USER MOD reduce.3.24.130724 H: found=0, std=0, add=1378, rem=0, adj=55 USER MOD reduce.3.24.130724 removed 1380 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 27 GLN :FLIP amide:sc= 0 F(o=-12!,f=-10) USER MOD Set 1.2: B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.3: B 32 TYR OH : rot 30:sc= 0.246 USER MOD Set 1.4: B 41 HIS : no HE2:sc= -10.7! C(o=-10!,f=-14!) USER MOD Set 2.1: A 77 TYR OH : rot 15:sc= -0.364 USER MOD Set 2.2: A 80 GLN : amide:sc= -0.479 K(o=-0.84,f=-4.7!) USER MOD Set 3.1: A 64 SER OG : rot -170:sc= -1.1! USER MOD Set 3.2: A 75 TYR OH : rot -47:sc= 1.14 USER MOD Set 4.1: A 55 HIS : no HD1:sc= -18.6! C(o=-36!,f=-42!) USER MOD Set 4.2: A 88 SER OG : rot -68:sc= 2.4 USER MOD Set 4.3: B 55 HIS : no HE2:sc= -20.3! C(o=-36!,f=-39!) USER MOD Set 4.4: B 88 SER OG : rot 170:sc= 0.371 USER MOD Set 5.1: A 53 THR OG1 : rot 150:sc= -0.166 USER MOD Set 5.2: B 67 THR OG1 : rot 180:sc= 0 USER MOD Set 6.1: A 51 ASN :FLIP amide:sc= -3.67! C(o=-8.9!,f=-7.7!) USER MOD Set 6.2: A 72 HIS : no HD1:sc= -3.83 K(o=-7.7,f=-8.8!) USER MOD Set 6.3: A 87 LYS NZ :NH3+ 148:sc= -0.151 (180deg=0) USER MOD Set 7.1: A 24 CYS SG : rot 83:sc= 2.04 USER MOD Set 7.2: A 49 LYS NZ :NH3+ -179:sc= -0.247 (180deg=-1.55) USER MOD Set 7.3: A 50 TYR OH : rot 2:sc= -1.07 USER MOD Set 8.1: A 36 LYS NZ :NH3+ -131:sc= 0.508 (180deg=0.00102) USER MOD Set 8.2: B 75 TYR OH : rot -47:sc= 0.86 USER MOD Set 9.1: A 32 TYR OH : rot 180:sc= 0.752 USER MOD Set 9.2: A 41 HIS : no HE2:sc= -13! C(o=-12!,f=-23!) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 ASN :FLIP amide:sc= -0.176 F(o=-1.4!,f=-0.18) USER MOD Single : A 13 MET CE :methyl 140:sc= -2.46! (180deg=-2.62!) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl 150:sc= -6.09! (180deg=-11.3!) USER MOD Single : A 18 GLN :FLIP amide:sc= -9.77! C(o=-19!,f=-9.8!) USER MOD Single : A 19 GLN :FLIP amide:sc= -3.14! C(o=-5.1!,f=-3.1!) USER MOD Single : A 21 SER OG : rot 62:sc= -6.98! USER MOD Single : A 26 THR OG1 : rot 90:sc= 0.215 USER MOD Single : A 27 GLN : amide:sc= -0.479 X(o=-0.48,f=-0.48) USER MOD Single : A 31 LYS NZ :NH3+ 170:sc= -1.06! (180deg=-2.07!) USER MOD Single : A 33 ASN :FLIP amide:sc= -0.215 F(o=-2.3!,f=-0.21) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 154:sc= -0.086 (180deg=-0.503) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 CYS SG : rot -40:sc= -9.41! USER MOD Single : A 61 ASN : amide:sc= -2.85 K(o=-2.8,f=-4!) USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -3.03! C(o=-3!,f=-8.2!) USER MOD Single : A 70 THR OG1 : rot 180:sc= -0.584 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 5 LYS NZ :NH3+ 162:sc= -0.0732 (180deg=-0.415) USER MOD Single : B 9 LYS NZ :NH3+ -144:sc= -0.653 (180deg=-2.24!) USER MOD Single : B 10 ASN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : B 13 MET CE :methyl 157:sc= 0 (180deg=-0.346) USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 17 MET CE :methyl 160:sc= -14.2! (180deg=-18!) USER MOD Single : B 18 GLN : amide:sc= -11.8! C(o=-12!,f=-12!) USER MOD Single : B 19 GLN : amide:sc= -0.652 K(o=-0.65,f=-1.8!) USER MOD Single : B 21 SER OG : rot 84:sc= -3.23! USER MOD Single : B 24 CYS SG : rot 180:sc= -0.756 USER MOD Single : B 26 THR OG1 : rot 72:sc= -0.764! USER MOD Single : B 33 ASN : amide:sc= -0.2 X(o=-0.2,f=-0.015) USER MOD Single : B 36 LYS NZ :NH3+ 142:sc= -1.72! (180deg=-3.57!) USER MOD Single : B 43 LYS NZ :NH3+ 158:sc= 0.034 (180deg=-0.368) 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+ 178:sc= 0 (180deg=-0.00461) USER MOD Single : B 50 TYR OH : rot -85:sc= -2.44! USER MOD Single : B 51 ASN : amide:sc= -0.0472 K(o=-0.047,f=-1.1) USER MOD Single : B 53 THR OG1 : rot 180:sc= 0 USER MOD Single : B 56 CYS SG : rot -169:sc= -9.38! USER MOD Single : B 61 ASN : amide:sc= -0.106 X(o=-0.11,f=-0.11) USER MOD Single : B 64 SER OG : rot -89:sc= -2.55! USER MOD Single : B 65 TYR OH : rot 180:sc= -0.003 USER MOD Single : B 68 HIS : no HD1:sc= -4.57! C(o=-4.6!,f=-5.8!) USER MOD Single : B 70 THR OG1 : rot 180:sc= -0.313 USER MOD Single : B 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 72 HIS : no HE2:sc= -1.72! C(o=-1.7!,f=-4.6!) USER MOD Single : B 77 TYR OH : rot 24:sc= -3.33! USER MOD Single : B 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 87 LYS NZ :NH3+ -177:sc= 1.47 (180deg=1.28) USER MOD ----------------------------------------------------------------- ATOM 67 N LYS A 5 -18.089 6.967 7.902 1.00 0.00 N ATOM 68 CA LYS A 5 -17.383 6.726 9.155 1.00 0.00 C ATOM 69 C LYS A 5 -15.875 6.883 8.977 1.00 0.00 C ATOM 70 O LYS A 5 -15.094 6.061 9.456 1.00 0.00 O ATOM 71 CB LYS A 5 -17.704 5.326 9.682 1.00 0.00 C ATOM 72 CG LYS A 5 -18.607 5.328 10.905 1.00 0.00 C ATOM 73 CD LYS A 5 -17.816 5.099 12.184 1.00 0.00 C ATOM 74 CE LYS A 5 -18.704 5.204 13.413 1.00 0.00 C ATOM 75 NZ LYS A 5 -19.393 3.917 13.712 1.00 0.00 N ATOM 0 HA LYS A 5 -17.720 7.468 9.879 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -18.181 4.749 8.890 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -16.772 4.818 9.930 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -19.134 6.280 10.968 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -19.364 4.551 10.800 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -17.350 4.114 12.154 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -17.011 5.831 12.252 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -18.102 5.502 14.272 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -19.447 5.986 13.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -19.989 4.030 14.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -19.988 3.645 12.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -18.684 3.176 13.885 1.00 0.00 H new ATOM 89 N ALA A 6 -15.474 7.945 8.287 1.00 0.00 N ATOM 90 CA ALA A 6 -14.061 8.212 8.049 1.00 0.00 C ATOM 91 C ALA A 6 -13.751 9.696 8.199 1.00 0.00 C ATOM 92 O ALA A 6 -14.656 10.522 8.311 1.00 0.00 O ATOM 93 CB ALA A 6 -13.654 7.723 6.669 1.00 0.00 C ATOM 0 H ALA A 6 -16.108 8.635 7.883 1.00 0.00 H new ATOM 0 HA ALA A 6 -13.484 7.669 8.798 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -12.596 7.930 6.507 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -13.829 6.650 6.597 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -14.245 8.238 5.912 1.00 0.00 H new ATOM 99 N VAL A 7 -12.464 10.028 8.199 1.00 0.00 N ATOM 100 CA VAL A 7 -12.034 11.413 8.335 1.00 0.00 C ATOM 101 C VAL A 7 -11.007 11.775 7.267 1.00 0.00 C ATOM 102 O VAL A 7 -9.801 11.693 7.498 1.00 0.00 O ATOM 103 CB VAL A 7 -11.426 11.679 9.725 1.00 0.00 C ATOM 104 CG1 VAL A 7 -11.131 13.160 9.906 1.00 0.00 C ATOM 105 CG2 VAL A 7 -12.354 11.175 10.821 1.00 0.00 C ATOM 0 H VAL A 7 -11.702 9.356 8.106 1.00 0.00 H new ATOM 0 HA VAL A 7 -12.921 12.034 8.210 1.00 0.00 H new ATOM 0 HB VAL A 7 -10.485 11.134 9.798 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -10.702 13.327 10.894 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -10.424 13.486 9.143 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -12.056 13.729 9.811 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -11.907 11.372 11.795 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -13.313 11.689 10.751 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -12.508 10.102 10.703 1.00 0.00 H new ATOM 115 N ILE A 8 -11.494 12.177 6.097 1.00 0.00 N ATOM 116 CA ILE A 8 -10.616 12.550 4.995 1.00 0.00 C ATOM 117 C ILE A 8 -9.542 13.529 5.464 1.00 0.00 C ATOM 118 O ILE A 8 -9.713 14.235 6.458 1.00 0.00 O ATOM 119 CB ILE A 8 -11.426 13.157 3.814 1.00 0.00 C ATOM 120 CG1 ILE A 8 -11.812 12.057 2.826 1.00 0.00 C ATOM 121 CG2 ILE A 8 -10.649 14.255 3.090 1.00 0.00 C ATOM 122 CD1 ILE A 8 -13.054 11.291 3.226 1.00 0.00 C ATOM 0 H ILE A 8 -12.490 12.252 5.889 1.00 0.00 H new ATOM 0 HA ILE A 8 -10.125 11.644 4.640 1.00 0.00 H new ATOM 0 HB ILE A 8 -12.325 13.610 4.232 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -11.971 12.502 1.844 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -10.980 11.359 2.729 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -11.253 14.650 2.273 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -10.416 15.058 3.790 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -9.723 13.842 2.690 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -13.267 10.527 2.478 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -12.893 10.816 4.194 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -13.898 11.977 3.294 1.00 0.00 H new ATOM 134 N LYS A 9 -8.438 13.564 4.729 1.00 0.00 N ATOM 135 CA LYS A 9 -7.328 14.453 5.044 1.00 0.00 C ATOM 136 C LYS A 9 -6.677 14.946 3.759 1.00 0.00 C ATOM 137 O LYS A 9 -5.909 15.907 3.764 1.00 0.00 O ATOM 138 CB LYS A 9 -6.295 13.731 5.913 1.00 0.00 C ATOM 139 CG LYS A 9 -6.901 12.711 6.863 1.00 0.00 C ATOM 140 CD LYS A 9 -7.549 13.385 8.062 1.00 0.00 C ATOM 141 CE LYS A 9 -7.825 12.388 9.176 1.00 0.00 C ATOM 142 NZ LYS A 9 -6.883 12.554 10.316 1.00 0.00 N ATOM 0 H LYS A 9 -8.287 12.982 3.905 1.00 0.00 H new ATOM 0 HA LYS A 9 -7.712 15.308 5.600 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -5.576 13.229 5.266 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -5.741 14.470 6.492 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -7.644 12.115 6.333 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -6.126 12.025 7.204 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -6.897 14.176 8.433 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -8.482 13.858 7.755 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -8.848 12.513 9.530 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -7.745 11.374 8.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -7.105 11.856 11.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -5.908 12.410 9.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -6.977 13.513 10.707 1.00 0.00 H new ATOM 156 N ASN A 10 -7.000 14.273 2.660 1.00 0.00 N ATOM 157 CA ASN A 10 -6.460 14.624 1.353 1.00 0.00 C ATOM 158 C ASN A 10 -7.220 13.895 0.251 1.00 0.00 C ATOM 159 O ASN A 10 -6.744 12.895 -0.285 1.00 0.00 O ATOM 160 CB ASN A 10 -4.977 14.270 1.279 1.00 0.00 C ATOM 161 CG ASN A 10 -4.139 15.400 0.713 1.00 0.00 C ATOM 162 OD1 ASN A 10 -4.773 16.280 -0.054 1.00 0.00 O flip ATOM 163 ND2 ASN A 10 -2.937 15.482 0.964 1.00 0.00 N flip ATOM 0 H ASN A 10 -7.637 13.477 2.650 1.00 0.00 H new ATOM 0 HA ASN A 10 -6.576 15.699 1.211 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -4.616 14.019 2.276 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -4.849 13.382 0.660 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -2.491 14.783 1.558 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -2.386 16.249 0.578 1.00 0.00 H new ATOM 170 N ALA A 11 -8.407 14.394 -0.075 1.00 0.00 N ATOM 171 CA ALA A 11 -9.231 13.778 -1.106 1.00 0.00 C ATOM 172 C ALA A 11 -9.152 14.543 -2.421 1.00 0.00 C ATOM 173 O ALA A 11 -10.080 15.265 -2.787 1.00 0.00 O ATOM 174 CB ALA A 11 -10.674 13.681 -0.637 1.00 0.00 C ATOM 0 H ALA A 11 -8.818 15.221 0.359 1.00 0.00 H new ATOM 0 HA ALA A 11 -8.845 12.774 -1.284 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -11.280 13.219 -1.417 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -10.723 13.075 0.268 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -11.056 14.680 -0.425 1.00 0.00 H new ATOM 180 N ASP A 12 -8.047 14.368 -3.136 1.00 0.00 N ATOM 181 CA ASP A 12 -7.859 15.031 -4.420 1.00 0.00 C ATOM 182 C ASP A 12 -8.653 14.308 -5.500 1.00 0.00 C ATOM 183 O ASP A 12 -8.265 14.286 -6.668 1.00 0.00 O ATOM 184 CB ASP A 12 -6.376 15.064 -4.794 1.00 0.00 C ATOM 185 CG ASP A 12 -6.109 15.928 -6.011 1.00 0.00 C ATOM 186 OD1 ASP A 12 -7.080 16.287 -6.708 1.00 0.00 O ATOM 187 OD2 ASP A 12 -4.927 16.244 -6.267 1.00 0.00 O ATOM 0 H ASP A 12 -7.269 13.774 -2.849 1.00 0.00 H new ATOM 0 HA ASP A 12 -8.219 16.056 -4.338 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -5.799 15.441 -3.950 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -6.030 14.049 -4.989 1.00 0.00 H new ATOM 192 N MET A 13 -9.767 13.709 -5.091 1.00 0.00 N ATOM 193 CA MET A 13 -10.625 12.969 -6.005 1.00 0.00 C ATOM 194 C MET A 13 -12.041 13.542 -6.006 1.00 0.00 C ATOM 195 O MET A 13 -12.421 14.287 -5.102 1.00 0.00 O ATOM 196 CB MET A 13 -10.650 11.491 -5.603 1.00 0.00 C ATOM 197 CG MET A 13 -11.859 10.727 -6.115 1.00 0.00 C ATOM 198 SD MET A 13 -12.601 9.685 -4.844 1.00 0.00 S ATOM 199 CE MET A 13 -11.288 8.499 -4.574 1.00 0.00 C ATOM 0 H MET A 13 -10.097 13.723 -4.126 1.00 0.00 H new ATOM 0 HA MET A 13 -10.224 13.061 -7.014 1.00 0.00 H new ATOM 0 HB2 MET A 13 -9.746 11.009 -5.975 1.00 0.00 H new ATOM 0 HB3 MET A 13 -10.624 11.421 -4.516 1.00 0.00 H new ATOM 0 HG2 MET A 13 -12.603 11.434 -6.482 1.00 0.00 H new ATOM 0 HG3 MET A 13 -11.563 10.108 -6.962 1.00 0.00 H new ATOM 0 HE1 MET A 13 -11.206 8.284 -3.509 1.00 0.00 H new ATOM 0 HE2 MET A 13 -11.512 7.579 -5.114 1.00 0.00 H new ATOM 0 HE3 MET A 13 -10.346 8.911 -4.935 1.00 0.00 H new ATOM 209 N SER A 14 -12.818 13.191 -7.027 1.00 0.00 N ATOM 210 CA SER A 14 -14.192 13.671 -7.144 1.00 0.00 C ATOM 211 C SER A 14 -14.960 13.451 -5.844 1.00 0.00 C ATOM 212 O SER A 14 -14.977 12.345 -5.302 1.00 0.00 O ATOM 213 CB SER A 14 -14.906 12.962 -8.298 1.00 0.00 C ATOM 214 OG SER A 14 -15.353 13.892 -9.269 1.00 0.00 O ATOM 0 H SER A 14 -12.520 12.576 -7.785 1.00 0.00 H new ATOM 0 HA SER A 14 -14.159 14.741 -7.348 1.00 0.00 H new ATOM 0 HB2 SER A 14 -14.230 12.244 -8.762 1.00 0.00 H new ATOM 0 HB3 SER A 14 -15.755 12.397 -7.913 1.00 0.00 H new ATOM 0 HG SER A 14 -15.804 13.414 -9.996 1.00 0.00 H new ATOM 220 N GLU A 15 -15.592 14.510 -5.346 1.00 0.00 N ATOM 221 CA GLU A 15 -16.360 14.430 -4.107 1.00 0.00 C ATOM 222 C GLU A 15 -17.098 13.100 -4.006 1.00 0.00 C ATOM 223 O GLU A 15 -16.695 12.210 -3.258 1.00 0.00 O ATOM 224 CB GLU A 15 -17.357 15.587 -4.019 1.00 0.00 C ATOM 225 CG GLU A 15 -16.986 16.777 -4.888 1.00 0.00 C ATOM 226 CD GLU A 15 -15.781 17.530 -4.359 1.00 0.00 C ATOM 227 OE1 GLU A 15 -15.797 17.915 -3.170 1.00 0.00 O ATOM 228 OE2 GLU A 15 -14.823 17.735 -5.132 1.00 0.00 O ATOM 0 H GLU A 15 -15.588 15.433 -5.781 1.00 0.00 H new ATOM 0 HA GLU A 15 -15.660 14.500 -3.275 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -18.344 15.228 -4.311 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -17.431 15.914 -2.982 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -16.779 16.432 -5.901 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -17.836 17.456 -4.950 1.00 0.00 H new ATOM 235 N GLU A 16 -18.182 12.971 -4.764 1.00 0.00 N ATOM 236 CA GLU A 16 -18.975 11.747 -4.760 1.00 0.00 C ATOM 237 C GLU A 16 -18.068 10.523 -4.813 1.00 0.00 C ATOM 238 O GLU A 16 -18.399 9.471 -4.269 1.00 0.00 O ATOM 239 CB GLU A 16 -19.942 11.733 -5.945 1.00 0.00 C ATOM 240 CG GLU A 16 -20.827 12.967 -6.023 1.00 0.00 C ATOM 241 CD GLU A 16 -22.304 12.628 -5.985 1.00 0.00 C ATOM 242 OE1 GLU A 16 -22.862 12.526 -4.872 1.00 0.00 O ATOM 243 OE2 GLU A 16 -22.904 12.466 -7.069 1.00 0.00 O ATOM 0 H GLU A 16 -18.531 13.698 -5.388 1.00 0.00 H new ATOM 0 HA GLU A 16 -19.552 11.716 -3.835 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -19.370 11.647 -6.869 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -20.573 10.847 -5.878 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -20.589 13.633 -5.194 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -20.606 13.511 -6.942 1.00 0.00 H new ATOM 250 N MET A 17 -16.921 10.670 -5.464 1.00 0.00 N ATOM 251 CA MET A 17 -15.966 9.576 -5.575 1.00 0.00 C ATOM 252 C MET A 17 -15.309 9.310 -4.225 1.00 0.00 C ATOM 253 O MET A 17 -15.048 8.163 -3.864 1.00 0.00 O ATOM 254 CB MET A 17 -14.903 9.899 -6.625 1.00 0.00 C ATOM 255 CG MET A 17 -15.266 9.431 -8.024 1.00 0.00 C ATOM 256 SD MET A 17 -14.103 8.214 -8.668 1.00 0.00 S ATOM 257 CE MET A 17 -14.139 6.987 -7.364 1.00 0.00 C ATOM 0 H MET A 17 -16.630 11.534 -5.922 1.00 0.00 H new ATOM 0 HA MET A 17 -16.501 8.679 -5.888 1.00 0.00 H new ATOM 0 HB2 MET A 17 -14.738 10.976 -6.643 1.00 0.00 H new ATOM 0 HB3 MET A 17 -13.961 9.437 -6.330 1.00 0.00 H new ATOM 0 HG2 MET A 17 -16.267 9.001 -8.011 1.00 0.00 H new ATOM 0 HG3 MET A 17 -15.297 10.290 -8.694 1.00 0.00 H new ATOM 0 HE1 MET A 17 -13.943 6.001 -7.786 1.00 0.00 H new ATOM 0 HE2 MET A 17 -13.376 7.222 -6.622 1.00 0.00 H new ATOM 0 HE3 MET A 17 -15.120 6.990 -6.889 1.00 0.00 H new ATOM 267 N GLN A 18 -15.053 10.382 -3.480 1.00 0.00 N ATOM 268 CA GLN A 18 -14.436 10.270 -2.164 1.00 0.00 C ATOM 269 C GLN A 18 -15.395 9.611 -1.180 1.00 0.00 C ATOM 270 O GLN A 18 -14.973 8.923 -0.251 1.00 0.00 O ATOM 271 CB GLN A 18 -14.023 11.648 -1.641 1.00 0.00 C ATOM 272 CG GLN A 18 -14.152 12.760 -2.667 1.00 0.00 C ATOM 273 CD GLN A 18 -12.920 13.641 -2.727 1.00 0.00 C ATOM 274 OE1 GLN A 18 -11.808 13.070 -3.176 1.00 0.00 O flip ATOM 275 NE2 GLN A 18 -12.967 14.819 -2.375 1.00 0.00 N flip ATOM 0 H GLN A 18 -15.264 11.338 -3.766 1.00 0.00 H new ATOM 0 HA GLN A 18 -13.545 9.650 -2.260 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -14.635 11.895 -0.773 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -12.989 11.601 -1.299 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -14.331 12.324 -3.650 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -15.021 13.372 -2.427 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -13.844 15.216 -2.037 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -12.129 15.399 -2.422 1.00 0.00 H new ATOM 284 N GLN A 19 -16.689 9.818 -1.400 1.00 0.00 N ATOM 285 CA GLN A 19 -17.707 9.235 -0.541 1.00 0.00 C ATOM 286 C GLN A 19 -17.870 7.761 -0.876 1.00 0.00 C ATOM 287 O GLN A 19 -18.044 6.922 0.010 1.00 0.00 O ATOM 288 CB GLN A 19 -19.038 9.975 -0.712 1.00 0.00 C ATOM 289 CG GLN A 19 -19.893 9.453 -1.857 1.00 0.00 C ATOM 290 CD GLN A 19 -21.055 10.369 -2.185 1.00 0.00 C ATOM 291 OE1 GLN A 19 -20.772 11.660 -2.316 1.00 0.00 O flip ATOM 292 NE2 GLN A 19 -22.194 9.921 -2.320 1.00 0.00 N flip ATOM 0 H GLN A 19 -17.055 10.385 -2.165 1.00 0.00 H new ATOM 0 HA GLN A 19 -17.396 9.332 0.499 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -19.606 9.900 0.215 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -18.835 11.033 -0.877 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -19.270 9.331 -2.743 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -20.276 8.466 -1.598 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -22.365 8.921 -2.210 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -22.966 10.549 -2.542 1.00 0.00 H new ATOM 301 N ASP A 20 -17.790 7.452 -2.165 1.00 0.00 N ATOM 302 CA ASP A 20 -17.905 6.080 -2.626 1.00 0.00 C ATOM 303 C ASP A 20 -16.656 5.303 -2.237 1.00 0.00 C ATOM 304 O ASP A 20 -16.691 4.084 -2.070 1.00 0.00 O ATOM 305 CB ASP A 20 -18.105 6.034 -4.142 1.00 0.00 C ATOM 306 CG ASP A 20 -19.501 5.585 -4.527 1.00 0.00 C ATOM 307 OD1 ASP A 20 -20.412 5.686 -3.679 1.00 0.00 O ATOM 308 OD2 ASP A 20 -19.683 5.132 -5.677 1.00 0.00 O ATOM 0 H ASP A 20 -17.646 8.136 -2.908 1.00 0.00 H new ATOM 0 HA ASP A 20 -18.775 5.623 -2.154 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -17.916 7.022 -4.561 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -17.374 5.356 -4.582 1.00 0.00 H new ATOM 313 N SER A 21 -15.554 6.030 -2.079 1.00 0.00 N ATOM 314 CA SER A 21 -14.287 5.429 -1.691 1.00 0.00 C ATOM 315 C SER A 21 -14.327 5.025 -0.224 1.00 0.00 C ATOM 316 O SER A 21 -14.012 3.889 0.128 1.00 0.00 O ATOM 317 CB SER A 21 -13.136 6.407 -1.936 1.00 0.00 C ATOM 318 OG SER A 21 -12.378 6.605 -0.755 1.00 0.00 O ATOM 0 H SER A 21 -15.516 7.040 -2.215 1.00 0.00 H new ATOM 0 HA SER A 21 -14.123 4.539 -2.298 1.00 0.00 H new ATOM 0 HB2 SER A 21 -12.491 6.024 -2.727 1.00 0.00 H new ATOM 0 HB3 SER A 21 -13.532 7.361 -2.282 1.00 0.00 H new ATOM 0 HG SER A 21 -11.979 5.754 -0.476 1.00 0.00 H new ATOM 324 N VAL A 22 -14.730 5.964 0.626 1.00 0.00 N ATOM 325 CA VAL A 22 -14.827 5.705 2.054 1.00 0.00 C ATOM 326 C VAL A 22 -15.810 4.575 2.326 1.00 0.00 C ATOM 327 O VAL A 22 -15.585 3.739 3.200 1.00 0.00 O ATOM 328 CB VAL A 22 -15.277 6.955 2.830 1.00 0.00 C ATOM 329 CG1 VAL A 22 -15.140 6.728 4.326 1.00 0.00 C ATOM 330 CG2 VAL A 22 -14.479 8.174 2.391 1.00 0.00 C ATOM 0 H VAL A 22 -14.994 6.910 0.349 1.00 0.00 H new ATOM 0 HA VAL A 22 -13.831 5.421 2.395 1.00 0.00 H new ATOM 0 HB VAL A 22 -16.328 7.141 2.608 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -15.462 7.622 4.861 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -15.761 5.883 4.624 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -14.098 6.516 4.568 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -14.812 9.048 2.951 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -13.419 8.003 2.581 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -14.633 8.346 1.326 1.00 0.00 H new ATOM 340 N GLU A 23 -16.897 4.552 1.561 1.00 0.00 N ATOM 341 CA GLU A 23 -17.911 3.516 1.711 1.00 0.00 C ATOM 342 C GLU A 23 -17.340 2.168 1.294 1.00 0.00 C ATOM 343 O GLU A 23 -17.608 1.144 1.924 1.00 0.00 O ATOM 344 CB GLU A 23 -19.148 3.852 0.876 1.00 0.00 C ATOM 345 CG GLU A 23 -19.832 5.141 1.301 1.00 0.00 C ATOM 346 CD GLU A 23 -21.120 5.397 0.544 1.00 0.00 C ATOM 347 OE1 GLU A 23 -21.048 5.863 -0.612 1.00 0.00 O ATOM 348 OE2 GLU A 23 -22.203 5.134 1.110 1.00 0.00 O ATOM 0 H GLU A 23 -17.097 5.238 0.833 1.00 0.00 H new ATOM 0 HA GLU A 23 -18.209 3.465 2.758 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -18.859 3.931 -0.172 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -19.860 3.030 0.949 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -20.045 5.099 2.369 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -19.151 5.978 1.144 1.00 0.00 H new ATOM 355 N CYS A 24 -16.532 2.183 0.239 1.00 0.00 N ATOM 356 CA CYS A 24 -15.900 0.967 -0.251 1.00 0.00 C ATOM 357 C CYS A 24 -14.841 0.507 0.740 1.00 0.00 C ATOM 358 O CYS A 24 -14.650 -0.690 0.961 1.00 0.00 O ATOM 359 CB CYS A 24 -15.270 1.205 -1.624 1.00 0.00 C ATOM 360 SG CYS A 24 -16.470 1.376 -2.966 1.00 0.00 S ATOM 0 H CYS A 24 -16.301 3.023 -0.291 1.00 0.00 H new ATOM 0 HA CYS A 24 -16.659 0.191 -0.353 1.00 0.00 H new ATOM 0 HB2 CYS A 24 -14.659 2.106 -1.580 1.00 0.00 H new ATOM 0 HB3 CYS A 24 -14.600 0.376 -1.853 1.00 0.00 H new ATOM 0 HG CYS A 24 -16.914 2.597 -2.998 1.00 0.00 H new ATOM 366 N ALA A 25 -14.182 1.476 1.368 1.00 0.00 N ATOM 367 CA ALA A 25 -13.172 1.181 2.368 1.00 0.00 C ATOM 368 C ALA A 25 -13.869 0.683 3.614 1.00 0.00 C ATOM 369 O ALA A 25 -13.395 -0.223 4.301 1.00 0.00 O ATOM 370 CB ALA A 25 -12.337 2.417 2.671 1.00 0.00 C ATOM 0 H ALA A 25 -14.332 2.471 1.199 1.00 0.00 H new ATOM 0 HA ALA A 25 -12.493 0.415 1.995 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -11.586 2.174 3.423 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -11.842 2.754 1.760 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -12.984 3.210 3.047 1.00 0.00 H new ATOM 376 N THR A 26 -15.027 1.275 3.871 1.00 0.00 N ATOM 377 CA THR A 26 -15.849 0.904 5.003 1.00 0.00 C ATOM 378 C THR A 26 -16.424 -0.487 4.781 1.00 0.00 C ATOM 379 O THR A 26 -16.543 -1.282 5.712 1.00 0.00 O ATOM 380 CB THR A 26 -16.974 1.918 5.183 1.00 0.00 C ATOM 381 OG1 THR A 26 -16.453 3.194 5.516 1.00 0.00 O ATOM 382 CG2 THR A 26 -17.955 1.531 6.259 1.00 0.00 C ATOM 0 H THR A 26 -15.418 2.024 3.299 1.00 0.00 H new ATOM 0 HA THR A 26 -15.239 0.896 5.906 1.00 0.00 H new ATOM 0 HB THR A 26 -17.496 1.943 4.227 1.00 0.00 H new ATOM 0 HG1 THR A 26 -16.283 3.702 4.696 1.00 0.00 H new ATOM 0 HG21 THR A 26 -18.730 2.294 6.336 1.00 0.00 H new ATOM 0 HG22 THR A 26 -18.412 0.574 6.008 1.00 0.00 H new ATOM 0 HG23 THR A 26 -17.434 1.445 7.213 1.00 0.00 H new ATOM 390 N GLN A 27 -16.760 -0.778 3.525 1.00 0.00 N ATOM 391 CA GLN A 27 -17.300 -2.080 3.161 1.00 0.00 C ATOM 392 C GLN A 27 -16.276 -3.158 3.472 1.00 0.00 C ATOM 393 O GLN A 27 -16.616 -4.237 3.961 1.00 0.00 O ATOM 394 CB GLN A 27 -17.669 -2.113 1.677 1.00 0.00 C ATOM 395 CG GLN A 27 -19.114 -1.735 1.403 1.00 0.00 C ATOM 396 CD GLN A 27 -20.099 -2.641 2.116 1.00 0.00 C ATOM 397 OE1 GLN A 27 -20.866 -2.194 2.969 1.00 0.00 O ATOM 398 NE2 GLN A 27 -20.082 -3.922 1.769 1.00 0.00 N ATOM 0 H GLN A 27 -16.666 -0.127 2.745 1.00 0.00 H new ATOM 0 HA GLN A 27 -18.204 -2.264 3.741 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -17.014 -1.432 1.133 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -17.483 -3.114 1.287 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -19.282 -0.704 1.716 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -19.299 -1.776 0.330 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -19.429 -4.249 1.057 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -20.722 -4.580 2.215 1.00 0.00 H new ATOM 407 N ALA A 28 -15.012 -2.846 3.205 1.00 0.00 N ATOM 408 CA ALA A 28 -13.926 -3.774 3.478 1.00 0.00 C ATOM 409 C ALA A 28 -13.703 -3.871 4.979 1.00 0.00 C ATOM 410 O ALA A 28 -13.266 -4.899 5.495 1.00 0.00 O ATOM 411 CB ALA A 28 -12.652 -3.320 2.782 1.00 0.00 C ATOM 0 H ALA A 28 -14.717 -1.958 2.800 1.00 0.00 H new ATOM 0 HA ALA A 28 -14.194 -4.758 3.093 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -11.849 -4.025 2.997 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -12.820 -3.278 1.706 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -12.372 -2.331 3.144 1.00 0.00 H new ATOM 417 N LEU A 29 -14.020 -2.783 5.675 1.00 0.00 N ATOM 418 CA LEU A 29 -13.868 -2.724 7.121 1.00 0.00 C ATOM 419 C LEU A 29 -14.934 -3.567 7.812 1.00 0.00 C ATOM 420 O LEU A 29 -14.657 -4.265 8.788 1.00 0.00 O ATOM 421 CB LEU A 29 -13.961 -1.280 7.605 1.00 0.00 C ATOM 422 CG LEU A 29 -12.729 -0.425 7.321 1.00 0.00 C ATOM 423 CD1 LEU A 29 -13.135 0.884 6.674 1.00 0.00 C ATOM 424 CD2 LEU A 29 -11.950 -0.171 8.601 1.00 0.00 C ATOM 0 H LEU A 29 -14.385 -1.928 5.256 1.00 0.00 H new ATOM 0 HA LEU A 29 -12.886 -3.125 7.374 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -14.826 -0.811 7.137 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -14.143 -1.284 8.680 1.00 0.00 H new ATOM 0 HG LEU A 29 -12.083 -0.966 6.630 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -12.246 1.484 6.477 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -13.651 0.681 5.736 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -13.800 1.430 7.343 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -11.075 0.440 8.379 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -12.586 0.351 9.316 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -11.630 -1.122 9.027 1.00 0.00 H new ATOM 436 N GLU A 30 -16.159 -3.488 7.301 1.00 0.00 N ATOM 437 CA GLU A 30 -17.278 -4.234 7.865 1.00 0.00 C ATOM 438 C GLU A 30 -17.154 -5.725 7.563 1.00 0.00 C ATOM 439 O GLU A 30 -17.572 -6.564 8.360 1.00 0.00 O ATOM 440 CB GLU A 30 -18.602 -3.699 7.313 1.00 0.00 C ATOM 441 CG GLU A 30 -19.494 -3.072 8.372 1.00 0.00 C ATOM 442 CD GLU A 30 -20.780 -2.511 7.797 1.00 0.00 C ATOM 443 OE1 GLU A 30 -20.773 -1.343 7.355 1.00 0.00 O ATOM 444 OE2 GLU A 30 -21.794 -3.240 7.787 1.00 0.00 O ATOM 0 H GLU A 30 -16.402 -2.913 6.495 1.00 0.00 H new ATOM 0 HA GLU A 30 -17.259 -4.101 8.947 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -18.392 -2.958 6.542 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -19.142 -4.515 6.832 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -19.735 -3.820 9.128 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -18.948 -2.274 8.875 1.00 0.00 H new ATOM 451 N LYS A 31 -16.581 -6.047 6.407 1.00 0.00 N ATOM 452 CA LYS A 31 -16.408 -7.438 6.003 1.00 0.00 C ATOM 453 C LYS A 31 -15.108 -8.012 6.558 1.00 0.00 C ATOM 454 O LYS A 31 -14.989 -9.220 6.762 1.00 0.00 O ATOM 455 CB LYS A 31 -16.415 -7.553 4.477 1.00 0.00 C ATOM 456 CG LYS A 31 -17.807 -7.668 3.879 1.00 0.00 C ATOM 457 CD LYS A 31 -17.922 -6.882 2.583 1.00 0.00 C ATOM 458 CE LYS A 31 -18.021 -7.805 1.380 1.00 0.00 C ATOM 459 NZ LYS A 31 -18.478 -9.170 1.763 1.00 0.00 N ATOM 0 H LYS A 31 -16.229 -5.365 5.735 1.00 0.00 H new ATOM 0 HA LYS A 31 -17.241 -8.012 6.410 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -15.918 -6.680 4.054 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -15.830 -8.425 4.185 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -18.038 -8.717 3.692 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -18.543 -7.302 4.595 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -18.801 -6.239 2.623 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -17.055 -6.231 2.473 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -18.714 -7.381 0.653 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -17.048 -7.871 0.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -18.695 -9.717 0.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -17.727 -9.650 2.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -19.332 -9.098 2.353 1.00 0.00 H new ATOM 473 N TYR A 32 -14.136 -7.139 6.798 1.00 0.00 N ATOM 474 CA TYR A 32 -12.843 -7.562 7.327 1.00 0.00 C ATOM 475 C TYR A 32 -12.150 -6.409 8.046 1.00 0.00 C ATOM 476 O TYR A 32 -12.669 -5.294 8.092 1.00 0.00 O ATOM 477 CB TYR A 32 -11.949 -8.086 6.198 1.00 0.00 C ATOM 478 CG TYR A 32 -12.640 -8.162 4.855 1.00 0.00 C ATOM 479 CD1 TYR A 32 -12.755 -7.037 4.047 1.00 0.00 C ATOM 480 CD2 TYR A 32 -13.181 -9.356 4.396 1.00 0.00 C ATOM 481 CE1 TYR A 32 -13.388 -7.100 2.821 1.00 0.00 C ATOM 482 CE2 TYR A 32 -13.816 -9.427 3.169 1.00 0.00 C ATOM 483 CZ TYR A 32 -13.917 -8.297 2.387 1.00 0.00 C ATOM 484 OH TYR A 32 -14.550 -8.364 1.166 1.00 0.00 O ATOM 0 H TYR A 32 -14.218 -6.135 6.635 1.00 0.00 H new ATOM 0 HA TYR A 32 -13.016 -8.365 8.043 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -11.075 -7.440 6.110 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -11.586 -9.078 6.466 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -12.342 -6.097 4.384 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -13.105 -10.243 5.007 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -13.468 -6.216 2.205 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -14.230 -10.363 2.826 1.00 0.00 H new ATOM 0 HH TYR A 32 -14.864 -9.279 1.010 1.00 0.00 H new ATOM 494 N ASN A 33 -10.976 -6.684 8.605 1.00 0.00 N ATOM 495 CA ASN A 33 -10.215 -5.665 9.320 1.00 0.00 C ATOM 496 C ASN A 33 -8.739 -6.039 9.398 1.00 0.00 C ATOM 497 O ASN A 33 -8.090 -5.839 10.426 1.00 0.00 O ATOM 498 CB ASN A 33 -10.776 -5.470 10.729 1.00 0.00 C ATOM 499 CG ASN A 33 -11.092 -6.786 11.412 1.00 0.00 C ATOM 500 OD1 ASN A 33 -10.157 -7.727 11.345 1.00 0.00 O flip ATOM 501 ND2 ASN A 33 -12.163 -6.955 11.996 1.00 0.00 N flip ATOM 0 H ASN A 33 -10.531 -7.602 8.577 1.00 0.00 H new ATOM 0 HA ASN A 33 -10.306 -4.730 8.767 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -10.056 -4.915 11.330 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -11.681 -4.865 10.676 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -12.853 -6.205 12.023 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -12.360 -7.845 12.453 1.00 0.00 H new ATOM 508 N ILE A 34 -8.212 -6.581 8.306 1.00 0.00 N ATOM 509 CA ILE A 34 -6.811 -6.980 8.248 1.00 0.00 C ATOM 510 C ILE A 34 -5.991 -5.976 7.451 1.00 0.00 C ATOM 511 O ILE A 34 -5.107 -6.357 6.685 1.00 0.00 O ATOM 512 CB ILE A 34 -6.647 -8.368 7.603 1.00 0.00 C ATOM 513 CG1 ILE A 34 -7.548 -9.388 8.294 1.00 0.00 C ATOM 514 CG2 ILE A 34 -5.191 -8.809 7.655 1.00 0.00 C ATOM 515 CD1 ILE A 34 -7.265 -9.532 9.767 1.00 0.00 C ATOM 0 H ILE A 34 -8.735 -6.754 7.448 1.00 0.00 H new ATOM 0 HA ILE A 34 -6.452 -7.016 9.276 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.947 -8.303 6.557 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -8.589 -9.094 8.158 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -7.425 -10.357 7.811 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -5.092 -9.792 7.195 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.574 -8.091 7.114 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -4.863 -8.860 8.693 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -7.940 -10.272 10.197 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -6.234 -9.856 9.909 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -7.416 -8.573 10.262 1.00 0.00 H new ATOM 527 N GLU A 35 -6.293 -4.693 7.626 1.00 0.00 N ATOM 528 CA GLU A 35 -5.583 -3.644 6.908 1.00 0.00 C ATOM 529 C GLU A 35 -5.396 -4.038 5.447 1.00 0.00 C ATOM 530 O GLU A 35 -6.222 -3.706 4.596 1.00 0.00 O ATOM 531 CB GLU A 35 -4.226 -3.373 7.562 1.00 0.00 C ATOM 532 CG GLU A 35 -4.333 -2.710 8.926 1.00 0.00 C ATOM 533 CD GLU A 35 -4.103 -3.683 10.067 1.00 0.00 C ATOM 534 OE1 GLU A 35 -3.268 -4.596 9.908 1.00 0.00 O ATOM 535 OE2 GLU A 35 -4.759 -3.529 11.119 1.00 0.00 O ATOM 0 H GLU A 35 -7.021 -4.357 8.256 1.00 0.00 H new ATOM 0 HA GLU A 35 -6.177 -2.731 6.951 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -3.687 -4.315 7.666 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -3.634 -2.738 6.903 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -3.605 -1.901 8.991 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -5.320 -2.260 9.031 1.00 0.00 H new ATOM 542 N LYS A 36 -4.318 -4.763 5.162 1.00 0.00 N ATOM 543 CA LYS A 36 -4.048 -5.211 3.804 1.00 0.00 C ATOM 544 C LYS A 36 -5.295 -5.851 3.202 1.00 0.00 C ATOM 545 O LYS A 36 -5.543 -5.744 2.000 1.00 0.00 O ATOM 546 CB LYS A 36 -2.889 -6.210 3.791 1.00 0.00 C ATOM 547 CG LYS A 36 -1.976 -6.099 5.000 1.00 0.00 C ATOM 548 CD LYS A 36 -0.576 -6.603 4.687 1.00 0.00 C ATOM 549 CE LYS A 36 0.086 -5.767 3.604 1.00 0.00 C ATOM 550 NZ LYS A 36 1.535 -6.078 3.468 1.00 0.00 N ATOM 0 H LYS A 36 -3.622 -5.050 5.850 1.00 0.00 H new ATOM 0 HA LYS A 36 -3.770 -4.345 3.204 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -3.293 -7.221 3.743 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -2.300 -6.059 2.886 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -1.926 -5.060 5.326 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -2.394 -6.672 5.827 1.00 0.00 H new ATOM 0 HD2 LYS A 36 0.032 -6.577 5.591 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -0.626 -7.643 4.366 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -0.414 -5.945 2.652 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -0.038 -4.709 3.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 2.081 -5.193 3.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 1.839 -6.671 4.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 1.698 -6.588 2.576 1.00 0.00 H new ATOM 564 N ASP A 37 -6.082 -6.509 4.051 1.00 0.00 N ATOM 565 CA ASP A 37 -7.311 -7.157 3.607 1.00 0.00 C ATOM 566 C ASP A 37 -8.316 -6.115 3.136 1.00 0.00 C ATOM 567 O ASP A 37 -8.931 -6.262 2.079 1.00 0.00 O ATOM 568 CB ASP A 37 -7.916 -7.992 4.740 1.00 0.00 C ATOM 569 CG ASP A 37 -7.583 -9.465 4.616 1.00 0.00 C ATOM 570 OD1 ASP A 37 -6.381 -9.798 4.541 1.00 0.00 O ATOM 571 OD2 ASP A 37 -8.524 -10.286 4.592 1.00 0.00 O ATOM 0 H ASP A 37 -5.890 -6.607 5.048 1.00 0.00 H new ATOM 0 HA ASP A 37 -7.070 -7.818 2.775 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -7.550 -7.619 5.697 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -8.999 -7.866 4.742 1.00 0.00 H new ATOM 576 N ILE A 38 -8.470 -5.055 3.923 1.00 0.00 N ATOM 577 CA ILE A 38 -9.390 -3.979 3.584 1.00 0.00 C ATOM 578 C ILE A 38 -8.931 -3.264 2.319 1.00 0.00 C ATOM 579 O ILE A 38 -9.744 -2.884 1.478 1.00 0.00 O ATOM 580 CB ILE A 38 -9.509 -2.953 4.727 1.00 0.00 C ATOM 581 CG1 ILE A 38 -10.097 -3.612 5.976 1.00 0.00 C ATOM 582 CG2 ILE A 38 -10.366 -1.774 4.291 1.00 0.00 C ATOM 583 CD1 ILE A 38 -9.165 -3.586 7.168 1.00 0.00 C ATOM 0 H ILE A 38 -7.968 -4.920 4.801 1.00 0.00 H new ATOM 0 HA ILE A 38 -10.368 -4.431 3.419 1.00 0.00 H new ATOM 0 HB ILE A 38 -8.512 -2.584 4.970 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -11.026 -3.107 6.240 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -10.351 -4.647 5.746 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -10.441 -1.057 5.109 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -9.909 -1.292 3.427 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.362 -2.127 4.025 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -9.647 -4.070 8.017 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -8.245 -4.116 6.922 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -8.931 -2.553 7.424 1.00 0.00 H new ATOM 595 N ALA A 39 -7.617 -3.094 2.189 1.00 0.00 N ATOM 596 CA ALA A 39 -7.045 -2.435 1.023 1.00 0.00 C ATOM 597 C ALA A 39 -7.375 -3.215 -0.244 1.00 0.00 C ATOM 598 O ALA A 39 -7.745 -2.635 -1.265 1.00 0.00 O ATOM 599 CB ALA A 39 -5.538 -2.288 1.183 1.00 0.00 C ATOM 0 H ALA A 39 -6.931 -3.404 2.877 1.00 0.00 H new ATOM 0 HA ALA A 39 -7.481 -1.440 0.938 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.125 -1.794 0.304 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.323 -1.691 2.069 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -5.086 -3.274 1.291 1.00 0.00 H new ATOM 605 N ALA A 40 -7.252 -4.537 -0.164 1.00 0.00 N ATOM 606 CA ALA A 40 -7.550 -5.401 -1.297 1.00 0.00 C ATOM 607 C ALA A 40 -9.016 -5.272 -1.688 1.00 0.00 C ATOM 608 O ALA A 40 -9.343 -4.954 -2.831 1.00 0.00 O ATOM 609 CB ALA A 40 -7.216 -6.845 -0.956 1.00 0.00 C ATOM 0 H ALA A 40 -6.948 -5.031 0.675 1.00 0.00 H new ATOM 0 HA ALA A 40 -6.938 -5.093 -2.145 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.443 -7.482 -1.811 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -6.156 -6.926 -0.714 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -7.809 -7.163 -0.099 1.00 0.00 H new ATOM 615 N HIS A 41 -9.894 -5.511 -0.720 1.00 0.00 N ATOM 616 CA HIS A 41 -11.330 -5.412 -0.942 1.00 0.00 C ATOM 617 C HIS A 41 -11.670 -4.110 -1.661 1.00 0.00 C ATOM 618 O HIS A 41 -12.425 -4.102 -2.633 1.00 0.00 O ATOM 619 CB HIS A 41 -12.071 -5.491 0.401 1.00 0.00 C ATOM 620 CG HIS A 41 -13.441 -4.881 0.388 1.00 0.00 C ATOM 621 ND1 HIS A 41 -14.577 -5.575 0.752 1.00 0.00 N ATOM 622 CD2 HIS A 41 -13.857 -3.633 0.061 1.00 0.00 C ATOM 623 CE1 HIS A 41 -15.629 -4.783 0.645 1.00 0.00 C ATOM 624 NE2 HIS A 41 -15.218 -3.599 0.229 1.00 0.00 N ATOM 0 H HIS A 41 -9.634 -5.776 0.230 1.00 0.00 H new ATOM 0 HA HIS A 41 -11.648 -6.243 -1.571 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -12.155 -6.537 0.695 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -11.472 -4.993 1.163 1.00 0.00 H new ATOM 0 HD1 HIS A 41 -14.601 -6.548 1.056 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -13.233 -2.817 -0.270 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -16.651 -5.057 0.861 1.00 0.00 H new ATOM 633 N ILE A 42 -11.102 -3.014 -1.173 1.00 0.00 N ATOM 634 CA ILE A 42 -11.336 -1.701 -1.760 1.00 0.00 C ATOM 635 C ILE A 42 -10.733 -1.608 -3.157 1.00 0.00 C ATOM 636 O ILE A 42 -11.455 -1.539 -4.151 1.00 0.00 O ATOM 637 CB ILE A 42 -10.739 -0.584 -0.883 1.00 0.00 C ATOM 638 CG1 ILE A 42 -11.258 -0.700 0.551 1.00 0.00 C ATOM 639 CG2 ILE A 42 -11.073 0.779 -1.468 1.00 0.00 C ATOM 640 CD1 ILE A 42 -10.295 -0.167 1.591 1.00 0.00 C ATOM 0 H ILE A 42 -10.474 -3.009 -0.369 1.00 0.00 H new ATOM 0 HA ILE A 42 -12.416 -1.569 -1.824 1.00 0.00 H new ATOM 0 HB ILE A 42 -9.655 -0.693 -0.864 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -12.201 -0.160 0.631 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -11.470 -1.747 0.768 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -10.645 1.560 -0.839 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -10.658 0.855 -2.473 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -12.155 0.901 -1.512 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -10.731 -0.283 2.583 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -9.359 -0.723 1.539 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -10.101 0.889 1.400 1.00 0.00 H new ATOM 652 N LYS A 43 -9.406 -1.604 -3.223 1.00 0.00 N ATOM 653 CA LYS A 43 -8.703 -1.515 -4.498 1.00 0.00 C ATOM 654 C LYS A 43 -9.345 -2.422 -5.542 1.00 0.00 C ATOM 655 O LYS A 43 -9.391 -2.085 -6.725 1.00 0.00 O ATOM 656 CB LYS A 43 -7.230 -1.886 -4.319 1.00 0.00 C ATOM 657 CG LYS A 43 -6.394 -1.678 -5.572 1.00 0.00 C ATOM 658 CD LYS A 43 -5.749 -2.974 -6.037 1.00 0.00 C ATOM 659 CE LYS A 43 -4.232 -2.880 -6.024 1.00 0.00 C ATOM 660 NZ LYS A 43 -3.659 -2.942 -7.396 1.00 0.00 N ATOM 0 H LYS A 43 -8.795 -1.661 -2.408 1.00 0.00 H new ATOM 0 HA LYS A 43 -8.772 -0.485 -4.849 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -6.810 -1.290 -3.509 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -7.161 -2.931 -4.016 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -7.023 -1.278 -6.367 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -5.620 -0.936 -5.375 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -6.069 -3.792 -5.392 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -6.091 -3.210 -7.045 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -3.930 -1.948 -5.547 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -3.823 -3.692 -5.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -2.623 -2.875 -7.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -3.925 -3.843 -7.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -4.029 -2.152 -7.963 1.00 0.00 H new ATOM 674 N LYS A 44 -9.839 -3.573 -5.099 1.00 0.00 N ATOM 675 CA LYS A 44 -10.478 -4.526 -5.998 1.00 0.00 C ATOM 676 C LYS A 44 -11.771 -3.952 -6.566 1.00 0.00 C ATOM 677 O LYS A 44 -11.906 -3.767 -7.776 1.00 0.00 O ATOM 678 CB LYS A 44 -10.765 -5.839 -5.265 1.00 0.00 C ATOM 679 CG LYS A 44 -9.811 -6.963 -5.633 1.00 0.00 C ATOM 680 CD LYS A 44 -10.526 -8.304 -5.686 1.00 0.00 C ATOM 681 CE LYS A 44 -10.992 -8.631 -7.095 1.00 0.00 C ATOM 682 NZ LYS A 44 -9.847 -8.826 -8.027 1.00 0.00 N ATOM 0 H LYS A 44 -9.809 -3.868 -4.123 1.00 0.00 H new ATOM 0 HA LYS A 44 -9.795 -4.723 -6.824 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -10.710 -5.665 -4.190 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -11.785 -6.153 -5.486 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -9.356 -6.753 -6.601 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -9.002 -7.009 -4.904 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -9.857 -9.088 -5.332 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -11.383 -8.287 -5.013 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -11.602 -9.534 -7.075 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -11.627 -7.825 -7.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -10.137 -9.448 -8.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -9.550 -7.906 -8.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -9.053 -9.260 -7.515 1.00 0.00 H new ATOM 696 N GLU A 45 -12.718 -3.671 -5.681 1.00 0.00 N ATOM 697 CA GLU A 45 -14.004 -3.114 -6.087 1.00 0.00 C ATOM 698 C GLU A 45 -13.810 -1.867 -6.943 1.00 0.00 C ATOM 699 O GLU A 45 -14.371 -1.757 -8.031 1.00 0.00 O ATOM 700 CB GLU A 45 -14.848 -2.777 -4.856 1.00 0.00 C ATOM 701 CG GLU A 45 -15.185 -3.986 -4.001 1.00 0.00 C ATOM 702 CD GLU A 45 -16.559 -3.891 -3.369 1.00 0.00 C ATOM 703 OE1 GLU A 45 -16.939 -2.782 -2.938 1.00 0.00 O ATOM 704 OE2 GLU A 45 -17.257 -4.925 -3.305 1.00 0.00 O ATOM 0 H GLU A 45 -12.621 -3.819 -4.676 1.00 0.00 H new ATOM 0 HA GLU A 45 -14.526 -3.863 -6.682 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -14.312 -2.049 -4.247 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -15.774 -2.302 -5.180 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -15.133 -4.885 -4.615 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -14.435 -4.092 -3.217 1.00 0.00 H new ATOM 711 N PHE A 46 -13.008 -0.933 -6.443 1.00 0.00 N ATOM 712 CA PHE A 46 -12.736 0.306 -7.163 1.00 0.00 C ATOM 713 C PHE A 46 -12.251 0.017 -8.578 1.00 0.00 C ATOM 714 O PHE A 46 -12.787 0.548 -9.551 1.00 0.00 O ATOM 715 CB PHE A 46 -11.688 1.133 -6.416 1.00 0.00 C ATOM 716 CG PHE A 46 -12.260 2.311 -5.683 1.00 0.00 C ATOM 717 CD1 PHE A 46 -12.751 2.168 -4.396 1.00 0.00 C ATOM 718 CD2 PHE A 46 -12.304 3.561 -6.278 1.00 0.00 C ATOM 719 CE1 PHE A 46 -13.275 3.249 -3.716 1.00 0.00 C ATOM 720 CE2 PHE A 46 -12.826 4.647 -5.604 1.00 0.00 C ATOM 721 CZ PHE A 46 -13.313 4.491 -4.320 1.00 0.00 C ATOM 0 H PHE A 46 -12.535 -1.010 -5.543 1.00 0.00 H new ATOM 0 HA PHE A 46 -13.665 0.873 -7.223 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -11.170 0.490 -5.704 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -10.942 1.486 -7.128 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -12.724 1.200 -3.919 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -11.925 3.688 -7.281 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -13.655 3.124 -2.713 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -12.854 5.616 -6.079 1.00 0.00 H new ATOM 0 HZ PHE A 46 -13.722 5.338 -3.790 1.00 0.00 H new ATOM 731 N ASP A 47 -11.232 -0.829 -8.685 1.00 0.00 N ATOM 732 CA ASP A 47 -10.670 -1.189 -9.981 1.00 0.00 C ATOM 733 C ASP A 47 -11.736 -1.784 -10.893 1.00 0.00 C ATOM 734 O ASP A 47 -11.637 -1.702 -12.116 1.00 0.00 O ATOM 735 CB ASP A 47 -9.522 -2.183 -9.803 1.00 0.00 C ATOM 736 CG ASP A 47 -8.198 -1.494 -9.542 1.00 0.00 C ATOM 737 OD1 ASP A 47 -8.148 -0.627 -8.643 1.00 0.00 O ATOM 738 OD2 ASP A 47 -7.213 -1.818 -10.236 1.00 0.00 O ATOM 0 H ASP A 47 -10.779 -1.278 -7.889 1.00 0.00 H new ATOM 0 HA ASP A 47 -10.288 -0.281 -10.447 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -9.750 -2.853 -8.974 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -9.437 -2.800 -10.697 1.00 0.00 H new ATOM 743 N LYS A 48 -12.756 -2.387 -10.293 1.00 0.00 N ATOM 744 CA LYS A 48 -13.833 -2.998 -11.059 1.00 0.00 C ATOM 745 C LYS A 48 -15.151 -2.264 -10.837 1.00 0.00 C ATOM 746 O LYS A 48 -16.211 -2.731 -11.254 1.00 0.00 O ATOM 747 CB LYS A 48 -13.986 -4.469 -10.673 1.00 0.00 C ATOM 748 CG LYS A 48 -12.943 -5.376 -11.307 1.00 0.00 C ATOM 749 CD LYS A 48 -12.995 -5.308 -12.824 1.00 0.00 C ATOM 750 CE LYS A 48 -14.370 -5.688 -13.349 1.00 0.00 C ATOM 751 NZ LYS A 48 -14.337 -6.026 -14.798 1.00 0.00 N ATOM 0 H LYS A 48 -12.859 -2.465 -9.281 1.00 0.00 H new ATOM 0 HA LYS A 48 -13.576 -2.928 -12.116 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -13.924 -4.560 -9.589 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -14.979 -4.811 -10.965 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -11.950 -5.087 -10.963 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -13.107 -6.403 -10.982 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -12.744 -4.300 -13.153 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -12.245 -5.977 -13.246 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -14.751 -6.540 -12.786 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -15.062 -4.862 -13.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -15.294 -6.279 -15.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -13.998 -5.205 -15.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -13.696 -6.830 -14.952 1.00 0.00 H new ATOM 765 N LYS A 49 -15.079 -1.114 -10.176 1.00 0.00 N ATOM 766 CA LYS A 49 -16.266 -0.318 -9.898 1.00 0.00 C ATOM 767 C LYS A 49 -16.139 1.083 -10.489 1.00 0.00 C ATOM 768 O LYS A 49 -17.082 1.873 -10.435 1.00 0.00 O ATOM 769 CB LYS A 49 -16.503 -0.226 -8.390 1.00 0.00 C ATOM 770 CG LYS A 49 -17.370 -1.347 -7.839 1.00 0.00 C ATOM 771 CD LYS A 49 -18.702 -0.820 -7.329 1.00 0.00 C ATOM 772 CE LYS A 49 -18.518 0.086 -6.123 1.00 0.00 C ATOM 773 NZ LYS A 49 -17.855 -0.620 -4.991 1.00 0.00 N ATOM 0 H LYS A 49 -14.210 -0.713 -9.823 1.00 0.00 H new ATOM 0 HA LYS A 49 -17.118 -0.812 -10.365 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -15.541 -0.238 -7.878 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -16.973 0.731 -8.163 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -17.545 -2.090 -8.618 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -16.843 -1.852 -7.029 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -19.206 -0.271 -8.124 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -19.347 -1.657 -7.062 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -17.922 0.953 -6.408 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -19.489 0.459 -5.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -17.764 0.028 -4.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -18.427 -1.443 -4.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -16.910 -0.939 -5.287 1.00 0.00 H new ATOM 787 N TYR A 50 -14.973 1.388 -11.048 1.00 0.00 N ATOM 788 CA TYR A 50 -14.735 2.699 -11.643 1.00 0.00 C ATOM 789 C TYR A 50 -13.765 2.607 -12.818 1.00 0.00 C ATOM 790 O TYR A 50 -14.117 2.937 -13.950 1.00 0.00 O ATOM 791 CB TYR A 50 -14.185 3.666 -10.593 1.00 0.00 C ATOM 792 CG TYR A 50 -14.925 3.620 -9.273 1.00 0.00 C ATOM 793 CD1 TYR A 50 -14.630 2.649 -8.324 1.00 0.00 C ATOM 794 CD2 TYR A 50 -15.914 4.549 -8.977 1.00 0.00 C ATOM 795 CE1 TYR A 50 -15.302 2.606 -7.117 1.00 0.00 C ATOM 796 CE2 TYR A 50 -16.588 4.512 -7.771 1.00 0.00 C ATOM 797 CZ TYR A 50 -16.279 3.539 -6.846 1.00 0.00 C ATOM 798 OH TYR A 50 -16.947 3.499 -5.644 1.00 0.00 O ATOM 0 H TYR A 50 -14.180 0.748 -11.102 1.00 0.00 H new ATOM 0 HA TYR A 50 -15.689 3.073 -12.015 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -13.134 3.438 -10.418 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -14.229 4.681 -10.989 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -13.864 1.917 -8.533 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -16.160 5.312 -9.700 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -15.062 1.845 -6.390 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -17.353 5.243 -7.555 1.00 0.00 H new ATOM 0 HH TYR A 50 -16.590 2.769 -5.096 1.00 0.00 H new ATOM 808 N ASN A 51 -12.543 2.163 -12.536 1.00 0.00 N ATOM 809 CA ASN A 51 -11.515 2.033 -13.563 1.00 0.00 C ATOM 810 C ASN A 51 -10.129 1.954 -12.924 1.00 0.00 C ATOM 811 O ASN A 51 -9.689 2.895 -12.264 1.00 0.00 O ATOM 812 CB ASN A 51 -11.573 3.217 -14.531 1.00 0.00 C ATOM 813 CG ASN A 51 -11.828 4.531 -13.820 1.00 0.00 C ATOM 814 OD1 ASN A 51 -10.756 5.214 -13.436 1.00 0.00 O flip ATOM 815 ND2 ASN A 51 -12.976 4.930 -13.619 1.00 0.00 N flip ATOM 0 H ASN A 51 -12.241 1.887 -11.602 1.00 0.00 H new ATOM 0 HA ASN A 51 -11.701 1.114 -14.118 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -10.634 3.280 -15.080 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -12.360 3.045 -15.265 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -13.771 4.373 -13.931 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -13.131 5.817 -13.140 1.00 0.00 H new ATOM 822 N PRO A 52 -9.421 0.825 -13.104 1.00 0.00 N ATOM 823 CA PRO A 52 -8.084 0.635 -12.532 1.00 0.00 C ATOM 824 C PRO A 52 -7.055 1.614 -13.105 1.00 0.00 C ATOM 825 O PRO A 52 -7.321 2.276 -14.108 1.00 0.00 O ATOM 826 CB PRO A 52 -7.725 -0.804 -12.912 1.00 0.00 C ATOM 827 CG PRO A 52 -8.589 -1.120 -14.081 1.00 0.00 C ATOM 828 CD PRO A 52 -9.862 -0.352 -13.872 1.00 0.00 C ATOM 0 HA PRO A 52 -8.078 0.817 -11.457 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -6.669 -0.893 -13.166 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -7.913 -1.489 -12.085 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -8.106 -0.829 -15.014 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -8.785 -2.190 -14.144 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -10.320 -0.067 -14.819 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -10.600 -0.937 -13.324 1.00 0.00 H new ATOM 836 N THR A 53 -5.874 1.708 -12.471 1.00 0.00 N ATOM 837 CA THR A 53 -5.551 0.924 -11.278 1.00 0.00 C ATOM 838 C THR A 53 -5.496 1.815 -10.045 1.00 0.00 C ATOM 839 O THR A 53 -4.737 2.784 -9.998 1.00 0.00 O ATOM 840 CB THR A 53 -4.224 0.192 -11.462 1.00 0.00 C ATOM 841 OG1 THR A 53 -3.855 -0.487 -10.276 1.00 0.00 O ATOM 842 CG2 THR A 53 -3.086 1.109 -11.840 1.00 0.00 C ATOM 0 H THR A 53 -5.123 2.328 -12.773 1.00 0.00 H new ATOM 0 HA THR A 53 -6.339 0.185 -11.133 1.00 0.00 H new ATOM 0 HB THR A 53 -4.392 -0.509 -12.279 1.00 0.00 H new ATOM 0 HG1 THR A 53 -3.334 -1.285 -10.504 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.172 0.526 -11.955 1.00 0.00 H new ATOM 0 HG22 THR A 53 -3.319 1.609 -12.780 1.00 0.00 H new ATOM 0 HG23 THR A 53 -2.944 1.855 -11.058 1.00 0.00 H new ATOM 850 N TRP A 54 -6.316 1.488 -9.054 1.00 0.00 N ATOM 851 CA TRP A 54 -6.374 2.267 -7.823 1.00 0.00 C ATOM 852 C TRP A 54 -5.384 1.758 -6.783 1.00 0.00 C ATOM 853 O TRP A 54 -5.278 0.556 -6.541 1.00 0.00 O ATOM 854 CB TRP A 54 -7.784 2.226 -7.236 1.00 0.00 C ATOM 855 CG TRP A 54 -8.836 2.744 -8.166 1.00 0.00 C ATOM 856 CD1 TRP A 54 -9.223 2.195 -9.353 1.00 0.00 C ATOM 857 CD2 TRP A 54 -9.636 3.916 -7.983 1.00 0.00 C ATOM 858 NE1 TRP A 54 -10.216 2.953 -9.921 1.00 0.00 N ATOM 859 CE2 TRP A 54 -10.488 4.016 -9.098 1.00 0.00 C ATOM 860 CE3 TRP A 54 -9.716 4.888 -6.983 1.00 0.00 C ATOM 861 CZ2 TRP A 54 -11.407 5.053 -9.242 1.00 0.00 C ATOM 862 CZ3 TRP A 54 -10.627 5.916 -7.125 1.00 0.00 C ATOM 863 CH2 TRP A 54 -11.463 5.992 -8.247 1.00 0.00 C ATOM 0 H TRP A 54 -6.950 0.689 -9.078 1.00 0.00 H new ATOM 0 HA TRP A 54 -6.107 3.293 -8.078 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -8.025 1.198 -6.964 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -7.803 2.812 -6.317 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -8.809 1.295 -9.783 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -10.677 2.758 -10.810 1.00 0.00 H new ATOM 0 HE3 TRP A 54 -9.077 4.836 -6.114 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -12.051 5.114 -10.106 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 -10.696 6.674 -6.359 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -12.166 6.808 -8.329 1.00 0.00 H new ATOM 874 N HIS A 55 -4.689 2.692 -6.143 1.00 0.00 N ATOM 875 CA HIS A 55 -3.736 2.356 -5.096 1.00 0.00 C ATOM 876 C HIS A 55 -4.375 2.640 -3.742 1.00 0.00 C ATOM 877 O HIS A 55 -4.528 3.798 -3.350 1.00 0.00 O ATOM 878 CB HIS A 55 -2.447 3.165 -5.260 1.00 0.00 C ATOM 879 CG HIS A 55 -2.000 3.289 -6.683 1.00 0.00 C ATOM 880 ND1 HIS A 55 -2.782 2.907 -7.753 1.00 0.00 N ATOM 881 CD2 HIS A 55 -0.845 3.756 -7.212 1.00 0.00 C ATOM 882 CE1 HIS A 55 -2.127 3.133 -8.878 1.00 0.00 C ATOM 883 NE2 HIS A 55 -0.950 3.649 -8.577 1.00 0.00 N ATOM 0 H HIS A 55 -4.770 3.691 -6.333 1.00 0.00 H new ATOM 0 HA HIS A 55 -3.477 1.300 -5.165 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -2.597 4.162 -4.846 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -1.655 2.694 -4.678 1.00 0.00 H new ATOM 0 HD2 HIS A 55 0.002 4.141 -6.663 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -2.492 2.930 -9.874 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -0.234 3.924 -9.250 1.00 0.00 H new ATOM 892 N CYS A 56 -4.781 1.585 -3.046 1.00 0.00 N ATOM 893 CA CYS A 56 -5.441 1.742 -1.758 1.00 0.00 C ATOM 894 C CYS A 56 -4.598 1.205 -0.612 1.00 0.00 C ATOM 895 O CYS A 56 -4.192 0.043 -0.611 1.00 0.00 O ATOM 896 CB CYS A 56 -6.799 1.037 -1.773 1.00 0.00 C ATOM 897 SG CYS A 56 -7.584 0.977 -3.401 1.00 0.00 S ATOM 0 H CYS A 56 -4.665 0.618 -3.350 1.00 0.00 H new ATOM 0 HA CYS A 56 -5.580 2.811 -1.595 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -6.671 0.019 -1.406 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -7.467 1.545 -1.078 1.00 0.00 H new ATOM 0 HG CYS A 56 -7.402 2.110 -4.013 1.00 0.00 H new ATOM 903 N ILE A 57 -4.358 2.062 0.371 1.00 0.00 N ATOM 904 CA ILE A 57 -3.583 1.684 1.543 1.00 0.00 C ATOM 905 C ILE A 57 -4.354 1.986 2.821 1.00 0.00 C ATOM 906 O ILE A 57 -4.397 3.128 3.279 1.00 0.00 O ATOM 907 CB ILE A 57 -2.229 2.403 1.585 1.00 0.00 C ATOM 908 CG1 ILE A 57 -1.448 2.085 0.307 1.00 0.00 C ATOM 909 CG2 ILE A 57 -1.453 1.987 2.832 1.00 0.00 C ATOM 910 CD1 ILE A 57 0.002 2.503 0.352 1.00 0.00 C ATOM 0 H ILE A 57 -4.690 3.026 0.379 1.00 0.00 H new ATOM 0 HA ILE A 57 -3.402 0.611 1.472 1.00 0.00 H new ATOM 0 HB ILE A 57 -2.383 3.481 1.636 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -1.500 1.013 0.119 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -1.932 2.580 -0.535 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -0.493 2.503 2.852 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -2.025 2.250 3.721 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -1.286 0.910 2.814 1.00 0.00 H new ATOM 0 HD11 ILE A 57 0.485 2.243 -0.590 1.00 0.00 H new ATOM 0 HD12 ILE A 57 0.066 3.580 0.507 1.00 0.00 H new ATOM 0 HD13 ILE A 57 0.504 1.988 1.171 1.00 0.00 H new ATOM 922 N VAL A 58 -4.969 0.953 3.384 1.00 0.00 N ATOM 923 CA VAL A 58 -5.751 1.097 4.604 1.00 0.00 C ATOM 924 C VAL A 58 -4.950 0.654 5.821 1.00 0.00 C ATOM 925 O VAL A 58 -4.471 -0.477 5.882 1.00 0.00 O ATOM 926 CB VAL A 58 -7.050 0.278 4.530 1.00 0.00 C ATOM 927 CG1 VAL A 58 -6.747 -1.157 4.141 1.00 0.00 C ATOM 928 CG2 VAL A 58 -7.798 0.336 5.852 1.00 0.00 C ATOM 0 H VAL A 58 -4.940 0.003 3.013 1.00 0.00 H new ATOM 0 HA VAL A 58 -6.001 2.153 4.703 1.00 0.00 H new ATOM 0 HB VAL A 58 -7.691 0.713 3.763 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -7.676 -1.725 4.093 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -6.260 -1.175 3.166 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -6.087 -1.604 4.885 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -8.714 -0.250 5.778 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -7.170 -0.072 6.644 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -8.048 1.371 6.084 1.00 0.00 H new ATOM 938 N GLY A 59 -4.809 1.551 6.790 1.00 0.00 N ATOM 939 CA GLY A 59 -4.067 1.230 7.990 1.00 0.00 C ATOM 940 C GLY A 59 -4.641 1.907 9.214 1.00 0.00 C ATOM 941 O GLY A 59 -5.842 2.165 9.283 1.00 0.00 O ATOM 0 H GLY A 59 -5.196 2.494 6.764 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -4.070 0.150 8.139 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -3.027 1.532 7.864 1.00 0.00 H new ATOM 945 N ARG A 60 -3.783 2.191 10.184 1.00 0.00 N ATOM 946 CA ARG A 60 -4.214 2.834 11.410 1.00 0.00 C ATOM 947 C ARG A 60 -3.046 3.521 12.105 1.00 0.00 C ATOM 948 O ARG A 60 -3.143 3.912 13.269 1.00 0.00 O ATOM 949 CB ARG A 60 -4.838 1.799 12.334 1.00 0.00 C ATOM 950 CG ARG A 60 -4.231 0.412 12.192 1.00 0.00 C ATOM 951 CD ARG A 60 -5.222 -0.671 12.588 1.00 0.00 C ATOM 952 NE ARG A 60 -5.158 -0.976 14.014 1.00 0.00 N ATOM 953 CZ ARG A 60 -4.023 -1.193 14.670 1.00 0.00 C ATOM 954 NH1 ARG A 60 -2.864 -1.147 14.028 1.00 0.00 N ATOM 955 NH2 ARG A 60 -4.045 -1.460 15.969 1.00 0.00 N ATOM 0 H ARG A 60 -2.785 1.985 10.142 1.00 0.00 H new ATOM 0 HA ARG A 60 -4.954 3.595 11.163 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -4.727 2.131 13.366 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -5.907 1.741 12.131 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -3.913 0.256 11.161 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -3.340 0.338 12.816 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -6.231 -0.350 12.331 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -5.019 -1.575 12.014 1.00 0.00 H new ATOM 0 HE ARG A 60 -6.033 -1.025 14.536 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -2.842 -0.945 13.028 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -1.994 -1.314 14.534 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -4.935 -1.499 16.467 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -3.172 -1.626 16.470 1.00 0.00 H new ATOM 969 N ASN A 61 -1.945 3.666 11.381 1.00 0.00 N ATOM 970 CA ASN A 61 -0.753 4.305 11.919 1.00 0.00 C ATOM 971 C ASN A 61 0.398 4.205 10.927 1.00 0.00 C ATOM 972 O ASN A 61 1.555 4.052 11.315 1.00 0.00 O ATOM 973 CB ASN A 61 -0.358 3.662 13.248 1.00 0.00 C ATOM 974 CG ASN A 61 0.383 4.624 14.158 1.00 0.00 C ATOM 975 OD1 ASN A 61 0.192 5.839 14.084 1.00 0.00 O ATOM 976 ND2 ASN A 61 1.235 4.085 15.021 1.00 0.00 N ATOM 0 H ASN A 61 -1.853 3.348 10.416 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.975 5.358 12.091 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -1.254 3.303 13.755 1.00 0.00 H new ATOM 0 HB3 ASN A 61 0.270 2.792 13.055 1.00 0.00 H new ATOM 0 HD21 ASN A 61 1.763 4.682 15.657 1.00 0.00 H new ATOM 0 HD22 ASN A 61 1.362 3.073 15.048 1.00 0.00 H new ATOM 983 N PHE A 62 0.067 4.285 9.643 1.00 0.00 N ATOM 984 CA PHE A 62 1.069 4.201 8.589 1.00 0.00 C ATOM 985 C PHE A 62 1.433 5.586 8.064 1.00 0.00 C ATOM 986 O PHE A 62 0.659 6.536 8.196 1.00 0.00 O ATOM 987 CB PHE A 62 0.560 3.326 7.441 1.00 0.00 C ATOM 988 CG PHE A 62 -0.535 3.968 6.637 1.00 0.00 C ATOM 989 CD1 PHE A 62 -0.271 5.063 5.830 1.00 0.00 C ATOM 990 CD2 PHE A 62 -1.829 3.473 6.689 1.00 0.00 C ATOM 991 CE1 PHE A 62 -1.277 5.653 5.088 1.00 0.00 C ATOM 992 CE2 PHE A 62 -2.839 4.059 5.950 1.00 0.00 C ATOM 993 CZ PHE A 62 -2.564 5.150 5.148 1.00 0.00 C ATOM 0 H PHE A 62 -0.888 4.408 9.308 1.00 0.00 H new ATOM 0 HA PHE A 62 1.965 3.749 9.014 1.00 0.00 H new ATOM 0 HB2 PHE A 62 1.393 3.087 6.780 1.00 0.00 H new ATOM 0 HB3 PHE A 62 0.196 2.383 7.848 1.00 0.00 H new ATOM 0 HD1 PHE A 62 0.732 5.460 5.780 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -2.050 2.620 7.314 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -1.058 6.506 4.462 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -3.843 3.664 5.999 1.00 0.00 H new ATOM 0 HZ PHE A 62 -3.352 5.609 4.569 1.00 0.00 H new ATOM 1003 N GLY A 63 2.613 5.690 7.462 1.00 0.00 N ATOM 1004 CA GLY A 63 3.066 6.953 6.914 1.00 0.00 C ATOM 1005 C GLY A 63 3.194 6.891 5.407 1.00 0.00 C ATOM 1006 O GLY A 63 4.276 6.641 4.878 1.00 0.00 O ATOM 0 H GLY A 63 3.267 4.916 7.344 1.00 0.00 H new ATOM 0 HA2 GLY A 63 2.366 7.742 7.188 1.00 0.00 H new ATOM 0 HA3 GLY A 63 4.029 7.216 7.351 1.00 0.00 H new ATOM 1010 N SER A 64 2.080 7.099 4.718 1.00 0.00 N ATOM 1011 CA SER A 64 2.062 7.045 3.263 1.00 0.00 C ATOM 1012 C SER A 64 2.589 8.335 2.643 1.00 0.00 C ATOM 1013 O SER A 64 2.265 9.434 3.091 1.00 0.00 O ATOM 1014 CB SER A 64 0.645 6.768 2.759 1.00 0.00 C ATOM 1015 OG SER A 64 -0.210 7.871 3.007 1.00 0.00 O ATOM 0 H SER A 64 1.177 7.307 5.144 1.00 0.00 H new ATOM 0 HA SER A 64 2.721 6.232 2.958 1.00 0.00 H new ATOM 0 HB2 SER A 64 0.671 6.557 1.690 1.00 0.00 H new ATOM 0 HB3 SER A 64 0.249 5.879 3.250 1.00 0.00 H new ATOM 0 HG SER A 64 -1.138 7.612 2.829 1.00 0.00 H new ATOM 1021 N TYR A 65 3.397 8.182 1.598 1.00 0.00 N ATOM 1022 CA TYR A 65 3.969 9.320 0.890 1.00 0.00 C ATOM 1023 C TYR A 65 3.997 9.049 -0.609 1.00 0.00 C ATOM 1024 O TYR A 65 5.055 9.068 -1.239 1.00 0.00 O ATOM 1025 CB TYR A 65 5.380 9.617 1.397 1.00 0.00 C ATOM 1026 CG TYR A 65 5.692 11.096 1.474 1.00 0.00 C ATOM 1027 CD1 TYR A 65 5.042 11.914 2.389 1.00 0.00 C ATOM 1028 CD2 TYR A 65 6.631 11.672 0.630 1.00 0.00 C ATOM 1029 CE1 TYR A 65 5.322 13.266 2.460 1.00 0.00 C ATOM 1030 CE2 TYR A 65 6.918 13.022 0.696 1.00 0.00 C ATOM 1031 CZ TYR A 65 6.261 13.815 1.612 1.00 0.00 C ATOM 1032 OH TYR A 65 6.542 15.160 1.681 1.00 0.00 O ATOM 0 H TYR A 65 3.671 7.274 1.222 1.00 0.00 H new ATOM 0 HA TYR A 65 3.343 10.192 1.080 1.00 0.00 H new ATOM 0 HB2 TYR A 65 5.503 9.175 2.386 1.00 0.00 H new ATOM 0 HB3 TYR A 65 6.103 9.134 0.740 1.00 0.00 H new ATOM 0 HD1 TYR A 65 4.307 11.487 3.055 1.00 0.00 H new ATOM 0 HD2 TYR A 65 7.146 11.054 -0.091 1.00 0.00 H new ATOM 0 HE1 TYR A 65 4.808 13.890 3.176 1.00 0.00 H new ATOM 0 HE2 TYR A 65 7.653 13.454 0.033 1.00 0.00 H new ATOM 0 HH TYR A 65 7.226 15.386 1.017 1.00 0.00 H new ATOM 1042 N VAL A 66 2.821 8.787 -1.168 1.00 0.00 N ATOM 1043 CA VAL A 66 2.690 8.502 -2.590 1.00 0.00 C ATOM 1044 C VAL A 66 2.100 9.694 -3.335 1.00 0.00 C ATOM 1045 O VAL A 66 1.072 10.240 -2.937 1.00 0.00 O ATOM 1046 CB VAL A 66 1.794 7.275 -2.830 1.00 0.00 C ATOM 1047 CG1 VAL A 66 2.450 6.015 -2.286 1.00 0.00 C ATOM 1048 CG2 VAL A 66 0.427 7.487 -2.199 1.00 0.00 C ATOM 0 H VAL A 66 1.940 8.766 -0.654 1.00 0.00 H new ATOM 0 HA VAL A 66 3.692 8.297 -2.968 1.00 0.00 H new ATOM 0 HB VAL A 66 1.661 7.149 -3.905 1.00 0.00 H new ATOM 0 HG11 VAL A 66 1.799 5.159 -2.466 1.00 0.00 H new ATOM 0 HG12 VAL A 66 3.405 5.857 -2.787 1.00 0.00 H new ATOM 0 HG13 VAL A 66 2.616 6.125 -1.214 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.196 6.610 -2.377 1.00 0.00 H new ATOM 0 HG22 VAL A 66 0.541 7.639 -1.126 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -0.046 8.364 -2.641 1.00 0.00 H new ATOM 1058 N THR A 67 2.758 10.093 -4.418 1.00 0.00 N ATOM 1059 CA THR A 67 2.295 11.222 -5.216 1.00 0.00 C ATOM 1060 C THR A 67 1.192 10.793 -6.177 1.00 0.00 C ATOM 1061 O THR A 67 1.376 9.884 -6.987 1.00 0.00 O ATOM 1062 CB THR A 67 3.460 11.831 -6.000 1.00 0.00 C ATOM 1063 OG1 THR A 67 4.295 12.590 -5.143 1.00 0.00 O ATOM 1064 CG2 THR A 67 3.015 12.738 -7.126 1.00 0.00 C ATOM 0 H THR A 67 3.611 9.653 -4.763 1.00 0.00 H new ATOM 0 HA THR A 67 1.890 11.972 -4.537 1.00 0.00 H new ATOM 0 HB THR A 67 3.995 10.984 -6.428 1.00 0.00 H new ATOM 0 HG1 THR A 67 5.035 12.970 -5.660 1.00 0.00 H new ATOM 0 HG21 THR A 67 3.890 13.136 -7.640 1.00 0.00 H new ATOM 0 HG22 THR A 67 2.406 12.171 -7.831 1.00 0.00 H new ATOM 0 HG23 THR A 67 2.428 13.561 -6.720 1.00 0.00 H new ATOM 1072 N HIS A 68 0.045 11.458 -6.084 1.00 0.00 N ATOM 1073 CA HIS A 68 -1.088 11.151 -6.948 1.00 0.00 C ATOM 1074 C HIS A 68 -0.818 11.619 -8.374 1.00 0.00 C ATOM 1075 O HIS A 68 0.184 12.286 -8.638 1.00 0.00 O ATOM 1076 CB HIS A 68 -2.358 11.814 -6.413 1.00 0.00 C ATOM 1077 CG HIS A 68 -2.230 13.294 -6.230 1.00 0.00 C ATOM 1078 ND1 HIS A 68 -1.019 13.930 -6.058 1.00 0.00 N ATOM 1079 CD2 HIS A 68 -3.171 14.268 -6.200 1.00 0.00 C ATOM 1080 CE1 HIS A 68 -1.220 15.229 -5.927 1.00 0.00 C ATOM 1081 NE2 HIS A 68 -2.517 15.460 -6.009 1.00 0.00 N ATOM 0 H HIS A 68 -0.124 12.213 -5.419 1.00 0.00 H new ATOM 0 HA HIS A 68 -1.229 10.070 -6.957 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -3.180 11.611 -7.099 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -2.620 11.360 -5.458 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -4.237 14.132 -6.306 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -0.453 15.975 -5.778 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -2.961 16.376 -5.941 1.00 0.00 H new ATOM 1090 N GLU A 69 -1.713 11.268 -9.290 1.00 0.00 N ATOM 1091 CA GLU A 69 -1.566 11.655 -10.687 1.00 0.00 C ATOM 1092 C GLU A 69 -2.834 11.351 -11.476 1.00 0.00 C ATOM 1093 O GLU A 69 -2.881 10.394 -12.250 1.00 0.00 O ATOM 1094 CB GLU A 69 -0.374 10.929 -11.318 1.00 0.00 C ATOM 1095 CG GLU A 69 -0.334 9.441 -11.008 1.00 0.00 C ATOM 1096 CD GLU A 69 0.617 8.684 -11.915 1.00 0.00 C ATOM 1097 OE1 GLU A 69 1.148 9.299 -12.865 1.00 0.00 O ATOM 1098 OE2 GLU A 69 0.832 7.477 -11.675 1.00 0.00 O ATOM 0 H GLU A 69 -2.547 10.716 -9.090 1.00 0.00 H new ATOM 0 HA GLU A 69 -1.389 12.730 -10.720 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -0.407 11.066 -12.399 1.00 0.00 H new ATOM 0 HB3 GLU A 69 0.549 11.390 -10.966 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -0.033 9.297 -9.970 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -1.336 9.025 -11.110 1.00 0.00 H new ATOM 1105 N THR A 70 -3.862 12.171 -11.280 1.00 0.00 N ATOM 1106 CA THR A 70 -5.129 11.985 -11.980 1.00 0.00 C ATOM 1107 C THR A 70 -6.239 12.813 -11.336 1.00 0.00 C ATOM 1108 O THR A 70 -6.300 14.029 -11.511 1.00 0.00 O ATOM 1109 CB THR A 70 -5.519 10.506 -11.988 1.00 0.00 C ATOM 1110 OG1 THR A 70 -6.864 10.345 -12.401 1.00 0.00 O ATOM 1111 CG2 THR A 70 -5.370 9.838 -10.639 1.00 0.00 C ATOM 0 H THR A 70 -3.843 12.968 -10.644 1.00 0.00 H new ATOM 0 HA THR A 70 -4.999 12.326 -13.007 1.00 0.00 H new ATOM 0 HB THR A 70 -4.831 10.031 -12.687 1.00 0.00 H new ATOM 0 HG1 THR A 70 -7.094 9.392 -12.401 1.00 0.00 H new ATOM 0 HG21 THR A 70 -5.663 8.791 -10.717 1.00 0.00 H new ATOM 0 HG22 THR A 70 -4.331 9.900 -10.315 1.00 0.00 H new ATOM 0 HG23 THR A 70 -6.008 10.340 -9.912 1.00 0.00 H new ATOM 1119 N LYS A 71 -7.117 12.143 -10.595 1.00 0.00 N ATOM 1120 CA LYS A 71 -8.228 12.815 -9.930 1.00 0.00 C ATOM 1121 C LYS A 71 -8.958 11.858 -8.994 1.00 0.00 C ATOM 1122 O LYS A 71 -10.100 12.103 -8.605 1.00 0.00 O ATOM 1123 CB LYS A 71 -9.202 13.382 -10.964 1.00 0.00 C ATOM 1124 CG LYS A 71 -8.901 14.818 -11.361 1.00 0.00 C ATOM 1125 CD LYS A 71 -9.780 15.271 -12.515 1.00 0.00 C ATOM 1126 CE LYS A 71 -9.075 15.105 -13.850 1.00 0.00 C ATOM 1127 NZ LYS A 71 -9.586 16.059 -14.873 1.00 0.00 N ATOM 0 H LYS A 71 -7.080 11.135 -10.440 1.00 0.00 H new ATOM 0 HA LYS A 71 -7.823 13.636 -9.338 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -9.178 12.755 -11.855 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -10.215 13.329 -10.564 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -9.056 15.474 -10.504 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -7.852 14.906 -11.644 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -10.705 14.695 -12.517 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -10.056 16.316 -12.375 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -8.004 15.257 -13.716 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -9.210 14.084 -14.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -9.078 15.912 -15.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -10.603 15.898 -15.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -9.434 17.034 -14.545 1.00 0.00 H new ATOM 1141 N HIS A 72 -8.289 10.767 -8.638 1.00 0.00 N ATOM 1142 CA HIS A 72 -8.870 9.770 -7.747 1.00 0.00 C ATOM 1143 C HIS A 72 -7.902 9.425 -6.619 1.00 0.00 C ATOM 1144 O HIS A 72 -7.387 8.310 -6.549 1.00 0.00 O ATOM 1145 CB HIS A 72 -9.230 8.506 -8.531 1.00 0.00 C ATOM 1146 CG HIS A 72 -10.196 8.751 -9.648 1.00 0.00 C ATOM 1147 ND1 HIS A 72 -11.383 9.432 -9.480 1.00 0.00 N ATOM 1148 CD2 HIS A 72 -10.145 8.405 -10.957 1.00 0.00 C ATOM 1149 CE1 HIS A 72 -12.021 9.494 -10.636 1.00 0.00 C ATOM 1150 NE2 HIS A 72 -11.291 8.879 -11.548 1.00 0.00 N ATOM 0 H HIS A 72 -7.343 10.551 -8.953 1.00 0.00 H new ATOM 0 HA HIS A 72 -9.777 10.189 -7.310 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -8.318 8.069 -8.939 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -9.657 7.773 -7.847 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -9.351 7.858 -11.445 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -12.977 9.967 -10.806 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -11.538 8.773 -12.532 1.00 0.00 H new ATOM 1159 N PHE A 73 -7.659 10.393 -5.739 1.00 0.00 N ATOM 1160 CA PHE A 73 -6.753 10.194 -4.614 1.00 0.00 C ATOM 1161 C PHE A 73 -7.381 10.707 -3.322 1.00 0.00 C ATOM 1162 O PHE A 73 -7.271 11.888 -2.995 1.00 0.00 O ATOM 1163 CB PHE A 73 -5.422 10.905 -4.876 1.00 0.00 C ATOM 1164 CG PHE A 73 -4.621 11.180 -3.634 1.00 0.00 C ATOM 1165 CD1 PHE A 73 -4.488 10.214 -2.649 1.00 0.00 C ATOM 1166 CD2 PHE A 73 -4.002 12.406 -3.455 1.00 0.00 C ATOM 1167 CE1 PHE A 73 -3.750 10.469 -1.507 1.00 0.00 C ATOM 1168 CE2 PHE A 73 -3.263 12.666 -2.316 1.00 0.00 C ATOM 1169 CZ PHE A 73 -3.137 11.695 -1.341 1.00 0.00 C ATOM 0 H PHE A 73 -8.077 11.322 -5.784 1.00 0.00 H new ATOM 0 HA PHE A 73 -6.566 9.126 -4.505 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -4.824 10.296 -5.554 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -5.620 11.848 -5.385 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -4.965 9.253 -2.774 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -4.098 13.168 -4.214 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -3.653 9.709 -0.745 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -2.785 13.626 -2.188 1.00 0.00 H new ATOM 0 HZ PHE A 73 -2.560 11.895 -0.450 1.00 0.00 H new ATOM 1179 N ILE A 74 -8.041 9.812 -2.595 1.00 0.00 N ATOM 1180 CA ILE A 74 -8.688 10.179 -1.344 1.00 0.00 C ATOM 1181 C ILE A 74 -7.949 9.594 -0.145 1.00 0.00 C ATOM 1182 O ILE A 74 -7.771 8.381 -0.045 1.00 0.00 O ATOM 1183 CB ILE A 74 -10.158 9.713 -1.311 1.00 0.00 C ATOM 1184 CG1 ILE A 74 -10.932 10.509 -0.254 1.00 0.00 C ATOM 1185 CG2 ILE A 74 -10.237 8.214 -1.044 1.00 0.00 C ATOM 1186 CD1 ILE A 74 -12.305 9.954 0.061 1.00 0.00 C ATOM 0 H ILE A 74 -8.141 8.830 -2.851 1.00 0.00 H new ATOM 0 HA ILE A 74 -8.660 11.267 -1.284 1.00 0.00 H new ATOM 0 HB ILE A 74 -10.615 9.899 -2.283 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -10.345 10.538 0.664 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -11.039 11.538 -0.597 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -11.281 7.903 -1.024 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -9.713 7.676 -1.834 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -9.773 7.991 -0.083 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -12.784 10.576 0.817 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -12.913 9.951 -0.844 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -12.208 8.935 0.437 1.00 0.00 H new ATOM 1198 N TYR A 75 -7.526 10.464 0.763 1.00 0.00 N ATOM 1199 CA TYR A 75 -6.812 10.036 1.959 1.00 0.00 C ATOM 1200 C TYR A 75 -7.620 10.367 3.209 1.00 0.00 C ATOM 1201 O TYR A 75 -7.465 11.438 3.794 1.00 0.00 O ATOM 1202 CB TYR A 75 -5.440 10.709 2.023 1.00 0.00 C ATOM 1203 CG TYR A 75 -4.489 10.062 3.003 1.00 0.00 C ATOM 1204 CD1 TYR A 75 -3.816 8.890 2.677 1.00 0.00 C ATOM 1205 CD2 TYR A 75 -4.259 10.624 4.252 1.00 0.00 C ATOM 1206 CE1 TYR A 75 -2.943 8.297 3.570 1.00 0.00 C ATOM 1207 CE2 TYR A 75 -3.387 10.038 5.149 1.00 0.00 C ATOM 1208 CZ TYR A 75 -2.732 8.874 4.805 1.00 0.00 C ATOM 1209 OH TYR A 75 -1.863 8.287 5.696 1.00 0.00 O ATOM 0 H TYR A 75 -7.665 11.472 0.694 1.00 0.00 H new ATOM 0 HA TYR A 75 -6.672 8.956 1.913 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -4.991 10.692 1.030 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -5.572 11.756 2.296 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -3.978 8.436 1.711 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -4.771 11.535 4.527 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -2.429 7.386 3.302 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -3.219 10.489 6.116 1.00 0.00 H new ATOM 0 HH TYR A 75 -2.049 7.326 5.750 1.00 0.00 H new ATOM 1219 N PHE A 76 -8.489 9.442 3.613 1.00 0.00 N ATOM 1220 CA PHE A 76 -9.327 9.650 4.790 1.00 0.00 C ATOM 1221 C PHE A 76 -8.958 8.686 5.914 1.00 0.00 C ATOM 1222 O PHE A 76 -8.200 7.738 5.711 1.00 0.00 O ATOM 1223 CB PHE A 76 -10.807 9.490 4.429 1.00 0.00 C ATOM 1224 CG PHE A 76 -11.109 8.250 3.635 1.00 0.00 C ATOM 1225 CD1 PHE A 76 -10.682 8.130 2.322 1.00 0.00 C ATOM 1226 CD2 PHE A 76 -11.821 7.205 4.202 1.00 0.00 C ATOM 1227 CE1 PHE A 76 -10.958 6.991 1.591 1.00 0.00 C ATOM 1228 CE2 PHE A 76 -12.100 6.064 3.475 1.00 0.00 C ATOM 1229 CZ PHE A 76 -11.668 5.956 2.168 1.00 0.00 C ATOM 0 H PHE A 76 -8.630 8.547 3.145 1.00 0.00 H new ATOM 0 HA PHE A 76 -9.153 10.666 5.143 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -11.395 9.474 5.347 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -11.128 10.362 3.859 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -10.127 8.936 1.865 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -12.162 7.284 5.224 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -10.619 6.910 0.569 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -12.656 5.257 3.929 1.00 0.00 H new ATOM 0 HZ PHE A 76 -11.885 5.065 1.598 1.00 0.00 H new ATOM 1239 N TYR A 77 -9.500 8.943 7.101 1.00 0.00 N ATOM 1240 CA TYR A 77 -9.234 8.106 8.265 1.00 0.00 C ATOM 1241 C TYR A 77 -10.537 7.705 8.951 1.00 0.00 C ATOM 1242 O TYR A 77 -11.123 8.489 9.697 1.00 0.00 O ATOM 1243 CB TYR A 77 -8.328 8.847 9.250 1.00 0.00 C ATOM 1244 CG TYR A 77 -8.286 8.226 10.630 1.00 0.00 C ATOM 1245 CD1 TYR A 77 -9.268 8.512 11.570 1.00 0.00 C ATOM 1246 CD2 TYR A 77 -7.264 7.357 10.991 1.00 0.00 C ATOM 1247 CE1 TYR A 77 -9.231 7.950 12.832 1.00 0.00 C ATOM 1248 CE2 TYR A 77 -7.223 6.791 12.251 1.00 0.00 C ATOM 1249 CZ TYR A 77 -8.207 7.091 13.167 1.00 0.00 C ATOM 1250 OH TYR A 77 -8.169 6.529 14.423 1.00 0.00 O ATOM 0 H TYR A 77 -10.128 9.727 7.281 1.00 0.00 H new ATOM 0 HA TYR A 77 -8.729 7.200 7.929 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -7.316 8.878 8.845 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -8.669 9.879 9.337 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -10.073 9.184 11.311 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -6.490 7.120 10.276 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -10.001 8.183 13.552 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -6.423 6.116 12.516 1.00 0.00 H new ATOM 0 HH TYR A 77 -9.039 6.644 14.859 1.00 0.00 H new ATOM 1260 N LEU A 78 -10.984 6.482 8.688 1.00 0.00 N ATOM 1261 CA LEU A 78 -12.222 5.977 9.277 1.00 0.00 C ATOM 1262 C LEU A 78 -12.198 6.105 10.796 1.00 0.00 C ATOM 1263 O LEU A 78 -11.174 6.450 11.386 1.00 0.00 O ATOM 1264 CB LEU A 78 -12.442 4.516 8.876 1.00 0.00 C ATOM 1265 CG LEU A 78 -12.893 4.289 7.427 1.00 0.00 C ATOM 1266 CD1 LEU A 78 -14.391 4.512 7.293 1.00 0.00 C ATOM 1267 CD2 LEU A 78 -12.130 5.196 6.469 1.00 0.00 C ATOM 0 H LEU A 78 -10.510 5.822 8.072 1.00 0.00 H new ATOM 0 HA LEU A 78 -13.047 6.579 8.897 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -11.513 3.969 9.039 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -13.188 4.083 9.542 1.00 0.00 H new ATOM 0 HG LEU A 78 -12.671 3.255 7.163 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -14.692 4.347 6.259 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.922 3.815 7.942 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -14.634 5.534 7.583 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -12.469 5.015 5.449 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -12.312 6.238 6.732 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -11.063 4.985 6.540 1.00 0.00 H new ATOM 1279 N GLY A 79 -13.337 5.826 11.422 1.00 0.00 N ATOM 1280 CA GLY A 79 -13.431 5.916 12.868 1.00 0.00 C ATOM 1281 C GLY A 79 -12.157 5.481 13.565 1.00 0.00 C ATOM 1282 O GLY A 79 -11.775 6.053 14.586 1.00 0.00 O ATOM 0 H GLY A 79 -14.197 5.539 10.954 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -13.662 6.943 13.150 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -14.259 5.297 13.213 1.00 0.00 H new ATOM 1286 N GLN A 80 -11.498 4.466 13.015 1.00 0.00 N ATOM 1287 CA GLN A 80 -10.262 3.955 13.595 1.00 0.00 C ATOM 1288 C GLN A 80 -9.366 3.349 12.520 1.00 0.00 C ATOM 1289 O GLN A 80 -8.756 2.299 12.724 1.00 0.00 O ATOM 1290 CB GLN A 80 -10.571 2.909 14.667 1.00 0.00 C ATOM 1291 CG GLN A 80 -9.376 2.556 15.537 1.00 0.00 C ATOM 1292 CD GLN A 80 -9.079 3.618 16.578 1.00 0.00 C ATOM 1293 OE1 GLN A 80 -9.312 4.806 16.355 1.00 0.00 O ATOM 1294 NE2 GLN A 80 -8.564 3.193 17.725 1.00 0.00 N ATOM 0 H GLN A 80 -11.799 3.982 12.169 1.00 0.00 H new ATOM 0 HA GLN A 80 -9.733 4.790 14.054 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -11.375 3.279 15.303 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -10.938 2.003 14.184 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -9.563 1.605 16.036 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -8.499 2.417 14.905 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -8.387 2.199 17.867 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -8.345 3.861 18.464 1.00 0.00 H new ATOM 1303 N VAL A 81 -9.293 4.015 11.374 1.00 0.00 N ATOM 1304 CA VAL A 81 -8.476 3.542 10.264 1.00 0.00 C ATOM 1305 C VAL A 81 -8.138 4.683 9.308 1.00 0.00 C ATOM 1306 O VAL A 81 -8.737 5.758 9.373 1.00 0.00 O ATOM 1307 CB VAL A 81 -9.192 2.414 9.492 1.00 0.00 C ATOM 1308 CG1 VAL A 81 -8.503 2.134 8.164 1.00 0.00 C ATOM 1309 CG2 VAL A 81 -9.257 1.153 10.339 1.00 0.00 C ATOM 0 H VAL A 81 -9.791 4.886 11.189 1.00 0.00 H new ATOM 0 HA VAL A 81 -7.550 3.149 10.684 1.00 0.00 H new ATOM 0 HB VAL A 81 -10.209 2.742 9.277 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -9.030 1.335 7.642 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -8.513 3.036 7.552 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -7.472 1.831 8.346 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -9.765 0.366 9.781 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -8.246 0.828 10.586 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -9.807 1.359 11.257 1.00 0.00 H new ATOM 1319 N ALA A 82 -7.181 4.441 8.419 1.00 0.00 N ATOM 1320 CA ALA A 82 -6.763 5.442 7.447 1.00 0.00 C ATOM 1321 C ALA A 82 -6.641 4.822 6.062 1.00 0.00 C ATOM 1322 O ALA A 82 -5.748 4.015 5.809 1.00 0.00 O ATOM 1323 CB ALA A 82 -5.442 6.071 7.867 1.00 0.00 C ATOM 0 H ALA A 82 -6.679 3.556 8.352 1.00 0.00 H new ATOM 0 HA ALA A 82 -7.522 6.224 7.409 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -5.144 6.817 7.130 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -5.559 6.549 8.840 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -4.676 5.299 7.932 1.00 0.00 H new ATOM 1329 N ILE A 83 -7.552 5.194 5.170 1.00 0.00 N ATOM 1330 CA ILE A 83 -7.551 4.659 3.815 1.00 0.00 C ATOM 1331 C ILE A 83 -6.912 5.631 2.828 1.00 0.00 C ATOM 1332 O ILE A 83 -7.400 6.746 2.627 1.00 0.00 O ATOM 1333 CB ILE A 83 -8.980 4.322 3.340 1.00 0.00 C ATOM 1334 CG1 ILE A 83 -9.927 4.177 4.537 1.00 0.00 C ATOM 1335 CG2 ILE A 83 -8.968 3.047 2.510 1.00 0.00 C ATOM 1336 CD1 ILE A 83 -9.680 2.931 5.362 1.00 0.00 C ATOM 0 H ILE A 83 -8.299 5.862 5.361 1.00 0.00 H new ATOM 0 HA ILE A 83 -6.960 3.744 3.844 1.00 0.00 H new ATOM 0 HB ILE A 83 -9.342 5.140 2.718 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -9.825 5.053 5.178 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -10.955 4.165 4.176 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -9.981 2.818 2.180 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -8.325 3.185 1.640 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -8.589 2.223 3.114 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -10.388 2.897 6.190 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -9.811 2.048 4.736 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -8.663 2.950 5.754 1.00 0.00 H new ATOM 1348 N LEU A 84 -5.819 5.190 2.210 1.00 0.00 N ATOM 1349 CA LEU A 84 -5.101 6.000 1.232 1.00 0.00 C ATOM 1350 C LEU A 84 -5.426 5.526 -0.182 1.00 0.00 C ATOM 1351 O LEU A 84 -4.763 4.638 -0.718 1.00 0.00 O ATOM 1352 CB LEU A 84 -3.592 5.917 1.485 1.00 0.00 C ATOM 1353 CG LEU A 84 -2.708 6.179 0.264 1.00 0.00 C ATOM 1354 CD1 LEU A 84 -2.465 7.671 0.093 1.00 0.00 C ATOM 1355 CD2 LEU A 84 -1.388 5.432 0.391 1.00 0.00 C ATOM 0 H LEU A 84 -5.410 4.270 2.371 1.00 0.00 H new ATOM 0 HA LEU A 84 -5.417 7.038 1.335 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -3.331 6.635 2.263 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.360 4.926 1.875 1.00 0.00 H new ATOM 0 HG LEU A 84 -3.226 5.812 -0.622 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.834 7.839 -0.780 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.418 8.182 -0.044 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.968 8.063 0.980 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.772 5.630 -0.486 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.864 5.768 1.286 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -1.581 4.362 0.465 1.00 0.00 H new ATOM 1367 N LEU A 85 -6.460 6.115 -0.773 1.00 0.00 N ATOM 1368 CA LEU A 85 -6.888 5.744 -2.117 1.00 0.00 C ATOM 1369 C LEU A 85 -6.360 6.722 -3.161 1.00 0.00 C ATOM 1370 O LEU A 85 -6.593 7.927 -3.074 1.00 0.00 O ATOM 1371 CB LEU A 85 -8.415 5.694 -2.184 1.00 0.00 C ATOM 1372 CG LEU A 85 -9.010 4.335 -2.555 1.00 0.00 C ATOM 1373 CD1 LEU A 85 -8.900 3.368 -1.386 1.00 0.00 C ATOM 1374 CD2 LEU A 85 -10.461 4.491 -2.984 1.00 0.00 C ATOM 0 H LEU A 85 -7.018 6.852 -0.342 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.478 4.758 -2.337 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -8.815 5.995 -1.215 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.754 6.431 -2.912 1.00 0.00 H new ATOM 0 HG LEU A 85 -8.444 3.927 -3.392 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -9.328 2.406 -1.668 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -7.851 3.235 -1.122 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -9.442 3.769 -0.530 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -10.870 3.515 -3.245 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -11.039 4.919 -2.165 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -10.515 5.150 -3.850 1.00 0.00 H new ATOM 1386 N PHE A 86 -5.656 6.192 -4.156 1.00 0.00 N ATOM 1387 CA PHE A 86 -5.106 7.019 -5.228 1.00 0.00 C ATOM 1388 C PHE A 86 -4.590 6.159 -6.380 1.00 0.00 C ATOM 1389 O PHE A 86 -3.872 5.182 -6.167 1.00 0.00 O ATOM 1390 CB PHE A 86 -3.989 7.921 -4.692 1.00 0.00 C ATOM 1391 CG PHE A 86 -2.628 7.284 -4.712 1.00 0.00 C ATOM 1392 CD1 PHE A 86 -2.371 6.148 -3.961 1.00 0.00 C ATOM 1393 CD2 PHE A 86 -1.609 7.818 -5.485 1.00 0.00 C ATOM 1394 CE1 PHE A 86 -1.123 5.558 -3.979 1.00 0.00 C ATOM 1395 CE2 PHE A 86 -0.359 7.231 -5.507 1.00 0.00 C ATOM 1396 CZ PHE A 86 -0.115 6.099 -4.754 1.00 0.00 C ATOM 0 H PHE A 86 -5.452 5.196 -4.244 1.00 0.00 H new ATOM 0 HA PHE A 86 -5.910 7.648 -5.611 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -3.959 8.836 -5.283 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -4.229 8.210 -3.669 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -3.156 5.720 -3.355 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -1.794 8.702 -6.076 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -0.935 4.674 -3.388 1.00 0.00 H new ATOM 0 HE2 PHE A 86 0.427 7.657 -6.113 1.00 0.00 H new ATOM 0 HZ PHE A 86 0.861 5.638 -4.771 1.00 0.00 H new ATOM 1406 N LYS A 87 -4.961 6.531 -7.602 1.00 0.00 N ATOM 1407 CA LYS A 87 -4.537 5.799 -8.792 1.00 0.00 C ATOM 1408 C LYS A 87 -3.262 6.402 -9.375 1.00 0.00 C ATOM 1409 O LYS A 87 -2.846 7.493 -8.985 1.00 0.00 O ATOM 1410 CB LYS A 87 -5.648 5.812 -9.844 1.00 0.00 C ATOM 1411 CG LYS A 87 -7.024 5.497 -9.279 1.00 0.00 C ATOM 1412 CD LYS A 87 -8.130 6.009 -10.188 1.00 0.00 C ATOM 1413 CE LYS A 87 -8.029 5.409 -11.581 1.00 0.00 C ATOM 1414 NZ LYS A 87 -7.775 6.449 -12.616 1.00 0.00 N ATOM 0 H LYS A 87 -5.556 7.337 -7.794 1.00 0.00 H new ATOM 0 HA LYS A 87 -4.331 4.769 -8.502 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -5.675 6.792 -10.320 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -5.409 5.087 -10.622 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -7.127 4.420 -9.150 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -7.125 5.948 -8.292 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -9.100 5.765 -9.755 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -8.074 7.096 -10.254 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -7.226 4.672 -11.602 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -8.953 4.880 -11.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -7.201 6.043 -13.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -8.681 6.784 -13.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -7.265 7.248 -12.188 1.00 0.00 H new ATOM 1428 N SER A 88 -2.644 5.685 -10.309 1.00 0.00 N ATOM 1429 CA SER A 88 -1.415 6.153 -10.942 1.00 0.00 C ATOM 1430 C SER A 88 -1.689 6.652 -12.350 1.00 0.00 C ATOM 1431 O SER A 88 -0.783 6.751 -13.179 1.00 0.00 O ATOM 1432 CB SER A 88 -0.381 5.033 -10.983 1.00 0.00 C ATOM 1433 OG SER A 88 0.740 5.337 -10.171 1.00 0.00 O ATOM 0 H SER A 88 -2.973 4.780 -10.644 1.00 0.00 H new ATOM 0 HA SER A 88 -1.023 6.980 -10.350 1.00 0.00 H new ATOM 0 HB2 SER A 88 -0.836 4.102 -10.644 1.00 0.00 H new ATOM 0 HB3 SER A 88 -0.056 4.873 -12.011 1.00 0.00 H new ATOM 0 HG SER A 88 1.235 6.086 -10.564 1.00 0.00 H new ATOM 1490 N ARG B 4 21.496 -3.619 6.915 1.00 0.00 N ATOM 1491 CA ARG B 4 20.433 -3.221 5.999 1.00 0.00 C ATOM 1492 C ARG B 4 19.147 -2.933 6.766 1.00 0.00 C ATOM 1493 O ARG B 4 18.322 -2.128 6.334 1.00 0.00 O ATOM 1494 CB ARG B 4 20.187 -4.314 4.957 1.00 0.00 C ATOM 1495 CG ARG B 4 21.437 -5.096 4.589 1.00 0.00 C ATOM 1496 CD ARG B 4 22.249 -4.378 3.524 1.00 0.00 C ATOM 1497 NE ARG B 4 22.625 -5.268 2.428 1.00 0.00 N ATOM 1498 CZ ARG B 4 23.495 -4.941 1.479 1.00 0.00 C ATOM 1499 NH1 ARG B 4 24.078 -3.749 1.492 1.00 0.00 N ATOM 1500 NH2 ARG B 4 23.782 -5.804 0.514 1.00 0.00 N ATOM 0 HA ARG B 4 20.747 -2.312 5.486 1.00 0.00 H new ATOM 0 HB2 ARG B 4 19.435 -5.005 5.338 1.00 0.00 H new ATOM 0 HB3 ARG B 4 19.775 -3.859 4.056 1.00 0.00 H new ATOM 0 HG2 ARG B 4 22.050 -5.243 5.478 1.00 0.00 H new ATOM 0 HG3 ARG B 4 21.156 -6.085 4.228 1.00 0.00 H new ATOM 0 HD2 ARG B 4 21.671 -3.542 3.130 1.00 0.00 H new ATOM 0 HD3 ARG B 4 23.148 -3.959 3.975 1.00 0.00 H new ATOM 0 HE ARG B 4 22.195 -6.192 2.389 1.00 0.00 H new ATOM 0 HH11 ARG B 4 23.858 -3.082 2.232 1.00 0.00 H new ATOM 0 HH12 ARG B 4 24.746 -3.500 0.762 1.00 0.00 H new ATOM 0 HH21 ARG B 4 23.334 -6.720 0.500 1.00 0.00 H new ATOM 0 HH22 ARG B 4 24.450 -5.551 -0.214 1.00 0.00 H new ATOM 1514 N LYS B 5 18.988 -3.594 7.908 1.00 0.00 N ATOM 1515 CA LYS B 5 17.806 -3.412 8.743 1.00 0.00 C ATOM 1516 C LYS B 5 16.529 -3.720 7.971 1.00 0.00 C ATOM 1517 O LYS B 5 16.571 -4.274 6.873 1.00 0.00 O ATOM 1518 CB LYS B 5 17.754 -1.982 9.279 1.00 0.00 C ATOM 1519 CG LYS B 5 18.205 -1.860 10.724 1.00 0.00 C ATOM 1520 CD LYS B 5 17.147 -1.185 11.581 1.00 0.00 C ATOM 1521 CE LYS B 5 15.938 -2.085 11.783 1.00 0.00 C ATOM 1522 NZ LYS B 5 16.290 -3.334 12.511 1.00 0.00 N ATOM 0 H LYS B 5 19.665 -4.262 8.277 1.00 0.00 H new ATOM 0 HA LYS B 5 17.877 -4.110 9.577 1.00 0.00 H new ATOM 0 HB2 LYS B 5 18.382 -1.346 8.656 1.00 0.00 H new ATOM 0 HB3 LYS B 5 16.734 -1.607 9.192 1.00 0.00 H new ATOM 0 HG2 LYS B 5 18.421 -2.851 11.124 1.00 0.00 H new ATOM 0 HG3 LYS B 5 19.132 -1.288 10.770 1.00 0.00 H new ATOM 0 HD2 LYS B 5 17.574 -0.924 12.549 1.00 0.00 H new ATOM 0 HD3 LYS B 5 16.834 -0.254 11.109 1.00 0.00 H new ATOM 0 HE2 LYS B 5 15.172 -1.544 12.339 1.00 0.00 H new ATOM 0 HE3 LYS B 5 15.509 -2.339 10.814 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 15.426 -3.768 12.894 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 16.750 -3.999 11.857 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 16.940 -3.110 13.291 1.00 0.00 H new ATOM 1536 N ALA B 6 15.394 -3.351 8.557 1.00 0.00 N ATOM 1537 CA ALA B 6 14.098 -3.579 7.933 1.00 0.00 C ATOM 1538 C ALA B 6 13.871 -5.054 7.642 1.00 0.00 C ATOM 1539 O ALA B 6 14.710 -5.899 7.951 1.00 0.00 O ATOM 1540 CB ALA B 6 13.978 -2.769 6.653 1.00 0.00 C ATOM 0 H ALA B 6 15.347 -2.891 9.466 1.00 0.00 H new ATOM 0 HA ALA B 6 13.330 -3.254 8.635 1.00 0.00 H new ATOM 0 HB1 ALA B 6 13.004 -2.950 6.198 1.00 0.00 H new ATOM 0 HB2 ALA B 6 14.080 -1.708 6.883 1.00 0.00 H new ATOM 0 HB3 ALA B 6 14.764 -3.067 5.959 1.00 0.00 H new ATOM 1546 N VAL B 7 12.726 -5.352 7.040 1.00 0.00 N ATOM 1547 CA VAL B 7 12.375 -6.720 6.698 1.00 0.00 C ATOM 1548 C VAL B 7 11.537 -6.761 5.428 1.00 0.00 C ATOM 1549 O VAL B 7 10.325 -6.970 5.482 1.00 0.00 O ATOM 1550 CB VAL B 7 11.593 -7.404 7.835 1.00 0.00 C ATOM 1551 CG1 VAL B 7 11.120 -8.784 7.406 1.00 0.00 C ATOM 1552 CG2 VAL B 7 12.445 -7.489 9.091 1.00 0.00 C ATOM 0 H VAL B 7 12.024 -4.660 6.779 1.00 0.00 H new ATOM 0 HA VAL B 7 13.309 -7.258 6.539 1.00 0.00 H new ATOM 0 HB VAL B 7 10.714 -6.801 8.060 1.00 0.00 H new ATOM 0 HG11 VAL B 7 10.570 -9.250 8.223 1.00 0.00 H new ATOM 0 HG12 VAL B 7 10.469 -8.692 6.537 1.00 0.00 H new ATOM 0 HG13 VAL B 7 11.982 -9.401 7.150 1.00 0.00 H new ATOM 0 HG21 VAL B 7 11.877 -7.975 9.884 1.00 0.00 H new ATOM 0 HG22 VAL B 7 13.344 -8.068 8.882 1.00 0.00 H new ATOM 0 HG23 VAL B 7 12.726 -6.485 9.409 1.00 0.00 H new ATOM 1562 N ILE B 8 12.187 -6.561 4.286 1.00 0.00 N ATOM 1563 CA ILE B 8 11.493 -6.578 3.007 1.00 0.00 C ATOM 1564 C ILE B 8 10.524 -7.754 2.949 1.00 0.00 C ATOM 1565 O ILE B 8 10.721 -8.771 3.613 1.00 0.00 O ATOM 1566 CB ILE B 8 12.493 -6.642 1.816 1.00 0.00 C ATOM 1567 CG1 ILE B 8 12.887 -5.230 1.381 1.00 0.00 C ATOM 1568 CG2 ILE B 8 11.911 -7.408 0.630 1.00 0.00 C ATOM 1569 CD1 ILE B 8 14.069 -4.665 2.138 1.00 0.00 C ATOM 0 H ILE B 8 13.190 -6.386 4.222 1.00 0.00 H new ATOM 0 HA ILE B 8 10.931 -5.648 2.919 1.00 0.00 H new ATOM 0 HB ILE B 8 13.379 -7.177 2.158 1.00 0.00 H new ATOM 0 HG12 ILE B 8 13.120 -5.240 0.316 1.00 0.00 H new ATOM 0 HG13 ILE B 8 12.032 -4.567 1.514 1.00 0.00 H new ATOM 0 HG21 ILE B 8 12.639 -7.431 -0.181 1.00 0.00 H new ATOM 0 HG22 ILE B 8 11.676 -8.428 0.935 1.00 0.00 H new ATOM 0 HG23 ILE B 8 11.002 -6.913 0.288 1.00 0.00 H new ATOM 0 HD11 ILE B 8 14.288 -3.661 1.774 1.00 0.00 H new ATOM 0 HD12 ILE B 8 13.833 -4.622 3.201 1.00 0.00 H new ATOM 0 HD13 ILE B 8 14.938 -5.305 1.985 1.00 0.00 H new ATOM 1581 N LYS B 9 9.483 -7.603 2.144 1.00 0.00 N ATOM 1582 CA LYS B 9 8.481 -8.649 1.987 1.00 0.00 C ATOM 1583 C LYS B 9 8.141 -8.836 0.515 1.00 0.00 C ATOM 1584 O LYS B 9 7.676 -9.897 0.100 1.00 0.00 O ATOM 1585 CB LYS B 9 7.224 -8.306 2.784 1.00 0.00 C ATOM 1586 CG LYS B 9 7.515 -7.911 4.221 1.00 0.00 C ATOM 1587 CD LYS B 9 8.008 -6.477 4.311 1.00 0.00 C ATOM 1588 CE LYS B 9 7.535 -5.804 5.589 1.00 0.00 C ATOM 1589 NZ LYS B 9 6.101 -6.088 5.868 1.00 0.00 N ATOM 0 H LYS B 9 9.309 -6.766 1.588 1.00 0.00 H new ATOM 0 HA LYS B 9 8.890 -9.583 2.372 1.00 0.00 H new ATOM 0 HB2 LYS B 9 6.699 -7.489 2.289 1.00 0.00 H new ATOM 0 HB3 LYS B 9 6.553 -9.165 2.779 1.00 0.00 H new ATOM 0 HG2 LYS B 9 6.613 -8.026 4.822 1.00 0.00 H new ATOM 0 HG3 LYS B 9 8.264 -8.582 4.640 1.00 0.00 H new ATOM 0 HD2 LYS B 9 9.097 -6.463 4.273 1.00 0.00 H new ATOM 0 HD3 LYS B 9 7.651 -5.914 3.449 1.00 0.00 H new ATOM 0 HE2 LYS B 9 8.143 -6.147 6.426 1.00 0.00 H new ATOM 0 HE3 LYS B 9 7.683 -4.727 5.508 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 5.656 -5.248 6.290 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 5.615 -6.327 4.980 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 6.028 -6.887 6.529 1.00 0.00 H new ATOM 1603 N ASN B 10 8.392 -7.794 -0.268 1.00 0.00 N ATOM 1604 CA ASN B 10 8.130 -7.826 -1.701 1.00 0.00 C ATOM 1605 C ASN B 10 9.177 -7.005 -2.440 1.00 0.00 C ATOM 1606 O ASN B 10 10.324 -7.428 -2.585 1.00 0.00 O ATOM 1607 CB ASN B 10 6.730 -7.288 -2.000 1.00 0.00 C ATOM 1608 CG ASN B 10 5.990 -8.135 -3.014 1.00 0.00 C ATOM 1609 OD1 ASN B 10 6.574 -8.614 -3.987 1.00 0.00 O ATOM 1610 ND2 ASN B 10 4.695 -8.325 -2.793 1.00 0.00 N ATOM 0 H ASN B 10 8.779 -6.912 0.068 1.00 0.00 H new ATOM 0 HA ASN B 10 8.184 -8.859 -2.043 1.00 0.00 H new ATOM 0 HB2 ASN B 10 6.154 -7.247 -1.075 1.00 0.00 H new ATOM 0 HB3 ASN B 10 6.808 -6.266 -2.372 1.00 0.00 H new ATOM 0 HD21 ASN B 10 4.144 -8.886 -3.442 1.00 0.00 H new ATOM 0 HD22 ASN B 10 4.251 -7.910 -1.974 1.00 0.00 H new ATOM 1617 N ALA B 11 8.783 -5.819 -2.886 1.00 0.00 N ATOM 1618 CA ALA B 11 9.695 -4.927 -3.586 1.00 0.00 C ATOM 1619 C ALA B 11 9.941 -5.371 -5.022 1.00 0.00 C ATOM 1620 O ALA B 11 10.279 -6.526 -5.281 1.00 0.00 O ATOM 1621 CB ALA B 11 11.013 -4.841 -2.834 1.00 0.00 C ATOM 0 H ALA B 11 7.837 -5.453 -2.775 1.00 0.00 H new ATOM 0 HA ALA B 11 9.228 -3.943 -3.624 1.00 0.00 H new ATOM 0 HB1 ALA B 11 11.691 -4.172 -3.364 1.00 0.00 H new ATOM 0 HB2 ALA B 11 10.835 -4.457 -1.830 1.00 0.00 H new ATOM 0 HB3 ALA B 11 11.460 -5.833 -2.769 1.00 0.00 H new ATOM 1627 N ASP B 12 9.786 -4.433 -5.949 1.00 0.00 N ATOM 1628 CA ASP B 12 10.005 -4.701 -7.362 1.00 0.00 C ATOM 1629 C ASP B 12 11.029 -3.726 -7.929 1.00 0.00 C ATOM 1630 O ASP B 12 10.930 -3.299 -9.079 1.00 0.00 O ATOM 1631 CB ASP B 12 8.690 -4.599 -8.136 1.00 0.00 C ATOM 1632 CG ASP B 12 8.563 -5.671 -9.201 1.00 0.00 C ATOM 1633 OD1 ASP B 12 9.207 -5.534 -10.262 1.00 0.00 O ATOM 1634 OD2 ASP B 12 7.820 -6.648 -8.973 1.00 0.00 O ATOM 0 H ASP B 12 9.507 -3.474 -5.743 1.00 0.00 H new ATOM 0 HA ASP B 12 10.390 -5.715 -7.468 1.00 0.00 H new ATOM 0 HB2 ASP B 12 7.855 -4.680 -7.441 1.00 0.00 H new ATOM 0 HB3 ASP B 12 8.621 -3.616 -8.603 1.00 0.00 H new ATOM 1639 N MET B 13 12.010 -3.373 -7.104 1.00 0.00 N ATOM 1640 CA MET B 13 13.058 -2.442 -7.503 1.00 0.00 C ATOM 1641 C MET B 13 14.435 -3.088 -7.387 1.00 0.00 C ATOM 1642 O MET B 13 14.617 -4.056 -6.648 1.00 0.00 O ATOM 1643 CB MET B 13 13.000 -1.187 -6.628 1.00 0.00 C ATOM 1644 CG MET B 13 14.265 -0.346 -6.683 1.00 0.00 C ATOM 1645 SD MET B 13 13.971 1.377 -6.240 1.00 0.00 S ATOM 1646 CE MET B 13 13.461 1.200 -4.532 1.00 0.00 C ATOM 0 H MET B 13 12.100 -3.721 -6.149 1.00 0.00 H new ATOM 0 HA MET B 13 12.893 -2.168 -8.545 1.00 0.00 H new ATOM 0 HB2 MET B 13 12.154 -0.575 -6.941 1.00 0.00 H new ATOM 0 HB3 MET B 13 12.815 -1.483 -5.595 1.00 0.00 H new ATOM 0 HG2 MET B 13 15.008 -0.769 -6.007 1.00 0.00 H new ATOM 0 HG3 MET B 13 14.685 -0.393 -7.688 1.00 0.00 H new ATOM 0 HE1 MET B 13 13.634 2.137 -4.002 1.00 0.00 H new ATOM 0 HE2 MET B 13 12.401 0.951 -4.493 1.00 0.00 H new ATOM 0 HE3 MET B 13 14.038 0.404 -4.061 1.00 0.00 H new ATOM 1656 N SER B 14 15.403 -2.543 -8.117 1.00 0.00 N ATOM 1657 CA SER B 14 16.765 -3.065 -8.090 1.00 0.00 C ATOM 1658 C SER B 14 17.153 -3.483 -6.676 1.00 0.00 C ATOM 1659 O SER B 14 16.563 -3.019 -5.700 1.00 0.00 O ATOM 1660 CB SER B 14 17.748 -2.015 -8.612 1.00 0.00 C ATOM 1661 OG SER B 14 18.529 -2.529 -9.677 1.00 0.00 O ATOM 0 H SER B 14 15.270 -1.741 -8.734 1.00 0.00 H new ATOM 0 HA SER B 14 16.807 -3.942 -8.736 1.00 0.00 H new ATOM 0 HB2 SER B 14 17.199 -1.136 -8.951 1.00 0.00 H new ATOM 0 HB3 SER B 14 18.401 -1.690 -7.802 1.00 0.00 H new ATOM 0 HG SER B 14 19.147 -1.837 -9.993 1.00 0.00 H new ATOM 1667 N GLU B 15 18.144 -4.362 -6.570 1.00 0.00 N ATOM 1668 CA GLU B 15 18.603 -4.842 -5.270 1.00 0.00 C ATOM 1669 C GLU B 15 19.265 -3.720 -4.475 1.00 0.00 C ATOM 1670 O GLU B 15 18.849 -3.406 -3.360 1.00 0.00 O ATOM 1671 CB GLU B 15 19.580 -6.006 -5.449 1.00 0.00 C ATOM 1672 CG GLU B 15 18.938 -7.372 -5.264 1.00 0.00 C ATOM 1673 CD GLU B 15 19.895 -8.511 -5.551 1.00 0.00 C ATOM 1674 OE1 GLU B 15 21.114 -8.252 -5.647 1.00 0.00 O ATOM 1675 OE2 GLU B 15 19.428 -9.661 -5.680 1.00 0.00 O ATOM 0 H GLU B 15 18.644 -4.756 -7.367 1.00 0.00 H new ATOM 0 HA GLU B 15 17.734 -5.190 -4.712 1.00 0.00 H new ATOM 0 HB2 GLU B 15 20.019 -5.952 -6.445 1.00 0.00 H new ATOM 0 HB3 GLU B 15 20.396 -5.898 -4.735 1.00 0.00 H new ATOM 0 HG2 GLU B 15 18.570 -7.461 -4.242 1.00 0.00 H new ATOM 0 HG3 GLU B 15 18.073 -7.455 -5.922 1.00 0.00 H new ATOM 1682 N GLU B 16 20.299 -3.119 -5.054 1.00 0.00 N ATOM 1683 CA GLU B 16 21.014 -2.033 -4.396 1.00 0.00 C ATOM 1684 C GLU B 16 20.055 -0.910 -4.016 1.00 0.00 C ATOM 1685 O GLU B 16 20.320 -0.140 -3.092 1.00 0.00 O ATOM 1686 CB GLU B 16 22.119 -1.493 -5.306 1.00 0.00 C ATOM 1687 CG GLU B 16 21.761 -1.525 -6.783 1.00 0.00 C ATOM 1688 CD GLU B 16 22.905 -2.012 -7.651 1.00 0.00 C ATOM 1689 OE1 GLU B 16 24.075 -1.798 -7.268 1.00 0.00 O ATOM 1690 OE2 GLU B 16 22.632 -2.605 -8.715 1.00 0.00 O ATOM 0 H GLU B 16 20.660 -3.365 -5.976 1.00 0.00 H new ATOM 0 HA GLU B 16 21.468 -2.426 -3.486 1.00 0.00 H new ATOM 0 HB2 GLU B 16 22.346 -0.467 -5.018 1.00 0.00 H new ATOM 0 HB3 GLU B 16 23.026 -2.077 -5.148 1.00 0.00 H new ATOM 0 HG2 GLU B 16 20.897 -2.174 -6.930 1.00 0.00 H new ATOM 0 HG3 GLU B 16 21.467 -0.525 -7.103 1.00 0.00 H new ATOM 1697 N MET B 17 18.941 -0.823 -4.735 1.00 0.00 N ATOM 1698 CA MET B 17 17.940 0.206 -4.473 1.00 0.00 C ATOM 1699 C MET B 17 17.083 -0.163 -3.264 1.00 0.00 C ATOM 1700 O MET B 17 16.798 0.682 -2.415 1.00 0.00 O ATOM 1701 CB MET B 17 17.049 0.407 -5.699 1.00 0.00 C ATOM 1702 CG MET B 17 17.773 1.029 -6.883 1.00 0.00 C ATOM 1703 SD MET B 17 16.995 2.555 -7.451 1.00 0.00 S ATOM 1704 CE MET B 17 16.682 3.382 -5.893 1.00 0.00 C ATOM 0 H MET B 17 18.708 -1.452 -5.503 1.00 0.00 H new ATOM 0 HA MET B 17 18.463 1.137 -4.256 1.00 0.00 H new ATOM 0 HB2 MET B 17 16.638 -0.556 -6.001 1.00 0.00 H new ATOM 0 HB3 MET B 17 16.206 1.042 -5.425 1.00 0.00 H new ATOM 0 HG2 MET B 17 18.807 1.235 -6.604 1.00 0.00 H new ATOM 0 HG3 MET B 17 17.801 0.313 -7.704 1.00 0.00 H new ATOM 0 HE1 MET B 17 16.543 4.449 -6.069 1.00 0.00 H new ATOM 0 HE2 MET B 17 15.783 2.969 -5.436 1.00 0.00 H new ATOM 0 HE3 MET B 17 17.530 3.232 -5.225 1.00 0.00 H new ATOM 1714 N GLN B 18 16.672 -1.426 -3.194 1.00 0.00 N ATOM 1715 CA GLN B 18 15.847 -1.899 -2.086 1.00 0.00 C ATOM 1716 C GLN B 18 16.575 -1.737 -0.758 1.00 0.00 C ATOM 1717 O GLN B 18 15.967 -1.391 0.257 1.00 0.00 O ATOM 1718 CB GLN B 18 15.455 -3.363 -2.289 1.00 0.00 C ATOM 1719 CG GLN B 18 16.309 -4.092 -3.312 1.00 0.00 C ATOM 1720 CD GLN B 18 15.484 -4.963 -4.237 1.00 0.00 C ATOM 1721 OE1 GLN B 18 15.999 -5.891 -4.860 1.00 0.00 O ATOM 1722 NE2 GLN B 18 14.192 -4.666 -4.329 1.00 0.00 N ATOM 0 H GLN B 18 16.896 -2.138 -3.889 1.00 0.00 H new ATOM 0 HA GLN B 18 14.942 -1.292 -2.063 1.00 0.00 H new ATOM 0 HB2 GLN B 18 15.525 -3.884 -1.334 1.00 0.00 H new ATOM 0 HB3 GLN B 18 14.412 -3.410 -2.601 1.00 0.00 H new ATOM 0 HG2 GLN B 18 16.865 -3.364 -3.903 1.00 0.00 H new ATOM 0 HG3 GLN B 18 17.043 -4.710 -2.795 1.00 0.00 H new ATOM 0 HE21 GLN B 18 13.808 -3.887 -3.794 1.00 0.00 H new ATOM 0 HE22 GLN B 18 13.584 -5.217 -4.935 1.00 0.00 H new ATOM 1731 N GLN B 19 17.881 -1.978 -0.770 1.00 0.00 N ATOM 1732 CA GLN B 19 18.687 -1.847 0.432 1.00 0.00 C ATOM 1733 C GLN B 19 18.909 -0.379 0.748 1.00 0.00 C ATOM 1734 O GLN B 19 18.815 0.047 1.901 1.00 0.00 O ATOM 1735 CB GLN B 19 20.029 -2.562 0.259 1.00 0.00 C ATOM 1736 CG GLN B 19 20.013 -4.008 0.724 1.00 0.00 C ATOM 1737 CD GLN B 19 19.947 -4.991 -0.426 1.00 0.00 C ATOM 1738 OE1 GLN B 19 20.927 -5.668 -0.738 1.00 0.00 O ATOM 1739 NE2 GLN B 19 18.786 -5.076 -1.065 1.00 0.00 N ATOM 0 H GLN B 19 18.401 -2.265 -1.599 1.00 0.00 H new ATOM 0 HA GLN B 19 18.156 -2.312 1.262 1.00 0.00 H new ATOM 0 HB2 GLN B 19 20.315 -2.531 -0.792 1.00 0.00 H new ATOM 0 HB3 GLN B 19 20.794 -2.019 0.814 1.00 0.00 H new ATOM 0 HG2 GLN B 19 20.908 -4.205 1.314 1.00 0.00 H new ATOM 0 HG3 GLN B 19 19.157 -4.165 1.380 1.00 0.00 H new ATOM 0 HE21 GLN B 19 17.999 -4.496 -0.773 1.00 0.00 H new ATOM 0 HE22 GLN B 19 18.681 -5.721 -1.848 1.00 0.00 H new ATOM 1748 N ASP B 20 19.185 0.397 -0.292 1.00 0.00 N ATOM 1749 CA ASP B 20 19.400 1.823 -0.132 1.00 0.00 C ATOM 1750 C ASP B 20 18.116 2.491 0.337 1.00 0.00 C ATOM 1751 O ASP B 20 18.145 3.472 1.080 1.00 0.00 O ATOM 1752 CB ASP B 20 19.874 2.448 -1.446 1.00 0.00 C ATOM 1753 CG ASP B 20 21.138 3.269 -1.273 1.00 0.00 C ATOM 1754 OD1 ASP B 20 22.224 2.665 -1.142 1.00 0.00 O ATOM 1755 OD2 ASP B 20 21.043 4.514 -1.270 1.00 0.00 O ATOM 0 H ASP B 20 19.264 0.061 -1.252 1.00 0.00 H new ATOM 0 HA ASP B 20 20.175 1.977 0.619 1.00 0.00 H new ATOM 0 HB2 ASP B 20 20.054 1.659 -2.176 1.00 0.00 H new ATOM 0 HB3 ASP B 20 19.084 3.082 -1.849 1.00 0.00 H new ATOM 1760 N SER B 21 16.986 1.937 -0.092 1.00 0.00 N ATOM 1761 CA SER B 21 15.684 2.460 0.292 1.00 0.00 C ATOM 1762 C SER B 21 15.469 2.273 1.785 1.00 0.00 C ATOM 1763 O SER B 21 15.101 3.208 2.494 1.00 0.00 O ATOM 1764 CB SER B 21 14.573 1.758 -0.490 1.00 0.00 C ATOM 1765 OG SER B 21 13.977 0.731 0.282 1.00 0.00 O ATOM 0 H SER B 21 16.948 1.124 -0.707 1.00 0.00 H new ATOM 0 HA SER B 21 15.653 3.524 0.058 1.00 0.00 H new ATOM 0 HB2 SER B 21 13.815 2.484 -0.782 1.00 0.00 H new ATOM 0 HB3 SER B 21 14.981 1.336 -1.409 1.00 0.00 H new ATOM 0 HG SER B 21 13.291 1.117 0.866 1.00 0.00 H new ATOM 1771 N VAL B 22 15.716 1.055 2.257 1.00 0.00 N ATOM 1772 CA VAL B 22 15.563 0.747 3.670 1.00 0.00 C ATOM 1773 C VAL B 22 16.355 1.727 4.522 1.00 0.00 C ATOM 1774 O VAL B 22 15.847 2.253 5.509 1.00 0.00 O ATOM 1775 CB VAL B 22 16.033 -0.680 3.997 1.00 0.00 C ATOM 1776 CG1 VAL B 22 15.960 -0.923 5.495 1.00 0.00 C ATOM 1777 CG2 VAL B 22 15.205 -1.706 3.237 1.00 0.00 C ATOM 0 H VAL B 22 16.022 0.270 1.682 1.00 0.00 H new ATOM 0 HA VAL B 22 14.500 0.829 3.897 1.00 0.00 H new ATOM 0 HB VAL B 22 17.070 -0.789 3.681 1.00 0.00 H new ATOM 0 HG11 VAL B 22 16.295 -1.936 5.716 1.00 0.00 H new ATOM 0 HG12 VAL B 22 16.601 -0.208 6.011 1.00 0.00 H new ATOM 0 HG13 VAL B 22 14.932 -0.799 5.834 1.00 0.00 H new ATOM 0 HG21 VAL B 22 15.554 -2.709 3.483 1.00 0.00 H new ATOM 0 HG22 VAL B 22 14.156 -1.608 3.518 1.00 0.00 H new ATOM 0 HG23 VAL B 22 15.311 -1.537 2.165 1.00 0.00 H new ATOM 1787 N GLU B 23 17.605 1.970 4.134 1.00 0.00 N ATOM 1788 CA GLU B 23 18.461 2.895 4.868 1.00 0.00 C ATOM 1789 C GLU B 23 17.867 4.296 4.850 1.00 0.00 C ATOM 1790 O GLU B 23 17.957 5.029 5.834 1.00 0.00 O ATOM 1791 CB GLU B 23 19.869 2.913 4.269 1.00 0.00 C ATOM 1792 CG GLU B 23 20.614 1.598 4.429 1.00 0.00 C ATOM 1793 CD GLU B 23 21.756 1.694 5.422 1.00 0.00 C ATOM 1794 OE1 GLU B 23 22.024 2.811 5.912 1.00 0.00 O ATOM 1795 OE2 GLU B 23 22.382 0.652 5.709 1.00 0.00 O ATOM 0 H GLU B 23 18.045 1.541 3.320 1.00 0.00 H new ATOM 0 HA GLU B 23 18.526 2.555 5.902 1.00 0.00 H new ATOM 0 HB2 GLU B 23 19.801 3.156 3.209 1.00 0.00 H new ATOM 0 HB3 GLU B 23 20.446 3.708 4.742 1.00 0.00 H new ATOM 0 HG2 GLU B 23 19.917 0.827 4.756 1.00 0.00 H new ATOM 0 HG3 GLU B 23 21.004 1.285 3.461 1.00 0.00 H new ATOM 1802 N CYS B 24 17.242 4.656 3.734 1.00 0.00 N ATOM 1803 CA CYS B 24 16.615 5.965 3.607 1.00 0.00 C ATOM 1804 C CYS B 24 15.378 6.026 4.492 1.00 0.00 C ATOM 1805 O CYS B 24 15.048 7.073 5.054 1.00 0.00 O ATOM 1806 CB CYS B 24 16.237 6.243 2.151 1.00 0.00 C ATOM 1807 SG CYS B 24 17.317 7.433 1.320 1.00 0.00 S ATOM 0 H CYS B 24 17.157 4.063 2.909 1.00 0.00 H new ATOM 0 HA CYS B 24 17.325 6.728 3.926 1.00 0.00 H new ATOM 0 HB2 CYS B 24 16.255 5.304 1.597 1.00 0.00 H new ATOM 0 HB3 CYS B 24 15.213 6.614 2.118 1.00 0.00 H new ATOM 0 HG CYS B 24 16.917 7.600 0.094 1.00 0.00 H new ATOM 1813 N ALA B 25 14.722 4.881 4.643 1.00 0.00 N ATOM 1814 CA ALA B 25 13.548 4.783 5.490 1.00 0.00 C ATOM 1815 C ALA B 25 13.994 4.867 6.931 1.00 0.00 C ATOM 1816 O ALA B 25 13.378 5.532 7.765 1.00 0.00 O ATOM 1817 CB ALA B 25 12.813 3.475 5.233 1.00 0.00 C ATOM 0 H ALA B 25 14.987 4.008 4.187 1.00 0.00 H new ATOM 0 HA ALA B 25 12.860 5.598 5.267 1.00 0.00 H new ATOM 0 HB1 ALA B 25 11.935 3.418 5.877 1.00 0.00 H new ATOM 0 HB2 ALA B 25 12.501 3.432 4.189 1.00 0.00 H new ATOM 0 HB3 ALA B 25 13.476 2.637 5.448 1.00 0.00 H new ATOM 1823 N THR B 26 15.105 4.198 7.194 1.00 0.00 N ATOM 1824 CA THR B 26 15.708 4.179 8.507 1.00 0.00 C ATOM 1825 C THR B 26 16.184 5.576 8.878 1.00 0.00 C ATOM 1826 O THR B 26 15.993 6.033 10.004 1.00 0.00 O ATOM 1827 CB THR B 26 16.881 3.206 8.513 1.00 0.00 C ATOM 1828 OG1 THR B 26 16.443 1.885 8.246 1.00 0.00 O ATOM 1829 CG2 THR B 26 17.630 3.187 9.819 1.00 0.00 C ATOM 0 H THR B 26 15.612 3.653 6.497 1.00 0.00 H new ATOM 0 HA THR B 26 14.970 3.854 9.240 1.00 0.00 H new ATOM 0 HB THR B 26 17.554 3.560 7.732 1.00 0.00 H new ATOM 0 HG1 THR B 26 16.195 1.807 7.301 1.00 0.00 H new ATOM 0 HG21 THR B 26 18.452 2.474 9.757 1.00 0.00 H new ATOM 0 HG22 THR B 26 18.027 4.181 10.026 1.00 0.00 H new ATOM 0 HG23 THR B 26 16.954 2.892 10.622 1.00 0.00 H new ATOM 1837 N GLN B 27 16.793 6.252 7.908 1.00 0.00 N ATOM 1838 CA GLN B 27 17.285 7.605 8.117 1.00 0.00 C ATOM 1839 C GLN B 27 16.156 8.494 8.614 1.00 0.00 C ATOM 1840 O GLN B 27 16.310 9.239 9.581 1.00 0.00 O ATOM 1841 CB GLN B 27 17.868 8.172 6.820 1.00 0.00 C ATOM 1842 CG GLN B 27 19.225 7.591 6.455 1.00 0.00 C ATOM 1843 CD GLN B 27 19.683 8.010 5.072 1.00 0.00 C ATOM 1844 OE1 GLN B 27 18.952 8.936 4.461 1.00 0.00 O flip ATOM 1845 NE2 GLN B 27 20.682 7.508 4.557 1.00 0.00 N flip ATOM 0 H GLN B 27 16.956 5.883 6.971 1.00 0.00 H new ATOM 0 HA GLN B 27 18.075 7.577 8.867 1.00 0.00 H new ATOM 0 HB2 GLN B 27 17.170 7.982 6.005 1.00 0.00 H new ATOM 0 HB3 GLN B 27 17.960 9.254 6.916 1.00 0.00 H new ATOM 0 HG2 GLN B 27 19.963 7.910 7.191 1.00 0.00 H new ATOM 0 HG3 GLN B 27 19.176 6.503 6.504 1.00 0.00 H new ATOM 0 HE21 GLN B 27 21.215 6.800 5.062 1.00 0.00 H new ATOM 0 HE22 GLN B 27 20.977 7.800 3.625 1.00 0.00 H new ATOM 1854 N ALA B 28 15.012 8.393 7.947 1.00 0.00 N ATOM 1855 CA ALA B 28 13.838 9.170 8.321 1.00 0.00 C ATOM 1856 C ALA B 28 13.367 8.781 9.715 1.00 0.00 C ATOM 1857 O ALA B 28 12.840 9.606 10.462 1.00 0.00 O ATOM 1858 CB ALA B 28 12.721 8.959 7.311 1.00 0.00 C ATOM 0 H ALA B 28 14.873 7.780 7.144 1.00 0.00 H new ATOM 0 HA ALA B 28 14.109 10.226 8.327 1.00 0.00 H new ATOM 0 HB1 ALA B 28 11.850 9.546 7.604 1.00 0.00 H new ATOM 0 HB2 ALA B 28 13.058 9.277 6.324 1.00 0.00 H new ATOM 0 HB3 ALA B 28 12.453 7.903 7.280 1.00 0.00 H new ATOM 1864 N LEU B 29 13.559 7.511 10.052 1.00 0.00 N ATOM 1865 CA LEU B 29 13.156 6.990 11.351 1.00 0.00 C ATOM 1866 C LEU B 29 14.013 7.574 12.469 1.00 0.00 C ATOM 1867 O LEU B 29 13.494 8.084 13.461 1.00 0.00 O ATOM 1868 CB LEU B 29 13.260 5.468 11.363 1.00 0.00 C ATOM 1869 CG LEU B 29 12.158 4.746 10.591 1.00 0.00 C ATOM 1870 CD1 LEU B 29 12.757 3.764 9.602 1.00 0.00 C ATOM 1871 CD2 LEU B 29 11.221 4.034 11.550 1.00 0.00 C ATOM 0 H LEU B 29 13.994 6.821 9.440 1.00 0.00 H new ATOM 0 HA LEU B 29 12.120 7.283 11.523 1.00 0.00 H new ATOM 0 HB2 LEU B 29 14.225 5.180 10.946 1.00 0.00 H new ATOM 0 HB3 LEU B 29 13.245 5.125 12.397 1.00 0.00 H new ATOM 0 HG LEU B 29 11.584 5.486 10.033 1.00 0.00 H new ATOM 0 HD11 LEU B 29 11.957 3.259 9.061 1.00 0.00 H new ATOM 0 HD12 LEU B 29 13.391 4.300 8.895 1.00 0.00 H new ATOM 0 HD13 LEU B 29 13.354 3.027 10.138 1.00 0.00 H new ATOM 0 HD21 LEU B 29 10.441 3.524 10.985 1.00 0.00 H new ATOM 0 HD22 LEU B 29 11.783 3.304 12.133 1.00 0.00 H new ATOM 0 HD23 LEU B 29 10.766 4.762 12.222 1.00 0.00 H new ATOM 1883 N GLU B 30 15.329 7.490 12.302 1.00 0.00 N ATOM 1884 CA GLU B 30 16.261 8.004 13.298 1.00 0.00 C ATOM 1885 C GLU B 30 16.055 9.500 13.518 1.00 0.00 C ATOM 1886 O GLU B 30 16.236 10.003 14.627 1.00 0.00 O ATOM 1887 CB GLU B 30 17.703 7.728 12.868 1.00 0.00 C ATOM 1888 CG GLU B 30 18.417 6.719 13.753 1.00 0.00 C ATOM 1889 CD GLU B 30 19.887 7.044 13.939 1.00 0.00 C ATOM 1890 OE1 GLU B 30 20.208 7.836 14.851 1.00 0.00 O ATOM 1891 OE2 GLU B 30 20.715 6.508 13.174 1.00 0.00 O ATOM 0 H GLU B 30 15.774 7.070 11.486 1.00 0.00 H new ATOM 0 HA GLU B 30 16.068 7.490 14.240 1.00 0.00 H new ATOM 0 HB2 GLU B 30 17.704 7.363 11.841 1.00 0.00 H new ATOM 0 HB3 GLU B 30 18.261 8.664 12.874 1.00 0.00 H new ATOM 0 HG2 GLU B 30 17.930 6.687 14.727 1.00 0.00 H new ATOM 0 HG3 GLU B 30 18.321 5.725 13.316 1.00 0.00 H new ATOM 1898 N LYS B 31 15.675 10.204 12.458 1.00 0.00 N ATOM 1899 CA LYS B 31 15.444 11.641 12.541 1.00 0.00 C ATOM 1900 C LYS B 31 14.045 11.934 13.072 1.00 0.00 C ATOM 1901 O LYS B 31 13.836 12.904 13.799 1.00 0.00 O ATOM 1902 CB LYS B 31 15.632 12.291 11.172 1.00 0.00 C ATOM 1903 CG LYS B 31 17.077 12.642 10.866 1.00 0.00 C ATOM 1904 CD LYS B 31 17.366 12.553 9.378 1.00 0.00 C ATOM 1905 CE LYS B 31 18.188 13.739 8.897 1.00 0.00 C ATOM 1906 NZ LYS B 31 18.309 13.762 7.414 1.00 0.00 N ATOM 0 H LYS B 31 15.521 9.804 11.533 1.00 0.00 H new ATOM 0 HA LYS B 31 16.172 12.062 13.234 1.00 0.00 H new ATOM 0 HB2 LYS B 31 15.259 11.615 10.403 1.00 0.00 H new ATOM 0 HB3 LYS B 31 15.027 13.196 11.121 1.00 0.00 H new ATOM 0 HG2 LYS B 31 17.291 13.651 11.220 1.00 0.00 H new ATOM 0 HG3 LYS B 31 17.739 11.967 11.408 1.00 0.00 H new ATOM 0 HD2 LYS B 31 17.902 11.628 9.165 1.00 0.00 H new ATOM 0 HD3 LYS B 31 16.427 12.512 8.826 1.00 0.00 H new ATOM 0 HE2 LYS B 31 17.725 14.665 9.238 1.00 0.00 H new ATOM 0 HE3 LYS B 31 19.182 13.697 9.342 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 18.876 14.584 7.125 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 18.774 12.890 7.090 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 17.362 13.828 6.989 1.00 0.00 H new ATOM 1920 N TYR B 32 13.092 11.085 12.703 1.00 0.00 N ATOM 1921 CA TYR B 32 11.712 11.249 13.144 1.00 0.00 C ATOM 1922 C TYR B 32 11.039 9.892 13.329 1.00 0.00 C ATOM 1923 O TYR B 32 11.389 8.919 12.662 1.00 0.00 O ATOM 1924 CB TYR B 32 10.921 12.091 12.140 1.00 0.00 C ATOM 1925 CG TYR B 32 11.779 12.742 11.079 1.00 0.00 C ATOM 1926 CD1 TYR B 32 12.337 13.997 11.286 1.00 0.00 C ATOM 1927 CD2 TYR B 32 12.030 12.102 9.872 1.00 0.00 C ATOM 1928 CE1 TYR B 32 13.121 14.596 10.318 1.00 0.00 C ATOM 1929 CE2 TYR B 32 12.813 12.694 8.900 1.00 0.00 C ATOM 1930 CZ TYR B 32 13.355 13.941 9.128 1.00 0.00 C ATOM 1931 OH TYR B 32 14.135 14.535 8.162 1.00 0.00 O ATOM 0 H TYR B 32 13.250 10.277 12.100 1.00 0.00 H new ATOM 0 HA TYR B 32 11.725 11.766 14.103 1.00 0.00 H new ATOM 0 HB2 TYR B 32 10.178 11.458 11.655 1.00 0.00 H new ATOM 0 HB3 TYR B 32 10.376 12.866 12.679 1.00 0.00 H new ATOM 0 HD1 TYR B 32 12.156 14.513 12.217 1.00 0.00 H new ATOM 0 HD2 TYR B 32 11.606 11.125 9.690 1.00 0.00 H new ATOM 0 HE1 TYR B 32 13.548 15.572 10.493 1.00 0.00 H new ATOM 0 HE2 TYR B 32 12.999 12.183 7.967 1.00 0.00 H new ATOM 0 HH TYR B 32 14.799 15.116 8.589 1.00 0.00 H new ATOM 1941 N ASN B 33 10.076 9.835 14.242 1.00 0.00 N ATOM 1942 CA ASN B 33 9.355 8.596 14.520 1.00 0.00 C ATOM 1943 C ASN B 33 7.884 8.722 14.138 1.00 0.00 C ATOM 1944 O ASN B 33 7.016 8.114 14.764 1.00 0.00 O ATOM 1945 CB ASN B 33 9.481 8.236 16.001 1.00 0.00 C ATOM 1946 CG ASN B 33 9.956 6.812 16.215 1.00 0.00 C ATOM 1947 OD1 ASN B 33 10.821 6.553 17.051 1.00 0.00 O ATOM 1948 ND2 ASN B 33 9.390 5.879 15.458 1.00 0.00 N ATOM 0 H ASN B 33 9.776 10.632 14.803 1.00 0.00 H new ATOM 0 HA ASN B 33 9.798 7.802 13.918 1.00 0.00 H new ATOM 0 HB2 ASN B 33 10.178 8.924 16.481 1.00 0.00 H new ATOM 0 HB3 ASN B 33 8.515 8.370 16.487 1.00 0.00 H new ATOM 0 HD21 ASN B 33 9.669 4.903 15.558 1.00 0.00 H new ATOM 0 HD22 ASN B 33 8.676 6.138 14.777 1.00 0.00 H new ATOM 1955 N ILE B 34 7.611 9.513 13.105 1.00 0.00 N ATOM 1956 CA ILE B 34 6.245 9.716 12.638 1.00 0.00 C ATOM 1957 C ILE B 34 6.064 9.155 11.233 1.00 0.00 C ATOM 1958 O ILE B 34 6.614 9.684 10.268 1.00 0.00 O ATOM 1959 CB ILE B 34 5.869 11.210 12.640 1.00 0.00 C ATOM 1960 CG1 ILE B 34 6.614 11.945 13.755 1.00 0.00 C ATOM 1961 CG2 ILE B 34 4.366 11.381 12.797 1.00 0.00 C ATOM 1962 CD1 ILE B 34 6.445 11.306 15.112 1.00 0.00 C ATOM 0 H ILE B 34 8.318 10.024 12.576 1.00 0.00 H new ATOM 0 HA ILE B 34 5.587 9.186 13.326 1.00 0.00 H new ATOM 0 HB ILE B 34 6.165 11.643 11.684 1.00 0.00 H new ATOM 0 HG12 ILE B 34 7.675 11.983 13.509 1.00 0.00 H new ATOM 0 HG13 ILE B 34 6.261 12.975 13.800 1.00 0.00 H new ATOM 0 HG21 ILE B 34 4.119 12.443 12.796 1.00 0.00 H new ATOM 0 HG22 ILE B 34 3.855 10.889 11.969 1.00 0.00 H new ATOM 0 HG23 ILE B 34 4.045 10.934 13.738 1.00 0.00 H new ATOM 0 HD11 ILE B 34 7.000 11.879 15.855 1.00 0.00 H new ATOM 0 HD12 ILE B 34 5.388 11.293 15.379 1.00 0.00 H new ATOM 0 HD13 ILE B 34 6.825 10.285 15.083 1.00 0.00 H new ATOM 1974 N GLU B 35 5.292 8.078 11.126 1.00 0.00 N ATOM 1975 CA GLU B 35 5.041 7.438 9.840 1.00 0.00 C ATOM 1976 C GLU B 35 5.088 8.450 8.701 1.00 0.00 C ATOM 1977 O GLU B 35 6.019 8.448 7.895 1.00 0.00 O ATOM 1978 CB GLU B 35 3.683 6.738 9.860 1.00 0.00 C ATOM 1979 CG GLU B 35 3.516 5.775 11.023 1.00 0.00 C ATOM 1980 CD GLU B 35 2.573 6.301 12.086 1.00 0.00 C ATOM 1981 OE1 GLU B 35 1.747 7.181 11.764 1.00 0.00 O ATOM 1982 OE2 GLU B 35 2.659 5.834 13.241 1.00 0.00 O ATOM 0 H GLU B 35 4.829 7.630 11.916 1.00 0.00 H new ATOM 0 HA GLU B 35 5.826 6.701 9.671 1.00 0.00 H new ATOM 0 HB2 GLU B 35 2.896 7.490 9.905 1.00 0.00 H new ATOM 0 HB3 GLU B 35 3.550 6.193 8.925 1.00 0.00 H new ATOM 0 HG2 GLU B 35 3.141 4.822 10.650 1.00 0.00 H new ATOM 0 HG3 GLU B 35 4.490 5.580 11.471 1.00 0.00 H new ATOM 1989 N LYS B 36 4.081 9.315 8.639 1.00 0.00 N ATOM 1990 CA LYS B 36 4.014 10.330 7.597 1.00 0.00 C ATOM 1991 C LYS B 36 5.362 11.027 7.434 1.00 0.00 C ATOM 1992 O LYS B 36 5.864 11.176 6.320 1.00 0.00 O ATOM 1993 CB LYS B 36 2.930 11.359 7.925 1.00 0.00 C ATOM 1994 CG LYS B 36 1.898 10.859 8.922 1.00 0.00 C ATOM 1995 CD LYS B 36 1.336 11.995 9.762 1.00 0.00 C ATOM 1996 CE LYS B 36 2.087 12.144 11.075 1.00 0.00 C ATOM 1997 NZ LYS B 36 2.884 13.401 11.120 1.00 0.00 N ATOM 0 H LYS B 36 3.302 9.333 9.297 1.00 0.00 H new ATOM 0 HA LYS B 36 3.762 9.837 6.658 1.00 0.00 H new ATOM 0 HB2 LYS B 36 3.402 12.257 8.323 1.00 0.00 H new ATOM 0 HB3 LYS B 36 2.423 11.647 7.004 1.00 0.00 H new ATOM 0 HG2 LYS B 36 1.086 10.364 8.389 1.00 0.00 H new ATOM 0 HG3 LYS B 36 2.353 10.114 9.574 1.00 0.00 H new ATOM 0 HD2 LYS B 36 1.395 12.927 9.200 1.00 0.00 H new ATOM 0 HD3 LYS B 36 0.281 11.811 9.964 1.00 0.00 H new ATOM 0 HE2 LYS B 36 1.377 12.135 11.902 1.00 0.00 H new ATOM 0 HE3 LYS B 36 2.749 11.289 11.213 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 2.842 13.804 12.078 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 3.873 13.194 10.874 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 2.494 14.084 10.440 1.00 0.00 H new ATOM 2011 N ASP B 37 5.944 11.446 8.553 1.00 0.00 N ATOM 2012 CA ASP B 37 7.236 12.122 8.536 1.00 0.00 C ATOM 2013 C ASP B 37 8.289 11.251 7.861 1.00 0.00 C ATOM 2014 O ASP B 37 8.850 11.622 6.828 1.00 0.00 O ATOM 2015 CB ASP B 37 7.675 12.464 9.963 1.00 0.00 C ATOM 2016 CG ASP B 37 7.650 13.955 10.232 1.00 0.00 C ATOM 2017 OD1 ASP B 37 7.486 14.731 9.268 1.00 0.00 O ATOM 2018 OD2 ASP B 37 7.794 14.348 11.410 1.00 0.00 O ATOM 0 H ASP B 37 5.541 11.329 9.483 1.00 0.00 H new ATOM 0 HA ASP B 37 7.132 13.046 7.967 1.00 0.00 H new ATOM 0 HB2 ASP B 37 7.021 11.958 10.673 1.00 0.00 H new ATOM 0 HB3 ASP B 37 8.683 12.084 10.132 1.00 0.00 H new ATOM 2023 N ILE B 38 8.549 10.088 8.448 1.00 0.00 N ATOM 2024 CA ILE B 38 9.528 9.157 7.903 1.00 0.00 C ATOM 2025 C ILE B 38 9.345 8.995 6.400 1.00 0.00 C ATOM 2026 O ILE B 38 10.312 9.025 5.638 1.00 0.00 O ATOM 2027 CB ILE B 38 9.420 7.775 8.577 1.00 0.00 C ATOM 2028 CG1 ILE B 38 9.318 7.930 10.095 1.00 0.00 C ATOM 2029 CG2 ILE B 38 10.613 6.908 8.205 1.00 0.00 C ATOM 2030 CD1 ILE B 38 8.406 6.914 10.745 1.00 0.00 C ATOM 0 H ILE B 38 8.094 9.768 9.303 1.00 0.00 H new ATOM 0 HA ILE B 38 10.515 9.574 8.104 1.00 0.00 H new ATOM 0 HB ILE B 38 8.515 7.283 8.220 1.00 0.00 H new ATOM 0 HG12 ILE B 38 10.314 7.843 10.529 1.00 0.00 H new ATOM 0 HG13 ILE B 38 8.956 8.932 10.327 1.00 0.00 H new ATOM 0 HG21 ILE B 38 10.521 5.936 8.689 1.00 0.00 H new ATOM 0 HG22 ILE B 38 10.642 6.774 7.124 1.00 0.00 H new ATOM 0 HG23 ILE B 38 11.532 7.392 8.535 1.00 0.00 H new ATOM 0 HD11 ILE B 38 8.381 7.083 11.821 1.00 0.00 H new ATOM 0 HD12 ILE B 38 7.400 7.016 10.339 1.00 0.00 H new ATOM 0 HD13 ILE B 38 8.779 5.910 10.544 1.00 0.00 H new ATOM 2042 N ALA B 39 8.096 8.828 5.977 1.00 0.00 N ATOM 2043 CA ALA B 39 7.786 8.667 4.562 1.00 0.00 C ATOM 2044 C ALA B 39 8.253 9.881 3.766 1.00 0.00 C ATOM 2045 O ALA B 39 9.016 9.753 2.809 1.00 0.00 O ATOM 2046 CB ALA B 39 6.293 8.444 4.368 1.00 0.00 C ATOM 0 H ALA B 39 7.284 8.801 6.593 1.00 0.00 H new ATOM 0 HA ALA B 39 8.319 7.791 4.192 1.00 0.00 H new ATOM 0 HB1 ALA B 39 6.078 8.326 3.306 1.00 0.00 H new ATOM 0 HB2 ALA B 39 5.987 7.545 4.903 1.00 0.00 H new ATOM 0 HB3 ALA B 39 5.744 9.302 4.756 1.00 0.00 H new ATOM 2052 N ALA B 40 7.793 11.061 4.174 1.00 0.00 N ATOM 2053 CA ALA B 40 8.170 12.299 3.505 1.00 0.00 C ATOM 2054 C ALA B 40 9.684 12.394 3.363 1.00 0.00 C ATOM 2055 O ALA B 40 10.201 12.744 2.301 1.00 0.00 O ATOM 2056 CB ALA B 40 7.636 13.498 4.275 1.00 0.00 C ATOM 0 H ALA B 40 7.159 11.184 4.964 1.00 0.00 H new ATOM 0 HA ALA B 40 7.731 12.298 2.507 1.00 0.00 H new ATOM 0 HB1 ALA B 40 7.925 14.417 3.764 1.00 0.00 H new ATOM 0 HB2 ALA B 40 6.549 13.440 4.330 1.00 0.00 H new ATOM 0 HB3 ALA B 40 8.051 13.497 5.283 1.00 0.00 H new ATOM 2062 N HIS B 41 10.387 12.074 4.443 1.00 0.00 N ATOM 2063 CA HIS B 41 11.844 12.115 4.452 1.00 0.00 C ATOM 2064 C HIS B 41 12.418 11.184 3.388 1.00 0.00 C ATOM 2065 O HIS B 41 13.260 11.588 2.585 1.00 0.00 O ATOM 2066 CB HIS B 41 12.370 11.723 5.838 1.00 0.00 C ATOM 2067 CG HIS B 41 13.805 11.291 5.846 1.00 0.00 C ATOM 2068 ND1 HIS B 41 14.768 11.897 6.625 1.00 0.00 N ATOM 2069 CD2 HIS B 41 14.436 10.304 5.170 1.00 0.00 C ATOM 2070 CE1 HIS B 41 15.930 11.302 6.425 1.00 0.00 C ATOM 2071 NE2 HIS B 41 15.756 10.331 5.547 1.00 0.00 N ATOM 0 H HIS B 41 9.970 11.782 5.327 1.00 0.00 H new ATOM 0 HA HIS B 41 12.163 13.132 4.224 1.00 0.00 H new ATOM 0 HB2 HIS B 41 12.253 12.571 6.513 1.00 0.00 H new ATOM 0 HB3 HIS B 41 11.756 10.914 6.233 1.00 0.00 H new ATOM 0 HD1 HIS B 41 14.608 12.682 7.257 1.00 0.00 H new ATOM 0 HD2 HIS B 41 13.985 9.621 4.465 1.00 0.00 H new ATOM 0 HE1 HIS B 41 16.864 11.565 6.899 1.00 0.00 H new ATOM 2080 N ILE B 42 11.958 9.936 3.390 1.00 0.00 N ATOM 2081 CA ILE B 42 12.427 8.945 2.428 1.00 0.00 C ATOM 2082 C ILE B 42 12.123 9.375 0.998 1.00 0.00 C ATOM 2083 O ILE B 42 13.026 9.713 0.233 1.00 0.00 O ATOM 2084 CB ILE B 42 11.777 7.569 2.674 1.00 0.00 C ATOM 2085 CG1 ILE B 42 11.965 7.135 4.128 1.00 0.00 C ATOM 2086 CG2 ILE B 42 12.358 6.533 1.725 1.00 0.00 C ATOM 2087 CD1 ILE B 42 10.965 6.090 4.580 1.00 0.00 C ATOM 0 H ILE B 42 11.261 9.587 4.048 1.00 0.00 H new ATOM 0 HA ILE B 42 13.506 8.866 2.564 1.00 0.00 H new ATOM 0 HB ILE B 42 10.707 7.653 2.481 1.00 0.00 H new ATOM 0 HG12 ILE B 42 12.973 6.740 4.254 1.00 0.00 H new ATOM 0 HG13 ILE B 42 11.882 8.009 4.774 1.00 0.00 H new ATOM 0 HG21 ILE B 42 11.890 5.566 1.910 1.00 0.00 H new ATOM 0 HG22 ILE B 42 12.169 6.836 0.695 1.00 0.00 H new ATOM 0 HG23 ILE B 42 13.433 6.452 1.888 1.00 0.00 H new ATOM 0 HD11 ILE B 42 11.157 5.829 5.621 1.00 0.00 H new ATOM 0 HD12 ILE B 42 9.955 6.489 4.486 1.00 0.00 H new ATOM 0 HD13 ILE B 42 11.063 5.200 3.959 1.00 0.00 H new ATOM 2099 N LYS B 43 10.844 9.353 0.645 1.00 0.00 N ATOM 2100 CA LYS B 43 10.411 9.735 -0.692 1.00 0.00 C ATOM 2101 C LYS B 43 11.240 10.901 -1.223 1.00 0.00 C ATOM 2102 O LYS B 43 11.860 10.804 -2.282 1.00 0.00 O ATOM 2103 CB LYS B 43 8.930 10.111 -0.676 1.00 0.00 C ATOM 2104 CG LYS B 43 8.250 9.976 -2.029 1.00 0.00 C ATOM 2105 CD LYS B 43 7.542 11.260 -2.426 1.00 0.00 C ATOM 2106 CE LYS B 43 8.534 12.372 -2.722 1.00 0.00 C ATOM 2107 NZ LYS B 43 7.908 13.718 -2.615 1.00 0.00 N ATOM 0 H LYS B 43 10.087 9.074 1.269 1.00 0.00 H new ATOM 0 HA LYS B 43 10.558 8.882 -1.354 1.00 0.00 H new ATOM 0 HB2 LYS B 43 8.412 9.479 0.046 1.00 0.00 H new ATOM 0 HB3 LYS B 43 8.829 11.140 -0.330 1.00 0.00 H new ATOM 0 HG2 LYS B 43 8.991 9.719 -2.786 1.00 0.00 H new ATOM 0 HG3 LYS B 43 7.531 9.158 -1.996 1.00 0.00 H new ATOM 0 HD2 LYS B 43 6.923 11.079 -3.305 1.00 0.00 H new ATOM 0 HD3 LYS B 43 6.873 11.571 -1.624 1.00 0.00 H new ATOM 0 HE2 LYS B 43 9.372 12.305 -2.028 1.00 0.00 H new ATOM 0 HE3 LYS B 43 8.940 12.239 -3.725 1.00 0.00 H new ATOM 0 HZ1 LYS B 43 8.646 14.432 -2.452 1.00 0.00 H new ATOM 0 HZ2 LYS B 43 7.403 13.937 -3.498 1.00 0.00 H new ATOM 0 HZ3 LYS B 43 7.236 13.726 -1.821 1.00 0.00 H new ATOM 2121 N LYS B 44 11.245 12.003 -0.481 1.00 0.00 N ATOM 2122 CA LYS B 44 11.997 13.187 -0.879 1.00 0.00 C ATOM 2123 C LYS B 44 13.460 12.848 -1.130 1.00 0.00 C ATOM 2124 O LYS B 44 14.049 13.286 -2.118 1.00 0.00 O ATOM 2125 CB LYS B 44 11.895 14.274 0.193 1.00 0.00 C ATOM 2126 CG LYS B 44 12.731 15.506 -0.110 1.00 0.00 C ATOM 2127 CD LYS B 44 12.058 16.394 -1.145 1.00 0.00 C ATOM 2128 CE LYS B 44 12.304 17.866 -0.860 1.00 0.00 C ATOM 2129 NZ LYS B 44 11.036 18.598 -0.588 1.00 0.00 N ATOM 0 H LYS B 44 10.737 12.101 0.398 1.00 0.00 H new ATOM 0 HA LYS B 44 11.563 13.559 -1.807 1.00 0.00 H new ATOM 0 HB2 LYS B 44 10.852 14.570 0.300 1.00 0.00 H new ATOM 0 HB3 LYS B 44 12.208 13.859 1.151 1.00 0.00 H new ATOM 0 HG2 LYS B 44 12.893 16.072 0.807 1.00 0.00 H new ATOM 0 HG3 LYS B 44 13.712 15.201 -0.473 1.00 0.00 H new ATOM 0 HD2 LYS B 44 12.434 16.147 -2.138 1.00 0.00 H new ATOM 0 HD3 LYS B 44 10.986 16.198 -1.152 1.00 0.00 H new ATOM 0 HE2 LYS B 44 12.971 17.963 -0.003 1.00 0.00 H new ATOM 0 HE3 LYS B 44 12.811 18.321 -1.711 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 11.247 19.599 -0.398 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 10.410 18.527 -1.415 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 10.565 18.180 0.240 1.00 0.00 H new ATOM 2143 N GLU B 45 14.042 12.067 -0.229 1.00 0.00 N ATOM 2144 CA GLU B 45 15.439 11.671 -0.354 1.00 0.00 C ATOM 2145 C GLU B 45 15.650 10.822 -1.601 1.00 0.00 C ATOM 2146 O GLU B 45 16.700 10.888 -2.237 1.00 0.00 O ATOM 2147 CB GLU B 45 15.889 10.897 0.887 1.00 0.00 C ATOM 2148 CG GLU B 45 17.162 11.440 1.516 1.00 0.00 C ATOM 2149 CD GLU B 45 18.411 10.777 0.969 1.00 0.00 C ATOM 2150 OE1 GLU B 45 18.286 9.948 0.043 1.00 0.00 O ATOM 2151 OE2 GLU B 45 19.514 11.086 1.468 1.00 0.00 O ATOM 0 H GLU B 45 13.569 11.696 0.595 1.00 0.00 H new ATOM 0 HA GLU B 45 16.040 12.576 -0.443 1.00 0.00 H new ATOM 0 HB2 GLU B 45 15.090 10.919 1.628 1.00 0.00 H new ATOM 0 HB3 GLU B 45 16.044 9.853 0.617 1.00 0.00 H new ATOM 0 HG2 GLU B 45 17.219 12.514 1.342 1.00 0.00 H new ATOM 0 HG3 GLU B 45 17.121 11.294 2.595 1.00 0.00 H new ATOM 2158 N PHE B 46 14.645 10.028 -1.946 1.00 0.00 N ATOM 2159 CA PHE B 46 14.721 9.170 -3.120 1.00 0.00 C ATOM 2160 C PHE B 46 14.565 9.988 -4.396 1.00 0.00 C ATOM 2161 O PHE B 46 15.200 9.705 -5.412 1.00 0.00 O ATOM 2162 CB PHE B 46 13.644 8.089 -3.057 1.00 0.00 C ATOM 2163 CG PHE B 46 14.177 6.738 -2.682 1.00 0.00 C ATOM 2164 CD1 PHE B 46 14.736 5.910 -3.641 1.00 0.00 C ATOM 2165 CD2 PHE B 46 14.123 6.298 -1.370 1.00 0.00 C ATOM 2166 CE1 PHE B 46 15.230 4.667 -3.298 1.00 0.00 C ATOM 2167 CE2 PHE B 46 14.616 5.056 -1.021 1.00 0.00 C ATOM 2168 CZ PHE B 46 15.171 4.240 -1.986 1.00 0.00 C ATOM 0 H PHE B 46 13.768 9.961 -1.430 1.00 0.00 H new ATOM 0 HA PHE B 46 15.701 8.693 -3.131 1.00 0.00 H new ATOM 0 HB2 PHE B 46 12.884 8.385 -2.334 1.00 0.00 H new ATOM 0 HB3 PHE B 46 13.151 8.021 -4.027 1.00 0.00 H new ATOM 0 HD1 PHE B 46 14.786 6.240 -4.668 1.00 0.00 H new ATOM 0 HD2 PHE B 46 13.690 6.933 -0.611 1.00 0.00 H new ATOM 0 HE1 PHE B 46 15.662 4.029 -4.055 1.00 0.00 H new ATOM 0 HE2 PHE B 46 14.567 4.724 0.005 1.00 0.00 H new ATOM 0 HZ PHE B 46 15.559 3.269 -1.715 1.00 0.00 H new ATOM 2178 N ASP B 47 13.713 11.004 -4.331 1.00 0.00 N ATOM 2179 CA ASP B 47 13.465 11.870 -5.476 1.00 0.00 C ATOM 2180 C ASP B 47 14.691 12.721 -5.792 1.00 0.00 C ATOM 2181 O ASP B 47 14.980 13.005 -6.954 1.00 0.00 O ATOM 2182 CB ASP B 47 12.257 12.769 -5.197 1.00 0.00 C ATOM 2183 CG ASP B 47 12.186 13.973 -6.121 1.00 0.00 C ATOM 2184 OD1 ASP B 47 13.213 14.665 -6.283 1.00 0.00 O ATOM 2185 OD2 ASP B 47 11.098 14.229 -6.676 1.00 0.00 O ATOM 0 H ASP B 47 13.181 11.248 -3.495 1.00 0.00 H new ATOM 0 HA ASP B 47 13.254 11.243 -6.342 1.00 0.00 H new ATOM 0 HB2 ASP B 47 11.344 12.183 -5.302 1.00 0.00 H new ATOM 0 HB3 ASP B 47 12.298 13.113 -4.164 1.00 0.00 H new ATOM 2190 N LYS B 48 15.402 13.136 -4.750 1.00 0.00 N ATOM 2191 CA LYS B 48 16.588 13.966 -4.921 1.00 0.00 C ATOM 2192 C LYS B 48 17.854 13.124 -5.053 1.00 0.00 C ATOM 2193 O LYS B 48 18.751 13.456 -5.828 1.00 0.00 O ATOM 2194 CB LYS B 48 16.730 14.928 -3.740 1.00 0.00 C ATOM 2195 CG LYS B 48 15.999 16.245 -3.937 1.00 0.00 C ATOM 2196 CD LYS B 48 16.761 17.167 -4.876 1.00 0.00 C ATOM 2197 CE LYS B 48 18.166 17.444 -4.364 1.00 0.00 C ATOM 2198 NZ LYS B 48 18.908 18.378 -5.255 1.00 0.00 N ATOM 0 H LYS B 48 15.179 12.912 -3.780 1.00 0.00 H new ATOM 0 HA LYS B 48 16.463 14.532 -5.844 1.00 0.00 H new ATOM 0 HB2 LYS B 48 16.352 14.443 -2.840 1.00 0.00 H new ATOM 0 HB3 LYS B 48 17.788 15.131 -3.572 1.00 0.00 H new ATOM 0 HG2 LYS B 48 15.004 16.054 -4.340 1.00 0.00 H new ATOM 0 HG3 LYS B 48 15.864 16.736 -2.973 1.00 0.00 H new ATOM 0 HD2 LYS B 48 16.816 16.715 -5.866 1.00 0.00 H new ATOM 0 HD3 LYS B 48 16.220 18.107 -4.984 1.00 0.00 H new ATOM 0 HE2 LYS B 48 18.110 17.867 -3.361 1.00 0.00 H new ATOM 0 HE3 LYS B 48 18.715 16.506 -4.284 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 19.861 18.541 -4.871 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 18.984 17.964 -6.206 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 18.398 19.283 -5.311 1.00 0.00 H new ATOM 2212 N LYS B 49 17.929 12.047 -4.280 1.00 0.00 N ATOM 2213 CA LYS B 49 19.098 11.175 -4.298 1.00 0.00 C ATOM 2214 C LYS B 49 19.100 10.251 -5.513 1.00 0.00 C ATOM 2215 O LYS B 49 20.149 9.747 -5.912 1.00 0.00 O ATOM 2216 CB LYS B 49 19.155 10.342 -3.016 1.00 0.00 C ATOM 2217 CG LYS B 49 20.564 9.959 -2.601 1.00 0.00 C ATOM 2218 CD LYS B 49 20.644 8.501 -2.179 1.00 0.00 C ATOM 2219 CE LYS B 49 22.075 7.989 -2.215 1.00 0.00 C ATOM 2220 NZ LYS B 49 22.936 8.674 -1.214 1.00 0.00 N ATOM 0 H LYS B 49 17.195 11.757 -3.634 1.00 0.00 H new ATOM 0 HA LYS B 49 19.980 11.813 -4.361 1.00 0.00 H new ATOM 0 HB2 LYS B 49 18.687 10.903 -2.207 1.00 0.00 H new ATOM 0 HB3 LYS B 49 18.567 9.435 -3.156 1.00 0.00 H new ATOM 0 HG2 LYS B 49 21.249 10.137 -3.430 1.00 0.00 H new ATOM 0 HG3 LYS B 49 20.887 10.595 -1.777 1.00 0.00 H new ATOM 0 HD2 LYS B 49 20.242 8.390 -1.172 1.00 0.00 H new ATOM 0 HD3 LYS B 49 20.023 7.895 -2.839 1.00 0.00 H new ATOM 0 HE2 LYS B 49 22.081 6.916 -2.025 1.00 0.00 H new ATOM 0 HE3 LYS B 49 22.489 8.138 -3.212 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 23.895 8.272 -1.248 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 22.979 9.690 -1.430 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 22.538 8.539 -0.263 1.00 0.00 H new ATOM 2234 N TYR B 50 17.926 10.017 -6.090 1.00 0.00 N ATOM 2235 CA TYR B 50 17.819 9.135 -7.248 1.00 0.00 C ATOM 2236 C TYR B 50 17.240 9.857 -8.462 1.00 0.00 C ATOM 2237 O TYR B 50 17.951 10.120 -9.432 1.00 0.00 O ATOM 2238 CB TYR B 50 16.958 7.918 -6.905 1.00 0.00 C ATOM 2239 CG TYR B 50 17.494 7.103 -5.750 1.00 0.00 C ATOM 2240 CD1 TYR B 50 17.208 7.454 -4.436 1.00 0.00 C ATOM 2241 CD2 TYR B 50 18.284 5.983 -5.972 1.00 0.00 C ATOM 2242 CE1 TYR B 50 17.696 6.712 -3.378 1.00 0.00 C ATOM 2243 CE2 TYR B 50 18.776 5.234 -4.918 1.00 0.00 C ATOM 2244 CZ TYR B 50 18.479 5.604 -3.623 1.00 0.00 C ATOM 2245 OH TYR B 50 18.965 4.863 -2.571 1.00 0.00 O ATOM 0 H TYR B 50 17.043 10.421 -5.779 1.00 0.00 H new ATOM 0 HA TYR B 50 18.826 8.808 -7.506 1.00 0.00 H new ATOM 0 HB2 TYR B 50 15.949 8.253 -6.665 1.00 0.00 H new ATOM 0 HB3 TYR B 50 16.880 7.279 -7.785 1.00 0.00 H new ATOM 0 HD1 TYR B 50 16.594 8.321 -4.239 1.00 0.00 H new ATOM 0 HD2 TYR B 50 18.519 5.691 -6.985 1.00 0.00 H new ATOM 0 HE1 TYR B 50 17.465 6.999 -2.363 1.00 0.00 H new ATOM 0 HE2 TYR B 50 19.389 4.365 -5.108 1.00 0.00 H new ATOM 0 HH TYR B 50 19.795 5.267 -2.242 1.00 0.00 H new ATOM 2255 N ASN B 51 15.945 10.165 -8.403 1.00 0.00 N ATOM 2256 CA ASN B 51 15.256 10.842 -9.495 1.00 0.00 C ATOM 2257 C ASN B 51 13.756 10.590 -9.392 1.00 0.00 C ATOM 2258 O ASN B 51 13.307 9.445 -9.451 1.00 0.00 O ATOM 2259 CB ASN B 51 15.769 10.354 -10.853 1.00 0.00 C ATOM 2260 CG ASN B 51 15.881 11.477 -11.866 1.00 0.00 C ATOM 2261 OD1 ASN B 51 14.992 12.321 -11.975 1.00 0.00 O ATOM 2262 ND2 ASN B 51 16.977 11.490 -12.616 1.00 0.00 N ATOM 0 H ASN B 51 15.350 9.953 -7.602 1.00 0.00 H new ATOM 0 HA ASN B 51 15.455 11.911 -9.416 1.00 0.00 H new ATOM 0 HB2 ASN B 51 16.745 9.887 -10.723 1.00 0.00 H new ATOM 0 HB3 ASN B 51 15.097 9.587 -11.238 1.00 0.00 H new ATOM 0 HD21 ASN B 51 17.107 12.220 -13.316 1.00 0.00 H new ATOM 0 HD22 ASN B 51 17.689 10.770 -12.492 1.00 0.00 H new ATOM 2269 N PRO B 52 12.956 11.654 -9.225 1.00 0.00 N ATOM 2270 CA PRO B 52 11.503 11.532 -9.103 1.00 0.00 C ATOM 2271 C PRO B 52 10.874 10.743 -10.258 1.00 0.00 C ATOM 2272 O PRO B 52 11.532 10.493 -11.268 1.00 0.00 O ATOM 2273 CB PRO B 52 11.009 12.984 -9.112 1.00 0.00 C ATOM 2274 CG PRO B 52 12.170 13.799 -9.576 1.00 0.00 C ATOM 2275 CD PRO B 52 13.392 13.054 -9.136 1.00 0.00 C ATOM 0 HA PRO B 52 11.225 10.982 -8.204 1.00 0.00 H new ATOM 0 HB2 PRO B 52 10.155 13.103 -9.778 1.00 0.00 H new ATOM 0 HB3 PRO B 52 10.684 13.294 -8.119 1.00 0.00 H new ATOM 0 HG2 PRO B 52 12.155 13.920 -10.659 1.00 0.00 H new ATOM 0 HG3 PRO B 52 12.144 14.799 -9.143 1.00 0.00 H new ATOM 0 HD2 PRO B 52 14.246 13.256 -9.783 1.00 0.00 H new ATOM 0 HD3 PRO B 52 13.689 13.323 -8.123 1.00 0.00 H new ATOM 2283 N THR B 53 9.598 10.348 -10.112 1.00 0.00 N ATOM 2284 CA THR B 53 8.810 10.642 -8.915 1.00 0.00 C ATOM 2285 C THR B 53 8.670 9.400 -8.050 1.00 0.00 C ATOM 2286 O THR B 53 8.343 8.321 -8.544 1.00 0.00 O ATOM 2287 CB THR B 53 7.429 11.178 -9.296 1.00 0.00 C ATOM 2288 OG1 THR B 53 7.526 12.496 -9.807 1.00 0.00 O ATOM 2289 CG2 THR B 53 6.456 11.206 -8.137 1.00 0.00 C ATOM 0 H THR B 53 9.090 9.818 -10.821 1.00 0.00 H new ATOM 0 HA THR B 53 9.334 11.408 -8.343 1.00 0.00 H new ATOM 0 HB THR B 53 7.050 10.488 -10.050 1.00 0.00 H new ATOM 0 HG1 THR B 53 6.633 12.821 -10.047 1.00 0.00 H new ATOM 0 HG21 THR B 53 5.497 11.597 -8.477 1.00 0.00 H new ATOM 0 HG22 THR B 53 6.320 10.196 -7.751 1.00 0.00 H new ATOM 0 HG23 THR B 53 6.849 11.846 -7.347 1.00 0.00 H new ATOM 2297 N TRP B 54 8.938 9.556 -6.763 1.00 0.00 N ATOM 2298 CA TRP B 54 8.858 8.441 -5.835 1.00 0.00 C ATOM 2299 C TRP B 54 7.624 8.529 -4.947 1.00 0.00 C ATOM 2300 O TRP B 54 7.264 9.598 -4.455 1.00 0.00 O ATOM 2301 CB TRP B 54 10.115 8.390 -4.968 1.00 0.00 C ATOM 2302 CG TRP B 54 11.367 8.184 -5.760 1.00 0.00 C ATOM 2303 CD1 TRP B 54 12.014 9.111 -6.525 1.00 0.00 C ATOM 2304 CD2 TRP B 54 12.121 6.973 -5.868 1.00 0.00 C ATOM 2305 NE1 TRP B 54 13.124 8.548 -7.105 1.00 0.00 N ATOM 2306 CE2 TRP B 54 13.214 7.238 -6.715 1.00 0.00 C ATOM 2307 CE3 TRP B 54 11.979 5.691 -5.331 1.00 0.00 C ATOM 2308 CZ2 TRP B 54 14.159 6.267 -7.036 1.00 0.00 C ATOM 2309 CZ3 TRP B 54 12.916 4.727 -5.650 1.00 0.00 C ATOM 2310 CH2 TRP B 54 13.994 5.020 -6.495 1.00 0.00 C ATOM 0 H TRP B 54 9.212 10.442 -6.339 1.00 0.00 H new ATOM 0 HA TRP B 54 8.780 7.528 -6.425 1.00 0.00 H new ATOM 0 HB2 TRP B 54 10.198 9.319 -4.404 1.00 0.00 H new ATOM 0 HB3 TRP B 54 10.015 7.584 -4.241 1.00 0.00 H new ATOM 0 HD1 TRP B 54 11.699 10.136 -6.655 1.00 0.00 H new ATOM 0 HE1 TRP B 54 13.776 9.028 -7.726 1.00 0.00 H new ATOM 0 HE3 TRP B 54 11.151 5.458 -4.678 1.00 0.00 H new ATOM 0 HZ2 TRP B 54 14.991 6.489 -7.688 1.00 0.00 H new ATOM 0 HZ3 TRP B 54 12.816 3.732 -5.242 1.00 0.00 H new ATOM 0 HH2 TRP B 54 14.711 4.245 -6.725 1.00 0.00 H new ATOM 2321 N HIS B 55 7.003 7.380 -4.732 1.00 0.00 N ATOM 2322 CA HIS B 55 5.824 7.274 -3.885 1.00 0.00 C ATOM 2323 C HIS B 55 6.038 6.142 -2.894 1.00 0.00 C ATOM 2324 O HIS B 55 5.886 4.969 -3.235 1.00 0.00 O ATOM 2325 CB HIS B 55 4.574 7.019 -4.726 1.00 0.00 C ATOM 2326 CG HIS B 55 4.591 7.721 -6.048 1.00 0.00 C ATOM 2327 ND1 HIS B 55 3.521 8.444 -6.530 1.00 0.00 N ATOM 2328 CD2 HIS B 55 5.559 7.811 -6.991 1.00 0.00 C ATOM 2329 CE1 HIS B 55 3.828 8.948 -7.712 1.00 0.00 C ATOM 2330 NE2 HIS B 55 5.058 8.579 -8.014 1.00 0.00 N ATOM 0 H HIS B 55 7.302 6.494 -5.140 1.00 0.00 H new ATOM 0 HA HIS B 55 5.676 8.211 -3.349 1.00 0.00 H new ATOM 0 HB2 HIS B 55 4.471 5.947 -4.894 1.00 0.00 H new ATOM 0 HB3 HIS B 55 3.696 7.339 -4.165 1.00 0.00 H new ATOM 0 HD1 HIS B 55 2.631 8.570 -6.049 1.00 0.00 H new ATOM 0 HD2 HIS B 55 6.541 7.363 -6.947 1.00 0.00 H new ATOM 0 HE1 HIS B 55 3.182 9.558 -8.326 1.00 0.00 H new ATOM 2339 N CYS B 56 6.436 6.494 -1.679 1.00 0.00 N ATOM 2340 CA CYS B 56 6.718 5.491 -0.663 1.00 0.00 C ATOM 2341 C CYS B 56 5.833 5.642 0.565 1.00 0.00 C ATOM 2342 O CYS B 56 5.240 6.694 0.804 1.00 0.00 O ATOM 2343 CB CYS B 56 8.185 5.577 -0.250 1.00 0.00 C ATOM 2344 SG CYS B 56 8.969 7.158 -0.645 1.00 0.00 S ATOM 0 H CYS B 56 6.570 7.458 -1.375 1.00 0.00 H new ATOM 0 HA CYS B 56 6.504 4.516 -1.101 1.00 0.00 H new ATOM 0 HB2 CYS B 56 8.260 5.404 0.824 1.00 0.00 H new ATOM 0 HB3 CYS B 56 8.738 4.776 -0.741 1.00 0.00 H new ATOM 0 HG CYS B 56 10.254 7.060 -0.473 1.00 0.00 H new ATOM 2350 N ILE B 57 5.772 4.571 1.345 1.00 0.00 N ATOM 2351 CA ILE B 57 4.984 4.547 2.570 1.00 0.00 C ATOM 2352 C ILE B 57 5.839 4.081 3.744 1.00 0.00 C ATOM 2353 O ILE B 57 6.900 3.488 3.551 1.00 0.00 O ATOM 2354 CB ILE B 57 3.765 3.614 2.439 1.00 0.00 C ATOM 2355 CG1 ILE B 57 3.050 3.858 1.109 1.00 0.00 C ATOM 2356 CG2 ILE B 57 2.813 3.816 3.609 1.00 0.00 C ATOM 2357 CD1 ILE B 57 2.487 5.254 0.974 1.00 0.00 C ATOM 0 H ILE B 57 6.264 3.699 1.148 1.00 0.00 H new ATOM 0 HA ILE B 57 4.632 5.563 2.747 1.00 0.00 H new ATOM 0 HB ILE B 57 4.112 2.581 2.457 1.00 0.00 H new ATOM 0 HG12 ILE B 57 3.748 3.676 0.292 1.00 0.00 H new ATOM 0 HG13 ILE B 57 2.240 3.136 1.003 1.00 0.00 H new ATOM 0 HG21 ILE B 57 1.957 3.149 3.501 1.00 0.00 H new ATOM 0 HG22 ILE B 57 3.331 3.594 4.542 1.00 0.00 H new ATOM 0 HG23 ILE B 57 2.468 4.850 3.623 1.00 0.00 H new ATOM 0 HD11 ILE B 57 1.994 5.356 0.007 1.00 0.00 H new ATOM 0 HD12 ILE B 57 1.764 5.433 1.770 1.00 0.00 H new ATOM 0 HD13 ILE B 57 3.296 5.981 1.047 1.00 0.00 H new ATOM 2369 N VAL B 58 5.377 4.350 4.959 1.00 0.00 N ATOM 2370 CA VAL B 58 6.111 3.951 6.152 1.00 0.00 C ATOM 2371 C VAL B 58 5.204 3.919 7.376 1.00 0.00 C ATOM 2372 O VAL B 58 4.880 4.960 7.949 1.00 0.00 O ATOM 2373 CB VAL B 58 7.296 4.892 6.427 1.00 0.00 C ATOM 2374 CG1 VAL B 58 6.823 6.334 6.486 1.00 0.00 C ATOM 2375 CG2 VAL B 58 8.004 4.501 7.714 1.00 0.00 C ATOM 0 H VAL B 58 4.502 4.840 5.143 1.00 0.00 H new ATOM 0 HA VAL B 58 6.492 2.948 5.963 1.00 0.00 H new ATOM 0 HB VAL B 58 8.010 4.799 5.608 1.00 0.00 H new ATOM 0 HG11 VAL B 58 7.673 6.988 6.681 1.00 0.00 H new ATOM 0 HG12 VAL B 58 6.367 6.606 5.534 1.00 0.00 H new ATOM 0 HG13 VAL B 58 6.090 6.444 7.285 1.00 0.00 H new ATOM 0 HG21 VAL B 58 8.839 5.179 7.890 1.00 0.00 H new ATOM 0 HG22 VAL B 58 7.304 4.563 8.547 1.00 0.00 H new ATOM 0 HG23 VAL B 58 8.377 3.480 7.628 1.00 0.00 H new ATOM 2385 N GLY B 59 4.801 2.718 7.771 1.00 0.00 N ATOM 2386 CA GLY B 59 3.938 2.567 8.925 1.00 0.00 C ATOM 2387 C GLY B 59 4.373 1.422 9.816 1.00 0.00 C ATOM 2388 O GLY B 59 5.512 1.385 10.278 1.00 0.00 O ATOM 0 H GLY B 59 5.057 1.844 7.311 1.00 0.00 H new ATOM 0 HA2 GLY B 59 3.937 3.493 9.500 1.00 0.00 H new ATOM 0 HA3 GLY B 59 2.914 2.398 8.592 1.00 0.00 H new ATOM 2392 N ARG B 60 3.463 0.486 10.060 1.00 0.00 N ATOM 2393 CA ARG B 60 3.758 -0.657 10.902 1.00 0.00 C ATOM 2394 C ARG B 60 2.597 -1.646 10.916 1.00 0.00 C ATOM 2395 O ARG B 60 2.796 -2.853 10.781 1.00 0.00 O ATOM 2396 CB ARG B 60 4.057 -0.181 12.314 1.00 0.00 C ATOM 2397 CG ARG B 60 3.030 0.800 12.855 1.00 0.00 C ATOM 2398 CD ARG B 60 3.536 1.501 14.105 1.00 0.00 C ATOM 2399 NE ARG B 60 3.728 0.572 15.216 1.00 0.00 N ATOM 2400 CZ ARG B 60 2.727 -0.016 15.863 1.00 0.00 C ATOM 2401 NH1 ARG B 60 1.474 0.228 15.506 1.00 0.00 N ATOM 2402 NH2 ARG B 60 2.976 -0.848 16.866 1.00 0.00 N ATOM 0 H ARG B 60 2.515 0.500 9.684 1.00 0.00 H new ATOM 0 HA ARG B 60 4.629 -1.171 10.496 1.00 0.00 H new ATOM 0 HB2 ARG B 60 4.107 -1.045 12.977 1.00 0.00 H new ATOM 0 HB3 ARG B 60 5.040 0.290 12.329 1.00 0.00 H new ATOM 0 HG2 ARG B 60 2.795 1.541 12.091 1.00 0.00 H new ATOM 0 HG3 ARG B 60 2.104 0.271 13.082 1.00 0.00 H new ATOM 0 HD2 ARG B 60 4.479 2.000 13.883 1.00 0.00 H new ATOM 0 HD3 ARG B 60 2.827 2.275 14.398 1.00 0.00 H new ATOM 0 HE ARG B 60 4.682 0.363 15.511 1.00 0.00 H new ATOM 0 HH11 ARG B 60 1.279 0.867 14.735 1.00 0.00 H new ATOM 0 HH12 ARG B 60 0.705 -0.223 16.002 1.00 0.00 H new ATOM 0 HH21 ARG B 60 3.939 -1.039 17.143 1.00 0.00 H new ATOM 0 HH22 ARG B 60 2.205 -1.297 17.360 1.00 0.00 H new ATOM 2416 N ASN B 61 1.384 -1.128 11.085 1.00 0.00 N ATOM 2417 CA ASN B 61 0.195 -1.972 11.122 1.00 0.00 C ATOM 2418 C ASN B 61 -0.904 -1.418 10.221 1.00 0.00 C ATOM 2419 O ASN B 61 -2.038 -1.227 10.661 1.00 0.00 O ATOM 2420 CB ASN B 61 -0.322 -2.090 12.558 1.00 0.00 C ATOM 2421 CG ASN B 61 0.297 -3.255 13.304 1.00 0.00 C ATOM 2422 OD1 ASN B 61 0.298 -4.388 12.822 1.00 0.00 O ATOM 2423 ND2 ASN B 61 0.827 -2.981 14.489 1.00 0.00 N ATOM 0 H ASN B 61 1.199 -0.131 11.198 1.00 0.00 H new ATOM 0 HA ASN B 61 0.473 -2.960 10.754 1.00 0.00 H new ATOM 0 HB2 ASN B 61 -0.109 -1.165 13.094 1.00 0.00 H new ATOM 0 HB3 ASN B 61 -1.406 -2.207 12.542 1.00 0.00 H new ATOM 0 HD21 ASN B 61 1.258 -3.724 15.039 1.00 0.00 H new ATOM 0 HD22 ASN B 61 0.804 -2.027 14.850 1.00 0.00 H new ATOM 2430 N PHE B 62 -0.568 -1.166 8.960 1.00 0.00 N ATOM 2431 CA PHE B 62 -1.534 -0.640 8.008 1.00 0.00 C ATOM 2432 C PHE B 62 -1.821 -1.662 6.913 1.00 0.00 C ATOM 2433 O PHE B 62 -1.673 -2.867 7.118 1.00 0.00 O ATOM 2434 CB PHE B 62 -1.008 0.653 7.387 1.00 0.00 C ATOM 2435 CG PHE B 62 0.073 0.422 6.373 1.00 0.00 C ATOM 2436 CD1 PHE B 62 1.074 -0.506 6.609 1.00 0.00 C ATOM 2437 CD2 PHE B 62 0.085 1.128 5.185 1.00 0.00 C ATOM 2438 CE1 PHE B 62 2.067 -0.725 5.675 1.00 0.00 C ATOM 2439 CE2 PHE B 62 1.076 0.915 4.246 1.00 0.00 C ATOM 2440 CZ PHE B 62 2.069 -0.013 4.491 1.00 0.00 C ATOM 0 H PHE B 62 0.365 -1.318 8.576 1.00 0.00 H new ATOM 0 HA PHE B 62 -2.462 -0.430 8.540 1.00 0.00 H new ATOM 0 HB2 PHE B 62 -1.834 1.184 6.914 1.00 0.00 H new ATOM 0 HB3 PHE B 62 -0.625 1.299 8.177 1.00 0.00 H new ATOM 0 HD1 PHE B 62 1.078 -1.064 7.534 1.00 0.00 H new ATOM 0 HD2 PHE B 62 -0.689 1.855 4.988 1.00 0.00 H new ATOM 0 HE1 PHE B 62 2.841 -1.452 5.870 1.00 0.00 H new ATOM 0 HE2 PHE B 62 1.074 1.474 3.322 1.00 0.00 H new ATOM 0 HZ PHE B 62 2.845 -0.182 3.759 1.00 0.00 H new ATOM 2450 N GLY B 63 -2.227 -1.171 5.748 1.00 0.00 N ATOM 2451 CA GLY B 63 -2.526 -2.045 4.632 1.00 0.00 C ATOM 2452 C GLY B 63 -2.362 -1.335 3.307 1.00 0.00 C ATOM 2453 O GLY B 63 -3.204 -0.527 2.922 1.00 0.00 O ATOM 0 H GLY B 63 -2.355 -0.177 5.557 1.00 0.00 H new ATOM 0 HA2 GLY B 63 -1.868 -2.914 4.663 1.00 0.00 H new ATOM 0 HA3 GLY B 63 -3.547 -2.415 4.723 1.00 0.00 H new ATOM 2457 N SER B 64 -1.269 -1.623 2.614 1.00 0.00 N ATOM 2458 CA SER B 64 -0.999 -0.985 1.331 1.00 0.00 C ATOM 2459 C SER B 64 -1.457 -1.856 0.167 1.00 0.00 C ATOM 2460 O SER B 64 -1.255 -3.070 0.163 1.00 0.00 O ATOM 2461 CB SER B 64 0.493 -0.675 1.194 1.00 0.00 C ATOM 2462 OG SER B 64 1.150 -1.660 0.415 1.00 0.00 O ATOM 0 H SER B 64 -0.558 -2.290 2.915 1.00 0.00 H new ATOM 0 HA SER B 64 -1.564 -0.054 1.300 1.00 0.00 H new ATOM 0 HB2 SER B 64 0.623 0.304 0.733 1.00 0.00 H new ATOM 0 HB3 SER B 64 0.949 -0.625 2.183 1.00 0.00 H new ATOM 0 HG SER B 64 1.461 -2.384 0.998 1.00 0.00 H new ATOM 2468 N TYR B 65 -2.070 -1.217 -0.823 1.00 0.00 N ATOM 2469 CA TYR B 65 -2.557 -1.912 -2.007 1.00 0.00 C ATOM 2470 C TYR B 65 -2.376 -1.037 -3.241 1.00 0.00 C ATOM 2471 O TYR B 65 -3.316 -0.809 -4.002 1.00 0.00 O ATOM 2472 CB TYR B 65 -4.029 -2.288 -1.839 1.00 0.00 C ATOM 2473 CG TYR B 65 -4.309 -3.746 -2.109 1.00 0.00 C ATOM 2474 CD1 TYR B 65 -4.049 -4.712 -1.145 1.00 0.00 C ATOM 2475 CD2 TYR B 65 -4.826 -4.160 -3.329 1.00 0.00 C ATOM 2476 CE1 TYR B 65 -4.296 -6.048 -1.391 1.00 0.00 C ATOM 2477 CE2 TYR B 65 -5.078 -5.493 -3.582 1.00 0.00 C ATOM 2478 CZ TYR B 65 -4.810 -6.435 -2.610 1.00 0.00 C ATOM 2479 OH TYR B 65 -5.057 -7.766 -2.859 1.00 0.00 O ATOM 0 H TYR B 65 -2.242 -0.212 -0.828 1.00 0.00 H new ATOM 0 HA TYR B 65 -1.978 -2.827 -2.135 1.00 0.00 H new ATOM 0 HB2 TYR B 65 -4.344 -2.047 -0.824 1.00 0.00 H new ATOM 0 HB3 TYR B 65 -4.631 -1.679 -2.513 1.00 0.00 H new ATOM 0 HD1 TYR B 65 -3.647 -4.413 -0.188 1.00 0.00 H new ATOM 0 HD2 TYR B 65 -5.035 -3.426 -4.093 1.00 0.00 H new ATOM 0 HE1 TYR B 65 -4.087 -6.787 -0.631 1.00 0.00 H new ATOM 0 HE2 TYR B 65 -5.483 -5.797 -4.536 1.00 0.00 H new ATOM 0 HH TYR B 65 -5.419 -7.868 -3.764 1.00 0.00 H new ATOM 2489 N VAL B 66 -1.157 -0.540 -3.422 1.00 0.00 N ATOM 2490 CA VAL B 66 -0.838 0.323 -4.551 1.00 0.00 C ATOM 2491 C VAL B 66 -0.148 -0.452 -5.667 1.00 0.00 C ATOM 2492 O VAL B 66 0.701 -1.307 -5.412 1.00 0.00 O ATOM 2493 CB VAL B 66 0.067 1.492 -4.117 1.00 0.00 C ATOM 2494 CG1 VAL B 66 -0.488 2.163 -2.871 1.00 0.00 C ATOM 2495 CG2 VAL B 66 1.491 1.007 -3.879 1.00 0.00 C ATOM 0 H VAL B 66 -0.371 -0.722 -2.798 1.00 0.00 H new ATOM 0 HA VAL B 66 -1.783 0.717 -4.925 1.00 0.00 H new ATOM 0 HB VAL B 66 0.087 2.228 -4.921 1.00 0.00 H new ATOM 0 HG11 VAL B 66 0.165 2.986 -2.580 1.00 0.00 H new ATOM 0 HG12 VAL B 66 -1.486 2.548 -3.079 1.00 0.00 H new ATOM 0 HG13 VAL B 66 -0.541 1.437 -2.060 1.00 0.00 H new ATOM 0 HG21 VAL B 66 2.115 1.847 -3.573 1.00 0.00 H new ATOM 0 HG22 VAL B 66 1.491 0.250 -3.095 1.00 0.00 H new ATOM 0 HG23 VAL B 66 1.887 0.576 -4.799 1.00 0.00 H new ATOM 2505 N THR B 67 -0.515 -0.143 -6.907 1.00 0.00 N ATOM 2506 CA THR B 67 0.073 -0.805 -8.066 1.00 0.00 C ATOM 2507 C THR B 67 1.470 -0.263 -8.350 1.00 0.00 C ATOM 2508 O THR B 67 1.707 0.942 -8.269 1.00 0.00 O ATOM 2509 CB THR B 67 -0.821 -0.617 -9.292 1.00 0.00 C ATOM 2510 OG1 THR B 67 -0.568 -1.621 -10.258 1.00 0.00 O ATOM 2511 CG2 THR B 67 -0.633 0.724 -9.963 1.00 0.00 C ATOM 0 H THR B 67 -1.217 0.561 -7.135 1.00 0.00 H new ATOM 0 HA THR B 67 0.155 -1.869 -7.845 1.00 0.00 H new ATOM 0 HB THR B 67 -1.843 -0.681 -8.919 1.00 0.00 H new ATOM 0 HG1 THR B 67 -1.151 -1.483 -11.033 1.00 0.00 H new ATOM 0 HG21 THR B 67 -1.295 0.795 -10.826 1.00 0.00 H new ATOM 0 HG22 THR B 67 -0.869 1.520 -9.257 1.00 0.00 H new ATOM 0 HG23 THR B 67 0.402 0.825 -10.291 1.00 0.00 H new ATOM 2519 N HIS B 68 2.394 -1.159 -8.681 1.00 0.00 N ATOM 2520 CA HIS B 68 3.766 -0.766 -8.974 1.00 0.00 C ATOM 2521 C HIS B 68 4.086 -0.954 -10.454 1.00 0.00 C ATOM 2522 O HIS B 68 3.420 -1.719 -11.153 1.00 0.00 O ATOM 2523 CB HIS B 68 4.743 -1.576 -8.121 1.00 0.00 C ATOM 2524 CG HIS B 68 4.927 -2.984 -8.596 1.00 0.00 C ATOM 2525 ND1 HIS B 68 3.894 -3.894 -8.678 1.00 0.00 N ATOM 2526 CD2 HIS B 68 6.035 -3.636 -9.020 1.00 0.00 C ATOM 2527 CE1 HIS B 68 4.359 -5.046 -9.131 1.00 0.00 C ATOM 2528 NE2 HIS B 68 5.654 -4.914 -9.346 1.00 0.00 N ATOM 0 H HIS B 68 2.217 -2.161 -8.753 1.00 0.00 H new ATOM 0 HA HIS B 68 3.873 0.291 -8.732 1.00 0.00 H new ATOM 0 HB2 HIS B 68 5.710 -1.074 -8.115 1.00 0.00 H new ATOM 0 HB3 HIS B 68 4.386 -1.592 -7.091 1.00 0.00 H new ATOM 0 HD2 HIS B 68 7.032 -3.227 -9.089 1.00 0.00 H new ATOM 0 HE1 HIS B 68 3.778 -5.941 -9.297 1.00 0.00 H new ATOM 0 HE2 HIS B 68 6.273 -5.644 -9.698 1.00 0.00 H new ATOM 2537 N GLU B 69 5.112 -0.252 -10.922 1.00 0.00 N ATOM 2538 CA GLU B 69 5.528 -0.338 -12.316 1.00 0.00 C ATOM 2539 C GLU B 69 6.975 0.113 -12.474 1.00 0.00 C ATOM 2540 O GLU B 69 7.611 0.541 -11.510 1.00 0.00 O ATOM 2541 CB GLU B 69 4.616 0.517 -13.199 1.00 0.00 C ATOM 2542 CG GLU B 69 4.401 1.924 -12.667 1.00 0.00 C ATOM 2543 CD GLU B 69 4.240 2.947 -13.773 1.00 0.00 C ATOM 2544 OE1 GLU B 69 5.268 3.382 -14.334 1.00 0.00 O ATOM 2545 OE2 GLU B 69 3.086 3.316 -14.078 1.00 0.00 O ATOM 0 H GLU B 69 5.672 0.384 -10.354 1.00 0.00 H new ATOM 0 HA GLU B 69 5.450 -1.379 -12.630 1.00 0.00 H new ATOM 0 HB2 GLU B 69 5.045 0.577 -14.199 1.00 0.00 H new ATOM 0 HB3 GLU B 69 3.650 0.022 -13.296 1.00 0.00 H new ATOM 0 HG2 GLU B 69 3.514 1.937 -12.033 1.00 0.00 H new ATOM 0 HG3 GLU B 69 5.246 2.204 -12.038 1.00 0.00 H new ATOM 2552 N THR B 70 7.491 0.015 -13.694 1.00 0.00 N ATOM 2553 CA THR B 70 8.864 0.413 -13.977 1.00 0.00 C ATOM 2554 C THR B 70 9.856 -0.504 -13.267 1.00 0.00 C ATOM 2555 O THR B 70 10.239 -1.546 -13.798 1.00 0.00 O ATOM 2556 CB THR B 70 9.093 1.863 -13.552 1.00 0.00 C ATOM 2557 OG1 THR B 70 7.873 2.582 -13.544 1.00 0.00 O ATOM 2558 CG2 THR B 70 10.056 2.604 -14.454 1.00 0.00 C ATOM 0 H THR B 70 6.979 -0.337 -14.503 1.00 0.00 H new ATOM 0 HA THR B 70 9.027 0.327 -15.051 1.00 0.00 H new ATOM 0 HB THR B 70 9.525 1.807 -12.553 1.00 0.00 H new ATOM 0 HG1 THR B 70 8.040 3.507 -13.268 1.00 0.00 H new ATOM 0 HG21 THR B 70 10.175 3.627 -14.097 1.00 0.00 H new ATOM 0 HG22 THR B 70 11.023 2.102 -14.444 1.00 0.00 H new ATOM 0 HG23 THR B 70 9.665 2.618 -15.471 1.00 0.00 H new ATOM 2566 N LYS B 71 10.272 -0.110 -12.067 1.00 0.00 N ATOM 2567 CA LYS B 71 11.221 -0.902 -11.295 1.00 0.00 C ATOM 2568 C LYS B 71 11.813 -0.083 -10.155 1.00 0.00 C ATOM 2569 O LYS B 71 13.018 -0.129 -9.905 1.00 0.00 O ATOM 2570 CB LYS B 71 12.339 -1.417 -12.201 1.00 0.00 C ATOM 2571 CG LYS B 71 12.749 -0.426 -13.278 1.00 0.00 C ATOM 2572 CD LYS B 71 13.689 -1.060 -14.288 1.00 0.00 C ATOM 2573 CE LYS B 71 14.690 -0.049 -14.823 1.00 0.00 C ATOM 2574 NZ LYS B 71 14.270 0.502 -16.140 1.00 0.00 N ATOM 0 H LYS B 71 9.968 0.750 -11.610 1.00 0.00 H new ATOM 0 HA LYS B 71 10.686 -1.751 -10.868 1.00 0.00 H new ATOM 0 HB2 LYS B 71 13.209 -1.659 -11.590 1.00 0.00 H new ATOM 0 HB3 LYS B 71 12.015 -2.343 -12.675 1.00 0.00 H new ATOM 0 HG2 LYS B 71 11.861 -0.054 -13.789 1.00 0.00 H new ATOM 0 HG3 LYS B 71 13.235 0.434 -12.817 1.00 0.00 H new ATOM 0 HD2 LYS B 71 14.221 -1.890 -13.822 1.00 0.00 H new ATOM 0 HD3 LYS B 71 13.112 -1.475 -15.114 1.00 0.00 H new ATOM 0 HE2 LYS B 71 14.802 0.766 -14.107 1.00 0.00 H new ATOM 0 HE3 LYS B 71 15.667 -0.522 -14.922 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 14.978 1.188 -16.471 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 14.188 -0.272 -16.830 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 13.350 0.976 -16.040 1.00 0.00 H new ATOM 2588 N HIS B 72 10.960 0.666 -9.467 1.00 0.00 N ATOM 2589 CA HIS B 72 11.399 1.494 -8.352 1.00 0.00 C ATOM 2590 C HIS B 72 10.461 1.336 -7.161 1.00 0.00 C ATOM 2591 O HIS B 72 10.043 2.320 -6.552 1.00 0.00 O ATOM 2592 CB HIS B 72 11.467 2.962 -8.775 1.00 0.00 C ATOM 2593 CG HIS B 72 12.565 3.250 -9.753 1.00 0.00 C ATOM 2594 ND1 HIS B 72 13.839 3.611 -9.370 1.00 0.00 N ATOM 2595 CD2 HIS B 72 12.573 3.226 -11.107 1.00 0.00 C ATOM 2596 CE1 HIS B 72 14.583 3.797 -10.444 1.00 0.00 C ATOM 2597 NE2 HIS B 72 13.840 3.571 -11.511 1.00 0.00 N ATOM 0 H HIS B 72 9.960 0.717 -9.662 1.00 0.00 H new ATOM 0 HA HIS B 72 12.395 1.165 -8.054 1.00 0.00 H new ATOM 0 HB2 HIS B 72 10.513 3.250 -9.216 1.00 0.00 H new ATOM 0 HB3 HIS B 72 11.608 3.581 -7.889 1.00 0.00 H new ATOM 0 HD1 HIS B 72 14.157 3.718 -8.407 1.00 0.00 H new ATOM 0 HD2 HIS B 72 11.740 2.981 -11.749 1.00 0.00 H new ATOM 0 HE1 HIS B 72 15.624 4.085 -10.449 1.00 0.00 H new ATOM 2606 N PHE B 73 10.137 0.088 -6.836 1.00 0.00 N ATOM 2607 CA PHE B 73 9.248 -0.205 -5.719 1.00 0.00 C ATOM 2608 C PHE B 73 9.897 -1.202 -4.767 1.00 0.00 C ATOM 2609 O PHE B 73 10.546 -2.153 -5.200 1.00 0.00 O ATOM 2610 CB PHE B 73 7.917 -0.757 -6.240 1.00 0.00 C ATOM 2611 CG PHE B 73 7.113 -1.488 -5.201 1.00 0.00 C ATOM 2612 CD1 PHE B 73 7.512 -2.735 -4.745 1.00 0.00 C ATOM 2613 CD2 PHE B 73 5.955 -0.929 -4.686 1.00 0.00 C ATOM 2614 CE1 PHE B 73 6.772 -3.409 -3.792 1.00 0.00 C ATOM 2615 CE2 PHE B 73 5.211 -1.598 -3.733 1.00 0.00 C ATOM 2616 CZ PHE B 73 5.619 -2.840 -3.285 1.00 0.00 C ATOM 0 H PHE B 73 10.477 -0.736 -7.331 1.00 0.00 H new ATOM 0 HA PHE B 73 9.058 0.719 -5.172 1.00 0.00 H new ATOM 0 HB2 PHE B 73 7.322 0.067 -6.633 1.00 0.00 H new ATOM 0 HB3 PHE B 73 8.116 -1.432 -7.073 1.00 0.00 H new ATOM 0 HD1 PHE B 73 8.411 -3.185 -5.139 1.00 0.00 H new ATOM 0 HD2 PHE B 73 5.630 0.041 -5.033 1.00 0.00 H new ATOM 0 HE1 PHE B 73 7.094 -4.379 -3.444 1.00 0.00 H new ATOM 0 HE2 PHE B 73 4.311 -1.150 -3.338 1.00 0.00 H new ATOM 0 HZ PHE B 73 5.038 -3.365 -2.541 1.00 0.00 H new ATOM 2626 N ILE B 74 9.719 -0.984 -3.468 1.00 0.00 N ATOM 2627 CA ILE B 74 10.290 -1.874 -2.468 1.00 0.00 C ATOM 2628 C ILE B 74 9.433 -1.927 -1.210 1.00 0.00 C ATOM 2629 O ILE B 74 9.080 -0.894 -0.640 1.00 0.00 O ATOM 2630 CB ILE B 74 11.718 -1.454 -2.070 1.00 0.00 C ATOM 2631 CG1 ILE B 74 12.405 -2.620 -1.326 1.00 0.00 C ATOM 2632 CG2 ILE B 74 11.670 -0.179 -1.231 1.00 0.00 C ATOM 2633 CD1 ILE B 74 13.471 -2.216 -0.325 1.00 0.00 C ATOM 0 H ILE B 74 9.186 -0.202 -3.086 1.00 0.00 H new ATOM 0 HA ILE B 74 10.323 -2.861 -2.930 1.00 0.00 H new ATOM 0 HB ILE B 74 12.309 -1.232 -2.959 1.00 0.00 H new ATOM 0 HG12 ILE B 74 11.641 -3.196 -0.804 1.00 0.00 H new ATOM 0 HG13 ILE B 74 12.856 -3.283 -2.064 1.00 0.00 H new ATOM 0 HG21 ILE B 74 12.683 0.112 -0.953 1.00 0.00 H new ATOM 0 HG22 ILE B 74 11.209 0.621 -1.810 1.00 0.00 H new ATOM 0 HG23 ILE B 74 11.084 -0.358 -0.330 1.00 0.00 H new ATOM 0 HD11 ILE B 74 13.889 -3.108 0.141 1.00 0.00 H new ATOM 0 HD12 ILE B 74 14.262 -1.669 -0.837 1.00 0.00 H new ATOM 0 HD13 ILE B 74 13.028 -1.580 0.442 1.00 0.00 H new ATOM 2645 N TYR B 75 9.116 -3.141 -0.774 1.00 0.00 N ATOM 2646 CA TYR B 75 8.317 -3.340 0.428 1.00 0.00 C ATOM 2647 C TYR B 75 9.156 -4.019 1.505 1.00 0.00 C ATOM 2648 O TYR B 75 9.859 -4.991 1.237 1.00 0.00 O ATOM 2649 CB TYR B 75 7.080 -4.185 0.116 1.00 0.00 C ATOM 2650 CG TYR B 75 5.926 -3.935 1.060 1.00 0.00 C ATOM 2651 CD1 TYR B 75 5.081 -2.848 0.882 1.00 0.00 C ATOM 2652 CD2 TYR B 75 5.682 -4.787 2.131 1.00 0.00 C ATOM 2653 CE1 TYR B 75 4.026 -2.615 1.744 1.00 0.00 C ATOM 2654 CE2 TYR B 75 4.629 -4.561 2.997 1.00 0.00 C ATOM 2655 CZ TYR B 75 3.804 -3.474 2.799 1.00 0.00 C ATOM 2656 OH TYR B 75 2.755 -3.246 3.659 1.00 0.00 O ATOM 0 H TYR B 75 9.401 -4.004 -1.237 1.00 0.00 H new ATOM 0 HA TYR B 75 7.989 -2.367 0.793 1.00 0.00 H new ATOM 0 HB2 TYR B 75 6.756 -3.978 -0.904 1.00 0.00 H new ATOM 0 HB3 TYR B 75 7.351 -5.240 0.157 1.00 0.00 H new ATOM 0 HD1 TYR B 75 5.251 -2.173 0.056 1.00 0.00 H new ATOM 0 HD2 TYR B 75 6.326 -5.640 2.289 1.00 0.00 H new ATOM 0 HE1 TYR B 75 3.379 -1.764 1.592 1.00 0.00 H new ATOM 0 HE2 TYR B 75 4.453 -5.232 3.825 1.00 0.00 H new ATOM 0 HH TYR B 75 2.753 -2.304 3.930 1.00 0.00 H new ATOM 2666 N PHE B 76 9.085 -3.494 2.722 1.00 0.00 N ATOM 2667 CA PHE B 76 9.849 -4.048 3.833 1.00 0.00 C ATOM 2668 C PHE B 76 9.340 -3.526 5.171 1.00 0.00 C ATOM 2669 O PHE B 76 8.527 -2.603 5.223 1.00 0.00 O ATOM 2670 CB PHE B 76 11.330 -3.703 3.678 1.00 0.00 C ATOM 2671 CG PHE B 76 11.580 -2.263 3.330 1.00 0.00 C ATOM 2672 CD1 PHE B 76 11.027 -1.707 2.187 1.00 0.00 C ATOM 2673 CD2 PHE B 76 12.371 -1.468 4.143 1.00 0.00 C ATOM 2674 CE1 PHE B 76 11.258 -0.383 1.863 1.00 0.00 C ATOM 2675 CE2 PHE B 76 12.606 -0.144 3.824 1.00 0.00 C ATOM 2676 CZ PHE B 76 12.049 0.399 2.683 1.00 0.00 C ATOM 0 H PHE B 76 8.508 -2.688 2.964 1.00 0.00 H new ATOM 0 HA PHE B 76 9.723 -5.131 3.816 1.00 0.00 H new ATOM 0 HB2 PHE B 76 11.848 -3.939 4.608 1.00 0.00 H new ATOM 0 HB3 PHE B 76 11.762 -4.336 2.903 1.00 0.00 H new ATOM 0 HD1 PHE B 76 10.409 -2.315 1.543 1.00 0.00 H new ATOM 0 HD2 PHE B 76 12.809 -1.888 5.036 1.00 0.00 H new ATOM 0 HE1 PHE B 76 10.821 0.040 0.970 1.00 0.00 H new ATOM 0 HE2 PHE B 76 13.225 0.465 4.466 1.00 0.00 H new ATOM 0 HZ PHE B 76 12.231 1.433 2.432 1.00 0.00 H new ATOM 2686 N TYR B 77 9.830 -4.124 6.251 1.00 0.00 N ATOM 2687 CA TYR B 77 9.432 -3.720 7.595 1.00 0.00 C ATOM 2688 C TYR B 77 10.651 -3.552 8.501 1.00 0.00 C ATOM 2689 O TYR B 77 11.373 -4.511 8.771 1.00 0.00 O ATOM 2690 CB TYR B 77 8.466 -4.746 8.194 1.00 0.00 C ATOM 2691 CG TYR B 77 8.353 -4.674 9.701 1.00 0.00 C ATOM 2692 CD1 TYR B 77 9.262 -5.335 10.518 1.00 0.00 C ATOM 2693 CD2 TYR B 77 7.336 -3.943 10.306 1.00 0.00 C ATOM 2694 CE1 TYR B 77 9.160 -5.270 11.895 1.00 0.00 C ATOM 2695 CE2 TYR B 77 7.229 -3.875 11.682 1.00 0.00 C ATOM 2696 CZ TYR B 77 8.144 -4.539 12.472 1.00 0.00 C ATOM 2697 OH TYR B 77 8.040 -4.473 13.841 1.00 0.00 O ATOM 0 H TYR B 77 10.503 -4.890 6.223 1.00 0.00 H new ATOM 0 HA TYR B 77 8.926 -2.757 7.523 1.00 0.00 H new ATOM 0 HB2 TYR B 77 7.478 -4.598 7.758 1.00 0.00 H new ATOM 0 HB3 TYR B 77 8.793 -5.747 7.911 1.00 0.00 H new ATOM 0 HD1 TYR B 77 10.060 -5.908 10.070 1.00 0.00 H new ATOM 0 HD2 TYR B 77 6.619 -3.420 9.691 1.00 0.00 H new ATOM 0 HE1 TYR B 77 9.874 -5.790 12.516 1.00 0.00 H new ATOM 0 HE2 TYR B 77 6.433 -3.305 12.137 1.00 0.00 H new ATOM 0 HH TYR B 77 8.916 -4.647 14.244 1.00 0.00 H new ATOM 2707 N LEU B 78 10.869 -2.326 8.969 1.00 0.00 N ATOM 2708 CA LEU B 78 11.995 -2.028 9.849 1.00 0.00 C ATOM 2709 C LEU B 78 11.791 -2.658 11.223 1.00 0.00 C ATOM 2710 O LEU B 78 10.695 -3.108 11.554 1.00 0.00 O ATOM 2711 CB LEU B 78 12.174 -0.516 9.987 1.00 0.00 C ATOM 2712 CG LEU B 78 12.983 0.149 8.871 1.00 0.00 C ATOM 2713 CD1 LEU B 78 14.461 -0.185 9.010 1.00 0.00 C ATOM 2714 CD2 LEU B 78 12.464 -0.281 7.507 1.00 0.00 C ATOM 0 H LEU B 78 10.280 -1.522 8.753 1.00 0.00 H new ATOM 0 HA LEU B 78 12.895 -2.453 9.405 1.00 0.00 H new ATOM 0 HB2 LEU B 78 11.189 -0.052 10.026 1.00 0.00 H new ATOM 0 HB3 LEU B 78 12.661 -0.309 10.940 1.00 0.00 H new ATOM 0 HG LEU B 78 12.866 1.229 8.959 1.00 0.00 H new ATOM 0 HD11 LEU B 78 15.020 0.297 8.208 1.00 0.00 H new ATOM 0 HD12 LEU B 78 14.826 0.173 9.972 1.00 0.00 H new ATOM 0 HD13 LEU B 78 14.597 -1.265 8.950 1.00 0.00 H new ATOM 0 HD21 LEU B 78 13.051 0.202 6.726 1.00 0.00 H new ATOM 0 HD22 LEU B 78 12.550 -1.363 7.410 1.00 0.00 H new ATOM 0 HD23 LEU B 78 11.418 0.010 7.407 1.00 0.00 H new ATOM 2726 N GLY B 79 12.857 -2.685 12.019 1.00 0.00 N ATOM 2727 CA GLY B 79 12.785 -3.263 13.349 1.00 0.00 C ATOM 2728 C GLY B 79 11.397 -3.174 13.959 1.00 0.00 C ATOM 2729 O GLY B 79 10.959 -4.092 14.652 1.00 0.00 O ATOM 0 H GLY B 79 13.773 -2.315 11.764 1.00 0.00 H new ATOM 0 HA2 GLY B 79 13.089 -4.309 13.302 1.00 0.00 H new ATOM 0 HA3 GLY B 79 13.496 -2.753 14.000 1.00 0.00 H new ATOM 2733 N GLN B 80 10.704 -2.068 13.704 1.00 0.00 N ATOM 2734 CA GLN B 80 9.361 -1.871 14.241 1.00 0.00 C ATOM 2735 C GLN B 80 8.554 -0.916 13.365 1.00 0.00 C ATOM 2736 O GLN B 80 7.797 -0.087 13.870 1.00 0.00 O ATOM 2737 CB GLN B 80 9.435 -1.329 15.671 1.00 0.00 C ATOM 2738 CG GLN B 80 10.623 -1.853 16.459 1.00 0.00 C ATOM 2739 CD GLN B 80 10.489 -1.607 17.950 1.00 0.00 C ATOM 2740 OE1 GLN B 80 10.907 -0.567 18.459 1.00 0.00 O ATOM 2741 NE2 GLN B 80 9.902 -2.566 18.657 1.00 0.00 N ATOM 0 H GLN B 80 11.048 -1.297 13.131 1.00 0.00 H new ATOM 0 HA GLN B 80 8.858 -2.838 14.250 1.00 0.00 H new ATOM 0 HB2 GLN B 80 9.484 -0.241 15.636 1.00 0.00 H new ATOM 0 HB3 GLN B 80 8.517 -1.590 16.197 1.00 0.00 H new ATOM 0 HG2 GLN B 80 10.730 -2.923 16.279 1.00 0.00 H new ATOM 0 HG3 GLN B 80 11.534 -1.376 16.096 1.00 0.00 H new ATOM 0 HE21 GLN B 80 9.571 -3.412 18.193 1.00 0.00 H new ATOM 0 HE22 GLN B 80 9.782 -2.457 19.664 1.00 0.00 H new ATOM 2750 N VAL B 81 8.723 -1.036 12.053 1.00 0.00 N ATOM 2751 CA VAL B 81 8.014 -0.180 11.110 1.00 0.00 C ATOM 2752 C VAL B 81 7.946 -0.823 9.728 1.00 0.00 C ATOM 2753 O VAL B 81 8.632 -1.806 9.457 1.00 0.00 O ATOM 2754 CB VAL B 81 8.696 1.196 10.999 1.00 0.00 C ATOM 2755 CG1 VAL B 81 8.107 2.004 9.852 1.00 0.00 C ATOM 2756 CG2 VAL B 81 8.576 1.954 12.311 1.00 0.00 C ATOM 0 H VAL B 81 9.345 -1.718 11.619 1.00 0.00 H new ATOM 0 HA VAL B 81 7.001 -0.048 11.489 1.00 0.00 H new ATOM 0 HB VAL B 81 9.754 1.038 10.788 1.00 0.00 H new ATOM 0 HG11 VAL B 81 8.606 2.972 9.795 1.00 0.00 H new ATOM 0 HG12 VAL B 81 8.252 1.465 8.916 1.00 0.00 H new ATOM 0 HG13 VAL B 81 7.041 2.155 10.023 1.00 0.00 H new ATOM 0 HG21 VAL B 81 9.063 2.925 12.216 1.00 0.00 H new ATOM 0 HG22 VAL B 81 7.523 2.098 12.553 1.00 0.00 H new ATOM 0 HG23 VAL B 81 9.056 1.383 13.106 1.00 0.00 H new ATOM 2766 N ALA B 82 7.117 -0.258 8.857 1.00 0.00 N ATOM 2767 CA ALA B 82 6.966 -0.771 7.503 1.00 0.00 C ATOM 2768 C ALA B 82 7.238 0.324 6.480 1.00 0.00 C ATOM 2769 O ALA B 82 7.192 1.511 6.804 1.00 0.00 O ATOM 2770 CB ALA B 82 5.574 -1.352 7.307 1.00 0.00 C ATOM 0 H ALA B 82 6.539 0.556 9.066 1.00 0.00 H new ATOM 0 HA ALA B 82 7.696 -1.566 7.354 1.00 0.00 H new ATOM 0 HB1 ALA B 82 5.478 -1.731 6.290 1.00 0.00 H new ATOM 0 HB2 ALA B 82 5.417 -2.167 8.014 1.00 0.00 H new ATOM 0 HB3 ALA B 82 4.828 -0.575 7.477 1.00 0.00 H new ATOM 2776 N ILE B 83 7.529 -0.076 5.248 1.00 0.00 N ATOM 2777 CA ILE B 83 7.816 0.885 4.190 1.00 0.00 C ATOM 2778 C ILE B 83 7.349 0.373 2.831 1.00 0.00 C ATOM 2779 O ILE B 83 7.632 -0.763 2.449 1.00 0.00 O ATOM 2780 CB ILE B 83 9.324 1.214 4.112 1.00 0.00 C ATOM 2781 CG1 ILE B 83 10.058 0.706 5.361 1.00 0.00 C ATOM 2782 CG2 ILE B 83 9.528 2.713 3.937 1.00 0.00 C ATOM 2783 CD1 ILE B 83 9.832 1.552 6.599 1.00 0.00 C ATOM 0 H ILE B 83 7.572 -1.053 4.958 1.00 0.00 H new ATOM 0 HA ILE B 83 7.267 1.793 4.440 1.00 0.00 H new ATOM 0 HB ILE B 83 9.745 0.704 3.245 1.00 0.00 H new ATOM 0 HG12 ILE B 83 9.737 -0.315 5.568 1.00 0.00 H new ATOM 0 HG13 ILE B 83 11.127 0.667 5.151 1.00 0.00 H new ATOM 0 HG21 ILE B 83 10.595 2.931 3.883 1.00 0.00 H new ATOM 0 HG22 ILE B 83 9.044 3.041 3.017 1.00 0.00 H new ATOM 0 HG23 ILE B 83 9.092 3.241 4.785 1.00 0.00 H new ATOM 0 HD11 ILE B 83 10.384 1.126 7.437 1.00 0.00 H new ATOM 0 HD12 ILE B 83 10.180 2.568 6.414 1.00 0.00 H new ATOM 0 HD13 ILE B 83 8.769 1.571 6.838 1.00 0.00 H new ATOM 2795 N LEU B 84 6.637 1.227 2.104 1.00 0.00 N ATOM 2796 CA LEU B 84 6.128 0.883 0.780 1.00 0.00 C ATOM 2797 C LEU B 84 6.635 1.879 -0.257 1.00 0.00 C ATOM 2798 O LEU B 84 6.012 2.914 -0.495 1.00 0.00 O ATOM 2799 CB LEU B 84 4.597 0.867 0.788 1.00 0.00 C ATOM 2800 CG LEU B 84 3.945 0.719 -0.587 1.00 0.00 C ATOM 2801 CD1 LEU B 84 3.683 -0.746 -0.897 1.00 0.00 C ATOM 2802 CD2 LEU B 84 2.653 1.521 -0.651 1.00 0.00 C ATOM 0 H LEU B 84 6.398 2.170 2.412 1.00 0.00 H new ATOM 0 HA LEU B 84 6.489 -0.111 0.517 1.00 0.00 H new ATOM 0 HB2 LEU B 84 4.261 0.047 1.423 1.00 0.00 H new ATOM 0 HB3 LEU B 84 4.241 1.791 1.245 1.00 0.00 H new ATOM 0 HG LEU B 84 4.630 1.110 -1.339 1.00 0.00 H new ATOM 0 HD11 LEU B 84 3.219 -0.833 -1.879 1.00 0.00 H new ATOM 0 HD12 LEU B 84 4.626 -1.293 -0.892 1.00 0.00 H new ATOM 0 HD13 LEU B 84 3.017 -1.164 -0.143 1.00 0.00 H new ATOM 0 HD21 LEU B 84 2.201 1.405 -1.636 1.00 0.00 H new ATOM 0 HD22 LEU B 84 1.962 1.159 0.110 1.00 0.00 H new ATOM 0 HD23 LEU B 84 2.869 2.574 -0.473 1.00 0.00 H new ATOM 2814 N LEU B 85 7.778 1.568 -0.860 1.00 0.00 N ATOM 2815 CA LEU B 85 8.379 2.446 -1.860 1.00 0.00 C ATOM 2816 C LEU B 85 7.946 2.071 -3.271 1.00 0.00 C ATOM 2817 O LEU B 85 7.843 0.894 -3.611 1.00 0.00 O ATOM 2818 CB LEU B 85 9.904 2.389 -1.767 1.00 0.00 C ATOM 2819 CG LEU B 85 10.565 3.665 -1.252 1.00 0.00 C ATOM 2820 CD1 LEU B 85 10.432 3.754 0.257 1.00 0.00 C ATOM 2821 CD2 LEU B 85 12.028 3.714 -1.665 1.00 0.00 C ATOM 0 H LEU B 85 8.307 0.716 -0.674 1.00 0.00 H new ATOM 0 HA LEU B 85 8.034 3.459 -1.653 1.00 0.00 H new ATOM 0 HB2 LEU B 85 10.183 1.563 -1.113 1.00 0.00 H new ATOM 0 HB3 LEU B 85 10.305 2.162 -2.755 1.00 0.00 H new ATOM 0 HG LEU B 85 10.058 4.522 -1.695 1.00 0.00 H new ATOM 0 HD11 LEU B 85 10.908 4.669 0.611 1.00 0.00 H new ATOM 0 HD12 LEU B 85 9.377 3.765 0.529 1.00 0.00 H new ATOM 0 HD13 LEU B 85 10.916 2.892 0.716 1.00 0.00 H new ATOM 0 HD21 LEU B 85 12.482 4.631 -1.289 1.00 0.00 H new ATOM 0 HD22 LEU B 85 12.552 2.853 -1.250 1.00 0.00 H new ATOM 0 HD23 LEU B 85 12.100 3.693 -2.752 1.00 0.00 H new ATOM 2833 N PHE B 86 7.709 3.087 -4.092 1.00 0.00 N ATOM 2834 CA PHE B 86 7.303 2.865 -5.480 1.00 0.00 C ATOM 2835 C PHE B 86 7.158 4.182 -6.246 1.00 0.00 C ATOM 2836 O PHE B 86 6.519 5.120 -5.771 1.00 0.00 O ATOM 2837 CB PHE B 86 5.992 2.070 -5.528 1.00 0.00 C ATOM 2838 CG PHE B 86 4.756 2.924 -5.564 1.00 0.00 C ATOM 2839 CD1 PHE B 86 4.275 3.416 -6.767 1.00 0.00 C ATOM 2840 CD2 PHE B 86 4.075 3.234 -4.398 1.00 0.00 C ATOM 2841 CE1 PHE B 86 3.139 4.201 -6.807 1.00 0.00 C ATOM 2842 CE2 PHE B 86 2.938 4.019 -4.431 1.00 0.00 C ATOM 2843 CZ PHE B 86 2.470 4.503 -5.637 1.00 0.00 C ATOM 0 H PHE B 86 7.789 4.068 -3.826 1.00 0.00 H new ATOM 0 HA PHE B 86 8.089 2.287 -5.967 1.00 0.00 H new ATOM 0 HB2 PHE B 86 6.002 1.427 -6.408 1.00 0.00 H new ATOM 0 HB3 PHE B 86 5.944 1.417 -4.657 1.00 0.00 H new ATOM 0 HD1 PHE B 86 4.795 3.183 -7.685 1.00 0.00 H new ATOM 0 HD2 PHE B 86 4.437 2.858 -3.452 1.00 0.00 H new ATOM 0 HE1 PHE B 86 2.775 4.578 -7.751 1.00 0.00 H new ATOM 0 HE2 PHE B 86 2.416 4.254 -3.515 1.00 0.00 H new ATOM 0 HZ PHE B 86 1.582 5.117 -5.665 1.00 0.00 H new ATOM 2853 N LYS B 87 7.751 4.235 -7.440 1.00 0.00 N ATOM 2854 CA LYS B 87 7.683 5.429 -8.282 1.00 0.00 C ATOM 2855 C LYS B 87 6.570 5.293 -9.315 1.00 0.00 C ATOM 2856 O LYS B 87 6.140 4.184 -9.637 1.00 0.00 O ATOM 2857 CB LYS B 87 9.021 5.656 -8.990 1.00 0.00 C ATOM 2858 CG LYS B 87 10.205 5.734 -8.044 1.00 0.00 C ATOM 2859 CD LYS B 87 11.488 6.057 -8.790 1.00 0.00 C ATOM 2860 CE LYS B 87 11.508 7.499 -9.269 1.00 0.00 C ATOM 2861 NZ LYS B 87 11.600 7.589 -10.752 1.00 0.00 N ATOM 0 H LYS B 87 8.283 3.465 -7.845 1.00 0.00 H new ATOM 0 HA LYS B 87 7.467 6.286 -7.643 1.00 0.00 H new ATOM 0 HB2 LYS B 87 9.188 4.847 -9.701 1.00 0.00 H new ATOM 0 HB3 LYS B 87 8.965 6.580 -9.566 1.00 0.00 H new ATOM 0 HG2 LYS B 87 10.019 6.497 -7.288 1.00 0.00 H new ATOM 0 HG3 LYS B 87 10.316 4.785 -7.519 1.00 0.00 H new ATOM 0 HD2 LYS B 87 12.343 5.877 -8.139 1.00 0.00 H new ATOM 0 HD3 LYS B 87 11.591 5.388 -9.644 1.00 0.00 H new ATOM 0 HE2 LYS B 87 10.605 8.007 -8.930 1.00 0.00 H new ATOM 0 HE3 LYS B 87 12.354 8.019 -8.820 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 11.662 8.588 -11.036 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 12.448 7.083 -11.079 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 10.754 7.160 -11.179 1.00 0.00 H new ATOM 2875 N SER B 88 6.109 6.425 -9.836 1.00 0.00 N ATOM 2876 CA SER B 88 5.047 6.427 -10.838 1.00 0.00 C ATOM 2877 C SER B 88 5.622 6.675 -12.223 1.00 0.00 C ATOM 2878 O SER B 88 4.910 7.060 -13.150 1.00 0.00 O ATOM 2879 CB SER B 88 4.007 7.495 -10.511 1.00 0.00 C ATOM 2880 OG SER B 88 2.788 6.910 -10.089 1.00 0.00 O ATOM 0 H SER B 88 6.452 7.351 -9.582 1.00 0.00 H new ATOM 0 HA SER B 88 4.566 5.449 -10.826 1.00 0.00 H new ATOM 0 HB2 SER B 88 4.389 8.151 -9.729 1.00 0.00 H new ATOM 0 HB3 SER B 88 3.831 8.116 -11.389 1.00 0.00 H new ATOM 0 HG SER B 88 2.196 7.606 -9.735 1.00 0.00 H new ATOM 2886 N GLY B 89 6.917 6.447 -12.345 1.00 0.00 N ATOM 2887 CA GLY B 89 7.597 6.643 -13.611 1.00 0.00 C ATOM 2888 C GLY B 89 9.103 6.541 -13.480 1.00 0.00 C ATOM 2889 O GLY B 89 9.594 6.438 -12.337 1.00 0.00 O ATOM 2890 OXT GLY B 89 9.792 6.563 -14.521 1.00 0.00 O ATOM 0 H GLY B 89 7.517 6.127 -11.585 1.00 0.00 H new ATOM 0 HA2 GLY B 89 7.246 5.900 -14.327 1.00 0.00 H new ATOM 0 HA3 GLY B 89 7.336 7.622 -14.013 1.00 0.00 H new