000 -1.847 1.00 0.00 H new ATOM 0 HG23 THR A 82 76.547 -6.086 -0.902 1.00 0.00 H new ATOM 1306 N ALA A 83 75.405 -10.326 -2.357 1.00 0.00 N ATOM 1307 CA ALA A 83 75.192 -11.794 -2.472 1.00 0.00 C ATOM 1308 C ALA A 83 75.200 -12.193 -3.949 1.00 0.00 C ATOM 1309 O ALA A 83 75.825 -13.159 -4.342 1.00 0.00 O ATOM 1310 CB ALA A 83 73.845 -12.155 -1.849 1.00 0.00 C ATOM 0 H ALA A 83 74.587 -9.789 -2.068 1.00 0.00 H new ATOM 0 HA ALA A 83 75.988 -12.325 -1.951 1.00 0.00 H new ATOM 0 HB1 ALA A 83 73.683 -13.230 -1.930 1.00 0.00 H new ATOM 0 HB2 ALA A 83 73.841 -11.866 -0.798 1.00 0.00 H new ATOM 0 HB3 ALA A 83 73.048 -11.627 -2.374 1.00 0.00 H new ATOM 1316 N CYS A 84 74.512 -11.451 -4.772 1.00 0.00 N ATOM 1317 CA CYS A 84 74.477 -11.779 -6.224 1.00 0.00 C ATOM 1318 C CYS A 84 75.765 -11.282 -6.881 1.00 0.00 C ATOM 1319 O CYS A 84 76.370 -10.328 -6.435 1.00 0.00 O ATOM 1320 CB CYS A 84 73.271 -11.097 -6.875 1.00 0.00 C ATOM 1321 SG CYS A 84 71.744 -11.782 -6.184 1.00 0.00 S ATOM 0 H CYS A 84 73.971 -10.630 -4.500 1.00 0.00 H new ATOM 0 HA CYS A 84 74.392 -12.858 -6.355 1.00 0.00 H new ATOM 0 HB2 CYS A 84 73.311 -10.022 -6.702 1.00 0.00 H new ATOM 0 HB3 CYS A 84 73.294 -11.247 -7.954 1.00 0.00 H new ATOM 0 HG CYS A 84 70.720 -11.202 -6.735 1.00 0.00 H new ATOM 1327 N HIS A 85 76.193 -11.921 -7.934 1.00 0.00 N ATOM 1328 CA HIS A 85 77.445 -11.479 -8.608 1.00 0.00 C ATOM 1329 C HIS A 85 77.202 -10.138 -9.300 1.00 0.00 C ATOM 1330 O HIS A 85 76.102 -9.834 -9.718 1.00 0.00 O ATOM 1331 CB HIS A 85 77.865 -12.523 -9.645 1.00 0.00 C ATOM 1332 CG HIS A 85 78.173 -13.823 -8.953 1.00 0.00 C ATOM 1333 ND1 HIS A 85 79.287 -13.984 -8.141 1.00 0.00 N ATOM 1334 CD2 HIS A 85 77.523 -15.035 -8.944 1.00 0.00 C ATOM 1335 CE1 HIS A 85 79.276 -15.250 -7.682 1.00 0.00 C ATOM 1336 NE2 HIS A 85 78.223 -15.929 -8.142 1.00 0.00 N ATOM 0 H HIS A 85 75.732 -12.727 -8.356 1.00 0.00 H new ATOM 0 HA HIS A 85 78.237 -11.368 -7.868 1.00 0.00 H new ATOM 0 HB2 HIS A 85 77.068 -12.667 -10.375 1.00 0.00 H new ATOM 0 HB3 HIS A 85 78.740 -12.175 -10.193 1.00 0.00 H new ATOM 0 HD2 HIS A 85 76.611 -15.258 -9.477 1.00 0.00 H new ATOM 0 HE1 HIS A 85 80.026 -15.664 -7.024 1.00 0.00 H new ATOM 0 HE2 HIS A 85 77.982 -16.901 -7.946 1.00 0.00 H new ATOM 1345 N GLU A 86 78.217 -9.326 -9.414 1.00 0.00 N ATOM 1346 CA GLU A 86 78.040 -7.999 -10.069 1.00 0.00 C ATOM 1347 C GLU A 86 77.564 -8.201 -11.509 1.00 0.00 C ATOM 1348 O GLU A 86 76.717 -7.481 -12.000 1.00 0.00 O ATOM 1349 CB GLU A 86 79.376 -7.250 -10.065 1.00 0.00 C ATOM 1350 CG GLU A 86 79.199 -5.865 -10.697 1.00 0.00 C ATOM 1351 CD GLU A 86 80.540 -5.128 -10.689 1.00 0.00 C ATOM 1352 OE1 GLU A 86 81.459 -5.620 -10.055 1.00 0.00 O ATOM 1353 OE2 GLU A 86 80.627 -4.087 -11.318 1.00 0.00 O ATOM 0 H GLU A 86 79.161 -9.524 -9.082 1.00 0.00 H new ATOM 0 HA GLU A 86 77.297 -7.416 -9.524 1.00 0.00 H new ATOM 0 HB2 GLU A 86 79.743 -7.149 -9.044 1.00 0.00 H new ATOM 0 HB3 GLU A 86 80.124 -7.819 -10.618 1.00 0.00 H new ATOM 0 HG2 GLU A 86 78.832 -5.963 -11.718 1.00 0.00 H new ATOM 0 HG3 GLU A 86 78.454 -5.293 -10.144 1.00 0.00 H new ATOM 1360 N PHE A 87 78.102 -9.177 -12.188 1.00 0.00 N ATOM 1361 CA PHE A 87 77.685 -9.432 -13.597 1.00 0.00 C ATOM 1362 C PHE A 87 76.465 -10.353 -13.607 1.00 0.00 C ATOM 1363 O PHE A 87 76.452 -11.384 -12.963 1.00 0.00 O ATOM 1364 CB PHE A 87 78.830 -10.103 -14.358 1.00 0.00 C ATOM 1365 CG PHE A 87 79.968 -9.124 -14.526 1.00 0.00 C ATOM 1366 CD1 PHE A 87 80.013 -8.295 -15.652 1.00 0.00 C ATOM 1367 CD2 PHE A 87 80.974 -9.046 -13.557 1.00 0.00 C ATOM 1368 CE1 PHE A 87 81.067 -7.385 -15.809 1.00 0.00 C ATOM 1369 CE2 PHE A 87 82.028 -8.137 -13.714 1.00 0.00 C ATOM 1370 CZ PHE A 87 82.074 -7.307 -14.840 1.00 0.00 C ATOM 0 H PHE A 87 78.815 -9.811 -11.827 1.00 0.00 H new ATOM 0 HA PHE A 87 77.435 -8.486 -14.076 1.00 0.00 H new ATOM 0 HB2 PHE A 87 79.172 -10.985 -13.817 1.00 0.00 H new ATOM 0 HB3 PHE A 87 78.482 -10.443 -15.333 1.00 0.00 H new ATOM 0 HD1 PHE A 87 79.236 -8.356 -16.400 1.00 0.00 H new ATOM 0 HD2 PHE A 87 80.938 -9.686 -12.688 1.00 0.00 H new ATOM 0 HE1 PHE A 87 81.102 -6.744 -16.677 1.00 0.00 H new ATOM 0 HE2 PHE A 87 82.805 -8.077 -12.966 1.00 0.00 H new ATOM 0 HZ PHE A 87 82.887 -6.606 -14.961 1.00 0.00 H new ATOM 1380 N PHE A 88 75.437 -9.995 -14.336 1.00 0.00 N ATOM 1381 CA PHE A 88 74.213 -10.853 -14.394 1.00 0.00 C ATOM 1382 C PHE A 88 73.677 -10.878 -15.828 1.00 0.00 C ATOM 1383 O PHE A 88 72.869 -11.712 -16.184 1.00 0.00 O ATOM 1384 CB PHE A 88 73.144 -10.270 -13.467 1.00 0.00 C ATOM 1385 CG PHE A 88 71.911 -11.139 -13.514 1.00 0.00 C ATOM 1386 CD1 PHE A 88 70.911 -10.883 -14.459 1.00 0.00 C ATOM 1387 CD2 PHE A 88 71.769 -12.202 -12.614 1.00 0.00 C ATOM 1388 CE1 PHE A 88 69.769 -11.691 -14.505 1.00 0.00 C ATOM 1389 CE2 PHE A 88 70.626 -13.010 -12.660 1.00 0.00 C ATOM 1390 CZ PHE A 88 69.626 -12.754 -13.605 1.00 0.00 C ATOM 0 H PHE A 88 75.393 -9.143 -14.895 1.00 0.00 H new ATOM 0 HA PHE A 88 74.462 -11.866 -14.079 1.00 0.00 H new ATOM 0 HB2 PHE A 88 73.524 -10.213 -12.447 1.00 0.00 H new ATOM 0 HB3 PHE A 88 72.897 -9.253 -13.772 1.00 0.00 H new ATOM 0 HD1 PHE A 88 71.020 -10.062 -15.152 1.00 0.00 H new ATOM 0 HD2 PHE A 88 72.541 -12.399 -11.884 1.00 0.00 H new ATOM 0 HE1 PHE A 88 68.998 -11.494 -15.235 1.00 0.00 H new ATOM 0 HE2 PHE A 88 70.516 -13.830 -11.966 1.00 0.00 H new ATOM 0 HZ PHE A 88 68.744 -13.376 -13.640 1.00 0.00 H new ATOM 1400 N GLU A 89 74.116 -9.961 -16.653 1.00 0.00 N ATOM 1401 CA GLU A 89 73.631 -9.915 -18.069 1.00 0.00 C ATOM 1402 C GLU A 89 74.669 -10.558 -18.991 1.00 0.00 C ATOM 1403 O GLU A 89 75.806 -10.135 -19.054 1.00 0.00 O ATOM 1404 CB GLU A 89 73.420 -8.458 -18.482 1.00 0.00 C ATOM 1405 CG GLU A 89 72.327 -7.837 -17.611 1.00 0.00 C ATOM 1406 CD GLU A 89 72.112 -6.379 -18.019 1.00 0.00 C ATOM 1407 OE1 GLU A 89 72.913 -5.878 -18.791 1.00 0.00 O ATOM 1408 OE2 GLU A 89 71.153 -5.788 -17.552 1.00 0.00 O ATOM 0 H GLU A 89 74.793 -9.238 -16.407 1.00 0.00 H new ATOM 0 HA GLU A 89 72.691 -10.461 -18.148 1.00 0.00 H new ATOM 0 HB2 GLU A 89 74.349 -7.899 -18.372 1.00 0.00 H new ATOM 0 HB3 GLU A 89 73.137 -8.404 -19.533 1.00 0.00 H new ATOM 0 HG2 GLU A 89 71.398 -8.397 -17.721 1.00 0.00 H new ATOM 0 HG3 GLU A 89 72.610 -7.893 -16.560 1.00 0.00 H new ATOM 1415 N HIS A 90 74.287 -11.576 -19.710 1.00 0.00 N ATOM 1416 CA HIS A 90 75.251 -12.243 -20.629 1.00 0.00 C ATOM 1417 C HIS A 90 75.618 -11.279 -21.758 1.00 0.00 C ATOM 1418 O HIS A 90 76.757 -11.198 -22.175 1.00 0.00 O ATOM 1419 CB HIS A 90 74.605 -13.499 -21.213 1.00 0.00 C ATOM 1420 CG HIS A 90 74.460 -14.530 -20.129 1.00 0.00 C ATOM 1421 ND1 HIS A 90 75.547 -15.211 -19.599 1.00 0.00 N ATOM 1422 CD2 HIS A 90 73.359 -15.000 -19.455 1.00 0.00 C ATOM 1423 CE1 HIS A 90 75.080 -16.044 -18.650 1.00 0.00 C ATOM 1424 NE2 HIS A 90 73.755 -15.952 -18.525 1.00 0.00 N ATOM 0 H HIS A 90 73.348 -11.975 -19.701 1.00 0.00 H new ATOM 0 HA HIS A 90 76.152 -12.521 -20.082 1.00 0.00 H new ATOM 0 HB2 HIS A 90 73.629 -13.258 -21.635 1.00 0.00 H new ATOM 0 HB3 HIS A 90 75.216 -13.892 -22.026 1.00 0.00 H new ATOM 0 HD2 HIS A 90 72.342 -14.678 -19.623 1.00 0.00 H new ATOM 0 HE1 HIS A 90 75.701 -16.705 -18.063 1.00 0.00 H new ATOM 0 HE2 HIS A 90 73.158 -16.472 -17.881 1.00 0.00 H new ATOM 1433 N GLU A 91 74.661 -10.548 -22.255 1.00 0.00 N ATOM 1434 CA GLU A 91 74.949 -9.583 -23.354 1.00 0.00 C ATOM 1435 C GLU A 91 73.762 -8.634 -23.522 1.00 0.00 C ATOM 1436 O GLU A 91 73.614 -7.750 -22.694 1.00 0.00 O ATOM 1437 CB GLU A 91 75.182 -10.346 -24.661 1.00 0.00 C ATOM 1438 CG GLU A 91 75.647 -9.369 -25.744 1.00 0.00 C ATOM 1439 CD GLU A 91 76.028 -10.145 -27.006 1.00 0.00 C ATOM 1440 OE1 GLU A 91 76.012 -11.363 -26.956 1.00 0.00 O ATOM 1441 OE2 GLU A 91 76.327 -9.506 -28.002 1.00 0.00 O ATOM 1442 OXT GLU A 91 73.022 -8.804 -24.476 1.00 0.00 O ATOM 0 H GLU A 91 73.689 -10.576 -21.948 1.00 0.00 H new ATOM 0 HA GLU A 91 75.842 -9.009 -23.107 1.00 0.00 H new ATOM 0 HB2 GLU A 91 75.930 -11.124 -24.512 1.00 0.00 H new ATOM 0 HB3 GLU A 91 74.264 -10.843 -24.974 1.00 0.00 H new ATOM 0 HG2 GLU A 91 74.854 -8.656 -25.969 1.00 0.00 H new ATOM 0 HG3 GLU A 91 76.501 -8.794 -25.387 1.00 0.00 H new TER 1449 GLU A 91 ATOM 1450 N SER B 1 59.418 -6.764 -8.284 1.00 0.00 N ATOM 1451 CA SER B 1 58.927 -5.822 -7.237 1.00 0.00 C ATOM 1452 C SER B 1 59.602 -4.463 -7.415 1.00 0.00 C ATOM 1453 O SER B 1 60.640 -4.351 -8.036 1.00 0.00 O ATOM 1454 CB SER B 1 59.277 -6.368 -5.856 1.00 0.00 C ATOM 1455 OG SER B 1 60.671 -6.200 -5.633 1.00 0.00 O ATOM 0 H1 SER B 1 58.703 -6.853 -9.034 1.00 0.00 H new ATOM 0 H2 SER B 1 60.303 -6.400 -8.691 1.00 0.00 H new ATOM 0 H3 SER B 1 59.591 -7.697 -7.858 1.00 0.00 H new ATOM 0 HA SER B 1 57.846 -5.714 -7.331 1.00 0.00 H new ATOM 0 HB2 SER B 1 58.707 -5.845 -5.088 1.00 0.00 H new ATOM 0 HB3 SER B 1 59.009 -7.422 -5.789 1.00 0.00 H new ATOM 0 HG SER B 1 60.905 -6.547 -4.747 1.00 0.00 H new ATOM 1463 N GLU B 2 59.021 -3.425 -6.881 1.00 0.00 N ATOM 1464 CA GLU B 2 59.627 -2.073 -7.023 1.00 0.00 C ATOM 1465 C GLU B 2 60.941 -2.004 -6.245 1.00 0.00 C ATOM 1466 O GLU B 2 61.854 -1.291 -6.612 1.00 0.00 O ATOM 1467 CB GLU B 2 58.650 -1.032 -6.471 1.00 0.00 C ATOM 1468 CG GLU B 2 58.361 -1.325 -4.992 1.00 0.00 C ATOM 1469 CD GLU B 2 57.367 -0.295 -4.453 1.00 0.00 C ATOM 1470 OE1 GLU B 2 57.186 0.722 -5.102 1.00 0.00 O ATOM 1471 OE2 GLU B 2 56.805 -0.540 -3.399 1.00 0.00 O ATOM 0 H GLU B 2 58.150 -3.456 -6.351 1.00 0.00 H new ATOM 0 HA GLU B 2 59.830 -1.873 -8.075 1.00 0.00 H new ATOM 0 HB2 GLU B 2 59.071 -0.032 -6.578 1.00 0.00 H new ATOM 0 HB3 GLU B 2 57.722 -1.051 -7.043 1.00 0.00 H new ATOM 0 HG2 GLU B 2 57.955 -2.330 -4.882 1.00 0.00 H new ATOM 0 HG3 GLU B 2 59.286 -1.290 -4.416 1.00 0.00 H new ATOM 1478 N LEU B 3 61.053 -2.747 -5.181 1.00 0.00 N ATOM 1479 CA LEU B 3 62.310 -2.746 -4.381 1.00 0.00 C ATOM 1480 C LEU B 3 63.431 -3.433 -5.165 1.00 0.00 C ATOM 1481 O LEU B 3 64.577 -3.036 -5.108 1.00 0.00 O ATOM 1482 CB LEU B 3 62.061 -3.504 -3.070 1.00 0.00 C ATOM 1483 CG LEU B 3 63.331 -3.535 -2.203 1.00 0.00 C ATOM 1484 CD1 LEU B 3 63.735 -2.111 -1.798 1.00 0.00 C ATOM 1485 CD2 LEU B 3 63.052 -4.369 -0.947 1.00 0.00 C ATOM 0 H LEU B 3 60.320 -3.362 -4.827 1.00 0.00 H new ATOM 0 HA LEU B 3 62.608 -1.719 -4.169 1.00 0.00 H new ATOM 0 HB2 LEU B 3 61.251 -3.027 -2.518 1.00 0.00 H new ATOM 0 HB3 LEU B 3 61.741 -4.523 -3.290 1.00 0.00 H new ATOM 0 HG LEU B 3 64.148 -3.978 -2.773 1.00 0.00 H new ATOM 0 HD11 LEU B 3 64.635 -2.149 -1.185 1.00 0.00 H new ATOM 0 HD12 LEU B 3 63.930 -1.520 -2.693 1.00 0.00 H new ATOM 0 HD13 LEU B 3 62.927 -1.652 -1.228 1.00 0.00 H new ATOM 0 HD21 LEU B 3 63.946 -4.398 -0.324 1.00 0.00 H new ATOM 0 HD22 LEU B 3 62.233 -3.919 -0.386 1.00 0.00 H new ATOM 0 HD23 LEU B 3 62.779 -5.383 -1.237 1.00 0.00 H new ATOM 1497 N GLU B 4 63.109 -4.471 -5.888 1.00 0.00 N ATOM 1498 CA GLU B 4 64.155 -5.194 -6.665 1.00 0.00 C ATOM 1499 C GLU B 4 64.739 -4.272 -7.736 1.00 0.00 C ATOM 1500 O GLU B 4 65.931 -4.253 -7.964 1.00 0.00 O ATOM 1501 CB GLU B 4 63.522 -6.427 -7.319 1.00 0.00 C ATOM 1502 CG GLU B 4 64.584 -7.222 -8.081 1.00 0.00 C ATOM 1503 CD GLU B 4 63.934 -8.454 -8.712 1.00 0.00 C ATOM 1504 OE1 GLU B 4 62.790 -8.727 -8.384 1.00 0.00 O ATOM 1505 OE2 GLU B 4 64.589 -9.103 -9.508 1.00 0.00 O ATOM 0 H GLU B 4 62.166 -4.850 -5.974 1.00 0.00 H new ATOM 0 HA GLU B 4 64.960 -5.506 -6.000 1.00 0.00 H new ATOM 0 HB2 GLU B 4 63.062 -7.057 -6.557 1.00 0.00 H new ATOM 0 HB3 GLU B 4 62.728 -6.120 -8.000 1.00 0.00 H new ATOM 0 HG2 GLU B 4 65.037 -6.600 -8.853 1.00 0.00 H new ATOM 0 HG3 GLU B 4 65.384 -7.524 -7.405 1.00 0.00 H new ATOM 1512 N LYS B 5 63.914 -3.512 -8.396 1.00 0.00 N ATOM 1513 CA LYS B 5 64.430 -2.597 -9.454 1.00 0.00 C ATOM 1514 C LYS B 5 65.428 -1.610 -8.848 1.00 0.00 C ATOM 1515 O LYS B 5 66.441 -1.295 -9.441 1.00 0.00 O ATOM 1516 CB LYS B 5 63.259 -1.832 -10.085 1.00 0.00 C ATOM 1517 CG LYS B 5 63.780 -0.897 -11.183 1.00 0.00 C ATOM 1518 CD LYS B 5 62.607 -0.166 -11.841 1.00 0.00 C ATOM 1519 CE LYS B 5 63.138 0.767 -12.930 1.00 0.00 C ATOM 1520 NZ LYS B 5 62.014 1.203 -13.805 1.00 0.00 N ATOM 0 H LYS B 5 62.905 -3.483 -8.250 1.00 0.00 H new ATOM 0 HA LYS B 5 64.935 -3.183 -10.222 1.00 0.00 H new ATOM 0 HB2 LYS B 5 62.538 -2.534 -10.504 1.00 0.00 H new ATOM 0 HB3 LYS B 5 62.736 -1.256 -9.322 1.00 0.00 H new ATOM 0 HG2 LYS B 5 64.478 -0.175 -10.758 1.00 0.00 H new ATOM 0 HG3 LYS B 5 64.329 -1.469 -11.931 1.00 0.00 H new ATOM 0 HD2 LYS B 5 61.910 -0.886 -12.271 1.00 0.00 H new ATOM 0 HD3 LYS B 5 62.055 0.405 -11.095 1.00 0.00 H new ATOM 0 HE2 LYS B 5 63.618 1.635 -12.478 1.00 0.00 H new ATOM 0 HE3 LYS B 5 63.897 0.256 -13.523 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 62.376 1.837 -14.545 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 61.575 0.370 -14.247 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 61.305 1.706 -13.234 1.00 0.00 H new ATOM 1534 N ALA B 6 65.151 -1.116 -7.674 1.00 0.00 N ATOM 1535 CA ALA B 6 66.089 -0.147 -7.040 1.00 0.00 C ATOM 1536 C ALA B 6 67.453 -0.811 -6.849 1.00 0.00 C ATOM 1537 O ALA B 6 68.475 -0.278 -7.232 1.00 0.00 O ATOM 1538 CB ALA B 6 65.537 0.286 -5.681 1.00 0.00 C ATOM 0 H ALA B 6 64.319 -1.340 -7.127 1.00 0.00 H new ATOM 0 HA ALA B 6 66.196 0.728 -7.682 1.00 0.00 H new ATOM 0 HB1 ALA B 6 66.224 0.995 -5.218 1.00 0.00 H new ATOM 0 HB2 ALA B 6 64.565 0.759 -5.817 1.00 0.00 H new ATOM 0 HB3 ALA B 6 65.428 -0.587 -5.037 1.00 0.00 H new ATOM 1544 N MET B 7 67.475 -1.976 -6.259 1.00 0.00 N ATOM 1545 CA MET B 7 68.770 -2.681 -6.044 1.00 0.00 C ATOM 1546 C MET B 7 69.438 -2.941 -7.395 1.00 0.00 C ATOM 1547 O MET B 7 70.601 -2.655 -7.596 1.00 0.00 O ATOM 1548 CB MET B 7 68.490 -4.011 -5.346 1.00 0.00 C ATOM 1549 CG MET B 7 69.803 -4.649 -4.892 1.00 0.00 C ATOM 1550 SD MET B 7 69.456 -6.266 -4.158 1.00 0.00 S ATOM 1551 CE MET B 7 68.514 -5.677 -2.726 1.00 0.00 C ATOM 0 H MET B 7 66.651 -2.470 -5.917 1.00 0.00 H new ATOM 0 HA MET B 7 69.432 -2.071 -5.430 1.00 0.00 H new ATOM 0 HB2 MET B 7 67.838 -3.850 -4.487 1.00 0.00 H new ATOM 0 HB3 MET B 7 67.964 -4.684 -6.024 1.00 0.00 H new ATOM 0 HG2 MET B 7 70.480 -4.759 -5.739 1.00 0.00 H new ATOM 0 HG3 MET B 7 70.302 -4.006 -4.166 1.00 0.00 H new ATOM 0 HE1 MET B 7 68.604 -6.395 -1.911 1.00 0.00 H new ATOM 0 HE2 MET B 7 68.906 -4.712 -2.405 1.00 0.00 H new ATOM 0 HE3 MET B 7 67.465 -5.570 -3.000 1.00 0.00 H new ATOM 1561 N VAL B 8 68.702 -3.495 -8.317 1.00 0.00 N ATOM 1562 CA VAL B 8 69.267 -3.799 -9.661 1.00 0.00 C ATOM 1563 C VAL B 8 69.748 -2.503 -10.315 1.00 0.00 C ATOM 1564 O VAL B 8 70.777 -2.468 -10.962 1.00 0.00 O ATOM 1565 CB VAL B 8 68.178 -4.447 -10.523 1.00 0.00 C ATOM 1566 CG1 VAL B 8 68.674 -4.589 -11.965 1.00 0.00 C ATOM 1567 CG2 VAL B 8 67.838 -5.831 -9.955 1.00 0.00 C ATOM 0 H VAL B 8 67.723 -3.753 -8.195 1.00 0.00 H new ATOM 0 HA VAL B 8 70.110 -4.483 -9.566 1.00 0.00 H new ATOM 0 HB VAL B 8 67.287 -3.820 -10.513 1.00 0.00 H new ATOM 0 HG11 VAL B 8 67.896 -5.050 -12.574 1.00 0.00 H new ATOM 0 HG12 VAL B 8 68.913 -3.604 -12.366 1.00 0.00 H new ATOM 0 HG13 VAL B 8 69.567 -5.214 -11.983 1.00 0.00 H new ATOM 0 HG21 VAL B 8 67.064 -6.295 -10.566 1.00 0.00 H new ATOM 0 HG22 VAL B 8 68.730 -6.457 -9.963 1.00 0.00 H new ATOM 0 HG23 VAL B 8 67.478 -5.726 -8.931 1.00 0.00 H new ATOM 1577 N ALA B 9 69.009 -1.439 -10.162 1.00 0.00 N ATOM 1578 CA ALA B 9 69.422 -0.154 -10.785 1.00 0.00 C ATOM 1579 C ALA B 9 70.791 0.269 -10.243 1.00 0.00 C ATOM 1580 O ALA B 9 71.632 0.751 -10.972 1.00 0.00 O ATOM 1581 CB ALA B 9 68.381 0.927 -10.455 1.00 0.00 C ATOM 0 H ALA B 9 68.138 -1.406 -9.633 1.00 0.00 H new ATOM 0 HA ALA B 9 69.489 -0.280 -11.866 1.00 0.00 H new ATOM 0 HB1 ALA B 9 68.680 1.871 -10.910 1.00 0.00 H new ATOM 0 HB2 ALA B 9 67.409 0.627 -10.846 1.00 0.00 H new ATOM 0 HB3 ALA B 9 68.315 1.050 -9.374 1.00 0.00 H new ATOM 1587 N LEU B 10 71.017 0.104 -8.970 1.00 0.00 N ATOM 1588 CA LEU B 10 72.331 0.514 -8.384 1.00 0.00 C ATOM 1589 C LEU B 10 73.493 -0.248 -9.039 1.00 0.00 C ATOM 1590 O LEU B 10 74.515 0.327 -9.359 1.00 0.00 O ATOM 1591 CB LEU B 10 72.336 0.217 -6.882 1.00 0.00 C ATOM 1592 CG LEU B 10 71.384 1.169 -6.145 1.00 0.00 C ATOM 1593 CD1 LEU B 10 71.245 0.701 -4.693 1.00 0.00 C ATOM 1594 CD2 LEU B 10 71.925 2.616 -6.180 1.00 0.00 C ATOM 0 H LEU B 10 70.352 -0.296 -8.308 1.00 0.00 H new ATOM 0 HA LEU B 10 72.462 1.581 -8.564 1.00 0.00 H new ATOM 0 HB2 LEU B 10 72.034 -0.816 -6.708 1.00 0.00 H new ATOM 0 HB3 LEU B 10 73.346 0.325 -6.487 1.00 0.00 H new ATOM 0 HG LEU B 10 70.411 1.157 -6.637 1.00 0.00 H new ATOM 0 HD11 LEU B 10 70.571 1.370 -4.158 1.00 0.00 H new ATOM 0 HD12 LEU B 10 70.842 -0.312 -4.674 1.00 0.00 H new ATOM 0 HD13 LEU B 10 72.223 0.712 -4.212 1.00 0.00 H new ATOM 0 HD21 LEU B 10 71.236 3.275 -5.652 1.00 0.00 H new ATOM 0 HD22 LEU B 10 72.902 2.651 -5.697 1.00 0.00 H new ATOM 0 HD23 LEU B 10 72.020 2.944 -7.215 1.00 0.00 H new ATOM 1606 N ILE B 11 73.361 -1.532 -9.231 1.00 0.00 N ATOM 1607 CA ILE B 11 74.482 -2.303 -9.850 1.00 0.00 C ATOM 1608 C ILE B 11 74.774 -1.739 -11.240 1.00 0.00 C ATOM 1609 O ILE B 11 75.904 -1.457 -11.581 1.00 0.00 O ATOM 1610 CB ILE B 11 74.101 -3.780 -9.957 1.00 0.00 C ATOM 1611 CG1 ILE B 11 73.945 -4.362 -8.550 1.00 0.00 C ATOM 1612 CG2 ILE B 11 75.206 -4.540 -10.697 1.00 0.00 C ATOM 1613 CD1 ILE B 11 73.313 -5.754 -8.633 1.00 0.00 C ATOM 0 H ILE B 11 72.534 -2.079 -8.989 1.00 0.00 H new ATOM 0 HA ILE B 11 75.372 -2.214 -9.227 1.00 0.00 H new ATOM 0 HB ILE B 11 73.163 -3.877 -10.504 1.00 0.00 H new ATOM 0 HG12 ILE B 11 74.917 -4.422 -8.061 1.00 0.00 H new ATOM 0 HG13 ILE B 11 73.323 -3.706 -7.942 1.00 0.00 H new ATOM 0 HG21 ILE B 11 74.935 -5.593 -10.774 1.00 0.00 H new ATOM 0 HG22 ILE B 11 75.328 -4.123 -11.697 1.00 0.00 H new ATOM 0 HG23 ILE B 11 76.143 -4.446 -10.148 1.00 0.00 H new ATOM 0 HD11 ILE B 11 73.204 -6.164 -7.629 1.00 0.00 H new ATOM 0 HD12 ILE B 11 72.333 -5.681 -9.104 1.00 0.00 H new ATOM 0 HD13 ILE B 11 73.952 -6.409 -9.225 1.00 0.00 H new ATOM 1625 N ASP B 12 73.762 -1.576 -12.042 1.00 0.00 N ATOM 1626 CA ASP B 12 73.982 -1.040 -13.410 1.00 0.00 C ATOM 1627 C ASP B 12 74.616 0.348 -13.298 1.00 0.00 C ATOM 1628 O ASP B 12 75.498 0.703 -14.053 1.00 0.00 O ATOM 1629 CB ASP B 12 72.637 -0.932 -14.131 1.00 0.00 C ATOM 1630 CG ASP B 12 72.111 -2.334 -14.441 1.00 0.00 C ATOM 1631 OD1 ASP B 12 72.908 -3.257 -14.449 1.00 0.00 O ATOM 1632 OD2 ASP B 12 70.919 -2.461 -14.666 1.00 0.00 O ATOM 0 H ASP B 12 72.792 -1.791 -11.809 1.00 0.00 H new ATOM 0 HA ASP B 12 74.640 -1.703 -13.972 1.00 0.00 H new ATOM 0 HB2 ASP B 12 71.922 -0.393 -13.510 1.00 0.00 H new ATOM 0 HB3 ASP B 12 72.751 -0.363 -15.053 1.00 0.00 H new ATOM 1637 N VAL B 13 74.171 1.133 -12.356 1.00 0.00 N ATOM 1638 CA VAL B 13 74.748 2.498 -12.186 1.00 0.00 C ATOM 1639 C VAL B 13 76.189 2.401 -11.650 1.00 0.00 C ATOM 1640 O VAL B 13 77.078 3.087 -12.113 1.00 0.00 O ATOM 1641 CB VAL B 13 73.879 3.291 -11.199 1.00 0.00 C ATOM 1642 CG1 VAL B 13 74.579 4.601 -10.819 1.00 0.00 C ATOM 1643 CG2 VAL B 13 72.530 3.607 -11.852 1.00 0.00 C ATOM 0 H VAL B 13 73.433 0.889 -11.696 1.00 0.00 H new ATOM 0 HA VAL B 13 74.767 3.006 -13.150 1.00 0.00 H new ATOM 0 HB VAL B 13 73.724 2.695 -10.300 1.00 0.00 H new ATOM 0 HG11 VAL B 13 73.955 5.157 -10.119 1.00 0.00 H new ATOM 0 HG12 VAL B 13 75.539 4.379 -10.353 1.00 0.00 H new ATOM 0 HG13 VAL B 13 74.741 5.200 -11.715 1.00 0.00 H new ATOM 0 HG21 VAL B 13 71.911 4.170 -11.154 1.00 0.00 H new ATOM 0 HG22 VAL B 13 72.692 4.199 -12.753 1.00 0.00 H new ATOM 0 HG23 VAL B 13 72.026 2.677 -12.115 1.00 0.00 H new ATOM 1653 N PHE B 14 76.425 1.570 -10.668 1.00 0.00 N ATOM 1654 CA PHE B 14 77.804 1.456 -10.098 1.00 0.00 C ATOM 1655 C PHE B 14 78.799 1.013 -11.175 1.00 0.00 C ATOM 1656 O PHE B 14 79.822 1.633 -11.378 1.00 0.00 O ATOM 1657 CB PHE B 14 77.803 0.417 -8.972 1.00 0.00 C ATOM 1658 CG PHE B 14 79.185 0.314 -8.361 1.00 0.00 C ATOM 1659 CD1 PHE B 14 80.166 -0.483 -8.968 1.00 0.00 C ATOM 1660 CD2 PHE B 14 79.482 1.005 -7.180 1.00 0.00 C ATOM 1661 CE1 PHE B 14 81.440 -0.586 -8.393 1.00 0.00 C ATOM 1662 CE2 PHE B 14 80.757 0.904 -6.606 1.00 0.00 C ATOM 1663 CZ PHE B 14 81.735 0.108 -7.213 1.00 0.00 C ATOM 0 H PHE B 14 75.726 0.966 -10.236 1.00 0.00 H new ATOM 0 HA PHE B 14 78.103 2.432 -9.716 1.00 0.00 H new ATOM 0 HB2 PHE B 14 77.078 0.698 -8.208 1.00 0.00 H new ATOM 0 HB3 PHE B 14 77.495 -0.553 -9.362 1.00 0.00 H new ATOM 0 HD1 PHE B 14 79.940 -1.018 -9.879 1.00 0.00 H new ATOM 0 HD2 PHE B 14 78.727 1.617 -6.710 1.00 0.00 H new ATOM 0 HE1 PHE B 14 82.195 -1.201 -8.860 1.00 0.00 H new ATOM 0 HE2 PHE B 14 80.984 1.440 -5.696 1.00 0.00 H new ATOM 0 HZ PHE B 14 82.717 0.029 -6.771 1.00 0.00 H new ATOM 1673 N HIS B 15 78.539 -0.088 -11.823 1.00 0.00 N ATOM 1674 CA HIS B 15 79.506 -0.611 -12.830 1.00 0.00 C ATOM 1675 C HIS B 15 79.750 0.403 -13.947 1.00 0.00 C ATOM 1676 O HIS B 15 80.865 0.563 -14.398 1.00 0.00 O ATOM 1677 CB HIS B 15 78.950 -1.906 -13.427 1.00 0.00 C ATOM 1678 CG HIS B 15 79.911 -2.457 -14.448 1.00 0.00 C ATOM 1679 ND1 HIS B 15 81.225 -2.776 -14.133 1.00 0.00 N ATOM 1680 CD2 HIS B 15 79.758 -2.775 -15.776 1.00 0.00 C ATOM 1681 CE1 HIS B 15 81.804 -3.264 -15.247 1.00 0.00 C ATOM 1682 NE2 HIS B 15 80.953 -3.283 -16.273 1.00 0.00 N ATOM 0 H HIS B 15 77.697 -0.650 -11.699 1.00 0.00 H new ATOM 0 HA HIS B 15 80.458 -0.799 -12.333 1.00 0.00 H new ATOM 0 HB2 HIS B 15 78.786 -2.639 -12.637 1.00 0.00 H new ATOM 0 HB3 HIS B 15 77.982 -1.716 -13.892 1.00 0.00 H new ATOM 0 HD2 HIS B 15 78.849 -2.650 -16.346 1.00 0.00 H new ATOM 0 HE1 HIS B 15 82.830 -3.598 -15.302 1.00 0.00 H new ATOM 0 HE2 HIS B 15 81.139 -3.603 -17.223 1.00 0.00 H new ATOM 1691 N GLN B 16 78.749 1.091 -14.413 1.00 0.00 N ATOM 1692 CA GLN B 16 78.993 2.075 -15.504 1.00 0.00 C ATOM 1693 C GLN B 16 79.819 3.255 -14.977 1.00 0.00 C ATOM 1694 O GLN B 16 80.702 3.755 -15.646 1.00 0.00 O ATOM 1695 CB GLN B 16 77.642 2.580 -16.025 1.00 0.00 C ATOM 1696 CG GLN B 16 77.848 3.450 -17.268 1.00 0.00 C ATOM 1697 CD GLN B 16 78.403 2.594 -18.407 1.00 0.00 C ATOM 1698 OE1 GLN B 16 77.741 1.694 -18.886 1.00 0.00 O ATOM 1699 NE2 GLN B 16 79.601 2.837 -18.862 1.00 0.00 N ATOM 0 H GLN B 16 77.784 1.018 -14.092 1.00 0.00 H new ATOM 0 HA GLN B 16 79.547 1.595 -16.311 1.00 0.00 H new ATOM 0 HB2 GLN B 16 76.998 1.735 -16.266 1.00 0.00 H new ATOM 0 HB3 GLN B 16 77.136 3.155 -15.249 1.00 0.00 H new ATOM 0 HG2 GLN B 16 76.903 3.903 -17.568 1.00 0.00 H new ATOM 0 HG3 GLN B 16 78.536 4.265 -17.044 1.00 0.00 H new ATOM 0 HE21 GLN B 16 80.156 3.592 -18.460 1.00 0.00 H new ATOM 0 HE22 GLN B 16 79.983 2.272 -19.620 1.00 0.00 H new ATOM 1708 N TYR B 17 79.539 3.701 -13.784 1.00 0.00 N ATOM 1709 CA TYR B 17 80.309 4.850 -13.215 1.00 0.00 C ATOM 1710 C TYR B 17 81.714 4.394 -12.794 1.00 0.00 C ATOM 1711 O TYR B 17 82.692 5.069 -13.046 1.00 0.00 O ATOM 1712 CB TYR B 17 79.552 5.430 -12.002 1.00 0.00 C ATOM 1713 CG TYR B 17 78.596 6.516 -12.454 1.00 0.00 C ATOM 1714 CD1 TYR B 17 77.394 6.178 -13.086 1.00 0.00 C ATOM 1715 CD2 TYR B 17 78.921 7.862 -12.242 1.00 0.00 C ATOM 1716 CE1 TYR B 17 76.516 7.184 -13.504 1.00 0.00 C ATOM 1717 CE2 TYR B 17 78.043 8.868 -12.660 1.00 0.00 C ATOM 1718 CZ TYR B 17 76.841 8.530 -13.292 1.00 0.00 C ATOM 1719 OH TYR B 17 75.976 9.523 -13.705 1.00 0.00 O ATOM 0 H TYR B 17 78.812 3.322 -13.177 1.00 0.00 H new ATOM 0 HA TYR B 17 80.411 5.623 -13.977 1.00 0.00 H new ATOM 0 HB2 TYR B 17 79.001 4.638 -11.495 1.00 0.00 H new ATOM 0 HB3 TYR B 17 80.262 5.836 -11.281 1.00 0.00 H new ATOM 0 HD1 TYR B 17 77.144 5.140 -13.251 1.00 0.00 H new ATOM 0 HD2 TYR B 17 79.849 8.123 -11.756 1.00 0.00 H new ATOM 0 HE1 TYR B 17 75.588 6.923 -13.990 1.00 0.00 H new ATOM 0 HE2 TYR B 17 78.293 9.906 -12.495 1.00 0.00 H new ATOM 0 HH TYR B 17 76.388 10.399 -13.553 1.00 0.00 H new ATOM 1729 N SER B 18 81.827 3.267 -12.150 1.00 0.00 N ATOM 1730 CA SER B 18 83.172 2.798 -11.714 1.00 0.00 C ATOM 1731 C SER B 18 83.997 2.391 -12.934 1.00 0.00 C ATOM 1732 O SER B 18 85.207 2.309 -12.875 1.00 0.00 O ATOM 1733 CB SER B 18 83.026 1.604 -10.769 1.00 0.00 C ATOM 1734 OG SER B 18 84.318 1.191 -10.340 1.00 0.00 O ATOM 0 H SER B 18 81.050 2.652 -11.907 1.00 0.00 H new ATOM 0 HA SER B 18 83.679 3.608 -11.190 1.00 0.00 H new ATOM 0 HB2 SER B 18 82.414 1.877 -9.910 1.00 0.00 H new ATOM 0 HB3 SER B 18 82.517 0.783 -11.275 1.00 0.00 H new ATOM 0 HG SER B 18 84.256 0.805 -9.441 1.00 0.00 H new ATOM 1740 N GLY B 19 83.356 2.144 -14.044 1.00 0.00 N ATOM 1741 CA GLY B 19 84.106 1.752 -15.272 1.00 0.00 C ATOM 1742 C GLY B 19 84.533 3.014 -16.025 1.00 0.00 C ATOM 1743 O GLY B 19 84.793 2.981 -17.212 1.00 0.00 O ATOM 0 H GLY B 19 82.343 2.197 -14.154 1.00 0.00 H new ATOM 0 HA2 GLY B 19 84.981 1.160 -15.005 1.00 0.00 H new ATOM 0 HA3 GLY B 19 83.481 1.127 -15.910 1.00 0.00 H new ATOM 1747 N ARG B 20 84.613 4.130 -15.345 1.00 0.00 N ATOM 1748 CA ARG B 20 85.026 5.395 -16.018 1.00 0.00 C ATOM 1749 C ARG B 20 86.559 5.495 -16.021 1.00 0.00 C ATOM 1750 O ARG B 20 87.184 5.557 -17.061 1.00 0.00 O ATOM 1751 CB ARG B 20 84.443 6.585 -15.248 1.00 0.00 C ATOM 1752 CG ARG B 20 84.633 7.886 -16.048 1.00 0.00 C ATOM 1753 CD ARG B 20 83.521 8.045 -17.092 1.00 0.00 C ATOM 1754 NE ARG B 20 83.598 9.412 -17.677 1.00 0.00 N ATOM 1755 CZ ARG B 20 83.176 10.434 -16.987 1.00 0.00 C ATOM 1756 NH1 ARG B 20 82.696 10.256 -15.788 1.00 0.00 N ATOM 1757 NH2 ARG B 20 83.239 11.635 -17.494 1.00 0.00 N ATOM 0 H ARG B 20 84.409 4.218 -14.349 1.00 0.00 H new ATOM 0 HA ARG B 20 84.659 5.402 -17.044 1.00 0.00 H new ATOM 0 HB2 ARG B 20 83.383 6.419 -15.058 1.00 0.00 H new ATOM 0 HB3 ARG B 20 84.931 6.673 -14.277 1.00 0.00 H new ATOM 0 HG2 ARG B 20 84.628 8.740 -15.371 1.00 0.00 H new ATOM 0 HG3 ARG B 20 85.605 7.877 -16.542 1.00 0.00 H new ATOM 0 HD2 ARG B 20 83.629 7.294 -17.874 1.00 0.00 H new ATOM 0 HD3 ARG B 20 82.546 7.887 -16.631 1.00 0.00 H new ATOM 0 HE ARG B 20 83.979 9.548 -18.613 1.00 0.00 H new ATOM 0 HH11 ARG B 20 82.651 9.318 -15.391 1.00 0.00 H new ATOM 0 HH12 ARG B 20 82.365 11.055 -15.247 1.00 0.00 H new ATOM 0 HH21 ARG B 20 83.619 11.774 -18.430 1.00 0.00 H new ATOM 0 HH22 ARG B 20 82.909 12.435 -16.954 1.00 0.00 H new ATOM 1771 N GLU B 21 87.165 5.508 -14.858 1.00 0.00 N ATOM 1772 CA GLU B 21 88.657 5.601 -14.764 1.00 0.00 C ATOM 1773 C GLU B 21 89.162 4.677 -13.655 1.00 0.00 C ATOM 1774 O GLU B 21 88.420 4.276 -12.779 1.00 0.00 O ATOM 1775 CB GLU B 21 89.080 7.038 -14.445 1.00 0.00 C ATOM 1776 CG GLU B 21 88.818 7.936 -15.652 1.00 0.00 C ATOM 1777 CD GLU B 21 89.043 9.397 -15.260 1.00 0.00 C ATOM 1778 OE1 GLU B 21 89.379 9.638 -14.111 1.00 0.00 O ATOM 1779 OE2 GLU B 21 88.876 10.251 -16.115 1.00 0.00 O ATOM 0 H GLU B 21 86.684 5.458 -13.960 1.00 0.00 H new ATOM 0 HA GLU B 21 89.085 5.302 -15.721 1.00 0.00 H new ATOM 0 HB2 GLU B 21 88.528 7.406 -13.580 1.00 0.00 H new ATOM 0 HB3 GLU B 21 90.138 7.066 -14.183 1.00 0.00 H new ATOM 0 HG2 GLU B 21 89.481 7.662 -16.473 1.00 0.00 H new ATOM 0 HG3 GLU B 21 87.797 7.797 -16.007 1.00 0.00 H new ATOM 1786 N GLY B 22 90.424 4.339 -13.684 1.00 0.00 N ATOM 1787 CA GLY B 22 90.995 3.444 -12.634 1.00 0.00 C ATOM 1788 C GLY B 22 90.953 1.997 -13.122 1.00 0.00 C ATOM 1789 O GLY B 22 90.362 1.690 -14.137 1.00 0.00 O ATOM 0 H GLY B 22 91.088 4.646 -14.394 1.00 0.00 H new ATOM 0 HA2 GLY B 22 92.022 3.735 -12.412 1.00 0.00 H new ATOM 0 HA3 GLY B 22 90.428 3.544 -11.708 1.00 0.00 H new ATOM 1793 N ASP B 23 91.580 1.102 -12.408 1.00 0.00 N ATOM 1794 CA ASP B 23 91.575 -0.324 -12.834 1.00 0.00 C ATOM 1795 C ASP B 23 90.138 -0.762 -13.128 1.00 0.00 C ATOM 1796 O ASP B 23 89.629 -0.562 -14.214 1.00 0.00 O ATOM 1797 CB ASP B 23 92.156 -1.191 -11.716 1.00 0.00 C ATOM 1798 CG ASP B 23 92.138 -2.661 -12.144 1.00 0.00 C ATOM 1799 OD1 ASP B 23 91.054 -3.207 -12.269 1.00 0.00 O ATOM 1800 OD2 ASP B 23 93.208 -3.212 -12.342 1.00 0.00 O ATOM 0 H ASP B 23 92.095 1.298 -11.549 1.00 0.00 H new ATOM 0 HA ASP B 23 92.180 -0.439 -13.733 1.00 0.00 H new ATOM 0 HB2 ASP B 23 93.176 -0.879 -11.493 1.00 0.00 H new ATOM 0 HB3 ASP B 23 91.576 -1.061 -10.802 1.00 0.00 H new ATOM 1805 N LYS B 24 89.477 -1.356 -12.172 1.00 0.00 N ATOM 1806 CA LYS B 24 88.075 -1.797 -12.406 1.00 0.00 C ATOM 1807 C LYS B 24 87.409 -2.137 -11.071 1.00 0.00 C ATOM 1808 O LYS B 24 87.899 -2.956 -10.321 1.00 0.00 O ATOM 1809 CB LYS B 24 88.089 -3.030 -13.310 1.00 0.00 C ATOM 1810 CG LYS B 24 86.664 -3.372 -13.746 1.00 0.00 C ATOM 1811 CD LYS B 24 86.667 -4.699 -14.517 1.00 0.00 C ATOM 1812 CE LYS B 24 87.536 -4.575 -15.775 1.00 0.00 C ATOM 1813 NZ LYS B 24 87.130 -5.615 -16.760 1.00 0.00 N ATOM 0 H LYS B 24 89.847 -1.554 -11.242 1.00 0.00 H new ATOM 0 HA LYS B 24 87.511 -0.997 -12.885 1.00 0.00 H new ATOM 0 HB2 LYS B 24 88.711 -2.843 -14.185 1.00 0.00 H new ATOM 0 HB3 LYS B 24 88.529 -3.875 -12.780 1.00 0.00 H new ATOM 0 HG2 LYS B 24 86.014 -3.448 -12.874 1.00 0.00 H new ATOM 0 HG3 LYS B 24 86.264 -2.576 -14.374 1.00 0.00 H new ATOM 0 HD2 LYS B 24 87.047 -5.498 -13.880 1.00 0.00 H new ATOM 0 HD3 LYS B 24 85.648 -4.970 -14.794 1.00 0.00 H new ATOM 0 HE2 LYS B 24 87.425 -3.582 -16.211 1.00 0.00 H new ATOM 0 HE3 LYS B 24 88.588 -4.694 -15.517 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 87.718 -5.533 -17.614 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 87.258 -6.558 -16.341 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 86.130 -5.481 -17.014 1.00 0.00 H new ATOM 1827 N HIS B 25 86.296 -1.511 -10.775 1.00 0.00 N ATOM 1828 CA HIS B 25 85.570 -1.782 -9.493 1.00 0.00 C ATOM 1829 C HIS B 25 86.246 -1.033 -8.333 1.00 0.00 C ATOM 1830 O HIS B 25 85.815 -1.116 -7.200 1.00 0.00 O ATOM 1831 CB HIS B 25 85.562 -3.298 -9.230 1.00 0.00 C ATOM 1832 CG HIS B 25 84.310 -3.705 -8.497 1.00 0.00 C ATOM 1833 ND1 HIS B 25 84.335 -4.157 -7.183 1.00 0.00 N ATOM 1834 CD2 HIS B 25 82.992 -3.744 -8.881 1.00 0.00 C ATOM 1835 CE1 HIS B 25 83.069 -4.447 -6.831 1.00 0.00 C ATOM 1836 NE2 HIS B 25 82.216 -4.212 -7.828 1.00 0.00 N ATOM 0 H HIS B 25 85.854 -0.815 -11.375 1.00 0.00 H new ATOM 0 HA HIS B 25 84.542 -1.427 -9.571 1.00 0.00 H new ATOM 0 HB2 HIS B 25 85.627 -3.836 -10.175 1.00 0.00 H new ATOM 0 HB3 HIS B 25 86.439 -3.575 -8.644 1.00 0.00 H new ATOM 0 HD2 HIS B 25 82.617 -3.455 -9.852 1.00 0.00 H new ATOM 0 HE1 HIS B 25 82.780 -4.823 -5.861 1.00 0.00 H new ATOM 0 HE2 HIS B 25 81.205 -4.347 -7.820 1.00 0.00 H new ATOM 1845 N LYS B 26 87.285 -0.286 -8.614 1.00 0.00 N ATOM 1846 CA LYS B 26 87.982 0.498 -7.543 1.00 0.00 C ATOM 1847 C LYS B 26 87.663 1.981 -7.750 1.00 0.00 C ATOM 1848 O LYS B 26 87.869 2.516 -8.822 1.00 0.00 O ATOM 1849 CB LYS B 26 89.495 0.280 -7.653 1.00 0.00 C ATOM 1850 CG LYS B 26 89.829 -1.182 -7.338 1.00 0.00 C ATOM 1851 CD LYS B 26 91.340 -1.396 -7.449 1.00 0.00 C ATOM 1852 CE LYS B 26 91.679 -2.855 -7.134 1.00 0.00 C ATOM 1853 NZ LYS B 26 93.092 -3.131 -7.517 1.00 0.00 N ATOM 0 H LYS B 26 87.685 -0.184 -9.547 1.00 0.00 H new ATOM 0 HA LYS B 26 87.646 0.174 -6.558 1.00 0.00 H new ATOM 0 HB2 LYS B 26 89.837 0.533 -8.656 1.00 0.00 H new ATOM 0 HB3 LYS B 26 90.019 0.940 -6.962 1.00 0.00 H new ATOM 0 HG2 LYS B 26 89.488 -1.436 -6.334 1.00 0.00 H new ATOM 0 HG3 LYS B 26 89.306 -1.843 -8.029 1.00 0.00 H new ATOM 0 HD2 LYS B 26 91.680 -1.142 -8.453 1.00 0.00 H new ATOM 0 HD3 LYS B 26 91.862 -0.734 -6.759 1.00 0.00 H new ATOM 0 HE2 LYS B 26 91.534 -3.052 -6.072 1.00 0.00 H new ATOM 0 HE3 LYS B 26 91.007 -3.521 -7.676 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 93.322 -4.122 -7.303 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 93.216 -2.959 -8.535 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 93.726 -2.505 -6.981 1.00 0.00 H new ATOM 1867 N LEU B 27 87.144 2.657 -6.748 1.00 0.00 N ATOM 1868 CA LEU B 27 86.798 4.106 -6.933 1.00 0.00 C ATOM 1869 C LEU B 27 87.944 4.998 -6.443 1.00 0.00 C ATOM 1870 O LEU B 27 88.317 4.982 -5.286 1.00 0.00 O ATOM 1871 CB LEU B 27 85.535 4.431 -6.135 1.00 0.00 C ATOM 1872 CG LEU B 27 84.365 3.569 -6.624 1.00 0.00 C ATOM 1873 CD1 LEU B 27 83.143 3.846 -5.745 1.00 0.00 C ATOM 1874 CD2 LEU B 27 84.032 3.904 -8.091 1.00 0.00 C ATOM 0 H LEU B 27 86.947 2.275 -5.823 1.00 0.00 H new ATOM 0 HA LEU B 27 86.631 4.294 -7.994 1.00 0.00 H new ATOM 0 HB2 LEU B 27 85.710 4.252 -5.074 1.00 0.00 H new ATOM 0 HB3 LEU B 27 85.289 5.487 -6.244 1.00 0.00 H new ATOM 0 HG LEU B 27 84.641 2.516 -6.560 1.00 0.00 H new ATOM 0 HD11 LEU B 27 82.305 3.237 -6.085 1.00 0.00 H new ATOM 0 HD12 LEU B 27 83.376 3.597 -4.710 1.00 0.00 H new ATOM 0 HD13 LEU B 27 82.877 4.901 -5.814 1.00 0.00 H new ATOM 0 HD21 LEU B 27 83.200 3.285 -8.426 1.00 0.00 H new ATOM 0 HD22 LEU B 27 83.757 4.956 -8.171 1.00 0.00 H new ATOM 0 HD23 LEU B 27 84.904 3.709 -8.716 1.00 0.00 H new ATOM 1886 N LYS B 28 88.498 5.781 -7.335 1.00 0.00 N ATOM 1887 CA LYS B 28 89.622 6.696 -6.971 1.00 0.00 C ATOM 1888 C LYS B 28 89.059 8.085 -6.627 1.00 0.00 C ATOM 1889 O LYS B 28 87.911 8.380 -6.899 1.00 0.00 O ATOM 1890 CB LYS B 28 90.578 6.799 -8.165 1.00 0.00 C ATOM 1891 CG LYS B 28 91.856 7.525 -7.748 1.00 0.00 C ATOM 1892 CD LYS B 28 92.888 7.443 -8.874 1.00 0.00 C ATOM 1893 CE LYS B 28 94.104 8.298 -8.511 1.00 0.00 C ATOM 1894 NZ LYS B 28 94.677 7.822 -7.221 1.00 0.00 N ATOM 0 H LYS B 28 88.214 5.825 -8.314 1.00 0.00 H new ATOM 0 HA LYS B 28 90.158 6.308 -6.105 1.00 0.00 H new ATOM 0 HB2 LYS B 28 90.820 5.803 -8.535 1.00 0.00 H new ATOM 0 HB3 LYS B 28 90.096 7.334 -8.983 1.00 0.00 H new ATOM 0 HG2 LYS B 28 91.635 8.568 -7.520 1.00 0.00 H new ATOM 0 HG3 LYS B 28 92.259 7.078 -6.839 1.00 0.00 H new ATOM 0 HD2 LYS B 28 93.191 6.408 -9.030 1.00 0.00 H new ATOM 0 HD3 LYS B 28 92.451 7.792 -9.810 1.00 0.00 H new ATOM 0 HE2 LYS B 28 94.854 8.236 -9.299 1.00 0.00 H new ATOM 0 HE3 LYS B 28 93.814 9.345 -8.428 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 95.637 8.205 -7.105 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 94.078 8.146 -6.435 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 94.716 6.783 -7.221 1.00 0.00 H new ATOM 1908 N LYS B 29 89.843 8.930 -6.006 1.00 0.00 N ATOM 1909 CA LYS B 29 89.328 10.280 -5.621 1.00 0.00 C ATOM 1910 C LYS B 29 88.828 11.025 -6.864 1.00 0.00 C ATOM 1911 O LYS B 29 87.809 11.685 -6.830 1.00 0.00 O ATOM 1912 CB LYS B 29 90.454 11.089 -4.956 1.00 0.00 C ATOM 1913 CG LYS B 29 91.520 11.478 -5.987 1.00 0.00 C ATOM 1914 CD LYS B 29 92.738 12.059 -5.263 1.00 0.00 C ATOM 1915 CE LYS B 29 93.703 12.679 -6.278 1.00 0.00 C ATOM 1916 NZ LYS B 29 94.413 11.595 -7.012 1.00 0.00 N ATOM 0 H LYS B 29 90.813 8.745 -5.750 1.00 0.00 H new ATOM 0 HA LYS B 29 88.501 10.160 -4.921 1.00 0.00 H new ATOM 0 HB2 LYS B 29 90.041 11.986 -4.495 1.00 0.00 H new ATOM 0 HB3 LYS B 29 90.909 10.502 -4.158 1.00 0.00 H new ATOM 0 HG2 LYS B 29 91.812 10.606 -6.571 1.00 0.00 H new ATOM 0 HG3 LYS B 29 91.116 12.209 -6.687 1.00 0.00 H new ATOM 0 HD2 LYS B 29 92.419 12.814 -4.544 1.00 0.00 H new ATOM 0 HD3 LYS B 29 93.244 11.276 -4.699 1.00 0.00 H new ATOM 0 HE2 LYS B 29 93.156 13.309 -6.979 1.00 0.00 H new ATOM 0 HE3 LYS B 29 94.422 13.320 -5.768 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 95.410 11.861 -7.145 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 94.360 10.713 -6.464 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 93.966 11.454 -7.940 1.00 0.00 H new ATOM 1930 N SER B 30 89.523 10.916 -7.962 1.00 0.00 N ATOM 1931 CA SER B 30 89.067 11.609 -9.202 1.00 0.00 C ATOM 1932 C SER B 30 87.679 11.091 -9.582 1.00 0.00 C ATOM 1933 O SER B 30 86.810 11.837 -9.987 1.00 0.00 O ATOM 1934 CB SER B 30 90.048 11.326 -10.342 1.00 0.00 C ATOM 1935 OG SER B 30 89.980 9.950 -10.689 1.00 0.00 O ATOM 0 H SER B 30 90.385 10.379 -8.056 1.00 0.00 H new ATOM 0 HA SER B 30 89.024 12.684 -9.026 1.00 0.00 H new ATOM 0 HB2 SER B 30 89.806 11.943 -11.207 1.00 0.00 H new ATOM 0 HB3 SER B 30 91.062 11.587 -10.038 1.00 0.00 H new ATOM 0 HG SER B 30 90.606 9.766 -11.420 1.00 0.00 H new ATOM 1941 N GLU B 31 87.468 9.815 -9.430 1.00 0.00 N ATOM 1942 CA GLU B 31 86.140 9.227 -9.756 1.00 0.00 C ATOM 1943 C GLU B 31 85.123 9.711 -8.720 1.00 0.00 C ATOM 1944 O GLU B 31 83.994 10.035 -9.033 1.00 0.00 O ATOM 1945 CB GLU B 31 86.235 7.701 -9.709 1.00 0.00 C ATOM 1946 CG GLU B 31 87.089 7.212 -10.879 1.00 0.00 C ATOM 1947 CD GLU B 31 87.229 5.691 -10.809 1.00 0.00 C ATOM 1948 OE1 GLU B 31 86.322 5.011 -11.259 1.00 0.00 O ATOM 1949 OE2 GLU B 31 88.242 5.233 -10.308 1.00 0.00 O ATOM 0 H GLU B 31 88.163 9.149 -9.092 1.00 0.00 H new ATOM 0 HA GLU B 31 85.828 9.535 -10.754 1.00 0.00 H new ATOM 0 HB2 GLU B 31 86.675 7.381 -8.764 1.00 0.00 H new ATOM 0 HB3 GLU B 31 85.239 7.261 -9.762 1.00 0.00 H new ATOM 0 HG2 GLU B 31 86.630 7.502 -11.824 1.00 0.00 H new ATOM 0 HG3 GLU B 31 88.073 7.680 -10.845 1.00 0.00 H new ATOM 1956 N LEU B 32 85.535 9.772 -7.485 1.00 0.00 N ATOM 1957 CA LEU B 32 84.618 10.249 -6.413 1.00 0.00 C ATOM 1958 C LEU B 32 84.200 11.690 -6.727 1.00 0.00 C ATOM 1959 O LEU B 32 83.047 12.055 -6.616 1.00 0.00 O ATOM 1960 CB LEU B 32 85.338 10.188 -5.058 1.00 0.00 C ATOM 1961 CG LEU B 32 84.416 10.674 -3.927 1.00 0.00 C ATOM 1962 CD1 LEU B 32 83.241 9.701 -3.743 1.00 0.00 C ATOM 1963 CD2 LEU B 32 85.223 10.748 -2.628 1.00 0.00 C ATOM 0 H LEU B 32 86.470 9.511 -7.171 1.00 0.00 H new ATOM 0 HA LEU B 32 83.732 9.616 -6.367 1.00 0.00 H new ATOM 0 HB2 LEU B 32 85.659 9.166 -4.858 1.00 0.00 H new ATOM 0 HB3 LEU B 32 86.237 10.804 -5.091 1.00 0.00 H new ATOM 0 HG LEU B 32 84.021 11.658 -4.181 1.00 0.00 H new ATOM 0 HD11 LEU B 32 82.596 10.057 -2.939 1.00 0.00 H new ATOM 0 HD12 LEU B 32 82.668 9.643 -4.669 1.00 0.00 H new ATOM 0 HD13 LEU B 32 83.624 8.712 -3.490 1.00 0.00 H new ATOM 0 HD21 LEU B 32 84.579 11.092 -1.819 1.00 0.00 H new ATOM 0 HD22 LEU B 32 85.614 9.760 -2.386 1.00 0.00 H new ATOM 0 HD23 LEU B 32 86.051 11.445 -2.754 1.00 0.00 H new ATOM 1975 N LYS B 33 85.138 12.508 -7.122 1.00 0.00 N ATOM 1976 CA LYS B 33 84.811 13.927 -7.452 1.00 0.00 C ATOM 1977 C LYS B 33 83.811 13.972 -8.615 1.00 0.00 C ATOM 1978 O LYS B 33 82.895 14.770 -8.628 1.00 0.00 O ATOM 1979 CB LYS B 33 86.099 14.662 -7.853 1.00 0.00 C ATOM 1980 CG LYS B 33 85.795 16.138 -8.139 1.00 0.00 C ATOM 1981 CD LYS B 33 87.081 16.868 -8.561 1.00 0.00 C ATOM 1982 CE LYS B 33 88.062 16.972 -7.380 1.00 0.00 C ATOM 1983 NZ LYS B 33 88.906 15.746 -7.324 1.00 0.00 N ATOM 0 H LYS B 33 86.120 12.255 -7.231 1.00 0.00 H new ATOM 0 HA LYS B 33 84.368 14.410 -6.581 1.00 0.00 H new ATOM 0 HB2 LYS B 33 86.836 14.582 -7.054 1.00 0.00 H new ATOM 0 HB3 LYS B 33 86.534 14.194 -8.736 1.00 0.00 H new ATOM 0 HG2 LYS B 33 85.047 16.217 -8.927 1.00 0.00 H new ATOM 0 HG3 LYS B 33 85.374 16.610 -7.251 1.00 0.00 H new ATOM 0 HD2 LYS B 33 87.553 16.335 -9.386 1.00 0.00 H new ATOM 0 HD3 LYS B 33 86.836 17.866 -8.925 1.00 0.00 H new ATOM 0 HE2 LYS B 33 88.692 17.855 -7.493 1.00 0.00 H new ATOM 0 HE3 LYS B 33 87.512 17.090 -6.446 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 88.714 15.232 -6.440 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 88.684 15.134 -8.135 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 89.910 16.014 -7.357 1.00 0.00 H new ATOM 1997 N GLU B 34 83.985 13.126 -9.596 1.00 0.00 N ATOM 1998 CA GLU B 34 83.047 13.130 -10.758 1.00 0.00 C ATOM 1999 C GLU B 34 81.654 12.684 -10.316 1.00 0.00 C ATOM 2000 O GLU B 34 80.655 13.256 -10.700 1.00 0.00 O ATOM 2001 CB GLU B 34 83.563 12.167 -11.831 1.00 0.00 C ATOM 2002 CG GLU B 34 84.827 12.742 -12.470 1.00 0.00 C ATOM 2003 CD GLU B 34 85.341 11.779 -13.541 1.00 0.00 C ATOM 2004 OE1 GLU B 34 84.833 10.672 -13.607 1.00 0.00 O ATOM 2005 OE2 GLU B 34 86.237 12.164 -14.275 1.00 0.00 O ATOM 0 H GLU B 34 84.733 12.434 -9.643 1.00 0.00 H new ATOM 0 HA GLU B 34 82.988 14.142 -11.160 1.00 0.00 H new ATOM 0 HB2 GLU B 34 83.777 11.194 -11.388 1.00 0.00 H new ATOM 0 HB3 GLU B 34 82.798 12.010 -12.591 1.00 0.00 H new ATOM 0 HG2 GLU B 34 84.613 13.715 -12.913 1.00 0.00 H new ATOM 0 HG3 GLU B 34 85.592 12.899 -11.710 1.00 0.00 H new ATOM 2012 N LEU B 35 81.581 11.645 -9.533 1.00 0.00 N ATOM 2013 CA LEU B 35 80.251 11.135 -9.090 1.00 0.00 C ATOM 2014 C LEU B 35 79.508 12.227 -8.315 1.00 0.00 C ATOM 2015 O LEU B 35 78.354 12.505 -8.573 1.00 0.00 O ATOM 2016 CB LEU B 35 80.460 9.907 -8.188 1.00 0.00 C ATOM 2017 CG LEU B 35 79.113 9.344 -7.705 1.00 0.00 C ATOM 2018 CD1 LEU B 35 78.304 8.812 -8.898 1.00 0.00 C ATOM 2019 CD2 LEU B 35 79.376 8.200 -6.718 1.00 0.00 C ATOM 0 H LEU B 35 82.384 11.125 -9.180 1.00 0.00 H new ATOM 0 HA LEU B 35 79.658 10.854 -9.960 1.00 0.00 H new ATOM 0 HB2 LEU B 35 81.005 9.138 -8.735 1.00 0.00 H new ATOM 0 HB3 LEU B 35 81.073 10.182 -7.329 1.00 0.00 H new ATOM 0 HG LEU B 35 78.545 10.136 -7.217 1.00 0.00 H new ATOM 0 HD11 LEU B 35 77.352 8.416 -8.544 1.00 0.00 H new ATOM 0 HD12 LEU B 35 78.120 9.622 -9.603 1.00 0.00 H new ATOM 0 HD13 LEU B 35 78.865 8.020 -9.394 1.00 0.00 H new ATOM 0 HD21 LEU B 35 78.426 7.794 -6.370 1.00 0.00 H new ATOM 0 HD22 LEU B 35 79.946 7.415 -7.215 1.00 0.00 H new ATOM 0 HD23 LEU B 35 79.943 8.577 -5.867 1.00 0.00 H new ATOM 2031 N ILE B 36 80.153 12.843 -7.367 1.00 0.00 N ATOM 2032 CA ILE B 36 79.476 13.913 -6.577 1.00 0.00 C ATOM 2033 C ILE B 36 79.029 15.049 -7.504 1.00 0.00 C ATOM 2034 O ILE B 36 77.939 15.569 -7.385 1.00 0.00 O ATOM 2035 CB ILE B 36 80.457 14.463 -5.539 1.00 0.00 C ATOM 2036 CG1 ILE B 36 80.880 13.335 -4.594 1.00 0.00 C ATOM 2037 CG2 ILE B 36 79.781 15.574 -4.734 1.00 0.00 C ATOM 2038 CD1 ILE B 36 82.042 13.805 -3.715 1.00 0.00 C ATOM 0 H ILE B 36 81.120 12.654 -7.103 1.00 0.00 H new ATOM 0 HA ILE B 36 78.601 13.495 -6.080 1.00 0.00 H new ATOM 0 HB ILE B 36 81.335 14.865 -6.045 1.00 0.00 H new ATOM 0 HG12 ILE B 36 80.038 13.035 -3.970 1.00 0.00 H new ATOM 0 HG13 ILE B 36 81.178 12.459 -5.169 1.00 0.00 H new ATOM 0 HG21 ILE B 36 80.480 15.965 -3.995 1.00 0.00 H new ATOM 0 HG22 ILE B 36 79.477 16.377 -5.406 1.00 0.00 H new ATOM 0 HG23 ILE B 36 78.903 15.173 -4.227 1.00 0.00 H new ATOM 0 HD11 ILE B 36 82.340 12.999 -3.044 1.00 0.00 H new ATOM 0 HD12 ILE B 36 82.886 14.083 -4.346 1.00 0.00 H new ATOM 0 HD13 ILE B 36 81.728 14.668 -3.128 1.00 0.00 H new ATOM 2050 N ASN B 37 79.870 15.450 -8.413 1.00 0.00 N ATOM 2051 CA ASN B 37 79.507 16.568 -9.330 1.00 0.00 C ATOM 2052 C ASN B 37 78.352 16.170 -10.260 1.00 0.00 C ATOM 2053 O ASN B 37 77.487 16.971 -10.558 1.00 0.00 O ATOM 2054 CB ASN B 37 80.727 16.931 -10.183 1.00 0.00 C ATOM 2055 CG ASN B 37 81.786 17.598 -9.303 1.00 0.00 C ATOM 2056 OD1 ASN B 37 81.473 18.136 -8.260 1.00 0.00 O ATOM 2057 ND2 ASN B 37 83.036 17.583 -9.682 1.00 0.00 N ATOM 0 H ASN B 37 80.797 15.051 -8.563 1.00 0.00 H new ATOM 0 HA ASN B 37 79.190 17.419 -8.727 1.00 0.00 H new ATOM 0 HB2 ASN B 37 81.138 16.035 -10.649 1.00 0.00 H new ATOM 0 HB3 ASN B 37 80.433 17.603 -10.989 1.00 0.00 H new ATOM 0 HD21 ASN B 37 83.750 18.023 -9.102 1.00 0.00 H new ATOM 0 HD22 ASN B 37 83.298 17.131 -10.558 1.00 0.00 H new ATOM 2064 N ASN B 38 78.347 14.960 -10.758 1.00 0.00 N ATOM 2065 CA ASN B 38 77.271 14.539 -11.708 1.00 0.00 C ATOM 2066 C ASN B 38 76.002 14.061 -10.987 1.00 0.00 C ATOM 2067 O ASN B 38 74.971 13.902 -11.612 1.00 0.00 O ATOM 2068 CB ASN B 38 77.800 13.395 -12.577 1.00 0.00 C ATOM 2069 CG ASN B 38 76.781 13.068 -13.669 1.00 0.00 C ATOM 2070 OD1 ASN B 38 76.145 12.034 -13.632 1.00 0.00 O ATOM 2071 ND2 ASN B 38 76.599 13.910 -14.649 1.00 0.00 N ATOM 0 H ASN B 38 79.042 14.244 -10.548 1.00 0.00 H new ATOM 0 HA ASN B 38 77.004 15.408 -12.309 1.00 0.00 H new ATOM 0 HB2 ASN B 38 78.752 13.676 -13.026 1.00 0.00 H new ATOM 0 HB3 ASN B 38 77.986 12.514 -11.963 1.00 0.00 H new ATOM 0 HD21 ASN B 38 75.923 13.700 -15.383 1.00 0.00 H new ATOM 0 HD22 ASN B 38 77.133 14.779 -14.681 1.00 0.00 H new ATOM 2078 N GLU B 39 76.056 13.804 -9.697 1.00 0.00 N ATOM 2079 CA GLU B 39 74.827 13.307 -8.981 1.00 0.00 C ATOM 2080 C GLU B 39 74.504 14.137 -7.734 1.00 0.00 C ATOM 2081 O GLU B 39 73.746 15.085 -7.789 1.00 0.00 O ATOM 2082 CB GLU B 39 75.031 11.847 -8.577 1.00 0.00 C ATOM 2083 CG GLU B 39 75.021 10.971 -9.832 1.00 0.00 C ATOM 2084 CD GLU B 39 75.223 9.507 -9.440 1.00 0.00 C ATOM 2085 OE1 GLU B 39 75.491 9.257 -8.276 1.00 0.00 O ATOM 2086 OE2 GLU B 39 75.108 8.660 -10.311 1.00 0.00 O ATOM 0 H GLU B 39 76.886 13.914 -9.114 1.00 0.00 H new ATOM 0 HA GLU B 39 73.986 13.402 -9.668 1.00 0.00 H new ATOM 0 HB2 GLU B 39 75.976 11.733 -8.047 1.00 0.00 H new ATOM 0 HB3 GLU B 39 74.242 11.533 -7.893 1.00 0.00 H new ATOM 0 HG2 GLU B 39 74.076 11.089 -10.362 1.00 0.00 H new ATOM 0 HG3 GLU B 39 75.810 11.287 -10.514 1.00 0.00 H new ATOM 2093 N LEU B 40 75.033 13.762 -6.601 1.00 0.00 N ATOM 2094 CA LEU B 40 74.707 14.501 -5.346 1.00 0.00 C ATOM 2095 C LEU B 40 75.440 15.841 -5.292 1.00 0.00 C ATOM 2096 O LEU B 40 76.640 15.915 -5.462 1.00 0.00 O ATOM 2097 CB LEU B 40 75.120 13.653 -4.141 1.00 0.00 C ATOM 2098 CG LEU B 40 74.368 12.317 -4.151 1.00 0.00 C ATOM 2099 CD1 LEU B 40 74.905 11.435 -3.018 1.00 0.00 C ATOM 2100 CD2 LEU B 40 72.858 12.552 -3.954 1.00 0.00 C ATOM 0 H LEU B 40 75.676 12.978 -6.489 1.00 0.00 H new ATOM 0 HA LEU B 40 73.634 14.692 -5.326 1.00 0.00 H new ATOM 0 HB2 LEU B 40 76.195 13.474 -4.165 1.00 0.00 H new ATOM 0 HB3 LEU B 40 74.907 14.192 -3.218 1.00 0.00 H new ATOM 0 HG LEU B 40 74.521 11.824 -5.111 1.00 0.00 H new ATOM 0 HD11 LEU B 40 74.376 10.482 -3.017 1.00 0.00 H new ATOM 0 HD12 LEU B 40 75.970 11.259 -3.168 1.00 0.00 H new ATOM 0 HD13 LEU B 40 74.751 11.936 -2.062 1.00 0.00 H new ATOM 0 HD21 LEU B 40 72.337 11.595 -3.963 1.00 0.00 H new ATOM 0 HD22 LEU B 40 72.689 13.048 -2.998 1.00 0.00 H new ATOM 0 HD23 LEU B 40 72.479 13.179 -4.761 1.00 0.00 H new ATOM 2112 N SER B 41 74.716 16.900 -5.036 1.00 0.00 N ATOM 2113 CA SER B 41 75.347 18.248 -4.946 1.00 0.00 C ATOM 2114 C SER B 41 74.544 19.108 -3.965 1.00 0.00 C ATOM 2115 O SER B 41 75.092 19.857 -3.180 1.00 0.00 O ATOM 2116 CB SER B 41 75.338 18.906 -6.325 1.00 0.00 C ATOM 2117 OG SER B 41 75.493 20.311 -6.178 1.00 0.00 O ATOM 0 H SER B 41 73.707 16.887 -4.885 1.00 0.00 H new ATOM 0 HA SER B 41 76.376 18.153 -4.598 1.00 0.00 H new ATOM 0 HB2 SER B 41 76.144 18.502 -6.938 1.00 0.00 H new ATOM 0 HB3 SER B 41 74.403 18.684 -6.840 1.00 0.00 H new ATOM 0 HG SER B 41 75.489 20.735 -7.062 1.00 0.00 H new ATOM 2123 N HIS B 42 73.244 19.001 -4.011 1.00 0.00 N ATOM 2124 CA HIS B 42 72.383 19.802 -3.092 1.00 0.00 C ATOM 2125 C HIS B 42 72.419 19.198 -1.687 1.00 0.00 C ATOM 2126 O HIS B 42 72.057 19.837 -0.719 1.00 0.00 O ATOM 2127 CB HIS B 42 70.943 19.791 -3.609 1.00 0.00 C ATOM 2128 CG HIS B 42 70.862 20.582 -4.885 1.00 0.00 C ATOM 2129 ND1 HIS B 42 70.678 21.958 -4.892 1.00 0.00 N ATOM 2130 CD2 HIS B 42 70.940 20.207 -6.204 1.00 0.00 C ATOM 2131 CE1 HIS B 42 70.651 22.357 -6.177 1.00 0.00 C ATOM 2132 NE2 HIS B 42 70.807 21.329 -7.014 1.00 0.00 N ATOM 0 H HIS B 42 72.737 18.389 -4.650 1.00 0.00 H new ATOM 0 HA HIS B 42 72.755 20.826 -3.054 1.00 0.00 H new ATOM 0 HB2 HIS B 42 70.616 18.766 -3.783 1.00 0.00 H new ATOM 0 HB3 HIS B 42 70.274 20.217 -2.862 1.00 0.00 H new ATOM 0 HD2 HIS B 42 71.083 19.196 -6.557 1.00 0.00 H new ATOM 0 HE1 HIS B 42 70.519 23.382 -6.492 1.00 0.00 H new ATOM 0 HE2 HIS B 42 70.825 21.360 -8.033 1.00 0.00 H new ATOM 2141 N PHE B 43 72.830 17.962 -1.570 1.00 0.00 N ATOM 2142 CA PHE B 43 72.864 17.300 -0.227 1.00 0.00 C ATOM 2143 C PHE B 43 74.286 17.335 0.337 1.00 0.00 C ATOM 2144 O PHE B 43 74.505 17.064 1.501 1.00 0.00 O ATOM 2145 CB PHE B 43 72.416 15.845 -0.380 1.00 0.00 C ATOM 2146 CG PHE B 43 70.984 15.811 -0.855 1.00 0.00 C ATOM 2147 CD1 PHE B 43 70.701 15.803 -2.227 1.00 0.00 C ATOM 2148 CD2 PHE B 43 69.939 15.791 0.075 1.00 0.00 C ATOM 2149 CE1 PHE B 43 69.373 15.775 -2.667 1.00 0.00 C ATOM 2150 CE2 PHE B 43 68.611 15.764 -0.365 1.00 0.00 C ATOM 2151 CZ PHE B 43 68.327 15.755 -1.736 1.00 0.00 C ATOM 0 H PHE B 43 73.144 17.380 -2.346 1.00 0.00 H new ATOM 0 HA PHE B 43 72.197 17.828 0.455 1.00 0.00 H new ATOM 0 HB2 PHE B 43 73.059 15.327 -1.091 1.00 0.00 H new ATOM 0 HB3 PHE B 43 72.508 15.322 0.572 1.00 0.00 H new ATOM 0 HD1 PHE B 43 71.508 15.818 -2.945 1.00 0.00 H new ATOM 0 HD2 PHE B 43 70.157 15.796 1.133 1.00 0.00 H new ATOM 0 HE1 PHE B 43 69.155 15.769 -3.725 1.00 0.00 H new ATOM 0 HE2 PHE B 43 67.805 15.750 0.353 1.00 0.00 H new ATOM 0 HZ PHE B 43 67.302 15.733 -2.075 1.00 0.00 H new ATOM 2161 N LEU B 44 75.253 17.679 -0.476 1.00 0.00 N ATOM 2162 CA LEU B 44 76.669 17.753 0.008 1.00 0.00 C ATOM 2163 C LEU B 44 77.065 19.230 0.109 1.00 0.00 C ATOM 2164 O LEU B 44 76.592 19.948 0.966 1.00 0.00 O ATOM 2165 CB LEU B 44 77.597 17.033 -0.989 1.00 0.00 C ATOM 2166 CG LEU B 44 77.579 15.509 -0.762 1.00 0.00 C ATOM 2167 CD1 LEU B 44 78.312 15.140 0.543 1.00 0.00 C ATOM 2168 CD2 LEU B 44 76.132 15.003 -0.702 1.00 0.00 C ATOM 0 H LEU B 44 75.123 17.913 -1.460 1.00 0.00 H new ATOM 0 HA LEU B 44 76.760 17.272 0.982 1.00 0.00 H new ATOM 0 HB2 LEU B 44 77.283 17.256 -2.009 1.00 0.00 H new ATOM 0 HB3 LEU B 44 78.615 17.408 -0.880 1.00 0.00 H new ATOM 0 HG LEU B 44 78.095 15.034 -1.597 1.00 0.00 H new ATOM 0 HD11 LEU B 44 78.286 14.059 0.682 1.00 0.00 H new ATOM 0 HD12 LEU B 44 79.348 15.474 0.485 1.00 0.00 H new ATOM 0 HD13 LEU B 44 77.821 15.626 1.386 1.00 0.00 H new ATOM 0 HD21 LEU B 44 76.130 13.925 -0.541 1.00 0.00 H new ATOM 0 HD22 LEU B 44 75.609 15.493 0.119 1.00 0.00 H new ATOM 0 HD23 LEU B 44 75.628 15.231 -1.641 1.00 0.00 H new ATOM 2180 N GLU B 45 77.917 19.688 -0.770 1.00 0.00 N ATOM 2181 CA GLU B 45 78.349 21.113 -0.749 1.00 0.00 C ATOM 2182 C GLU B 45 79.280 21.343 -1.939 1.00 0.00 C ATOM 2183 O GLU B 45 80.061 20.484 -2.292 1.00 0.00 O ATOM 2184 CB GLU B 45 79.110 21.408 0.551 1.00 0.00 C ATOM 2185 CG GLU B 45 79.556 22.877 0.582 1.00 0.00 C ATOM 2186 CD GLU B 45 78.329 23.791 0.560 1.00 0.00 C ATOM 2187 OE1 GLU B 45 77.257 23.322 0.904 1.00 0.00 O ATOM 2188 OE2 GLU B 45 78.483 24.947 0.199 1.00 0.00 O ATOM 0 H GLU B 45 78.336 19.126 -1.511 1.00 0.00 H new ATOM 0 HA GLU B 45 77.480 21.768 -0.807 1.00 0.00 H new ATOM 0 HB2 GLU B 45 78.474 21.195 1.410 1.00 0.00 H new ATOM 0 HB3 GLU B 45 79.979 20.755 0.629 1.00 0.00 H new ATOM 0 HG2 GLU B 45 80.148 23.068 1.477 1.00 0.00 H new ATOM 0 HG3 GLU B 45 80.196 23.091 -0.274 1.00 0.00 H new ATOM 2195 N GLU B 46 79.218 22.485 -2.561 1.00 0.00 N ATOM 2196 CA GLU B 46 80.125 22.728 -3.714 1.00 0.00 C ATOM 2197 C GLU B 46 81.564 22.745 -3.192 1.00 0.00 C ATOM 2198 O GLU B 46 81.880 23.446 -2.250 1.00 0.00 O ATOM 2199 CB GLU B 46 79.781 24.072 -4.365 1.00 0.00 C ATOM 2200 CG GLU B 46 80.650 24.283 -5.605 1.00 0.00 C ATOM 2201 CD GLU B 46 80.292 25.622 -6.255 1.00 0.00 C ATOM 2202 OE1 GLU B 46 79.303 26.209 -5.848 1.00 0.00 O ATOM 2203 OE2 GLU B 46 81.012 26.036 -7.148 1.00 0.00 O ATOM 0 H GLU B 46 78.588 23.251 -2.325 1.00 0.00 H new ATOM 0 HA GLU B 46 80.011 21.944 -4.462 1.00 0.00 H new ATOM 0 HB2 GLU B 46 78.727 24.094 -4.640 1.00 0.00 H new ATOM 0 HB3 GLU B 46 79.942 24.883 -3.654 1.00 0.00 H new ATOM 0 HG2 GLU B 46 81.705 24.270 -5.330 1.00 0.00 H new ATOM 0 HG3 GLU B 46 80.495 23.469 -6.314 1.00 0.00 H new ATOM 2210 N ILE B 47 82.435 21.964 -3.783 1.00 0.00 N ATOM 2211 CA ILE B 47 83.858 21.906 -3.312 1.00 0.00 C ATOM 2212 C ILE B 47 84.771 22.590 -4.329 1.00 0.00 C ATOM 2213 O ILE B 47 84.719 22.317 -5.512 1.00 0.00 O ATOM 2214 CB ILE B 47 84.274 20.440 -3.161 1.00 0.00 C ATOM 2215 CG1 ILE B 47 83.360 19.760 -2.136 1.00 0.00 C ATOM 2216 CG2 ILE B 47 85.728 20.365 -2.684 1.00 0.00 C ATOM 2217 CD1 ILE B 47 83.595 18.247 -2.154 1.00 0.00 C ATOM 0 H ILE B 47 82.222 21.360 -4.577 1.00 0.00 H new ATOM 0 HA ILE B 47 83.945 22.418 -2.354 1.00 0.00 H new ATOM 0 HB ILE B 47 84.186 19.933 -4.122 1.00 0.00 H new ATOM 0 HG12 ILE B 47 83.558 20.156 -1.140 1.00 0.00 H new ATOM 0 HG13 ILE B 47 82.317 19.978 -2.365 1.00 0.00 H new ATOM 0 HG21 ILE B 47 86.022 19.321 -2.577 1.00 0.00 H new ATOM 0 HG22 ILE B 47 86.376 20.852 -3.413 1.00 0.00 H new ATOM 0 HG23 ILE B 47 85.822 20.869 -1.722 1.00 0.00 H new ATOM 0 HD11 ILE B 47 82.943 17.769 -1.423 1.00 0.00 H new ATOM 0 HD12 ILE B 47 83.375 17.856 -3.148 1.00 0.00 H new ATOM 0 HD13 ILE B 47 84.635 18.037 -1.904 1.00 0.00 H new ATOM 2229 N LYS B 48 85.612 23.482 -3.867 1.00 0.00 N ATOM 2230 CA LYS B 48 86.545 24.205 -4.785 1.00 0.00 C ATOM 2231 C LYS B 48 87.968 23.676 -4.584 1.00 0.00 C ATOM 2232 O LYS B 48 88.794 23.753 -5.472 1.00 0.00 O ATOM 2233 CB LYS B 48 86.527 25.700 -4.442 1.00 0.00 C ATOM 2234 CG LYS B 48 85.112 26.272 -4.606 1.00 0.00 C ATOM 2235 CD LYS B 48 84.723 26.327 -6.090 1.00 0.00 C ATOM 2236 CE LYS B 48 83.558 27.303 -6.282 1.00 0.00 C ATOM 2237 NZ LYS B 48 83.247 27.428 -7.733 1.00 0.00 N ATOM 0 H LYS B 48 85.692 23.742 -2.884 1.00 0.00 H new ATOM 0 HA LYS B 48 86.232 24.050 -5.818 1.00 0.00 H new ATOM 0 HB2 LYS B 48 86.869 25.848 -3.418 1.00 0.00 H new ATOM 0 HB3 LYS B 48 87.220 26.236 -5.090 1.00 0.00 H new ATOM 0 HG2 LYS B 48 84.398 25.655 -4.060 1.00 0.00 H new ATOM 0 HG3 LYS B 48 85.065 27.272 -4.174 1.00 0.00 H new ATOM 0 HD2 LYS B 48 85.577 26.643 -6.688 1.00 0.00 H new ATOM 0 HD3 LYS B 48 84.440 25.334 -6.439 1.00 0.00 H new ATOM 0 HE2 LYS B 48 82.681 26.949 -5.741 1.00 0.00 H new ATOM 0 HE3 LYS B 48 83.815 28.278 -5.869 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 83.166 28.434 -7.985 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 84.009 26.992 -8.290 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 82.349 26.946 -7.938 1.00 0.00 H new ATOM 2251 N GLU B 49 88.264 23.157 -3.414 1.00 0.00 N ATOM 2252 CA GLU B 49 89.643 22.637 -3.131 1.00 0.00 C ATOM 2253 C GLU B 49 89.625 21.109 -3.004 1.00 0.00 C ATOM 2254 O GLU B 49 88.804 20.541 -2.312 1.00 0.00 O ATOM 2255 CB GLU B 49 90.136 23.234 -1.812 1.00 0.00 C ATOM 2256 CG GLU B 49 90.364 24.737 -1.979 1.00 0.00 C ATOM 2257 CD GLU B 49 90.819 25.336 -0.646 1.00 0.00 C ATOM 2258 OE1 GLU B 49 92.006 25.282 -0.370 1.00 0.00 O ATOM 2259 OE2 GLU B 49 89.973 25.837 0.076 1.00 0.00 O ATOM 0 H GLU B 49 87.606 23.071 -2.639 1.00 0.00 H new ATOM 0 HA GLU B 49 90.303 22.919 -3.952 1.00 0.00 H new ATOM 0 HB2 GLU B 49 89.405 23.053 -1.024 1.00 0.00 H new ATOM 0 HB3 GLU B 49 91.062 22.748 -1.505 1.00 0.00 H new ATOM 0 HG2 GLU B 49 91.116 24.918 -2.747 1.00 0.00 H new ATOM 0 HG3 GLU B 49 89.445 25.220 -2.312 1.00 0.00 H new ATOM 2266 N GLN B 50 90.540 20.447 -3.659 1.00 0.00 N ATOM 2267 CA GLN B 50 90.610 18.958 -3.575 1.00 0.00 C ATOM 2268 C GLN B 50 90.941 18.547 -2.135 1.00 0.00 C ATOM 2269 O GLN B 50 90.437 17.573 -1.619 1.00 0.00 O ATOM 2270 CB GLN B 50 91.702 18.447 -4.520 1.00 0.00 C ATOM 2271 CG GLN B 50 91.779 16.918 -4.449 1.00 0.00 C ATOM 2272 CD GLN B 50 92.827 16.411 -5.442 1.00 0.00 C ATOM 2273 OE1 GLN B 50 92.514 16.137 -6.584 1.00 0.00 O ATOM 2274 NE2 GLN B 50 94.065 16.273 -5.054 1.00 0.00 N ATOM 0 H GLN B 50 91.248 20.877 -4.254 1.00 0.00 H new ATOM 0 HA GLN B 50 89.651 18.528 -3.864 1.00 0.00 H new ATOM 0 HB2 GLN B 50 91.488 18.762 -5.541 1.00 0.00 H new ATOM 0 HB3 GLN B 50 92.664 18.881 -4.247 1.00 0.00 H new ATOM 0 HG2 GLN B 50 92.039 16.603 -3.438 1.00 0.00 H new ATOM 0 HG3 GLN B 50 90.806 16.484 -4.678 1.00 0.00 H new ATOM 0 HE21 GLN B 50 94.328 16.503 -4.096 1.00 0.00 H new ATOM 0 HE22 GLN B 50 94.770 15.935 -5.709 1.00 0.00 H new ATOM 2283 N GLU B 51 91.810 19.281 -1.498 1.00 0.00 N ATOM 2284 CA GLU B 51 92.209 18.937 -0.100 1.00 0.00 C ATOM 2285 C GLU B 51 90.961 18.603 0.725 1.00 0.00 C ATOM 2286 O GLU B 51 90.990 17.760 1.599 1.00 0.00 O ATOM 2287 CB GLU B 51 92.933 20.128 0.529 1.00 0.00 C ATOM 2288 CG GLU B 51 94.298 20.302 -0.138 1.00 0.00 C ATOM 2289 CD GLU B 51 95.026 21.493 0.486 1.00 0.00 C ATOM 2290 OE1 GLU B 51 94.397 22.217 1.240 1.00 0.00 O ATOM 2291 OE2 GLU B 51 96.196 21.667 0.190 1.00 0.00 O ATOM 0 H GLU B 51 92.264 20.108 -1.885 1.00 0.00 H new ATOM 0 HA GLU B 51 92.873 18.073 -0.115 1.00 0.00 H new ATOM 0 HB2 GLU B 51 92.339 21.034 0.409 1.00 0.00 H new ATOM 0 HB3 GLU B 51 93.057 19.968 1.600 1.00 0.00 H new ATOM 0 HG2 GLU B 51 94.891 19.396 -0.016 1.00 0.00 H new ATOM 0 HG3 GLU B 51 94.173 20.460 -1.209 1.00 0.00 H new ATOM 2298 N VAL B 52 89.865 19.242 0.435 1.00 0.00 N ATOM 2299 CA VAL B 52 88.608 18.949 1.178 1.00 0.00 C ATOM 2300 C VAL B 52 88.117 17.551 0.784 1.00 0.00 C ATOM 2301 O VAL B 52 87.527 16.840 1.573 1.00 0.00 O ATOM 2302 CB VAL B 52 87.544 19.993 0.825 1.00 0.00 C ATOM 2303 CG1 VAL B 52 86.193 19.578 1.414 1.00 0.00 C ATOM 2304 CG2 VAL B 52 87.954 21.347 1.406 1.00 0.00 C ATOM 0 H VAL B 52 89.784 19.958 -0.287 1.00 0.00 H new ATOM 0 HA VAL B 52 88.794 18.986 2.251 1.00 0.00 H new ATOM 0 HB VAL B 52 87.457 20.066 -0.259 1.00 0.00 H new ATOM 0 HG11 VAL B 52 85.440 20.324 1.160 1.00 0.00 H new ATOM 0 HG12 VAL B 52 85.899 18.612 1.004 1.00 0.00 H new ATOM 0 HG13 VAL B 52 86.277 19.502 2.498 1.00 0.00 H new ATOM 0 HG21 VAL B 52 87.199 22.093 1.157 1.00 0.00 H new ATOM 0 HG22 VAL B 52 88.041 21.267 2.490 1.00 0.00 H new ATOM 0 HG23 VAL B 52 88.914 21.648 0.986 1.00 0.00 H new ATOM 2314 N VAL B 53 88.367 17.158 -0.436 1.00 0.00 N ATOM 2315 CA VAL B 53 87.928 15.806 -0.894 1.00 0.00 C ATOM 2316 C VAL B 53 88.767 14.728 -0.194 1.00 0.00 C ATOM 2317 O VAL B 53 88.262 13.707 0.227 1.00 0.00 O ATOM 2318 CB VAL B 53 88.111 15.691 -2.414 1.00 0.00 C ATOM 2319 CG1 VAL B 53 87.861 14.249 -2.863 1.00 0.00 C ATOM 2320 CG2 VAL B 53 87.125 16.622 -3.122 1.00 0.00 C ATOM 0 H VAL B 53 88.857 17.715 -1.137 1.00 0.00 H new ATOM 0 HA VAL B 53 86.876 15.666 -0.645 1.00 0.00 H new ATOM 0 HB VAL B 53 89.131 15.975 -2.671 1.00 0.00 H new ATOM 0 HG11 VAL B 53 87.993 14.176 -3.943 1.00 0.00 H new ATOM 0 HG12 VAL B 53 88.568 13.585 -2.365 1.00 0.00 H new ATOM 0 HG13 VAL B 53 86.844 13.958 -2.601 1.00 0.00 H new ATOM 0 HG21 VAL B 53 87.257 16.539 -4.201 1.00 0.00 H new ATOM 0 HG22 VAL B 53 86.105 16.341 -2.858 1.00 0.00 H new ATOM 0 HG23 VAL B 53 87.309 17.651 -2.812 1.00 0.00 H new ATOM 2330 N ASP B 54 90.052 14.942 -0.090 1.00 0.00 N ATOM 2331 CA ASP B 54 90.931 13.923 0.558 1.00 0.00 C ATOM 2332 C ASP B 54 90.521 13.697 2.013 1.00 0.00 C ATOM 2333 O ASP B 54 90.509 12.582 2.496 1.00 0.00 O ATOM 2334 CB ASP B 54 92.383 14.403 0.513 1.00 0.00 C ATOM 2335 CG ASP B 54 92.893 14.358 -0.928 1.00 0.00 C ATOM 2336 OD1 ASP B 54 92.296 13.652 -1.724 1.00 0.00 O ATOM 2337 OD2 ASP B 54 93.871 15.029 -1.210 1.00 0.00 O ATOM 0 H ASP B 54 90.531 15.778 -0.425 1.00 0.00 H new ATOM 0 HA ASP B 54 90.829 12.983 0.016 1.00 0.00 H new ATOM 0 HB2 ASP B 54 92.453 15.418 0.903 1.00 0.00 H new ATOM 0 HB3 ASP B 54 93.005 13.773 1.149 1.00 0.00 H new ATOM 2342 N LYS B 55 90.179 14.739 2.715 1.00 0.00 N ATOM 2343 CA LYS B 55 89.763 14.565 4.137 1.00 0.00 C ATOM 2344 C LYS B 55 88.534 13.657 4.179 1.00 0.00 C ATOM 2345 O LYS B 55 88.435 12.751 4.984 1.00 0.00 O ATOM 2346 CB LYS B 55 89.419 15.932 4.746 1.00 0.00 C ATOM 2347 CG LYS B 55 89.057 15.764 6.224 1.00 0.00 C ATOM 2348 CD LYS B 55 88.697 17.126 6.829 1.00 0.00 C ATOM 2349 CE LYS B 55 89.907 18.073 6.782 1.00 0.00 C ATOM 2350 NZ LYS B 55 89.909 18.811 5.488 1.00 0.00 N ATOM 0 H LYS B 55 90.169 15.699 2.371 1.00 0.00 H new ATOM 0 HA LYS B 55 90.575 14.118 4.710 1.00 0.00 H new ATOM 0 HB2 LYS B 55 90.267 16.610 4.644 1.00 0.00 H new ATOM 0 HB3 LYS B 55 88.585 16.381 4.207 1.00 0.00 H new ATOM 0 HG2 LYS B 55 88.217 15.077 6.326 1.00 0.00 H new ATOM 0 HG3 LYS B 55 89.895 15.325 6.766 1.00 0.00 H new ATOM 0 HD2 LYS B 55 87.863 17.565 6.281 1.00 0.00 H new ATOM 0 HD3 LYS B 55 88.369 16.997 7.860 1.00 0.00 H new ATOM 0 HE2 LYS B 55 89.865 18.776 7.614 1.00 0.00 H new ATOM 0 HE3 LYS B 55 90.831 17.505 6.891 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 90.786 18.602 4.970 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 89.092 18.514 4.918 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 89.850 19.833 5.671 1.00 0.00 H new ATOM 2364 N VAL B 56 87.596 13.915 3.317 1.00 0.00 N ATOM 2365 CA VAL B 56 86.350 13.099 3.279 1.00 0.00 C ATOM 2366 C VAL B 56 86.690 11.636 2.984 1.00 0.00 C ATOM 2367 O VAL B 56 86.102 10.728 3.539 1.00 0.00 O ATOM 2368 CB VAL B 56 85.427 13.649 2.182 1.00 0.00 C ATOM 2369 CG1 VAL B 56 84.249 12.694 1.960 1.00 0.00 C ATOM 2370 CG2 VAL B 56 84.900 15.020 2.609 1.00 0.00 C ATOM 0 H VAL B 56 87.638 14.665 2.627 1.00 0.00 H new ATOM 0 HA VAL B 56 85.849 13.154 4.245 1.00 0.00 H new ATOM 0 HB VAL B 56 85.988 13.742 1.252 1.00 0.00 H new ATOM 0 HG11 VAL B 56 83.600 13.092 1.180 1.00 0.00 H new ATOM 0 HG12 VAL B 56 84.625 11.717 1.655 1.00 0.00 H new ATOM 0 HG13 VAL B 56 83.683 12.592 2.886 1.00 0.00 H new ATOM 0 HG21 VAL B 56 84.244 15.415 1.833 1.00 0.00 H new ATOM 0 HG22 VAL B 56 84.343 14.922 3.540 1.00 0.00 H new ATOM 0 HG23 VAL B 56 85.738 15.702 2.758 1.00 0.00 H new ATOM 2380 N MET B 57 87.619 11.398 2.103 1.00 0.00 N ATOM 2381 CA MET B 57 87.977 9.993 1.756 1.00 0.00 C ATOM 2382 C MET B 57 88.642 9.294 2.946 1.00 0.00 C ATOM 2383 O MET B 57 88.385 8.138 3.219 1.00 0.00 O ATOM 2384 CB MET B 57 88.933 10.006 0.565 1.00 0.00 C ATOM 2385 CG MET B 57 88.164 10.446 -0.679 1.00 0.00 C ATOM 2386 SD MET B 57 89.274 10.469 -2.104 1.00 0.00 S ATOM 2387 CE MET B 57 89.616 8.692 -2.178 1.00 0.00 C ATOM 0 H MET B 57 88.147 12.115 1.607 1.00 0.00 H new ATOM 0 HA MET B 57 87.069 9.445 1.502 1.00 0.00 H new ATOM 0 HB2 MET B 57 89.764 10.686 0.755 1.00 0.00 H new ATOM 0 HB3 MET B 57 89.361 9.015 0.413 1.00 0.00 H new ATOM 0 HG2 MET B 57 87.333 9.766 -0.864 1.00 0.00 H new ATOM 0 HG3 MET B 57 87.736 11.436 -0.523 1.00 0.00 H new ATOM 0 HE1 MET B 57 89.899 8.418 -3.194 1.00 0.00 H new ATOM 0 HE2 MET B 57 90.432 8.450 -1.497 1.00 0.00 H new ATOM 0 HE3 MET B 57 88.724 8.137 -1.888 1.00 0.00 H new ATOM 2397 N GLU B 58 89.488 9.979 3.661 1.00 0.00 N ATOM 2398 CA GLU B 58 90.151 9.336 4.832 1.00 0.00 C ATOM 2399 C GLU B 58 89.100 9.034 5.897 1.00 0.00 C ATOM 2400 O GLU B 58 89.071 7.967 6.476 1.00 0.00 O ATOM 2401 CB GLU B 58 91.202 10.285 5.410 1.00 0.00 C ATOM 2402 CG GLU B 58 92.375 10.405 4.438 1.00 0.00 C ATOM 2403 CD GLU B 58 93.399 11.396 4.994 1.00 0.00 C ATOM 2404 OE1 GLU B 58 94.244 10.974 5.766 1.00 0.00 O ATOM 2405 OE2 GLU B 58 93.320 12.560 4.638 1.00 0.00 O ATOM 0 H GLU B 58 89.749 10.950 3.489 1.00 0.00 H new ATOM 0 HA GLU B 58 90.634 8.411 4.517 1.00 0.00 H new ATOM 0 HB2 GLU B 58 90.762 11.266 5.587 1.00 0.00 H new ATOM 0 HB3 GLU B 58 91.551 9.913 6.373 1.00 0.00 H new ATOM 0 HG2 GLU B 58 92.840 9.430 4.290 1.00 0.00 H new ATOM 0 HG3 GLU B 58 92.021 10.740 3.463 1.00 0.00 H new ATOM 2412 N THR B 59 88.223 9.965 6.141 1.00 0.00 N ATOM 2413 CA THR B 59 87.153 9.735 7.148 1.00 0.00 C ATOM 2414 C THR B 59 86.170 8.706 6.594 1.00 0.00 C ATOM 2415 O THR B 59 85.696 7.834 7.294 1.00 0.00 O ATOM 2416 CB THR B 59 86.423 11.055 7.425 1.00 0.00 C ATOM 2417 OG1 THR B 59 87.349 12.009 7.926 1.00 0.00 O ATOM 2418 CG2 THR B 59 85.316 10.827 8.456 1.00 0.00 C ATOM 0 H THR B 59 88.201 10.877 5.685 1.00 0.00 H new ATOM 0 HA THR B 59 87.586 9.366 8.078 1.00 0.00 H new ATOM 0 HB THR B 59 85.981 11.425 6.500 1.00 0.00 H new ATOM 0 HG1 THR B 59 87.844 12.408 7.180 1.00 0.00 H new ATOM 0 HG21 THR B 59 84.800 11.767 8.650 1.00 0.00 H new ATOM 0 HG22 THR B 59 84.605 10.096 8.071 1.00 0.00 H new ATOM 0 HG23 THR B 59 85.753 10.455 9.383 1.00 0.00 H new ATOM 2426 N LEU B 60 85.873 8.803 5.330 1.00 0.00 N ATOM 2427 CA LEU B 60 84.925 7.839 4.711 1.00 0.00 C ATOM 2428 C LEU B 60 85.577 6.457 4.627 1.00 0.00 C ATOM 2429 O LEU B 60 84.936 5.448 4.843 1.00 0.00 O ATOM 2430 CB LEU B 60 84.562 8.319 3.303 1.00 0.00 C ATOM 2431 CG LEU B 60 83.584 7.343 2.635 1.00 0.00 C ATOM 2432 CD1 LEU B 60 82.292 7.235 3.463 1.00 0.00 C ATOM 2433 CD2 LEU B 60 83.260 7.862 1.231 1.00 0.00 C ATOM 0 H LEU B 60 86.247 9.510 4.697 1.00 0.00 H new ATOM 0 HA LEU B 60 84.023 7.775 5.320 1.00 0.00 H new ATOM 0 HB2 LEU B 60 84.115 9.312 3.355 1.00 0.00 H new ATOM 0 HB3 LEU B 60 85.465 8.408 2.699 1.00 0.00 H new ATOM 0 HG LEU B 60 84.037 6.354 2.573 1.00 0.00 H new ATOM 0 HD11 LEU B 60 81.606 6.540 2.979 1.00 0.00 H new ATOM 0 HD12 LEU B 60 82.530 6.872 4.463 1.00 0.00 H new ATOM 0 HD13 LEU B 60 81.823 8.216 3.535 1.00 0.00 H new ATOM 0 HD21 LEU B 60 82.565 7.179 0.742 1.00 0.00 H new ATOM 0 HD22 LEU B 60 82.806 8.850 1.304 1.00 0.00 H new ATOM 0 HD23 LEU B 60 84.178 7.926 0.646 1.00 0.00 H new ATOM 2445 N ASP B 61 86.839 6.397 4.294 1.00 0.00 N ATOM 2446 CA ASP B 61 87.517 5.072 4.174 1.00 0.00 C ATOM 2447 C ASP B 61 87.621 4.404 5.543 1.00 0.00 C ATOM 2448 O ASP B 61 88.420 4.782 6.376 1.00 0.00 O ATOM 2449 CB ASP B 61 88.924 5.266 3.602 1.00 0.00 C ATOM 2450 CG ASP B 61 88.827 5.669 2.130 1.00 0.00 C ATOM 2451 OD1 ASP B 61 87.790 5.423 1.537 1.00 0.00 O ATOM 2452 OD2 ASP B 61 89.794 6.209 1.619 1.00 0.00 O ATOM 0 H ASP B 61 87.429 7.206 4.100 1.00 0.00 H new ATOM 0 HA ASP B 61 86.930 4.437 3.510 1.00 0.00 H new ATOM 0 HB2 ASP B 61 89.454 6.034 4.166 1.00 0.00 H new ATOM 0 HB3 ASP B 61 89.498 4.345 3.700 1.00 0.00 H new ATOM 2457 N GLU B 62 86.817 3.410 5.777 1.00 0.00 N ATOM 2458 CA GLU B 62 86.864 2.708 7.083 1.00 0.00 C ATOM 2459 C GLU B 62 88.251 2.087 7.278 1.00 0.00 C ATOM 2460 O GLU B 62 88.796 2.084 8.364 1.00 0.00 O ATOM 2461 CB GLU B 62 85.807 1.606 7.105 1.00 0.00 C ATOM 2462 CG GLU B 62 84.412 2.232 7.158 1.00 0.00 C ATOM 2463 CD GLU B 62 84.192 2.876 8.526 1.00 0.00 C ATOM 2464 OE1 GLU B 62 84.918 2.531 9.444 1.00 0.00 O ATOM 2465 OE2 GLU B 62 83.300 3.701 8.634 1.00 0.00 O ATOM 0 H GLU B 62 86.127 3.052 5.117 1.00 0.00 H new ATOM 0 HA GLU B 62 86.667 3.418 7.886 1.00 0.00 H new ATOM 0 HB2 GLU B 62 85.902 0.980 6.218 1.00 0.00 H new ATOM 0 HB3 GLU B 62 85.959 0.960 7.969 1.00 0.00 H new ATOM 0 HG2 GLU B 62 84.308 2.980 6.372 1.00 0.00 H new ATOM 0 HG3 GLU B 62 83.653 1.471 6.977 1.00 0.00 H new ATOM 2472 N ASP B 63 88.815 1.534 6.234 1.00 0.00 N ATOM 2473 CA ASP B 63 90.156 0.883 6.352 1.00 0.00 C ATOM 2474 C ASP B 63 91.277 1.847 5.941 1.00 0.00 C ATOM 2475 O ASP B 63 92.443 1.561 6.131 1.00 0.00 O ATOM 2476 CB ASP B 63 90.191 -0.348 5.445 1.00 0.00 C ATOM 2477 CG ASP B 63 89.927 0.077 3.999 1.00 0.00 C ATOM 2478 OD1 ASP B 63 89.679 1.251 3.784 1.00 0.00 O ATOM 2479 OD2 ASP B 63 89.980 -0.779 3.132 1.00 0.00 O ATOM 0 H ASP B 63 88.403 1.505 5.301 1.00 0.00 H new ATOM 0 HA ASP B 63 90.315 0.597 7.392 1.00 0.00 H new ATOM 0 HB2 ASP B 63 91.161 -0.840 5.519 1.00 0.00 H new ATOM 0 HB3 ASP B 63 89.441 -1.071 5.766 1.00 0.00 H new ATOM 2484 N GLY B 64 90.951 2.981 5.382 1.00 0.00 N ATOM 2485 CA GLY B 64 92.026 3.933 4.974 1.00 0.00 C ATOM 2486 C GLY B 64 92.821 3.342 3.805 1.00 0.00 C ATOM 2487 O GLY B 64 93.993 3.618 3.638 1.00 0.00 O ATOM 0 H GLY B 64 89.997 3.288 5.191 1.00 0.00 H new ATOM 0 HA2 GLY B 64 91.589 4.888 4.683 1.00 0.00 H new ATOM 0 HA3 GLY B 64 92.690 4.130 5.816 1.00 0.00 H new ATOM 2491 N ASP B 65 92.197 2.531 2.993 1.00 0.00 N ATOM 2492 CA ASP B 65 92.923 1.921 1.841 1.00 0.00 C ATOM 2493 C ASP B 65 93.228 3.004 0.803 1.00 0.00 C ATOM 2494 O ASP B 65 93.898 2.760 -0.181 1.00 0.00 O ATOM 2495 CB ASP B 65 92.044 0.845 1.204 1.00 0.00 C ATOM 2496 CG ASP B 65 90.749 1.482 0.693 1.00 0.00 C ATOM 2497 OD1 ASP B 65 90.423 2.565 1.154 1.00 0.00 O ATOM 2498 OD2 ASP B 65 90.106 0.877 -0.148 1.00 0.00 O ATOM 0 H ASP B 65 91.216 2.265 3.078 1.00 0.00 H new ATOM 0 HA ASP B 65 93.855 1.476 2.190 1.00 0.00 H new ATOM 0 HB2 ASP B 65 92.575 0.366 0.382 1.00 0.00 H new ATOM 0 HB3 ASP B 65 91.817 0.067 1.933 1.00 0.00 H new ATOM 2503 N GLY B 66 92.760 4.203 1.025 1.00 0.00 N ATOM 2504 CA GLY B 66 93.037 5.315 0.062 1.00 0.00 C ATOM 2505 C GLY B 66 91.951 5.384 -1.020 1.00 0.00 C ATOM 2506 O GLY B 66 91.805 6.390 -1.685 1.00 0.00 O ATOM 0 H GLY B 66 92.196 4.464 1.834 1.00 0.00 H new ATOM 0 HA2 GLY B 66 93.083 6.263 0.598 1.00 0.00 H new ATOM 0 HA3 GLY B 66 94.011 5.164 -0.403 1.00 0.00 H new ATOM 2510 N GLU B 67 91.181 4.335 -1.201 1.00 0.00 N ATOM 2511 CA GLU B 67 90.094 4.343 -2.237 1.00 0.00 C ATOM 2512 C GLU B 67 88.797 3.876 -1.586 1.00 0.00 C ATOM 2513 O GLU B 67 88.807 3.312 -0.511 1.00 0.00 O ATOM 2514 CB GLU B 67 90.437 3.385 -3.383 1.00 0.00 C ATOM 2515 CG GLU B 67 91.605 3.943 -4.197 1.00 0.00 C ATOM 2516 CD GLU B 67 92.911 3.770 -3.416 1.00 0.00 C ATOM 2517 OE1 GLU B 67 92.898 3.060 -2.425 1.00 0.00 O ATOM 2518 OE2 GLU B 67 93.902 4.348 -3.829 1.00 0.00 O ATOM 0 H GLU B 67 91.259 3.467 -0.672 1.00 0.00 H new ATOM 0 HA GLU B 67 89.990 5.352 -2.635 1.00 0.00 H new ATOM 0 HB2 GLU B 67 90.697 2.405 -2.983 1.00 0.00 H new ATOM 0 HB3 GLU B 67 89.568 3.247 -4.026 1.00 0.00 H new ATOM 0 HG2 GLU B 67 91.672 3.427 -5.155 1.00 0.00 H new ATOM 0 HG3 GLU B 67 91.438 4.998 -4.414 1.00 0.00 H new ATOM 2525 N CYS B 68 87.677 4.103 -2.226 1.00 0.00 N ATOM 2526 CA CYS B 68 86.372 3.664 -1.638 1.00 0.00 C ATOM 2527 C CYS B 68 85.928 2.348 -2.295 1.00 0.00 C ATOM 2528 O CYS B 68 85.575 2.307 -3.463 1.00 0.00 O ATOM 2529 CB CYS B 68 85.318 4.744 -1.892 1.00 0.00 C ATOM 2530 SG CYS B 68 83.810 4.345 -0.979 1.00 0.00 S ATOM 0 H CYS B 68 87.609 4.573 -3.129 1.00 0.00 H new ATOM 0 HA CYS B 68 86.487 3.509 -0.565 1.00 0.00 H new ATOM 0 HB2 CYS B 68 85.697 5.717 -1.580 1.00 0.00 H new ATOM 0 HB3 CYS B 68 85.102 4.813 -2.958 1.00 0.00 H new ATOM 0 HG CYS B 68 82.916 5.264 -1.194 1.00 0.00 H new ATOM 2536 N ASP B 69 85.983 1.266 -1.555 1.00 0.00 N ATOM 2537 CA ASP B 69 85.600 -0.067 -2.113 1.00 0.00 C ATOM 2538 C ASP B 69 84.084 -0.146 -2.333 1.00 0.00 C ATOM 2539 O ASP B 69 83.340 0.751 -1.993 1.00 0.00 O ATOM 2540 CB ASP B 69 86.030 -1.172 -1.137 1.00 0.00 C ATOM 2541 CG ASP B 69 86.091 -2.518 -1.866 1.00 0.00 C ATOM 2542 OD1 ASP B 69 85.642 -2.579 -2.998 1.00 0.00 O ATOM 2543 OD2 ASP B 69 86.593 -3.463 -1.280 1.00 0.00 O ATOM 0 H ASP B 69 86.280 1.251 -0.579 1.00 0.00 H new ATOM 0 HA ASP B 69 86.101 -0.201 -3.072 1.00 0.00 H new ATOM 0 HB2 ASP B 69 87.005 -0.934 -0.712 1.00 0.00 H new ATOM 0 HB3 ASP B 69 85.326 -1.230 -0.307 1.00 0.00 H new ATOM 2548 N PHE B 70 83.640 -1.233 -2.904 1.00 0.00 N ATOM 2549 CA PHE B 70 82.180 -1.414 -3.163 1.00 0.00 C ATOM 2550 C PHE B 70 81.397 -1.442 -1.845 1.00 0.00 C ATOM 2551 O PHE B 70 80.395 -0.774 -1.694 1.00 0.00 O ATOM 2552 CB PHE B 70 81.946 -2.731 -3.902 1.00 0.00 C ATOM 2553 CG PHE B 70 80.471 -2.876 -4.202 1.00 0.00 C ATOM 2554 CD1 PHE B 70 79.602 -3.380 -3.226 1.00 0.00 C ATOM 2555 CD2 PHE B 70 79.973 -2.502 -5.457 1.00 0.00 C ATOM 2556 CE1 PHE B 70 78.236 -3.510 -3.504 1.00 0.00 C ATOM 2557 CE2 PHE B 70 78.606 -2.633 -5.734 1.00 0.00 C ATOM 2558 CZ PHE B 70 77.739 -3.138 -4.758 1.00 0.00 C ATOM 0 H PHE B 70 84.229 -2.009 -3.205 1.00 0.00 H new ATOM 0 HA PHE B 70 81.834 -0.577 -3.769 1.00 0.00 H new ATOM 0 HB2 PHE B 70 82.521 -2.750 -4.828 1.00 0.00 H new ATOM 0 HB3 PHE B 70 82.290 -3.569 -3.295 1.00 0.00 H new ATOM 0 HD1 PHE B 70 79.986 -3.668 -2.259 1.00 0.00 H new ATOM 0 HD2 PHE B 70 80.642 -2.113 -6.210 1.00 0.00 H new ATOM 0 HE1 PHE B 70 77.566 -3.897 -2.751 1.00 0.00 H new ATOM 0 HE2 PHE B 70 78.221 -2.344 -6.701 1.00 0.00 H new ATOM 0 HZ PHE B 70 76.686 -3.241 -4.973 1.00 0.00 H new ATOM 2568 N GLN B 71 81.820 -2.242 -0.907 1.00 0.00 N ATOM 2569 CA GLN B 71 81.061 -2.338 0.374 1.00 0.00 C ATOM 2570 C GLN B 71 81.014 -0.963 1.046 1.00 0.00 C ATOM 2571 O GLN B 71 79.955 -0.463 1.367 1.00 0.00 O ATOM 2572 CB GLN B 71 81.740 -3.346 1.302 1.00 0.00 C ATOM 2573 CG GLN B 71 81.570 -4.757 0.733 1.00 0.00 C ATOM 2574 CD GLN B 71 82.352 -5.751 1.594 1.00 0.00 C ATOM 2575 OE1 GLN B 71 83.248 -5.370 2.321 1.00 0.00 O ATOM 2576 NE2 GLN B 71 82.049 -7.020 1.542 1.00 0.00 N ATOM 0 H GLN B 71 82.651 -2.830 -0.969 1.00 0.00 H new ATOM 0 HA GLN B 71 80.044 -2.672 0.168 1.00 0.00 H new ATOM 0 HB2 GLN B 71 82.799 -3.108 1.403 1.00 0.00 H new ATOM 0 HB3 GLN B 71 81.304 -3.289 2.299 1.00 0.00 H new ATOM 0 HG2 GLN B 71 80.514 -5.028 0.713 1.00 0.00 H new ATOM 0 HG3 GLN B 71 81.927 -4.791 -0.296 1.00 0.00 H new ATOM 0 HE21 GLN B 71 81.297 -7.340 0.932 1.00 0.00 H new ATOM 0 HE22 GLN B 71 82.564 -7.691 2.112 1.00 0.00 H new ATOM 2585 N GLU B 72 82.139 -0.339 1.262 1.00 0.00 N ATOM 2586 CA GLU B 72 82.114 1.004 1.913 1.00 0.00 C ATOM 2587 C GLU B 72 81.294 1.938 1.024 1.00 0.00 C ATOM 2588 O GLU B 72 80.462 2.696 1.483 1.00 0.00 O ATOM 2589 CB GLU B 72 83.543 1.534 2.036 1.00 0.00 C ATOM 2590 CG GLU B 72 84.303 0.713 3.081 1.00 0.00 C ATOM 2591 CD GLU B 72 85.778 1.116 3.076 1.00 0.00 C ATOM 2592 OE1 GLU B 72 86.122 2.040 3.794 1.00 0.00 O ATOM 2593 OE2 GLU B 72 86.540 0.494 2.354 1.00 0.00 O ATOM 0 H GLU B 72 83.064 -0.694 1.020 1.00 0.00 H new ATOM 0 HA GLU B 72 81.674 0.942 2.908 1.00 0.00 H new ATOM 0 HB2 GLU B 72 84.049 1.474 1.072 1.00 0.00 H new ATOM 0 HB3 GLU B 72 83.529 2.585 2.324 1.00 0.00 H new ATOM 0 HG2 GLU B 72 83.874 0.877 4.070 1.00 0.00 H new ATOM 0 HG3 GLU B 72 84.205 -0.351 2.864 1.00 0.00 H new ATOM 2600 N PHE B 73 81.534 1.872 -0.254 1.00 0.00 N ATOM 2601 CA PHE B 73 80.777 2.743 -1.195 1.00 0.00 C ATOM 2602 C PHE B 73 79.287 2.614 -0.861 1.00 0.00 C ATOM 2603 O PHE B 73 78.555 3.583 -0.848 1.00 0.00 O ATOM 2604 CB PHE B 73 81.029 2.315 -2.640 1.00 0.00 C ATOM 2605 CG PHE B 73 80.137 3.116 -3.554 1.00 0.00 C ATOM 2606 CD1 PHE B 73 80.586 4.334 -4.074 1.00 0.00 C ATOM 2607 CD2 PHE B 73 78.863 2.641 -3.878 1.00 0.00 C ATOM 2608 CE1 PHE B 73 79.759 5.079 -4.924 1.00 0.00 C ATOM 2609 CE2 PHE B 73 78.034 3.384 -4.727 1.00 0.00 C ATOM 2610 CZ PHE B 73 78.482 4.604 -5.250 1.00 0.00 C ATOM 0 H PHE B 73 82.220 1.254 -0.688 1.00 0.00 H new ATOM 0 HA PHE B 73 81.103 3.778 -1.091 1.00 0.00 H new ATOM 0 HB2 PHE B 73 82.075 2.473 -2.902 1.00 0.00 H new ATOM 0 HB3 PHE B 73 80.828 1.250 -2.757 1.00 0.00 H new ATOM 0 HD1 PHE B 73 81.570 4.700 -3.820 1.00 0.00 H new ATOM 0 HD2 PHE B 73 78.518 1.701 -3.473 1.00 0.00 H new ATOM 0 HE1 PHE B 73 80.105 6.019 -5.328 1.00 0.00 H new ATOM 0 HE2 PHE B 73 77.050 3.017 -4.979 1.00 0.00 H new ATOM 0 HZ PHE B 73 77.843 5.178 -5.904 1.00 0.00 H new ATOM 2620 N MET B 74 78.849 1.425 -0.559 1.00 0.00 N ATOM 2621 CA MET B 74 77.424 1.224 -0.184 1.00 0.00 C ATOM 2622 C MET B 74 77.148 1.999 1.111 1.00 0.00 C ATOM 2623 O MET B 74 76.060 2.483 1.342 1.00 0.00 O ATOM 2624 CB MET B 74 77.154 -0.266 0.039 1.00 0.00 C ATOM 2625 CG MET B 74 75.649 -0.499 0.173 1.00 0.00 C ATOM 2626 SD MET B 74 74.870 -0.361 -1.455 1.00 0.00 S ATOM 2627 CE MET B 74 73.259 0.234 -0.885 1.00 0.00 C ATOM 0 H MET B 74 79.420 0.580 -0.556 1.00 0.00 H new ATOM 0 HA MET B 74 76.774 1.584 -0.981 1.00 0.00 H new ATOM 0 HB2 MET B 74 77.549 -0.846 -0.795 1.00 0.00 H new ATOM 0 HB3 MET B 74 77.667 -0.609 0.938 1.00 0.00 H new ATOM 0 HG2 MET B 74 75.459 -1.485 0.596 1.00 0.00 H new ATOM 0 HG3 MET B 74 75.217 0.231 0.858 1.00 0.00 H new ATOM 0 HE1 MET B 74 72.605 0.390 -1.743 1.00 0.00 H new ATOM 0 HE2 MET B 74 72.814 -0.504 -0.218 1.00 0.00 H new ATOM 0 HE3 MET B 74 73.387 1.175 -0.350 1.00 0.00 H new ATOM 2637 N ALA B 75 78.144 2.144 1.945 1.00 0.00 N ATOM 2638 CA ALA B 75 77.945 2.921 3.204 1.00 0.00 C ATOM 2639 C ALA B 75 77.668 4.375 2.814 1.00 0.00 C ATOM 2640 O ALA B 75 76.705 4.981 3.239 1.00 0.00 O ATOM 2641 CB ALA B 75 79.209 2.842 4.066 1.00 0.00 C ATOM 0 H ALA B 75 79.080 1.761 1.811 1.00 0.00 H new ATOM 0 HA ALA B 75 77.112 2.516 3.778 1.00 0.00 H new ATOM 0 HB1 ALA B 75 79.060 3.410 4.984 1.00 0.00 H new ATOM 0 HB2 ALA B 75 79.416 1.801 4.314 1.00 0.00 H new ATOM 0 HB3 ALA B 75 80.052 3.258 3.515 1.00 0.00 H new ATOM 2647 N PHE B 76 78.522 4.922 1.995 1.00 0.00 N ATOM 2648 CA PHE B 76 78.349 6.331 1.546 1.00 0.00 C ATOM 2649 C PHE B 76 76.935 6.478 0.992 1.00 0.00 C ATOM 2650 O PHE B 76 76.252 7.453 1.236 1.00 0.00 O ATOM 2651 CB PHE B 76 79.369 6.641 0.449 1.00 0.00 C ATOM 2652 CG PHE B 76 79.206 8.066 -0.017 1.00 0.00 C ATOM 2653 CD1 PHE B 76 79.795 9.109 0.708 1.00 0.00 C ATOM 2654 CD2 PHE B 76 78.467 8.346 -1.174 1.00 0.00 C ATOM 2655 CE1 PHE B 76 79.647 10.432 0.276 1.00 0.00 C ATOM 2656 CE2 PHE B 76 78.322 9.670 -1.607 1.00 0.00 C ATOM 2657 CZ PHE B 76 78.911 10.712 -0.881 1.00 0.00 C ATOM 0 H PHE B 76 79.341 4.448 1.614 1.00 0.00 H new ATOM 0 HA PHE B 76 78.502 7.021 2.376 1.00 0.00 H new ATOM 0 HB2 PHE B 76 80.380 6.486 0.826 1.00 0.00 H new ATOM 0 HB3 PHE B 76 79.233 5.958 -0.389 1.00 0.00 H new ATOM 0 HD1 PHE B 76 80.363 8.893 1.600 1.00 0.00 H new ATOM 0 HD2 PHE B 76 78.010 7.542 -1.731 1.00 0.00 H new ATOM 0 HE1 PHE B 76 80.101 11.237 0.835 1.00 0.00 H new ATOM 0 HE2 PHE B 76 77.756 9.887 -2.501 1.00 0.00 H new ATOM 0 HZ PHE B 76 78.797 11.733 -1.214 1.00 0.00 H new ATOM 2667 N VAL B 77 76.484 5.491 0.278 1.00 0.00 N ATOM 2668 CA VAL B 77 75.098 5.555 -0.251 1.00 0.00 C ATOM 2669 C VAL B 77 74.158 5.665 0.956 1.00 0.00 C ATOM 2670 O VAL B 77 73.219 6.434 0.960 1.00 0.00 O ATOM 2671 CB VAL B 77 74.775 4.298 -1.066 1.00 0.00 C ATOM 2672 CG1 VAL B 77 73.279 4.267 -1.391 1.00 0.00 C ATOM 2673 CG2 VAL B 77 75.578 4.315 -2.370 1.00 0.00 C ATOM 0 H VAL B 77 77.009 4.650 0.039 1.00 0.00 H new ATOM 0 HA VAL B 77 74.979 6.413 -0.913 1.00 0.00 H new ATOM 0 HB VAL B 77 75.039 3.414 -0.486 1.00 0.00 H new ATOM 0 HG11 VAL B 77 73.051 3.372 -1.971 1.00 0.00 H new ATOM 0 HG12 VAL B 77 72.705 4.255 -0.464 1.00 0.00 H new ATOM 0 HG13 VAL B 77 73.014 5.152 -1.970 1.00 0.00 H new ATOM 0 HG21 VAL B 77 75.349 3.421 -2.950 1.00 0.00 H new ATOM 0 HG22 VAL B 77 75.314 5.201 -2.948 1.00 0.00 H new ATOM 0 HG23 VAL B 77 76.643 4.335 -2.141 1.00 0.00 H new ATOM 2683 N SER B 78 74.418 4.895 1.988 1.00 0.00 N ATOM 2684 CA SER B 78 73.557 4.948 3.206 1.00 0.00 C ATOM 2685 C SER B 78 73.777 6.268 3.950 1.00 0.00 C ATOM 2686 O SER B 78 72.840 6.912 4.375 1.00 0.00 O ATOM 2687 CB SER B 78 73.919 3.786 4.132 1.00 0.00 C ATOM 2688 OG SER B 78 75.137 4.081 4.804 1.00 0.00 O ATOM 0 H SER B 78 75.192 4.232 2.036 1.00 0.00 H new ATOM 0 HA SER B 78 72.512 4.875 2.905 1.00 0.00 H new ATOM 0 HB2 SER B 78 73.121 3.622 4.857 1.00 0.00 H new ATOM 0 HB3 SER B 78 74.022 2.866 3.557 1.00 0.00 H new ATOM 0 HG SER B 78 75.803 4.389 4.154 1.00 0.00 H new ATOM 2694 N MET B 79 75.008 6.661 4.140 1.00 0.00 N ATOM 2695 CA MET B 79 75.276 7.924 4.893 1.00 0.00 C ATOM 2696 C MET B 79 74.452 9.051 4.281 1.00 0.00 C ATOM 2697 O MET B 79 73.883 9.867 4.979 1.00 0.00 O ATOM 2698 CB MET B 79 76.765 8.270 4.804 1.00 0.00 C ATOM 2699 CG MET B 79 77.065 9.481 5.689 1.00 0.00 C ATOM 2700 SD MET B 79 78.831 9.869 5.603 1.00 0.00 S ATOM 2701 CE MET B 79 78.847 11.145 6.887 1.00 0.00 C ATOM 0 H MET B 79 75.836 6.166 3.809 1.00 0.00 H new ATOM 0 HA MET B 79 75.002 7.793 5.940 1.00 0.00 H new ATOM 0 HB2 MET B 79 77.366 7.418 5.121 1.00 0.00 H new ATOM 0 HB3 MET B 79 77.037 8.486 3.771 1.00 0.00 H new ATOM 0 HG2 MET B 79 76.477 10.339 5.362 1.00 0.00 H new ATOM 0 HG3 MET B 79 76.777 9.272 6.719 1.00 0.00 H new ATOM 0 HE1 MET B 79 79.860 11.531 7.003 1.00 0.00 H new ATOM 0 HE2 MET B 79 78.179 11.957 6.601 1.00 0.00 H new ATOM 0 HE3 MET B 79 78.512 10.715 7.831 1.00 0.00 H new ATOM 2711 N VAL B 80 74.356 9.084 2.989 1.00 0.00 N ATOM 2712 CA VAL B 80 73.538 10.135 2.332 1.00 0.00 C ATOM 2713 C VAL B 80 72.067 9.883 2.681 1.00 0.00 C ATOM 2714 O VAL B 80 71.264 10.792 2.745 1.00 0.00 O ATOM 2715 CB VAL B 80 73.745 10.068 0.818 1.00 0.00 C ATOM 2716 CG1 VAL B 80 72.728 10.972 0.116 1.00 0.00 C ATOM 2717 CG2 VAL B 80 75.162 10.542 0.481 1.00 0.00 C ATOM 0 H VAL B 80 74.810 8.427 2.354 1.00 0.00 H new ATOM 0 HA VAL B 80 73.834 11.125 2.678 1.00 0.00 H new ATOM 0 HB VAL B 80 73.608 9.041 0.479 1.00 0.00 H new ATOM 0 HG11 VAL B 80 72.879 10.921 -0.962 1.00 0.00 H new ATOM 0 HG12 VAL B 80 71.718 10.639 0.357 1.00 0.00 H new ATOM 0 HG13 VAL B 80 72.861 12.000 0.453 1.00 0.00 H new ATOM 0 HG21 VAL B 80 75.314 10.496 -0.597 1.00 0.00 H new ATOM 0 HG22 VAL B 80 75.293 11.569 0.822 1.00 0.00 H new ATOM 0 HG23 VAL B 80 75.889 9.899 0.978 1.00 0.00 H new ATOM 2727 N THR B 81 71.722 8.647 2.936 1.00 0.00 N ATOM 2728 CA THR B 81 70.317 8.323 3.316 1.00 0.00 C ATOM 2729 C THR B 81 70.120 8.655 4.799 1.00 0.00 C ATOM 2730 O THR B 81 69.183 9.328 5.180 1.00 0.00 O ATOM 2731 CB THR B 81 70.051 6.833 3.084 1.00 0.00 C ATOM 2732 OG1 THR B 81 70.457 6.482 1.769 1.00 0.00 O ATOM 2733 CG2 THR B 81 68.557 6.546 3.252 1.00 0.00 C ATOM 0 H THR B 81 72.355 7.848 2.897 1.00 0.00 H new ATOM 0 HA THR B 81 69.625 8.906 2.709 1.00 0.00 H new ATOM 0 HB THR B 81 70.614 6.246 3.809 1.00 0.00 H new ATOM 0 HG1 THR B 81 71.435 6.437 1.730 1.00 0.00 H new ATOM 0 HG21 THR B 81 68.369 5.485 3.087 1.00 0.00 H new ATOM 0 HG22 THR B 81 68.246 6.816 4.261 1.00 0.00 H new ATOM 0 HG23 THR B 81 67.990 7.132 2.528 1.00 0.00 H new ATOM 2741 N THR B 82 71.013 8.191 5.633 1.00 0.00 N ATOM 2742 CA THR B 82 70.912 8.470 7.090 1.00 0.00 C ATOM 2743 C THR B 82 71.203 9.949 7.345 1.00 0.00 C ATOM 2744 O THR B 82 70.929 10.471 8.407 1.00 0.00 O ATOM 2745 CB THR B 82 71.941 7.622 7.842 1.00 0.00 C ATOM 2746 OG1 THR B 82 73.250 8.036 7.476 1.00 0.00 O ATOM 2747 CG2 THR B 82 71.758 6.142 7.495 1.00 0.00 C ATOM 0 H THR B 82 71.816 7.624 5.360 1.00 0.00 H new ATOM 0 HA THR B 82 69.908 8.226 7.437 1.00 0.00 H new ATOM 0 HB THR B 82 71.799 7.755 8.914 1.00 0.00 H new ATOM 0 HG1 THR B 82 73.911 7.495 7.957 1.00 0.00 H new ATOM 0 HG21 THR B 82 72.495 5.548 8.035 1.00 0.00 H new ATOM 0 HG22 THR B 82 70.755 5.823 7.780 1.00 0.00 H new ATOM 0 HG23 THR B 82 71.893 6.000 6.423 1.00 0.00 H new ATOM 2755 N ALA B 83 71.749 10.630 6.376 1.00 0.00 N ATOM 2756 CA ALA B 83 72.048 12.076 6.561 1.00 0.00 C ATOM 2757 C ALA B 83 70.737 12.867 6.577 1.00 0.00 C ATOM 2758 O ALA B 83 70.523 13.720 7.415 1.00 0.00 O ATOM 2759 CB ALA B 83 72.925 12.552 5.405 1.00 0.00 C ATOM 0 H ALA B 83 72.001 10.247 5.465 1.00 0.00 H new ATOM 0 HA ALA B 83 72.571 12.231 7.505 1.00 0.00 H new ATOM 0 HB1 ALA B 83 73.150 13.611 5.531 1.00 0.00 H new ATOM 0 HB2 ALA B 83 73.854 11.982 5.395 1.00 0.00 H new ATOM 0 HB3 ALA B 83 72.398 12.403 4.463 1.00 0.00 H new ATOM 2765 N CYS B 84 69.858 12.583 5.656 1.00 0.00 N ATOM 2766 CA CYS B 84 68.558 13.309 5.613 1.00 0.00 C ATOM 2767 C CYS B 84 67.623 12.727 6.673 1.00 0.00 C ATOM 2768 O CYS B 84 67.718 11.569 7.028 1.00 0.00 O ATOM 2769 CB CYS B 84 67.930 13.151 4.226 1.00 0.00 C ATOM 2770 SG CYS B 84 68.983 13.956 2.992 1.00 0.00 S ATOM 0 H CYS B 84 69.984 11.878 4.930 1.00 0.00 H new ATOM 0 HA CYS B 84 68.721 14.368 5.813 1.00 0.00 H new ATOM 0 HB2 CYS B 84 67.813 12.094 3.986 1.00 0.00 H new ATOM 0 HB3 CYS B 84 66.934 13.593 4.214 1.00 0.00 H new ATOM 0 HG CYS B 84 68.452 13.821 1.813 1.00 0.00 H new ATOM 2776 N HIS B 85 66.719 13.516 7.186 1.00 0.00 N ATOM 2777 CA HIS B 85 65.788 12.997 8.227 1.00 0.00 C ATOM 2778 C HIS B 85 64.813 12.008 7.585 1.00 0.00 C ATOM 2779 O HIS B 85 64.489 12.110 6.417 1.00 0.00 O ATOM 2780 CB HIS B 85 65.006 14.160 8.843 1.00 0.00 C ATOM 2781 CG HIS B 85 65.961 15.094 9.537 1.00 0.00 C ATOM 2782 ND1 HIS B 85 66.623 14.742 10.705 1.00 0.00 N ATOM 2783 CD2 HIS B 85 66.374 16.372 9.242 1.00 0.00 C ATOM 2784 CE1 HIS B 85 67.391 15.786 11.067 1.00 0.00 C ATOM 2785 NE2 HIS B 85 67.274 16.802 10.210 1.00 0.00 N ATOM 0 H HIS B 85 66.585 14.494 6.930 1.00 0.00 H new ATOM 0 HA HIS B 85 66.358 12.494 9.008 1.00 0.00 H new ATOM 0 HB2 HIS B 85 64.457 14.694 8.068 1.00 0.00 H new ATOM 0 HB3 HIS B 85 64.270 13.782 9.552 1.00 0.00 H new ATOM 0 HD2 HIS B 85 66.049 16.952 8.390 1.00 0.00 H new ATOM 0 HE1 HIS B 85 68.023 15.800 11.942 1.00 0.00 H new ATOM 0 HE2 HIS B 85 67.746 17.705 10.256 1.00 0.00 H new ATOM 2794 N GLU B 86 64.353 11.043 8.333 1.00 0.00 N ATOM 2795 CA GLU B 86 63.409 10.041 7.761 1.00 0.00 C ATOM 2796 C GLU B 86 62.151 10.753 7.263 1.00 0.00 C ATOM 2797 O GLU B 86 61.613 10.429 6.223 1.00 0.00 O ATOM 2798 CB GLU B 86 63.029 9.025 8.844 1.00 0.00 C ATOM 2799 CG GLU B 86 62.097 7.961 8.256 1.00 0.00 C ATOM 2800 CD GLU B 86 61.726 6.954 9.345 1.00 0.00 C ATOM 2801 OE1 GLU B 86 62.330 7.007 10.403 1.00 0.00 O ATOM 2802 OE2 GLU B 86 60.845 6.145 9.101 1.00 0.00 O ATOM 0 H GLU B 86 64.590 10.905 9.315 1.00 0.00 H new ATOM 0 HA GLU B 86 63.885 9.524 6.928 1.00 0.00 H new ATOM 0 HB2 GLU B 86 63.927 8.554 9.244 1.00 0.00 H new ATOM 0 HB3 GLU B 86 62.538 9.532 9.675 1.00 0.00 H new ATOM 0 HG2 GLU B 86 61.198 8.430 7.857 1.00 0.00 H new ATOM 0 HG3 GLU B 86 62.586 7.452 7.426 1.00 0.00 H new ATOM 2809 N PHE B 87 61.680 11.723 7.997 1.00 0.00 N ATOM 2810 CA PHE B 87 60.456 12.461 7.570 1.00 0.00 C ATOM 2811 C PHE B 87 60.853 13.614 6.646 1.00 0.00 C ATOM 2812 O PHE B 87 61.733 14.391 6.957 1.00 0.00 O ATOM 2813 CB PHE B 87 59.743 13.026 8.799 1.00 0.00 C ATOM 2814 CG PHE B 87 59.168 11.893 9.615 1.00 0.00 C ATOM 2815 CD1 PHE B 87 57.870 11.436 9.360 1.00 0.00 C ATOM 2816 CD2 PHE B 87 59.933 11.301 10.628 1.00 0.00 C ATOM 2817 CE1 PHE B 87 57.337 10.386 10.118 1.00 0.00 C ATOM 2818 CE2 PHE B 87 59.399 10.253 11.386 1.00 0.00 C ATOM 2819 CZ PHE B 87 58.102 9.795 11.131 1.00 0.00 C ATOM 0 H PHE B 87 62.090 12.038 8.876 1.00 0.00 H new ATOM 0 HA PHE B 87 59.790 11.779 7.042 1.00 0.00 H new ATOM 0 HB2 PHE B 87 60.441 13.605 9.403 1.00 0.00 H new ATOM 0 HB3 PHE B 87 58.949 13.706 8.491 1.00 0.00 H new ATOM 0 HD1 PHE B 87 57.280 11.893 8.579 1.00 0.00 H new ATOM 0 HD2 PHE B 87 60.935 11.653 10.824 1.00 0.00 H new ATOM 0 HE1 PHE B 87 56.336 10.032 9.921 1.00 0.00 H new ATOM 0 HE2 PHE B 87 59.988 9.798 12.168 1.00 0.00 H new ATOM 0 HZ PHE B 87 57.691 8.985 11.716 1.00 0.00 H new ATOM 2829 N PHE B 88 60.208 13.735 5.512 1.00 0.00 N ATOM 2830 CA PHE B 88 60.544 14.844 4.565 1.00 0.00 C ATOM 2831 C PHE B 88 59.254 15.404 3.959 1.00 0.00 C ATOM 2832 O PHE B 88 59.243 16.477 3.387 1.00 0.00 O ATOM 2833 CB PHE B 88 61.429 14.297 3.442 1.00 0.00 C ATOM 2834 CG PHE B 88 61.780 15.413 2.487 1.00 0.00 C ATOM 2835 CD1 PHE B 88 60.949 15.686 1.394 1.00 0.00 C ATOM 2836 CD2 PHE B 88 62.935 16.176 2.699 1.00 0.00 C ATOM 2837 CE1 PHE B 88 61.273 16.723 0.511 1.00 0.00 C ATOM 2838 CE2 PHE B 88 63.259 17.212 1.816 1.00 0.00 C ATOM 2839 CZ PHE B 88 62.428 17.485 0.721 1.00 0.00 C ATOM 0 H PHE B 88 59.462 13.113 5.201 1.00 0.00 H new ATOM 0 HA PHE B 88 61.071 15.634 5.100 1.00 0.00 H new ATOM 0 HB2 PHE B 88 62.337 13.862 3.860 1.00 0.00 H new ATOM 0 HB3 PHE B 88 60.909 13.500 2.911 1.00 0.00 H new ATOM 0 HD1 PHE B 88 60.058 15.097 1.232 1.00 0.00 H new ATOM 0 HD2 PHE B 88 63.575 15.965 3.543 1.00 0.00 H new ATOM 0 HE1 PHE B 88 60.632 16.935 -0.332 1.00 0.00 H new ATOM 0 HE2 PHE B 88 64.149 17.801 1.978 1.00 0.00 H new ATOM 0 HZ PHE B 88 62.679 18.284 0.039 1.00 0.00 H new ATOM 2849 N GLU B 89 58.167 14.684 4.077 1.00 0.00 N ATOM 2850 CA GLU B 89 56.869 15.165 3.505 1.00 0.00 C ATOM 2851 C GLU B 89 56.009 15.775 4.614 1.00 0.00 C ATOM 2852 O GLU B 89 55.679 15.124 5.585 1.00 0.00 O ATOM 2853 CB GLU B 89 56.126 13.983 2.880 1.00 0.00 C ATOM 2854 CG GLU B 89 56.954 13.417 1.725 1.00 0.00 C ATOM 2855 CD GLU B 89 56.215 12.235 1.096 1.00 0.00 C ATOM 2856 OE1 GLU B 89 55.232 11.800 1.675 1.00 0.00 O ATOM 2857 OE2 GLU B 89 56.643 11.785 0.046 1.00 0.00 O ATOM 0 H GLU B 89 58.121 13.780 4.547 1.00 0.00 H new ATOM 0 HA GLU B 89 57.066 15.922 2.745 1.00 0.00 H new ATOM 0 HB2 GLU B 89 55.952 13.211 3.630 1.00 0.00 H new ATOM 0 HB3 GLU B 89 55.149 14.303 2.519 1.00 0.00 H new ATOM 0 HG2 GLU B 89 57.129 14.190 0.976 1.00 0.00 H new ATOM 0 HG3 GLU B 89 57.931 13.097 2.087 1.00 0.00 H new ATOM 2864 N HIS B 90 55.640 17.019 4.476 1.00 0.00 N ATOM 2865 CA HIS B 90 54.800 17.666 5.521 1.00 0.00 C ATOM 2866 C HIS B 90 53.420 17.005 5.537 1.00 0.00 C ATOM 2867 O HIS B 90 52.842 16.772 6.580 1.00 0.00 O ATOM 2868 CB HIS B 90 54.654 19.154 5.203 1.00 0.00 C ATOM 2869 CG HIS B 90 55.977 19.837 5.412 1.00 0.00 C ATOM 2870 ND1 HIS B 90 56.508 20.056 6.676 1.00 0.00 N ATOM 2871 CD2 HIS B 90 56.893 20.348 4.525 1.00 0.00 C ATOM 2872 CE1 HIS B 90 57.693 20.675 6.515 1.00 0.00 C ATOM 2873 NE2 HIS B 90 57.973 20.874 5.226 1.00 0.00 N ATOM 0 H HIS B 90 55.884 17.614 3.685 1.00 0.00 H new ATOM 0 HA HIS B 90 55.270 17.550 6.498 1.00 0.00 H new ATOM 0 HB2 HIS B 90 54.321 19.287 4.174 1.00 0.00 H new ATOM 0 HB3 HIS B 90 53.895 19.602 5.844 1.00 0.00 H new ATOM 0 HD2 HIS B 90 56.790 20.342 3.450 1.00 0.00 H new ATOM 0 HE1 HIS B 90 58.337 20.973 7.329 1.00 0.00 H new ATOM 0 HE2 HIS B 90 58.804 21.318 4.836 1.00 0.00 H new ATOM 2882 N GLU B 91 52.890 16.700 4.386 1.00 0.00 N ATOM 2883 CA GLU B 91 51.550 16.050 4.327 1.00 0.00 C ATOM 2884 C GLU B 91 51.309 15.504 2.918 1.00 0.00 C ATOM 2885 O GLU B 91 51.893 14.483 2.591 1.00 0.00 O ATOM 2886 CB GLU B 91 50.466 17.074 4.669 1.00 0.00 C ATOM 2887 CG GLU B 91 49.114 16.366 4.775 1.00 0.00 C ATOM 2888 CD GLU B 91 48.054 17.353 5.267 1.00 0.00 C ATOM 2889 OE1 GLU B 91 48.418 18.472 5.587 1.00 0.00 O ATOM 2890 OE2 GLU B 91 46.896 16.972 5.316 1.00 0.00 O ATOM 2891 OXT GLU B 91 50.545 16.114 2.190 1.00 0.00 O ATOM 0 H GLU B 91 53.328 16.873 3.481 1.00 0.00 H new ATOM 0 HA GLU B 91 51.514 15.232 5.046 1.00 0.00 H new ATOM 0 HB2 GLU B 91 50.703 17.571 5.610 1.00 0.00 H new ATOM 0 HB3 GLU B 91 50.425 17.847 3.901 1.00 0.00 H new ATOM 0 HG2 GLU B 91 48.827 15.962 3.804 1.00 0.00 H new ATOM 0 HG3 GLU B 91 49.187 15.523 5.462 1.00 0.00 H new TER 2898 GLU B 91 HETATM 2899 CA CA A 101 57.952 -2.351 13.605 1.00 0.00 CA HETATM 2900 CA CA B 102 86.965 2.942 -10.828 1.00 0.00 CA HETATM 2901 CA CA A 103 70.939 -5.927 15.082 1.00 0.00 CA HETATM 2902 CA CA B 104 88.142 2.643 2.050 1.00 0.00 CA