USER MOD reduce.3.24.130724 H: found=0, std=0, add=1450, rem=0, adj=54 USER MOD reduce.3.24.130724 removed 1453 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 36 LYS NZ :NH3+ -138:sc= -1.71! (180deg=-4.69!) USER MOD Set 1.2: C 7 GLN : amide:sc= -1.99! K(o=-3.7!,f=-1.9) USER MOD Set 2.1: B 53 THR OG1 : rot 180:sc= -1.88! USER MOD Set 2.2: B 55 HIS : no HD1:sc= -1.93 K(o=-3.8,f=-5.6!) USER MOD Set 3.1: B 31 LYS NZ :NH3+ 170:sc= 0 (180deg=0) USER MOD Set 3.2: B 41 HIS : no HE2:sc= -10.5! C(o=-10!,f=-15!) USER MOD Set 4.1: B 14 SER OG : rot 180:sc= 0 USER MOD Set 4.2: B 17 MET CE :methyl -120:sc= 0 (180deg=-0.985) USER MOD Set 5.1: A 88 SER OG : rot 114:sc= 0.0632 USER MOD Set 5.2: C 1 MET CE :methyl 180:sc= -0.0201 (180deg=0) USER MOD Set 6.1: A 75 TYR OH : rot -152:sc= -2.39! USER MOD Set 6.2: A 77 TYR OH : rot 180:sc= 0.519 USER MOD Set 7.1: A 53 THR OG1 : rot -160:sc= -0.436 USER MOD Set 7.2: A 55 HIS : no HD1:sc= -4.76! C(o=-5.2!,f=-6.5!) USER MOD Set 8.1: A 43 LYS NZ :NH3+ 178:sc= -0.137 (180deg=-0.143) USER MOD Set 8.2: B 67 THR OG1 : rot 180:sc= 0 USER MOD Set 9.1: A 24 CYS SG : rot 138:sc= -0.737 USER MOD Set 9.2: A 41 HIS : no HE2:sc= -6.93! C(o=-7.7!,f=-12!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 ASN : amide:sc= -1.38 K(o=-1.4,f=-3.7!) USER MOD Single : A 13 MET CE :methyl 178:sc= -6.41! (180deg=-6.47!) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl -164:sc= 0 (180deg=-0.176) USER MOD Single : A 18 GLN : amide:sc= -2.47! K(o=-2.5!,f=-1.6) USER MOD Single : A 19 GLN : amide:sc= -1.29 K(o=-1.3,f=-3.6!) USER MOD Single : A 21 SER OG : rot -18:sc= -0.685 USER MOD Single : A 26 THR OG1 : rot 68:sc= 0.112 USER MOD Single : A 27 GLN : amide:sc= -0.14 X(o=-0.14,f=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= -2.24 K(o=-2.2,f=-8.2!) USER MOD Single : A 36 LYS NZ :NH3+ 160:sc= -0.0545 (180deg=-0.408) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 169:sc= -0.0163 (180deg=-0.216) USER MOD Single : A 49 LYS NZ :NH3+ -168:sc= -0.0196 (180deg=-0.219) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 ASN : amide:sc= -1.62 X(o=-1.6,f=-1.3) USER MOD Single : A 56 CYS SG : rot 44:sc= -0.619 USER MOD Single : A 61 ASN : amide:sc= -1.99 K(o=-2,f=-0.32) USER MOD Single : A 64 SER OG : rot 163:sc= -1.21! USER MOD Single : A 65 TYR OH : rot 180:sc= -0.504 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HE2:sc= -2.31 K(o=-2.3,f=-4.6!) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 HIS : no HE2:sc= -7.88! C(o=-7.9!,f=-8.5!) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ 146:sc= -2.79! (180deg=-5.09!) USER MOD Single : B 10 ASN : amide:sc= -1.45 K(o=-1.5,f=-2.1) USER MOD Single : B 13 MET CE :methyl 134:sc= -2.44 (180deg=-7.43!) USER MOD Single : B 18 GLN : amide:sc= -3.69! K(o=-3.7!,f=-1.8) USER MOD Single : B 19 GLN : amide:sc= -0.891 K(o=-0.89,f=0) USER MOD Single : B 21 SER OG : rot -170:sc= -0.338 USER MOD Single : B 24 CYS SG : rot 146:sc= 0.294 USER MOD Single : B 26 THR OG1 : rot 71:sc= 1.09 USER MOD Single : B 27 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : B 32 TYR OH : rot 180:sc= 0 USER MOD Single : B 33 ASN : amide:sc= -2.59 K(o=-2.6,f=-0.77) USER MOD Single : B 43 LYS NZ :NH3+ -108:sc= -5.33! (180deg=-13.5!) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 TYR OH : rot 180:sc= 0 USER MOD Single : B 51 ASN : amide:sc= -1.6 X(o=-1.6,f=-1.2) USER MOD Single : B 56 CYS SG : rot 47:sc= -1.13 USER MOD Single : B 61 ASN : amide:sc= -3.62 K(o=-3.6,f=-7!) USER MOD Single : B 64 SER OG : rot 140:sc= -2.99 USER MOD Single : B 65 TYR OH : rot 128:sc= 0.735 USER MOD Single : B 68 HIS : no HE2:sc= -3.01 K(o=-3,f=-4.3!) USER MOD Single : B 70 THR OG1 : rot 180:sc= 0 USER MOD Single : B 71 LYS NZ :NH3+ 142:sc= 0.141 (180deg=0) USER MOD Single : B 72 HIS : no HE2:sc= -7.12! C(o=-7.1!,f=-16!) USER MOD Single : B 75 TYR OH : rot 0:sc= -6.56! USER MOD Single : B 77 TYR OH : rot 172:sc= -0.634 USER MOD Single : B 80 GLN : amide:sc= -2.27! C(o=-2.3!,f=-5.9!) USER MOD Single : B 87 LYS NZ :NH3+ -107:sc= 0.00495 (180deg=-0.723) USER MOD Single : B 88 SER OG : rot 180:sc= 0.546 USER MOD Single : C 1 MET N :NH3+ -162:sc= -0.0624 (180deg=-0.442) USER MOD Single : C 2 LYS NZ :NH3+ -120:sc= 0 (180deg=-0.759) USER MOD Single : C 4 THR OG1 : rot 128:sc= 2.01 USER MOD Single : D 4 THR OG1 : rot 112:sc= 0.704 USER MOD Single : D 7 GLN : amide:sc= -0.951 K(o=-0.95,f=0) USER MOD ----------------------------------------------------------------- ATOM 89 N ALA A 6 -13.095 -5.466 -13.238 1.00 0.00 N ATOM 90 CA ALA A 6 -12.091 -5.740 -12.218 1.00 0.00 C ATOM 91 C ALA A 6 -12.309 -7.105 -11.572 1.00 0.00 C ATOM 92 O ALA A 6 -13.392 -7.393 -11.060 1.00 0.00 O ATOM 93 CB ALA A 6 -12.111 -4.648 -11.159 1.00 0.00 C ATOM 0 HA ALA A 6 -11.115 -5.753 -12.703 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -11.357 -4.862 -10.401 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -11.895 -3.686 -11.624 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -13.095 -4.612 -10.692 1.00 0.00 H new ATOM 99 N VAL A 7 -11.276 -7.942 -11.598 1.00 0.00 N ATOM 100 CA VAL A 7 -11.355 -9.269 -11.015 1.00 0.00 C ATOM 101 C VAL A 7 -10.987 -9.253 -9.537 1.00 0.00 C ATOM 102 O VAL A 7 -10.046 -8.576 -9.128 1.00 0.00 O ATOM 103 CB VAL A 7 -10.434 -10.251 -11.747 1.00 0.00 C ATOM 104 CG1 VAL A 7 -10.894 -10.449 -13.184 1.00 0.00 C ATOM 105 CG2 VAL A 7 -8.990 -9.772 -11.700 1.00 0.00 C ATOM 0 H VAL A 7 -10.374 -7.720 -12.019 1.00 0.00 H new ATOM 0 HA VAL A 7 -12.389 -9.596 -11.120 1.00 0.00 H new ATOM 0 HB VAL A 7 -10.487 -11.214 -11.239 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -10.227 -11.150 -13.686 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -11.909 -10.847 -13.190 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -10.876 -9.493 -13.707 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -8.353 -10.484 -12.225 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -8.915 -8.796 -12.179 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -8.666 -9.693 -10.662 1.00 0.00 H new ATOM 115 N ILE A 8 -11.733 -10.010 -8.744 1.00 0.00 N ATOM 116 CA ILE A 8 -11.485 -10.091 -7.309 1.00 0.00 C ATOM 117 C ILE A 8 -10.644 -11.317 -6.963 1.00 0.00 C ATOM 118 O ILE A 8 -10.998 -12.444 -7.311 1.00 0.00 O ATOM 119 CB ILE A 8 -12.805 -10.131 -6.502 1.00 0.00 C ATOM 120 CG1 ILE A 8 -13.602 -8.837 -6.700 1.00 0.00 C ATOM 121 CG2 ILE A 8 -12.524 -10.354 -5.021 1.00 0.00 C ATOM 122 CD1 ILE A 8 -14.067 -8.614 -8.121 1.00 0.00 C ATOM 0 H ILE A 8 -12.516 -10.578 -9.069 1.00 0.00 H new ATOM 0 HA ILE A 8 -10.936 -9.191 -7.035 1.00 0.00 H new ATOM 0 HB ILE A 8 -13.401 -10.965 -6.872 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -14.471 -8.853 -6.042 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -12.986 -7.992 -6.393 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -13.465 -10.379 -4.472 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -12.001 -11.301 -4.888 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -11.904 -9.542 -4.642 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -14.623 -7.678 -8.179 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -13.203 -8.564 -8.783 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -14.711 -9.439 -8.427 1.00 0.00 H new ATOM 134 N LYS A 9 -9.535 -11.087 -6.267 1.00 0.00 N ATOM 135 CA LYS A 9 -8.647 -12.170 -5.860 1.00 0.00 C ATOM 136 C LYS A 9 -9.018 -12.678 -4.470 1.00 0.00 C ATOM 137 O LYS A 9 -8.974 -13.877 -4.200 1.00 0.00 O ATOM 138 CB LYS A 9 -7.191 -11.703 -5.877 1.00 0.00 C ATOM 139 CG LYS A 9 -6.707 -11.272 -7.251 1.00 0.00 C ATOM 140 CD LYS A 9 -6.820 -12.402 -8.261 1.00 0.00 C ATOM 141 CE LYS A 9 -5.985 -13.605 -7.848 1.00 0.00 C ATOM 142 NZ LYS A 9 -6.088 -14.717 -8.834 1.00 0.00 N ATOM 0 H LYS A 9 -9.230 -10.159 -5.973 1.00 0.00 H new ATOM 0 HA LYS A 9 -8.762 -12.988 -6.571 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -7.077 -10.870 -5.183 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -6.555 -12.510 -5.513 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -7.292 -10.418 -7.592 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -5.670 -10.943 -7.186 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -7.864 -12.699 -8.360 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -6.494 -12.050 -9.240 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -4.942 -13.305 -7.746 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -6.313 -13.956 -6.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -5.505 -15.518 -8.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -7.080 -15.020 -8.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -5.751 -14.390 -9.762 1.00 0.00 H new ATOM 156 N ASN A 10 -9.382 -11.749 -3.592 1.00 0.00 N ATOM 157 CA ASN A 10 -9.763 -12.086 -2.227 1.00 0.00 C ATOM 158 C ASN A 10 -10.393 -10.881 -1.544 1.00 0.00 C ATOM 159 O ASN A 10 -9.901 -9.759 -1.665 1.00 0.00 O ATOM 160 CB ASN A 10 -8.544 -12.568 -1.437 1.00 0.00 C ATOM 161 CG ASN A 10 -7.429 -11.540 -1.404 1.00 0.00 C ATOM 162 OD1 ASN A 10 -6.938 -11.104 -2.446 1.00 0.00 O ATOM 163 ND2 ASN A 10 -7.018 -11.149 -0.203 1.00 0.00 N ATOM 0 H ASN A 10 -9.421 -10.752 -3.804 1.00 0.00 H new ATOM 0 HA ASN A 10 -10.496 -12.892 -2.259 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -8.846 -12.804 -0.417 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -8.170 -13.491 -1.880 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -6.268 -10.462 -0.119 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -7.452 -11.535 0.635 1.00 0.00 H new ATOM 170 N ALA A 11 -11.493 -11.112 -0.834 1.00 0.00 N ATOM 171 CA ALA A 11 -12.187 -10.031 -0.152 1.00 0.00 C ATOM 172 C ALA A 11 -13.013 -10.539 1.025 1.00 0.00 C ATOM 173 O ALA A 11 -13.715 -11.545 0.923 1.00 0.00 O ATOM 174 CB ALA A 11 -13.076 -9.280 -1.130 1.00 0.00 C ATOM 0 H ALA A 11 -11.919 -12.032 -0.718 1.00 0.00 H new ATOM 0 HA ALA A 11 -11.431 -9.353 0.244 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -13.591 -8.473 -0.608 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -12.465 -8.863 -1.931 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -13.811 -9.965 -1.553 1.00 0.00 H new ATOM 180 N ASP A 12 -12.926 -9.819 2.136 1.00 0.00 N ATOM 181 CA ASP A 12 -13.663 -10.162 3.345 1.00 0.00 C ATOM 182 C ASP A 12 -14.546 -8.992 3.767 1.00 0.00 C ATOM 183 O ASP A 12 -14.464 -8.508 4.895 1.00 0.00 O ATOM 184 CB ASP A 12 -12.698 -10.531 4.474 1.00 0.00 C ATOM 185 CG ASP A 12 -11.820 -11.715 4.120 1.00 0.00 C ATOM 186 OD1 ASP A 12 -12.370 -12.804 3.855 1.00 0.00 O ATOM 187 OD2 ASP A 12 -10.581 -11.553 4.109 1.00 0.00 O ATOM 0 H ASP A 12 -12.346 -8.985 2.224 1.00 0.00 H new ATOM 0 HA ASP A 12 -14.295 -11.025 3.136 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -12.069 -9.672 4.706 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -13.268 -10.761 5.374 1.00 0.00 H new ATOM 192 N MET A 13 -15.377 -8.534 2.837 1.00 0.00 N ATOM 193 CA MET A 13 -16.271 -7.411 3.079 1.00 0.00 C ATOM 194 C MET A 13 -17.651 -7.676 2.485 1.00 0.00 C ATOM 195 O MET A 13 -17.789 -8.439 1.529 1.00 0.00 O ATOM 196 CB MET A 13 -15.683 -6.135 2.470 1.00 0.00 C ATOM 197 CG MET A 13 -16.563 -4.910 2.641 1.00 0.00 C ATOM 198 SD MET A 13 -15.902 -3.461 1.795 1.00 0.00 S ATOM 199 CE MET A 13 -14.294 -3.312 2.568 1.00 0.00 C ATOM 0 H MET A 13 -15.449 -8.929 1.899 1.00 0.00 H new ATOM 0 HA MET A 13 -16.377 -7.285 4.156 1.00 0.00 H new ATOM 0 HB2 MET A 13 -14.713 -5.940 2.927 1.00 0.00 H new ATOM 0 HB3 MET A 13 -15.508 -6.299 1.407 1.00 0.00 H new ATOM 0 HG2 MET A 13 -17.560 -5.127 2.258 1.00 0.00 H new ATOM 0 HG3 MET A 13 -16.670 -4.689 3.703 1.00 0.00 H new ATOM 0 HE1 MET A 13 -13.751 -2.479 2.121 1.00 0.00 H new ATOM 0 HE2 MET A 13 -14.419 -3.133 3.636 1.00 0.00 H new ATOM 0 HE3 MET A 13 -13.731 -4.233 2.418 1.00 0.00 H new ATOM 209 N SER A 14 -18.670 -7.041 3.060 1.00 0.00 N ATOM 210 CA SER A 14 -20.046 -7.204 2.590 1.00 0.00 C ATOM 211 C SER A 14 -20.122 -7.124 1.066 1.00 0.00 C ATOM 212 O SER A 14 -19.424 -6.327 0.440 1.00 0.00 O ATOM 213 CB SER A 14 -20.948 -6.137 3.213 1.00 0.00 C ATOM 214 OG SER A 14 -20.951 -6.234 4.626 1.00 0.00 O ATOM 0 H SER A 14 -18.570 -6.408 3.853 1.00 0.00 H new ATOM 0 HA SER A 14 -20.391 -8.191 2.898 1.00 0.00 H new ATOM 0 HB2 SER A 14 -20.605 -5.147 2.914 1.00 0.00 H new ATOM 0 HB3 SER A 14 -21.964 -6.250 2.835 1.00 0.00 H new ATOM 0 HG SER A 14 -21.533 -5.540 5.000 1.00 0.00 H new ATOM 220 N GLU A 15 -20.968 -7.964 0.478 1.00 0.00 N ATOM 221 CA GLU A 15 -21.135 -8.007 -0.971 1.00 0.00 C ATOM 222 C GLU A 15 -21.451 -6.630 -1.546 1.00 0.00 C ATOM 223 O GLU A 15 -20.861 -6.213 -2.540 1.00 0.00 O ATOM 224 CB GLU A 15 -22.244 -8.989 -1.347 1.00 0.00 C ATOM 225 CG GLU A 15 -21.969 -10.418 -0.899 1.00 0.00 C ATOM 226 CD GLU A 15 -23.079 -11.377 -1.287 1.00 0.00 C ATOM 227 OE1 GLU A 15 -24.066 -10.927 -1.906 1.00 0.00 O ATOM 228 OE2 GLU A 15 -22.959 -12.580 -0.971 1.00 0.00 O ATOM 0 H GLU A 15 -21.552 -8.628 0.986 1.00 0.00 H new ATOM 0 HA GLU A 15 -20.190 -8.342 -1.398 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -23.182 -8.652 -0.905 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -22.379 -8.976 -2.429 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -21.031 -10.758 -1.338 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -21.840 -10.437 0.183 1.00 0.00 H new ATOM 235 N GLU A 16 -22.387 -5.935 -0.921 1.00 0.00 N ATOM 236 CA GLU A 16 -22.788 -4.612 -1.382 1.00 0.00 C ATOM 237 C GLU A 16 -21.620 -3.631 -1.362 1.00 0.00 C ATOM 238 O GLU A 16 -21.430 -2.863 -2.306 1.00 0.00 O ATOM 239 CB GLU A 16 -23.932 -4.075 -0.519 1.00 0.00 C ATOM 240 CG GLU A 16 -23.577 -3.946 0.952 1.00 0.00 C ATOM 241 CD GLU A 16 -24.726 -3.413 1.785 1.00 0.00 C ATOM 242 OE1 GLU A 16 -25.186 -2.285 1.510 1.00 0.00 O ATOM 243 OE2 GLU A 16 -25.166 -4.125 2.713 1.00 0.00 O ATOM 0 H GLU A 16 -22.884 -6.263 -0.093 1.00 0.00 H new ATOM 0 HA GLU A 16 -23.127 -4.711 -2.413 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -24.234 -3.099 -0.898 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -24.793 -4.736 -0.620 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -23.276 -4.921 1.336 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -22.718 -3.283 1.058 1.00 0.00 H new ATOM 250 N MET A 17 -20.842 -3.652 -0.286 1.00 0.00 N ATOM 251 CA MET A 17 -19.704 -2.749 -0.162 1.00 0.00 C ATOM 252 C MET A 17 -18.699 -2.963 -1.288 1.00 0.00 C ATOM 253 O MET A 17 -18.279 -2.009 -1.943 1.00 0.00 O ATOM 254 CB MET A 17 -19.017 -2.931 1.190 1.00 0.00 C ATOM 255 CG MET A 17 -19.902 -2.587 2.378 1.00 0.00 C ATOM 256 SD MET A 17 -19.040 -2.752 3.952 1.00 0.00 S ATOM 257 CE MET A 17 -20.287 -2.150 5.088 1.00 0.00 C ATOM 0 H MET A 17 -20.976 -4.279 0.507 1.00 0.00 H new ATOM 0 HA MET A 17 -20.085 -1.730 -0.233 1.00 0.00 H new ATOM 0 HB2 MET A 17 -18.686 -3.965 1.283 1.00 0.00 H new ATOM 0 HB3 MET A 17 -18.124 -2.306 1.221 1.00 0.00 H new ATOM 0 HG2 MET A 17 -20.266 -1.565 2.272 1.00 0.00 H new ATOM 0 HG3 MET A 17 -20.776 -3.238 2.376 1.00 0.00 H new ATOM 0 HE1 MET A 17 -19.824 -1.921 6.048 1.00 0.00 H new ATOM 0 HE2 MET A 17 -20.745 -1.248 4.681 1.00 0.00 H new ATOM 0 HE3 MET A 17 -21.052 -2.914 5.227 1.00 0.00 H new ATOM 267 N GLN A 18 -18.314 -4.213 -1.511 1.00 0.00 N ATOM 268 CA GLN A 18 -17.356 -4.533 -2.563 1.00 0.00 C ATOM 269 C GLN A 18 -17.870 -4.096 -3.930 1.00 0.00 C ATOM 270 O GLN A 18 -17.098 -3.633 -4.769 1.00 0.00 O ATOM 271 CB GLN A 18 -17.018 -6.023 -2.559 1.00 0.00 C ATOM 272 CG GLN A 18 -18.229 -6.938 -2.531 1.00 0.00 C ATOM 273 CD GLN A 18 -17.839 -8.395 -2.409 1.00 0.00 C ATOM 274 OE1 GLN A 18 -17.315 -8.992 -3.349 1.00 0.00 O ATOM 275 NE2 GLN A 18 -18.071 -8.969 -1.236 1.00 0.00 N ATOM 0 H GLN A 18 -18.648 -5.018 -0.981 1.00 0.00 H new ATOM 0 HA GLN A 18 -16.441 -3.977 -2.358 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -16.425 -6.251 -3.445 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -16.393 -6.240 -1.692 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -18.871 -6.664 -1.694 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -18.813 -6.794 -3.440 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -18.508 -8.435 -0.485 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -17.812 -9.944 -1.085 1.00 0.00 H new ATOM 284 N GLN A 19 -19.174 -4.226 -4.151 1.00 0.00 N ATOM 285 CA GLN A 19 -19.762 -3.816 -5.423 1.00 0.00 C ATOM 286 C GLN A 19 -19.577 -2.318 -5.627 1.00 0.00 C ATOM 287 O GLN A 19 -19.230 -1.864 -6.718 1.00 0.00 O ATOM 288 CB GLN A 19 -21.247 -4.179 -5.478 1.00 0.00 C ATOM 289 CG GLN A 19 -21.510 -5.676 -5.531 1.00 0.00 C ATOM 290 CD GLN A 19 -20.963 -6.323 -6.788 1.00 0.00 C ATOM 291 OE1 GLN A 19 -19.759 -6.301 -7.039 1.00 0.00 O ATOM 292 NE2 GLN A 19 -21.851 -6.904 -7.589 1.00 0.00 N ATOM 0 H GLN A 19 -19.837 -4.607 -3.476 1.00 0.00 H new ATOM 0 HA GLN A 19 -19.251 -4.348 -6.225 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -21.746 -3.762 -4.603 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -21.694 -3.709 -6.354 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -21.061 -6.151 -4.658 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -22.584 -5.854 -5.474 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -22.841 -6.899 -7.342 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -21.543 -7.355 -8.450 1.00 0.00 H new ATOM 301 N ASP A 20 -19.801 -1.556 -4.561 1.00 0.00 N ATOM 302 CA ASP A 20 -19.649 -0.106 -4.608 1.00 0.00 C ATOM 303 C ASP A 20 -18.186 0.272 -4.781 1.00 0.00 C ATOM 304 O ASP A 20 -17.866 1.237 -5.466 1.00 0.00 O ATOM 305 CB ASP A 20 -20.215 0.532 -3.337 1.00 0.00 C ATOM 306 CG ASP A 20 -20.095 2.044 -3.344 1.00 0.00 C ATOM 307 OD1 ASP A 20 -20.665 2.681 -4.255 1.00 0.00 O ATOM 308 OD2 ASP A 20 -19.433 2.590 -2.438 1.00 0.00 O ATOM 0 H ASP A 20 -20.089 -1.919 -3.653 1.00 0.00 H new ATOM 0 HA ASP A 20 -20.207 0.270 -5.465 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -21.264 0.254 -3.231 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -19.690 0.133 -2.469 1.00 0.00 H new ATOM 313 N SER A 21 -17.301 -0.498 -4.161 1.00 0.00 N ATOM 314 CA SER A 21 -15.873 -0.237 -4.269 1.00 0.00 C ATOM 315 C SER A 21 -15.407 -0.494 -5.696 1.00 0.00 C ATOM 316 O SER A 21 -14.620 0.272 -6.254 1.00 0.00 O ATOM 317 CB SER A 21 -15.086 -1.111 -3.290 1.00 0.00 C ATOM 318 OG SER A 21 -15.285 -2.489 -3.559 1.00 0.00 O ATOM 0 H SER A 21 -17.545 -1.302 -3.583 1.00 0.00 H new ATOM 0 HA SER A 21 -15.690 0.807 -4.016 1.00 0.00 H new ATOM 0 HB2 SER A 21 -14.024 -0.874 -3.359 1.00 0.00 H new ATOM 0 HB3 SER A 21 -15.396 -0.888 -2.269 1.00 0.00 H new ATOM 0 HG SER A 21 -16.089 -2.602 -4.108 1.00 0.00 H new ATOM 324 N VAL A 22 -15.913 -1.572 -6.289 1.00 0.00 N ATOM 325 CA VAL A 22 -15.565 -1.926 -7.658 1.00 0.00 C ATOM 326 C VAL A 22 -16.027 -0.839 -8.617 1.00 0.00 C ATOM 327 O VAL A 22 -15.252 -0.344 -9.436 1.00 0.00 O ATOM 328 CB VAL A 22 -16.197 -3.270 -8.071 1.00 0.00 C ATOM 329 CG1 VAL A 22 -15.793 -3.644 -9.489 1.00 0.00 C ATOM 330 CG2 VAL A 22 -15.806 -4.368 -7.093 1.00 0.00 C ATOM 0 H VAL A 22 -16.566 -2.215 -5.841 1.00 0.00 H new ATOM 0 HA VAL A 22 -14.480 -2.024 -7.706 1.00 0.00 H new ATOM 0 HB VAL A 22 -17.281 -3.159 -8.046 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -16.251 -4.596 -9.759 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -16.130 -2.871 -10.179 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -14.708 -3.734 -9.547 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -16.262 -5.309 -7.401 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -14.721 -4.476 -7.082 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -16.154 -4.106 -6.094 1.00 0.00 H new ATOM 340 N GLU A 23 -17.292 -0.461 -8.494 1.00 0.00 N ATOM 341 CA GLU A 23 -17.863 0.584 -9.329 1.00 0.00 C ATOM 342 C GLU A 23 -17.172 1.908 -9.042 1.00 0.00 C ATOM 343 O GLU A 23 -16.805 2.649 -9.955 1.00 0.00 O ATOM 344 CB GLU A 23 -19.366 0.701 -9.067 1.00 0.00 C ATOM 345 CG GLU A 23 -20.021 1.859 -9.796 1.00 0.00 C ATOM 346 CD GLU A 23 -21.521 1.918 -9.577 1.00 0.00 C ATOM 347 OE1 GLU A 23 -22.052 1.049 -8.853 1.00 0.00 O ATOM 348 OE2 GLU A 23 -22.166 2.833 -10.131 1.00 0.00 O ATOM 0 H GLU A 23 -17.944 -0.865 -7.821 1.00 0.00 H new ATOM 0 HA GLU A 23 -17.711 0.327 -10.377 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -19.852 -0.228 -9.367 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -19.532 0.816 -7.996 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -19.572 2.794 -9.461 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -19.817 1.772 -10.863 1.00 0.00 H new ATOM 355 N CYS A 24 -16.990 2.185 -7.759 1.00 0.00 N ATOM 356 CA CYS A 24 -16.332 3.407 -7.321 1.00 0.00 C ATOM 357 C CYS A 24 -14.909 3.474 -7.872 1.00 0.00 C ATOM 358 O CYS A 24 -14.392 4.553 -8.164 1.00 0.00 O ATOM 359 CB CYS A 24 -16.312 3.471 -5.791 1.00 0.00 C ATOM 360 SG CYS A 24 -15.614 4.995 -5.118 1.00 0.00 S ATOM 0 H CYS A 24 -17.291 1.575 -6.999 1.00 0.00 H new ATOM 0 HA CYS A 24 -16.890 4.262 -7.703 1.00 0.00 H new ATOM 0 HB2 CYS A 24 -17.331 3.358 -5.421 1.00 0.00 H new ATOM 0 HB3 CYS A 24 -15.740 2.625 -5.411 1.00 0.00 H new ATOM 0 HG CYS A 24 -16.334 5.395 -4.112 1.00 0.00 H new ATOM 366 N ALA A 25 -14.288 2.307 -8.028 1.00 0.00 N ATOM 367 CA ALA A 25 -12.938 2.228 -8.556 1.00 0.00 C ATOM 368 C ALA A 25 -12.937 2.606 -10.025 1.00 0.00 C ATOM 369 O ALA A 25 -12.045 3.312 -10.503 1.00 0.00 O ATOM 370 CB ALA A 25 -12.371 0.829 -8.363 1.00 0.00 C ATOM 0 H ALA A 25 -14.703 1.405 -7.795 1.00 0.00 H new ATOM 0 HA ALA A 25 -12.304 2.929 -8.012 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -11.359 0.788 -8.765 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -12.350 0.588 -7.300 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -12.998 0.107 -8.886 1.00 0.00 H new ATOM 376 N THR A 26 -13.957 2.137 -10.737 1.00 0.00 N ATOM 377 CA THR A 26 -14.088 2.433 -12.151 1.00 0.00 C ATOM 378 C THR A 26 -14.134 3.939 -12.363 1.00 0.00 C ATOM 379 O THR A 26 -13.461 4.481 -13.242 1.00 0.00 O ATOM 380 CB THR A 26 -15.344 1.775 -12.727 1.00 0.00 C ATOM 381 OG1 THR A 26 -15.298 0.371 -12.552 1.00 0.00 O ATOM 382 CG2 THR A 26 -15.540 2.048 -14.203 1.00 0.00 C ATOM 0 H THR A 26 -14.701 1.552 -10.355 1.00 0.00 H new ATOM 0 HA THR A 26 -13.222 2.028 -12.674 1.00 0.00 H new ATOM 0 HB THR A 26 -16.178 2.215 -12.180 1.00 0.00 H new ATOM 0 HG1 THR A 26 -15.363 0.158 -11.598 1.00 0.00 H new ATOM 0 HG21 THR A 26 -16.448 1.553 -14.547 1.00 0.00 H new ATOM 0 HG22 THR A 26 -15.629 3.122 -14.366 1.00 0.00 H new ATOM 0 HG23 THR A 26 -14.685 1.666 -14.760 1.00 0.00 H new ATOM 390 N GLN A 27 -14.917 4.612 -11.528 1.00 0.00 N ATOM 391 CA GLN A 27 -15.036 6.058 -11.598 1.00 0.00 C ATOM 392 C GLN A 27 -13.672 6.694 -11.367 1.00 0.00 C ATOM 393 O GLN A 27 -13.298 7.653 -12.039 1.00 0.00 O ATOM 394 CB GLN A 27 -16.038 6.564 -10.557 1.00 0.00 C ATOM 395 CG GLN A 27 -17.435 5.996 -10.733 1.00 0.00 C ATOM 396 CD GLN A 27 -18.410 6.509 -9.692 1.00 0.00 C ATOM 397 OE1 GLN A 27 -18.647 7.712 -9.587 1.00 0.00 O ATOM 398 NE2 GLN A 27 -18.981 5.596 -8.914 1.00 0.00 N ATOM 0 H GLN A 27 -15.478 4.177 -10.796 1.00 0.00 H new ATOM 0 HA GLN A 27 -15.399 6.336 -12.587 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -15.674 6.310 -9.561 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -16.087 7.652 -10.611 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -17.804 6.250 -11.727 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -17.390 4.908 -10.678 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -18.755 4.609 -9.036 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -19.645 5.882 -8.195 1.00 0.00 H new ATOM 407 N ALA A 28 -12.925 6.134 -10.418 1.00 0.00 N ATOM 408 CA ALA A 28 -11.590 6.629 -10.103 1.00 0.00 C ATOM 409 C ALA A 28 -10.740 6.730 -11.360 1.00 0.00 C ATOM 410 O ALA A 28 -10.107 7.754 -11.615 1.00 0.00 O ATOM 411 CB ALA A 28 -10.916 5.714 -9.092 1.00 0.00 C ATOM 0 H ALA A 28 -13.223 5.337 -9.855 1.00 0.00 H new ATOM 0 HA ALA A 28 -11.689 7.625 -9.672 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -9.920 6.094 -8.865 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -11.509 5.682 -8.178 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -10.835 4.710 -9.508 1.00 0.00 H new ATOM 417 N LEU A 29 -10.739 5.662 -12.152 1.00 0.00 N ATOM 418 CA LEU A 29 -9.973 5.638 -13.389 1.00 0.00 C ATOM 419 C LEU A 29 -10.419 6.758 -14.319 1.00 0.00 C ATOM 420 O LEU A 29 -9.609 7.549 -14.801 1.00 0.00 O ATOM 421 CB LEU A 29 -10.125 4.286 -14.080 1.00 0.00 C ATOM 422 CG LEU A 29 -9.409 3.139 -13.376 1.00 0.00 C ATOM 423 CD1 LEU A 29 -9.903 1.797 -13.895 1.00 0.00 C ATOM 424 CD2 LEU A 29 -7.905 3.258 -13.566 1.00 0.00 C ATOM 0 H LEU A 29 -11.259 4.806 -11.958 1.00 0.00 H new ATOM 0 HA LEU A 29 -8.922 5.791 -13.145 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -11.186 4.046 -14.154 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -9.744 4.366 -15.098 1.00 0.00 H new ATOM 0 HG LEU A 29 -9.632 3.198 -12.311 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -9.379 0.992 -13.379 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -10.974 1.708 -13.713 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -9.710 1.728 -14.966 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -7.408 2.432 -13.058 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -7.669 3.225 -14.630 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -7.559 4.203 -13.147 1.00 0.00 H new ATOM 436 N GLU A 30 -11.718 6.822 -14.560 1.00 0.00 N ATOM 437 CA GLU A 30 -12.286 7.847 -15.427 1.00 0.00 C ATOM 438 C GLU A 30 -12.049 9.244 -14.857 1.00 0.00 C ATOM 439 O GLU A 30 -11.934 10.218 -15.602 1.00 0.00 O ATOM 440 CB GLU A 30 -13.785 7.609 -15.618 1.00 0.00 C ATOM 441 CG GLU A 30 -14.112 6.265 -16.248 1.00 0.00 C ATOM 442 CD GLU A 30 -15.602 6.052 -16.425 1.00 0.00 C ATOM 443 OE1 GLU A 30 -16.329 6.066 -15.409 1.00 0.00 O ATOM 444 OE2 GLU A 30 -16.043 5.872 -17.580 1.00 0.00 O ATOM 0 H GLU A 30 -12.402 6.176 -14.167 1.00 0.00 H new ATOM 0 HA GLU A 30 -11.787 7.783 -16.394 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -14.282 7.678 -14.650 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -14.194 8.403 -16.243 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -13.621 6.193 -17.218 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -13.706 5.468 -15.626 1.00 0.00 H new ATOM 451 N LYS A 31 -11.989 9.338 -13.532 1.00 0.00 N ATOM 452 CA LYS A 31 -11.780 10.615 -12.863 1.00 0.00 C ATOM 453 C LYS A 31 -10.310 11.016 -12.841 1.00 0.00 C ATOM 454 O LYS A 31 -9.982 12.193 -12.994 1.00 0.00 O ATOM 455 CB LYS A 31 -12.333 10.572 -11.437 1.00 0.00 C ATOM 456 CG LYS A 31 -13.851 10.514 -11.375 1.00 0.00 C ATOM 457 CD LYS A 31 -14.349 10.461 -9.940 1.00 0.00 C ATOM 458 CE LYS A 31 -15.867 10.454 -9.877 1.00 0.00 C ATOM 459 NZ LYS A 31 -16.366 10.389 -8.475 1.00 0.00 N ATOM 0 H LYS A 31 -12.083 8.542 -12.900 1.00 0.00 H new ATOM 0 HA LYS A 31 -12.320 11.369 -13.435 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -11.923 9.702 -10.923 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -11.989 11.453 -10.896 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -14.270 11.387 -11.874 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -14.205 9.637 -11.917 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -13.959 9.568 -9.451 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -13.965 11.319 -9.389 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -16.254 11.352 -10.359 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -16.249 9.601 -10.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -17.406 10.386 -8.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -16.018 9.520 -8.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -16.023 11.216 -7.946 1.00 0.00 H new ATOM 473 N TYR A 32 -9.423 10.046 -12.643 1.00 0.00 N ATOM 474 CA TYR A 32 -7.996 10.347 -12.596 1.00 0.00 C ATOM 475 C TYR A 32 -7.156 9.299 -13.327 1.00 0.00 C ATOM 476 O TYR A 32 -6.389 9.632 -14.229 1.00 0.00 O ATOM 477 CB TYR A 32 -7.516 10.449 -11.146 1.00 0.00 C ATOM 478 CG TYR A 32 -8.319 11.405 -10.292 1.00 0.00 C ATOM 479 CD1 TYR A 32 -9.628 11.112 -9.928 1.00 0.00 C ATOM 480 CD2 TYR A 32 -7.765 12.598 -9.843 1.00 0.00 C ATOM 481 CE1 TYR A 32 -10.361 11.980 -9.141 1.00 0.00 C ATOM 482 CE2 TYR A 32 -8.492 13.472 -9.057 1.00 0.00 C ATOM 483 CZ TYR A 32 -9.789 13.157 -8.709 1.00 0.00 C ATOM 484 OH TYR A 32 -10.515 14.024 -7.925 1.00 0.00 O ATOM 0 H TYR A 32 -9.660 9.062 -12.515 1.00 0.00 H new ATOM 0 HA TYR A 32 -7.863 11.303 -13.102 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -7.551 9.458 -10.693 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -6.473 10.765 -11.142 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -10.080 10.191 -10.266 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -6.749 12.846 -10.113 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -11.377 11.737 -8.866 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -8.047 14.396 -8.717 1.00 0.00 H new ATOM 0 HH TYR A 32 -9.965 14.805 -7.706 1.00 0.00 H new ATOM 494 N ASN A 33 -7.288 8.040 -12.922 1.00 0.00 N ATOM 495 CA ASN A 33 -6.520 6.958 -13.533 1.00 0.00 C ATOM 496 C ASN A 33 -5.024 7.154 -13.282 1.00 0.00 C ATOM 497 O ASN A 33 -4.216 7.107 -14.210 1.00 0.00 O ATOM 498 CB ASN A 33 -6.793 6.878 -15.040 1.00 0.00 C ATOM 499 CG ASN A 33 -5.995 5.782 -15.722 1.00 0.00 C ATOM 500 OD1 ASN A 33 -6.121 4.606 -15.385 1.00 0.00 O ATOM 501 ND2 ASN A 33 -5.168 6.167 -16.686 1.00 0.00 N ATOM 0 H ASN A 33 -7.917 7.743 -12.176 1.00 0.00 H new ATOM 0 HA ASN A 33 -6.835 6.021 -13.074 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -7.856 6.703 -15.204 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -6.553 7.837 -15.500 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -4.604 5.476 -17.181 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -5.096 7.154 -16.932 1.00 0.00 H new ATOM 508 N ILE A 34 -4.659 7.376 -12.022 1.00 0.00 N ATOM 509 CA ILE A 34 -3.260 7.578 -11.664 1.00 0.00 C ATOM 510 C ILE A 34 -2.898 6.794 -10.402 1.00 0.00 C ATOM 511 O ILE A 34 -2.021 7.196 -9.639 1.00 0.00 O ATOM 512 CB ILE A 34 -2.948 9.073 -11.447 1.00 0.00 C ATOM 513 CG1 ILE A 34 -3.399 9.889 -12.659 1.00 0.00 C ATOM 514 CG2 ILE A 34 -1.459 9.278 -11.194 1.00 0.00 C ATOM 515 CD1 ILE A 34 -3.151 11.374 -12.516 1.00 0.00 C ATOM 0 H ILE A 34 -5.309 7.420 -11.237 1.00 0.00 H new ATOM 0 HA ILE A 34 -2.659 7.211 -12.496 1.00 0.00 H new ATOM 0 HB ILE A 34 -3.496 9.417 -10.570 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -2.878 9.526 -13.545 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -4.463 9.721 -12.824 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -1.258 10.339 -11.043 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -1.161 8.722 -10.305 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -0.891 8.920 -12.053 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -3.496 11.888 -13.413 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -3.694 11.752 -11.650 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -2.084 11.554 -12.382 1.00 0.00 H new ATOM 527 N GLU A 35 -3.573 5.665 -10.208 1.00 0.00 N ATOM 528 CA GLU A 35 -3.332 4.795 -9.057 1.00 0.00 C ATOM 529 C GLU A 35 -3.563 5.521 -7.732 1.00 0.00 C ATOM 530 O GLU A 35 -4.522 5.234 -7.017 1.00 0.00 O ATOM 531 CB GLU A 35 -1.905 4.249 -9.105 1.00 0.00 C ATOM 532 CG GLU A 35 -1.599 3.456 -10.366 1.00 0.00 C ATOM 533 CD GLU A 35 -0.170 2.948 -10.407 1.00 0.00 C ATOM 534 OE1 GLU A 35 0.585 3.212 -9.448 1.00 0.00 O ATOM 535 OE2 GLU A 35 0.195 2.284 -11.401 1.00 0.00 O ATOM 0 H GLU A 35 -4.299 5.327 -10.839 1.00 0.00 H new ATOM 0 HA GLU A 35 -4.045 3.972 -9.113 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -1.204 5.080 -9.030 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -1.739 3.612 -8.236 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -2.283 2.610 -10.433 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -1.782 4.084 -11.238 1.00 0.00 H new ATOM 542 N LYS A 36 -2.673 6.453 -7.407 1.00 0.00 N ATOM 543 CA LYS A 36 -2.775 7.212 -6.163 1.00 0.00 C ATOM 544 C LYS A 36 -4.099 7.966 -6.086 1.00 0.00 C ATOM 545 O LYS A 36 -4.844 7.838 -5.114 1.00 0.00 O ATOM 546 CB LYS A 36 -1.624 8.207 -6.054 1.00 0.00 C ATOM 547 CG LYS A 36 -1.616 8.981 -4.746 1.00 0.00 C ATOM 548 CD LYS A 36 -0.758 10.230 -4.846 1.00 0.00 C ATOM 549 CE LYS A 36 -1.402 11.272 -5.745 1.00 0.00 C ATOM 550 NZ LYS A 36 -2.712 11.735 -5.209 1.00 0.00 N ATOM 0 H LYS A 36 -1.872 6.702 -7.987 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.726 6.502 -5.337 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -0.680 7.672 -6.156 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -1.683 8.911 -6.884 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -2.636 9.259 -4.480 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -1.240 8.343 -3.946 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -0.605 10.649 -3.852 1.00 0.00 H new ATOM 0 HD3 LYS A 36 0.225 9.968 -5.236 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -0.731 12.125 -5.851 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -1.545 10.853 -6.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -2.957 12.652 -5.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -3.448 11.038 -5.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -2.647 11.839 -4.176 1.00 0.00 H new ATOM 564 N ASP A 37 -4.380 8.757 -7.115 1.00 0.00 N ATOM 565 CA ASP A 37 -5.610 9.542 -7.167 1.00 0.00 C ATOM 566 C ASP A 37 -6.827 8.655 -6.936 1.00 0.00 C ATOM 567 O ASP A 37 -7.764 9.034 -6.232 1.00 0.00 O ATOM 568 CB ASP A 37 -5.730 10.252 -8.517 1.00 0.00 C ATOM 569 CG ASP A 37 -4.582 11.209 -8.770 1.00 0.00 C ATOM 570 OD1 ASP A 37 -3.420 10.751 -8.786 1.00 0.00 O ATOM 571 OD2 ASP A 37 -4.844 12.416 -8.953 1.00 0.00 O ATOM 0 H ASP A 37 -3.773 8.873 -7.926 1.00 0.00 H new ATOM 0 HA ASP A 37 -5.570 10.290 -6.375 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -5.762 9.509 -9.314 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -6.671 10.800 -8.554 1.00 0.00 H new ATOM 576 N ILE A 38 -6.800 7.468 -7.529 1.00 0.00 N ATOM 577 CA ILE A 38 -7.890 6.513 -7.389 1.00 0.00 C ATOM 578 C ILE A 38 -8.181 6.233 -5.916 1.00 0.00 C ATOM 579 O ILE A 38 -9.325 6.307 -5.467 1.00 0.00 O ATOM 580 CB ILE A 38 -7.547 5.184 -8.099 1.00 0.00 C ATOM 581 CG1 ILE A 38 -7.322 5.425 -9.593 1.00 0.00 C ATOM 582 CG2 ILE A 38 -8.645 4.151 -7.878 1.00 0.00 C ATOM 583 CD1 ILE A 38 -6.985 4.168 -10.365 1.00 0.00 C ATOM 0 H ILE A 38 -6.030 7.143 -8.114 1.00 0.00 H new ATOM 0 HA ILE A 38 -8.774 6.952 -7.852 1.00 0.00 H new ATOM 0 HB ILE A 38 -6.626 4.791 -7.668 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -8.219 5.874 -10.019 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -6.514 6.146 -9.719 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -8.381 3.224 -8.387 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -8.755 3.960 -6.811 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -9.586 4.529 -8.278 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -6.839 4.415 -11.417 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -6.071 3.729 -9.965 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -7.802 3.453 -10.270 1.00 0.00 H new ATOM 595 N ALA A 39 -7.128 5.915 -5.174 1.00 0.00 N ATOM 596 CA ALA A 39 -7.244 5.619 -3.753 1.00 0.00 C ATOM 597 C ALA A 39 -7.657 6.847 -2.947 1.00 0.00 C ATOM 598 O ALA A 39 -8.300 6.728 -1.905 1.00 0.00 O ATOM 599 CB ALA A 39 -5.927 5.069 -3.229 1.00 0.00 C ATOM 0 H ALA A 39 -6.177 5.855 -5.537 1.00 0.00 H new ATOM 0 HA ALA A 39 -8.027 4.870 -3.634 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -6.022 4.850 -2.165 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.675 4.155 -3.767 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -5.139 5.807 -3.379 1.00 0.00 H new ATOM 605 N ALA A 40 -7.265 8.025 -3.418 1.00 0.00 N ATOM 606 CA ALA A 40 -7.576 9.266 -2.717 1.00 0.00 C ATOM 607 C ALA A 40 -9.078 9.533 -2.640 1.00 0.00 C ATOM 608 O ALA A 40 -9.625 9.735 -1.556 1.00 0.00 O ATOM 609 CB ALA A 40 -6.871 10.436 -3.388 1.00 0.00 C ATOM 0 H ALA A 40 -6.733 8.147 -4.280 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.216 9.157 -1.694 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.110 11.358 -2.857 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -5.794 10.273 -3.365 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -7.204 10.517 -4.423 1.00 0.00 H new ATOM 615 N HIS A 41 -9.735 9.556 -3.793 1.00 0.00 N ATOM 616 CA HIS A 41 -11.167 9.828 -3.846 1.00 0.00 C ATOM 617 C HIS A 41 -11.988 8.675 -3.259 1.00 0.00 C ATOM 618 O HIS A 41 -12.926 8.894 -2.494 1.00 0.00 O ATOM 619 CB HIS A 41 -11.589 10.116 -5.294 1.00 0.00 C ATOM 620 CG HIS A 41 -12.246 8.963 -5.989 1.00 0.00 C ATOM 621 ND1 HIS A 41 -13.557 8.601 -5.760 1.00 0.00 N ATOM 622 CD2 HIS A 41 -11.768 8.088 -6.902 1.00 0.00 C ATOM 623 CE1 HIS A 41 -13.858 7.555 -6.504 1.00 0.00 C ATOM 624 NE2 HIS A 41 -12.792 7.223 -7.207 1.00 0.00 N ATOM 0 H HIS A 41 -9.301 9.390 -4.701 1.00 0.00 H new ATOM 0 HA HIS A 41 -11.367 10.707 -3.233 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -12.273 10.964 -5.298 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -10.709 10.414 -5.864 1.00 0.00 H new ATOM 0 HD1 HIS A 41 -14.194 9.069 -5.116 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -10.770 8.072 -7.314 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -14.815 7.055 -6.533 1.00 0.00 H new ATOM 633 N ILE A 42 -11.639 7.446 -3.632 1.00 0.00 N ATOM 634 CA ILE A 42 -12.358 6.272 -3.148 1.00 0.00 C ATOM 635 C ILE A 42 -12.237 6.118 -1.632 1.00 0.00 C ATOM 636 O ILE A 42 -13.228 5.873 -0.944 1.00 0.00 O ATOM 637 CB ILE A 42 -11.853 4.979 -3.823 1.00 0.00 C ATOM 638 CG1 ILE A 42 -11.993 5.082 -5.338 1.00 0.00 C ATOM 639 CG2 ILE A 42 -12.611 3.765 -3.300 1.00 0.00 C ATOM 640 CD1 ILE A 42 -11.437 3.880 -6.065 1.00 0.00 C ATOM 0 H ILE A 42 -10.866 7.238 -4.265 1.00 0.00 H new ATOM 0 HA ILE A 42 -13.405 6.428 -3.407 1.00 0.00 H new ATOM 0 HB ILE A 42 -10.798 4.854 -3.578 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -13.046 5.199 -5.593 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -11.480 5.979 -5.685 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -12.239 2.865 -3.789 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -12.464 3.680 -2.223 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -13.674 3.880 -3.513 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -11.566 4.013 -7.139 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -10.376 3.776 -5.837 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -11.967 2.983 -5.744 1.00 0.00 H new ATOM 652 N LYS A 43 -11.017 6.241 -1.121 1.00 0.00 N ATOM 653 CA LYS A 43 -10.773 6.093 0.310 1.00 0.00 C ATOM 654 C LYS A 43 -11.522 7.153 1.113 1.00 0.00 C ATOM 655 O LYS A 43 -12.247 6.829 2.051 1.00 0.00 O ATOM 656 CB LYS A 43 -9.269 6.168 0.600 1.00 0.00 C ATOM 657 CG LYS A 43 -8.868 5.696 1.994 1.00 0.00 C ATOM 658 CD LYS A 43 -9.373 6.621 3.095 1.00 0.00 C ATOM 659 CE LYS A 43 -8.915 8.054 2.879 1.00 0.00 C ATOM 660 NZ LYS A 43 -9.339 8.949 3.993 1.00 0.00 N ATOM 0 H LYS A 43 -10.184 6.442 -1.674 1.00 0.00 H new ATOM 0 HA LYS A 43 -11.146 5.116 0.617 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -8.739 5.567 -0.139 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -8.938 7.198 0.470 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.259 4.692 2.160 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -7.782 5.628 2.052 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -10.462 6.588 3.127 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -9.015 6.266 4.061 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -7.829 8.078 2.788 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -9.322 8.427 1.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -8.978 9.909 3.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -10.378 8.973 4.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -8.958 8.589 4.891 1.00 0.00 H new ATOM 674 N LYS A 44 -11.341 8.421 0.754 1.00 0.00 N ATOM 675 CA LYS A 44 -11.999 9.510 1.471 1.00 0.00 C ATOM 676 C LYS A 44 -13.517 9.349 1.467 1.00 0.00 C ATOM 677 O LYS A 44 -14.183 9.694 2.441 1.00 0.00 O ATOM 678 CB LYS A 44 -11.586 10.871 0.895 1.00 0.00 C ATOM 679 CG LYS A 44 -11.959 11.082 -0.566 1.00 0.00 C ATOM 680 CD LYS A 44 -13.376 11.619 -0.719 1.00 0.00 C ATOM 681 CE LYS A 44 -13.711 11.901 -2.175 1.00 0.00 C ATOM 682 NZ LYS A 44 -15.093 12.431 -2.335 1.00 0.00 N ATOM 0 H LYS A 44 -10.750 8.719 -0.022 1.00 0.00 H new ATOM 0 HA LYS A 44 -11.671 9.467 2.509 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -12.048 11.658 1.491 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -10.507 10.983 1.000 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -11.256 11.778 -1.023 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -11.869 10.138 -1.104 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -14.085 10.897 -0.315 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -13.485 12.533 -0.136 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -12.998 12.620 -2.579 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -13.604 10.985 -2.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -15.282 12.610 -3.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -15.776 11.735 -1.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -15.188 13.319 -1.802 1.00 0.00 H new ATOM 696 N GLU A 45 -14.062 8.821 0.375 1.00 0.00 N ATOM 697 CA GLU A 45 -15.504 8.621 0.278 1.00 0.00 C ATOM 698 C GLU A 45 -15.977 7.616 1.324 1.00 0.00 C ATOM 699 O GLU A 45 -16.898 7.892 2.093 1.00 0.00 O ATOM 700 CB GLU A 45 -15.882 8.138 -1.123 1.00 0.00 C ATOM 701 CG GLU A 45 -17.375 7.918 -1.309 1.00 0.00 C ATOM 702 CD GLU A 45 -17.726 7.439 -2.704 1.00 0.00 C ATOM 703 OE1 GLU A 45 -17.235 6.363 -3.105 1.00 0.00 O ATOM 704 OE2 GLU A 45 -18.492 8.142 -3.397 1.00 0.00 O ATOM 0 H GLU A 45 -13.534 8.527 -0.447 1.00 0.00 H new ATOM 0 HA GLU A 45 -15.996 9.576 0.465 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -15.537 8.868 -1.855 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -15.357 7.205 -1.331 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -17.724 7.187 -0.580 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -17.904 8.849 -1.105 1.00 0.00 H new ATOM 711 N PHE A 46 -15.334 6.454 1.355 1.00 0.00 N ATOM 712 CA PHE A 46 -15.682 5.411 2.316 1.00 0.00 C ATOM 713 C PHE A 46 -15.374 5.861 3.742 1.00 0.00 C ATOM 714 O PHE A 46 -16.175 5.665 4.655 1.00 0.00 O ATOM 715 CB PHE A 46 -14.921 4.123 2.001 1.00 0.00 C ATOM 716 CG PHE A 46 -15.430 3.387 0.795 1.00 0.00 C ATOM 717 CD1 PHE A 46 -16.704 2.845 0.788 1.00 0.00 C ATOM 718 CD2 PHE A 46 -14.633 3.230 -0.327 1.00 0.00 C ATOM 719 CE1 PHE A 46 -17.175 2.158 -0.315 1.00 0.00 C ATOM 720 CE2 PHE A 46 -15.098 2.544 -1.435 1.00 0.00 C ATOM 721 CZ PHE A 46 -16.371 2.007 -1.429 1.00 0.00 C ATOM 0 H PHE A 46 -14.569 6.210 0.726 1.00 0.00 H new ATOM 0 HA PHE A 46 -16.752 5.221 2.236 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -13.869 4.364 1.849 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -14.975 3.462 2.866 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -17.338 2.960 1.655 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -13.637 3.648 -0.337 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -18.171 1.739 -0.306 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -14.467 2.428 -2.304 1.00 0.00 H new ATOM 0 HZ PHE A 46 -16.737 1.471 -2.292 1.00 0.00 H new ATOM 731 N ASP A 47 -14.203 6.461 3.918 1.00 0.00 N ATOM 732 CA ASP A 47 -13.761 6.946 5.219 1.00 0.00 C ATOM 733 C ASP A 47 -14.821 7.841 5.853 1.00 0.00 C ATOM 734 O ASP A 47 -15.124 7.727 7.041 1.00 0.00 O ATOM 735 CB ASP A 47 -12.459 7.734 5.047 1.00 0.00 C ATOM 736 CG ASP A 47 -11.707 7.925 6.346 1.00 0.00 C ATOM 737 OD1 ASP A 47 -11.157 6.929 6.861 1.00 0.00 O ATOM 738 OD2 ASP A 47 -11.667 9.067 6.848 1.00 0.00 O ATOM 0 H ASP A 47 -13.535 6.625 3.165 1.00 0.00 H new ATOM 0 HA ASP A 47 -13.596 6.091 5.875 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -11.818 7.214 4.335 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -12.686 8.710 4.618 1.00 0.00 H new ATOM 743 N LYS A 48 -15.369 8.737 5.044 1.00 0.00 N ATOM 744 CA LYS A 48 -16.387 9.678 5.493 1.00 0.00 C ATOM 745 C LYS A 48 -17.772 9.035 5.570 1.00 0.00 C ATOM 746 O LYS A 48 -18.516 9.254 6.527 1.00 0.00 O ATOM 747 CB LYS A 48 -16.414 10.875 4.541 1.00 0.00 C ATOM 748 CG LYS A 48 -17.542 11.852 4.810 1.00 0.00 C ATOM 749 CD LYS A 48 -17.452 12.438 6.209 1.00 0.00 C ATOM 750 CE LYS A 48 -16.155 13.204 6.411 1.00 0.00 C ATOM 751 NZ LYS A 48 -16.022 14.333 5.449 1.00 0.00 N ATOM 0 H LYS A 48 -15.121 8.832 4.059 1.00 0.00 H new ATOM 0 HA LYS A 48 -16.129 10.003 6.501 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -15.464 11.404 4.612 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -16.499 10.510 3.517 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -17.510 12.656 4.075 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -18.500 11.346 4.688 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -18.299 13.103 6.381 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -17.521 11.637 6.945 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -16.115 13.589 7.430 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -15.310 12.525 6.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -15.226 14.940 5.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -15.847 13.957 4.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -16.899 14.892 5.446 1.00 0.00 H new ATOM 765 N LYS A 49 -18.120 8.267 4.548 1.00 0.00 N ATOM 766 CA LYS A 49 -19.426 7.615 4.480 1.00 0.00 C ATOM 767 C LYS A 49 -19.552 6.463 5.464 1.00 0.00 C ATOM 768 O LYS A 49 -20.370 6.498 6.383 1.00 0.00 O ATOM 769 CB LYS A 49 -19.682 7.108 3.060 1.00 0.00 C ATOM 770 CG LYS A 49 -19.823 8.218 2.036 1.00 0.00 C ATOM 771 CD LYS A 49 -20.956 9.156 2.404 1.00 0.00 C ATOM 772 CE LYS A 49 -21.124 10.260 1.373 1.00 0.00 C ATOM 773 NZ LYS A 49 -19.896 11.090 1.241 1.00 0.00 N ATOM 0 H LYS A 49 -17.515 8.077 3.749 1.00 0.00 H new ATOM 0 HA LYS A 49 -20.173 8.361 4.752 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -18.863 6.453 2.764 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -20.590 6.504 3.057 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -18.890 8.777 1.970 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -20.007 7.788 1.051 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -21.884 8.591 2.488 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -20.762 9.597 3.382 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -21.370 9.820 0.407 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -21.963 10.896 1.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -20.112 11.944 0.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -19.559 11.365 2.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -19.157 10.542 0.756 1.00 0.00 H new ATOM 787 N TYR A 50 -18.754 5.435 5.246 1.00 0.00 N ATOM 788 CA TYR A 50 -18.780 4.245 6.089 1.00 0.00 C ATOM 789 C TYR A 50 -18.014 4.444 7.393 1.00 0.00 C ATOM 790 O TYR A 50 -18.109 3.617 8.298 1.00 0.00 O ATOM 791 CB TYR A 50 -18.233 3.045 5.316 1.00 0.00 C ATOM 792 CG TYR A 50 -19.087 2.675 4.123 1.00 0.00 C ATOM 793 CD1 TYR A 50 -19.287 3.573 3.081 1.00 0.00 C ATOM 794 CD2 TYR A 50 -19.705 1.433 4.043 1.00 0.00 C ATOM 795 CE1 TYR A 50 -20.075 3.247 1.998 1.00 0.00 C ATOM 796 CE2 TYR A 50 -20.494 1.097 2.960 1.00 0.00 C ATOM 797 CZ TYR A 50 -20.676 2.008 1.939 1.00 0.00 C ATOM 798 OH TYR A 50 -21.463 1.679 0.860 1.00 0.00 O ATOM 0 H TYR A 50 -18.073 5.396 4.487 1.00 0.00 H new ATOM 0 HA TYR A 50 -19.818 4.054 6.360 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -17.221 3.268 4.977 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -18.163 2.188 5.986 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -18.816 4.544 3.121 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -19.566 0.718 4.841 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -20.221 3.959 1.199 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -20.966 0.127 2.912 1.00 0.00 H new ATOM 0 HH TYR A 50 -21.810 0.770 0.974 1.00 0.00 H new ATOM 808 N ASN A 51 -17.257 5.542 7.479 1.00 0.00 N ATOM 809 CA ASN A 51 -16.464 5.870 8.671 1.00 0.00 C ATOM 810 C ASN A 51 -15.046 5.334 8.530 1.00 0.00 C ATOM 811 O ASN A 51 -14.827 4.277 7.940 1.00 0.00 O ATOM 812 CB ASN A 51 -17.103 5.332 9.955 1.00 0.00 C ATOM 813 CG ASN A 51 -18.549 5.761 10.108 1.00 0.00 C ATOM 814 OD1 ASN A 51 -18.854 6.953 10.160 1.00 0.00 O ATOM 815 ND2 ASN A 51 -19.450 4.788 10.182 1.00 0.00 N ATOM 0 H ASN A 51 -17.176 6.227 6.728 1.00 0.00 H new ATOM 0 HA ASN A 51 -16.434 6.957 8.748 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -17.048 4.243 9.956 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -16.531 5.680 10.815 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -20.439 5.015 10.286 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -19.153 3.813 10.135 1.00 0.00 H new ATOM 822 N PRO A 52 -14.058 6.067 9.064 1.00 0.00 N ATOM 823 CA PRO A 52 -12.652 5.670 8.982 1.00 0.00 C ATOM 824 C PRO A 52 -12.342 4.395 9.772 1.00 0.00 C ATOM 825 O PRO A 52 -13.168 3.934 10.560 1.00 0.00 O ATOM 826 CB PRO A 52 -11.905 6.864 9.588 1.00 0.00 C ATOM 827 CG PRO A 52 -12.906 7.531 10.464 1.00 0.00 C ATOM 828 CD PRO A 52 -14.230 7.346 9.779 1.00 0.00 C ATOM 0 HA PRO A 52 -12.364 5.439 7.956 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -11.035 6.539 10.158 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -11.544 7.540 8.813 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -12.914 7.086 11.459 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -12.674 8.589 10.589 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -15.052 7.301 10.494 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -14.448 8.165 9.094 1.00 0.00 H new ATOM 836 N THR A 53 -11.146 3.819 9.564 1.00 0.00 N ATOM 837 CA THR A 53 -10.162 4.362 8.632 1.00 0.00 C ATOM 838 C THR A 53 -9.918 3.393 7.483 1.00 0.00 C ATOM 839 O THR A 53 -9.599 2.227 7.702 1.00 0.00 O ATOM 840 CB THR A 53 -8.855 4.652 9.367 1.00 0.00 C ATOM 841 OG1 THR A 53 -7.923 5.286 8.508 1.00 0.00 O ATOM 842 CG2 THR A 53 -8.190 3.414 9.928 1.00 0.00 C ATOM 0 H THR A 53 -10.842 2.969 10.038 1.00 0.00 H new ATOM 0 HA THR A 53 -10.551 5.292 8.217 1.00 0.00 H new ATOM 0 HB THR A 53 -9.134 5.301 10.197 1.00 0.00 H new ATOM 0 HG1 THR A 53 -7.019 5.180 8.871 1.00 0.00 H new ATOM 0 HG21 THR A 53 -7.268 3.695 10.436 1.00 0.00 H new ATOM 0 HG22 THR A 53 -8.862 2.930 10.637 1.00 0.00 H new ATOM 0 HG23 THR A 53 -7.961 2.724 9.116 1.00 0.00 H new ATOM 850 N TRP A 54 -10.082 3.883 6.257 1.00 0.00 N ATOM 851 CA TRP A 54 -9.894 3.052 5.073 1.00 0.00 C ATOM 852 C TRP A 54 -8.515 3.234 4.460 1.00 0.00 C ATOM 853 O TRP A 54 -8.059 4.354 4.236 1.00 0.00 O ATOM 854 CB TRP A 54 -10.965 3.363 4.034 1.00 0.00 C ATOM 855 CG TRP A 54 -12.345 3.073 4.521 1.00 0.00 C ATOM 856 CD1 TRP A 54 -12.973 3.653 5.583 1.00 0.00 C ATOM 857 CD2 TRP A 54 -13.266 2.124 3.976 1.00 0.00 C ATOM 858 NE1 TRP A 54 -14.231 3.129 5.731 1.00 0.00 N ATOM 859 CE2 TRP A 54 -14.437 2.186 4.754 1.00 0.00 C ATOM 860 CE3 TRP A 54 -13.215 1.230 2.903 1.00 0.00 C ATOM 861 CZ2 TRP A 54 -15.548 1.390 4.490 1.00 0.00 C ATOM 862 CZ3 TRP A 54 -14.318 0.438 2.644 1.00 0.00 C ATOM 863 CH2 TRP A 54 -15.471 0.523 3.434 1.00 0.00 C ATOM 0 H TRP A 54 -10.344 4.849 6.059 1.00 0.00 H new ATOM 0 HA TRP A 54 -9.982 2.013 5.391 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -10.897 4.414 3.753 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -10.772 2.779 3.134 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -12.542 4.415 6.216 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -14.904 3.396 6.449 1.00 0.00 H new ATOM 0 HE3 TRP A 54 -12.330 1.159 2.288 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -16.439 1.454 5.097 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 -14.290 -0.258 1.819 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -16.317 -0.109 3.205 1.00 0.00 H new ATOM 874 N HIS A 55 -7.861 2.117 4.181 1.00 0.00 N ATOM 875 CA HIS A 55 -6.539 2.133 3.580 1.00 0.00 C ATOM 876 C HIS A 55 -6.627 1.602 2.155 1.00 0.00 C ATOM 877 O HIS A 55 -7.340 0.631 1.897 1.00 0.00 O ATOM 878 CB HIS A 55 -5.591 1.288 4.421 1.00 0.00 C ATOM 879 CG HIS A 55 -5.798 1.492 5.889 1.00 0.00 C ATOM 880 ND1 HIS A 55 -5.743 2.730 6.490 1.00 0.00 N ATOM 881 CD2 HIS A 55 -6.081 0.612 6.873 1.00 0.00 C ATOM 882 CE1 HIS A 55 -5.977 2.605 7.780 1.00 0.00 C ATOM 883 NE2 HIS A 55 -6.186 1.327 8.042 1.00 0.00 N ATOM 0 H HIS A 55 -8.228 1.183 4.363 1.00 0.00 H new ATOM 0 HA HIS A 55 -6.154 3.152 3.546 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -5.735 0.235 4.179 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -4.561 1.536 4.164 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -6.202 -0.455 6.762 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -5.995 3.409 8.500 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -6.392 0.935 8.961 1.00 0.00 H new ATOM 892 N CYS A 56 -5.933 2.249 1.223 1.00 0.00 N ATOM 893 CA CYS A 56 -5.989 1.824 -0.171 1.00 0.00 C ATOM 894 C CYS A 56 -4.632 1.929 -0.863 1.00 0.00 C ATOM 895 O CYS A 56 -3.806 2.776 -0.526 1.00 0.00 O ATOM 896 CB CYS A 56 -7.026 2.651 -0.931 1.00 0.00 C ATOM 897 SG CYS A 56 -7.225 2.179 -2.665 1.00 0.00 S ATOM 0 H CYS A 56 -5.335 3.056 1.403 1.00 0.00 H new ATOM 0 HA CYS A 56 -6.279 0.773 -0.177 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -7.988 2.557 -0.428 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -6.742 3.702 -0.883 1.00 0.00 H new ATOM 0 HG CYS A 56 -7.271 0.883 -2.759 1.00 0.00 H new ATOM 903 N ILE A 57 -4.426 1.048 -1.838 1.00 0.00 N ATOM 904 CA ILE A 57 -3.190 1.006 -2.607 1.00 0.00 C ATOM 905 C ILE A 57 -3.478 0.518 -4.024 1.00 0.00 C ATOM 906 O ILE A 57 -4.389 -0.282 -4.235 1.00 0.00 O ATOM 907 CB ILE A 57 -2.153 0.074 -1.946 1.00 0.00 C ATOM 908 CG1 ILE A 57 -1.913 0.491 -0.495 1.00 0.00 C ATOM 909 CG2 ILE A 57 -0.848 0.088 -2.726 1.00 0.00 C ATOM 910 CD1 ILE A 57 -0.912 -0.383 0.229 1.00 0.00 C ATOM 0 H ILE A 57 -5.111 0.345 -2.115 1.00 0.00 H new ATOM 0 HA ILE A 57 -2.778 2.015 -2.638 1.00 0.00 H new ATOM 0 HB ILE A 57 -2.547 -0.942 -1.955 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -1.563 1.523 -0.476 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -2.861 0.466 0.043 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -0.129 -0.575 -2.245 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -1.030 -0.253 -3.745 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -0.448 1.102 -2.748 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.792 -0.028 1.253 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -1.270 -1.412 0.242 1.00 0.00 H new ATOM 0 HD13 ILE A 57 0.048 -0.339 -0.285 1.00 0.00 H new ATOM 922 N VAL A 58 -2.716 1.009 -4.999 1.00 0.00 N ATOM 923 CA VAL A 58 -2.929 0.617 -6.386 1.00 0.00 C ATOM 924 C VAL A 58 -1.652 0.745 -7.208 1.00 0.00 C ATOM 925 O VAL A 58 -0.909 1.717 -7.082 1.00 0.00 O ATOM 926 CB VAL A 58 -4.037 1.467 -7.042 1.00 0.00 C ATOM 927 CG1 VAL A 58 -4.292 1.016 -8.474 1.00 0.00 C ATOM 928 CG2 VAL A 58 -5.315 1.400 -6.219 1.00 0.00 C ATOM 0 H VAL A 58 -1.954 1.672 -4.855 1.00 0.00 H new ATOM 0 HA VAL A 58 -3.237 -0.429 -6.371 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.701 2.503 -7.072 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -5.077 1.630 -8.915 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.377 1.123 -9.057 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -4.604 -0.028 -8.476 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -6.087 2.005 -6.695 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -5.653 0.366 -6.155 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -5.122 1.781 -5.216 1.00 0.00 H new ATOM 938 N GLY A 59 -1.410 -0.252 -8.054 1.00 0.00 N ATOM 939 CA GLY A 59 -0.230 -0.251 -8.897 1.00 0.00 C ATOM 940 C GLY A 59 -0.161 -1.484 -9.775 1.00 0.00 C ATOM 941 O GLY A 59 -1.171 -1.911 -10.334 1.00 0.00 O ATOM 0 H GLY A 59 -2.015 -1.065 -8.170 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -0.232 0.641 -9.524 1.00 0.00 H new ATOM 0 HA3 GLY A 59 0.662 -0.200 -8.273 1.00 0.00 H new ATOM 945 N ARG A 60 1.027 -2.068 -9.892 1.00 0.00 N ATOM 946 CA ARG A 60 1.202 -3.271 -10.708 1.00 0.00 C ATOM 947 C ARG A 60 2.633 -3.801 -10.640 1.00 0.00 C ATOM 948 O ARG A 60 3.173 -4.279 -11.634 1.00 0.00 O ATOM 949 CB ARG A 60 0.806 -2.991 -12.162 1.00 0.00 C ATOM 950 CG ARG A 60 1.458 -1.756 -12.770 1.00 0.00 C ATOM 951 CD ARG A 60 2.964 -1.918 -12.916 1.00 0.00 C ATOM 952 NE ARG A 60 3.559 -0.835 -13.695 1.00 0.00 N ATOM 953 CZ ARG A 60 3.310 -0.624 -14.986 1.00 0.00 C ATOM 954 NH1 ARG A 60 2.514 -1.446 -15.660 1.00 0.00 N ATOM 955 NH2 ARG A 60 3.872 0.402 -15.609 1.00 0.00 N ATOM 0 H ARG A 60 1.877 -1.734 -9.438 1.00 0.00 H new ATOM 0 HA ARG A 60 0.547 -4.042 -10.302 1.00 0.00 H new ATOM 0 HB2 ARG A 60 1.065 -3.859 -12.769 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -0.277 -2.877 -12.214 1.00 0.00 H new ATOM 0 HG2 ARG A 60 1.018 -1.559 -13.748 1.00 0.00 H new ATOM 0 HG3 ARG A 60 1.246 -0.889 -12.144 1.00 0.00 H new ATOM 0 HD2 ARG A 60 3.423 -1.948 -11.928 1.00 0.00 H new ATOM 0 HD3 ARG A 60 3.181 -2.872 -13.397 1.00 0.00 H new ATOM 0 HE ARG A 60 4.204 -0.202 -13.222 1.00 0.00 H new ATOM 0 HH11 ARG A 60 2.089 -2.245 -15.189 1.00 0.00 H new ATOM 0 HH12 ARG A 60 2.327 -1.279 -16.649 1.00 0.00 H new ATOM 0 HH21 ARG A 60 4.495 1.029 -15.100 1.00 0.00 H new ATOM 0 HH22 ARG A 60 3.682 0.564 -16.598 1.00 0.00 H new ATOM 969 N ASN A 61 3.230 -3.718 -9.452 1.00 0.00 N ATOM 970 CA ASN A 61 4.598 -4.192 -9.230 1.00 0.00 C ATOM 971 C ASN A 61 5.104 -3.731 -7.863 1.00 0.00 C ATOM 972 O ASN A 61 5.975 -2.864 -7.778 1.00 0.00 O ATOM 973 CB ASN A 61 5.541 -3.674 -10.326 1.00 0.00 C ATOM 974 CG ASN A 61 6.978 -4.159 -10.175 1.00 0.00 C ATOM 975 OD1 ASN A 61 7.874 -3.675 -10.868 1.00 0.00 O ATOM 976 ND2 ASN A 61 7.212 -5.130 -9.294 1.00 0.00 N ATOM 0 H ASN A 61 2.785 -3.324 -8.623 1.00 0.00 H new ATOM 0 HA ASN A 61 4.586 -5.281 -9.263 1.00 0.00 H new ATOM 0 HB2 ASN A 61 5.161 -3.987 -11.298 1.00 0.00 H new ATOM 0 HB3 ASN A 61 5.531 -2.584 -10.316 1.00 0.00 H new ATOM 0 HD21 ASN A 61 8.157 -5.496 -9.177 1.00 0.00 H new ATOM 0 HD22 ASN A 61 6.446 -5.508 -8.736 1.00 0.00 H new ATOM 983 N PHE A 62 4.558 -4.304 -6.791 1.00 0.00 N ATOM 984 CA PHE A 62 4.974 -3.921 -5.445 1.00 0.00 C ATOM 985 C PHE A 62 4.448 -4.879 -4.383 1.00 0.00 C ATOM 986 O PHE A 62 3.264 -5.216 -4.361 1.00 0.00 O ATOM 987 CB PHE A 62 4.474 -2.514 -5.116 1.00 0.00 C ATOM 988 CG PHE A 62 2.974 -2.418 -5.029 1.00 0.00 C ATOM 989 CD1 PHE A 62 2.196 -2.442 -6.174 1.00 0.00 C ATOM 990 CD2 PHE A 62 2.342 -2.316 -3.799 1.00 0.00 C ATOM 991 CE1 PHE A 62 0.818 -2.364 -6.096 1.00 0.00 C ATOM 992 CE2 PHE A 62 0.966 -2.238 -3.714 1.00 0.00 C ATOM 993 CZ PHE A 62 0.201 -2.262 -4.864 1.00 0.00 C ATOM 0 H PHE A 62 3.837 -5.025 -6.827 1.00 0.00 H new ATOM 0 HA PHE A 62 6.063 -3.954 -5.434 1.00 0.00 H new ATOM 0 HB2 PHE A 62 4.907 -2.195 -4.168 1.00 0.00 H new ATOM 0 HB3 PHE A 62 4.831 -1.822 -5.878 1.00 0.00 H new ATOM 0 HD1 PHE A 62 2.672 -2.523 -7.140 1.00 0.00 H new ATOM 0 HD2 PHE A 62 2.934 -2.297 -2.896 1.00 0.00 H new ATOM 0 HE1 PHE A 62 0.224 -2.383 -6.998 1.00 0.00 H new ATOM 0 HE2 PHE A 62 0.488 -2.158 -2.749 1.00 0.00 H new ATOM 0 HZ PHE A 62 -0.875 -2.201 -4.800 1.00 0.00 H new ATOM 1003 N GLY A 63 5.332 -5.271 -3.476 1.00 0.00 N ATOM 1004 CA GLY A 63 4.939 -6.140 -2.383 1.00 0.00 C ATOM 1005 C GLY A 63 4.117 -5.370 -1.374 1.00 0.00 C ATOM 1006 O GLY A 63 4.392 -4.197 -1.124 1.00 0.00 O ATOM 0 H GLY A 63 6.316 -5.003 -3.477 1.00 0.00 H new ATOM 0 HA2 GLY A 63 4.362 -6.981 -2.767 1.00 0.00 H new ATOM 0 HA3 GLY A 63 5.825 -6.554 -1.901 1.00 0.00 H new ATOM 1010 N SER A 64 3.091 -5.995 -0.809 1.00 0.00 N ATOM 1011 CA SER A 64 2.240 -5.294 0.145 1.00 0.00 C ATOM 1012 C SER A 64 1.908 -6.133 1.373 1.00 0.00 C ATOM 1013 O SER A 64 1.699 -7.343 1.290 1.00 0.00 O ATOM 1014 CB SER A 64 0.946 -4.849 -0.537 1.00 0.00 C ATOM 1015 OG SER A 64 1.214 -3.962 -1.610 1.00 0.00 O ATOM 0 H SER A 64 2.831 -6.965 -0.989 1.00 0.00 H new ATOM 0 HA SER A 64 2.803 -4.427 0.490 1.00 0.00 H new ATOM 0 HB2 SER A 64 0.408 -5.721 -0.908 1.00 0.00 H new ATOM 0 HB3 SER A 64 0.298 -4.360 0.190 1.00 0.00 H new ATOM 0 HG SER A 64 0.429 -3.908 -2.194 1.00 0.00 H new ATOM 1021 N TYR A 65 1.839 -5.448 2.510 1.00 0.00 N ATOM 1022 CA TYR A 65 1.504 -6.066 3.785 1.00 0.00 C ATOM 1023 C TYR A 65 0.733 -5.064 4.632 1.00 0.00 C ATOM 1024 O TYR A 65 1.101 -3.891 4.701 1.00 0.00 O ATOM 1025 CB TYR A 65 2.764 -6.532 4.518 1.00 0.00 C ATOM 1026 CG TYR A 65 2.474 -7.244 5.819 1.00 0.00 C ATOM 1027 CD1 TYR A 65 1.951 -6.559 6.912 1.00 0.00 C ATOM 1028 CD2 TYR A 65 2.709 -8.606 5.954 1.00 0.00 C ATOM 1029 CE1 TYR A 65 1.675 -7.210 8.098 1.00 0.00 C ATOM 1030 CE2 TYR A 65 2.439 -9.265 7.138 1.00 0.00 C ATOM 1031 CZ TYR A 65 1.922 -8.564 8.207 1.00 0.00 C ATOM 1032 OH TYR A 65 1.646 -9.216 9.389 1.00 0.00 O ATOM 0 H TYR A 65 2.015 -4.445 2.572 1.00 0.00 H new ATOM 0 HA TYR A 65 0.886 -6.946 3.604 1.00 0.00 H new ATOM 0 HB2 TYR A 65 3.329 -7.198 3.866 1.00 0.00 H new ATOM 0 HB3 TYR A 65 3.399 -5.669 4.719 1.00 0.00 H new ATOM 0 HD1 TYR A 65 1.758 -5.500 6.831 1.00 0.00 H new ATOM 0 HD2 TYR A 65 3.110 -9.160 5.118 1.00 0.00 H new ATOM 0 HE1 TYR A 65 1.268 -6.663 8.936 1.00 0.00 H new ATOM 0 HE2 TYR A 65 2.632 -10.324 7.226 1.00 0.00 H new ATOM 0 HH TYR A 65 1.875 -10.165 9.301 1.00 0.00 H new ATOM 1042 N VAL A 66 -0.355 -5.513 5.242 1.00 0.00 N ATOM 1043 CA VAL A 66 -1.195 -4.628 6.043 1.00 0.00 C ATOM 1044 C VAL A 66 -1.989 -5.403 7.087 1.00 0.00 C ATOM 1045 O VAL A 66 -2.088 -6.623 7.020 1.00 0.00 O ATOM 1046 CB VAL A 66 -2.193 -3.878 5.134 1.00 0.00 C ATOM 1047 CG1 VAL A 66 -2.976 -2.840 5.920 1.00 0.00 C ATOM 1048 CG2 VAL A 66 -1.477 -3.231 3.958 1.00 0.00 C ATOM 0 H VAL A 66 -0.677 -6.480 5.199 1.00 0.00 H new ATOM 0 HA VAL A 66 -0.533 -3.925 6.548 1.00 0.00 H new ATOM 0 HB VAL A 66 -2.900 -4.610 4.743 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -3.671 -2.328 5.255 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.533 -3.332 6.718 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.287 -2.115 6.353 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -2.202 -2.709 3.333 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.739 -2.520 4.328 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -0.977 -4.000 3.369 1.00 0.00 H new ATOM 1058 N THR A 67 -2.567 -4.679 8.044 1.00 0.00 N ATOM 1059 CA THR A 67 -3.377 -5.286 9.094 1.00 0.00 C ATOM 1060 C THR A 67 -4.706 -4.548 9.197 1.00 0.00 C ATOM 1061 O THR A 67 -4.761 -3.328 9.046 1.00 0.00 O ATOM 1062 CB THR A 67 -2.634 -5.260 10.430 1.00 0.00 C ATOM 1063 OG1 THR A 67 -1.432 -6.003 10.349 1.00 0.00 O ATOM 1064 CG2 THR A 67 -3.444 -5.822 11.578 1.00 0.00 C ATOM 0 H THR A 67 -2.487 -3.664 8.112 1.00 0.00 H new ATOM 0 HA THR A 67 -3.569 -6.329 8.842 1.00 0.00 H new ATOM 0 HB THR A 67 -2.436 -4.207 10.629 1.00 0.00 H new ATOM 0 HG1 THR A 67 -0.970 -5.973 11.213 1.00 0.00 H new ATOM 0 HG21 THR A 67 -2.857 -5.773 12.495 1.00 0.00 H new ATOM 0 HG22 THR A 67 -4.357 -5.238 11.699 1.00 0.00 H new ATOM 0 HG23 THR A 67 -3.702 -6.860 11.367 1.00 0.00 H new ATOM 1072 N HIS A 68 -5.780 -5.297 9.410 1.00 0.00 N ATOM 1073 CA HIS A 68 -7.109 -4.707 9.480 1.00 0.00 C ATOM 1074 C HIS A 68 -8.053 -5.548 10.331 1.00 0.00 C ATOM 1075 O HIS A 68 -7.869 -6.755 10.475 1.00 0.00 O ATOM 1076 CB HIS A 68 -7.662 -4.579 8.065 1.00 0.00 C ATOM 1077 CG HIS A 68 -7.683 -5.886 7.337 1.00 0.00 C ATOM 1078 ND1 HIS A 68 -8.679 -6.825 7.504 1.00 0.00 N ATOM 1079 CD2 HIS A 68 -6.798 -6.430 6.467 1.00 0.00 C ATOM 1080 CE1 HIS A 68 -8.406 -7.887 6.767 1.00 0.00 C ATOM 1081 NE2 HIS A 68 -7.272 -7.673 6.128 1.00 0.00 N ATOM 0 H HIS A 68 -5.757 -6.309 9.537 1.00 0.00 H new ATOM 0 HA HIS A 68 -7.031 -3.726 9.949 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -8.673 -4.175 8.109 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -7.058 -3.865 7.506 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -9.498 -6.717 8.102 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -5.889 -5.971 6.107 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -9.010 -8.780 6.699 1.00 0.00 H new ATOM 1090 N GLU A 69 -9.061 -4.890 10.892 1.00 0.00 N ATOM 1091 CA GLU A 69 -10.045 -5.555 11.733 1.00 0.00 C ATOM 1092 C GLU A 69 -10.733 -6.700 10.971 1.00 0.00 C ATOM 1093 O GLU A 69 -10.098 -7.714 10.689 1.00 0.00 O ATOM 1094 CB GLU A 69 -11.053 -4.525 12.253 1.00 0.00 C ATOM 1095 CG GLU A 69 -12.066 -5.081 13.238 1.00 0.00 C ATOM 1096 CD GLU A 69 -11.423 -5.636 14.494 1.00 0.00 C ATOM 1097 OE1 GLU A 69 -10.627 -6.593 14.382 1.00 0.00 O ATOM 1098 OE2 GLU A 69 -11.712 -5.113 15.589 1.00 0.00 O ATOM 0 H GLU A 69 -9.217 -3.889 10.777 1.00 0.00 H new ATOM 0 HA GLU A 69 -9.544 -6.004 12.590 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -10.508 -3.711 12.731 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -11.587 -4.096 11.405 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -12.768 -4.294 13.513 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -12.643 -5.868 12.753 1.00 0.00 H new ATOM 1105 N THR A 70 -12.022 -6.551 10.638 1.00 0.00 N ATOM 1106 CA THR A 70 -12.746 -7.601 9.919 1.00 0.00 C ATOM 1107 C THR A 70 -14.039 -7.082 9.296 1.00 0.00 C ATOM 1108 O THR A 70 -14.581 -6.058 9.713 1.00 0.00 O ATOM 1109 CB THR A 70 -13.075 -8.768 10.856 1.00 0.00 C ATOM 1110 OG1 THR A 70 -13.815 -8.315 11.976 1.00 0.00 O ATOM 1111 CG2 THR A 70 -11.856 -9.497 11.376 1.00 0.00 C ATOM 0 H THR A 70 -12.577 -5.723 10.853 1.00 0.00 H new ATOM 0 HA THR A 70 -12.091 -7.942 9.117 1.00 0.00 H new ATOM 0 HB THR A 70 -13.654 -9.464 10.249 1.00 0.00 H new ATOM 0 HG1 THR A 70 -14.018 -9.073 12.563 1.00 0.00 H new ATOM 0 HG21 THR A 70 -12.170 -10.309 12.032 1.00 0.00 H new ATOM 0 HG22 THR A 70 -11.291 -9.905 10.538 1.00 0.00 H new ATOM 0 HG23 THR A 70 -11.227 -8.803 11.933 1.00 0.00 H new ATOM 1119 N LYS A 71 -14.526 -7.814 8.296 1.00 0.00 N ATOM 1120 CA LYS A 71 -15.759 -7.466 7.596 1.00 0.00 C ATOM 1121 C LYS A 71 -15.606 -6.173 6.809 1.00 0.00 C ATOM 1122 O LYS A 71 -16.526 -5.355 6.755 1.00 0.00 O ATOM 1123 CB LYS A 71 -16.923 -7.340 8.584 1.00 0.00 C ATOM 1124 CG LYS A 71 -17.201 -8.605 9.384 1.00 0.00 C ATOM 1125 CD LYS A 71 -18.116 -9.574 8.642 1.00 0.00 C ATOM 1126 CE LYS A 71 -17.508 -10.051 7.332 1.00 0.00 C ATOM 1127 NZ LYS A 71 -18.320 -11.128 6.701 1.00 0.00 N ATOM 0 H LYS A 71 -14.078 -8.662 7.950 1.00 0.00 H new ATOM 0 HA LYS A 71 -15.974 -8.270 6.892 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -16.711 -6.525 9.276 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -17.823 -7.066 8.034 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -16.258 -9.102 9.611 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -17.657 -8.336 10.337 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -18.324 -10.434 9.278 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -19.071 -9.088 8.442 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -17.423 -9.210 6.644 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -16.498 -10.417 7.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -17.871 -11.425 5.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -18.380 -11.941 7.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -19.277 -10.771 6.504 1.00 0.00 H new ATOM 1141 N HIS A 72 -14.449 -5.997 6.183 1.00 0.00 N ATOM 1142 CA HIS A 72 -14.199 -4.806 5.384 1.00 0.00 C ATOM 1143 C HIS A 72 -12.851 -4.872 4.675 1.00 0.00 C ATOM 1144 O HIS A 72 -12.051 -3.938 4.743 1.00 0.00 O ATOM 1145 CB HIS A 72 -14.298 -3.543 6.237 1.00 0.00 C ATOM 1146 CG HIS A 72 -13.626 -3.651 7.567 1.00 0.00 C ATOM 1147 ND1 HIS A 72 -12.287 -3.931 7.719 1.00 0.00 N ATOM 1148 CD2 HIS A 72 -14.123 -3.507 8.817 1.00 0.00 C ATOM 1149 CE1 HIS A 72 -11.987 -3.955 9.005 1.00 0.00 C ATOM 1150 NE2 HIS A 72 -13.087 -3.699 9.693 1.00 0.00 N ATOM 0 H HIS A 72 -13.674 -6.660 6.213 1.00 0.00 H new ATOM 0 HA HIS A 72 -14.972 -4.765 4.617 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -13.859 -2.711 5.687 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -15.350 -3.304 6.392 1.00 0.00 H new ATOM 0 HD1 HIS A 72 -11.629 -4.095 6.957 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -15.147 -3.282 9.076 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -11.011 -4.150 9.423 1.00 0.00 H new ATOM 1159 N PHE A 73 -12.624 -5.974 3.973 1.00 0.00 N ATOM 1160 CA PHE A 73 -11.395 -6.169 3.218 1.00 0.00 C ATOM 1161 C PHE A 73 -11.722 -6.613 1.796 1.00 0.00 C ATOM 1162 O PHE A 73 -12.644 -7.398 1.584 1.00 0.00 O ATOM 1163 CB PHE A 73 -10.484 -7.193 3.908 1.00 0.00 C ATOM 1164 CG PHE A 73 -9.295 -7.602 3.078 1.00 0.00 C ATOM 1165 CD1 PHE A 73 -9.453 -8.450 1.993 1.00 0.00 C ATOM 1166 CD2 PHE A 73 -8.027 -7.130 3.375 1.00 0.00 C ATOM 1167 CE1 PHE A 73 -8.370 -8.821 1.220 1.00 0.00 C ATOM 1168 CE2 PHE A 73 -6.939 -7.498 2.606 1.00 0.00 C ATOM 1169 CZ PHE A 73 -7.111 -8.344 1.526 1.00 0.00 C ATOM 0 H PHE A 73 -13.281 -6.752 3.911 1.00 0.00 H new ATOM 0 HA PHE A 73 -10.860 -5.220 3.177 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -10.131 -6.775 4.851 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -11.069 -8.080 4.151 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -10.436 -8.826 1.749 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -7.887 -6.467 4.216 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -8.508 -9.483 0.378 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -5.955 -7.125 2.849 1.00 0.00 H new ATOM 0 HZ PHE A 73 -6.262 -8.631 0.923 1.00 0.00 H new ATOM 1179 N ILE A 74 -10.977 -6.100 0.822 1.00 0.00 N ATOM 1180 CA ILE A 74 -11.222 -6.458 -0.568 1.00 0.00 C ATOM 1181 C ILE A 74 -10.040 -6.106 -1.464 1.00 0.00 C ATOM 1182 O ILE A 74 -9.521 -4.990 -1.432 1.00 0.00 O ATOM 1183 CB ILE A 74 -12.486 -5.757 -1.106 1.00 0.00 C ATOM 1184 CG1 ILE A 74 -12.758 -6.171 -2.555 1.00 0.00 C ATOM 1185 CG2 ILE A 74 -12.341 -4.247 -1.001 1.00 0.00 C ATOM 1186 CD1 ILE A 74 -13.990 -5.521 -3.150 1.00 0.00 C ATOM 0 H ILE A 74 -10.209 -5.444 0.967 1.00 0.00 H new ATOM 0 HA ILE A 74 -11.366 -7.538 -0.589 1.00 0.00 H new ATOM 0 HB ILE A 74 -13.336 -6.066 -0.497 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -11.892 -5.916 -3.166 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -12.871 -7.254 -2.599 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -13.241 -3.767 -1.385 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -12.197 -3.967 0.043 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -11.480 -3.923 -1.585 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -14.120 -5.860 -4.178 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -14.866 -5.797 -2.563 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -13.871 -4.438 -3.138 1.00 0.00 H new ATOM 1198 N TYR A 75 -9.640 -7.079 -2.274 1.00 0.00 N ATOM 1199 CA TYR A 75 -8.538 -6.908 -3.211 1.00 0.00 C ATOM 1200 C TYR A 75 -8.984 -7.348 -4.601 1.00 0.00 C ATOM 1201 O TYR A 75 -9.617 -8.392 -4.749 1.00 0.00 O ATOM 1202 CB TYR A 75 -7.325 -7.723 -2.754 1.00 0.00 C ATOM 1203 CG TYR A 75 -6.103 -7.541 -3.623 1.00 0.00 C ATOM 1204 CD1 TYR A 75 -5.563 -6.281 -3.836 1.00 0.00 C ATOM 1205 CD2 TYR A 75 -5.485 -8.631 -4.223 1.00 0.00 C ATOM 1206 CE1 TYR A 75 -4.442 -6.109 -4.623 1.00 0.00 C ATOM 1207 CE2 TYR A 75 -4.364 -8.469 -5.013 1.00 0.00 C ATOM 1208 CZ TYR A 75 -3.846 -7.206 -5.210 1.00 0.00 C ATOM 1209 OH TYR A 75 -2.729 -7.039 -5.995 1.00 0.00 O ATOM 0 H TYR A 75 -10.069 -8.004 -2.300 1.00 0.00 H new ATOM 0 HA TYR A 75 -8.250 -5.857 -3.245 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -7.076 -7.443 -1.731 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -7.594 -8.779 -2.739 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -6.028 -5.420 -3.378 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -5.888 -9.621 -4.069 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -4.034 -5.121 -4.778 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -3.896 -9.326 -5.474 1.00 0.00 H new ATOM 0 HH TYR A 75 -2.686 -7.758 -6.659 1.00 0.00 H new ATOM 1219 N PHE A 76 -8.684 -6.542 -5.617 1.00 0.00 N ATOM 1220 CA PHE A 76 -9.102 -6.872 -6.976 1.00 0.00 C ATOM 1221 C PHE A 76 -8.369 -6.039 -8.025 1.00 0.00 C ATOM 1222 O PHE A 76 -8.177 -4.833 -7.860 1.00 0.00 O ATOM 1223 CB PHE A 76 -10.613 -6.660 -7.113 1.00 0.00 C ATOM 1224 CG PHE A 76 -11.059 -5.263 -6.784 1.00 0.00 C ATOM 1225 CD1 PHE A 76 -10.888 -4.743 -5.511 1.00 0.00 C ATOM 1226 CD2 PHE A 76 -11.652 -4.469 -7.751 1.00 0.00 C ATOM 1227 CE1 PHE A 76 -11.298 -3.457 -5.211 1.00 0.00 C ATOM 1228 CE2 PHE A 76 -12.065 -3.183 -7.458 1.00 0.00 C ATOM 1229 CZ PHE A 76 -11.887 -2.677 -6.186 1.00 0.00 C ATOM 0 H PHE A 76 -8.162 -5.670 -5.528 1.00 0.00 H new ATOM 0 HA PHE A 76 -8.849 -7.917 -7.154 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -10.913 -6.897 -8.134 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -11.130 -7.361 -6.458 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -10.429 -5.349 -4.744 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -11.794 -4.860 -8.748 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -11.158 -3.063 -4.215 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -12.526 -2.575 -8.223 1.00 0.00 H new ATOM 0 HZ PHE A 76 -12.208 -1.672 -5.954 1.00 0.00 H new ATOM 1239 N TYR A 77 -7.979 -6.697 -9.117 1.00 0.00 N ATOM 1240 CA TYR A 77 -7.285 -6.035 -10.217 1.00 0.00 C ATOM 1241 C TYR A 77 -8.285 -5.416 -11.188 1.00 0.00 C ATOM 1242 O TYR A 77 -9.434 -5.849 -11.263 1.00 0.00 O ATOM 1243 CB TYR A 77 -6.386 -7.024 -10.963 1.00 0.00 C ATOM 1244 CG TYR A 77 -5.236 -7.555 -10.135 1.00 0.00 C ATOM 1245 CD1 TYR A 77 -5.464 -8.283 -8.974 1.00 0.00 C ATOM 1246 CD2 TYR A 77 -3.921 -7.330 -10.520 1.00 0.00 C ATOM 1247 CE1 TYR A 77 -4.414 -8.769 -8.220 1.00 0.00 C ATOM 1248 CE2 TYR A 77 -2.864 -7.813 -9.770 1.00 0.00 C ATOM 1249 CZ TYR A 77 -3.118 -8.532 -8.622 1.00 0.00 C ATOM 1250 OH TYR A 77 -2.068 -9.015 -7.873 1.00 0.00 O ATOM 0 H TYR A 77 -8.134 -7.695 -9.262 1.00 0.00 H new ATOM 0 HA TYR A 77 -6.665 -5.244 -9.795 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -6.992 -7.863 -11.305 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -5.986 -6.536 -11.852 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -6.479 -8.472 -8.656 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -3.720 -6.768 -11.420 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -4.608 -9.332 -7.319 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -1.847 -7.628 -10.082 1.00 0.00 H new ATOM 0 HH TYR A 77 -1.221 -8.761 -8.295 1.00 0.00 H new ATOM 1260 N LEU A 78 -7.847 -4.401 -11.930 1.00 0.00 N ATOM 1261 CA LEU A 78 -8.718 -3.733 -12.893 1.00 0.00 C ATOM 1262 C LEU A 78 -7.913 -3.080 -14.013 1.00 0.00 C ATOM 1263 O LEU A 78 -6.922 -2.393 -13.761 1.00 0.00 O ATOM 1264 CB LEU A 78 -9.574 -2.677 -12.189 1.00 0.00 C ATOM 1265 CG LEU A 78 -10.517 -1.890 -13.102 1.00 0.00 C ATOM 1266 CD1 LEU A 78 -11.465 -2.827 -13.839 1.00 0.00 C ATOM 1267 CD2 LEU A 78 -11.300 -0.866 -12.294 1.00 0.00 C ATOM 0 H LEU A 78 -6.900 -4.025 -11.883 1.00 0.00 H new ATOM 0 HA LEU A 78 -9.366 -4.490 -13.335 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -10.167 -3.168 -11.417 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -8.912 -1.974 -11.683 1.00 0.00 H new ATOM 0 HG LEU A 78 -9.917 -1.364 -13.844 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -12.125 -2.245 -14.482 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -10.888 -3.524 -14.447 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -12.061 -3.384 -13.116 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -11.967 -0.313 -12.956 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -11.887 -1.377 -11.531 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -10.608 -0.173 -11.816 1.00 0.00 H new ATOM 1279 N GLY A 79 -8.349 -3.310 -15.252 1.00 0.00 N ATOM 1280 CA GLY A 79 -7.675 -2.752 -16.410 1.00 0.00 C ATOM 1281 C GLY A 79 -6.293 -3.334 -16.594 1.00 0.00 C ATOM 1282 O GLY A 79 -6.025 -4.027 -17.575 1.00 0.00 O ATOM 0 H GLY A 79 -9.166 -3.879 -15.473 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.271 -2.942 -17.303 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -7.601 -1.670 -16.300 1.00 0.00 H new ATOM 1286 N GLN A 80 -5.423 -3.062 -15.636 1.00 0.00 N ATOM 1287 CA GLN A 80 -4.064 -3.568 -15.667 1.00 0.00 C ATOM 1288 C GLN A 80 -3.295 -3.081 -14.444 1.00 0.00 C ATOM 1289 O GLN A 80 -2.111 -2.753 -14.531 1.00 0.00 O ATOM 1290 CB GLN A 80 -3.349 -3.127 -16.946 1.00 0.00 C ATOM 1291 CG GLN A 80 -3.265 -1.619 -17.109 1.00 0.00 C ATOM 1292 CD GLN A 80 -2.550 -1.210 -18.381 1.00 0.00 C ATOM 1293 OE1 GLN A 80 -1.381 -1.541 -18.584 1.00 0.00 O ATOM 1294 NE2 GLN A 80 -3.248 -0.483 -19.246 1.00 0.00 N ATOM 0 H GLN A 80 -5.638 -2.488 -14.821 1.00 0.00 H new ATOM 0 HA GLN A 80 -4.104 -4.657 -15.653 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -2.341 -3.541 -16.949 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -3.869 -3.548 -17.806 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -4.272 -1.201 -17.112 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -2.745 -1.193 -16.251 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -4.214 -0.231 -19.038 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -2.818 -0.177 -20.119 1.00 0.00 H new ATOM 1303 N VAL A 81 -3.981 -3.037 -13.305 1.00 0.00 N ATOM 1304 CA VAL A 81 -3.369 -2.587 -12.062 1.00 0.00 C ATOM 1305 C VAL A 81 -4.114 -3.139 -10.851 1.00 0.00 C ATOM 1306 O VAL A 81 -5.342 -3.064 -10.777 1.00 0.00 O ATOM 1307 CB VAL A 81 -3.343 -1.049 -11.976 1.00 0.00 C ATOM 1308 CG1 VAL A 81 -2.482 -0.465 -13.084 1.00 0.00 C ATOM 1309 CG2 VAL A 81 -4.756 -0.485 -12.039 1.00 0.00 C ATOM 0 H VAL A 81 -4.961 -3.308 -13.219 1.00 0.00 H new ATOM 0 HA VAL A 81 -2.346 -2.963 -12.058 1.00 0.00 H new ATOM 0 HB VAL A 81 -2.905 -0.767 -11.019 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -2.477 0.622 -13.006 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.463 -0.841 -12.989 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -2.888 -0.757 -14.052 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -4.717 0.603 -11.977 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -5.223 -0.778 -12.979 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -5.341 -0.875 -11.206 1.00 0.00 H new ATOM 1319 N ALA A 82 -3.363 -3.691 -9.905 1.00 0.00 N ATOM 1320 CA ALA A 82 -3.948 -4.257 -8.696 1.00 0.00 C ATOM 1321 C ALA A 82 -4.506 -3.161 -7.795 1.00 0.00 C ATOM 1322 O ALA A 82 -3.900 -2.102 -7.643 1.00 0.00 O ATOM 1323 CB ALA A 82 -2.913 -5.085 -7.948 1.00 0.00 C ATOM 0 H ALA A 82 -2.346 -3.759 -9.952 1.00 0.00 H new ATOM 0 HA ALA A 82 -4.773 -4.907 -8.988 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -3.363 -5.502 -7.047 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -2.564 -5.895 -8.588 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -2.070 -4.451 -7.673 1.00 0.00 H new ATOM 1329 N ILE A 83 -5.666 -3.423 -7.202 1.00 0.00 N ATOM 1330 CA ILE A 83 -6.305 -2.457 -6.317 1.00 0.00 C ATOM 1331 C ILE A 83 -6.604 -3.079 -4.956 1.00 0.00 C ATOM 1332 O ILE A 83 -7.156 -4.177 -4.870 1.00 0.00 O ATOM 1333 CB ILE A 83 -7.614 -1.917 -6.927 1.00 0.00 C ATOM 1334 CG1 ILE A 83 -7.345 -1.303 -8.302 1.00 0.00 C ATOM 1335 CG2 ILE A 83 -8.252 -0.890 -6.000 1.00 0.00 C ATOM 1336 CD1 ILE A 83 -8.586 -0.768 -8.980 1.00 0.00 C ATOM 0 H ILE A 83 -6.182 -4.295 -7.318 1.00 0.00 H new ATOM 0 HA ILE A 83 -5.608 -1.629 -6.189 1.00 0.00 H new ATOM 0 HB ILE A 83 -8.309 -2.748 -7.048 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -6.623 -0.494 -8.194 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -6.887 -2.056 -8.943 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -9.175 -0.520 -6.447 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -8.475 -1.355 -5.040 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -7.563 -0.059 -5.849 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -8.319 -0.348 -9.950 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -9.302 -1.578 -9.120 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -9.034 0.008 -8.359 1.00 0.00 H new ATOM 1348 N LEU A 84 -6.234 -2.370 -3.895 1.00 0.00 N ATOM 1349 CA LEU A 84 -6.457 -2.849 -2.535 1.00 0.00 C ATOM 1350 C LEU A 84 -7.215 -1.809 -1.713 1.00 0.00 C ATOM 1351 O LEU A 84 -6.962 -0.610 -1.831 1.00 0.00 O ATOM 1352 CB LEU A 84 -5.118 -3.174 -1.870 1.00 0.00 C ATOM 1353 CG LEU A 84 -5.215 -3.742 -0.454 1.00 0.00 C ATOM 1354 CD1 LEU A 84 -6.019 -5.033 -0.453 1.00 0.00 C ATOM 1355 CD2 LEU A 84 -3.822 -3.973 0.119 1.00 0.00 C ATOM 0 H LEU A 84 -5.777 -1.460 -3.951 1.00 0.00 H new ATOM 0 HA LEU A 84 -7.061 -3.755 -2.581 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -4.584 -3.890 -2.495 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -4.516 -2.266 -1.839 1.00 0.00 H new ATOM 0 HG LEU A 84 -5.731 -3.019 0.178 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -6.078 -5.424 0.563 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -7.024 -4.836 -0.825 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -5.531 -5.766 -1.096 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -3.906 -4.378 1.128 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -3.282 -4.679 -0.511 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -3.280 -3.028 0.151 1.00 0.00 H new ATOM 1367 N LEU A 85 -8.147 -2.273 -0.884 1.00 0.00 N ATOM 1368 CA LEU A 85 -8.939 -1.370 -0.050 1.00 0.00 C ATOM 1369 C LEU A 85 -9.535 -2.102 1.149 1.00 0.00 C ATOM 1370 O LEU A 85 -9.955 -3.257 1.041 1.00 0.00 O ATOM 1371 CB LEU A 85 -10.057 -0.729 -0.875 1.00 0.00 C ATOM 1372 CG LEU A 85 -10.954 0.244 -0.107 1.00 0.00 C ATOM 1373 CD1 LEU A 85 -10.147 1.428 0.405 1.00 0.00 C ATOM 1374 CD2 LEU A 85 -12.101 0.717 -0.986 1.00 0.00 C ATOM 0 H LEU A 85 -8.372 -3.261 -0.771 1.00 0.00 H new ATOM 0 HA LEU A 85 -8.273 -0.591 0.322 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -9.609 -0.199 -1.716 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -10.679 -1.521 -1.292 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.373 -0.280 0.752 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -10.803 2.108 0.948 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -9.361 1.072 1.072 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -9.697 1.953 -0.438 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -12.729 1.408 -0.424 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -11.701 1.223 -1.865 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -12.696 -0.140 -1.300 1.00 0.00 H new ATOM 1386 N PHE A 86 -9.565 -1.420 2.294 1.00 0.00 N ATOM 1387 CA PHE A 86 -10.106 -1.997 3.524 1.00 0.00 C ATOM 1388 C PHE A 86 -9.947 -1.036 4.698 1.00 0.00 C ATOM 1389 O PHE A 86 -8.923 -0.364 4.828 1.00 0.00 O ATOM 1390 CB PHE A 86 -9.420 -3.331 3.831 1.00 0.00 C ATOM 1391 CG PHE A 86 -7.922 -3.262 3.812 1.00 0.00 C ATOM 1392 CD1 PHE A 86 -7.229 -2.526 4.759 1.00 0.00 C ATOM 1393 CD2 PHE A 86 -7.206 -3.937 2.837 1.00 0.00 C ATOM 1394 CE1 PHE A 86 -5.849 -2.464 4.732 1.00 0.00 C ATOM 1395 CE2 PHE A 86 -5.827 -3.879 2.805 1.00 0.00 C ATOM 1396 CZ PHE A 86 -5.147 -3.142 3.753 1.00 0.00 C ATOM 0 H PHE A 86 -9.220 -0.465 2.395 1.00 0.00 H new ATOM 0 HA PHE A 86 -11.171 -2.174 3.375 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -9.746 -3.679 4.811 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -9.749 -4.073 3.104 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -7.773 -1.995 5.526 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -7.733 -4.516 2.093 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -5.319 -1.886 5.475 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -5.281 -4.410 2.039 1.00 0.00 H new ATOM 0 HZ PHE A 86 -4.068 -3.095 3.730 1.00 0.00 H new ATOM 1406 N LYS A 87 -10.969 -0.964 5.549 1.00 0.00 N ATOM 1407 CA LYS A 87 -10.933 -0.076 6.706 1.00 0.00 C ATOM 1408 C LYS A 87 -10.475 -0.808 7.961 1.00 0.00 C ATOM 1409 O LYS A 87 -10.350 -2.033 7.973 1.00 0.00 O ATOM 1410 CB LYS A 87 -12.298 0.569 6.954 1.00 0.00 C ATOM 1411 CG LYS A 87 -13.396 -0.423 7.296 1.00 0.00 C ATOM 1412 CD LYS A 87 -14.685 0.288 7.674 1.00 0.00 C ATOM 1413 CE LYS A 87 -15.792 -0.700 8.000 1.00 0.00 C ATOM 1414 NZ LYS A 87 -17.055 -0.013 8.387 1.00 0.00 N ATOM 0 H LYS A 87 -11.827 -1.508 5.459 1.00 0.00 H new ATOM 0 HA LYS A 87 -10.210 0.707 6.480 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -12.206 1.289 7.768 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -12.591 1.128 6.065 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -13.576 -1.078 6.443 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -13.072 -1.057 8.122 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -14.507 0.933 8.534 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -15.001 0.932 6.853 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -15.976 -1.337 7.135 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -15.469 -1.351 8.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -17.785 -0.723 8.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -16.887 0.575 9.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -17.377 0.589 7.602 1.00 0.00 H new ATOM 1428 N SER A 88 -10.219 -0.040 9.016 1.00 0.00 N ATOM 1429 CA SER A 88 -9.767 -0.596 10.283 1.00 0.00 C ATOM 1430 C SER A 88 -10.265 0.247 11.450 1.00 0.00 C ATOM 1431 O SER A 88 -10.268 1.475 11.388 1.00 0.00 O ATOM 1432 CB SER A 88 -8.242 -0.664 10.312 1.00 0.00 C ATOM 1433 OG SER A 88 -7.777 -1.223 11.528 1.00 0.00 O ATOM 0 H SER A 88 -10.318 0.975 9.016 1.00 0.00 H new ATOM 0 HA SER A 88 -10.175 -1.602 10.379 1.00 0.00 H new ATOM 0 HB2 SER A 88 -7.886 -1.263 9.474 1.00 0.00 H new ATOM 0 HB3 SER A 88 -7.828 0.337 10.187 1.00 0.00 H new ATOM 0 HG SER A 88 -7.350 -2.087 11.349 1.00 0.00 H new ATOM 1536 N ALA B 6 19.346 3.427 3.306 1.00 0.00 N ATOM 1537 CA ALA B 6 17.996 3.880 2.991 1.00 0.00 C ATOM 1538 C ALA B 6 17.854 5.380 3.218 1.00 0.00 C ATOM 1539 O ALA B 6 18.132 5.880 4.309 1.00 0.00 O ATOM 1540 CB ALA B 6 16.977 3.125 3.832 1.00 0.00 C ATOM 0 HA ALA B 6 17.809 3.676 1.937 1.00 0.00 H new ATOM 0 HB1 ALA B 6 15.974 3.473 3.587 1.00 0.00 H new ATOM 0 HB2 ALA B 6 17.052 2.058 3.623 1.00 0.00 H new ATOM 0 HB3 ALA B 6 17.174 3.303 4.889 1.00 0.00 H new ATOM 1546 N VAL B 7 17.419 6.098 2.185 1.00 0.00 N ATOM 1547 CA VAL B 7 17.245 7.532 2.285 1.00 0.00 C ATOM 1548 C VAL B 7 15.821 7.897 2.675 1.00 0.00 C ATOM 1549 O VAL B 7 14.857 7.351 2.140 1.00 0.00 O ATOM 1550 CB VAL B 7 17.586 8.231 0.968 1.00 0.00 C ATOM 1551 CG1 VAL B 7 19.059 8.052 0.629 1.00 0.00 C ATOM 1552 CG2 VAL B 7 16.701 7.722 -0.161 1.00 0.00 C ATOM 0 H VAL B 7 17.183 5.705 1.274 1.00 0.00 H new ATOM 0 HA VAL B 7 17.930 7.871 3.063 1.00 0.00 H new ATOM 0 HB VAL B 7 17.394 9.297 1.089 1.00 0.00 H new ATOM 0 HG11 VAL B 7 19.280 8.557 -0.311 1.00 0.00 H new ATOM 0 HG12 VAL B 7 19.670 8.481 1.423 1.00 0.00 H new ATOM 0 HG13 VAL B 7 19.284 6.990 0.532 1.00 0.00 H new ATOM 0 HG21 VAL B 7 16.962 8.234 -1.087 1.00 0.00 H new ATOM 0 HG22 VAL B 7 16.850 6.649 -0.285 1.00 0.00 H new ATOM 0 HG23 VAL B 7 15.656 7.918 0.079 1.00 0.00 H new ATOM 1562 N ILE B 8 15.698 8.837 3.599 1.00 0.00 N ATOM 1563 CA ILE B 8 14.392 9.292 4.062 1.00 0.00 C ATOM 1564 C ILE B 8 13.751 10.236 3.051 1.00 0.00 C ATOM 1565 O ILE B 8 14.397 11.150 2.537 1.00 0.00 O ATOM 1566 CB ILE B 8 14.490 9.982 5.443 1.00 0.00 C ATOM 1567 CG1 ILE B 8 14.824 8.955 6.528 1.00 0.00 C ATOM 1568 CG2 ILE B 8 13.197 10.711 5.787 1.00 0.00 C ATOM 1569 CD1 ILE B 8 16.136 8.234 6.309 1.00 0.00 C ATOM 0 H ILE B 8 16.488 9.302 4.046 1.00 0.00 H new ATOM 0 HA ILE B 8 13.761 8.409 4.165 1.00 0.00 H new ATOM 0 HB ILE B 8 15.291 10.719 5.395 1.00 0.00 H new ATOM 0 HG12 ILE B 8 14.855 9.459 7.494 1.00 0.00 H new ATOM 0 HG13 ILE B 8 14.021 8.220 6.578 1.00 0.00 H new ATOM 0 HG21 ILE B 8 13.296 11.186 6.763 1.00 0.00 H new ATOM 0 HG22 ILE B 8 12.996 11.471 5.032 1.00 0.00 H new ATOM 0 HG23 ILE B 8 12.373 9.998 5.812 1.00 0.00 H new ATOM 0 HD11 ILE B 8 16.301 7.524 7.119 1.00 0.00 H new ATOM 0 HD12 ILE B 8 16.103 7.700 5.359 1.00 0.00 H new ATOM 0 HD13 ILE B 8 16.950 8.958 6.290 1.00 0.00 H new ATOM 1581 N LYS B 9 12.474 10.003 2.771 1.00 0.00 N ATOM 1582 CA LYS B 9 11.735 10.824 1.820 1.00 0.00 C ATOM 1583 C LYS B 9 10.541 11.499 2.490 1.00 0.00 C ATOM 1584 O LYS B 9 10.126 12.585 2.083 1.00 0.00 O ATOM 1585 CB LYS B 9 11.258 9.974 0.642 1.00 0.00 C ATOM 1586 CG LYS B 9 12.388 9.310 -0.132 1.00 0.00 C ATOM 1587 CD LYS B 9 13.376 10.324 -0.694 1.00 0.00 C ATOM 1588 CE LYS B 9 12.769 11.161 -1.812 1.00 0.00 C ATOM 1589 NZ LYS B 9 11.742 12.118 -1.316 1.00 0.00 N ATOM 0 H LYS B 9 11.928 9.250 3.190 1.00 0.00 H new ATOM 0 HA LYS B 9 12.407 11.599 1.453 1.00 0.00 H new ATOM 0 HB2 LYS B 9 10.581 9.204 1.012 1.00 0.00 H new ATOM 0 HB3 LYS B 9 10.684 10.602 -0.039 1.00 0.00 H new ATOM 0 HG2 LYS B 9 12.915 8.616 0.523 1.00 0.00 H new ATOM 0 HG3 LYS B 9 11.970 8.722 -0.949 1.00 0.00 H new ATOM 0 HD2 LYS B 9 13.714 10.981 0.107 1.00 0.00 H new ATOM 0 HD3 LYS B 9 14.256 9.802 -1.070 1.00 0.00 H new ATOM 0 HE2 LYS B 9 13.561 11.713 -2.319 1.00 0.00 H new ATOM 0 HE3 LYS B 9 12.318 10.500 -2.552 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 11.773 12.987 -1.886 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 10.799 11.687 -1.394 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 11.935 12.350 -0.321 1.00 0.00 H new ATOM 1603 N ASN B 10 9.984 10.850 3.508 1.00 0.00 N ATOM 1604 CA ASN B 10 8.829 11.397 4.214 1.00 0.00 C ATOM 1605 C ASN B 10 8.795 10.944 5.671 1.00 0.00 C ATOM 1606 O ASN B 10 7.771 10.467 6.161 1.00 0.00 O ATOM 1607 CB ASN B 10 7.537 10.980 3.507 1.00 0.00 C ATOM 1608 CG ASN B 10 7.486 11.455 2.069 1.00 0.00 C ATOM 1609 OD1 ASN B 10 7.538 12.655 1.797 1.00 0.00 O ATOM 1610 ND2 ASN B 10 7.381 10.513 1.138 1.00 0.00 N ATOM 0 H ASN B 10 10.311 9.951 3.861 1.00 0.00 H new ATOM 0 HA ASN B 10 8.916 12.483 4.203 1.00 0.00 H new ATOM 0 HB2 ASN B 10 7.447 9.894 3.531 1.00 0.00 H new ATOM 0 HB3 ASN B 10 6.682 11.383 4.050 1.00 0.00 H new ATOM 0 HD21 ASN B 10 7.340 10.772 0.152 1.00 0.00 H new ATOM 0 HD22 ASN B 10 7.341 9.530 1.409 1.00 0.00 H new ATOM 1617 N ALA B 11 9.919 11.103 6.364 1.00 0.00 N ATOM 1618 CA ALA B 11 10.012 10.719 7.769 1.00 0.00 C ATOM 1619 C ALA B 11 9.013 11.501 8.616 1.00 0.00 C ATOM 1620 O ALA B 11 8.751 12.676 8.356 1.00 0.00 O ATOM 1621 CB ALA B 11 11.425 10.935 8.285 1.00 0.00 C ATOM 0 H ALA B 11 10.777 11.495 5.976 1.00 0.00 H new ATOM 0 HA ALA B 11 9.768 9.659 7.847 1.00 0.00 H new ATOM 0 HB1 ALA B 11 11.478 10.644 9.334 1.00 0.00 H new ATOM 0 HB2 ALA B 11 12.121 10.329 7.705 1.00 0.00 H new ATOM 0 HB3 ALA B 11 11.691 11.987 8.187 1.00 0.00 H new ATOM 1627 N ASP B 12 8.454 10.843 9.626 1.00 0.00 N ATOM 1628 CA ASP B 12 7.481 11.482 10.506 1.00 0.00 C ATOM 1629 C ASP B 12 7.164 10.591 11.705 1.00 0.00 C ATOM 1630 O ASP B 12 6.001 10.303 11.989 1.00 0.00 O ATOM 1631 CB ASP B 12 6.200 11.802 9.731 1.00 0.00 C ATOM 1632 CG ASP B 12 5.155 12.488 10.591 1.00 0.00 C ATOM 1633 OD1 ASP B 12 5.447 13.583 11.118 1.00 0.00 O ATOM 1634 OD2 ASP B 12 4.047 11.932 10.736 1.00 0.00 O ATOM 0 H ASP B 12 8.657 9.870 9.856 1.00 0.00 H new ATOM 0 HA ASP B 12 7.913 12.412 10.877 1.00 0.00 H new ATOM 0 HB2 ASP B 12 6.443 12.441 8.882 1.00 0.00 H new ATOM 0 HB3 ASP B 12 5.784 10.879 9.327 1.00 0.00 H new ATOM 1639 N MET B 13 8.207 10.160 12.405 1.00 0.00 N ATOM 1640 CA MET B 13 8.045 9.302 13.573 1.00 0.00 C ATOM 1641 C MET B 13 9.360 9.175 14.335 1.00 0.00 C ATOM 1642 O MET B 13 10.423 9.489 13.803 1.00 0.00 O ATOM 1643 CB MET B 13 7.539 7.921 13.156 1.00 0.00 C ATOM 1644 CG MET B 13 7.241 7.000 14.327 1.00 0.00 C ATOM 1645 SD MET B 13 6.455 5.458 13.818 1.00 0.00 S ATOM 1646 CE MET B 13 7.728 4.744 12.782 1.00 0.00 C ATOM 0 H MET B 13 9.175 10.391 12.184 1.00 0.00 H new ATOM 0 HA MET B 13 7.307 9.759 14.232 1.00 0.00 H new ATOM 0 HB2 MET B 13 6.634 8.040 12.560 1.00 0.00 H new ATOM 0 HB3 MET B 13 8.284 7.449 12.515 1.00 0.00 H new ATOM 0 HG2 MET B 13 8.169 6.774 14.851 1.00 0.00 H new ATOM 0 HG3 MET B 13 6.593 7.517 15.035 1.00 0.00 H new ATOM 0 HE1 MET B 13 7.857 3.692 13.037 1.00 0.00 H new ATOM 0 HE2 MET B 13 7.436 4.831 11.735 1.00 0.00 H new ATOM 0 HE3 MET B 13 8.667 5.274 12.942 1.00 0.00 H new ATOM 1656 N SER B 14 9.277 8.724 15.585 1.00 0.00 N ATOM 1657 CA SER B 14 10.460 8.563 16.434 1.00 0.00 C ATOM 1658 C SER B 14 11.643 7.991 15.650 1.00 0.00 C ATOM 1659 O SER B 14 11.484 7.083 14.835 1.00 0.00 O ATOM 1660 CB SER B 14 10.137 7.653 17.621 1.00 0.00 C ATOM 1661 OG SER B 14 9.096 8.200 18.414 1.00 0.00 O ATOM 0 H SER B 14 8.400 8.462 16.036 1.00 0.00 H new ATOM 0 HA SER B 14 10.742 9.551 16.798 1.00 0.00 H new ATOM 0 HB2 SER B 14 9.843 6.668 17.259 1.00 0.00 H new ATOM 0 HB3 SER B 14 11.030 7.515 18.231 1.00 0.00 H new ATOM 0 HG SER B 14 8.907 7.599 19.165 1.00 0.00 H new ATOM 1667 N GLU B 15 12.827 8.544 15.902 1.00 0.00 N ATOM 1668 CA GLU B 15 14.046 8.110 15.222 1.00 0.00 C ATOM 1669 C GLU B 15 14.261 6.609 15.357 1.00 0.00 C ATOM 1670 O GLU B 15 14.617 5.936 14.393 1.00 0.00 O ATOM 1671 CB GLU B 15 15.257 8.859 15.781 1.00 0.00 C ATOM 1672 CG GLU B 15 15.165 10.368 15.629 1.00 0.00 C ATOM 1673 CD GLU B 15 15.115 10.811 14.179 1.00 0.00 C ATOM 1674 OE1 GLU B 15 15.179 9.940 13.286 1.00 0.00 O ATOM 1675 OE2 GLU B 15 15.014 12.033 13.935 1.00 0.00 O ATOM 0 H GLU B 15 12.969 9.297 16.575 1.00 0.00 H new ATOM 0 HA GLU B 15 13.932 8.340 14.163 1.00 0.00 H new ATOM 0 HB2 GLU B 15 15.368 8.615 16.838 1.00 0.00 H new ATOM 0 HB3 GLU B 15 16.156 8.506 15.276 1.00 0.00 H new ATOM 0 HG2 GLU B 15 14.274 10.727 16.145 1.00 0.00 H new ATOM 0 HG3 GLU B 15 16.023 10.831 16.116 1.00 0.00 H new ATOM 1682 N GLU B 16 14.050 6.090 16.555 1.00 0.00 N ATOM 1683 CA GLU B 16 14.232 4.667 16.804 1.00 0.00 C ATOM 1684 C GLU B 16 13.268 3.833 15.967 1.00 0.00 C ATOM 1685 O GLU B 16 13.642 2.789 15.435 1.00 0.00 O ATOM 1686 CB GLU B 16 14.041 4.354 18.290 1.00 0.00 C ATOM 1687 CG GLU B 16 12.663 4.719 18.815 1.00 0.00 C ATOM 1688 CD GLU B 16 12.496 4.402 20.288 1.00 0.00 C ATOM 1689 OE1 GLU B 16 12.633 3.216 20.657 1.00 0.00 O ATOM 1690 OE2 GLU B 16 12.229 5.336 21.071 1.00 0.00 O ATOM 0 H GLU B 16 13.754 6.629 17.369 1.00 0.00 H new ATOM 0 HA GLU B 16 15.250 4.406 16.514 1.00 0.00 H new ATOM 0 HB2 GLU B 16 14.213 3.290 18.454 1.00 0.00 H new ATOM 0 HB3 GLU B 16 14.794 4.891 18.866 1.00 0.00 H new ATOM 0 HG2 GLU B 16 12.487 5.783 18.654 1.00 0.00 H new ATOM 0 HG3 GLU B 16 11.907 4.181 18.244 1.00 0.00 H new ATOM 1697 N MET B 17 12.029 4.295 15.854 1.00 0.00 N ATOM 1698 CA MET B 17 11.025 3.579 15.080 1.00 0.00 C ATOM 1699 C MET B 17 11.393 3.549 13.604 1.00 0.00 C ATOM 1700 O MET B 17 11.411 2.486 12.982 1.00 0.00 O ATOM 1701 CB MET B 17 9.648 4.215 15.276 1.00 0.00 C ATOM 1702 CG MET B 17 9.172 4.193 16.718 1.00 0.00 C ATOM 1703 SD MET B 17 7.565 4.983 16.937 1.00 0.00 S ATOM 1704 CE MET B 17 7.318 4.765 18.698 1.00 0.00 C ATOM 0 H MET B 17 11.697 5.157 16.286 1.00 0.00 H new ATOM 0 HA MET B 17 10.989 2.551 15.439 1.00 0.00 H new ATOM 0 HB2 MET B 17 9.680 5.247 14.928 1.00 0.00 H new ATOM 0 HB3 MET B 17 8.922 3.691 14.654 1.00 0.00 H new ATOM 0 HG2 MET B 17 9.113 3.160 17.061 1.00 0.00 H new ATOM 0 HG3 MET B 17 9.907 4.696 17.346 1.00 0.00 H new ATOM 0 HE1 MET B 17 6.412 4.184 18.869 1.00 0.00 H new ATOM 0 HE2 MET B 17 8.173 4.239 19.123 1.00 0.00 H new ATOM 0 HE3 MET B 17 7.219 5.740 19.175 1.00 0.00 H new ATOM 1714 N GLN B 18 11.699 4.713 13.047 1.00 0.00 N ATOM 1715 CA GLN B 18 12.081 4.804 11.645 1.00 0.00 C ATOM 1716 C GLN B 18 13.412 4.103 11.405 1.00 0.00 C ATOM 1717 O GLN B 18 13.602 3.442 10.385 1.00 0.00 O ATOM 1718 CB GLN B 18 12.165 6.265 11.207 1.00 0.00 C ATOM 1719 CG GLN B 18 13.133 7.090 12.035 1.00 0.00 C ATOM 1720 CD GLN B 18 13.113 8.555 11.654 1.00 0.00 C ATOM 1721 OE1 GLN B 18 13.505 8.930 10.550 1.00 0.00 O ATOM 1722 NE2 GLN B 18 12.634 9.390 12.566 1.00 0.00 N ATOM 0 H GLN B 18 11.690 5.604 13.543 1.00 0.00 H new ATOM 0 HA GLN B 18 11.316 4.306 11.049 1.00 0.00 H new ATOM 0 HB2 GLN B 18 12.468 6.306 10.161 1.00 0.00 H new ATOM 0 HB3 GLN B 18 11.173 6.712 11.269 1.00 0.00 H new ATOM 0 HG2 GLN B 18 12.882 6.988 13.091 1.00 0.00 H new ATOM 0 HG3 GLN B 18 14.142 6.698 11.908 1.00 0.00 H new ATOM 0 HE21 GLN B 18 12.320 9.034 13.469 1.00 0.00 H new ATOM 0 HE22 GLN B 18 12.579 10.388 12.365 1.00 0.00 H new ATOM 1731 N GLN B 19 14.325 4.241 12.358 1.00 0.00 N ATOM 1732 CA GLN B 19 15.632 3.611 12.255 1.00 0.00 C ATOM 1733 C GLN B 19 15.508 2.096 12.374 1.00 0.00 C ATOM 1734 O GLN B 19 16.192 1.350 11.674 1.00 0.00 O ATOM 1735 CB GLN B 19 16.574 4.158 13.329 1.00 0.00 C ATOM 1736 CG GLN B 19 17.058 5.574 13.049 1.00 0.00 C ATOM 1737 CD GLN B 19 17.950 6.144 14.146 1.00 0.00 C ATOM 1738 OE1 GLN B 19 18.420 7.278 14.041 1.00 0.00 O ATOM 1739 NE2 GLN B 19 18.191 5.371 15.204 1.00 0.00 N ATOM 0 H GLN B 19 14.183 4.784 13.210 1.00 0.00 H new ATOM 0 HA GLN B 19 16.051 3.844 11.276 1.00 0.00 H new ATOM 0 HB2 GLN B 19 16.063 4.141 14.292 1.00 0.00 H new ATOM 0 HB3 GLN B 19 17.437 3.498 13.414 1.00 0.00 H new ATOM 0 HG2 GLN B 19 17.606 5.582 12.107 1.00 0.00 H new ATOM 0 HG3 GLN B 19 16.194 6.225 12.921 1.00 0.00 H new ATOM 0 HE21 GLN B 19 17.784 4.437 15.256 1.00 0.00 H new ATOM 0 HE22 GLN B 19 18.782 5.713 15.962 1.00 0.00 H new ATOM 1748 N ASP B 20 14.625 1.648 13.258 1.00 0.00 N ATOM 1749 CA ASP B 20 14.405 0.221 13.462 1.00 0.00 C ATOM 1750 C ASP B 20 13.869 -0.426 12.196 1.00 0.00 C ATOM 1751 O ASP B 20 14.258 -1.538 11.847 1.00 0.00 O ATOM 1752 CB ASP B 20 13.442 -0.005 14.631 1.00 0.00 C ATOM 1753 CG ASP B 20 13.192 -1.475 14.906 1.00 0.00 C ATOM 1754 OD1 ASP B 20 12.656 -2.164 14.013 1.00 0.00 O ATOM 1755 OD2 ASP B 20 13.532 -1.938 16.016 1.00 0.00 O ATOM 0 H ASP B 20 14.050 2.252 13.845 1.00 0.00 H new ATOM 0 HA ASP B 20 15.360 -0.245 13.703 1.00 0.00 H new ATOM 0 HB2 ASP B 20 13.848 0.464 15.527 1.00 0.00 H new ATOM 0 HB3 ASP B 20 12.493 0.487 14.416 1.00 0.00 H new ATOM 1760 N SER B 21 12.984 0.276 11.503 1.00 0.00 N ATOM 1761 CA SER B 21 12.418 -0.242 10.267 1.00 0.00 C ATOM 1762 C SER B 21 13.486 -0.298 9.185 1.00 0.00 C ATOM 1763 O SER B 21 13.569 -1.266 8.428 1.00 0.00 O ATOM 1764 CB SER B 21 11.243 0.625 9.807 1.00 0.00 C ATOM 1765 OG SER B 21 10.681 0.127 8.605 1.00 0.00 O ATOM 0 H SER B 21 12.645 1.199 11.773 1.00 0.00 H new ATOM 0 HA SER B 21 12.049 -1.251 10.452 1.00 0.00 H new ATOM 0 HB2 SER B 21 10.480 0.651 10.585 1.00 0.00 H new ATOM 0 HB3 SER B 21 11.581 1.650 9.657 1.00 0.00 H new ATOM 0 HG SER B 21 10.042 0.778 8.248 1.00 0.00 H new ATOM 1771 N VAL B 22 14.314 0.740 9.129 1.00 0.00 N ATOM 1772 CA VAL B 22 15.388 0.805 8.149 1.00 0.00 C ATOM 1773 C VAL B 22 16.402 -0.302 8.399 1.00 0.00 C ATOM 1774 O VAL B 22 16.820 -0.999 7.474 1.00 0.00 O ATOM 1775 CB VAL B 22 16.109 2.168 8.186 1.00 0.00 C ATOM 1776 CG1 VAL B 22 17.181 2.241 7.107 1.00 0.00 C ATOM 1777 CG2 VAL B 22 15.110 3.304 8.030 1.00 0.00 C ATOM 0 H VAL B 22 14.261 1.547 9.751 1.00 0.00 H new ATOM 0 HA VAL B 22 14.936 0.678 7.165 1.00 0.00 H new ATOM 0 HB VAL B 22 16.597 2.271 9.155 1.00 0.00 H new ATOM 0 HG11 VAL B 22 17.677 3.211 7.152 1.00 0.00 H new ATOM 0 HG12 VAL B 22 17.914 1.451 7.269 1.00 0.00 H new ATOM 0 HG13 VAL B 22 16.720 2.114 6.127 1.00 0.00 H new ATOM 0 HG21 VAL B 22 15.636 4.258 8.058 1.00 0.00 H new ATOM 0 HG22 VAL B 22 14.591 3.204 7.077 1.00 0.00 H new ATOM 0 HG23 VAL B 22 14.385 3.265 8.843 1.00 0.00 H new ATOM 1787 N GLU B 23 16.783 -0.466 9.660 1.00 0.00 N ATOM 1788 CA GLU B 23 17.737 -1.499 10.038 1.00 0.00 C ATOM 1789 C GLU B 23 17.123 -2.878 9.846 1.00 0.00 C ATOM 1790 O GLU B 23 17.745 -3.773 9.272 1.00 0.00 O ATOM 1791 CB GLU B 23 18.177 -1.318 11.492 1.00 0.00 C ATOM 1792 CG GLU B 23 18.912 -0.012 11.755 1.00 0.00 C ATOM 1793 CD GLU B 23 20.240 0.071 11.028 1.00 0.00 C ATOM 1794 OE1 GLU B 23 20.240 0.011 9.780 1.00 0.00 O ATOM 1795 OE2 GLU B 23 21.279 0.200 11.708 1.00 0.00 O ATOM 0 H GLU B 23 16.446 0.103 10.437 1.00 0.00 H new ATOM 0 HA GLU B 23 18.613 -1.410 9.396 1.00 0.00 H new ATOM 0 HB2 GLU B 23 17.299 -1.365 12.136 1.00 0.00 H new ATOM 0 HB3 GLU B 23 18.823 -2.150 11.772 1.00 0.00 H new ATOM 0 HG2 GLU B 23 18.282 0.823 11.448 1.00 0.00 H new ATOM 0 HG3 GLU B 23 19.082 0.095 12.826 1.00 0.00 H new ATOM 1802 N CYS B 24 15.897 -3.038 10.325 1.00 0.00 N ATOM 1803 CA CYS B 24 15.191 -4.308 10.200 1.00 0.00 C ATOM 1804 C CYS B 24 14.856 -4.611 8.742 1.00 0.00 C ATOM 1805 O CYS B 24 14.769 -5.772 8.347 1.00 0.00 O ATOM 1806 CB CYS B 24 13.918 -4.301 11.044 1.00 0.00 C ATOM 1807 SG CYS B 24 14.218 -4.275 12.826 1.00 0.00 S ATOM 0 H CYS B 24 15.371 -2.307 10.803 1.00 0.00 H new ATOM 0 HA CYS B 24 15.851 -5.094 10.568 1.00 0.00 H new ATOM 0 HB2 CYS B 24 13.320 -3.431 10.774 1.00 0.00 H new ATOM 0 HB3 CYS B 24 13.326 -5.183 10.798 1.00 0.00 H new ATOM 0 HG CYS B 24 13.292 -3.575 13.412 1.00 0.00 H new ATOM 1813 N ALA B 25 14.679 -3.561 7.943 1.00 0.00 N ATOM 1814 CA ALA B 25 14.365 -3.729 6.533 1.00 0.00 C ATOM 1815 C ALA B 25 15.591 -4.217 5.783 1.00 0.00 C ATOM 1816 O ALA B 25 15.501 -5.085 4.914 1.00 0.00 O ATOM 1817 CB ALA B 25 13.860 -2.422 5.941 1.00 0.00 C ATOM 0 H ALA B 25 14.748 -2.591 8.250 1.00 0.00 H new ATOM 0 HA ALA B 25 13.576 -4.474 6.435 1.00 0.00 H new ATOM 0 HB1 ALA B 25 13.630 -2.566 4.885 1.00 0.00 H new ATOM 0 HB2 ALA B 25 12.960 -2.107 6.469 1.00 0.00 H new ATOM 0 HB3 ALA B 25 14.628 -1.655 6.044 1.00 0.00 H new ATOM 1823 N THR B 26 16.741 -3.652 6.131 1.00 0.00 N ATOM 1824 CA THR B 26 17.990 -4.030 5.497 1.00 0.00 C ATOM 1825 C THR B 26 18.292 -5.499 5.751 1.00 0.00 C ATOM 1826 O THR B 26 18.637 -6.246 4.834 1.00 0.00 O ATOM 1827 CB THR B 26 19.137 -3.155 6.005 1.00 0.00 C ATOM 1828 OG1 THR B 26 18.876 -1.787 5.745 1.00 0.00 O ATOM 1829 CG2 THR B 26 20.473 -3.493 5.381 1.00 0.00 C ATOM 0 H THR B 26 16.831 -2.932 6.848 1.00 0.00 H new ATOM 0 HA THR B 26 17.889 -3.877 4.422 1.00 0.00 H new ATOM 0 HB THR B 26 19.196 -3.351 7.076 1.00 0.00 H new ATOM 0 HG1 THR B 26 18.157 -1.474 6.333 1.00 0.00 H new ATOM 0 HG21 THR B 26 21.241 -2.834 5.786 1.00 0.00 H new ATOM 0 HG22 THR B 26 20.728 -4.529 5.606 1.00 0.00 H new ATOM 0 HG23 THR B 26 20.414 -3.360 4.301 1.00 0.00 H new ATOM 1837 N GLN B 27 18.141 -5.912 7.003 1.00 0.00 N ATOM 1838 CA GLN B 27 18.379 -7.297 7.381 1.00 0.00 C ATOM 1839 C GLN B 27 17.433 -8.216 6.621 1.00 0.00 C ATOM 1840 O GLN B 27 17.826 -9.289 6.161 1.00 0.00 O ATOM 1841 CB GLN B 27 18.194 -7.480 8.888 1.00 0.00 C ATOM 1842 CG GLN B 27 19.152 -6.647 9.724 1.00 0.00 C ATOM 1843 CD GLN B 27 18.940 -6.834 11.212 1.00 0.00 C ATOM 1844 OE1 GLN B 27 17.859 -6.563 11.736 1.00 0.00 O ATOM 1845 NE2 GLN B 27 19.973 -7.299 11.904 1.00 0.00 N ATOM 0 H GLN B 27 17.855 -5.307 7.773 1.00 0.00 H new ATOM 0 HA GLN B 27 19.406 -7.556 7.124 1.00 0.00 H new ATOM 0 HB2 GLN B 27 17.170 -7.218 9.154 1.00 0.00 H new ATOM 0 HB3 GLN B 27 18.329 -8.533 9.137 1.00 0.00 H new ATOM 0 HG2 GLN B 27 20.178 -6.915 9.470 1.00 0.00 H new ATOM 0 HG3 GLN B 27 19.027 -5.594 9.472 1.00 0.00 H new ATOM 0 HE21 GLN B 27 20.851 -7.511 11.430 1.00 0.00 H new ATOM 0 HE22 GLN B 27 19.889 -7.445 12.910 1.00 0.00 H new ATOM 1854 N ALA B 28 16.183 -7.779 6.487 1.00 0.00 N ATOM 1855 CA ALA B 28 15.168 -8.550 5.779 1.00 0.00 C ATOM 1856 C ALA B 28 15.614 -8.877 4.363 1.00 0.00 C ATOM 1857 O ALA B 28 15.457 -10.005 3.900 1.00 0.00 O ATOM 1858 CB ALA B 28 13.853 -7.787 5.750 1.00 0.00 C ATOM 0 H ALA B 28 15.849 -6.891 6.862 1.00 0.00 H new ATOM 0 HA ALA B 28 15.024 -9.489 6.314 1.00 0.00 H new ATOM 0 HB1 ALA B 28 13.104 -8.374 5.219 1.00 0.00 H new ATOM 0 HB2 ALA B 28 13.515 -7.605 6.770 1.00 0.00 H new ATOM 0 HB3 ALA B 28 13.996 -6.834 5.240 1.00 0.00 H new ATOM 1864 N LEU B 29 16.172 -7.889 3.678 1.00 0.00 N ATOM 1865 CA LEU B 29 16.640 -8.090 2.313 1.00 0.00 C ATOM 1866 C LEU B 29 17.782 -9.093 2.276 1.00 0.00 C ATOM 1867 O LEU B 29 17.847 -9.947 1.393 1.00 0.00 O ATOM 1868 CB LEU B 29 17.082 -6.764 1.700 1.00 0.00 C ATOM 1869 CG LEU B 29 15.935 -5.836 1.320 1.00 0.00 C ATOM 1870 CD1 LEU B 29 16.451 -4.432 1.035 1.00 0.00 C ATOM 1871 CD2 LEU B 29 15.192 -6.383 0.112 1.00 0.00 C ATOM 0 H LEU B 29 16.311 -6.946 4.041 1.00 0.00 H new ATOM 0 HA LEU B 29 15.813 -8.489 1.726 1.00 0.00 H new ATOM 0 HB2 LEU B 29 17.732 -6.249 2.407 1.00 0.00 H new ATOM 0 HB3 LEU B 29 17.678 -6.969 0.811 1.00 0.00 H new ATOM 0 HG LEU B 29 15.243 -5.782 2.161 1.00 0.00 H new ATOM 0 HD11 LEU B 29 15.616 -3.785 0.766 1.00 0.00 H new ATOM 0 HD12 LEU B 29 16.943 -4.038 1.924 1.00 0.00 H new ATOM 0 HD13 LEU B 29 17.164 -4.467 0.211 1.00 0.00 H new ATOM 0 HD21 LEU B 29 14.375 -5.710 -0.148 1.00 0.00 H new ATOM 0 HD22 LEU B 29 15.878 -6.464 -0.731 1.00 0.00 H new ATOM 0 HD23 LEU B 29 14.789 -7.368 0.348 1.00 0.00 H new ATOM 1883 N GLU B 30 18.684 -8.977 3.239 1.00 0.00 N ATOM 1884 CA GLU B 30 19.834 -9.866 3.323 1.00 0.00 C ATOM 1885 C GLU B 30 19.413 -11.305 3.612 1.00 0.00 C ATOM 1886 O GLU B 30 20.019 -12.249 3.108 1.00 0.00 O ATOM 1887 CB GLU B 30 20.800 -9.382 4.405 1.00 0.00 C ATOM 1888 CG GLU B 30 21.342 -7.984 4.154 1.00 0.00 C ATOM 1889 CD GLU B 30 22.299 -7.528 5.237 1.00 0.00 C ATOM 1890 OE1 GLU B 30 21.878 -7.455 6.410 1.00 0.00 O ATOM 1891 OE2 GLU B 30 23.471 -7.243 4.912 1.00 0.00 O ATOM 0 H GLU B 30 18.642 -8.273 3.976 1.00 0.00 H new ATOM 0 HA GLU B 30 20.334 -9.848 2.355 1.00 0.00 H new ATOM 0 HB2 GLU B 30 20.291 -9.398 5.369 1.00 0.00 H new ATOM 0 HB3 GLU B 30 21.635 -10.080 4.474 1.00 0.00 H new ATOM 0 HG2 GLU B 30 21.852 -7.963 3.191 1.00 0.00 H new ATOM 0 HG3 GLU B 30 20.511 -7.282 4.089 1.00 0.00 H new ATOM 1898 N LYS B 31 18.385 -11.470 4.438 1.00 0.00 N ATOM 1899 CA LYS B 31 17.911 -12.803 4.799 1.00 0.00 C ATOM 1900 C LYS B 31 16.842 -13.312 3.837 1.00 0.00 C ATOM 1901 O LYS B 31 16.790 -14.505 3.537 1.00 0.00 O ATOM 1902 CB LYS B 31 17.382 -12.817 6.236 1.00 0.00 C ATOM 1903 CG LYS B 31 16.182 -11.913 6.474 1.00 0.00 C ATOM 1904 CD LYS B 31 15.754 -11.947 7.934 1.00 0.00 C ATOM 1905 CE LYS B 31 14.599 -10.998 8.211 1.00 0.00 C ATOM 1906 NZ LYS B 31 14.071 -11.154 9.595 1.00 0.00 N ATOM 0 H LYS B 31 17.867 -10.704 4.868 1.00 0.00 H new ATOM 0 HA LYS B 31 18.764 -13.477 4.727 1.00 0.00 H new ATOM 0 HB2 LYS B 31 17.109 -13.839 6.500 1.00 0.00 H new ATOM 0 HB3 LYS B 31 18.186 -12.518 6.909 1.00 0.00 H new ATOM 0 HG2 LYS B 31 16.430 -10.891 6.188 1.00 0.00 H new ATOM 0 HG3 LYS B 31 15.353 -12.229 5.841 1.00 0.00 H new ATOM 0 HD2 LYS B 31 15.462 -12.962 8.203 1.00 0.00 H new ATOM 0 HD3 LYS B 31 16.601 -11.681 8.566 1.00 0.00 H new ATOM 0 HE2 LYS B 31 14.930 -9.970 8.063 1.00 0.00 H new ATOM 0 HE3 LYS B 31 13.799 -11.182 7.494 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 13.405 -10.382 9.801 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 13.580 -12.067 9.678 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 14.859 -11.122 10.273 1.00 0.00 H new ATOM 1920 N TYR B 32 15.984 -12.417 3.361 1.00 0.00 N ATOM 1921 CA TYR B 32 14.918 -12.806 2.444 1.00 0.00 C ATOM 1922 C TYR B 32 15.146 -12.251 1.043 1.00 0.00 C ATOM 1923 O TYR B 32 14.986 -12.963 0.052 1.00 0.00 O ATOM 1924 CB TYR B 32 13.560 -12.342 2.972 1.00 0.00 C ATOM 1925 CG TYR B 32 13.124 -13.055 4.233 1.00 0.00 C ATOM 1926 CD1 TYR B 32 12.991 -14.437 4.259 1.00 0.00 C ATOM 1927 CD2 TYR B 32 12.842 -12.347 5.394 1.00 0.00 C ATOM 1928 CE1 TYR B 32 12.588 -15.094 5.407 1.00 0.00 C ATOM 1929 CE2 TYR B 32 12.440 -12.996 6.546 1.00 0.00 C ATOM 1930 CZ TYR B 32 12.316 -14.369 6.547 1.00 0.00 C ATOM 1931 OH TYR B 32 11.915 -15.018 7.693 1.00 0.00 O ATOM 0 H TYR B 32 16.004 -11.424 3.592 1.00 0.00 H new ATOM 0 HA TYR B 32 14.927 -13.894 2.380 1.00 0.00 H new ATOM 0 HB2 TYR B 32 13.602 -11.270 3.167 1.00 0.00 H new ATOM 0 HB3 TYR B 32 12.807 -12.496 2.199 1.00 0.00 H new ATOM 0 HD1 TYR B 32 13.206 -15.008 3.368 1.00 0.00 H new ATOM 0 HD2 TYR B 32 12.938 -11.271 5.397 1.00 0.00 H new ATOM 0 HE1 TYR B 32 12.487 -16.169 5.410 1.00 0.00 H new ATOM 0 HE2 TYR B 32 12.224 -12.431 7.441 1.00 0.00 H new ATOM 0 HH TYR B 32 11.765 -14.362 8.405 1.00 0.00 H new ATOM 1941 N ASN B 33 15.512 -10.978 0.963 1.00 0.00 N ATOM 1942 CA ASN B 33 15.748 -10.336 -0.325 1.00 0.00 C ATOM 1943 C ASN B 33 14.465 -10.319 -1.151 1.00 0.00 C ATOM 1944 O ASN B 33 14.474 -10.631 -2.342 1.00 0.00 O ATOM 1945 CB ASN B 33 16.856 -11.067 -1.093 1.00 0.00 C ATOM 1946 CG ASN B 33 17.235 -10.396 -2.409 1.00 0.00 C ATOM 1947 OD1 ASN B 33 18.004 -10.954 -3.193 1.00 0.00 O ATOM 1948 ND2 ASN B 33 16.721 -9.192 -2.660 1.00 0.00 N ATOM 0 H ASN B 33 15.652 -10.371 1.771 1.00 0.00 H new ATOM 0 HA ASN B 33 16.066 -9.309 -0.145 1.00 0.00 H new ATOM 0 HB2 ASN B 33 17.741 -11.133 -0.461 1.00 0.00 H new ATOM 0 HB3 ASN B 33 16.533 -12.088 -1.296 1.00 0.00 H new ATOM 0 HD21 ASN B 33 16.962 -8.705 -3.523 1.00 0.00 H new ATOM 0 HD22 ASN B 33 16.087 -8.758 -1.989 1.00 0.00 H new ATOM 1955 N ILE B 34 13.362 -9.951 -0.508 1.00 0.00 N ATOM 1956 CA ILE B 34 12.068 -9.890 -1.175 1.00 0.00 C ATOM 1957 C ILE B 34 11.199 -8.797 -0.564 1.00 0.00 C ATOM 1958 O ILE B 34 10.949 -8.788 0.640 1.00 0.00 O ATOM 1959 CB ILE B 34 11.327 -11.240 -1.085 1.00 0.00 C ATOM 1960 CG1 ILE B 34 12.186 -12.359 -1.678 1.00 0.00 C ATOM 1961 CG2 ILE B 34 9.984 -11.161 -1.799 1.00 0.00 C ATOM 1962 CD1 ILE B 34 11.532 -13.722 -1.614 1.00 0.00 C ATOM 0 H ILE B 34 13.339 -9.690 0.478 1.00 0.00 H new ATOM 0 HA ILE B 34 12.254 -9.661 -2.224 1.00 0.00 H new ATOM 0 HB ILE B 34 11.143 -11.465 -0.034 1.00 0.00 H new ATOM 0 HG12 ILE B 34 12.411 -12.121 -2.718 1.00 0.00 H new ATOM 0 HG13 ILE B 34 13.137 -12.396 -1.147 1.00 0.00 H new ATOM 0 HG21 ILE B 34 9.476 -12.122 -1.725 1.00 0.00 H new ATOM 0 HG22 ILE B 34 9.370 -10.389 -1.335 1.00 0.00 H new ATOM 0 HG23 ILE B 34 10.144 -10.915 -2.849 1.00 0.00 H new ATOM 0 HD11 ILE B 34 12.198 -14.466 -2.052 1.00 0.00 H new ATOM 0 HD12 ILE B 34 11.332 -13.981 -0.574 1.00 0.00 H new ATOM 0 HD13 ILE B 34 10.594 -13.702 -2.170 1.00 0.00 H new ATOM 1974 N GLU B 35 10.747 -7.875 -1.405 1.00 0.00 N ATOM 1975 CA GLU B 35 9.913 -6.759 -0.964 1.00 0.00 C ATOM 1976 C GLU B 35 8.781 -7.218 -0.045 1.00 0.00 C ATOM 1977 O GLU B 35 8.518 -6.596 0.985 1.00 0.00 O ATOM 1978 CB GLU B 35 9.344 -6.033 -2.185 1.00 0.00 C ATOM 1979 CG GLU B 35 8.564 -6.939 -3.121 1.00 0.00 C ATOM 1980 CD GLU B 35 8.268 -6.284 -4.457 1.00 0.00 C ATOM 1981 OE1 GLU B 35 7.648 -5.203 -4.465 1.00 0.00 O ATOM 1982 OE2 GLU B 35 8.658 -6.857 -5.497 1.00 0.00 O ATOM 0 H GLU B 35 10.945 -7.877 -2.406 1.00 0.00 H new ATOM 0 HA GLU B 35 10.539 -6.078 -0.388 1.00 0.00 H new ATOM 0 HB2 GLU B 35 8.693 -5.226 -1.847 1.00 0.00 H new ATOM 0 HB3 GLU B 35 10.163 -5.572 -2.737 1.00 0.00 H new ATOM 0 HG2 GLU B 35 9.129 -7.856 -3.288 1.00 0.00 H new ATOM 0 HG3 GLU B 35 7.626 -7.225 -2.645 1.00 0.00 H new ATOM 1989 N LYS B 36 8.113 -8.302 -0.421 1.00 0.00 N ATOM 1990 CA LYS B 36 7.007 -8.831 0.375 1.00 0.00 C ATOM 1991 C LYS B 36 7.470 -9.254 1.769 1.00 0.00 C ATOM 1992 O LYS B 36 6.948 -8.783 2.779 1.00 0.00 O ATOM 1993 CB LYS B 36 6.381 -10.034 -0.333 1.00 0.00 C ATOM 1994 CG LYS B 36 5.195 -10.629 0.412 1.00 0.00 C ATOM 1995 CD LYS B 36 4.709 -11.921 -0.225 1.00 0.00 C ATOM 1996 CE LYS B 36 5.643 -13.091 0.057 1.00 0.00 C ATOM 1997 NZ LYS B 36 6.924 -12.990 -0.693 1.00 0.00 N ATOM 0 H LYS B 36 8.315 -8.832 -1.269 1.00 0.00 H new ATOM 0 HA LYS B 36 6.269 -8.036 0.483 1.00 0.00 H new ATOM 0 HB2 LYS B 36 6.059 -9.732 -1.329 1.00 0.00 H new ATOM 0 HB3 LYS B 36 7.141 -10.804 -0.464 1.00 0.00 H new ATOM 0 HG2 LYS B 36 5.477 -10.820 1.448 1.00 0.00 H new ATOM 0 HG3 LYS B 36 4.380 -9.906 0.431 1.00 0.00 H new ATOM 0 HD2 LYS B 36 3.713 -12.156 0.149 1.00 0.00 H new ATOM 0 HD3 LYS B 36 4.620 -11.781 -1.302 1.00 0.00 H new ATOM 0 HE2 LYS B 36 5.854 -13.134 1.126 1.00 0.00 H new ATOM 0 HE3 LYS B 36 5.143 -14.023 -0.207 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 7.181 -13.925 -1.069 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 6.814 -12.319 -1.480 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 7.674 -12.656 -0.055 1.00 0.00 H new ATOM 2011 N ASP B 37 8.443 -10.160 1.809 1.00 0.00 N ATOM 2012 CA ASP B 37 8.974 -10.677 3.072 1.00 0.00 C ATOM 2013 C ASP B 37 9.394 -9.557 4.025 1.00 0.00 C ATOM 2014 O ASP B 37 9.114 -9.614 5.224 1.00 0.00 O ATOM 2015 CB ASP B 37 10.167 -11.596 2.802 1.00 0.00 C ATOM 2016 CG ASP B 37 9.794 -12.788 1.944 1.00 0.00 C ATOM 2017 OD1 ASP B 37 9.333 -12.578 0.801 1.00 0.00 O ATOM 2018 OD2 ASP B 37 9.962 -13.933 2.413 1.00 0.00 O ATOM 0 H ASP B 37 8.883 -10.555 0.978 1.00 0.00 H new ATOM 0 HA ASP B 37 8.173 -11.238 3.553 1.00 0.00 H new ATOM 0 HB2 ASP B 37 10.955 -11.028 2.308 1.00 0.00 H new ATOM 0 HB3 ASP B 37 10.574 -11.947 3.750 1.00 0.00 H new ATOM 2023 N ILE B 38 10.072 -8.543 3.491 1.00 0.00 N ATOM 2024 CA ILE B 38 10.537 -7.417 4.302 1.00 0.00 C ATOM 2025 C ILE B 38 9.426 -6.891 5.211 1.00 0.00 C ATOM 2026 O ILE B 38 9.569 -6.854 6.436 1.00 0.00 O ATOM 2027 CB ILE B 38 11.038 -6.262 3.404 1.00 0.00 C ATOM 2028 CG1 ILE B 38 12.193 -6.727 2.516 1.00 0.00 C ATOM 2029 CG2 ILE B 38 11.476 -5.071 4.247 1.00 0.00 C ATOM 2030 CD1 ILE B 38 12.556 -5.736 1.430 1.00 0.00 C ATOM 0 H ILE B 38 10.312 -8.477 2.502 1.00 0.00 H new ATOM 0 HA ILE B 38 11.358 -7.784 4.918 1.00 0.00 H new ATOM 0 HB ILE B 38 10.210 -5.952 2.767 1.00 0.00 H new ATOM 0 HG12 ILE B 38 13.069 -6.909 3.138 1.00 0.00 H new ATOM 0 HG13 ILE B 38 11.926 -7.678 2.055 1.00 0.00 H new ATOM 0 HG21 ILE B 38 11.824 -4.271 3.594 1.00 0.00 H new ATOM 0 HG22 ILE B 38 10.633 -4.715 4.839 1.00 0.00 H new ATOM 0 HG23 ILE B 38 12.284 -5.374 4.912 1.00 0.00 H new ATOM 0 HD11 ILE B 38 13.382 -6.131 0.839 1.00 0.00 H new ATOM 0 HD12 ILE B 38 11.693 -5.572 0.784 1.00 0.00 H new ATOM 0 HD13 ILE B 38 12.854 -4.791 1.884 1.00 0.00 H new ATOM 2042 N ALA B 39 8.324 -6.483 4.595 1.00 0.00 N ATOM 2043 CA ALA B 39 7.180 -5.950 5.324 1.00 0.00 C ATOM 2044 C ALA B 39 6.504 -7.012 6.186 1.00 0.00 C ATOM 2045 O ALA B 39 5.819 -6.688 7.156 1.00 0.00 O ATOM 2046 CB ALA B 39 6.177 -5.352 4.350 1.00 0.00 C ATOM 0 H ALA B 39 8.198 -6.512 3.583 1.00 0.00 H new ATOM 0 HA ALA B 39 7.549 -5.173 5.993 1.00 0.00 H new ATOM 0 HB1 ALA B 39 5.325 -4.956 4.903 1.00 0.00 H new ATOM 0 HB2 ALA B 39 6.651 -4.547 3.788 1.00 0.00 H new ATOM 0 HB3 ALA B 39 5.835 -6.124 3.660 1.00 0.00 H new ATOM 2052 N ALA B 40 6.677 -8.275 5.823 1.00 0.00 N ATOM 2053 CA ALA B 40 6.055 -9.365 6.562 1.00 0.00 C ATOM 2054 C ALA B 40 6.580 -9.455 7.992 1.00 0.00 C ATOM 2055 O ALA B 40 5.824 -9.301 8.954 1.00 0.00 O ATOM 2056 CB ALA B 40 6.277 -10.683 5.838 1.00 0.00 C ATOM 0 H ALA B 40 7.240 -8.570 5.025 1.00 0.00 H new ATOM 0 HA ALA B 40 4.986 -9.158 6.616 1.00 0.00 H new ATOM 0 HB1 ALA B 40 5.808 -11.490 6.400 1.00 0.00 H new ATOM 0 HB2 ALA B 40 5.836 -10.630 4.842 1.00 0.00 H new ATOM 0 HB3 ALA B 40 7.346 -10.875 5.752 1.00 0.00 H new ATOM 2062 N HIS B 41 7.873 -9.721 8.125 1.00 0.00 N ATOM 2063 CA HIS B 41 8.485 -9.851 9.442 1.00 0.00 C ATOM 2064 C HIS B 41 8.524 -8.510 10.173 1.00 0.00 C ATOM 2065 O HIS B 41 8.195 -8.432 11.356 1.00 0.00 O ATOM 2066 CB HIS B 41 9.898 -10.432 9.315 1.00 0.00 C ATOM 2067 CG HIS B 41 10.975 -9.401 9.181 1.00 0.00 C ATOM 2068 ND1 HIS B 41 11.364 -8.589 10.224 1.00 0.00 N ATOM 2069 CD2 HIS B 41 11.742 -9.048 8.125 1.00 0.00 C ATOM 2070 CE1 HIS B 41 12.325 -7.781 9.817 1.00 0.00 C ATOM 2071 NE2 HIS B 41 12.575 -8.038 8.548 1.00 0.00 N ATOM 0 H HIS B 41 8.515 -9.850 7.343 1.00 0.00 H new ATOM 0 HA HIS B 41 7.873 -10.534 10.031 1.00 0.00 H new ATOM 0 HB2 HIS B 41 10.106 -11.047 10.191 1.00 0.00 H new ATOM 0 HB3 HIS B 41 9.931 -11.091 8.447 1.00 0.00 H new ATOM 0 HD1 HIS B 41 10.970 -8.609 11.165 1.00 0.00 H new ATOM 0 HD2 HIS B 41 11.707 -9.478 7.135 1.00 0.00 H new ATOM 0 HE1 HIS B 41 12.822 -7.036 10.421 1.00 0.00 H new ATOM 2080 N ILE B 42 8.937 -7.459 9.470 1.00 0.00 N ATOM 2081 CA ILE B 42 9.028 -6.133 10.071 1.00 0.00 C ATOM 2082 C ILE B 42 7.691 -5.686 10.656 1.00 0.00 C ATOM 2083 O ILE B 42 7.636 -5.180 11.775 1.00 0.00 O ATOM 2084 CB ILE B 42 9.525 -5.081 9.056 1.00 0.00 C ATOM 2085 CG1 ILE B 42 10.941 -5.418 8.601 1.00 0.00 C ATOM 2086 CG2 ILE B 42 9.480 -3.682 9.662 1.00 0.00 C ATOM 2087 CD1 ILE B 42 11.489 -4.439 7.588 1.00 0.00 C ATOM 0 H ILE B 42 9.213 -7.500 8.489 1.00 0.00 H new ATOM 0 HA ILE B 42 9.755 -6.210 10.880 1.00 0.00 H new ATOM 0 HB ILE B 42 8.864 -5.098 8.190 1.00 0.00 H new ATOM 0 HG12 ILE B 42 11.599 -5.439 9.469 1.00 0.00 H new ATOM 0 HG13 ILE B 42 10.949 -6.419 8.170 1.00 0.00 H new ATOM 0 HG21 ILE B 42 9.834 -2.957 8.930 1.00 0.00 H new ATOM 0 HG22 ILE B 42 8.455 -3.441 9.945 1.00 0.00 H new ATOM 0 HG23 ILE B 42 10.118 -3.647 10.545 1.00 0.00 H new ATOM 0 HD11 ILE B 42 12.499 -4.735 7.305 1.00 0.00 H new ATOM 0 HD12 ILE B 42 10.851 -4.435 6.704 1.00 0.00 H new ATOM 0 HD13 ILE B 42 11.512 -3.440 8.023 1.00 0.00 H new ATOM 2099 N LYS B 43 6.614 -5.863 9.902 1.00 0.00 N ATOM 2100 CA LYS B 43 5.295 -5.459 10.374 1.00 0.00 C ATOM 2101 C LYS B 43 4.865 -6.251 11.604 1.00 0.00 C ATOM 2102 O LYS B 43 4.431 -5.671 12.599 1.00 0.00 O ATOM 2103 CB LYS B 43 4.252 -5.605 9.266 1.00 0.00 C ATOM 2104 CG LYS B 43 4.383 -4.578 8.148 1.00 0.00 C ATOM 2105 CD LYS B 43 4.135 -3.157 8.638 1.00 0.00 C ATOM 2106 CE LYS B 43 5.407 -2.503 9.163 1.00 0.00 C ATOM 2107 NZ LYS B 43 5.366 -2.280 10.637 1.00 0.00 N ATOM 0 H LYS B 43 6.626 -6.279 8.971 1.00 0.00 H new ATOM 0 HA LYS B 43 5.365 -4.409 10.659 1.00 0.00 H new ATOM 0 HB2 LYS B 43 4.330 -6.604 8.838 1.00 0.00 H new ATOM 0 HB3 LYS B 43 3.258 -5.523 9.705 1.00 0.00 H new ATOM 0 HG2 LYS B 43 5.381 -4.642 7.714 1.00 0.00 H new ATOM 0 HG3 LYS B 43 3.675 -4.815 7.354 1.00 0.00 H new ATOM 0 HD2 LYS B 43 3.730 -2.558 7.822 1.00 0.00 H new ATOM 0 HD3 LYS B 43 3.383 -3.172 9.427 1.00 0.00 H new ATOM 0 HE2 LYS B 43 6.263 -3.131 8.917 1.00 0.00 H new ATOM 0 HE3 LYS B 43 5.556 -1.549 8.658 1.00 0.00 H new ATOM 0 HZ1 LYS B 43 5.257 -1.264 10.832 1.00 0.00 H new ATOM 0 HZ2 LYS B 43 4.562 -2.798 11.044 1.00 0.00 H new ATOM 0 HZ3 LYS B 43 6.250 -2.622 11.065 1.00 0.00 H new ATOM 2121 N LYS B 44 4.974 -7.572 11.540 1.00 0.00 N ATOM 2122 CA LYS B 44 4.576 -8.416 12.664 1.00 0.00 C ATOM 2123 C LYS B 44 5.327 -8.045 13.940 1.00 0.00 C ATOM 2124 O LYS B 44 4.728 -7.944 15.010 1.00 0.00 O ATOM 2125 CB LYS B 44 4.800 -9.893 12.334 1.00 0.00 C ATOM 2126 CG LYS B 44 3.947 -10.397 11.182 1.00 0.00 C ATOM 2127 CD LYS B 44 4.234 -11.860 10.878 1.00 0.00 C ATOM 2128 CE LYS B 44 3.385 -12.366 9.722 1.00 0.00 C ATOM 2129 NZ LYS B 44 3.656 -13.798 9.420 1.00 0.00 N ATOM 0 H LYS B 44 5.331 -8.080 10.731 1.00 0.00 H new ATOM 0 HA LYS B 44 3.513 -8.247 12.838 1.00 0.00 H new ATOM 0 HB2 LYS B 44 5.851 -10.046 12.090 1.00 0.00 H new ATOM 0 HB3 LYS B 44 4.588 -10.491 13.220 1.00 0.00 H new ATOM 0 HG2 LYS B 44 2.892 -10.275 11.428 1.00 0.00 H new ATOM 0 HG3 LYS B 44 4.139 -9.795 10.294 1.00 0.00 H new ATOM 0 HD2 LYS B 44 5.290 -11.982 10.636 1.00 0.00 H new ATOM 0 HD3 LYS B 44 4.039 -12.462 11.765 1.00 0.00 H new ATOM 0 HE2 LYS B 44 2.330 -12.239 9.964 1.00 0.00 H new ATOM 0 HE3 LYS B 44 3.583 -11.764 8.835 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 3.058 -14.105 8.626 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 4.657 -13.915 9.164 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 3.443 -14.376 10.258 1.00 0.00 H new ATOM 2143 N GLU B 45 6.633 -7.847 13.826 1.00 0.00 N ATOM 2144 CA GLU B 45 7.447 -7.491 14.984 1.00 0.00 C ATOM 2145 C GLU B 45 6.959 -6.193 15.622 1.00 0.00 C ATOM 2146 O GLU B 45 6.802 -6.110 16.837 1.00 0.00 O ATOM 2147 CB GLU B 45 8.918 -7.356 14.584 1.00 0.00 C ATOM 2148 CG GLU B 45 9.549 -8.664 14.133 1.00 0.00 C ATOM 2149 CD GLU B 45 10.997 -8.500 13.711 1.00 0.00 C ATOM 2150 OE1 GLU B 45 11.508 -7.361 13.766 1.00 0.00 O ATOM 2151 OE2 GLU B 45 11.620 -9.512 13.323 1.00 0.00 O ATOM 0 H GLU B 45 7.150 -7.926 12.951 1.00 0.00 H new ATOM 0 HA GLU B 45 7.350 -8.291 15.718 1.00 0.00 H new ATOM 0 HB2 GLU B 45 9.001 -6.626 13.779 1.00 0.00 H new ATOM 0 HB3 GLU B 45 9.481 -6.963 15.430 1.00 0.00 H new ATOM 0 HG2 GLU B 45 9.491 -9.389 14.944 1.00 0.00 H new ATOM 0 HG3 GLU B 45 8.976 -9.071 13.300 1.00 0.00 H new ATOM 2158 N PHE B 46 6.723 -5.181 14.795 1.00 0.00 N ATOM 2159 CA PHE B 46 6.257 -3.889 15.286 1.00 0.00 C ATOM 2160 C PHE B 46 4.866 -3.989 15.903 1.00 0.00 C ATOM 2161 O PHE B 46 4.621 -3.450 16.983 1.00 0.00 O ATOM 2162 CB PHE B 46 6.266 -2.858 14.162 1.00 0.00 C ATOM 2163 CG PHE B 46 7.643 -2.371 13.793 1.00 0.00 C ATOM 2164 CD1 PHE B 46 8.650 -3.262 13.455 1.00 0.00 C ATOM 2165 CD2 PHE B 46 7.921 -1.016 13.771 1.00 0.00 C ATOM 2166 CE1 PHE B 46 9.908 -2.807 13.103 1.00 0.00 C ATOM 2167 CE2 PHE B 46 9.176 -0.554 13.423 1.00 0.00 C ATOM 2168 CZ PHE B 46 10.171 -1.451 13.086 1.00 0.00 C ATOM 0 H PHE B 46 6.846 -5.230 13.784 1.00 0.00 H new ATOM 0 HA PHE B 46 6.944 -3.567 16.069 1.00 0.00 H new ATOM 0 HB2 PHE B 46 5.796 -3.292 13.280 1.00 0.00 H new ATOM 0 HB3 PHE B 46 5.657 -2.005 14.460 1.00 0.00 H new ATOM 0 HD1 PHE B 46 8.450 -4.323 13.467 1.00 0.00 H new ATOM 0 HD2 PHE B 46 7.146 -0.309 14.029 1.00 0.00 H new ATOM 0 HE1 PHE B 46 10.684 -3.511 12.842 1.00 0.00 H new ATOM 0 HE2 PHE B 46 9.379 0.507 13.415 1.00 0.00 H new ATOM 0 HZ PHE B 46 11.152 -1.093 12.810 1.00 0.00 H new ATOM 2178 N ASP B 47 3.958 -4.681 15.226 1.00 0.00 N ATOM 2179 CA ASP B 47 2.601 -4.841 15.735 1.00 0.00 C ATOM 2180 C ASP B 47 2.617 -5.543 17.090 1.00 0.00 C ATOM 2181 O ASP B 47 1.785 -5.275 17.951 1.00 0.00 O ATOM 2182 CB ASP B 47 1.740 -5.627 14.744 1.00 0.00 C ATOM 2183 CG ASP B 47 1.429 -4.830 13.491 1.00 0.00 C ATOM 2184 OD1 ASP B 47 2.380 -4.400 12.808 1.00 0.00 O ATOM 2185 OD2 ASP B 47 0.231 -4.639 13.194 1.00 0.00 O ATOM 0 H ASP B 47 4.134 -5.137 14.331 1.00 0.00 H new ATOM 0 HA ASP B 47 2.167 -3.849 15.860 1.00 0.00 H new ATOM 0 HB2 ASP B 47 2.256 -6.547 14.468 1.00 0.00 H new ATOM 0 HB3 ASP B 47 0.807 -5.918 15.228 1.00 0.00 H new ATOM 2190 N LYS B 48 3.569 -6.448 17.265 1.00 0.00 N ATOM 2191 CA LYS B 48 3.697 -7.197 18.509 1.00 0.00 C ATOM 2192 C LYS B 48 4.412 -6.370 19.581 1.00 0.00 C ATOM 2193 O LYS B 48 4.024 -6.370 20.748 1.00 0.00 O ATOM 2194 CB LYS B 48 4.468 -8.493 18.252 1.00 0.00 C ATOM 2195 CG LYS B 48 4.046 -9.642 19.149 1.00 0.00 C ATOM 2196 CD LYS B 48 4.148 -9.276 20.620 1.00 0.00 C ATOM 2197 CE LYS B 48 3.612 -10.388 21.500 1.00 0.00 C ATOM 2198 NZ LYS B 48 3.738 -10.063 22.948 1.00 0.00 N ATOM 0 H LYS B 48 4.267 -6.683 16.559 1.00 0.00 H new ATOM 0 HA LYS B 48 2.697 -7.431 18.873 1.00 0.00 H new ATOM 0 HB2 LYS B 48 4.331 -8.787 17.211 1.00 0.00 H new ATOM 0 HB3 LYS B 48 5.533 -8.306 18.393 1.00 0.00 H new ATOM 0 HG2 LYS B 48 3.020 -9.927 18.916 1.00 0.00 H new ATOM 0 HG3 LYS B 48 4.673 -10.511 18.946 1.00 0.00 H new ATOM 0 HD2 LYS B 48 5.188 -9.075 20.876 1.00 0.00 H new ATOM 0 HD3 LYS B 48 3.591 -8.359 20.809 1.00 0.00 H new ATOM 0 HE2 LYS B 48 2.564 -10.568 21.259 1.00 0.00 H new ATOM 0 HE3 LYS B 48 4.152 -11.311 21.287 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 3.360 -10.849 23.514 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 4.740 -9.916 23.185 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 3.202 -9.197 23.157 1.00 0.00 H new ATOM 2212 N LYS B 49 5.472 -5.682 19.172 1.00 0.00 N ATOM 2213 CA LYS B 49 6.266 -4.868 20.092 1.00 0.00 C ATOM 2214 C LYS B 49 5.613 -3.527 20.411 1.00 0.00 C ATOM 2215 O LYS B 49 5.333 -3.222 21.571 1.00 0.00 O ATOM 2216 CB LYS B 49 7.658 -4.626 19.505 1.00 0.00 C ATOM 2217 CG LYS B 49 8.455 -5.901 19.277 1.00 0.00 C ATOM 2218 CD LYS B 49 9.842 -5.599 18.732 1.00 0.00 C ATOM 2219 CE LYS B 49 10.642 -6.870 18.509 1.00 0.00 C ATOM 2220 NZ LYS B 49 12.005 -6.585 17.981 1.00 0.00 N ATOM 0 H LYS B 49 5.804 -5.670 18.208 1.00 0.00 H new ATOM 0 HA LYS B 49 6.337 -5.427 21.025 1.00 0.00 H new ATOM 0 HB2 LYS B 49 7.556 -4.097 18.557 1.00 0.00 H new ATOM 0 HB3 LYS B 49 8.217 -3.973 20.176 1.00 0.00 H new ATOM 0 HG2 LYS B 49 8.543 -6.450 20.215 1.00 0.00 H new ATOM 0 HG3 LYS B 49 7.921 -6.546 18.579 1.00 0.00 H new ATOM 0 HD2 LYS B 49 9.754 -5.054 17.792 1.00 0.00 H new ATOM 0 HD3 LYS B 49 10.374 -4.950 19.428 1.00 0.00 H new ATOM 0 HE2 LYS B 49 10.724 -7.416 19.449 1.00 0.00 H new ATOM 0 HE3 LYS B 49 10.110 -7.516 17.810 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 12.518 -7.479 17.843 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 11.928 -6.086 17.072 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 12.523 -5.990 18.659 1.00 0.00 H new ATOM 2234 N TYR B 50 5.404 -2.722 19.383 1.00 0.00 N ATOM 2235 CA TYR B 50 4.818 -1.396 19.546 1.00 0.00 C ATOM 2236 C TYR B 50 3.294 -1.431 19.587 1.00 0.00 C ATOM 2237 O TYR B 50 2.666 -0.469 20.026 1.00 0.00 O ATOM 2238 CB TYR B 50 5.299 -0.469 18.429 1.00 0.00 C ATOM 2239 CG TYR B 50 6.790 -0.221 18.457 1.00 0.00 C ATOM 2240 CD1 TYR B 50 7.690 -1.269 18.309 1.00 0.00 C ATOM 2241 CD2 TYR B 50 7.300 1.057 18.642 1.00 0.00 C ATOM 2242 CE1 TYR B 50 9.052 -1.052 18.345 1.00 0.00 C ATOM 2243 CE2 TYR B 50 8.663 1.285 18.677 1.00 0.00 C ATOM 2244 CZ TYR B 50 9.534 0.226 18.528 1.00 0.00 C ATOM 2245 OH TYR B 50 10.893 0.447 18.562 1.00 0.00 O ATOM 0 H TYR B 50 5.632 -2.963 18.419 1.00 0.00 H new ATOM 0 HA TYR B 50 5.153 -1.011 20.509 1.00 0.00 H new ATOM 0 HB2 TYR B 50 5.028 -0.901 17.466 1.00 0.00 H new ATOM 0 HB3 TYR B 50 4.778 0.485 18.508 1.00 0.00 H new ATOM 0 HD1 TYR B 50 7.317 -2.272 18.163 1.00 0.00 H new ATOM 0 HD2 TYR B 50 6.620 1.888 18.761 1.00 0.00 H new ATOM 0 HE1 TYR B 50 9.737 -1.879 18.230 1.00 0.00 H new ATOM 0 HE2 TYR B 50 9.043 2.286 18.820 1.00 0.00 H new ATOM 0 HH TYR B 50 11.066 1.402 18.697 1.00 0.00 H new ATOM 2255 N ASN B 51 2.709 -2.533 19.112 1.00 0.00 N ATOM 2256 CA ASN B 51 1.252 -2.703 19.073 1.00 0.00 C ATOM 2257 C ASN B 51 0.710 -2.258 17.721 1.00 0.00 C ATOM 2258 O ASN B 51 1.220 -1.310 17.123 1.00 0.00 O ATOM 2259 CB ASN B 51 0.549 -1.931 20.197 1.00 0.00 C ATOM 2260 CG ASN B 51 1.109 -2.264 21.567 1.00 0.00 C ATOM 2261 OD1 ASN B 51 1.085 -3.418 21.996 1.00 0.00 O ATOM 2262 ND2 ASN B 51 1.617 -1.251 22.261 1.00 0.00 N ATOM 0 H ASN B 51 3.228 -3.330 18.745 1.00 0.00 H new ATOM 0 HA ASN B 51 1.044 -3.763 19.222 1.00 0.00 H new ATOM 0 HB2 ASN B 51 0.650 -0.861 20.017 1.00 0.00 H new ATOM 0 HB3 ASN B 51 -0.517 -2.158 20.178 1.00 0.00 H new ATOM 0 HD21 ASN B 51 2.008 -1.414 23.189 1.00 0.00 H new ATOM 0 HD22 ASN B 51 1.616 -0.311 21.866 1.00 0.00 H new ATOM 2269 N PRO B 52 -0.322 -2.945 17.205 1.00 0.00 N ATOM 2270 CA PRO B 52 -0.909 -2.616 15.905 1.00 0.00 C ATOM 2271 C PRO B 52 -1.495 -1.201 15.864 1.00 0.00 C ATOM 2272 O PRO B 52 -1.593 -0.540 16.897 1.00 0.00 O ATOM 2273 CB PRO B 52 -2.019 -3.661 15.727 1.00 0.00 C ATOM 2274 CG PRO B 52 -1.679 -4.758 16.676 1.00 0.00 C ATOM 2275 CD PRO B 52 -0.990 -4.099 17.833 1.00 0.00 C ATOM 0 HA PRO B 52 -0.160 -2.635 15.113 1.00 0.00 H new ATOM 0 HB2 PRO B 52 -2.998 -3.237 15.950 1.00 0.00 H new ATOM 0 HB3 PRO B 52 -2.056 -4.026 14.700 1.00 0.00 H new ATOM 0 HG2 PRO B 52 -2.576 -5.284 17.003 1.00 0.00 H new ATOM 0 HG3 PRO B 52 -1.031 -5.496 16.204 1.00 0.00 H new ATOM 0 HD2 PRO B 52 -1.698 -3.787 18.601 1.00 0.00 H new ATOM 0 HD3 PRO B 52 -0.275 -4.768 18.312 1.00 0.00 H new ATOM 2283 N THR B 53 -1.881 -0.729 14.668 1.00 0.00 N ATOM 2284 CA THR B 53 -1.767 -1.506 13.441 1.00 0.00 C ATOM 2285 C THR B 53 -0.838 -0.823 12.445 1.00 0.00 C ATOM 2286 O THR B 53 -1.111 0.280 11.972 1.00 0.00 O ATOM 2287 CB THR B 53 -3.152 -1.692 12.829 1.00 0.00 C ATOM 2288 OG1 THR B 53 -3.096 -2.517 11.681 1.00 0.00 O ATOM 2289 CG2 THR B 53 -3.799 -0.389 12.425 1.00 0.00 C ATOM 0 H THR B 53 -2.279 0.200 14.533 1.00 0.00 H new ATOM 0 HA THR B 53 -1.341 -2.480 13.682 1.00 0.00 H new ATOM 0 HB THR B 53 -3.751 -2.156 13.612 1.00 0.00 H new ATOM 0 HG1 THR B 53 -3.997 -2.621 11.309 1.00 0.00 H new ATOM 0 HG21 THR B 53 -4.781 -0.588 11.997 1.00 0.00 H new ATOM 0 HG22 THR B 53 -3.908 0.250 13.301 1.00 0.00 H new ATOM 0 HG23 THR B 53 -3.175 0.113 11.685 1.00 0.00 H new ATOM 2297 N TRP B 54 0.269 -1.485 12.138 1.00 0.00 N ATOM 2298 CA TRP B 54 1.249 -0.947 11.208 1.00 0.00 C ATOM 2299 C TRP B 54 0.983 -1.394 9.781 1.00 0.00 C ATOM 2300 O TRP B 54 0.498 -2.498 9.539 1.00 0.00 O ATOM 2301 CB TRP B 54 2.652 -1.358 11.624 1.00 0.00 C ATOM 2302 CG TRP B 54 2.997 -0.921 13.007 1.00 0.00 C ATOM 2303 CD1 TRP B 54 2.376 -1.302 14.158 1.00 0.00 C ATOM 2304 CD2 TRP B 54 4.025 -0.003 13.386 1.00 0.00 C ATOM 2305 NE1 TRP B 54 2.974 -0.703 15.235 1.00 0.00 N ATOM 2306 CE2 TRP B 54 3.987 0.106 14.787 1.00 0.00 C ATOM 2307 CE3 TRP B 54 4.979 0.730 12.678 1.00 0.00 C ATOM 2308 CZ2 TRP B 54 4.867 0.920 15.495 1.00 0.00 C ATOM 2309 CZ3 TRP B 54 5.851 1.541 13.380 1.00 0.00 C ATOM 2310 CH2 TRP B 54 5.791 1.629 14.776 1.00 0.00 C ATOM 0 H TRP B 54 0.510 -2.399 12.522 1.00 0.00 H new ATOM 0 HA TRP B 54 1.163 0.139 11.239 1.00 0.00 H new ATOM 0 HB2 TRP B 54 2.743 -2.442 11.557 1.00 0.00 H new ATOM 0 HB3 TRP B 54 3.372 -0.934 10.924 1.00 0.00 H new ATOM 0 HD1 TRP B 54 1.535 -1.978 14.213 1.00 0.00 H new ATOM 0 HE1 TRP B 54 2.709 -0.837 16.211 1.00 0.00 H new ATOM 0 HE3 TRP B 54 5.035 0.665 11.601 1.00 0.00 H new ATOM 0 HZ2 TRP B 54 4.822 0.989 16.572 1.00 0.00 H new ATOM 0 HZ3 TRP B 54 6.591 2.116 12.843 1.00 0.00 H new ATOM 0 HH2 TRP B 54 6.488 2.269 15.296 1.00 0.00 H new ATOM 2321 N HIS B 55 1.314 -0.519 8.844 1.00 0.00 N ATOM 2322 CA HIS B 55 1.129 -0.799 7.430 1.00 0.00 C ATOM 2323 C HIS B 55 2.450 -0.613 6.705 1.00 0.00 C ATOM 2324 O HIS B 55 3.175 0.343 6.978 1.00 0.00 O ATOM 2325 CB HIS B 55 0.074 0.142 6.856 1.00 0.00 C ATOM 2326 CG HIS B 55 -1.081 0.361 7.782 1.00 0.00 C ATOM 2327 ND1 HIS B 55 -1.927 -0.649 8.186 1.00 0.00 N ATOM 2328 CD2 HIS B 55 -1.516 1.482 8.396 1.00 0.00 C ATOM 2329 CE1 HIS B 55 -2.839 -0.156 9.003 1.00 0.00 C ATOM 2330 NE2 HIS B 55 -2.612 1.136 9.148 1.00 0.00 N ATOM 0 H HIS B 55 1.715 0.398 9.041 1.00 0.00 H new ATOM 0 HA HIS B 55 0.792 -1.827 7.298 1.00 0.00 H new ATOM 0 HB2 HIS B 55 0.537 1.102 6.628 1.00 0.00 H new ATOM 0 HB3 HIS B 55 -0.295 -0.265 5.915 1.00 0.00 H new ATOM 0 HD2 HIS B 55 -1.083 2.468 8.312 1.00 0.00 H new ATOM 0 HE1 HIS B 55 -3.635 -0.715 9.473 1.00 0.00 H new ATOM 0 HE2 HIS B 55 -3.161 1.774 9.725 1.00 0.00 H new ATOM 2339 N CYS B 56 2.779 -1.526 5.798 1.00 0.00 N ATOM 2340 CA CYS B 56 4.042 -1.429 5.073 1.00 0.00 C ATOM 2341 C CYS B 56 3.905 -1.873 3.623 1.00 0.00 C ATOM 2342 O CYS B 56 3.123 -2.768 3.300 1.00 0.00 O ATOM 2343 CB CYS B 56 5.119 -2.259 5.774 1.00 0.00 C ATOM 2344 SG CYS B 56 6.733 -2.221 4.958 1.00 0.00 S ATOM 0 H CYS B 56 2.201 -2.329 5.549 1.00 0.00 H new ATOM 0 HA CYS B 56 4.335 -0.379 5.070 1.00 0.00 H new ATOM 0 HB2 CYS B 56 5.233 -1.897 6.796 1.00 0.00 H new ATOM 0 HB3 CYS B 56 4.781 -3.293 5.837 1.00 0.00 H new ATOM 0 HG CYS B 56 7.041 -0.993 4.662 1.00 0.00 H new ATOM 2350 N ILE B 57 4.685 -1.235 2.760 1.00 0.00 N ATOM 2351 CA ILE B 57 4.684 -1.539 1.336 1.00 0.00 C ATOM 2352 C ILE B 57 6.097 -1.414 0.776 1.00 0.00 C ATOM 2353 O ILE B 57 6.870 -0.561 1.212 1.00 0.00 O ATOM 2354 CB ILE B 57 3.749 -0.593 0.557 1.00 0.00 C ATOM 2355 CG1 ILE B 57 2.358 -0.565 1.195 1.00 0.00 C ATOM 2356 CG2 ILE B 57 3.656 -1.027 -0.897 1.00 0.00 C ATOM 2357 CD1 ILE B 57 1.648 -1.901 1.167 1.00 0.00 C ATOM 0 H ILE B 57 5.334 -0.495 3.027 1.00 0.00 H new ATOM 0 HA ILE B 57 4.322 -2.560 1.217 1.00 0.00 H new ATOM 0 HB ILE B 57 4.164 0.414 0.596 1.00 0.00 H new ATOM 0 HG12 ILE B 57 2.449 -0.234 2.229 1.00 0.00 H new ATOM 0 HG13 ILE B 57 1.745 0.173 0.677 1.00 0.00 H new ATOM 0 HG21 ILE B 57 2.993 -0.351 -1.437 1.00 0.00 H new ATOM 0 HG22 ILE B 57 4.648 -1.000 -1.349 1.00 0.00 H new ATOM 0 HG23 ILE B 57 3.261 -2.042 -0.949 1.00 0.00 H new ATOM 0 HD11 ILE B 57 0.669 -1.803 1.637 1.00 0.00 H new ATOM 0 HD12 ILE B 57 1.524 -2.226 0.134 1.00 0.00 H new ATOM 0 HD13 ILE B 57 2.239 -2.638 1.710 1.00 0.00 H new ATOM 2369 N VAL B 58 6.439 -2.269 -0.182 1.00 0.00 N ATOM 2370 CA VAL B 58 7.770 -2.240 -0.776 1.00 0.00 C ATOM 2371 C VAL B 58 7.737 -2.725 -2.219 1.00 0.00 C ATOM 2372 O VAL B 58 7.147 -3.760 -2.521 1.00 0.00 O ATOM 2373 CB VAL B 58 8.760 -3.109 0.029 1.00 0.00 C ATOM 2374 CG1 VAL B 58 10.156 -3.051 -0.576 1.00 0.00 C ATOM 2375 CG2 VAL B 58 8.784 -2.675 1.486 1.00 0.00 C ATOM 0 H VAL B 58 5.819 -2.985 -0.561 1.00 0.00 H new ATOM 0 HA VAL B 58 8.107 -1.204 -0.754 1.00 0.00 H new ATOM 0 HB VAL B 58 8.420 -4.144 -0.017 1.00 0.00 H new ATOM 0 HG11 VAL B 58 10.833 -3.672 0.011 1.00 0.00 H new ATOM 0 HG12 VAL B 58 10.124 -3.419 -1.602 1.00 0.00 H new ATOM 0 HG13 VAL B 58 10.512 -2.021 -0.571 1.00 0.00 H new ATOM 0 HG21 VAL B 58 9.487 -3.298 2.040 1.00 0.00 H new ATOM 0 HG22 VAL B 58 9.095 -1.632 1.550 1.00 0.00 H new ATOM 0 HG23 VAL B 58 7.788 -2.784 1.914 1.00 0.00 H new ATOM 2385 N GLY B 59 8.377 -1.972 -3.107 1.00 0.00 N ATOM 2386 CA GLY B 59 8.407 -2.347 -4.509 1.00 0.00 C ATOM 2387 C GLY B 59 9.208 -1.377 -5.356 1.00 0.00 C ATOM 2388 O GLY B 59 10.291 -0.946 -4.961 1.00 0.00 O ATOM 0 H GLY B 59 8.875 -1.110 -2.882 1.00 0.00 H new ATOM 0 HA2 GLY B 59 8.834 -3.345 -4.605 1.00 0.00 H new ATOM 0 HA3 GLY B 59 7.387 -2.399 -4.889 1.00 0.00 H new ATOM 2392 N ARG B 60 8.677 -1.032 -6.528 1.00 0.00 N ATOM 2393 CA ARG B 60 9.359 -0.108 -7.436 1.00 0.00 C ATOM 2394 C ARG B 60 8.384 0.532 -8.421 1.00 0.00 C ATOM 2395 O ARG B 60 8.760 0.871 -9.541 1.00 0.00 O ATOM 2396 CB ARG B 60 10.445 -0.846 -8.220 1.00 0.00 C ATOM 2397 CG ARG B 60 11.516 -1.474 -7.348 1.00 0.00 C ATOM 2398 CD ARG B 60 12.542 -2.210 -8.189 1.00 0.00 C ATOM 2399 NE ARG B 60 11.954 -3.344 -8.900 1.00 0.00 N ATOM 2400 CZ ARG B 60 12.653 -4.189 -9.655 1.00 0.00 C ATOM 2401 NH1 ARG B 60 13.966 -4.042 -9.788 1.00 0.00 N ATOM 2402 NH2 ARG B 60 12.038 -5.188 -10.273 1.00 0.00 N ATOM 0 H ARG B 60 7.780 -1.376 -6.871 1.00 0.00 H new ATOM 0 HA ARG B 60 9.805 0.678 -6.827 1.00 0.00 H new ATOM 0 HB2 ARG B 60 9.978 -1.625 -8.822 1.00 0.00 H new ATOM 0 HB3 ARG B 60 10.917 -0.148 -8.912 1.00 0.00 H new ATOM 0 HG2 ARG B 60 12.010 -0.701 -6.760 1.00 0.00 H new ATOM 0 HG3 ARG B 60 11.056 -2.166 -6.642 1.00 0.00 H new ATOM 0 HD2 ARG B 60 12.983 -1.520 -8.908 1.00 0.00 H new ATOM 0 HD3 ARG B 60 13.350 -2.563 -7.548 1.00 0.00 H new ATOM 0 HE ARG B 60 10.949 -3.497 -8.813 1.00 0.00 H new ATOM 0 HH11 ARG B 60 14.445 -3.278 -9.310 1.00 0.00 H new ATOM 0 HH12 ARG B 60 14.496 -4.693 -10.368 1.00 0.00 H new ATOM 0 HH21 ARG B 60 11.030 -5.308 -10.170 1.00 0.00 H new ATOM 0 HH22 ARG B 60 12.572 -5.836 -10.852 1.00 0.00 H new ATOM 2416 N ASN B 61 7.138 0.695 -7.989 1.00 0.00 N ATOM 2417 CA ASN B 61 6.088 1.295 -8.815 1.00 0.00 C ATOM 2418 C ASN B 61 4.721 1.008 -8.206 1.00 0.00 C ATOM 2419 O ASN B 61 4.051 0.052 -8.596 1.00 0.00 O ATOM 2420 CB ASN B 61 6.130 0.754 -10.252 1.00 0.00 C ATOM 2421 CG ASN B 61 5.072 1.365 -11.164 1.00 0.00 C ATOM 2422 OD1 ASN B 61 4.875 0.898 -12.285 1.00 0.00 O ATOM 2423 ND2 ASN B 61 4.402 2.425 -10.710 1.00 0.00 N ATOM 0 H ASN B 61 6.825 0.417 -7.059 1.00 0.00 H new ATOM 0 HA ASN B 61 6.261 2.371 -8.847 1.00 0.00 H new ATOM 0 HB2 ASN B 61 7.116 0.945 -10.675 1.00 0.00 H new ATOM 0 HB3 ASN B 61 5.997 -0.328 -10.228 1.00 0.00 H new ATOM 0 HD21 ASN B 61 3.700 2.875 -11.298 1.00 0.00 H new ATOM 0 HD22 ASN B 61 4.591 2.786 -9.775 1.00 0.00 H new ATOM 2430 N PHE B 62 4.315 1.822 -7.240 1.00 0.00 N ATOM 2431 CA PHE B 62 3.030 1.615 -6.581 1.00 0.00 C ATOM 2432 C PHE B 62 2.469 2.893 -5.968 1.00 0.00 C ATOM 2433 O PHE B 62 3.164 3.620 -5.257 1.00 0.00 O ATOM 2434 CB PHE B 62 3.185 0.565 -5.484 1.00 0.00 C ATOM 2435 CG PHE B 62 4.099 0.998 -4.372 1.00 0.00 C ATOM 2436 CD1 PHE B 62 5.443 1.236 -4.614 1.00 0.00 C ATOM 2437 CD2 PHE B 62 3.613 1.176 -3.087 1.00 0.00 C ATOM 2438 CE1 PHE B 62 6.284 1.641 -3.595 1.00 0.00 C ATOM 2439 CE2 PHE B 62 4.448 1.582 -2.064 1.00 0.00 C ATOM 2440 CZ PHE B 62 5.787 1.814 -2.318 1.00 0.00 C ATOM 0 H PHE B 62 4.848 2.622 -6.898 1.00 0.00 H new ATOM 0 HA PHE B 62 2.328 1.281 -7.345 1.00 0.00 H new ATOM 0 HB2 PHE B 62 2.203 0.335 -5.070 1.00 0.00 H new ATOM 0 HB3 PHE B 62 3.569 -0.356 -5.923 1.00 0.00 H new ATOM 0 HD1 PHE B 62 5.837 1.103 -5.611 1.00 0.00 H new ATOM 0 HD2 PHE B 62 2.568 0.995 -2.882 1.00 0.00 H new ATOM 0 HE1 PHE B 62 7.329 1.822 -3.797 1.00 0.00 H new ATOM 0 HE2 PHE B 62 4.055 1.718 -1.067 1.00 0.00 H new ATOM 0 HZ PHE B 62 6.443 2.130 -1.520 1.00 0.00 H new ATOM 2450 N GLY B 63 1.188 3.129 -6.226 1.00 0.00 N ATOM 2451 CA GLY B 63 0.508 4.285 -5.670 1.00 0.00 C ATOM 2452 C GLY B 63 -0.253 3.901 -4.418 1.00 0.00 C ATOM 2453 O GLY B 63 -0.718 2.769 -4.311 1.00 0.00 O ATOM 0 H GLY B 63 0.604 2.536 -6.815 1.00 0.00 H new ATOM 0 HA2 GLY B 63 1.234 5.064 -5.437 1.00 0.00 H new ATOM 0 HA3 GLY B 63 -0.179 4.700 -6.408 1.00 0.00 H new ATOM 2457 N SER B 64 -0.373 4.810 -3.452 1.00 0.00 N ATOM 2458 CA SER B 64 -1.078 4.469 -2.219 1.00 0.00 C ATOM 2459 C SER B 64 -1.574 5.692 -1.451 1.00 0.00 C ATOM 2460 O SER B 64 -0.974 6.769 -1.493 1.00 0.00 O ATOM 2461 CB SER B 64 -0.175 3.629 -1.314 1.00 0.00 C ATOM 2462 OG SER B 64 0.999 4.338 -0.961 1.00 0.00 O ATOM 0 H SER B 64 -0.004 5.760 -3.495 1.00 0.00 H new ATOM 0 HA SER B 64 -1.958 3.898 -2.514 1.00 0.00 H new ATOM 0 HB2 SER B 64 -0.719 3.349 -0.412 1.00 0.00 H new ATOM 0 HB3 SER B 64 0.095 2.704 -1.823 1.00 0.00 H new ATOM 0 HG SER B 64 1.214 4.167 -0.020 1.00 0.00 H new ATOM 2468 N TYR B 65 -2.678 5.482 -0.733 1.00 0.00 N ATOM 2469 CA TYR B 65 -3.305 6.512 0.088 1.00 0.00 C ATOM 2470 C TYR B 65 -3.770 5.875 1.398 1.00 0.00 C ATOM 2471 O TYR B 65 -4.371 4.801 1.391 1.00 0.00 O ATOM 2472 CB TYR B 65 -4.486 7.136 -0.661 1.00 0.00 C ATOM 2473 CG TYR B 65 -5.036 8.390 -0.016 1.00 0.00 C ATOM 2474 CD1 TYR B 65 -5.598 8.361 1.254 1.00 0.00 C ATOM 2475 CD2 TYR B 65 -4.995 9.606 -0.687 1.00 0.00 C ATOM 2476 CE1 TYR B 65 -6.105 9.509 1.835 1.00 0.00 C ATOM 2477 CE2 TYR B 65 -5.497 10.757 -0.112 1.00 0.00 C ATOM 2478 CZ TYR B 65 -6.051 10.702 1.149 1.00 0.00 C ATOM 2479 OH TYR B 65 -6.557 11.845 1.723 1.00 0.00 O ATOM 0 H TYR B 65 -3.164 4.585 -0.706 1.00 0.00 H new ATOM 0 HA TYR B 65 -2.589 7.305 0.304 1.00 0.00 H new ATOM 0 HB2 TYR B 65 -4.173 7.371 -1.678 1.00 0.00 H new ATOM 0 HB3 TYR B 65 -5.285 6.399 -0.736 1.00 0.00 H new ATOM 0 HD1 TYR B 65 -5.640 7.428 1.796 1.00 0.00 H new ATOM 0 HD2 TYR B 65 -4.563 9.652 -1.676 1.00 0.00 H new ATOM 0 HE1 TYR B 65 -6.541 9.470 2.822 1.00 0.00 H new ATOM 0 HE2 TYR B 65 -5.456 11.694 -0.647 1.00 0.00 H new ATOM 0 HH TYR B 65 -5.882 12.555 1.689 1.00 0.00 H new ATOM 2489 N VAL B 66 -3.453 6.514 2.521 1.00 0.00 N ATOM 2490 CA VAL B 66 -3.803 5.970 3.834 1.00 0.00 C ATOM 2491 C VAL B 66 -3.896 7.074 4.890 1.00 0.00 C ATOM 2492 O VAL B 66 -3.436 8.185 4.665 1.00 0.00 O ATOM 2493 CB VAL B 66 -2.731 4.955 4.283 1.00 0.00 C ATOM 2494 CG1 VAL B 66 -3.130 4.265 5.576 1.00 0.00 C ATOM 2495 CG2 VAL B 66 -2.465 3.931 3.190 1.00 0.00 C ATOM 0 H VAL B 66 -2.957 7.405 2.551 1.00 0.00 H new ATOM 0 HA VAL B 66 -4.775 5.486 3.741 1.00 0.00 H new ATOM 0 HB VAL B 66 -1.810 5.508 4.469 1.00 0.00 H new ATOM 0 HG11 VAL B 66 -2.354 3.556 5.865 1.00 0.00 H new ATOM 0 HG12 VAL B 66 -3.253 5.009 6.363 1.00 0.00 H new ATOM 0 HG13 VAL B 66 -4.070 3.733 5.430 1.00 0.00 H new ATOM 0 HG21 VAL B 66 -1.706 3.226 3.529 1.00 0.00 H new ATOM 0 HG22 VAL B 66 -3.385 3.393 2.964 1.00 0.00 H new ATOM 0 HG23 VAL B 66 -2.113 4.440 2.293 1.00 0.00 H new ATOM 2505 N THR B 67 -4.483 6.753 6.045 1.00 0.00 N ATOM 2506 CA THR B 67 -4.611 7.717 7.138 1.00 0.00 C ATOM 2507 C THR B 67 -3.862 7.212 8.367 1.00 0.00 C ATOM 2508 O THR B 67 -3.730 6.004 8.565 1.00 0.00 O ATOM 2509 CB THR B 67 -6.083 7.961 7.476 1.00 0.00 C ATOM 2510 OG1 THR B 67 -6.782 8.449 6.343 1.00 0.00 O ATOM 2511 CG2 THR B 67 -6.284 8.954 8.600 1.00 0.00 C ATOM 0 H THR B 67 -4.877 5.834 6.247 1.00 0.00 H new ATOM 0 HA THR B 67 -4.174 8.663 6.819 1.00 0.00 H new ATOM 0 HB THR B 67 -6.470 6.993 7.795 1.00 0.00 H new ATOM 0 HG1 THR B 67 -7.722 8.598 6.577 1.00 0.00 H new ATOM 0 HG21 THR B 67 -7.350 9.080 8.788 1.00 0.00 H new ATOM 0 HG22 THR B 67 -5.798 8.585 9.503 1.00 0.00 H new ATOM 0 HG23 THR B 67 -5.849 9.913 8.320 1.00 0.00 H new ATOM 2519 N HIS B 68 -3.343 8.134 9.176 1.00 0.00 N ATOM 2520 CA HIS B 68 -2.578 7.749 10.355 1.00 0.00 C ATOM 2521 C HIS B 68 -2.403 8.913 11.327 1.00 0.00 C ATOM 2522 O HIS B 68 -2.273 10.067 10.917 1.00 0.00 O ATOM 2523 CB HIS B 68 -1.211 7.252 9.903 1.00 0.00 C ATOM 2524 CG HIS B 68 -0.485 8.271 9.086 1.00 0.00 C ATOM 2525 ND1 HIS B 68 0.143 9.367 9.637 1.00 0.00 N ATOM 2526 CD2 HIS B 68 -0.339 8.390 7.745 1.00 0.00 C ATOM 2527 CE1 HIS B 68 0.644 10.116 8.674 1.00 0.00 C ATOM 2528 NE2 HIS B 68 0.368 9.546 7.515 1.00 0.00 N ATOM 0 H HIS B 68 -3.438 9.140 9.038 1.00 0.00 H new ATOM 0 HA HIS B 68 -3.123 6.965 10.880 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -0.612 6.995 10.777 1.00 0.00 H new ATOM 0 HB3 HIS B 68 -1.332 6.339 9.320 1.00 0.00 H new ATOM 0 HD1 HIS B 68 0.210 9.568 10.635 1.00 0.00 H new ATOM 0 HD2 HIS B 68 -0.709 7.705 6.996 1.00 0.00 H new ATOM 0 HE1 HIS B 68 1.188 11.039 8.810 1.00 0.00 H new ATOM 2537 N GLU B 69 -2.390 8.596 12.618 1.00 0.00 N ATOM 2538 CA GLU B 69 -2.218 9.608 13.659 1.00 0.00 C ATOM 2539 C GLU B 69 -0.862 10.298 13.525 1.00 0.00 C ATOM 2540 O GLU B 69 0.103 9.699 13.050 1.00 0.00 O ATOM 2541 CB GLU B 69 -2.335 8.971 15.045 1.00 0.00 C ATOM 2542 CG GLU B 69 -1.219 7.988 15.354 1.00 0.00 C ATOM 2543 CD GLU B 69 -1.305 7.428 16.759 1.00 0.00 C ATOM 2544 OE1 GLU B 69 -1.279 8.227 17.719 1.00 0.00 O ATOM 2545 OE2 GLU B 69 -1.397 6.191 16.900 1.00 0.00 O ATOM 0 H GLU B 69 -2.497 7.645 12.970 1.00 0.00 H new ATOM 0 HA GLU B 69 -3.005 10.353 13.539 1.00 0.00 H new ATOM 0 HB2 GLU B 69 -2.335 9.758 15.799 1.00 0.00 H new ATOM 0 HB3 GLU B 69 -3.293 8.457 15.121 1.00 0.00 H new ATOM 0 HG2 GLU B 69 -1.255 7.167 14.637 1.00 0.00 H new ATOM 0 HG3 GLU B 69 -0.257 8.484 15.223 1.00 0.00 H new ATOM 2552 N THR B 70 -0.794 11.557 13.946 1.00 0.00 N ATOM 2553 CA THR B 70 0.447 12.323 13.873 1.00 0.00 C ATOM 2554 C THR B 70 1.580 11.611 14.609 1.00 0.00 C ATOM 2555 O THR B 70 1.345 10.875 15.567 1.00 0.00 O ATOM 2556 CB THR B 70 0.250 13.722 14.454 1.00 0.00 C ATOM 2557 OG1 THR B 70 -0.182 13.649 15.802 1.00 0.00 O ATOM 2558 CG2 THR B 70 -0.756 14.554 13.690 1.00 0.00 C ATOM 0 H THR B 70 -1.583 12.069 14.341 1.00 0.00 H new ATOM 0 HA THR B 70 0.720 12.409 12.821 1.00 0.00 H new ATOM 0 HB THR B 70 1.224 14.205 14.378 1.00 0.00 H new ATOM 0 HG1 THR B 70 -0.301 14.555 16.157 1.00 0.00 H new ATOM 0 HG21 THR B 70 -0.846 15.535 14.157 1.00 0.00 H new ATOM 0 HG22 THR B 70 -0.422 14.672 12.659 1.00 0.00 H new ATOM 0 HG23 THR B 70 -1.725 14.055 13.703 1.00 0.00 H new ATOM 2566 N LYS B 71 2.807 11.835 14.145 1.00 0.00 N ATOM 2567 CA LYS B 71 3.988 11.215 14.744 1.00 0.00 C ATOM 2568 C LYS B 71 3.978 9.710 14.523 1.00 0.00 C ATOM 2569 O LYS B 71 4.403 8.941 15.385 1.00 0.00 O ATOM 2570 CB LYS B 71 4.064 11.519 16.242 1.00 0.00 C ATOM 2571 CG LYS B 71 4.112 13.002 16.582 1.00 0.00 C ATOM 2572 CD LYS B 71 5.301 13.702 15.938 1.00 0.00 C ATOM 2573 CE LYS B 71 4.974 14.211 14.541 1.00 0.00 C ATOM 2574 NZ LYS B 71 6.144 14.883 13.908 1.00 0.00 N ATOM 0 H LYS B 71 3.011 12.444 13.352 1.00 0.00 H new ATOM 0 HA LYS B 71 4.867 11.637 14.257 1.00 0.00 H new ATOM 0 HB2 LYS B 71 3.200 11.074 16.735 1.00 0.00 H new ATOM 0 HB3 LYS B 71 4.950 11.036 16.654 1.00 0.00 H new ATOM 0 HG2 LYS B 71 3.189 13.479 16.251 1.00 0.00 H new ATOM 0 HG3 LYS B 71 4.164 13.123 17.664 1.00 0.00 H new ATOM 0 HD2 LYS B 71 5.613 14.538 16.565 1.00 0.00 H new ATOM 0 HD3 LYS B 71 6.143 13.012 15.885 1.00 0.00 H new ATOM 0 HE2 LYS B 71 4.652 13.377 13.917 1.00 0.00 H new ATOM 0 HE3 LYS B 71 4.139 14.910 14.595 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 6.172 14.651 12.895 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 6.058 15.913 14.025 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 7.020 14.555 14.362 1.00 0.00 H new ATOM 2588 N HIS B 72 3.498 9.298 13.356 1.00 0.00 N ATOM 2589 CA HIS B 72 3.440 7.884 13.007 1.00 0.00 C ATOM 2590 C HIS B 72 3.393 7.705 11.494 1.00 0.00 C ATOM 2591 O HIS B 72 2.377 7.298 10.932 1.00 0.00 O ATOM 2592 CB HIS B 72 2.225 7.211 13.654 1.00 0.00 C ATOM 2593 CG HIS B 72 2.235 7.254 15.153 1.00 0.00 C ATOM 2594 ND1 HIS B 72 1.949 8.391 15.878 1.00 0.00 N ATOM 2595 CD2 HIS B 72 2.511 6.291 16.064 1.00 0.00 C ATOM 2596 CE1 HIS B 72 2.047 8.126 17.169 1.00 0.00 C ATOM 2597 NE2 HIS B 72 2.387 6.859 17.307 1.00 0.00 N ATOM 0 H HIS B 72 3.143 9.925 12.634 1.00 0.00 H new ATOM 0 HA HIS B 72 4.343 7.408 13.388 1.00 0.00 H new ATOM 0 HB2 HIS B 72 1.318 7.695 13.292 1.00 0.00 H new ATOM 0 HB3 HIS B 72 2.182 6.171 13.330 1.00 0.00 H new ATOM 0 HD1 HIS B 72 1.700 9.297 15.480 1.00 0.00 H new ATOM 0 HD2 HIS B 72 2.779 5.266 15.852 1.00 0.00 H new ATOM 0 HE1 HIS B 72 1.878 8.827 17.973 1.00 0.00 H new ATOM 2606 N PHE B 73 4.510 8.013 10.845 1.00 0.00 N ATOM 2607 CA PHE B 73 4.623 7.892 9.397 1.00 0.00 C ATOM 2608 C PHE B 73 6.085 7.963 8.969 1.00 0.00 C ATOM 2609 O PHE B 73 6.841 8.810 9.447 1.00 0.00 O ATOM 2610 CB PHE B 73 3.811 8.990 8.704 1.00 0.00 C ATOM 2611 CG PHE B 73 4.001 9.027 7.215 1.00 0.00 C ATOM 2612 CD1 PHE B 73 3.797 7.892 6.449 1.00 0.00 C ATOM 2613 CD2 PHE B 73 4.385 10.199 6.582 1.00 0.00 C ATOM 2614 CE1 PHE B 73 3.973 7.923 5.081 1.00 0.00 C ATOM 2615 CE2 PHE B 73 4.562 10.236 5.213 1.00 0.00 C ATOM 2616 CZ PHE B 73 4.356 9.096 4.461 1.00 0.00 C ATOM 0 H PHE B 73 5.356 8.351 11.303 1.00 0.00 H new ATOM 0 HA PHE B 73 4.222 6.923 9.099 1.00 0.00 H new ATOM 0 HB2 PHE B 73 2.754 8.842 8.924 1.00 0.00 H new ATOM 0 HB3 PHE B 73 4.091 9.957 9.122 1.00 0.00 H new ATOM 0 HD1 PHE B 73 3.497 6.972 6.928 1.00 0.00 H new ATOM 0 HD2 PHE B 73 4.548 11.093 7.166 1.00 0.00 H new ATOM 0 HE1 PHE B 73 3.811 7.030 4.495 1.00 0.00 H new ATOM 0 HE2 PHE B 73 4.861 11.155 4.731 1.00 0.00 H new ATOM 0 HZ PHE B 73 4.494 9.122 3.390 1.00 0.00 H new ATOM 2626 N ILE B 74 6.485 7.060 8.074 1.00 0.00 N ATOM 2627 CA ILE B 74 7.865 7.026 7.606 1.00 0.00 C ATOM 2628 C ILE B 74 7.982 6.338 6.244 1.00 0.00 C ATOM 2629 O ILE B 74 7.302 5.351 5.970 1.00 0.00 O ATOM 2630 CB ILE B 74 8.770 6.320 8.642 1.00 0.00 C ATOM 2631 CG1 ILE B 74 10.223 6.235 8.153 1.00 0.00 C ATOM 2632 CG2 ILE B 74 8.225 4.936 8.965 1.00 0.00 C ATOM 2633 CD1 ILE B 74 10.459 5.177 7.094 1.00 0.00 C ATOM 0 H ILE B 74 5.878 6.350 7.664 1.00 0.00 H new ATOM 0 HA ILE B 74 8.198 8.057 7.488 1.00 0.00 H new ATOM 0 HB ILE B 74 8.767 6.917 9.554 1.00 0.00 H new ATOM 0 HG12 ILE B 74 10.518 7.205 7.754 1.00 0.00 H new ATOM 0 HG13 ILE B 74 10.871 6.031 9.006 1.00 0.00 H new ATOM 0 HG21 ILE B 74 8.873 4.451 9.696 1.00 0.00 H new ATOM 0 HG22 ILE B 74 7.220 5.028 9.376 1.00 0.00 H new ATOM 0 HG23 ILE B 74 8.192 4.337 8.055 1.00 0.00 H new ATOM 0 HD11 ILE B 74 11.509 5.182 6.803 1.00 0.00 H new ATOM 0 HD12 ILE B 74 10.198 4.197 7.494 1.00 0.00 H new ATOM 0 HD13 ILE B 74 9.840 5.390 6.223 1.00 0.00 H new ATOM 2645 N TYR B 75 8.855 6.885 5.399 1.00 0.00 N ATOM 2646 CA TYR B 75 9.088 6.356 4.056 1.00 0.00 C ATOM 2647 C TYR B 75 10.545 6.585 3.653 1.00 0.00 C ATOM 2648 O TYR B 75 11.150 7.581 4.050 1.00 0.00 O ATOM 2649 CB TYR B 75 8.146 7.043 3.060 1.00 0.00 C ATOM 2650 CG TYR B 75 8.281 6.559 1.631 1.00 0.00 C ATOM 2651 CD1 TYR B 75 9.442 6.784 0.899 1.00 0.00 C ATOM 2652 CD2 TYR B 75 7.239 5.880 1.010 1.00 0.00 C ATOM 2653 CE1 TYR B 75 9.559 6.350 -0.405 1.00 0.00 C ATOM 2654 CE2 TYR B 75 7.350 5.441 -0.294 1.00 0.00 C ATOM 2655 CZ TYR B 75 8.511 5.679 -0.997 1.00 0.00 C ATOM 2656 OH TYR B 75 8.623 5.244 -2.297 1.00 0.00 O ATOM 0 H TYR B 75 9.419 7.704 5.625 1.00 0.00 H new ATOM 0 HA TYR B 75 8.888 5.285 4.050 1.00 0.00 H new ATOM 0 HB2 TYR B 75 7.118 6.889 3.387 1.00 0.00 H new ATOM 0 HB3 TYR B 75 8.331 8.117 3.086 1.00 0.00 H new ATOM 0 HD1 TYR B 75 10.266 7.308 1.360 1.00 0.00 H new ATOM 0 HD2 TYR B 75 6.327 5.693 1.557 1.00 0.00 H new ATOM 0 HE1 TYR B 75 10.467 6.535 -0.959 1.00 0.00 H new ATOM 0 HE2 TYR B 75 6.531 4.914 -0.761 1.00 0.00 H new ATOM 0 HH TYR B 75 9.503 5.492 -2.650 1.00 0.00 H new ATOM 2666 N PHE B 76 11.114 5.664 2.875 1.00 0.00 N ATOM 2667 CA PHE B 76 12.505 5.797 2.452 1.00 0.00 C ATOM 2668 C PHE B 76 12.854 4.824 1.330 1.00 0.00 C ATOM 2669 O PHE B 76 12.346 3.702 1.279 1.00 0.00 O ATOM 2670 CB PHE B 76 13.449 5.584 3.641 1.00 0.00 C ATOM 2671 CG PHE B 76 13.312 4.242 4.307 1.00 0.00 C ATOM 2672 CD1 PHE B 76 13.613 3.071 3.627 1.00 0.00 C ATOM 2673 CD2 PHE B 76 12.879 4.155 5.618 1.00 0.00 C ATOM 2674 CE1 PHE B 76 13.482 1.842 4.244 1.00 0.00 C ATOM 2675 CE2 PHE B 76 12.747 2.928 6.241 1.00 0.00 C ATOM 2676 CZ PHE B 76 13.050 1.770 5.552 1.00 0.00 C ATOM 0 H PHE B 76 10.640 4.829 2.530 1.00 0.00 H new ATOM 0 HA PHE B 76 12.631 6.809 2.067 1.00 0.00 H new ATOM 0 HB2 PHE B 76 14.477 5.704 3.300 1.00 0.00 H new ATOM 0 HB3 PHE B 76 13.265 6.364 4.380 1.00 0.00 H new ATOM 0 HD1 PHE B 76 13.954 3.121 2.603 1.00 0.00 H new ATOM 0 HD2 PHE B 76 12.641 5.057 6.162 1.00 0.00 H new ATOM 0 HE1 PHE B 76 13.718 0.938 3.702 1.00 0.00 H new ATOM 0 HE2 PHE B 76 12.407 2.875 7.265 1.00 0.00 H new ATOM 0 HZ PHE B 76 12.949 0.810 6.036 1.00 0.00 H new ATOM 2686 N TYR B 77 13.734 5.266 0.435 1.00 0.00 N ATOM 2687 CA TYR B 77 14.175 4.446 -0.687 1.00 0.00 C ATOM 2688 C TYR B 77 15.442 3.682 -0.308 1.00 0.00 C ATOM 2689 O TYR B 77 16.309 4.213 0.387 1.00 0.00 O ATOM 2690 CB TYR B 77 14.437 5.321 -1.913 1.00 0.00 C ATOM 2691 CG TYR B 77 14.556 4.539 -3.201 1.00 0.00 C ATOM 2692 CD1 TYR B 77 13.477 3.817 -3.693 1.00 0.00 C ATOM 2693 CD2 TYR B 77 15.740 4.524 -3.926 1.00 0.00 C ATOM 2694 CE1 TYR B 77 13.574 3.099 -4.869 1.00 0.00 C ATOM 2695 CE2 TYR B 77 15.848 3.810 -5.104 1.00 0.00 C ATOM 2696 CZ TYR B 77 14.762 3.099 -5.571 1.00 0.00 C ATOM 2697 OH TYR B 77 14.865 2.386 -6.744 1.00 0.00 O ATOM 0 H TYR B 77 14.157 6.194 0.467 1.00 0.00 H new ATOM 0 HA TYR B 77 13.388 3.732 -0.930 1.00 0.00 H new ATOM 0 HB2 TYR B 77 13.629 6.046 -2.011 1.00 0.00 H new ATOM 0 HB3 TYR B 77 15.355 5.887 -1.755 1.00 0.00 H new ATOM 0 HD1 TYR B 77 12.545 3.817 -3.147 1.00 0.00 H new ATOM 0 HD2 TYR B 77 16.592 5.080 -3.563 1.00 0.00 H new ATOM 0 HE1 TYR B 77 12.725 2.541 -5.237 1.00 0.00 H new ATOM 0 HE2 TYR B 77 16.777 3.809 -5.656 1.00 0.00 H new ATOM 0 HH TYR B 77 15.719 2.592 -7.178 1.00 0.00 H new ATOM 2707 N LEU B 78 15.545 2.436 -0.757 1.00 0.00 N ATOM 2708 CA LEU B 78 16.711 1.610 -0.447 1.00 0.00 C ATOM 2709 C LEU B 78 16.742 0.340 -1.290 1.00 0.00 C ATOM 2710 O LEU B 78 15.701 -0.235 -1.604 1.00 0.00 O ATOM 2711 CB LEU B 78 16.716 1.236 1.034 1.00 0.00 C ATOM 2712 CG LEU B 78 17.900 0.374 1.478 1.00 0.00 C ATOM 2713 CD1 LEU B 78 19.215 1.091 1.212 1.00 0.00 C ATOM 2714 CD2 LEU B 78 17.775 0.010 2.951 1.00 0.00 C ATOM 0 H LEU B 78 14.841 1.976 -1.334 1.00 0.00 H new ATOM 0 HA LEU B 78 17.598 2.198 -0.682 1.00 0.00 H new ATOM 0 HB2 LEU B 78 16.711 2.152 1.625 1.00 0.00 H new ATOM 0 HB3 LEU B 78 15.792 0.704 1.262 1.00 0.00 H new ATOM 0 HG LEU B 78 17.890 -0.547 0.896 1.00 0.00 H new ATOM 0 HD11 LEU B 78 20.044 0.462 1.535 1.00 0.00 H new ATOM 0 HD12 LEU B 78 19.308 1.296 0.146 1.00 0.00 H new ATOM 0 HD13 LEU B 78 19.236 2.030 1.765 1.00 0.00 H new ATOM 0 HD21 LEU B 78 18.626 -0.603 3.248 1.00 0.00 H new ATOM 0 HD22 LEU B 78 17.757 0.920 3.550 1.00 0.00 H new ATOM 0 HD23 LEU B 78 16.853 -0.548 3.111 1.00 0.00 H new ATOM 2726 N GLY B 79 17.950 -0.095 -1.643 1.00 0.00 N ATOM 2727 CA GLY B 79 18.109 -1.299 -2.440 1.00 0.00 C ATOM 2728 C GLY B 79 17.326 -1.245 -3.731 1.00 0.00 C ATOM 2729 O GLY B 79 16.741 -2.239 -4.155 1.00 0.00 O ATOM 0 H GLY B 79 18.823 0.367 -1.390 1.00 0.00 H new ATOM 0 HA2 GLY B 79 19.165 -1.445 -2.665 1.00 0.00 H new ATOM 0 HA3 GLY B 79 17.785 -2.162 -1.858 1.00 0.00 H new ATOM 2733 N GLN B 80 17.313 -0.075 -4.357 1.00 0.00 N ATOM 2734 CA GLN B 80 16.593 0.114 -5.605 1.00 0.00 C ATOM 2735 C GLN B 80 15.126 -0.282 -5.449 1.00 0.00 C ATOM 2736 O GLN B 80 14.529 -0.859 -6.357 1.00 0.00 O ATOM 2737 CB GLN B 80 17.239 -0.707 -6.726 1.00 0.00 C ATOM 2738 CG GLN B 80 18.587 -0.176 -7.193 1.00 0.00 C ATOM 2739 CD GLN B 80 19.641 -0.174 -6.101 1.00 0.00 C ATOM 2740 OE1 GLN B 80 19.553 0.579 -5.133 1.00 0.00 O ATOM 2741 NE2 GLN B 80 20.650 -1.024 -6.256 1.00 0.00 N ATOM 0 H GLN B 80 17.795 0.758 -4.018 1.00 0.00 H new ATOM 0 HA GLN B 80 16.643 1.171 -5.867 1.00 0.00 H new ATOM 0 HB2 GLN B 80 17.365 -1.734 -6.382 1.00 0.00 H new ATOM 0 HB3 GLN B 80 16.559 -0.737 -7.577 1.00 0.00 H new ATOM 0 HG2 GLN B 80 18.939 -0.782 -8.028 1.00 0.00 H new ATOM 0 HG3 GLN B 80 18.460 0.840 -7.568 1.00 0.00 H new ATOM 0 HE21 GLN B 80 20.684 -1.631 -7.075 1.00 0.00 H new ATOM 0 HE22 GLN B 80 21.391 -1.069 -5.556 1.00 0.00 H new ATOM 2750 N VAL B 81 14.553 0.034 -4.291 1.00 0.00 N ATOM 2751 CA VAL B 81 13.158 -0.290 -4.016 1.00 0.00 C ATOM 2752 C VAL B 81 12.581 0.623 -2.937 1.00 0.00 C ATOM 2753 O VAL B 81 13.194 0.834 -1.891 1.00 0.00 O ATOM 2754 CB VAL B 81 12.990 -1.760 -3.579 1.00 0.00 C ATOM 2755 CG1 VAL B 81 13.429 -2.703 -4.686 1.00 0.00 C ATOM 2756 CG2 VAL B 81 13.768 -2.041 -2.302 1.00 0.00 C ATOM 0 H VAL B 81 15.033 0.513 -3.529 1.00 0.00 H new ATOM 0 HA VAL B 81 12.612 -0.136 -4.947 1.00 0.00 H new ATOM 0 HB VAL B 81 11.932 -1.931 -3.378 1.00 0.00 H new ATOM 0 HG11 VAL B 81 13.302 -3.734 -4.357 1.00 0.00 H new ATOM 0 HG12 VAL B 81 12.822 -2.528 -5.575 1.00 0.00 H new ATOM 0 HG13 VAL B 81 14.478 -2.524 -4.922 1.00 0.00 H new ATOM 0 HG21 VAL B 81 13.633 -3.084 -2.016 1.00 0.00 H new ATOM 0 HG22 VAL B 81 14.827 -1.845 -2.471 1.00 0.00 H new ATOM 0 HG23 VAL B 81 13.402 -1.395 -1.504 1.00 0.00 H new ATOM 2766 N ALA B 82 11.399 1.163 -3.206 1.00 0.00 N ATOM 2767 CA ALA B 82 10.726 2.056 -2.268 1.00 0.00 C ATOM 2768 C ALA B 82 10.167 1.287 -1.079 1.00 0.00 C ATOM 2769 O ALA B 82 9.660 0.177 -1.230 1.00 0.00 O ATOM 2770 CB ALA B 82 9.618 2.821 -2.975 1.00 0.00 C ATOM 0 H ALA B 82 10.883 0.998 -4.070 1.00 0.00 H new ATOM 0 HA ALA B 82 11.461 2.767 -1.890 1.00 0.00 H new ATOM 0 HB1 ALA B 82 9.123 3.484 -2.265 1.00 0.00 H new ATOM 0 HB2 ALA B 82 10.044 3.411 -3.786 1.00 0.00 H new ATOM 0 HB3 ALA B 82 8.892 2.117 -3.381 1.00 0.00 H new ATOM 2776 N ILE B 83 10.262 1.888 0.103 1.00 0.00 N ATOM 2777 CA ILE B 83 9.765 1.266 1.323 1.00 0.00 C ATOM 2778 C ILE B 83 8.928 2.256 2.128 1.00 0.00 C ATOM 2779 O ILE B 83 9.239 3.446 2.184 1.00 0.00 O ATOM 2780 CB ILE B 83 10.921 0.737 2.198 1.00 0.00 C ATOM 2781 CG1 ILE B 83 11.765 -0.263 1.405 1.00 0.00 C ATOM 2782 CG2 ILE B 83 10.380 0.094 3.470 1.00 0.00 C ATOM 2783 CD1 ILE B 83 12.916 -0.846 2.195 1.00 0.00 C ATOM 0 H ILE B 83 10.680 2.808 0.241 1.00 0.00 H new ATOM 0 HA ILE B 83 9.141 0.422 1.027 1.00 0.00 H new ATOM 0 HB ILE B 83 11.554 1.577 2.485 1.00 0.00 H new ATOM 0 HG12 ILE B 83 11.124 -1.074 1.061 1.00 0.00 H new ATOM 0 HG13 ILE B 83 12.159 0.231 0.516 1.00 0.00 H new ATOM 0 HG21 ILE B 83 11.210 -0.273 4.074 1.00 0.00 H new ATOM 0 HG22 ILE B 83 9.816 0.833 4.039 1.00 0.00 H new ATOM 0 HG23 ILE B 83 9.727 -0.738 3.208 1.00 0.00 H new ATOM 0 HD11 ILE B 83 13.469 -1.546 1.569 1.00 0.00 H new ATOM 0 HD12 ILE B 83 13.580 -0.044 2.517 1.00 0.00 H new ATOM 0 HD13 ILE B 83 12.529 -1.369 3.069 1.00 0.00 H new ATOM 2795 N LEU B 84 7.857 1.759 2.738 1.00 0.00 N ATOM 2796 CA LEU B 84 6.967 2.604 3.528 1.00 0.00 C ATOM 2797 C LEU B 84 6.453 1.862 4.757 1.00 0.00 C ATOM 2798 O LEU B 84 6.232 0.651 4.714 1.00 0.00 O ATOM 2799 CB LEU B 84 5.788 3.071 2.672 1.00 0.00 C ATOM 2800 CG LEU B 84 4.750 3.922 3.404 1.00 0.00 C ATOM 2801 CD1 LEU B 84 5.383 5.195 3.945 1.00 0.00 C ATOM 2802 CD2 LEU B 84 3.589 4.253 2.479 1.00 0.00 C ATOM 0 H LEU B 84 7.584 0.777 2.701 1.00 0.00 H new ATOM 0 HA LEU B 84 7.535 3.471 3.864 1.00 0.00 H new ATOM 0 HB2 LEU B 84 6.176 3.644 1.830 1.00 0.00 H new ATOM 0 HB3 LEU B 84 5.290 2.194 2.259 1.00 0.00 H new ATOM 0 HG LEU B 84 4.367 3.348 4.248 1.00 0.00 H new ATOM 0 HD11 LEU B 84 4.627 5.786 4.462 1.00 0.00 H new ATOM 0 HD12 LEU B 84 6.181 4.937 4.641 1.00 0.00 H new ATOM 0 HD13 LEU B 84 5.795 5.776 3.120 1.00 0.00 H new ATOM 0 HD21 LEU B 84 2.858 4.859 3.015 1.00 0.00 H new ATOM 0 HD22 LEU B 84 3.958 4.808 1.616 1.00 0.00 H new ATOM 0 HD23 LEU B 84 3.117 3.330 2.142 1.00 0.00 H new ATOM 2814 N LEU B 85 6.267 2.597 5.850 1.00 0.00 N ATOM 2815 CA LEU B 85 5.781 2.011 7.094 1.00 0.00 C ATOM 2816 C LEU B 85 5.181 3.073 8.013 1.00 0.00 C ATOM 2817 O LEU B 85 5.692 4.192 8.109 1.00 0.00 O ATOM 2818 CB LEU B 85 6.910 1.263 7.808 1.00 0.00 C ATOM 2819 CG LEU B 85 6.569 0.755 9.212 1.00 0.00 C ATOM 2820 CD1 LEU B 85 7.497 -0.380 9.607 1.00 0.00 C ATOM 2821 CD2 LEU B 85 6.663 1.889 10.225 1.00 0.00 C ATOM 0 H LEU B 85 6.446 3.600 5.899 1.00 0.00 H new ATOM 0 HA LEU B 85 4.992 1.302 6.843 1.00 0.00 H new ATOM 0 HB2 LEU B 85 7.207 0.413 7.193 1.00 0.00 H new ATOM 0 HB3 LEU B 85 7.775 1.923 7.878 1.00 0.00 H new ATOM 0 HG LEU B 85 5.546 0.380 9.202 1.00 0.00 H new ATOM 0 HD11 LEU B 85 7.240 -0.729 10.607 1.00 0.00 H new ATOM 0 HD12 LEU B 85 7.390 -1.201 8.898 1.00 0.00 H new ATOM 0 HD13 LEU B 85 8.528 -0.026 9.600 1.00 0.00 H new ATOM 0 HD21 LEU B 85 6.418 1.511 11.218 1.00 0.00 H new ATOM 0 HD22 LEU B 85 7.677 2.290 10.229 1.00 0.00 H new ATOM 0 HD23 LEU B 85 5.962 2.678 9.954 1.00 0.00 H new ATOM 2833 N PHE B 86 4.085 2.712 8.684 1.00 0.00 N ATOM 2834 CA PHE B 86 3.404 3.630 9.594 1.00 0.00 C ATOM 2835 C PHE B 86 2.199 2.961 10.260 1.00 0.00 C ATOM 2836 O PHE B 86 1.374 2.344 9.585 1.00 0.00 O ATOM 2837 CB PHE B 86 2.948 4.875 8.833 1.00 0.00 C ATOM 2838 CG PHE B 86 1.934 4.591 7.761 1.00 0.00 C ATOM 2839 CD1 PHE B 86 2.242 3.762 6.693 1.00 0.00 C ATOM 2840 CD2 PHE B 86 0.671 5.154 7.823 1.00 0.00 C ATOM 2841 CE1 PHE B 86 1.310 3.500 5.710 1.00 0.00 C ATOM 2842 CE2 PHE B 86 -0.267 4.897 6.842 1.00 0.00 C ATOM 2843 CZ PHE B 86 0.054 4.068 5.784 1.00 0.00 C ATOM 0 H PHE B 86 3.652 1.791 8.613 1.00 0.00 H new ATOM 0 HA PHE B 86 4.109 3.916 10.375 1.00 0.00 H new ATOM 0 HB2 PHE B 86 2.525 5.588 9.541 1.00 0.00 H new ATOM 0 HB3 PHE B 86 3.817 5.352 8.381 1.00 0.00 H new ATOM 0 HD1 PHE B 86 3.224 3.316 6.630 1.00 0.00 H new ATOM 0 HD2 PHE B 86 0.416 5.802 8.648 1.00 0.00 H new ATOM 0 HE1 PHE B 86 1.563 2.852 4.884 1.00 0.00 H new ATOM 0 HE2 PHE B 86 -1.249 5.343 6.902 1.00 0.00 H new ATOM 0 HZ PHE B 86 -0.677 3.865 5.016 1.00 0.00 H new ATOM 2853 N LYS B 87 2.096 3.094 11.583 1.00 0.00 N ATOM 2854 CA LYS B 87 0.982 2.504 12.326 1.00 0.00 C ATOM 2855 C LYS B 87 -0.253 3.392 12.259 1.00 0.00 C ATOM 2856 O LYS B 87 -0.150 4.599 12.034 1.00 0.00 O ATOM 2857 CB LYS B 87 1.355 2.257 13.792 1.00 0.00 C ATOM 2858 CG LYS B 87 1.491 3.525 14.620 1.00 0.00 C ATOM 2859 CD LYS B 87 1.373 3.231 16.107 1.00 0.00 C ATOM 2860 CE LYS B 87 2.508 2.351 16.598 1.00 0.00 C ATOM 2861 NZ LYS B 87 2.434 2.114 18.066 1.00 0.00 N ATOM 0 H LYS B 87 2.767 3.602 12.160 1.00 0.00 H new ATOM 0 HA LYS B 87 0.757 1.546 11.856 1.00 0.00 H new ATOM 0 HB2 LYS B 87 0.597 1.619 14.246 1.00 0.00 H new ATOM 0 HB3 LYS B 87 2.297 1.709 13.829 1.00 0.00 H new ATOM 0 HG2 LYS B 87 2.454 3.994 14.415 1.00 0.00 H new ATOM 0 HG3 LYS B 87 0.721 4.238 14.326 1.00 0.00 H new ATOM 0 HD2 LYS B 87 1.372 4.168 16.664 1.00 0.00 H new ATOM 0 HD3 LYS B 87 0.420 2.741 16.306 1.00 0.00 H new ATOM 0 HE2 LYS B 87 2.479 1.395 16.074 1.00 0.00 H new ATOM 0 HE3 LYS B 87 3.462 2.819 16.354 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 3.179 2.660 18.544 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 1.504 2.415 18.420 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 2.567 1.101 18.261 1.00 0.00 H new ATOM 2875 N SER B 88 -1.421 2.791 12.462 1.00 0.00 N ATOM 2876 CA SER B 88 -2.673 3.544 12.431 1.00 0.00 C ATOM 2877 C SER B 88 -2.795 4.441 13.662 1.00 0.00 C ATOM 2878 O SER B 88 -1.789 4.857 14.237 1.00 0.00 O ATOM 2879 CB SER B 88 -3.870 2.593 12.346 1.00 0.00 C ATOM 2880 OG SER B 88 -5.081 3.310 12.184 1.00 0.00 O ATOM 0 H SER B 88 -1.528 1.794 12.648 1.00 0.00 H new ATOM 0 HA SER B 88 -2.667 4.176 11.543 1.00 0.00 H new ATOM 0 HB2 SER B 88 -3.735 1.908 11.509 1.00 0.00 H new ATOM 0 HB3 SER B 88 -3.921 1.986 13.250 1.00 0.00 H new ATOM 0 HG SER B 88 -5.830 2.680 12.131 1.00 0.00 H new ATOM 2886 N GLY B 89 -4.027 4.731 14.065 1.00 0.00 N ATOM 2887 CA GLY B 89 -4.252 5.572 15.225 1.00 0.00 C ATOM 2888 C GLY B 89 -3.777 4.923 16.511 1.00 0.00 C ATOM 2889 O GLY B 89 -3.304 3.768 16.454 1.00 0.00 O ATOM 2890 OXT GLY B 89 -3.877 5.569 17.576 1.00 0.00 O ATOM 0 H GLY B 89 -4.876 4.398 13.608 1.00 0.00 H new ATOM 0 HA2 GLY B 89 -3.735 6.521 15.088 1.00 0.00 H new ATOM 0 HA3 GLY B 89 -5.315 5.797 15.306 1.00 0.00 H new ATOM 2895 N MET C 1 -6.676 -7.652 14.650 1.00 0.00 N ATOM 2896 CA MET C 1 -6.712 -7.342 13.197 1.00 0.00 C ATOM 2897 C MET C 1 -5.888 -8.347 12.398 1.00 0.00 C ATOM 2898 O MET C 1 -4.740 -8.630 12.735 1.00 0.00 O ATOM 2899 CB MET C 1 -6.167 -5.927 12.992 1.00 0.00 C ATOM 2900 CG MET C 1 -6.979 -4.854 13.699 1.00 0.00 C ATOM 2901 SD MET C 1 -6.312 -3.198 13.445 1.00 0.00 S ATOM 2902 CE MET C 1 -7.468 -2.219 14.400 1.00 0.00 C ATOM 0 H1 MET C 1 -7.461 -7.166 15.128 1.00 0.00 H new ATOM 0 H2 MET C 1 -6.769 -8.679 14.788 1.00 0.00 H new ATOM 0 H3 MET C 1 -5.773 -7.329 15.052 1.00 0.00 H new ATOM 0 HA MET C 1 -7.740 -7.406 12.840 1.00 0.00 H new ATOM 0 HB2 MET C 1 -5.138 -5.887 13.350 1.00 0.00 H new ATOM 0 HB3 MET C 1 -6.142 -5.707 11.925 1.00 0.00 H new ATOM 0 HG2 MET C 1 -8.008 -4.886 13.340 1.00 0.00 H new ATOM 0 HG3 MET C 1 -7.008 -5.070 14.767 1.00 0.00 H new ATOM 0 HE1 MET C 1 -7.189 -1.167 14.342 1.00 0.00 H new ATOM 0 HE2 MET C 1 -8.473 -2.350 14.000 1.00 0.00 H new ATOM 0 HE3 MET C 1 -7.446 -2.543 15.441 1.00 0.00 H new ATOM 2914 N LYS C 2 -6.484 -8.883 11.337 1.00 0.00 N ATOM 2915 CA LYS C 2 -5.803 -9.856 10.489 1.00 0.00 C ATOM 2916 C LYS C 2 -4.904 -9.162 9.477 1.00 0.00 C ATOM 2917 O LYS C 2 -5.330 -8.239 8.781 1.00 0.00 O ATOM 2918 CB LYS C 2 -6.821 -10.743 9.764 1.00 0.00 C ATOM 2919 CG LYS C 2 -7.571 -11.701 10.678 1.00 0.00 C ATOM 2920 CD LYS C 2 -8.360 -10.967 11.749 1.00 0.00 C ATOM 2921 CE LYS C 2 -9.202 -11.925 12.574 1.00 0.00 C ATOM 2922 NZ LYS C 2 -9.966 -11.219 13.639 1.00 0.00 N ATOM 0 H LYS C 2 -7.435 -8.661 11.044 1.00 0.00 H new ATOM 0 HA LYS C 2 -5.182 -10.482 11.130 1.00 0.00 H new ATOM 0 HB2 LYS C 2 -7.542 -10.106 9.252 1.00 0.00 H new ATOM 0 HB3 LYS C 2 -6.304 -11.319 8.997 1.00 0.00 H new ATOM 0 HG2 LYS C 2 -8.249 -12.313 10.083 1.00 0.00 H new ATOM 0 HG3 LYS C 2 -6.862 -12.380 11.152 1.00 0.00 H new ATOM 0 HD2 LYS C 2 -7.674 -10.428 12.403 1.00 0.00 H new ATOM 0 HD3 LYS C 2 -9.005 -10.223 11.282 1.00 0.00 H new ATOM 0 HE2 LYS C 2 -9.895 -12.454 11.920 1.00 0.00 H new ATOM 0 HE3 LYS C 2 -8.556 -12.676 13.028 1.00 0.00 H new ATOM 0 HZ1 LYS C 2 -9.687 -11.589 14.570 1.00 0.00 H new ATOM 0 HZ2 LYS C 2 -9.761 -10.200 13.596 1.00 0.00 H new ATOM 0 HZ3 LYS C 2 -10.984 -11.374 13.496 1.00 0.00 H new ATOM 2936 N ASP C 3 -3.655 -9.607 9.401 1.00 0.00 N ATOM 2937 CA ASP C 3 -2.697 -9.023 8.474 1.00 0.00 C ATOM 2938 C ASP C 3 -2.835 -9.626 7.077 1.00 0.00 C ATOM 2939 O ASP C 3 -2.725 -10.838 6.900 1.00 0.00 O ATOM 2940 CB ASP C 3 -1.269 -9.208 8.996 1.00 0.00 C ATOM 2941 CG ASP C 3 -0.933 -10.657 9.291 1.00 0.00 C ATOM 2942 OD1 ASP C 3 -0.923 -11.472 8.344 1.00 0.00 O ATOM 2943 OD2 ASP C 3 -0.679 -10.978 10.470 1.00 0.00 O ATOM 0 H ASP C 3 -3.284 -10.369 9.969 1.00 0.00 H new ATOM 0 HA ASP C 3 -2.911 -7.957 8.400 1.00 0.00 H new ATOM 0 HB2 ASP C 3 -0.565 -8.819 8.260 1.00 0.00 H new ATOM 0 HB3 ASP C 3 -1.140 -8.618 9.903 1.00 0.00 H new ATOM 2948 N THR C 4 -3.066 -8.770 6.086 1.00 0.00 N ATOM 2949 CA THR C 4 -3.204 -9.218 4.710 1.00 0.00 C ATOM 2950 C THR C 4 -1.836 -9.312 4.045 1.00 0.00 C ATOM 2951 O THR C 4 -1.027 -8.389 4.139 1.00 0.00 O ATOM 2952 CB THR C 4 -4.100 -8.259 3.930 1.00 0.00 C ATOM 2953 OG1 THR C 4 -4.302 -8.724 2.607 1.00 0.00 O ATOM 2954 CG2 THR C 4 -3.537 -6.859 3.842 1.00 0.00 C ATOM 0 H THR C 4 -3.161 -7.762 6.213 1.00 0.00 H new ATOM 0 HA THR C 4 -3.663 -10.207 4.711 1.00 0.00 H new ATOM 0 HB THR C 4 -5.039 -8.224 4.483 1.00 0.00 H new ATOM 0 HG1 THR C 4 -5.262 -8.757 2.415 1.00 0.00 H new ATOM 0 HG21 THR C 4 -4.221 -6.227 3.276 1.00 0.00 H new ATOM 0 HG22 THR C 4 -3.414 -6.452 4.846 1.00 0.00 H new ATOM 0 HG23 THR C 4 -2.569 -6.887 3.341 1.00 0.00 H new ATOM 2962 N GLY C 5 -1.581 -10.429 3.371 1.00 0.00 N ATOM 2963 CA GLY C 5 -0.307 -10.614 2.702 1.00 0.00 C ATOM 2964 C GLY C 5 -0.463 -10.804 1.208 1.00 0.00 C ATOM 2965 O GLY C 5 -1.213 -11.674 0.763 1.00 0.00 O ATOM 0 H GLY C 5 -2.233 -11.208 3.276 1.00 0.00 H new ATOM 0 HA2 GLY C 5 0.329 -9.749 2.891 1.00 0.00 H new ATOM 0 HA3 GLY C 5 0.200 -11.481 3.125 1.00 0.00 H new ATOM 2969 N ILE C 6 0.247 -9.991 0.432 1.00 0.00 N ATOM 2970 CA ILE C 6 0.184 -10.067 -1.024 1.00 0.00 C ATOM 2971 C ILE C 6 1.382 -9.378 -1.666 1.00 0.00 C ATOM 2972 O ILE C 6 2.155 -8.693 -0.995 1.00 0.00 O ATOM 2973 CB ILE C 6 -1.102 -9.422 -1.581 1.00 0.00 C ATOM 2974 CG1 ILE C 6 -1.165 -7.944 -1.203 1.00 0.00 C ATOM 2975 CG2 ILE C 6 -2.339 -10.155 -1.079 1.00 0.00 C ATOM 2976 CD1 ILE C 6 -2.320 -7.209 -1.847 1.00 0.00 C ATOM 0 H ILE C 6 0.874 -9.270 0.788 1.00 0.00 H new ATOM 0 HA ILE C 6 0.189 -11.128 -1.272 1.00 0.00 H new ATOM 0 HB ILE C 6 -1.079 -9.501 -2.668 1.00 0.00 H new ATOM 0 HG12 ILE C 6 -1.247 -7.857 -0.120 1.00 0.00 H new ATOM 0 HG13 ILE C 6 -0.231 -7.462 -1.492 1.00 0.00 H new ATOM 0 HG21 ILE C 6 -3.233 -9.681 -1.486 1.00 0.00 H new ATOM 0 HG22 ILE C 6 -2.301 -11.196 -1.401 1.00 0.00 H new ATOM 0 HG23 ILE C 6 -2.370 -10.113 0.010 1.00 0.00 H new ATOM 0 HD11 ILE C 6 -2.305 -6.164 -1.536 1.00 0.00 H new ATOM 0 HD12 ILE C 6 -2.228 -7.266 -2.932 1.00 0.00 H new ATOM 0 HD13 ILE C 6 -3.260 -7.666 -1.538 1.00 0.00 H new ATOM 2988 N GLN C 7 1.523 -9.560 -2.974 1.00 0.00 N ATOM 2989 CA GLN C 7 2.616 -8.956 -3.723 1.00 0.00 C ATOM 2990 C GLN C 7 2.269 -8.877 -5.204 1.00 0.00 C ATOM 2991 O GLN C 7 2.032 -9.896 -5.852 1.00 0.00 O ATOM 2992 CB GLN C 7 3.905 -9.761 -3.535 1.00 0.00 C ATOM 2993 CG GLN C 7 5.091 -9.199 -4.309 1.00 0.00 C ATOM 2994 CD GLN C 7 6.365 -10.023 -4.168 1.00 0.00 C ATOM 2995 OE1 GLN C 7 7.408 -9.656 -4.709 1.00 0.00 O ATOM 2996 NE2 GLN C 7 6.294 -11.144 -3.451 1.00 0.00 N ATOM 0 H GLN C 7 0.889 -10.125 -3.540 1.00 0.00 H new ATOM 0 HA GLN C 7 2.771 -7.947 -3.342 1.00 0.00 H new ATOM 0 HB2 GLN C 7 4.154 -9.790 -2.474 1.00 0.00 H new ATOM 0 HB3 GLN C 7 3.731 -10.790 -3.850 1.00 0.00 H new ATOM 0 HG2 GLN C 7 4.826 -9.135 -5.364 1.00 0.00 H new ATOM 0 HG3 GLN C 7 5.287 -8.183 -3.967 1.00 0.00 H new ATOM 0 HE21 GLN C 7 5.412 -11.417 -3.017 1.00 0.00 H new ATOM 0 HE22 GLN C 7 7.121 -11.729 -3.336 1.00 0.00 H new ATOM 3005 N VAL C 8 2.236 -7.660 -5.733 1.00 0.00 N ATOM 3006 CA VAL C 8 1.913 -7.449 -7.138 1.00 0.00 C ATOM 3007 C VAL C 8 3.159 -7.543 -8.010 1.00 0.00 C ATOM 3008 O VAL C 8 4.223 -7.039 -7.649 1.00 0.00 O ATOM 3009 CB VAL C 8 1.243 -6.081 -7.362 1.00 0.00 C ATOM 3010 CG1 VAL C 8 0.750 -5.958 -8.796 1.00 0.00 C ATOM 3011 CG2 VAL C 8 0.100 -5.878 -6.379 1.00 0.00 C ATOM 0 H VAL C 8 2.429 -6.805 -5.211 1.00 0.00 H new ATOM 0 HA VAL C 8 1.215 -8.237 -7.423 1.00 0.00 H new ATOM 0 HB VAL C 8 1.984 -5.301 -7.187 1.00 0.00 H new ATOM 0 HG11 VAL C 8 0.279 -4.985 -8.937 1.00 0.00 H new ATOM 0 HG12 VAL C 8 1.593 -6.056 -9.480 1.00 0.00 H new ATOM 0 HG13 VAL C 8 0.024 -6.745 -9.000 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -0.361 -4.906 -6.553 1.00 0.00 H new ATOM 0 HG22 VAL C 8 -0.644 -6.663 -6.519 1.00 0.00 H new ATOM 0 HG23 VAL C 8 0.485 -5.920 -5.360 1.00 0.00 H new ATOM 3222 N ASP D 3 -3.526 11.962 6.322 1.00 0.00 N ATOM 3223 CA ASP D 3 -3.508 10.978 5.251 1.00 0.00 C ATOM 3224 C ASP D 3 -2.185 10.985 4.494 1.00 0.00 C ATOM 3225 O ASP D 3 -1.774 12.010 3.951 1.00 0.00 O ATOM 3226 CB ASP D 3 -4.652 11.246 4.276 1.00 0.00 C ATOM 3227 CG ASP D 3 -4.586 12.641 3.685 1.00 0.00 C ATOM 3228 OD1 ASP D 3 -4.698 13.617 4.456 1.00 0.00 O ATOM 3229 OD2 ASP D 3 -4.411 12.758 2.454 1.00 0.00 O ATOM 0 HA ASP D 3 -3.630 9.996 5.708 1.00 0.00 H new ATOM 0 HB2 ASP D 3 -4.622 10.511 3.472 1.00 0.00 H new ATOM 0 HB3 ASP D 3 -5.604 11.116 4.791 1.00 0.00 H new ATOM 3234 N THR D 4 -1.536 9.826 4.436 1.00 0.00 N ATOM 3235 CA THR D 4 -0.281 9.690 3.717 1.00 0.00 C ATOM 3236 C THR D 4 -0.556 9.549 2.226 1.00 0.00 C ATOM 3237 O THR D 4 -1.527 8.903 1.828 1.00 0.00 O ATOM 3238 CB THR D 4 0.496 8.476 4.220 1.00 0.00 C ATOM 3239 OG1 THR D 4 1.767 8.405 3.593 1.00 0.00 O ATOM 3240 CG2 THR D 4 -0.218 7.166 3.967 1.00 0.00 C ATOM 0 H THR D 4 -1.862 8.968 4.880 1.00 0.00 H new ATOM 0 HA THR D 4 0.321 10.582 3.891 1.00 0.00 H new ATOM 0 HB THR D 4 0.594 8.614 5.297 1.00 0.00 H new ATOM 0 HG1 THR D 4 2.468 8.579 4.255 1.00 0.00 H new ATOM 0 HG21 THR D 4 0.386 6.343 4.348 1.00 0.00 H new ATOM 0 HG22 THR D 4 -1.182 7.173 4.475 1.00 0.00 H new ATOM 0 HG23 THR D 4 -0.373 7.037 2.896 1.00 0.00 H new ATOM 3248 N GLY D 5 0.290 10.149 1.403 1.00 0.00 N ATOM 3249 CA GLY D 5 0.097 10.066 -0.030 1.00 0.00 C ATOM 3250 C GLY D 5 1.391 9.846 -0.781 1.00 0.00 C ATOM 3251 O GLY D 5 2.384 10.532 -0.538 1.00 0.00 O ATOM 0 H GLY D 5 1.103 10.689 1.699 1.00 0.00 H new ATOM 0 HA2 GLY D 5 -0.591 9.251 -0.253 1.00 0.00 H new ATOM 0 HA3 GLY D 5 -0.372 10.984 -0.383 1.00 0.00 H new ATOM 3255 N ILE D 6 1.379 8.889 -1.701 1.00 0.00 N ATOM 3256 CA ILE D 6 2.561 8.584 -2.494 1.00 0.00 C ATOM 3257 C ILE D 6 2.179 7.982 -3.840 1.00 0.00 C ATOM 3258 O ILE D 6 1.022 7.626 -4.070 1.00 0.00 O ATOM 3259 CB ILE D 6 3.515 7.618 -1.763 1.00 0.00 C ATOM 3260 CG1 ILE D 6 2.828 6.276 -1.510 1.00 0.00 C ATOM 3261 CG2 ILE D 6 3.993 8.230 -0.452 1.00 0.00 C ATOM 3262 CD1 ILE D 6 3.759 5.226 -0.954 1.00 0.00 C ATOM 0 H ILE D 6 0.565 8.313 -1.915 1.00 0.00 H new ATOM 0 HA ILE D 6 3.078 9.530 -2.651 1.00 0.00 H new ATOM 0 HB ILE D 6 4.384 7.445 -2.398 1.00 0.00 H new ATOM 0 HG12 ILE D 6 2.001 6.424 -0.815 1.00 0.00 H new ATOM 0 HG13 ILE D 6 2.398 5.913 -2.444 1.00 0.00 H new ATOM 0 HG21 ILE D 6 4.665 7.535 0.050 1.00 0.00 H new ATOM 0 HG22 ILE D 6 4.521 9.161 -0.656 1.00 0.00 H new ATOM 0 HG23 ILE D 6 3.135 8.433 0.189 1.00 0.00 H new ATOM 0 HD11 ILE D 6 3.209 4.298 -0.797 1.00 0.00 H new ATOM 0 HD12 ILE D 6 4.572 5.051 -1.658 1.00 0.00 H new ATOM 0 HD13 ILE D 6 4.169 5.569 -0.004 1.00 0.00 H new ATOM 3274 N GLN D 7 3.160 7.880 -4.726 1.00 0.00 N ATOM 3275 CA GLN D 7 2.937 7.334 -6.059 1.00 0.00 C ATOM 3276 C GLN D 7 4.256 6.934 -6.710 1.00 0.00 C ATOM 3277 O GLN D 7 4.710 7.567 -7.663 1.00 0.00 O ATOM 3278 CB GLN D 7 2.200 8.353 -6.933 1.00 0.00 C ATOM 3279 CG GLN D 7 2.894 9.706 -7.014 1.00 0.00 C ATOM 3280 CD GLN D 7 2.149 10.723 -7.871 1.00 0.00 C ATOM 3281 OE1 GLN D 7 2.600 11.858 -8.025 1.00 0.00 O ATOM 3282 NE2 GLN D 7 1.006 10.333 -8.431 1.00 0.00 N ATOM 0 H GLN D 7 4.121 8.169 -4.546 1.00 0.00 H new ATOM 0 HA GLN D 7 2.320 6.441 -5.963 1.00 0.00 H new ATOM 0 HB2 GLN D 7 2.096 7.947 -7.939 1.00 0.00 H new ATOM 0 HB3 GLN D 7 1.193 8.494 -6.540 1.00 0.00 H new ATOM 0 HG2 GLN D 7 3.009 10.107 -6.007 1.00 0.00 H new ATOM 0 HG3 GLN D 7 3.897 9.567 -7.419 1.00 0.00 H new ATOM 0 HE21 GLN D 7 0.663 9.384 -8.282 1.00 0.00 H new ATOM 0 HE22 GLN D 7 0.474 10.983 -9.010 1.00 0.00 H new ATOM 3291 N VAL D 8 4.867 5.877 -6.187 1.00 0.00 N ATOM 3292 CA VAL D 8 6.134 5.392 -6.714 1.00 0.00 C ATOM 3293 C VAL D 8 5.946 4.783 -8.097 1.00 0.00 C ATOM 3294 O VAL D 8 4.975 4.072 -8.349 1.00 0.00 O ATOM 3295 CB VAL D 8 6.764 4.342 -5.778 1.00 0.00 C ATOM 3296 CG1 VAL D 8 8.120 3.894 -6.304 1.00 0.00 C ATOM 3297 CG2 VAL D 8 6.888 4.892 -4.367 1.00 0.00 C ATOM 0 H VAL D 8 4.504 5.341 -5.399 1.00 0.00 H new ATOM 0 HA VAL D 8 6.804 6.249 -6.784 1.00 0.00 H new ATOM 0 HB VAL D 8 6.109 3.472 -5.750 1.00 0.00 H new ATOM 0 HG11 VAL D 8 8.546 3.153 -5.628 1.00 0.00 H new ATOM 0 HG12 VAL D 8 7.999 3.454 -7.294 1.00 0.00 H new ATOM 0 HG13 VAL D 8 8.788 4.753 -6.368 1.00 0.00 H new ATOM 0 HG21 VAL D 8 7.335 4.137 -3.720 1.00 0.00 H new ATOM 0 HG22 VAL D 8 7.519 5.781 -4.377 1.00 0.00 H new ATOM 0 HG23 VAL D 8 5.899 5.153 -3.990 1.00 0.00 H new ATOM 3307 N ASP D 9 6.884 5.075 -8.992 1.00 0.00 N ATOM 3308 CA ASP D 9 6.831 4.564 -10.355 1.00 0.00 C ATOM 3309 C ASP D 9 8.130 4.867 -11.090 1.00 0.00 C ATOM 3310 O ASP D 9 8.429 6.023 -11.391 1.00 0.00 O ATOM 3311 CB ASP D 9 5.647 5.180 -11.105 1.00 0.00 C ATOM 3312 CG ASP D 9 5.576 4.734 -12.555 1.00 0.00 C ATOM 3313 OD1 ASP D 9 5.463 3.515 -12.797 1.00 0.00 O ATOM 3314 OD2 ASP D 9 5.633 5.606 -13.447 1.00 0.00 O ATOM 0 H ASP D 9 7.692 5.665 -8.796 1.00 0.00 H new ATOM 0 HA ASP D 9 6.699 3.483 -10.313 1.00 0.00 H new ATOM 0 HB2 ASP D 9 4.721 4.908 -10.600 1.00 0.00 H new ATOM 0 HB3 ASP D 9 5.723 6.267 -11.067 1.00 0.00 H new