USER MOD reduce.3.24.130724 H: found=0, std=0, add=1378, rem=0, adj=53 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 13 MET CE :methyl 173:sc= -1.37 (180deg=-1.75!) USER MOD Set 1.2: B 18 GLN : amide:sc= -23.8! C(o=-25!,f=-32!) USER MOD Set 2.1: A 88 SER OG : rot 49:sc= -1.77! USER MOD Set 2.2: B 55 HIS : no HE2:sc= -12.7! C(o=-14!,f=-17!) USER MOD Set 2.3: B 88 SER OG : rot 140:sc=-0.00211 USER MOD Set 3.1: A 77 TYR OH : rot -145:sc= -2.02! USER MOD Set 3.2: A 80 GLN : amide:sc= -0.356 K(o=-2.4,f=-3.5) USER MOD Set 4.1: A 68 HIS :FLIP no HD1:sc= -1.83 F(o=-13!,f=-8.4) USER MOD Set 4.2: A 72 HIS : no HD1:sc= -6.55! C(o=-8.4!,f=-9.2!) 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= -0.287 F(o=-2.8!,f=-0.29) USER MOD Single : A 13 MET CE :methyl 170:sc= -0.0752 (180deg=-0.272) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl 166:sc= -4.84! (180deg=-6.42!) USER MOD Single : A 18 GLN :FLIP amide:sc= -3.87! C(o=-11!,f=-3.9!) USER MOD Single : A 19 GLN :FLIP amide:sc= -2.75! C(o=-5.4!,f=-2.8!) USER MOD Single : A 21 SER OG : rot -112:sc= -5.34! USER MOD Single : A 24 CYS SG : rot 59:sc= -11.2! USER MOD Single : A 26 THR OG1 : rot 71:sc= 0.367 USER MOD Single : A 27 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 LYS NZ :NH3+ -146:sc= -0.291 (180deg=-1.05!) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN :FLIP amide:sc= 1.06 F(o=-0.33,f=1.1) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 HIS : no HD1:sc= -21.2! C(o=-21!,f=-27!) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0487) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 TYR OH : rot -120:sc= -1.93! USER MOD Single : A 51 ASN :FLIP amide:sc= -0.404 F(o=-5.7!,f=-0.4) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 HIS : no HD1:sc= -27.5! C(o=-27!,f=-28!) USER MOD Single : A 56 CYS SG : rot -31:sc= -6.52! USER MOD Single : A 61 ASN : amide:sc= -2.01! C(o=-2!,f=-11!) USER MOD Single : A 64 SER OG : rot 115:sc= 0.598 USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0.0274 USER MOD Single : A 70 THR OG1 : rot 180:sc= -0.693 USER MOD Single : A 71 LYS NZ :NH3+ -158:sc= 0.0521 (180deg=0.00156) USER MOD Single : A 75 TYR OH : rot -120:sc= -0.125 USER MOD Single : A 87 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.123) USER MOD Single : B 5 LYS NZ :NH3+ -147:sc= -0.323 (180deg=-1.79!) USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 ASN :FLIP amide:sc= -0.136 F(o=-2!,f=-0.14) USER MOD Single : B 14 SER OG : rot 180:sc= -1.4 USER MOD Single : B 17 MET CE :methyl -170:sc= -6.73! (180deg=-7.29!) USER MOD Single : B 19 GLN : amide:sc= -0.487 K(o=-0.49,f=-2.8!) USER MOD Single : B 21 SER OG : rot -83:sc= -0.946 USER MOD Single : B 24 CYS SG : rot 155:sc= 0.128 USER MOD Single : B 26 THR OG1 : rot 73:sc= 0.431 USER MOD Single : B 27 GLN : amide:sc= 0 K(o=0,f=-0.82) USER MOD Single : B 31 LYS NZ :NH3+ 162:sc=-0.00194 (180deg=-0.147) USER MOD Single : B 32 TYR OH : rot 180:sc= 0 USER MOD Single : B 33 ASN : amide:sc= -0.0144 X(o=-0.014,f=-0.13) USER MOD Single : B 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 HIS : no HE2:sc= -26.6! C(o=-27!,f=-30!) USER MOD Single : B 43 LYS NZ :NH3+ 174:sc= -0.0225 (180deg=-0.0669) 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+ -147:sc= -0.266 (180deg=-1.15!) USER MOD Single : B 50 TYR OH : rot 130:sc= -3.62! USER MOD Single : B 51 ASN : amide:sc= 0.49 K(o=0.49,f=-0.013) USER MOD Single : B 53 THR OG1 : rot 180:sc= 0 USER MOD Single : B 56 CYS SG : rot 43:sc= -1.13 USER MOD Single : B 61 ASN : amide:sc= 1.02 K(o=1,f=-0.14) USER MOD Single : B 64 SER OG : rot -108:sc= -2.51! USER MOD Single : B 65 TYR OH : rot 180:sc= 0 USER MOD Single : B 67 THR OG1 : rot 94:sc= -0.15 USER MOD Single : B 68 HIS : no HD1:sc= -1.53 X(o=-1.5,f=-1.2) USER MOD Single : B 70 THR OG1 : rot 180:sc= -0.245 USER MOD Single : B 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 72 HIS : no HE2:sc= -8.13! C(o=-8.1!,f=-9.8!) USER MOD Single : B 75 TYR OH : rot 111:sc= 1.8 USER MOD Single : B 77 TYR OH : rot -30:sc= -0.414 USER MOD Single : B 80 GLN : amide:sc= -0.0176 X(o=-0.018,f=-0.25) USER MOD Single : B 87 LYS NZ :NH3+ -143:sc= -4.42! (180deg=-9.04!) USER MOD ----------------------------------------------------------------- ATOM 67 N LYS A 5 -18.558 7.961 7.346 1.00 0.00 N ATOM 68 CA LYS A 5 -17.531 7.585 8.312 1.00 0.00 C ATOM 69 C LYS A 5 -16.152 8.044 7.849 1.00 0.00 C ATOM 70 O LYS A 5 -16.034 8.894 6.966 1.00 0.00 O ATOM 71 CB LYS A 5 -17.531 6.069 8.522 1.00 0.00 C ATOM 72 CG LYS A 5 -18.046 5.642 9.886 1.00 0.00 C ATOM 73 CD LYS A 5 -17.593 4.235 10.236 1.00 0.00 C ATOM 74 CE LYS A 5 -18.316 3.194 9.397 1.00 0.00 C ATOM 75 NZ LYS A 5 -18.807 2.058 10.223 1.00 0.00 N ATOM 0 HA LYS A 5 -17.759 8.078 9.257 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -18.144 5.604 7.750 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -16.516 5.693 8.392 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -17.691 6.339 10.645 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -19.135 5.688 9.896 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -16.518 4.148 10.079 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -17.777 4.044 11.293 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -19.158 3.661 8.885 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -17.643 2.818 8.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -19.294 1.370 9.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -18.002 1.596 10.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -19.469 2.413 10.942 1.00 0.00 H new ATOM 89 N ALA A 6 -15.113 7.475 8.450 1.00 0.00 N ATOM 90 CA ALA A 6 -13.741 7.819 8.102 1.00 0.00 C ATOM 91 C ALA A 6 -13.452 9.290 8.369 1.00 0.00 C ATOM 92 O ALA A 6 -14.353 10.128 8.344 1.00 0.00 O ATOM 93 CB ALA A 6 -13.467 7.487 6.645 1.00 0.00 C ATOM 0 H ALA A 6 -15.196 6.771 9.183 1.00 0.00 H new ATOM 0 HA ALA A 6 -13.079 7.227 8.733 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -12.438 7.749 6.399 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -13.619 6.420 6.480 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -14.148 8.053 6.009 1.00 0.00 H new ATOM 99 N VAL A 7 -12.184 9.597 8.621 1.00 0.00 N ATOM 100 CA VAL A 7 -11.765 10.964 8.889 1.00 0.00 C ATOM 101 C VAL A 7 -10.765 11.439 7.843 1.00 0.00 C ATOM 102 O VAL A 7 -9.578 11.592 8.130 1.00 0.00 O ATOM 103 CB VAL A 7 -11.128 11.095 10.284 1.00 0.00 C ATOM 104 CG1 VAL A 7 -10.631 12.513 10.512 1.00 0.00 C ATOM 105 CG2 VAL A 7 -12.119 10.686 11.363 1.00 0.00 C ATOM 0 H VAL A 7 -11.428 8.913 8.645 1.00 0.00 H new ATOM 0 HA VAL A 7 -12.660 11.585 8.849 1.00 0.00 H new ATOM 0 HB VAL A 7 -10.271 10.423 10.338 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -10.184 12.587 11.503 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -9.885 12.763 9.758 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -11.468 13.208 10.439 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -11.652 10.785 12.343 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -12.997 11.330 11.313 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -12.419 9.650 11.207 1.00 0.00 H new ATOM 115 N ILE A 8 -11.249 11.665 6.627 1.00 0.00 N ATOM 116 CA ILE A 8 -10.393 12.118 5.542 1.00 0.00 C ATOM 117 C ILE A 8 -9.315 13.067 6.063 1.00 0.00 C ATOM 118 O ILE A 8 -9.586 13.946 6.881 1.00 0.00 O ATOM 119 CB ILE A 8 -11.222 12.789 4.412 1.00 0.00 C ATOM 120 CG1 ILE A 8 -11.568 11.754 3.340 1.00 0.00 C ATOM 121 CG2 ILE A 8 -10.484 13.967 3.780 1.00 0.00 C ATOM 122 CD1 ILE A 8 -12.890 11.055 3.573 1.00 0.00 C ATOM 0 H ILE A 8 -12.228 11.542 6.370 1.00 0.00 H new ATOM 0 HA ILE A 8 -9.901 11.243 5.117 1.00 0.00 H new ATOM 0 HB ILE A 8 -12.136 13.179 4.860 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -11.594 12.246 2.368 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -10.775 11.008 3.299 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -11.101 14.405 2.996 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -10.279 14.719 4.542 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -9.544 13.620 3.351 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -13.067 10.336 2.773 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -12.862 10.534 4.530 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -13.694 11.791 3.584 1.00 0.00 H new ATOM 134 N LYS A 9 -8.095 12.878 5.577 1.00 0.00 N ATOM 135 CA LYS A 9 -6.970 13.712 5.985 1.00 0.00 C ATOM 136 C LYS A 9 -6.282 14.318 4.769 1.00 0.00 C ATOM 137 O LYS A 9 -5.441 15.208 4.897 1.00 0.00 O ATOM 138 CB LYS A 9 -5.965 12.892 6.797 1.00 0.00 C ATOM 139 CG LYS A 9 -6.572 12.214 8.014 1.00 0.00 C ATOM 140 CD LYS A 9 -6.252 12.973 9.290 1.00 0.00 C ATOM 141 CE LYS A 9 -7.330 12.770 10.342 1.00 0.00 C ATOM 142 NZ LYS A 9 -7.300 13.837 11.380 1.00 0.00 N ATOM 0 H LYS A 9 -7.858 12.154 4.899 1.00 0.00 H new ATOM 0 HA LYS A 9 -7.354 14.520 6.608 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -5.523 12.133 6.152 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -5.155 13.545 7.122 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -7.653 12.144 7.892 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -6.194 11.195 8.091 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -5.291 12.639 9.682 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -6.154 14.036 9.068 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -8.308 12.758 9.862 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -7.196 11.798 10.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -8.050 13.663 12.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -6.375 13.832 11.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -7.453 14.762 10.931 1.00 0.00 H new ATOM 156 N ASN A 10 -6.642 13.826 3.588 1.00 0.00 N ATOM 157 CA ASN A 10 -6.057 14.316 2.346 1.00 0.00 C ATOM 158 C ASN A 10 -6.833 13.798 1.141 1.00 0.00 C ATOM 159 O ASN A 10 -6.492 12.760 0.574 1.00 0.00 O ATOM 160 CB ASN A 10 -4.597 13.880 2.247 1.00 0.00 C ATOM 161 CG ASN A 10 -3.724 14.924 1.577 1.00 0.00 C ATOM 162 OD1 ASN A 10 -4.342 16.006 1.119 1.00 0.00 O flip ATOM 163 ND2 ASN A 10 -2.509 14.759 1.472 1.00 0.00 N flip ATOM 0 H ASN A 10 -7.336 13.089 3.465 1.00 0.00 H new ATOM 0 HA ASN A 10 -6.109 15.405 2.350 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -4.213 13.677 3.247 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -4.537 12.947 1.687 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -2.076 13.911 1.839 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -1.935 15.470 1.018 1.00 0.00 H new ATOM 170 N ALA A 11 -7.877 14.520 0.752 1.00 0.00 N ATOM 171 CA ALA A 11 -8.695 14.120 -0.386 1.00 0.00 C ATOM 172 C ALA A 11 -8.733 15.201 -1.460 1.00 0.00 C ATOM 173 O ALA A 11 -9.350 16.251 -1.279 1.00 0.00 O ATOM 174 CB ALA A 11 -10.106 13.778 0.068 1.00 0.00 C ATOM 0 H ALA A 11 -8.176 15.383 1.206 1.00 0.00 H new ATOM 0 HA ALA A 11 -8.238 13.233 -0.824 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -10.704 13.481 -0.794 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -10.069 12.957 0.784 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -10.558 14.650 0.540 1.00 0.00 H new ATOM 180 N ASP A 12 -8.078 14.928 -2.582 1.00 0.00 N ATOM 181 CA ASP A 12 -8.041 15.863 -3.698 1.00 0.00 C ATOM 182 C ASP A 12 -8.814 15.296 -4.883 1.00 0.00 C ATOM 183 O ASP A 12 -8.490 15.565 -6.041 1.00 0.00 O ATOM 184 CB ASP A 12 -6.596 16.158 -4.103 1.00 0.00 C ATOM 185 CG ASP A 12 -5.893 17.066 -3.112 1.00 0.00 C ATOM 186 OD1 ASP A 12 -5.470 16.566 -2.048 1.00 0.00 O ATOM 187 OD2 ASP A 12 -5.765 18.274 -3.400 1.00 0.00 O ATOM 0 H ASP A 12 -7.563 14.062 -2.743 1.00 0.00 H new ATOM 0 HA ASP A 12 -8.509 16.796 -3.384 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -6.046 15.221 -4.187 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -6.585 16.623 -5.089 1.00 0.00 H new ATOM 192 N MET A 13 -9.835 14.503 -4.579 1.00 0.00 N ATOM 193 CA MET A 13 -10.663 13.881 -5.605 1.00 0.00 C ATOM 194 C MET A 13 -12.110 14.357 -5.495 1.00 0.00 C ATOM 195 O MET A 13 -12.482 15.028 -4.534 1.00 0.00 O ATOM 196 CB MET A 13 -10.583 12.353 -5.478 1.00 0.00 C ATOM 197 CG MET A 13 -11.814 11.616 -5.983 1.00 0.00 C ATOM 198 SD MET A 13 -11.492 9.874 -6.315 1.00 0.00 S ATOM 199 CE MET A 13 -11.053 9.294 -4.678 1.00 0.00 C ATOM 0 H MET A 13 -10.110 14.275 -3.624 1.00 0.00 H new ATOM 0 HA MET A 13 -10.289 14.174 -6.586 1.00 0.00 H new ATOM 0 HB2 MET A 13 -9.711 12.000 -6.029 1.00 0.00 H new ATOM 0 HB3 MET A 13 -10.424 12.095 -4.431 1.00 0.00 H new ATOM 0 HG2 MET A 13 -12.611 11.700 -5.245 1.00 0.00 H new ATOM 0 HG3 MET A 13 -12.172 12.096 -6.894 1.00 0.00 H new ATOM 0 HE1 MET A 13 -10.999 8.205 -4.680 1.00 0.00 H new ATOM 0 HE2 MET A 13 -10.084 9.705 -4.394 1.00 0.00 H new ATOM 0 HE3 MET A 13 -11.809 9.618 -3.962 1.00 0.00 H new ATOM 209 N SER A 14 -12.919 14.003 -6.487 1.00 0.00 N ATOM 210 CA SER A 14 -14.324 14.394 -6.504 1.00 0.00 C ATOM 211 C SER A 14 -15.021 13.987 -5.210 1.00 0.00 C ATOM 212 O SER A 14 -14.856 12.866 -4.731 1.00 0.00 O ATOM 213 CB SER A 14 -15.038 13.761 -7.700 1.00 0.00 C ATOM 214 OG SER A 14 -14.828 14.520 -8.878 1.00 0.00 O ATOM 0 H SER A 14 -12.626 13.446 -7.290 1.00 0.00 H new ATOM 0 HA SER A 14 -14.369 15.479 -6.594 1.00 0.00 H new ATOM 0 HB2 SER A 14 -14.674 12.744 -7.849 1.00 0.00 H new ATOM 0 HB3 SER A 14 -16.106 13.690 -7.494 1.00 0.00 H new ATOM 0 HG SER A 14 -15.293 14.094 -9.629 1.00 0.00 H new ATOM 220 N GLU A 15 -15.802 14.906 -4.652 1.00 0.00 N ATOM 221 CA GLU A 15 -16.527 14.645 -3.414 1.00 0.00 C ATOM 222 C GLU A 15 -17.215 13.285 -3.462 1.00 0.00 C ATOM 223 O GLU A 15 -16.839 12.362 -2.738 1.00 0.00 O ATOM 224 CB GLU A 15 -17.560 15.744 -3.160 1.00 0.00 C ATOM 225 CG GLU A 15 -17.343 16.492 -1.856 1.00 0.00 C ATOM 226 CD GLU A 15 -17.541 15.610 -0.639 1.00 0.00 C ATOM 227 OE1 GLU A 15 -18.321 14.639 -0.730 1.00 0.00 O ATOM 228 OE2 GLU A 15 -16.916 15.891 0.405 1.00 0.00 O ATOM 0 H GLU A 15 -15.949 15.839 -5.038 1.00 0.00 H new ATOM 0 HA GLU A 15 -15.806 14.639 -2.596 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -17.533 16.455 -3.986 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -18.556 15.301 -3.154 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -16.334 16.904 -1.841 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -18.032 17.335 -1.806 1.00 0.00 H new ATOM 235 N GLU A 16 -18.226 13.167 -4.317 1.00 0.00 N ATOM 236 CA GLU A 16 -18.964 11.918 -4.456 1.00 0.00 C ATOM 237 C GLU A 16 -18.011 10.728 -4.511 1.00 0.00 C ATOM 238 O GLU A 16 -18.370 9.615 -4.128 1.00 0.00 O ATOM 239 CB GLU A 16 -19.835 11.950 -5.713 1.00 0.00 C ATOM 240 CG GLU A 16 -19.297 12.864 -6.801 1.00 0.00 C ATOM 241 CD GLU A 16 -18.723 12.095 -7.975 1.00 0.00 C ATOM 242 OE1 GLU A 16 -19.490 11.782 -8.912 1.00 0.00 O ATOM 243 OE2 GLU A 16 -17.509 11.806 -7.959 1.00 0.00 O ATOM 0 H GLU A 16 -18.552 13.920 -4.923 1.00 0.00 H new ATOM 0 HA GLU A 16 -19.607 11.806 -3.583 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -19.923 10.939 -6.110 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -20.839 12.274 -5.441 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -20.098 13.514 -7.153 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -18.525 13.508 -6.381 1.00 0.00 H new ATOM 250 N MET A 17 -16.793 10.974 -4.984 1.00 0.00 N ATOM 251 CA MET A 17 -15.787 9.922 -5.081 1.00 0.00 C ATOM 252 C MET A 17 -15.211 9.605 -3.707 1.00 0.00 C ATOM 253 O MET A 17 -15.148 8.445 -3.300 1.00 0.00 O ATOM 254 CB MET A 17 -14.664 10.339 -6.032 1.00 0.00 C ATOM 255 CG MET A 17 -14.944 10.004 -7.488 1.00 0.00 C ATOM 256 SD MET A 17 -13.733 8.864 -8.184 1.00 0.00 S ATOM 257 CE MET A 17 -14.047 7.395 -7.208 1.00 0.00 C ATOM 0 H MET A 17 -16.479 11.890 -5.305 1.00 0.00 H new ATOM 0 HA MET A 17 -16.268 9.027 -5.476 1.00 0.00 H new ATOM 0 HB2 MET A 17 -14.501 11.413 -5.940 1.00 0.00 H new ATOM 0 HB3 MET A 17 -13.740 9.849 -5.726 1.00 0.00 H new ATOM 0 HG2 MET A 17 -15.939 9.566 -7.571 1.00 0.00 H new ATOM 0 HG3 MET A 17 -14.950 10.923 -8.074 1.00 0.00 H new ATOM 0 HE1 MET A 17 -13.562 6.538 -7.675 1.00 0.00 H new ATOM 0 HE2 MET A 17 -13.649 7.534 -6.203 1.00 0.00 H new ATOM 0 HE3 MET A 17 -15.121 7.218 -7.152 1.00 0.00 H new ATOM 267 N GLN A 18 -14.797 10.646 -2.992 1.00 0.00 N ATOM 268 CA GLN A 18 -14.231 10.480 -1.659 1.00 0.00 C ATOM 269 C GLN A 18 -15.231 9.795 -0.737 1.00 0.00 C ATOM 270 O GLN A 18 -14.848 9.114 0.217 1.00 0.00 O ATOM 271 CB GLN A 18 -13.818 11.835 -1.076 1.00 0.00 C ATOM 272 CG GLN A 18 -14.109 13.012 -1.994 1.00 0.00 C ATOM 273 CD GLN A 18 -12.929 13.956 -2.128 1.00 0.00 C ATOM 274 OE1 GLN A 18 -11.884 13.504 -2.811 1.00 0.00 O flip ATOM 275 NE2 GLN A 18 -12.958 15.079 -1.624 1.00 0.00 N flip ATOM 0 H GLN A 18 -14.843 11.613 -3.314 1.00 0.00 H new ATOM 0 HA GLN A 18 -13.344 9.852 -1.741 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -14.338 11.987 -0.130 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -12.751 11.815 -0.854 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -14.384 12.639 -2.980 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -14.968 13.563 -1.611 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -13.782 15.385 -1.107 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -12.158 15.703 -1.723 1.00 0.00 H new ATOM 284 N GLN A 19 -16.517 9.962 -1.037 1.00 0.00 N ATOM 285 CA GLN A 19 -17.567 9.344 -0.245 1.00 0.00 C ATOM 286 C GLN A 19 -17.679 7.873 -0.613 1.00 0.00 C ATOM 287 O GLN A 19 -17.753 7.003 0.255 1.00 0.00 O ATOM 288 CB GLN A 19 -18.906 10.068 -0.461 1.00 0.00 C ATOM 289 CG GLN A 19 -19.792 9.442 -1.531 1.00 0.00 C ATOM 290 CD GLN A 19 -21.022 10.276 -1.834 1.00 0.00 C ATOM 291 OE1 GLN A 19 -21.172 10.675 -3.091 1.00 0.00 O flip ATOM 292 NE2 GLN A 19 -21.827 10.558 -0.947 1.00 0.00 N flip ATOM 0 H GLN A 19 -16.852 10.520 -1.822 1.00 0.00 H new ATOM 0 HA GLN A 19 -17.314 9.425 0.812 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -19.452 10.085 0.482 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -18.706 11.104 -0.733 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -19.213 9.311 -2.445 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -20.102 8.449 -1.205 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -21.671 10.230 0.006 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -22.650 11.120 -1.165 1.00 0.00 H new ATOM 301 N ASP A 20 -17.666 7.608 -1.914 1.00 0.00 N ATOM 302 CA ASP A 20 -17.740 6.245 -2.407 1.00 0.00 C ATOM 303 C ASP A 20 -16.469 5.498 -2.032 1.00 0.00 C ATOM 304 O ASP A 20 -16.471 4.277 -1.876 1.00 0.00 O ATOM 305 CB ASP A 20 -17.936 6.228 -3.924 1.00 0.00 C ATOM 306 CG ASP A 20 -19.110 7.079 -4.364 1.00 0.00 C ATOM 307 OD1 ASP A 20 -20.136 7.088 -3.654 1.00 0.00 O ATOM 308 OD2 ASP A 20 -19.004 7.738 -5.421 1.00 0.00 O ATOM 0 H ASP A 20 -17.605 8.320 -2.642 1.00 0.00 H new ATOM 0 HA ASP A 20 -18.597 5.751 -1.949 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -17.028 6.587 -4.409 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -18.090 5.201 -4.256 1.00 0.00 H new ATOM 313 N SER A 21 -15.386 6.253 -1.870 1.00 0.00 N ATOM 314 CA SER A 21 -14.104 5.679 -1.492 1.00 0.00 C ATOM 315 C SER A 21 -14.181 5.151 -0.066 1.00 0.00 C ATOM 316 O SER A 21 -13.864 3.991 0.196 1.00 0.00 O ATOM 317 CB SER A 21 -12.994 6.724 -1.609 1.00 0.00 C ATOM 318 OG SER A 21 -11.762 6.218 -1.126 1.00 0.00 O ATOM 0 H SER A 21 -15.374 7.265 -1.996 1.00 0.00 H new ATOM 0 HA SER A 21 -13.872 4.856 -2.168 1.00 0.00 H new ATOM 0 HB2 SER A 21 -12.883 7.026 -2.651 1.00 0.00 H new ATOM 0 HB3 SER A 21 -13.270 7.616 -1.046 1.00 0.00 H new ATOM 0 HG SER A 21 -11.509 6.697 -0.309 1.00 0.00 H new ATOM 324 N VAL A 22 -14.622 6.010 0.849 1.00 0.00 N ATOM 325 CA VAL A 22 -14.759 5.625 2.246 1.00 0.00 C ATOM 326 C VAL A 22 -15.626 4.379 2.371 1.00 0.00 C ATOM 327 O VAL A 22 -15.264 3.425 3.059 1.00 0.00 O ATOM 328 CB VAL A 22 -15.381 6.752 3.089 1.00 0.00 C ATOM 329 CG1 VAL A 22 -15.440 6.345 4.552 1.00 0.00 C ATOM 330 CG2 VAL A 22 -14.599 8.046 2.919 1.00 0.00 C ATOM 0 H VAL A 22 -14.889 6.973 0.647 1.00 0.00 H new ATOM 0 HA VAL A 22 -13.756 5.421 2.622 1.00 0.00 H new ATOM 0 HB VAL A 22 -16.398 6.925 2.738 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -15.882 7.152 5.137 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -16.048 5.446 4.655 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -14.432 6.144 4.915 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -15.056 8.829 3.524 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -13.569 7.894 3.241 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -14.611 8.343 1.870 1.00 0.00 H new ATOM 340 N GLU A 23 -16.768 4.390 1.690 1.00 0.00 N ATOM 341 CA GLU A 23 -17.680 3.254 1.717 1.00 0.00 C ATOM 342 C GLU A 23 -16.967 2.003 1.219 1.00 0.00 C ATOM 343 O GLU A 23 -17.200 0.903 1.719 1.00 0.00 O ATOM 344 CB GLU A 23 -18.913 3.533 0.855 1.00 0.00 C ATOM 345 CG GLU A 23 -19.851 4.570 1.450 1.00 0.00 C ATOM 346 CD GLU A 23 -21.307 4.150 1.374 1.00 0.00 C ATOM 347 OE1 GLU A 23 -21.621 3.019 1.801 1.00 0.00 O ATOM 348 OE2 GLU A 23 -22.131 4.952 0.888 1.00 0.00 O ATOM 0 H GLU A 23 -17.082 5.171 1.114 1.00 0.00 H new ATOM 0 HA GLU A 23 -18.006 3.095 2.745 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -18.589 3.871 -0.129 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -19.461 2.602 0.708 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -19.581 4.744 2.491 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -19.721 5.516 0.924 1.00 0.00 H new ATOM 355 N CYS A 24 -16.084 2.183 0.240 1.00 0.00 N ATOM 356 CA CYS A 24 -15.324 1.072 -0.313 1.00 0.00 C ATOM 357 C CYS A 24 -14.356 0.533 0.731 1.00 0.00 C ATOM 358 O CYS A 24 -14.126 -0.674 0.820 1.00 0.00 O ATOM 359 CB CYS A 24 -14.562 1.512 -1.564 1.00 0.00 C ATOM 360 SG CYS A 24 -13.324 0.323 -2.131 1.00 0.00 S ATOM 0 H CYS A 24 -15.879 3.088 -0.184 1.00 0.00 H new ATOM 0 HA CYS A 24 -16.019 0.281 -0.594 1.00 0.00 H new ATOM 0 HB2 CYS A 24 -15.276 1.688 -2.368 1.00 0.00 H new ATOM 0 HB3 CYS A 24 -14.070 2.463 -1.361 1.00 0.00 H new ATOM 0 HG CYS A 24 -13.901 -0.811 -2.398 1.00 0.00 H new ATOM 366 N ALA A 25 -13.818 1.436 1.545 1.00 0.00 N ATOM 367 CA ALA A 25 -12.907 1.047 2.608 1.00 0.00 C ATOM 368 C ALA A 25 -13.710 0.373 3.699 1.00 0.00 C ATOM 369 O ALA A 25 -13.255 -0.568 4.347 1.00 0.00 O ATOM 370 CB ALA A 25 -12.165 2.257 3.153 1.00 0.00 C ATOM 0 H ALA A 25 -13.998 2.438 1.487 1.00 0.00 H new ATOM 0 HA ALA A 25 -12.159 0.356 2.219 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -11.489 1.942 3.948 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -11.591 2.723 2.352 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -12.882 2.975 3.551 1.00 0.00 H new ATOM 376 N THR A 26 -14.932 0.861 3.861 1.00 0.00 N ATOM 377 CA THR A 26 -15.855 0.319 4.836 1.00 0.00 C ATOM 378 C THR A 26 -16.300 -1.066 4.396 1.00 0.00 C ATOM 379 O THR A 26 -16.464 -1.971 5.214 1.00 0.00 O ATOM 380 CB THR A 26 -17.063 1.240 4.970 1.00 0.00 C ATOM 381 OG1 THR A 26 -16.670 2.599 4.902 1.00 0.00 O ATOM 382 CG2 THR A 26 -17.817 1.046 6.259 1.00 0.00 C ATOM 0 H THR A 26 -15.306 1.641 3.320 1.00 0.00 H new ATOM 0 HA THR A 26 -15.360 0.245 5.804 1.00 0.00 H new ATOM 0 HB THR A 26 -17.719 0.979 4.140 1.00 0.00 H new ATOM 0 HG1 THR A 26 -16.403 2.817 3.985 1.00 0.00 H new ATOM 0 HG21 THR A 26 -18.664 1.731 6.292 1.00 0.00 H new ATOM 0 HG22 THR A 26 -18.178 0.019 6.318 1.00 0.00 H new ATOM 0 HG23 THR A 26 -17.155 1.247 7.101 1.00 0.00 H new ATOM 390 N GLN A 27 -16.479 -1.224 3.087 1.00 0.00 N ATOM 391 CA GLN A 27 -16.888 -2.499 2.523 1.00 0.00 C ATOM 392 C GLN A 27 -15.834 -3.556 2.817 1.00 0.00 C ATOM 393 O GLN A 27 -16.153 -4.689 3.177 1.00 0.00 O ATOM 394 CB GLN A 27 -17.106 -2.372 1.015 1.00 0.00 C ATOM 395 CG GLN A 27 -18.570 -2.434 0.609 1.00 0.00 C ATOM 396 CD GLN A 27 -18.791 -2.050 -0.840 1.00 0.00 C ATOM 397 OE1 GLN A 27 -19.206 -0.931 -1.141 1.00 0.00 O ATOM 398 NE2 GLN A 27 -18.512 -2.979 -1.746 1.00 0.00 N ATOM 0 H GLN A 27 -16.346 -0.482 2.400 1.00 0.00 H new ATOM 0 HA GLN A 27 -17.830 -2.800 2.982 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -16.681 -1.429 0.672 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -16.562 -3.169 0.508 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -18.946 -3.443 0.775 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -19.149 -1.769 1.249 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -18.170 -3.893 -1.450 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -18.640 -2.779 -2.738 1.00 0.00 H new ATOM 407 N ALA A 28 -14.572 -3.166 2.679 1.00 0.00 N ATOM 408 CA ALA A 28 -13.462 -4.067 2.949 1.00 0.00 C ATOM 409 C ALA A 28 -13.214 -4.159 4.450 1.00 0.00 C ATOM 410 O ALA A 28 -12.559 -5.083 4.930 1.00 0.00 O ATOM 411 CB ALA A 28 -12.209 -3.594 2.225 1.00 0.00 C ATOM 0 H ALA A 28 -14.294 -2.231 2.381 1.00 0.00 H new ATOM 0 HA ALA A 28 -13.716 -5.060 2.579 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -11.387 -4.278 2.436 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -12.396 -3.572 1.151 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -11.946 -2.593 2.568 1.00 0.00 H new ATOM 417 N LEU A 29 -13.753 -3.189 5.184 1.00 0.00 N ATOM 418 CA LEU A 29 -13.606 -3.146 6.632 1.00 0.00 C ATOM 419 C LEU A 29 -14.605 -4.078 7.310 1.00 0.00 C ATOM 420 O LEU A 29 -14.299 -4.705 8.324 1.00 0.00 O ATOM 421 CB LEU A 29 -13.812 -1.724 7.138 1.00 0.00 C ATOM 422 CG LEU A 29 -12.609 -0.807 6.956 1.00 0.00 C ATOM 423 CD1 LEU A 29 -13.063 0.613 6.691 1.00 0.00 C ATOM 424 CD2 LEU A 29 -11.709 -0.863 8.179 1.00 0.00 C ATOM 0 H LEU A 29 -14.298 -2.419 4.795 1.00 0.00 H new ATOM 0 HA LEU A 29 -12.597 -3.478 6.878 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -14.666 -1.288 6.620 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -14.067 -1.762 8.197 1.00 0.00 H new ATOM 0 HG LEU A 29 -12.037 -1.151 6.094 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -12.192 1.256 6.563 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -13.669 0.638 5.785 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -13.656 0.969 7.534 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -10.855 -0.202 8.033 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -12.269 -0.543 9.058 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -11.357 -1.884 8.325 1.00 0.00 H new ATOM 436 N GLU A 30 -15.808 -4.150 6.746 1.00 0.00 N ATOM 437 CA GLU A 30 -16.866 -4.991 7.295 1.00 0.00 C ATOM 438 C GLU A 30 -16.782 -6.413 6.748 1.00 0.00 C ATOM 439 O GLU A 30 -17.216 -7.364 7.399 1.00 0.00 O ATOM 440 CB GLU A 30 -18.233 -4.388 6.972 1.00 0.00 C ATOM 441 CG GLU A 30 -18.493 -4.237 5.482 1.00 0.00 C ATOM 442 CD GLU A 30 -19.876 -4.712 5.084 1.00 0.00 C ATOM 443 OE1 GLU A 30 -20.675 -5.037 5.988 1.00 0.00 O ATOM 444 OE2 GLU A 30 -20.162 -4.758 3.869 1.00 0.00 O ATOM 0 H GLU A 30 -16.074 -3.634 5.907 1.00 0.00 H new ATOM 0 HA GLU A 30 -16.736 -5.036 8.376 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -19.010 -5.017 7.406 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -18.311 -3.410 7.447 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -18.377 -3.191 5.200 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -17.744 -4.802 4.927 1.00 0.00 H new ATOM 451 N LYS A 31 -16.224 -6.551 5.551 1.00 0.00 N ATOM 452 CA LYS A 31 -16.086 -7.859 4.920 1.00 0.00 C ATOM 453 C LYS A 31 -14.817 -8.561 5.392 1.00 0.00 C ATOM 454 O LYS A 31 -14.720 -9.787 5.346 1.00 0.00 O ATOM 455 CB LYS A 31 -16.069 -7.716 3.397 1.00 0.00 C ATOM 456 CG LYS A 31 -17.452 -7.727 2.770 1.00 0.00 C ATOM 457 CD LYS A 31 -17.718 -6.452 1.987 1.00 0.00 C ATOM 458 CE LYS A 31 -18.912 -6.609 1.060 1.00 0.00 C ATOM 459 NZ LYS A 31 -18.816 -7.844 0.235 1.00 0.00 N ATOM 0 H LYS A 31 -15.860 -5.775 4.998 1.00 0.00 H new ATOM 0 HA LYS A 31 -16.944 -8.466 5.210 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -15.567 -6.785 3.133 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -15.479 -8.528 2.971 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -17.546 -8.588 2.108 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -18.205 -7.840 3.550 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -17.898 -5.629 2.679 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -16.835 -6.190 1.404 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -19.828 -6.637 1.650 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -18.980 -5.740 0.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -19.238 -7.671 -0.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -17.817 -8.108 0.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -19.327 -8.617 0.707 1.00 0.00 H new ATOM 473 N TYR A 32 -13.848 -7.775 5.850 1.00 0.00 N ATOM 474 CA TYR A 32 -12.586 -8.321 6.335 1.00 0.00 C ATOM 475 C TYR A 32 -12.060 -7.510 7.512 1.00 0.00 C ATOM 476 O TYR A 32 -12.805 -6.768 8.152 1.00 0.00 O ATOM 477 CB TYR A 32 -11.543 -8.341 5.216 1.00 0.00 C ATOM 478 CG TYR A 32 -12.139 -8.411 3.830 1.00 0.00 C ATOM 479 CD1 TYR A 32 -12.907 -7.366 3.331 1.00 0.00 C ATOM 480 CD2 TYR A 32 -11.933 -9.520 3.018 1.00 0.00 C ATOM 481 CE1 TYR A 32 -13.454 -7.425 2.063 1.00 0.00 C ATOM 482 CE2 TYR A 32 -12.477 -9.586 1.750 1.00 0.00 C ATOM 483 CZ TYR A 32 -13.236 -8.536 1.277 1.00 0.00 C ATOM 484 OH TYR A 32 -13.779 -8.599 0.013 1.00 0.00 O ATOM 0 H TYR A 32 -13.913 -6.758 5.895 1.00 0.00 H new ATOM 0 HA TYR A 32 -12.771 -9.342 6.668 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -10.925 -7.446 5.291 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -10.883 -9.197 5.362 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -13.079 -6.494 3.944 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -11.338 -10.343 3.384 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -14.049 -6.605 1.690 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -12.309 -10.456 1.132 1.00 0.00 H new ATOM 0 HH TYR A 32 -13.529 -9.448 -0.408 1.00 0.00 H new ATOM 494 N ASN A 33 -10.770 -7.654 7.788 1.00 0.00 N ATOM 495 CA ASN A 33 -10.137 -6.935 8.885 1.00 0.00 C ATOM 496 C ASN A 33 -8.620 -7.015 8.774 1.00 0.00 C ATOM 497 O ASN A 33 -7.906 -6.952 9.775 1.00 0.00 O ATOM 498 CB ASN A 33 -10.599 -7.498 10.229 1.00 0.00 C ATOM 499 CG ASN A 33 -10.507 -6.478 11.346 1.00 0.00 C ATOM 500 OD1 ASN A 33 -11.654 -6.104 11.903 1.00 0.00 O flip ATOM 501 ND2 ASN A 33 -9.418 -6.029 11.704 1.00 0.00 N flip ATOM 0 H ASN A 33 -10.141 -8.264 7.266 1.00 0.00 H new ATOM 0 HA ASN A 33 -10.434 -5.888 8.824 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -11.629 -7.843 10.140 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -9.992 -8.367 10.484 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -8.562 -6.344 11.248 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -9.372 -5.342 12.456 1.00 0.00 H new ATOM 508 N ILE A 34 -8.136 -7.151 7.546 1.00 0.00 N ATOM 509 CA ILE A 34 -6.704 -7.238 7.288 1.00 0.00 C ATOM 510 C ILE A 34 -6.244 -6.079 6.412 1.00 0.00 C ATOM 511 O ILE A 34 -6.473 -6.082 5.203 1.00 0.00 O ATOM 512 CB ILE A 34 -6.334 -8.564 6.590 1.00 0.00 C ATOM 513 CG1 ILE A 34 -7.227 -9.702 7.085 1.00 0.00 C ATOM 514 CG2 ILE A 34 -4.866 -8.893 6.816 1.00 0.00 C ATOM 515 CD1 ILE A 34 -7.274 -9.822 8.589 1.00 0.00 C ATOM 0 H ILE A 34 -8.717 -7.204 6.709 1.00 0.00 H new ATOM 0 HA ILE A 34 -6.203 -7.194 8.255 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.498 -8.446 5.519 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -8.239 -9.549 6.709 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -6.870 -10.642 6.665 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -4.622 -9.831 6.317 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.247 -8.094 6.408 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -4.675 -8.990 7.885 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -7.926 -10.650 8.868 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -6.270 -10.007 8.971 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -7.660 -8.896 9.016 1.00 0.00 H new ATOM 527 N GLU A 35 -5.596 -5.091 7.029 1.00 0.00 N ATOM 528 CA GLU A 35 -5.103 -3.923 6.302 1.00 0.00 C ATOM 529 C GLU A 35 -4.835 -4.267 4.843 1.00 0.00 C ATOM 530 O GLU A 35 -5.629 -3.946 3.960 1.00 0.00 O ATOM 531 CB GLU A 35 -3.821 -3.394 6.951 1.00 0.00 C ATOM 532 CG GLU A 35 -3.690 -3.750 8.423 1.00 0.00 C ATOM 533 CD GLU A 35 -3.199 -5.168 8.638 1.00 0.00 C ATOM 534 OE1 GLU A 35 -2.257 -5.583 7.932 1.00 0.00 O ATOM 535 OE2 GLU A 35 -3.757 -5.862 9.513 1.00 0.00 O ATOM 0 H GLU A 35 -5.401 -5.077 8.030 1.00 0.00 H new ATOM 0 HA GLU A 35 -5.871 -3.151 6.344 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -2.961 -3.791 6.412 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -3.791 -2.310 6.844 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -3.001 -3.054 8.901 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -4.657 -3.626 8.910 1.00 0.00 H new ATOM 542 N LYS A 36 -3.714 -4.933 4.602 1.00 0.00 N ATOM 543 CA LYS A 36 -3.337 -5.338 3.255 1.00 0.00 C ATOM 544 C LYS A 36 -4.552 -5.833 2.475 1.00 0.00 C ATOM 545 O LYS A 36 -4.718 -5.513 1.298 1.00 0.00 O ATOM 546 CB LYS A 36 -2.271 -6.437 3.314 1.00 0.00 C ATOM 547 CG LYS A 36 -2.043 -6.991 4.712 1.00 0.00 C ATOM 548 CD LYS A 36 -1.671 -8.465 4.677 1.00 0.00 C ATOM 549 CE LYS A 36 -0.397 -8.698 3.882 1.00 0.00 C ATOM 550 NZ LYS A 36 0.474 -9.723 4.518 1.00 0.00 N ATOM 0 H LYS A 36 -3.048 -5.205 5.325 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.928 -4.469 2.740 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -2.565 -7.252 2.653 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -1.331 -6.040 2.932 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -1.250 -6.427 5.203 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -2.945 -6.857 5.309 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -1.539 -8.832 5.695 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -2.487 -9.037 4.235 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -0.653 -9.016 2.871 1.00 0.00 H new ATOM 0 HE3 LYS A 36 0.152 -7.760 3.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 1.332 -9.853 3.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 0.739 -9.409 5.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -0.040 -10.625 4.581 1.00 0.00 H new ATOM 564 N ASP A 37 -5.401 -6.615 3.137 1.00 0.00 N ATOM 565 CA ASP A 37 -6.601 -7.152 2.502 1.00 0.00 C ATOM 566 C ASP A 37 -7.561 -6.028 2.129 1.00 0.00 C ATOM 567 O ASP A 37 -7.908 -5.857 0.961 1.00 0.00 O ATOM 568 CB ASP A 37 -7.296 -8.148 3.434 1.00 0.00 C ATOM 569 CG ASP A 37 -7.211 -9.574 2.926 1.00 0.00 C ATOM 570 OD1 ASP A 37 -6.211 -10.255 3.234 1.00 0.00 O ATOM 571 OD2 ASP A 37 -8.145 -10.010 2.221 1.00 0.00 O ATOM 0 H ASP A 37 -5.280 -6.891 4.112 1.00 0.00 H new ATOM 0 HA ASP A 37 -6.302 -7.670 1.591 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -6.844 -8.091 4.424 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -8.343 -7.867 3.545 1.00 0.00 H new ATOM 576 N ILE A 38 -7.981 -5.260 3.129 1.00 0.00 N ATOM 577 CA ILE A 38 -8.895 -4.149 2.907 1.00 0.00 C ATOM 578 C ILE A 38 -8.442 -3.303 1.722 1.00 0.00 C ATOM 579 O ILE A 38 -9.233 -2.983 0.835 1.00 0.00 O ATOM 580 CB ILE A 38 -8.996 -3.251 4.155 1.00 0.00 C ATOM 581 CG1 ILE A 38 -8.998 -4.107 5.423 1.00 0.00 C ATOM 582 CG2 ILE A 38 -10.246 -2.389 4.089 1.00 0.00 C ATOM 583 CD1 ILE A 38 -8.531 -3.364 6.656 1.00 0.00 C ATOM 0 H ILE A 38 -7.702 -5.388 4.102 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.875 -4.576 2.696 1.00 0.00 H new ATOM 0 HB ILE A 38 -8.128 -2.592 4.183 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -10.006 -4.483 5.596 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -8.357 -4.974 5.267 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -10.302 -1.761 4.978 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -10.207 -1.758 3.201 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.127 -3.029 4.041 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -8.559 -4.033 7.516 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -7.511 -3.011 6.504 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -9.186 -2.512 6.838 1.00 0.00 H new ATOM 595 N ALA A 39 -7.161 -2.950 1.714 1.00 0.00 N ATOM 596 CA ALA A 39 -6.598 -2.147 0.636 1.00 0.00 C ATOM 597 C ALA A 39 -6.755 -2.853 -0.706 1.00 0.00 C ATOM 598 O ALA A 39 -7.037 -2.219 -1.723 1.00 0.00 O ATOM 599 CB ALA A 39 -5.130 -1.852 0.910 1.00 0.00 C ATOM 0 H ALA A 39 -6.494 -3.207 2.441 1.00 0.00 H new ATOM 0 HA ALA A 39 -7.144 -1.205 0.591 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -4.722 -1.252 0.097 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.038 -1.304 1.848 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -4.578 -2.789 0.982 1.00 0.00 H new ATOM 605 N ALA A 40 -6.573 -4.169 -0.700 1.00 0.00 N ATOM 606 CA ALA A 40 -6.697 -4.965 -1.915 1.00 0.00 C ATOM 607 C ALA A 40 -8.093 -4.837 -2.512 1.00 0.00 C ATOM 608 O ALA A 40 -8.270 -4.267 -3.589 1.00 0.00 O ATOM 609 CB ALA A 40 -6.375 -6.423 -1.623 1.00 0.00 C ATOM 0 H ALA A 40 -6.339 -4.707 0.134 1.00 0.00 H new ATOM 0 HA ALA A 40 -5.982 -4.586 -2.646 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -6.471 -7.007 -2.538 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -5.355 -6.502 -1.247 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -7.068 -6.806 -0.874 1.00 0.00 H new ATOM 615 N HIS A 41 -9.084 -5.372 -1.806 1.00 0.00 N ATOM 616 CA HIS A 41 -10.468 -5.317 -2.265 1.00 0.00 C ATOM 617 C HIS A 41 -10.855 -3.894 -2.650 1.00 0.00 C ATOM 618 O HIS A 41 -11.395 -3.658 -3.731 1.00 0.00 O ATOM 619 CB HIS A 41 -11.417 -5.835 -1.181 1.00 0.00 C ATOM 620 CG HIS A 41 -10.724 -6.533 -0.050 1.00 0.00 C ATOM 621 ND1 HIS A 41 -10.981 -6.256 1.276 1.00 0.00 N ATOM 622 CD2 HIS A 41 -9.779 -7.502 -0.054 1.00 0.00 C ATOM 623 CE1 HIS A 41 -10.223 -7.025 2.039 1.00 0.00 C ATOM 624 NE2 HIS A 41 -9.485 -7.790 1.256 1.00 0.00 N ATOM 0 H HIS A 41 -8.955 -5.849 -0.914 1.00 0.00 H new ATOM 0 HA HIS A 41 -10.553 -5.954 -3.145 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -11.989 -4.997 -0.782 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -12.132 -6.521 -1.635 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -9.338 -7.963 -0.926 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -10.210 -7.027 3.119 1.00 0.00 H new ATOM 0 HE2 HIS A 41 -8.807 -8.483 1.573 1.00 0.00 H new ATOM 633 N ILE A 42 -10.577 -2.950 -1.758 1.00 0.00 N ATOM 634 CA ILE A 42 -10.898 -1.551 -2.005 1.00 0.00 C ATOM 635 C ILE A 42 -10.389 -1.102 -3.371 1.00 0.00 C ATOM 636 O ILE A 42 -11.176 -0.808 -4.270 1.00 0.00 O ATOM 637 CB ILE A 42 -10.298 -0.638 -0.919 1.00 0.00 C ATOM 638 CG1 ILE A 42 -10.916 -0.956 0.444 1.00 0.00 C ATOM 639 CG2 ILE A 42 -10.513 0.825 -1.279 1.00 0.00 C ATOM 640 CD1 ILE A 42 -10.240 -0.242 1.593 1.00 0.00 C ATOM 0 H ILE A 42 -10.131 -3.129 -0.858 1.00 0.00 H new ATOM 0 HA ILE A 42 -11.984 -1.466 -1.981 1.00 0.00 H new ATOM 0 HB ILE A 42 -9.225 -0.822 -0.861 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -11.971 -0.684 0.428 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -10.866 -2.031 0.615 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -10.084 1.458 -0.502 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -10.029 1.040 -2.231 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -11.581 1.026 -1.362 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -10.729 -0.514 2.528 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -9.190 -0.532 1.635 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -10.313 0.835 1.445 1.00 0.00 H new ATOM 652 N LYS A 43 -9.068 -1.052 -3.519 1.00 0.00 N ATOM 653 CA LYS A 43 -8.456 -0.639 -4.778 1.00 0.00 C ATOM 654 C LYS A 43 -9.037 -1.426 -5.948 1.00 0.00 C ATOM 655 O LYS A 43 -9.291 -0.869 -7.017 1.00 0.00 O ATOM 656 CB LYS A 43 -6.940 -0.831 -4.720 1.00 0.00 C ATOM 657 CG LYS A 43 -6.264 -0.756 -6.080 1.00 0.00 C ATOM 658 CD LYS A 43 -6.360 -2.077 -6.825 1.00 0.00 C ATOM 659 CE LYS A 43 -6.363 -1.869 -8.330 1.00 0.00 C ATOM 660 NZ LYS A 43 -6.190 -3.149 -9.070 1.00 0.00 N ATOM 0 H LYS A 43 -8.402 -1.292 -2.784 1.00 0.00 H new ATOM 0 HA LYS A 43 -8.674 0.418 -4.930 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -6.511 -0.070 -4.068 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -6.722 -1.799 -4.268 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -6.727 0.032 -6.674 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -5.216 -0.485 -5.952 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -5.521 -2.715 -6.547 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -7.269 -2.599 -6.527 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -7.301 -1.401 -8.629 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -5.562 -1.181 -8.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -6.198 -2.962 -10.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -5.283 -3.584 -8.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -6.968 -3.796 -8.830 1.00 0.00 H new ATOM 674 N LYS A 44 -9.246 -2.721 -5.740 1.00 0.00 N ATOM 675 CA LYS A 44 -9.798 -3.581 -6.779 1.00 0.00 C ATOM 676 C LYS A 44 -11.114 -3.017 -7.304 1.00 0.00 C ATOM 677 O LYS A 44 -11.261 -2.756 -8.499 1.00 0.00 O ATOM 678 CB LYS A 44 -10.015 -4.996 -6.241 1.00 0.00 C ATOM 679 CG LYS A 44 -10.630 -5.945 -7.258 1.00 0.00 C ATOM 680 CD LYS A 44 -9.643 -7.017 -7.687 1.00 0.00 C ATOM 681 CE LYS A 44 -9.711 -8.233 -6.778 1.00 0.00 C ATOM 682 NZ LYS A 44 -8.764 -9.299 -7.207 1.00 0.00 N ATOM 0 H LYS A 44 -9.042 -3.198 -4.862 1.00 0.00 H new ATOM 0 HA LYS A 44 -9.084 -3.621 -7.601 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -9.059 -5.401 -5.910 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -10.661 -4.948 -5.364 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -11.516 -6.415 -6.830 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -10.959 -5.381 -8.131 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -9.853 -7.317 -8.714 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -8.633 -6.608 -7.675 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -9.483 -7.935 -5.755 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -10.727 -8.629 -6.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -8.840 -10.111 -6.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -8.997 -9.602 -8.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -7.792 -8.929 -7.185 1.00 0.00 H new ATOM 696 N GLU A 45 -12.064 -2.828 -6.399 1.00 0.00 N ATOM 697 CA GLU A 45 -13.371 -2.292 -6.759 1.00 0.00 C ATOM 698 C GLU A 45 -13.223 -0.973 -7.509 1.00 0.00 C ATOM 699 O GLU A 45 -13.740 -0.814 -8.615 1.00 0.00 O ATOM 700 CB GLU A 45 -14.224 -2.087 -5.506 1.00 0.00 C ATOM 701 CG GLU A 45 -14.938 -3.345 -5.043 1.00 0.00 C ATOM 702 CD GLU A 45 -14.789 -3.587 -3.553 1.00 0.00 C ATOM 703 OE1 GLU A 45 -14.523 -2.613 -2.818 1.00 0.00 O ATOM 704 OE2 GLU A 45 -14.936 -4.750 -3.122 1.00 0.00 O ATOM 0 H GLU A 45 -11.954 -3.038 -5.407 1.00 0.00 H new ATOM 0 HA GLU A 45 -13.867 -3.010 -7.412 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -13.588 -1.723 -4.699 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -14.964 -1.311 -5.703 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -15.997 -3.269 -5.291 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -14.544 -4.203 -5.588 1.00 0.00 H new ATOM 711 N PHE A 46 -12.512 -0.031 -6.898 1.00 0.00 N ATOM 712 CA PHE A 46 -12.290 1.275 -7.506 1.00 0.00 C ATOM 713 C PHE A 46 -11.737 1.129 -8.921 1.00 0.00 C ATOM 714 O PHE A 46 -12.203 1.783 -9.853 1.00 0.00 O ATOM 715 CB PHE A 46 -11.321 2.096 -6.653 1.00 0.00 C ATOM 716 CG PHE A 46 -11.992 3.149 -5.816 1.00 0.00 C ATOM 717 CD1 PHE A 46 -12.717 2.801 -4.688 1.00 0.00 C ATOM 718 CD2 PHE A 46 -11.891 4.488 -6.157 1.00 0.00 C ATOM 719 CE1 PHE A 46 -13.329 3.770 -3.914 1.00 0.00 C ATOM 720 CE2 PHE A 46 -12.501 5.460 -5.389 1.00 0.00 C ATOM 721 CZ PHE A 46 -13.220 5.102 -4.266 1.00 0.00 C ATOM 0 H PHE A 46 -12.080 -0.148 -5.982 1.00 0.00 H new ATOM 0 HA PHE A 46 -13.248 1.792 -7.560 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -10.768 1.423 -5.998 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -10.592 2.575 -7.307 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -12.805 1.761 -4.410 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -11.329 4.775 -7.033 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -13.891 3.486 -3.036 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -12.416 6.500 -5.667 1.00 0.00 H new ATOM 0 HZ PHE A 46 -13.696 5.861 -3.664 1.00 0.00 H new ATOM 731 N ASP A 47 -10.736 0.268 -9.068 1.00 0.00 N ATOM 732 CA ASP A 47 -10.108 0.034 -10.364 1.00 0.00 C ATOM 733 C ASP A 47 -11.023 -0.771 -11.287 1.00 0.00 C ATOM 734 O ASP A 47 -10.770 -0.874 -12.487 1.00 0.00 O ATOM 735 CB ASP A 47 -8.766 -0.689 -10.174 1.00 0.00 C ATOM 736 CG ASP A 47 -8.693 -2.017 -10.905 1.00 0.00 C ATOM 737 OD1 ASP A 47 -9.476 -2.928 -10.562 1.00 0.00 O ATOM 738 OD2 ASP A 47 -7.854 -2.145 -11.822 1.00 0.00 O ATOM 0 H ASP A 47 -10.341 -0.281 -8.304 1.00 0.00 H new ATOM 0 HA ASP A 47 -9.929 1.000 -10.835 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -7.960 -0.044 -10.525 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -8.599 -0.858 -9.110 1.00 0.00 H new ATOM 743 N LYS A 48 -12.082 -1.341 -10.723 1.00 0.00 N ATOM 744 CA LYS A 48 -13.022 -2.138 -11.503 1.00 0.00 C ATOM 745 C LYS A 48 -14.444 -1.603 -11.370 1.00 0.00 C ATOM 746 O LYS A 48 -15.406 -2.272 -11.748 1.00 0.00 O ATOM 747 CB LYS A 48 -12.977 -3.598 -11.055 1.00 0.00 C ATOM 748 CG LYS A 48 -12.184 -4.501 -11.985 1.00 0.00 C ATOM 749 CD LYS A 48 -12.974 -4.847 -13.237 1.00 0.00 C ATOM 750 CE LYS A 48 -14.285 -5.538 -12.896 1.00 0.00 C ATOM 751 NZ LYS A 48 -14.063 -6.875 -12.278 1.00 0.00 N ATOM 0 H LYS A 48 -12.311 -1.267 -9.732 1.00 0.00 H new ATOM 0 HA LYS A 48 -12.726 -2.071 -12.550 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -12.542 -3.649 -10.057 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -13.996 -3.976 -10.978 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -11.253 -4.008 -12.266 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -11.913 -5.417 -11.460 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -13.177 -3.938 -13.803 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -12.376 -5.495 -13.878 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -14.858 -4.912 -12.212 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -14.882 -5.651 -13.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -14.977 -7.356 -12.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -13.452 -7.446 -12.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -13.605 -6.758 -11.352 1.00 0.00 H new ATOM 765 N LYS A 49 -14.572 -0.399 -10.830 1.00 0.00 N ATOM 766 CA LYS A 49 -15.878 0.219 -10.647 1.00 0.00 C ATOM 767 C LYS A 49 -15.898 1.640 -11.201 1.00 0.00 C ATOM 768 O LYS A 49 -16.929 2.119 -11.671 1.00 0.00 O ATOM 769 CB LYS A 49 -16.255 0.233 -9.166 1.00 0.00 C ATOM 770 CG LYS A 49 -17.741 0.432 -8.921 1.00 0.00 C ATOM 771 CD LYS A 49 -18.002 1.094 -7.579 1.00 0.00 C ATOM 772 CE LYS A 49 -17.445 0.266 -6.431 1.00 0.00 C ATOM 773 NZ LYS A 49 -18.502 -0.550 -5.773 1.00 0.00 N ATOM 0 H LYS A 49 -13.787 0.169 -10.511 1.00 0.00 H new ATOM 0 HA LYS A 49 -16.609 -0.373 -11.198 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -15.942 -0.707 -8.711 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -15.703 1.029 -8.666 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -18.163 1.044 -9.718 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -18.249 -0.532 -8.957 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -17.549 2.085 -7.567 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -19.075 1.232 -7.443 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -16.659 -0.390 -6.804 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -16.986 0.927 -5.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -18.083 -1.100 -4.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -19.240 0.078 -5.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -18.923 -1.199 -6.468 1.00 0.00 H new ATOM 787 N TYR A 50 -14.752 2.309 -11.137 1.00 0.00 N ATOM 788 CA TYR A 50 -14.639 3.677 -11.626 1.00 0.00 C ATOM 789 C TYR A 50 -13.794 3.738 -12.895 1.00 0.00 C ATOM 790 O TYR A 50 -14.254 4.217 -13.933 1.00 0.00 O ATOM 791 CB TYR A 50 -14.026 4.575 -10.549 1.00 0.00 C ATOM 792 CG TYR A 50 -14.736 4.492 -9.214 1.00 0.00 C ATOM 793 CD1 TYR A 50 -15.888 5.229 -8.971 1.00 0.00 C ATOM 794 CD2 TYR A 50 -14.251 3.677 -8.199 1.00 0.00 C ATOM 795 CE1 TYR A 50 -16.537 5.156 -7.752 1.00 0.00 C ATOM 796 CE2 TYR A 50 -14.895 3.597 -6.979 1.00 0.00 C ATOM 797 CZ TYR A 50 -16.037 4.339 -6.760 1.00 0.00 C ATOM 798 OH TYR A 50 -16.681 4.264 -5.545 1.00 0.00 O ATOM 0 H TYR A 50 -13.889 1.926 -10.751 1.00 0.00 H new ATOM 0 HA TYR A 50 -15.641 4.034 -11.863 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -12.980 4.302 -10.412 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -14.043 5.608 -10.896 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -16.283 5.869 -9.746 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -13.356 3.096 -8.366 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -17.431 5.736 -7.578 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -14.506 2.957 -6.201 1.00 0.00 H new ATOM 0 HH TYR A 50 -16.071 4.549 -4.833 1.00 0.00 H new ATOM 808 N ASN A 51 -12.559 3.252 -12.803 1.00 0.00 N ATOM 809 CA ASN A 51 -11.642 3.252 -13.939 1.00 0.00 C ATOM 810 C ASN A 51 -10.199 3.094 -13.460 1.00 0.00 C ATOM 811 O ASN A 51 -9.665 3.973 -12.785 1.00 0.00 O ATOM 812 CB ASN A 51 -11.782 4.549 -14.739 1.00 0.00 C ATOM 813 CG ASN A 51 -12.068 4.297 -16.205 1.00 0.00 C ATOM 814 OD1 ASN A 51 -11.775 3.086 -16.667 1.00 0.00 O flip ATOM 815 ND2 ASN A 51 -12.550 5.179 -16.916 1.00 0.00 N flip ATOM 0 H ASN A 51 -12.169 2.852 -11.950 1.00 0.00 H new ATOM 0 HA ASN A 51 -11.896 2.410 -14.583 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -12.586 5.150 -14.313 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -10.865 5.131 -14.646 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -12.760 6.095 -16.520 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -12.740 4.993 -17.901 1.00 0.00 H new ATOM 822 N PRO A 52 -9.544 1.969 -13.801 1.00 0.00 N ATOM 823 CA PRO A 52 -8.159 1.713 -13.393 1.00 0.00 C ATOM 824 C PRO A 52 -7.199 2.814 -13.857 1.00 0.00 C ATOM 825 O PRO A 52 -7.558 3.630 -14.706 1.00 0.00 O ATOM 826 CB PRO A 52 -7.815 0.378 -14.067 1.00 0.00 C ATOM 827 CG PRO A 52 -8.852 0.190 -15.119 1.00 0.00 C ATOM 828 CD PRO A 52 -10.090 0.863 -14.602 1.00 0.00 C ATOM 0 HA PRO A 52 -8.059 1.689 -12.308 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -6.815 0.402 -14.500 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -7.831 -0.441 -13.348 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -8.534 0.630 -16.064 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -9.032 -0.869 -15.305 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -10.724 1.224 -15.412 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -10.697 0.187 -13.999 1.00 0.00 H new ATOM 836 N THR A 53 -5.975 2.842 -13.305 1.00 0.00 N ATOM 837 CA THR A 53 -5.535 1.880 -12.297 1.00 0.00 C ATOM 838 C THR A 53 -5.428 2.552 -10.934 1.00 0.00 C ATOM 839 O THR A 53 -4.746 3.565 -10.781 1.00 0.00 O ATOM 840 CB THR A 53 -4.192 1.259 -12.706 1.00 0.00 C ATOM 841 OG1 THR A 53 -4.396 0.151 -13.565 1.00 0.00 O ATOM 842 CG2 THR A 53 -3.355 0.778 -11.538 1.00 0.00 C ATOM 0 H THR A 53 -5.267 3.535 -13.549 1.00 0.00 H new ATOM 0 HA THR A 53 -6.274 1.082 -12.226 1.00 0.00 H new ATOM 0 HB THR A 53 -3.652 2.064 -13.205 1.00 0.00 H new ATOM 0 HG1 THR A 53 -3.530 -0.231 -13.817 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.423 0.353 -11.909 1.00 0.00 H new ATOM 0 HG22 THR A 53 -3.134 1.617 -10.879 1.00 0.00 H new ATOM 0 HG23 THR A 53 -3.906 0.017 -10.985 1.00 0.00 H new ATOM 850 N TRP A 54 -6.118 1.987 -9.952 1.00 0.00 N ATOM 851 CA TRP A 54 -6.112 2.540 -8.605 1.00 0.00 C ATOM 852 C TRP A 54 -5.105 1.838 -7.705 1.00 0.00 C ATOM 853 O TRP A 54 -4.670 0.719 -7.980 1.00 0.00 O ATOM 854 CB TRP A 54 -7.507 2.444 -7.989 1.00 0.00 C ATOM 855 CG TRP A 54 -8.545 3.182 -8.771 1.00 0.00 C ATOM 856 CD1 TRP A 54 -9.058 2.829 -9.985 1.00 0.00 C ATOM 857 CD2 TRP A 54 -9.194 4.403 -8.398 1.00 0.00 C ATOM 858 NE1 TRP A 54 -9.987 3.754 -10.391 1.00 0.00 N ATOM 859 CE2 TRP A 54 -10.088 4.731 -9.433 1.00 0.00 C ATOM 860 CE3 TRP A 54 -9.104 5.250 -7.289 1.00 0.00 C ATOM 861 CZ2 TRP A 54 -10.888 5.870 -9.390 1.00 0.00 C ATOM 862 CZ3 TRP A 54 -9.898 6.379 -7.248 1.00 0.00 C ATOM 863 CH2 TRP A 54 -10.780 6.682 -8.292 1.00 0.00 C ATOM 0 H TRP A 54 -6.688 1.148 -10.063 1.00 0.00 H new ATOM 0 HA TRP A 54 -5.816 3.586 -8.685 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -7.794 1.395 -7.915 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -7.477 2.838 -6.973 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -8.774 1.950 -10.545 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -10.516 3.721 -11.263 1.00 0.00 H new ATOM 0 HE3 TRP A 54 -8.426 5.025 -6.479 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -11.570 6.105 -10.194 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 -9.838 7.040 -6.396 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -11.387 7.573 -8.231 1.00 0.00 H new ATOM 874 N HIS A 55 -4.755 2.514 -6.620 1.00 0.00 N ATOM 875 CA HIS A 55 -3.815 1.994 -5.639 1.00 0.00 C ATOM 876 C HIS A 55 -4.126 2.604 -4.280 1.00 0.00 C ATOM 877 O HIS A 55 -3.973 3.809 -4.086 1.00 0.00 O ATOM 878 CB HIS A 55 -2.379 2.316 -6.053 1.00 0.00 C ATOM 879 CG HIS A 55 -2.229 2.597 -7.515 1.00 0.00 C ATOM 880 ND1 HIS A 55 -1.346 1.915 -8.326 1.00 0.00 N ATOM 881 CD2 HIS A 55 -2.858 3.490 -8.315 1.00 0.00 C ATOM 882 CE1 HIS A 55 -1.438 2.377 -9.560 1.00 0.00 C ATOM 883 NE2 HIS A 55 -2.349 3.332 -9.581 1.00 0.00 N ATOM 0 H HIS A 55 -5.116 3.441 -6.395 1.00 0.00 H new ATOM 0 HA HIS A 55 -3.914 0.910 -5.581 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -2.031 3.180 -5.487 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -1.735 1.479 -5.784 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -3.618 4.195 -8.014 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -0.865 2.032 -10.408 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -2.629 3.866 -10.404 1.00 0.00 H new ATOM 892 N CYS A 56 -4.599 1.781 -3.352 1.00 0.00 N ATOM 893 CA CYS A 56 -4.965 2.280 -2.033 1.00 0.00 C ATOM 894 C CYS A 56 -4.172 1.620 -0.910 1.00 0.00 C ATOM 895 O CYS A 56 -3.748 0.468 -1.014 1.00 0.00 O ATOM 896 CB CYS A 56 -6.461 2.073 -1.796 1.00 0.00 C ATOM 897 SG CYS A 56 -6.916 0.368 -1.401 1.00 0.00 S ATOM 0 H CYS A 56 -4.737 0.779 -3.485 1.00 0.00 H new ATOM 0 HA CYS A 56 -4.723 3.343 -2.017 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -6.782 2.722 -0.981 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -7.006 2.386 -2.686 1.00 0.00 H new ATOM 0 HG CYS A 56 -6.104 -0.449 -2.003 1.00 0.00 H new ATOM 903 N ILE A 57 -4.000 2.370 0.173 1.00 0.00 N ATOM 904 CA ILE A 57 -3.282 1.890 1.348 1.00 0.00 C ATOM 905 C ILE A 57 -4.142 2.045 2.598 1.00 0.00 C ATOM 906 O ILE A 57 -4.521 3.156 2.967 1.00 0.00 O ATOM 907 CB ILE A 57 -1.957 2.650 1.558 1.00 0.00 C ATOM 908 CG1 ILE A 57 -1.154 2.704 0.254 1.00 0.00 C ATOM 909 CG2 ILE A 57 -1.145 2.002 2.671 1.00 0.00 C ATOM 910 CD1 ILE A 57 -0.986 1.358 -0.418 1.00 0.00 C ATOM 0 H ILE A 57 -4.352 3.323 0.261 1.00 0.00 H new ATOM 0 HA ILE A 57 -3.058 0.837 1.177 1.00 0.00 H new ATOM 0 HB ILE A 57 -2.186 3.673 1.855 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -1.649 3.386 -0.438 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -0.169 3.121 0.462 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -0.213 2.550 2.807 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -1.717 2.023 3.598 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -0.923 0.968 2.405 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.407 1.478 -1.334 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -0.463 0.678 0.255 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -1.966 0.947 -0.660 1.00 0.00 H new ATOM 922 N VAL A 58 -4.453 0.927 3.245 1.00 0.00 N ATOM 923 CA VAL A 58 -5.275 0.949 4.449 1.00 0.00 C ATOM 924 C VAL A 58 -4.468 0.528 5.671 1.00 0.00 C ATOM 925 O VAL A 58 -3.882 -0.552 5.697 1.00 0.00 O ATOM 926 CB VAL A 58 -6.500 0.028 4.305 1.00 0.00 C ATOM 927 CG1 VAL A 58 -6.083 -1.334 3.782 1.00 0.00 C ATOM 928 CG2 VAL A 58 -7.234 -0.103 5.632 1.00 0.00 C ATOM 0 H VAL A 58 -4.149 -0.003 2.957 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.618 1.975 4.584 1.00 0.00 H new ATOM 0 HB VAL A 58 -7.184 0.476 3.584 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -6.962 -1.972 3.687 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -5.610 -1.220 2.807 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.377 -1.790 4.477 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -8.096 -0.758 5.508 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -6.562 -0.525 6.379 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -7.570 0.880 5.961 1.00 0.00 H new ATOM 938 N GLY A 59 -4.442 1.390 6.683 1.00 0.00 N ATOM 939 CA GLY A 59 -3.701 1.089 7.892 1.00 0.00 C ATOM 940 C GLY A 59 -4.200 1.880 9.083 1.00 0.00 C ATOM 941 O GLY A 59 -5.060 2.748 8.943 1.00 0.00 O ATOM 0 H GLY A 59 -4.921 2.291 6.686 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -3.779 0.023 8.108 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -2.645 1.305 7.732 1.00 0.00 H new ATOM 945 N ARG A 60 -3.665 1.577 10.258 1.00 0.00 N ATOM 946 CA ARG A 60 -4.072 2.265 11.475 1.00 0.00 C ATOM 947 C ARG A 60 -2.870 2.598 12.351 1.00 0.00 C ATOM 948 O ARG A 60 -2.933 2.481 13.574 1.00 0.00 O ATOM 949 CB ARG A 60 -5.059 1.401 12.254 1.00 0.00 C ATOM 950 CG ARG A 60 -4.738 -0.084 12.199 1.00 0.00 C ATOM 951 CD ARG A 60 -5.907 -0.926 12.683 1.00 0.00 C ATOM 952 NE ARG A 60 -5.473 -2.018 13.550 1.00 0.00 N ATOM 953 CZ ARG A 60 -4.851 -3.107 13.111 1.00 0.00 C ATOM 954 NH1 ARG A 60 -4.591 -3.247 11.818 1.00 0.00 N ATOM 955 NH2 ARG A 60 -4.487 -4.055 13.963 1.00 0.00 N ATOM 0 H ARG A 60 -2.951 0.862 10.394 1.00 0.00 H new ATOM 0 HA ARG A 60 -4.553 3.201 11.190 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -5.070 1.724 13.295 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -6.062 1.563 11.859 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -4.485 -0.365 11.177 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -3.861 -0.291 12.813 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -6.611 -0.293 13.223 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -6.439 -1.335 11.824 1.00 0.00 H new ATOM 0 HE ARG A 60 -5.658 -1.940 14.550 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -4.869 -2.519 11.160 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -4.113 -4.083 11.481 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -4.684 -3.949 14.958 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -4.010 -4.890 13.623 1.00 0.00 H new ATOM 969 N ASN A 61 -1.779 3.016 11.721 1.00 0.00 N ATOM 970 CA ASN A 61 -0.568 3.368 12.449 1.00 0.00 C ATOM 971 C ASN A 61 0.611 3.525 11.499 1.00 0.00 C ATOM 972 O ASN A 61 1.762 3.298 11.877 1.00 0.00 O ATOM 973 CB ASN A 61 -0.253 2.305 13.504 1.00 0.00 C ATOM 974 CG ASN A 61 -0.051 2.903 14.882 1.00 0.00 C ATOM 975 OD1 ASN A 61 0.852 2.504 15.618 1.00 0.00 O ATOM 976 ND2 ASN A 61 -0.893 3.865 15.240 1.00 0.00 N ATOM 0 H ASN A 61 -1.709 3.119 10.709 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.738 4.323 12.947 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -1.067 1.581 13.541 1.00 0.00 H new ATOM 0 HB3 ASN A 61 0.645 1.761 13.211 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -0.806 4.304 16.157 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -1.627 4.165 14.599 1.00 0.00 H new ATOM 983 N PHE A 62 0.317 3.913 10.265 1.00 0.00 N ATOM 984 CA PHE A 62 1.353 4.099 9.257 1.00 0.00 C ATOM 985 C PHE A 62 1.419 5.551 8.797 1.00 0.00 C ATOM 986 O PHE A 62 0.759 6.426 9.356 1.00 0.00 O ATOM 987 CB PHE A 62 1.091 3.189 8.057 1.00 0.00 C ATOM 988 CG PHE A 62 0.038 3.717 7.126 1.00 0.00 C ATOM 989 CD1 PHE A 62 0.380 4.567 6.086 1.00 0.00 C ATOM 990 CD2 PHE A 62 -1.292 3.366 7.289 1.00 0.00 C ATOM 991 CE1 PHE A 62 -0.585 5.057 5.228 1.00 0.00 C ATOM 992 CE2 PHE A 62 -2.262 3.851 6.432 1.00 0.00 C ATOM 993 CZ PHE A 62 -1.909 4.698 5.400 1.00 0.00 C ATOM 0 H PHE A 62 -0.630 4.105 9.938 1.00 0.00 H new ATOM 0 HA PHE A 62 2.310 3.837 9.708 1.00 0.00 H new ATOM 0 HB2 PHE A 62 2.020 3.054 7.503 1.00 0.00 H new ATOM 0 HB3 PHE A 62 0.788 2.205 8.416 1.00 0.00 H new ATOM 0 HD1 PHE A 62 1.413 4.849 5.945 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -1.574 2.705 8.095 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -0.305 5.720 4.423 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -3.295 3.568 6.569 1.00 0.00 H new ATOM 0 HZ PHE A 62 -2.665 5.079 4.729 1.00 0.00 H new ATOM 1003 N GLY A 63 2.222 5.791 7.767 1.00 0.00 N ATOM 1004 CA GLY A 63 2.373 7.129 7.227 1.00 0.00 C ATOM 1005 C GLY A 63 2.553 7.110 5.724 1.00 0.00 C ATOM 1006 O GLY A 63 3.634 6.795 5.227 1.00 0.00 O ATOM 0 H GLY A 63 2.775 5.077 7.293 1.00 0.00 H new ATOM 0 HA2 GLY A 63 1.496 7.725 7.481 1.00 0.00 H new ATOM 0 HA3 GLY A 63 3.233 7.613 7.690 1.00 0.00 H new ATOM 1010 N SER A 64 1.490 7.433 4.999 1.00 0.00 N ATOM 1011 CA SER A 64 1.536 7.434 3.543 1.00 0.00 C ATOM 1012 C SER A 64 2.077 8.751 2.996 1.00 0.00 C ATOM 1013 O SER A 64 1.727 9.829 3.475 1.00 0.00 O ATOM 1014 CB SER A 64 0.147 7.164 2.962 1.00 0.00 C ATOM 1015 OG SER A 64 -0.798 8.111 3.434 1.00 0.00 O ATOM 0 H SER A 64 0.588 7.697 5.394 1.00 0.00 H new ATOM 0 HA SER A 64 2.215 6.637 3.240 1.00 0.00 H new ATOM 0 HB2 SER A 64 0.191 7.202 1.874 1.00 0.00 H new ATOM 0 HB3 SER A 64 -0.175 6.159 3.233 1.00 0.00 H new ATOM 0 HG SER A 64 -1.115 8.658 2.685 1.00 0.00 H new ATOM 1021 N TYR A 65 2.926 8.645 1.980 1.00 0.00 N ATOM 1022 CA TYR A 65 3.518 9.815 1.341 1.00 0.00 C ATOM 1023 C TYR A 65 3.878 9.494 -0.106 1.00 0.00 C ATOM 1024 O TYR A 65 4.986 9.040 -0.399 1.00 0.00 O ATOM 1025 CB TYR A 65 4.759 10.277 2.106 1.00 0.00 C ATOM 1026 CG TYR A 65 5.339 11.576 1.593 1.00 0.00 C ATOM 1027 CD1 TYR A 65 6.287 11.582 0.578 1.00 0.00 C ATOM 1028 CD2 TYR A 65 4.941 12.796 2.126 1.00 0.00 C ATOM 1029 CE1 TYR A 65 6.822 12.767 0.109 1.00 0.00 C ATOM 1030 CE2 TYR A 65 5.471 13.985 1.661 1.00 0.00 C ATOM 1031 CZ TYR A 65 6.410 13.965 0.653 1.00 0.00 C ATOM 1032 OH TYR A 65 6.941 15.146 0.188 1.00 0.00 O ATOM 0 H TYR A 65 3.221 7.755 1.579 1.00 0.00 H new ATOM 0 HA TYR A 65 2.787 10.624 1.353 1.00 0.00 H new ATOM 0 HB2 TYR A 65 4.503 10.394 3.159 1.00 0.00 H new ATOM 0 HB3 TYR A 65 5.522 9.500 2.047 1.00 0.00 H new ATOM 0 HD1 TYR A 65 6.611 10.646 0.148 1.00 0.00 H new ATOM 0 HD2 TYR A 65 4.205 12.816 2.917 1.00 0.00 H new ATOM 0 HE1 TYR A 65 7.559 12.755 -0.680 1.00 0.00 H new ATOM 0 HE2 TYR A 65 5.151 14.925 2.086 1.00 0.00 H new ATOM 0 HH TYR A 65 6.544 15.898 0.676 1.00 0.00 H new ATOM 1042 N VAL A 66 2.927 9.723 -1.005 1.00 0.00 N ATOM 1043 CA VAL A 66 3.132 9.449 -2.421 1.00 0.00 C ATOM 1044 C VAL A 66 2.621 10.598 -3.285 1.00 0.00 C ATOM 1045 O VAL A 66 2.427 11.714 -2.803 1.00 0.00 O ATOM 1046 CB VAL A 66 2.420 8.152 -2.845 1.00 0.00 C ATOM 1047 CG1 VAL A 66 2.774 7.016 -1.898 1.00 0.00 C ATOM 1048 CG2 VAL A 66 0.915 8.366 -2.893 1.00 0.00 C ATOM 0 H VAL A 66 2.006 10.098 -0.777 1.00 0.00 H new ATOM 0 HA VAL A 66 4.206 9.336 -2.570 1.00 0.00 H new ATOM 0 HB VAL A 66 2.759 7.879 -3.844 1.00 0.00 H new ATOM 0 HG11 VAL A 66 2.262 6.107 -2.213 1.00 0.00 H new ATOM 0 HG12 VAL A 66 3.851 6.850 -1.915 1.00 0.00 H new ATOM 0 HG13 VAL A 66 2.463 7.276 -0.886 1.00 0.00 H new ATOM 0 HG21 VAL A 66 0.425 7.440 -3.194 1.00 0.00 H new ATOM 0 HG22 VAL A 66 0.558 8.661 -1.906 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.682 9.151 -3.613 1.00 0.00 H new ATOM 1058 N THR A 67 2.402 10.312 -4.564 1.00 0.00 N ATOM 1059 CA THR A 67 1.911 11.319 -5.497 1.00 0.00 C ATOM 1060 C THR A 67 0.407 11.167 -5.717 1.00 0.00 C ATOM 1061 O THR A 67 -0.288 10.540 -4.917 1.00 0.00 O ATOM 1062 CB THR A 67 2.662 11.220 -6.829 1.00 0.00 C ATOM 1063 OG1 THR A 67 2.760 12.493 -7.442 1.00 0.00 O ATOM 1064 CG2 THR A 67 2.016 10.281 -7.826 1.00 0.00 C ATOM 0 H THR A 67 2.557 9.393 -4.978 1.00 0.00 H new ATOM 0 HA THR A 67 2.093 12.304 -5.067 1.00 0.00 H new ATOM 0 HB THR A 67 3.644 10.822 -6.572 1.00 0.00 H new ATOM 0 HG1 THR A 67 3.244 12.411 -8.290 1.00 0.00 H new ATOM 0 HG21 THR A 67 2.604 10.264 -8.743 1.00 0.00 H new ATOM 0 HG22 THR A 67 1.972 9.277 -7.404 1.00 0.00 H new ATOM 0 HG23 THR A 67 1.006 10.626 -8.049 1.00 0.00 H new ATOM 1072 N HIS A 68 -0.088 11.746 -6.807 1.00 0.00 N ATOM 1073 CA HIS A 68 -1.508 11.674 -7.134 1.00 0.00 C ATOM 1074 C HIS A 68 -1.762 12.164 -8.556 1.00 0.00 C ATOM 1075 O HIS A 68 -1.422 13.295 -8.905 1.00 0.00 O ATOM 1076 CB HIS A 68 -2.323 12.507 -6.142 1.00 0.00 C ATOM 1077 CG HIS A 68 -2.189 13.982 -6.352 1.00 0.00 C ATOM 1078 ND1 HIS A 68 -2.918 14.841 -7.106 1.00 0.00 N flip ATOM 1079 CD2 HIS A 68 -1.206 14.741 -5.754 1.00 0.00 C flip ATOM 1080 CE1 HIS A 68 -2.366 16.088 -6.948 1.00 0.00 C flip ATOM 1081 NE2 HIS A 68 -1.335 16.002 -6.128 1.00 0.00 N flip ATOM 0 H HIS A 68 0.473 12.270 -7.478 1.00 0.00 H new ATOM 0 HA HIS A 68 -1.820 10.632 -7.066 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -3.374 12.230 -6.224 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -2.007 12.262 -5.128 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -0.448 14.364 -5.084 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -2.719 16.994 -7.419 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -0.740 16.776 -5.833 1.00 0.00 H new ATOM 1090 N GLU A 69 -2.360 11.304 -9.374 1.00 0.00 N ATOM 1091 CA GLU A 69 -2.660 11.647 -10.759 1.00 0.00 C ATOM 1092 C GLU A 69 -4.108 11.313 -11.102 1.00 0.00 C ATOM 1093 O GLU A 69 -4.734 10.479 -10.448 1.00 0.00 O ATOM 1094 CB GLU A 69 -1.717 10.904 -11.710 1.00 0.00 C ATOM 1095 CG GLU A 69 -0.565 10.204 -11.006 1.00 0.00 C ATOM 1096 CD GLU A 69 0.787 10.616 -11.552 1.00 0.00 C ATOM 1097 OE1 GLU A 69 0.903 11.755 -12.052 1.00 0.00 O ATOM 1098 OE2 GLU A 69 1.731 9.802 -11.477 1.00 0.00 O ATOM 0 H GLU A 69 -2.647 10.364 -9.101 1.00 0.00 H new ATOM 0 HA GLU A 69 -2.514 12.721 -10.878 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -2.290 10.166 -12.272 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -1.313 11.612 -12.433 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -0.606 10.427 -9.940 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -0.682 9.125 -11.110 1.00 0.00 H new ATOM 1105 N THR A 70 -4.633 11.966 -12.133 1.00 0.00 N ATOM 1106 CA THR A 70 -6.007 11.736 -12.563 1.00 0.00 C ATOM 1107 C THR A 70 -6.997 12.392 -11.607 1.00 0.00 C ATOM 1108 O THR A 70 -7.440 13.519 -11.832 1.00 0.00 O ATOM 1109 CB THR A 70 -6.288 10.236 -12.656 1.00 0.00 C ATOM 1110 OG1 THR A 70 -5.097 9.519 -12.927 1.00 0.00 O ATOM 1111 CG2 THR A 70 -7.293 9.881 -13.730 1.00 0.00 C ATOM 0 H THR A 70 -4.128 12.658 -12.686 1.00 0.00 H new ATOM 0 HA THR A 70 -6.132 12.186 -13.548 1.00 0.00 H new ATOM 0 HB THR A 70 -6.704 9.959 -11.687 1.00 0.00 H new ATOM 0 HG1 THR A 70 -5.297 8.561 -12.981 1.00 0.00 H new ATOM 0 HG21 THR A 70 -7.446 8.802 -13.742 1.00 0.00 H new ATOM 0 HG22 THR A 70 -8.240 10.380 -13.522 1.00 0.00 H new ATOM 0 HG23 THR A 70 -6.918 10.205 -14.701 1.00 0.00 H new ATOM 1119 N LYS A 71 -7.342 11.680 -10.539 1.00 0.00 N ATOM 1120 CA LYS A 71 -8.281 12.192 -9.548 1.00 0.00 C ATOM 1121 C LYS A 71 -7.572 12.509 -8.236 1.00 0.00 C ATOM 1122 O LYS A 71 -8.214 12.699 -7.203 1.00 0.00 O ATOM 1123 CB LYS A 71 -9.397 11.175 -9.302 1.00 0.00 C ATOM 1124 CG LYS A 71 -10.149 10.784 -10.563 1.00 0.00 C ATOM 1125 CD LYS A 71 -11.609 10.481 -10.270 1.00 0.00 C ATOM 1126 CE LYS A 71 -12.453 10.536 -11.532 1.00 0.00 C ATOM 1127 NZ LYS A 71 -13.879 10.847 -11.235 1.00 0.00 N ATOM 0 H LYS A 71 -6.985 10.746 -10.338 1.00 0.00 H new ATOM 0 HA LYS A 71 -8.714 13.113 -9.938 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -8.969 10.280 -8.851 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -10.102 11.589 -8.581 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -10.083 11.592 -11.292 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -9.678 9.910 -11.012 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -11.693 9.493 -9.818 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -11.992 11.198 -9.543 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -12.050 11.292 -12.206 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -12.391 9.580 -12.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -14.477 10.520 -12.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -14.164 10.365 -10.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -13.993 11.874 -11.118 1.00 0.00 H new ATOM 1141 N HIS A 72 -6.246 12.566 -8.285 1.00 0.00 N ATOM 1142 CA HIS A 72 -5.451 12.863 -7.099 1.00 0.00 C ATOM 1143 C HIS A 72 -5.465 11.685 -6.130 1.00 0.00 C ATOM 1144 O HIS A 72 -4.576 10.834 -6.160 1.00 0.00 O ATOM 1145 CB HIS A 72 -5.982 14.120 -6.407 1.00 0.00 C ATOM 1146 CG HIS A 72 -6.037 15.317 -7.305 1.00 0.00 C ATOM 1147 ND1 HIS A 72 -5.613 16.571 -6.917 1.00 0.00 N ATOM 1148 CD2 HIS A 72 -6.469 15.447 -8.583 1.00 0.00 C ATOM 1149 CE1 HIS A 72 -5.782 17.421 -7.916 1.00 0.00 C ATOM 1150 NE2 HIS A 72 -6.300 16.763 -8.938 1.00 0.00 N ATOM 0 H HIS A 72 -5.699 12.411 -9.132 1.00 0.00 H new ATOM 0 HA HIS A 72 -4.422 13.039 -7.412 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -6.981 13.918 -6.022 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -5.349 14.348 -5.549 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -6.871 14.662 -9.206 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -5.538 18.473 -7.899 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -6.536 17.167 -9.844 1.00 0.00 H new ATOM 1159 N PHE A 73 -6.483 11.641 -5.274 1.00 0.00 N ATOM 1160 CA PHE A 73 -6.620 10.569 -4.297 1.00 0.00 C ATOM 1161 C PHE A 73 -7.584 10.977 -3.192 1.00 0.00 C ATOM 1162 O PHE A 73 -8.299 11.971 -3.318 1.00 0.00 O ATOM 1163 CB PHE A 73 -5.257 10.206 -3.699 1.00 0.00 C ATOM 1164 CG PHE A 73 -4.589 11.341 -2.977 1.00 0.00 C ATOM 1165 CD1 PHE A 73 -5.202 11.944 -1.890 1.00 0.00 C ATOM 1166 CD2 PHE A 73 -3.346 11.803 -3.381 1.00 0.00 C ATOM 1167 CE1 PHE A 73 -4.589 12.987 -1.222 1.00 0.00 C ATOM 1168 CE2 PHE A 73 -2.729 12.846 -2.716 1.00 0.00 C ATOM 1169 CZ PHE A 73 -3.352 13.439 -1.635 1.00 0.00 C ATOM 0 H PHE A 73 -7.226 12.339 -5.239 1.00 0.00 H new ATOM 0 HA PHE A 73 -7.020 9.692 -4.806 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -5.384 9.373 -3.008 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -4.601 9.860 -4.498 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -6.170 11.595 -1.561 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -2.854 11.343 -4.225 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -5.078 13.448 -0.377 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -1.761 13.197 -3.041 1.00 0.00 H new ATOM 0 HZ PHE A 73 -2.872 14.254 -1.114 1.00 0.00 H new ATOM 1179 N ILE A 74 -7.604 10.211 -2.108 1.00 0.00 N ATOM 1180 CA ILE A 74 -8.488 10.510 -0.992 1.00 0.00 C ATOM 1181 C ILE A 74 -8.097 9.735 0.258 1.00 0.00 C ATOM 1182 O ILE A 74 -8.259 8.518 0.325 1.00 0.00 O ATOM 1183 CB ILE A 74 -9.956 10.199 -1.333 1.00 0.00 C ATOM 1184 CG1 ILE A 74 -10.877 10.773 -0.229 1.00 0.00 C ATOM 1185 CG2 ILE A 74 -10.135 8.695 -1.541 1.00 0.00 C ATOM 1186 CD1 ILE A 74 -11.848 9.791 0.406 1.00 0.00 C ATOM 0 H ILE A 74 -7.022 9.384 -1.980 1.00 0.00 H new ATOM 0 HA ILE A 74 -8.384 11.577 -0.797 1.00 0.00 H new ATOM 0 HB ILE A 74 -10.240 10.680 -2.269 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -10.250 11.193 0.557 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -11.450 11.597 -0.654 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -11.177 8.482 -1.782 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -9.498 8.363 -2.361 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -9.858 8.166 -0.629 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -12.440 10.304 1.164 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -12.510 9.387 -0.360 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -11.291 8.977 0.870 1.00 0.00 H new ATOM 1198 N TYR A 75 -7.593 10.456 1.252 1.00 0.00 N ATOM 1199 CA TYR A 75 -7.192 9.850 2.513 1.00 0.00 C ATOM 1200 C TYR A 75 -8.272 10.067 3.564 1.00 0.00 C ATOM 1201 O TYR A 75 -8.848 11.150 3.654 1.00 0.00 O ATOM 1202 CB TYR A 75 -5.866 10.447 2.995 1.00 0.00 C ATOM 1203 CG TYR A 75 -4.715 10.295 2.018 1.00 0.00 C ATOM 1204 CD1 TYR A 75 -4.934 9.999 0.674 1.00 0.00 C ATOM 1205 CD2 TYR A 75 -3.403 10.452 2.445 1.00 0.00 C ATOM 1206 CE1 TYR A 75 -3.880 9.865 -0.209 1.00 0.00 C ATOM 1207 CE2 TYR A 75 -2.344 10.320 1.568 1.00 0.00 C ATOM 1208 CZ TYR A 75 -2.587 10.026 0.244 1.00 0.00 C ATOM 1209 OH TYR A 75 -1.534 9.893 -0.631 1.00 0.00 O ATOM 0 H TYR A 75 -7.452 11.465 1.207 1.00 0.00 H new ATOM 0 HA TYR A 75 -7.057 8.780 2.357 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -6.013 11.507 3.201 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -5.591 9.974 3.938 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -5.945 9.872 0.316 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -3.207 10.682 3.482 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -4.067 9.636 -1.248 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -1.330 10.447 1.918 1.00 0.00 H new ATOM 0 HH TYR A 75 -0.947 9.168 -0.329 1.00 0.00 H new ATOM 1219 N PHE A 76 -8.550 9.034 4.347 1.00 0.00 N ATOM 1220 CA PHE A 76 -9.572 9.120 5.384 1.00 0.00 C ATOM 1221 C PHE A 76 -9.364 8.047 6.445 1.00 0.00 C ATOM 1222 O PHE A 76 -9.152 6.877 6.125 1.00 0.00 O ATOM 1223 CB PHE A 76 -10.962 8.973 4.763 1.00 0.00 C ATOM 1224 CG PHE A 76 -11.003 7.992 3.627 1.00 0.00 C ATOM 1225 CD1 PHE A 76 -10.343 8.263 2.440 1.00 0.00 C ATOM 1226 CD2 PHE A 76 -11.696 6.799 3.748 1.00 0.00 C ATOM 1227 CE1 PHE A 76 -10.373 7.361 1.393 1.00 0.00 C ATOM 1228 CE2 PHE A 76 -11.730 5.893 2.704 1.00 0.00 C ATOM 1229 CZ PHE A 76 -11.068 6.175 1.525 1.00 0.00 C ATOM 0 H PHE A 76 -8.084 8.129 4.285 1.00 0.00 H new ATOM 0 HA PHE A 76 -9.491 10.096 5.862 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -11.665 8.656 5.533 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -11.298 9.947 4.406 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -9.799 9.189 2.331 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -12.215 6.574 4.668 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -9.853 7.584 0.473 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -12.274 4.966 2.810 1.00 0.00 H new ATOM 0 HZ PHE A 76 -11.094 5.469 0.708 1.00 0.00 H new ATOM 1239 N TYR A 77 -9.430 8.451 7.708 1.00 0.00 N ATOM 1240 CA TYR A 77 -9.252 7.521 8.816 1.00 0.00 C ATOM 1241 C TYR A 77 -10.601 7.087 9.381 1.00 0.00 C ATOM 1242 O TYR A 77 -11.243 7.828 10.125 1.00 0.00 O ATOM 1243 CB TYR A 77 -8.399 8.159 9.917 1.00 0.00 C ATOM 1244 CG TYR A 77 -8.533 7.481 11.264 1.00 0.00 C ATOM 1245 CD1 TYR A 77 -7.765 6.367 11.584 1.00 0.00 C ATOM 1246 CD2 TYR A 77 -9.428 7.956 12.214 1.00 0.00 C ATOM 1247 CE1 TYR A 77 -7.887 5.747 12.813 1.00 0.00 C ATOM 1248 CE2 TYR A 77 -9.555 7.340 13.447 1.00 0.00 C ATOM 1249 CZ TYR A 77 -8.782 6.237 13.740 1.00 0.00 C ATOM 1250 OH TYR A 77 -8.905 5.622 14.965 1.00 0.00 O ATOM 0 H TYR A 77 -9.605 9.415 7.990 1.00 0.00 H new ATOM 0 HA TYR A 77 -8.736 6.638 8.439 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -7.353 8.137 9.612 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -8.679 9.207 10.019 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -7.062 5.980 10.861 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -10.035 8.820 11.987 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -7.284 4.882 13.046 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -10.256 7.721 14.175 1.00 0.00 H new ATOM 0 HH TYR A 77 -9.839 5.664 15.260 1.00 0.00 H new ATOM 1260 N LEU A 78 -11.023 5.879 9.022 1.00 0.00 N ATOM 1261 CA LEU A 78 -12.294 5.342 9.492 1.00 0.00 C ATOM 1262 C LEU A 78 -12.353 5.348 11.015 1.00 0.00 C ATOM 1263 O LEU A 78 -11.348 5.595 11.683 1.00 0.00 O ATOM 1264 CB LEU A 78 -12.493 3.918 8.971 1.00 0.00 C ATOM 1265 CG LEU A 78 -13.068 3.814 7.556 1.00 0.00 C ATOM 1266 CD1 LEU A 78 -14.521 4.263 7.537 1.00 0.00 C ATOM 1267 CD2 LEU A 78 -12.241 4.637 6.580 1.00 0.00 C ATOM 0 H LEU A 78 -10.503 5.253 8.407 1.00 0.00 H new ATOM 0 HA LEU A 78 -13.093 5.977 9.110 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -11.533 3.403 8.994 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -13.156 3.388 9.655 1.00 0.00 H new ATOM 0 HG LEU A 78 -13.026 2.770 7.244 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -14.913 4.182 6.523 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -15.106 3.630 8.204 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -14.586 5.299 7.870 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -12.666 4.550 5.580 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -12.249 5.683 6.888 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -11.215 4.269 6.572 1.00 0.00 H new ATOM 1279 N GLY A 79 -13.534 5.076 11.558 1.00 0.00 N ATOM 1280 CA GLY A 79 -13.701 5.055 13.000 1.00 0.00 C ATOM 1281 C GLY A 79 -12.442 4.623 13.728 1.00 0.00 C ATOM 1282 O GLY A 79 -12.169 5.088 14.835 1.00 0.00 O ATOM 0 H GLY A 79 -14.379 4.870 11.026 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -13.991 6.048 13.343 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -14.515 4.378 13.258 1.00 0.00 H new ATOM 1286 N GLN A 80 -11.676 3.730 13.110 1.00 0.00 N ATOM 1287 CA GLN A 80 -10.442 3.236 13.714 1.00 0.00 C ATOM 1288 C GLN A 80 -9.518 2.632 12.660 1.00 0.00 C ATOM 1289 O GLN A 80 -8.879 1.607 12.894 1.00 0.00 O ATOM 1290 CB GLN A 80 -10.761 2.192 14.785 1.00 0.00 C ATOM 1291 CG GLN A 80 -10.065 2.447 16.113 1.00 0.00 C ATOM 1292 CD GLN A 80 -10.678 3.602 16.881 1.00 0.00 C ATOM 1293 OE1 GLN A 80 -10.019 4.606 17.147 1.00 0.00 O ATOM 1294 NE2 GLN A 80 -11.948 3.462 17.246 1.00 0.00 N ATOM 0 H GLN A 80 -11.886 3.334 12.194 1.00 0.00 H new ATOM 0 HA GLN A 80 -9.930 4.081 14.175 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -11.838 2.169 14.948 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -10.473 1.207 14.417 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -10.112 1.545 16.723 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -9.010 2.655 15.932 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -12.457 2.612 17.004 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -12.413 4.205 17.768 1.00 0.00 H new ATOM 1303 N VAL A 81 -9.452 3.274 11.498 1.00 0.00 N ATOM 1304 CA VAL A 81 -8.609 2.802 10.408 1.00 0.00 C ATOM 1305 C VAL A 81 -8.267 3.942 9.458 1.00 0.00 C ATOM 1306 O VAL A 81 -8.889 5.003 9.496 1.00 0.00 O ATOM 1307 CB VAL A 81 -9.300 1.674 9.619 1.00 0.00 C ATOM 1308 CG1 VAL A 81 -8.474 1.277 8.405 1.00 0.00 C ATOM 1309 CG2 VAL A 81 -9.551 0.474 10.519 1.00 0.00 C ATOM 0 H VAL A 81 -9.974 4.125 11.288 1.00 0.00 H new ATOM 0 HA VAL A 81 -7.692 2.413 10.851 1.00 0.00 H new ATOM 0 HB VAL A 81 -10.262 2.044 9.263 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -8.983 0.479 7.864 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -8.353 2.139 7.750 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -7.494 0.928 8.730 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -10.040 -0.314 9.946 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -8.601 0.105 10.907 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -10.192 0.770 11.350 1.00 0.00 H new ATOM 1319 N ALA A 82 -7.275 3.717 8.607 1.00 0.00 N ATOM 1320 CA ALA A 82 -6.851 4.724 7.645 1.00 0.00 C ATOM 1321 C ALA A 82 -6.867 4.155 6.234 1.00 0.00 C ATOM 1322 O ALA A 82 -6.509 2.997 6.017 1.00 0.00 O ATOM 1323 CB ALA A 82 -5.466 5.243 7.998 1.00 0.00 C ATOM 0 H ALA A 82 -6.748 2.844 8.564 1.00 0.00 H new ATOM 0 HA ALA A 82 -7.552 5.558 7.685 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -5.163 5.995 7.270 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -5.487 5.689 8.993 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -4.754 4.418 7.985 1.00 0.00 H new ATOM 1329 N ILE A 83 -7.293 4.968 5.275 1.00 0.00 N ATOM 1330 CA ILE A 83 -7.362 4.533 3.887 1.00 0.00 C ATOM 1331 C ILE A 83 -6.779 5.579 2.946 1.00 0.00 C ATOM 1332 O ILE A 83 -7.124 6.759 3.018 1.00 0.00 O ATOM 1333 CB ILE A 83 -8.813 4.228 3.456 1.00 0.00 C ATOM 1334 CG1 ILE A 83 -9.733 4.122 4.678 1.00 0.00 C ATOM 1335 CG2 ILE A 83 -8.861 2.947 2.635 1.00 0.00 C ATOM 1336 CD1 ILE A 83 -9.509 2.873 5.502 1.00 0.00 C ATOM 0 H ILE A 83 -7.595 5.929 5.433 1.00 0.00 H new ATOM 0 HA ILE A 83 -6.771 3.619 3.822 1.00 0.00 H new ATOM 0 HB ILE A 83 -9.169 5.051 2.836 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -9.583 4.996 5.312 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -10.770 4.145 4.344 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -9.890 2.744 2.338 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -8.242 3.062 1.745 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -8.486 2.117 3.234 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -10.195 2.868 6.349 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -9.688 1.993 4.884 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -8.482 2.857 5.867 1.00 0.00 H new ATOM 1348 N LEU A 84 -5.899 5.132 2.060 1.00 0.00 N ATOM 1349 CA LEU A 84 -5.266 6.015 1.092 1.00 0.00 C ATOM 1350 C LEU A 84 -5.589 5.547 -0.326 1.00 0.00 C ATOM 1351 O LEU A 84 -4.961 4.628 -0.846 1.00 0.00 O ATOM 1352 CB LEU A 84 -3.746 6.059 1.340 1.00 0.00 C ATOM 1353 CG LEU A 84 -2.851 5.821 0.119 1.00 0.00 C ATOM 1354 CD1 LEU A 84 -2.969 6.978 -0.858 1.00 0.00 C ATOM 1355 CD2 LEU A 84 -1.403 5.626 0.549 1.00 0.00 C ATOM 0 H LEU A 84 -5.607 4.157 1.993 1.00 0.00 H new ATOM 0 HA LEU A 84 -5.655 7.027 1.209 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -3.496 7.032 1.762 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.501 5.312 2.095 1.00 0.00 H new ATOM 0 HG LEU A 84 -3.184 4.912 -0.383 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -2.327 6.794 -1.720 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -4.003 7.071 -1.189 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -2.661 7.901 -0.367 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.782 5.458 -0.331 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.056 6.516 1.074 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -1.333 4.764 1.212 1.00 0.00 H new ATOM 1367 N LEU A 85 -6.591 6.172 -0.937 1.00 0.00 N ATOM 1368 CA LEU A 85 -7.013 5.804 -2.284 1.00 0.00 C ATOM 1369 C LEU A 85 -6.441 6.754 -3.331 1.00 0.00 C ATOM 1370 O LEU A 85 -6.641 7.967 -3.260 1.00 0.00 O ATOM 1371 CB LEU A 85 -8.540 5.799 -2.375 1.00 0.00 C ATOM 1372 CG LEU A 85 -9.173 4.423 -2.579 1.00 0.00 C ATOM 1373 CD1 LEU A 85 -8.980 3.558 -1.343 1.00 0.00 C ATOM 1374 CD2 LEU A 85 -10.652 4.565 -2.907 1.00 0.00 C ATOM 0 H LEU A 85 -7.125 6.935 -0.521 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.630 4.804 -2.487 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -8.944 6.236 -1.462 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.841 6.446 -3.199 1.00 0.00 H new ATOM 0 HG LEU A 85 -8.678 3.935 -3.418 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -9.437 2.582 -1.507 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -7.915 3.432 -1.150 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -9.450 4.039 -0.485 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -11.090 3.577 -3.050 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -11.160 5.072 -2.086 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -10.768 5.148 -3.820 1.00 0.00 H new ATOM 1386 N PHE A 86 -5.737 6.191 -4.310 1.00 0.00 N ATOM 1387 CA PHE A 86 -5.146 6.989 -5.382 1.00 0.00 C ATOM 1388 C PHE A 86 -4.693 6.106 -6.547 1.00 0.00 C ATOM 1389 O PHE A 86 -4.161 5.017 -6.343 1.00 0.00 O ATOM 1390 CB PHE A 86 -3.968 7.810 -4.845 1.00 0.00 C ATOM 1391 CG PHE A 86 -2.646 7.096 -4.907 1.00 0.00 C ATOM 1392 CD1 PHE A 86 -2.351 6.074 -4.020 1.00 0.00 C ATOM 1393 CD2 PHE A 86 -1.701 7.449 -5.856 1.00 0.00 C ATOM 1394 CE1 PHE A 86 -1.138 5.417 -4.077 1.00 0.00 C ATOM 1395 CE2 PHE A 86 -0.485 6.796 -5.919 1.00 0.00 C ATOM 1396 CZ PHE A 86 -0.202 5.778 -5.028 1.00 0.00 C ATOM 0 H PHE A 86 -5.562 5.189 -4.384 1.00 0.00 H new ATOM 0 HA PHE A 86 -5.911 7.670 -5.756 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -3.896 8.737 -5.414 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -4.172 8.086 -3.810 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -3.078 5.788 -3.275 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -1.917 8.244 -6.555 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -0.921 4.622 -3.379 1.00 0.00 H new ATOM 0 HE2 PHE A 86 0.244 7.081 -6.664 1.00 0.00 H new ATOM 0 HZ PHE A 86 0.748 5.266 -5.075 1.00 0.00 H new ATOM 1406 N LYS A 87 -4.905 6.593 -7.769 1.00 0.00 N ATOM 1407 CA LYS A 87 -4.514 5.855 -8.968 1.00 0.00 C ATOM 1408 C LYS A 87 -3.093 6.219 -9.382 1.00 0.00 C ATOM 1409 O LYS A 87 -2.243 6.511 -8.541 1.00 0.00 O ATOM 1410 CB LYS A 87 -5.481 6.155 -10.115 1.00 0.00 C ATOM 1411 CG LYS A 87 -6.869 5.576 -9.907 1.00 0.00 C ATOM 1412 CD LYS A 87 -7.948 6.533 -10.386 1.00 0.00 C ATOM 1413 CE LYS A 87 -8.361 6.234 -11.819 1.00 0.00 C ATOM 1414 NZ LYS A 87 -9.286 7.269 -12.358 1.00 0.00 N ATOM 0 H LYS A 87 -5.345 7.494 -7.954 1.00 0.00 H new ATOM 0 HA LYS A 87 -4.551 4.790 -8.740 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -5.562 7.235 -10.238 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -5.066 5.759 -11.042 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -6.955 4.631 -10.444 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -7.019 5.357 -8.850 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -8.817 6.459 -9.733 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -7.584 7.558 -10.317 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -7.473 6.178 -12.448 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -8.844 5.258 -11.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -9.423 7.115 -13.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -10.203 7.203 -11.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -8.879 8.213 -12.202 1.00 0.00 H new ATOM 1428 N SER A 88 -2.846 6.205 -10.687 1.00 0.00 N ATOM 1429 CA SER A 88 -1.533 6.539 -11.221 1.00 0.00 C ATOM 1430 C SER A 88 -1.613 6.774 -12.720 1.00 0.00 C ATOM 1431 O SER A 88 -0.608 6.729 -13.431 1.00 0.00 O ATOM 1432 CB SER A 88 -0.535 5.425 -10.918 1.00 0.00 C ATOM 1433 OG SER A 88 0.367 5.811 -9.894 1.00 0.00 O ATOM 0 H SER A 88 -3.540 5.965 -11.395 1.00 0.00 H new ATOM 0 HA SER A 88 -1.191 7.456 -10.741 1.00 0.00 H new ATOM 0 HB2 SER A 88 -1.071 4.525 -10.615 1.00 0.00 H new ATOM 0 HB3 SER A 88 0.021 5.175 -11.822 1.00 0.00 H new ATOM 0 HG SER A 88 -0.136 6.174 -9.135 1.00 0.00 H new ATOM 1490 N ARG B 4 20.675 -0.979 7.300 1.00 0.00 N ATOM 1491 CA ARG B 4 19.365 -1.597 7.124 1.00 0.00 C ATOM 1492 C ARG B 4 18.506 -1.425 8.372 1.00 0.00 C ATOM 1493 O ARG B 4 17.979 -0.344 8.630 1.00 0.00 O ATOM 1494 CB ARG B 4 19.519 -3.083 6.797 1.00 0.00 C ATOM 1495 CG ARG B 4 18.513 -3.585 5.775 1.00 0.00 C ATOM 1496 CD ARG B 4 18.645 -2.841 4.456 1.00 0.00 C ATOM 1497 NE ARG B 4 20.037 -2.708 4.040 1.00 0.00 N ATOM 1498 CZ ARG B 4 20.795 -3.735 3.672 1.00 0.00 C ATOM 1499 NH1 ARG B 4 20.297 -4.964 3.675 1.00 0.00 N ATOM 1500 NH2 ARG B 4 22.052 -3.534 3.301 1.00 0.00 N ATOM 0 HA ARG B 4 18.866 -1.098 6.293 1.00 0.00 H new ATOM 0 HB2 ARG B 4 20.527 -3.262 6.422 1.00 0.00 H new ATOM 0 HB3 ARG B 4 19.413 -3.662 7.714 1.00 0.00 H new ATOM 0 HG2 ARG B 4 18.662 -4.652 5.609 1.00 0.00 H new ATOM 0 HG3 ARG B 4 17.503 -3.461 6.165 1.00 0.00 H new ATOM 0 HD2 ARG B 4 18.085 -3.369 3.684 1.00 0.00 H new ATOM 0 HD3 ARG B 4 18.199 -1.851 4.552 1.00 0.00 H new ATOM 0 HE ARG B 4 20.451 -1.776 4.031 1.00 0.00 H new ATOM 0 HH11 ARG B 4 19.330 -5.122 3.960 1.00 0.00 H new ATOM 0 HH12 ARG B 4 20.880 -5.751 3.392 1.00 0.00 H new ATOM 0 HH21 ARG B 4 22.438 -2.590 3.298 1.00 0.00 H new ATOM 0 HH22 ARG B 4 22.633 -4.323 3.019 1.00 0.00 H new ATOM 1514 N LYS B 5 18.366 -2.500 9.142 1.00 0.00 N ATOM 1515 CA LYS B 5 17.565 -2.465 10.360 1.00 0.00 C ATOM 1516 C LYS B 5 16.080 -2.576 10.031 1.00 0.00 C ATOM 1517 O LYS B 5 15.234 -2.030 10.738 1.00 0.00 O ATOM 1518 CB LYS B 5 17.836 -1.174 11.134 1.00 0.00 C ATOM 1519 CG LYS B 5 17.172 -1.130 12.500 1.00 0.00 C ATOM 1520 CD LYS B 5 17.841 -2.085 13.476 1.00 0.00 C ATOM 1521 CE LYS B 5 18.442 -1.342 14.658 1.00 0.00 C ATOM 1522 NZ LYS B 5 19.120 -0.084 14.238 1.00 0.00 N ATOM 0 H LYS B 5 18.796 -3.404 8.944 1.00 0.00 H new ATOM 0 HA LYS B 5 17.846 -3.316 10.980 1.00 0.00 H new ATOM 0 HB2 LYS B 5 18.912 -1.055 11.259 1.00 0.00 H new ATOM 0 HB3 LYS B 5 17.488 -0.327 10.543 1.00 0.00 H new ATOM 0 HG2 LYS B 5 17.216 -0.115 12.895 1.00 0.00 H new ATOM 0 HG3 LYS B 5 16.118 -1.388 12.402 1.00 0.00 H new ATOM 0 HD2 LYS B 5 17.111 -2.811 13.834 1.00 0.00 H new ATOM 0 HD3 LYS B 5 18.622 -2.645 12.962 1.00 0.00 H new ATOM 0 HE2 LYS B 5 17.657 -1.108 15.377 1.00 0.00 H new ATOM 0 HE3 LYS B 5 19.158 -1.988 15.166 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 19.935 0.095 14.859 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 19.447 -0.177 13.255 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 18.452 0.710 14.307 1.00 0.00 H new ATOM 1536 N ALA B 6 15.772 -3.286 8.950 1.00 0.00 N ATOM 1537 CA ALA B 6 14.389 -3.469 8.523 1.00 0.00 C ATOM 1538 C ALA B 6 14.065 -4.941 8.299 1.00 0.00 C ATOM 1539 O ALA B 6 14.813 -5.825 8.719 1.00 0.00 O ATOM 1540 CB ALA B 6 14.117 -2.669 7.258 1.00 0.00 C ATOM 0 H ALA B 6 16.461 -3.744 8.354 1.00 0.00 H new ATOM 0 HA ALA B 6 13.742 -3.103 9.320 1.00 0.00 H new ATOM 0 HB1 ALA B 6 13.081 -2.815 6.951 1.00 0.00 H new ATOM 0 HB2 ALA B 6 14.292 -1.611 7.452 1.00 0.00 H new ATOM 0 HB3 ALA B 6 14.782 -3.007 6.464 1.00 0.00 H new ATOM 1546 N VAL B 7 12.939 -5.197 7.638 1.00 0.00 N ATOM 1547 CA VAL B 7 12.508 -6.562 7.362 1.00 0.00 C ATOM 1548 C VAL B 7 11.620 -6.620 6.124 1.00 0.00 C ATOM 1549 O VAL B 7 10.404 -6.773 6.233 1.00 0.00 O ATOM 1550 CB VAL B 7 11.731 -7.152 8.554 1.00 0.00 C ATOM 1551 CG1 VAL B 7 11.240 -8.555 8.231 1.00 0.00 C ATOM 1552 CG2 VAL B 7 12.591 -7.154 9.808 1.00 0.00 C ATOM 0 H VAL B 7 12.310 -4.476 7.284 1.00 0.00 H new ATOM 0 HA VAL B 7 13.410 -7.149 7.190 1.00 0.00 H new ATOM 0 HB VAL B 7 10.861 -6.523 8.742 1.00 0.00 H new ATOM 0 HG11 VAL B 7 10.694 -8.955 9.085 1.00 0.00 H new ATOM 0 HG12 VAL B 7 10.581 -8.519 7.363 1.00 0.00 H new ATOM 0 HG13 VAL B 7 12.093 -9.198 8.013 1.00 0.00 H new ATOM 0 HG21 VAL B 7 12.023 -7.575 10.638 1.00 0.00 H new ATOM 0 HG22 VAL B 7 13.483 -7.756 9.636 1.00 0.00 H new ATOM 0 HG23 VAL B 7 12.884 -6.132 10.050 1.00 0.00 H new ATOM 1562 N ILE B 8 12.229 -6.503 4.948 1.00 0.00 N ATOM 1563 CA ILE B 8 11.477 -6.550 3.699 1.00 0.00 C ATOM 1564 C ILE B 8 10.303 -7.521 3.824 1.00 0.00 C ATOM 1565 O ILE B 8 10.427 -8.587 4.425 1.00 0.00 O ATOM 1566 CB ILE B 8 12.395 -6.940 2.505 1.00 0.00 C ATOM 1567 CG1 ILE B 8 12.866 -5.680 1.778 1.00 0.00 C ATOM 1568 CG2 ILE B 8 11.696 -7.878 1.522 1.00 0.00 C ATOM 1569 CD1 ILE B 8 13.824 -4.836 2.589 1.00 0.00 C ATOM 0 H ILE B 8 13.235 -6.376 4.834 1.00 0.00 H new ATOM 0 HA ILE B 8 11.083 -5.553 3.500 1.00 0.00 H new ATOM 0 HB ILE B 8 13.253 -7.475 2.913 1.00 0.00 H new ATOM 0 HG12 ILE B 8 13.350 -5.968 0.845 1.00 0.00 H new ATOM 0 HG13 ILE B 8 11.997 -5.077 1.514 1.00 0.00 H new ATOM 0 HG21 ILE B 8 12.376 -8.122 0.706 1.00 0.00 H new ATOM 0 HG22 ILE B 8 11.404 -8.793 2.037 1.00 0.00 H new ATOM 0 HG23 ILE B 8 10.809 -7.389 1.121 1.00 0.00 H new ATOM 0 HD11 ILE B 8 14.116 -3.959 2.011 1.00 0.00 H new ATOM 0 HD12 ILE B 8 13.337 -4.517 3.511 1.00 0.00 H new ATOM 0 HD13 ILE B 8 14.710 -5.422 2.831 1.00 0.00 H new ATOM 1581 N LYS B 9 9.168 -7.142 3.250 1.00 0.00 N ATOM 1582 CA LYS B 9 7.973 -7.979 3.297 1.00 0.00 C ATOM 1583 C LYS B 9 7.526 -8.361 1.893 1.00 0.00 C ATOM 1584 O LYS B 9 6.667 -9.224 1.714 1.00 0.00 O ATOM 1585 CB LYS B 9 6.841 -7.254 4.028 1.00 0.00 C ATOM 1586 CG LYS B 9 7.217 -6.794 5.426 1.00 0.00 C ATOM 1587 CD LYS B 9 6.991 -7.890 6.454 1.00 0.00 C ATOM 1588 CE LYS B 9 7.624 -7.536 7.790 1.00 0.00 C ATOM 1589 NZ LYS B 9 6.601 -7.264 8.836 1.00 0.00 N ATOM 0 H LYS B 9 9.049 -6.263 2.747 1.00 0.00 H new ATOM 0 HA LYS B 9 8.219 -8.890 3.843 1.00 0.00 H new ATOM 0 HB2 LYS B 9 6.535 -6.389 3.440 1.00 0.00 H new ATOM 0 HB3 LYS B 9 5.978 -7.917 4.092 1.00 0.00 H new ATOM 0 HG2 LYS B 9 8.264 -6.490 5.441 1.00 0.00 H new ATOM 0 HG3 LYS B 9 6.627 -5.917 5.692 1.00 0.00 H new ATOM 0 HD2 LYS B 9 5.921 -8.051 6.588 1.00 0.00 H new ATOM 0 HD3 LYS B 9 7.411 -8.827 6.088 1.00 0.00 H new ATOM 0 HE2 LYS B 9 8.266 -8.354 8.115 1.00 0.00 H new ATOM 0 HE3 LYS B 9 8.261 -6.660 7.669 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 7.074 -7.027 9.731 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 6.004 -6.467 8.538 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 6.009 -8.109 8.971 1.00 0.00 H new ATOM 1603 N ASN B 10 8.116 -7.708 0.899 1.00 0.00 N ATOM 1604 CA ASN B 10 7.784 -7.970 -0.494 1.00 0.00 C ATOM 1605 C ASN B 10 8.791 -7.296 -1.415 1.00 0.00 C ATOM 1606 O ASN B 10 9.854 -7.848 -1.702 1.00 0.00 O ATOM 1607 CB ASN B 10 6.375 -7.466 -0.805 1.00 0.00 C ATOM 1608 CG ASN B 10 5.878 -7.928 -2.161 1.00 0.00 C ATOM 1609 OD1 ASN B 10 6.549 -8.922 -2.730 1.00 0.00 O flip ATOM 1610 ND2 ASN B 10 4.902 -7.397 -2.691 1.00 0.00 N flip ATOM 0 H ASN B 10 8.829 -6.991 1.034 1.00 0.00 H new ATOM 0 HA ASN B 10 7.820 -9.046 -0.662 1.00 0.00 H new ATOM 0 HB2 ASN B 10 5.689 -7.815 -0.033 1.00 0.00 H new ATOM 0 HB3 ASN B 10 6.367 -6.377 -0.771 1.00 0.00 H new ATOM 0 HD21 ASN B 10 4.416 -6.636 -2.217 1.00 0.00 H new ATOM 0 HD22 ASN B 10 4.579 -7.719 -3.604 1.00 0.00 H new ATOM 1617 N ALA B 11 8.452 -6.095 -1.866 1.00 0.00 N ATOM 1618 CA ALA B 11 9.328 -5.336 -2.745 1.00 0.00 C ATOM 1619 C ALA B 11 9.218 -5.807 -4.189 1.00 0.00 C ATOM 1620 O ALA B 11 8.456 -6.721 -4.505 1.00 0.00 O ATOM 1621 CB ALA B 11 10.768 -5.437 -2.262 1.00 0.00 C ATOM 0 H ALA B 11 7.576 -5.626 -1.637 1.00 0.00 H new ATOM 0 HA ALA B 11 9.012 -4.293 -2.714 1.00 0.00 H new ATOM 0 HB1 ALA B 11 11.416 -4.865 -2.927 1.00 0.00 H new ATOM 0 HB2 ALA B 11 10.842 -5.036 -1.251 1.00 0.00 H new ATOM 0 HB3 ALA B 11 11.079 -6.482 -2.262 1.00 0.00 H new ATOM 1627 N ASP B 12 9.992 -5.169 -5.058 1.00 0.00 N ATOM 1628 CA ASP B 12 10.007 -5.500 -6.478 1.00 0.00 C ATOM 1629 C ASP B 12 10.938 -4.550 -7.216 1.00 0.00 C ATOM 1630 O ASP B 12 10.681 -4.159 -8.354 1.00 0.00 O ATOM 1631 CB ASP B 12 8.596 -5.418 -7.065 1.00 0.00 C ATOM 1632 CG ASP B 12 7.925 -6.775 -7.143 1.00 0.00 C ATOM 1633 OD1 ASP B 12 8.563 -7.726 -7.640 1.00 0.00 O ATOM 1634 OD2 ASP B 12 6.760 -6.888 -6.706 1.00 0.00 O ATOM 0 H ASP B 12 10.624 -4.411 -4.800 1.00 0.00 H new ATOM 0 HA ASP B 12 10.368 -6.521 -6.597 1.00 0.00 H new ATOM 0 HB2 ASP B 12 7.989 -4.750 -6.454 1.00 0.00 H new ATOM 0 HB3 ASP B 12 8.645 -4.982 -8.063 1.00 0.00 H new ATOM 1639 N MET B 13 12.019 -4.174 -6.542 1.00 0.00 N ATOM 1640 CA MET B 13 12.998 -3.257 -7.105 1.00 0.00 C ATOM 1641 C MET B 13 14.414 -3.806 -6.941 1.00 0.00 C ATOM 1642 O MET B 13 14.637 -4.764 -6.202 1.00 0.00 O ATOM 1643 CB MET B 13 12.881 -1.892 -6.421 1.00 0.00 C ATOM 1644 CG MET B 13 14.106 -1.011 -6.596 1.00 0.00 C ATOM 1645 SD MET B 13 13.767 0.727 -6.255 1.00 0.00 S ATOM 1646 CE MET B 13 13.078 0.621 -4.605 1.00 0.00 C ATOM 0 H MET B 13 12.239 -4.494 -5.599 1.00 0.00 H new ATOM 0 HA MET B 13 12.797 -3.146 -8.170 1.00 0.00 H new ATOM 0 HB2 MET B 13 12.010 -1.370 -6.818 1.00 0.00 H new ATOM 0 HB3 MET B 13 12.703 -2.044 -5.356 1.00 0.00 H new ATOM 0 HG2 MET B 13 14.897 -1.360 -5.932 1.00 0.00 H new ATOM 0 HG3 MET B 13 14.478 -1.111 -7.616 1.00 0.00 H new ATOM 0 HE1 MET B 13 12.933 1.625 -4.206 1.00 0.00 H new ATOM 0 HE2 MET B 13 12.119 0.104 -4.644 1.00 0.00 H new ATOM 0 HE3 MET B 13 13.762 0.069 -3.960 1.00 0.00 H new ATOM 1656 N SER B 14 15.365 -3.188 -7.634 1.00 0.00 N ATOM 1657 CA SER B 14 16.759 -3.613 -7.564 1.00 0.00 C ATOM 1658 C SER B 14 17.201 -3.785 -6.115 1.00 0.00 C ATOM 1659 O SER B 14 16.979 -2.905 -5.282 1.00 0.00 O ATOM 1660 CB SER B 14 17.662 -2.594 -8.264 1.00 0.00 C ATOM 1661 OG SER B 14 16.916 -1.479 -8.723 1.00 0.00 O ATOM 0 H SER B 14 15.196 -2.392 -8.250 1.00 0.00 H new ATOM 0 HA SER B 14 16.845 -4.574 -8.071 1.00 0.00 H new ATOM 0 HB2 SER B 14 18.437 -2.258 -7.576 1.00 0.00 H new ATOM 0 HB3 SER B 14 18.167 -3.069 -9.105 1.00 0.00 H new ATOM 0 HG SER B 14 17.517 -0.843 -9.165 1.00 0.00 H new ATOM 1667 N GLU B 15 17.829 -4.918 -5.819 1.00 0.00 N ATOM 1668 CA GLU B 15 18.301 -5.195 -4.469 1.00 0.00 C ATOM 1669 C GLU B 15 18.912 -3.946 -3.846 1.00 0.00 C ATOM 1670 O GLU B 15 18.393 -3.412 -2.865 1.00 0.00 O ATOM 1671 CB GLU B 15 19.330 -6.326 -4.484 1.00 0.00 C ATOM 1672 CG GLU B 15 18.733 -7.687 -4.797 1.00 0.00 C ATOM 1673 CD GLU B 15 18.423 -7.860 -6.271 1.00 0.00 C ATOM 1674 OE1 GLU B 15 19.316 -8.316 -7.015 1.00 0.00 O ATOM 1675 OE2 GLU B 15 17.288 -7.539 -6.681 1.00 0.00 O ATOM 0 H GLU B 15 18.022 -5.657 -6.495 1.00 0.00 H new ATOM 0 HA GLU B 15 17.446 -5.503 -3.867 1.00 0.00 H new ATOM 0 HB2 GLU B 15 20.098 -6.097 -5.222 1.00 0.00 H new ATOM 0 HB3 GLU B 15 19.824 -6.370 -3.513 1.00 0.00 H new ATOM 0 HG2 GLU B 15 19.427 -8.466 -4.481 1.00 0.00 H new ATOM 0 HG3 GLU B 15 17.819 -7.821 -4.219 1.00 0.00 H new ATOM 1682 N GLU B 16 20.016 -3.481 -4.423 1.00 0.00 N ATOM 1683 CA GLU B 16 20.691 -2.291 -3.922 1.00 0.00 C ATOM 1684 C GLU B 16 19.680 -1.182 -3.656 1.00 0.00 C ATOM 1685 O GLU B 16 19.815 -0.420 -2.699 1.00 0.00 O ATOM 1686 CB GLU B 16 21.746 -1.816 -4.923 1.00 0.00 C ATOM 1687 CG GLU B 16 22.409 -2.950 -5.688 1.00 0.00 C ATOM 1688 CD GLU B 16 23.854 -3.164 -5.284 1.00 0.00 C ATOM 1689 OE1 GLU B 16 24.270 -2.603 -4.247 1.00 0.00 O ATOM 1690 OE2 GLU B 16 24.571 -3.893 -6.001 1.00 0.00 O ATOM 0 H GLU B 16 20.460 -3.909 -5.235 1.00 0.00 H new ATOM 0 HA GLU B 16 21.188 -2.543 -2.985 1.00 0.00 H new ATOM 0 HB2 GLU B 16 21.280 -1.133 -5.633 1.00 0.00 H new ATOM 0 HB3 GLU B 16 22.511 -1.250 -4.391 1.00 0.00 H new ATOM 0 HG2 GLU B 16 21.850 -3.871 -5.521 1.00 0.00 H new ATOM 0 HG3 GLU B 16 22.363 -2.738 -6.756 1.00 0.00 H new ATOM 1697 N MET B 17 18.658 -1.107 -4.503 1.00 0.00 N ATOM 1698 CA MET B 17 17.616 -0.102 -4.348 1.00 0.00 C ATOM 1699 C MET B 17 16.792 -0.392 -3.099 1.00 0.00 C ATOM 1700 O MET B 17 16.332 0.525 -2.418 1.00 0.00 O ATOM 1701 CB MET B 17 16.712 -0.076 -5.582 1.00 0.00 C ATOM 1702 CG MET B 17 17.362 0.561 -6.799 1.00 0.00 C ATOM 1703 SD MET B 17 17.727 2.310 -6.554 1.00 0.00 S ATOM 1704 CE MET B 17 16.235 2.852 -5.725 1.00 0.00 C ATOM 0 H MET B 17 18.531 -1.729 -5.301 1.00 0.00 H new ATOM 0 HA MET B 17 18.087 0.875 -4.242 1.00 0.00 H new ATOM 0 HB2 MET B 17 16.419 -1.096 -5.829 1.00 0.00 H new ATOM 0 HB3 MET B 17 15.799 0.468 -5.342 1.00 0.00 H new ATOM 0 HG2 MET B 17 18.285 0.030 -7.033 1.00 0.00 H new ATOM 0 HG3 MET B 17 16.702 0.448 -7.659 1.00 0.00 H new ATOM 0 HE1 MET B 17 16.227 3.940 -5.664 1.00 0.00 H new ATOM 0 HE2 MET B 17 15.364 2.514 -6.286 1.00 0.00 H new ATOM 0 HE3 MET B 17 16.204 2.432 -4.720 1.00 0.00 H new ATOM 1714 N GLN B 18 16.626 -1.676 -2.799 1.00 0.00 N ATOM 1715 CA GLN B 18 15.874 -2.096 -1.623 1.00 0.00 C ATOM 1716 C GLN B 18 16.685 -1.834 -0.361 1.00 0.00 C ATOM 1717 O GLN B 18 16.133 -1.502 0.688 1.00 0.00 O ATOM 1718 CB GLN B 18 15.523 -3.581 -1.717 1.00 0.00 C ATOM 1719 CG GLN B 18 15.461 -4.098 -3.142 1.00 0.00 C ATOM 1720 CD GLN B 18 14.408 -3.390 -3.968 1.00 0.00 C ATOM 1721 OE1 GLN B 18 14.547 -2.211 -4.292 1.00 0.00 O ATOM 1722 NE2 GLN B 18 13.346 -4.107 -4.313 1.00 0.00 N ATOM 0 H GLN B 18 17.003 -2.444 -3.355 1.00 0.00 H new ATOM 0 HA GLN B 18 14.950 -1.519 -1.578 1.00 0.00 H new ATOM 0 HB2 GLN B 18 16.263 -4.157 -1.162 1.00 0.00 H new ATOM 0 HB3 GLN B 18 14.560 -3.750 -1.235 1.00 0.00 H new ATOM 0 HG2 GLN B 18 16.435 -3.971 -3.614 1.00 0.00 H new ATOM 0 HG3 GLN B 18 15.250 -5.167 -3.129 1.00 0.00 H new ATOM 0 HE21 GLN B 18 13.272 -5.082 -4.022 1.00 0.00 H new ATOM 0 HE22 GLN B 18 12.603 -3.683 -4.869 1.00 0.00 H new ATOM 1731 N GLN B 19 18.001 -1.973 -0.480 1.00 0.00 N ATOM 1732 CA GLN B 19 18.898 -1.740 0.641 1.00 0.00 C ATOM 1733 C GLN B 19 19.088 -0.246 0.839 1.00 0.00 C ATOM 1734 O GLN B 19 19.170 0.241 1.968 1.00 0.00 O ATOM 1735 CB GLN B 19 20.247 -2.422 0.396 1.00 0.00 C ATOM 1736 CG GLN B 19 21.183 -1.621 -0.493 1.00 0.00 C ATOM 1737 CD GLN B 19 22.569 -2.229 -0.575 1.00 0.00 C ATOM 1738 OE1 GLN B 19 22.835 -3.087 -1.417 1.00 0.00 O ATOM 1739 NE2 GLN B 19 23.463 -1.788 0.304 1.00 0.00 N ATOM 0 H GLN B 19 18.469 -2.246 -1.344 1.00 0.00 H new ATOM 0 HA GLN B 19 18.459 -2.166 1.543 1.00 0.00 H new ATOM 0 HB2 GLN B 19 20.734 -2.599 1.355 1.00 0.00 H new ATOM 0 HB3 GLN B 19 20.074 -3.397 -0.059 1.00 0.00 H new ATOM 0 HG2 GLN B 19 20.759 -1.555 -1.495 1.00 0.00 H new ATOM 0 HG3 GLN B 19 21.259 -0.603 -0.111 1.00 0.00 H new ATOM 0 HE21 GLN B 19 23.200 -1.076 0.985 1.00 0.00 H new ATOM 0 HE22 GLN B 19 24.412 -2.162 0.298 1.00 0.00 H new ATOM 1748 N ASP B 20 19.127 0.481 -0.272 1.00 0.00 N ATOM 1749 CA ASP B 20 19.274 1.924 -0.228 1.00 0.00 C ATOM 1750 C ASP B 20 17.947 2.553 0.164 1.00 0.00 C ATOM 1751 O ASP B 20 17.903 3.590 0.826 1.00 0.00 O ATOM 1752 CB ASP B 20 19.736 2.462 -1.583 1.00 0.00 C ATOM 1753 CG ASP B 20 21.156 2.991 -1.540 1.00 0.00 C ATOM 1754 OD1 ASP B 20 21.682 3.189 -0.425 1.00 0.00 O ATOM 1755 OD2 ASP B 20 21.743 3.207 -2.622 1.00 0.00 O ATOM 0 H ASP B 20 19.059 0.091 -1.212 1.00 0.00 H new ATOM 0 HA ASP B 20 20.031 2.182 0.513 1.00 0.00 H new ATOM 0 HB2 ASP B 20 19.669 1.669 -2.328 1.00 0.00 H new ATOM 0 HB3 ASP B 20 19.064 3.258 -1.903 1.00 0.00 H new ATOM 1760 N SER B 21 16.862 1.895 -0.237 1.00 0.00 N ATOM 1761 CA SER B 21 15.523 2.364 0.081 1.00 0.00 C ATOM 1762 C SER B 21 15.274 2.241 1.576 1.00 0.00 C ATOM 1763 O SER B 21 14.833 3.191 2.223 1.00 0.00 O ATOM 1764 CB SER B 21 14.474 1.564 -0.695 1.00 0.00 C ATOM 1765 OG SER B 21 13.396 1.187 0.145 1.00 0.00 O ATOM 0 H SER B 21 16.888 1.034 -0.784 1.00 0.00 H new ATOM 0 HA SER B 21 15.442 3.411 -0.210 1.00 0.00 H new ATOM 0 HB2 SER B 21 14.100 2.160 -1.527 1.00 0.00 H new ATOM 0 HB3 SER B 21 14.934 0.673 -1.123 1.00 0.00 H new ATOM 0 HG SER B 21 13.633 0.373 0.636 1.00 0.00 H new ATOM 1771 N VAL B 22 15.576 1.067 2.124 1.00 0.00 N ATOM 1772 CA VAL B 22 15.400 0.830 3.548 1.00 0.00 C ATOM 1773 C VAL B 22 16.238 1.814 4.353 1.00 0.00 C ATOM 1774 O VAL B 22 15.775 2.376 5.345 1.00 0.00 O ATOM 1775 CB VAL B 22 15.793 -0.607 3.938 1.00 0.00 C ATOM 1776 CG1 VAL B 22 15.537 -0.845 5.417 1.00 0.00 C ATOM 1777 CG2 VAL B 22 15.037 -1.617 3.088 1.00 0.00 C ATOM 0 H VAL B 22 15.942 0.270 1.603 1.00 0.00 H new ATOM 0 HA VAL B 22 14.343 0.971 3.773 1.00 0.00 H new ATOM 0 HB VAL B 22 16.859 -0.737 3.751 1.00 0.00 H new ATOM 0 HG11 VAL B 22 15.820 -1.865 5.676 1.00 0.00 H new ATOM 0 HG12 VAL B 22 16.128 -0.144 6.006 1.00 0.00 H new ATOM 0 HG13 VAL B 22 14.479 -0.697 5.632 1.00 0.00 H new ATOM 0 HG21 VAL B 22 15.328 -2.627 3.378 1.00 0.00 H new ATOM 0 HG22 VAL B 22 13.965 -1.490 3.240 1.00 0.00 H new ATOM 0 HG23 VAL B 22 15.276 -1.459 2.036 1.00 0.00 H new ATOM 1787 N GLU B 23 17.474 2.028 3.908 1.00 0.00 N ATOM 1788 CA GLU B 23 18.370 2.958 4.580 1.00 0.00 C ATOM 1789 C GLU B 23 17.772 4.361 4.570 1.00 0.00 C ATOM 1790 O GLU B 23 17.938 5.125 5.520 1.00 0.00 O ATOM 1791 CB GLU B 23 19.742 2.961 3.903 1.00 0.00 C ATOM 1792 CG GLU B 23 20.402 1.592 3.864 1.00 0.00 C ATOM 1793 CD GLU B 23 21.807 1.604 4.433 1.00 0.00 C ATOM 1794 OE1 GLU B 23 21.977 2.053 5.586 1.00 0.00 O ATOM 1795 OE2 GLU B 23 22.737 1.162 3.725 1.00 0.00 O ATOM 0 H GLU B 23 17.874 1.571 3.089 1.00 0.00 H new ATOM 0 HA GLU B 23 18.496 2.637 5.614 1.00 0.00 H new ATOM 0 HB2 GLU B 23 19.635 3.333 2.884 1.00 0.00 H new ATOM 0 HB3 GLU B 23 20.396 3.656 4.429 1.00 0.00 H new ATOM 0 HG2 GLU B 23 19.793 0.883 4.425 1.00 0.00 H new ATOM 0 HG3 GLU B 23 20.435 1.238 2.834 1.00 0.00 H new ATOM 1802 N CYS B 24 17.062 4.686 3.492 1.00 0.00 N ATOM 1803 CA CYS B 24 16.423 5.991 3.363 1.00 0.00 C ATOM 1804 C CYS B 24 15.277 6.114 4.359 1.00 0.00 C ATOM 1805 O CYS B 24 15.074 7.168 4.966 1.00 0.00 O ATOM 1806 CB CYS B 24 15.902 6.193 1.939 1.00 0.00 C ATOM 1807 SG CYS B 24 17.186 6.595 0.732 1.00 0.00 S ATOM 0 H CYS B 24 16.915 4.064 2.697 1.00 0.00 H new ATOM 0 HA CYS B 24 17.163 6.762 3.576 1.00 0.00 H new ATOM 0 HB2 CYS B 24 15.389 5.286 1.619 1.00 0.00 H new ATOM 0 HB3 CYS B 24 15.161 6.992 1.945 1.00 0.00 H new ATOM 0 HG CYS B 24 16.793 6.239 -0.455 1.00 0.00 H new ATOM 1813 N ALA B 25 14.549 5.018 4.546 1.00 0.00 N ATOM 1814 CA ALA B 25 13.450 4.995 5.493 1.00 0.00 C ATOM 1815 C ALA B 25 14.028 5.086 6.887 1.00 0.00 C ATOM 1816 O ALA B 25 13.410 5.611 7.813 1.00 0.00 O ATOM 1817 CB ALA B 25 12.623 3.728 5.325 1.00 0.00 C ATOM 0 H ALA B 25 14.703 4.138 4.054 1.00 0.00 H new ATOM 0 HA ALA B 25 12.784 5.839 5.315 1.00 0.00 H new ATOM 0 HB1 ALA B 25 11.804 3.730 6.044 1.00 0.00 H new ATOM 0 HB2 ALA B 25 12.218 3.689 4.314 1.00 0.00 H new ATOM 0 HB3 ALA B 25 13.254 2.856 5.496 1.00 0.00 H new ATOM 1823 N THR B 26 15.251 4.587 7.003 1.00 0.00 N ATOM 1824 CA THR B 26 15.982 4.612 8.252 1.00 0.00 C ATOM 1825 C THR B 26 16.425 6.033 8.556 1.00 0.00 C ATOM 1826 O THR B 26 16.406 6.471 9.705 1.00 0.00 O ATOM 1827 CB THR B 26 17.197 3.698 8.158 1.00 0.00 C ATOM 1828 OG1 THR B 26 16.865 2.486 7.505 1.00 0.00 O ATOM 1829 CG2 THR B 26 17.781 3.353 9.503 1.00 0.00 C ATOM 0 H THR B 26 15.760 4.155 6.232 1.00 0.00 H new ATOM 0 HA THR B 26 15.335 4.259 9.055 1.00 0.00 H new ATOM 0 HB THR B 26 17.940 4.257 7.589 1.00 0.00 H new ATOM 0 HG1 THR B 26 16.751 2.652 6.546 1.00 0.00 H new ATOM 0 HG21 THR B 26 18.643 2.700 9.369 1.00 0.00 H new ATOM 0 HG22 THR B 26 18.093 4.266 10.009 1.00 0.00 H new ATOM 0 HG23 THR B 26 17.030 2.843 10.106 1.00 0.00 H new ATOM 1837 N GLN B 27 16.810 6.756 7.508 1.00 0.00 N ATOM 1838 CA GLN B 27 17.238 8.137 7.655 1.00 0.00 C ATOM 1839 C GLN B 27 16.111 8.954 8.265 1.00 0.00 C ATOM 1840 O GLN B 27 16.319 9.730 9.196 1.00 0.00 O ATOM 1841 CB GLN B 27 17.634 8.724 6.299 1.00 0.00 C ATOM 1842 CG GLN B 27 19.103 8.533 5.955 1.00 0.00 C ATOM 1843 CD GLN B 27 19.455 9.089 4.590 1.00 0.00 C ATOM 1844 OE1 GLN B 27 18.631 9.087 3.674 1.00 0.00 O ATOM 1845 NE2 GLN B 27 20.684 9.571 4.446 1.00 0.00 N ATOM 0 H GLN B 27 16.833 6.406 6.550 1.00 0.00 H new ATOM 0 HA GLN B 27 18.108 8.169 8.311 1.00 0.00 H new ATOM 0 HB2 GLN B 27 17.025 8.263 5.522 1.00 0.00 H new ATOM 0 HB3 GLN B 27 17.404 9.790 6.293 1.00 0.00 H new ATOM 0 HG2 GLN B 27 19.717 9.021 6.712 1.00 0.00 H new ATOM 0 HG3 GLN B 27 19.345 7.471 5.985 1.00 0.00 H new ATOM 0 HE21 GLN B 27 21.334 9.553 5.232 1.00 0.00 H new ATOM 0 HE22 GLN B 27 20.978 9.960 3.550 1.00 0.00 H new ATOM 1854 N ALA B 28 14.910 8.754 7.740 1.00 0.00 N ATOM 1855 CA ALA B 28 13.734 9.455 8.236 1.00 0.00 C ATOM 1856 C ALA B 28 13.275 8.856 9.561 1.00 0.00 C ATOM 1857 O ALA B 28 12.560 9.494 10.333 1.00 0.00 O ATOM 1858 CB ALA B 28 12.613 9.404 7.208 1.00 0.00 C ATOM 0 H ALA B 28 14.724 8.111 6.970 1.00 0.00 H new ATOM 0 HA ALA B 28 13.998 10.499 8.405 1.00 0.00 H new ATOM 0 HB1 ALA B 28 11.741 9.932 7.594 1.00 0.00 H new ATOM 0 HB2 ALA B 28 12.945 9.878 6.284 1.00 0.00 H new ATOM 0 HB3 ALA B 28 12.349 8.365 7.009 1.00 0.00 H new ATOM 1864 N LEU B 29 13.695 7.622 9.816 1.00 0.00 N ATOM 1865 CA LEU B 29 13.339 6.928 11.046 1.00 0.00 C ATOM 1866 C LEU B 29 14.159 7.445 12.224 1.00 0.00 C ATOM 1867 O LEU B 29 13.626 7.693 13.306 1.00 0.00 O ATOM 1868 CB LEU B 29 13.556 5.429 10.883 1.00 0.00 C ATOM 1869 CG LEU B 29 12.417 4.701 10.181 1.00 0.00 C ATOM 1870 CD1 LEU B 29 12.951 3.537 9.373 1.00 0.00 C ATOM 1871 CD2 LEU B 29 11.388 4.225 11.193 1.00 0.00 C ATOM 0 H LEU B 29 14.285 7.081 9.184 1.00 0.00 H new ATOM 0 HA LEU B 29 12.286 7.120 11.250 1.00 0.00 H new ATOM 0 HB2 LEU B 29 14.476 5.266 10.321 1.00 0.00 H new ATOM 0 HB3 LEU B 29 13.702 4.986 11.868 1.00 0.00 H new ATOM 0 HG LEU B 29 11.929 5.397 9.498 1.00 0.00 H new ATOM 0 HD11 LEU B 29 12.124 3.028 8.878 1.00 0.00 H new ATOM 0 HD12 LEU B 29 13.651 3.905 8.623 1.00 0.00 H new ATOM 0 HD13 LEU B 29 13.463 2.839 10.035 1.00 0.00 H new ATOM 0 HD21 LEU B 29 10.581 3.707 10.675 1.00 0.00 H new ATOM 0 HD22 LEU B 29 11.861 3.544 11.900 1.00 0.00 H new ATOM 0 HD23 LEU B 29 10.983 5.082 11.731 1.00 0.00 H new ATOM 1883 N GLU B 30 15.461 7.600 12.003 1.00 0.00 N ATOM 1884 CA GLU B 30 16.367 8.080 13.040 1.00 0.00 C ATOM 1885 C GLU B 30 16.313 9.602 13.152 1.00 0.00 C ATOM 1886 O GLU B 30 16.631 10.168 14.198 1.00 0.00 O ATOM 1887 CB GLU B 30 17.798 7.627 12.738 1.00 0.00 C ATOM 1888 CG GLU B 30 18.179 6.319 13.412 1.00 0.00 C ATOM 1889 CD GLU B 30 18.990 6.530 14.675 1.00 0.00 C ATOM 1890 OE1 GLU B 30 18.394 6.896 15.709 1.00 0.00 O ATOM 1891 OE2 GLU B 30 20.223 6.332 14.630 1.00 0.00 O ATOM 0 H GLU B 30 15.913 7.399 11.111 1.00 0.00 H new ATOM 0 HA GLU B 30 16.050 7.656 13.993 1.00 0.00 H new ATOM 0 HB2 GLU B 30 17.915 7.518 11.660 1.00 0.00 H new ATOM 0 HB3 GLU B 30 18.491 8.405 13.057 1.00 0.00 H new ATOM 0 HG2 GLU B 30 17.274 5.762 13.654 1.00 0.00 H new ATOM 0 HG3 GLU B 30 18.752 5.708 12.714 1.00 0.00 H new ATOM 1898 N LYS B 31 15.903 10.258 12.070 1.00 0.00 N ATOM 1899 CA LYS B 31 15.805 11.714 12.052 1.00 0.00 C ATOM 1900 C LYS B 31 14.467 12.172 12.622 1.00 0.00 C ATOM 1901 O LYS B 31 14.377 13.223 13.257 1.00 0.00 O ATOM 1902 CB LYS B 31 15.967 12.242 10.625 1.00 0.00 C ATOM 1903 CG LYS B 31 17.398 12.611 10.268 1.00 0.00 C ATOM 1904 CD LYS B 31 17.886 11.832 9.058 1.00 0.00 C ATOM 1905 CE LYS B 31 18.482 12.753 8.008 1.00 0.00 C ATOM 1906 NZ LYS B 31 19.639 13.523 8.538 1.00 0.00 N ATOM 0 H LYS B 31 15.634 9.806 11.196 1.00 0.00 H new ATOM 0 HA LYS B 31 16.606 12.115 12.673 1.00 0.00 H new ATOM 0 HB2 LYS B 31 15.611 11.486 9.925 1.00 0.00 H new ATOM 0 HB3 LYS B 31 15.332 13.119 10.497 1.00 0.00 H new ATOM 0 HG2 LYS B 31 17.460 13.680 10.063 1.00 0.00 H new ATOM 0 HG3 LYS B 31 18.050 12.411 11.118 1.00 0.00 H new ATOM 0 HD2 LYS B 31 18.633 11.103 9.370 1.00 0.00 H new ATOM 0 HD3 LYS B 31 17.057 11.273 8.625 1.00 0.00 H new ATOM 0 HE2 LYS B 31 18.801 12.164 7.148 1.00 0.00 H new ATOM 0 HE3 LYS B 31 17.717 13.444 7.655 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 20.199 13.897 7.746 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 19.293 14.312 9.120 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 20.234 12.899 9.119 1.00 0.00 H new ATOM 1920 N TYR B 32 13.430 11.373 12.391 1.00 0.00 N ATOM 1921 CA TYR B 32 12.095 11.687 12.880 1.00 0.00 C ATOM 1922 C TYR B 32 11.389 10.425 13.362 1.00 0.00 C ATOM 1923 O TYR B 32 11.974 9.341 13.376 1.00 0.00 O ATOM 1924 CB TYR B 32 11.271 12.363 11.780 1.00 0.00 C ATOM 1925 CG TYR B 32 12.116 13.020 10.712 1.00 0.00 C ATOM 1926 CD1 TYR B 32 12.895 12.258 9.852 1.00 0.00 C ATOM 1927 CD2 TYR B 32 12.131 14.401 10.563 1.00 0.00 C ATOM 1928 CE1 TYR B 32 13.668 12.852 8.874 1.00 0.00 C ATOM 1929 CE2 TYR B 32 12.902 15.003 9.585 1.00 0.00 C ATOM 1930 CZ TYR B 32 13.667 14.225 8.743 1.00 0.00 C ATOM 1931 OH TYR B 32 14.435 14.820 7.769 1.00 0.00 O ATOM 0 H TYR B 32 13.491 10.501 11.866 1.00 0.00 H new ATOM 0 HA TYR B 32 12.191 12.374 13.721 1.00 0.00 H new ATOM 0 HB2 TYR B 32 10.623 11.621 11.314 1.00 0.00 H new ATOM 0 HB3 TYR B 32 10.622 13.113 12.232 1.00 0.00 H new ATOM 0 HD1 TYR B 32 12.897 11.182 9.949 1.00 0.00 H new ATOM 0 HD2 TYR B 32 11.532 15.014 11.220 1.00 0.00 H new ATOM 0 HE1 TYR B 32 14.270 12.244 8.215 1.00 0.00 H new ATOM 0 HE2 TYR B 32 12.904 16.078 9.482 1.00 0.00 H new ATOM 0 HH TYR B 32 14.320 15.792 7.811 1.00 0.00 H new ATOM 1941 N ASN B 33 10.128 10.568 13.756 1.00 0.00 N ATOM 1942 CA ASN B 33 9.346 9.436 14.239 1.00 0.00 C ATOM 1943 C ASN B 33 7.881 9.582 13.846 1.00 0.00 C ATOM 1944 O ASN B 33 6.984 9.188 14.592 1.00 0.00 O ATOM 1945 CB ASN B 33 9.469 9.316 15.760 1.00 0.00 C ATOM 1946 CG ASN B 33 10.129 10.529 16.383 1.00 0.00 C ATOM 1947 OD1 ASN B 33 9.577 11.629 16.364 1.00 0.00 O ATOM 1948 ND2 ASN B 33 11.321 10.337 16.938 1.00 0.00 N ATOM 0 H ASN B 33 9.626 11.456 13.750 1.00 0.00 H new ATOM 0 HA ASN B 33 9.739 8.530 13.777 1.00 0.00 H new ATOM 0 HB2 ASN B 33 8.477 9.183 16.193 1.00 0.00 H new ATOM 0 HB3 ASN B 33 10.046 8.425 16.006 1.00 0.00 H new ATOM 0 HD21 ASN B 33 11.814 11.118 17.370 1.00 0.00 H new ATOM 0 HD22 ASN B 33 11.743 9.408 16.932 1.00 0.00 H new ATOM 1955 N ILE B 34 7.645 10.154 12.671 1.00 0.00 N ATOM 1956 CA ILE B 34 6.292 10.359 12.174 1.00 0.00 C ATOM 1957 C ILE B 34 6.079 9.636 10.852 1.00 0.00 C ATOM 1958 O ILE B 34 6.542 10.095 9.810 1.00 0.00 O ATOM 1959 CB ILE B 34 5.999 11.855 11.966 1.00 0.00 C ATOM 1960 CG1 ILE B 34 6.823 12.699 12.938 1.00 0.00 C ATOM 1961 CG2 ILE B 34 4.512 12.137 12.126 1.00 0.00 C ATOM 1962 CD1 ILE B 34 6.365 12.589 14.372 1.00 0.00 C ATOM 0 H ILE B 34 8.378 10.485 12.043 1.00 0.00 H new ATOM 0 HA ILE B 34 5.613 9.955 12.925 1.00 0.00 H new ATOM 0 HB ILE B 34 6.286 12.127 10.950 1.00 0.00 H new ATOM 0 HG12 ILE B 34 7.868 12.395 12.875 1.00 0.00 H new ATOM 0 HG13 ILE B 34 6.776 13.743 12.629 1.00 0.00 H new ATOM 0 HG21 ILE B 34 4.325 13.200 11.975 1.00 0.00 H new ATOM 0 HG22 ILE B 34 3.951 11.562 11.389 1.00 0.00 H new ATOM 0 HG23 ILE B 34 4.193 11.851 13.128 1.00 0.00 H new ATOM 0 HD11 ILE B 34 6.995 13.214 15.004 1.00 0.00 H new ATOM 0 HD12 ILE B 34 5.330 12.921 14.450 1.00 0.00 H new ATOM 0 HD13 ILE B 34 6.439 11.552 14.699 1.00 0.00 H new ATOM 1974 N GLU B 35 5.376 8.508 10.897 1.00 0.00 N ATOM 1975 CA GLU B 35 5.106 7.730 9.692 1.00 0.00 C ATOM 1976 C GLU B 35 5.042 8.637 8.468 1.00 0.00 C ATOM 1977 O GLU B 35 5.875 8.542 7.569 1.00 0.00 O ATOM 1978 CB GLU B 35 3.792 6.960 9.840 1.00 0.00 C ATOM 1979 CG GLU B 35 3.790 5.973 10.995 1.00 0.00 C ATOM 1980 CD GLU B 35 2.918 6.430 12.147 1.00 0.00 C ATOM 1981 OE1 GLU B 35 3.376 7.282 12.937 1.00 0.00 O ATOM 1982 OE2 GLU B 35 1.776 5.936 12.259 1.00 0.00 O ATOM 0 H GLU B 35 4.984 8.113 11.752 1.00 0.00 H new ATOM 0 HA GLU B 35 5.921 7.019 9.556 1.00 0.00 H new ATOM 0 HB2 GLU B 35 2.978 7.671 9.980 1.00 0.00 H new ATOM 0 HB3 GLU B 35 3.590 6.422 8.914 1.00 0.00 H new ATOM 0 HG2 GLU B 35 3.439 5.004 10.640 1.00 0.00 H new ATOM 0 HG3 GLU B 35 4.811 5.832 11.350 1.00 0.00 H new ATOM 1989 N LYS B 36 4.054 9.521 8.444 1.00 0.00 N ATOM 1990 CA LYS B 36 3.891 10.448 7.332 1.00 0.00 C ATOM 1991 C LYS B 36 5.197 11.178 7.030 1.00 0.00 C ATOM 1992 O LYS B 36 5.682 11.154 5.899 1.00 0.00 O ATOM 1993 CB LYS B 36 2.787 11.460 7.642 1.00 0.00 C ATOM 1994 CG LYS B 36 1.493 10.819 8.114 1.00 0.00 C ATOM 1995 CD LYS B 36 0.497 10.677 6.974 1.00 0.00 C ATOM 1996 CE LYS B 36 0.130 12.027 6.380 1.00 0.00 C ATOM 1997 NZ LYS B 36 -0.899 11.900 5.311 1.00 0.00 N ATOM 0 H LYS B 36 3.354 9.616 9.180 1.00 0.00 H new ATOM 0 HA LYS B 36 3.609 9.871 6.451 1.00 0.00 H new ATOM 0 HB2 LYS B 36 3.142 12.150 8.408 1.00 0.00 H new ATOM 0 HB3 LYS B 36 2.586 12.051 6.749 1.00 0.00 H new ATOM 0 HG2 LYS B 36 1.705 9.838 8.539 1.00 0.00 H new ATOM 0 HG3 LYS B 36 1.055 11.422 8.909 1.00 0.00 H new ATOM 0 HD2 LYS B 36 0.921 10.040 6.197 1.00 0.00 H new ATOM 0 HD3 LYS B 36 -0.404 10.181 7.337 1.00 0.00 H new ATOM 0 HE2 LYS B 36 -0.243 12.681 7.168 1.00 0.00 H new ATOM 0 HE3 LYS B 36 1.023 12.499 5.970 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 -1.123 12.842 4.931 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 -0.533 11.296 4.547 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 -1.761 11.473 5.707 1.00 0.00 H new ATOM 2011 N ASP B 37 5.764 11.823 8.045 1.00 0.00 N ATOM 2012 CA ASP B 37 7.013 12.555 7.877 1.00 0.00 C ATOM 2013 C ASP B 37 8.090 11.649 7.295 1.00 0.00 C ATOM 2014 O ASP B 37 8.605 11.897 6.205 1.00 0.00 O ATOM 2015 CB ASP B 37 7.477 13.130 9.217 1.00 0.00 C ATOM 2016 CG ASP B 37 7.019 14.561 9.418 1.00 0.00 C ATOM 2017 OD1 ASP B 37 7.224 15.385 8.501 1.00 0.00 O ATOM 2018 OD2 ASP B 37 6.456 14.858 10.493 1.00 0.00 O ATOM 0 H ASP B 37 5.379 11.853 8.989 1.00 0.00 H new ATOM 0 HA ASP B 37 6.838 13.377 7.183 1.00 0.00 H new ATOM 0 HB2 ASP B 37 7.094 12.511 10.028 1.00 0.00 H new ATOM 0 HB3 ASP B 37 8.565 13.088 9.271 1.00 0.00 H new ATOM 2023 N ILE B 38 8.425 10.596 8.031 1.00 0.00 N ATOM 2024 CA ILE B 38 9.438 9.646 7.596 1.00 0.00 C ATOM 2025 C ILE B 38 9.298 9.351 6.108 1.00 0.00 C ATOM 2026 O ILE B 38 10.282 9.345 5.369 1.00 0.00 O ATOM 2027 CB ILE B 38 9.343 8.327 8.389 1.00 0.00 C ATOM 2028 CG1 ILE B 38 9.151 8.618 9.878 1.00 0.00 C ATOM 2029 CG2 ILE B 38 10.585 7.479 8.165 1.00 0.00 C ATOM 2030 CD1 ILE B 38 8.612 7.441 10.663 1.00 0.00 C ATOM 0 H ILE B 38 8.007 10.379 8.936 1.00 0.00 H new ATOM 0 HA ILE B 38 10.411 10.100 7.783 1.00 0.00 H new ATOM 0 HB ILE B 38 8.479 7.767 8.031 1.00 0.00 H new ATOM 0 HG12 ILE B 38 10.106 8.922 10.306 1.00 0.00 H new ATOM 0 HG13 ILE B 38 8.469 9.461 9.990 1.00 0.00 H new ATOM 0 HG21 ILE B 38 10.500 6.552 8.732 1.00 0.00 H new ATOM 0 HG22 ILE B 38 10.681 7.247 7.104 1.00 0.00 H new ATOM 0 HG23 ILE B 38 11.466 8.029 8.498 1.00 0.00 H new ATOM 0 HD11 ILE B 38 8.502 7.722 11.710 1.00 0.00 H new ATOM 0 HD12 ILE B 38 7.641 7.150 10.262 1.00 0.00 H new ATOM 0 HD13 ILE B 38 9.304 6.603 10.583 1.00 0.00 H new ATOM 2042 N ALA B 39 8.065 9.114 5.675 1.00 0.00 N ATOM 2043 CA ALA B 39 7.789 8.828 4.273 1.00 0.00 C ATOM 2044 C ALA B 39 8.114 10.036 3.402 1.00 0.00 C ATOM 2045 O ALA B 39 8.749 9.909 2.354 1.00 0.00 O ATOM 2046 CB ALA B 39 6.334 8.423 4.096 1.00 0.00 C ATOM 0 H ALA B 39 7.240 9.114 6.275 1.00 0.00 H new ATOM 0 HA ALA B 39 8.424 8.000 3.959 1.00 0.00 H new ATOM 0 HB1 ALA B 39 6.140 8.212 3.044 1.00 0.00 H new ATOM 0 HB2 ALA B 39 6.130 7.531 4.689 1.00 0.00 H new ATOM 0 HB3 ALA B 39 5.687 9.235 4.428 1.00 0.00 H new ATOM 2052 N ALA B 40 7.677 11.210 3.847 1.00 0.00 N ATOM 2053 CA ALA B 40 7.920 12.448 3.116 1.00 0.00 C ATOM 2054 C ALA B 40 9.408 12.634 2.838 1.00 0.00 C ATOM 2055 O ALA B 40 9.825 12.772 1.688 1.00 0.00 O ATOM 2056 CB ALA B 40 7.375 13.633 3.899 1.00 0.00 C ATOM 0 H ALA B 40 7.151 11.330 4.713 1.00 0.00 H new ATOM 0 HA ALA B 40 7.402 12.388 2.159 1.00 0.00 H new ATOM 0 HB1 ALA B 40 7.562 14.553 3.344 1.00 0.00 H new ATOM 0 HB2 ALA B 40 6.302 13.509 4.046 1.00 0.00 H new ATOM 0 HB3 ALA B 40 7.870 13.687 4.868 1.00 0.00 H new ATOM 2062 N HIS B 41 10.203 12.638 3.902 1.00 0.00 N ATOM 2063 CA HIS B 41 11.646 12.807 3.784 1.00 0.00 C ATOM 2064 C HIS B 41 12.240 11.777 2.828 1.00 0.00 C ATOM 2065 O HIS B 41 13.124 12.093 2.033 1.00 0.00 O ATOM 2066 CB HIS B 41 12.300 12.685 5.161 1.00 0.00 C ATOM 2067 CG HIS B 41 11.366 12.999 6.287 1.00 0.00 C ATOM 2068 ND1 HIS B 41 11.395 12.343 7.499 1.00 0.00 N ATOM 2069 CD2 HIS B 41 10.365 13.908 6.378 1.00 0.00 C ATOM 2070 CE1 HIS B 41 10.454 12.834 8.285 1.00 0.00 C ATOM 2071 NE2 HIS B 41 9.817 13.785 7.629 1.00 0.00 N ATOM 0 H HIS B 41 9.870 12.526 4.860 1.00 0.00 H new ATOM 0 HA HIS B 41 11.843 13.800 3.380 1.00 0.00 H new ATOM 0 HB2 HIS B 41 12.682 11.672 5.286 1.00 0.00 H new ATOM 0 HB3 HIS B 41 13.157 13.357 5.210 1.00 0.00 H new ATOM 0 HD1 HIS B 41 12.042 11.595 7.750 1.00 0.00 H new ATOM 0 HD2 HIS B 41 10.056 14.600 5.609 1.00 0.00 H new ATOM 0 HE1 HIS B 41 10.242 12.512 9.294 1.00 0.00 H new ATOM 2080 N ILE B 42 11.748 10.545 2.912 1.00 0.00 N ATOM 2081 CA ILE B 42 12.230 9.470 2.053 1.00 0.00 C ATOM 2082 C ILE B 42 11.909 9.751 0.590 1.00 0.00 C ATOM 2083 O ILE B 42 12.806 10.007 -0.215 1.00 0.00 O ATOM 2084 CB ILE B 42 11.612 8.114 2.447 1.00 0.00 C ATOM 2085 CG1 ILE B 42 11.893 7.805 3.918 1.00 0.00 C ATOM 2086 CG2 ILE B 42 12.153 7.007 1.555 1.00 0.00 C ATOM 2087 CD1 ILE B 42 10.990 6.735 4.492 1.00 0.00 C ATOM 0 H ILE B 42 11.016 10.267 3.566 1.00 0.00 H new ATOM 0 HA ILE B 42 13.311 9.422 2.185 1.00 0.00 H new ATOM 0 HB ILE B 42 10.532 8.172 2.309 1.00 0.00 H new ATOM 0 HG12 ILE B 42 12.931 7.488 4.023 1.00 0.00 H new ATOM 0 HG13 ILE B 42 11.778 8.718 4.502 1.00 0.00 H new ATOM 0 HG21 ILE B 42 11.708 6.055 1.845 1.00 0.00 H new ATOM 0 HG22 ILE B 42 11.904 7.222 0.516 1.00 0.00 H new ATOM 0 HG23 ILE B 42 13.236 6.949 1.664 1.00 0.00 H new ATOM 0 HD11 ILE B 42 11.245 6.567 5.538 1.00 0.00 H new ATOM 0 HD12 ILE B 42 9.951 7.058 4.419 1.00 0.00 H new ATOM 0 HD13 ILE B 42 11.122 5.809 3.933 1.00 0.00 H new ATOM 2099 N LYS B 43 10.626 9.703 0.251 1.00 0.00 N ATOM 2100 CA LYS B 43 10.186 9.953 -1.115 1.00 0.00 C ATOM 2101 C LYS B 43 10.966 11.110 -1.732 1.00 0.00 C ATOM 2102 O LYS B 43 11.385 11.045 -2.889 1.00 0.00 O ATOM 2103 CB LYS B 43 8.689 10.263 -1.139 1.00 0.00 C ATOM 2104 CG LYS B 43 8.118 10.403 -2.540 1.00 0.00 C ATOM 2105 CD LYS B 43 7.891 11.861 -2.906 1.00 0.00 C ATOM 2106 CE LYS B 43 7.418 12.006 -4.342 1.00 0.00 C ATOM 2107 NZ LYS B 43 5.946 12.217 -4.421 1.00 0.00 N ATOM 0 H LYS B 43 9.872 9.493 0.905 1.00 0.00 H new ATOM 0 HA LYS B 43 10.375 9.055 -1.704 1.00 0.00 H new ATOM 0 HB2 LYS B 43 8.154 9.471 -0.615 1.00 0.00 H new ATOM 0 HB3 LYS B 43 8.509 11.186 -0.589 1.00 0.00 H new ATOM 0 HG2 LYS B 43 8.799 9.948 -3.259 1.00 0.00 H new ATOM 0 HG3 LYS B 43 7.176 9.859 -2.606 1.00 0.00 H new ATOM 0 HD2 LYS B 43 7.152 12.296 -2.233 1.00 0.00 H new ATOM 0 HD3 LYS B 43 8.816 12.420 -2.768 1.00 0.00 H new ATOM 0 HE2 LYS B 43 7.931 12.846 -4.811 1.00 0.00 H new ATOM 0 HE3 LYS B 43 7.688 11.113 -4.905 1.00 0.00 H new ATOM 0 HZ1 LYS B 43 5.676 12.412 -5.406 1.00 0.00 H new ATOM 0 HZ2 LYS B 43 5.455 11.362 -4.090 1.00 0.00 H new ATOM 0 HZ3 LYS B 43 5.678 13.024 -3.822 1.00 0.00 H new ATOM 2121 N LYS B 44 11.156 12.167 -0.951 1.00 0.00 N ATOM 2122 CA LYS B 44 11.882 13.343 -1.415 1.00 0.00 C ATOM 2123 C LYS B 44 13.327 12.997 -1.755 1.00 0.00 C ATOM 2124 O LYS B 44 13.799 13.270 -2.860 1.00 0.00 O ATOM 2125 CB LYS B 44 11.850 14.439 -0.348 1.00 0.00 C ATOM 2126 CG LYS B 44 10.659 15.375 -0.472 1.00 0.00 C ATOM 2127 CD LYS B 44 10.566 16.317 0.717 1.00 0.00 C ATOM 2128 CE LYS B 44 10.797 17.761 0.303 1.00 0.00 C ATOM 2129 NZ LYS B 44 9.611 18.338 -0.388 1.00 0.00 N ATOM 0 H LYS B 44 10.817 12.234 0.009 1.00 0.00 H new ATOM 0 HA LYS B 44 11.393 13.705 -2.319 1.00 0.00 H new ATOM 0 HB2 LYS B 44 11.835 13.974 0.638 1.00 0.00 H new ATOM 0 HB3 LYS B 44 12.768 15.023 -0.411 1.00 0.00 H new ATOM 0 HG2 LYS B 44 10.744 15.955 -1.391 1.00 0.00 H new ATOM 0 HG3 LYS B 44 9.742 14.791 -0.548 1.00 0.00 H new ATOM 0 HD2 LYS B 44 9.584 16.223 1.181 1.00 0.00 H new ATOM 0 HD3 LYS B 44 11.302 16.030 1.468 1.00 0.00 H new ATOM 0 HE2 LYS B 44 11.030 18.358 1.185 1.00 0.00 H new ATOM 0 HE3 LYS B 44 11.663 17.815 -0.356 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 9.810 19.324 -0.654 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 9.404 17.784 -1.243 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 8.790 18.310 0.250 1.00 0.00 H new ATOM 2143 N GLU B 45 14.023 12.401 -0.797 1.00 0.00 N ATOM 2144 CA GLU B 45 15.419 12.023 -0.987 1.00 0.00 C ATOM 2145 C GLU B 45 15.556 10.957 -2.068 1.00 0.00 C ATOM 2146 O GLU B 45 16.607 10.830 -2.696 1.00 0.00 O ATOM 2147 CB GLU B 45 16.014 11.513 0.326 1.00 0.00 C ATOM 2148 CG GLU B 45 16.586 12.615 1.203 1.00 0.00 C ATOM 2149 CD GLU B 45 16.728 12.191 2.651 1.00 0.00 C ATOM 2150 OE1 GLU B 45 15.689 11.989 3.315 1.00 0.00 O ATOM 2151 OE2 GLU B 45 17.877 12.062 3.122 1.00 0.00 O ATOM 0 H GLU B 45 13.645 12.168 0.121 1.00 0.00 H new ATOM 0 HA GLU B 45 15.967 12.909 -1.308 1.00 0.00 H new ATOM 0 HB2 GLU B 45 15.242 10.981 0.882 1.00 0.00 H new ATOM 0 HB3 GLU B 45 16.801 10.792 0.103 1.00 0.00 H new ATOM 0 HG2 GLU B 45 17.561 12.912 0.818 1.00 0.00 H new ATOM 0 HG3 GLU B 45 15.941 13.492 1.146 1.00 0.00 H new ATOM 2158 N PHE B 46 14.492 10.193 -2.281 1.00 0.00 N ATOM 2159 CA PHE B 46 14.502 9.141 -3.287 1.00 0.00 C ATOM 2160 C PHE B 46 14.351 9.725 -4.684 1.00 0.00 C ATOM 2161 O PHE B 46 15.084 9.362 -5.604 1.00 0.00 O ATOM 2162 CB PHE B 46 13.388 8.132 -3.016 1.00 0.00 C ATOM 2163 CG PHE B 46 13.900 6.759 -2.696 1.00 0.00 C ATOM 2164 CD1 PHE B 46 14.384 6.465 -1.433 1.00 0.00 C ATOM 2165 CD2 PHE B 46 13.903 5.765 -3.661 1.00 0.00 C ATOM 2166 CE1 PHE B 46 14.862 5.205 -1.136 1.00 0.00 C ATOM 2167 CE2 PHE B 46 14.380 4.501 -3.369 1.00 0.00 C ATOM 2168 CZ PHE B 46 14.860 4.222 -2.106 1.00 0.00 C ATOM 0 H PHE B 46 13.613 10.283 -1.771 1.00 0.00 H new ATOM 0 HA PHE B 46 15.462 8.629 -3.230 1.00 0.00 H new ATOM 0 HB2 PHE B 46 12.778 8.488 -2.186 1.00 0.00 H new ATOM 0 HB3 PHE B 46 12.737 8.076 -3.889 1.00 0.00 H new ATOM 0 HD1 PHE B 46 14.388 7.231 -0.671 1.00 0.00 H new ATOM 0 HD2 PHE B 46 13.529 5.980 -4.651 1.00 0.00 H new ATOM 0 HE1 PHE B 46 15.237 4.988 -0.147 1.00 0.00 H new ATOM 0 HE2 PHE B 46 14.377 3.733 -4.128 1.00 0.00 H new ATOM 0 HZ PHE B 46 15.234 3.235 -1.876 1.00 0.00 H new ATOM 2178 N ASP B 47 13.397 10.637 -4.837 1.00 0.00 N ATOM 2179 CA ASP B 47 13.155 11.276 -6.122 1.00 0.00 C ATOM 2180 C ASP B 47 14.338 12.154 -6.512 1.00 0.00 C ATOM 2181 O ASP B 47 14.565 12.423 -7.691 1.00 0.00 O ATOM 2182 CB ASP B 47 11.880 12.117 -6.065 1.00 0.00 C ATOM 2183 CG ASP B 47 12.092 13.436 -5.347 1.00 0.00 C ATOM 2184 OD1 ASP B 47 12.836 14.287 -5.877 1.00 0.00 O ATOM 2185 OD2 ASP B 47 11.516 13.615 -4.254 1.00 0.00 O ATOM 0 H ASP B 47 12.780 10.949 -4.087 1.00 0.00 H new ATOM 0 HA ASP B 47 13.032 10.497 -6.875 1.00 0.00 H new ATOM 0 HB2 ASP B 47 11.529 12.310 -7.079 1.00 0.00 H new ATOM 0 HB3 ASP B 47 11.097 11.552 -5.559 1.00 0.00 H new ATOM 2190 N LYS B 48 15.088 12.603 -5.509 1.00 0.00 N ATOM 2191 CA LYS B 48 16.245 13.455 -5.743 1.00 0.00 C ATOM 2192 C LYS B 48 17.511 12.621 -5.936 1.00 0.00 C ATOM 2193 O LYS B 48 18.331 12.909 -6.809 1.00 0.00 O ATOM 2194 CB LYS B 48 16.404 14.449 -4.576 1.00 0.00 C ATOM 2195 CG LYS B 48 17.648 14.244 -3.719 1.00 0.00 C ATOM 2196 CD LYS B 48 18.894 14.774 -4.411 1.00 0.00 C ATOM 2197 CE LYS B 48 19.034 16.276 -4.230 1.00 0.00 C ATOM 2198 NZ LYS B 48 20.250 16.632 -3.448 1.00 0.00 N ATOM 0 H LYS B 48 14.913 12.390 -4.527 1.00 0.00 H new ATOM 0 HA LYS B 48 16.086 14.019 -6.662 1.00 0.00 H new ATOM 0 HB2 LYS B 48 16.423 15.461 -4.981 1.00 0.00 H new ATOM 0 HB3 LYS B 48 15.525 14.378 -3.936 1.00 0.00 H new ATOM 0 HG2 LYS B 48 17.519 14.749 -2.762 1.00 0.00 H new ATOM 0 HG3 LYS B 48 17.773 13.183 -3.505 1.00 0.00 H new ATOM 0 HD2 LYS B 48 19.775 14.274 -4.009 1.00 0.00 H new ATOM 0 HD3 LYS B 48 18.850 14.537 -5.474 1.00 0.00 H new ATOM 0 HE2 LYS B 48 19.078 16.757 -5.207 1.00 0.00 H new ATOM 0 HE3 LYS B 48 18.150 16.664 -3.723 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 20.308 17.666 -3.347 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 20.197 16.195 -2.506 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 21.096 16.285 -3.944 1.00 0.00 H new ATOM 2212 N LYS B 49 17.666 11.592 -5.111 1.00 0.00 N ATOM 2213 CA LYS B 49 18.834 10.722 -5.183 1.00 0.00 C ATOM 2214 C LYS B 49 18.692 9.693 -6.299 1.00 0.00 C ATOM 2215 O LYS B 49 19.667 9.049 -6.688 1.00 0.00 O ATOM 2216 CB LYS B 49 19.040 10.009 -3.846 1.00 0.00 C ATOM 2217 CG LYS B 49 20.500 9.749 -3.513 1.00 0.00 C ATOM 2218 CD LYS B 49 20.857 8.279 -3.677 1.00 0.00 C ATOM 2219 CE LYS B 49 21.081 7.606 -2.333 1.00 0.00 C ATOM 2220 NZ LYS B 49 22.096 8.325 -1.514 1.00 0.00 N ATOM 0 H LYS B 49 16.997 11.340 -4.384 1.00 0.00 H new ATOM 0 HA LYS B 49 19.702 11.344 -5.402 1.00 0.00 H new ATOM 0 HB2 LYS B 49 18.596 10.609 -3.052 1.00 0.00 H new ATOM 0 HB3 LYS B 49 18.506 9.059 -3.864 1.00 0.00 H new ATOM 0 HG2 LYS B 49 21.135 10.353 -4.161 1.00 0.00 H new ATOM 0 HG3 LYS B 49 20.702 10.061 -2.488 1.00 0.00 H new ATOM 0 HD2 LYS B 49 20.057 7.767 -4.212 1.00 0.00 H new ATOM 0 HD3 LYS B 49 21.757 8.188 -4.285 1.00 0.00 H new ATOM 0 HE2 LYS B 49 20.139 7.563 -1.787 1.00 0.00 H new ATOM 0 HE3 LYS B 49 21.405 6.577 -2.492 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 22.624 7.640 -0.936 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 22.755 8.829 -2.141 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 21.619 9.009 -0.892 1.00 0.00 H new ATOM 2234 N TYR B 50 17.475 9.537 -6.810 1.00 0.00 N ATOM 2235 CA TYR B 50 17.217 8.577 -7.878 1.00 0.00 C ATOM 2236 C TYR B 50 16.427 9.213 -9.018 1.00 0.00 C ATOM 2237 O TYR B 50 16.963 9.439 -10.102 1.00 0.00 O ATOM 2238 CB TYR B 50 16.454 7.369 -7.332 1.00 0.00 C ATOM 2239 CG TYR B 50 17.138 6.689 -6.168 1.00 0.00 C ATOM 2240 CD1 TYR B 50 18.406 6.140 -6.306 1.00 0.00 C ATOM 2241 CD2 TYR B 50 16.514 6.599 -4.930 1.00 0.00 C ATOM 2242 CE1 TYR B 50 19.034 5.519 -5.243 1.00 0.00 C ATOM 2243 CE2 TYR B 50 17.135 5.980 -3.862 1.00 0.00 C ATOM 2244 CZ TYR B 50 18.394 5.441 -4.023 1.00 0.00 C ATOM 2245 OH TYR B 50 19.016 4.825 -2.963 1.00 0.00 O ATOM 0 H TYR B 50 16.655 10.060 -6.504 1.00 0.00 H new ATOM 0 HA TYR B 50 18.180 8.250 -8.270 1.00 0.00 H new ATOM 0 HB2 TYR B 50 15.460 7.690 -7.020 1.00 0.00 H new ATOM 0 HB3 TYR B 50 16.318 6.644 -8.135 1.00 0.00 H new ATOM 0 HD1 TYR B 50 18.910 6.199 -7.260 1.00 0.00 H new ATOM 0 HD2 TYR B 50 15.528 7.020 -4.800 1.00 0.00 H new ATOM 0 HE1 TYR B 50 20.020 5.097 -5.367 1.00 0.00 H new ATOM 0 HE2 TYR B 50 16.637 5.919 -2.906 1.00 0.00 H new ATOM 0 HH TYR B 50 18.981 5.411 -2.178 1.00 0.00 H new ATOM 2255 N ASN B 51 15.151 9.492 -8.759 1.00 0.00 N ATOM 2256 CA ASN B 51 14.267 10.093 -9.753 1.00 0.00 C ATOM 2257 C ASN B 51 12.807 9.795 -9.418 1.00 0.00 C ATOM 2258 O ASN B 51 12.400 8.633 -9.374 1.00 0.00 O ATOM 2259 CB ASN B 51 14.589 9.570 -11.155 1.00 0.00 C ATOM 2260 CG ASN B 51 14.952 10.683 -12.117 1.00 0.00 C ATOM 2261 OD1 ASN B 51 14.082 11.380 -12.637 1.00 0.00 O ATOM 2262 ND2 ASN B 51 16.247 10.855 -12.359 1.00 0.00 N ATOM 0 H ASN B 51 14.704 9.309 -7.861 1.00 0.00 H new ATOM 0 HA ASN B 51 14.426 11.171 -9.735 1.00 0.00 H new ATOM 0 HB2 ASN B 51 15.415 8.862 -11.095 1.00 0.00 H new ATOM 0 HB3 ASN B 51 13.729 9.024 -11.543 1.00 0.00 H new ATOM 0 HD21 ASN B 51 16.553 11.588 -12.998 1.00 0.00 H new ATOM 0 HD22 ASN B 51 16.935 10.254 -11.906 1.00 0.00 H new ATOM 2269 N PRO B 52 11.996 10.838 -9.177 1.00 0.00 N ATOM 2270 CA PRO B 52 10.577 10.673 -8.846 1.00 0.00 C ATOM 2271 C PRO B 52 9.792 9.992 -9.971 1.00 0.00 C ATOM 2272 O PRO B 52 10.315 9.816 -11.071 1.00 0.00 O ATOM 2273 CB PRO B 52 10.081 12.110 -8.641 1.00 0.00 C ATOM 2274 CG PRO B 52 11.077 12.966 -9.345 1.00 0.00 C ATOM 2275 CD PRO B 52 12.392 12.256 -9.206 1.00 0.00 C ATOM 0 HA PRO B 52 10.438 10.035 -7.973 1.00 0.00 H new ATOM 0 HB2 PRO B 52 9.082 12.245 -9.055 1.00 0.00 H new ATOM 0 HB3 PRO B 52 10.024 12.361 -7.582 1.00 0.00 H new ATOM 0 HG2 PRO B 52 10.811 13.095 -10.394 1.00 0.00 H new ATOM 0 HG3 PRO B 52 11.120 13.961 -8.902 1.00 0.00 H new ATOM 0 HD2 PRO B 52 13.059 12.473 -10.041 1.00 0.00 H new ATOM 0 HD3 PRO B 52 12.915 12.548 -8.296 1.00 0.00 H new ATOM 2283 N THR B 53 8.534 9.605 -9.706 1.00 0.00 N ATOM 2284 CA THR B 53 7.894 9.807 -8.405 1.00 0.00 C ATOM 2285 C THR B 53 7.886 8.509 -7.603 1.00 0.00 C ATOM 2286 O THR B 53 7.608 7.437 -8.139 1.00 0.00 O ATOM 2287 CB THR B 53 6.466 10.328 -8.597 1.00 0.00 C ATOM 2288 OG1 THR B 53 6.473 11.723 -8.842 1.00 0.00 O ATOM 2289 CG2 THR B 53 5.562 10.077 -7.408 1.00 0.00 C ATOM 0 H THR B 53 7.935 9.143 -10.391 1.00 0.00 H new ATOM 0 HA THR B 53 8.466 10.548 -7.847 1.00 0.00 H new ATOM 0 HB THR B 53 6.073 9.774 -9.449 1.00 0.00 H new ATOM 0 HG1 THR B 53 5.553 12.038 -8.964 1.00 0.00 H new ATOM 0 HG21 THR B 53 4.568 10.473 -7.617 1.00 0.00 H new ATOM 0 HG22 THR B 53 5.494 9.005 -7.222 1.00 0.00 H new ATOM 0 HG23 THR B 53 5.972 10.572 -6.528 1.00 0.00 H new ATOM 2297 N TRP B 54 8.201 8.615 -6.316 1.00 0.00 N ATOM 2298 CA TRP B 54 8.237 7.447 -5.442 1.00 0.00 C ATOM 2299 C TRP B 54 7.063 7.441 -4.468 1.00 0.00 C ATOM 2300 O TRP B 54 7.057 8.184 -3.487 1.00 0.00 O ATOM 2301 CB TRP B 54 9.548 7.413 -4.653 1.00 0.00 C ATOM 2302 CG TRP B 54 10.766 7.323 -5.519 1.00 0.00 C ATOM 2303 CD1 TRP B 54 11.312 8.322 -6.272 1.00 0.00 C ATOM 2304 CD2 TRP B 54 11.594 6.171 -5.717 1.00 0.00 C ATOM 2305 NE1 TRP B 54 12.426 7.862 -6.929 1.00 0.00 N ATOM 2306 CE2 TRP B 54 12.622 6.545 -6.604 1.00 0.00 C ATOM 2307 CE3 TRP B 54 11.566 4.861 -5.232 1.00 0.00 C ATOM 2308 CZ2 TRP B 54 13.611 5.654 -7.013 1.00 0.00 C ATOM 2309 CZ3 TRP B 54 12.549 3.979 -5.639 1.00 0.00 C ATOM 2310 CH2 TRP B 54 13.560 4.378 -6.522 1.00 0.00 C ATOM 0 H TRP B 54 8.434 9.495 -5.856 1.00 0.00 H new ATOM 0 HA TRP B 54 8.166 6.563 -6.076 1.00 0.00 H new ATOM 0 HB2 TRP B 54 9.615 8.310 -4.038 1.00 0.00 H new ATOM 0 HB3 TRP B 54 9.532 6.561 -3.974 1.00 0.00 H new ATOM 0 HD1 TRP B 54 10.924 9.328 -6.341 1.00 0.00 H new ATOM 0 HE1 TRP B 54 13.013 8.411 -7.557 1.00 0.00 H new ATOM 0 HE3 TRP B 54 10.790 4.543 -4.551 1.00 0.00 H new ATOM 0 HZ2 TRP B 54 14.391 5.960 -7.694 1.00 0.00 H new ATOM 0 HZ3 TRP B 54 12.537 2.964 -5.270 1.00 0.00 H new ATOM 0 HH2 TRP B 54 14.314 3.665 -6.821 1.00 0.00 H new ATOM 2321 N HIS B 55 6.086 6.579 -4.726 1.00 0.00 N ATOM 2322 CA HIS B 55 4.929 6.461 -3.847 1.00 0.00 C ATOM 2323 C HIS B 55 5.318 5.643 -2.622 1.00 0.00 C ATOM 2324 O HIS B 55 5.289 4.413 -2.653 1.00 0.00 O ATOM 2325 CB HIS B 55 3.762 5.797 -4.581 1.00 0.00 C ATOM 2326 CG HIS B 55 3.513 6.360 -5.946 1.00 0.00 C ATOM 2327 ND1 HIS B 55 2.464 5.958 -6.748 1.00 0.00 N ATOM 2328 CD2 HIS B 55 4.182 7.304 -6.651 1.00 0.00 C ATOM 2329 CE1 HIS B 55 2.500 6.629 -7.886 1.00 0.00 C ATOM 2330 NE2 HIS B 55 3.532 7.451 -7.852 1.00 0.00 N ATOM 0 H HIS B 55 6.072 5.955 -5.532 1.00 0.00 H new ATOM 0 HA HIS B 55 4.609 7.455 -3.536 1.00 0.00 H new ATOM 0 HB2 HIS B 55 3.960 4.729 -4.668 1.00 0.00 H new ATOM 0 HB3 HIS B 55 2.858 5.906 -3.982 1.00 0.00 H new ATOM 0 HD1 HIS B 55 1.769 5.253 -6.501 1.00 0.00 H new ATOM 0 HD2 HIS B 55 5.062 7.841 -6.329 1.00 0.00 H new ATOM 0 HE1 HIS B 55 1.803 6.523 -8.705 1.00 0.00 H new ATOM 2339 N CYS B 56 5.720 6.329 -1.557 1.00 0.00 N ATOM 2340 CA CYS B 56 6.158 5.650 -0.341 1.00 0.00 C ATOM 2341 C CYS B 56 5.158 5.791 0.801 1.00 0.00 C ATOM 2342 O CYS B 56 4.576 6.854 1.015 1.00 0.00 O ATOM 2343 CB CYS B 56 7.518 6.195 0.098 1.00 0.00 C ATOM 2344 SG CYS B 56 8.490 6.917 -1.244 1.00 0.00 S ATOM 0 H CYS B 56 5.752 7.347 -1.510 1.00 0.00 H new ATOM 0 HA CYS B 56 6.236 4.589 -0.577 1.00 0.00 H new ATOM 0 HB2 CYS B 56 7.363 6.951 0.868 1.00 0.00 H new ATOM 0 HB3 CYS B 56 8.091 5.388 0.554 1.00 0.00 H new ATOM 0 HG CYS B 56 7.717 7.638 -2.000 1.00 0.00 H new ATOM 2350 N ILE B 57 4.991 4.701 1.545 1.00 0.00 N ATOM 2351 CA ILE B 57 4.094 4.669 2.694 1.00 0.00 C ATOM 2352 C ILE B 57 4.775 3.970 3.865 1.00 0.00 C ATOM 2353 O ILE B 57 4.895 2.746 3.884 1.00 0.00 O ATOM 2354 CB ILE B 57 2.774 3.937 2.373 1.00 0.00 C ATOM 2355 CG1 ILE B 57 2.142 4.492 1.089 1.00 0.00 C ATOM 2356 CG2 ILE B 57 1.806 4.052 3.544 1.00 0.00 C ATOM 2357 CD1 ILE B 57 2.072 6.003 1.035 1.00 0.00 C ATOM 0 H ILE B 57 5.472 3.819 1.369 1.00 0.00 H new ATOM 0 HA ILE B 57 3.860 5.702 2.952 1.00 0.00 H new ATOM 0 HB ILE B 57 2.996 2.882 2.211 1.00 0.00 H new ATOM 0 HG12 ILE B 57 2.714 4.135 0.232 1.00 0.00 H new ATOM 0 HG13 ILE B 57 1.134 4.089 0.990 1.00 0.00 H new ATOM 0 HG21 ILE B 57 0.880 3.531 3.303 1.00 0.00 H new ATOM 0 HG22 ILE B 57 2.254 3.604 4.431 1.00 0.00 H new ATOM 0 HG23 ILE B 57 1.591 5.103 3.737 1.00 0.00 H new ATOM 0 HD11 ILE B 57 1.613 6.313 0.096 1.00 0.00 H new ATOM 0 HD12 ILE B 57 1.474 6.370 1.870 1.00 0.00 H new ATOM 0 HD13 ILE B 57 3.078 6.416 1.100 1.00 0.00 H new ATOM 2369 N VAL B 58 5.237 4.755 4.833 1.00 0.00 N ATOM 2370 CA VAL B 58 5.923 4.203 5.996 1.00 0.00 C ATOM 2371 C VAL B 58 5.024 4.190 7.226 1.00 0.00 C ATOM 2372 O VAL B 58 4.485 5.221 7.624 1.00 0.00 O ATOM 2373 CB VAL B 58 7.207 4.990 6.315 1.00 0.00 C ATOM 2374 CG1 VAL B 58 6.930 6.483 6.332 1.00 0.00 C ATOM 2375 CG2 VAL B 58 7.798 4.533 7.640 1.00 0.00 C ATOM 0 H VAL B 58 5.149 5.771 4.836 1.00 0.00 H new ATOM 0 HA VAL B 58 6.187 3.176 5.743 1.00 0.00 H new ATOM 0 HB VAL B 58 7.937 4.791 5.530 1.00 0.00 H new ATOM 0 HG11 VAL B 58 7.850 7.021 6.559 1.00 0.00 H new ATOM 0 HG12 VAL B 58 6.559 6.795 5.356 1.00 0.00 H new ATOM 0 HG13 VAL B 58 6.182 6.706 7.093 1.00 0.00 H new ATOM 0 HG21 VAL B 58 8.705 5.100 7.849 1.00 0.00 H new ATOM 0 HG22 VAL B 58 7.074 4.699 8.438 1.00 0.00 H new ATOM 0 HG23 VAL B 58 8.039 3.471 7.584 1.00 0.00 H new ATOM 2385 N GLY B 59 4.880 3.014 7.830 1.00 0.00 N ATOM 2386 CA GLY B 59 4.056 2.880 9.015 1.00 0.00 C ATOM 2387 C GLY B 59 4.631 1.879 9.994 1.00 0.00 C ATOM 2388 O GLY B 59 5.669 2.128 10.607 1.00 0.00 O ATOM 0 H GLY B 59 5.322 2.149 7.517 1.00 0.00 H new ATOM 0 HA2 GLY B 59 3.961 3.850 9.502 1.00 0.00 H new ATOM 0 HA3 GLY B 59 3.052 2.569 8.726 1.00 0.00 H new ATOM 2392 N ARG B 60 3.959 0.742 10.145 1.00 0.00 N ATOM 2393 CA ARG B 60 4.418 -0.290 11.055 1.00 0.00 C ATOM 2394 C ARG B 60 3.359 -1.366 11.267 1.00 0.00 C ATOM 2395 O ARG B 60 3.552 -2.287 12.060 1.00 0.00 O ATOM 2396 CB ARG B 60 4.791 0.342 12.385 1.00 0.00 C ATOM 2397 CG ARG B 60 3.599 0.876 13.160 1.00 0.00 C ATOM 2398 CD ARG B 60 3.930 1.058 14.631 1.00 0.00 C ATOM 2399 NE ARG B 60 2.763 0.846 15.483 1.00 0.00 N ATOM 2400 CZ ARG B 60 2.835 0.633 16.793 1.00 0.00 C ATOM 2401 NH1 ARG B 60 4.014 0.593 17.400 1.00 0.00 N ATOM 2402 NH2 ARG B 60 1.726 0.457 17.497 1.00 0.00 N ATOM 0 H ARG B 60 3.097 0.517 9.648 1.00 0.00 H new ATOM 0 HA ARG B 60 5.291 -0.771 10.613 1.00 0.00 H new ATOM 0 HB2 ARG B 60 5.310 -0.397 12.996 1.00 0.00 H new ATOM 0 HB3 ARG B 60 5.492 1.157 12.206 1.00 0.00 H new ATOM 0 HG2 ARG B 60 3.285 1.830 12.736 1.00 0.00 H new ATOM 0 HG3 ARG B 60 2.759 0.189 13.057 1.00 0.00 H new ATOM 0 HD2 ARG B 60 4.718 0.360 14.915 1.00 0.00 H new ATOM 0 HD3 ARG B 60 4.320 2.063 14.794 1.00 0.00 H new ATOM 0 HE ARG B 60 1.840 0.862 15.048 1.00 0.00 H new ATOM 0 HH11 ARG B 60 4.870 0.726 16.861 1.00 0.00 H new ATOM 0 HH12 ARG B 60 4.065 0.429 18.406 1.00 0.00 H new ATOM 0 HH21 ARG B 60 0.818 0.485 17.033 1.00 0.00 H new ATOM 0 HH22 ARG B 60 1.781 0.293 18.502 1.00 0.00 H new ATOM 2416 N ASN B 61 2.241 -1.250 10.558 1.00 0.00 N ATOM 2417 CA ASN B 61 1.164 -2.224 10.683 1.00 0.00 C ATOM 2418 C ASN B 61 -0.019 -1.863 9.796 1.00 0.00 C ATOM 2419 O ASN B 61 -1.164 -2.185 10.114 1.00 0.00 O ATOM 2420 CB ASN B 61 0.707 -2.322 12.138 1.00 0.00 C ATOM 2421 CG ASN B 61 0.764 -3.741 12.668 1.00 0.00 C ATOM 2422 OD1 ASN B 61 -0.235 -4.459 12.661 1.00 0.00 O ATOM 2423 ND2 ASN B 61 1.938 -4.152 13.129 1.00 0.00 N ATOM 0 H ASN B 61 2.058 -0.496 9.895 1.00 0.00 H new ATOM 0 HA ASN B 61 1.551 -3.190 10.358 1.00 0.00 H new ATOM 0 HB2 ASN B 61 1.334 -1.681 12.757 1.00 0.00 H new ATOM 0 HB3 ASN B 61 -0.313 -1.947 12.222 1.00 0.00 H new ATOM 0 HD21 ASN B 61 2.039 -5.098 13.497 1.00 0.00 H new ATOM 0 HD22 ASN B 61 2.740 -3.522 13.115 1.00 0.00 H new ATOM 2430 N PHE B 62 0.259 -1.202 8.680 1.00 0.00 N ATOM 2431 CA PHE B 62 -0.792 -0.811 7.753 1.00 0.00 C ATOM 2432 C PHE B 62 -0.981 -1.866 6.673 1.00 0.00 C ATOM 2433 O PHE B 62 -0.466 -2.980 6.776 1.00 0.00 O ATOM 2434 CB PHE B 62 -0.470 0.539 7.113 1.00 0.00 C ATOM 2435 CG PHE B 62 0.694 0.495 6.165 1.00 0.00 C ATOM 2436 CD1 PHE B 62 1.960 0.160 6.615 1.00 0.00 C ATOM 2437 CD2 PHE B 62 0.521 0.794 4.823 1.00 0.00 C ATOM 2438 CE1 PHE B 62 3.032 0.122 5.745 1.00 0.00 C ATOM 2439 CE2 PHE B 62 1.589 0.759 3.947 1.00 0.00 C ATOM 2440 CZ PHE B 62 2.847 0.423 4.408 1.00 0.00 C ATOM 0 H PHE B 62 1.199 -0.927 8.396 1.00 0.00 H new ATOM 0 HA PHE B 62 -1.720 -0.721 8.317 1.00 0.00 H new ATOM 0 HB2 PHE B 62 -1.350 0.897 6.578 1.00 0.00 H new ATOM 0 HB3 PHE B 62 -0.259 1.263 7.900 1.00 0.00 H new ATOM 0 HD1 PHE B 62 2.111 -0.074 7.658 1.00 0.00 H new ATOM 0 HD2 PHE B 62 -0.460 1.058 4.457 1.00 0.00 H new ATOM 0 HE1 PHE B 62 4.014 -0.143 6.109 1.00 0.00 H new ATOM 0 HE2 PHE B 62 1.440 0.994 2.903 1.00 0.00 H new ATOM 0 HZ PHE B 62 3.684 0.395 3.726 1.00 0.00 H new ATOM 2450 N GLY B 63 -1.720 -1.505 5.634 1.00 0.00 N ATOM 2451 CA GLY B 63 -1.970 -2.420 4.540 1.00 0.00 C ATOM 2452 C GLY B 63 -1.915 -1.722 3.199 1.00 0.00 C ATOM 2453 O GLY B 63 -2.940 -1.276 2.681 1.00 0.00 O ATOM 0 H GLY B 63 -2.154 -0.588 5.529 1.00 0.00 H new ATOM 0 HA2 GLY B 63 -1.233 -3.223 4.562 1.00 0.00 H new ATOM 0 HA3 GLY B 63 -2.949 -2.882 4.669 1.00 0.00 H new ATOM 2457 N SER B 64 -0.716 -1.612 2.643 1.00 0.00 N ATOM 2458 CA SER B 64 -0.530 -0.945 1.362 1.00 0.00 C ATOM 2459 C SER B 64 -0.842 -1.881 0.199 1.00 0.00 C ATOM 2460 O SER B 64 -0.243 -2.948 0.064 1.00 0.00 O ATOM 2461 CB SER B 64 0.900 -0.412 1.236 1.00 0.00 C ATOM 2462 OG SER B 64 1.845 -1.368 1.686 1.00 0.00 O ATOM 0 H SER B 64 0.141 -1.976 3.059 1.00 0.00 H new ATOM 0 HA SER B 64 -1.226 -0.107 1.322 1.00 0.00 H new ATOM 0 HB2 SER B 64 1.105 -0.156 0.197 1.00 0.00 H new ATOM 0 HB3 SER B 64 1.002 0.505 1.817 1.00 0.00 H new ATOM 0 HG SER B 64 2.220 -1.079 2.544 1.00 0.00 H new ATOM 2468 N TYR B 65 -1.783 -1.465 -0.640 1.00 0.00 N ATOM 2469 CA TYR B 65 -2.183 -2.251 -1.800 1.00 0.00 C ATOM 2470 C TYR B 65 -2.260 -1.368 -3.040 1.00 0.00 C ATOM 2471 O TYR B 65 -3.332 -0.882 -3.404 1.00 0.00 O ATOM 2472 CB TYR B 65 -3.536 -2.919 -1.549 1.00 0.00 C ATOM 2473 CG TYR B 65 -3.940 -3.899 -2.626 1.00 0.00 C ATOM 2474 CD1 TYR B 65 -4.597 -3.470 -3.772 1.00 0.00 C ATOM 2475 CD2 TYR B 65 -3.663 -5.254 -2.497 1.00 0.00 C ATOM 2476 CE1 TYR B 65 -4.970 -4.363 -4.759 1.00 0.00 C ATOM 2477 CE2 TYR B 65 -4.031 -6.154 -3.480 1.00 0.00 C ATOM 2478 CZ TYR B 65 -4.683 -5.703 -4.608 1.00 0.00 C ATOM 2479 OH TYR B 65 -5.050 -6.596 -5.589 1.00 0.00 O ATOM 0 H TYR B 65 -2.285 -0.583 -0.537 1.00 0.00 H new ATOM 0 HA TYR B 65 -1.434 -3.025 -1.966 1.00 0.00 H new ATOM 0 HB2 TYR B 65 -3.502 -3.439 -0.592 1.00 0.00 H new ATOM 0 HB3 TYR B 65 -4.302 -2.148 -1.466 1.00 0.00 H new ATOM 0 HD1 TYR B 65 -4.820 -2.420 -3.894 1.00 0.00 H new ATOM 0 HD2 TYR B 65 -3.152 -5.610 -1.615 1.00 0.00 H new ATOM 0 HE1 TYR B 65 -5.483 -4.013 -5.643 1.00 0.00 H new ATOM 0 HE2 TYR B 65 -3.809 -7.205 -3.365 1.00 0.00 H new ATOM 0 HH TYR B 65 -4.774 -7.500 -5.329 1.00 0.00 H new ATOM 2489 N VAL B 66 -1.115 -1.155 -3.677 1.00 0.00 N ATOM 2490 CA VAL B 66 -1.048 -0.319 -4.868 1.00 0.00 C ATOM 2491 C VAL B 66 -0.558 -1.113 -6.075 1.00 0.00 C ATOM 2492 O VAL B 66 0.213 -2.062 -5.935 1.00 0.00 O ATOM 2493 CB VAL B 66 -0.114 0.886 -4.648 1.00 0.00 C ATOM 2494 CG1 VAL B 66 -0.476 1.617 -3.364 1.00 0.00 C ATOM 2495 CG2 VAL B 66 1.338 0.437 -4.621 1.00 0.00 C ATOM 0 H VAL B 66 -0.220 -1.550 -3.388 1.00 0.00 H new ATOM 0 HA VAL B 66 -2.059 0.039 -5.062 1.00 0.00 H new ATOM 0 HB VAL B 66 -0.242 1.578 -5.481 1.00 0.00 H new ATOM 0 HG11 VAL B 66 0.195 2.465 -3.226 1.00 0.00 H new ATOM 0 HG12 VAL B 66 -1.504 1.974 -3.426 1.00 0.00 H new ATOM 0 HG13 VAL B 66 -0.379 0.936 -2.518 1.00 0.00 H new ATOM 0 HG21 VAL B 66 1.983 1.301 -4.465 1.00 0.00 H new ATOM 0 HG22 VAL B 66 1.483 -0.276 -3.809 1.00 0.00 H new ATOM 0 HG23 VAL B 66 1.590 -0.037 -5.570 1.00 0.00 H new ATOM 2505 N THR B 67 -1.006 -0.712 -7.261 1.00 0.00 N ATOM 2506 CA THR B 67 -0.607 -1.381 -8.494 1.00 0.00 C ATOM 2507 C THR B 67 0.836 -1.042 -8.845 1.00 0.00 C ATOM 2508 O THR B 67 1.097 -0.212 -9.715 1.00 0.00 O ATOM 2509 CB THR B 67 -1.532 -0.976 -9.643 1.00 0.00 C ATOM 2510 OG1 THR B 67 -2.819 -1.543 -9.475 1.00 0.00 O ATOM 2511 CG2 THR B 67 -1.018 -1.398 -11.003 1.00 0.00 C ATOM 0 H THR B 67 -1.645 0.072 -7.394 1.00 0.00 H new ATOM 0 HA THR B 67 -0.685 -2.457 -8.339 1.00 0.00 H new ATOM 0 HB THR B 67 -1.573 0.113 -9.610 1.00 0.00 H new ATOM 0 HG1 THR B 67 -3.401 -0.903 -9.014 1.00 0.00 H new ATOM 0 HG21 THR B 67 -1.721 -1.080 -11.773 1.00 0.00 H new ATOM 0 HG22 THR B 67 -0.048 -0.936 -11.185 1.00 0.00 H new ATOM 0 HG23 THR B 67 -0.914 -2.483 -11.032 1.00 0.00 H new ATOM 2519 N HIS B 68 1.771 -1.688 -8.157 1.00 0.00 N ATOM 2520 CA HIS B 68 3.190 -1.456 -8.388 1.00 0.00 C ATOM 2521 C HIS B 68 3.564 -1.777 -9.832 1.00 0.00 C ATOM 2522 O HIS B 68 2.773 -2.359 -10.573 1.00 0.00 O ATOM 2523 CB HIS B 68 4.021 -2.307 -7.429 1.00 0.00 C ATOM 2524 CG HIS B 68 4.086 -3.750 -7.818 1.00 0.00 C ATOM 2525 ND1 HIS B 68 3.024 -4.620 -7.673 1.00 0.00 N ATOM 2526 CD2 HIS B 68 5.092 -4.476 -8.356 1.00 0.00 C ATOM 2527 CE1 HIS B 68 3.378 -5.818 -8.105 1.00 0.00 C ATOM 2528 NE2 HIS B 68 4.627 -5.756 -8.524 1.00 0.00 N ATOM 0 H HIS B 68 1.570 -2.378 -7.433 1.00 0.00 H new ATOM 0 HA HIS B 68 3.401 -0.402 -8.206 1.00 0.00 H new ATOM 0 HB2 HIS B 68 5.033 -1.905 -7.383 1.00 0.00 H new ATOM 0 HB3 HIS B 68 3.600 -2.227 -6.427 1.00 0.00 H new ATOM 0 HD2 HIS B 68 6.079 -4.115 -8.607 1.00 0.00 H new ATOM 0 HE1 HIS B 68 2.751 -6.698 -8.113 1.00 0.00 H new ATOM 0 HE2 HIS B 68 5.161 -6.534 -8.911 1.00 0.00 H new ATOM 2537 N GLU B 69 4.773 -1.393 -10.224 1.00 0.00 N ATOM 2538 CA GLU B 69 5.249 -1.641 -11.580 1.00 0.00 C ATOM 2539 C GLU B 69 6.645 -1.061 -11.782 1.00 0.00 C ATOM 2540 O GLU B 69 7.177 -0.375 -10.909 1.00 0.00 O ATOM 2541 CB GLU B 69 4.279 -1.037 -12.598 1.00 0.00 C ATOM 2542 CG GLU B 69 3.800 0.357 -12.229 1.00 0.00 C ATOM 2543 CD GLU B 69 2.463 0.701 -12.857 1.00 0.00 C ATOM 2544 OE1 GLU B 69 1.729 -0.233 -13.242 1.00 0.00 O ATOM 2545 OE2 GLU B 69 2.150 1.906 -12.964 1.00 0.00 O ATOM 0 H GLU B 69 5.441 -0.909 -9.623 1.00 0.00 H new ATOM 0 HA GLU B 69 5.300 -2.719 -11.731 1.00 0.00 H new ATOM 0 HB2 GLU B 69 4.766 -0.999 -13.573 1.00 0.00 H new ATOM 0 HB3 GLU B 69 3.415 -1.694 -12.699 1.00 0.00 H new ATOM 0 HG2 GLU B 69 3.718 0.434 -11.145 1.00 0.00 H new ATOM 0 HG3 GLU B 69 4.544 1.088 -12.545 1.00 0.00 H new ATOM 2552 N THR B 70 7.234 -1.343 -12.940 1.00 0.00 N ATOM 2553 CA THR B 70 8.569 -0.852 -13.260 1.00 0.00 C ATOM 2554 C THR B 70 9.633 -1.647 -12.511 1.00 0.00 C ATOM 2555 O THR B 70 10.139 -2.650 -13.012 1.00 0.00 O ATOM 2556 CB THR B 70 8.689 0.634 -12.914 1.00 0.00 C ATOM 2557 OG1 THR B 70 7.472 1.310 -13.174 1.00 0.00 O ATOM 2558 CG2 THR B 70 9.782 1.341 -13.687 1.00 0.00 C ATOM 0 H THR B 70 6.807 -1.910 -13.673 1.00 0.00 H new ATOM 0 HA THR B 70 8.728 -0.981 -14.331 1.00 0.00 H new ATOM 0 HB THR B 70 8.938 0.665 -11.853 1.00 0.00 H new ATOM 0 HG1 THR B 70 7.569 2.258 -12.945 1.00 0.00 H new ATOM 0 HG21 THR B 70 9.814 2.391 -13.395 1.00 0.00 H new ATOM 0 HG22 THR B 70 10.742 0.874 -13.468 1.00 0.00 H new ATOM 0 HG23 THR B 70 9.578 1.268 -14.755 1.00 0.00 H new ATOM 2566 N LYS B 71 9.967 -1.191 -11.308 1.00 0.00 N ATOM 2567 CA LYS B 71 10.972 -1.859 -10.490 1.00 0.00 C ATOM 2568 C LYS B 71 11.403 -0.970 -9.329 1.00 0.00 C ATOM 2569 O LYS B 71 12.592 -0.863 -9.026 1.00 0.00 O ATOM 2570 CB LYS B 71 12.187 -2.234 -11.339 1.00 0.00 C ATOM 2571 CG LYS B 71 12.653 -1.116 -12.257 1.00 0.00 C ATOM 2572 CD LYS B 71 14.163 -1.135 -12.436 1.00 0.00 C ATOM 2573 CE LYS B 71 14.856 -0.246 -11.417 1.00 0.00 C ATOM 2574 NZ LYS B 71 16.110 0.346 -11.958 1.00 0.00 N ATOM 0 H LYS B 71 9.556 -0.362 -10.878 1.00 0.00 H new ATOM 0 HA LYS B 71 10.529 -2.769 -10.085 1.00 0.00 H new ATOM 0 HB2 LYS B 71 13.007 -2.518 -10.680 1.00 0.00 H new ATOM 0 HB3 LYS B 71 11.944 -3.110 -11.941 1.00 0.00 H new ATOM 0 HG2 LYS B 71 12.169 -1.216 -13.229 1.00 0.00 H new ATOM 0 HG3 LYS B 71 12.346 -0.154 -11.846 1.00 0.00 H new ATOM 0 HD2 LYS B 71 14.529 -2.157 -12.338 1.00 0.00 H new ATOM 0 HD3 LYS B 71 14.415 -0.802 -13.443 1.00 0.00 H new ATOM 0 HE2 LYS B 71 14.180 0.553 -11.112 1.00 0.00 H new ATOM 0 HE3 LYS B 71 15.085 -0.828 -10.524 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 16.552 0.945 -11.232 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 16.766 -0.415 -12.225 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 15.889 0.922 -12.795 1.00 0.00 H new ATOM 2588 N HIS B 72 10.432 -0.335 -8.685 1.00 0.00 N ATOM 2589 CA HIS B 72 10.714 0.545 -7.558 1.00 0.00 C ATOM 2590 C HIS B 72 9.686 0.353 -6.447 1.00 0.00 C ATOM 2591 O HIS B 72 9.370 1.289 -5.712 1.00 0.00 O ATOM 2592 CB HIS B 72 10.725 2.005 -8.015 1.00 0.00 C ATOM 2593 CG HIS B 72 11.654 2.266 -9.161 1.00 0.00 C ATOM 2594 ND1 HIS B 72 13.020 2.094 -9.076 1.00 0.00 N ATOM 2595 CD2 HIS B 72 11.408 2.687 -10.425 1.00 0.00 C ATOM 2596 CE1 HIS B 72 13.573 2.399 -10.237 1.00 0.00 C ATOM 2597 NE2 HIS B 72 12.616 2.760 -11.072 1.00 0.00 N ATOM 0 H HIS B 72 9.443 -0.413 -8.923 1.00 0.00 H new ATOM 0 HA HIS B 72 11.698 0.288 -7.165 1.00 0.00 H new ATOM 0 HB2 HIS B 72 9.715 2.295 -8.304 1.00 0.00 H new ATOM 0 HB3 HIS B 72 11.010 2.638 -7.175 1.00 0.00 H new ATOM 0 HD1 HIS B 72 13.524 1.780 -8.247 1.00 0.00 H new ATOM 0 HD2 HIS B 72 10.441 2.922 -10.845 1.00 0.00 H new ATOM 0 HE1 HIS B 72 14.628 2.360 -10.464 1.00 0.00 H new ATOM 2606 N PHE B 73 9.171 -0.868 -6.325 1.00 0.00 N ATOM 2607 CA PHE B 73 8.186 -1.179 -5.297 1.00 0.00 C ATOM 2608 C PHE B 73 8.778 -2.122 -4.256 1.00 0.00 C ATOM 2609 O PHE B 73 8.532 -3.327 -4.283 1.00 0.00 O ATOM 2610 CB PHE B 73 6.935 -1.805 -5.923 1.00 0.00 C ATOM 2611 CG PHE B 73 6.078 -2.556 -4.942 1.00 0.00 C ATOM 2612 CD1 PHE B 73 5.606 -1.935 -3.797 1.00 0.00 C ATOM 2613 CD2 PHE B 73 5.749 -3.883 -5.164 1.00 0.00 C ATOM 2614 CE1 PHE B 73 4.820 -2.622 -2.892 1.00 0.00 C ATOM 2615 CE2 PHE B 73 4.963 -4.577 -4.263 1.00 0.00 C ATOM 2616 CZ PHE B 73 4.498 -3.946 -3.125 1.00 0.00 C ATOM 0 H PHE B 73 9.420 -1.655 -6.924 1.00 0.00 H new ATOM 0 HA PHE B 73 7.903 -0.249 -4.804 1.00 0.00 H new ATOM 0 HB2 PHE B 73 6.338 -1.018 -6.385 1.00 0.00 H new ATOM 0 HB3 PHE B 73 7.239 -2.484 -6.720 1.00 0.00 H new ATOM 0 HD1 PHE B 73 5.856 -0.901 -3.610 1.00 0.00 H new ATOM 0 HD2 PHE B 73 6.111 -4.381 -6.051 1.00 0.00 H new ATOM 0 HE1 PHE B 73 4.458 -2.125 -2.004 1.00 0.00 H new ATOM 0 HE2 PHE B 73 4.713 -5.611 -4.448 1.00 0.00 H new ATOM 0 HZ PHE B 73 3.884 -4.486 -2.419 1.00 0.00 H new ATOM 2626 N ILE B 74 9.560 -1.563 -3.339 1.00 0.00 N ATOM 2627 CA ILE B 74 10.187 -2.356 -2.292 1.00 0.00 C ATOM 2628 C ILE B 74 9.458 -2.190 -0.965 1.00 0.00 C ATOM 2629 O ILE B 74 9.299 -1.076 -0.466 1.00 0.00 O ATOM 2630 CB ILE B 74 11.664 -1.971 -2.094 1.00 0.00 C ATOM 2631 CG1 ILE B 74 12.323 -2.960 -1.107 1.00 0.00 C ATOM 2632 CG2 ILE B 74 11.764 -0.519 -1.628 1.00 0.00 C ATOM 2633 CD1 ILE B 74 13.318 -2.355 -0.132 1.00 0.00 C ATOM 0 H ILE B 74 9.774 -0.566 -3.301 1.00 0.00 H new ATOM 0 HA ILE B 74 10.129 -3.396 -2.615 1.00 0.00 H new ATOM 0 HB ILE B 74 12.205 -2.040 -3.038 1.00 0.00 H new ATOM 0 HG12 ILE B 74 11.536 -3.452 -0.535 1.00 0.00 H new ATOM 0 HG13 ILE B 74 12.831 -3.734 -1.682 1.00 0.00 H new ATOM 0 HG21 ILE B 74 12.812 -0.253 -1.490 1.00 0.00 H new ATOM 0 HG22 ILE B 74 11.319 0.135 -2.378 1.00 0.00 H new ATOM 0 HG23 ILE B 74 11.232 -0.403 -0.684 1.00 0.00 H new ATOM 0 HD11 ILE B 74 13.718 -3.138 0.512 1.00 0.00 H new ATOM 0 HD12 ILE B 74 14.133 -1.889 -0.686 1.00 0.00 H new ATOM 0 HD13 ILE B 74 12.818 -1.603 0.479 1.00 0.00 H new ATOM 2645 N TYR B 75 9.023 -3.306 -0.397 1.00 0.00 N ATOM 2646 CA TYR B 75 8.317 -3.291 0.877 1.00 0.00 C ATOM 2647 C TYR B 75 9.168 -3.940 1.962 1.00 0.00 C ATOM 2648 O TYR B 75 9.789 -4.979 1.737 1.00 0.00 O ATOM 2649 CB TYR B 75 6.979 -4.021 0.753 1.00 0.00 C ATOM 2650 CG TYR B 75 5.999 -3.675 1.851 1.00 0.00 C ATOM 2651 CD1 TYR B 75 6.411 -3.594 3.176 1.00 0.00 C ATOM 2652 CD2 TYR B 75 4.661 -3.430 1.565 1.00 0.00 C ATOM 2653 CE1 TYR B 75 5.519 -3.278 4.183 1.00 0.00 C ATOM 2654 CE2 TYR B 75 3.764 -3.114 2.567 1.00 0.00 C ATOM 2655 CZ TYR B 75 4.198 -3.039 3.873 1.00 0.00 C ATOM 2656 OH TYR B 75 3.307 -2.723 4.874 1.00 0.00 O ATOM 0 H TYR B 75 9.147 -4.235 -0.799 1.00 0.00 H new ATOM 0 HA TYR B 75 8.126 -2.254 1.154 1.00 0.00 H new ATOM 0 HB2 TYR B 75 6.531 -3.781 -0.211 1.00 0.00 H new ATOM 0 HB3 TYR B 75 7.158 -5.096 0.763 1.00 0.00 H new ATOM 0 HD1 TYR B 75 7.446 -3.781 3.423 1.00 0.00 H new ATOM 0 HD2 TYR B 75 4.317 -3.488 0.543 1.00 0.00 H new ATOM 0 HE1 TYR B 75 5.856 -3.219 5.208 1.00 0.00 H new ATOM 0 HE2 TYR B 75 2.728 -2.927 2.328 1.00 0.00 H new ATOM 0 HH TYR B 75 3.029 -1.788 4.781 1.00 0.00 H new ATOM 2666 N PHE B 76 9.195 -3.323 3.136 1.00 0.00 N ATOM 2667 CA PHE B 76 9.973 -3.844 4.252 1.00 0.00 C ATOM 2668 C PHE B 76 9.494 -3.256 5.572 1.00 0.00 C ATOM 2669 O PHE B 76 8.716 -2.301 5.593 1.00 0.00 O ATOM 2670 CB PHE B 76 11.460 -3.538 4.053 1.00 0.00 C ATOM 2671 CG PHE B 76 11.737 -2.103 3.705 1.00 0.00 C ATOM 2672 CD1 PHE B 76 11.477 -1.624 2.432 1.00 0.00 C ATOM 2673 CD2 PHE B 76 12.257 -1.235 4.651 1.00 0.00 C ATOM 2674 CE1 PHE B 76 11.730 -0.304 2.107 1.00 0.00 C ATOM 2675 CE2 PHE B 76 12.512 0.085 4.333 1.00 0.00 C ATOM 2676 CZ PHE B 76 12.249 0.551 3.059 1.00 0.00 C ATOM 0 H PHE B 76 8.688 -2.462 3.340 1.00 0.00 H new ATOM 0 HA PHE B 76 9.833 -4.924 4.285 1.00 0.00 H new ATOM 0 HB2 PHE B 76 12.000 -3.793 4.965 1.00 0.00 H new ATOM 0 HB3 PHE B 76 11.851 -4.177 3.262 1.00 0.00 H new ATOM 0 HD1 PHE B 76 11.072 -2.289 1.684 1.00 0.00 H new ATOM 0 HD2 PHE B 76 12.465 -1.594 5.648 1.00 0.00 H new ATOM 0 HE1 PHE B 76 11.522 0.057 1.111 1.00 0.00 H new ATOM 0 HE2 PHE B 76 12.917 0.752 5.080 1.00 0.00 H new ATOM 0 HZ PHE B 76 12.449 1.582 2.808 1.00 0.00 H new ATOM 2686 N TYR B 77 9.962 -3.832 6.672 1.00 0.00 N ATOM 2687 CA TYR B 77 9.582 -3.367 7.999 1.00 0.00 C ATOM 2688 C TYR B 77 10.804 -3.244 8.902 1.00 0.00 C ATOM 2689 O TYR B 77 11.457 -4.238 9.219 1.00 0.00 O ATOM 2690 CB TYR B 77 8.565 -4.321 8.625 1.00 0.00 C ATOM 2691 CG TYR B 77 8.115 -3.904 10.007 1.00 0.00 C ATOM 2692 CD1 TYR B 77 8.853 -4.250 11.131 1.00 0.00 C ATOM 2693 CD2 TYR B 77 6.952 -3.165 10.185 1.00 0.00 C ATOM 2694 CE1 TYR B 77 8.444 -3.872 12.396 1.00 0.00 C ATOM 2695 CE2 TYR B 77 6.538 -2.783 11.446 1.00 0.00 C ATOM 2696 CZ TYR B 77 7.286 -3.138 12.548 1.00 0.00 C ATOM 2697 OH TYR B 77 6.876 -2.758 13.806 1.00 0.00 O ATOM 0 H TYR B 77 10.606 -4.623 6.671 1.00 0.00 H new ATOM 0 HA TYR B 77 9.128 -2.381 7.895 1.00 0.00 H new ATOM 0 HB2 TYR B 77 7.694 -4.389 7.973 1.00 0.00 H new ATOM 0 HB3 TYR B 77 9.001 -5.319 8.679 1.00 0.00 H new ATOM 0 HD1 TYR B 77 9.761 -4.823 11.015 1.00 0.00 H new ATOM 0 HD2 TYR B 77 6.363 -2.885 9.324 1.00 0.00 H new ATOM 0 HE1 TYR B 77 9.028 -4.150 13.261 1.00 0.00 H new ATOM 0 HE2 TYR B 77 5.632 -2.208 11.568 1.00 0.00 H new ATOM 0 HH TYR B 77 7.172 -3.423 14.462 1.00 0.00 H new ATOM 2707 N LEU B 78 11.106 -2.018 9.314 1.00 0.00 N ATOM 2708 CA LEU B 78 12.248 -1.766 10.182 1.00 0.00 C ATOM 2709 C LEU B 78 11.993 -2.320 11.579 1.00 0.00 C ATOM 2710 O LEU B 78 10.876 -2.730 11.896 1.00 0.00 O ATOM 2711 CB LEU B 78 12.539 -0.265 10.251 1.00 0.00 C ATOM 2712 CG LEU B 78 13.181 0.337 8.996 1.00 0.00 C ATOM 2713 CD1 LEU B 78 14.658 -0.017 8.929 1.00 0.00 C ATOM 2714 CD2 LEU B 78 12.460 -0.137 7.741 1.00 0.00 C ATOM 0 H LEU B 78 10.576 -1.184 9.061 1.00 0.00 H new ATOM 0 HA LEU B 78 13.118 -2.273 9.764 1.00 0.00 H new ATOM 0 HB2 LEU B 78 11.605 0.261 10.449 1.00 0.00 H new ATOM 0 HB3 LEU B 78 13.196 -0.078 11.100 1.00 0.00 H new ATOM 0 HG LEU B 78 13.089 1.422 9.053 1.00 0.00 H new ATOM 0 HD11 LEU B 78 15.096 0.419 8.031 1.00 0.00 H new ATOM 0 HD12 LEU B 78 15.167 0.376 9.809 1.00 0.00 H new ATOM 0 HD13 LEU B 78 14.771 -1.101 8.898 1.00 0.00 H new ATOM 0 HD21 LEU B 78 12.932 0.302 6.862 1.00 0.00 H new ATOM 0 HD22 LEU B 78 12.516 -1.224 7.678 1.00 0.00 H new ATOM 0 HD23 LEU B 78 11.415 0.171 7.784 1.00 0.00 H new ATOM 2726 N GLY B 79 13.036 -2.335 12.405 1.00 0.00 N ATOM 2727 CA GLY B 79 12.909 -2.847 13.760 1.00 0.00 C ATOM 2728 C GLY B 79 11.500 -2.717 14.306 1.00 0.00 C ATOM 2729 O GLY B 79 10.948 -3.672 14.851 1.00 0.00 O ATOM 0 H GLY B 79 13.968 -2.001 12.160 1.00 0.00 H new ATOM 0 HA2 GLY B 79 13.205 -3.896 13.777 1.00 0.00 H new ATOM 0 HA3 GLY B 79 13.598 -2.311 14.413 1.00 0.00 H new ATOM 2733 N GLN B 80 10.918 -1.533 14.155 1.00 0.00 N ATOM 2734 CA GLN B 80 9.564 -1.276 14.633 1.00 0.00 C ATOM 2735 C GLN B 80 8.843 -0.294 13.713 1.00 0.00 C ATOM 2736 O GLN B 80 8.103 0.576 14.173 1.00 0.00 O ATOM 2737 CB GLN B 80 9.602 -0.726 16.061 1.00 0.00 C ATOM 2738 CG GLN B 80 10.891 -1.049 16.802 1.00 0.00 C ATOM 2739 CD GLN B 80 10.719 -1.037 18.308 1.00 0.00 C ATOM 2740 OE1 GLN B 80 9.799 -1.654 18.844 1.00 0.00 O ATOM 2741 NE2 GLN B 80 11.606 -0.330 18.999 1.00 0.00 N ATOM 0 H GLN B 80 11.364 -0.734 13.704 1.00 0.00 H new ATOM 0 HA GLN B 80 9.016 -2.218 14.630 1.00 0.00 H new ATOM 0 HB2 GLN B 80 9.472 0.356 16.029 1.00 0.00 H new ATOM 0 HB3 GLN B 80 8.759 -1.132 16.621 1.00 0.00 H new ATOM 0 HG2 GLN B 80 11.249 -2.030 16.489 1.00 0.00 H new ATOM 0 HG3 GLN B 80 11.657 -0.326 16.522 1.00 0.00 H new ATOM 0 HE21 GLN B 80 12.353 0.166 18.513 1.00 0.00 H new ATOM 0 HE22 GLN B 80 11.540 -0.283 20.016 1.00 0.00 H new ATOM 2750 N VAL B 81 9.071 -0.438 12.411 1.00 0.00 N ATOM 2751 CA VAL B 81 8.453 0.434 11.417 1.00 0.00 C ATOM 2752 C VAL B 81 8.295 -0.286 10.083 1.00 0.00 C ATOM 2753 O VAL B 81 8.862 -1.358 9.874 1.00 0.00 O ATOM 2754 CB VAL B 81 9.286 1.714 11.204 1.00 0.00 C ATOM 2755 CG1 VAL B 81 8.742 2.524 10.037 1.00 0.00 C ATOM 2756 CG2 VAL B 81 9.310 2.551 12.472 1.00 0.00 C ATOM 0 H VAL B 81 9.682 -1.154 12.018 1.00 0.00 H new ATOM 0 HA VAL B 81 7.469 0.708 11.797 1.00 0.00 H new ATOM 0 HB VAL B 81 10.308 1.421 10.966 1.00 0.00 H new ATOM 0 HG11 VAL B 81 9.345 3.422 9.905 1.00 0.00 H new ATOM 0 HG12 VAL B 81 8.781 1.924 9.128 1.00 0.00 H new ATOM 0 HG13 VAL B 81 7.709 2.807 10.241 1.00 0.00 H new ATOM 0 HG21 VAL B 81 9.902 3.450 12.303 1.00 0.00 H new ATOM 0 HG22 VAL B 81 8.292 2.832 12.742 1.00 0.00 H new ATOM 0 HG23 VAL B 81 9.753 1.972 13.282 1.00 0.00 H new ATOM 2766 N ALA B 82 7.522 0.311 9.182 1.00 0.00 N ATOM 2767 CA ALA B 82 7.290 -0.271 7.867 1.00 0.00 C ATOM 2768 C ALA B 82 7.432 0.785 6.778 1.00 0.00 C ATOM 2769 O ALA B 82 7.050 1.940 6.968 1.00 0.00 O ATOM 2770 CB ALA B 82 5.913 -0.914 7.809 1.00 0.00 C ATOM 0 H ALA B 82 7.045 1.199 9.340 1.00 0.00 H new ATOM 0 HA ALA B 82 8.041 -1.042 7.695 1.00 0.00 H new ATOM 0 HB1 ALA B 82 5.754 -1.345 6.820 1.00 0.00 H new ATOM 0 HB2 ALA B 82 5.846 -1.699 8.562 1.00 0.00 H new ATOM 0 HB3 ALA B 82 5.151 -0.160 8.003 1.00 0.00 H new ATOM 2776 N ILE B 83 7.986 0.386 5.639 1.00 0.00 N ATOM 2777 CA ILE B 83 8.178 1.307 4.525 1.00 0.00 C ATOM 2778 C ILE B 83 7.765 0.669 3.205 1.00 0.00 C ATOM 2779 O ILE B 83 8.193 -0.437 2.874 1.00 0.00 O ATOM 2780 CB ILE B 83 9.644 1.775 4.421 1.00 0.00 C ATOM 2781 CG1 ILE B 83 10.379 1.547 5.744 1.00 0.00 C ATOM 2782 CG2 ILE B 83 9.703 3.244 4.026 1.00 0.00 C ATOM 2783 CD1 ILE B 83 9.901 2.443 6.865 1.00 0.00 C ATOM 0 H ILE B 83 8.309 -0.565 5.463 1.00 0.00 H new ATOM 0 HA ILE B 83 7.544 2.172 4.722 1.00 0.00 H new ATOM 0 HB ILE B 83 10.139 1.186 3.649 1.00 0.00 H new ATOM 0 HG12 ILE B 83 10.255 0.506 6.044 1.00 0.00 H new ATOM 0 HG13 ILE B 83 11.446 1.710 5.590 1.00 0.00 H new ATOM 0 HG21 ILE B 83 10.744 3.561 3.956 1.00 0.00 H new ATOM 0 HG22 ILE B 83 9.217 3.381 3.060 1.00 0.00 H new ATOM 0 HG23 ILE B 83 9.191 3.844 4.778 1.00 0.00 H new ATOM 0 HD11 ILE B 83 10.466 2.225 7.771 1.00 0.00 H new ATOM 0 HD12 ILE B 83 10.050 3.486 6.586 1.00 0.00 H new ATOM 0 HD13 ILE B 83 8.841 2.264 7.047 1.00 0.00 H new ATOM 2795 N LEU B 84 6.927 1.375 2.453 1.00 0.00 N ATOM 2796 CA LEU B 84 6.449 0.885 1.166 1.00 0.00 C ATOM 2797 C LEU B 84 6.825 1.857 0.050 1.00 0.00 C ATOM 2798 O LEU B 84 6.133 2.846 -0.184 1.00 0.00 O ATOM 2799 CB LEU B 84 4.929 0.678 1.217 1.00 0.00 C ATOM 2800 CG LEU B 84 4.172 0.978 -0.079 1.00 0.00 C ATOM 2801 CD1 LEU B 84 3.807 -0.312 -0.794 1.00 0.00 C ATOM 2802 CD2 LEU B 84 2.927 1.801 0.212 1.00 0.00 C ATOM 0 H LEU B 84 6.564 2.292 2.714 1.00 0.00 H new ATOM 0 HA LEU B 84 6.925 -0.073 0.954 1.00 0.00 H new ATOM 0 HB2 LEU B 84 4.731 -0.356 1.500 1.00 0.00 H new ATOM 0 HB3 LEU B 84 4.522 1.308 2.008 1.00 0.00 H new ATOM 0 HG LEU B 84 4.823 1.559 -0.733 1.00 0.00 H new ATOM 0 HD11 LEU B 84 3.269 -0.079 -1.713 1.00 0.00 H new ATOM 0 HD12 LEU B 84 4.715 -0.864 -1.035 1.00 0.00 H new ATOM 0 HD13 LEU B 84 3.174 -0.920 -0.148 1.00 0.00 H new ATOM 0 HD21 LEU B 84 2.400 2.006 -0.720 1.00 0.00 H new ATOM 0 HD22 LEU B 84 2.273 1.246 0.884 1.00 0.00 H new ATOM 0 HD23 LEU B 84 3.214 2.742 0.681 1.00 0.00 H new ATOM 2814 N LEU B 85 7.929 1.568 -0.634 1.00 0.00 N ATOM 2815 CA LEU B 85 8.399 2.419 -1.722 1.00 0.00 C ATOM 2816 C LEU B 85 8.008 1.838 -3.077 1.00 0.00 C ATOM 2817 O LEU B 85 8.432 0.740 -3.436 1.00 0.00 O ATOM 2818 CB LEU B 85 9.918 2.586 -1.647 1.00 0.00 C ATOM 2819 CG LEU B 85 10.401 3.989 -1.278 1.00 0.00 C ATOM 2820 CD1 LEU B 85 9.941 4.358 0.123 1.00 0.00 C ATOM 2821 CD2 LEU B 85 11.917 4.074 -1.384 1.00 0.00 C ATOM 0 H LEU B 85 8.514 0.752 -0.454 1.00 0.00 H new ATOM 0 HA LEU B 85 7.926 3.395 -1.615 1.00 0.00 H new ATOM 0 HB2 LEU B 85 10.309 1.880 -0.915 1.00 0.00 H new ATOM 0 HB3 LEU B 85 10.346 2.314 -2.612 1.00 0.00 H new ATOM 0 HG LEU B 85 9.967 4.701 -1.980 1.00 0.00 H new ATOM 0 HD11 LEU B 85 10.293 5.360 0.370 1.00 0.00 H new ATOM 0 HD12 LEU B 85 8.852 4.336 0.166 1.00 0.00 H new ATOM 0 HD13 LEU B 85 10.347 3.644 0.839 1.00 0.00 H new ATOM 0 HD21 LEU B 85 12.245 5.079 -1.118 1.00 0.00 H new ATOM 0 HD22 LEU B 85 12.370 3.353 -0.704 1.00 0.00 H new ATOM 0 HD23 LEU B 85 12.223 3.851 -2.406 1.00 0.00 H new ATOM 2833 N PHE B 86 7.199 2.582 -3.824 1.00 0.00 N ATOM 2834 CA PHE B 86 6.751 2.144 -5.140 1.00 0.00 C ATOM 2835 C PHE B 86 6.476 3.342 -6.050 1.00 0.00 C ATOM 2836 O PHE B 86 5.720 4.245 -5.690 1.00 0.00 O ATOM 2837 CB PHE B 86 5.498 1.264 -5.008 1.00 0.00 C ATOM 2838 CG PHE B 86 4.200 2.011 -5.164 1.00 0.00 C ATOM 2839 CD1 PHE B 86 3.653 2.209 -6.421 1.00 0.00 C ATOM 2840 CD2 PHE B 86 3.534 2.515 -4.059 1.00 0.00 C ATOM 2841 CE1 PHE B 86 2.463 2.896 -6.574 1.00 0.00 C ATOM 2842 CE2 PHE B 86 2.345 3.203 -4.206 1.00 0.00 C ATOM 2843 CZ PHE B 86 1.809 3.395 -5.465 1.00 0.00 C ATOM 0 H PHE B 86 6.840 3.493 -3.539 1.00 0.00 H new ATOM 0 HA PHE B 86 7.546 1.553 -5.595 1.00 0.00 H new ATOM 0 HB2 PHE B 86 5.542 0.474 -5.758 1.00 0.00 H new ATOM 0 HB3 PHE B 86 5.510 0.778 -4.032 1.00 0.00 H new ATOM 0 HD1 PHE B 86 4.162 1.822 -7.292 1.00 0.00 H new ATOM 0 HD2 PHE B 86 3.948 2.369 -3.072 1.00 0.00 H new ATOM 0 HE1 PHE B 86 2.046 3.042 -7.559 1.00 0.00 H new ATOM 0 HE2 PHE B 86 1.834 3.591 -3.337 1.00 0.00 H new ATOM 0 HZ PHE B 86 0.881 3.934 -5.581 1.00 0.00 H new ATOM 2853 N LYS B 87 7.092 3.343 -7.228 1.00 0.00 N ATOM 2854 CA LYS B 87 6.909 4.429 -8.186 1.00 0.00 C ATOM 2855 C LYS B 87 5.980 4.003 -9.317 1.00 0.00 C ATOM 2856 O LYS B 87 5.888 2.819 -9.645 1.00 0.00 O ATOM 2857 CB LYS B 87 8.257 4.866 -8.760 1.00 0.00 C ATOM 2858 CG LYS B 87 9.393 4.810 -7.754 1.00 0.00 C ATOM 2859 CD LYS B 87 10.719 5.176 -8.396 1.00 0.00 C ATOM 2860 CE LYS B 87 10.711 6.604 -8.916 1.00 0.00 C ATOM 2861 NZ LYS B 87 9.768 6.775 -10.056 1.00 0.00 N ATOM 0 H LYS B 87 7.722 2.605 -7.542 1.00 0.00 H new ATOM 0 HA LYS B 87 6.456 5.270 -7.661 1.00 0.00 H new ATOM 0 HB2 LYS B 87 8.504 4.230 -9.610 1.00 0.00 H new ATOM 0 HB3 LYS B 87 8.168 5.884 -9.139 1.00 0.00 H new ATOM 0 HG2 LYS B 87 9.185 5.492 -6.930 1.00 0.00 H new ATOM 0 HG3 LYS B 87 9.457 3.808 -7.330 1.00 0.00 H new ATOM 0 HD2 LYS B 87 11.522 5.057 -7.668 1.00 0.00 H new ATOM 0 HD3 LYS B 87 10.929 4.490 -9.217 1.00 0.00 H new ATOM 0 HE2 LYS B 87 10.432 7.282 -8.110 1.00 0.00 H new ATOM 0 HE3 LYS B 87 11.717 6.881 -9.232 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 10.176 7.436 -10.747 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 9.604 5.855 -10.512 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 8.865 7.153 -9.706 1.00 0.00 H new ATOM 2875 N SER B 88 5.297 4.973 -9.912 1.00 0.00 N ATOM 2876 CA SER B 88 4.378 4.697 -11.010 1.00 0.00 C ATOM 2877 C SER B 88 4.918 5.259 -12.314 1.00 0.00 C ATOM 2878 O SER B 88 4.186 5.426 -13.289 1.00 0.00 O ATOM 2879 CB SER B 88 3.004 5.291 -10.715 1.00 0.00 C ATOM 2880 OG SER B 88 2.022 4.277 -10.591 1.00 0.00 O ATOM 0 H SER B 88 5.362 5.957 -9.653 1.00 0.00 H new ATOM 0 HA SER B 88 4.281 3.616 -11.110 1.00 0.00 H new ATOM 0 HB2 SER B 88 3.047 5.873 -9.795 1.00 0.00 H new ATOM 0 HB3 SER B 88 2.723 5.977 -11.514 1.00 0.00 H new ATOM 0 HG SER B 88 1.413 4.500 -9.857 1.00 0.00 H new ATOM 2886 N GLY B 89 6.208 5.544 -12.315 1.00 0.00 N ATOM 2887 CA GLY B 89 6.859 6.086 -13.494 1.00 0.00 C ATOM 2888 C GLY B 89 5.917 6.902 -14.357 1.00 0.00 C ATOM 2889 O GLY B 89 5.575 6.439 -15.466 1.00 0.00 O ATOM 2890 OXT GLY B 89 5.522 8.006 -13.925 1.00 0.00 O ATOM 0 H GLY B 89 6.825 5.409 -11.514 1.00 0.00 H new ATOM 0 HA2 GLY B 89 7.697 6.711 -13.187 1.00 0.00 H new ATOM 0 HA3 GLY B 89 7.271 5.268 -14.085 1.00 0.00 H new