USER MOD reduce.3.24.130724 H: found=0, std=0, add=1378, rem=0, adj=55 USER MOD reduce.3.24.130724 removed 1380 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 64 SER OG : rot -95:sc= -0.848! USER MOD Set 1.2: B 75 TYR OH : rot 59:sc= -0.11! USER MOD Set 2.1: B 70 THR OG1 : rot 102:sc= 0 USER MOD Set 2.2: B 87 LYS NZ :NH3+ -99:sc= -6.04! (180deg=-7.12!) USER MOD Set 3.1: B 27 GLN :FLIP amide:sc= 0 F(o=-18!,f=-16) USER MOD Set 3.2: B 32 TYR OH : rot 180:sc= -0.0548 USER MOD Set 3.3: B 41 HIS : no HE2:sc= -16.3! C(o=-16!,f=-24!) USER MOD Set 4.1: B 24 CYS SG : rot 77:sc= 0.757 USER MOD Set 4.2: B 49 LYS NZ :NH3+ -167:sc= -0.0336 (180deg=-0.274) USER MOD Set 4.3: B 50 TYR OH : rot -98:sc= -3.18! USER MOD Set 5.1: B 13 MET CE :methyl -165:sc= -0.5 (180deg=-0.419) USER MOD Set 5.2: B 17 MET CE :methyl 141:sc= -7.18! (180deg=-15.7!) USER MOD Set 6.1: A 67 THR OG1 : rot -160:sc= 0.0638 USER MOD Set 6.2: A 68 HIS : no HD1:sc= -1.98! C(o=-1.9!,f=-5.4!) USER MOD Set 7.1: A 64 SER OG : rot -140:sc= 0.466! USER MOD Set 7.2: A 75 TYR OH : rot 28:sc= 1.03 USER MOD Set 8.1: A 55 HIS : no HD1:sc= -27.5! C(o=-46!,f=-50!) USER MOD Set 8.2: A 88 SER OG : rot -169:sc= 1.57 USER MOD Set 8.3: B 55 HIS : no HE2:sc= -18.7! C(o=-46!,f=-51!) USER MOD Set 8.4: B 88 SER OG : rot -88:sc= -1.14! USER MOD Set 9.1: A 51 ASN : amide:sc= 0 X(o=-0.2,f=-0.35) USER MOD Set 9.2: A 87 LYS NZ :NH3+ -169:sc= -0.2! (180deg=-0.35!) USER MOD Set10.1: A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set10.2: B 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ -111:sc= -0.0735 (180deg=-1.68!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 ASN :FLIP amide:sc= 0.364! C(o=-1.7!,f=0.36!) USER MOD Single : A 13 MET CE :methyl 170:sc= 0 (180deg=-0.0968) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl 153:sc= -3.29! (180deg=-6.7!) USER MOD Single : A 18 GLN :FLIP amide:sc= -8.68! C(o=-16!,f=-8.7!) USER MOD Single : A 19 GLN : amide:sc= 0 K(o=0,f=-0.93) USER MOD Single : A 21 SER OG : rot 93:sc= -2.09! USER MOD Single : A 24 CYS SG : rot -132:sc= -0.124 USER MOD Single : A 26 THR OG1 : rot -7:sc= -1.94! USER MOD Single : A 27 GLN :FLIP amide:sc= -0.0575 F(o=-1.2!,f=-0.057) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= -1.17! C(o=-1.2!,f=-0.99!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 HIS :FLIP no HD1:sc= -15.5! C(o=-17!,f=-16!) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ -159:sc= 0.29 (180deg=-0.141) USER MOD Single : A 50 TYR OH : rot 80:sc= -0.33 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 CYS SG : rot -170:sc= -8.37! USER MOD Single : A 61 ASN :FLIP amide:sc= -2.74! C(o=-6.1!,f=-2.7!) USER MOD Single : A 65 TYR OH : rot 180:sc= -3.58! USER MOD Single : A 70 THR OG1 : rot -110:sc= -1.52 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 HIS :FLIP no HD1:sc= -9.28! C(o=-10!,f=-9.3!) USER MOD Single : A 77 TYR OH : rot 180:sc= -3.3! USER MOD Single : A 80 GLN :FLIP amide:sc= -6.24! C(o=-8!,f=-6.2!) USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 ASN :FLIP amide:sc= -0.104 F(o=-0.99,f=-0.1) USER MOD Single : B 14 SER OG : rot 160:sc= -1.16 USER MOD Single : B 18 GLN :FLIP amide:sc= -4.56! C(o=-11!,f=-4.6!) USER MOD Single : B 19 GLN : amide:sc= -8.68! C(o=-8.7!,f=-15!) USER MOD Single : B 21 SER OG : rot 81:sc= -4.69! USER MOD Single : B 26 THR OG1 : rot 78:sc= 0.492 USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 33 ASN : amide:sc= -0.0136 X(o=-0.014,f=-0.036) USER MOD Single : B 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 LYS NZ :NH3+ -125:sc= -0.777 (180deg=-3.85!) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 LYS NZ :NH3+ 162:sc= -0.0495 (180deg=-0.344) USER MOD Single : B 51 ASN :FLIP amide:sc= -2.29 F(o=-7.7!,f=-2.3) USER MOD Single : B 53 THR OG1 : rot 180:sc= -0.245 USER MOD Single : B 56 CYS SG : rot 0:sc= -12.7! USER MOD Single : B 61 ASN : amide:sc= -0.0836 X(o=-0.084,f=0) USER MOD Single : B 65 TYR OH : rot 30:sc= -0.104 USER MOD Single : B 68 HIS : no HD1:sc= -22.6! C(o=-23!,f=-32!) USER MOD Single : B 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 72 HIS : no HD1:sc= -3.46! C(o=-3.5!,f=-3.5!) USER MOD Single : B 77 TYR OH : rot 54:sc= -1.46! USER MOD Single : B 80 GLN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD ----------------------------------------------------------------- ATOM 67 N LYS A 5 -18.107 6.750 7.945 1.00 0.00 N ATOM 68 CA LYS A 5 -17.492 6.197 9.148 1.00 0.00 C ATOM 69 C LYS A 5 -15.971 6.305 9.095 1.00 0.00 C ATOM 70 O LYS A 5 -15.260 5.463 9.644 1.00 0.00 O ATOM 71 CB LYS A 5 -17.904 4.736 9.326 1.00 0.00 C ATOM 72 CG LYS A 5 -18.191 4.354 10.769 1.00 0.00 C ATOM 73 CD LYS A 5 -17.383 3.139 11.192 1.00 0.00 C ATOM 74 CE LYS A 5 -17.374 2.972 12.702 1.00 0.00 C ATOM 75 NZ LYS A 5 -16.048 2.514 13.202 1.00 0.00 N ATOM 0 HA LYS A 5 -17.843 6.778 10.000 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -18.792 4.542 8.725 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -17.112 4.095 8.940 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -17.957 5.194 11.423 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -19.254 4.145 10.887 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -17.800 2.245 10.729 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -16.360 3.238 10.830 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -17.632 3.920 13.174 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -18.140 2.253 12.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -16.127 1.538 13.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -15.354 2.548 12.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -15.735 3.135 13.975 1.00 0.00 H new ATOM 89 N ALA A 6 -15.480 7.346 8.435 1.00 0.00 N ATOM 90 CA ALA A 6 -14.044 7.565 8.313 1.00 0.00 C ATOM 91 C ALA A 6 -13.664 8.975 8.739 1.00 0.00 C ATOM 92 O ALA A 6 -14.479 9.711 9.298 1.00 0.00 O ATOM 93 CB ALA A 6 -13.588 7.311 6.888 1.00 0.00 C ATOM 0 H ALA A 6 -16.055 8.052 7.976 1.00 0.00 H new ATOM 0 HA ALA A 6 -13.542 6.861 8.977 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -12.514 7.479 6.814 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -13.814 6.281 6.612 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -14.109 7.990 6.213 1.00 0.00 H new ATOM 99 N VAL A 7 -12.420 9.345 8.465 1.00 0.00 N ATOM 100 CA VAL A 7 -11.922 10.667 8.812 1.00 0.00 C ATOM 101 C VAL A 7 -10.888 11.141 7.798 1.00 0.00 C ATOM 102 O VAL A 7 -9.692 11.186 8.093 1.00 0.00 O ATOM 103 CB VAL A 7 -11.291 10.676 10.215 1.00 0.00 C ATOM 104 CG1 VAL A 7 -11.012 12.102 10.665 1.00 0.00 C ATOM 105 CG2 VAL A 7 -12.193 9.960 11.209 1.00 0.00 C ATOM 0 H VAL A 7 -11.737 8.746 8.002 1.00 0.00 H new ATOM 0 HA VAL A 7 -12.776 11.344 8.803 1.00 0.00 H new ATOM 0 HB VAL A 7 -10.342 10.142 10.172 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -10.566 12.089 11.659 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -10.324 12.577 9.965 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -11.946 12.664 10.694 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -11.731 9.976 12.196 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -13.159 10.463 11.252 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -12.336 8.927 10.892 1.00 0.00 H new ATOM 115 N ILE A 8 -11.351 11.492 6.602 1.00 0.00 N ATOM 116 CA ILE A 8 -10.455 11.962 5.554 1.00 0.00 C ATOM 117 C ILE A 8 -9.410 12.911 6.135 1.00 0.00 C ATOM 118 O ILE A 8 -9.727 13.790 6.938 1.00 0.00 O ATOM 119 CB ILE A 8 -11.245 12.644 4.397 1.00 0.00 C ATOM 120 CG1 ILE A 8 -11.372 11.681 3.215 1.00 0.00 C ATOM 121 CG2 ILE A 8 -10.590 13.946 3.937 1.00 0.00 C ATOM 122 CD1 ILE A 8 -12.584 10.779 3.292 1.00 0.00 C ATOM 0 H ILE A 8 -12.335 11.460 6.337 1.00 0.00 H new ATOM 0 HA ILE A 8 -9.941 11.097 5.134 1.00 0.00 H new ATOM 0 HB ILE A 8 -12.234 12.894 4.781 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -11.418 12.258 2.291 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -10.474 11.065 3.162 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -11.177 14.383 3.130 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -10.544 14.645 4.772 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -9.581 13.740 3.581 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -12.607 10.125 2.420 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -12.531 10.175 4.198 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -13.489 11.386 3.314 1.00 0.00 H new ATOM 134 N LYS A 9 -8.165 12.723 5.721 1.00 0.00 N ATOM 135 CA LYS A 9 -7.067 13.557 6.196 1.00 0.00 C ATOM 136 C LYS A 9 -6.503 14.397 5.058 1.00 0.00 C ATOM 137 O LYS A 9 -5.821 15.397 5.285 1.00 0.00 O ATOM 138 CB LYS A 9 -5.964 12.689 6.803 1.00 0.00 C ATOM 139 CG LYS A 9 -6.472 11.692 7.832 1.00 0.00 C ATOM 140 CD LYS A 9 -6.399 12.260 9.240 1.00 0.00 C ATOM 141 CE LYS A 9 -7.660 13.033 9.594 1.00 0.00 C ATOM 142 NZ LYS A 9 -7.419 14.026 10.676 1.00 0.00 N ATOM 0 H LYS A 9 -7.889 12.000 5.057 1.00 0.00 H new ATOM 0 HA LYS A 9 -7.453 14.226 6.965 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -5.458 12.148 6.004 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -5.221 13.335 7.271 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -7.502 11.421 7.601 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -5.882 10.777 7.776 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -6.255 11.449 9.954 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -5.533 12.916 9.325 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -8.032 13.546 8.707 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -8.437 12.336 9.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -8.303 14.531 10.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -7.089 13.535 11.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -6.696 14.707 10.367 1.00 0.00 H new ATOM 156 N ASN A 10 -6.795 13.981 3.832 1.00 0.00 N ATOM 157 CA ASN A 10 -6.327 14.683 2.647 1.00 0.00 C ATOM 158 C ASN A 10 -6.902 14.026 1.402 1.00 0.00 C ATOM 159 O ASN A 10 -7.307 12.866 1.440 1.00 0.00 O ATOM 160 CB ASN A 10 -4.798 14.674 2.593 1.00 0.00 C ATOM 161 CG ASN A 10 -4.202 16.050 2.815 1.00 0.00 C ATOM 162 OD1 ASN A 10 -3.481 16.551 1.818 1.00 0.00 O flip ATOM 163 ND2 ASN A 10 -4.388 16.658 3.869 1.00 0.00 N flip ATOM 0 H ASN A 10 -7.358 13.154 3.633 1.00 0.00 H new ATOM 0 HA ASN A 10 -6.664 15.719 2.691 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -4.415 13.989 3.349 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -4.474 14.293 1.625 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -4.949 16.236 4.609 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -3.981 17.584 4.002 1.00 0.00 H new ATOM 170 N ALA A 11 -6.946 14.762 0.301 1.00 0.00 N ATOM 171 CA ALA A 11 -7.482 14.216 -0.936 1.00 0.00 C ATOM 172 C ALA A 11 -7.685 15.300 -1.989 1.00 0.00 C ATOM 173 O ALA A 11 -8.158 16.395 -1.688 1.00 0.00 O ATOM 174 CB ALA A 11 -8.793 13.496 -0.662 1.00 0.00 C ATOM 0 H ALA A 11 -6.621 15.727 0.239 1.00 0.00 H new ATOM 0 HA ALA A 11 -6.755 13.506 -1.330 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -9.187 13.090 -1.594 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -8.621 12.683 0.044 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -9.512 14.198 -0.239 1.00 0.00 H new ATOM 180 N ASP A 12 -7.333 14.978 -3.229 1.00 0.00 N ATOM 181 CA ASP A 12 -7.483 15.912 -4.336 1.00 0.00 C ATOM 182 C ASP A 12 -8.335 15.298 -5.439 1.00 0.00 C ATOM 183 O ASP A 12 -8.180 15.621 -6.617 1.00 0.00 O ATOM 184 CB ASP A 12 -6.113 16.312 -4.890 1.00 0.00 C ATOM 185 CG ASP A 12 -5.983 17.810 -5.083 1.00 0.00 C ATOM 186 OD1 ASP A 12 -6.356 18.562 -4.159 1.00 0.00 O ATOM 187 OD2 ASP A 12 -5.508 18.230 -6.159 1.00 0.00 O ATOM 0 H ASP A 12 -6.941 14.074 -3.492 1.00 0.00 H new ATOM 0 HA ASP A 12 -7.983 16.806 -3.964 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -5.334 15.967 -4.210 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -5.949 15.810 -5.843 1.00 0.00 H new ATOM 192 N MET A 13 -9.239 14.407 -5.043 1.00 0.00 N ATOM 193 CA MET A 13 -10.126 13.738 -5.987 1.00 0.00 C ATOM 194 C MET A 13 -11.533 14.320 -5.915 1.00 0.00 C ATOM 195 O MET A 13 -11.846 15.104 -5.020 1.00 0.00 O ATOM 196 CB MET A 13 -10.168 12.236 -5.695 1.00 0.00 C ATOM 197 CG MET A 13 -11.279 11.504 -6.430 1.00 0.00 C ATOM 198 SD MET A 13 -10.866 9.783 -6.777 1.00 0.00 S ATOM 199 CE MET A 13 -10.588 9.159 -5.122 1.00 0.00 C ATOM 0 H MET A 13 -9.376 14.131 -4.071 1.00 0.00 H new ATOM 0 HA MET A 13 -9.737 13.898 -6.993 1.00 0.00 H new ATOM 0 HB2 MET A 13 -9.210 11.794 -5.969 1.00 0.00 H new ATOM 0 HB3 MET A 13 -10.293 12.086 -4.623 1.00 0.00 H new ATOM 0 HG2 MET A 13 -12.190 11.542 -5.833 1.00 0.00 H new ATOM 0 HG3 MET A 13 -11.490 12.019 -7.367 1.00 0.00 H new ATOM 0 HE1 MET A 13 -10.498 8.073 -5.153 1.00 0.00 H new ATOM 0 HE2 MET A 13 -9.670 9.588 -4.721 1.00 0.00 H new ATOM 0 HE3 MET A 13 -11.427 9.436 -4.483 1.00 0.00 H new ATOM 209 N SER A 14 -12.380 13.929 -6.862 1.00 0.00 N ATOM 210 CA SER A 14 -13.756 14.411 -6.899 1.00 0.00 C ATOM 211 C SER A 14 -14.469 14.107 -5.586 1.00 0.00 C ATOM 212 O SER A 14 -14.447 12.974 -5.105 1.00 0.00 O ATOM 213 CB SER A 14 -14.511 13.773 -8.066 1.00 0.00 C ATOM 214 OG SER A 14 -15.801 14.340 -8.212 1.00 0.00 O ATOM 0 H SER A 14 -12.138 13.281 -7.612 1.00 0.00 H new ATOM 0 HA SER A 14 -13.736 15.492 -7.040 1.00 0.00 H new ATOM 0 HB2 SER A 14 -13.944 13.909 -8.987 1.00 0.00 H new ATOM 0 HB3 SER A 14 -14.599 12.699 -7.902 1.00 0.00 H new ATOM 0 HG SER A 14 -16.261 13.916 -8.966 1.00 0.00 H new ATOM 220 N GLU A 15 -15.097 15.126 -5.009 1.00 0.00 N ATOM 221 CA GLU A 15 -15.815 14.966 -3.749 1.00 0.00 C ATOM 222 C GLU A 15 -16.504 13.607 -3.685 1.00 0.00 C ATOM 223 O GLU A 15 -16.132 12.748 -2.886 1.00 0.00 O ATOM 224 CB GLU A 15 -16.844 16.085 -3.581 1.00 0.00 C ATOM 225 CG GLU A 15 -16.222 17.456 -3.376 1.00 0.00 C ATOM 226 CD GLU A 15 -16.547 18.048 -2.018 1.00 0.00 C ATOM 227 OE1 GLU A 15 -16.112 17.471 -0.999 1.00 0.00 O ATOM 228 OE2 GLU A 15 -17.235 19.089 -1.973 1.00 0.00 O ATOM 0 H GLU A 15 -15.124 16.071 -5.393 1.00 0.00 H new ATOM 0 HA GLU A 15 -15.092 15.023 -2.935 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -17.485 16.114 -4.462 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -17.484 15.854 -2.729 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -15.140 17.380 -3.485 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -16.574 18.131 -4.156 1.00 0.00 H new ATOM 235 N GLU A 16 -17.510 13.420 -4.533 1.00 0.00 N ATOM 236 CA GLU A 16 -18.249 12.164 -4.574 1.00 0.00 C ATOM 237 C GLU A 16 -17.295 10.976 -4.628 1.00 0.00 C ATOM 238 O GLU A 16 -17.612 9.889 -4.144 1.00 0.00 O ATOM 239 CB GLU A 16 -19.189 12.138 -5.782 1.00 0.00 C ATOM 240 CG GLU A 16 -18.684 12.954 -6.961 1.00 0.00 C ATOM 241 CD GLU A 16 -19.337 12.553 -8.268 1.00 0.00 C ATOM 242 OE1 GLU A 16 -20.532 12.866 -8.456 1.00 0.00 O ATOM 243 OE2 GLU A 16 -18.654 11.926 -9.106 1.00 0.00 O ATOM 0 H GLU A 16 -17.832 14.121 -5.200 1.00 0.00 H new ATOM 0 HA GLU A 16 -18.842 12.089 -3.663 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -19.331 11.105 -6.100 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -20.166 12.516 -5.480 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -18.872 14.011 -6.774 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -17.604 12.833 -7.046 1.00 0.00 H new ATOM 250 N MET A 17 -16.123 11.191 -5.219 1.00 0.00 N ATOM 251 CA MET A 17 -15.119 10.139 -5.333 1.00 0.00 C ATOM 252 C MET A 17 -14.441 9.890 -3.990 1.00 0.00 C ATOM 253 O MET A 17 -14.042 8.767 -3.684 1.00 0.00 O ATOM 254 CB MET A 17 -14.073 10.515 -6.386 1.00 0.00 C ATOM 255 CG MET A 17 -14.459 10.112 -7.799 1.00 0.00 C ATOM 256 SD MET A 17 -13.336 8.891 -8.506 1.00 0.00 S ATOM 257 CE MET A 17 -13.607 7.502 -7.409 1.00 0.00 C ATOM 0 H MET A 17 -15.846 12.084 -5.626 1.00 0.00 H new ATOM 0 HA MET A 17 -15.621 9.222 -5.642 1.00 0.00 H new ATOM 0 HB2 MET A 17 -13.911 11.592 -6.356 1.00 0.00 H new ATOM 0 HB3 MET A 17 -13.125 10.043 -6.129 1.00 0.00 H new ATOM 0 HG2 MET A 17 -15.471 9.708 -7.793 1.00 0.00 H new ATOM 0 HG3 MET A 17 -14.473 10.998 -8.434 1.00 0.00 H new ATOM 0 HE1 MET A 17 -13.396 6.573 -7.939 1.00 0.00 H new ATOM 0 HE2 MET A 17 -12.946 7.586 -6.546 1.00 0.00 H new ATOM 0 HE3 MET A 17 -14.644 7.501 -7.073 1.00 0.00 H new ATOM 267 N GLN A 18 -14.317 10.945 -3.189 1.00 0.00 N ATOM 268 CA GLN A 18 -13.692 10.840 -1.875 1.00 0.00 C ATOM 269 C GLN A 18 -14.610 10.112 -0.902 1.00 0.00 C ATOM 270 O GLN A 18 -14.159 9.305 -0.088 1.00 0.00 O ATOM 271 CB GLN A 18 -13.347 12.228 -1.328 1.00 0.00 C ATOM 272 CG GLN A 18 -13.613 13.357 -2.312 1.00 0.00 C ATOM 273 CD GLN A 18 -12.338 14.022 -2.793 1.00 0.00 C ATOM 274 OE1 GLN A 18 -11.458 13.238 -3.405 1.00 0.00 O flip ATOM 275 NE2 GLN A 18 -12.147 15.225 -2.617 1.00 0.00 N flip ATOM 0 H GLN A 18 -14.641 11.882 -3.428 1.00 0.00 H new ATOM 0 HA GLN A 18 -12.771 10.268 -1.984 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -13.925 12.405 -0.421 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -12.295 12.246 -1.044 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -14.160 12.966 -3.169 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -14.252 14.103 -1.840 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -12.851 15.789 -2.141 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -11.284 15.658 -2.947 1.00 0.00 H new ATOM 284 N GLN A 19 -15.905 10.395 -1.000 1.00 0.00 N ATOM 285 CA GLN A 19 -16.889 9.758 -0.138 1.00 0.00 C ATOM 286 C GLN A 19 -17.164 8.346 -0.628 1.00 0.00 C ATOM 287 O GLN A 19 -17.397 7.434 0.165 1.00 0.00 O ATOM 288 CB GLN A 19 -18.186 10.568 -0.113 1.00 0.00 C ATOM 289 CG GLN A 19 -18.074 11.870 0.663 1.00 0.00 C ATOM 290 CD GLN A 19 -19.354 12.679 0.626 1.00 0.00 C ATOM 291 OE1 GLN A 19 -20.232 12.437 -0.202 1.00 0.00 O ATOM 292 NE2 GLN A 19 -19.467 13.648 1.528 1.00 0.00 N ATOM 0 H GLN A 19 -16.295 11.061 -1.667 1.00 0.00 H new ATOM 0 HA GLN A 19 -16.491 9.715 0.876 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -18.486 10.790 -1.137 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -18.976 9.959 0.326 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -17.816 11.651 1.699 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -17.259 12.466 0.251 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -18.714 13.813 2.196 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -20.307 14.226 1.553 1.00 0.00 H new ATOM 301 N ASP A 20 -17.114 8.170 -1.944 1.00 0.00 N ATOM 302 CA ASP A 20 -17.338 6.868 -2.546 1.00 0.00 C ATOM 303 C ASP A 20 -16.150 5.961 -2.258 1.00 0.00 C ATOM 304 O ASP A 20 -16.306 4.761 -2.031 1.00 0.00 O ATOM 305 CB ASP A 20 -17.548 7.001 -4.056 1.00 0.00 C ATOM 306 CG ASP A 20 -19.014 7.112 -4.428 1.00 0.00 C ATOM 307 OD1 ASP A 20 -19.746 7.856 -3.742 1.00 0.00 O ATOM 308 OD2 ASP A 20 -19.428 6.456 -5.407 1.00 0.00 O ATOM 0 H ASP A 20 -16.920 8.916 -2.612 1.00 0.00 H new ATOM 0 HA ASP A 20 -18.238 6.430 -2.114 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -17.016 7.881 -4.418 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -17.113 6.137 -4.558 1.00 0.00 H new ATOM 313 N SER A 21 -14.959 6.554 -2.254 1.00 0.00 N ATOM 314 CA SER A 21 -13.739 5.812 -1.975 1.00 0.00 C ATOM 315 C SER A 21 -13.767 5.285 -0.548 1.00 0.00 C ATOM 316 O SER A 21 -13.542 4.099 -0.307 1.00 0.00 O ATOM 317 CB SER A 21 -12.510 6.697 -2.186 1.00 0.00 C ATOM 318 OG SER A 21 -12.063 7.252 -0.961 1.00 0.00 O ATOM 0 H SER A 21 -14.816 7.546 -2.441 1.00 0.00 H new ATOM 0 HA SER A 21 -13.679 4.970 -2.665 1.00 0.00 H new ATOM 0 HB2 SER A 21 -11.709 6.111 -2.637 1.00 0.00 H new ATOM 0 HB3 SER A 21 -12.751 7.498 -2.885 1.00 0.00 H new ATOM 0 HG SER A 21 -11.379 6.670 -0.568 1.00 0.00 H new ATOM 324 N VAL A 22 -14.064 6.175 0.394 1.00 0.00 N ATOM 325 CA VAL A 22 -14.142 5.796 1.796 1.00 0.00 C ATOM 326 C VAL A 22 -15.120 4.642 1.979 1.00 0.00 C ATOM 327 O VAL A 22 -14.830 3.672 2.679 1.00 0.00 O ATOM 328 CB VAL A 22 -14.592 6.977 2.675 1.00 0.00 C ATOM 329 CG1 VAL A 22 -14.431 6.636 4.146 1.00 0.00 C ATOM 330 CG2 VAL A 22 -13.813 8.234 2.323 1.00 0.00 C ATOM 0 H VAL A 22 -14.254 7.160 0.210 1.00 0.00 H new ATOM 0 HA VAL A 22 -13.143 5.489 2.106 1.00 0.00 H new ATOM 0 HB VAL A 22 -15.648 7.168 2.482 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -14.754 7.482 4.753 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -15.039 5.764 4.386 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -13.384 6.417 4.356 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -14.146 9.057 2.955 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -12.749 8.060 2.484 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -13.985 8.488 1.277 1.00 0.00 H new ATOM 340 N GLU A 23 -16.278 4.754 1.333 1.00 0.00 N ATOM 341 CA GLU A 23 -17.299 3.718 1.412 1.00 0.00 C ATOM 342 C GLU A 23 -16.726 2.376 0.979 1.00 0.00 C ATOM 343 O GLU A 23 -17.003 1.345 1.592 1.00 0.00 O ATOM 344 CB GLU A 23 -18.501 4.087 0.539 1.00 0.00 C ATOM 345 CG GLU A 23 -19.277 5.289 1.052 1.00 0.00 C ATOM 346 CD GLU A 23 -20.749 5.229 0.694 1.00 0.00 C ATOM 347 OE1 GLU A 23 -21.331 4.126 0.754 1.00 0.00 O ATOM 348 OE2 GLU A 23 -21.323 6.288 0.357 1.00 0.00 O ATOM 0 H GLU A 23 -16.531 5.552 0.750 1.00 0.00 H new ATOM 0 HA GLU A 23 -17.632 3.638 2.447 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -18.155 4.293 -0.474 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -19.172 3.230 0.478 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -19.173 5.349 2.135 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -18.843 6.200 0.639 1.00 0.00 H new ATOM 355 N CYS A 24 -15.916 2.397 -0.075 1.00 0.00 N ATOM 356 CA CYS A 24 -15.294 1.179 -0.577 1.00 0.00 C ATOM 357 C CYS A 24 -14.375 0.587 0.484 1.00 0.00 C ATOM 358 O CYS A 24 -14.333 -0.630 0.685 1.00 0.00 O ATOM 359 CB CYS A 24 -14.504 1.466 -1.855 1.00 0.00 C ATOM 360 SG CYS A 24 -14.435 0.074 -3.005 1.00 0.00 S ATOM 0 H CYS A 24 -15.676 3.241 -0.595 1.00 0.00 H new ATOM 0 HA CYS A 24 -16.079 0.459 -0.810 1.00 0.00 H new ATOM 0 HB2 CYS A 24 -14.951 2.321 -2.362 1.00 0.00 H new ATOM 0 HB3 CYS A 24 -13.487 1.752 -1.585 1.00 0.00 H new ATOM 0 HG CYS A 24 -13.209 -0.103 -3.398 1.00 0.00 H new ATOM 366 N ALA A 25 -13.662 1.462 1.188 1.00 0.00 N ATOM 367 CA ALA A 25 -12.773 1.028 2.249 1.00 0.00 C ATOM 368 C ALA A 25 -13.613 0.507 3.394 1.00 0.00 C ATOM 369 O ALA A 25 -13.222 -0.410 4.115 1.00 0.00 O ATOM 370 CB ALA A 25 -11.881 2.173 2.709 1.00 0.00 C ATOM 0 H ALA A 25 -13.686 2.471 1.040 1.00 0.00 H new ATOM 0 HA ALA A 25 -12.120 0.236 1.882 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -11.223 1.824 3.505 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -11.281 2.526 1.870 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -12.500 2.989 3.081 1.00 0.00 H new ATOM 376 N THR A 26 -14.797 1.092 3.522 1.00 0.00 N ATOM 377 CA THR A 26 -15.741 0.696 4.544 1.00 0.00 C ATOM 378 C THR A 26 -16.306 -0.673 4.209 1.00 0.00 C ATOM 379 O THR A 26 -16.530 -1.502 5.089 1.00 0.00 O ATOM 380 CB THR A 26 -16.870 1.719 4.641 1.00 0.00 C ATOM 381 OG1 THR A 26 -16.418 3.003 4.247 1.00 0.00 O ATOM 382 CG2 THR A 26 -17.440 1.841 6.032 1.00 0.00 C ATOM 0 H THR A 26 -15.123 1.849 2.921 1.00 0.00 H new ATOM 0 HA THR A 26 -15.230 0.649 5.506 1.00 0.00 H new ATOM 0 HB THR A 26 -17.652 1.355 3.974 1.00 0.00 H new ATOM 0 HG1 THR A 26 -15.450 2.977 4.098 1.00 0.00 H new ATOM 0 HG21 THR A 26 -18.238 2.584 6.034 1.00 0.00 H new ATOM 0 HG22 THR A 26 -17.840 0.877 6.347 1.00 0.00 H new ATOM 0 HG23 THR A 26 -16.654 2.150 6.721 1.00 0.00 H new ATOM 390 N GLN A 27 -16.516 -0.908 2.917 1.00 0.00 N ATOM 391 CA GLN A 27 -17.033 -2.184 2.450 1.00 0.00 C ATOM 392 C GLN A 27 -16.083 -3.298 2.863 1.00 0.00 C ATOM 393 O GLN A 27 -16.508 -4.366 3.307 1.00 0.00 O ATOM 394 CB GLN A 27 -17.202 -2.169 0.929 1.00 0.00 C ATOM 395 CG GLN A 27 -18.160 -1.096 0.437 1.00 0.00 C ATOM 396 CD GLN A 27 -18.474 -1.227 -1.041 1.00 0.00 C ATOM 397 OE1 GLN A 27 -18.578 -2.462 -1.517 1.00 0.00 O flip ATOM 398 NE2 GLN A 27 -18.622 -0.229 -1.747 1.00 0.00 N flip ATOM 0 H GLN A 27 -16.335 -0.229 2.177 1.00 0.00 H new ATOM 0 HA GLN A 27 -18.010 -2.358 2.901 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -16.228 -2.016 0.464 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -17.562 -3.144 0.601 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -19.087 -1.152 1.008 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -17.728 -0.114 0.627 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -18.533 0.702 -1.339 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -18.833 -0.333 -2.739 1.00 0.00 H new ATOM 407 N ALA A 28 -14.790 -3.027 2.727 1.00 0.00 N ATOM 408 CA ALA A 28 -13.761 -3.992 3.098 1.00 0.00 C ATOM 409 C ALA A 28 -13.477 -3.928 4.595 1.00 0.00 C ATOM 410 O ALA A 28 -12.981 -4.886 5.187 1.00 0.00 O ATOM 411 CB ALA A 28 -12.490 -3.741 2.301 1.00 0.00 C ATOM 0 H ALA A 28 -14.429 -2.146 2.362 1.00 0.00 H new ATOM 0 HA ALA A 28 -14.125 -4.992 2.864 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -11.731 -4.468 2.588 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -12.703 -3.839 1.236 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -12.124 -2.735 2.506 1.00 0.00 H new ATOM 417 N LEU A 29 -13.799 -2.789 5.204 1.00 0.00 N ATOM 418 CA LEU A 29 -13.585 -2.594 6.632 1.00 0.00 C ATOM 419 C LEU A 29 -14.643 -3.328 7.448 1.00 0.00 C ATOM 420 O LEU A 29 -14.358 -3.858 8.523 1.00 0.00 O ATOM 421 CB LEU A 29 -13.609 -1.107 6.972 1.00 0.00 C ATOM 422 CG LEU A 29 -12.307 -0.371 6.675 1.00 0.00 C ATOM 423 CD1 LEU A 29 -12.595 1.044 6.214 1.00 0.00 C ATOM 424 CD2 LEU A 29 -11.406 -0.364 7.899 1.00 0.00 C ATOM 0 H LEU A 29 -14.210 -1.986 4.727 1.00 0.00 H new ATOM 0 HA LEU A 29 -12.607 -3.004 6.885 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -14.416 -0.632 6.414 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -13.843 -0.993 8.030 1.00 0.00 H new ATOM 0 HG LEU A 29 -11.787 -0.896 5.873 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -11.656 1.557 6.006 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -13.201 1.015 5.309 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -13.135 1.579 6.996 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -10.482 0.166 7.668 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -11.915 0.137 8.723 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -11.174 -1.390 8.186 1.00 0.00 H new ATOM 436 N GLU A 30 -15.866 -3.353 6.929 1.00 0.00 N ATOM 437 CA GLU A 30 -16.972 -4.019 7.604 1.00 0.00 C ATOM 438 C GLU A 30 -17.056 -5.485 7.191 1.00 0.00 C ATOM 439 O GLU A 30 -17.495 -6.334 7.967 1.00 0.00 O ATOM 440 CB GLU A 30 -18.290 -3.307 7.290 1.00 0.00 C ATOM 441 CG GLU A 30 -18.828 -2.484 8.449 1.00 0.00 C ATOM 442 CD GLU A 30 -20.117 -1.764 8.104 1.00 0.00 C ATOM 443 OE1 GLU A 30 -20.997 -2.391 7.477 1.00 0.00 O ATOM 444 OE2 GLU A 30 -20.247 -0.575 8.461 1.00 0.00 O ATOM 0 H GLU A 30 -16.116 -2.918 6.041 1.00 0.00 H new ATOM 0 HA GLU A 30 -16.792 -3.975 8.678 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -18.145 -2.655 6.429 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -19.036 -4.049 7.006 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -18.999 -3.137 9.305 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -18.077 -1.753 8.750 1.00 0.00 H new ATOM 451 N LYS A 31 -16.628 -5.776 5.968 1.00 0.00 N ATOM 452 CA LYS A 31 -16.650 -7.141 5.456 1.00 0.00 C ATOM 453 C LYS A 31 -15.413 -7.905 5.912 1.00 0.00 C ATOM 454 O LYS A 31 -15.401 -9.135 5.933 1.00 0.00 O ATOM 455 CB LYS A 31 -16.733 -7.134 3.929 1.00 0.00 C ATOM 456 CG LYS A 31 -18.153 -7.233 3.399 1.00 0.00 C ATOM 457 CD LYS A 31 -18.342 -6.384 2.153 1.00 0.00 C ATOM 458 CE LYS A 31 -19.784 -6.410 1.673 1.00 0.00 C ATOM 459 NZ LYS A 31 -20.006 -5.469 0.541 1.00 0.00 N ATOM 0 H LYS A 31 -16.262 -5.085 5.313 1.00 0.00 H new ATOM 0 HA LYS A 31 -17.532 -7.643 5.853 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -16.276 -6.219 3.552 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -16.149 -7.967 3.537 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -18.386 -8.273 3.171 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -18.854 -6.911 4.170 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -18.046 -5.356 2.364 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -17.687 -6.748 1.361 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -20.045 -7.421 1.362 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -20.447 -6.149 2.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -21.001 -5.515 0.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -19.781 -4.500 0.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -19.392 -5.733 -0.256 1.00 0.00 H new ATOM 473 N TYR A 32 -14.375 -7.162 6.282 1.00 0.00 N ATOM 474 CA TYR A 32 -13.129 -7.759 6.746 1.00 0.00 C ATOM 475 C TYR A 32 -12.481 -6.885 7.815 1.00 0.00 C ATOM 476 O TYR A 32 -13.069 -5.905 8.270 1.00 0.00 O ATOM 477 CB TYR A 32 -12.162 -7.954 5.576 1.00 0.00 C ATOM 478 CG TYR A 32 -12.851 -8.164 4.247 1.00 0.00 C ATOM 479 CD1 TYR A 32 -13.562 -7.136 3.644 1.00 0.00 C ATOM 480 CD2 TYR A 32 -12.788 -9.390 3.596 1.00 0.00 C ATOM 481 CE1 TYR A 32 -14.192 -7.321 2.429 1.00 0.00 C ATOM 482 CE2 TYR A 32 -13.416 -9.583 2.380 1.00 0.00 C ATOM 483 CZ TYR A 32 -14.117 -8.546 1.802 1.00 0.00 C ATOM 484 OH TYR A 32 -14.744 -8.735 0.592 1.00 0.00 O ATOM 0 H TYR A 32 -14.373 -6.142 6.269 1.00 0.00 H new ATOM 0 HA TYR A 32 -13.359 -8.732 7.181 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -11.512 -7.082 5.504 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -11.523 -8.812 5.784 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -13.624 -6.175 4.133 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -12.240 -10.204 4.047 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -14.740 -6.510 1.973 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -13.358 -10.541 1.885 1.00 0.00 H new ATOM 0 HH TYR A 32 -14.593 -9.653 0.285 1.00 0.00 H new ATOM 494 N ASN A 33 -11.264 -7.244 8.206 1.00 0.00 N ATOM 495 CA ASN A 33 -10.532 -6.491 9.215 1.00 0.00 C ATOM 496 C ASN A 33 -9.032 -6.714 9.065 1.00 0.00 C ATOM 497 O ASN A 33 -8.274 -6.614 10.031 1.00 0.00 O ATOM 498 CB ASN A 33 -10.990 -6.891 10.619 1.00 0.00 C ATOM 499 CG ASN A 33 -12.237 -7.752 10.594 1.00 0.00 C ATOM 500 OD1 ASN A 33 -13.342 -7.271 10.842 1.00 0.00 O ATOM 501 ND2 ASN A 33 -12.064 -9.034 10.293 1.00 0.00 N ATOM 0 H ASN A 33 -10.763 -8.053 7.839 1.00 0.00 H new ATOM 0 HA ASN A 33 -10.741 -5.431 9.070 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -10.187 -7.432 11.120 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -11.183 -5.993 11.205 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -12.866 -9.663 10.261 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -11.129 -9.390 10.094 1.00 0.00 H new ATOM 508 N ILE A 34 -8.616 -7.011 7.841 1.00 0.00 N ATOM 509 CA ILE A 34 -7.211 -7.246 7.541 1.00 0.00 C ATOM 510 C ILE A 34 -6.670 -6.169 6.609 1.00 0.00 C ATOM 511 O ILE A 34 -6.962 -6.173 5.414 1.00 0.00 O ATOM 512 CB ILE A 34 -7.001 -8.625 6.888 1.00 0.00 C ATOM 513 CG1 ILE A 34 -7.779 -9.698 7.645 1.00 0.00 C ATOM 514 CG2 ILE A 34 -5.520 -8.971 6.840 1.00 0.00 C ATOM 515 CD1 ILE A 34 -7.466 -9.731 9.120 1.00 0.00 C ATOM 0 H ILE A 34 -9.236 -7.095 7.036 1.00 0.00 H new ATOM 0 HA ILE A 34 -6.671 -7.215 8.487 1.00 0.00 H new ATOM 0 HB ILE A 34 -7.377 -8.585 5.866 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -8.847 -9.526 7.511 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -7.556 -10.673 7.211 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -5.390 -9.948 6.376 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.989 -8.218 6.257 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -5.119 -8.994 7.853 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -8.052 -10.515 9.599 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -6.404 -9.933 9.262 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -7.715 -8.768 9.566 1.00 0.00 H new ATOM 527 N GLU A 35 -5.889 -5.248 7.166 1.00 0.00 N ATOM 528 CA GLU A 35 -5.309 -4.155 6.388 1.00 0.00 C ATOM 529 C GLU A 35 -5.170 -4.532 4.917 1.00 0.00 C ATOM 530 O GLU A 35 -5.965 -4.105 4.079 1.00 0.00 O ATOM 531 CB GLU A 35 -3.943 -3.769 6.958 1.00 0.00 C ATOM 532 CG GLU A 35 -3.932 -3.632 8.472 1.00 0.00 C ATOM 533 CD GLU A 35 -3.129 -4.725 9.149 1.00 0.00 C ATOM 534 OE1 GLU A 35 -2.637 -5.627 8.440 1.00 0.00 O ATOM 535 OE2 GLU A 35 -2.992 -4.678 10.389 1.00 0.00 O ATOM 0 H GLU A 35 -5.642 -5.236 8.156 1.00 0.00 H new ATOM 0 HA GLU A 35 -5.984 -3.302 6.457 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -3.210 -4.521 6.664 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -3.627 -2.825 6.514 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -3.518 -2.661 8.742 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -4.957 -3.656 8.843 1.00 0.00 H new ATOM 542 N LYS A 36 -4.159 -5.334 4.608 1.00 0.00 N ATOM 543 CA LYS A 36 -3.917 -5.766 3.238 1.00 0.00 C ATOM 544 C LYS A 36 -5.210 -6.228 2.568 1.00 0.00 C ATOM 545 O LYS A 36 -5.488 -5.872 1.423 1.00 0.00 O ATOM 546 CB LYS A 36 -2.887 -6.897 3.216 1.00 0.00 C ATOM 547 CG LYS A 36 -2.064 -6.992 4.490 1.00 0.00 C ATOM 548 CD LYS A 36 -1.978 -8.423 4.990 1.00 0.00 C ATOM 549 CE LYS A 36 -0.725 -8.648 5.821 1.00 0.00 C ATOM 550 NZ LYS A 36 -0.952 -9.635 6.910 1.00 0.00 N ATOM 0 H LYS A 36 -3.493 -5.699 5.289 1.00 0.00 H new ATOM 0 HA LYS A 36 -3.529 -4.914 2.680 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -3.402 -7.844 3.054 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -2.216 -6.750 2.370 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -1.060 -6.609 4.306 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -2.509 -6.362 5.260 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -2.859 -8.654 5.588 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -1.981 -9.107 4.141 1.00 0.00 H new ATOM 0 HE2 LYS A 36 0.081 -8.998 5.176 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -0.400 -7.701 6.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -0.074 -9.760 7.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -1.703 -9.289 7.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -1.238 -10.546 6.498 1.00 0.00 H new ATOM 564 N ASP A 37 -5.996 -7.026 3.289 1.00 0.00 N ATOM 565 CA ASP A 37 -7.259 -7.537 2.764 1.00 0.00 C ATOM 566 C ASP A 37 -8.185 -6.393 2.362 1.00 0.00 C ATOM 567 O ASP A 37 -8.577 -6.275 1.201 1.00 0.00 O ATOM 568 CB ASP A 37 -7.941 -8.428 3.803 1.00 0.00 C ATOM 569 CG ASP A 37 -8.305 -9.791 3.249 1.00 0.00 C ATOM 570 OD1 ASP A 37 -7.464 -10.712 3.336 1.00 0.00 O ATOM 571 OD2 ASP A 37 -9.429 -9.939 2.727 1.00 0.00 O ATOM 0 H ASP A 37 -5.780 -7.332 4.238 1.00 0.00 H new ATOM 0 HA ASP A 37 -7.044 -8.130 1.875 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -7.280 -8.553 4.660 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -8.843 -7.934 4.165 1.00 0.00 H new ATOM 576 N ILE A 38 -8.529 -5.550 3.331 1.00 0.00 N ATOM 577 CA ILE A 38 -9.406 -4.413 3.079 1.00 0.00 C ATOM 578 C ILE A 38 -8.903 -3.586 1.901 1.00 0.00 C ATOM 579 O ILE A 38 -9.634 -3.345 0.941 1.00 0.00 O ATOM 580 CB ILE A 38 -9.519 -3.508 4.321 1.00 0.00 C ATOM 581 CG1 ILE A 38 -9.896 -4.334 5.552 1.00 0.00 C ATOM 582 CG2 ILE A 38 -10.541 -2.407 4.083 1.00 0.00 C ATOM 583 CD1 ILE A 38 -9.122 -3.956 6.796 1.00 0.00 C ATOM 0 H ILE A 38 -8.214 -5.633 4.297 1.00 0.00 H new ATOM 0 HA ILE A 38 -10.391 -4.815 2.842 1.00 0.00 H new ATOM 0 HB ILE A 38 -8.549 -3.045 4.502 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -10.962 -4.214 5.747 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -9.728 -5.389 5.336 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -10.609 -1.776 4.969 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -10.232 -1.802 3.230 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.515 -2.852 3.879 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -9.442 -4.583 7.628 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -8.056 -4.103 6.620 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -9.309 -2.910 7.037 1.00 0.00 H new ATOM 595 N ALA A 39 -7.648 -3.155 1.981 1.00 0.00 N ATOM 596 CA ALA A 39 -7.045 -2.354 0.922 1.00 0.00 C ATOM 597 C ALA A 39 -7.175 -3.048 -0.432 1.00 0.00 C ATOM 598 O ALA A 39 -7.427 -2.403 -1.448 1.00 0.00 O ATOM 599 CB ALA A 39 -5.582 -2.076 1.235 1.00 0.00 C ATOM 0 H ALA A 39 -7.029 -3.347 2.769 1.00 0.00 H new ATOM 0 HA ALA A 39 -7.580 -1.406 0.870 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.146 -1.477 0.435 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.508 -1.532 2.177 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -5.042 -3.019 1.318 1.00 0.00 H new ATOM 605 N ALA A 40 -7.001 -4.366 -0.435 1.00 0.00 N ATOM 606 CA ALA A 40 -7.098 -5.148 -1.663 1.00 0.00 C ATOM 607 C ALA A 40 -8.441 -4.930 -2.348 1.00 0.00 C ATOM 608 O ALA A 40 -8.504 -4.422 -3.467 1.00 0.00 O ATOM 609 CB ALA A 40 -6.894 -6.625 -1.363 1.00 0.00 C ATOM 0 H ALA A 40 -6.792 -4.915 0.399 1.00 0.00 H new ATOM 0 HA ALA A 40 -6.314 -4.812 -2.341 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -6.969 -7.198 -2.287 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -5.908 -6.774 -0.922 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -7.659 -6.963 -0.664 1.00 0.00 H new ATOM 615 N HIS A 41 -9.514 -5.319 -1.668 1.00 0.00 N ATOM 616 CA HIS A 41 -10.858 -5.168 -2.211 1.00 0.00 C ATOM 617 C HIS A 41 -11.121 -3.721 -2.612 1.00 0.00 C ATOM 618 O HIS A 41 -11.586 -3.446 -3.718 1.00 0.00 O ATOM 619 CB HIS A 41 -11.898 -5.624 -1.185 1.00 0.00 C ATOM 620 CG HIS A 41 -11.363 -6.608 -0.190 1.00 0.00 C ATOM 621 ND1 HIS A 41 -10.375 -7.528 -0.294 1.00 0.00 N flip ATOM 622 CD2 HIS A 41 -11.854 -6.721 1.094 1.00 0.00 C flip ATOM 623 CE1 HIS A 41 -10.287 -8.172 0.915 1.00 0.00 C flip ATOM 624 NE2 HIS A 41 -11.190 -7.667 1.735 1.00 0.00 N flip ATOM 0 H HIS A 41 -9.479 -5.741 -0.740 1.00 0.00 H new ATOM 0 HA HIS A 41 -10.938 -5.793 -3.101 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -12.279 -4.752 -0.653 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -12.742 -6.072 -1.709 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -12.656 -6.129 1.510 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -9.592 -8.963 1.156 1.00 0.00 H new ATOM 0 HE2 HIS A 41 -11.348 -7.958 2.700 1.00 0.00 H new ATOM 633 N ILE A 42 -10.816 -2.800 -1.706 1.00 0.00 N ATOM 634 CA ILE A 42 -11.014 -1.380 -1.961 1.00 0.00 C ATOM 635 C ILE A 42 -10.528 -1.000 -3.355 1.00 0.00 C ATOM 636 O ILE A 42 -11.297 -0.503 -4.177 1.00 0.00 O ATOM 637 CB ILE A 42 -10.280 -0.514 -0.919 1.00 0.00 C ATOM 638 CG1 ILE A 42 -10.799 -0.822 0.486 1.00 0.00 C ATOM 639 CG2 ILE A 42 -10.447 0.962 -1.240 1.00 0.00 C ATOM 640 CD1 ILE A 42 -10.078 -0.061 1.576 1.00 0.00 C ATOM 0 H ILE A 42 -10.430 -3.013 -0.786 1.00 0.00 H new ATOM 0 HA ILE A 42 -12.085 -1.192 -1.888 1.00 0.00 H new ATOM 0 HB ILE A 42 -9.217 -0.753 -0.955 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -11.862 -0.586 0.532 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -10.701 -1.891 0.675 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -9.922 1.558 -0.494 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -10.033 1.169 -2.227 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -11.506 1.219 -1.230 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -10.498 -0.329 2.546 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -9.018 -0.315 1.557 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -10.197 1.010 1.412 1.00 0.00 H new ATOM 652 N LYS A 43 -9.247 -1.242 -3.617 1.00 0.00 N ATOM 653 CA LYS A 43 -8.663 -0.926 -4.915 1.00 0.00 C ATOM 654 C LYS A 43 -9.370 -1.695 -6.025 1.00 0.00 C ATOM 655 O LYS A 43 -9.964 -1.102 -6.923 1.00 0.00 O ATOM 656 CB LYS A 43 -7.169 -1.253 -4.922 1.00 0.00 C ATOM 657 CG LYS A 43 -6.523 -1.113 -6.291 1.00 0.00 C ATOM 658 CD LYS A 43 -6.583 -2.416 -7.072 1.00 0.00 C ATOM 659 CE LYS A 43 -5.206 -3.046 -7.208 1.00 0.00 C ATOM 660 NZ LYS A 43 -4.970 -3.578 -8.579 1.00 0.00 N ATOM 0 H LYS A 43 -8.596 -1.655 -2.949 1.00 0.00 H new ATOM 0 HA LYS A 43 -8.791 0.141 -5.095 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -6.658 -0.595 -4.219 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -7.027 -2.273 -4.565 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -7.027 -0.327 -6.853 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -5.484 -0.805 -6.174 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -7.255 -3.112 -6.570 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -6.999 -2.229 -8.062 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -4.443 -2.305 -6.970 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -5.103 -3.853 -6.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -4.020 -3.999 -8.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -5.682 -4.304 -8.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -5.042 -2.803 -9.269 1.00 0.00 H new ATOM 674 N LYS A 44 -9.303 -3.021 -5.954 1.00 0.00 N ATOM 675 CA LYS A 44 -9.938 -3.874 -6.951 1.00 0.00 C ATOM 676 C LYS A 44 -11.263 -3.280 -7.414 1.00 0.00 C ATOM 677 O LYS A 44 -11.412 -2.883 -8.570 1.00 0.00 O ATOM 678 CB LYS A 44 -10.167 -5.274 -6.380 1.00 0.00 C ATOM 679 CG LYS A 44 -9.072 -6.262 -6.739 1.00 0.00 C ATOM 680 CD LYS A 44 -9.086 -7.470 -5.816 1.00 0.00 C ATOM 681 CE LYS A 44 -9.036 -8.770 -6.602 1.00 0.00 C ATOM 682 NZ LYS A 44 -9.323 -9.952 -5.742 1.00 0.00 N ATOM 0 H LYS A 44 -8.815 -3.528 -5.216 1.00 0.00 H new ATOM 0 HA LYS A 44 -9.272 -3.942 -7.811 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -10.243 -5.207 -5.295 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -11.122 -5.654 -6.744 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -9.200 -6.590 -7.771 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -8.102 -5.769 -6.680 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -8.235 -7.421 -5.137 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -9.986 -7.449 -5.201 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -9.759 -8.730 -7.416 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -8.051 -8.882 -7.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -9.279 -10.818 -6.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -8.618 -10.006 -4.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -10.273 -9.858 -5.329 1.00 0.00 H new ATOM 696 N GLU A 45 -12.224 -3.222 -6.503 1.00 0.00 N ATOM 697 CA GLU A 45 -13.539 -2.679 -6.816 1.00 0.00 C ATOM 698 C GLU A 45 -13.418 -1.328 -7.516 1.00 0.00 C ATOM 699 O GLU A 45 -14.128 -1.052 -8.483 1.00 0.00 O ATOM 700 CB GLU A 45 -14.372 -2.536 -5.542 1.00 0.00 C ATOM 701 CG GLU A 45 -14.762 -3.866 -4.918 1.00 0.00 C ATOM 702 CD GLU A 45 -16.236 -4.178 -5.085 1.00 0.00 C ATOM 703 OE1 GLU A 45 -17.070 -3.348 -4.666 1.00 0.00 O ATOM 704 OE2 GLU A 45 -16.557 -5.255 -5.632 1.00 0.00 O ATOM 0 H GLU A 45 -12.118 -3.544 -5.541 1.00 0.00 H new ATOM 0 HA GLU A 45 -14.040 -3.373 -7.491 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -13.809 -1.953 -4.813 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -15.276 -1.972 -5.771 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -14.172 -4.663 -5.371 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -14.515 -3.851 -3.856 1.00 0.00 H new ATOM 711 N PHE A 46 -12.513 -0.491 -7.020 1.00 0.00 N ATOM 712 CA PHE A 46 -12.298 0.831 -7.594 1.00 0.00 C ATOM 713 C PHE A 46 -11.827 0.733 -9.041 1.00 0.00 C ATOM 714 O PHE A 46 -12.283 1.482 -9.905 1.00 0.00 O ATOM 715 CB PHE A 46 -11.273 1.607 -6.767 1.00 0.00 C ATOM 716 CG PHE A 46 -11.856 2.780 -6.036 1.00 0.00 C ATOM 717 CD1 PHE A 46 -12.543 2.600 -4.847 1.00 0.00 C ATOM 718 CD2 PHE A 46 -11.714 4.063 -6.536 1.00 0.00 C ATOM 719 CE1 PHE A 46 -13.078 3.678 -4.171 1.00 0.00 C ATOM 720 CE2 PHE A 46 -12.246 5.147 -5.864 1.00 0.00 C ATOM 721 CZ PHE A 46 -12.930 4.954 -4.680 1.00 0.00 C ATOM 0 H PHE A 46 -11.916 -0.706 -6.221 1.00 0.00 H new ATOM 0 HA PHE A 46 -13.250 1.362 -7.578 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -10.814 0.931 -6.045 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -10.478 1.958 -7.425 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -12.661 1.605 -4.444 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -11.181 4.219 -7.462 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -13.612 3.524 -3.245 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -12.127 6.143 -6.264 1.00 0.00 H new ATOM 0 HZ PHE A 46 -13.348 5.799 -4.153 1.00 0.00 H new ATOM 731 N ASP A 47 -10.911 -0.195 -9.298 1.00 0.00 N ATOM 732 CA ASP A 47 -10.377 -0.389 -10.640 1.00 0.00 C ATOM 733 C ASP A 47 -11.463 -0.885 -11.590 1.00 0.00 C ATOM 734 O ASP A 47 -11.369 -0.702 -12.805 1.00 0.00 O ATOM 735 CB ASP A 47 -9.203 -1.375 -10.607 1.00 0.00 C ATOM 736 CG ASP A 47 -9.558 -2.738 -11.175 1.00 0.00 C ATOM 737 OD1 ASP A 47 -10.327 -3.471 -10.521 1.00 0.00 O ATOM 738 OD2 ASP A 47 -9.064 -3.070 -12.273 1.00 0.00 O ATOM 0 H ASP A 47 -10.524 -0.824 -8.595 1.00 0.00 H new ATOM 0 HA ASP A 47 -10.017 0.572 -11.008 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -8.369 -0.958 -11.172 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -8.864 -1.493 -9.578 1.00 0.00 H new ATOM 743 N LYS A 48 -12.490 -1.516 -11.032 1.00 0.00 N ATOM 744 CA LYS A 48 -13.588 -2.041 -11.835 1.00 0.00 C ATOM 745 C LYS A 48 -14.900 -1.322 -11.526 1.00 0.00 C ATOM 746 O LYS A 48 -15.964 -1.740 -11.982 1.00 0.00 O ATOM 747 CB LYS A 48 -13.751 -3.542 -11.593 1.00 0.00 C ATOM 748 CG LYS A 48 -12.947 -4.404 -12.553 1.00 0.00 C ATOM 749 CD LYS A 48 -13.512 -4.341 -13.963 1.00 0.00 C ATOM 750 CE LYS A 48 -14.808 -5.126 -14.080 1.00 0.00 C ATOM 751 NZ LYS A 48 -14.642 -6.351 -14.909 1.00 0.00 N ATOM 0 H LYS A 48 -12.585 -1.676 -10.029 1.00 0.00 H new ATOM 0 HA LYS A 48 -13.344 -1.867 -12.883 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -13.449 -3.772 -10.571 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -14.806 -3.803 -11.680 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -11.909 -4.071 -12.560 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -12.948 -5.437 -12.205 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -13.689 -3.301 -14.239 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -12.781 -4.738 -14.667 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -15.154 -5.405 -13.085 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -15.578 -4.492 -14.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -15.548 -6.858 -14.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.336 -6.084 -15.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -13.926 -6.968 -14.476 1.00 0.00 H new ATOM 765 N LYS A 49 -14.824 -0.246 -10.749 1.00 0.00 N ATOM 766 CA LYS A 49 -16.017 0.512 -10.387 1.00 0.00 C ATOM 767 C LYS A 49 -15.950 1.948 -10.902 1.00 0.00 C ATOM 768 O LYS A 49 -16.885 2.725 -10.711 1.00 0.00 O ATOM 769 CB LYS A 49 -16.204 0.517 -8.869 1.00 0.00 C ATOM 770 CG LYS A 49 -17.649 0.694 -8.435 1.00 0.00 C ATOM 771 CD LYS A 49 -17.749 1.474 -7.135 1.00 0.00 C ATOM 772 CE LYS A 49 -19.053 2.252 -7.051 1.00 0.00 C ATOM 773 NZ LYS A 49 -19.146 3.294 -8.110 1.00 0.00 N ATOM 0 H LYS A 49 -13.955 0.119 -10.360 1.00 0.00 H new ATOM 0 HA LYS A 49 -16.870 0.023 -10.857 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -15.823 -0.419 -8.461 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -15.604 1.319 -8.440 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -18.203 1.214 -9.216 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -18.115 -0.284 -8.311 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -17.679 0.788 -6.291 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -16.908 2.162 -7.057 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -19.893 1.564 -7.144 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -19.133 2.722 -6.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -19.838 4.017 -7.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -18.215 3.739 -8.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -19.450 2.856 -9.003 1.00 0.00 H new ATOM 787 N TYR A 50 -14.845 2.300 -11.553 1.00 0.00 N ATOM 788 CA TYR A 50 -14.679 3.649 -12.082 1.00 0.00 C ATOM 789 C TYR A 50 -13.791 3.654 -13.324 1.00 0.00 C ATOM 790 O TYR A 50 -14.230 4.025 -14.411 1.00 0.00 O ATOM 791 CB TYR A 50 -14.084 4.566 -11.012 1.00 0.00 C ATOM 792 CG TYR A 50 -14.751 4.432 -9.662 1.00 0.00 C ATOM 793 CD1 TYR A 50 -14.436 3.381 -8.809 1.00 0.00 C ATOM 794 CD2 TYR A 50 -15.694 5.360 -9.237 1.00 0.00 C ATOM 795 CE1 TYR A 50 -15.043 3.257 -7.573 1.00 0.00 C ATOM 796 CE2 TYR A 50 -16.305 5.243 -8.003 1.00 0.00 C ATOM 797 CZ TYR A 50 -15.977 4.191 -7.175 1.00 0.00 C ATOM 798 OH TYR A 50 -16.584 4.071 -5.946 1.00 0.00 O ATOM 0 H TYR A 50 -14.057 1.675 -11.726 1.00 0.00 H new ATOM 0 HA TYR A 50 -15.664 4.019 -12.368 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -13.022 4.346 -10.907 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -14.164 5.600 -11.346 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -13.704 2.649 -9.117 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -15.954 6.186 -9.882 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -14.787 2.434 -6.923 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -17.036 5.973 -7.689 1.00 0.00 H new ATOM 0 HH TYR A 50 -15.983 4.409 -5.250 1.00 0.00 H new ATOM 808 N ASN A 51 -12.539 3.247 -13.150 1.00 0.00 N ATOM 809 CA ASN A 51 -11.584 3.209 -14.250 1.00 0.00 C ATOM 810 C ASN A 51 -10.162 3.071 -13.712 1.00 0.00 C ATOM 811 O ASN A 51 -9.664 3.960 -13.024 1.00 0.00 O ATOM 812 CB ASN A 51 -11.702 4.474 -15.102 1.00 0.00 C ATOM 813 CG ASN A 51 -10.904 4.383 -16.388 1.00 0.00 C ATOM 814 OD1 ASN A 51 -9.796 4.909 -16.483 1.00 0.00 O ATOM 815 ND2 ASN A 51 -11.467 3.712 -17.387 1.00 0.00 N ATOM 0 H ASN A 51 -12.161 2.938 -12.254 1.00 0.00 H new ATOM 0 HA ASN A 51 -11.810 2.344 -14.874 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -12.751 4.651 -15.340 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -11.357 5.331 -14.524 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -10.978 3.617 -18.277 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -12.388 3.292 -17.264 1.00 0.00 H new ATOM 822 N PRO A 52 -9.489 1.945 -14.012 1.00 0.00 N ATOM 823 CA PRO A 52 -8.122 1.700 -13.543 1.00 0.00 C ATOM 824 C PRO A 52 -7.133 2.759 -14.035 1.00 0.00 C ATOM 825 O PRO A 52 -7.466 3.565 -14.903 1.00 0.00 O ATOM 826 CB PRO A 52 -7.773 0.325 -14.126 1.00 0.00 C ATOM 827 CG PRO A 52 -8.747 0.112 -15.233 1.00 0.00 C ATOM 828 CD PRO A 52 -10.001 0.826 -14.820 1.00 0.00 C ATOM 0 HA PRO A 52 -8.059 1.740 -12.456 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -6.747 0.302 -14.494 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -7.858 -0.456 -13.371 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -8.363 0.509 -16.173 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -8.935 -0.950 -15.389 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -10.569 1.176 -15.682 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -10.663 0.180 -14.243 1.00 0.00 H new ATOM 836 N THR A 53 -5.910 2.763 -13.482 1.00 0.00 N ATOM 837 CA THR A 53 -5.505 1.809 -12.450 1.00 0.00 C ATOM 838 C THR A 53 -5.544 2.467 -11.078 1.00 0.00 C ATOM 839 O THR A 53 -5.129 3.614 -10.917 1.00 0.00 O ATOM 840 CB THR A 53 -4.105 1.266 -12.750 1.00 0.00 C ATOM 841 OG1 THR A 53 -4.166 0.235 -13.719 1.00 0.00 O ATOM 842 CG2 THR A 53 -3.397 0.706 -11.533 1.00 0.00 C ATOM 0 H THR A 53 -5.180 3.427 -13.740 1.00 0.00 H new ATOM 0 HA THR A 53 -6.205 0.974 -12.450 1.00 0.00 H new ATOM 0 HB THR A 53 -3.539 2.124 -13.114 1.00 0.00 H new ATOM 0 HG1 THR A 53 -3.262 -0.098 -13.899 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.412 0.340 -11.822 1.00 0.00 H new ATOM 0 HG22 THR A 53 -3.288 1.489 -10.783 1.00 0.00 H new ATOM 0 HG23 THR A 53 -3.982 -0.115 -11.118 1.00 0.00 H new ATOM 850 N TRP A 54 -6.061 1.740 -10.094 1.00 0.00 N ATOM 851 CA TRP A 54 -6.169 2.269 -8.743 1.00 0.00 C ATOM 852 C TRP A 54 -5.141 1.655 -7.806 1.00 0.00 C ATOM 853 O TRP A 54 -4.861 0.458 -7.854 1.00 0.00 O ATOM 854 CB TRP A 54 -7.577 2.041 -8.198 1.00 0.00 C ATOM 855 CG TRP A 54 -8.620 2.777 -8.974 1.00 0.00 C ATOM 856 CD1 TRP A 54 -9.181 2.392 -10.153 1.00 0.00 C ATOM 857 CD2 TRP A 54 -9.217 4.034 -8.635 1.00 0.00 C ATOM 858 NE1 TRP A 54 -10.088 3.329 -10.571 1.00 0.00 N ATOM 859 CE2 TRP A 54 -10.135 4.346 -9.655 1.00 0.00 C ATOM 860 CE3 TRP A 54 -9.069 4.925 -7.568 1.00 0.00 C ATOM 861 CZ2 TRP A 54 -10.899 5.510 -9.641 1.00 0.00 C ATOM 862 CZ3 TRP A 54 -9.827 6.081 -7.556 1.00 0.00 C ATOM 863 CH2 TRP A 54 -10.733 6.364 -8.585 1.00 0.00 C ATOM 0 H TRP A 54 -6.410 0.788 -10.207 1.00 0.00 H new ATOM 0 HA TRP A 54 -5.968 3.339 -8.795 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -7.801 0.974 -8.216 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -7.615 2.357 -7.155 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -8.945 1.480 -10.682 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -10.640 3.278 -11.427 1.00 0.00 H new ATOM 0 HE3 TRP A 54 -8.375 4.714 -6.768 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -11.597 5.731 -10.435 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 -9.718 6.778 -6.738 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -11.312 7.275 -8.544 1.00 0.00 H new ATOM 874 N HIS A 55 -4.598 2.502 -6.945 1.00 0.00 N ATOM 875 CA HIS A 55 -3.609 2.094 -5.960 1.00 0.00 C ATOM 876 C HIS A 55 -4.004 2.655 -4.603 1.00 0.00 C ATOM 877 O HIS A 55 -3.931 3.863 -4.376 1.00 0.00 O ATOM 878 CB HIS A 55 -2.224 2.592 -6.371 1.00 0.00 C ATOM 879 CG HIS A 55 -2.063 2.698 -7.855 1.00 0.00 C ATOM 880 ND1 HIS A 55 -1.170 1.929 -8.575 1.00 0.00 N ATOM 881 CD2 HIS A 55 -2.704 3.472 -8.761 1.00 0.00 C ATOM 882 CE1 HIS A 55 -1.271 2.228 -9.857 1.00 0.00 C ATOM 883 NE2 HIS A 55 -2.194 3.160 -9.996 1.00 0.00 N ATOM 0 H HIS A 55 -4.832 3.494 -6.910 1.00 0.00 H new ATOM 0 HA HIS A 55 -3.572 1.006 -5.900 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -2.045 3.568 -5.920 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -1.467 1.915 -5.975 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -3.474 4.200 -8.551 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -0.696 1.785 -10.656 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -2.482 3.581 -10.879 1.00 0.00 H new ATOM 892 N CYS A 56 -4.461 1.783 -3.716 1.00 0.00 N ATOM 893 CA CYS A 56 -4.910 2.211 -2.403 1.00 0.00 C ATOM 894 C CYS A 56 -4.245 1.425 -1.284 1.00 0.00 C ATOM 895 O CYS A 56 -3.499 0.476 -1.523 1.00 0.00 O ATOM 896 CB CYS A 56 -6.425 2.060 -2.303 1.00 0.00 C ATOM 897 SG CYS A 56 -7.236 1.683 -3.875 1.00 0.00 S ATOM 0 H CYS A 56 -4.530 0.779 -3.882 1.00 0.00 H new ATOM 0 HA CYS A 56 -4.627 3.257 -2.285 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -6.654 1.268 -1.590 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -6.845 2.982 -1.902 1.00 0.00 H new ATOM 0 HG CYS A 56 -8.525 1.780 -3.733 1.00 0.00 H new ATOM 903 N ILE A 57 -4.537 1.838 -0.059 1.00 0.00 N ATOM 904 CA ILE A 57 -3.989 1.193 1.125 1.00 0.00 C ATOM 905 C ILE A 57 -4.893 1.421 2.330 1.00 0.00 C ATOM 906 O ILE A 57 -5.773 2.282 2.301 1.00 0.00 O ATOM 907 CB ILE A 57 -2.576 1.708 1.433 1.00 0.00 C ATOM 908 CG1 ILE A 57 -1.627 1.268 0.322 1.00 0.00 C ATOM 909 CG2 ILE A 57 -2.097 1.201 2.789 1.00 0.00 C ATOM 910 CD1 ILE A 57 -0.208 1.720 0.532 1.00 0.00 C ATOM 0 H ILE A 57 -5.156 2.624 0.141 1.00 0.00 H new ATOM 0 HA ILE A 57 -3.932 0.124 0.920 1.00 0.00 H new ATOM 0 HB ILE A 57 -2.594 2.797 1.478 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -1.646 0.181 0.248 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -1.988 1.659 -0.629 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -1.094 1.579 2.985 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -2.775 1.550 3.568 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -2.080 0.111 2.785 1.00 0.00 H new ATOM 0 HD11 ILE A 57 0.411 1.372 -0.295 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -0.176 2.809 0.577 1.00 0.00 H new ATOM 0 HD13 ILE A 57 0.171 1.307 1.467 1.00 0.00 H new ATOM 922 N VAL A 58 -4.680 0.648 3.384 1.00 0.00 N ATOM 923 CA VAL A 58 -5.485 0.776 4.592 1.00 0.00 C ATOM 924 C VAL A 58 -4.693 0.358 5.821 1.00 0.00 C ATOM 925 O VAL A 58 -4.249 -0.784 5.929 1.00 0.00 O ATOM 926 CB VAL A 58 -6.768 -0.066 4.505 1.00 0.00 C ATOM 927 CG1 VAL A 58 -6.432 -1.519 4.233 1.00 0.00 C ATOM 928 CG2 VAL A 58 -7.585 0.070 5.781 1.00 0.00 C ATOM 0 H VAL A 58 -3.959 -0.073 3.429 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.760 1.827 4.681 1.00 0.00 H new ATOM 0 HB VAL A 58 -7.370 0.306 3.676 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -7.352 -2.100 4.175 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -5.893 -1.597 3.289 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.809 -1.906 5.040 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -8.489 -0.533 5.700 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -6.994 -0.274 6.630 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -7.858 1.115 5.929 1.00 0.00 H new ATOM 938 N GLY A 59 -4.519 1.292 6.747 1.00 0.00 N ATOM 939 CA GLY A 59 -3.779 1.007 7.957 1.00 0.00 C ATOM 940 C GLY A 59 -4.358 1.718 9.159 1.00 0.00 C ATOM 941 O GLY A 59 -5.407 2.354 9.067 1.00 0.00 O ATOM 0 H GLY A 59 -4.879 2.244 6.680 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -3.780 -0.068 8.137 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -2.740 1.307 7.825 1.00 0.00 H new ATOM 945 N ARG A 60 -3.678 1.606 10.291 1.00 0.00 N ATOM 946 CA ARG A 60 -4.138 2.238 11.515 1.00 0.00 C ATOM 947 C ARG A 60 -2.965 2.593 12.421 1.00 0.00 C ATOM 948 O ARG A 60 -3.096 2.610 13.646 1.00 0.00 O ATOM 949 CB ARG A 60 -5.097 1.305 12.242 1.00 0.00 C ATOM 950 CG ARG A 60 -4.719 -0.163 12.124 1.00 0.00 C ATOM 951 CD ARG A 60 -5.712 -1.056 12.850 1.00 0.00 C ATOM 952 NE ARG A 60 -5.474 -1.078 14.291 1.00 0.00 N ATOM 953 CZ ARG A 60 -4.281 -1.293 14.836 1.00 0.00 C ATOM 954 NH1 ARG A 60 -3.226 -1.512 14.062 1.00 0.00 N ATOM 955 NH2 ARG A 60 -4.142 -1.291 16.153 1.00 0.00 N ATOM 0 H ARG A 60 -2.807 1.084 10.385 1.00 0.00 H new ATOM 0 HA ARG A 60 -4.655 3.162 11.255 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -5.130 1.580 13.296 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -6.102 1.447 11.844 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -4.677 -0.445 11.072 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -3.722 -0.317 12.536 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -6.725 -0.705 12.655 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -5.644 -2.070 12.456 1.00 0.00 H new ATOM 0 HE ARG A 60 -6.267 -0.920 14.913 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -3.330 -1.515 13.047 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -2.311 -1.677 14.482 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -4.951 -1.124 16.751 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -3.226 -1.456 16.569 1.00 0.00 H new ATOM 969 N ASN A 61 -1.820 2.876 11.814 1.00 0.00 N ATOM 970 CA ASN A 61 -0.625 3.230 12.568 1.00 0.00 C ATOM 971 C ASN A 61 0.589 3.317 11.653 1.00 0.00 C ATOM 972 O ASN A 61 1.721 3.105 12.084 1.00 0.00 O ATOM 973 CB ASN A 61 -0.373 2.204 13.674 1.00 0.00 C ATOM 974 CG ASN A 61 -0.279 2.844 15.045 1.00 0.00 C ATOM 975 OD1 ASN A 61 0.935 3.195 15.453 1.00 0.00 O flip ATOM 976 ND2 ASN A 61 -1.288 3.022 15.729 1.00 0.00 N flip ATOM 0 H ASN A 61 -1.694 2.867 10.802 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.787 4.209 13.020 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -1.177 1.468 13.674 1.00 0.00 H new ATOM 0 HB3 ASN A 61 0.551 1.666 13.463 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -2.201 2.736 15.375 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -1.210 3.455 16.649 1.00 0.00 H new ATOM 983 N PHE A 62 0.344 3.632 10.387 1.00 0.00 N ATOM 984 CA PHE A 62 1.416 3.748 9.410 1.00 0.00 C ATOM 985 C PHE A 62 1.601 5.200 8.981 1.00 0.00 C ATOM 986 O PHE A 62 1.051 6.116 9.592 1.00 0.00 O ATOM 987 CB PHE A 62 1.105 2.881 8.189 1.00 0.00 C ATOM 988 CG PHE A 62 0.061 3.472 7.282 1.00 0.00 C ATOM 989 CD1 PHE A 62 -0.995 4.207 7.798 1.00 0.00 C ATOM 990 CD2 PHE A 62 0.140 3.292 5.912 1.00 0.00 C ATOM 991 CE1 PHE A 62 -1.952 4.752 6.963 1.00 0.00 C ATOM 992 CE2 PHE A 62 -0.814 3.834 5.071 1.00 0.00 C ATOM 993 CZ PHE A 62 -1.861 4.566 5.598 1.00 0.00 C ATOM 0 H PHE A 62 -0.588 3.811 10.014 1.00 0.00 H new ATOM 0 HA PHE A 62 2.341 3.403 9.871 1.00 0.00 H new ATOM 0 HB2 PHE A 62 2.022 2.726 7.621 1.00 0.00 H new ATOM 0 HB3 PHE A 62 0.769 1.900 8.526 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -1.071 4.355 8.865 1.00 0.00 H new ATOM 0 HD2 PHE A 62 0.957 2.721 5.495 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -2.770 5.323 7.378 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -0.741 3.686 4.004 1.00 0.00 H new ATOM 0 HZ PHE A 62 -2.607 4.992 4.943 1.00 0.00 H new ATOM 1003 N GLY A 63 2.378 5.398 7.922 1.00 0.00 N ATOM 1004 CA GLY A 63 2.625 6.734 7.418 1.00 0.00 C ATOM 1005 C GLY A 63 2.677 6.765 5.906 1.00 0.00 C ATOM 1006 O GLY A 63 3.755 6.796 5.312 1.00 0.00 O ATOM 0 H GLY A 63 2.842 4.653 7.402 1.00 0.00 H new ATOM 0 HA2 GLY A 63 1.841 7.405 7.768 1.00 0.00 H new ATOM 0 HA3 GLY A 63 3.567 7.106 7.822 1.00 0.00 H new ATOM 1010 N SER A 64 1.506 6.744 5.280 1.00 0.00 N ATOM 1011 CA SER A 64 1.415 6.756 3.826 1.00 0.00 C ATOM 1012 C SER A 64 1.782 8.124 3.261 1.00 0.00 C ATOM 1013 O SER A 64 1.249 9.148 3.685 1.00 0.00 O ATOM 1014 CB SER A 64 0.008 6.363 3.376 1.00 0.00 C ATOM 1015 OG SER A 64 -0.979 7.011 4.159 1.00 0.00 O ATOM 0 H SER A 64 0.605 6.719 5.758 1.00 0.00 H new ATOM 0 HA SER A 64 2.128 6.027 3.441 1.00 0.00 H new ATOM 0 HB2 SER A 64 -0.127 6.624 2.326 1.00 0.00 H new ATOM 0 HB3 SER A 64 -0.113 5.283 3.454 1.00 0.00 H new ATOM 0 HG SER A 64 -1.712 6.387 4.343 1.00 0.00 H new ATOM 1021 N TYR A 65 2.697 8.126 2.298 1.00 0.00 N ATOM 1022 CA TYR A 65 3.147 9.357 1.663 1.00 0.00 C ATOM 1023 C TYR A 65 3.408 9.125 0.177 1.00 0.00 C ATOM 1024 O TYR A 65 4.542 8.881 -0.232 1.00 0.00 O ATOM 1025 CB TYR A 65 4.417 9.865 2.348 1.00 0.00 C ATOM 1026 CG TYR A 65 4.768 11.295 2.007 1.00 0.00 C ATOM 1027 CD1 TYR A 65 5.556 11.593 0.903 1.00 0.00 C ATOM 1028 CD2 TYR A 65 4.317 12.347 2.795 1.00 0.00 C ATOM 1029 CE1 TYR A 65 5.885 12.898 0.593 1.00 0.00 C ATOM 1030 CE2 TYR A 65 4.640 13.655 2.491 1.00 0.00 C ATOM 1031 CZ TYR A 65 5.425 13.926 1.390 1.00 0.00 C ATOM 1032 OH TYR A 65 5.751 15.227 1.086 1.00 0.00 O ATOM 0 H TYR A 65 3.144 7.282 1.939 1.00 0.00 H new ATOM 0 HA TYR A 65 2.364 10.109 1.764 1.00 0.00 H new ATOM 0 HB2 TYR A 65 4.295 9.779 3.428 1.00 0.00 H new ATOM 0 HB3 TYR A 65 5.251 9.220 2.069 1.00 0.00 H new ATOM 0 HD1 TYR A 65 5.918 10.791 0.277 1.00 0.00 H new ATOM 0 HD2 TYR A 65 3.704 12.138 3.659 1.00 0.00 H new ATOM 0 HE1 TYR A 65 6.499 13.113 -0.269 1.00 0.00 H new ATOM 0 HE2 TYR A 65 4.280 14.461 3.112 1.00 0.00 H new ATOM 0 HH TYR A 65 5.347 15.828 1.746 1.00 0.00 H new ATOM 1042 N VAL A 66 2.349 9.194 -0.624 1.00 0.00 N ATOM 1043 CA VAL A 66 2.468 8.981 -2.061 1.00 0.00 C ATOM 1044 C VAL A 66 1.849 10.132 -2.849 1.00 0.00 C ATOM 1045 O VAL A 66 0.969 10.835 -2.354 1.00 0.00 O ATOM 1046 CB VAL A 66 1.797 7.658 -2.486 1.00 0.00 C ATOM 1047 CG1 VAL A 66 2.157 6.546 -1.516 1.00 0.00 C ATOM 1048 CG2 VAL A 66 0.286 7.818 -2.580 1.00 0.00 C ATOM 0 H VAL A 66 1.402 9.395 -0.303 1.00 0.00 H new ATOM 0 HA VAL A 66 3.534 8.931 -2.285 1.00 0.00 H new ATOM 0 HB VAL A 66 2.169 7.391 -3.475 1.00 0.00 H new ATOM 0 HG11 VAL A 66 1.676 5.620 -1.830 1.00 0.00 H new ATOM 0 HG12 VAL A 66 3.238 6.408 -1.506 1.00 0.00 H new ATOM 0 HG13 VAL A 66 1.816 6.811 -0.515 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.162 6.871 -2.881 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.110 8.114 -1.608 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.046 8.584 -3.318 1.00 0.00 H new ATOM 1058 N THR A 67 2.312 10.309 -4.081 1.00 0.00 N ATOM 1059 CA THR A 67 1.797 11.368 -4.942 1.00 0.00 C ATOM 1060 C THR A 67 0.319 11.136 -5.249 1.00 0.00 C ATOM 1061 O THR A 67 -0.373 10.436 -4.509 1.00 0.00 O ATOM 1062 CB THR A 67 2.609 11.440 -6.240 1.00 0.00 C ATOM 1063 OG1 THR A 67 2.586 12.753 -6.772 1.00 0.00 O ATOM 1064 CG2 THR A 67 2.114 10.500 -7.317 1.00 0.00 C ATOM 0 H THR A 67 3.041 9.735 -4.505 1.00 0.00 H new ATOM 0 HA THR A 67 1.894 12.319 -4.418 1.00 0.00 H new ATOM 0 HB THR A 67 3.620 11.141 -5.962 1.00 0.00 H new ATOM 0 HG1 THR A 67 2.820 12.725 -7.723 1.00 0.00 H new ATOM 0 HG21 THR A 67 2.736 10.606 -8.206 1.00 0.00 H new ATOM 0 HG22 THR A 67 2.168 9.473 -6.956 1.00 0.00 H new ATOM 0 HG23 THR A 67 1.081 10.743 -7.566 1.00 0.00 H new ATOM 1072 N HIS A 68 -0.161 11.724 -6.341 1.00 0.00 N ATOM 1073 CA HIS A 68 -1.557 11.571 -6.733 1.00 0.00 C ATOM 1074 C HIS A 68 -1.711 11.607 -8.250 1.00 0.00 C ATOM 1075 O HIS A 68 -1.489 12.640 -8.883 1.00 0.00 O ATOM 1076 CB HIS A 68 -2.414 12.668 -6.098 1.00 0.00 C ATOM 1077 CG HIS A 68 -1.649 13.909 -5.762 1.00 0.00 C ATOM 1078 ND1 HIS A 68 -0.391 14.178 -6.257 1.00 0.00 N ATOM 1079 CD2 HIS A 68 -1.974 14.962 -4.975 1.00 0.00 C ATOM 1080 CE1 HIS A 68 0.025 15.341 -5.788 1.00 0.00 C ATOM 1081 NE2 HIS A 68 -0.917 15.837 -5.008 1.00 0.00 N ATOM 0 H HIS A 68 0.394 12.308 -6.967 1.00 0.00 H new ATOM 0 HA HIS A 68 -1.898 10.599 -6.376 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -3.224 12.925 -6.780 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -2.874 12.278 -5.190 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -2.894 15.090 -4.424 1.00 0.00 H new ATOM 0 HE1 HIS A 68 0.975 15.807 -6.006 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -0.868 16.726 -4.511 1.00 0.00 H new ATOM 1090 N GLU A 69 -2.095 10.474 -8.826 1.00 0.00 N ATOM 1091 CA GLU A 69 -2.285 10.373 -10.267 1.00 0.00 C ATOM 1092 C GLU A 69 -3.757 10.540 -10.631 1.00 0.00 C ATOM 1093 O GLU A 69 -4.617 10.626 -9.754 1.00 0.00 O ATOM 1094 CB GLU A 69 -1.768 9.028 -10.781 1.00 0.00 C ATOM 1095 CG GLU A 69 -0.298 8.787 -10.478 1.00 0.00 C ATOM 1096 CD GLU A 69 0.574 9.973 -10.842 1.00 0.00 C ATOM 1097 OE1 GLU A 69 0.676 10.287 -12.047 1.00 0.00 O ATOM 1098 OE2 GLU A 69 1.154 10.587 -9.923 1.00 0.00 O ATOM 0 H GLU A 69 -2.281 9.611 -8.315 1.00 0.00 H new ATOM 0 HA GLU A 69 -1.717 11.174 -10.741 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -2.358 8.227 -10.336 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -1.922 8.977 -11.859 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -0.181 8.567 -9.417 1.00 0.00 H new ATOM 0 HG3 GLU A 69 0.043 7.908 -11.026 1.00 0.00 H new ATOM 1105 N THR A 70 -4.042 10.589 -11.929 1.00 0.00 N ATOM 1106 CA THR A 70 -5.411 10.750 -12.404 1.00 0.00 C ATOM 1107 C THR A 70 -6.185 11.712 -11.504 1.00 0.00 C ATOM 1108 O THR A 70 -5.814 12.878 -11.365 1.00 0.00 O ATOM 1109 CB THR A 70 -6.120 9.394 -12.457 1.00 0.00 C ATOM 1110 OG1 THR A 70 -5.188 8.333 -12.338 1.00 0.00 O ATOM 1111 CG2 THR A 70 -6.902 9.176 -13.736 1.00 0.00 C ATOM 0 H THR A 70 -3.344 10.520 -12.669 1.00 0.00 H new ATOM 0 HA THR A 70 -5.376 11.169 -13.410 1.00 0.00 H new ATOM 0 HB THR A 70 -6.818 9.402 -11.620 1.00 0.00 H new ATOM 0 HG1 THR A 70 -5.117 7.863 -13.195 1.00 0.00 H new ATOM 0 HG21 THR A 70 -7.379 8.196 -13.708 1.00 0.00 H new ATOM 0 HG22 THR A 70 -7.665 9.949 -13.832 1.00 0.00 H new ATOM 0 HG23 THR A 70 -6.225 9.226 -14.589 1.00 0.00 H new ATOM 1119 N LYS A 71 -7.257 11.217 -10.892 1.00 0.00 N ATOM 1120 CA LYS A 71 -8.075 12.035 -10.005 1.00 0.00 C ATOM 1121 C LYS A 71 -7.336 12.331 -8.706 1.00 0.00 C ATOM 1122 O LYS A 71 -7.950 12.484 -7.650 1.00 0.00 O ATOM 1123 CB LYS A 71 -9.401 11.330 -9.707 1.00 0.00 C ATOM 1124 CG LYS A 71 -10.580 11.901 -10.477 1.00 0.00 C ATOM 1125 CD LYS A 71 -11.554 10.811 -10.893 1.00 0.00 C ATOM 1126 CE LYS A 71 -11.835 10.855 -12.387 1.00 0.00 C ATOM 1127 NZ LYS A 71 -12.727 9.745 -12.818 1.00 0.00 N ATOM 0 H LYS A 71 -7.578 10.254 -10.994 1.00 0.00 H new ATOM 0 HA LYS A 71 -8.281 12.981 -10.507 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -9.301 10.271 -9.945 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -9.608 11.399 -8.639 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -11.097 12.636 -9.860 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -10.219 12.425 -11.362 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -11.146 9.836 -10.627 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -12.488 10.926 -10.343 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -12.295 11.810 -12.642 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -10.894 10.798 -12.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -12.894 9.811 -13.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -12.277 8.833 -12.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -13.634 9.813 -12.315 1.00 0.00 H new ATOM 1141 N HIS A 72 -6.013 12.414 -8.794 1.00 0.00 N ATOM 1142 CA HIS A 72 -5.185 12.693 -7.629 1.00 0.00 C ATOM 1143 C HIS A 72 -5.196 11.519 -6.657 1.00 0.00 C ATOM 1144 O HIS A 72 -4.348 10.630 -6.734 1.00 0.00 O ATOM 1145 CB HIS A 72 -5.672 13.961 -6.925 1.00 0.00 C ATOM 1146 CG HIS A 72 -5.836 15.130 -7.846 1.00 0.00 C ATOM 1147 ND1 HIS A 72 -6.716 15.350 -8.852 1.00 0.00 N flip ATOM 1148 CD2 HIS A 72 -5.032 16.251 -7.792 1.00 0.00 C flip ATOM 1149 CE1 HIS A 72 -6.430 16.585 -9.379 1.00 0.00 C flip ATOM 1150 NE2 HIS A 72 -5.412 17.108 -8.722 1.00 0.00 N flip ATOM 0 H HIS A 72 -5.491 12.292 -9.662 1.00 0.00 H new ATOM 0 HA HIS A 72 -4.161 12.845 -7.970 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -6.626 13.754 -6.440 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -4.965 14.225 -6.138 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -4.219 16.403 -7.097 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -6.954 17.053 -10.199 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -4.990 18.019 -8.902 1.00 0.00 H new ATOM 1159 N PHE A 73 -6.164 11.525 -5.746 1.00 0.00 N ATOM 1160 CA PHE A 73 -6.290 10.461 -4.753 1.00 0.00 C ATOM 1161 C PHE A 73 -7.177 10.906 -3.593 1.00 0.00 C ATOM 1162 O PHE A 73 -7.911 11.889 -3.703 1.00 0.00 O ATOM 1163 CB PHE A 73 -4.907 10.050 -4.233 1.00 0.00 C ATOM 1164 CG PHE A 73 -4.418 10.878 -3.077 1.00 0.00 C ATOM 1165 CD1 PHE A 73 -4.529 12.259 -3.100 1.00 0.00 C ATOM 1166 CD2 PHE A 73 -3.852 10.273 -1.967 1.00 0.00 C ATOM 1167 CE1 PHE A 73 -4.084 13.022 -2.037 1.00 0.00 C ATOM 1168 CE2 PHE A 73 -3.404 11.030 -0.902 1.00 0.00 C ATOM 1169 CZ PHE A 73 -3.521 12.406 -0.935 1.00 0.00 C ATOM 0 H PHE A 73 -6.873 12.254 -5.674 1.00 0.00 H new ATOM 0 HA PHE A 73 -6.756 9.600 -5.233 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -4.941 9.004 -3.929 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -4.187 10.122 -5.048 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -4.968 12.745 -3.959 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -3.760 9.197 -1.934 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -4.176 14.098 -2.067 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -2.962 10.546 -0.043 1.00 0.00 H new ATOM 0 HZ PHE A 73 -3.173 12.999 -0.102 1.00 0.00 H new ATOM 1179 N ILE A 74 -7.097 10.182 -2.480 1.00 0.00 N ATOM 1180 CA ILE A 74 -7.885 10.510 -1.298 1.00 0.00 C ATOM 1181 C ILE A 74 -7.439 9.703 -0.084 1.00 0.00 C ATOM 1182 O ILE A 74 -7.644 8.490 -0.019 1.00 0.00 O ATOM 1183 CB ILE A 74 -9.390 10.264 -1.522 1.00 0.00 C ATOM 1184 CG1 ILE A 74 -10.189 10.861 -0.343 1.00 0.00 C ATOM 1185 CG2 ILE A 74 -9.648 8.771 -1.705 1.00 0.00 C ATOM 1186 CD1 ILE A 74 -11.466 10.127 0.024 1.00 0.00 C ATOM 0 H ILE A 74 -6.495 9.366 -2.373 1.00 0.00 H new ATOM 0 HA ILE A 74 -7.719 11.571 -1.113 1.00 0.00 H new ATOM 0 HB ILE A 74 -9.724 10.762 -2.432 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -9.542 10.888 0.534 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -10.442 11.893 -0.585 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -10.713 8.603 -1.863 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -9.091 8.409 -2.569 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -9.324 8.234 -0.814 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -11.947 10.630 0.863 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -12.141 10.122 -0.831 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -11.228 9.101 0.305 1.00 0.00 H new ATOM 1198 N TYR A 75 -6.839 10.387 0.883 1.00 0.00 N ATOM 1199 CA TYR A 75 -6.374 9.744 2.104 1.00 0.00 C ATOM 1200 C TYR A 75 -7.302 10.082 3.267 1.00 0.00 C ATOM 1201 O TYR A 75 -7.608 11.251 3.504 1.00 0.00 O ATOM 1202 CB TYR A 75 -4.946 10.186 2.429 1.00 0.00 C ATOM 1203 CG TYR A 75 -4.329 9.440 3.589 1.00 0.00 C ATOM 1204 CD1 TYR A 75 -4.177 8.059 3.549 1.00 0.00 C ATOM 1205 CD2 TYR A 75 -3.899 10.115 4.723 1.00 0.00 C ATOM 1206 CE1 TYR A 75 -3.613 7.374 4.609 1.00 0.00 C ATOM 1207 CE2 TYR A 75 -3.334 9.437 5.787 1.00 0.00 C ATOM 1208 CZ TYR A 75 -3.194 8.067 5.724 1.00 0.00 C ATOM 1209 OH TYR A 75 -2.632 7.387 6.780 1.00 0.00 O ATOM 0 H TYR A 75 -6.663 11.391 0.844 1.00 0.00 H new ATOM 0 HA TYR A 75 -6.381 8.665 1.950 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -4.322 10.047 1.546 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -4.947 11.253 2.654 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -4.504 7.513 2.677 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -4.008 11.188 4.775 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -3.501 6.301 4.564 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -3.004 9.977 6.662 1.00 0.00 H new ATOM 0 HH TYR A 75 -2.202 6.570 6.451 1.00 0.00 H new ATOM 1219 N PHE A 76 -7.750 9.057 3.984 1.00 0.00 N ATOM 1220 CA PHE A 76 -8.647 9.252 5.120 1.00 0.00 C ATOM 1221 C PHE A 76 -8.312 8.294 6.258 1.00 0.00 C ATOM 1222 O PHE A 76 -7.403 7.473 6.147 1.00 0.00 O ATOM 1223 CB PHE A 76 -10.101 9.049 4.687 1.00 0.00 C ATOM 1224 CG PHE A 76 -10.277 7.964 3.663 1.00 0.00 C ATOM 1225 CD1 PHE A 76 -9.768 8.113 2.383 1.00 0.00 C ATOM 1226 CD2 PHE A 76 -10.952 6.796 3.980 1.00 0.00 C ATOM 1227 CE1 PHE A 76 -9.928 7.116 1.439 1.00 0.00 C ATOM 1228 CE2 PHE A 76 -11.116 5.796 3.040 1.00 0.00 C ATOM 1229 CZ PHE A 76 -10.603 5.957 1.767 1.00 0.00 C ATOM 0 H PHE A 76 -7.508 8.083 3.800 1.00 0.00 H new ATOM 0 HA PHE A 76 -8.515 10.273 5.479 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -10.703 8.811 5.564 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -10.485 9.985 4.282 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -9.240 9.018 2.120 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -11.355 6.665 4.974 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -9.525 7.244 0.445 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -11.644 4.890 3.300 1.00 0.00 H new ATOM 0 HZ PHE A 76 -10.730 5.178 1.030 1.00 0.00 H new ATOM 1239 N TYR A 77 -9.056 8.408 7.354 1.00 0.00 N ATOM 1240 CA TYR A 77 -8.844 7.555 8.520 1.00 0.00 C ATOM 1241 C TYR A 77 -10.179 7.137 9.135 1.00 0.00 C ATOM 1242 O TYR A 77 -10.826 7.922 9.829 1.00 0.00 O ATOM 1243 CB TYR A 77 -7.990 8.289 9.558 1.00 0.00 C ATOM 1244 CG TYR A 77 -7.786 7.519 10.844 1.00 0.00 C ATOM 1245 CD1 TYR A 77 -8.837 7.316 11.729 1.00 0.00 C ATOM 1246 CD2 TYR A 77 -6.539 7.001 11.177 1.00 0.00 C ATOM 1247 CE1 TYR A 77 -8.654 6.618 12.908 1.00 0.00 C ATOM 1248 CE2 TYR A 77 -6.348 6.301 12.354 1.00 0.00 C ATOM 1249 CZ TYR A 77 -7.408 6.113 13.216 1.00 0.00 C ATOM 1250 OH TYR A 77 -7.224 5.417 14.389 1.00 0.00 O ATOM 0 H TYR A 77 -9.813 9.084 7.460 1.00 0.00 H new ATOM 0 HA TYR A 77 -8.319 6.655 8.199 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -7.016 8.510 9.121 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -8.460 9.245 9.790 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -9.814 7.710 11.492 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -5.706 7.148 10.505 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -9.482 6.469 13.585 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -5.374 5.903 12.597 1.00 0.00 H new ATOM 0 HH TYR A 77 -6.290 5.128 14.455 1.00 0.00 H new ATOM 1260 N LEU A 78 -10.588 5.897 8.873 1.00 0.00 N ATOM 1261 CA LEU A 78 -11.848 5.376 9.400 1.00 0.00 C ATOM 1262 C LEU A 78 -11.783 5.215 10.915 1.00 0.00 C ATOM 1263 O LEU A 78 -10.788 5.568 11.546 1.00 0.00 O ATOM 1264 CB LEU A 78 -12.184 4.026 8.757 1.00 0.00 C ATOM 1265 CG LEU A 78 -12.592 4.065 7.279 1.00 0.00 C ATOM 1266 CD1 LEU A 78 -14.065 4.418 7.141 1.00 0.00 C ATOM 1267 CD2 LEU A 78 -11.727 5.045 6.497 1.00 0.00 C ATOM 0 H LEU A 78 -10.066 5.235 8.299 1.00 0.00 H new ATOM 0 HA LEU A 78 -12.630 6.095 9.156 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -11.317 3.373 8.856 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -12.994 3.568 9.324 1.00 0.00 H new ATOM 0 HG LEU A 78 -12.435 3.072 6.859 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -14.336 4.441 6.086 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.668 3.669 7.655 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -14.248 5.397 7.584 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -12.038 5.052 5.452 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -11.840 6.045 6.916 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -10.682 4.740 6.562 1.00 0.00 H new ATOM 1279 N GLY A 79 -12.849 4.669 11.493 1.00 0.00 N ATOM 1280 CA GLY A 79 -12.891 4.463 12.928 1.00 0.00 C ATOM 1281 C GLY A 79 -11.722 3.638 13.424 1.00 0.00 C ATOM 1282 O GLY A 79 -11.810 2.414 13.515 1.00 0.00 O ATOM 0 H GLY A 79 -13.684 4.366 10.992 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -12.891 5.430 13.432 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -13.823 3.965 13.194 1.00 0.00 H new ATOM 1286 N GLN A 80 -10.622 4.311 13.746 1.00 0.00 N ATOM 1287 CA GLN A 80 -9.426 3.635 14.233 1.00 0.00 C ATOM 1288 C GLN A 80 -8.630 3.038 13.076 1.00 0.00 C ATOM 1289 O GLN A 80 -7.695 2.266 13.287 1.00 0.00 O ATOM 1290 CB GLN A 80 -9.806 2.536 15.229 1.00 0.00 C ATOM 1291 CG GLN A 80 -10.692 3.024 16.365 1.00 0.00 C ATOM 1292 CD GLN A 80 -12.168 2.835 16.076 1.00 0.00 C ATOM 1293 OE1 GLN A 80 -12.858 3.931 15.785 1.00 0.00 O flip ATOM 1294 NE2 GLN A 80 -12.683 1.716 16.115 1.00 0.00 N flip ATOM 0 H GLN A 80 -10.535 5.325 13.678 1.00 0.00 H new ATOM 0 HA GLN A 80 -8.801 4.372 14.738 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -10.320 1.736 14.696 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -8.896 2.106 15.648 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -10.433 2.489 17.278 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -10.494 4.080 16.547 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -12.114 0.901 16.343 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -13.678 1.605 15.919 1.00 0.00 H new ATOM 1303 N VAL A 81 -9.005 3.402 11.853 1.00 0.00 N ATOM 1304 CA VAL A 81 -8.328 2.901 10.663 1.00 0.00 C ATOM 1305 C VAL A 81 -8.082 4.020 9.654 1.00 0.00 C ATOM 1306 O VAL A 81 -8.481 5.164 9.870 1.00 0.00 O ATOM 1307 CB VAL A 81 -9.140 1.785 9.984 1.00 0.00 C ATOM 1308 CG1 VAL A 81 -8.277 1.024 8.991 1.00 0.00 C ATOM 1309 CG2 VAL A 81 -9.726 0.843 11.024 1.00 0.00 C ATOM 0 H VAL A 81 -9.775 4.043 11.661 1.00 0.00 H new ATOM 0 HA VAL A 81 -7.371 2.497 10.992 1.00 0.00 H new ATOM 0 HB VAL A 81 -9.964 2.243 9.437 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -8.869 0.239 8.521 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -7.911 1.710 8.226 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -7.430 0.577 9.512 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -10.297 0.060 10.525 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -8.919 0.392 11.602 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -10.382 1.401 11.692 1.00 0.00 H new ATOM 1319 N ALA A 82 -7.421 3.678 8.550 1.00 0.00 N ATOM 1320 CA ALA A 82 -7.121 4.651 7.506 1.00 0.00 C ATOM 1321 C ALA A 82 -7.098 3.987 6.135 1.00 0.00 C ATOM 1322 O ALA A 82 -6.940 2.771 6.029 1.00 0.00 O ATOM 1323 CB ALA A 82 -5.791 5.332 7.786 1.00 0.00 C ATOM 0 H ALA A 82 -7.084 2.735 8.357 1.00 0.00 H new ATOM 0 HA ALA A 82 -7.908 5.405 7.506 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -5.580 6.056 6.999 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -5.840 5.845 8.747 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -4.998 4.584 7.814 1.00 0.00 H new ATOM 1329 N ILE A 83 -7.253 4.789 5.084 1.00 0.00 N ATOM 1330 CA ILE A 83 -7.250 4.266 3.722 1.00 0.00 C ATOM 1331 C ILE A 83 -6.630 5.255 2.739 1.00 0.00 C ATOM 1332 O ILE A 83 -7.149 6.353 2.534 1.00 0.00 O ATOM 1333 CB ILE A 83 -8.676 3.926 3.246 1.00 0.00 C ATOM 1334 CG1 ILE A 83 -9.599 3.669 4.444 1.00 0.00 C ATOM 1335 CG2 ILE A 83 -8.648 2.721 2.314 1.00 0.00 C ATOM 1336 CD1 ILE A 83 -9.364 2.339 5.129 1.00 0.00 C ATOM 0 H ILE A 83 -7.382 5.799 5.150 1.00 0.00 H new ATOM 0 HA ILE A 83 -6.648 3.358 3.744 1.00 0.00 H new ATOM 0 HB ILE A 83 -9.071 4.779 2.694 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -9.464 4.469 5.172 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -10.635 3.715 4.108 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -9.662 2.492 1.985 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -8.027 2.946 1.447 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -8.235 1.862 2.842 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -10.055 2.233 5.965 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -9.528 1.529 4.418 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -8.339 2.296 5.498 1.00 0.00 H new ATOM 1348 N LEU A 84 -5.525 4.850 2.122 1.00 0.00 N ATOM 1349 CA LEU A 84 -4.834 5.684 1.147 1.00 0.00 C ATOM 1350 C LEU A 84 -5.201 5.255 -0.272 1.00 0.00 C ATOM 1351 O LEU A 84 -4.669 4.272 -0.787 1.00 0.00 O ATOM 1352 CB LEU A 84 -3.317 5.594 1.356 1.00 0.00 C ATOM 1353 CG LEU A 84 -2.469 5.806 0.101 1.00 0.00 C ATOM 1354 CD1 LEU A 84 -1.752 7.144 0.165 1.00 0.00 C ATOM 1355 CD2 LEU A 84 -1.471 4.670 -0.067 1.00 0.00 C ATOM 0 H LEU A 84 -5.087 3.943 2.282 1.00 0.00 H new ATOM 0 HA LEU A 84 -5.146 6.719 1.288 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -3.025 6.335 2.101 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.082 4.614 1.772 1.00 0.00 H new ATOM 0 HG LEU A 84 -3.130 5.811 -0.766 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.153 7.279 -0.736 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -2.486 7.947 0.237 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.102 7.167 1.040 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.876 4.838 -0.965 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.814 4.632 0.802 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -2.007 3.725 -0.158 1.00 0.00 H new ATOM 1367 N LEU A 85 -6.119 5.988 -0.892 1.00 0.00 N ATOM 1368 CA LEU A 85 -6.565 5.669 -2.247 1.00 0.00 C ATOM 1369 C LEU A 85 -5.944 6.607 -3.276 1.00 0.00 C ATOM 1370 O LEU A 85 -5.975 7.825 -3.115 1.00 0.00 O ATOM 1371 CB LEU A 85 -8.088 5.755 -2.334 1.00 0.00 C ATOM 1372 CG LEU A 85 -8.791 4.444 -2.683 1.00 0.00 C ATOM 1373 CD1 LEU A 85 -8.832 3.528 -1.472 1.00 0.00 C ATOM 1374 CD2 LEU A 85 -10.196 4.714 -3.199 1.00 0.00 C ATOM 0 H LEU A 85 -6.569 6.806 -0.481 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.240 4.653 -2.470 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -8.472 6.112 -1.378 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.352 6.502 -3.083 1.00 0.00 H new ATOM 0 HG LEU A 85 -8.227 3.947 -3.472 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -9.336 2.598 -1.736 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -7.815 3.310 -1.146 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -9.375 4.018 -0.664 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -10.682 3.769 -3.443 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -10.772 5.231 -2.432 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -10.142 5.335 -4.093 1.00 0.00 H new ATOM 1386 N PHE A 86 -5.392 6.029 -4.340 1.00 0.00 N ATOM 1387 CA PHE A 86 -4.774 6.823 -5.403 1.00 0.00 C ATOM 1388 C PHE A 86 -4.501 5.984 -6.652 1.00 0.00 C ATOM 1389 O PHE A 86 -3.937 4.894 -6.570 1.00 0.00 O ATOM 1390 CB PHE A 86 -3.473 7.456 -4.906 1.00 0.00 C ATOM 1391 CG PHE A 86 -2.376 6.461 -4.658 1.00 0.00 C ATOM 1392 CD1 PHE A 86 -1.580 6.015 -5.701 1.00 0.00 C ATOM 1393 CD2 PHE A 86 -2.139 5.974 -3.383 1.00 0.00 C ATOM 1394 CE1 PHE A 86 -0.568 5.101 -5.476 1.00 0.00 C ATOM 1395 CE2 PHE A 86 -1.128 5.061 -3.152 1.00 0.00 C ATOM 1396 CZ PHE A 86 -0.342 4.623 -4.200 1.00 0.00 C ATOM 0 H PHE A 86 -5.359 5.021 -4.490 1.00 0.00 H new ATOM 0 HA PHE A 86 -5.478 7.609 -5.675 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -3.131 8.186 -5.639 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -3.673 8.001 -3.983 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -1.752 6.386 -6.701 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -2.751 6.312 -2.560 1.00 0.00 H new ATOM 0 HE1 PHE A 86 0.046 4.761 -6.297 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -0.952 4.690 -2.153 1.00 0.00 H new ATOM 0 HZ PHE A 86 0.448 3.908 -4.022 1.00 0.00 H new ATOM 1406 N LYS A 87 -4.901 6.513 -7.811 1.00 0.00 N ATOM 1407 CA LYS A 87 -4.701 5.830 -9.090 1.00 0.00 C ATOM 1408 C LYS A 87 -3.323 6.144 -9.663 1.00 0.00 C ATOM 1409 O LYS A 87 -2.439 6.630 -8.959 1.00 0.00 O ATOM 1410 CB LYS A 87 -5.778 6.261 -10.090 1.00 0.00 C ATOM 1411 CG LYS A 87 -6.987 5.347 -10.134 1.00 0.00 C ATOM 1412 CD LYS A 87 -8.065 5.912 -11.045 1.00 0.00 C ATOM 1413 CE LYS A 87 -7.545 6.124 -12.457 1.00 0.00 C ATOM 1414 NZ LYS A 87 -8.653 6.339 -13.429 1.00 0.00 N ATOM 0 H LYS A 87 -5.367 7.417 -7.889 1.00 0.00 H new ATOM 0 HA LYS A 87 -4.773 4.756 -8.916 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -6.108 7.269 -9.840 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -5.336 6.308 -11.085 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -6.688 4.360 -10.487 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -7.387 5.218 -9.128 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -8.917 5.232 -11.068 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -8.424 6.859 -10.642 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -6.876 6.984 -12.472 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -6.957 5.258 -12.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -8.278 6.294 -14.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -9.374 5.601 -13.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -9.081 7.273 -13.267 1.00 0.00 H new ATOM 1428 N SER A 88 -3.156 5.875 -10.955 1.00 0.00 N ATOM 1429 CA SER A 88 -1.896 6.137 -11.642 1.00 0.00 C ATOM 1430 C SER A 88 -2.152 6.509 -13.092 1.00 0.00 C ATOM 1431 O SER A 88 -1.255 6.461 -13.934 1.00 0.00 O ATOM 1432 CB SER A 88 -0.978 4.920 -11.574 1.00 0.00 C ATOM 1433 OG SER A 88 -0.195 4.934 -10.394 1.00 0.00 O ATOM 0 H SER A 88 -3.882 5.474 -11.549 1.00 0.00 H new ATOM 0 HA SER A 88 -1.405 6.972 -11.141 1.00 0.00 H new ATOM 0 HB2 SER A 88 -1.575 4.009 -11.607 1.00 0.00 H new ATOM 0 HB3 SER A 88 -0.325 4.905 -12.447 1.00 0.00 H new ATOM 0 HG SER A 88 0.500 4.246 -10.454 1.00 0.00 H new ATOM 1490 N ARG B 4 20.179 -1.458 6.707 1.00 0.00 N ATOM 1491 CA ARG B 4 18.762 -1.198 6.487 1.00 0.00 C ATOM 1492 C ARG B 4 17.993 -1.223 7.804 1.00 0.00 C ATOM 1493 O ARG B 4 16.906 -0.654 7.911 1.00 0.00 O ATOM 1494 CB ARG B 4 18.176 -2.233 5.525 1.00 0.00 C ATOM 1495 CG ARG B 4 19.076 -2.535 4.339 1.00 0.00 C ATOM 1496 CD ARG B 4 20.313 -3.309 4.761 1.00 0.00 C ATOM 1497 NE ARG B 4 21.180 -3.613 3.626 1.00 0.00 N ATOM 1498 CZ ARG B 4 21.979 -4.674 3.572 1.00 0.00 C ATOM 1499 NH1 ARG B 4 22.015 -5.531 4.584 1.00 0.00 N ATOM 1500 NH2 ARG B 4 22.740 -4.881 2.506 1.00 0.00 N ATOM 0 HA ARG B 4 18.665 -0.205 6.048 1.00 0.00 H new ATOM 0 HB2 ARG B 4 17.985 -3.157 6.070 1.00 0.00 H new ATOM 0 HB3 ARG B 4 17.214 -1.874 5.159 1.00 0.00 H new ATOM 0 HG2 ARG B 4 18.521 -3.110 3.597 1.00 0.00 H new ATOM 0 HG3 ARG B 4 19.375 -1.602 3.861 1.00 0.00 H new ATOM 0 HD2 ARG B 4 20.870 -2.730 5.498 1.00 0.00 H new ATOM 0 HD3 ARG B 4 20.012 -4.237 5.247 1.00 0.00 H new ATOM 0 HE ARG B 4 21.172 -2.975 2.830 1.00 0.00 H new ATOM 0 HH11 ARG B 4 21.429 -5.376 5.405 1.00 0.00 H new ATOM 0 HH12 ARG B 4 22.628 -6.345 4.542 1.00 0.00 H new ATOM 0 HH21 ARG B 4 22.713 -4.225 1.725 1.00 0.00 H new ATOM 0 HH22 ARG B 4 23.352 -5.696 2.467 1.00 0.00 H new ATOM 1514 N LYS B 5 18.563 -1.888 8.804 1.00 0.00 N ATOM 1515 CA LYS B 5 17.930 -1.991 10.113 1.00 0.00 C ATOM 1516 C LYS B 5 16.438 -2.265 9.967 1.00 0.00 C ATOM 1517 O LYS B 5 15.638 -1.898 10.828 1.00 0.00 O ATOM 1518 CB LYS B 5 18.151 -0.710 10.918 1.00 0.00 C ATOM 1519 CG LYS B 5 18.382 -0.956 12.400 1.00 0.00 C ATOM 1520 CD LYS B 5 19.581 -1.863 12.632 1.00 0.00 C ATOM 1521 CE LYS B 5 19.172 -3.327 12.679 1.00 0.00 C ATOM 1522 NZ LYS B 5 19.856 -4.056 13.781 1.00 0.00 N ATOM 0 H LYS B 5 19.462 -2.364 8.732 1.00 0.00 H new ATOM 0 HA LYS B 5 18.387 -2.824 10.647 1.00 0.00 H new ATOM 0 HB2 LYS B 5 19.009 -0.177 10.509 1.00 0.00 H new ATOM 0 HB3 LYS B 5 17.284 -0.060 10.797 1.00 0.00 H new ATOM 0 HG2 LYS B 5 18.540 -0.005 12.908 1.00 0.00 H new ATOM 0 HG3 LYS B 5 17.492 -1.408 12.838 1.00 0.00 H new ATOM 0 HD2 LYS B 5 20.311 -1.713 11.836 1.00 0.00 H new ATOM 0 HD3 LYS B 5 20.069 -1.590 13.568 1.00 0.00 H new ATOM 0 HE2 LYS B 5 18.092 -3.399 12.811 1.00 0.00 H new ATOM 0 HE3 LYS B 5 19.409 -3.802 11.727 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 19.552 -5.050 13.781 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 20.886 -4.009 13.642 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 19.610 -3.619 14.692 1.00 0.00 H new ATOM 1536 N ALA B 6 16.075 -2.913 8.868 1.00 0.00 N ATOM 1537 CA ALA B 6 14.683 -3.245 8.594 1.00 0.00 C ATOM 1538 C ALA B 6 14.523 -4.734 8.318 1.00 0.00 C ATOM 1539 O ALA B 6 15.415 -5.530 8.608 1.00 0.00 O ATOM 1540 CB ALA B 6 14.169 -2.433 7.417 1.00 0.00 C ATOM 0 H ALA B 6 16.729 -3.221 8.148 1.00 0.00 H new ATOM 0 HA ALA B 6 14.094 -2.997 9.477 1.00 0.00 H new ATOM 0 HB1 ALA B 6 13.128 -2.691 7.224 1.00 0.00 H new ATOM 0 HB2 ALA B 6 14.242 -1.370 7.648 1.00 0.00 H new ATOM 0 HB3 ALA B 6 14.768 -2.654 6.533 1.00 0.00 H new ATOM 1546 N VAL B 7 13.379 -5.102 7.754 1.00 0.00 N ATOM 1547 CA VAL B 7 13.100 -6.495 7.436 1.00 0.00 C ATOM 1548 C VAL B 7 12.154 -6.608 6.247 1.00 0.00 C ATOM 1549 O VAL B 7 10.970 -6.906 6.409 1.00 0.00 O ATOM 1550 CB VAL B 7 12.483 -7.230 8.640 1.00 0.00 C ATOM 1551 CG1 VAL B 7 12.440 -8.728 8.386 1.00 0.00 C ATOM 1552 CG2 VAL B 7 13.259 -6.918 9.911 1.00 0.00 C ATOM 0 H VAL B 7 12.630 -4.455 7.508 1.00 0.00 H new ATOM 0 HA VAL B 7 14.053 -6.960 7.183 1.00 0.00 H new ATOM 0 HB VAL B 7 11.460 -6.879 8.772 1.00 0.00 H new ATOM 0 HG11 VAL B 7 12.001 -9.231 9.248 1.00 0.00 H new ATOM 0 HG12 VAL B 7 11.836 -8.930 7.501 1.00 0.00 H new ATOM 0 HG13 VAL B 7 13.452 -9.099 8.226 1.00 0.00 H new ATOM 0 HG21 VAL B 7 12.808 -7.446 10.751 1.00 0.00 H new ATOM 0 HG22 VAL B 7 14.294 -7.239 9.793 1.00 0.00 H new ATOM 0 HG23 VAL B 7 13.231 -5.845 10.100 1.00 0.00 H new ATOM 1562 N ILE B 8 12.682 -6.372 5.049 1.00 0.00 N ATOM 1563 CA ILE B 8 11.879 -6.452 3.837 1.00 0.00 C ATOM 1564 C ILE B 8 10.919 -7.638 3.906 1.00 0.00 C ATOM 1565 O ILE B 8 11.159 -8.606 4.629 1.00 0.00 O ATOM 1566 CB ILE B 8 12.777 -6.547 2.572 1.00 0.00 C ATOM 1567 CG1 ILE B 8 13.073 -5.145 2.037 1.00 0.00 C ATOM 1568 CG2 ILE B 8 12.135 -7.397 1.478 1.00 0.00 C ATOM 1569 CD1 ILE B 8 14.210 -4.450 2.753 1.00 0.00 C ATOM 0 H ILE B 8 13.659 -6.125 4.894 1.00 0.00 H new ATOM 0 HA ILE B 8 11.293 -5.536 3.763 1.00 0.00 H new ATOM 0 HB ILE B 8 13.708 -7.034 2.864 1.00 0.00 H new ATOM 0 HG12 ILE B 8 13.311 -5.213 0.976 1.00 0.00 H new ATOM 0 HG13 ILE B 8 12.174 -4.535 2.123 1.00 0.00 H new ATOM 0 HG21 ILE B 8 12.797 -7.436 0.613 1.00 0.00 H new ATOM 0 HG22 ILE B 8 11.967 -8.407 1.853 1.00 0.00 H new ATOM 0 HG23 ILE B 8 11.182 -6.956 1.186 1.00 0.00 H new ATOM 0 HD11 ILE B 8 14.362 -3.461 2.320 1.00 0.00 H new ATOM 0 HD12 ILE B 8 13.966 -4.349 3.811 1.00 0.00 H new ATOM 0 HD13 ILE B 8 15.121 -5.038 2.645 1.00 0.00 H new ATOM 1581 N LYS B 9 9.835 -7.552 3.145 1.00 0.00 N ATOM 1582 CA LYS B 9 8.834 -8.610 3.111 1.00 0.00 C ATOM 1583 C LYS B 9 8.124 -8.631 1.762 1.00 0.00 C ATOM 1584 O LYS B 9 7.357 -9.546 1.464 1.00 0.00 O ATOM 1585 CB LYS B 9 7.813 -8.419 4.236 1.00 0.00 C ATOM 1586 CG LYS B 9 8.316 -7.546 5.373 1.00 0.00 C ATOM 1587 CD LYS B 9 8.700 -8.379 6.584 1.00 0.00 C ATOM 1588 CE LYS B 9 8.566 -7.584 7.872 1.00 0.00 C ATOM 1589 NZ LYS B 9 7.238 -7.787 8.515 1.00 0.00 N ATOM 0 H LYS B 9 9.627 -6.757 2.541 1.00 0.00 H new ATOM 0 HA LYS B 9 9.341 -9.564 3.255 1.00 0.00 H new ATOM 0 HB2 LYS B 9 6.908 -7.975 3.822 1.00 0.00 H new ATOM 0 HB3 LYS B 9 7.537 -9.395 4.634 1.00 0.00 H new ATOM 0 HG2 LYS B 9 9.179 -6.970 5.037 1.00 0.00 H new ATOM 0 HG3 LYS B 9 7.544 -6.829 5.653 1.00 0.00 H new ATOM 0 HD2 LYS B 9 8.066 -9.264 6.634 1.00 0.00 H new ATOM 0 HD3 LYS B 9 9.727 -8.728 6.476 1.00 0.00 H new ATOM 0 HE2 LYS B 9 9.354 -7.880 8.565 1.00 0.00 H new ATOM 0 HE3 LYS B 9 8.709 -6.524 7.661 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 7.187 -7.228 9.390 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 6.487 -7.481 7.864 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 7.112 -8.794 8.740 1.00 0.00 H new ATOM 1603 N ASN B 10 8.390 -7.612 0.954 1.00 0.00 N ATOM 1604 CA ASN B 10 7.785 -7.499 -0.367 1.00 0.00 C ATOM 1605 C ASN B 10 8.534 -6.474 -1.210 1.00 0.00 C ATOM 1606 O ASN B 10 8.048 -5.366 -1.437 1.00 0.00 O ATOM 1607 CB ASN B 10 6.315 -7.099 -0.245 1.00 0.00 C ATOM 1608 CG ASN B 10 5.421 -7.879 -1.189 1.00 0.00 C ATOM 1609 OD1 ASN B 10 5.987 -8.335 -2.301 1.00 0.00 O flip ATOM 1610 ND2 ASN B 10 4.235 -8.072 -0.922 1.00 0.00 N flip ATOM 0 H ASN B 10 9.024 -6.849 1.192 1.00 0.00 H new ATOM 0 HA ASN B 10 7.848 -8.470 -0.858 1.00 0.00 H new ATOM 0 HB2 ASN B 10 5.982 -7.259 0.781 1.00 0.00 H new ATOM 0 HB3 ASN B 10 6.213 -6.033 -0.451 1.00 0.00 H new ATOM 0 HD21 ASN B 10 3.841 -7.704 -0.056 1.00 0.00 H new ATOM 0 HD22 ASN B 10 3.647 -8.600 -1.566 1.00 0.00 H new ATOM 1617 N ALA B 11 9.725 -6.848 -1.665 1.00 0.00 N ATOM 1618 CA ALA B 11 10.546 -5.956 -2.473 1.00 0.00 C ATOM 1619 C ALA B 11 10.794 -6.531 -3.862 1.00 0.00 C ATOM 1620 O ALA B 11 11.477 -7.545 -4.015 1.00 0.00 O ATOM 1621 CB ALA B 11 11.865 -5.681 -1.770 1.00 0.00 C ATOM 0 H ALA B 11 10.142 -7.762 -1.488 1.00 0.00 H new ATOM 0 HA ALA B 11 10.004 -5.018 -2.595 1.00 0.00 H new ATOM 0 HB1 ALA B 11 12.471 -5.013 -2.382 1.00 0.00 H new ATOM 0 HB2 ALA B 11 11.672 -5.213 -0.805 1.00 0.00 H new ATOM 0 HB3 ALA B 11 12.399 -6.619 -1.618 1.00 0.00 H new ATOM 1627 N ASP B 12 10.242 -5.871 -4.874 1.00 0.00 N ATOM 1628 CA ASP B 12 10.407 -6.305 -6.255 1.00 0.00 C ATOM 1629 C ASP B 12 11.208 -5.275 -7.043 1.00 0.00 C ATOM 1630 O ASP B 12 10.991 -5.083 -8.239 1.00 0.00 O ATOM 1631 CB ASP B 12 9.043 -6.523 -6.912 1.00 0.00 C ATOM 1632 CG ASP B 12 8.622 -7.980 -6.901 1.00 0.00 C ATOM 1633 OD1 ASP B 12 9.435 -8.837 -7.306 1.00 0.00 O ATOM 1634 OD2 ASP B 12 7.478 -8.264 -6.486 1.00 0.00 O ATOM 0 H ASP B 12 9.675 -5.031 -4.763 1.00 0.00 H new ATOM 0 HA ASP B 12 10.952 -7.249 -6.257 1.00 0.00 H new ATOM 0 HB2 ASP B 12 8.293 -5.927 -6.392 1.00 0.00 H new ATOM 0 HB3 ASP B 12 9.077 -6.165 -7.941 1.00 0.00 H new ATOM 1639 N MET B 13 12.133 -4.612 -6.358 1.00 0.00 N ATOM 1640 CA MET B 13 12.970 -3.593 -6.978 1.00 0.00 C ATOM 1641 C MET B 13 14.440 -4.011 -6.949 1.00 0.00 C ATOM 1642 O MET B 13 14.805 -4.987 -6.296 1.00 0.00 O ATOM 1643 CB MET B 13 12.762 -2.248 -6.260 1.00 0.00 C ATOM 1644 CG MET B 13 14.012 -1.388 -6.139 1.00 0.00 C ATOM 1645 SD MET B 13 14.258 -0.766 -4.465 1.00 0.00 S ATOM 1646 CE MET B 13 12.841 0.315 -4.289 1.00 0.00 C ATOM 0 H MET B 13 12.322 -4.764 -5.367 1.00 0.00 H new ATOM 0 HA MET B 13 12.681 -3.480 -8.023 1.00 0.00 H new ATOM 0 HB2 MET B 13 11.999 -1.682 -6.794 1.00 0.00 H new ATOM 0 HB3 MET B 13 12.374 -2.442 -5.260 1.00 0.00 H new ATOM 0 HG2 MET B 13 14.882 -1.972 -6.438 1.00 0.00 H new ATOM 0 HG3 MET B 13 13.940 -0.547 -6.829 1.00 0.00 H new ATOM 0 HE1 MET B 13 12.987 0.969 -3.430 1.00 0.00 H new ATOM 0 HE2 MET B 13 12.730 0.918 -5.190 1.00 0.00 H new ATOM 0 HE3 MET B 13 11.943 -0.284 -4.140 1.00 0.00 H new ATOM 1656 N SER B 14 15.278 -3.265 -7.664 1.00 0.00 N ATOM 1657 CA SER B 14 16.705 -3.559 -7.719 1.00 0.00 C ATOM 1658 C SER B 14 17.273 -3.758 -6.317 1.00 0.00 C ATOM 1659 O SER B 14 17.062 -2.933 -5.428 1.00 0.00 O ATOM 1660 CB SER B 14 17.455 -2.430 -8.431 1.00 0.00 C ATOM 1661 OG SER B 14 18.442 -1.863 -7.589 1.00 0.00 O ATOM 0 H SER B 14 14.993 -2.454 -8.212 1.00 0.00 H new ATOM 0 HA SER B 14 16.838 -4.483 -8.281 1.00 0.00 H new ATOM 0 HB2 SER B 14 17.923 -2.815 -9.337 1.00 0.00 H new ATOM 0 HB3 SER B 14 16.749 -1.659 -8.740 1.00 0.00 H new ATOM 0 HG SER B 14 19.105 -1.390 -8.134 1.00 0.00 H new ATOM 1667 N GLU B 15 17.993 -4.860 -6.127 1.00 0.00 N ATOM 1668 CA GLU B 15 18.589 -5.172 -4.833 1.00 0.00 C ATOM 1669 C GLU B 15 19.115 -3.911 -4.154 1.00 0.00 C ATOM 1670 O GLU B 15 18.557 -3.451 -3.158 1.00 0.00 O ATOM 1671 CB GLU B 15 19.727 -6.179 -5.005 1.00 0.00 C ATOM 1672 CG GLU B 15 19.271 -7.528 -5.536 1.00 0.00 C ATOM 1673 CD GLU B 15 20.416 -8.512 -5.680 1.00 0.00 C ATOM 1674 OE1 GLU B 15 21.080 -8.499 -6.737 1.00 0.00 O ATOM 1675 OE2 GLU B 15 20.647 -9.295 -4.736 1.00 0.00 O ATOM 0 H GLU B 15 18.178 -5.552 -6.854 1.00 0.00 H new ATOM 0 HA GLU B 15 17.814 -5.607 -4.201 1.00 0.00 H new ATOM 0 HB2 GLU B 15 20.470 -5.762 -5.685 1.00 0.00 H new ATOM 0 HB3 GLU B 15 20.221 -6.324 -4.044 1.00 0.00 H new ATOM 0 HG2 GLU B 15 18.520 -7.945 -4.864 1.00 0.00 H new ATOM 0 HG3 GLU B 15 18.791 -7.390 -6.505 1.00 0.00 H new ATOM 1682 N GLU B 16 20.193 -3.358 -4.701 1.00 0.00 N ATOM 1683 CA GLU B 16 20.797 -2.150 -4.149 1.00 0.00 C ATOM 1684 C GLU B 16 19.741 -1.081 -3.896 1.00 0.00 C ATOM 1685 O GLU B 16 19.860 -0.282 -2.967 1.00 0.00 O ATOM 1686 CB GLU B 16 21.866 -1.611 -5.101 1.00 0.00 C ATOM 1687 CG GLU B 16 22.756 -2.693 -5.692 1.00 0.00 C ATOM 1688 CD GLU B 16 24.082 -2.818 -4.965 1.00 0.00 C ATOM 1689 OE1 GLU B 16 24.542 -1.810 -4.392 1.00 0.00 O ATOM 1690 OE2 GLU B 16 24.658 -3.927 -4.969 1.00 0.00 O ATOM 0 H GLU B 16 20.666 -3.727 -5.526 1.00 0.00 H new ATOM 0 HA GLU B 16 21.262 -2.408 -3.198 1.00 0.00 H new ATOM 0 HB2 GLU B 16 21.379 -1.070 -5.912 1.00 0.00 H new ATOM 0 HB3 GLU B 16 22.488 -0.893 -4.567 1.00 0.00 H new ATOM 0 HG2 GLU B 16 22.234 -3.649 -5.654 1.00 0.00 H new ATOM 0 HG3 GLU B 16 22.941 -2.472 -6.743 1.00 0.00 H new ATOM 1697 N MET B 17 18.707 -1.074 -4.730 1.00 0.00 N ATOM 1698 CA MET B 17 17.626 -0.105 -4.601 1.00 0.00 C ATOM 1699 C MET B 17 16.790 -0.389 -3.358 1.00 0.00 C ATOM 1700 O MET B 17 16.355 0.532 -2.666 1.00 0.00 O ATOM 1701 CB MET B 17 16.741 -0.137 -5.849 1.00 0.00 C ATOM 1702 CG MET B 17 17.249 0.745 -6.976 1.00 0.00 C ATOM 1703 SD MET B 17 16.073 2.033 -7.432 1.00 0.00 S ATOM 1704 CE MET B 17 15.598 2.639 -5.814 1.00 0.00 C ATOM 0 H MET B 17 18.595 -1.730 -5.503 1.00 0.00 H new ATOM 0 HA MET B 17 18.064 0.888 -4.500 1.00 0.00 H new ATOM 0 HB2 MET B 17 16.669 -1.164 -6.207 1.00 0.00 H new ATOM 0 HB3 MET B 17 15.733 0.178 -5.578 1.00 0.00 H new ATOM 0 HG2 MET B 17 18.189 1.207 -6.675 1.00 0.00 H new ATOM 0 HG3 MET B 17 17.462 0.127 -7.848 1.00 0.00 H new ATOM 0 HE1 MET B 17 15.492 3.723 -5.848 1.00 0.00 H new ATOM 0 HE2 MET B 17 14.648 2.191 -5.522 1.00 0.00 H new ATOM 0 HE3 MET B 17 16.364 2.372 -5.086 1.00 0.00 H new ATOM 1714 N GLN B 18 16.569 -1.670 -3.079 1.00 0.00 N ATOM 1715 CA GLN B 18 15.786 -2.074 -1.917 1.00 0.00 C ATOM 1716 C GLN B 18 16.517 -1.726 -0.626 1.00 0.00 C ATOM 1717 O GLN B 18 15.903 -1.299 0.354 1.00 0.00 O ATOM 1718 CB GLN B 18 15.492 -3.576 -1.959 1.00 0.00 C ATOM 1719 CG GLN B 18 15.964 -4.260 -3.233 1.00 0.00 C ATOM 1720 CD GLN B 18 14.937 -5.227 -3.791 1.00 0.00 C ATOM 1721 OE1 GLN B 18 13.754 -4.714 -4.106 1.00 0.00 O flip ATOM 1722 NE2 GLN B 18 15.204 -6.419 -3.934 1.00 0.00 N flip ATOM 0 H GLN B 18 16.921 -2.445 -3.641 1.00 0.00 H new ATOM 0 HA GLN B 18 14.842 -1.530 -1.943 1.00 0.00 H new ATOM 0 HB2 GLN B 18 15.969 -4.054 -1.103 1.00 0.00 H new ATOM 0 HB3 GLN B 18 14.418 -3.729 -1.852 1.00 0.00 H new ATOM 0 HG2 GLN B 18 16.191 -3.504 -3.984 1.00 0.00 H new ATOM 0 HG3 GLN B 18 16.891 -4.797 -3.031 1.00 0.00 H new ATOM 0 HE21 GLN B 18 16.127 -6.769 -3.678 1.00 0.00 H new ATOM 0 HE22 GLN B 18 14.502 -7.057 -4.308 1.00 0.00 H new ATOM 1731 N GLN B 19 17.833 -1.899 -0.637 1.00 0.00 N ATOM 1732 CA GLN B 19 18.650 -1.593 0.526 1.00 0.00 C ATOM 1733 C GLN B 19 18.780 -0.087 0.681 1.00 0.00 C ATOM 1734 O GLN B 19 18.797 0.438 1.795 1.00 0.00 O ATOM 1735 CB GLN B 19 20.033 -2.231 0.391 1.00 0.00 C ATOM 1736 CG GLN B 19 19.993 -3.744 0.245 1.00 0.00 C ATOM 1737 CD GLN B 19 19.307 -4.424 1.412 1.00 0.00 C ATOM 1738 OE1 GLN B 19 18.323 -3.915 1.951 1.00 0.00 O ATOM 1739 NE2 GLN B 19 19.822 -5.580 1.810 1.00 0.00 N ATOM 0 H GLN B 19 18.356 -2.250 -1.440 1.00 0.00 H new ATOM 0 HA GLN B 19 18.167 -2.003 1.413 1.00 0.00 H new ATOM 0 HB2 GLN B 19 20.538 -1.804 -0.475 1.00 0.00 H new ATOM 0 HB3 GLN B 19 20.630 -1.974 1.266 1.00 0.00 H new ATOM 0 HG2 GLN B 19 19.474 -4.003 -0.678 1.00 0.00 H new ATOM 0 HG3 GLN B 19 21.011 -4.124 0.155 1.00 0.00 H new ATOM 0 HE21 GLN B 19 20.638 -5.965 1.335 1.00 0.00 H new ATOM 0 HE22 GLN B 19 19.402 -6.084 2.591 1.00 0.00 H new ATOM 1748 N ASP B 20 18.854 0.604 -0.450 1.00 0.00 N ATOM 1749 CA ASP B 20 18.963 2.050 -0.448 1.00 0.00 C ATOM 1750 C ASP B 20 17.632 2.667 -0.042 1.00 0.00 C ATOM 1751 O ASP B 20 17.587 3.736 0.568 1.00 0.00 O ATOM 1752 CB ASP B 20 19.385 2.563 -1.827 1.00 0.00 C ATOM 1753 CG ASP B 20 20.884 2.761 -1.936 1.00 0.00 C ATOM 1754 OD1 ASP B 20 21.599 1.763 -2.160 1.00 0.00 O ATOM 1755 OD2 ASP B 20 21.341 3.915 -1.798 1.00 0.00 O ATOM 0 H ASP B 20 18.840 0.182 -1.379 1.00 0.00 H new ATOM 0 HA ASP B 20 19.727 2.341 0.273 1.00 0.00 H new ATOM 0 HB2 ASP B 20 19.058 1.857 -2.590 1.00 0.00 H new ATOM 0 HB3 ASP B 20 18.881 3.508 -2.030 1.00 0.00 H new ATOM 1760 N SER B 21 16.547 1.973 -0.380 1.00 0.00 N ATOM 1761 CA SER B 21 15.208 2.436 -0.047 1.00 0.00 C ATOM 1762 C SER B 21 14.985 2.369 1.458 1.00 0.00 C ATOM 1763 O SER B 21 14.423 3.286 2.054 1.00 0.00 O ATOM 1764 CB SER B 21 14.156 1.596 -0.772 1.00 0.00 C ATOM 1765 OG SER B 21 13.492 0.723 0.125 1.00 0.00 O ATOM 0 H SER B 21 16.573 1.087 -0.885 1.00 0.00 H new ATOM 0 HA SER B 21 15.111 3.472 -0.371 1.00 0.00 H new ATOM 0 HB2 SER B 21 13.429 2.252 -1.250 1.00 0.00 H new ATOM 0 HB3 SER B 21 14.631 1.016 -1.563 1.00 0.00 H new ATOM 0 HG SER B 21 12.794 1.216 0.605 1.00 0.00 H new ATOM 1771 N VAL B 22 15.439 1.278 2.068 1.00 0.00 N ATOM 1772 CA VAL B 22 15.298 1.102 3.506 1.00 0.00 C ATOM 1773 C VAL B 22 16.150 2.119 4.252 1.00 0.00 C ATOM 1774 O VAL B 22 15.740 2.653 5.282 1.00 0.00 O ATOM 1775 CB VAL B 22 15.699 -0.316 3.950 1.00 0.00 C ATOM 1776 CG1 VAL B 22 15.281 -0.561 5.392 1.00 0.00 C ATOM 1777 CG2 VAL B 22 15.089 -1.358 3.026 1.00 0.00 C ATOM 0 H VAL B 22 15.905 0.507 1.590 1.00 0.00 H new ATOM 0 HA VAL B 22 14.246 1.254 3.746 1.00 0.00 H new ATOM 0 HB VAL B 22 16.784 -0.403 3.890 1.00 0.00 H new ATOM 0 HG11 VAL B 22 15.572 -1.568 5.689 1.00 0.00 H new ATOM 0 HG12 VAL B 22 15.771 0.165 6.041 1.00 0.00 H new ATOM 0 HG13 VAL B 22 14.200 -0.455 5.480 1.00 0.00 H new ATOM 0 HG21 VAL B 22 15.384 -2.354 3.356 1.00 0.00 H new ATOM 0 HG22 VAL B 22 14.002 -1.274 3.050 1.00 0.00 H new ATOM 0 HG23 VAL B 22 15.443 -1.193 2.008 1.00 0.00 H new ATOM 1787 N GLU B 23 17.337 2.394 3.716 1.00 0.00 N ATOM 1788 CA GLU B 23 18.239 3.360 4.325 1.00 0.00 C ATOM 1789 C GLU B 23 17.611 4.745 4.306 1.00 0.00 C ATOM 1790 O GLU B 23 17.726 5.505 5.267 1.00 0.00 O ATOM 1791 CB GLU B 23 19.581 3.381 3.590 1.00 0.00 C ATOM 1792 CG GLU B 23 20.306 2.045 3.608 1.00 0.00 C ATOM 1793 CD GLU B 23 21.807 2.196 3.455 1.00 0.00 C ATOM 1794 OE1 GLU B 23 22.251 2.655 2.382 1.00 0.00 O ATOM 1795 OE2 GLU B 23 22.539 1.856 4.408 1.00 0.00 O ATOM 0 H GLU B 23 17.693 1.961 2.864 1.00 0.00 H new ATOM 0 HA GLU B 23 18.416 3.064 5.359 1.00 0.00 H new ATOM 0 HB2 GLU B 23 19.414 3.680 2.555 1.00 0.00 H new ATOM 0 HB3 GLU B 23 20.221 4.138 4.042 1.00 0.00 H new ATOM 0 HG2 GLU B 23 20.090 1.531 4.544 1.00 0.00 H new ATOM 0 HG3 GLU B 23 19.923 1.417 2.803 1.00 0.00 H new ATOM 1802 N CYS B 24 16.931 5.061 3.208 1.00 0.00 N ATOM 1803 CA CYS B 24 16.268 6.350 3.072 1.00 0.00 C ATOM 1804 C CYS B 24 15.092 6.432 4.034 1.00 0.00 C ATOM 1805 O CYS B 24 14.799 7.491 4.593 1.00 0.00 O ATOM 1806 CB CYS B 24 15.785 6.557 1.634 1.00 0.00 C ATOM 1807 SG CYS B 24 17.114 6.612 0.410 1.00 0.00 S ATOM 0 H CYS B 24 16.826 4.443 2.403 1.00 0.00 H new ATOM 0 HA CYS B 24 16.983 7.137 3.313 1.00 0.00 H new ATOM 0 HB2 CYS B 24 15.098 5.752 1.373 1.00 0.00 H new ATOM 0 HB3 CYS B 24 15.219 7.487 1.582 1.00 0.00 H new ATOM 0 HG CYS B 24 17.543 5.406 0.181 1.00 0.00 H new ATOM 1813 N ALA B 25 14.442 5.292 4.252 1.00 0.00 N ATOM 1814 CA ALA B 25 13.322 5.226 5.173 1.00 0.00 C ATOM 1815 C ALA B 25 13.858 5.315 6.583 1.00 0.00 C ATOM 1816 O ALA B 25 13.240 5.902 7.472 1.00 0.00 O ATOM 1817 CB ALA B 25 12.532 3.941 4.974 1.00 0.00 C ATOM 0 H ALA B 25 14.674 4.406 3.803 1.00 0.00 H new ATOM 0 HA ALA B 25 12.641 6.056 4.985 1.00 0.00 H new ATOM 0 HB1 ALA B 25 11.698 3.914 5.675 1.00 0.00 H new ATOM 0 HB2 ALA B 25 12.150 3.903 3.954 1.00 0.00 H new ATOM 0 HB3 ALA B 25 13.182 3.084 5.150 1.00 0.00 H new ATOM 1823 N THR B 26 15.043 4.748 6.760 1.00 0.00 N ATOM 1824 CA THR B 26 15.722 4.767 8.036 1.00 0.00 C ATOM 1825 C THR B 26 16.201 6.182 8.330 1.00 0.00 C ATOM 1826 O THR B 26 16.133 6.652 9.465 1.00 0.00 O ATOM 1827 CB THR B 26 16.903 3.805 8.016 1.00 0.00 C ATOM 1828 OG1 THR B 26 16.459 2.465 7.888 1.00 0.00 O ATOM 1829 CG2 THR B 26 17.756 3.889 9.256 1.00 0.00 C ATOM 0 H THR B 26 15.555 4.265 6.022 1.00 0.00 H new ATOM 0 HA THR B 26 15.032 4.450 8.818 1.00 0.00 H new ATOM 0 HB THR B 26 17.505 4.102 7.157 1.00 0.00 H new ATOM 0 HG1 THR B 26 16.214 2.289 6.956 1.00 0.00 H new ATOM 0 HG21 THR B 26 18.580 3.179 9.180 1.00 0.00 H new ATOM 0 HG22 THR B 26 18.155 4.899 9.356 1.00 0.00 H new ATOM 0 HG23 THR B 26 17.151 3.650 10.131 1.00 0.00 H new ATOM 1837 N GLN B 27 16.664 6.862 7.284 1.00 0.00 N ATOM 1838 CA GLN B 27 17.131 8.234 7.415 1.00 0.00 C ATOM 1839 C GLN B 27 16.005 9.100 7.957 1.00 0.00 C ATOM 1840 O GLN B 27 16.213 9.937 8.834 1.00 0.00 O ATOM 1841 CB GLN B 27 17.608 8.769 6.063 1.00 0.00 C ATOM 1842 CG GLN B 27 19.087 8.534 5.801 1.00 0.00 C ATOM 1843 CD GLN B 27 19.560 9.173 4.511 1.00 0.00 C ATOM 1844 OE1 GLN B 27 18.619 9.669 3.717 1.00 0.00 O flip ATOM 1845 NE2 GLN B 27 20.758 9.219 4.230 1.00 0.00 N flip ATOM 0 H GLN B 27 16.725 6.483 6.339 1.00 0.00 H new ATOM 0 HA GLN B 27 17.972 8.260 8.107 1.00 0.00 H new ATOM 0 HB2 GLN B 27 17.028 8.297 5.270 1.00 0.00 H new ATOM 0 HB3 GLN B 27 17.405 9.839 6.013 1.00 0.00 H new ATOM 0 HG2 GLN B 27 19.667 8.932 6.633 1.00 0.00 H new ATOM 0 HG3 GLN B 27 19.279 7.462 5.763 1.00 0.00 H new ATOM 0 HE21 GLN B 27 21.447 8.825 4.870 1.00 0.00 H new ATOM 0 HE22 GLN B 27 21.061 9.651 3.357 1.00 0.00 H new ATOM 1854 N ALA B 28 14.805 8.868 7.437 1.00 0.00 N ATOM 1855 CA ALA B 28 13.627 9.603 7.877 1.00 0.00 C ATOM 1856 C ALA B 28 13.284 9.232 9.314 1.00 0.00 C ATOM 1857 O ALA B 28 12.839 10.069 10.098 1.00 0.00 O ATOM 1858 CB ALA B 28 12.447 9.306 6.964 1.00 0.00 C ATOM 0 H ALA B 28 14.623 8.176 6.710 1.00 0.00 H new ATOM 0 HA ALA B 28 13.844 10.670 7.830 1.00 0.00 H new ATOM 0 HB1 ALA B 28 11.574 9.862 7.305 1.00 0.00 H new ATOM 0 HB2 ALA B 28 12.692 9.604 5.945 1.00 0.00 H new ATOM 0 HB3 ALA B 28 12.229 8.238 6.987 1.00 0.00 H new ATOM 1864 N LEU B 29 13.500 7.964 9.648 1.00 0.00 N ATOM 1865 CA LEU B 29 13.221 7.464 10.986 1.00 0.00 C ATOM 1866 C LEU B 29 14.118 8.143 12.016 1.00 0.00 C ATOM 1867 O LEU B 29 13.684 8.456 13.125 1.00 0.00 O ATOM 1868 CB LEU B 29 13.425 5.951 11.038 1.00 0.00 C ATOM 1869 CG LEU B 29 12.331 5.133 10.357 1.00 0.00 C ATOM 1870 CD1 LEU B 29 12.944 4.135 9.393 1.00 0.00 C ATOM 1871 CD2 LEU B 29 11.474 4.424 11.392 1.00 0.00 C ATOM 0 H LEU B 29 13.869 7.262 9.006 1.00 0.00 H new ATOM 0 HA LEU B 29 12.183 7.693 11.225 1.00 0.00 H new ATOM 0 HB2 LEU B 29 14.381 5.711 10.573 1.00 0.00 H new ATOM 0 HB3 LEU B 29 13.493 5.643 12.082 1.00 0.00 H new ATOM 0 HG LEU B 29 11.691 5.810 9.791 1.00 0.00 H new ATOM 0 HD11 LEU B 29 12.153 3.558 8.914 1.00 0.00 H new ATOM 0 HD12 LEU B 29 13.516 4.667 8.633 1.00 0.00 H new ATOM 0 HD13 LEU B 29 13.605 3.461 9.938 1.00 0.00 H new ATOM 0 HD21 LEU B 29 10.699 3.846 10.888 1.00 0.00 H new ATOM 0 HD22 LEU B 29 12.098 3.756 11.985 1.00 0.00 H new ATOM 0 HD23 LEU B 29 11.009 5.161 12.046 1.00 0.00 H new ATOM 1883 N GLU B 30 15.373 8.364 11.639 1.00 0.00 N ATOM 1884 CA GLU B 30 16.340 9.001 12.522 1.00 0.00 C ATOM 1885 C GLU B 30 16.094 10.505 12.616 1.00 0.00 C ATOM 1886 O GLU B 30 16.372 11.124 13.643 1.00 0.00 O ATOM 1887 CB GLU B 30 17.763 8.736 12.025 1.00 0.00 C ATOM 1888 CG GLU B 30 18.660 8.091 13.066 1.00 0.00 C ATOM 1889 CD GLU B 30 19.765 9.017 13.536 1.00 0.00 C ATOM 1890 OE1 GLU B 30 19.608 10.248 13.392 1.00 0.00 O ATOM 1891 OE2 GLU B 30 20.787 8.512 14.047 1.00 0.00 O ATOM 0 H GLU B 30 15.744 8.110 10.724 1.00 0.00 H new ATOM 0 HA GLU B 30 16.220 8.573 13.517 1.00 0.00 H new ATOM 0 HB2 GLU B 30 17.718 8.092 11.147 1.00 0.00 H new ATOM 0 HB3 GLU B 30 18.209 9.678 11.707 1.00 0.00 H new ATOM 0 HG2 GLU B 30 18.057 7.787 13.922 1.00 0.00 H new ATOM 0 HG3 GLU B 30 19.102 7.186 12.649 1.00 0.00 H new ATOM 1898 N LYS B 31 15.576 11.087 11.539 1.00 0.00 N ATOM 1899 CA LYS B 31 15.298 12.519 11.505 1.00 0.00 C ATOM 1900 C LYS B 31 13.951 12.827 12.153 1.00 0.00 C ATOM 1901 O LYS B 31 13.753 13.906 12.712 1.00 0.00 O ATOM 1902 CB LYS B 31 15.315 13.029 10.061 1.00 0.00 C ATOM 1903 CG LYS B 31 16.706 13.368 9.553 1.00 0.00 C ATOM 1904 CD LYS B 31 16.937 12.822 8.153 1.00 0.00 C ATOM 1905 CE LYS B 31 18.045 13.577 7.435 1.00 0.00 C ATOM 1906 NZ LYS B 31 19.127 12.667 6.970 1.00 0.00 N ATOM 0 H LYS B 31 15.341 10.590 10.680 1.00 0.00 H new ATOM 0 HA LYS B 31 16.077 13.030 12.071 1.00 0.00 H new ATOM 0 HB2 LYS B 31 14.874 12.272 9.412 1.00 0.00 H new ATOM 0 HB3 LYS B 31 14.685 13.916 9.990 1.00 0.00 H new ATOM 0 HG2 LYS B 31 16.839 14.450 9.549 1.00 0.00 H new ATOM 0 HG3 LYS B 31 17.453 12.957 10.233 1.00 0.00 H new ATOM 0 HD2 LYS B 31 17.195 11.765 8.212 1.00 0.00 H new ATOM 0 HD3 LYS B 31 16.014 12.893 7.577 1.00 0.00 H new ATOM 0 HE2 LYS B 31 17.627 14.109 6.581 1.00 0.00 H new ATOM 0 HE3 LYS B 31 18.465 14.328 8.104 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 19.862 13.221 6.486 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 19.544 12.177 7.787 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 18.732 11.966 6.311 1.00 0.00 H new ATOM 1920 N TYR B 32 13.032 11.872 12.076 1.00 0.00 N ATOM 1921 CA TYR B 32 11.704 12.037 12.657 1.00 0.00 C ATOM 1922 C TYR B 32 11.142 10.692 13.103 1.00 0.00 C ATOM 1923 O TYR B 32 11.695 9.641 12.781 1.00 0.00 O ATOM 1924 CB TYR B 32 10.755 12.694 11.651 1.00 0.00 C ATOM 1925 CG TYR B 32 11.438 13.174 10.389 1.00 0.00 C ATOM 1926 CD1 TYR B 32 11.674 12.303 9.333 1.00 0.00 C ATOM 1927 CD2 TYR B 32 11.849 14.495 10.255 1.00 0.00 C ATOM 1928 CE1 TYR B 32 12.299 12.735 8.179 1.00 0.00 C ATOM 1929 CE2 TYR B 32 12.474 14.934 9.104 1.00 0.00 C ATOM 1930 CZ TYR B 32 12.697 14.049 8.069 1.00 0.00 C ATOM 1931 OH TYR B 32 13.320 14.481 6.921 1.00 0.00 O ATOM 0 H TYR B 32 13.182 10.974 11.616 1.00 0.00 H new ATOM 0 HA TYR B 32 11.793 12.685 13.529 1.00 0.00 H new ATOM 0 HB2 TYR B 32 9.976 11.981 11.382 1.00 0.00 H new ATOM 0 HB3 TYR B 32 10.262 13.540 12.130 1.00 0.00 H new ATOM 0 HD1 TYR B 32 11.364 11.272 9.415 1.00 0.00 H new ATOM 0 HD2 TYR B 32 11.677 15.190 11.064 1.00 0.00 H new ATOM 0 HE1 TYR B 32 12.475 12.045 7.367 1.00 0.00 H new ATOM 0 HE2 TYR B 32 12.786 15.964 9.015 1.00 0.00 H new ATOM 0 HH TYR B 32 13.535 15.433 7.004 1.00 0.00 H new ATOM 1941 N ASN B 33 10.042 10.732 13.849 1.00 0.00 N ATOM 1942 CA ASN B 33 9.408 9.514 14.340 1.00 0.00 C ATOM 1943 C ASN B 33 7.918 9.502 14.018 1.00 0.00 C ATOM 1944 O ASN B 33 7.118 8.927 14.754 1.00 0.00 O ATOM 1945 CB ASN B 33 9.617 9.381 15.850 1.00 0.00 C ATOM 1946 CG ASN B 33 9.548 7.941 16.320 1.00 0.00 C ATOM 1947 OD1 ASN B 33 10.364 7.109 15.926 1.00 0.00 O ATOM 1948 ND2 ASN B 33 8.569 7.641 17.165 1.00 0.00 N ATOM 0 H ASN B 33 9.572 11.594 14.126 1.00 0.00 H new ATOM 0 HA ASN B 33 9.873 8.666 13.837 1.00 0.00 H new ATOM 0 HB2 ASN B 33 10.586 9.801 16.118 1.00 0.00 H new ATOM 0 HB3 ASN B 33 8.860 9.967 16.372 1.00 0.00 H new ATOM 0 HD21 ASN B 33 8.471 6.688 17.514 1.00 0.00 H new ATOM 0 HD22 ASN B 33 7.915 8.364 17.465 1.00 0.00 H new ATOM 1955 N ILE B 34 7.553 10.141 12.912 1.00 0.00 N ATOM 1956 CA ILE B 34 6.160 10.206 12.486 1.00 0.00 C ATOM 1957 C ILE B 34 5.964 9.506 11.147 1.00 0.00 C ATOM 1958 O ILE B 34 6.362 10.028 10.108 1.00 0.00 O ATOM 1959 CB ILE B 34 5.686 11.666 12.353 1.00 0.00 C ATOM 1960 CG1 ILE B 34 6.442 12.567 13.328 1.00 0.00 C ATOM 1961 CG2 ILE B 34 4.185 11.762 12.583 1.00 0.00 C ATOM 1962 CD1 ILE B 34 6.399 12.079 14.756 1.00 0.00 C ATOM 0 H ILE B 34 8.205 10.623 12.293 1.00 0.00 H new ATOM 0 HA ILE B 34 5.570 9.702 13.251 1.00 0.00 H new ATOM 0 HB ILE B 34 5.899 12.007 11.340 1.00 0.00 H new ATOM 0 HG12 ILE B 34 7.482 12.642 13.009 1.00 0.00 H new ATOM 0 HG13 ILE B 34 6.021 13.572 13.283 1.00 0.00 H new ATOM 0 HG21 ILE B 34 3.868 12.800 12.485 1.00 0.00 H new ATOM 0 HG22 ILE B 34 3.664 11.152 11.845 1.00 0.00 H new ATOM 0 HG23 ILE B 34 3.947 11.402 13.584 1.00 0.00 H new ATOM 0 HD11 ILE B 34 6.956 12.767 15.392 1.00 0.00 H new ATOM 0 HD12 ILE B 34 5.364 12.031 15.093 1.00 0.00 H new ATOM 0 HD13 ILE B 34 6.847 11.087 14.815 1.00 0.00 H new ATOM 1974 N GLU B 35 5.350 8.326 11.177 1.00 0.00 N ATOM 1975 CA GLU B 35 5.106 7.561 9.958 1.00 0.00 C ATOM 1976 C GLU B 35 4.938 8.493 8.762 1.00 0.00 C ATOM 1977 O GLU B 35 5.805 8.563 7.892 1.00 0.00 O ATOM 1978 CB GLU B 35 3.862 6.686 10.118 1.00 0.00 C ATOM 1979 CG GLU B 35 3.600 6.263 11.554 1.00 0.00 C ATOM 1980 CD GLU B 35 2.571 7.140 12.240 1.00 0.00 C ATOM 1981 OE1 GLU B 35 2.833 8.351 12.397 1.00 0.00 O ATOM 1982 OE2 GLU B 35 1.503 6.615 12.621 1.00 0.00 O ATOM 0 H GLU B 35 5.013 7.880 12.030 1.00 0.00 H new ATOM 0 HA GLU B 35 5.969 6.919 9.780 1.00 0.00 H new ATOM 0 HB2 GLU B 35 2.994 7.229 9.743 1.00 0.00 H new ATOM 0 HB3 GLU B 35 3.972 5.795 9.499 1.00 0.00 H new ATOM 0 HG2 GLU B 35 3.258 5.228 11.568 1.00 0.00 H new ATOM 0 HG3 GLU B 35 4.534 6.297 12.115 1.00 0.00 H new ATOM 1989 N LYS B 36 3.823 9.216 8.732 1.00 0.00 N ATOM 1990 CA LYS B 36 3.552 10.152 7.649 1.00 0.00 C ATOM 1991 C LYS B 36 4.798 10.968 7.321 1.00 0.00 C ATOM 1992 O LYS B 36 5.136 11.162 6.154 1.00 0.00 O ATOM 1993 CB LYS B 36 2.400 11.087 8.028 1.00 0.00 C ATOM 1994 CG LYS B 36 2.088 11.097 9.516 1.00 0.00 C ATOM 1995 CD LYS B 36 1.659 12.478 9.985 1.00 0.00 C ATOM 1996 CE LYS B 36 0.280 12.843 9.457 1.00 0.00 C ATOM 1997 NZ LYS B 36 -0.736 12.896 10.545 1.00 0.00 N ATOM 0 H LYS B 36 3.094 9.171 9.444 1.00 0.00 H new ATOM 0 HA LYS B 36 3.267 9.580 6.766 1.00 0.00 H new ATOM 0 HB2 LYS B 36 2.646 12.100 7.710 1.00 0.00 H new ATOM 0 HB3 LYS B 36 1.506 10.789 7.480 1.00 0.00 H new ATOM 0 HG2 LYS B 36 1.297 10.377 9.728 1.00 0.00 H new ATOM 0 HG3 LYS B 36 2.967 10.778 10.076 1.00 0.00 H new ATOM 0 HD2 LYS B 36 1.652 12.507 11.075 1.00 0.00 H new ATOM 0 HD3 LYS B 36 2.385 13.219 9.651 1.00 0.00 H new ATOM 0 HE2 LYS B 36 0.327 13.810 8.957 1.00 0.00 H new ATOM 0 HE3 LYS B 36 -0.027 12.112 8.709 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 -1.662 13.148 10.144 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 -0.800 11.966 11.006 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 -0.457 13.611 11.246 1.00 0.00 H new ATOM 2011 N ASP B 37 5.481 11.437 8.361 1.00 0.00 N ATOM 2012 CA ASP B 37 6.695 12.225 8.181 1.00 0.00 C ATOM 2013 C ASP B 37 7.781 11.386 7.520 1.00 0.00 C ATOM 2014 O ASP B 37 8.266 11.719 6.439 1.00 0.00 O ATOM 2015 CB ASP B 37 7.189 12.755 9.529 1.00 0.00 C ATOM 2016 CG ASP B 37 6.971 14.248 9.679 1.00 0.00 C ATOM 2017 OD1 ASP B 37 5.821 14.702 9.498 1.00 0.00 O ATOM 2018 OD2 ASP B 37 7.950 14.964 9.975 1.00 0.00 O ATOM 0 H ASP B 37 5.215 11.286 9.334 1.00 0.00 H new ATOM 0 HA ASP B 37 6.464 13.071 7.533 1.00 0.00 H new ATOM 0 HB2 ASP B 37 6.671 12.233 10.333 1.00 0.00 H new ATOM 0 HB3 ASP B 37 8.251 12.533 9.636 1.00 0.00 H new ATOM 2023 N ILE B 38 8.152 10.292 8.176 1.00 0.00 N ATOM 2024 CA ILE B 38 9.173 9.395 7.653 1.00 0.00 C ATOM 2025 C ILE B 38 8.940 9.120 6.173 1.00 0.00 C ATOM 2026 O ILE B 38 9.833 9.316 5.346 1.00 0.00 O ATOM 2027 CB ILE B 38 9.193 8.059 8.420 1.00 0.00 C ATOM 2028 CG1 ILE B 38 8.791 8.277 9.880 1.00 0.00 C ATOM 2029 CG2 ILE B 38 10.572 7.421 8.335 1.00 0.00 C ATOM 2030 CD1 ILE B 38 8.218 7.043 10.541 1.00 0.00 C ATOM 0 H ILE B 38 7.759 10.006 9.073 1.00 0.00 H new ATOM 0 HA ILE B 38 10.136 9.889 7.784 1.00 0.00 H new ATOM 0 HB ILE B 38 8.471 7.383 7.961 1.00 0.00 H new ATOM 0 HG12 ILE B 38 9.664 8.608 10.443 1.00 0.00 H new ATOM 0 HG13 ILE B 38 8.056 9.080 9.930 1.00 0.00 H new ATOM 0 HG21 ILE B 38 10.571 6.478 8.881 1.00 0.00 H new ATOM 0 HG22 ILE B 38 10.823 7.235 7.291 1.00 0.00 H new ATOM 0 HG23 ILE B 38 11.311 8.093 8.772 1.00 0.00 H new ATOM 0 HD11 ILE B 38 7.956 7.272 11.574 1.00 0.00 H new ATOM 0 HD12 ILE B 38 7.326 6.723 10.002 1.00 0.00 H new ATOM 0 HD13 ILE B 38 8.959 6.244 10.524 1.00 0.00 H new ATOM 2042 N ALA B 39 7.733 8.674 5.843 1.00 0.00 N ATOM 2043 CA ALA B 39 7.379 8.384 4.461 1.00 0.00 C ATOM 2044 C ALA B 39 7.749 9.555 3.559 1.00 0.00 C ATOM 2045 O ALA B 39 8.393 9.379 2.526 1.00 0.00 O ATOM 2046 CB ALA B 39 5.895 8.073 4.345 1.00 0.00 C ATOM 0 H ALA B 39 6.984 8.506 6.515 1.00 0.00 H new ATOM 0 HA ALA B 39 7.941 7.508 4.138 1.00 0.00 H new ATOM 0 HB1 ALA B 39 5.648 7.859 3.305 1.00 0.00 H new ATOM 0 HB2 ALA B 39 5.656 7.206 4.961 1.00 0.00 H new ATOM 0 HB3 ALA B 39 5.316 8.931 4.686 1.00 0.00 H new ATOM 2052 N ALA B 40 7.347 10.754 3.968 1.00 0.00 N ATOM 2053 CA ALA B 40 7.646 11.958 3.208 1.00 0.00 C ATOM 2054 C ALA B 40 9.142 12.064 2.945 1.00 0.00 C ATOM 2055 O ALA B 40 9.598 11.933 1.809 1.00 0.00 O ATOM 2056 CB ALA B 40 7.148 13.188 3.954 1.00 0.00 C ATOM 0 H ALA B 40 6.813 10.916 4.822 1.00 0.00 H new ATOM 0 HA ALA B 40 7.132 11.901 2.249 1.00 0.00 H new ATOM 0 HB1 ALA B 40 7.378 14.082 3.375 1.00 0.00 H new ATOM 0 HB2 ALA B 40 6.070 13.115 4.097 1.00 0.00 H new ATOM 0 HB3 ALA B 40 7.639 13.248 4.925 1.00 0.00 H new ATOM 2062 N HIS B 41 9.901 12.290 4.009 1.00 0.00 N ATOM 2063 CA HIS B 41 11.352 12.401 3.911 1.00 0.00 C ATOM 2064 C HIS B 41 11.895 11.408 2.886 1.00 0.00 C ATOM 2065 O HIS B 41 12.797 11.727 2.113 1.00 0.00 O ATOM 2066 CB HIS B 41 11.983 12.160 5.293 1.00 0.00 C ATOM 2067 CG HIS B 41 13.378 11.605 5.263 1.00 0.00 C ATOM 2068 ND1 HIS B 41 14.430 12.181 5.944 1.00 0.00 N ATOM 2069 CD2 HIS B 41 13.891 10.514 4.642 1.00 0.00 C ATOM 2070 CE1 HIS B 41 15.526 11.470 5.744 1.00 0.00 C ATOM 2071 NE2 HIS B 41 15.225 10.454 4.958 1.00 0.00 N ATOM 0 H HIS B 41 9.535 12.401 4.954 1.00 0.00 H new ATOM 0 HA HIS B 41 11.612 13.405 3.576 1.00 0.00 H new ATOM 0 HB2 HIS B 41 11.994 13.102 5.840 1.00 0.00 H new ATOM 0 HB3 HIS B 41 11.347 11.474 5.852 1.00 0.00 H new ATOM 0 HD1 HIS B 41 14.371 13.025 6.514 1.00 0.00 H new ATOM 0 HD2 HIS B 41 13.350 9.821 4.015 1.00 0.00 H new ATOM 0 HE1 HIS B 41 16.502 11.684 6.154 1.00 0.00 H new ATOM 2080 N ILE B 42 11.342 10.199 2.897 1.00 0.00 N ATOM 2081 CA ILE B 42 11.769 9.149 1.979 1.00 0.00 C ATOM 2082 C ILE B 42 11.391 9.477 0.537 1.00 0.00 C ATOM 2083 O ILE B 42 12.258 9.716 -0.302 1.00 0.00 O ATOM 2084 CB ILE B 42 11.154 7.789 2.364 1.00 0.00 C ATOM 2085 CG1 ILE B 42 11.479 7.453 3.821 1.00 0.00 C ATOM 2086 CG2 ILE B 42 11.661 6.697 1.435 1.00 0.00 C ATOM 2087 CD1 ILE B 42 10.660 6.308 4.377 1.00 0.00 C ATOM 0 H ILE B 42 10.595 9.922 3.534 1.00 0.00 H new ATOM 0 HA ILE B 42 12.855 9.088 2.055 1.00 0.00 H new ATOM 0 HB ILE B 42 10.071 7.852 2.259 1.00 0.00 H new ATOM 0 HG12 ILE B 42 12.537 7.204 3.900 1.00 0.00 H new ATOM 0 HG13 ILE B 42 11.314 8.338 4.435 1.00 0.00 H new ATOM 0 HG21 ILE B 42 11.218 5.743 1.719 1.00 0.00 H new ATOM 0 HG22 ILE B 42 11.383 6.935 0.408 1.00 0.00 H new ATOM 0 HG23 ILE B 42 12.746 6.630 1.511 1.00 0.00 H new ATOM 0 HD11 ILE B 42 10.945 6.127 5.413 1.00 0.00 H new ATOM 0 HD12 ILE B 42 9.601 6.562 4.331 1.00 0.00 H new ATOM 0 HD13 ILE B 42 10.844 5.410 3.788 1.00 0.00 H new ATOM 2099 N LYS B 43 10.092 9.480 0.255 1.00 0.00 N ATOM 2100 CA LYS B 43 9.604 9.771 -1.088 1.00 0.00 C ATOM 2101 C LYS B 43 10.403 10.899 -1.735 1.00 0.00 C ATOM 2102 O LYS B 43 10.917 10.753 -2.845 1.00 0.00 O ATOM 2103 CB LYS B 43 8.120 10.142 -1.048 1.00 0.00 C ATOM 2104 CG LYS B 43 7.588 10.662 -2.375 1.00 0.00 C ATOM 2105 CD LYS B 43 6.079 10.842 -2.340 1.00 0.00 C ATOM 2106 CE LYS B 43 5.674 12.229 -2.813 1.00 0.00 C ATOM 2107 NZ LYS B 43 4.912 12.179 -4.091 1.00 0.00 N ATOM 0 H LYS B 43 9.360 9.285 0.937 1.00 0.00 H new ATOM 0 HA LYS B 43 9.732 8.871 -1.690 1.00 0.00 H new ATOM 0 HB2 LYS B 43 7.543 9.266 -0.752 1.00 0.00 H new ATOM 0 HB3 LYS B 43 7.964 10.900 -0.281 1.00 0.00 H new ATOM 0 HG2 LYS B 43 8.063 11.614 -2.610 1.00 0.00 H new ATOM 0 HG3 LYS B 43 7.854 9.967 -3.172 1.00 0.00 H new ATOM 0 HD2 LYS B 43 5.607 10.089 -2.970 1.00 0.00 H new ATOM 0 HD3 LYS B 43 5.715 10.682 -1.325 1.00 0.00 H new ATOM 0 HE2 LYS B 43 5.067 12.711 -2.047 1.00 0.00 H new ATOM 0 HE3 LYS B 43 6.565 12.842 -2.946 1.00 0.00 H new ATOM 0 HZ1 LYS B 43 5.375 12.788 -4.795 1.00 0.00 H new ATOM 0 HZ2 LYS B 43 4.887 11.200 -4.442 1.00 0.00 H new ATOM 0 HZ3 LYS B 43 3.941 12.514 -3.929 1.00 0.00 H new ATOM 2121 N LYS B 44 10.498 12.026 -1.038 1.00 0.00 N ATOM 2122 CA LYS B 44 11.227 13.182 -1.548 1.00 0.00 C ATOM 2123 C LYS B 44 12.695 12.850 -1.795 1.00 0.00 C ATOM 2124 O LYS B 44 13.264 13.232 -2.818 1.00 0.00 O ATOM 2125 CB LYS B 44 11.117 14.353 -0.569 1.00 0.00 C ATOM 2126 CG LYS B 44 9.688 14.800 -0.310 1.00 0.00 C ATOM 2127 CD LYS B 44 9.573 15.567 0.997 1.00 0.00 C ATOM 2128 CE LYS B 44 8.275 16.355 1.066 1.00 0.00 C ATOM 2129 NZ LYS B 44 8.417 17.713 0.470 1.00 0.00 N ATOM 0 H LYS B 44 10.079 12.164 -0.118 1.00 0.00 H new ATOM 0 HA LYS B 44 10.777 13.464 -2.500 1.00 0.00 H new ATOM 0 HB2 LYS B 44 11.576 14.068 0.377 1.00 0.00 H new ATOM 0 HB3 LYS B 44 11.687 15.196 -0.959 1.00 0.00 H new ATOM 0 HG2 LYS B 44 9.347 15.428 -1.133 1.00 0.00 H new ATOM 0 HG3 LYS B 44 9.033 13.929 -0.281 1.00 0.00 H new ATOM 0 HD2 LYS B 44 9.623 14.871 1.834 1.00 0.00 H new ATOM 0 HD3 LYS B 44 10.419 16.247 1.097 1.00 0.00 H new ATOM 0 HE2 LYS B 44 7.491 15.809 0.542 1.00 0.00 H new ATOM 0 HE3 LYS B 44 7.960 16.446 2.106 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 7.510 18.218 0.537 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 9.148 18.244 0.986 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 8.692 17.627 -0.529 1.00 0.00 H new ATOM 2143 N GLU B 45 13.303 12.148 -0.850 1.00 0.00 N ATOM 2144 CA GLU B 45 14.709 11.773 -0.962 1.00 0.00 C ATOM 2145 C GLU B 45 14.948 10.874 -2.171 1.00 0.00 C ATOM 2146 O GLU B 45 15.974 10.981 -2.840 1.00 0.00 O ATOM 2147 CB GLU B 45 15.172 11.069 0.314 1.00 0.00 C ATOM 2148 CG GLU B 45 16.630 10.639 0.279 1.00 0.00 C ATOM 2149 CD GLU B 45 17.585 11.815 0.342 1.00 0.00 C ATOM 2150 OE1 GLU B 45 17.116 12.951 0.568 1.00 0.00 O ATOM 2151 OE2 GLU B 45 18.803 11.602 0.165 1.00 0.00 O ATOM 0 H GLU B 45 12.847 11.826 0.003 1.00 0.00 H new ATOM 0 HA GLU B 45 15.289 12.686 -1.099 1.00 0.00 H new ATOM 0 HB2 GLU B 45 15.019 11.736 1.162 1.00 0.00 H new ATOM 0 HB3 GLU B 45 14.547 10.192 0.482 1.00 0.00 H new ATOM 0 HG2 GLU B 45 16.828 9.969 1.116 1.00 0.00 H new ATOM 0 HG3 GLU B 45 16.816 10.072 -0.633 1.00 0.00 H new ATOM 2158 N PHE B 46 13.996 9.988 -2.448 1.00 0.00 N ATOM 2159 CA PHE B 46 14.115 9.073 -3.577 1.00 0.00 C ATOM 2160 C PHE B 46 13.980 9.815 -4.902 1.00 0.00 C ATOM 2161 O PHE B 46 14.629 9.466 -5.888 1.00 0.00 O ATOM 2162 CB PHE B 46 13.060 7.971 -3.489 1.00 0.00 C ATOM 2163 CG PHE B 46 13.629 6.640 -3.095 1.00 0.00 C ATOM 2164 CD1 PHE B 46 14.142 6.444 -1.824 1.00 0.00 C ATOM 2165 CD2 PHE B 46 13.654 5.589 -3.995 1.00 0.00 C ATOM 2166 CE1 PHE B 46 14.672 5.222 -1.459 1.00 0.00 C ATOM 2167 CE2 PHE B 46 14.183 4.364 -3.636 1.00 0.00 C ATOM 2168 CZ PHE B 46 14.691 4.181 -2.365 1.00 0.00 C ATOM 0 H PHE B 46 13.137 9.885 -1.908 1.00 0.00 H new ATOM 0 HA PHE B 46 15.106 8.620 -3.534 1.00 0.00 H new ATOM 0 HB2 PHE B 46 12.299 8.262 -2.765 1.00 0.00 H new ATOM 0 HB3 PHE B 46 12.562 7.875 -4.454 1.00 0.00 H new ATOM 0 HD1 PHE B 46 14.128 7.255 -1.111 1.00 0.00 H new ATOM 0 HD2 PHE B 46 13.256 5.728 -4.989 1.00 0.00 H new ATOM 0 HE1 PHE B 46 15.071 5.081 -0.465 1.00 0.00 H new ATOM 0 HE2 PHE B 46 14.199 3.552 -4.348 1.00 0.00 H new ATOM 0 HZ PHE B 46 15.103 3.224 -2.080 1.00 0.00 H new ATOM 2178 N ASP B 47 13.135 10.839 -4.919 1.00 0.00 N ATOM 2179 CA ASP B 47 12.921 11.626 -6.126 1.00 0.00 C ATOM 2180 C ASP B 47 14.165 12.440 -6.470 1.00 0.00 C ATOM 2181 O ASP B 47 14.488 12.635 -7.642 1.00 0.00 O ATOM 2182 CB ASP B 47 11.721 12.558 -5.949 1.00 0.00 C ATOM 2183 CG ASP B 47 12.108 13.887 -5.332 1.00 0.00 C ATOM 2184 OD1 ASP B 47 12.870 14.641 -5.973 1.00 0.00 O ATOM 2185 OD2 ASP B 47 11.649 14.174 -4.206 1.00 0.00 O ATOM 0 H ASP B 47 12.589 11.143 -4.113 1.00 0.00 H new ATOM 0 HA ASP B 47 12.718 10.938 -6.947 1.00 0.00 H new ATOM 0 HB2 ASP B 47 11.254 12.733 -6.918 1.00 0.00 H new ATOM 0 HB3 ASP B 47 10.976 12.071 -5.319 1.00 0.00 H new ATOM 2190 N LYS B 48 14.859 12.913 -5.441 1.00 0.00 N ATOM 2191 CA LYS B 48 16.064 13.708 -5.638 1.00 0.00 C ATOM 2192 C LYS B 48 17.303 12.821 -5.707 1.00 0.00 C ATOM 2193 O LYS B 48 18.324 13.210 -6.275 1.00 0.00 O ATOM 2194 CB LYS B 48 16.220 14.728 -4.509 1.00 0.00 C ATOM 2195 CG LYS B 48 15.584 16.074 -4.812 1.00 0.00 C ATOM 2196 CD LYS B 48 16.571 17.213 -4.613 1.00 0.00 C ATOM 2197 CE LYS B 48 17.651 17.208 -5.682 1.00 0.00 C ATOM 2198 NZ LYS B 48 17.089 17.461 -7.037 1.00 0.00 N ATOM 0 H LYS B 48 14.608 12.760 -4.464 1.00 0.00 H new ATOM 0 HA LYS B 48 15.964 14.235 -6.587 1.00 0.00 H new ATOM 0 HB2 LYS B 48 15.776 14.322 -3.600 1.00 0.00 H new ATOM 0 HB3 LYS B 48 17.281 14.874 -4.307 1.00 0.00 H new ATOM 0 HG2 LYS B 48 15.219 16.082 -5.839 1.00 0.00 H new ATOM 0 HG3 LYS B 48 14.719 16.223 -4.165 1.00 0.00 H new ATOM 0 HD2 LYS B 48 16.040 18.164 -4.636 1.00 0.00 H new ATOM 0 HD3 LYS B 48 17.032 17.129 -3.629 1.00 0.00 H new ATOM 0 HE2 LYS B 48 18.396 17.969 -5.450 1.00 0.00 H new ATOM 0 HE3 LYS B 48 18.165 16.247 -5.675 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 17.852 17.751 -7.681 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 16.644 16.592 -7.396 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 16.377 18.217 -6.982 1.00 0.00 H new ATOM 2212 N LYS B 49 17.210 11.633 -5.125 1.00 0.00 N ATOM 2213 CA LYS B 49 18.328 10.699 -5.121 1.00 0.00 C ATOM 2214 C LYS B 49 18.297 9.803 -6.354 1.00 0.00 C ATOM 2215 O LYS B 49 19.333 9.307 -6.798 1.00 0.00 O ATOM 2216 CB LYS B 49 18.304 9.845 -3.853 1.00 0.00 C ATOM 2217 CG LYS B 49 19.371 10.232 -2.841 1.00 0.00 C ATOM 2218 CD LYS B 49 20.768 10.044 -3.409 1.00 0.00 C ATOM 2219 CE LYS B 49 21.029 8.589 -3.765 1.00 0.00 C ATOM 2220 NZ LYS B 49 20.881 7.695 -2.584 1.00 0.00 N ATOM 0 H LYS B 49 16.373 11.294 -4.650 1.00 0.00 H new ATOM 0 HA LYS B 49 19.251 11.279 -5.141 1.00 0.00 H new ATOM 0 HB2 LYS B 49 17.323 9.930 -3.385 1.00 0.00 H new ATOM 0 HB3 LYS B 49 18.437 8.798 -4.127 1.00 0.00 H new ATOM 0 HG2 LYS B 49 19.234 11.272 -2.545 1.00 0.00 H new ATOM 0 HG3 LYS B 49 19.258 9.627 -1.941 1.00 0.00 H new ATOM 0 HD2 LYS B 49 20.888 10.665 -4.297 1.00 0.00 H new ATOM 0 HD3 LYS B 49 21.507 10.381 -2.682 1.00 0.00 H new ATOM 0 HE2 LYS B 49 20.336 8.276 -4.546 1.00 0.00 H new ATOM 0 HE3 LYS B 49 22.035 8.489 -4.172 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 21.275 6.758 -2.806 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 21.391 8.102 -1.774 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 19.873 7.599 -2.345 1.00 0.00 H new ATOM 2234 N TYR B 50 17.104 9.595 -6.903 1.00 0.00 N ATOM 2235 CA TYR B 50 16.946 8.756 -8.083 1.00 0.00 C ATOM 2236 C TYR B 50 16.170 9.484 -9.177 1.00 0.00 C ATOM 2237 O TYR B 50 16.695 9.722 -10.264 1.00 0.00 O ATOM 2238 CB TYR B 50 16.225 7.459 -7.715 1.00 0.00 C ATOM 2239 CG TYR B 50 16.743 6.815 -6.450 1.00 0.00 C ATOM 2240 CD1 TYR B 50 16.568 7.427 -5.216 1.00 0.00 C ATOM 2241 CD2 TYR B 50 17.407 5.595 -6.489 1.00 0.00 C ATOM 2242 CE1 TYR B 50 17.040 6.842 -4.056 1.00 0.00 C ATOM 2243 CE2 TYR B 50 17.882 5.003 -5.334 1.00 0.00 C ATOM 2244 CZ TYR B 50 17.696 5.631 -4.121 1.00 0.00 C ATOM 2245 OH TYR B 50 18.168 5.046 -2.968 1.00 0.00 O ATOM 0 H TYR B 50 16.235 9.996 -6.549 1.00 0.00 H new ATOM 0 HA TYR B 50 17.940 8.522 -8.464 1.00 0.00 H new ATOM 0 HB2 TYR B 50 15.161 7.666 -7.598 1.00 0.00 H new ATOM 0 HB3 TYR B 50 16.324 6.752 -8.539 1.00 0.00 H new ATOM 0 HD1 TYR B 50 16.055 8.376 -5.162 1.00 0.00 H new ATOM 0 HD2 TYR B 50 17.554 5.101 -7.438 1.00 0.00 H new ATOM 0 HE1 TYR B 50 16.896 7.331 -3.104 1.00 0.00 H new ATOM 0 HE2 TYR B 50 18.396 4.054 -5.381 1.00 0.00 H new ATOM 0 HH TYR B 50 19.122 5.245 -2.867 1.00 0.00 H new ATOM 2255 N ASN B 51 14.918 9.826 -8.874 1.00 0.00 N ATOM 2256 CA ASN B 51 14.044 10.520 -9.814 1.00 0.00 C ATOM 2257 C ASN B 51 12.586 10.233 -9.473 1.00 0.00 C ATOM 2258 O ASN B 51 12.145 9.085 -9.530 1.00 0.00 O ATOM 2259 CB ASN B 51 14.330 10.086 -11.254 1.00 0.00 C ATOM 2260 CG ASN B 51 14.084 8.605 -11.472 1.00 0.00 C ATOM 2261 OD1 ASN B 51 14.037 7.847 -10.383 1.00 0.00 O flip ATOM 2262 ND2 ASN B 51 13.937 8.149 -12.607 1.00 0.00 N flip ATOM 0 H ASN B 51 14.484 9.630 -7.972 1.00 0.00 H new ATOM 0 HA ASN B 51 14.237 11.590 -9.732 1.00 0.00 H new ATOM 0 HB2 ASN B 51 13.702 10.660 -11.935 1.00 0.00 H new ATOM 0 HB3 ASN B 51 15.365 10.320 -11.502 1.00 0.00 H new ATOM 0 HD21 ASN B 51 13.981 8.769 -13.415 1.00 0.00 H new ATOM 0 HD22 ASN B 51 13.771 7.151 -12.738 1.00 0.00 H new ATOM 2269 N PRO B 52 11.813 11.267 -9.110 1.00 0.00 N ATOM 2270 CA PRO B 52 10.402 11.104 -8.757 1.00 0.00 C ATOM 2271 C PRO B 52 9.611 10.384 -9.853 1.00 0.00 C ATOM 2272 O PRO B 52 10.121 10.187 -10.956 1.00 0.00 O ATOM 2273 CB PRO B 52 9.895 12.540 -8.574 1.00 0.00 C ATOM 2274 CG PRO B 52 10.948 13.416 -9.165 1.00 0.00 C ATOM 2275 CD PRO B 52 12.240 12.671 -9.010 1.00 0.00 C ATOM 0 HA PRO B 52 10.277 10.489 -7.865 1.00 0.00 H new ATOM 0 HB2 PRO B 52 8.938 12.685 -9.075 1.00 0.00 H new ATOM 0 HB3 PRO B 52 9.740 12.770 -7.520 1.00 0.00 H new ATOM 0 HG2 PRO B 52 10.740 13.622 -10.215 1.00 0.00 H new ATOM 0 HG3 PRO B 52 10.988 14.378 -8.653 1.00 0.00 H new ATOM 0 HD2 PRO B 52 12.956 12.934 -9.789 1.00 0.00 H new ATOM 0 HD3 PRO B 52 12.718 12.882 -8.053 1.00 0.00 H new ATOM 2283 N THR B 53 8.364 9.984 -9.558 1.00 0.00 N ATOM 2284 CA THR B 53 7.746 10.211 -8.253 1.00 0.00 C ATOM 2285 C THR B 53 7.560 8.895 -7.509 1.00 0.00 C ATOM 2286 O THR B 53 6.951 7.958 -8.024 1.00 0.00 O ATOM 2287 CB THR B 53 6.400 10.919 -8.418 1.00 0.00 C ATOM 2288 OG1 THR B 53 6.590 12.286 -8.736 1.00 0.00 O ATOM 2289 CG2 THR B 53 5.530 10.850 -7.182 1.00 0.00 C ATOM 0 H THR B 53 7.761 9.495 -10.220 1.00 0.00 H new ATOM 0 HA THR B 53 8.409 10.848 -7.667 1.00 0.00 H new ATOM 0 HB THR B 53 5.893 10.392 -9.226 1.00 0.00 H new ATOM 0 HG1 THR B 53 5.718 12.722 -8.839 1.00 0.00 H new ATOM 0 HG21 THR B 53 4.591 11.372 -7.368 1.00 0.00 H new ATOM 0 HG22 THR B 53 5.324 9.807 -6.940 1.00 0.00 H new ATOM 0 HG23 THR B 53 6.047 11.321 -6.346 1.00 0.00 H new ATOM 2297 N TRP B 54 8.098 8.831 -6.297 1.00 0.00 N ATOM 2298 CA TRP B 54 8.001 7.625 -5.485 1.00 0.00 C ATOM 2299 C TRP B 54 6.861 7.713 -4.479 1.00 0.00 C ATOM 2300 O TRP B 54 6.560 8.784 -3.950 1.00 0.00 O ATOM 2301 CB TRP B 54 9.312 7.378 -4.737 1.00 0.00 C ATOM 2302 CG TRP B 54 10.504 7.246 -5.633 1.00 0.00 C ATOM 2303 CD1 TRP B 54 11.075 8.230 -6.387 1.00 0.00 C ATOM 2304 CD2 TRP B 54 11.274 6.061 -5.864 1.00 0.00 C ATOM 2305 NE1 TRP B 54 12.156 7.731 -7.071 1.00 0.00 N ATOM 2306 CE2 TRP B 54 12.300 6.401 -6.767 1.00 0.00 C ATOM 2307 CE3 TRP B 54 11.198 4.746 -5.395 1.00 0.00 C ATOM 2308 CZ2 TRP B 54 13.242 5.475 -7.208 1.00 0.00 C ATOM 2309 CZ3 TRP B 54 12.132 3.828 -5.834 1.00 0.00 C ATOM 2310 CH2 TRP B 54 13.143 4.194 -6.730 1.00 0.00 C ATOM 0 H TRP B 54 8.605 9.598 -5.856 1.00 0.00 H new ATOM 0 HA TRP B 54 7.800 6.796 -6.163 1.00 0.00 H new ATOM 0 HB2 TRP B 54 9.482 8.199 -4.040 1.00 0.00 H new ATOM 0 HB3 TRP B 54 9.214 6.470 -4.142 1.00 0.00 H new ATOM 0 HD1 TRP B 54 10.728 9.251 -6.438 1.00 0.00 H new ATOM 0 HE1 TRP B 54 12.755 8.263 -7.703 1.00 0.00 H new ATOM 0 HE3 TRP B 54 10.423 4.453 -4.702 1.00 0.00 H new ATOM 0 HZ2 TRP B 54 14.022 5.756 -7.901 1.00 0.00 H new ATOM 0 HZ3 TRP B 54 12.081 2.809 -5.479 1.00 0.00 H new ATOM 0 HH2 TRP B 54 13.859 3.452 -7.051 1.00 0.00 H new ATOM 2321 N HIS B 55 6.249 6.568 -4.203 1.00 0.00 N ATOM 2322 CA HIS B 55 5.160 6.481 -3.241 1.00 0.00 C ATOM 2323 C HIS B 55 5.635 5.706 -2.019 1.00 0.00 C ATOM 2324 O HIS B 55 5.694 4.477 -2.036 1.00 0.00 O ATOM 2325 CB HIS B 55 3.947 5.795 -3.871 1.00 0.00 C ATOM 2326 CG HIS B 55 3.367 6.558 -5.021 1.00 0.00 C ATOM 2327 ND1 HIS B 55 2.011 6.660 -5.251 1.00 0.00 N ATOM 2328 CD2 HIS B 55 3.968 7.265 -6.008 1.00 0.00 C ATOM 2329 CE1 HIS B 55 1.804 7.396 -6.329 1.00 0.00 C ATOM 2330 NE2 HIS B 55 2.975 7.775 -6.806 1.00 0.00 N ATOM 0 H HIS B 55 6.493 5.678 -4.638 1.00 0.00 H new ATOM 0 HA HIS B 55 4.862 7.485 -2.939 1.00 0.00 H new ATOM 0 HB2 HIS B 55 4.237 4.801 -4.212 1.00 0.00 H new ATOM 0 HB3 HIS B 55 3.179 5.659 -3.110 1.00 0.00 H new ATOM 0 HD1 HIS B 55 1.282 6.234 -4.679 1.00 0.00 H new ATOM 0 HD2 HIS B 55 5.031 7.402 -6.142 1.00 0.00 H new ATOM 0 HE1 HIS B 55 0.840 7.645 -6.748 1.00 0.00 H new ATOM 2339 N CYS B 56 6.013 6.433 -0.975 1.00 0.00 N ATOM 2340 CA CYS B 56 6.530 5.804 0.236 1.00 0.00 C ATOM 2341 C CYS B 56 5.511 5.779 1.370 1.00 0.00 C ATOM 2342 O CYS B 56 5.007 6.818 1.798 1.00 0.00 O ATOM 2343 CB CYS B 56 7.794 6.527 0.702 1.00 0.00 C ATOM 2344 SG CYS B 56 8.476 5.891 2.252 1.00 0.00 S ATOM 0 H CYS B 56 5.972 7.452 -0.941 1.00 0.00 H new ATOM 0 HA CYS B 56 6.758 4.769 -0.019 1.00 0.00 H new ATOM 0 HB2 CYS B 56 8.553 6.448 -0.076 1.00 0.00 H new ATOM 0 HB3 CYS B 56 7.570 7.587 0.823 1.00 0.00 H new ATOM 0 HG CYS B 56 7.735 4.914 2.683 1.00 0.00 H new ATOM 2350 N ILE B 57 5.245 4.577 1.873 1.00 0.00 N ATOM 2351 CA ILE B 57 4.321 4.389 2.986 1.00 0.00 C ATOM 2352 C ILE B 57 5.031 3.699 4.147 1.00 0.00 C ATOM 2353 O ILE B 57 5.258 2.489 4.115 1.00 0.00 O ATOM 2354 CB ILE B 57 3.093 3.551 2.583 1.00 0.00 C ATOM 2355 CG1 ILE B 57 2.514 4.050 1.258 1.00 0.00 C ATOM 2356 CG2 ILE B 57 2.041 3.601 3.684 1.00 0.00 C ATOM 2357 CD1 ILE B 57 2.187 5.526 1.257 1.00 0.00 C ATOM 0 H ILE B 57 5.660 3.713 1.524 1.00 0.00 H new ATOM 0 HA ILE B 57 3.977 5.379 3.287 1.00 0.00 H new ATOM 0 HB ILE B 57 3.405 2.515 2.448 1.00 0.00 H new ATOM 0 HG12 ILE B 57 3.227 3.844 0.459 1.00 0.00 H new ATOM 0 HG13 ILE B 57 1.609 3.486 1.031 1.00 0.00 H new ATOM 0 HG21 ILE B 57 1.177 3.005 3.389 1.00 0.00 H new ATOM 0 HG22 ILE B 57 2.461 3.200 4.607 1.00 0.00 H new ATOM 0 HG23 ILE B 57 1.732 4.634 3.845 1.00 0.00 H new ATOM 0 HD11 ILE B 57 1.781 5.808 0.286 1.00 0.00 H new ATOM 0 HD12 ILE B 57 1.451 5.736 2.033 1.00 0.00 H new ATOM 0 HD13 ILE B 57 3.093 6.100 1.452 1.00 0.00 H new ATOM 2369 N VAL B 58 5.394 4.475 5.165 1.00 0.00 N ATOM 2370 CA VAL B 58 6.095 3.934 6.325 1.00 0.00 C ATOM 2371 C VAL B 58 5.190 3.869 7.550 1.00 0.00 C ATOM 2372 O VAL B 58 4.658 4.885 7.995 1.00 0.00 O ATOM 2373 CB VAL B 58 7.336 4.778 6.666 1.00 0.00 C ATOM 2374 CG1 VAL B 58 6.974 6.251 6.722 1.00 0.00 C ATOM 2375 CG2 VAL B 58 7.956 4.320 7.979 1.00 0.00 C ATOM 0 H VAL B 58 5.215 5.478 5.210 1.00 0.00 H new ATOM 0 HA VAL B 58 6.404 2.923 6.059 1.00 0.00 H new ATOM 0 HB VAL B 58 8.077 4.637 5.879 1.00 0.00 H new ATOM 0 HG11 VAL B 58 7.862 6.835 6.964 1.00 0.00 H new ATOM 0 HG12 VAL B 58 6.585 6.567 5.754 1.00 0.00 H new ATOM 0 HG13 VAL B 58 6.215 6.410 7.488 1.00 0.00 H new ATOM 0 HG21 VAL B 58 8.832 4.930 8.200 1.00 0.00 H new ATOM 0 HG22 VAL B 58 7.227 4.426 8.782 1.00 0.00 H new ATOM 0 HG23 VAL B 58 8.254 3.275 7.896 1.00 0.00 H new ATOM 2385 N GLY B 59 5.028 2.668 8.097 1.00 0.00 N ATOM 2386 CA GLY B 59 4.197 2.487 9.270 1.00 0.00 C ATOM 2387 C GLY B 59 4.727 1.391 10.170 1.00 0.00 C ATOM 2388 O GLY B 59 5.630 1.623 10.973 1.00 0.00 O ATOM 0 H GLY B 59 5.461 1.814 7.745 1.00 0.00 H new ATOM 0 HA2 GLY B 59 4.146 3.422 9.827 1.00 0.00 H new ATOM 0 HA3 GLY B 59 3.180 2.244 8.961 1.00 0.00 H new ATOM 2392 N ARG B 60 4.170 0.191 10.034 1.00 0.00 N ATOM 2393 CA ARG B 60 4.600 -0.935 10.840 1.00 0.00 C ATOM 2394 C ARG B 60 3.630 -2.109 10.730 1.00 0.00 C ATOM 2395 O ARG B 60 4.025 -3.264 10.884 1.00 0.00 O ATOM 2396 CB ARG B 60 4.730 -0.494 12.288 1.00 0.00 C ATOM 2397 CG ARG B 60 3.396 -0.297 12.986 1.00 0.00 C ATOM 2398 CD ARG B 60 3.568 -0.182 14.492 1.00 0.00 C ATOM 2399 NE ARG B 60 2.301 -0.337 15.200 1.00 0.00 N ATOM 2400 CZ ARG B 60 1.837 0.544 16.081 1.00 0.00 C ATOM 2401 NH1 ARG B 60 2.532 1.639 16.355 1.00 0.00 N ATOM 2402 NH2 ARG B 60 0.677 0.331 16.688 1.00 0.00 N ATOM 0 H ARG B 60 3.422 -0.021 9.374 1.00 0.00 H new ATOM 0 HA ARG B 60 5.567 -1.275 10.469 1.00 0.00 H new ATOM 0 HB2 ARG B 60 5.310 -1.237 12.835 1.00 0.00 H new ATOM 0 HB3 ARG B 60 5.292 0.439 12.326 1.00 0.00 H new ATOM 0 HG2 ARG B 60 2.913 0.603 12.604 1.00 0.00 H new ATOM 0 HG3 ARG B 60 2.737 -1.134 12.757 1.00 0.00 H new ATOM 0 HD2 ARG B 60 4.271 -0.941 14.836 1.00 0.00 H new ATOM 0 HD3 ARG B 60 4.003 0.788 14.734 1.00 0.00 H new ATOM 0 HE ARG B 60 1.740 -1.167 15.008 1.00 0.00 H new ATOM 0 HH11 ARG B 60 3.424 1.807 15.890 1.00 0.00 H new ATOM 0 HH12 ARG B 60 2.175 2.314 17.031 1.00 0.00 H new ATOM 0 HH21 ARG B 60 0.139 -0.510 16.479 1.00 0.00 H new ATOM 0 HH22 ARG B 60 0.323 1.008 17.364 1.00 0.00 H new ATOM 2416 N ASN B 61 2.362 -1.811 10.460 1.00 0.00 N ATOM 2417 CA ASN B 61 1.351 -2.855 10.333 1.00 0.00 C ATOM 2418 C ASN B 61 0.146 -2.369 9.533 1.00 0.00 C ATOM 2419 O ASN B 61 -1.000 -2.581 9.932 1.00 0.00 O ATOM 2420 CB ASN B 61 0.900 -3.331 11.716 1.00 0.00 C ATOM 2421 CG ASN B 61 0.997 -4.836 11.870 1.00 0.00 C ATOM 2422 OD1 ASN B 61 1.521 -5.337 12.865 1.00 0.00 O ATOM 2423 ND2 ASN B 61 0.490 -5.566 10.883 1.00 0.00 N ATOM 0 H ASN B 61 2.012 -0.862 10.326 1.00 0.00 H new ATOM 0 HA ASN B 61 1.802 -3.689 9.795 1.00 0.00 H new ATOM 0 HB2 ASN B 61 1.511 -2.850 12.480 1.00 0.00 H new ATOM 0 HB3 ASN B 61 -0.130 -3.017 11.887 1.00 0.00 H new ATOM 0 HD21 ASN B 61 0.526 -6.584 10.931 1.00 0.00 H new ATOM 0 HD22 ASN B 61 0.065 -5.108 10.077 1.00 0.00 H new ATOM 2430 N PHE B 62 0.408 -1.725 8.400 1.00 0.00 N ATOM 2431 CA PHE B 62 -0.661 -1.223 7.546 1.00 0.00 C ATOM 2432 C PHE B 62 -0.964 -2.212 6.426 1.00 0.00 C ATOM 2433 O PHE B 62 -0.282 -3.226 6.280 1.00 0.00 O ATOM 2434 CB PHE B 62 -0.274 0.132 6.953 1.00 0.00 C ATOM 2435 CG PHE B 62 0.883 0.060 5.999 1.00 0.00 C ATOM 2436 CD1 PHE B 62 2.169 -0.168 6.466 1.00 0.00 C ATOM 2437 CD2 PHE B 62 0.687 0.219 4.637 1.00 0.00 C ATOM 2438 CE1 PHE B 62 3.236 -0.237 5.590 1.00 0.00 C ATOM 2439 CE2 PHE B 62 1.750 0.152 3.757 1.00 0.00 C ATOM 2440 CZ PHE B 62 3.026 -0.077 4.234 1.00 0.00 C ATOM 0 H PHE B 62 1.349 -1.539 8.053 1.00 0.00 H new ATOM 0 HA PHE B 62 -1.556 -1.102 8.156 1.00 0.00 H new ATOM 0 HB2 PHE B 62 -1.136 0.553 6.435 1.00 0.00 H new ATOM 0 HB3 PHE B 62 -0.024 0.816 7.764 1.00 0.00 H new ATOM 0 HD1 PHE B 62 2.338 -0.293 7.525 1.00 0.00 H new ATOM 0 HD2 PHE B 62 -0.309 0.397 4.258 1.00 0.00 H new ATOM 0 HE1 PHE B 62 4.233 -0.416 5.965 1.00 0.00 H new ATOM 0 HE2 PHE B 62 1.584 0.279 2.697 1.00 0.00 H new ATOM 0 HZ PHE B 62 3.858 -0.131 3.548 1.00 0.00 H new ATOM 2450 N GLY B 63 -1.987 -1.910 5.634 1.00 0.00 N ATOM 2451 CA GLY B 63 -2.357 -2.779 4.533 1.00 0.00 C ATOM 2452 C GLY B 63 -2.204 -2.091 3.193 1.00 0.00 C ATOM 2453 O GLY B 63 -3.166 -1.545 2.653 1.00 0.00 O ATOM 0 H GLY B 63 -2.567 -1.077 5.735 1.00 0.00 H new ATOM 0 HA2 GLY B 63 -1.737 -3.675 4.554 1.00 0.00 H new ATOM 0 HA3 GLY B 63 -3.390 -3.104 4.658 1.00 0.00 H new ATOM 2457 N SER B 64 -0.987 -2.107 2.662 1.00 0.00 N ATOM 2458 CA SER B 64 -0.705 -1.469 1.383 1.00 0.00 C ATOM 2459 C SER B 64 -1.231 -2.299 0.219 1.00 0.00 C ATOM 2460 O SER B 64 -1.021 -3.510 0.156 1.00 0.00 O ATOM 2461 CB SER B 64 0.798 -1.243 1.223 1.00 0.00 C ATOM 2462 OG SER B 64 1.540 -2.177 1.987 1.00 0.00 O ATOM 0 H SER B 64 -0.181 -2.555 3.097 1.00 0.00 H new ATOM 0 HA SER B 64 -1.217 -0.507 1.373 1.00 0.00 H new ATOM 0 HB2 SER B 64 1.072 -1.330 0.172 1.00 0.00 H new ATOM 0 HB3 SER B 64 1.052 -0.230 1.536 1.00 0.00 H new ATOM 0 HG SER B 64 1.766 -1.783 2.856 1.00 0.00 H new ATOM 2468 N TYR B 65 -1.912 -1.631 -0.705 1.00 0.00 N ATOM 2469 CA TYR B 65 -2.469 -2.289 -1.882 1.00 0.00 C ATOM 2470 C TYR B 65 -2.345 -1.381 -3.101 1.00 0.00 C ATOM 2471 O TYR B 65 -3.345 -0.985 -3.700 1.00 0.00 O ATOM 2472 CB TYR B 65 -3.937 -2.649 -1.642 1.00 0.00 C ATOM 2473 CG TYR B 65 -4.462 -3.704 -2.588 1.00 0.00 C ATOM 2474 CD1 TYR B 65 -4.086 -5.034 -2.456 1.00 0.00 C ATOM 2475 CD2 TYR B 65 -5.336 -3.368 -3.615 1.00 0.00 C ATOM 2476 CE1 TYR B 65 -4.565 -6.000 -3.318 1.00 0.00 C ATOM 2477 CE2 TYR B 65 -5.820 -4.329 -4.482 1.00 0.00 C ATOM 2478 CZ TYR B 65 -5.432 -5.643 -4.330 1.00 0.00 C ATOM 2479 OH TYR B 65 -5.911 -6.603 -5.192 1.00 0.00 O ATOM 0 H TYR B 65 -2.093 -0.628 -0.661 1.00 0.00 H new ATOM 0 HA TYR B 65 -1.909 -3.205 -2.068 1.00 0.00 H new ATOM 0 HB2 TYR B 65 -4.053 -3.001 -0.617 1.00 0.00 H new ATOM 0 HB3 TYR B 65 -4.544 -1.749 -1.741 1.00 0.00 H new ATOM 0 HD1 TYR B 65 -3.407 -5.318 -1.665 1.00 0.00 H new ATOM 0 HD2 TYR B 65 -5.642 -2.339 -3.737 1.00 0.00 H new ATOM 0 HE1 TYR B 65 -4.263 -7.030 -3.201 1.00 0.00 H new ATOM 0 HE2 TYR B 65 -6.499 -4.052 -5.275 1.00 0.00 H new ATOM 0 HH TYR B 65 -5.963 -7.464 -4.727 1.00 0.00 H new ATOM 2489 N VAL B 66 -1.108 -1.044 -3.451 1.00 0.00 N ATOM 2490 CA VAL B 66 -0.844 -0.168 -4.586 1.00 0.00 C ATOM 2491 C VAL B 66 -0.236 -0.932 -5.758 1.00 0.00 C ATOM 2492 O VAL B 66 0.170 -2.086 -5.619 1.00 0.00 O ATOM 2493 CB VAL B 66 0.109 0.972 -4.187 1.00 0.00 C ATOM 2494 CG1 VAL B 66 -0.500 1.809 -3.071 1.00 0.00 C ATOM 2495 CG2 VAL B 66 1.461 0.414 -3.770 1.00 0.00 C ATOM 0 H VAL B 66 -0.271 -1.365 -2.964 1.00 0.00 H new ATOM 0 HA VAL B 66 -1.804 0.246 -4.895 1.00 0.00 H new ATOM 0 HB VAL B 66 0.260 1.617 -5.052 1.00 0.00 H new ATOM 0 HG11 VAL B 66 0.187 2.611 -2.801 1.00 0.00 H new ATOM 0 HG12 VAL B 66 -1.443 2.238 -3.411 1.00 0.00 H new ATOM 0 HG13 VAL B 66 -0.681 1.178 -2.201 1.00 0.00 H new ATOM 0 HG21 VAL B 66 2.123 1.234 -3.491 1.00 0.00 H new ATOM 0 HG22 VAL B 66 1.332 -0.254 -2.918 1.00 0.00 H new ATOM 0 HG23 VAL B 66 1.899 -0.139 -4.601 1.00 0.00 H new ATOM 2505 N THR B 67 -0.176 -0.277 -6.914 1.00 0.00 N ATOM 2506 CA THR B 67 0.383 -0.889 -8.115 1.00 0.00 C ATOM 2507 C THR B 67 1.399 0.038 -8.777 1.00 0.00 C ATOM 2508 O THR B 67 1.035 1.051 -9.373 1.00 0.00 O ATOM 2509 CB THR B 67 -0.732 -1.232 -9.103 1.00 0.00 C ATOM 2510 OG1 THR B 67 -1.688 -2.089 -8.503 1.00 0.00 O ATOM 2511 CG2 THR B 67 -0.231 -1.911 -10.359 1.00 0.00 C ATOM 0 H THR B 67 -0.508 0.679 -7.044 1.00 0.00 H new ATOM 0 HA THR B 67 0.894 -1.806 -7.821 1.00 0.00 H new ATOM 0 HB THR B 67 -1.177 -0.276 -9.379 1.00 0.00 H new ATOM 0 HG1 THR B 67 -2.394 -2.296 -9.150 1.00 0.00 H new ATOM 0 HG21 THR B 67 -1.073 -2.127 -11.017 1.00 0.00 H new ATOM 0 HG22 THR B 67 0.471 -1.254 -10.872 1.00 0.00 H new ATOM 0 HG23 THR B 67 0.270 -2.842 -10.094 1.00 0.00 H new ATOM 2519 N HIS B 68 2.673 -0.317 -8.668 1.00 0.00 N ATOM 2520 CA HIS B 68 3.746 0.479 -9.251 1.00 0.00 C ATOM 2521 C HIS B 68 3.638 0.521 -10.771 1.00 0.00 C ATOM 2522 O HIS B 68 2.541 0.571 -11.329 1.00 0.00 O ATOM 2523 CB HIS B 68 5.101 -0.096 -8.847 1.00 0.00 C ATOM 2524 CG HIS B 68 6.229 0.884 -8.942 1.00 0.00 C ATOM 2525 ND1 HIS B 68 6.313 1.846 -9.926 1.00 0.00 N ATOM 2526 CD2 HIS B 68 7.327 1.044 -8.167 1.00 0.00 C ATOM 2527 CE1 HIS B 68 7.415 2.554 -9.754 1.00 0.00 C ATOM 2528 NE2 HIS B 68 8.048 2.087 -8.692 1.00 0.00 N ATOM 0 H HIS B 68 2.989 -1.154 -8.179 1.00 0.00 H new ATOM 0 HA HIS B 68 3.654 1.497 -8.873 1.00 0.00 H new ATOM 0 HB2 HIS B 68 5.038 -0.464 -7.823 1.00 0.00 H new ATOM 0 HB3 HIS B 68 5.324 -0.954 -9.481 1.00 0.00 H new ATOM 0 HD2 HIS B 68 7.587 0.459 -7.297 1.00 0.00 H new ATOM 0 HE1 HIS B 68 7.743 3.374 -10.375 1.00 0.00 H new ATOM 0 HE2 HIS B 68 8.929 2.444 -8.323 1.00 0.00 H new ATOM 2537 N GLU B 69 4.789 0.500 -11.434 1.00 0.00 N ATOM 2538 CA GLU B 69 4.840 0.537 -12.890 1.00 0.00 C ATOM 2539 C GLU B 69 6.275 0.720 -13.374 1.00 0.00 C ATOM 2540 O GLU B 69 6.511 1.055 -14.535 1.00 0.00 O ATOM 2541 CB GLU B 69 3.963 1.671 -13.419 1.00 0.00 C ATOM 2542 CG GLU B 69 3.809 2.824 -12.439 1.00 0.00 C ATOM 2543 CD GLU B 69 2.401 3.384 -12.417 1.00 0.00 C ATOM 2544 OE1 GLU B 69 1.756 3.410 -13.486 1.00 0.00 O ATOM 2545 OE2 GLU B 69 1.943 3.796 -11.331 1.00 0.00 O ATOM 0 H GLU B 69 5.703 0.457 -10.983 1.00 0.00 H new ATOM 0 HA GLU B 69 4.464 -0.412 -13.271 1.00 0.00 H new ATOM 0 HB2 GLU B 69 4.391 2.048 -14.348 1.00 0.00 H new ATOM 0 HB3 GLU B 69 2.977 1.275 -13.660 1.00 0.00 H new ATOM 0 HG2 GLU B 69 4.077 2.484 -11.439 1.00 0.00 H new ATOM 0 HG3 GLU B 69 4.508 3.617 -12.704 1.00 0.00 H new ATOM 2552 N THR B 70 7.228 0.502 -12.473 1.00 0.00 N ATOM 2553 CA THR B 70 8.640 0.646 -12.805 1.00 0.00 C ATOM 2554 C THR B 70 9.478 -0.428 -12.117 1.00 0.00 C ATOM 2555 O THR B 70 9.592 -1.550 -12.610 1.00 0.00 O ATOM 2556 CB THR B 70 9.140 2.035 -12.399 1.00 0.00 C ATOM 2557 OG1 THR B 70 8.429 3.047 -13.091 1.00 0.00 O ATOM 2558 CG2 THR B 70 10.614 2.244 -12.671 1.00 0.00 C ATOM 0 H THR B 70 7.048 0.225 -11.508 1.00 0.00 H new ATOM 0 HA THR B 70 8.746 0.526 -13.883 1.00 0.00 H new ATOM 0 HB THR B 70 8.972 2.098 -11.324 1.00 0.00 H new ATOM 0 HG1 THR B 70 7.758 3.441 -12.495 1.00 0.00 H new ATOM 0 HG21 THR B 70 10.903 3.248 -12.360 1.00 0.00 H new ATOM 0 HG22 THR B 70 11.195 1.510 -12.112 1.00 0.00 H new ATOM 0 HG23 THR B 70 10.808 2.124 -13.737 1.00 0.00 H new ATOM 2566 N LYS B 71 10.066 -0.075 -10.979 1.00 0.00 N ATOM 2567 CA LYS B 71 10.899 -1.006 -10.226 1.00 0.00 C ATOM 2568 C LYS B 71 10.062 -1.842 -9.261 1.00 0.00 C ATOM 2569 O LYS B 71 10.597 -2.485 -8.359 1.00 0.00 O ATOM 2570 CB LYS B 71 11.977 -0.246 -9.452 1.00 0.00 C ATOM 2571 CG LYS B 71 13.160 -1.112 -9.051 1.00 0.00 C ATOM 2572 CD LYS B 71 14.062 -1.405 -10.238 1.00 0.00 C ATOM 2573 CE LYS B 71 13.746 -2.758 -10.853 1.00 0.00 C ATOM 2574 NZ LYS B 71 14.483 -2.976 -12.129 1.00 0.00 N ATOM 0 H LYS B 71 9.981 0.850 -10.557 1.00 0.00 H new ATOM 0 HA LYS B 71 11.374 -1.680 -10.939 1.00 0.00 H new ATOM 0 HB2 LYS B 71 12.334 0.583 -10.062 1.00 0.00 H new ATOM 0 HB3 LYS B 71 11.533 0.186 -8.555 1.00 0.00 H new ATOM 0 HG2 LYS B 71 13.733 -0.609 -8.272 1.00 0.00 H new ATOM 0 HG3 LYS B 71 12.799 -2.049 -8.626 1.00 0.00 H new ATOM 0 HD2 LYS B 71 13.942 -0.625 -10.990 1.00 0.00 H new ATOM 0 HD3 LYS B 71 15.104 -1.383 -9.919 1.00 0.00 H new ATOM 0 HE2 LYS B 71 14.004 -3.547 -10.146 1.00 0.00 H new ATOM 0 HE3 LYS B 71 12.674 -2.832 -11.036 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 14.239 -3.910 -12.515 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 14.218 -2.239 -12.813 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 15.507 -2.932 -11.951 1.00 0.00 H new ATOM 2588 N HIS B 72 8.748 -1.830 -9.458 1.00 0.00 N ATOM 2589 CA HIS B 72 7.842 -2.590 -8.603 1.00 0.00 C ATOM 2590 C HIS B 72 7.637 -1.887 -7.267 1.00 0.00 C ATOM 2591 O HIS B 72 6.619 -1.232 -7.052 1.00 0.00 O ATOM 2592 CB HIS B 72 8.393 -3.998 -8.368 1.00 0.00 C ATOM 2593 CG HIS B 72 8.335 -4.877 -9.578 1.00 0.00 C ATOM 2594 ND1 HIS B 72 9.097 -4.658 -10.707 1.00 0.00 N ATOM 2595 CD2 HIS B 72 7.601 -5.988 -9.831 1.00 0.00 C ATOM 2596 CE1 HIS B 72 8.835 -5.595 -11.602 1.00 0.00 C ATOM 2597 NE2 HIS B 72 7.932 -6.413 -11.095 1.00 0.00 N ATOM 0 H HIS B 72 8.287 -1.304 -10.200 1.00 0.00 H new ATOM 0 HA HIS B 72 6.879 -2.661 -9.109 1.00 0.00 H new ATOM 0 HB2 HIS B 72 9.428 -3.922 -8.034 1.00 0.00 H new ATOM 0 HB3 HIS B 72 7.831 -4.468 -7.561 1.00 0.00 H new ATOM 0 HD2 HIS B 72 6.889 -6.452 -9.164 1.00 0.00 H new ATOM 0 HE1 HIS B 72 9.283 -5.677 -12.581 1.00 0.00 H new ATOM 0 HE2 HIS B 72 7.542 -7.230 -11.566 1.00 0.00 H new ATOM 2606 N PHE B 73 8.612 -2.033 -6.378 1.00 0.00 N ATOM 2607 CA PHE B 73 8.559 -1.419 -5.053 1.00 0.00 C ATOM 2608 C PHE B 73 9.450 -2.179 -4.082 1.00 0.00 C ATOM 2609 O PHE B 73 10.225 -3.047 -4.486 1.00 0.00 O ATOM 2610 CB PHE B 73 7.125 -1.389 -4.517 1.00 0.00 C ATOM 2611 CG PHE B 73 6.543 -2.752 -4.274 1.00 0.00 C ATOM 2612 CD1 PHE B 73 6.210 -3.577 -5.335 1.00 0.00 C ATOM 2613 CD2 PHE B 73 6.324 -3.205 -2.982 1.00 0.00 C ATOM 2614 CE1 PHE B 73 5.670 -4.831 -5.115 1.00 0.00 C ATOM 2615 CE2 PHE B 73 5.785 -4.457 -2.754 1.00 0.00 C ATOM 2616 CZ PHE B 73 5.458 -5.271 -3.822 1.00 0.00 C ATOM 0 H PHE B 73 9.458 -2.576 -6.552 1.00 0.00 H new ATOM 0 HA PHE B 73 8.917 -0.394 -5.146 1.00 0.00 H new ATOM 0 HB2 PHE B 73 7.107 -0.824 -3.585 1.00 0.00 H new ATOM 0 HB3 PHE B 73 6.493 -0.855 -5.226 1.00 0.00 H new ATOM 0 HD1 PHE B 73 6.374 -3.237 -6.347 1.00 0.00 H new ATOM 0 HD2 PHE B 73 6.578 -2.572 -2.144 1.00 0.00 H new ATOM 0 HE1 PHE B 73 5.415 -5.465 -5.951 1.00 0.00 H new ATOM 0 HE2 PHE B 73 5.620 -4.799 -1.743 1.00 0.00 H new ATOM 0 HZ PHE B 73 5.037 -6.250 -3.646 1.00 0.00 H new ATOM 2626 N ILE B 74 9.336 -1.854 -2.802 1.00 0.00 N ATOM 2627 CA ILE B 74 10.136 -2.519 -1.785 1.00 0.00 C ATOM 2628 C ILE B 74 9.490 -2.418 -0.407 1.00 0.00 C ATOM 2629 O ILE B 74 9.378 -1.333 0.163 1.00 0.00 O ATOM 2630 CB ILE B 74 11.557 -1.938 -1.711 1.00 0.00 C ATOM 2631 CG1 ILE B 74 12.449 -2.881 -0.873 1.00 0.00 C ATOM 2632 CG2 ILE B 74 11.511 -0.515 -1.157 1.00 0.00 C ATOM 2633 CD1 ILE B 74 13.419 -2.201 0.076 1.00 0.00 C ATOM 0 H ILE B 74 8.702 -1.139 -2.445 1.00 0.00 H new ATOM 0 HA ILE B 74 10.193 -3.567 -2.079 1.00 0.00 H new ATOM 0 HB ILE B 74 11.995 -1.872 -2.707 1.00 0.00 H new ATOM 0 HG12 ILE B 74 11.804 -3.540 -0.292 1.00 0.00 H new ATOM 0 HG13 ILE B 74 13.019 -3.512 -1.555 1.00 0.00 H new ATOM 0 HG21 ILE B 74 12.522 -0.111 -1.108 1.00 0.00 H new ATOM 0 HG22 ILE B 74 10.902 0.110 -1.810 1.00 0.00 H new ATOM 0 HG23 ILE B 74 11.076 -0.528 -0.157 1.00 0.00 H new ATOM 0 HD11 ILE B 74 13.993 -2.956 0.612 1.00 0.00 H new ATOM 0 HD12 ILE B 74 14.098 -1.565 -0.492 1.00 0.00 H new ATOM 0 HD13 ILE B 74 12.864 -1.593 0.790 1.00 0.00 H new ATOM 2645 N TYR B 75 9.078 -3.563 0.121 1.00 0.00 N ATOM 2646 CA TYR B 75 8.453 -3.626 1.436 1.00 0.00 C ATOM 2647 C TYR B 75 9.453 -4.131 2.472 1.00 0.00 C ATOM 2648 O TYR B 75 10.203 -5.071 2.212 1.00 0.00 O ATOM 2649 CB TYR B 75 7.232 -4.549 1.396 1.00 0.00 C ATOM 2650 CG TYR B 75 6.066 -4.055 2.222 1.00 0.00 C ATOM 2651 CD1 TYR B 75 6.271 -3.452 3.456 1.00 0.00 C ATOM 2652 CD2 TYR B 75 4.761 -4.191 1.766 1.00 0.00 C ATOM 2653 CE1 TYR B 75 5.208 -3.001 4.215 1.00 0.00 C ATOM 2654 CE2 TYR B 75 3.692 -3.742 2.518 1.00 0.00 C ATOM 2655 CZ TYR B 75 3.920 -3.148 3.742 1.00 0.00 C ATOM 2656 OH TYR B 75 2.859 -2.697 4.494 1.00 0.00 O ATOM 0 H TYR B 75 9.166 -4.466 -0.345 1.00 0.00 H new ATOM 0 HA TYR B 75 8.130 -2.624 1.717 1.00 0.00 H new ATOM 0 HB2 TYR B 75 6.909 -4.664 0.361 1.00 0.00 H new ATOM 0 HB3 TYR B 75 7.524 -5.537 1.751 1.00 0.00 H new ATOM 0 HD1 TYR B 75 7.278 -3.334 3.829 1.00 0.00 H new ATOM 0 HD2 TYR B 75 4.579 -4.655 0.808 1.00 0.00 H new ATOM 0 HE1 TYR B 75 5.384 -2.536 5.174 1.00 0.00 H new ATOM 0 HE2 TYR B 75 2.683 -3.856 2.149 1.00 0.00 H new ATOM 0 HH TYR B 75 2.957 -1.735 4.654 1.00 0.00 H new ATOM 2666 N PHE B 76 9.466 -3.503 3.645 1.00 0.00 N ATOM 2667 CA PHE B 76 10.386 -3.903 4.705 1.00 0.00 C ATOM 2668 C PHE B 76 9.919 -3.396 6.064 1.00 0.00 C ATOM 2669 O PHE B 76 9.134 -2.454 6.151 1.00 0.00 O ATOM 2670 CB PHE B 76 11.793 -3.381 4.410 1.00 0.00 C ATOM 2671 CG PHE B 76 11.810 -2.000 3.820 1.00 0.00 C ATOM 2672 CD1 PHE B 76 11.272 -1.761 2.566 1.00 0.00 C ATOM 2673 CD2 PHE B 76 12.364 -0.941 4.521 1.00 0.00 C ATOM 2674 CE1 PHE B 76 11.287 -0.491 2.022 1.00 0.00 C ATOM 2675 CE2 PHE B 76 12.382 0.330 3.982 1.00 0.00 C ATOM 2676 CZ PHE B 76 11.843 0.556 2.732 1.00 0.00 C ATOM 0 H PHE B 76 8.855 -2.722 3.884 1.00 0.00 H new ATOM 0 HA PHE B 76 10.405 -4.992 4.736 1.00 0.00 H new ATOM 0 HB2 PHE B 76 12.372 -3.380 5.333 1.00 0.00 H new ATOM 0 HB3 PHE B 76 12.289 -4.067 3.723 1.00 0.00 H new ATOM 0 HD1 PHE B 76 10.836 -2.576 2.008 1.00 0.00 H new ATOM 0 HD2 PHE B 76 12.787 -1.112 5.500 1.00 0.00 H new ATOM 0 HE1 PHE B 76 10.865 -0.317 1.043 1.00 0.00 H new ATOM 0 HE2 PHE B 76 12.818 1.147 4.538 1.00 0.00 H new ATOM 0 HZ PHE B 76 11.856 1.550 2.309 1.00 0.00 H new ATOM 2686 N TYR B 77 10.407 -4.031 7.127 1.00 0.00 N ATOM 2687 CA TYR B 77 10.040 -3.642 8.484 1.00 0.00 C ATOM 2688 C TYR B 77 11.281 -3.347 9.322 1.00 0.00 C ATOM 2689 O TYR B 77 12.062 -4.247 9.631 1.00 0.00 O ATOM 2690 CB TYR B 77 9.207 -4.747 9.147 1.00 0.00 C ATOM 2691 CG TYR B 77 9.201 -4.679 10.659 1.00 0.00 C ATOM 2692 CD1 TYR B 77 10.166 -5.344 11.405 1.00 0.00 C ATOM 2693 CD2 TYR B 77 8.236 -3.947 11.339 1.00 0.00 C ATOM 2694 CE1 TYR B 77 10.170 -5.283 12.785 1.00 0.00 C ATOM 2695 CE2 TYR B 77 8.233 -3.879 12.720 1.00 0.00 C ATOM 2696 CZ TYR B 77 9.201 -4.549 13.438 1.00 0.00 C ATOM 2697 OH TYR B 77 9.202 -4.483 14.812 1.00 0.00 O ATOM 0 H TYR B 77 11.056 -4.816 7.074 1.00 0.00 H new ATOM 0 HA TYR B 77 9.442 -2.733 8.426 1.00 0.00 H new ATOM 0 HB2 TYR B 77 8.181 -4.683 8.785 1.00 0.00 H new ATOM 0 HB3 TYR B 77 9.594 -5.718 8.837 1.00 0.00 H new ATOM 0 HD1 TYR B 77 10.926 -5.919 10.897 1.00 0.00 H new ATOM 0 HD2 TYR B 77 7.475 -3.422 10.780 1.00 0.00 H new ATOM 0 HE1 TYR B 77 10.927 -5.807 13.350 1.00 0.00 H new ATOM 0 HE2 TYR B 77 7.477 -3.304 13.234 1.00 0.00 H new ATOM 0 HH TYR B 77 10.080 -4.180 15.124 1.00 0.00 H new ATOM 2707 N LEU B 78 11.452 -2.081 9.691 1.00 0.00 N ATOM 2708 CA LEU B 78 12.592 -1.667 10.502 1.00 0.00 C ATOM 2709 C LEU B 78 12.440 -2.172 11.935 1.00 0.00 C ATOM 2710 O LEU B 78 11.384 -2.683 12.309 1.00 0.00 O ATOM 2711 CB LEU B 78 12.727 -0.141 10.489 1.00 0.00 C ATOM 2712 CG LEU B 78 13.116 0.480 9.141 1.00 0.00 C ATOM 2713 CD1 LEU B 78 14.615 0.368 8.910 1.00 0.00 C ATOM 2714 CD2 LEU B 78 12.350 -0.175 7.999 1.00 0.00 C ATOM 0 H LEU B 78 10.816 -1.324 9.441 1.00 0.00 H new ATOM 0 HA LEU B 78 13.496 -2.102 10.075 1.00 0.00 H new ATOM 0 HB2 LEU B 78 11.779 0.292 10.808 1.00 0.00 H new ATOM 0 HB3 LEU B 78 13.474 0.146 11.230 1.00 0.00 H new ATOM 0 HG LEU B 78 12.849 1.537 9.168 1.00 0.00 H new ATOM 0 HD11 LEU B 78 14.869 0.814 7.949 1.00 0.00 H new ATOM 0 HD12 LEU B 78 15.146 0.892 9.705 1.00 0.00 H new ATOM 0 HD13 LEU B 78 14.906 -0.683 8.911 1.00 0.00 H new ATOM 0 HD21 LEU B 78 12.643 0.283 7.054 1.00 0.00 H new ATOM 0 HD22 LEU B 78 12.578 -1.241 7.972 1.00 0.00 H new ATOM 0 HD23 LEU B 78 11.280 -0.037 8.152 1.00 0.00 H new ATOM 2726 N GLY B 79 13.503 -2.030 12.725 1.00 0.00 N ATOM 2727 CA GLY B 79 13.479 -2.478 14.109 1.00 0.00 C ATOM 2728 C GLY B 79 12.078 -2.537 14.690 1.00 0.00 C ATOM 2729 O GLY B 79 11.743 -3.467 15.423 1.00 0.00 O ATOM 0 H GLY B 79 14.385 -1.611 12.429 1.00 0.00 H new ATOM 0 HA2 GLY B 79 13.935 -3.466 14.173 1.00 0.00 H new ATOM 0 HA3 GLY B 79 14.089 -1.806 14.713 1.00 0.00 H new ATOM 2733 N GLN B 80 11.261 -1.543 14.360 1.00 0.00 N ATOM 2734 CA GLN B 80 9.889 -1.490 14.852 1.00 0.00 C ATOM 2735 C GLN B 80 9.020 -0.624 13.943 1.00 0.00 C ATOM 2736 O GLN B 80 8.180 0.142 14.415 1.00 0.00 O ATOM 2737 CB GLN B 80 9.857 -0.946 16.281 1.00 0.00 C ATOM 2738 CG GLN B 80 10.419 -1.911 17.312 1.00 0.00 C ATOM 2739 CD GLN B 80 10.518 -1.295 18.694 1.00 0.00 C ATOM 2740 OE1 GLN B 80 9.702 -0.279 18.948 1.00 0.00 O flip ATOM 2741 NE2 GLN B 80 11.317 -1.729 19.524 1.00 0.00 N flip ATOM 0 H GLN B 80 11.524 -0.765 13.755 1.00 0.00 H new ATOM 0 HA GLN B 80 9.488 -2.504 14.850 1.00 0.00 H new ATOM 0 HB2 GLN B 80 10.424 -0.016 16.319 1.00 0.00 H new ATOM 0 HB3 GLN B 80 8.828 -0.703 16.546 1.00 0.00 H new ATOM 0 HG2 GLN B 80 9.786 -2.797 17.358 1.00 0.00 H new ATOM 0 HG3 GLN B 80 11.408 -2.242 16.994 1.00 0.00 H new ATOM 0 HE21 GLN B 80 11.925 -2.512 19.285 1.00 0.00 H new ATOM 0 HE22 GLN B 80 11.371 -1.305 20.450 1.00 0.00 H new ATOM 2750 N VAL B 81 9.235 -0.751 12.637 1.00 0.00 N ATOM 2751 CA VAL B 81 8.479 0.019 11.655 1.00 0.00 C ATOM 2752 C VAL B 81 8.436 -0.697 10.311 1.00 0.00 C ATOM 2753 O VAL B 81 9.144 -1.680 10.096 1.00 0.00 O ATOM 2754 CB VAL B 81 9.090 1.419 11.462 1.00 0.00 C ATOM 2755 CG1 VAL B 81 8.349 2.185 10.377 1.00 0.00 C ATOM 2756 CG2 VAL B 81 9.078 2.190 12.772 1.00 0.00 C ATOM 0 H VAL B 81 9.928 -1.381 12.234 1.00 0.00 H new ATOM 0 HA VAL B 81 7.464 0.120 12.038 1.00 0.00 H new ATOM 0 HB VAL B 81 10.126 1.301 11.144 1.00 0.00 H new ATOM 0 HG11 VAL B 81 8.797 3.171 10.257 1.00 0.00 H new ATOM 0 HG12 VAL B 81 8.416 1.639 9.436 1.00 0.00 H new ATOM 0 HG13 VAL B 81 7.302 2.294 10.659 1.00 0.00 H new ATOM 0 HG21 VAL B 81 9.513 3.177 12.617 1.00 0.00 H new ATOM 0 HG22 VAL B 81 8.051 2.297 13.122 1.00 0.00 H new ATOM 0 HG23 VAL B 81 9.661 1.649 13.518 1.00 0.00 H new ATOM 2766 N ALA B 82 7.602 -0.192 9.411 1.00 0.00 N ATOM 2767 CA ALA B 82 7.462 -0.773 8.084 1.00 0.00 C ATOM 2768 C ALA B 82 7.524 0.315 7.021 1.00 0.00 C ATOM 2769 O ALA B 82 7.171 1.465 7.280 1.00 0.00 O ATOM 2770 CB ALA B 82 6.156 -1.550 7.982 1.00 0.00 C ATOM 0 H ALA B 82 7.011 0.622 9.578 1.00 0.00 H new ATOM 0 HA ALA B 82 8.288 -1.465 7.916 1.00 0.00 H new ATOM 0 HB1 ALA B 82 6.065 -1.979 6.984 1.00 0.00 H new ATOM 0 HB2 ALA B 82 6.150 -2.350 8.723 1.00 0.00 H new ATOM 0 HB3 ALA B 82 5.318 -0.878 8.166 1.00 0.00 H new ATOM 2776 N ILE B 83 7.978 -0.046 5.829 1.00 0.00 N ATOM 2777 CA ILE B 83 8.086 0.916 4.741 1.00 0.00 C ATOM 2778 C ILE B 83 7.667 0.306 3.410 1.00 0.00 C ATOM 2779 O ILE B 83 8.065 -0.808 3.068 1.00 0.00 O ATOM 2780 CB ILE B 83 9.520 1.469 4.610 1.00 0.00 C ATOM 2781 CG1 ILE B 83 10.315 1.228 5.899 1.00 0.00 C ATOM 2782 CG2 ILE B 83 9.482 2.952 4.270 1.00 0.00 C ATOM 2783 CD1 ILE B 83 9.881 2.105 7.055 1.00 0.00 C ATOM 0 H ILE B 83 8.276 -0.992 5.591 1.00 0.00 H new ATOM 0 HA ILE B 83 7.410 1.735 4.988 1.00 0.00 H new ATOM 0 HB ILE B 83 10.023 0.940 3.800 1.00 0.00 H new ATOM 0 HG12 ILE B 83 10.212 0.182 6.189 1.00 0.00 H new ATOM 0 HG13 ILE B 83 11.373 1.401 5.701 1.00 0.00 H new ATOM 0 HG21 ILE B 83 10.500 3.331 4.180 1.00 0.00 H new ATOM 0 HG22 ILE B 83 8.957 3.095 3.326 1.00 0.00 H new ATOM 0 HG23 ILE B 83 8.962 3.493 5.060 1.00 0.00 H new ATOM 0 HD11 ILE B 83 10.488 1.878 7.932 1.00 0.00 H new ATOM 0 HD12 ILE B 83 10.011 3.153 6.785 1.00 0.00 H new ATOM 0 HD13 ILE B 83 8.832 1.916 7.281 1.00 0.00 H new ATOM 2795 N LEU B 84 6.863 1.054 2.663 1.00 0.00 N ATOM 2796 CA LEU B 84 6.384 0.613 1.361 1.00 0.00 C ATOM 2797 C LEU B 84 6.753 1.637 0.292 1.00 0.00 C ATOM 2798 O LEU B 84 6.068 2.647 0.124 1.00 0.00 O ATOM 2799 CB LEU B 84 4.867 0.406 1.402 1.00 0.00 C ATOM 2800 CG LEU B 84 4.147 0.567 0.062 1.00 0.00 C ATOM 2801 CD1 LEU B 84 3.930 -0.789 -0.592 1.00 0.00 C ATOM 2802 CD2 LEU B 84 2.820 1.288 0.256 1.00 0.00 C ATOM 0 H LEU B 84 6.528 1.976 2.941 1.00 0.00 H new ATOM 0 HA LEU B 84 6.859 -0.336 1.112 1.00 0.00 H new ATOM 0 HB2 LEU B 84 4.664 -0.593 1.787 1.00 0.00 H new ATOM 0 HB3 LEU B 84 4.440 1.114 2.112 1.00 0.00 H new ATOM 0 HG LEU B 84 4.772 1.169 -0.598 1.00 0.00 H new ATOM 0 HD11 LEU B 84 3.417 -0.656 -1.544 1.00 0.00 H new ATOM 0 HD12 LEU B 84 4.894 -1.269 -0.763 1.00 0.00 H new ATOM 0 HD13 LEU B 84 3.324 -1.416 0.062 1.00 0.00 H new ATOM 0 HD21 LEU B 84 2.320 1.395 -0.707 1.00 0.00 H new ATOM 0 HD22 LEU B 84 2.188 0.711 0.931 1.00 0.00 H new ATOM 0 HD23 LEU B 84 3.001 2.275 0.682 1.00 0.00 H new ATOM 2814 N LEU B 85 7.848 1.382 -0.417 1.00 0.00 N ATOM 2815 CA LEU B 85 8.313 2.296 -1.454 1.00 0.00 C ATOM 2816 C LEU B 85 7.929 1.806 -2.845 1.00 0.00 C ATOM 2817 O LEU B 85 8.144 0.644 -3.189 1.00 0.00 O ATOM 2818 CB LEU B 85 9.832 2.470 -1.365 1.00 0.00 C ATOM 2819 CG LEU B 85 10.303 3.895 -1.073 1.00 0.00 C ATOM 2820 CD1 LEU B 85 10.108 4.231 0.397 1.00 0.00 C ATOM 2821 CD2 LEU B 85 11.762 4.067 -1.471 1.00 0.00 C ATOM 0 H LEU B 85 8.428 0.552 -0.293 1.00 0.00 H new ATOM 0 HA LEU B 85 7.828 3.258 -1.288 1.00 0.00 H new ATOM 0 HB2 LEU B 85 10.213 1.810 -0.585 1.00 0.00 H new ATOM 0 HB3 LEU B 85 10.276 2.142 -2.305 1.00 0.00 H new ATOM 0 HG LEU B 85 9.701 4.584 -1.666 1.00 0.00 H new ATOM 0 HD11 LEU B 85 10.449 5.249 0.586 1.00 0.00 H new ATOM 0 HD12 LEU B 85 9.051 4.149 0.652 1.00 0.00 H new ATOM 0 HD13 LEU B 85 10.684 3.536 1.009 1.00 0.00 H new ATOM 0 HD21 LEU B 85 12.080 5.087 -1.256 1.00 0.00 H new ATOM 0 HD22 LEU B 85 12.378 3.368 -0.905 1.00 0.00 H new ATOM 0 HD23 LEU B 85 11.874 3.869 -2.537 1.00 0.00 H new ATOM 2833 N PHE B 86 7.364 2.708 -3.643 1.00 0.00 N ATOM 2834 CA PHE B 86 6.952 2.379 -5.003 1.00 0.00 C ATOM 2835 C PHE B 86 6.511 3.640 -5.752 1.00 0.00 C ATOM 2836 O PHE B 86 5.622 4.359 -5.300 1.00 0.00 O ATOM 2837 CB PHE B 86 5.825 1.333 -4.977 1.00 0.00 C ATOM 2838 CG PHE B 86 4.441 1.904 -5.131 1.00 0.00 C ATOM 2839 CD1 PHE B 86 3.868 2.656 -4.118 1.00 0.00 C ATOM 2840 CD2 PHE B 86 3.719 1.689 -6.293 1.00 0.00 C ATOM 2841 CE1 PHE B 86 2.599 3.183 -4.263 1.00 0.00 C ATOM 2842 CE2 PHE B 86 2.451 2.211 -6.444 1.00 0.00 C ATOM 2843 CZ PHE B 86 1.889 2.961 -5.428 1.00 0.00 C ATOM 0 H PHE B 86 7.181 3.674 -3.370 1.00 0.00 H new ATOM 0 HA PHE B 86 7.804 1.954 -5.534 1.00 0.00 H new ATOM 0 HB2 PHE B 86 5.998 0.611 -5.775 1.00 0.00 H new ATOM 0 HB3 PHE B 86 5.876 0.786 -4.036 1.00 0.00 H new ATOM 0 HD1 PHE B 86 4.419 2.832 -3.206 1.00 0.00 H new ATOM 0 HD2 PHE B 86 4.154 1.105 -7.091 1.00 0.00 H new ATOM 0 HE1 PHE B 86 2.162 3.768 -3.467 1.00 0.00 H new ATOM 0 HE2 PHE B 86 1.898 2.034 -7.355 1.00 0.00 H new ATOM 0 HZ PHE B 86 0.897 3.373 -5.544 1.00 0.00 H new ATOM 2853 N LYS B 87 7.137 3.902 -6.898 1.00 0.00 N ATOM 2854 CA LYS B 87 6.801 5.075 -7.699 1.00 0.00 C ATOM 2855 C LYS B 87 5.578 4.803 -8.567 1.00 0.00 C ATOM 2856 O LYS B 87 5.210 3.651 -8.793 1.00 0.00 O ATOM 2857 CB LYS B 87 7.985 5.485 -8.580 1.00 0.00 C ATOM 2858 CG LYS B 87 9.194 4.571 -8.453 1.00 0.00 C ATOM 2859 CD LYS B 87 10.473 5.280 -8.866 1.00 0.00 C ATOM 2860 CE LYS B 87 10.420 5.719 -10.320 1.00 0.00 C ATOM 2861 NZ LYS B 87 10.915 4.657 -11.238 1.00 0.00 N ATOM 0 H LYS B 87 7.877 3.320 -7.291 1.00 0.00 H new ATOM 0 HA LYS B 87 6.571 5.893 -7.017 1.00 0.00 H new ATOM 0 HB2 LYS B 87 7.662 5.501 -9.621 1.00 0.00 H new ATOM 0 HB3 LYS B 87 8.282 6.502 -8.322 1.00 0.00 H new ATOM 0 HG2 LYS B 87 9.284 4.226 -7.423 1.00 0.00 H new ATOM 0 HG3 LYS B 87 9.050 3.687 -9.074 1.00 0.00 H new ATOM 0 HD2 LYS B 87 10.631 6.149 -8.228 1.00 0.00 H new ATOM 0 HD3 LYS B 87 11.324 4.615 -8.716 1.00 0.00 H new ATOM 0 HE2 LYS B 87 9.395 5.978 -10.584 1.00 0.00 H new ATOM 0 HE3 LYS B 87 11.020 6.620 -10.450 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 11.902 4.855 -11.498 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 10.861 3.734 -10.762 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 10.328 4.639 -12.096 1.00 0.00 H new ATOM 2875 N SER B 88 4.951 5.871 -9.049 1.00 0.00 N ATOM 2876 CA SER B 88 3.767 5.742 -9.890 1.00 0.00 C ATOM 2877 C SER B 88 4.092 6.086 -11.335 1.00 0.00 C ATOM 2878 O SER B 88 3.205 6.380 -12.136 1.00 0.00 O ATOM 2879 CB SER B 88 2.652 6.646 -9.375 1.00 0.00 C ATOM 2880 OG SER B 88 1.748 5.925 -8.555 1.00 0.00 O ATOM 0 H SER B 88 5.242 6.833 -8.872 1.00 0.00 H new ATOM 0 HA SER B 88 3.431 4.706 -9.849 1.00 0.00 H new ATOM 0 HB2 SER B 88 3.082 7.472 -8.809 1.00 0.00 H new ATOM 0 HB3 SER B 88 2.115 7.082 -10.217 1.00 0.00 H new ATOM 0 HG SER B 88 1.044 5.531 -9.112 1.00 0.00 H new ATOM 2886 N GLY B 89 5.372 6.043 -11.651 1.00 0.00 N ATOM 2887 CA GLY B 89 5.822 6.346 -12.997 1.00 0.00 C ATOM 2888 C GLY B 89 4.941 7.370 -13.684 1.00 0.00 C ATOM 2889 O GLY B 89 3.916 6.971 -14.276 1.00 0.00 O ATOM 2890 OXT GLY B 89 5.276 8.572 -13.634 1.00 0.00 O ATOM 0 H GLY B 89 6.117 5.802 -10.997 1.00 0.00 H new ATOM 0 HA2 GLY B 89 6.846 6.718 -12.960 1.00 0.00 H new ATOM 0 HA3 GLY B 89 5.837 5.430 -13.587 1.00 0.00 H new