USER MOD reduce.3.24.130724 H: found=0, std=0, add=1227, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1229 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 41 LYS NZ :NH3+ 151:sc= 0 (180deg=-0.0143) USER MOD Set 1.2: A 51 LYS NZ :NH3+ -157:sc= -0.0906 (180deg=0) USER MOD Set 2.1: A 14 THR OG1 : rot -70:sc= -8.73! USER MOD Set 2.2: B 27 SER OG : rot -24:sc= -2.56! USER MOD Set 3.1: A 1 MET CE :methyl -159:sc= -8.69! (180deg=-9.32!) USER MOD Set 3.2: B 35 THR OG1 : rot 72:sc=-0.00587 USER MOD Single : A 1 MET N :NH3+ -109:sc= 0.0246 (180deg=-0.223) USER MOD Single : A 2 ASN : amide:sc= -0.766 K(o=-0.77,f=-20!) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= -0.0123 (180deg=-0.0123) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ -131:sc= 1.17 (180deg=-0.938) USER MOD Single : A 12 GLN : amide:sc= -2.73! C(o=-2.7!,f=-5.5!) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 SER OG : rot 34:sc= -3.4! USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 MET CE :methyl -140:sc= -4.15! (180deg=-8.23!) USER MOD Single : A 27 SER OG : rot 144:sc= -3.52 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 95:sc= -2.37! USER MOD Single : A 35 THR OG1 : rot 69:sc= 0.969 USER MOD Single : A 38 LYS NZ :NH3+ -115:sc= 0 (180deg=-0.0772) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.466 USER MOD Single : A 49 ASN : amide:sc= -0.137 K(o=-0.14,f=-0.89) USER MOD Single : A 78 SER OG : rot -13:sc= 0.272! USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 SER OG : rot -163:sc= 1.18 USER MOD Single : A 86 LYS NZ :NH3+ 147:sc= 0 (180deg=-0.0145) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl 158:sc= -0.542 (180deg=-2.57!) USER MOD Single : B 1 MET N :NH3+ 157:sc= -0.458 (180deg=-1.5!) USER MOD Single : B 2 ASN : amide:sc= -1.25 K(o=-1.2,f=-5.3!) USER MOD Single : B 3 LYS NZ :NH3+ -145:sc= -1.74! (180deg=-7.64!) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0 USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 GLN : amide:sc= -0.333 K(o=-0.33,f=-1.8!) USER MOD Single : B 14 THR OG1 : rot -80:sc= -8.48! USER MOD Single : B 17 THR OG1 : rot 180:sc= 0 USER MOD Single : B 18 GLN : amide:sc= -0.0804 X(o=-0.08,f=0) USER MOD Single : B 20 SER OG : rot -60:sc= -10.2! USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 24 MET CE :methyl -133:sc= -12.8! (180deg=-14.6!) USER MOD Single : B 30 LYS NZ :NH3+ -125:sc= 0 (180deg=-0.205) USER MOD Single : B 33 THR OG1 : rot 97:sc= -3.04! USER MOD Single : B 38 LYS NZ :NH3+ 170:sc= -0.0393 (180deg=-0.17) USER MOD Single : B 41 LYS NZ :NH3+ -126:sc= 0 (180deg=-0.258) USER MOD Single : B 43 GLN : amide:sc= -0.0867 K(o=-0.087,f=-1.2!) USER MOD Single : B 45 THR OG1 : rot -53:sc= 1.2 USER MOD Single : B 49 ASN : amide:sc= -0.791 X(o=-0.79,f=-0.49) USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 78 SER OG : rot 180:sc= 0 USER MOD Single : B 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 84 SER OG : rot -157:sc= 0.392 USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 94 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.824 4.015 10.231 1.00 0.00 N ATOM 2 CA MET A 1 4.940 5.180 9.933 1.00 0.00 C ATOM 3 C MET A 1 3.501 4.705 9.714 1.00 0.00 C ATOM 4 O MET A 1 3.207 3.532 9.828 1.00 0.00 O ATOM 5 CB MET A 1 5.505 5.785 8.650 1.00 0.00 C ATOM 6 CG MET A 1 6.306 7.045 8.985 1.00 0.00 C ATOM 7 SD MET A 1 7.507 7.363 7.670 1.00 0.00 S ATOM 8 CE MET A 1 6.329 7.399 6.297 1.00 0.00 C ATOM 0 H1 MET A 1 6.109 4.042 11.231 1.00 0.00 H new ATOM 0 H2 MET A 1 5.310 3.131 10.041 1.00 0.00 H new ATOM 0 H3 MET A 1 6.671 4.059 9.629 1.00 0.00 H new ATOM 0 HA MET A 1 4.917 5.903 10.749 1.00 0.00 H new ATOM 0 HB2 MET A 1 6.143 5.060 8.145 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.694 6.029 7.964 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.635 7.897 9.093 1.00 0.00 H new ATOM 0 HG3 MET A 1 6.819 6.920 9.938 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.855 7.211 5.361 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.571 6.630 6.448 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.850 8.377 6.254 1.00 0.00 H new ATOM 20 N ASN A 2 2.600 5.604 9.395 1.00 0.00 N ATOM 21 CA ASN A 2 1.183 5.190 9.168 1.00 0.00 C ATOM 22 C ASN A 2 0.318 6.378 8.757 1.00 0.00 C ATOM 23 O ASN A 2 0.810 7.442 8.439 1.00 0.00 O ATOM 24 CB ASN A 2 0.700 4.617 10.508 1.00 0.00 C ATOM 25 CG ASN A 2 0.928 5.639 11.623 1.00 0.00 C ATOM 26 OD1 ASN A 2 0.875 6.829 11.390 1.00 0.00 O ATOM 27 ND2 ASN A 2 1.180 5.222 12.832 1.00 0.00 N ATOM 0 H ASN A 2 2.785 6.601 9.283 1.00 0.00 H new ATOM 0 HA ASN A 2 1.111 4.461 8.361 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -0.358 4.364 10.445 1.00 0.00 H new ATOM 0 HB3 ASN A 2 1.235 3.694 10.733 1.00 0.00 H new ATOM 0 HD21 ASN A 2 1.333 5.896 13.582 1.00 0.00 H new ATOM 0 HD22 ASN A 2 1.224 4.222 13.028 1.00 0.00 H new ATOM 34 N LYS A 3 -0.980 6.199 8.769 1.00 0.00 N ATOM 35 CA LYS A 3 -1.904 7.311 8.386 1.00 0.00 C ATOM 36 C LYS A 3 -1.562 8.581 9.175 1.00 0.00 C ATOM 37 O LYS A 3 -1.967 9.666 8.817 1.00 0.00 O ATOM 38 CB LYS A 3 -3.309 6.812 8.748 1.00 0.00 C ATOM 39 CG LYS A 3 -4.304 7.201 7.642 1.00 0.00 C ATOM 40 CD LYS A 3 -5.715 7.326 8.238 1.00 0.00 C ATOM 41 CE LYS A 3 -6.747 7.539 7.120 1.00 0.00 C ATOM 42 NZ LYS A 3 -7.929 8.139 7.800 1.00 0.00 N ATOM 0 H LYS A 3 -1.441 5.327 9.029 1.00 0.00 H new ATOM 0 HA LYS A 3 -1.825 7.564 7.329 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -3.298 5.730 8.875 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -3.623 7.242 9.699 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -4.006 8.145 7.186 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -4.297 6.450 6.852 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -5.960 6.426 8.802 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -5.749 8.161 8.938 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -6.359 8.200 6.345 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -7.005 6.597 6.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -8.679 8.315 7.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -8.280 7.484 8.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -7.654 9.037 8.246 1.00 0.00 H new ATOM 56 N THR A 4 -0.813 8.453 10.243 1.00 0.00 N ATOM 57 CA THR A 4 -0.440 9.655 11.045 1.00 0.00 C ATOM 58 C THR A 4 1.019 10.037 10.781 1.00 0.00 C ATOM 59 O THR A 4 1.321 11.132 10.344 1.00 0.00 O ATOM 60 CB THR A 4 -0.629 9.237 12.507 1.00 0.00 C ATOM 61 OG1 THR A 4 -2.009 9.018 12.761 1.00 0.00 O ATOM 62 CG2 THR A 4 -0.106 10.340 13.433 1.00 0.00 C ATOM 0 H THR A 4 -0.445 7.568 10.592 1.00 0.00 H new ATOM 0 HA THR A 4 -1.047 10.523 10.789 1.00 0.00 H new ATOM 0 HB THR A 4 -0.073 8.318 12.694 1.00 0.00 H new ATOM 0 HG1 THR A 4 -2.131 8.749 13.695 1.00 0.00 H new ATOM 0 HG21 THR A 4 -0.243 10.038 14.471 1.00 0.00 H new ATOM 0 HG22 THR A 4 0.954 10.505 13.239 1.00 0.00 H new ATOM 0 HG23 THR A 4 -0.657 11.262 13.248 1.00 0.00 H new ATOM 70 N GLU A 5 1.929 9.142 11.043 1.00 0.00 N ATOM 71 CA GLU A 5 3.366 9.459 10.810 1.00 0.00 C ATOM 72 C GLU A 5 3.567 9.913 9.366 1.00 0.00 C ATOM 73 O GLU A 5 4.232 10.897 9.107 1.00 0.00 O ATOM 74 CB GLU A 5 4.126 8.163 11.092 1.00 0.00 C ATOM 75 CG GLU A 5 3.882 7.730 12.540 1.00 0.00 C ATOM 76 CD GLU A 5 5.040 8.207 13.419 1.00 0.00 C ATOM 77 OE1 GLU A 5 6.051 7.523 13.457 1.00 0.00 O ATOM 78 OE2 GLU A 5 4.897 9.247 14.041 1.00 0.00 O ATOM 0 H GLU A 5 1.742 8.208 11.407 1.00 0.00 H new ATOM 0 HA GLU A 5 3.721 10.267 11.450 1.00 0.00 H new ATOM 0 HB2 GLU A 5 3.798 7.381 10.408 1.00 0.00 H new ATOM 0 HB3 GLU A 5 5.192 8.310 10.920 1.00 0.00 H new ATOM 0 HG2 GLU A 5 2.942 8.147 12.902 1.00 0.00 H new ATOM 0 HG3 GLU A 5 3.792 6.645 12.596 1.00 0.00 H new ATOM 85 N LEU A 6 2.990 9.214 8.423 1.00 0.00 N ATOM 86 CA LEU A 6 3.147 9.629 6.995 1.00 0.00 C ATOM 87 C LEU A 6 2.779 11.106 6.825 1.00 0.00 C ATOM 88 O LEU A 6 3.506 11.860 6.202 1.00 0.00 O ATOM 89 CB LEU A 6 2.197 8.733 6.201 1.00 0.00 C ATOM 90 CG LEU A 6 2.760 7.312 6.150 1.00 0.00 C ATOM 91 CD1 LEU A 6 1.611 6.306 6.037 1.00 0.00 C ATOM 92 CD2 LEU A 6 3.679 7.177 4.934 1.00 0.00 C ATOM 0 H LEU A 6 2.422 8.381 8.576 1.00 0.00 H new ATOM 0 HA LEU A 6 4.175 9.522 6.650 1.00 0.00 H new ATOM 0 HB2 LEU A 6 1.211 8.728 6.665 1.00 0.00 H new ATOM 0 HB3 LEU A 6 2.072 9.123 5.191 1.00 0.00 H new ATOM 0 HG LEU A 6 3.325 7.111 7.061 1.00 0.00 H new ATOM 0 HD11 LEU A 6 2.015 5.294 6.001 1.00 0.00 H new ATOM 0 HD12 LEU A 6 0.955 6.404 6.902 1.00 0.00 H new ATOM 0 HD13 LEU A 6 1.043 6.503 5.127 1.00 0.00 H new ATOM 0 HD21 LEU A 6 4.083 6.165 4.894 1.00 0.00 H new ATOM 0 HD22 LEU A 6 3.112 7.378 4.025 1.00 0.00 H new ATOM 0 HD23 LEU A 6 4.498 7.892 5.016 1.00 0.00 H new ATOM 104 N ILE A 7 1.679 11.546 7.394 1.00 0.00 N ATOM 105 CA ILE A 7 1.333 12.998 7.265 1.00 0.00 C ATOM 106 C ILE A 7 2.521 13.778 7.806 1.00 0.00 C ATOM 107 O ILE A 7 3.015 14.696 7.188 1.00 0.00 O ATOM 108 CB ILE A 7 0.042 13.254 8.066 1.00 0.00 C ATOM 109 CG1 ILE A 7 0.350 13.778 9.470 1.00 0.00 C ATOM 110 CG2 ILE A 7 -0.786 11.977 8.171 1.00 0.00 C ATOM 111 CD1 ILE A 7 -0.931 14.329 10.071 1.00 0.00 C ATOM 0 H ILE A 7 1.021 10.979 7.929 1.00 0.00 H new ATOM 0 HA ILE A 7 1.147 13.308 6.237 1.00 0.00 H new ATOM 0 HB ILE A 7 -0.528 14.013 7.530 1.00 0.00 H new ATOM 0 HG12 ILE A 7 0.747 12.978 10.094 1.00 0.00 H new ATOM 0 HG13 ILE A 7 1.112 14.556 9.425 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -1.694 12.178 8.740 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -1.053 11.633 7.172 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -0.204 11.206 8.676 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -0.729 14.707 11.073 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -1.307 15.139 9.446 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -1.677 13.537 10.126 1.00 0.00 H new ATOM 123 N LYS A 8 3.013 13.360 8.940 1.00 0.00 N ATOM 124 CA LYS A 8 4.214 14.002 9.524 1.00 0.00 C ATOM 125 C LYS A 8 5.338 13.927 8.500 1.00 0.00 C ATOM 126 O LYS A 8 6.089 14.863 8.309 1.00 0.00 O ATOM 127 CB LYS A 8 4.557 13.146 10.743 1.00 0.00 C ATOM 128 CG LYS A 8 4.620 14.016 11.997 1.00 0.00 C ATOM 129 CD LYS A 8 4.769 13.123 13.238 1.00 0.00 C ATOM 130 CE LYS A 8 5.646 11.905 12.913 1.00 0.00 C ATOM 131 NZ LYS A 8 6.247 11.504 14.216 1.00 0.00 N ATOM 0 H LYS A 8 2.626 12.592 9.489 1.00 0.00 H new ATOM 0 HA LYS A 8 4.061 15.047 9.794 1.00 0.00 H new ATOM 0 HB2 LYS A 8 3.808 12.365 10.871 1.00 0.00 H new ATOM 0 HB3 LYS A 8 5.514 12.647 10.589 1.00 0.00 H new ATOM 0 HG2 LYS A 8 5.461 14.707 11.931 1.00 0.00 H new ATOM 0 HG3 LYS A 8 3.717 14.620 12.078 1.00 0.00 H new ATOM 0 HD2 LYS A 8 5.214 13.693 14.054 1.00 0.00 H new ATOM 0 HD3 LYS A 8 3.787 12.793 13.578 1.00 0.00 H new ATOM 0 HE2 LYS A 8 5.054 11.095 12.485 1.00 0.00 H new ATOM 0 HE3 LYS A 8 6.416 12.156 12.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 7.273 11.377 14.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 6.067 12.245 14.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 5.821 10.610 14.534 1.00 0.00 H new ATOM 145 N ALA A 9 5.440 12.811 7.817 1.00 0.00 N ATOM 146 CA ALA A 9 6.493 12.670 6.781 1.00 0.00 C ATOM 147 C ALA A 9 6.364 13.821 5.794 1.00 0.00 C ATOM 148 O ALA A 9 7.341 14.357 5.317 1.00 0.00 O ATOM 149 CB ALA A 9 6.194 11.346 6.094 1.00 0.00 C ATOM 0 H ALA A 9 4.837 11.997 7.937 1.00 0.00 H new ATOM 0 HA ALA A 9 7.503 12.689 7.191 1.00 0.00 H new ATOM 0 HB1 ALA A 9 6.931 11.168 5.311 1.00 0.00 H new ATOM 0 HB2 ALA A 9 6.238 10.539 6.825 1.00 0.00 H new ATOM 0 HB3 ALA A 9 5.198 11.382 5.653 1.00 0.00 H new ATOM 155 N ILE A 10 5.154 14.233 5.520 1.00 0.00 N ATOM 156 CA ILE A 10 4.951 15.372 4.611 1.00 0.00 C ATOM 157 C ILE A 10 4.987 16.624 5.465 1.00 0.00 C ATOM 158 O ILE A 10 5.441 17.670 5.064 1.00 0.00 O ATOM 159 CB ILE A 10 3.554 15.137 4.006 1.00 0.00 C ATOM 160 CG1 ILE A 10 3.680 14.373 2.686 1.00 0.00 C ATOM 161 CG2 ILE A 10 2.842 16.470 3.751 1.00 0.00 C ATOM 162 CD1 ILE A 10 4.274 12.987 2.949 1.00 0.00 C ATOM 0 H ILE A 10 4.300 13.820 5.895 1.00 0.00 H new ATOM 0 HA ILE A 10 5.697 15.473 3.822 1.00 0.00 H new ATOM 0 HB ILE A 10 2.968 14.553 4.716 1.00 0.00 H new ATOM 0 HG12 ILE A 10 2.702 14.277 2.215 1.00 0.00 H new ATOM 0 HG13 ILE A 10 4.314 14.926 1.993 1.00 0.00 H new ATOM 0 HG21 ILE A 10 1.857 16.281 3.324 1.00 0.00 H new ATOM 0 HG22 ILE A 10 2.732 17.009 4.692 1.00 0.00 H new ATOM 0 HG23 ILE A 10 3.430 17.069 3.056 1.00 0.00 H new ATOM 0 HD11 ILE A 10 4.363 12.445 2.008 1.00 0.00 H new ATOM 0 HD12 ILE A 10 5.260 13.094 3.401 1.00 0.00 H new ATOM 0 HD13 ILE A 10 3.623 12.434 3.626 1.00 0.00 H new ATOM 174 N ALA A 11 4.537 16.514 6.666 1.00 0.00 N ATOM 175 CA ALA A 11 4.569 17.688 7.549 1.00 0.00 C ATOM 176 C ALA A 11 6.027 18.027 7.874 1.00 0.00 C ATOM 177 O ALA A 11 6.324 19.075 8.413 1.00 0.00 O ATOM 178 CB ALA A 11 3.800 17.244 8.792 1.00 0.00 C ATOM 0 H ALA A 11 4.149 15.664 7.075 1.00 0.00 H new ATOM 0 HA ALA A 11 4.129 18.584 7.111 1.00 0.00 H new ATOM 0 HB1 ALA A 11 3.771 18.061 9.513 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.783 16.971 8.512 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.297 16.383 9.239 1.00 0.00 H new ATOM 184 N GLN A 12 6.943 17.150 7.534 1.00 0.00 N ATOM 185 CA GLN A 12 8.375 17.433 7.807 1.00 0.00 C ATOM 186 C GLN A 12 9.178 17.430 6.499 1.00 0.00 C ATOM 187 O GLN A 12 10.079 18.228 6.328 1.00 0.00 O ATOM 188 CB GLN A 12 8.828 16.335 8.789 1.00 0.00 C ATOM 189 CG GLN A 12 9.370 15.112 8.039 1.00 0.00 C ATOM 190 CD GLN A 12 10.856 15.317 7.733 1.00 0.00 C ATOM 191 OE1 GLN A 12 11.255 15.338 6.586 1.00 0.00 O ATOM 192 NE2 GLN A 12 11.697 15.471 8.719 1.00 0.00 N ATOM 0 H GLN A 12 6.755 16.256 7.081 1.00 0.00 H new ATOM 0 HA GLN A 12 8.535 18.420 8.242 1.00 0.00 H new ATOM 0 HB2 GLN A 12 9.599 16.730 9.451 1.00 0.00 H new ATOM 0 HB3 GLN A 12 7.989 16.037 9.418 1.00 0.00 H new ATOM 0 HG2 GLN A 12 9.232 14.213 8.640 1.00 0.00 H new ATOM 0 HG3 GLN A 12 8.814 14.964 7.113 1.00 0.00 H new ATOM 0 HE21 GLN A 12 11.362 15.453 9.682 1.00 0.00 H new ATOM 0 HE22 GLN A 12 12.689 15.609 8.526 1.00 0.00 H new ATOM 201 N ASP A 13 8.831 16.594 5.550 1.00 0.00 N ATOM 202 CA ASP A 13 9.564 16.638 4.250 1.00 0.00 C ATOM 203 C ASP A 13 9.056 17.872 3.535 1.00 0.00 C ATOM 204 O ASP A 13 9.778 18.603 2.885 1.00 0.00 O ATOM 205 CB ASP A 13 9.157 15.381 3.484 1.00 0.00 C ATOM 206 CG ASP A 13 9.893 14.167 4.055 1.00 0.00 C ATOM 207 OD1 ASP A 13 9.742 13.909 5.237 1.00 0.00 O ATOM 208 OD2 ASP A 13 10.597 13.518 3.299 1.00 0.00 O ATOM 0 H ASP A 13 8.088 15.898 5.617 1.00 0.00 H new ATOM 0 HA ASP A 13 10.649 16.675 4.352 1.00 0.00 H new ATOM 0 HB2 ASP A 13 8.080 15.232 3.557 1.00 0.00 H new ATOM 0 HB3 ASP A 13 9.392 15.496 2.426 1.00 0.00 H new ATOM 213 N THR A 14 7.792 18.105 3.713 1.00 0.00 N ATOM 214 CA THR A 14 7.124 19.283 3.135 1.00 0.00 C ATOM 215 C THR A 14 7.191 20.397 4.192 1.00 0.00 C ATOM 216 O THR A 14 7.938 21.347 4.063 1.00 0.00 O ATOM 217 CB THR A 14 5.696 18.780 2.891 1.00 0.00 C ATOM 218 OG1 THR A 14 5.665 17.375 3.069 1.00 0.00 O ATOM 219 CG2 THR A 14 5.262 19.057 1.474 1.00 0.00 C ATOM 0 H THR A 14 7.176 17.501 4.257 1.00 0.00 H new ATOM 0 HA THR A 14 7.556 19.684 2.218 1.00 0.00 H new ATOM 0 HB THR A 14 5.034 19.292 3.589 1.00 0.00 H new ATOM 0 HG1 THR A 14 6.148 16.941 2.335 1.00 0.00 H new ATOM 0 HG21 THR A 14 4.246 18.691 1.326 1.00 0.00 H new ATOM 0 HG22 THR A 14 5.291 20.131 1.288 1.00 0.00 H new ATOM 0 HG23 THR A 14 5.934 18.550 0.782 1.00 0.00 H new ATOM 227 N GLY A 15 6.452 20.248 5.261 1.00 0.00 N ATOM 228 CA GLY A 15 6.500 21.253 6.373 1.00 0.00 C ATOM 229 C GLY A 15 6.226 22.666 5.861 1.00 0.00 C ATOM 230 O GLY A 15 6.568 23.644 6.499 1.00 0.00 O ATOM 0 H GLY A 15 5.812 19.469 5.415 1.00 0.00 H new ATOM 0 HA2 GLY A 15 5.765 20.991 7.134 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.479 21.221 6.852 1.00 0.00 H new ATOM 234 N LEU A 16 5.595 22.782 4.736 1.00 0.00 N ATOM 235 CA LEU A 16 5.273 24.142 4.195 1.00 0.00 C ATOM 236 C LEU A 16 4.308 24.829 5.133 1.00 0.00 C ATOM 237 O LEU A 16 4.592 25.853 5.723 1.00 0.00 O ATOM 238 CB LEU A 16 4.573 23.918 2.856 1.00 0.00 C ATOM 239 CG LEU A 16 5.513 23.209 1.901 1.00 0.00 C ATOM 240 CD1 LEU A 16 5.279 21.710 1.991 1.00 0.00 C ATOM 241 CD2 LEU A 16 5.234 23.679 0.469 1.00 0.00 C ATOM 0 H LEU A 16 5.284 22.000 4.160 1.00 0.00 H new ATOM 0 HA LEU A 16 6.170 24.752 4.088 1.00 0.00 H new ATOM 0 HB2 LEU A 16 3.671 23.324 3.001 1.00 0.00 H new ATOM 0 HB3 LEU A 16 4.262 24.873 2.433 1.00 0.00 H new ATOM 0 HG LEU A 16 6.545 23.438 2.166 1.00 0.00 H new ATOM 0 HD11 LEU A 16 5.953 21.195 1.306 1.00 0.00 H new ATOM 0 HD12 LEU A 16 5.470 21.373 3.010 1.00 0.00 H new ATOM 0 HD13 LEU A 16 4.247 21.486 1.722 1.00 0.00 H new ATOM 0 HD21 LEU A 16 5.909 23.170 -0.219 1.00 0.00 H new ATOM 0 HD22 LEU A 16 4.203 23.446 0.204 1.00 0.00 H new ATOM 0 HD23 LEU A 16 5.392 24.755 0.402 1.00 0.00 H new ATOM 253 N THR A 17 3.161 24.250 5.261 1.00 0.00 N ATOM 254 CA THR A 17 2.124 24.812 6.139 1.00 0.00 C ATOM 255 C THR A 17 1.449 23.673 6.897 1.00 0.00 C ATOM 256 O THR A 17 0.443 23.863 7.551 1.00 0.00 O ATOM 257 CB THR A 17 1.146 25.489 5.164 1.00 0.00 C ATOM 258 OG1 THR A 17 0.748 26.747 5.689 1.00 0.00 O ATOM 259 CG2 THR A 17 -0.089 24.612 4.942 1.00 0.00 C ATOM 0 H THR A 17 2.894 23.390 4.781 1.00 0.00 H new ATOM 0 HA THR A 17 2.503 25.511 6.884 1.00 0.00 H new ATOM 0 HB THR A 17 1.649 25.631 4.207 1.00 0.00 H new ATOM 0 HG1 THR A 17 0.126 27.179 5.067 1.00 0.00 H new ATOM 0 HG21 THR A 17 -0.768 25.109 4.249 1.00 0.00 H new ATOM 0 HG22 THR A 17 0.216 23.652 4.525 1.00 0.00 H new ATOM 0 HG23 THR A 17 -0.596 24.450 5.893 1.00 0.00 H new ATOM 267 N GLN A 18 1.956 22.468 6.761 1.00 0.00 N ATOM 268 CA GLN A 18 1.282 21.315 7.409 1.00 0.00 C ATOM 269 C GLN A 18 -0.144 21.300 6.862 1.00 0.00 C ATOM 270 O GLN A 18 -1.073 20.861 7.510 1.00 0.00 O ATOM 271 CB GLN A 18 1.299 21.594 8.917 1.00 0.00 C ATOM 272 CG GLN A 18 2.680 22.111 9.328 1.00 0.00 C ATOM 273 CD GLN A 18 3.022 21.606 10.730 1.00 0.00 C ATOM 274 OE1 GLN A 18 3.761 20.654 10.882 1.00 0.00 O ATOM 275 NE2 GLN A 18 2.513 22.207 11.770 1.00 0.00 N ATOM 0 H GLN A 18 2.799 22.243 6.233 1.00 0.00 H new ATOM 0 HA GLN A 18 1.757 20.353 7.218 1.00 0.00 H new ATOM 0 HB2 GLN A 18 0.534 22.329 9.170 1.00 0.00 H new ATOM 0 HB3 GLN A 18 1.061 20.684 9.468 1.00 0.00 H new ATOM 0 HG2 GLN A 18 3.432 21.773 8.615 1.00 0.00 H new ATOM 0 HG3 GLN A 18 2.691 23.201 9.311 1.00 0.00 H new ATOM 0 HE21 GLN A 18 1.892 23.007 11.644 1.00 0.00 H new ATOM 0 HE22 GLN A 18 2.736 21.877 12.709 1.00 0.00 H new ATOM 284 N VAL A 19 -0.291 21.833 5.659 1.00 0.00 N ATOM 285 CA VAL A 19 -1.622 21.944 4.979 1.00 0.00 C ATOM 286 C VAL A 19 -2.726 21.351 5.849 1.00 0.00 C ATOM 287 O VAL A 19 -3.256 21.997 6.731 1.00 0.00 O ATOM 288 CB VAL A 19 -1.456 21.222 3.604 1.00 0.00 C ATOM 289 CG1 VAL A 19 -0.629 19.936 3.736 1.00 0.00 C ATOM 290 CG2 VAL A 19 -2.820 20.864 2.983 1.00 0.00 C ATOM 0 H VAL A 19 0.485 22.204 5.111 1.00 0.00 H new ATOM 0 HA VAL A 19 -1.925 22.979 4.818 1.00 0.00 H new ATOM 0 HB VAL A 19 -0.934 21.924 2.954 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -0.535 19.462 2.759 1.00 0.00 H new ATOM 0 HG12 VAL A 19 0.363 20.179 4.118 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -1.126 19.253 4.425 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -2.665 20.363 2.027 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -3.363 20.201 3.656 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -3.398 21.774 2.826 1.00 0.00 H new ATOM 300 N SER A 20 -3.050 20.138 5.617 1.00 0.00 N ATOM 301 CA SER A 20 -4.073 19.459 6.395 1.00 0.00 C ATOM 302 C SER A 20 -3.515 18.110 6.773 1.00 0.00 C ATOM 303 O SER A 20 -4.254 17.179 6.946 1.00 0.00 O ATOM 304 CB SER A 20 -5.262 19.341 5.462 1.00 0.00 C ATOM 305 OG SER A 20 -6.350 20.088 5.988 1.00 0.00 O ATOM 0 H SER A 20 -2.627 19.566 4.886 1.00 0.00 H new ATOM 0 HA SER A 20 -4.367 19.973 7.310 1.00 0.00 H new ATOM 0 HB2 SER A 20 -4.999 19.710 4.471 1.00 0.00 H new ATOM 0 HB3 SER A 20 -5.546 18.295 5.348 1.00 0.00 H new ATOM 0 HG SER A 20 -6.009 20.881 6.452 1.00 0.00 H new ATOM 311 N VAL A 21 -2.204 17.979 6.847 1.00 0.00 N ATOM 312 CA VAL A 21 -1.572 16.666 7.182 1.00 0.00 C ATOM 313 C VAL A 21 -2.597 15.765 7.846 1.00 0.00 C ATOM 314 O VAL A 21 -2.709 14.587 7.567 1.00 0.00 O ATOM 315 CB VAL A 21 -0.438 17.015 8.146 1.00 0.00 C ATOM 316 CG1 VAL A 21 0.614 17.850 7.413 1.00 0.00 C ATOM 317 CG2 VAL A 21 -0.983 17.817 9.333 1.00 0.00 C ATOM 0 H VAL A 21 -1.543 18.739 6.686 1.00 0.00 H new ATOM 0 HA VAL A 21 -1.202 16.134 6.306 1.00 0.00 H new ATOM 0 HB VAL A 21 0.012 16.093 8.514 1.00 0.00 H new ATOM 0 HG11 VAL A 21 1.423 18.100 8.099 1.00 0.00 H new ATOM 0 HG12 VAL A 21 1.012 17.279 6.575 1.00 0.00 H new ATOM 0 HG13 VAL A 21 0.157 18.767 7.042 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -0.167 18.060 10.013 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -1.440 18.738 8.971 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -1.730 17.224 9.860 1.00 0.00 H new ATOM 327 N SER A 22 -3.391 16.362 8.672 1.00 0.00 N ATOM 328 CA SER A 22 -4.481 15.605 9.352 1.00 0.00 C ATOM 329 C SER A 22 -5.640 15.397 8.375 1.00 0.00 C ATOM 330 O SER A 22 -6.245 14.343 8.319 1.00 0.00 O ATOM 331 CB SER A 22 -4.912 16.489 10.524 1.00 0.00 C ATOM 332 OG SER A 22 -4.505 15.882 11.743 1.00 0.00 O ATOM 0 H SER A 22 -3.338 17.352 8.913 1.00 0.00 H new ATOM 0 HA SER A 22 -4.161 14.620 9.693 1.00 0.00 H new ATOM 0 HB2 SER A 22 -4.466 17.479 10.431 1.00 0.00 H new ATOM 0 HB3 SER A 22 -5.994 16.624 10.515 1.00 0.00 H new ATOM 0 HG SER A 22 -4.778 16.446 12.496 1.00 0.00 H new ATOM 338 N LYS A 23 -5.946 16.403 7.599 1.00 0.00 N ATOM 339 CA LYS A 23 -7.053 16.291 6.620 1.00 0.00 C ATOM 340 C LYS A 23 -6.579 15.669 5.302 1.00 0.00 C ATOM 341 O LYS A 23 -7.295 14.877 4.719 1.00 0.00 O ATOM 342 CB LYS A 23 -7.539 17.722 6.406 1.00 0.00 C ATOM 343 CG LYS A 23 -9.016 17.833 6.781 1.00 0.00 C ATOM 344 CD LYS A 23 -9.857 18.052 5.518 1.00 0.00 C ATOM 345 CE LYS A 23 -9.395 19.326 4.805 1.00 0.00 C ATOM 346 NZ LYS A 23 -10.635 19.914 4.227 1.00 0.00 N ATOM 0 H LYS A 23 -5.468 17.304 7.606 1.00 0.00 H new ATOM 0 HA LYS A 23 -7.846 15.638 6.985 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -6.949 18.410 7.012 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -7.397 18.011 5.365 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -9.340 16.926 7.292 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -9.163 18.660 7.475 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -9.760 17.195 4.851 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -10.912 18.133 5.781 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -8.917 20.016 5.500 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -8.665 19.101 4.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -10.400 20.792 3.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -11.064 19.237 3.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -11.308 20.124 4.991 1.00 0.00 H new ATOM 360 N MET A 24 -5.396 15.982 4.808 1.00 0.00 N ATOM 361 CA MET A 24 -4.994 15.329 3.531 1.00 0.00 C ATOM 362 C MET A 24 -4.825 13.834 3.793 1.00 0.00 C ATOM 363 O MET A 24 -5.017 13.026 2.910 1.00 0.00 O ATOM 364 CB MET A 24 -3.687 15.957 3.004 1.00 0.00 C ATOM 365 CG MET A 24 -3.062 16.945 3.992 1.00 0.00 C ATOM 366 SD MET A 24 -1.273 16.835 3.846 1.00 0.00 S ATOM 367 CE MET A 24 -1.202 15.111 4.356 1.00 0.00 C ATOM 0 H MET A 24 -4.725 16.632 5.218 1.00 0.00 H new ATOM 0 HA MET A 24 -5.758 15.477 2.768 1.00 0.00 H new ATOM 0 HB2 MET A 24 -2.970 15.165 2.787 1.00 0.00 H new ATOM 0 HB3 MET A 24 -3.889 16.470 2.064 1.00 0.00 H new ATOM 0 HG2 MET A 24 -3.399 17.960 3.779 1.00 0.00 H new ATOM 0 HG3 MET A 24 -3.375 16.713 5.010 1.00 0.00 H new ATOM 0 HE1 MET A 24 -0.342 14.960 5.008 1.00 0.00 H new ATOM 0 HE2 MET A 24 -2.115 14.853 4.893 1.00 0.00 H new ATOM 0 HE3 MET A 24 -1.107 14.475 3.476 1.00 0.00 H new ATOM 377 N LEU A 25 -4.501 13.445 5.009 1.00 0.00 N ATOM 378 CA LEU A 25 -4.379 11.987 5.288 1.00 0.00 C ATOM 379 C LEU A 25 -5.781 11.379 5.361 1.00 0.00 C ATOM 380 O LEU A 25 -6.050 10.347 4.779 1.00 0.00 O ATOM 381 CB LEU A 25 -3.628 11.870 6.620 1.00 0.00 C ATOM 382 CG LEU A 25 -4.595 11.720 7.810 1.00 0.00 C ATOM 383 CD1 LEU A 25 -5.058 10.267 7.917 1.00 0.00 C ATOM 384 CD2 LEU A 25 -3.894 12.115 9.111 1.00 0.00 C ATOM 0 H LEU A 25 -4.321 14.064 5.799 1.00 0.00 H new ATOM 0 HA LEU A 25 -3.837 11.448 4.511 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -2.958 11.011 6.585 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.006 12.753 6.766 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.453 12.372 7.648 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -5.742 10.164 8.760 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -5.569 9.979 6.998 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -4.194 9.620 8.070 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -4.587 12.005 9.945 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -3.030 11.470 9.269 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -3.565 13.152 9.047 1.00 0.00 H new ATOM 396 N ALA A 26 -6.686 12.030 6.050 1.00 0.00 N ATOM 397 CA ALA A 26 -8.073 11.500 6.126 1.00 0.00 C ATOM 398 C ALA A 26 -8.651 11.527 4.720 1.00 0.00 C ATOM 399 O ALA A 26 -9.520 10.754 4.367 1.00 0.00 O ATOM 400 CB ALA A 26 -8.828 12.460 7.047 1.00 0.00 C ATOM 0 H ALA A 26 -6.521 12.899 6.558 1.00 0.00 H new ATOM 0 HA ALA A 26 -8.133 10.480 6.506 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -9.862 12.129 7.149 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -8.353 12.473 8.028 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -8.808 13.463 6.622 1.00 0.00 H new ATOM 406 N SER A 27 -8.131 12.403 3.903 1.00 0.00 N ATOM 407 CA SER A 27 -8.602 12.484 2.500 1.00 0.00 C ATOM 408 C SER A 27 -7.831 11.464 1.675 1.00 0.00 C ATOM 409 O SER A 27 -8.384 10.780 0.842 1.00 0.00 O ATOM 410 CB SER A 27 -8.281 13.906 2.047 1.00 0.00 C ATOM 411 OG SER A 27 -6.912 13.988 1.679 1.00 0.00 O ATOM 0 H SER A 27 -7.398 13.066 4.153 1.00 0.00 H new ATOM 0 HA SER A 27 -9.665 12.272 2.389 1.00 0.00 H new ATOM 0 HB2 SER A 27 -8.913 14.181 1.202 1.00 0.00 H new ATOM 0 HB3 SER A 27 -8.496 14.612 2.849 1.00 0.00 H new ATOM 0 HG SER A 27 -6.814 14.596 0.917 1.00 0.00 H new ATOM 417 N PHE A 28 -6.553 11.349 1.926 1.00 0.00 N ATOM 418 CA PHE A 28 -5.719 10.361 1.182 1.00 0.00 C ATOM 419 C PHE A 28 -6.307 8.973 1.374 1.00 0.00 C ATOM 420 O PHE A 28 -6.523 8.255 0.429 1.00 0.00 O ATOM 421 CB PHE A 28 -4.318 10.482 1.795 1.00 0.00 C ATOM 422 CG PHE A 28 -3.656 9.126 1.927 1.00 0.00 C ATOM 423 CD1 PHE A 28 -3.935 8.316 3.036 1.00 0.00 C ATOM 424 CD2 PHE A 28 -2.733 8.694 0.967 1.00 0.00 C ATOM 425 CE1 PHE A 28 -3.304 7.089 3.179 1.00 0.00 C ATOM 426 CE2 PHE A 28 -2.096 7.466 1.117 1.00 0.00 C ATOM 427 CZ PHE A 28 -2.380 6.662 2.222 1.00 0.00 C ATOM 0 H PHE A 28 -6.049 11.901 2.619 1.00 0.00 H new ATOM 0 HA PHE A 28 -5.685 10.542 0.108 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -3.701 11.131 1.173 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -4.387 10.952 2.776 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -4.643 8.648 3.781 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -2.515 9.314 0.110 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -3.527 6.463 4.031 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -1.381 7.135 0.378 1.00 0.00 H new ATOM 0 HZ PHE A 28 -1.885 5.709 2.337 1.00 0.00 H new ATOM 437 N GLU A 29 -6.609 8.598 2.576 1.00 0.00 N ATOM 438 CA GLU A 29 -7.220 7.271 2.764 1.00 0.00 C ATOM 439 C GLU A 29 -8.608 7.325 2.164 1.00 0.00 C ATOM 440 O GLU A 29 -9.089 6.381 1.569 1.00 0.00 O ATOM 441 CB GLU A 29 -7.292 7.044 4.258 1.00 0.00 C ATOM 442 CG GLU A 29 -7.678 5.593 4.489 1.00 0.00 C ATOM 443 CD GLU A 29 -8.986 5.520 5.280 1.00 0.00 C ATOM 444 OE1 GLU A 29 -9.883 6.291 4.975 1.00 0.00 O ATOM 445 OE2 GLU A 29 -9.070 4.697 6.176 1.00 0.00 O ATOM 0 H GLU A 29 -6.461 9.145 3.424 1.00 0.00 H new ATOM 0 HA GLU A 29 -6.657 6.467 2.290 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -6.331 7.263 4.724 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -8.025 7.711 4.711 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -7.792 5.082 3.533 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -6.885 5.079 5.033 1.00 0.00 H new ATOM 452 N LYS A 30 -9.240 8.457 2.284 1.00 0.00 N ATOM 453 CA LYS A 30 -10.580 8.613 1.690 1.00 0.00 C ATOM 454 C LYS A 30 -10.442 8.506 0.178 1.00 0.00 C ATOM 455 O LYS A 30 -11.363 8.171 -0.498 1.00 0.00 O ATOM 456 CB LYS A 30 -11.071 10.002 2.096 1.00 0.00 C ATOM 457 CG LYS A 30 -12.421 10.278 1.429 1.00 0.00 C ATOM 458 CD LYS A 30 -12.953 11.640 1.883 1.00 0.00 C ATOM 459 CE LYS A 30 -14.084 11.437 2.895 1.00 0.00 C ATOM 460 NZ LYS A 30 -14.749 12.766 3.001 1.00 0.00 N ATOM 0 H LYS A 30 -8.880 9.278 2.770 1.00 0.00 H new ATOM 0 HA LYS A 30 -11.284 7.852 2.027 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -11.169 10.063 3.180 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -10.344 10.758 1.799 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -12.311 10.263 0.345 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -13.133 9.494 1.688 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -12.150 12.224 2.332 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -13.316 12.205 1.024 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -14.783 10.672 2.558 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -13.696 11.111 3.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -15.536 12.707 3.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -14.061 13.473 3.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -15.114 13.047 2.069 1.00 0.00 H new ATOM 474 N ILE A 31 -9.285 8.744 -0.368 1.00 0.00 N ATOM 475 CA ILE A 31 -9.152 8.594 -1.841 1.00 0.00 C ATOM 476 C ILE A 31 -8.397 7.315 -2.145 1.00 0.00 C ATOM 477 O ILE A 31 -8.622 6.677 -3.145 1.00 0.00 O ATOM 478 CB ILE A 31 -8.444 9.824 -2.381 1.00 0.00 C ATOM 479 CG1 ILE A 31 -7.326 10.300 -1.472 1.00 0.00 C ATOM 480 CG2 ILE A 31 -9.476 10.934 -2.565 1.00 0.00 C ATOM 481 CD1 ILE A 31 -6.028 10.274 -2.268 1.00 0.00 C ATOM 0 H ILE A 31 -8.442 9.030 0.129 1.00 0.00 H new ATOM 0 HA ILE A 31 -10.126 8.519 -2.325 1.00 0.00 H new ATOM 0 HB ILE A 31 -7.982 9.561 -3.332 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -7.531 11.308 -1.111 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -7.248 9.657 -0.595 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -8.985 11.827 -2.953 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -10.241 10.606 -3.269 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -9.939 11.163 -1.605 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.207 10.612 -1.636 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -5.830 9.257 -2.607 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -6.117 10.934 -3.131 1.00 0.00 H new ATOM 493 N ILE A 32 -7.551 6.904 -1.259 1.00 0.00 N ATOM 494 CA ILE A 32 -6.831 5.620 -1.466 1.00 0.00 C ATOM 495 C ILE A 32 -7.823 4.499 -1.262 1.00 0.00 C ATOM 496 O ILE A 32 -8.112 3.722 -2.158 1.00 0.00 O ATOM 497 CB ILE A 32 -5.747 5.546 -0.389 1.00 0.00 C ATOM 498 CG1 ILE A 32 -4.782 6.732 -0.543 1.00 0.00 C ATOM 499 CG2 ILE A 32 -4.988 4.223 -0.541 1.00 0.00 C ATOM 500 CD1 ILE A 32 -3.462 6.270 -1.156 1.00 0.00 C ATOM 0 H ILE A 32 -7.322 7.398 -0.397 1.00 0.00 H new ATOM 0 HA ILE A 32 -6.391 5.545 -2.461 1.00 0.00 H new ATOM 0 HB ILE A 32 -6.201 5.593 0.601 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -5.235 7.497 -1.173 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -4.598 7.188 0.430 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -4.212 4.159 0.222 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -5.681 3.390 -0.424 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -4.530 4.178 -1.529 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -2.790 7.122 -1.258 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -3.003 5.522 -0.510 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -3.649 5.836 -2.138 1.00 0.00 H new ATOM 512 N THR A 33 -8.362 4.429 -0.086 1.00 0.00 N ATOM 513 CA THR A 33 -9.348 3.382 0.197 1.00 0.00 C ATOM 514 C THR A 33 -10.613 3.663 -0.625 1.00 0.00 C ATOM 515 O THR A 33 -11.273 2.754 -1.097 1.00 0.00 O ATOM 516 CB THR A 33 -9.577 3.461 1.716 1.00 0.00 C ATOM 517 OG1 THR A 33 -9.102 2.274 2.325 1.00 0.00 O ATOM 518 CG2 THR A 33 -11.057 3.625 2.032 1.00 0.00 C ATOM 0 H THR A 33 -8.157 5.058 0.690 1.00 0.00 H new ATOM 0 HA THR A 33 -9.029 2.376 -0.077 1.00 0.00 H new ATOM 0 HB THR A 33 -9.037 4.325 2.103 1.00 0.00 H new ATOM 0 HG1 THR A 33 -8.186 2.414 2.643 1.00 0.00 H new ATOM 0 HG21 THR A 33 -11.195 3.679 3.112 1.00 0.00 H new ATOM 0 HG22 THR A 33 -11.428 4.542 1.573 1.00 0.00 H new ATOM 0 HG23 THR A 33 -11.610 2.772 1.638 1.00 0.00 H new ATOM 526 N GLU A 34 -10.956 4.916 -0.815 1.00 0.00 N ATOM 527 CA GLU A 34 -12.168 5.221 -1.611 1.00 0.00 C ATOM 528 C GLU A 34 -11.897 5.075 -3.111 1.00 0.00 C ATOM 529 O GLU A 34 -12.780 4.686 -3.844 1.00 0.00 O ATOM 530 CB GLU A 34 -12.515 6.650 -1.247 1.00 0.00 C ATOM 531 CG GLU A 34 -13.030 6.679 0.206 1.00 0.00 C ATOM 532 CD GLU A 34 -14.454 6.116 0.265 1.00 0.00 C ATOM 533 OE1 GLU A 34 -14.885 5.534 -0.718 1.00 0.00 O ATOM 534 OE2 GLU A 34 -15.090 6.278 1.294 1.00 0.00 O ATOM 0 H GLU A 34 -10.451 5.725 -0.455 1.00 0.00 H new ATOM 0 HA GLU A 34 -12.987 4.535 -1.395 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -11.638 7.290 -1.350 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -13.275 7.039 -1.925 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -12.371 6.093 0.847 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -13.017 7.701 0.585 1.00 0.00 H new ATOM 541 N THR A 35 -10.697 5.351 -3.598 1.00 0.00 N ATOM 542 CA THR A 35 -10.474 5.162 -5.069 1.00 0.00 C ATOM 543 C THR A 35 -10.751 3.715 -5.386 1.00 0.00 C ATOM 544 O THR A 35 -11.524 3.406 -6.271 1.00 0.00 O ATOM 545 CB THR A 35 -9.015 5.490 -5.393 1.00 0.00 C ATOM 546 OG1 THR A 35 -8.860 6.898 -5.514 1.00 0.00 O ATOM 547 CG2 THR A 35 -8.639 4.815 -6.722 1.00 0.00 C ATOM 0 H THR A 35 -9.897 5.685 -3.061 1.00 0.00 H new ATOM 0 HA THR A 35 -11.125 5.811 -5.654 1.00 0.00 H new ATOM 0 HB THR A 35 -8.367 5.126 -4.596 1.00 0.00 H new ATOM 0 HG1 THR A 35 -8.971 7.316 -4.635 1.00 0.00 H new ATOM 0 HG21 THR A 35 -7.601 5.041 -6.964 1.00 0.00 H new ATOM 0 HG22 THR A 35 -8.763 3.736 -6.630 1.00 0.00 H new ATOM 0 HG23 THR A 35 -9.286 5.188 -7.516 1.00 0.00 H new ATOM 555 N VAL A 36 -10.155 2.814 -4.654 1.00 0.00 N ATOM 556 CA VAL A 36 -10.458 1.385 -4.926 1.00 0.00 C ATOM 557 C VAL A 36 -11.981 1.230 -4.863 1.00 0.00 C ATOM 558 O VAL A 36 -12.584 0.507 -5.631 1.00 0.00 O ATOM 559 CB VAL A 36 -9.751 0.588 -3.820 1.00 0.00 C ATOM 560 CG1 VAL A 36 -10.769 0.088 -2.787 1.00 0.00 C ATOM 561 CG2 VAL A 36 -9.032 -0.609 -4.445 1.00 0.00 C ATOM 0 H VAL A 36 -9.491 2.998 -3.902 1.00 0.00 H new ATOM 0 HA VAL A 36 -10.118 1.033 -5.900 1.00 0.00 H new ATOM 0 HB VAL A 36 -9.032 1.236 -3.319 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -10.252 -0.475 -2.010 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -11.281 0.940 -2.339 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -11.499 -0.556 -3.278 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -8.528 -1.179 -3.664 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -9.758 -1.247 -4.949 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -8.297 -0.255 -5.168 1.00 0.00 H new ATOM 571 N ALA A 37 -12.600 1.955 -3.961 1.00 0.00 N ATOM 572 CA ALA A 37 -14.084 1.910 -3.851 1.00 0.00 C ATOM 573 C ALA A 37 -14.707 2.808 -4.924 1.00 0.00 C ATOM 574 O ALA A 37 -15.900 2.804 -5.144 1.00 0.00 O ATOM 575 CB ALA A 37 -14.395 2.445 -2.469 1.00 0.00 C ATOM 0 H ALA A 37 -12.136 2.575 -3.297 1.00 0.00 H new ATOM 0 HA ALA A 37 -14.482 0.906 -3.994 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -15.474 2.443 -2.312 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -13.918 1.814 -1.719 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -14.017 3.464 -2.380 1.00 0.00 H new ATOM 581 N LYS A 38 -13.897 3.556 -5.617 1.00 0.00 N ATOM 582 CA LYS A 38 -14.420 4.412 -6.710 1.00 0.00 C ATOM 583 C LYS A 38 -14.143 3.682 -8.008 1.00 0.00 C ATOM 584 O LYS A 38 -14.607 4.050 -9.070 1.00 0.00 O ATOM 585 CB LYS A 38 -13.641 5.727 -6.631 1.00 0.00 C ATOM 586 CG LYS A 38 -14.617 6.908 -6.692 1.00 0.00 C ATOM 587 CD LYS A 38 -14.750 7.538 -5.303 1.00 0.00 C ATOM 588 CE LYS A 38 -15.380 6.528 -4.340 1.00 0.00 C ATOM 589 NZ LYS A 38 -16.845 6.622 -4.590 1.00 0.00 N ATOM 0 H LYS A 38 -12.889 3.610 -5.471 1.00 0.00 H new ATOM 0 HA LYS A 38 -15.488 4.616 -6.640 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -13.065 5.765 -5.706 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -12.928 5.789 -7.453 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -14.261 7.650 -7.406 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -15.592 6.569 -7.043 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -13.770 7.844 -4.936 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -15.365 8.436 -5.357 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -15.011 5.520 -4.528 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -15.140 6.767 -3.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -17.320 6.987 -3.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -17.020 7.266 -5.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -17.219 5.679 -4.818 1.00 0.00 H new ATOM 603 N GLY A 39 -13.399 2.618 -7.906 1.00 0.00 N ATOM 604 CA GLY A 39 -13.085 1.806 -9.085 1.00 0.00 C ATOM 605 C GLY A 39 -11.950 2.443 -9.875 1.00 0.00 C ATOM 606 O GLY A 39 -12.025 2.574 -11.082 1.00 0.00 O ATOM 0 H GLY A 39 -12.993 2.280 -7.033 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -12.803 0.799 -8.777 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -13.969 1.711 -9.716 1.00 0.00 H new ATOM 610 N ASP A 40 -10.895 2.835 -9.215 1.00 0.00 N ATOM 611 CA ASP A 40 -9.760 3.455 -9.958 1.00 0.00 C ATOM 612 C ASP A 40 -8.439 2.791 -9.561 1.00 0.00 C ATOM 613 O ASP A 40 -8.040 2.814 -8.415 1.00 0.00 O ATOM 614 CB ASP A 40 -9.772 4.933 -9.563 1.00 0.00 C ATOM 615 CG ASP A 40 -10.091 5.790 -10.791 1.00 0.00 C ATOM 616 OD1 ASP A 40 -9.601 5.464 -11.859 1.00 0.00 O ATOM 617 OD2 ASP A 40 -10.820 6.757 -10.640 1.00 0.00 O ATOM 0 H ASP A 40 -10.769 2.755 -8.206 1.00 0.00 H new ATOM 0 HA ASP A 40 -9.860 3.331 -11.036 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -10.514 5.106 -8.784 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -8.804 5.217 -9.150 1.00 0.00 H new ATOM 622 N LYS A 41 -7.761 2.203 -10.506 1.00 0.00 N ATOM 623 CA LYS A 41 -6.463 1.539 -10.196 1.00 0.00 C ATOM 624 C LYS A 41 -5.377 2.599 -10.018 1.00 0.00 C ATOM 625 O LYS A 41 -4.623 2.888 -10.927 1.00 0.00 O ATOM 626 CB LYS A 41 -6.165 0.657 -11.409 1.00 0.00 C ATOM 627 CG LYS A 41 -7.267 -0.392 -11.562 1.00 0.00 C ATOM 628 CD LYS A 41 -7.325 -0.864 -13.016 1.00 0.00 C ATOM 629 CE LYS A 41 -7.880 -2.290 -13.068 1.00 0.00 C ATOM 630 NZ LYS A 41 -6.704 -3.169 -12.823 1.00 0.00 N ATOM 0 H LYS A 41 -8.050 2.153 -11.483 1.00 0.00 H new ATOM 0 HA LYS A 41 -6.499 0.955 -9.277 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -6.103 1.268 -12.309 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -5.198 0.169 -11.288 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -7.073 -1.237 -10.902 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -8.228 0.029 -11.267 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -7.956 -0.195 -13.602 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -6.330 -0.833 -13.459 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -8.651 -2.442 -12.312 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -8.336 -2.501 -14.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -7.018 -4.049 -12.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -6.244 -3.393 -13.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -6.028 -2.679 -12.203 1.00 0.00 H new ATOM 644 N VAL A 42 -5.300 3.188 -8.857 1.00 0.00 N ATOM 645 CA VAL A 42 -4.268 4.241 -8.622 1.00 0.00 C ATOM 646 C VAL A 42 -2.865 3.642 -8.735 1.00 0.00 C ATOM 647 O VAL A 42 -2.629 2.507 -8.368 1.00 0.00 O ATOM 648 CB VAL A 42 -4.529 4.766 -7.204 1.00 0.00 C ATOM 649 CG1 VAL A 42 -4.520 3.606 -6.210 1.00 0.00 C ATOM 650 CG2 VAL A 42 -3.438 5.768 -6.814 1.00 0.00 C ATOM 0 H VAL A 42 -5.905 2.987 -8.061 1.00 0.00 H new ATOM 0 HA VAL A 42 -4.327 5.043 -9.358 1.00 0.00 H new ATOM 0 HB VAL A 42 -5.502 5.256 -7.183 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -4.706 3.986 -5.205 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -5.299 2.892 -6.477 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -3.549 3.111 -6.237 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -3.627 6.138 -5.806 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -2.465 5.277 -6.843 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -3.444 6.603 -7.514 1.00 0.00 H new ATOM 660 N GLN A 43 -1.934 4.401 -9.247 1.00 0.00 N ATOM 661 CA GLN A 43 -0.542 3.885 -9.395 1.00 0.00 C ATOM 662 C GLN A 43 0.446 4.866 -8.763 1.00 0.00 C ATOM 663 O GLN A 43 0.821 5.854 -9.365 1.00 0.00 O ATOM 664 CB GLN A 43 -0.295 3.790 -10.907 1.00 0.00 C ATOM 665 CG GLN A 43 -1.575 3.354 -11.625 1.00 0.00 C ATOM 666 CD GLN A 43 -1.215 2.500 -12.842 1.00 0.00 C ATOM 667 OE1 GLN A 43 -0.268 2.792 -13.544 1.00 0.00 O ATOM 668 NE2 GLN A 43 -1.936 1.450 -13.123 1.00 0.00 N ATOM 0 H GLN A 43 -2.077 5.358 -9.570 1.00 0.00 H new ATOM 0 HA GLN A 43 -0.411 2.921 -8.903 1.00 0.00 H new ATOM 0 HB2 GLN A 43 0.035 4.756 -11.290 1.00 0.00 H new ATOM 0 HB3 GLN A 43 0.505 3.077 -11.108 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -2.210 2.786 -10.945 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -2.145 4.229 -11.938 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -2.731 1.205 -12.533 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -1.704 0.874 -13.932 1.00 0.00 H new ATOM 677 N LEU A 44 0.877 4.602 -7.559 1.00 0.00 N ATOM 678 CA LEU A 44 1.846 5.521 -6.901 1.00 0.00 C ATOM 679 C LEU A 44 3.134 5.574 -7.719 1.00 0.00 C ATOM 680 O LEU A 44 3.889 4.626 -7.744 1.00 0.00 O ATOM 681 CB LEU A 44 2.107 4.903 -5.529 1.00 0.00 C ATOM 682 CG LEU A 44 1.171 5.538 -4.503 1.00 0.00 C ATOM 683 CD1 LEU A 44 1.241 4.762 -3.184 1.00 0.00 C ATOM 684 CD2 LEU A 44 1.606 6.981 -4.266 1.00 0.00 C ATOM 0 H LEU A 44 0.600 3.792 -7.005 1.00 0.00 H new ATOM 0 HA LEU A 44 1.470 6.541 -6.819 1.00 0.00 H new ATOM 0 HB2 LEU A 44 1.947 3.825 -5.566 1.00 0.00 H new ATOM 0 HB3 LEU A 44 3.145 5.061 -5.238 1.00 0.00 H new ATOM 0 HG LEU A 44 0.147 5.513 -4.877 1.00 0.00 H new ATOM 0 HD11 LEU A 44 0.571 5.220 -2.456 1.00 0.00 H new ATOM 0 HD12 LEU A 44 0.940 3.728 -3.354 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.262 4.785 -2.802 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.944 7.445 -3.535 1.00 0.00 H new ATOM 0 HD22 LEU A 44 2.629 6.996 -3.890 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.556 7.535 -5.203 1.00 0.00 H new ATOM 696 N THR A 45 3.380 6.679 -8.389 1.00 0.00 N ATOM 697 CA THR A 45 4.620 6.824 -9.230 1.00 0.00 C ATOM 698 C THR A 45 5.060 5.468 -9.811 1.00 0.00 C ATOM 699 O THR A 45 4.616 5.073 -10.871 1.00 0.00 O ATOM 700 CB THR A 45 5.700 7.425 -8.305 1.00 0.00 C ATOM 701 OG1 THR A 45 6.987 7.044 -8.772 1.00 0.00 O ATOM 702 CG2 THR A 45 5.521 6.941 -6.862 1.00 0.00 C ATOM 0 H THR A 45 2.769 7.496 -8.390 1.00 0.00 H new ATOM 0 HA THR A 45 4.442 7.471 -10.089 1.00 0.00 H new ATOM 0 HB THR A 45 5.600 8.510 -8.320 1.00 0.00 H new ATOM 0 HG1 THR A 45 7.674 7.426 -8.187 1.00 0.00 H new ATOM 0 HG21 THR A 45 6.295 7.380 -6.232 1.00 0.00 H new ATOM 0 HG22 THR A 45 4.540 7.244 -6.496 1.00 0.00 H new ATOM 0 HG23 THR A 45 5.600 5.854 -6.830 1.00 0.00 H new ATOM 710 N GLY A 46 5.918 4.751 -9.130 1.00 0.00 N ATOM 711 CA GLY A 46 6.362 3.430 -9.653 1.00 0.00 C ATOM 712 C GLY A 46 6.689 2.497 -8.485 1.00 0.00 C ATOM 713 O GLY A 46 7.564 1.658 -8.583 1.00 0.00 O ATOM 0 H GLY A 46 6.328 5.025 -8.237 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.580 2.992 -10.273 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.239 3.555 -10.288 1.00 0.00 H new ATOM 717 N PHE A 47 6.000 2.629 -7.377 1.00 0.00 N ATOM 718 CA PHE A 47 6.295 1.735 -6.219 1.00 0.00 C ATOM 719 C PHE A 47 5.015 1.183 -5.581 1.00 0.00 C ATOM 720 O PHE A 47 5.046 0.141 -4.960 1.00 0.00 O ATOM 721 CB PHE A 47 7.140 2.580 -5.256 1.00 0.00 C ATOM 722 CG PHE A 47 6.268 3.349 -4.309 1.00 0.00 C ATOM 723 CD1 PHE A 47 5.790 2.745 -3.147 1.00 0.00 C ATOM 724 CD2 PHE A 47 5.947 4.669 -4.596 1.00 0.00 C ATOM 725 CE1 PHE A 47 4.984 3.471 -2.274 1.00 0.00 C ATOM 726 CE2 PHE A 47 5.140 5.398 -3.726 1.00 0.00 C ATOM 727 CZ PHE A 47 4.657 4.798 -2.564 1.00 0.00 C ATOM 0 H PHE A 47 5.255 3.309 -7.227 1.00 0.00 H new ATOM 0 HA PHE A 47 6.841 0.841 -6.522 1.00 0.00 H new ATOM 0 HB2 PHE A 47 7.812 1.933 -4.693 1.00 0.00 H new ATOM 0 HB3 PHE A 47 7.764 3.270 -5.824 1.00 0.00 H new ATOM 0 HD1 PHE A 47 6.044 1.719 -2.925 1.00 0.00 H new ATOM 0 HD2 PHE A 47 6.324 5.132 -5.496 1.00 0.00 H new ATOM 0 HE1 PHE A 47 4.611 3.008 -1.372 1.00 0.00 H new ATOM 0 HE2 PHE A 47 4.889 6.424 -3.951 1.00 0.00 H new ATOM 0 HZ PHE A 47 4.030 5.359 -1.888 1.00 0.00 H new ATOM 737 N LEU A 48 3.887 1.823 -5.737 1.00 0.00 N ATOM 738 CA LEU A 48 2.655 1.236 -5.138 1.00 0.00 C ATOM 739 C LEU A 48 1.515 1.188 -6.156 1.00 0.00 C ATOM 740 O LEU A 48 1.068 2.198 -6.664 1.00 0.00 O ATOM 741 CB LEU A 48 2.306 2.116 -3.946 1.00 0.00 C ATOM 742 CG LEU A 48 2.751 1.434 -2.645 1.00 0.00 C ATOM 743 CD1 LEU A 48 2.109 2.148 -1.465 1.00 0.00 C ATOM 744 CD2 LEU A 48 2.328 -0.043 -2.636 1.00 0.00 C ATOM 0 H LEU A 48 3.766 2.703 -6.239 1.00 0.00 H new ATOM 0 HA LEU A 48 2.817 0.204 -4.826 1.00 0.00 H new ATOM 0 HB2 LEU A 48 2.794 3.086 -4.044 1.00 0.00 H new ATOM 0 HB3 LEU A 48 1.232 2.300 -3.921 1.00 0.00 H new ATOM 0 HG LEU A 48 3.837 1.486 -2.572 1.00 0.00 H new ATOM 0 HD11 LEU A 48 2.420 1.669 -0.537 1.00 0.00 H new ATOM 0 HD12 LEU A 48 2.422 3.192 -1.457 1.00 0.00 H new ATOM 0 HD13 LEU A 48 1.024 2.095 -1.554 1.00 0.00 H new ATOM 0 HD21 LEU A 48 2.653 -0.509 -1.706 1.00 0.00 H new ATOM 0 HD22 LEU A 48 1.243 -0.111 -2.717 1.00 0.00 H new ATOM 0 HD23 LEU A 48 2.788 -0.558 -3.479 1.00 0.00 H new ATOM 756 N ASN A 49 1.050 0.005 -6.462 1.00 0.00 N ATOM 757 CA ASN A 49 -0.057 -0.143 -7.453 1.00 0.00 C ATOM 758 C ASN A 49 -1.305 -0.725 -6.781 1.00 0.00 C ATOM 759 O ASN A 49 -1.462 -1.925 -6.684 1.00 0.00 O ATOM 760 CB ASN A 49 0.488 -1.119 -8.499 1.00 0.00 C ATOM 761 CG ASN A 49 0.800 -0.364 -9.792 1.00 0.00 C ATOM 762 OD1 ASN A 49 0.067 0.522 -10.185 1.00 0.00 O ATOM 763 ND2 ASN A 49 1.866 -0.679 -10.476 1.00 0.00 N ATOM 0 H ASN A 49 1.392 -0.870 -6.065 1.00 0.00 H new ATOM 0 HA ASN A 49 -0.351 0.812 -7.889 1.00 0.00 H new ATOM 0 HB2 ASN A 49 1.389 -1.605 -8.123 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -0.242 -1.905 -8.692 1.00 0.00 H new ATOM 0 HD21 ASN A 49 2.083 -0.182 -11.340 1.00 0.00 H new ATOM 0 HD22 ASN A 49 2.482 -1.423 -10.147 1.00 0.00 H new ATOM 770 N ILE A 50 -2.199 0.116 -6.330 1.00 0.00 N ATOM 771 CA ILE A 50 -3.446 -0.391 -5.675 1.00 0.00 C ATOM 772 C ILE A 50 -4.513 -0.638 -6.743 1.00 0.00 C ATOM 773 O ILE A 50 -4.738 0.199 -7.596 1.00 0.00 O ATOM 774 CB ILE A 50 -3.909 0.728 -4.725 1.00 0.00 C ATOM 775 CG1 ILE A 50 -2.710 1.372 -4.012 1.00 0.00 C ATOM 776 CG2 ILE A 50 -4.871 0.153 -3.683 1.00 0.00 C ATOM 777 CD1 ILE A 50 -1.926 0.309 -3.244 1.00 0.00 C ATOM 0 H ILE A 50 -2.121 1.132 -6.386 1.00 0.00 H new ATOM 0 HA ILE A 50 -3.275 -1.325 -5.140 1.00 0.00 H new ATOM 0 HB ILE A 50 -4.415 1.492 -5.315 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -2.061 1.858 -4.741 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -3.056 2.146 -3.327 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -5.197 0.947 -3.012 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -5.738 -0.276 -4.186 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -4.364 -0.622 -3.108 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -1.078 0.774 -2.742 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -2.575 -0.157 -2.503 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.565 -0.449 -3.939 1.00 0.00 H new ATOM 789 N LYS A 51 -5.179 -1.768 -6.719 1.00 0.00 N ATOM 790 CA LYS A 51 -6.223 -2.006 -7.765 1.00 0.00 C ATOM 791 C LYS A 51 -7.348 -2.900 -7.227 1.00 0.00 C ATOM 792 O LYS A 51 -7.094 -3.976 -6.729 1.00 0.00 O ATOM 793 CB LYS A 51 -5.489 -2.694 -8.920 1.00 0.00 C ATOM 794 CG LYS A 51 -4.823 -3.981 -8.427 1.00 0.00 C ATOM 795 CD LYS A 51 -4.170 -4.706 -9.606 1.00 0.00 C ATOM 796 CE LYS A 51 -5.099 -5.820 -10.098 1.00 0.00 C ATOM 797 NZ LYS A 51 -4.997 -5.777 -11.583 1.00 0.00 N ATOM 0 H LYS A 51 -5.050 -2.518 -6.040 1.00 0.00 H new ATOM 0 HA LYS A 51 -6.696 -1.076 -8.080 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -6.191 -2.923 -9.722 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -4.738 -2.022 -9.335 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -4.074 -3.748 -7.670 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -5.563 -4.627 -7.954 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -3.969 -4.002 -10.414 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -3.211 -5.125 -9.303 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -4.792 -6.791 -9.709 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -6.124 -5.654 -9.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -5.847 -6.205 -12.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -4.916 -4.789 -11.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -4.156 -6.308 -11.889 1.00 0.00 H new ATOM 811 N PRO A 52 -8.566 -2.426 -7.342 1.00 0.00 N ATOM 812 CA PRO A 52 -9.724 -3.206 -6.857 1.00 0.00 C ATOM 813 C PRO A 52 -10.131 -4.255 -7.887 1.00 0.00 C ATOM 814 O PRO A 52 -10.161 -4.002 -9.075 1.00 0.00 O ATOM 815 CB PRO A 52 -10.824 -2.169 -6.710 1.00 0.00 C ATOM 816 CG PRO A 52 -10.471 -1.083 -7.672 1.00 0.00 C ATOM 817 CD PRO A 52 -8.981 -1.141 -7.918 1.00 0.00 C ATOM 0 HA PRO A 52 -9.512 -3.740 -5.931 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -11.800 -2.596 -6.939 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -10.874 -1.790 -5.689 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -11.017 -1.210 -8.607 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -10.753 -0.110 -7.269 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -8.752 -1.090 -8.982 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -8.467 -0.307 -7.441 1.00 0.00 H new ATOM 825 N VAL A 53 -10.458 -5.426 -7.430 1.00 0.00 N ATOM 826 CA VAL A 53 -10.884 -6.504 -8.368 1.00 0.00 C ATOM 827 C VAL A 53 -12.034 -7.309 -7.766 1.00 0.00 C ATOM 828 O VAL A 53 -11.893 -7.953 -6.749 1.00 0.00 O ATOM 829 CB VAL A 53 -9.651 -7.372 -8.582 1.00 0.00 C ATOM 830 CG1 VAL A 53 -8.520 -6.511 -9.150 1.00 0.00 C ATOM 831 CG2 VAL A 53 -9.207 -7.973 -7.248 1.00 0.00 C ATOM 0 H VAL A 53 -10.450 -5.688 -6.444 1.00 0.00 H new ATOM 0 HA VAL A 53 -11.251 -6.104 -9.313 1.00 0.00 H new ATOM 0 HB VAL A 53 -9.890 -8.175 -9.279 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -7.635 -7.128 -9.305 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -8.833 -6.081 -10.101 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -8.285 -5.710 -8.449 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -8.325 -8.594 -7.404 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -8.968 -7.171 -6.549 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -10.012 -8.583 -6.838 1.00 0.00 H new ATOM 841 N ALA A 54 -13.174 -7.249 -8.388 1.00 0.00 N ATOM 842 CA ALA A 54 -14.379 -7.971 -7.867 1.00 0.00 C ATOM 843 C ALA A 54 -14.037 -9.378 -7.365 1.00 0.00 C ATOM 844 O ALA A 54 -13.414 -10.168 -8.047 1.00 0.00 O ATOM 845 CB ALA A 54 -15.352 -8.043 -9.043 1.00 0.00 C ATOM 0 H ALA A 54 -13.331 -6.724 -9.249 1.00 0.00 H new ATOM 0 HA ALA A 54 -14.803 -7.447 -7.010 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -16.260 -8.561 -8.733 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -15.603 -7.034 -9.370 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -14.888 -8.586 -9.866 1.00 0.00 H new ATOM 1164 N VAL A 75 -15.084 -6.112 -3.492 1.00 0.00 N ATOM 1165 CA VAL A 75 -14.021 -6.138 -4.543 1.00 0.00 C ATOM 1166 C VAL A 75 -12.706 -6.633 -3.934 1.00 0.00 C ATOM 1167 O VAL A 75 -12.623 -6.898 -2.750 1.00 0.00 O ATOM 1168 CB VAL A 75 -13.903 -4.693 -5.073 1.00 0.00 C ATOM 1169 CG1 VAL A 75 -12.659 -4.001 -4.503 1.00 0.00 C ATOM 1170 CG2 VAL A 75 -13.798 -4.730 -6.600 1.00 0.00 C ATOM 0 HA VAL A 75 -14.263 -6.818 -5.360 1.00 0.00 H new ATOM 0 HB VAL A 75 -14.786 -4.134 -4.763 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -12.598 -2.984 -4.891 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -12.726 -3.971 -3.415 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -11.768 -4.555 -4.797 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -13.714 -3.713 -6.984 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -12.916 -5.301 -6.890 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -14.689 -5.202 -7.015 1.00 0.00 H new ATOM 1180 N GLY A 76 -11.685 -6.764 -4.729 1.00 0.00 N ATOM 1181 CA GLY A 76 -10.387 -7.248 -4.190 1.00 0.00 C ATOM 1182 C GLY A 76 -9.361 -6.126 -4.277 1.00 0.00 C ATOM 1183 O GLY A 76 -8.444 -6.173 -5.068 1.00 0.00 O ATOM 0 H GLY A 76 -11.692 -6.557 -5.728 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -10.506 -7.569 -3.155 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -10.045 -8.115 -4.755 1.00 0.00 H new ATOM 1187 N VAL A 77 -9.517 -5.118 -3.464 1.00 0.00 N ATOM 1188 CA VAL A 77 -8.559 -3.970 -3.474 1.00 0.00 C ATOM 1189 C VAL A 77 -7.126 -4.480 -3.373 1.00 0.00 C ATOM 1190 O VAL A 77 -6.525 -4.461 -2.322 1.00 0.00 O ATOM 1191 CB VAL A 77 -8.940 -3.132 -2.239 1.00 0.00 C ATOM 1192 CG1 VAL A 77 -9.045 -4.039 -1.002 1.00 0.00 C ATOM 1193 CG2 VAL A 77 -7.880 -2.050 -1.984 1.00 0.00 C ATOM 0 H VAL A 77 -10.274 -5.037 -2.785 1.00 0.00 H new ATOM 0 HA VAL A 77 -8.614 -3.384 -4.392 1.00 0.00 H new ATOM 0 HB VAL A 77 -9.903 -2.656 -2.426 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -9.315 -3.439 -0.133 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -9.809 -4.797 -1.171 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -8.085 -4.524 -0.824 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -8.161 -1.465 -1.109 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.913 -2.522 -1.810 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -7.813 -1.395 -2.852 1.00 0.00 H new ATOM 1203 N SER A 78 -6.578 -4.935 -4.462 1.00 0.00 N ATOM 1204 CA SER A 78 -5.183 -5.448 -4.426 1.00 0.00 C ATOM 1205 C SER A 78 -4.195 -4.286 -4.305 1.00 0.00 C ATOM 1206 O SER A 78 -4.571 -3.132 -4.298 1.00 0.00 O ATOM 1207 CB SER A 78 -4.984 -6.183 -5.752 1.00 0.00 C ATOM 1208 OG SER A 78 -6.224 -6.730 -6.186 1.00 0.00 O ATOM 0 H SER A 78 -7.034 -4.974 -5.374 1.00 0.00 H new ATOM 0 HA SER A 78 -5.012 -6.104 -3.572 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.594 -5.497 -6.504 1.00 0.00 H new ATOM 0 HB3 SER A 78 -4.247 -6.977 -5.632 1.00 0.00 H new ATOM 0 HG SER A 78 -6.869 -6.704 -5.449 1.00 0.00 H new ATOM 1214 N VAL A 79 -2.936 -4.606 -4.226 1.00 0.00 N ATOM 1215 CA VAL A 79 -1.860 -3.575 -4.106 1.00 0.00 C ATOM 1216 C VAL A 79 -0.512 -4.254 -4.376 1.00 0.00 C ATOM 1217 O VAL A 79 -0.442 -5.461 -4.503 1.00 0.00 O ATOM 1218 CB VAL A 79 -1.915 -3.123 -2.628 1.00 0.00 C ATOM 1219 CG1 VAL A 79 -0.672 -2.305 -2.264 1.00 0.00 C ATOM 1220 CG2 VAL A 79 -3.162 -2.275 -2.377 1.00 0.00 C ATOM 0 H VAL A 79 -2.594 -5.567 -4.240 1.00 0.00 H new ATOM 0 HA VAL A 79 -1.983 -2.743 -4.799 1.00 0.00 H new ATOM 0 HB VAL A 79 -1.950 -4.017 -2.006 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -0.732 -1.997 -1.220 1.00 0.00 H new ATOM 0 HG12 VAL A 79 0.220 -2.913 -2.413 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -0.619 -1.421 -2.900 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -3.187 -1.964 -1.332 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -3.137 -1.393 -3.017 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -4.052 -2.862 -2.602 1.00 0.00 H new ATOM 1230 N LYS A 80 0.564 -3.511 -4.400 1.00 0.00 N ATOM 1231 CA LYS A 80 1.893 -4.140 -4.584 1.00 0.00 C ATOM 1232 C LYS A 80 2.995 -3.084 -4.461 1.00 0.00 C ATOM 1233 O LYS A 80 2.730 -1.903 -4.476 1.00 0.00 O ATOM 1234 CB LYS A 80 1.871 -4.707 -6.008 1.00 0.00 C ATOM 1235 CG LYS A 80 1.684 -6.225 -5.963 1.00 0.00 C ATOM 1236 CD LYS A 80 0.505 -6.624 -6.854 1.00 0.00 C ATOM 1237 CE LYS A 80 -0.118 -7.918 -6.329 1.00 0.00 C ATOM 1238 NZ LYS A 80 0.526 -9.003 -7.120 1.00 0.00 N ATOM 0 H LYS A 80 0.574 -2.496 -4.300 1.00 0.00 H new ATOM 0 HA LYS A 80 2.091 -4.908 -3.836 1.00 0.00 H new ATOM 0 HB2 LYS A 80 1.063 -4.249 -6.578 1.00 0.00 H new ATOM 0 HB3 LYS A 80 2.801 -4.462 -6.521 1.00 0.00 H new ATOM 0 HG2 LYS A 80 2.593 -6.724 -6.300 1.00 0.00 H new ATOM 0 HG3 LYS A 80 1.504 -6.549 -4.938 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -0.240 -5.829 -6.867 1.00 0.00 H new ATOM 0 HD3 LYS A 80 0.842 -6.761 -7.881 1.00 0.00 H new ATOM 0 HE2 LYS A 80 0.070 -8.042 -5.262 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -1.200 -7.919 -6.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 0.149 -9.924 -6.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 0.325 -8.862 -8.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 1.554 -8.982 -6.966 1.00 0.00 H new ATOM 1252 N PRO A 81 4.201 -3.564 -4.386 1.00 0.00 N ATOM 1253 CA PRO A 81 5.394 -2.715 -4.302 1.00 0.00 C ATOM 1254 C PRO A 81 6.116 -2.660 -5.651 1.00 0.00 C ATOM 1255 O PRO A 81 6.298 -3.668 -6.306 1.00 0.00 O ATOM 1256 CB PRO A 81 6.255 -3.491 -3.315 1.00 0.00 C ATOM 1257 CG PRO A 81 5.806 -4.927 -3.436 1.00 0.00 C ATOM 1258 CD PRO A 81 4.577 -4.953 -4.318 1.00 0.00 C ATOM 0 HA PRO A 81 5.175 -1.686 -4.018 1.00 0.00 H new ATOM 0 HB2 PRO A 81 7.314 -3.389 -3.552 1.00 0.00 H new ATOM 0 HB3 PRO A 81 6.119 -3.121 -2.299 1.00 0.00 H new ATOM 0 HG2 PRO A 81 6.598 -5.540 -3.866 1.00 0.00 H new ATOM 0 HG3 PRO A 81 5.580 -5.341 -2.453 1.00 0.00 H new ATOM 0 HD2 PRO A 81 4.796 -5.361 -5.305 1.00 0.00 H new ATOM 0 HD3 PRO A 81 3.784 -5.566 -3.889 1.00 0.00 H new ATOM 1266 N GLY A 82 6.567 -1.508 -6.047 1.00 0.00 N ATOM 1267 CA GLY A 82 7.322 -1.408 -7.328 1.00 0.00 C ATOM 1268 C GLY A 82 8.797 -1.623 -7.007 1.00 0.00 C ATOM 1269 O GLY A 82 9.134 -2.335 -6.080 1.00 0.00 O ATOM 0 H GLY A 82 6.448 -0.630 -5.542 1.00 0.00 H new ATOM 0 HA2 GLY A 82 6.971 -2.156 -8.039 1.00 0.00 H new ATOM 0 HA3 GLY A 82 7.168 -0.432 -7.789 1.00 0.00 H new ATOM 1273 N GLU A 83 9.680 -1.003 -7.732 1.00 0.00 N ATOM 1274 CA GLU A 83 11.127 -1.172 -7.420 1.00 0.00 C ATOM 1275 C GLU A 83 11.636 0.045 -6.652 1.00 0.00 C ATOM 1276 O GLU A 83 12.701 0.017 -6.065 1.00 0.00 O ATOM 1277 CB GLU A 83 11.842 -1.298 -8.760 1.00 0.00 C ATOM 1278 CG GLU A 83 11.512 -0.091 -9.647 1.00 0.00 C ATOM 1279 CD GLU A 83 10.575 -0.527 -10.776 1.00 0.00 C ATOM 1280 OE1 GLU A 83 9.410 -0.758 -10.498 1.00 0.00 O ATOM 1281 OE2 GLU A 83 11.039 -0.621 -11.901 1.00 0.00 O ATOM 0 H GLU A 83 9.468 -0.391 -8.520 1.00 0.00 H new ATOM 0 HA GLU A 83 11.306 -2.050 -6.799 1.00 0.00 H new ATOM 0 HB2 GLU A 83 12.919 -1.360 -8.602 1.00 0.00 H new ATOM 0 HB3 GLU A 83 11.539 -2.219 -9.258 1.00 0.00 H new ATOM 0 HG2 GLU A 83 11.042 0.693 -9.053 1.00 0.00 H new ATOM 0 HG3 GLU A 83 12.428 0.330 -10.062 1.00 0.00 H new ATOM 1288 N SER A 84 10.878 1.112 -6.635 1.00 0.00 N ATOM 1289 CA SER A 84 11.323 2.319 -5.883 1.00 0.00 C ATOM 1290 C SER A 84 11.582 1.930 -4.429 1.00 0.00 C ATOM 1291 O SER A 84 12.462 2.456 -3.778 1.00 0.00 O ATOM 1292 CB SER A 84 10.165 3.310 -5.981 1.00 0.00 C ATOM 1293 OG SER A 84 10.683 4.622 -6.158 1.00 0.00 O ATOM 0 H SER A 84 9.977 1.198 -7.106 1.00 0.00 H new ATOM 0 HA SER A 84 12.242 2.750 -6.280 1.00 0.00 H new ATOM 0 HB2 SER A 84 9.516 3.047 -6.816 1.00 0.00 H new ATOM 0 HB3 SER A 84 9.556 3.266 -5.078 1.00 0.00 H new ATOM 0 HG SER A 84 9.983 5.279 -5.961 1.00 0.00 H new ATOM 1299 N LEU A 85 10.826 0.989 -3.926 1.00 0.00 N ATOM 1300 CA LEU A 85 11.032 0.537 -2.521 1.00 0.00 C ATOM 1301 C LEU A 85 12.170 -0.479 -2.484 1.00 0.00 C ATOM 1302 O LEU A 85 12.893 -0.583 -1.513 1.00 0.00 O ATOM 1303 CB LEU A 85 9.729 -0.148 -2.094 1.00 0.00 C ATOM 1304 CG LEU A 85 8.505 0.678 -2.510 1.00 0.00 C ATOM 1305 CD1 LEU A 85 7.553 -0.199 -3.327 1.00 0.00 C ATOM 1306 CD2 LEU A 85 7.780 1.183 -1.258 1.00 0.00 C ATOM 0 H LEU A 85 10.075 0.515 -4.428 1.00 0.00 H new ATOM 0 HA LEU A 85 11.281 1.369 -1.863 1.00 0.00 H new ATOM 0 HB2 LEU A 85 9.672 -1.139 -2.544 1.00 0.00 H new ATOM 0 HB3 LEU A 85 9.726 -0.288 -1.013 1.00 0.00 H new ATOM 0 HG LEU A 85 8.828 1.527 -3.112 1.00 0.00 H new ATOM 0 HD11 LEU A 85 6.683 0.387 -3.623 1.00 0.00 H new ATOM 0 HD12 LEU A 85 8.066 -0.562 -4.217 1.00 0.00 H new ATOM 0 HD13 LEU A 85 7.231 -1.047 -2.723 1.00 0.00 H new ATOM 0 HD21 LEU A 85 6.910 1.770 -1.553 1.00 0.00 H new ATOM 0 HD22 LEU A 85 7.457 0.333 -0.657 1.00 0.00 H new ATOM 0 HD23 LEU A 85 8.456 1.806 -0.672 1.00 0.00 H new ATOM 1318 N LYS A 86 12.325 -1.241 -3.536 1.00 0.00 N ATOM 1319 CA LYS A 86 13.408 -2.264 -3.562 1.00 0.00 C ATOM 1320 C LYS A 86 14.753 -1.597 -3.789 1.00 0.00 C ATOM 1321 O LYS A 86 15.741 -1.944 -3.172 1.00 0.00 O ATOM 1322 CB LYS A 86 13.061 -3.203 -4.720 1.00 0.00 C ATOM 1323 CG LYS A 86 12.756 -4.600 -4.175 1.00 0.00 C ATOM 1324 CD LYS A 86 11.733 -5.290 -5.080 1.00 0.00 C ATOM 1325 CE LYS A 86 11.510 -6.725 -4.596 1.00 0.00 C ATOM 1326 NZ LYS A 86 12.593 -7.520 -5.239 1.00 0.00 N ATOM 0 H LYS A 86 11.748 -1.198 -4.376 1.00 0.00 H new ATOM 0 HA LYS A 86 13.480 -2.807 -2.620 1.00 0.00 H new ATOM 0 HB2 LYS A 86 12.200 -2.819 -5.267 1.00 0.00 H new ATOM 0 HB3 LYS A 86 13.891 -3.250 -5.425 1.00 0.00 H new ATOM 0 HG2 LYS A 86 13.671 -5.191 -4.126 1.00 0.00 H new ATOM 0 HG3 LYS A 86 12.368 -4.529 -3.159 1.00 0.00 H new ATOM 0 HD2 LYS A 86 10.792 -4.740 -5.068 1.00 0.00 H new ATOM 0 HD3 LYS A 86 12.087 -5.293 -6.111 1.00 0.00 H new ATOM 0 HE2 LYS A 86 11.566 -6.788 -3.509 1.00 0.00 H new ATOM 0 HE3 LYS A 86 10.525 -7.091 -4.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 12.879 -8.294 -4.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 12.247 -7.917 -6.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 13.411 -6.905 -5.426 1.00 0.00 H new ATOM 1340 N LYS A 87 14.799 -0.622 -4.640 1.00 0.00 N ATOM 1341 CA LYS A 87 16.082 0.082 -4.859 1.00 0.00 C ATOM 1342 C LYS A 87 16.365 0.882 -3.597 1.00 0.00 C ATOM 1343 O LYS A 87 17.484 0.950 -3.099 1.00 0.00 O ATOM 1344 CB LYS A 87 15.848 0.989 -6.070 1.00 0.00 C ATOM 1345 CG LYS A 87 17.098 1.835 -6.330 1.00 0.00 C ATOM 1346 CD LYS A 87 16.706 3.108 -7.081 1.00 0.00 C ATOM 1347 CE LYS A 87 16.397 2.767 -8.540 1.00 0.00 C ATOM 1348 NZ LYS A 87 16.778 3.985 -9.308 1.00 0.00 N ATOM 0 H LYS A 87 14.010 -0.283 -5.191 1.00 0.00 H new ATOM 0 HA LYS A 87 16.932 -0.573 -5.049 1.00 0.00 H new ATOM 0 HB2 LYS A 87 15.616 0.387 -6.948 1.00 0.00 H new ATOM 0 HB3 LYS A 87 14.990 1.636 -5.891 1.00 0.00 H new ATOM 0 HG2 LYS A 87 17.580 2.091 -5.386 1.00 0.00 H new ATOM 0 HG3 LYS A 87 17.821 1.265 -6.913 1.00 0.00 H new ATOM 0 HD2 LYS A 87 15.835 3.566 -6.612 1.00 0.00 H new ATOM 0 HD3 LYS A 87 17.515 3.836 -7.031 1.00 0.00 H new ATOM 0 HE2 LYS A 87 16.965 1.898 -8.871 1.00 0.00 H new ATOM 0 HE3 LYS A 87 15.342 2.529 -8.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 16.595 3.829 -10.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 16.217 4.795 -8.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 17.789 4.183 -9.166 1.00 0.00 H new ATOM 1362 N ALA A 88 15.329 1.425 -3.024 1.00 0.00 N ATOM 1363 CA ALA A 88 15.507 2.158 -1.759 1.00 0.00 C ATOM 1364 C ALA A 88 15.851 1.123 -0.693 1.00 0.00 C ATOM 1365 O ALA A 88 16.632 1.363 0.207 1.00 0.00 O ATOM 1366 CB ALA A 88 14.156 2.820 -1.484 1.00 0.00 C ATOM 0 H ALA A 88 14.374 1.389 -3.381 1.00 0.00 H new ATOM 0 HA ALA A 88 16.295 2.911 -1.779 1.00 0.00 H new ATOM 0 HB1 ALA A 88 14.211 3.386 -0.554 1.00 0.00 H new ATOM 0 HB2 ALA A 88 13.907 3.493 -2.305 1.00 0.00 H new ATOM 0 HB3 ALA A 88 13.386 2.053 -1.397 1.00 0.00 H new ATOM 1372 N ALA A 89 15.288 -0.052 -0.819 1.00 0.00 N ATOM 1373 CA ALA A 89 15.585 -1.126 0.166 1.00 0.00 C ATOM 1374 C ALA A 89 17.075 -1.415 0.144 1.00 0.00 C ATOM 1375 O ALA A 89 17.709 -1.519 1.175 1.00 0.00 O ATOM 1376 CB ALA A 89 14.777 -2.339 -0.288 1.00 0.00 C ATOM 0 H ALA A 89 14.637 -0.310 -1.561 1.00 0.00 H new ATOM 0 HA ALA A 89 15.320 -0.851 1.187 1.00 0.00 H new ATOM 0 HB1 ALA A 89 14.951 -3.169 0.397 1.00 0.00 H new ATOM 0 HB2 ALA A 89 13.716 -2.088 -0.293 1.00 0.00 H new ATOM 0 HB3 ALA A 89 15.086 -2.627 -1.293 1.00 0.00 H new ATOM 1382 N GLU A 90 17.652 -1.493 -1.025 1.00 0.00 N ATOM 1383 CA GLU A 90 19.121 -1.713 -1.099 1.00 0.00 C ATOM 1384 C GLU A 90 19.775 -0.631 -0.244 1.00 0.00 C ATOM 1385 O GLU A 90 20.789 -0.840 0.394 1.00 0.00 O ATOM 1386 CB GLU A 90 19.490 -1.546 -2.575 1.00 0.00 C ATOM 1387 CG GLU A 90 19.851 -2.909 -3.169 1.00 0.00 C ATOM 1388 CD GLU A 90 21.333 -3.198 -2.924 1.00 0.00 C ATOM 1389 OE1 GLU A 90 21.801 -2.903 -1.838 1.00 0.00 O ATOM 1390 OE2 GLU A 90 21.973 -3.711 -3.827 1.00 0.00 O ATOM 0 H GLU A 90 17.174 -1.415 -1.922 1.00 0.00 H new ATOM 0 HA GLU A 90 19.443 -2.691 -0.740 1.00 0.00 H new ATOM 0 HB2 GLU A 90 18.655 -1.109 -3.122 1.00 0.00 H new ATOM 0 HB3 GLU A 90 20.331 -0.860 -2.675 1.00 0.00 H new ATOM 0 HG2 GLU A 90 19.238 -3.688 -2.716 1.00 0.00 H new ATOM 0 HG3 GLU A 90 19.640 -2.919 -4.238 1.00 0.00 H new ATOM 1397 N GLY A 91 19.161 0.527 -0.213 1.00 0.00 N ATOM 1398 CA GLY A 91 19.696 1.641 0.618 1.00 0.00 C ATOM 1399 C GLY A 91 19.598 1.278 2.112 1.00 0.00 C ATOM 1400 O GLY A 91 20.459 1.635 2.892 1.00 0.00 O ATOM 0 H GLY A 91 18.310 0.745 -0.731 1.00 0.00 H new ATOM 0 HA2 GLY A 91 20.734 1.839 0.351 1.00 0.00 H new ATOM 0 HA3 GLY A 91 19.136 2.555 0.420 1.00 0.00 H new ATOM 1404 N LEU A 92 18.560 0.577 2.528 1.00 0.00 N ATOM 1405 CA LEU A 92 18.433 0.214 3.975 1.00 0.00 C ATOM 1406 C LEU A 92 19.438 -0.875 4.370 1.00 0.00 C ATOM 1407 O LEU A 92 19.371 -1.412 5.458 1.00 0.00 O ATOM 1408 CB LEU A 92 16.991 -0.303 4.123 1.00 0.00 C ATOM 1409 CG LEU A 92 16.916 -1.823 3.900 1.00 0.00 C ATOM 1410 CD1 LEU A 92 16.964 -2.546 5.251 1.00 0.00 C ATOM 1411 CD2 LEU A 92 15.606 -2.172 3.185 1.00 0.00 C ATOM 0 H LEU A 92 17.804 0.245 1.929 1.00 0.00 H new ATOM 0 HA LEU A 92 18.641 1.065 4.624 1.00 0.00 H new ATOM 0 HB2 LEU A 92 16.616 -0.060 5.117 1.00 0.00 H new ATOM 0 HB3 LEU A 92 16.345 0.204 3.406 1.00 0.00 H new ATOM 0 HG LEU A 92 17.762 -2.138 3.289 1.00 0.00 H new ATOM 0 HD11 LEU A 92 16.911 -3.623 5.090 1.00 0.00 H new ATOM 0 HD12 LEU A 92 17.895 -2.301 5.762 1.00 0.00 H new ATOM 0 HD13 LEU A 92 16.120 -2.229 5.864 1.00 0.00 H new ATOM 0 HD21 LEU A 92 15.553 -3.249 3.027 1.00 0.00 H new ATOM 0 HD22 LEU A 92 14.762 -1.853 3.796 1.00 0.00 H new ATOM 0 HD23 LEU A 92 15.570 -1.662 2.222 1.00 0.00 H new ATOM 1423 N LYS A 93 20.341 -1.237 3.495 1.00 0.00 N ATOM 1424 CA LYS A 93 21.302 -2.328 3.834 1.00 0.00 C ATOM 1425 C LYS A 93 20.495 -3.609 4.027 1.00 0.00 C ATOM 1426 O LYS A 93 20.756 -4.414 4.904 1.00 0.00 O ATOM 1427 CB LYS A 93 21.991 -1.903 5.136 1.00 0.00 C ATOM 1428 CG LYS A 93 23.504 -2.090 5.001 1.00 0.00 C ATOM 1429 CD LYS A 93 24.112 -0.863 4.318 1.00 0.00 C ATOM 1430 CE LYS A 93 25.490 -0.569 4.919 1.00 0.00 C ATOM 1431 NZ LYS A 93 25.443 0.869 5.308 1.00 0.00 N ATOM 0 H LYS A 93 20.454 -0.828 2.568 1.00 0.00 H new ATOM 0 HA LYS A 93 22.049 -2.502 3.060 1.00 0.00 H new ATOM 0 HB2 LYS A 93 21.762 -0.861 5.357 1.00 0.00 H new ATOM 0 HB3 LYS A 93 21.614 -2.496 5.969 1.00 0.00 H new ATOM 0 HG2 LYS A 93 23.953 -2.231 5.984 1.00 0.00 H new ATOM 0 HG3 LYS A 93 23.720 -2.987 4.420 1.00 0.00 H new ATOM 0 HD2 LYS A 93 24.202 -1.038 3.246 1.00 0.00 H new ATOM 0 HD3 LYS A 93 23.457 -0.001 4.446 1.00 0.00 H new ATOM 0 HE2 LYS A 93 25.688 -1.205 5.782 1.00 0.00 H new ATOM 0 HE3 LYS A 93 26.284 -0.756 4.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 26.353 1.145 5.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 25.260 1.451 4.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 24.683 1.016 6.002 1.00 0.00 H new ATOM 1445 N TYR A 94 19.493 -3.777 3.204 1.00 0.00 N ATOM 1446 CA TYR A 94 18.612 -4.977 3.293 1.00 0.00 C ATOM 1447 C TYR A 94 19.451 -6.246 3.500 1.00 0.00 C ATOM 1448 O TYR A 94 19.055 -7.153 4.206 1.00 0.00 O ATOM 1449 CB TYR A 94 17.861 -5.005 1.958 1.00 0.00 C ATOM 1450 CG TYR A 94 18.484 -6.015 1.036 1.00 0.00 C ATOM 1451 CD1 TYR A 94 19.581 -5.664 0.247 1.00 0.00 C ATOM 1452 CD2 TYR A 94 17.973 -7.311 0.997 1.00 0.00 C ATOM 1453 CE1 TYR A 94 20.168 -6.619 -0.590 1.00 0.00 C ATOM 1454 CE2 TYR A 94 18.556 -8.270 0.165 1.00 0.00 C ATOM 1455 CZ TYR A 94 19.657 -7.924 -0.631 1.00 0.00 C ATOM 1456 OH TYR A 94 20.239 -8.865 -1.453 1.00 0.00 O ATOM 0 H TYR A 94 19.245 -3.122 2.462 1.00 0.00 H new ATOM 0 HA TYR A 94 17.925 -4.934 4.138 1.00 0.00 H new ATOM 0 HB2 TYR A 94 16.813 -5.253 2.127 1.00 0.00 H new ATOM 0 HB3 TYR A 94 17.885 -4.017 1.498 1.00 0.00 H new ATOM 0 HD1 TYR A 94 19.975 -4.659 0.283 1.00 0.00 H new ATOM 0 HD2 TYR A 94 17.125 -7.575 1.611 1.00 0.00 H new ATOM 0 HE1 TYR A 94 21.015 -6.351 -1.205 1.00 0.00 H new ATOM 0 HE2 TYR A 94 18.160 -9.274 0.135 1.00 0.00 H new ATOM 0 HH TYR A 94 19.765 -9.718 -1.361 1.00 0.00 H new ATOM 1466 N GLU A 95 20.610 -6.308 2.897 1.00 0.00 N ATOM 1467 CA GLU A 95 21.474 -7.513 3.071 1.00 0.00 C ATOM 1468 C GLU A 95 21.756 -7.717 4.558 1.00 0.00 C ATOM 1469 O GLU A 95 21.690 -8.819 5.067 1.00 0.00 O ATOM 1470 CB GLU A 95 22.762 -7.222 2.298 1.00 0.00 C ATOM 1471 CG GLU A 95 23.434 -5.963 2.852 1.00 0.00 C ATOM 1472 CD GLU A 95 24.550 -5.520 1.905 1.00 0.00 C ATOM 1473 OE1 GLU A 95 25.248 -6.384 1.399 1.00 0.00 O ATOM 1474 OE2 GLU A 95 24.688 -4.326 1.701 1.00 0.00 O ATOM 0 H GLU A 95 20.994 -5.580 2.294 1.00 0.00 H new ATOM 0 HA GLU A 95 21.002 -8.423 2.700 1.00 0.00 H new ATOM 0 HB2 GLU A 95 23.442 -8.071 2.376 1.00 0.00 H new ATOM 0 HB3 GLU A 95 22.538 -7.089 1.240 1.00 0.00 H new ATOM 0 HG2 GLU A 95 22.700 -5.165 2.964 1.00 0.00 H new ATOM 0 HG3 GLU A 95 23.842 -6.162 3.843 1.00 0.00 H new ATOM 1547 N MET B 1 -5.081 7.058 -11.404 1.00 0.00 N ATOM 1548 CA MET B 1 -4.359 8.260 -10.885 1.00 0.00 C ATOM 1549 C MET B 1 -2.916 7.914 -10.551 1.00 0.00 C ATOM 1550 O MET B 1 -2.413 6.868 -10.909 1.00 0.00 O ATOM 1551 CB MET B 1 -5.081 8.669 -9.602 1.00 0.00 C ATOM 1552 CG MET B 1 -5.437 7.434 -8.779 1.00 0.00 C ATOM 1553 SD MET B 1 -5.964 7.931 -7.116 1.00 0.00 S ATOM 1554 CE MET B 1 -7.031 9.313 -7.594 1.00 0.00 C ATOM 0 H1 MET B 1 -6.104 7.179 -11.262 1.00 0.00 H new ATOM 0 H2 MET B 1 -4.884 6.946 -12.419 1.00 0.00 H new ATOM 0 H3 MET B 1 -4.758 6.212 -10.893 1.00 0.00 H new ATOM 0 HA MET B 1 -4.352 9.057 -11.628 1.00 0.00 H new ATOM 0 HB2 MET B 1 -4.447 9.335 -9.016 1.00 0.00 H new ATOM 0 HB3 MET B 1 -5.986 9.225 -9.847 1.00 0.00 H new ATOM 0 HG2 MET B 1 -6.234 6.876 -9.271 1.00 0.00 H new ATOM 0 HG3 MET B 1 -4.576 6.769 -8.713 1.00 0.00 H new ATOM 0 HE1 MET B 1 -7.747 9.513 -6.796 1.00 0.00 H new ATOM 0 HE2 MET B 1 -6.422 10.200 -7.766 1.00 0.00 H new ATOM 0 HE3 MET B 1 -7.568 9.059 -8.508 1.00 0.00 H new ATOM 1566 N ASN B 2 -2.257 8.789 -9.838 1.00 0.00 N ATOM 1567 CA ASN B 2 -0.849 8.529 -9.440 1.00 0.00 C ATOM 1568 C ASN B 2 -0.298 9.698 -8.621 1.00 0.00 C ATOM 1569 O ASN B 2 -1.042 10.463 -8.040 1.00 0.00 O ATOM 1570 CB ASN B 2 -0.064 8.364 -10.749 1.00 0.00 C ATOM 1571 CG ASN B 2 -0.226 9.620 -11.608 1.00 0.00 C ATOM 1572 OD1 ASN B 2 -1.317 9.945 -12.029 1.00 0.00 O ATOM 1573 ND2 ASN B 2 0.823 10.346 -11.886 1.00 0.00 N ATOM 0 H ASN B 2 -2.639 9.677 -9.514 1.00 0.00 H new ATOM 0 HA ASN B 2 -0.768 7.640 -8.814 1.00 0.00 H new ATOM 0 HB2 ASN B 2 0.991 8.193 -10.533 1.00 0.00 H new ATOM 0 HB3 ASN B 2 -0.424 7.491 -11.293 1.00 0.00 H new ATOM 0 HD21 ASN B 2 0.725 11.186 -12.457 1.00 0.00 H new ATOM 0 HD22 ASN B 2 1.740 10.073 -11.532 1.00 0.00 H new ATOM 1580 N LYS B 3 1.004 9.845 -8.570 1.00 0.00 N ATOM 1581 CA LYS B 3 1.606 10.967 -7.787 1.00 0.00 C ATOM 1582 C LYS B 3 1.011 12.317 -8.223 1.00 0.00 C ATOM 1583 O LYS B 3 1.204 13.322 -7.571 1.00 0.00 O ATOM 1584 CB LYS B 3 3.110 10.912 -8.092 1.00 0.00 C ATOM 1585 CG LYS B 3 3.821 10.057 -7.032 1.00 0.00 C ATOM 1586 CD LYS B 3 5.187 10.678 -6.690 1.00 0.00 C ATOM 1587 CE LYS B 3 5.764 10.034 -5.415 1.00 0.00 C ATOM 1588 NZ LYS B 3 4.650 10.052 -4.422 1.00 0.00 N ATOM 0 H LYS B 3 1.675 9.236 -9.037 1.00 0.00 H new ATOM 0 HA LYS B 3 1.405 10.870 -6.720 1.00 0.00 H new ATOM 0 HB2 LYS B 3 3.275 10.491 -9.084 1.00 0.00 H new ATOM 0 HB3 LYS B 3 3.527 11.919 -8.100 1.00 0.00 H new ATOM 0 HG2 LYS B 3 3.207 9.990 -6.134 1.00 0.00 H new ATOM 0 HG3 LYS B 3 3.956 9.041 -7.402 1.00 0.00 H new ATOM 0 HD2 LYS B 3 5.877 10.536 -7.522 1.00 0.00 H new ATOM 0 HD3 LYS B 3 5.079 11.753 -6.546 1.00 0.00 H new ATOM 0 HE2 LYS B 3 6.102 9.016 -5.608 1.00 0.00 H new ATOM 0 HE3 LYS B 3 6.626 10.592 -5.049 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 5.036 10.211 -3.470 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 3.986 10.817 -4.659 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 4.150 9.140 -4.445 1.00 0.00 H new ATOM 1602 N THR B 4 0.284 12.348 -9.314 1.00 0.00 N ATOM 1603 CA THR B 4 -0.325 13.637 -9.769 1.00 0.00 C ATOM 1604 C THR B 4 -1.803 13.682 -9.383 1.00 0.00 C ATOM 1605 O THR B 4 -2.254 14.600 -8.726 1.00 0.00 O ATOM 1606 CB THR B 4 -0.161 13.643 -11.293 1.00 0.00 C ATOM 1607 OG1 THR B 4 1.205 13.865 -11.619 1.00 0.00 O ATOM 1608 CG2 THR B 4 -1.020 14.754 -11.906 1.00 0.00 C ATOM 0 H THR B 4 0.087 11.541 -9.906 1.00 0.00 H new ATOM 0 HA THR B 4 0.150 14.504 -9.311 1.00 0.00 H new ATOM 0 HB THR B 4 -0.482 12.681 -11.693 1.00 0.00 H new ATOM 0 HG1 THR B 4 1.313 13.868 -12.593 1.00 0.00 H new ATOM 0 HG21 THR B 4 -0.898 14.752 -12.989 1.00 0.00 H new ATOM 0 HG22 THR B 4 -2.068 14.583 -11.658 1.00 0.00 H new ATOM 0 HG23 THR B 4 -0.706 15.719 -11.507 1.00 0.00 H new ATOM 1616 N GLU B 5 -2.562 12.701 -9.782 1.00 0.00 N ATOM 1617 CA GLU B 5 -4.008 12.702 -9.424 1.00 0.00 C ATOM 1618 C GLU B 5 -4.151 12.596 -7.907 1.00 0.00 C ATOM 1619 O GLU B 5 -4.835 13.390 -7.290 1.00 0.00 O ATOM 1620 CB GLU B 5 -4.615 11.494 -10.129 1.00 0.00 C ATOM 1621 CG GLU B 5 -5.236 11.936 -11.456 1.00 0.00 C ATOM 1622 CD GLU B 5 -4.129 12.180 -12.482 1.00 0.00 C ATOM 1623 OE1 GLU B 5 -3.477 11.220 -12.861 1.00 0.00 O ATOM 1624 OE2 GLU B 5 -3.950 13.322 -12.873 1.00 0.00 O ATOM 0 H GLU B 5 -2.248 11.904 -10.336 1.00 0.00 H new ATOM 0 HA GLU B 5 -4.516 13.616 -9.732 1.00 0.00 H new ATOM 0 HB2 GLU B 5 -3.848 10.740 -10.307 1.00 0.00 H new ATOM 0 HB3 GLU B 5 -5.373 11.033 -9.496 1.00 0.00 H new ATOM 0 HG2 GLU B 5 -5.922 11.172 -11.821 1.00 0.00 H new ATOM 0 HG3 GLU B 5 -5.819 12.845 -11.312 1.00 0.00 H new ATOM 1631 N LEU B 6 -3.486 11.647 -7.288 1.00 0.00 N ATOM 1632 CA LEU B 6 -3.574 11.545 -5.797 1.00 0.00 C ATOM 1633 C LEU B 6 -3.202 12.901 -5.203 1.00 0.00 C ATOM 1634 O LEU B 6 -3.864 13.419 -4.318 1.00 0.00 O ATOM 1635 CB LEU B 6 -2.557 10.479 -5.388 1.00 0.00 C ATOM 1636 CG LEU B 6 -3.144 9.087 -5.623 1.00 0.00 C ATOM 1637 CD1 LEU B 6 -2.041 8.038 -5.462 1.00 0.00 C ATOM 1638 CD2 LEU B 6 -4.252 8.823 -4.600 1.00 0.00 C ATOM 0 H LEU B 6 -2.896 10.950 -7.743 1.00 0.00 H new ATOM 0 HA LEU B 6 -4.571 11.278 -5.447 1.00 0.00 H new ATOM 0 HB2 LEU B 6 -1.639 10.599 -5.964 1.00 0.00 H new ATOM 0 HB3 LEU B 6 -2.292 10.600 -4.338 1.00 0.00 H new ATOM 0 HG LEU B 6 -3.558 9.030 -6.630 1.00 0.00 H new ATOM 0 HD11 LEU B 6 -2.457 7.044 -5.629 1.00 0.00 H new ATOM 0 HD12 LEU B 6 -1.250 8.227 -6.188 1.00 0.00 H new ATOM 0 HD13 LEU B 6 -1.630 8.094 -4.454 1.00 0.00 H new ATOM 0 HD21 LEU B 6 -4.672 7.831 -4.766 1.00 0.00 H new ATOM 0 HD22 LEU B 6 -3.838 8.878 -3.593 1.00 0.00 H new ATOM 0 HD23 LEU B 6 -5.036 9.572 -4.711 1.00 0.00 H new ATOM 1650 N ILE B 7 -2.167 13.505 -5.732 1.00 0.00 N ATOM 1651 CA ILE B 7 -1.773 14.858 -5.257 1.00 0.00 C ATOM 1652 C ILE B 7 -3.035 15.709 -5.285 1.00 0.00 C ATOM 1653 O ILE B 7 -3.438 16.299 -4.303 1.00 0.00 O ATOM 1654 CB ILE B 7 -0.733 15.340 -6.286 1.00 0.00 C ATOM 1655 CG1 ILE B 7 0.667 15.210 -5.687 1.00 0.00 C ATOM 1656 CG2 ILE B 7 -0.996 16.800 -6.668 1.00 0.00 C ATOM 1657 CD1 ILE B 7 1.702 15.834 -6.629 1.00 0.00 C ATOM 0 H ILE B 7 -1.581 13.117 -6.471 1.00 0.00 H new ATOM 0 HA ILE B 7 -1.354 14.896 -4.251 1.00 0.00 H new ATOM 0 HB ILE B 7 -0.810 14.726 -7.183 1.00 0.00 H new ATOM 0 HG12 ILE B 7 0.703 15.704 -4.716 1.00 0.00 H new ATOM 0 HG13 ILE B 7 0.903 14.159 -5.519 1.00 0.00 H new ATOM 0 HG21 ILE B 7 -0.253 17.125 -7.396 1.00 0.00 H new ATOM 0 HG22 ILE B 7 -1.992 16.889 -7.102 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -0.931 17.426 -5.778 1.00 0.00 H new ATOM 0 HD11 ILE B 7 2.696 15.736 -6.193 1.00 0.00 H new ATOM 0 HD12 ILE B 7 1.675 15.321 -7.590 1.00 0.00 H new ATOM 0 HD13 ILE B 7 1.472 16.889 -6.775 1.00 0.00 H new ATOM 1669 N LYS B 8 -3.680 15.711 -6.412 1.00 0.00 N ATOM 1670 CA LYS B 8 -4.954 16.444 -6.564 1.00 0.00 C ATOM 1671 C LYS B 8 -5.938 15.954 -5.511 1.00 0.00 C ATOM 1672 O LYS B 8 -6.669 16.725 -4.931 1.00 0.00 O ATOM 1673 CB LYS B 8 -5.441 16.046 -7.954 1.00 0.00 C ATOM 1674 CG LYS B 8 -6.008 17.259 -8.686 1.00 0.00 C ATOM 1675 CD LYS B 8 -7.218 16.838 -9.536 1.00 0.00 C ATOM 1676 CE LYS B 8 -7.033 15.402 -10.054 1.00 0.00 C ATOM 1677 NZ LYS B 8 -7.760 15.364 -11.354 1.00 0.00 N ATOM 0 H LYS B 8 -3.368 15.223 -7.252 1.00 0.00 H new ATOM 0 HA LYS B 8 -4.851 17.523 -6.448 1.00 0.00 H new ATOM 0 HB2 LYS B 8 -4.617 15.620 -8.527 1.00 0.00 H new ATOM 0 HB3 LYS B 8 -6.205 15.273 -7.871 1.00 0.00 H new ATOM 0 HG2 LYS B 8 -6.305 18.022 -7.967 1.00 0.00 H new ATOM 0 HG3 LYS B 8 -5.242 17.702 -9.322 1.00 0.00 H new ATOM 0 HD2 LYS B 8 -8.129 16.903 -8.941 1.00 0.00 H new ATOM 0 HD3 LYS B 8 -7.337 17.522 -10.376 1.00 0.00 H new ATOM 0 HE2 LYS B 8 -5.978 15.163 -10.185 1.00 0.00 H new ATOM 0 HE3 LYS B 8 -7.440 14.674 -9.353 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 -7.679 14.414 -11.769 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 -8.763 15.589 -11.197 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 -7.346 16.062 -12.004 1.00 0.00 H new ATOM 1691 N ALA B 9 -5.955 14.666 -5.253 1.00 0.00 N ATOM 1692 CA ALA B 9 -6.891 14.128 -4.225 1.00 0.00 C ATOM 1693 C ALA B 9 -6.763 14.950 -2.954 1.00 0.00 C ATOM 1694 O ALA B 9 -7.740 15.251 -2.300 1.00 0.00 O ATOM 1695 CB ALA B 9 -6.440 12.695 -3.982 1.00 0.00 C ATOM 0 H ALA B 9 -5.363 13.972 -5.709 1.00 0.00 H new ATOM 0 HA ALA B 9 -7.933 14.169 -4.542 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -7.084 12.233 -3.234 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -6.502 12.131 -4.913 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -5.410 12.693 -3.625 1.00 0.00 H new ATOM 1701 N ILE B 10 -5.567 15.354 -2.617 1.00 0.00 N ATOM 1702 CA ILE B 10 -5.400 16.190 -1.418 1.00 0.00 C ATOM 1703 C ILE B 10 -5.434 17.637 -1.876 1.00 0.00 C ATOM 1704 O ILE B 10 -5.911 18.515 -1.195 1.00 0.00 O ATOM 1705 CB ILE B 10 -4.029 15.797 -0.843 1.00 0.00 C ATOM 1706 CG1 ILE B 10 -4.214 14.734 0.243 1.00 0.00 C ATOM 1707 CG2 ILE B 10 -3.325 17.017 -0.240 1.00 0.00 C ATOM 1708 CD1 ILE B 10 -4.823 13.472 -0.373 1.00 0.00 C ATOM 0 H ILE B 10 -4.709 15.137 -3.124 1.00 0.00 H new ATOM 0 HA ILE B 10 -6.172 16.058 -0.660 1.00 0.00 H new ATOM 0 HB ILE B 10 -3.415 15.400 -1.652 1.00 0.00 H new ATOM 0 HG12 ILE B 10 -3.254 14.499 0.704 1.00 0.00 H new ATOM 0 HG13 ILE B 10 -4.862 15.115 1.032 1.00 0.00 H new ATOM 0 HG21 ILE B 10 -2.357 16.717 0.161 1.00 0.00 H new ATOM 0 HG22 ILE B 10 -3.179 17.772 -1.013 1.00 0.00 H new ATOM 0 HG23 ILE B 10 -3.937 17.431 0.561 1.00 0.00 H new ATOM 0 HD11 ILE B 10 -4.954 12.716 0.401 1.00 0.00 H new ATOM 0 HD12 ILE B 10 -5.791 13.712 -0.813 1.00 0.00 H new ATOM 0 HD13 ILE B 10 -4.158 13.088 -1.147 1.00 0.00 H new ATOM 1720 N ALA B 11 -4.966 17.894 -3.051 1.00 0.00 N ATOM 1721 CA ALA B 11 -5.019 19.286 -3.538 1.00 0.00 C ATOM 1722 C ALA B 11 -6.485 19.677 -3.777 1.00 0.00 C ATOM 1723 O ALA B 11 -6.801 20.825 -4.022 1.00 0.00 O ATOM 1724 CB ALA B 11 -4.218 19.272 -4.838 1.00 0.00 C ATOM 0 H ALA B 11 -4.554 17.213 -3.689 1.00 0.00 H new ATOM 0 HA ALA B 11 -4.610 20.011 -2.835 1.00 0.00 H new ATOM 0 HB1 ALA B 11 -4.207 20.273 -5.269 1.00 0.00 H new ATOM 0 HB2 ALA B 11 -3.196 18.954 -4.632 1.00 0.00 H new ATOM 0 HB3 ALA B 11 -4.679 18.579 -5.542 1.00 0.00 H new ATOM 1730 N GLN B 12 -7.386 18.722 -3.692 1.00 0.00 N ATOM 1731 CA GLN B 12 -8.829 19.024 -3.895 1.00 0.00 C ATOM 1732 C GLN B 12 -9.615 18.663 -2.629 1.00 0.00 C ATOM 1733 O GLN B 12 -10.457 19.421 -2.189 1.00 0.00 O ATOM 1734 CB GLN B 12 -9.248 18.173 -5.108 1.00 0.00 C ATOM 1735 CG GLN B 12 -10.717 17.746 -5.000 1.00 0.00 C ATOM 1736 CD GLN B 12 -11.376 17.829 -6.379 1.00 0.00 C ATOM 1737 OE1 GLN B 12 -11.046 18.689 -7.172 1.00 0.00 O ATOM 1738 NE2 GLN B 12 -12.301 16.966 -6.701 1.00 0.00 N ATOM 0 H GLN B 12 -7.175 17.745 -3.490 1.00 0.00 H new ATOM 0 HA GLN B 12 -9.026 20.080 -4.081 1.00 0.00 H new ATOM 0 HB2 GLN B 12 -9.098 18.742 -6.025 1.00 0.00 H new ATOM 0 HB3 GLN B 12 -8.613 17.290 -5.174 1.00 0.00 H new ATOM 0 HG2 GLN B 12 -10.784 16.729 -4.614 1.00 0.00 H new ATOM 0 HG3 GLN B 12 -11.243 18.390 -4.295 1.00 0.00 H new ATOM 0 HE21 GLN B 12 -12.579 16.244 -6.036 1.00 0.00 H new ATOM 0 HE22 GLN B 12 -12.746 17.014 -7.617 1.00 0.00 H new ATOM 1747 N ASP B 13 -9.322 17.549 -2.004 1.00 0.00 N ATOM 1748 CA ASP B 13 -10.045 17.227 -0.738 1.00 0.00 C ATOM 1749 C ASP B 13 -9.535 18.214 0.294 1.00 0.00 C ATOM 1750 O ASP B 13 -10.252 18.715 1.139 1.00 0.00 O ATOM 1751 CB ASP B 13 -9.638 15.805 -0.365 1.00 0.00 C ATOM 1752 CG ASP B 13 -10.243 14.817 -1.364 1.00 0.00 C ATOM 1753 OD1 ASP B 13 -10.262 15.134 -2.542 1.00 0.00 O ATOM 1754 OD2 ASP B 13 -10.677 13.762 -0.934 1.00 0.00 O ATOM 0 H ASP B 13 -8.630 16.864 -2.307 1.00 0.00 H new ATOM 0 HA ASP B 13 -11.130 17.293 -0.815 1.00 0.00 H new ATOM 0 HB2 ASP B 13 -8.552 15.716 -0.363 1.00 0.00 H new ATOM 0 HB3 ASP B 13 -9.979 15.572 0.644 1.00 0.00 H new ATOM 1759 N THR B 14 -8.281 18.518 0.167 1.00 0.00 N ATOM 1760 CA THR B 14 -7.619 19.498 1.042 1.00 0.00 C ATOM 1761 C THR B 14 -7.628 20.835 0.286 1.00 0.00 C ATOM 1762 O THR B 14 -8.473 21.679 0.514 1.00 0.00 O ATOM 1763 CB THR B 14 -6.208 18.920 1.210 1.00 0.00 C ATOM 1764 OG1 THR B 14 -6.165 17.619 0.649 1.00 0.00 O ATOM 1765 CG2 THR B 14 -5.863 18.791 2.671 1.00 0.00 C ATOM 0 H THR B 14 -7.668 18.107 -0.538 1.00 0.00 H new ATOM 0 HA THR B 14 -8.081 19.670 2.014 1.00 0.00 H new ATOM 0 HB THR B 14 -5.504 19.588 0.715 1.00 0.00 H new ATOM 0 HG1 THR B 14 -6.549 16.977 1.282 1.00 0.00 H new ATOM 0 HG21 THR B 14 -4.859 18.379 2.773 1.00 0.00 H new ATOM 0 HG22 THR B 14 -5.902 19.773 3.142 1.00 0.00 H new ATOM 0 HG23 THR B 14 -6.578 18.127 3.156 1.00 0.00 H new ATOM 1773 N GLY B 15 -6.726 21.011 -0.651 1.00 0.00 N ATOM 1774 CA GLY B 15 -6.698 22.266 -1.475 1.00 0.00 C ATOM 1775 C GLY B 15 -6.684 23.522 -0.598 1.00 0.00 C ATOM 1776 O GLY B 15 -6.741 24.630 -1.094 1.00 0.00 O ATOM 0 H GLY B 15 -6.000 20.333 -0.883 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -5.816 22.260 -2.116 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -7.569 22.290 -2.130 1.00 0.00 H new ATOM 1780 N LEU B 16 -6.597 23.366 0.688 1.00 0.00 N ATOM 1781 CA LEU B 16 -6.569 24.567 1.586 1.00 0.00 C ATOM 1782 C LEU B 16 -5.350 25.427 1.271 1.00 0.00 C ATOM 1783 O LEU B 16 -5.322 26.612 1.541 1.00 0.00 O ATOM 1784 CB LEU B 16 -6.493 24.032 3.008 1.00 0.00 C ATOM 1785 CG LEU B 16 -5.344 23.056 3.061 1.00 0.00 C ATOM 1786 CD1 LEU B 16 -4.262 23.562 4.011 1.00 0.00 C ATOM 1787 CD2 LEU B 16 -5.847 21.695 3.523 1.00 0.00 C ATOM 0 H LEU B 16 -6.544 22.465 1.164 1.00 0.00 H new ATOM 0 HA LEU B 16 -7.451 25.192 1.448 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -6.339 24.846 3.717 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -7.426 23.542 3.284 1.00 0.00 H new ATOM 0 HG LEU B 16 -4.915 22.961 2.063 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -3.439 22.848 4.039 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -3.893 24.526 3.662 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -4.680 23.674 5.012 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -5.014 20.993 3.560 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -6.288 21.788 4.516 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -6.600 21.329 2.825 1.00 0.00 H new ATOM 1799 N THR B 17 -4.344 24.832 0.706 1.00 0.00 N ATOM 1800 CA THR B 17 -3.115 25.593 0.369 1.00 0.00 C ATOM 1801 C THR B 17 -2.303 24.854 -0.698 1.00 0.00 C ATOM 1802 O THR B 17 -1.332 25.379 -1.209 1.00 0.00 O ATOM 1803 CB THR B 17 -2.346 25.672 1.695 1.00 0.00 C ATOM 1804 OG1 THR B 17 -1.880 26.999 1.893 1.00 0.00 O ATOM 1805 CG2 THR B 17 -1.153 24.709 1.682 1.00 0.00 C ATOM 0 H THR B 17 -4.319 23.842 0.461 1.00 0.00 H new ATOM 0 HA THR B 17 -3.328 26.580 -0.043 1.00 0.00 H new ATOM 0 HB THR B 17 -3.016 25.390 2.507 1.00 0.00 H new ATOM 0 HG1 THR B 17 -1.390 27.051 2.740 1.00 0.00 H new ATOM 0 HG21 THR B 17 -0.619 24.778 2.630 1.00 0.00 H new ATOM 0 HG22 THR B 17 -1.510 23.689 1.540 1.00 0.00 H new ATOM 0 HG23 THR B 17 -0.480 24.974 0.866 1.00 0.00 H new ATOM 1813 N GLN B 18 -2.652 23.626 -1.011 1.00 0.00 N ATOM 1814 CA GLN B 18 -1.841 22.867 -2.005 1.00 0.00 C ATOM 1815 C GLN B 18 -0.413 22.878 -1.511 1.00 0.00 C ATOM 1816 O GLN B 18 0.525 22.962 -2.276 1.00 0.00 O ATOM 1817 CB GLN B 18 -1.978 23.617 -3.333 1.00 0.00 C ATOM 1818 CG GLN B 18 -3.443 23.990 -3.551 1.00 0.00 C ATOM 1819 CD GLN B 18 -3.683 24.289 -5.033 1.00 0.00 C ATOM 1820 OE1 GLN B 18 -4.685 23.888 -5.591 1.00 0.00 O ATOM 1821 NE2 GLN B 18 -2.798 24.980 -5.697 1.00 0.00 N ATOM 0 H GLN B 18 -3.453 23.127 -0.624 1.00 0.00 H new ATOM 0 HA GLN B 18 -2.161 21.833 -2.135 1.00 0.00 H new ATOM 0 HB2 GLN B 18 -1.360 24.515 -3.323 1.00 0.00 H new ATOM 0 HB3 GLN B 18 -1.623 22.994 -4.154 1.00 0.00 H new ATOM 0 HG2 GLN B 18 -4.089 23.174 -3.225 1.00 0.00 H new ATOM 0 HG3 GLN B 18 -3.700 24.861 -2.948 1.00 0.00 H new ATOM 0 HE21 GLN B 18 -1.957 25.316 -5.228 1.00 0.00 H new ATOM 0 HE22 GLN B 18 -2.947 25.184 -6.685 1.00 0.00 H new ATOM 1830 N VAL B 19 -0.276 22.807 -0.206 1.00 0.00 N ATOM 1831 CA VAL B 19 1.063 22.821 0.452 1.00 0.00 C ATOM 1832 C VAL B 19 2.149 22.661 -0.615 1.00 0.00 C ATOM 1833 O VAL B 19 2.558 23.621 -1.240 1.00 0.00 O ATOM 1834 CB VAL B 19 1.000 21.666 1.500 1.00 0.00 C ATOM 1835 CG1 VAL B 19 0.132 20.506 1.002 1.00 0.00 C ATOM 1836 CG2 VAL B 19 2.387 21.122 1.843 1.00 0.00 C ATOM 0 H VAL B 19 -1.060 22.738 0.443 1.00 0.00 H new ATOM 0 HA VAL B 19 1.312 23.752 0.961 1.00 0.00 H new ATOM 0 HB VAL B 19 0.557 22.099 2.397 1.00 0.00 H new ATOM 0 HG11 VAL B 19 0.109 19.719 1.756 1.00 0.00 H new ATOM 0 HG12 VAL B 19 -0.882 20.862 0.819 1.00 0.00 H new ATOM 0 HG13 VAL B 19 0.550 20.110 0.076 1.00 0.00 H new ATOM 0 HG21 VAL B 19 2.293 20.321 2.576 1.00 0.00 H new ATOM 0 HG22 VAL B 19 2.859 20.735 0.940 1.00 0.00 H new ATOM 0 HG23 VAL B 19 2.999 21.923 2.258 1.00 0.00 H new ATOM 1846 N SER B 20 2.565 21.476 -0.870 1.00 0.00 N ATOM 1847 CA SER B 20 3.549 21.234 -1.932 1.00 0.00 C ATOM 1848 C SER B 20 3.058 20.042 -2.715 1.00 0.00 C ATOM 1849 O SER B 20 3.841 19.328 -3.281 1.00 0.00 O ATOM 1850 CB SER B 20 4.872 20.946 -1.248 1.00 0.00 C ATOM 1851 OG SER B 20 4.969 19.558 -0.989 1.00 0.00 O ATOM 0 H SER B 20 2.257 20.639 -0.374 1.00 0.00 H new ATOM 0 HA SER B 20 3.677 22.078 -2.610 1.00 0.00 H new ATOM 0 HB2 SER B 20 5.700 21.269 -1.880 1.00 0.00 H new ATOM 0 HB3 SER B 20 4.944 21.508 -0.317 1.00 0.00 H new ATOM 0 HG SER B 20 4.232 19.282 -0.405 1.00 0.00 H new ATOM 1857 N VAL B 21 1.764 19.792 -2.695 1.00 0.00 N ATOM 1858 CA VAL B 21 1.158 18.616 -3.388 1.00 0.00 C ATOM 1859 C VAL B 21 2.204 17.853 -4.178 1.00 0.00 C ATOM 1860 O VAL B 21 2.275 16.640 -4.168 1.00 0.00 O ATOM 1861 CB VAL B 21 0.108 19.217 -4.322 1.00 0.00 C ATOM 1862 CG1 VAL B 21 -0.999 19.877 -3.495 1.00 0.00 C ATOM 1863 CG2 VAL B 21 0.753 20.265 -5.238 1.00 0.00 C ATOM 0 H VAL B 21 1.086 20.379 -2.208 1.00 0.00 H new ATOM 0 HA VAL B 21 0.728 17.903 -2.685 1.00 0.00 H new ATOM 0 HB VAL B 21 -0.317 18.421 -4.934 1.00 0.00 H new ATOM 0 HG11 VAL B 21 -1.746 20.305 -4.163 1.00 0.00 H new ATOM 0 HG12 VAL B 21 -1.469 19.130 -2.855 1.00 0.00 H new ATOM 0 HG13 VAL B 21 -0.570 20.666 -2.877 1.00 0.00 H new ATOM 0 HG21 VAL B 21 -0.005 20.686 -5.899 1.00 0.00 H new ATOM 0 HG22 VAL B 21 1.188 21.060 -4.632 1.00 0.00 H new ATOM 0 HG23 VAL B 21 1.534 19.795 -5.835 1.00 0.00 H new ATOM 1873 N SER B 22 3.040 18.585 -4.816 1.00 0.00 N ATOM 1874 CA SER B 22 4.132 17.957 -5.617 1.00 0.00 C ATOM 1875 C SER B 22 5.251 17.455 -4.707 1.00 0.00 C ATOM 1876 O SER B 22 5.837 16.421 -4.951 1.00 0.00 O ATOM 1877 CB SER B 22 4.639 19.064 -6.542 1.00 0.00 C ATOM 1878 OG SER B 22 4.228 18.786 -7.874 1.00 0.00 O ATOM 0 H SER B 22 3.027 19.605 -4.827 1.00 0.00 H new ATOM 0 HA SER B 22 3.779 17.091 -6.177 1.00 0.00 H new ATOM 0 HB2 SER B 22 4.247 20.029 -6.222 1.00 0.00 H new ATOM 0 HB3 SER B 22 5.726 19.128 -6.490 1.00 0.00 H new ATOM 0 HG SER B 22 4.550 19.494 -8.470 1.00 0.00 H new ATOM 1884 N LYS B 23 5.551 18.172 -3.665 1.00 0.00 N ATOM 1885 CA LYS B 23 6.628 17.733 -2.750 1.00 0.00 C ATOM 1886 C LYS B 23 6.070 16.837 -1.645 1.00 0.00 C ATOM 1887 O LYS B 23 6.755 15.946 -1.184 1.00 0.00 O ATOM 1888 CB LYS B 23 7.208 19.018 -2.172 1.00 0.00 C ATOM 1889 CG LYS B 23 8.610 19.255 -2.734 1.00 0.00 C ATOM 1890 CD LYS B 23 9.210 20.523 -2.112 1.00 0.00 C ATOM 1891 CE LYS B 23 8.162 21.644 -2.101 1.00 0.00 C ATOM 1892 NZ LYS B 23 8.943 22.906 -2.225 1.00 0.00 N ATOM 0 H LYS B 23 5.093 19.047 -3.409 1.00 0.00 H new ATOM 0 HA LYS B 23 7.386 17.144 -3.265 1.00 0.00 H new ATOM 0 HB2 LYS B 23 6.562 19.861 -2.416 1.00 0.00 H new ATOM 0 HB3 LYS B 23 7.249 18.952 -1.085 1.00 0.00 H new ATOM 0 HG2 LYS B 23 9.248 18.397 -2.520 1.00 0.00 H new ATOM 0 HG3 LYS B 23 8.565 19.357 -3.818 1.00 0.00 H new ATOM 0 HD2 LYS B 23 9.545 20.317 -1.096 1.00 0.00 H new ATOM 0 HD3 LYS B 23 10.086 20.838 -2.679 1.00 0.00 H new ATOM 0 HE2 LYS B 23 7.458 21.533 -2.926 1.00 0.00 H new ATOM 0 HE3 LYS B 23 7.579 21.630 -1.180 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 8.293 23.718 -2.225 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 9.600 22.988 -1.423 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 9.482 22.895 -3.114 1.00 0.00 H new ATOM 1906 N MET B 24 4.841 17.027 -1.208 1.00 0.00 N ATOM 1907 CA MET B 24 4.348 16.110 -0.140 1.00 0.00 C ATOM 1908 C MET B 24 4.183 14.709 -0.732 1.00 0.00 C ATOM 1909 O MET B 24 4.538 13.732 -0.099 1.00 0.00 O ATOM 1910 CB MET B 24 3.024 16.641 0.464 1.00 0.00 C ATOM 1911 CG MET B 24 2.337 17.703 -0.401 1.00 0.00 C ATOM 1912 SD MET B 24 0.582 17.311 -0.484 1.00 0.00 S ATOM 1913 CE MET B 24 0.828 15.848 -1.506 1.00 0.00 C ATOM 0 H MET B 24 4.190 17.743 -1.530 1.00 0.00 H new ATOM 0 HA MET B 24 5.070 16.062 0.675 1.00 0.00 H new ATOM 0 HB2 MET B 24 2.340 15.805 0.610 1.00 0.00 H new ATOM 0 HB3 MET B 24 3.227 17.062 1.449 1.00 0.00 H new ATOM 0 HG2 MET B 24 2.485 18.695 0.026 1.00 0.00 H new ATOM 0 HG3 MET B 24 2.771 17.718 -1.401 1.00 0.00 H new ATOM 0 HE1 MET B 24 0.121 15.861 -2.336 1.00 0.00 H new ATOM 0 HE2 MET B 24 1.846 15.844 -1.896 1.00 0.00 H new ATOM 0 HE3 MET B 24 0.666 14.953 -0.905 1.00 0.00 H new ATOM 1923 N LEU B 25 3.697 14.576 -1.950 1.00 0.00 N ATOM 1924 CA LEU B 25 3.599 13.204 -2.521 1.00 0.00 C ATOM 1925 C LEU B 25 4.993 12.765 -2.965 1.00 0.00 C ATOM 1926 O LEU B 25 5.427 11.669 -2.673 1.00 0.00 O ATOM 1927 CB LEU B 25 2.640 13.295 -3.707 1.00 0.00 C ATOM 1928 CG LEU B 25 1.172 13.320 -3.233 1.00 0.00 C ATOM 1929 CD1 LEU B 25 0.342 12.365 -4.099 1.00 0.00 C ATOM 1930 CD2 LEU B 25 1.040 12.880 -1.766 1.00 0.00 C ATOM 0 H LEU B 25 3.376 15.336 -2.550 1.00 0.00 H new ATOM 0 HA LEU B 25 3.230 12.474 -1.801 1.00 0.00 H new ATOM 0 HB2 LEU B 25 2.855 14.195 -4.284 1.00 0.00 H new ATOM 0 HB3 LEU B 25 2.797 12.445 -4.371 1.00 0.00 H new ATOM 0 HG LEU B 25 0.813 14.345 -3.324 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -0.696 12.381 -3.766 1.00 0.00 H new ATOM 0 HD12 LEU B 25 0.394 12.681 -5.141 1.00 0.00 H new ATOM 0 HD13 LEU B 25 0.737 11.353 -4.007 1.00 0.00 H new ATOM 0 HD21 LEU B 25 -0.009 12.911 -1.470 1.00 0.00 H new ATOM 0 HD22 LEU B 25 1.418 11.864 -1.655 1.00 0.00 H new ATOM 0 HD23 LEU B 25 1.616 13.553 -1.131 1.00 0.00 H new ATOM 1942 N ALA B 26 5.719 13.626 -3.635 1.00 0.00 N ATOM 1943 CA ALA B 26 7.104 13.253 -4.049 1.00 0.00 C ATOM 1944 C ALA B 26 7.876 12.833 -2.801 1.00 0.00 C ATOM 1945 O ALA B 26 8.694 11.932 -2.827 1.00 0.00 O ATOM 1946 CB ALA B 26 7.706 14.520 -4.657 1.00 0.00 C ATOM 0 H ALA B 26 5.416 14.560 -3.910 1.00 0.00 H new ATOM 0 HA ALA B 26 7.133 12.430 -4.763 1.00 0.00 H new ATOM 0 HB1 ALA B 26 8.726 14.318 -4.984 1.00 0.00 H new ATOM 0 HB2 ALA B 26 7.107 14.834 -5.512 1.00 0.00 H new ATOM 0 HB3 ALA B 26 7.715 15.313 -3.910 1.00 0.00 H new ATOM 1952 N SER B 27 7.585 13.465 -1.694 1.00 0.00 N ATOM 1953 CA SER B 27 8.260 13.097 -0.423 1.00 0.00 C ATOM 1954 C SER B 27 7.560 11.874 0.161 1.00 0.00 C ATOM 1955 O SER B 27 8.184 11.006 0.728 1.00 0.00 O ATOM 1956 CB SER B 27 8.094 14.303 0.498 1.00 0.00 C ATOM 1957 OG SER B 27 6.717 14.480 0.798 1.00 0.00 O ATOM 0 H SER B 27 6.906 14.222 -1.619 1.00 0.00 H new ATOM 0 HA SER B 27 9.314 12.854 -0.558 1.00 0.00 H new ATOM 0 HB2 SER B 27 8.662 14.154 1.417 1.00 0.00 H new ATOM 0 HB3 SER B 27 8.491 15.198 0.019 1.00 0.00 H new ATOM 0 HG SER B 27 6.173 14.073 0.092 1.00 0.00 H new ATOM 1963 N PHE B 28 6.263 11.794 -0.006 1.00 0.00 N ATOM 1964 CA PHE B 28 5.501 10.615 0.507 1.00 0.00 C ATOM 1965 C PHE B 28 6.147 9.358 -0.033 1.00 0.00 C ATOM 1966 O PHE B 28 6.473 8.458 0.703 1.00 0.00 O ATOM 1967 CB PHE B 28 4.083 10.810 -0.041 1.00 0.00 C ATOM 1968 CG PHE B 28 3.337 9.497 -0.189 1.00 0.00 C ATOM 1969 CD1 PHE B 28 3.562 8.670 -1.301 1.00 0.00 C ATOM 1970 CD2 PHE B 28 2.376 9.134 0.760 1.00 0.00 C ATOM 1971 CE1 PHE B 28 2.827 7.497 -1.456 1.00 0.00 C ATOM 1972 CE2 PHE B 28 1.648 7.956 0.607 1.00 0.00 C ATOM 1973 CZ PHE B 28 1.868 7.136 -0.504 1.00 0.00 C ATOM 0 H PHE B 28 5.697 12.499 -0.478 1.00 0.00 H new ATOM 0 HA PHE B 28 5.489 10.527 1.593 1.00 0.00 H new ATOM 0 HB2 PHE B 28 3.526 11.469 0.625 1.00 0.00 H new ATOM 0 HB3 PHE B 28 4.135 11.307 -1.010 1.00 0.00 H new ATOM 0 HD1 PHE B 28 4.305 8.943 -2.036 1.00 0.00 H new ATOM 0 HD2 PHE B 28 2.197 9.769 1.615 1.00 0.00 H new ATOM 0 HE1 PHE B 28 2.998 6.864 -2.314 1.00 0.00 H new ATOM 0 HE2 PHE B 28 0.913 7.676 1.347 1.00 0.00 H new ATOM 0 HZ PHE B 28 1.299 6.226 -0.627 1.00 0.00 H new ATOM 1983 N GLU B 29 6.394 9.307 -1.299 1.00 0.00 N ATOM 1984 CA GLU B 29 7.078 8.120 -1.830 1.00 0.00 C ATOM 1985 C GLU B 29 8.489 8.131 -1.276 1.00 0.00 C ATOM 1986 O GLU B 29 9.061 7.110 -0.957 1.00 0.00 O ATOM 1987 CB GLU B 29 7.095 8.280 -3.335 1.00 0.00 C ATOM 1988 CG GLU B 29 7.710 7.026 -3.924 1.00 0.00 C ATOM 1989 CD GLU B 29 9.034 7.366 -4.613 1.00 0.00 C ATOM 1990 OE1 GLU B 29 9.821 8.085 -4.020 1.00 0.00 O ATOM 1991 OE2 GLU B 29 9.239 6.900 -5.722 1.00 0.00 O ATOM 0 H GLU B 29 6.155 10.027 -1.981 1.00 0.00 H new ATOM 0 HA GLU B 29 6.593 7.183 -1.558 1.00 0.00 H new ATOM 0 HB2 GLU B 29 6.084 8.425 -3.716 1.00 0.00 H new ATOM 0 HB3 GLU B 29 7.673 9.159 -3.620 1.00 0.00 H new ATOM 0 HG2 GLU B 29 7.878 6.290 -3.138 1.00 0.00 H new ATOM 0 HG3 GLU B 29 7.023 6.576 -4.640 1.00 0.00 H new ATOM 1998 N LYS B 30 9.036 9.304 -1.124 1.00 0.00 N ATOM 1999 CA LYS B 30 10.391 9.405 -0.550 1.00 0.00 C ATOM 2000 C LYS B 30 10.344 8.904 0.885 1.00 0.00 C ATOM 2001 O LYS B 30 11.320 8.490 1.425 1.00 0.00 O ATOM 2002 CB LYS B 30 10.767 10.883 -0.594 1.00 0.00 C ATOM 2003 CG LYS B 30 12.280 11.011 -0.418 1.00 0.00 C ATOM 2004 CD LYS B 30 12.708 12.457 -0.679 1.00 0.00 C ATOM 2005 CE LYS B 30 14.236 12.538 -0.721 1.00 0.00 C ATOM 2006 NZ LYS B 30 14.666 12.436 0.702 1.00 0.00 N ATOM 0 H LYS B 30 8.599 10.191 -1.374 1.00 0.00 H new ATOM 0 HA LYS B 30 11.123 8.811 -1.097 1.00 0.00 H new ATOM 0 HB2 LYS B 30 10.459 11.323 -1.542 1.00 0.00 H new ATOM 0 HB3 LYS B 30 10.248 11.428 0.194 1.00 0.00 H new ATOM 0 HG2 LYS B 30 12.565 10.713 0.591 1.00 0.00 H new ATOM 0 HG3 LYS B 30 12.794 10.339 -1.106 1.00 0.00 H new ATOM 0 HD2 LYS B 30 12.289 12.807 -1.622 1.00 0.00 H new ATOM 0 HD3 LYS B 30 12.320 13.109 0.104 1.00 0.00 H new ATOM 0 HE2 LYS B 30 14.658 11.731 -1.320 1.00 0.00 H new ATOM 0 HE3 LYS B 30 14.570 13.474 -1.168 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 15.263 13.252 0.944 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 13.828 12.426 1.318 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 15.207 11.559 0.839 1.00 0.00 H new ATOM 2020 N ILE B 31 9.203 8.894 1.503 1.00 0.00 N ATOM 2021 CA ILE B 31 9.148 8.361 2.889 1.00 0.00 C ATOM 2022 C ILE B 31 8.493 6.992 2.868 1.00 0.00 C ATOM 2023 O ILE B 31 8.777 6.145 3.677 1.00 0.00 O ATOM 2024 CB ILE B 31 8.384 9.355 3.749 1.00 0.00 C ATOM 2025 CG1 ILE B 31 7.217 9.990 3.011 1.00 0.00 C ATOM 2026 CG2 ILE B 31 9.355 10.434 4.217 1.00 0.00 C ATOM 2027 CD1 ILE B 31 5.929 9.589 3.723 1.00 0.00 C ATOM 0 H ILE B 31 8.318 9.225 1.119 1.00 0.00 H new ATOM 0 HA ILE B 31 10.145 8.238 3.312 1.00 0.00 H new ATOM 0 HB ILE B 31 7.961 8.818 4.598 1.00 0.00 H new ATOM 0 HG12 ILE B 31 7.321 11.075 2.996 1.00 0.00 H new ATOM 0 HG13 ILE B 31 7.197 9.658 1.973 1.00 0.00 H new ATOM 0 HG21 ILE B 31 8.824 11.157 4.836 1.00 0.00 H new ATOM 0 HG22 ILE B 31 10.155 9.976 4.799 1.00 0.00 H new ATOM 0 HG23 ILE B 31 9.781 10.941 3.351 1.00 0.00 H new ATOM 0 HD11 ILE B 31 5.076 10.034 3.210 1.00 0.00 H new ATOM 0 HD12 ILE B 31 5.831 8.503 3.715 1.00 0.00 H new ATOM 0 HD13 ILE B 31 5.958 9.943 4.754 1.00 0.00 H new ATOM 2039 N ILE B 32 7.663 6.757 1.903 1.00 0.00 N ATOM 2040 CA ILE B 32 7.034 5.417 1.774 1.00 0.00 C ATOM 2041 C ILE B 32 8.077 4.469 1.235 1.00 0.00 C ATOM 2042 O ILE B 32 8.418 3.471 1.846 1.00 0.00 O ATOM 2043 CB ILE B 32 5.914 5.562 0.749 1.00 0.00 C ATOM 2044 CG1 ILE B 32 4.892 6.604 1.234 1.00 0.00 C ATOM 2045 CG2 ILE B 32 5.234 4.201 0.565 1.00 0.00 C ATOM 2046 CD1 ILE B 32 3.605 5.917 1.686 1.00 0.00 C ATOM 0 H ILE B 32 7.389 7.436 1.192 1.00 0.00 H new ATOM 0 HA ILE B 32 6.651 5.045 2.724 1.00 0.00 H new ATOM 0 HB ILE B 32 6.324 5.898 -0.203 1.00 0.00 H new ATOM 0 HG12 ILE B 32 5.313 7.180 2.058 1.00 0.00 H new ATOM 0 HG13 ILE B 32 4.673 7.309 0.432 1.00 0.00 H new ATOM 0 HG21 ILE B 32 4.431 4.292 -0.166 1.00 0.00 H new ATOM 0 HG22 ILE B 32 5.965 3.474 0.212 1.00 0.00 H new ATOM 0 HG23 ILE B 32 4.822 3.868 1.518 1.00 0.00 H new ATOM 0 HD11 ILE B 32 2.892 6.668 2.026 1.00 0.00 H new ATOM 0 HD12 ILE B 32 3.177 5.362 0.852 1.00 0.00 H new ATOM 0 HD13 ILE B 32 3.827 5.231 2.503 1.00 0.00 H new ATOM 2058 N THR B 33 8.601 4.792 0.092 1.00 0.00 N ATOM 2059 CA THR B 33 9.634 3.939 -0.501 1.00 0.00 C ATOM 2060 C THR B 33 10.910 4.073 0.337 1.00 0.00 C ATOM 2061 O THR B 33 11.643 3.119 0.524 1.00 0.00 O ATOM 2062 CB THR B 33 9.795 4.458 -1.941 1.00 0.00 C ATOM 2063 OG1 THR B 33 9.331 3.474 -2.848 1.00 0.00 O ATOM 2064 CG2 THR B 33 11.253 4.770 -2.245 1.00 0.00 C ATOM 0 H THR B 33 8.351 5.617 -0.453 1.00 0.00 H new ATOM 0 HA THR B 33 9.389 2.877 -0.518 1.00 0.00 H new ATOM 0 HB THR B 33 9.213 5.373 -2.047 1.00 0.00 H new ATOM 0 HG1 THR B 33 8.410 3.680 -3.112 1.00 0.00 H new ATOM 0 HG21 THR B 33 11.341 5.135 -3.268 1.00 0.00 H new ATOM 0 HG22 THR B 33 11.613 5.533 -1.555 1.00 0.00 H new ATOM 0 HG23 THR B 33 11.850 3.866 -2.130 1.00 0.00 H new ATOM 2072 N GLU B 34 11.177 5.249 0.857 1.00 0.00 N ATOM 2073 CA GLU B 34 12.394 5.417 1.682 1.00 0.00 C ATOM 2074 C GLU B 34 12.196 4.822 3.084 1.00 0.00 C ATOM 2075 O GLU B 34 13.132 4.302 3.652 1.00 0.00 O ATOM 2076 CB GLU B 34 12.608 6.916 1.732 1.00 0.00 C ATOM 2077 CG GLU B 34 12.946 7.410 0.308 1.00 0.00 C ATOM 2078 CD GLU B 34 14.295 6.833 -0.126 1.00 0.00 C ATOM 2079 OE1 GLU B 34 15.299 7.232 0.440 1.00 0.00 O ATOM 2080 OE2 GLU B 34 14.301 6.001 -1.019 1.00 0.00 O ATOM 0 H GLU B 34 10.605 6.086 0.742 1.00 0.00 H new ATOM 0 HA GLU B 34 13.257 4.896 1.268 1.00 0.00 H new ATOM 0 HB2 GLU B 34 11.713 7.414 2.103 1.00 0.00 H new ATOM 0 HB3 GLU B 34 13.417 7.160 2.420 1.00 0.00 H new ATOM 0 HG2 GLU B 34 12.166 7.104 -0.389 1.00 0.00 H new ATOM 0 HG3 GLU B 34 12.981 8.499 0.288 1.00 0.00 H new ATOM 2087 N THR B 35 11.000 4.853 3.654 1.00 0.00 N ATOM 2088 CA THR B 35 10.849 4.228 5.012 1.00 0.00 C ATOM 2089 C THR B 35 11.176 2.759 4.887 1.00 0.00 C ATOM 2090 O THR B 35 11.989 2.236 5.621 1.00 0.00 O ATOM 2091 CB THR B 35 9.399 4.392 5.467 1.00 0.00 C ATOM 2092 OG1 THR B 35 9.205 5.708 5.970 1.00 0.00 O ATOM 2093 CG2 THR B 35 9.122 3.372 6.578 1.00 0.00 C ATOM 0 H THR B 35 10.158 5.267 3.253 1.00 0.00 H new ATOM 0 HA THR B 35 11.513 4.700 5.736 1.00 0.00 H new ATOM 0 HB THR B 35 8.721 4.228 4.629 1.00 0.00 H new ATOM 0 HG1 THR B 35 9.213 6.347 5.227 1.00 0.00 H new ATOM 0 HG21 THR B 35 8.091 3.474 6.916 1.00 0.00 H new ATOM 0 HG22 THR B 35 9.280 2.364 6.194 1.00 0.00 H new ATOM 0 HG23 THR B 35 9.798 3.552 7.414 1.00 0.00 H new ATOM 2101 N VAL B 36 10.574 2.087 3.946 1.00 0.00 N ATOM 2102 CA VAL B 36 10.916 0.652 3.774 1.00 0.00 C ATOM 2103 C VAL B 36 12.434 0.570 3.611 1.00 0.00 C ATOM 2104 O VAL B 36 13.085 -0.331 4.100 1.00 0.00 O ATOM 2105 CB VAL B 36 10.179 0.206 2.506 1.00 0.00 C ATOM 2106 CG1 VAL B 36 11.155 -0.466 1.535 1.00 0.00 C ATOM 2107 CG2 VAL B 36 9.080 -0.780 2.894 1.00 0.00 C ATOM 0 H VAL B 36 9.876 2.460 3.303 1.00 0.00 H new ATOM 0 HA VAL B 36 10.628 0.016 4.611 1.00 0.00 H new ATOM 0 HB VAL B 36 9.743 1.076 2.015 1.00 0.00 H new ATOM 0 HG11 VAL B 36 10.619 -0.778 0.639 1.00 0.00 H new ATOM 0 HG12 VAL B 36 11.940 0.239 1.262 1.00 0.00 H new ATOM 0 HG13 VAL B 36 11.601 -1.338 2.013 1.00 0.00 H new ATOM 0 HG21 VAL B 36 8.549 -1.104 1.999 1.00 0.00 H new ATOM 0 HG22 VAL B 36 9.525 -1.646 3.385 1.00 0.00 H new ATOM 0 HG23 VAL B 36 8.381 -0.296 3.575 1.00 0.00 H new ATOM 2117 N ALA B 37 12.994 1.551 2.949 1.00 0.00 N ATOM 2118 CA ALA B 37 14.466 1.593 2.772 1.00 0.00 C ATOM 2119 C ALA B 37 15.112 2.172 4.033 1.00 0.00 C ATOM 2120 O ALA B 37 16.318 2.192 4.180 1.00 0.00 O ATOM 2121 CB ALA B 37 14.691 2.511 1.589 1.00 0.00 C ATOM 0 H ALA B 37 12.486 2.326 2.523 1.00 0.00 H new ATOM 0 HA ALA B 37 14.901 0.607 2.605 1.00 0.00 H new ATOM 0 HB1 ALA B 37 15.760 2.595 1.392 1.00 0.00 H new ATOM 0 HB2 ALA B 37 14.191 2.102 0.711 1.00 0.00 H new ATOM 0 HB3 ALA B 37 14.284 3.497 1.811 1.00 0.00 H new ATOM 2127 N LYS B 38 14.309 2.616 4.959 1.00 0.00 N ATOM 2128 CA LYS B 38 14.856 3.149 6.233 1.00 0.00 C ATOM 2129 C LYS B 38 14.745 2.042 7.259 1.00 0.00 C ATOM 2130 O LYS B 38 15.502 1.964 8.207 1.00 0.00 O ATOM 2131 CB LYS B 38 13.978 4.345 6.607 1.00 0.00 C ATOM 2132 CG LYS B 38 14.861 5.508 7.069 1.00 0.00 C ATOM 2133 CD LYS B 38 14.333 6.821 6.484 1.00 0.00 C ATOM 2134 CE LYS B 38 14.408 6.769 4.955 1.00 0.00 C ATOM 2135 NZ LYS B 38 14.710 8.167 4.538 1.00 0.00 N ATOM 0 H LYS B 38 13.292 2.632 4.886 1.00 0.00 H new ATOM 0 HA LYS B 38 15.897 3.465 6.167 1.00 0.00 H new ATOM 0 HB2 LYS B 38 13.377 4.650 5.750 1.00 0.00 H new ATOM 0 HB3 LYS B 38 13.284 4.065 7.400 1.00 0.00 H new ATOM 0 HG2 LYS B 38 14.869 5.561 8.158 1.00 0.00 H new ATOM 0 HG3 LYS B 38 15.890 5.345 6.750 1.00 0.00 H new ATOM 0 HD2 LYS B 38 13.303 6.985 6.802 1.00 0.00 H new ATOM 0 HD3 LYS B 38 14.920 7.660 6.859 1.00 0.00 H new ATOM 0 HE2 LYS B 38 15.184 6.081 4.621 1.00 0.00 H new ATOM 0 HE3 LYS B 38 13.468 6.423 4.525 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 14.944 8.184 3.525 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 13.879 8.768 4.712 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 15.518 8.526 5.086 1.00 0.00 H new ATOM 2149 N GLY B 39 13.818 1.154 7.037 1.00 0.00 N ATOM 2150 CA GLY B 39 13.657 0.013 7.945 1.00 0.00 C ATOM 2151 C GLY B 39 12.415 0.184 8.815 1.00 0.00 C ATOM 2152 O GLY B 39 12.425 -0.146 9.985 1.00 0.00 O ATOM 0 H GLY B 39 13.164 1.180 6.255 1.00 0.00 H new ATOM 0 HA2 GLY B 39 13.578 -0.908 7.368 1.00 0.00 H new ATOM 0 HA3 GLY B 39 14.540 -0.081 8.578 1.00 0.00 H new ATOM 2156 N ASP B 40 11.339 0.685 8.266 1.00 0.00 N ATOM 2157 CA ASP B 40 10.108 0.851 9.098 1.00 0.00 C ATOM 2158 C ASP B 40 8.888 0.270 8.376 1.00 0.00 C ATOM 2159 O ASP B 40 8.668 0.514 7.206 1.00 0.00 O ATOM 2160 CB ASP B 40 9.956 2.359 9.311 1.00 0.00 C ATOM 2161 CG ASP B 40 10.012 2.673 10.808 1.00 0.00 C ATOM 2162 OD1 ASP B 40 8.964 2.668 11.433 1.00 0.00 O ATOM 2163 OD2 ASP B 40 11.101 2.913 11.304 1.00 0.00 O ATOM 0 H ASP B 40 11.258 0.982 7.294 1.00 0.00 H new ATOM 0 HA ASP B 40 10.185 0.322 10.048 1.00 0.00 H new ATOM 0 HB2 ASP B 40 10.749 2.892 8.787 1.00 0.00 H new ATOM 0 HB3 ASP B 40 9.010 2.702 8.892 1.00 0.00 H new ATOM 2168 N LYS B 41 8.095 -0.498 9.075 1.00 0.00 N ATOM 2169 CA LYS B 41 6.883 -1.105 8.455 1.00 0.00 C ATOM 2170 C LYS B 41 5.744 -0.087 8.436 1.00 0.00 C ATOM 2171 O LYS B 41 4.958 0.003 9.359 1.00 0.00 O ATOM 2172 CB LYS B 41 6.529 -2.292 9.351 1.00 0.00 C ATOM 2173 CG LYS B 41 7.588 -3.389 9.198 1.00 0.00 C ATOM 2174 CD LYS B 41 8.202 -3.708 10.563 1.00 0.00 C ATOM 2175 CE LYS B 41 9.243 -4.819 10.410 1.00 0.00 C ATOM 2176 NZ LYS B 41 8.451 -6.074 10.290 1.00 0.00 N ATOM 0 H LYS B 41 8.237 -0.732 10.058 1.00 0.00 H new ATOM 0 HA LYS B 41 7.054 -1.415 7.424 1.00 0.00 H new ATOM 0 HB2 LYS B 41 6.472 -1.971 10.391 1.00 0.00 H new ATOM 0 HB3 LYS B 41 5.547 -2.682 9.084 1.00 0.00 H new ATOM 0 HG2 LYS B 41 7.138 -4.286 8.773 1.00 0.00 H new ATOM 0 HG3 LYS B 41 8.365 -3.064 8.506 1.00 0.00 H new ATOM 0 HD2 LYS B 41 8.667 -2.815 10.982 1.00 0.00 H new ATOM 0 HD3 LYS B 41 7.423 -4.019 11.260 1.00 0.00 H new ATOM 0 HE2 LYS B 41 9.865 -4.659 9.529 1.00 0.00 H new ATOM 0 HE3 LYS B 41 9.912 -4.855 11.270 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 8.775 -6.759 11.003 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 7.444 -5.865 10.444 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 8.580 -6.476 9.340 1.00 0.00 H new ATOM 2190 N VAL B 42 5.659 0.684 7.390 1.00 0.00 N ATOM 2191 CA VAL B 42 4.578 1.712 7.297 1.00 0.00 C ATOM 2192 C VAL B 42 3.200 1.046 7.353 1.00 0.00 C ATOM 2193 O VAL B 42 2.911 0.134 6.602 1.00 0.00 O ATOM 2194 CB VAL B 42 4.792 2.396 5.945 1.00 0.00 C ATOM 2195 CG1 VAL B 42 3.735 3.487 5.743 1.00 0.00 C ATOM 2196 CG2 VAL B 42 6.189 3.026 5.908 1.00 0.00 C ATOM 0 H VAL B 42 6.292 0.649 6.591 1.00 0.00 H new ATOM 0 HA VAL B 42 4.617 2.423 8.123 1.00 0.00 H new ATOM 0 HB VAL B 42 4.703 1.657 5.149 1.00 0.00 H new ATOM 0 HG11 VAL B 42 3.891 3.971 4.779 1.00 0.00 H new ATOM 0 HG12 VAL B 42 2.741 3.040 5.767 1.00 0.00 H new ATOM 0 HG13 VAL B 42 3.819 4.227 6.539 1.00 0.00 H new ATOM 0 HG21 VAL B 42 6.343 3.514 4.945 1.00 0.00 H new ATOM 0 HG22 VAL B 42 6.277 3.763 6.706 1.00 0.00 H new ATOM 0 HG23 VAL B 42 6.942 2.250 6.046 1.00 0.00 H new ATOM 2206 N GLN B 43 2.349 1.495 8.238 1.00 0.00 N ATOM 2207 CA GLN B 43 0.996 0.896 8.349 1.00 0.00 C ATOM 2208 C GLN B 43 -0.066 1.970 8.070 1.00 0.00 C ATOM 2209 O GLN B 43 -0.397 2.763 8.926 1.00 0.00 O ATOM 2210 CB GLN B 43 0.931 0.396 9.798 1.00 0.00 C ATOM 2211 CG GLN B 43 -0.496 0.492 10.334 1.00 0.00 C ATOM 2212 CD GLN B 43 -0.745 -0.628 11.347 1.00 0.00 C ATOM 2213 OE1 GLN B 43 0.185 -1.205 11.874 1.00 0.00 O ATOM 2214 NE2 GLN B 43 -1.971 -0.961 11.644 1.00 0.00 N ATOM 0 H GLN B 43 2.539 2.256 8.890 1.00 0.00 H new ATOM 0 HA GLN B 43 0.812 0.092 7.637 1.00 0.00 H new ATOM 0 HB2 GLN B 43 1.276 -0.637 9.848 1.00 0.00 H new ATOM 0 HB3 GLN B 43 1.601 0.986 10.423 1.00 0.00 H new ATOM 0 HG2 GLN B 43 -0.653 1.462 10.805 1.00 0.00 H new ATOM 0 HG3 GLN B 43 -1.209 0.417 9.513 1.00 0.00 H new ATOM 0 HE21 GLN B 43 -2.752 -0.477 11.202 1.00 0.00 H new ATOM 0 HE22 GLN B 43 -2.148 -1.705 12.318 1.00 0.00 H new ATOM 2223 N LEU B 44 -0.598 2.000 6.882 1.00 0.00 N ATOM 2224 CA LEU B 44 -1.633 3.023 6.557 1.00 0.00 C ATOM 2225 C LEU B 44 -2.946 2.696 7.267 1.00 0.00 C ATOM 2226 O LEU B 44 -3.808 2.036 6.723 1.00 0.00 O ATOM 2227 CB LEU B 44 -1.809 2.946 5.046 1.00 0.00 C ATOM 2228 CG LEU B 44 -0.829 3.907 4.378 1.00 0.00 C ATOM 2229 CD1 LEU B 44 -0.843 3.696 2.861 1.00 0.00 C ATOM 2230 CD2 LEU B 44 -1.253 5.337 4.699 1.00 0.00 C ATOM 0 H LEU B 44 -0.363 1.362 6.122 1.00 0.00 H new ATOM 0 HA LEU B 44 -1.338 4.021 6.882 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -1.633 1.928 4.699 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -2.832 3.203 4.773 1.00 0.00 H new ATOM 0 HG LEU B 44 0.179 3.723 4.750 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -0.141 4.385 2.391 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -0.552 2.671 2.634 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -1.846 3.882 2.477 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -0.562 6.036 4.228 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -2.260 5.512 4.320 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -1.241 5.486 5.779 1.00 0.00 H new ATOM 2242 N THR B 45 -3.093 3.168 8.480 1.00 0.00 N ATOM 2243 CA THR B 45 -4.338 2.923 9.283 1.00 0.00 C ATOM 2244 C THR B 45 -4.929 1.524 9.044 1.00 0.00 C ATOM 2245 O THR B 45 -6.117 1.314 9.188 1.00 0.00 O ATOM 2246 CB THR B 45 -5.331 4.025 8.876 1.00 0.00 C ATOM 2247 OG1 THR B 45 -6.614 3.714 9.399 1.00 0.00 O ATOM 2248 CG2 THR B 45 -5.421 4.143 7.353 1.00 0.00 C ATOM 0 H THR B 45 -2.387 3.726 8.961 1.00 0.00 H new ATOM 0 HA THR B 45 -4.114 2.957 10.349 1.00 0.00 H new ATOM 0 HB THR B 45 -4.980 4.976 9.277 1.00 0.00 H new ATOM 0 HG1 THR B 45 -6.868 2.808 9.125 1.00 0.00 H new ATOM 0 HG21 THR B 45 -6.129 4.929 7.090 1.00 0.00 H new ATOM 0 HG22 THR B 45 -4.439 4.389 6.949 1.00 0.00 H new ATOM 0 HG23 THR B 45 -5.759 3.195 6.934 1.00 0.00 H new ATOM 2256 N GLY B 46 -4.106 0.557 8.729 1.00 0.00 N ATOM 2257 CA GLY B 46 -4.625 -0.828 8.539 1.00 0.00 C ATOM 2258 C GLY B 46 -4.965 -1.131 7.072 1.00 0.00 C ATOM 2259 O GLY B 46 -4.958 -2.279 6.673 1.00 0.00 O ATOM 0 H GLY B 46 -3.101 0.667 8.596 1.00 0.00 H new ATOM 0 HA2 GLY B 46 -3.882 -1.543 8.892 1.00 0.00 H new ATOM 0 HA3 GLY B 46 -5.516 -0.966 9.151 1.00 0.00 H new ATOM 2263 N PHE B 47 -5.283 -0.150 6.262 1.00 0.00 N ATOM 2264 CA PHE B 47 -5.636 -0.481 4.846 1.00 0.00 C ATOM 2265 C PHE B 47 -4.380 -0.670 3.985 1.00 0.00 C ATOM 2266 O PHE B 47 -4.386 -1.457 3.060 1.00 0.00 O ATOM 2267 CB PHE B 47 -6.585 0.636 4.359 1.00 0.00 C ATOM 2268 CG PHE B 47 -5.842 1.795 3.748 1.00 0.00 C ATOM 2269 CD1 PHE B 47 -5.202 1.653 2.518 1.00 0.00 C ATOM 2270 CD2 PHE B 47 -5.809 3.019 4.414 1.00 0.00 C ATOM 2271 CE1 PHE B 47 -4.525 2.735 1.959 1.00 0.00 C ATOM 2272 CE2 PHE B 47 -5.131 4.102 3.857 1.00 0.00 C ATOM 2273 CZ PHE B 47 -4.488 3.959 2.628 1.00 0.00 C ATOM 0 H PHE B 47 -5.313 0.839 6.510 1.00 0.00 H new ATOM 0 HA PHE B 47 -6.149 -1.439 4.765 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -7.279 0.225 3.625 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -7.183 0.993 5.198 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -5.231 0.706 1.999 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -6.310 3.129 5.364 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -4.028 2.626 1.006 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -5.104 5.049 4.376 1.00 0.00 H new ATOM 0 HZ PHE B 47 -3.961 4.796 2.194 1.00 0.00 H new ATOM 2283 N LEU B 48 -3.296 -0.012 4.286 1.00 0.00 N ATOM 2284 CA LEU B 48 -2.062 -0.244 3.474 1.00 0.00 C ATOM 2285 C LEU B 48 -0.846 -0.433 4.392 1.00 0.00 C ATOM 2286 O LEU B 48 -0.227 0.514 4.830 1.00 0.00 O ATOM 2287 CB LEU B 48 -1.900 0.986 2.585 1.00 0.00 C ATOM 2288 CG LEU B 48 -2.426 0.706 1.171 1.00 0.00 C ATOM 2289 CD1 LEU B 48 -1.868 1.757 0.215 1.00 0.00 C ATOM 2290 CD2 LEU B 48 -1.990 -0.684 0.700 1.00 0.00 C ATOM 0 H LEU B 48 -3.207 0.665 5.044 1.00 0.00 H new ATOM 0 HA LEU B 48 -2.141 -1.149 2.871 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -2.439 1.828 3.019 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -0.849 1.271 2.538 1.00 0.00 H new ATOM 0 HG LEU B 48 -3.515 0.746 1.185 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -2.237 1.565 -0.792 1.00 0.00 H new ATOM 0 HD12 LEU B 48 -2.189 2.748 0.536 1.00 0.00 H new ATOM 0 HD13 LEU B 48 -0.779 1.710 0.218 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -2.373 -0.864 -0.305 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -0.901 -0.740 0.689 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -2.385 -1.439 1.380 1.00 0.00 H new ATOM 2302 N ASN B 49 -0.508 -1.661 4.691 1.00 0.00 N ATOM 2303 CA ASN B 49 0.655 -1.923 5.591 1.00 0.00 C ATOM 2304 C ASN B 49 1.884 -2.378 4.797 1.00 0.00 C ATOM 2305 O ASN B 49 2.095 -3.555 4.588 1.00 0.00 O ATOM 2306 CB ASN B 49 0.184 -3.042 6.521 1.00 0.00 C ATOM 2307 CG ASN B 49 1.166 -3.189 7.684 1.00 0.00 C ATOM 2308 OD1 ASN B 49 2.276 -3.647 7.502 1.00 0.00 O ATOM 2309 ND2 ASN B 49 0.803 -2.815 8.881 1.00 0.00 N ATOM 0 H ASN B 49 -0.988 -2.494 4.350 1.00 0.00 H new ATOM 0 HA ASN B 49 0.955 -1.025 6.131 1.00 0.00 H new ATOM 0 HB2 ASN B 49 -0.813 -2.818 6.900 1.00 0.00 H new ATOM 0 HB3 ASN B 49 0.113 -3.980 5.971 1.00 0.00 H new ATOM 0 HD21 ASN B 49 1.452 -2.907 9.663 1.00 0.00 H new ATOM 0 HD22 ASN B 49 -0.129 -2.430 9.034 1.00 0.00 H new ATOM 2316 N ILE B 50 2.704 -1.453 4.377 1.00 0.00 N ATOM 2317 CA ILE B 50 3.937 -1.827 3.614 1.00 0.00 C ATOM 2318 C ILE B 50 4.964 -2.441 4.572 1.00 0.00 C ATOM 2319 O ILE B 50 5.104 -2.000 5.696 1.00 0.00 O ATOM 2320 CB ILE B 50 4.464 -0.506 3.040 1.00 0.00 C ATOM 2321 CG1 ILE B 50 3.460 0.048 2.011 1.00 0.00 C ATOM 2322 CG2 ILE B 50 5.834 -0.733 2.388 1.00 0.00 C ATOM 2323 CD1 ILE B 50 3.941 -0.216 0.578 1.00 0.00 C ATOM 0 H ILE B 50 2.576 -0.452 4.528 1.00 0.00 H new ATOM 0 HA ILE B 50 3.741 -2.559 2.831 1.00 0.00 H new ATOM 0 HB ILE B 50 4.578 0.221 3.844 1.00 0.00 H new ATOM 0 HG12 ILE B 50 2.485 -0.415 2.163 1.00 0.00 H new ATOM 0 HG13 ILE B 50 3.331 1.119 2.164 1.00 0.00 H new ATOM 0 HG21 ILE B 50 6.204 0.208 1.982 1.00 0.00 H new ATOM 0 HG22 ILE B 50 6.535 -1.107 3.135 1.00 0.00 H new ATOM 0 HG23 ILE B 50 5.738 -1.462 1.584 1.00 0.00 H new ATOM 0 HD11 ILE B 50 3.215 0.185 -0.129 1.00 0.00 H new ATOM 0 HD12 ILE B 50 4.905 0.269 0.423 1.00 0.00 H new ATOM 0 HD13 ILE B 50 4.046 -1.290 0.421 1.00 0.00 H new ATOM 2335 N LYS B 51 5.687 -3.449 4.150 1.00 0.00 N ATOM 2336 CA LYS B 51 6.698 -4.060 5.069 1.00 0.00 C ATOM 2337 C LYS B 51 7.847 -4.691 4.268 1.00 0.00 C ATOM 2338 O LYS B 51 7.638 -5.634 3.532 1.00 0.00 O ATOM 2339 CB LYS B 51 5.936 -5.132 5.860 1.00 0.00 C ATOM 2340 CG LYS B 51 5.068 -5.971 4.915 1.00 0.00 C ATOM 2341 CD LYS B 51 4.590 -7.229 5.644 1.00 0.00 C ATOM 2342 CE LYS B 51 5.634 -8.337 5.488 1.00 0.00 C ATOM 2343 NZ LYS B 51 5.199 -9.410 6.425 1.00 0.00 N ATOM 0 H LYS B 51 5.624 -3.870 3.223 1.00 0.00 H new ATOM 0 HA LYS B 51 7.148 -3.316 5.727 1.00 0.00 H new ATOM 0 HB2 LYS B 51 6.641 -5.776 6.386 1.00 0.00 H new ATOM 0 HB3 LYS B 51 5.310 -4.659 6.617 1.00 0.00 H new ATOM 0 HG2 LYS B 51 4.212 -5.387 4.575 1.00 0.00 H new ATOM 0 HG3 LYS B 51 5.639 -6.246 4.028 1.00 0.00 H new ATOM 0 HD2 LYS B 51 4.430 -7.012 6.700 1.00 0.00 H new ATOM 0 HD3 LYS B 51 3.633 -7.556 5.237 1.00 0.00 H new ATOM 0 HE2 LYS B 51 5.673 -8.701 4.461 1.00 0.00 H new ATOM 0 HE3 LYS B 51 6.632 -7.977 5.736 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 5.866 -10.206 6.375 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 5.178 -9.036 7.395 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 4.248 -9.738 6.160 1.00 0.00 H new ATOM 2357 N PRO B 52 9.030 -4.149 4.433 1.00 0.00 N ATOM 2358 CA PRO B 52 10.207 -4.675 3.705 1.00 0.00 C ATOM 2359 C PRO B 52 10.718 -5.965 4.341 1.00 0.00 C ATOM 2360 O PRO B 52 10.719 -6.125 5.547 1.00 0.00 O ATOM 2361 CB PRO B 52 11.245 -3.570 3.844 1.00 0.00 C ATOM 2362 CG PRO B 52 10.868 -2.835 5.089 1.00 0.00 C ATOM 2363 CD PRO B 52 9.382 -3.009 5.291 1.00 0.00 C ATOM 0 HA PRO B 52 9.977 -4.920 2.668 1.00 0.00 H new ATOM 0 HB2 PRO B 52 12.251 -3.982 3.919 1.00 0.00 H new ATOM 0 HB3 PRO B 52 11.235 -2.909 2.978 1.00 0.00 H new ATOM 0 HG2 PRO B 52 11.419 -3.225 5.945 1.00 0.00 H new ATOM 0 HG3 PRO B 52 11.121 -1.778 5.001 1.00 0.00 H new ATOM 0 HD2 PRO B 52 9.143 -3.209 6.336 1.00 0.00 H new ATOM 0 HD3 PRO B 52 8.834 -2.111 5.005 1.00 0.00 H new ATOM 2371 N VAL B 53 11.159 -6.879 3.527 1.00 0.00 N ATOM 2372 CA VAL B 53 11.688 -8.171 4.054 1.00 0.00 C ATOM 2373 C VAL B 53 12.877 -8.645 3.217 1.00 0.00 C ATOM 2374 O VAL B 53 12.754 -8.918 2.042 1.00 0.00 O ATOM 2375 CB VAL B 53 10.526 -9.150 3.959 1.00 0.00 C ATOM 2376 CG1 VAL B 53 9.359 -8.633 4.805 1.00 0.00 C ATOM 2377 CG2 VAL B 53 10.078 -9.276 2.500 1.00 0.00 C ATOM 0 H VAL B 53 11.177 -6.789 2.511 1.00 0.00 H new ATOM 0 HA VAL B 53 12.050 -8.078 5.078 1.00 0.00 H new ATOM 0 HB VAL B 53 10.843 -10.126 4.326 1.00 0.00 H new ATOM 0 HG11 VAL B 53 8.525 -9.331 4.740 1.00 0.00 H new ATOM 0 HG12 VAL B 53 9.675 -8.542 5.844 1.00 0.00 H new ATOM 0 HG13 VAL B 53 9.045 -7.657 4.434 1.00 0.00 H new ATOM 0 HG21 VAL B 53 9.246 -9.977 2.434 1.00 0.00 H new ATOM 0 HG22 VAL B 53 9.760 -8.301 2.131 1.00 0.00 H new ATOM 0 HG23 VAL B 53 10.908 -9.640 1.895 1.00 0.00 H new ATOM 2387 N ALA B 54 14.029 -8.724 3.820 1.00 0.00 N ATOM 2388 CA ALA B 54 15.260 -9.149 3.076 1.00 0.00 C ATOM 2389 C ALA B 54 14.991 -10.330 2.138 1.00 0.00 C ATOM 2390 O ALA B 54 14.261 -11.247 2.457 1.00 0.00 O ATOM 2391 CB ALA B 54 16.274 -9.541 4.149 1.00 0.00 C ATOM 0 H ALA B 54 14.178 -8.511 4.806 1.00 0.00 H new ATOM 0 HA ALA B 54 15.621 -8.341 2.440 1.00 0.00 H new ATOM 0 HB1 ALA B 54 17.201 -9.863 3.674 1.00 0.00 H new ATOM 0 HB2 ALA B 54 16.475 -8.683 4.791 1.00 0.00 H new ATOM 0 HB3 ALA B 54 15.872 -10.357 4.749 1.00 0.00 H new ATOM 2710 N VAL B 75 15.758 -6.152 -0.327 1.00 0.00 N ATOM 2711 CA VAL B 75 14.659 -6.485 0.627 1.00 0.00 C ATOM 2712 C VAL B 75 13.375 -6.772 -0.155 1.00 0.00 C ATOM 2713 O VAL B 75 13.315 -6.588 -1.355 1.00 0.00 O ATOM 2714 CB VAL B 75 14.508 -5.263 1.555 1.00 0.00 C ATOM 2715 CG1 VAL B 75 13.287 -4.426 1.159 1.00 0.00 C ATOM 2716 CG2 VAL B 75 14.334 -5.743 2.998 1.00 0.00 C ATOM 0 HA VAL B 75 14.875 -7.376 1.217 1.00 0.00 H new ATOM 0 HB VAL B 75 15.402 -4.647 1.464 1.00 0.00 H new ATOM 0 HG11 VAL B 75 13.201 -3.569 1.828 1.00 0.00 H new ATOM 0 HG12 VAL B 75 13.403 -4.076 0.133 1.00 0.00 H new ATOM 0 HG13 VAL B 75 12.387 -5.037 1.234 1.00 0.00 H new ATOM 0 HG21 VAL B 75 14.227 -4.882 3.658 1.00 0.00 H new ATOM 0 HG22 VAL B 75 13.443 -6.367 3.069 1.00 0.00 H new ATOM 0 HG23 VAL B 75 15.208 -6.322 3.297 1.00 0.00 H new ATOM 2726 N GLY B 76 12.357 -7.225 0.513 1.00 0.00 N ATOM 2727 CA GLY B 76 11.084 -7.530 -0.190 1.00 0.00 C ATOM 2728 C GLY B 76 10.009 -6.570 0.298 1.00 0.00 C ATOM 2729 O GLY B 76 9.150 -6.928 1.076 1.00 0.00 O ATOM 0 H GLY B 76 12.350 -7.398 1.518 1.00 0.00 H new ATOM 0 HA2 GLY B 76 11.216 -7.432 -1.268 1.00 0.00 H new ATOM 0 HA3 GLY B 76 10.785 -8.560 0.002 1.00 0.00 H new ATOM 2733 N VAL B 77 10.061 -5.348 -0.153 1.00 0.00 N ATOM 2734 CA VAL B 77 9.053 -4.333 0.271 1.00 0.00 C ATOM 2735 C VAL B 77 7.642 -4.871 0.070 1.00 0.00 C ATOM 2736 O VAL B 77 6.989 -4.589 -0.916 1.00 0.00 O ATOM 2737 CB VAL B 77 9.321 -3.114 -0.625 1.00 0.00 C ATOM 2738 CG1 VAL B 77 9.379 -3.547 -2.097 1.00 0.00 C ATOM 2739 CG2 VAL B 77 8.208 -2.074 -0.445 1.00 0.00 C ATOM 0 H VAL B 77 10.766 -5.004 -0.805 1.00 0.00 H new ATOM 0 HA VAL B 77 9.134 -4.079 1.328 1.00 0.00 H new ATOM 0 HB VAL B 77 10.276 -2.674 -0.339 1.00 0.00 H new ATOM 0 HG11 VAL B 77 9.569 -2.677 -2.725 1.00 0.00 H new ATOM 0 HG12 VAL B 77 10.180 -4.274 -2.231 1.00 0.00 H new ATOM 0 HG13 VAL B 77 8.429 -3.999 -2.381 1.00 0.00 H new ATOM 0 HG21 VAL B 77 8.407 -1.214 -1.084 1.00 0.00 H new ATOM 0 HG22 VAL B 77 7.250 -2.516 -0.719 1.00 0.00 H new ATOM 0 HG23 VAL B 77 8.175 -1.753 0.596 1.00 0.00 H new ATOM 2749 N SER B 78 7.170 -5.641 1.006 1.00 0.00 N ATOM 2750 CA SER B 78 5.799 -6.199 0.882 1.00 0.00 C ATOM 2751 C SER B 78 4.766 -5.152 1.308 1.00 0.00 C ATOM 2752 O SER B 78 5.100 -4.061 1.724 1.00 0.00 O ATOM 2753 CB SER B 78 5.771 -7.399 1.827 1.00 0.00 C ATOM 2754 OG SER B 78 5.816 -8.598 1.065 1.00 0.00 O ATOM 0 H SER B 78 7.674 -5.908 1.851 1.00 0.00 H new ATOM 0 HA SER B 78 5.559 -6.485 -0.142 1.00 0.00 H new ATOM 0 HB2 SER B 78 6.618 -7.357 2.511 1.00 0.00 H new ATOM 0 HB3 SER B 78 4.868 -7.376 2.436 1.00 0.00 H new ATOM 0 HG SER B 78 5.800 -9.370 1.669 1.00 0.00 H new ATOM 2760 N VAL B 79 3.514 -5.494 1.209 1.00 0.00 N ATOM 2761 CA VAL B 79 2.414 -4.562 1.599 1.00 0.00 C ATOM 2762 C VAL B 79 1.073 -5.243 1.316 1.00 0.00 C ATOM 2763 O VAL B 79 1.034 -6.333 0.776 1.00 0.00 O ATOM 2764 CB VAL B 79 2.591 -3.328 0.696 1.00 0.00 C ATOM 2765 CG1 VAL B 79 2.546 -3.753 -0.774 1.00 0.00 C ATOM 2766 CG2 VAL B 79 1.469 -2.321 0.961 1.00 0.00 C ATOM 0 H VAL B 79 3.197 -6.401 0.867 1.00 0.00 H new ATOM 0 HA VAL B 79 2.439 -4.289 2.654 1.00 0.00 H new ATOM 0 HB VAL B 79 3.553 -2.866 0.916 1.00 0.00 H new ATOM 0 HG11 VAL B 79 2.672 -2.877 -1.410 1.00 0.00 H new ATOM 0 HG12 VAL B 79 3.349 -4.463 -0.972 1.00 0.00 H new ATOM 0 HG13 VAL B 79 1.586 -4.222 -0.988 1.00 0.00 H new ATOM 0 HG21 VAL B 79 1.602 -1.451 0.318 1.00 0.00 H new ATOM 0 HG22 VAL B 79 0.506 -2.785 0.749 1.00 0.00 H new ATOM 0 HG23 VAL B 79 1.499 -2.009 2.005 1.00 0.00 H new ATOM 2776 N LYS B 80 -0.027 -4.612 1.632 1.00 0.00 N ATOM 2777 CA LYS B 80 -1.338 -5.233 1.327 1.00 0.00 C ATOM 2778 C LYS B 80 -2.476 -4.244 1.594 1.00 0.00 C ATOM 2779 O LYS B 80 -2.266 -3.176 2.132 1.00 0.00 O ATOM 2780 CB LYS B 80 -1.436 -6.432 2.278 1.00 0.00 C ATOM 2781 CG LYS B 80 -1.327 -5.953 3.730 1.00 0.00 C ATOM 2782 CD LYS B 80 -1.870 -7.034 4.669 1.00 0.00 C ATOM 2783 CE LYS B 80 -0.707 -7.835 5.256 1.00 0.00 C ATOM 2784 NZ LYS B 80 -1.278 -9.176 5.560 1.00 0.00 N ATOM 0 H LYS B 80 -0.069 -3.699 2.085 1.00 0.00 H new ATOM 0 HA LYS B 80 -1.419 -5.529 0.281 1.00 0.00 H new ATOM 0 HB2 LYS B 80 -2.382 -6.951 2.127 1.00 0.00 H new ATOM 0 HB3 LYS B 80 -0.642 -7.146 2.060 1.00 0.00 H new ATOM 0 HG2 LYS B 80 -0.288 -5.733 3.974 1.00 0.00 H new ATOM 0 HG3 LYS B 80 -1.888 -5.028 3.861 1.00 0.00 H new ATOM 0 HD2 LYS B 80 -2.450 -6.576 5.470 1.00 0.00 H new ATOM 0 HD3 LYS B 80 -2.544 -7.697 4.126 1.00 0.00 H new ATOM 0 HE2 LYS B 80 0.119 -7.909 4.548 1.00 0.00 H new ATOM 0 HE3 LYS B 80 -0.315 -7.360 6.155 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 -0.539 -9.784 5.967 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 -2.057 -9.075 6.241 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 -1.637 -9.607 4.684 1.00 0.00 H new ATOM 2798 N PRO B 81 -3.650 -4.661 1.222 1.00 0.00 N ATOM 2799 CA PRO B 81 -4.871 -3.869 1.416 1.00 0.00 C ATOM 2800 C PRO B 81 -5.625 -4.341 2.660 1.00 0.00 C ATOM 2801 O PRO B 81 -5.918 -5.512 2.807 1.00 0.00 O ATOM 2802 CB PRO B 81 -5.680 -4.217 0.175 1.00 0.00 C ATOM 2803 CG PRO B 81 -5.192 -5.578 -0.254 1.00 0.00 C ATOM 2804 CD PRO B 81 -3.953 -5.903 0.548 1.00 0.00 C ATOM 0 HA PRO B 81 -4.680 -2.804 1.549 1.00 0.00 H new ATOM 0 HB2 PRO B 81 -6.748 -4.234 0.394 1.00 0.00 H new ATOM 0 HB3 PRO B 81 -5.528 -3.479 -0.613 1.00 0.00 H new ATOM 0 HG2 PRO B 81 -5.963 -6.330 -0.086 1.00 0.00 H new ATOM 0 HG3 PRO B 81 -4.968 -5.584 -1.321 1.00 0.00 H new ATOM 0 HD2 PRO B 81 -4.135 -6.710 1.257 1.00 0.00 H new ATOM 0 HD3 PRO B 81 -3.132 -6.222 -0.094 1.00 0.00 H new ATOM 2812 N GLY B 82 -5.968 -3.445 3.537 1.00 0.00 N ATOM 2813 CA GLY B 82 -6.736 -3.851 4.745 1.00 0.00 C ATOM 2814 C GLY B 82 -8.207 -3.954 4.354 1.00 0.00 C ATOM 2815 O GLY B 82 -8.531 -4.148 3.198 1.00 0.00 O ATOM 0 H GLY B 82 -5.751 -2.450 3.472 1.00 0.00 H new ATOM 0 HA2 GLY B 82 -6.374 -4.807 5.123 1.00 0.00 H new ATOM 0 HA3 GLY B 82 -6.604 -3.121 5.544 1.00 0.00 H new ATOM 2819 N GLU B 83 -9.102 -3.811 5.288 1.00 0.00 N ATOM 2820 CA GLU B 83 -10.546 -3.886 4.931 1.00 0.00 C ATOM 2821 C GLU B 83 -11.092 -2.483 4.666 1.00 0.00 C ATOM 2822 O GLU B 83 -12.147 -2.321 4.085 1.00 0.00 O ATOM 2823 CB GLU B 83 -11.245 -4.517 6.130 1.00 0.00 C ATOM 2824 CG GLU B 83 -10.972 -3.693 7.395 1.00 0.00 C ATOM 2825 CD GLU B 83 -10.165 -4.530 8.389 1.00 0.00 C ATOM 2826 OE1 GLU B 83 -9.142 -5.064 7.991 1.00 0.00 O ATOM 2827 OE2 GLU B 83 -10.583 -4.624 9.531 1.00 0.00 O ATOM 0 H GLU B 83 -8.901 -3.647 6.274 1.00 0.00 H new ATOM 0 HA GLU B 83 -10.709 -4.473 4.027 1.00 0.00 H new ATOM 0 HB2 GLU B 83 -12.318 -4.572 5.947 1.00 0.00 H new ATOM 0 HB3 GLU B 83 -10.893 -5.539 6.270 1.00 0.00 H new ATOM 0 HG2 GLU B 83 -10.424 -2.786 7.139 1.00 0.00 H new ATOM 0 HG3 GLU B 83 -11.913 -3.380 7.847 1.00 0.00 H new ATOM 2834 N SER B 84 -10.377 -1.465 5.071 1.00 0.00 N ATOM 2835 CA SER B 84 -10.859 -0.076 4.820 1.00 0.00 C ATOM 2836 C SER B 84 -11.115 0.103 3.324 1.00 0.00 C ATOM 2837 O SER B 84 -12.057 0.754 2.912 1.00 0.00 O ATOM 2838 CB SER B 84 -9.724 0.835 5.286 1.00 0.00 C ATOM 2839 OG SER B 84 -10.271 2.039 5.807 1.00 0.00 O ATOM 0 H SER B 84 -9.486 -1.536 5.562 1.00 0.00 H new ATOM 0 HA SER B 84 -11.788 0.150 5.343 1.00 0.00 H new ATOM 0 HB2 SER B 84 -9.129 0.333 6.049 1.00 0.00 H new ATOM 0 HB3 SER B 84 -9.055 1.056 4.454 1.00 0.00 H new ATOM 0 HG SER B 84 -9.599 2.751 5.759 1.00 0.00 H new ATOM 2845 N LEU B 85 -10.288 -0.495 2.506 1.00 0.00 N ATOM 2846 CA LEU B 85 -10.482 -0.385 1.034 1.00 0.00 C ATOM 2847 C LEU B 85 -11.528 -1.407 0.592 1.00 0.00 C ATOM 2848 O LEU B 85 -12.272 -1.186 -0.345 1.00 0.00 O ATOM 2849 CB LEU B 85 -9.128 -0.714 0.384 1.00 0.00 C ATOM 2850 CG LEU B 85 -7.962 -0.163 1.217 1.00 0.00 C ATOM 2851 CD1 LEU B 85 -7.089 -1.324 1.701 1.00 0.00 C ATOM 2852 CD2 LEU B 85 -7.116 0.789 0.360 1.00 0.00 C ATOM 0 H LEU B 85 -9.486 -1.055 2.797 1.00 0.00 H new ATOM 0 HA LEU B 85 -10.821 0.610 0.746 1.00 0.00 H new ATOM 0 HB2 LEU B 85 -9.025 -1.794 0.280 1.00 0.00 H new ATOM 0 HB3 LEU B 85 -9.092 -0.292 -0.620 1.00 0.00 H new ATOM 0 HG LEU B 85 -8.358 0.380 2.075 1.00 0.00 H new ATOM 0 HD11 LEU B 85 -6.261 -0.934 2.293 1.00 0.00 H new ATOM 0 HD12 LEU B 85 -7.687 -1.998 2.314 1.00 0.00 H new ATOM 0 HD13 LEU B 85 -6.697 -1.867 0.841 1.00 0.00 H new ATOM 0 HD21 LEU B 85 -6.290 1.178 0.955 1.00 0.00 H new ATOM 0 HD22 LEU B 85 -6.721 0.250 -0.501 1.00 0.00 H new ATOM 0 HD23 LEU B 85 -7.736 1.617 0.016 1.00 0.00 H new ATOM 2864 N LYS B 86 -11.585 -2.531 1.260 1.00 0.00 N ATOM 2865 CA LYS B 86 -12.580 -3.574 0.881 1.00 0.00 C ATOM 2866 C LYS B 86 -13.973 -3.140 1.307 1.00 0.00 C ATOM 2867 O LYS B 86 -14.943 -3.349 0.605 1.00 0.00 O ATOM 2868 CB LYS B 86 -12.156 -4.841 1.627 1.00 0.00 C ATOM 2869 CG LYS B 86 -11.818 -5.943 0.621 1.00 0.00 C ATOM 2870 CD LYS B 86 -11.855 -7.302 1.323 1.00 0.00 C ATOM 2871 CE LYS B 86 -11.569 -8.411 0.308 1.00 0.00 C ATOM 2872 NZ LYS B 86 -10.109 -8.677 0.432 1.00 0.00 N ATOM 0 H LYS B 86 -10.986 -2.770 2.050 1.00 0.00 H new ATOM 0 HA LYS B 86 -12.610 -3.740 -0.196 1.00 0.00 H new ATOM 0 HB2 LYS B 86 -11.291 -4.632 2.256 1.00 0.00 H new ATOM 0 HB3 LYS B 86 -12.958 -5.171 2.287 1.00 0.00 H new ATOM 0 HG2 LYS B 86 -12.530 -5.928 -0.204 1.00 0.00 H new ATOM 0 HG3 LYS B 86 -10.831 -5.769 0.193 1.00 0.00 H new ATOM 0 HD2 LYS B 86 -11.117 -7.329 2.124 1.00 0.00 H new ATOM 0 HD3 LYS B 86 -12.831 -7.459 1.783 1.00 0.00 H new ATOM 0 HE2 LYS B 86 -12.153 -9.305 0.525 1.00 0.00 H new ATOM 0 HE3 LYS B 86 -11.829 -8.098 -0.703 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 -9.835 -9.428 -0.234 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 -9.578 -7.810 0.213 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 -9.893 -8.980 1.403 1.00 0.00 H new ATOM 2886 N LYS B 87 -14.079 -2.508 2.433 1.00 0.00 N ATOM 2887 CA LYS B 87 -15.409 -2.027 2.868 1.00 0.00 C ATOM 2888 C LYS B 87 -15.787 -0.892 1.929 1.00 0.00 C ATOM 2889 O LYS B 87 -16.918 -0.765 1.477 1.00 0.00 O ATOM 2890 CB LYS B 87 -15.220 -1.540 4.308 1.00 0.00 C ATOM 2891 CG LYS B 87 -16.504 -0.869 4.804 1.00 0.00 C ATOM 2892 CD LYS B 87 -17.540 -1.939 5.154 1.00 0.00 C ATOM 2893 CE LYS B 87 -18.617 -1.330 6.054 1.00 0.00 C ATOM 2894 NZ LYS B 87 -19.851 -2.111 5.760 1.00 0.00 N ATOM 0 H LYS B 87 -13.307 -2.304 3.068 1.00 0.00 H new ATOM 0 HA LYS B 87 -16.197 -2.780 2.839 1.00 0.00 H new ATOM 0 HB2 LYS B 87 -14.965 -2.380 4.955 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -14.389 -0.836 4.357 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -16.291 -0.255 5.679 1.00 0.00 H new ATOM 0 HG3 LYS B 87 -16.899 -0.204 4.036 1.00 0.00 H new ATOM 0 HD2 LYS B 87 -17.992 -2.334 4.244 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -17.058 -2.775 5.660 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -18.342 -1.407 7.106 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -18.759 -0.271 5.838 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -20.636 -1.752 6.340 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 -20.092 -2.013 4.753 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 -19.688 -3.114 5.981 1.00 0.00 H new ATOM 2908 N ALA B 88 -14.812 -0.105 1.571 1.00 0.00 N ATOM 2909 CA ALA B 88 -15.076 0.978 0.609 1.00 0.00 C ATOM 2910 C ALA B 88 -15.385 0.318 -0.731 1.00 0.00 C ATOM 2911 O ALA B 88 -16.211 0.775 -1.498 1.00 0.00 O ATOM 2912 CB ALA B 88 -13.777 1.786 0.550 1.00 0.00 C ATOM 0 H ALA B 88 -13.851 -0.171 1.906 1.00 0.00 H new ATOM 0 HA ALA B 88 -15.911 1.626 0.876 1.00 0.00 H new ATOM 0 HB1 ALA B 88 -13.895 2.614 -0.149 1.00 0.00 H new ATOM 0 HB2 ALA B 88 -13.547 2.177 1.541 1.00 0.00 H new ATOM 0 HB3 ALA B 88 -12.963 1.143 0.216 1.00 0.00 H new ATOM 2918 N ALA B 89 -14.738 -0.789 -1.000 1.00 0.00 N ATOM 2919 CA ALA B 89 -14.996 -1.507 -2.277 1.00 0.00 C ATOM 2920 C ALA B 89 -16.462 -1.898 -2.339 1.00 0.00 C ATOM 2921 O ALA B 89 -17.123 -1.693 -3.339 1.00 0.00 O ATOM 2922 CB ALA B 89 -14.094 -2.739 -2.252 1.00 0.00 C ATOM 0 H ALA B 89 -14.045 -1.222 -0.390 1.00 0.00 H new ATOM 0 HA ALA B 89 -14.784 -0.895 -3.154 1.00 0.00 H new ATOM 0 HB1 ALA B 89 -14.237 -3.313 -3.168 1.00 0.00 H new ATOM 0 HB2 ALA B 89 -13.053 -2.426 -2.178 1.00 0.00 H new ATOM 0 HB3 ALA B 89 -14.348 -3.359 -1.392 1.00 0.00 H new ATOM 2928 N GLU B 90 -16.991 -2.412 -1.262 1.00 0.00 N ATOM 2929 CA GLU B 90 -18.438 -2.757 -1.254 1.00 0.00 C ATOM 2930 C GLU B 90 -19.201 -1.505 -1.681 1.00 0.00 C ATOM 2931 O GLU B 90 -20.232 -1.570 -2.322 1.00 0.00 O ATOM 2932 CB GLU B 90 -18.762 -3.130 0.194 1.00 0.00 C ATOM 2933 CG GLU B 90 -18.122 -4.480 0.529 1.00 0.00 C ATOM 2934 CD GLU B 90 -18.624 -4.957 1.893 1.00 0.00 C ATOM 2935 OE1 GLU B 90 -18.257 -4.346 2.883 1.00 0.00 O ATOM 2936 OE2 GLU B 90 -19.366 -5.924 1.923 1.00 0.00 O ATOM 0 H GLU B 90 -16.488 -2.606 -0.396 1.00 0.00 H new ATOM 0 HA GLU B 90 -18.703 -3.575 -1.924 1.00 0.00 H new ATOM 0 HB2 GLU B 90 -18.390 -2.361 0.871 1.00 0.00 H new ATOM 0 HB3 GLU B 90 -19.842 -3.183 0.334 1.00 0.00 H new ATOM 0 HG2 GLU B 90 -18.370 -5.213 -0.239 1.00 0.00 H new ATOM 0 HG3 GLU B 90 -17.036 -4.387 0.541 1.00 0.00 H new ATOM 2943 N GLY B 91 -18.665 -0.360 -1.341 1.00 0.00 N ATOM 2944 CA GLY B 91 -19.312 0.922 -1.733 1.00 0.00 C ATOM 2945 C GLY B 91 -19.220 1.112 -3.259 1.00 0.00 C ATOM 2946 O GLY B 91 -20.101 1.693 -3.862 1.00 0.00 O ATOM 0 H GLY B 91 -17.802 -0.261 -0.806 1.00 0.00 H new ATOM 0 HA2 GLY B 91 -20.356 0.923 -1.420 1.00 0.00 H new ATOM 0 HA3 GLY B 91 -18.826 1.755 -1.224 1.00 0.00 H new ATOM 2950 N LEU B 92 -18.167 0.639 -3.895 1.00 0.00 N ATOM 2951 CA LEU B 92 -18.049 0.815 -5.377 1.00 0.00 C ATOM 2952 C LEU B 92 -19.013 -0.109 -6.129 1.00 0.00 C ATOM 2953 O LEU B 92 -18.923 -0.249 -7.334 1.00 0.00 O ATOM 2954 CB LEU B 92 -16.589 0.449 -5.699 1.00 0.00 C ATOM 2955 CG LEU B 92 -16.442 -1.050 -6.006 1.00 0.00 C ATOM 2956 CD1 LEU B 92 -16.468 -1.270 -7.523 1.00 0.00 C ATOM 2957 CD2 LEU B 92 -15.110 -1.556 -5.442 1.00 0.00 C ATOM 0 H LEU B 92 -17.393 0.144 -3.453 1.00 0.00 H new ATOM 0 HA LEU B 92 -18.304 1.829 -5.684 1.00 0.00 H new ATOM 0 HB2 LEU B 92 -16.246 1.032 -6.553 1.00 0.00 H new ATOM 0 HB3 LEU B 92 -15.951 0.714 -4.856 1.00 0.00 H new ATOM 0 HG LEU B 92 -17.266 -1.596 -5.547 1.00 0.00 H new ATOM 0 HD11 LEU B 92 -16.364 -2.333 -7.738 1.00 0.00 H new ATOM 0 HD12 LEU B 92 -17.414 -0.909 -7.927 1.00 0.00 H new ATOM 0 HD13 LEU B 92 -15.645 -0.724 -7.984 1.00 0.00 H new ATOM 0 HD21 LEU B 92 -15.004 -2.619 -5.659 1.00 0.00 H new ATOM 0 HD22 LEU B 92 -14.288 -1.008 -5.903 1.00 0.00 H new ATOM 0 HD23 LEU B 92 -15.090 -1.402 -4.363 1.00 0.00 H new ATOM 2969 N LYS B 93 -19.909 -0.771 -5.443 1.00 0.00 N ATOM 2970 CA LYS B 93 -20.828 -1.714 -6.146 1.00 0.00 C ATOM 2971 C LYS B 93 -19.965 -2.799 -6.787 1.00 0.00 C ATOM 2972 O LYS B 93 -20.202 -3.249 -7.893 1.00 0.00 O ATOM 2973 CB LYS B 93 -21.558 -0.884 -7.209 1.00 0.00 C ATOM 2974 CG LYS B 93 -23.071 -1.032 -7.028 1.00 0.00 C ATOM 2975 CD LYS B 93 -23.537 -0.156 -5.859 1.00 0.00 C ATOM 2976 CE LYS B 93 -24.628 0.806 -6.338 1.00 0.00 C ATOM 2977 NZ LYS B 93 -25.441 1.101 -5.126 1.00 0.00 N ATOM 0 H LYS B 93 -20.043 -0.700 -4.434 1.00 0.00 H new ATOM 0 HA LYS B 93 -21.553 -2.190 -5.486 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -21.273 0.165 -7.125 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -21.267 -1.215 -8.206 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -23.587 -0.740 -7.943 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -23.324 -2.075 -6.838 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -23.919 -0.782 -5.053 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -22.695 0.406 -5.455 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -24.197 1.716 -6.755 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -25.237 0.354 -7.121 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -26.210 1.755 -5.375 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -25.845 0.217 -4.755 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -24.837 1.537 -4.400 1.00 0.00 H new ATOM 2991 N TYR B 94 -18.941 -3.195 -6.078 1.00 0.00 N ATOM 2992 CA TYR B 94 -18.004 -4.231 -6.592 1.00 0.00 C ATOM 2993 C TYR B 94 -18.779 -5.404 -7.203 1.00 0.00 C ATOM 2994 O TYR B 94 -18.385 -5.964 -8.207 1.00 0.00 O ATOM 2995 CB TYR B 94 -17.190 -4.658 -5.365 1.00 0.00 C ATOM 2996 CG TYR B 94 -17.661 -5.994 -4.865 1.00 0.00 C ATOM 2997 CD1 TYR B 94 -17.106 -7.154 -5.401 1.00 0.00 C ATOM 2998 CD2 TYR B 94 -18.654 -6.071 -3.887 1.00 0.00 C ATOM 2999 CE1 TYR B 94 -17.543 -8.408 -4.963 1.00 0.00 C ATOM 3000 CE2 TYR B 94 -19.092 -7.325 -3.441 1.00 0.00 C ATOM 3001 CZ TYR B 94 -18.537 -8.494 -3.981 1.00 0.00 C ATOM 3002 OH TYR B 94 -18.970 -9.729 -3.546 1.00 0.00 O ATOM 0 H TYR B 94 -18.713 -2.837 -5.150 1.00 0.00 H new ATOM 0 HA TYR B 94 -17.360 -3.860 -7.389 1.00 0.00 H new ATOM 0 HB2 TYR B 94 -16.132 -4.711 -5.623 1.00 0.00 H new ATOM 0 HB3 TYR B 94 -17.289 -3.912 -4.577 1.00 0.00 H new ATOM 0 HD1 TYR B 94 -16.337 -7.085 -6.156 1.00 0.00 H new ATOM 0 HD2 TYR B 94 -19.082 -5.169 -3.476 1.00 0.00 H new ATOM 0 HE1 TYR B 94 -17.115 -9.307 -5.381 1.00 0.00 H new ATOM 0 HE2 TYR B 94 -19.857 -7.391 -2.681 1.00 0.00 H new ATOM 0 HH TYR B 94 -19.662 -9.611 -2.862 1.00 0.00 H new ATOM 3012 N GLU B 95 -19.887 -5.770 -6.610 1.00 0.00 N ATOM 3013 CA GLU B 95 -20.688 -6.896 -7.174 1.00 0.00 C ATOM 3014 C GLU B 95 -21.060 -6.572 -8.618 1.00 0.00 C ATOM 3015 O GLU B 95 -21.030 -7.424 -9.485 1.00 0.00 O ATOM 3016 CB GLU B 95 -21.935 -7.011 -6.294 1.00 0.00 C ATOM 3017 CG GLU B 95 -22.695 -5.681 -6.273 1.00 0.00 C ATOM 3018 CD GLU B 95 -23.738 -5.670 -7.391 1.00 0.00 C ATOM 3019 OE1 GLU B 95 -24.341 -6.705 -7.623 1.00 0.00 O ATOM 3020 OE2 GLU B 95 -23.917 -4.626 -7.997 1.00 0.00 O ATOM 0 H GLU B 95 -20.268 -5.341 -5.767 1.00 0.00 H new ATOM 0 HA GLU B 95 -20.137 -7.837 -7.181 1.00 0.00 H new ATOM 0 HB2 GLU B 95 -22.583 -7.802 -6.671 1.00 0.00 H new ATOM 0 HB3 GLU B 95 -21.648 -7.290 -5.280 1.00 0.00 H new ATOM 0 HG2 GLU B 95 -23.181 -5.543 -5.307 1.00 0.00 H new ATOM 0 HG3 GLU B 95 -22.000 -4.851 -6.402 1.00 0.00 H new ATOM 3027 N ASP B 96 -21.365 -5.330 -8.893 1.00 0.00 N ATOM 3028 CA ASP B 96 -21.686 -4.940 -10.293 1.00 0.00 C ATOM 3029 C ASP B 96 -20.437 -5.182 -11.135 1.00 0.00 C ATOM 3030 O ASP B 96 -20.503 -5.587 -12.279 1.00 0.00 O ATOM 3031 CB ASP B 96 -22.028 -3.449 -10.240 1.00 0.00 C ATOM 3032 CG ASP B 96 -23.430 -3.223 -10.808 1.00 0.00 C ATOM 3033 OD1 ASP B 96 -24.346 -3.892 -10.359 1.00 0.00 O ATOM 3034 OD2 ASP B 96 -23.564 -2.383 -11.683 1.00 0.00 O ATOM 0 H ASP B 96 -21.405 -4.574 -8.210 1.00 0.00 H new ATOM 0 HA ASP B 96 -22.513 -5.504 -10.725 1.00 0.00 H new ATOM 0 HB2 ASP B 96 -21.979 -3.091 -9.212 1.00 0.00 H new ATOM 0 HB3 ASP B 96 -21.297 -2.877 -10.812 1.00 0.00 H new ATOM 3039 N PHE B 97 -19.293 -4.961 -10.543 1.00 0.00 N ATOM 3040 CA PHE B 97 -18.012 -5.202 -11.262 1.00 0.00 C ATOM 3041 C PHE B 97 -17.823 -6.710 -11.445 1.00 0.00 C ATOM 3042 O PHE B 97 -17.182 -7.163 -12.372 1.00 0.00 O ATOM 3043 CB PHE B 97 -16.929 -4.638 -10.335 1.00 0.00 C ATOM 3044 CG PHE B 97 -16.062 -3.660 -11.088 1.00 0.00 C ATOM 3045 CD1 PHE B 97 -16.540 -2.377 -11.377 1.00 0.00 C ATOM 3046 CD2 PHE B 97 -14.775 -4.036 -11.491 1.00 0.00 C ATOM 3047 CE1 PHE B 97 -15.730 -1.469 -12.070 1.00 0.00 C ATOM 3048 CE2 PHE B 97 -13.966 -3.130 -12.185 1.00 0.00 C ATOM 3049 CZ PHE B 97 -14.443 -1.846 -12.474 1.00 0.00 C ATOM 0 H PHE B 97 -19.193 -4.622 -9.586 1.00 0.00 H new ATOM 0 HA PHE B 97 -17.981 -4.738 -12.248 1.00 0.00 H new ATOM 0 HB2 PHE B 97 -17.392 -4.143 -9.481 1.00 0.00 H new ATOM 0 HB3 PHE B 97 -16.318 -5.450 -9.941 1.00 0.00 H new ATOM 0 HD1 PHE B 97 -17.533 -2.087 -11.066 1.00 0.00 H new ATOM 0 HD2 PHE B 97 -14.407 -5.026 -11.266 1.00 0.00 H new ATOM 0 HE1 PHE B 97 -16.098 -0.478 -12.293 1.00 0.00 H new ATOM 0 HE2 PHE B 97 -12.974 -3.421 -12.498 1.00 0.00 H new ATOM 0 HZ PHE B 97 -13.818 -1.146 -13.009 1.00 0.00 H new