USER MOD reduce.3.24.130724 H: found=0, std=0, add=1346, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1340 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 43 ASN : amide:sc= -0.257 K(o=-0.26,f=-1.1!) USER MOD Set 1.2: B 47 GLN :FLIP amide:sc= 0 F(o=-1.2,f=-0.26) USER MOD Set 2.1: A 68 SER OG : rot -74:sc= 0.997 USER MOD Set 2.2: B 42 THR OG1 : rot 76:sc= 1.31 USER MOD Set 3.1: A 42 THR OG1 : rot 76:sc= 1.26 USER MOD Set 3.2: B 68 SER OG : rot 180:sc= -0.0663 USER MOD Set 4.1: A 29 SER OG : rot 151:sc= 0.0259 USER MOD Set 4.2: B 7 TYR OH : rot 90:sc=-0.00361 USER MOD Set 5.1: A 7 TYR OH : rot 105:sc= 0.976 USER MOD Set 5.2: B 29 SER OG : rot -162:sc= 0.7 USER MOD Set 6.1: A 4 THR OG1 : rot 38:sc= 1.97 USER MOD Set 6.2: A 60 LYS NZ :NH3+ -177:sc= 2.26 (180deg=1.06) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -176:sc= 0 (180deg=-0.0278) USER MOD Single : A 5 SER OG : rot -2:sc= 0.295 USER MOD Single : A 6 LYS NZ :NH3+ 168:sc= -0.0104 (180deg=-0.173) USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= -0.978 K(o=-0.98,f=-3.2!) USER MOD Single : A 14 LYS NZ :NH3+ 134:sc= 1.24 (180deg=0.6) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HD1:sc= 0.718 K(o=0.72,f=-5!) USER MOD Single : A 33 THR OG1 : rot 69:sc= 1.13 USER MOD Single : A 35 MET CE :methyl 145:sc= -0.301 (180deg=-1.77) USER MOD Single : A 39 ASN : amide:sc= -0.508 X(o=-0.51,f=-0.14) USER MOD Single : A 43 ASN : amide:sc= 0 X(o=0,f=-0.046) USER MOD Single : A 46 ASN : amide:sc= 1.07 K(o=1.1,f=0) USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 SER OG : rot 180:sc= 0.0306 USER MOD Single : A 53 GLN : amide:sc= -1.4 K(o=-1.4,f=-6.1!) USER MOD Single : A 55 LYS NZ :NH3+ -175:sc= -0.625 (180deg=-0.74) USER MOD Single : A 63 GLN :FLIP amide:sc= -0.0424 F(o=-0.82,f=-0.042) USER MOD Single : A 66 MET CE :methyl 156:sc= 0 (180deg=-0.356) USER MOD Single : A 67 SER OG : rot 98:sc= 1.25 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 174:sc= 1.26 (180deg=1.05) USER MOD Single : A 74 THR OG1 : rot 180:sc= -0.258 USER MOD Single : A 75 HIS : no HD1:sc= -0.0569 X(o=-0.057,f=0) USER MOD Single : A 78 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 79 HIS : no HD1:sc= -0.231 X(o=-0.23,f=-0.15) USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 81 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 82 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 83 HIS : no HD1:sc= -0.118 K(o=-0.12,f=-3.5!) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -166:sc=-0.00469 (180deg=-0.256) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0 USER MOD Single : B 5 SER OG : rot -69:sc= 0.64 USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 THR OG1 : rot 180:sc= 0.00741 USER MOD Single : B 11 GLN :FLIP amide:sc= -0.386 F(o=-0.91,f=-0.39) USER MOD Single : B 14 LYS NZ :NH3+ -179:sc= 1.03 (180deg=1.03) USER MOD Single : B 25 LYS NZ :NH3+ -153:sc= 1.04 (180deg=0.511) USER MOD Single : B 26 HIS : no HD1:sc= 0.108 K(o=0.11,f=-6.1!) USER MOD Single : B 33 THR OG1 : rot 78:sc= 1.64 USER MOD Single : B 35 MET CE :methyl 153:sc= -0.0703 (180deg=-0.841) USER MOD Single : B 39 ASN : amide:sc= -0.109 K(o=-0.11,f=-0.82) USER MOD Single : B 46 ASN : amide:sc= -1.75 X(o=-1.8,f=-2.1!) USER MOD Single : B 52 SER OG : rot 180:sc= 0 USER MOD Single : B 53 GLN : amide:sc= -0.26 K(o=-0.26,f=-0.89) USER MOD Single : B 55 LYS NZ :NH3+ -114:sc= 0.825 (180deg=0.0333) USER MOD Single : B 60 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0175) USER MOD Single : B 63 GLN : amide:sc=-0.000529 K(o=-0.00053,f=-0.82) USER MOD Single : B 66 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 67 SER OG : rot 180:sc= 0 USER MOD Single : B 71 THR OG1 : rot 160:sc= -0.21 USER MOD Single : B 73 LYS NZ :NH3+ -164:sc= -0.0636 (180deg=-0.322) USER MOD Single : B 74 THR OG1 : rot 45:sc= 0.067 USER MOD Single : B 75 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 78 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 79 HIS : no HD1:sc= -0.013 X(o=-0.013,f=0) USER MOD Single : B 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 81 HIS : no HD1:sc= -0.624 K(o=-0.62,f=-3.3!) USER MOD Single : B 82 HIS : no HD1:sc= 0 X(o=0,f=-0.0069) USER MOD Single : B 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.162 -1.064 22.723 1.00 0.00 N ATOM 2 CA MET A 1 3.675 -0.382 21.514 1.00 0.00 C ATOM 3 C MET A 1 2.582 0.463 20.871 1.00 0.00 C ATOM 4 O MET A 1 1.594 -0.066 20.366 1.00 0.00 O ATOM 5 CB MET A 1 4.187 -1.401 20.491 1.00 0.00 C ATOM 6 CG MET A 1 5.433 -2.153 20.927 1.00 0.00 C ATOM 7 SD MET A 1 5.990 -3.330 19.678 1.00 0.00 S ATOM 8 CE MET A 1 7.440 -4.010 20.479 1.00 0.00 C ATOM 0 H1 MET A 1 3.937 -1.580 23.186 1.00 0.00 H new ATOM 0 H2 MET A 1 2.775 -0.358 23.382 1.00 0.00 H new ATOM 0 H3 MET A 1 2.413 -1.733 22.453 1.00 0.00 H new ATOM 0 HA MET A 1 4.498 0.263 21.822 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.395 -2.121 20.286 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.398 -0.884 19.555 1.00 0.00 H new ATOM 0 HG2 MET A 1 6.231 -1.441 21.134 1.00 0.00 H new ATOM 0 HG3 MET A 1 5.229 -2.683 21.858 1.00 0.00 H new ATOM 0 HE1 MET A 1 7.898 -4.756 19.830 1.00 0.00 H new ATOM 0 HE2 MET A 1 8.155 -3.211 20.676 1.00 0.00 H new ATOM 0 HE3 MET A 1 7.150 -4.477 21.420 1.00 0.00 H new ATOM 17 N PRO A 2 2.749 1.792 20.872 1.00 0.00 N ATOM 18 CA PRO A 2 1.796 2.714 20.261 1.00 0.00 C ATOM 19 C PRO A 2 2.072 2.920 18.773 1.00 0.00 C ATOM 20 O PRO A 2 1.863 4.008 18.235 1.00 0.00 O ATOM 21 CB PRO A 2 2.046 4.002 21.040 1.00 0.00 C ATOM 22 CG PRO A 2 3.503 3.968 21.365 1.00 0.00 C ATOM 23 CD PRO A 2 3.886 2.510 21.482 1.00 0.00 C ATOM 0 HA PRO A 2 0.768 2.356 20.308 1.00 0.00 H new ATOM 0 HB2 PRO A 2 1.793 4.880 20.446 1.00 0.00 H new ATOM 0 HB3 PRO A 2 1.439 4.043 21.944 1.00 0.00 H new ATOM 0 HG2 PRO A 2 4.085 4.460 20.586 1.00 0.00 H new ATOM 0 HG3 PRO A 2 3.705 4.497 22.296 1.00 0.00 H new ATOM 0 HD2 PRO A 2 4.818 2.299 20.958 1.00 0.00 H new ATOM 0 HD3 PRO A 2 4.031 2.218 22.522 1.00 0.00 H new ATOM 31 N ILE A 3 2.535 1.864 18.112 1.00 0.00 N ATOM 32 CA ILE A 3 2.880 1.940 16.700 1.00 0.00 C ATOM 33 C ILE A 3 1.632 1.868 15.817 1.00 0.00 C ATOM 34 O ILE A 3 1.041 2.900 15.491 1.00 0.00 O ATOM 35 CB ILE A 3 3.898 0.845 16.299 1.00 0.00 C ATOM 36 CG1 ILE A 3 3.530 -0.507 16.926 1.00 0.00 C ATOM 37 CG2 ILE A 3 5.305 1.262 16.708 1.00 0.00 C ATOM 38 CD1 ILE A 3 4.428 -1.646 16.487 1.00 0.00 C ATOM 0 H ILE A 3 2.679 0.946 18.533 1.00 0.00 H new ATOM 0 HA ILE A 3 3.354 2.908 16.539 1.00 0.00 H new ATOM 0 HB ILE A 3 3.868 0.729 15.216 1.00 0.00 H new ATOM 0 HG12 ILE A 3 3.575 -0.418 18.011 1.00 0.00 H new ATOM 0 HG13 ILE A 3 2.499 -0.749 16.668 1.00 0.00 H new ATOM 0 HG21 ILE A 3 6.013 0.484 16.421 1.00 0.00 H new ATOM 0 HG22 ILE A 3 5.568 2.194 16.208 1.00 0.00 H new ATOM 0 HG23 ILE A 3 5.342 1.406 17.788 1.00 0.00 H new ATOM 0 HD11 ILE A 3 4.108 -2.569 16.970 1.00 0.00 H new ATOM 0 HD12 ILE A 3 4.365 -1.762 15.405 1.00 0.00 H new ATOM 0 HD13 ILE A 3 5.458 -1.427 16.769 1.00 0.00 H new ATOM 50 N THR A 4 1.211 0.666 15.448 1.00 0.00 N ATOM 51 CA THR A 4 0.012 0.512 14.649 1.00 0.00 C ATOM 52 C THR A 4 -1.217 0.458 15.540 1.00 0.00 C ATOM 53 O THR A 4 -1.266 -0.297 16.513 1.00 0.00 O ATOM 54 CB THR A 4 0.041 -0.754 13.777 1.00 0.00 C ATOM 55 OG1 THR A 4 1.276 -0.845 13.058 1.00 0.00 O ATOM 56 CG2 THR A 4 -1.116 -0.738 12.789 1.00 0.00 C ATOM 0 H THR A 4 1.680 -0.207 15.689 1.00 0.00 H new ATOM 0 HA THR A 4 -0.031 1.380 13.991 1.00 0.00 H new ATOM 0 HB THR A 4 -0.052 -1.619 14.433 1.00 0.00 H new ATOM 0 HG1 THR A 4 2.009 -0.529 13.626 1.00 0.00 H new ATOM 0 HG21 THR A 4 -1.085 -1.640 12.177 1.00 0.00 H new ATOM 0 HG22 THR A 4 -2.059 -0.702 13.334 1.00 0.00 H new ATOM 0 HG23 THR A 4 -1.034 0.139 12.147 1.00 0.00 H new ATOM 64 N SER A 5 -2.194 1.276 15.211 1.00 0.00 N ATOM 65 CA SER A 5 -3.470 1.283 15.892 1.00 0.00 C ATOM 66 C SER A 5 -4.521 1.802 14.932 1.00 0.00 C ATOM 67 O SER A 5 -4.181 2.324 13.871 1.00 0.00 O ATOM 68 CB SER A 5 -3.410 2.167 17.144 1.00 0.00 C ATOM 69 OG SER A 5 -2.432 1.700 18.059 1.00 0.00 O ATOM 0 H SER A 5 -2.124 1.960 14.457 1.00 0.00 H new ATOM 0 HA SER A 5 -3.722 0.272 16.211 1.00 0.00 H new ATOM 0 HB2 SER A 5 -3.181 3.193 16.856 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.386 2.182 17.628 1.00 0.00 H new ATOM 0 HG SER A 5 -2.021 0.882 17.709 1.00 0.00 H new ATOM 75 N LYS A 6 -5.785 1.657 15.282 1.00 0.00 N ATOM 76 CA LYS A 6 -6.846 2.215 14.466 1.00 0.00 C ATOM 77 C LYS A 6 -6.906 3.724 14.661 1.00 0.00 C ATOM 78 O LYS A 6 -7.524 4.438 13.867 1.00 0.00 O ATOM 79 CB LYS A 6 -8.195 1.587 14.816 1.00 0.00 C ATOM 80 CG LYS A 6 -8.247 0.082 14.602 1.00 0.00 C ATOM 81 CD LYS A 6 -9.651 -0.458 14.823 1.00 0.00 C ATOM 82 CE LYS A 6 -9.707 -1.972 14.686 1.00 0.00 C ATOM 83 NZ LYS A 6 -8.914 -2.660 15.737 1.00 0.00 N ATOM 0 H LYS A 6 -6.100 1.163 16.117 1.00 0.00 H new ATOM 0 HA LYS A 6 -6.630 1.993 13.421 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -8.426 1.804 15.859 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -8.971 2.057 14.212 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -7.919 -0.155 13.590 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -7.554 -0.409 15.285 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -9.998 -0.171 15.816 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -10.332 -0.003 14.103 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -10.744 -2.302 14.741 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -9.333 -2.260 13.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -9.140 -3.675 15.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -7.900 -2.530 15.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -9.147 -2.257 16.667 1.00 0.00 H new ATOM 97 N TYR A 7 -6.246 4.195 15.729 1.00 0.00 N ATOM 98 CA TYR A 7 -6.247 5.608 16.089 1.00 0.00 C ATOM 99 C TYR A 7 -7.683 6.083 16.279 1.00 0.00 C ATOM 100 O TYR A 7 -8.561 5.289 16.617 1.00 0.00 O ATOM 101 CB TYR A 7 -5.534 6.441 15.012 1.00 0.00 C ATOM 102 CG TYR A 7 -4.038 6.186 14.906 1.00 0.00 C ATOM 103 CD1 TYR A 7 -3.148 6.812 15.771 1.00 0.00 C ATOM 104 CD2 TYR A 7 -3.514 5.334 13.935 1.00 0.00 C ATOM 105 CE1 TYR A 7 -1.783 6.597 15.676 1.00 0.00 C ATOM 106 CE2 TYR A 7 -2.151 5.119 13.833 1.00 0.00 C ATOM 107 CZ TYR A 7 -1.290 5.752 14.704 1.00 0.00 C ATOM 108 OH TYR A 7 0.070 5.538 14.600 1.00 0.00 O ATOM 0 H TYR A 7 -5.702 3.606 16.360 1.00 0.00 H new ATOM 0 HA TYR A 7 -5.704 5.739 17.025 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -5.995 6.234 14.046 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -5.696 7.498 15.222 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -3.528 7.478 16.531 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -4.183 4.833 13.251 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -1.108 7.089 16.360 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -1.763 4.457 13.073 1.00 0.00 H new ATOM 0 HH TYR A 7 0.289 4.649 14.951 1.00 0.00 H new ATOM 118 N THR A 8 -7.925 7.368 16.101 1.00 0.00 N ATOM 119 CA THR A 8 -9.288 7.851 16.060 1.00 0.00 C ATOM 120 C THR A 8 -9.766 7.835 14.609 1.00 0.00 C ATOM 121 O THR A 8 -9.018 8.198 13.697 1.00 0.00 O ATOM 122 CB THR A 8 -9.443 9.255 16.695 1.00 0.00 C ATOM 123 OG1 THR A 8 -10.831 9.604 16.788 1.00 0.00 O ATOM 124 CG2 THR A 8 -8.702 10.321 15.904 1.00 0.00 C ATOM 0 H THR A 8 -7.208 8.084 15.984 1.00 0.00 H new ATOM 0 HA THR A 8 -9.911 7.189 16.662 1.00 0.00 H new ATOM 0 HB THR A 8 -9.005 9.211 17.692 1.00 0.00 H new ATOM 0 HG1 THR A 8 -10.919 10.492 17.192 1.00 0.00 H new ATOM 0 HG21 THR A 8 -8.837 11.290 16.384 1.00 0.00 H new ATOM 0 HG22 THR A 8 -7.640 10.077 15.871 1.00 0.00 H new ATOM 0 HG23 THR A 8 -9.097 10.361 14.889 1.00 0.00 H new ATOM 132 N ASP A 9 -10.995 7.383 14.403 1.00 0.00 N ATOM 133 CA ASP A 9 -11.506 7.099 13.065 1.00 0.00 C ATOM 134 C ASP A 9 -11.414 8.309 12.137 1.00 0.00 C ATOM 135 O ASP A 9 -10.982 8.177 10.993 1.00 0.00 O ATOM 136 CB ASP A 9 -12.951 6.589 13.135 1.00 0.00 C ATOM 137 CG ASP A 9 -13.931 7.632 13.640 1.00 0.00 C ATOM 138 OD1 ASP A 9 -13.857 8.001 14.835 1.00 0.00 O ATOM 139 OD2 ASP A 9 -14.787 8.076 12.849 1.00 0.00 O ATOM 0 H ASP A 9 -11.664 7.203 15.152 1.00 0.00 H new ATOM 0 HA ASP A 9 -10.872 6.319 12.642 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -13.261 6.259 12.144 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -12.990 5.717 13.788 1.00 0.00 H new ATOM 144 N GLU A 10 -11.777 9.489 12.631 1.00 0.00 N ATOM 145 CA GLU A 10 -11.797 10.684 11.793 1.00 0.00 C ATOM 146 C GLU A 10 -10.393 11.187 11.470 1.00 0.00 C ATOM 147 O GLU A 10 -10.221 12.029 10.592 1.00 0.00 O ATOM 148 CB GLU A 10 -12.620 11.797 12.437 1.00 0.00 C ATOM 149 CG GLU A 10 -14.107 11.505 12.463 1.00 0.00 C ATOM 150 CD GLU A 10 -14.933 12.757 12.650 1.00 0.00 C ATOM 151 OE1 GLU A 10 -15.010 13.566 11.700 1.00 0.00 O ATOM 152 OE2 GLU A 10 -15.515 12.936 13.739 1.00 0.00 O ATOM 0 H GLU A 10 -12.059 9.643 13.599 1.00 0.00 H new ATOM 0 HA GLU A 10 -12.270 10.397 10.854 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -12.270 11.954 13.457 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -12.449 12.727 11.894 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -14.396 11.017 11.532 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -14.324 10.805 13.270 1.00 0.00 H new ATOM 159 N GLN A 11 -9.391 10.679 12.168 1.00 0.00 N ATOM 160 CA GLN A 11 -8.014 11.015 11.842 1.00 0.00 C ATOM 161 C GLN A 11 -7.652 10.339 10.530 1.00 0.00 C ATOM 162 O GLN A 11 -7.359 10.995 9.536 1.00 0.00 O ATOM 163 CB GLN A 11 -7.077 10.556 12.963 1.00 0.00 C ATOM 164 CG GLN A 11 -5.632 10.996 12.802 1.00 0.00 C ATOM 165 CD GLN A 11 -4.770 10.557 13.973 1.00 0.00 C ATOM 166 OE1 GLN A 11 -5.254 10.401 15.092 1.00 0.00 O ATOM 167 NE2 GLN A 11 -3.483 10.365 13.727 1.00 0.00 N ATOM 0 H GLN A 11 -9.502 10.040 12.955 1.00 0.00 H new ATOM 0 HA GLN A 11 -7.907 12.095 11.739 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -7.455 10.936 13.912 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -7.107 9.468 13.021 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -5.228 10.582 11.879 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -5.592 12.081 12.709 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -3.118 10.504 12.785 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -2.857 10.078 14.480 1.00 0.00 H new ATOM 176 N VAL A 12 -7.737 9.016 10.530 1.00 0.00 N ATOM 177 CA VAL A 12 -7.444 8.226 9.350 1.00 0.00 C ATOM 178 C VAL A 12 -8.389 8.594 8.210 1.00 0.00 C ATOM 179 O VAL A 12 -7.964 8.771 7.067 1.00 0.00 O ATOM 180 CB VAL A 12 -7.581 6.723 9.650 1.00 0.00 C ATOM 181 CG1 VAL A 12 -7.195 5.899 8.435 1.00 0.00 C ATOM 182 CG2 VAL A 12 -6.740 6.337 10.859 1.00 0.00 C ATOM 0 H VAL A 12 -8.010 8.466 11.345 1.00 0.00 H new ATOM 0 HA VAL A 12 -6.417 8.441 9.055 1.00 0.00 H new ATOM 0 HB VAL A 12 -8.625 6.513 9.884 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -7.298 4.839 8.667 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -7.848 6.153 7.600 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -6.161 6.112 8.164 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -6.851 5.270 11.054 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -5.692 6.562 10.660 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -7.074 6.902 11.730 1.00 0.00 H new ATOM 192 N GLU A 13 -9.667 8.728 8.548 1.00 0.00 N ATOM 193 CA GLU A 13 -10.712 9.023 7.573 1.00 0.00 C ATOM 194 C GLU A 13 -10.416 10.312 6.810 1.00 0.00 C ATOM 195 O GLU A 13 -10.559 10.369 5.588 1.00 0.00 O ATOM 196 CB GLU A 13 -12.061 9.158 8.281 1.00 0.00 C ATOM 197 CG GLU A 13 -13.251 9.218 7.338 1.00 0.00 C ATOM 198 CD GLU A 13 -14.237 10.304 7.713 1.00 0.00 C ATOM 199 OE1 GLU A 13 -14.611 10.397 8.900 1.00 0.00 O ATOM 200 OE2 GLU A 13 -14.633 11.078 6.818 1.00 0.00 O ATOM 0 H GLU A 13 -10.008 8.635 9.505 1.00 0.00 H new ATOM 0 HA GLU A 13 -10.744 8.199 6.860 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -12.190 8.314 8.959 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -12.050 10.060 8.893 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -12.896 9.390 6.322 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -13.760 8.254 7.339 1.00 0.00 H new ATOM 207 N LYS A 14 -9.988 11.338 7.533 1.00 0.00 N ATOM 208 CA LYS A 14 -9.784 12.652 6.933 1.00 0.00 C ATOM 209 C LYS A 14 -8.503 12.701 6.120 1.00 0.00 C ATOM 210 O LYS A 14 -8.453 13.367 5.087 1.00 0.00 O ATOM 211 CB LYS A 14 -9.800 13.753 7.996 1.00 0.00 C ATOM 212 CG LYS A 14 -11.181 14.358 8.211 1.00 0.00 C ATOM 213 CD LYS A 14 -12.222 13.299 8.545 1.00 0.00 C ATOM 214 CE LYS A 14 -13.633 13.856 8.471 1.00 0.00 C ATOM 215 NZ LYS A 14 -13.906 14.852 9.540 1.00 0.00 N ATOM 0 H LYS A 14 -9.776 11.288 8.530 1.00 0.00 H new ATOM 0 HA LYS A 14 -10.615 12.831 6.250 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -9.439 13.344 8.939 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -9.106 14.541 7.704 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -11.135 15.088 9.019 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -11.485 14.895 7.313 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -12.124 12.462 7.854 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -12.037 12.909 9.546 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -13.786 14.321 7.497 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -14.348 13.037 8.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -14.376 15.683 9.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -14.523 14.427 10.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -13.010 15.144 9.980 1.00 0.00 H new ATOM 229 N ILE A 15 -7.473 11.993 6.567 1.00 0.00 N ATOM 230 CA ILE A 15 -6.259 11.879 5.766 1.00 0.00 C ATOM 231 C ILE A 15 -6.570 11.143 4.463 1.00 0.00 C ATOM 232 O ILE A 15 -6.205 11.601 3.381 1.00 0.00 O ATOM 233 CB ILE A 15 -5.106 11.163 6.522 1.00 0.00 C ATOM 234 CG1 ILE A 15 -4.355 12.137 7.436 1.00 0.00 C ATOM 235 CG2 ILE A 15 -4.127 10.526 5.548 1.00 0.00 C ATOM 236 CD1 ILE A 15 -5.174 12.673 8.587 1.00 0.00 C ATOM 0 H ILE A 15 -7.451 11.499 7.459 1.00 0.00 H new ATOM 0 HA ILE A 15 -5.915 12.891 5.552 1.00 0.00 H new ATOM 0 HB ILE A 15 -5.557 10.382 7.134 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -3.474 11.635 7.836 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -3.999 12.976 6.838 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -3.330 10.032 6.104 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -4.650 9.793 4.934 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -3.698 11.296 4.907 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -4.564 13.354 9.181 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -6.041 13.207 8.199 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -5.508 11.845 9.212 1.00 0.00 H new ATOM 248 N LEU A 16 -7.283 10.023 4.574 1.00 0.00 N ATOM 249 CA LEU A 16 -7.663 9.237 3.404 1.00 0.00 C ATOM 250 C LEU A 16 -8.502 10.060 2.437 1.00 0.00 C ATOM 251 O LEU A 16 -8.308 9.987 1.227 1.00 0.00 O ATOM 252 CB LEU A 16 -8.445 7.989 3.817 1.00 0.00 C ATOM 253 CG LEU A 16 -7.631 6.911 4.529 1.00 0.00 C ATOM 254 CD1 LEU A 16 -8.532 5.765 4.961 1.00 0.00 C ATOM 255 CD2 LEU A 16 -6.524 6.403 3.621 1.00 0.00 C ATOM 0 H LEU A 16 -7.608 9.641 5.462 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.743 8.935 2.904 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -9.263 8.293 4.470 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -8.895 7.551 2.926 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.178 7.347 5.419 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -7.937 5.005 5.467 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -9.296 6.140 5.642 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -9.010 5.328 4.084 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -5.951 5.635 4.140 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.961 5.980 2.716 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.865 7.229 3.354 1.00 0.00 H new ATOM 267 N ALA A 17 -9.426 10.844 2.981 1.00 0.00 N ATOM 268 CA ALA A 17 -10.310 11.673 2.173 1.00 0.00 C ATOM 269 C ALA A 17 -9.521 12.644 1.305 1.00 0.00 C ATOM 270 O ALA A 17 -9.734 12.720 0.093 1.00 0.00 O ATOM 271 CB ALA A 17 -11.278 12.435 3.062 1.00 0.00 C ATOM 0 H ALA A 17 -9.582 10.922 3.986 1.00 0.00 H new ATOM 0 HA ALA A 17 -10.874 11.014 1.514 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -11.932 13.050 2.444 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -11.879 11.729 3.635 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -10.719 13.074 3.746 1.00 0.00 H new ATOM 277 N GLU A 18 -8.599 13.374 1.923 1.00 0.00 N ATOM 278 CA GLU A 18 -7.817 14.368 1.204 1.00 0.00 C ATOM 279 C GLU A 18 -6.889 13.700 0.191 1.00 0.00 C ATOM 280 O GLU A 18 -6.725 14.196 -0.923 1.00 0.00 O ATOM 281 CB GLU A 18 -7.020 15.238 2.182 1.00 0.00 C ATOM 282 CG GLU A 18 -7.897 15.953 3.200 1.00 0.00 C ATOM 283 CD GLU A 18 -7.165 17.042 3.958 1.00 0.00 C ATOM 284 OE1 GLU A 18 -6.217 16.732 4.702 1.00 0.00 O ATOM 285 OE2 GLU A 18 -7.540 18.227 3.815 1.00 0.00 O ATOM 0 H GLU A 18 -8.377 13.296 2.915 1.00 0.00 H new ATOM 0 HA GLU A 18 -8.505 15.013 0.657 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -6.298 14.614 2.709 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -6.451 15.978 1.619 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -8.755 16.389 2.688 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -8.287 15.224 3.910 1.00 0.00 H new ATOM 292 N VAL A 19 -6.305 12.565 0.572 1.00 0.00 N ATOM 293 CA VAL A 19 -5.431 11.815 -0.327 1.00 0.00 C ATOM 294 C VAL A 19 -6.212 11.276 -1.528 1.00 0.00 C ATOM 295 O VAL A 19 -5.770 11.393 -2.672 1.00 0.00 O ATOM 296 CB VAL A 19 -4.731 10.646 0.404 1.00 0.00 C ATOM 297 CG1 VAL A 19 -3.943 9.783 -0.572 1.00 0.00 C ATOM 298 CG2 VAL A 19 -3.818 11.172 1.498 1.00 0.00 C ATOM 0 H VAL A 19 -6.421 12.146 1.495 1.00 0.00 H new ATOM 0 HA VAL A 19 -4.667 12.508 -0.680 1.00 0.00 H new ATOM 0 HB VAL A 19 -5.503 10.026 0.860 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -3.461 8.969 -0.031 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -4.619 9.371 -1.321 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -3.184 10.391 -1.064 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -3.334 10.335 2.002 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -3.059 11.819 1.059 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -4.405 11.740 2.220 1.00 0.00 H new ATOM 308 N ALA A 20 -7.381 10.701 -1.262 1.00 0.00 N ATOM 309 CA ALA A 20 -8.225 10.153 -2.320 1.00 0.00 C ATOM 310 C ALA A 20 -8.629 11.240 -3.306 1.00 0.00 C ATOM 311 O ALA A 20 -8.673 11.015 -4.516 1.00 0.00 O ATOM 312 CB ALA A 20 -9.458 9.489 -1.730 1.00 0.00 C ATOM 0 H ALA A 20 -7.766 10.602 -0.323 1.00 0.00 H new ATOM 0 HA ALA A 20 -7.649 9.399 -2.857 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -10.074 9.087 -2.534 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -9.153 8.680 -1.067 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -10.032 10.224 -1.166 1.00 0.00 H new ATOM 318 N LEU A 21 -8.911 12.424 -2.776 1.00 0.00 N ATOM 319 CA LEU A 21 -9.267 13.564 -3.600 1.00 0.00 C ATOM 320 C LEU A 21 -8.094 13.948 -4.496 1.00 0.00 C ATOM 321 O LEU A 21 -8.293 14.287 -5.650 1.00 0.00 O ATOM 322 CB LEU A 21 -9.705 14.746 -2.721 1.00 0.00 C ATOM 323 CG LEU A 21 -10.410 15.900 -3.450 1.00 0.00 C ATOM 324 CD1 LEU A 21 -11.343 16.632 -2.501 1.00 0.00 C ATOM 325 CD2 LEU A 21 -9.401 16.878 -4.034 1.00 0.00 C ATOM 0 H LEU A 21 -8.899 12.616 -1.774 1.00 0.00 H new ATOM 0 HA LEU A 21 -10.109 13.293 -4.237 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -10.373 14.370 -1.946 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -8.825 15.144 -2.217 1.00 0.00 H new ATOM 0 HG LEU A 21 -10.990 15.473 -4.268 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -11.835 17.447 -3.031 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -12.094 15.939 -2.123 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -10.770 17.036 -1.667 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -9.929 17.684 -4.544 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -8.791 17.294 -3.232 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -8.759 16.358 -4.745 1.00 0.00 H new ATOM 337 N VAL A 22 -6.871 13.862 -3.969 1.00 0.00 N ATOM 338 CA VAL A 22 -5.671 14.137 -4.764 1.00 0.00 C ATOM 339 C VAL A 22 -5.596 13.182 -5.952 1.00 0.00 C ATOM 340 O VAL A 22 -5.287 13.584 -7.078 1.00 0.00 O ATOM 341 CB VAL A 22 -4.375 13.998 -3.926 1.00 0.00 C ATOM 342 CG1 VAL A 22 -3.140 14.198 -4.792 1.00 0.00 C ATOM 343 CG2 VAL A 22 -4.367 14.985 -2.770 1.00 0.00 C ATOM 0 H VAL A 22 -6.685 13.605 -3.000 1.00 0.00 H new ATOM 0 HA VAL A 22 -5.747 15.167 -5.112 1.00 0.00 H new ATOM 0 HB VAL A 22 -4.352 12.987 -3.520 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -2.245 14.095 -4.179 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -3.125 13.449 -5.584 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -3.164 15.194 -5.235 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -3.447 14.867 -2.197 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -4.425 16.002 -3.159 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -5.224 14.795 -2.123 1.00 0.00 H new ATOM 353 N LEU A 23 -5.897 11.918 -5.688 1.00 0.00 N ATOM 354 CA LEU A 23 -5.887 10.887 -6.719 1.00 0.00 C ATOM 355 C LEU A 23 -6.904 11.212 -7.809 1.00 0.00 C ATOM 356 O LEU A 23 -6.602 11.136 -9.000 1.00 0.00 O ATOM 357 CB LEU A 23 -6.201 9.523 -6.099 1.00 0.00 C ATOM 358 CG LEU A 23 -5.327 9.135 -4.904 1.00 0.00 C ATOM 359 CD1 LEU A 23 -5.798 7.821 -4.301 1.00 0.00 C ATOM 360 CD2 LEU A 23 -3.864 9.038 -5.314 1.00 0.00 C ATOM 0 H LEU A 23 -6.153 11.579 -4.761 1.00 0.00 H new ATOM 0 HA LEU A 23 -4.894 10.854 -7.168 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -7.244 9.517 -5.783 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -6.096 8.759 -6.869 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.420 9.915 -4.148 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -5.164 7.562 -3.453 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -6.830 7.924 -3.965 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -5.738 7.034 -5.052 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -3.261 8.761 -4.449 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -3.753 8.281 -6.091 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -3.529 10.002 -5.696 1.00 0.00 H new ATOM 372 N GLU A 24 -8.105 11.592 -7.390 1.00 0.00 N ATOM 373 CA GLU A 24 -9.172 11.951 -8.315 1.00 0.00 C ATOM 374 C GLU A 24 -8.866 13.277 -9.012 1.00 0.00 C ATOM 375 O GLU A 24 -9.149 13.454 -10.199 1.00 0.00 O ATOM 376 CB GLU A 24 -10.494 12.044 -7.553 1.00 0.00 C ATOM 377 CG GLU A 24 -10.953 10.722 -6.967 1.00 0.00 C ATOM 378 CD GLU A 24 -12.360 10.796 -6.413 1.00 0.00 C ATOM 379 OE1 GLU A 24 -12.573 11.499 -5.405 1.00 0.00 O ATOM 380 OE2 GLU A 24 -13.269 10.168 -7.005 1.00 0.00 O ATOM 0 H GLU A 24 -8.365 11.660 -6.406 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.249 11.180 -9.081 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -10.389 12.771 -6.748 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -11.265 12.421 -8.225 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -10.908 9.951 -7.736 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -10.268 10.421 -6.174 1.00 0.00 H new ATOM 387 N LYS A 25 -8.274 14.188 -8.259 1.00 0.00 N ATOM 388 CA LYS A 25 -7.900 15.516 -8.740 1.00 0.00 C ATOM 389 C LYS A 25 -6.867 15.430 -9.862 1.00 0.00 C ATOM 390 O LYS A 25 -6.887 16.225 -10.800 1.00 0.00 O ATOM 391 CB LYS A 25 -7.351 16.313 -7.554 1.00 0.00 C ATOM 392 CG LYS A 25 -6.906 17.732 -7.848 1.00 0.00 C ATOM 393 CD LYS A 25 -6.478 18.403 -6.555 1.00 0.00 C ATOM 394 CE LYS A 25 -5.867 19.773 -6.779 1.00 0.00 C ATOM 395 NZ LYS A 25 -5.434 20.389 -5.496 1.00 0.00 N ATOM 0 H LYS A 25 -8.034 14.028 -7.281 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.775 16.016 -9.155 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.118 16.348 -6.781 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -6.504 15.768 -7.138 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -6.080 17.726 -8.559 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -7.719 18.292 -8.310 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -7.342 18.498 -5.897 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -5.756 17.767 -6.043 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -5.012 19.687 -7.450 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -6.593 20.421 -7.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -5.020 21.325 -5.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -6.255 20.493 -4.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -4.723 19.781 -5.041 1.00 0.00 H new ATOM 409 N HIS A 26 -5.967 14.460 -9.762 1.00 0.00 N ATOM 410 CA HIS A 26 -4.958 14.247 -10.796 1.00 0.00 C ATOM 411 C HIS A 26 -5.406 13.173 -11.780 1.00 0.00 C ATOM 412 O HIS A 26 -4.666 12.824 -12.701 1.00 0.00 O ATOM 413 CB HIS A 26 -3.609 13.852 -10.182 1.00 0.00 C ATOM 414 CG HIS A 26 -2.897 14.977 -9.495 1.00 0.00 C ATOM 415 ND1 HIS A 26 -1.834 15.653 -10.054 1.00 0.00 N ATOM 416 CD2 HIS A 26 -3.089 15.531 -8.277 1.00 0.00 C ATOM 417 CE1 HIS A 26 -1.406 16.569 -9.208 1.00 0.00 C ATOM 418 NE2 HIS A 26 -2.149 16.517 -8.121 1.00 0.00 N ATOM 0 H HIS A 26 -5.914 13.809 -8.978 1.00 0.00 H new ATOM 0 HA HIS A 26 -4.836 15.189 -11.330 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -3.770 13.047 -9.465 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -2.966 13.456 -10.968 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -3.844 15.249 -7.558 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -0.584 17.248 -9.378 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -2.042 17.112 -7.299 1.00 0.00 H new ATOM 427 N ALA A 27 -6.620 12.661 -11.575 1.00 0.00 N ATOM 428 CA ALA A 27 -7.177 11.599 -12.414 1.00 0.00 C ATOM 429 C ALA A 27 -6.212 10.417 -12.508 1.00 0.00 C ATOM 430 O ALA A 27 -5.926 9.911 -13.596 1.00 0.00 O ATOM 431 CB ALA A 27 -7.516 12.137 -13.800 1.00 0.00 C ATOM 0 H ALA A 27 -7.242 12.968 -10.827 1.00 0.00 H new ATOM 0 HA ALA A 27 -8.097 11.243 -11.951 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -7.929 11.334 -14.411 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -8.249 12.938 -13.710 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -6.612 12.523 -14.271 1.00 0.00 H new ATOM 437 N ALA A 28 -5.709 9.989 -11.358 1.00 0.00 N ATOM 438 CA ALA A 28 -4.754 8.896 -11.301 1.00 0.00 C ATOM 439 C ALA A 28 -5.425 7.567 -11.628 1.00 0.00 C ATOM 440 O ALA A 28 -6.413 7.187 -10.998 1.00 0.00 O ATOM 441 CB ALA A 28 -4.094 8.839 -9.930 1.00 0.00 C ATOM 0 H ALA A 28 -5.949 10.386 -10.449 1.00 0.00 H new ATOM 0 HA ALA A 28 -3.984 9.078 -12.051 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -3.381 8.015 -9.903 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -3.572 9.777 -9.738 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -4.856 8.685 -9.166 1.00 0.00 H new ATOM 447 N SER A 29 -4.890 6.882 -12.630 1.00 0.00 N ATOM 448 CA SER A 29 -5.382 5.568 -13.025 1.00 0.00 C ATOM 449 C SER A 29 -5.201 4.569 -11.883 1.00 0.00 C ATOM 450 O SER A 29 -4.365 4.780 -11.005 1.00 0.00 O ATOM 451 CB SER A 29 -4.614 5.098 -14.259 1.00 0.00 C ATOM 452 OG SER A 29 -4.522 6.135 -15.222 1.00 0.00 O ATOM 0 H SER A 29 -4.107 7.219 -13.190 1.00 0.00 H new ATOM 0 HA SER A 29 -6.445 5.634 -13.258 1.00 0.00 H new ATOM 0 HB2 SER A 29 -3.614 4.775 -13.969 1.00 0.00 H new ATOM 0 HB3 SER A 29 -5.114 4.233 -14.696 1.00 0.00 H new ATOM 0 HG SER A 29 -3.705 6.019 -15.751 1.00 0.00 H new ATOM 458 N PRO A 30 -5.982 3.473 -11.874 1.00 0.00 N ATOM 459 CA PRO A 30 -5.909 2.456 -10.816 1.00 0.00 C ATOM 460 C PRO A 30 -4.493 1.925 -10.607 1.00 0.00 C ATOM 461 O PRO A 30 -4.029 1.818 -9.471 1.00 0.00 O ATOM 462 CB PRO A 30 -6.833 1.345 -11.316 1.00 0.00 C ATOM 463 CG PRO A 30 -7.786 2.031 -12.232 1.00 0.00 C ATOM 464 CD PRO A 30 -7.008 3.142 -12.881 1.00 0.00 C ATOM 0 HA PRO A 30 -6.200 2.863 -9.848 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -6.273 0.568 -11.836 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -7.355 0.862 -10.490 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -8.176 1.339 -12.979 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -8.642 2.423 -11.683 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -6.560 2.823 -13.822 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -7.643 3.999 -13.105 1.00 0.00 H new ATOM 472 N GLU A 31 -3.806 1.606 -11.703 1.00 0.00 N ATOM 473 CA GLU A 31 -2.435 1.114 -11.617 1.00 0.00 C ATOM 474 C GLU A 31 -1.509 2.170 -11.013 1.00 0.00 C ATOM 475 O GLU A 31 -0.711 1.866 -10.128 1.00 0.00 O ATOM 476 CB GLU A 31 -1.921 0.650 -12.989 1.00 0.00 C ATOM 477 CG GLU A 31 -2.111 1.655 -14.114 1.00 0.00 C ATOM 478 CD GLU A 31 -1.440 1.215 -15.407 1.00 0.00 C ATOM 479 OE1 GLU A 31 -1.933 0.262 -16.047 1.00 0.00 O ATOM 480 OE2 GLU A 31 -0.409 1.817 -15.782 1.00 0.00 O ATOM 0 H GLU A 31 -4.173 1.679 -12.652 1.00 0.00 H new ATOM 0 HA GLU A 31 -2.436 0.249 -10.954 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -0.860 0.417 -12.904 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -2.430 -0.276 -13.258 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -3.177 1.799 -14.292 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -1.706 2.619 -13.808 1.00 0.00 H new ATOM 487 N LEU A 32 -1.639 3.414 -11.474 1.00 0.00 N ATOM 488 CA LEU A 32 -0.864 4.527 -10.924 1.00 0.00 C ATOM 489 C LEU A 32 -1.165 4.700 -9.438 1.00 0.00 C ATOM 490 O LEU A 32 -0.255 4.843 -8.627 1.00 0.00 O ATOM 491 CB LEU A 32 -1.179 5.830 -11.681 1.00 0.00 C ATOM 492 CG LEU A 32 -0.462 7.088 -11.170 1.00 0.00 C ATOM 493 CD1 LEU A 32 1.043 6.880 -11.150 1.00 0.00 C ATOM 494 CD2 LEU A 32 -0.813 8.293 -12.038 1.00 0.00 C ATOM 0 H LEU A 32 -2.274 3.677 -12.228 1.00 0.00 H new ATOM 0 HA LEU A 32 0.195 4.300 -11.045 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -0.922 5.689 -12.731 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -2.254 6.004 -11.636 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.799 7.279 -10.151 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.530 7.784 -10.785 1.00 0.00 H new ATOM 0 HD12 LEU A 32 1.286 6.045 -10.492 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.393 6.661 -12.159 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -0.296 9.176 -11.661 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.505 8.103 -13.066 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.889 8.462 -12.007 1.00 0.00 H new ATOM 506 N THR A 33 -2.447 4.654 -9.101 1.00 0.00 N ATOM 507 CA THR A 33 -2.904 4.823 -7.728 1.00 0.00 C ATOM 508 C THR A 33 -2.258 3.807 -6.787 1.00 0.00 C ATOM 509 O THR A 33 -1.641 4.171 -5.783 1.00 0.00 O ATOM 510 CB THR A 33 -4.436 4.672 -7.650 1.00 0.00 C ATOM 511 OG1 THR A 33 -5.073 5.658 -8.471 1.00 0.00 O ATOM 512 CG2 THR A 33 -4.927 4.797 -6.216 1.00 0.00 C ATOM 0 H THR A 33 -3.200 4.498 -9.772 1.00 0.00 H new ATOM 0 HA THR A 33 -2.611 5.825 -7.413 1.00 0.00 H new ATOM 0 HB THR A 33 -4.695 3.678 -8.015 1.00 0.00 H new ATOM 0 HG1 THR A 33 -4.896 5.462 -9.415 1.00 0.00 H new ATOM 0 HG21 THR A 33 -6.011 4.686 -6.192 1.00 0.00 H new ATOM 0 HG22 THR A 33 -4.469 4.019 -5.605 1.00 0.00 H new ATOM 0 HG23 THR A 33 -4.653 5.776 -5.822 1.00 0.00 H new ATOM 520 N LEU A 34 -2.394 2.534 -7.125 1.00 0.00 N ATOM 521 CA LEU A 34 -1.909 1.467 -6.270 1.00 0.00 C ATOM 522 C LEU A 34 -0.380 1.439 -6.252 1.00 0.00 C ATOM 523 O LEU A 34 0.235 1.120 -5.232 1.00 0.00 O ATOM 524 CB LEU A 34 -2.491 0.129 -6.735 1.00 0.00 C ATOM 525 CG LEU A 34 -2.269 -1.042 -5.783 1.00 0.00 C ATOM 526 CD1 LEU A 34 -3.502 -1.926 -5.729 1.00 0.00 C ATOM 527 CD2 LEU A 34 -1.065 -1.856 -6.218 1.00 0.00 C ATOM 0 H LEU A 34 -2.837 2.217 -7.987 1.00 0.00 H new ATOM 0 HA LEU A 34 -2.240 1.649 -5.248 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -3.563 0.252 -6.891 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -2.055 -0.122 -7.702 1.00 0.00 H new ATOM 0 HG LEU A 34 -2.082 -0.642 -4.786 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -3.325 -2.756 -5.045 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -4.353 -1.342 -5.379 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -3.714 -2.315 -6.725 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -0.920 -2.688 -5.529 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -1.231 -2.243 -7.223 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -0.178 -1.223 -6.215 1.00 0.00 H new ATOM 539 N MET A 35 0.228 1.796 -7.379 1.00 0.00 N ATOM 540 CA MET A 35 1.678 1.897 -7.465 1.00 0.00 C ATOM 541 C MET A 35 2.188 3.009 -6.552 1.00 0.00 C ATOM 542 O MET A 35 3.245 2.887 -5.931 1.00 0.00 O ATOM 543 CB MET A 35 2.111 2.154 -8.907 1.00 0.00 C ATOM 544 CG MET A 35 3.612 2.287 -9.083 1.00 0.00 C ATOM 545 SD MET A 35 4.086 2.483 -10.810 1.00 0.00 S ATOM 546 CE MET A 35 3.169 3.956 -11.255 1.00 0.00 C ATOM 0 H MET A 35 -0.262 2.020 -8.245 1.00 0.00 H new ATOM 0 HA MET A 35 2.110 0.952 -7.137 1.00 0.00 H new ATOM 0 HB2 MET A 35 1.752 1.338 -9.535 1.00 0.00 H new ATOM 0 HB3 MET A 35 1.631 3.065 -9.263 1.00 0.00 H new ATOM 0 HG2 MET A 35 3.968 3.145 -8.512 1.00 0.00 H new ATOM 0 HG3 MET A 35 4.103 1.405 -8.672 1.00 0.00 H new ATOM 0 HE1 MET A 35 3.750 4.546 -11.963 1.00 0.00 H new ATOM 0 HE2 MET A 35 2.222 3.671 -11.712 1.00 0.00 H new ATOM 0 HE3 MET A 35 2.976 4.549 -10.361 1.00 0.00 H new ATOM 556 N ILE A 36 1.421 4.092 -6.475 1.00 0.00 N ATOM 557 CA ILE A 36 1.729 5.193 -5.571 1.00 0.00 C ATOM 558 C ILE A 36 1.750 4.710 -4.126 1.00 0.00 C ATOM 559 O ILE A 36 2.676 5.019 -3.379 1.00 0.00 O ATOM 560 CB ILE A 36 0.719 6.355 -5.736 1.00 0.00 C ATOM 561 CG1 ILE A 36 1.035 7.134 -7.015 1.00 0.00 C ATOM 562 CG2 ILE A 36 0.722 7.280 -4.523 1.00 0.00 C ATOM 563 CD1 ILE A 36 0.047 8.238 -7.320 1.00 0.00 C ATOM 0 H ILE A 36 0.577 4.230 -7.031 1.00 0.00 H new ATOM 0 HA ILE A 36 2.719 5.568 -5.829 1.00 0.00 H new ATOM 0 HB ILE A 36 -0.282 5.931 -5.813 1.00 0.00 H new ATOM 0 HG12 ILE A 36 2.032 7.566 -6.929 1.00 0.00 H new ATOM 0 HG13 ILE A 36 1.060 6.440 -7.855 1.00 0.00 H new ATOM 0 HG21 ILE A 36 0.001 8.083 -4.676 1.00 0.00 H new ATOM 0 HG22 ILE A 36 0.451 6.713 -3.632 1.00 0.00 H new ATOM 0 HG23 ILE A 36 1.717 7.706 -4.393 1.00 0.00 H new ATOM 0 HD11 ILE A 36 0.339 8.743 -8.241 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -0.949 7.812 -7.440 1.00 0.00 H new ATOM 0 HD13 ILE A 36 0.038 8.955 -6.499 1.00 0.00 H new ATOM 575 N ALA A 37 0.742 3.930 -3.751 1.00 0.00 N ATOM 576 CA ALA A 37 0.668 3.371 -2.404 1.00 0.00 C ATOM 577 C ALA A 37 1.909 2.543 -2.086 1.00 0.00 C ATOM 578 O ALA A 37 2.443 2.602 -0.976 1.00 0.00 O ATOM 579 CB ALA A 37 -0.585 2.527 -2.250 1.00 0.00 C ATOM 0 H ALA A 37 -0.035 3.670 -4.359 1.00 0.00 H new ATOM 0 HA ALA A 37 0.623 4.198 -1.696 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -0.626 2.117 -1.241 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -1.465 3.146 -2.426 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -0.565 1.711 -2.972 1.00 0.00 H new ATOM 585 N GLY A 38 2.370 1.782 -3.068 1.00 0.00 N ATOM 586 CA GLY A 38 3.578 1.001 -2.897 1.00 0.00 C ATOM 587 C GLY A 38 4.806 1.875 -2.756 1.00 0.00 C ATOM 588 O GLY A 38 5.719 1.564 -1.991 1.00 0.00 O ATOM 0 H GLY A 38 1.928 1.691 -3.983 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.479 0.370 -2.014 1.00 0.00 H new ATOM 0 HA3 GLY A 38 3.703 0.336 -3.751 1.00 0.00 H new ATOM 592 N ASN A 39 4.823 2.980 -3.489 1.00 0.00 N ATOM 593 CA ASN A 39 5.929 3.926 -3.411 1.00 0.00 C ATOM 594 C ASN A 39 5.926 4.607 -2.045 1.00 0.00 C ATOM 595 O ASN A 39 6.979 4.919 -1.499 1.00 0.00 O ATOM 596 CB ASN A 39 5.826 4.965 -4.532 1.00 0.00 C ATOM 597 CG ASN A 39 7.152 5.644 -4.840 1.00 0.00 C ATOM 598 OD1 ASN A 39 8.002 5.816 -3.969 1.00 0.00 O ATOM 599 ND2 ASN A 39 7.338 6.026 -6.095 1.00 0.00 N ATOM 0 H ASN A 39 4.086 3.243 -4.143 1.00 0.00 H new ATOM 0 HA ASN A 39 6.868 3.387 -3.535 1.00 0.00 H new ATOM 0 HB2 ASN A 39 5.454 4.481 -5.435 1.00 0.00 H new ATOM 0 HB3 ASN A 39 5.094 5.722 -4.252 1.00 0.00 H new ATOM 0 HD21 ASN A 39 8.210 6.480 -6.366 1.00 0.00 H new ATOM 0 HD22 ASN A 39 6.609 5.866 -6.790 1.00 0.00 H new ATOM 606 N ILE A 40 4.732 4.813 -1.486 1.00 0.00 N ATOM 607 CA ILE A 40 4.602 5.357 -0.138 1.00 0.00 C ATOM 608 C ILE A 40 5.300 4.437 0.857 1.00 0.00 C ATOM 609 O ILE A 40 6.144 4.878 1.634 1.00 0.00 O ATOM 610 CB ILE A 40 3.123 5.525 0.286 1.00 0.00 C ATOM 611 CG1 ILE A 40 2.364 6.425 -0.697 1.00 0.00 C ATOM 612 CG2 ILE A 40 3.033 6.090 1.699 1.00 0.00 C ATOM 613 CD1 ILE A 40 2.936 7.821 -0.819 1.00 0.00 C ATOM 0 H ILE A 40 3.845 4.611 -1.947 1.00 0.00 H new ATOM 0 HA ILE A 40 5.066 6.343 -0.141 1.00 0.00 H new ATOM 0 HB ILE A 40 2.657 4.540 0.272 1.00 0.00 H new ATOM 0 HG12 ILE A 40 2.366 5.955 -1.680 1.00 0.00 H new ATOM 0 HG13 ILE A 40 1.324 6.496 -0.380 1.00 0.00 H new ATOM 0 HG21 ILE A 40 1.986 6.201 1.980 1.00 0.00 H new ATOM 0 HG22 ILE A 40 3.525 5.410 2.395 1.00 0.00 H new ATOM 0 HG23 ILE A 40 3.523 7.063 1.734 1.00 0.00 H new ATOM 0 HD11 ILE A 40 2.345 8.395 -1.532 1.00 0.00 H new ATOM 0 HD12 ILE A 40 2.908 8.312 0.154 1.00 0.00 H new ATOM 0 HD13 ILE A 40 3.967 7.762 -1.167 1.00 0.00 H new ATOM 625 N ALA A 41 4.952 3.150 0.813 1.00 0.00 N ATOM 626 CA ALA A 41 5.589 2.154 1.660 1.00 0.00 C ATOM 627 C ALA A 41 7.100 2.144 1.442 1.00 0.00 C ATOM 628 O ALA A 41 7.873 2.089 2.395 1.00 0.00 O ATOM 629 CB ALA A 41 5.003 0.779 1.388 1.00 0.00 C ATOM 0 H ALA A 41 4.230 2.777 0.196 1.00 0.00 H new ATOM 0 HA ALA A 41 5.398 2.415 2.701 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.489 0.043 2.029 1.00 0.00 H new ATOM 0 HB2 ALA A 41 3.933 0.792 1.596 1.00 0.00 H new ATOM 0 HB3 ALA A 41 5.166 0.514 0.343 1.00 0.00 H new ATOM 635 N THR A 42 7.512 2.222 0.182 1.00 0.00 N ATOM 636 CA THR A 42 8.926 2.253 -0.166 1.00 0.00 C ATOM 637 C THR A 42 9.608 3.490 0.427 1.00 0.00 C ATOM 638 O THR A 42 10.715 3.405 0.959 1.00 0.00 O ATOM 639 CB THR A 42 9.121 2.238 -1.697 1.00 0.00 C ATOM 640 OG1 THR A 42 8.412 1.131 -2.271 1.00 0.00 O ATOM 641 CG2 THR A 42 10.595 2.127 -2.058 1.00 0.00 C ATOM 0 H THR A 42 6.882 2.265 -0.619 1.00 0.00 H new ATOM 0 HA THR A 42 9.386 1.359 0.255 1.00 0.00 H new ATOM 0 HB THR A 42 8.730 3.175 -2.095 1.00 0.00 H new ATOM 0 HG1 THR A 42 7.453 1.332 -2.291 1.00 0.00 H new ATOM 0 HG21 THR A 42 10.704 2.119 -3.142 1.00 0.00 H new ATOM 0 HG22 THR A 42 11.136 2.979 -1.645 1.00 0.00 H new ATOM 0 HG23 THR A 42 11.002 1.204 -1.645 1.00 0.00 H new ATOM 649 N ASN A 43 8.938 4.637 0.334 1.00 0.00 N ATOM 650 CA ASN A 43 9.446 5.880 0.911 1.00 0.00 C ATOM 651 C ASN A 43 9.614 5.731 2.416 1.00 0.00 C ATOM 652 O ASN A 43 10.610 6.180 2.992 1.00 0.00 O ATOM 653 CB ASN A 43 8.500 7.047 0.604 1.00 0.00 C ATOM 654 CG ASN A 43 9.002 8.373 1.152 1.00 0.00 C ATOM 655 OD1 ASN A 43 8.725 8.735 2.296 1.00 0.00 O ATOM 656 ND2 ASN A 43 9.733 9.119 0.334 1.00 0.00 N ATOM 0 H ASN A 43 8.038 4.731 -0.137 1.00 0.00 H new ATOM 0 HA ASN A 43 10.417 6.093 0.463 1.00 0.00 H new ATOM 0 HB2 ASN A 43 8.372 7.130 -0.475 1.00 0.00 H new ATOM 0 HB3 ASN A 43 7.518 6.833 1.026 1.00 0.00 H new ATOM 0 HD21 ASN A 43 10.085 10.024 0.647 1.00 0.00 H new ATOM 0 HD22 ASN A 43 9.943 8.788 -0.607 1.00 0.00 H new ATOM 663 N VAL A 44 8.634 5.092 3.047 1.00 0.00 N ATOM 664 CA VAL A 44 8.704 4.804 4.468 1.00 0.00 C ATOM 665 C VAL A 44 9.926 3.950 4.764 1.00 0.00 C ATOM 666 O VAL A 44 10.759 4.318 5.591 1.00 0.00 O ATOM 667 CB VAL A 44 7.436 4.082 4.980 1.00 0.00 C ATOM 668 CG1 VAL A 44 7.554 3.756 6.463 1.00 0.00 C ATOM 669 CG2 VAL A 44 6.199 4.925 4.723 1.00 0.00 C ATOM 0 H VAL A 44 7.782 4.765 2.592 1.00 0.00 H new ATOM 0 HA VAL A 44 8.778 5.759 4.989 1.00 0.00 H new ATOM 0 HB VAL A 44 7.340 3.145 4.431 1.00 0.00 H new ATOM 0 HG11 VAL A 44 6.649 3.249 6.797 1.00 0.00 H new ATOM 0 HG12 VAL A 44 8.415 3.107 6.626 1.00 0.00 H new ATOM 0 HG13 VAL A 44 7.683 4.678 7.029 1.00 0.00 H new ATOM 0 HG21 VAL A 44 5.318 4.399 5.090 1.00 0.00 H new ATOM 0 HG22 VAL A 44 6.295 5.879 5.241 1.00 0.00 H new ATOM 0 HG23 VAL A 44 6.096 5.102 3.653 1.00 0.00 H new ATOM 679 N LEU A 45 10.055 2.839 4.046 1.00 0.00 N ATOM 680 CA LEU A 45 11.161 1.912 4.257 1.00 0.00 C ATOM 681 C LEU A 45 12.507 2.563 3.941 1.00 0.00 C ATOM 682 O LEU A 45 13.558 2.043 4.307 1.00 0.00 O ATOM 683 CB LEU A 45 10.986 0.657 3.405 1.00 0.00 C ATOM 684 CG LEU A 45 9.647 -0.064 3.562 1.00 0.00 C ATOM 685 CD1 LEU A 45 9.492 -1.144 2.503 1.00 0.00 C ATOM 686 CD2 LEU A 45 9.528 -0.666 4.951 1.00 0.00 C ATOM 0 H LEU A 45 9.406 2.558 3.311 1.00 0.00 H new ATOM 0 HA LEU A 45 11.152 1.634 5.311 1.00 0.00 H new ATOM 0 HB2 LEU A 45 11.111 0.930 2.357 1.00 0.00 H new ATOM 0 HB3 LEU A 45 11.786 -0.042 3.650 1.00 0.00 H new ATOM 0 HG LEU A 45 8.848 0.666 3.429 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.533 -1.645 2.632 1.00 0.00 H new ATOM 0 HD12 LEU A 45 9.534 -0.691 1.512 1.00 0.00 H new ATOM 0 HD13 LEU A 45 10.298 -1.871 2.604 1.00 0.00 H new ATOM 0 HD21 LEU A 45 8.569 -1.175 5.046 1.00 0.00 H new ATOM 0 HD22 LEU A 45 10.336 -1.381 5.108 1.00 0.00 H new ATOM 0 HD23 LEU A 45 9.594 0.126 5.697 1.00 0.00 H new ATOM 698 N ASN A 46 12.468 3.700 3.261 1.00 0.00 N ATOM 699 CA ASN A 46 13.682 4.413 2.892 1.00 0.00 C ATOM 700 C ASN A 46 14.108 5.429 3.952 1.00 0.00 C ATOM 701 O ASN A 46 15.218 5.351 4.477 1.00 0.00 O ATOM 702 CB ASN A 46 13.498 5.119 1.544 1.00 0.00 C ATOM 703 CG ASN A 46 14.085 4.335 0.386 1.00 0.00 C ATOM 704 OD1 ASN A 46 15.236 4.545 -0.001 1.00 0.00 O ATOM 705 ND2 ASN A 46 13.300 3.425 -0.172 1.00 0.00 N ATOM 0 H ASN A 46 11.606 4.149 2.953 1.00 0.00 H new ATOM 0 HA ASN A 46 14.474 3.668 2.813 1.00 0.00 H new ATOM 0 HB2 ASN A 46 12.435 5.281 1.366 1.00 0.00 H new ATOM 0 HB3 ASN A 46 13.967 6.102 1.587 1.00 0.00 H new ATOM 0 HD21 ASN A 46 13.643 2.866 -0.953 1.00 0.00 H new ATOM 0 HD22 ASN A 46 12.353 3.283 0.180 1.00 0.00 H new ATOM 712 N GLN A 47 13.235 6.379 4.285 1.00 0.00 N ATOM 713 CA GLN A 47 13.654 7.520 5.087 1.00 0.00 C ATOM 714 C GLN A 47 12.681 7.764 6.221 1.00 0.00 C ATOM 715 O GLN A 47 12.783 8.758 6.939 1.00 0.00 O ATOM 716 CB GLN A 47 13.708 8.778 4.211 1.00 0.00 C ATOM 717 CG GLN A 47 14.629 8.668 3.004 1.00 0.00 C ATOM 718 CD GLN A 47 14.584 9.905 2.127 1.00 0.00 C ATOM 719 OE1 GLN A 47 15.353 10.846 2.314 1.00 0.00 O ATOM 720 NE2 GLN A 47 13.672 9.916 1.165 1.00 0.00 N ATOM 0 H GLN A 47 12.251 6.380 4.016 1.00 0.00 H new ATOM 0 HA GLN A 47 14.640 7.302 5.498 1.00 0.00 H new ATOM 0 HB2 GLN A 47 12.701 9.007 3.864 1.00 0.00 H new ATOM 0 HB3 GLN A 47 14.032 9.619 4.824 1.00 0.00 H new ATOM 0 HG2 GLN A 47 15.651 8.504 3.344 1.00 0.00 H new ATOM 0 HG3 GLN A 47 14.347 7.797 2.413 1.00 0.00 H new ATOM 0 HE21 GLN A 47 13.052 9.116 1.041 1.00 0.00 H new ATOM 0 HE22 GLN A 47 13.591 10.725 0.549 1.00 0.00 H new ATOM 729 N ARG A 48 11.744 6.853 6.390 1.00 0.00 N ATOM 730 CA ARG A 48 10.587 7.131 7.212 1.00 0.00 C ATOM 731 C ARG A 48 10.285 5.979 8.172 1.00 0.00 C ATOM 732 O ARG A 48 9.163 5.839 8.655 1.00 0.00 O ATOM 733 CB ARG A 48 9.409 7.392 6.276 1.00 0.00 C ATOM 734 CG ARG A 48 8.396 8.360 6.824 1.00 0.00 C ATOM 735 CD ARG A 48 7.344 8.709 5.783 1.00 0.00 C ATOM 736 NE ARG A 48 6.191 9.391 6.371 1.00 0.00 N ATOM 737 CZ ARG A 48 5.905 10.684 6.199 1.00 0.00 C ATOM 738 NH1 ARG A 48 6.737 11.482 5.543 1.00 0.00 N ATOM 739 NH2 ARG A 48 4.790 11.182 6.708 1.00 0.00 N ATOM 0 H ARG A 48 11.761 5.922 5.973 1.00 0.00 H new ATOM 0 HA ARG A 48 10.777 8.004 7.836 1.00 0.00 H new ATOM 0 HB2 ARG A 48 9.788 7.776 5.329 1.00 0.00 H new ATOM 0 HB3 ARG A 48 8.913 6.446 6.060 1.00 0.00 H new ATOM 0 HG2 ARG A 48 7.914 7.927 7.700 1.00 0.00 H new ATOM 0 HG3 ARG A 48 8.900 9.269 7.154 1.00 0.00 H new ATOM 0 HD2 ARG A 48 7.789 9.345 5.018 1.00 0.00 H new ATOM 0 HD3 ARG A 48 7.011 7.798 5.286 1.00 0.00 H new ATOM 0 HE ARG A 48 5.561 8.840 6.954 1.00 0.00 H new ATOM 0 HH11 ARG A 48 7.607 11.110 5.163 1.00 0.00 H new ATOM 0 HH12 ARG A 48 6.506 12.468 5.419 1.00 0.00 H new ATOM 0 HH21 ARG A 48 4.153 10.579 7.229 1.00 0.00 H new ATOM 0 HH22 ARG A 48 4.567 12.169 6.579 1.00 0.00 H new ATOM 753 N VAL A 49 11.303 5.178 8.467 1.00 0.00 N ATOM 754 CA VAL A 49 11.143 4.022 9.343 1.00 0.00 C ATOM 755 C VAL A 49 12.499 3.587 9.900 1.00 0.00 C ATOM 756 O VAL A 49 13.545 3.900 9.321 1.00 0.00 O ATOM 757 CB VAL A 49 10.499 2.838 8.584 1.00 0.00 C ATOM 758 CG1 VAL A 49 11.484 2.213 7.627 1.00 0.00 C ATOM 759 CG2 VAL A 49 9.962 1.781 9.527 1.00 0.00 C ATOM 0 H VAL A 49 12.250 5.308 8.112 1.00 0.00 H new ATOM 0 HA VAL A 49 10.488 4.313 10.164 1.00 0.00 H new ATOM 0 HB VAL A 49 9.659 3.245 8.021 1.00 0.00 H new ATOM 0 HG11 VAL A 49 11.008 1.383 7.105 1.00 0.00 H new ATOM 0 HG12 VAL A 49 11.810 2.959 6.902 1.00 0.00 H new ATOM 0 HG13 VAL A 49 12.347 1.845 8.182 1.00 0.00 H new ATOM 0 HG21 VAL A 49 9.519 0.969 8.950 1.00 0.00 H new ATOM 0 HG22 VAL A 49 10.776 1.390 10.137 1.00 0.00 H new ATOM 0 HG23 VAL A 49 9.204 2.222 10.174 1.00 0.00 H new ATOM 769 N ALA A 50 12.474 2.867 11.013 1.00 0.00 N ATOM 770 CA ALA A 50 13.692 2.348 11.614 1.00 0.00 C ATOM 771 C ALA A 50 14.204 1.150 10.830 1.00 0.00 C ATOM 772 O ALA A 50 13.417 0.331 10.360 1.00 0.00 O ATOM 773 CB ALA A 50 13.444 1.966 13.067 1.00 0.00 C ATOM 0 H ALA A 50 11.620 2.629 11.518 1.00 0.00 H new ATOM 0 HA ALA A 50 14.452 3.129 11.585 1.00 0.00 H new ATOM 0 HB1 ALA A 50 14.365 1.579 13.504 1.00 0.00 H new ATOM 0 HB2 ALA A 50 13.120 2.845 13.624 1.00 0.00 H new ATOM 0 HB3 ALA A 50 12.670 1.200 13.115 1.00 0.00 H new ATOM 779 N ALA A 51 15.521 1.049 10.686 1.00 0.00 N ATOM 780 CA ALA A 51 16.132 -0.054 9.947 1.00 0.00 C ATOM 781 C ALA A 51 15.790 -1.393 10.590 1.00 0.00 C ATOM 782 O ALA A 51 15.572 -2.387 9.898 1.00 0.00 O ATOM 783 CB ALA A 51 17.639 0.129 9.870 1.00 0.00 C ATOM 0 H ALA A 51 16.188 1.718 11.071 1.00 0.00 H new ATOM 0 HA ALA A 51 15.729 -0.050 8.934 1.00 0.00 H new ATOM 0 HB1 ALA A 51 18.078 -0.701 9.317 1.00 0.00 H new ATOM 0 HB2 ALA A 51 17.866 1.066 9.361 1.00 0.00 H new ATOM 0 HB3 ALA A 51 18.054 0.154 10.877 1.00 0.00 H new ATOM 789 N SER A 52 15.722 -1.394 11.917 1.00 0.00 N ATOM 790 CA SER A 52 15.378 -2.587 12.684 1.00 0.00 C ATOM 791 C SER A 52 13.937 -3.012 12.423 1.00 0.00 C ATOM 792 O SER A 52 13.539 -4.133 12.733 1.00 0.00 O ATOM 793 CB SER A 52 15.540 -2.293 14.175 1.00 0.00 C ATOM 794 OG SER A 52 16.669 -1.464 14.406 1.00 0.00 O ATOM 0 H SER A 52 15.903 -0.570 12.491 1.00 0.00 H new ATOM 0 HA SER A 52 16.044 -3.394 12.376 1.00 0.00 H new ATOM 0 HB2 SER A 52 14.642 -1.805 14.554 1.00 0.00 H new ATOM 0 HB3 SER A 52 15.651 -3.228 14.725 1.00 0.00 H new ATOM 0 HG SER A 52 16.754 -1.287 15.366 1.00 0.00 H new ATOM 800 N GLN A 53 13.165 -2.109 11.836 1.00 0.00 N ATOM 801 CA GLN A 53 11.728 -2.287 11.737 1.00 0.00 C ATOM 802 C GLN A 53 11.288 -2.529 10.298 1.00 0.00 C ATOM 803 O GLN A 53 10.122 -2.817 10.046 1.00 0.00 O ATOM 804 CB GLN A 53 11.029 -1.038 12.288 1.00 0.00 C ATOM 805 CG GLN A 53 9.722 -1.327 13.007 1.00 0.00 C ATOM 806 CD GLN A 53 9.938 -2.112 14.293 1.00 0.00 C ATOM 807 OE1 GLN A 53 10.862 -2.916 14.400 1.00 0.00 O ATOM 808 NE2 GLN A 53 9.103 -1.872 15.285 1.00 0.00 N ATOM 0 H GLN A 53 13.513 -1.245 11.421 1.00 0.00 H new ATOM 0 HA GLN A 53 11.451 -3.165 12.320 1.00 0.00 H new ATOM 0 HB2 GLN A 53 11.705 -0.529 12.975 1.00 0.00 H new ATOM 0 HB3 GLN A 53 10.835 -0.350 11.465 1.00 0.00 H new ATOM 0 HG2 GLN A 53 9.219 -0.387 13.236 1.00 0.00 H new ATOM 0 HG3 GLN A 53 9.062 -1.889 12.346 1.00 0.00 H new ATOM 0 HE21 GLN A 53 8.347 -1.199 15.163 1.00 0.00 H new ATOM 0 HE22 GLN A 53 9.214 -2.360 16.174 1.00 0.00 H new ATOM 817 N ARG A 54 12.227 -2.443 9.366 1.00 0.00 N ATOM 818 CA ARG A 54 11.891 -2.434 7.944 1.00 0.00 C ATOM 819 C ARG A 54 11.339 -3.772 7.457 1.00 0.00 C ATOM 820 O ARG A 54 10.434 -3.801 6.626 1.00 0.00 O ATOM 821 CB ARG A 54 13.102 -1.987 7.123 1.00 0.00 C ATOM 822 CG ARG A 54 13.456 -0.543 7.415 1.00 0.00 C ATOM 823 CD ARG A 54 14.644 -0.023 6.628 1.00 0.00 C ATOM 824 NE ARG A 54 14.905 1.377 6.975 1.00 0.00 N ATOM 825 CZ ARG A 54 16.019 2.041 6.674 1.00 0.00 C ATOM 826 NH1 ARG A 54 16.974 1.459 5.970 1.00 0.00 N ATOM 827 NH2 ARG A 54 16.171 3.297 7.073 1.00 0.00 N ATOM 0 H ARG A 54 13.225 -2.379 9.565 1.00 0.00 H new ATOM 0 HA ARG A 54 11.085 -1.714 7.800 1.00 0.00 H new ATOM 0 HB2 ARG A 54 13.955 -2.627 7.349 1.00 0.00 H new ATOM 0 HB3 ARG A 54 12.889 -2.105 6.061 1.00 0.00 H new ATOM 0 HG2 ARG A 54 12.590 0.083 7.200 1.00 0.00 H new ATOM 0 HG3 ARG A 54 13.666 -0.440 8.480 1.00 0.00 H new ATOM 0 HD2 ARG A 54 15.525 -0.629 6.841 1.00 0.00 H new ATOM 0 HD3 ARG A 54 14.448 -0.110 5.559 1.00 0.00 H new ATOM 0 HE ARG A 54 14.179 1.880 7.485 1.00 0.00 H new ATOM 0 HH11 ARG A 54 16.860 0.496 5.654 1.00 0.00 H new ATOM 0 HH12 ARG A 54 17.825 1.973 5.743 1.00 0.00 H new ATOM 0 HH21 ARG A 54 15.434 3.754 7.610 1.00 0.00 H new ATOM 0 HH22 ARG A 54 17.025 3.806 6.842 1.00 0.00 H new ATOM 841 N LYS A 55 11.846 -4.874 7.988 1.00 0.00 N ATOM 842 CA LYS A 55 11.324 -6.182 7.613 1.00 0.00 C ATOM 843 C LYS A 55 9.971 -6.417 8.264 1.00 0.00 C ATOM 844 O LYS A 55 9.024 -6.831 7.600 1.00 0.00 O ATOM 845 CB LYS A 55 12.299 -7.298 7.991 1.00 0.00 C ATOM 846 CG LYS A 55 13.171 -7.757 6.833 1.00 0.00 C ATOM 847 CD LYS A 55 12.347 -8.451 5.752 1.00 0.00 C ATOM 848 CE LYS A 55 12.307 -9.969 5.934 1.00 0.00 C ATOM 849 NZ LYS A 55 11.615 -10.397 7.183 1.00 0.00 N ATOM 0 H LYS A 55 12.605 -4.892 8.669 1.00 0.00 H new ATOM 0 HA LYS A 55 11.202 -6.197 6.530 1.00 0.00 H new ATOM 0 HB2 LYS A 55 12.939 -6.952 8.803 1.00 0.00 H new ATOM 0 HB3 LYS A 55 11.735 -8.150 8.371 1.00 0.00 H new ATOM 0 HG2 LYS A 55 13.688 -6.899 6.403 1.00 0.00 H new ATOM 0 HG3 LYS A 55 13.937 -8.439 7.201 1.00 0.00 H new ATOM 0 HD2 LYS A 55 11.330 -8.059 5.767 1.00 0.00 H new ATOM 0 HD3 LYS A 55 12.765 -8.216 4.773 1.00 0.00 H new ATOM 0 HE2 LYS A 55 11.804 -10.417 5.077 1.00 0.00 H new ATOM 0 HE3 LYS A 55 13.327 -10.354 5.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 11.696 -11.428 7.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 12.055 -9.929 8.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 10.611 -10.132 7.131 1.00 0.00 H new ATOM 863 N LEU A 56 9.881 -6.130 9.557 1.00 0.00 N ATOM 864 CA LEU A 56 8.630 -6.288 10.287 1.00 0.00 C ATOM 865 C LEU A 56 7.524 -5.443 9.677 1.00 0.00 C ATOM 866 O LEU A 56 6.433 -5.936 9.411 1.00 0.00 O ATOM 867 CB LEU A 56 8.800 -5.901 11.757 1.00 0.00 C ATOM 868 CG LEU A 56 9.579 -6.892 12.615 1.00 0.00 C ATOM 869 CD1 LEU A 56 9.675 -6.384 14.043 1.00 0.00 C ATOM 870 CD2 LEU A 56 8.910 -8.257 12.585 1.00 0.00 C ATOM 0 H LEU A 56 10.659 -5.787 10.121 1.00 0.00 H new ATOM 0 HA LEU A 56 8.353 -7.340 10.220 1.00 0.00 H new ATOM 0 HB2 LEU A 56 9.302 -4.935 11.804 1.00 0.00 H new ATOM 0 HB3 LEU A 56 7.811 -5.768 12.195 1.00 0.00 H new ATOM 0 HG LEU A 56 10.586 -6.990 12.209 1.00 0.00 H new ATOM 0 HD11 LEU A 56 10.233 -7.099 14.647 1.00 0.00 H new ATOM 0 HD12 LEU A 56 10.188 -5.422 14.053 1.00 0.00 H new ATOM 0 HD13 LEU A 56 8.673 -6.265 14.455 1.00 0.00 H new ATOM 0 HD21 LEU A 56 9.477 -8.954 13.202 1.00 0.00 H new ATOM 0 HD22 LEU A 56 7.895 -8.173 12.972 1.00 0.00 H new ATOM 0 HD23 LEU A 56 8.878 -8.624 11.559 1.00 0.00 H new ATOM 882 N ILE A 57 7.820 -4.173 9.437 1.00 0.00 N ATOM 883 CA ILE A 57 6.813 -3.228 8.980 1.00 0.00 C ATOM 884 C ILE A 57 6.389 -3.524 7.539 1.00 0.00 C ATOM 885 O ILE A 57 5.245 -3.269 7.162 1.00 0.00 O ATOM 886 CB ILE A 57 7.315 -1.768 9.125 1.00 0.00 C ATOM 887 CG1 ILE A 57 6.146 -0.786 9.126 1.00 0.00 C ATOM 888 CG2 ILE A 57 8.297 -1.407 8.021 1.00 0.00 C ATOM 889 CD1 ILE A 57 6.554 0.621 9.511 1.00 0.00 C ATOM 0 H ILE A 57 8.752 -3.774 9.552 1.00 0.00 H new ATOM 0 HA ILE A 57 5.934 -3.345 9.614 1.00 0.00 H new ATOM 0 HB ILE A 57 7.833 -1.697 10.081 1.00 0.00 H new ATOM 0 HG12 ILE A 57 5.693 -0.768 8.135 1.00 0.00 H new ATOM 0 HG13 ILE A 57 5.383 -1.139 9.819 1.00 0.00 H new ATOM 0 HG21 ILE A 57 8.629 -0.377 8.152 1.00 0.00 H new ATOM 0 HG22 ILE A 57 9.157 -2.075 8.067 1.00 0.00 H new ATOM 0 HG23 ILE A 57 7.809 -1.510 7.052 1.00 0.00 H new ATOM 0 HD11 ILE A 57 5.679 1.271 9.493 1.00 0.00 H new ATOM 0 HD12 ILE A 57 6.981 0.614 10.514 1.00 0.00 H new ATOM 0 HD13 ILE A 57 7.296 0.991 8.803 1.00 0.00 H new ATOM 901 N ALA A 58 7.300 -4.087 6.744 1.00 0.00 N ATOM 902 CA ALA A 58 6.975 -4.479 5.376 1.00 0.00 C ATOM 903 C ALA A 58 6.003 -5.656 5.370 1.00 0.00 C ATOM 904 O ALA A 58 5.012 -5.655 4.640 1.00 0.00 O ATOM 905 CB ALA A 58 8.237 -4.829 4.602 1.00 0.00 C ATOM 0 H ALA A 58 8.262 -4.280 7.023 1.00 0.00 H new ATOM 0 HA ALA A 58 6.495 -3.632 4.885 1.00 0.00 H new ATOM 0 HB1 ALA A 58 7.972 -5.118 3.585 1.00 0.00 H new ATOM 0 HB2 ALA A 58 8.898 -3.962 4.572 1.00 0.00 H new ATOM 0 HB3 ALA A 58 8.747 -5.657 5.093 1.00 0.00 H new ATOM 911 N GLU A 59 6.289 -6.654 6.201 1.00 0.00 N ATOM 912 CA GLU A 59 5.425 -7.822 6.321 1.00 0.00 C ATOM 913 C GLU A 59 4.107 -7.424 6.975 1.00 0.00 C ATOM 914 O GLU A 59 3.036 -7.865 6.564 1.00 0.00 O ATOM 915 CB GLU A 59 6.127 -8.907 7.141 1.00 0.00 C ATOM 916 CG GLU A 59 7.478 -9.307 6.567 1.00 0.00 C ATOM 917 CD GLU A 59 8.263 -10.226 7.479 1.00 0.00 C ATOM 918 OE1 GLU A 59 8.167 -10.073 8.714 1.00 0.00 O ATOM 919 OE2 GLU A 59 9.007 -11.085 6.965 1.00 0.00 O ATOM 0 H GLU A 59 7.113 -6.676 6.801 1.00 0.00 H new ATOM 0 HA GLU A 59 5.215 -8.220 5.328 1.00 0.00 H new ATOM 0 HB2 GLU A 59 6.264 -8.551 8.162 1.00 0.00 H new ATOM 0 HB3 GLU A 59 5.486 -9.787 7.193 1.00 0.00 H new ATOM 0 HG2 GLU A 59 7.326 -9.801 5.607 1.00 0.00 H new ATOM 0 HG3 GLU A 59 8.064 -8.409 6.374 1.00 0.00 H new ATOM 926 N LYS A 60 4.207 -6.564 7.981 1.00 0.00 N ATOM 927 CA LYS A 60 3.048 -6.026 8.687 1.00 0.00 C ATOM 928 C LYS A 60 2.098 -5.341 7.703 1.00 0.00 C ATOM 929 O LYS A 60 0.874 -5.456 7.812 1.00 0.00 O ATOM 930 CB LYS A 60 3.538 -5.037 9.755 1.00 0.00 C ATOM 931 CG LYS A 60 2.470 -4.544 10.719 1.00 0.00 C ATOM 932 CD LYS A 60 3.098 -3.787 11.885 1.00 0.00 C ATOM 933 CE LYS A 60 3.805 -2.511 11.436 1.00 0.00 C ATOM 934 NZ LYS A 60 2.855 -1.468 10.970 1.00 0.00 N ATOM 0 H LYS A 60 5.099 -6.217 8.333 1.00 0.00 H new ATOM 0 HA LYS A 60 2.498 -6.834 9.169 1.00 0.00 H new ATOM 0 HB2 LYS A 60 4.333 -5.512 10.330 1.00 0.00 H new ATOM 0 HB3 LYS A 60 3.979 -4.175 9.254 1.00 0.00 H new ATOM 0 HG2 LYS A 60 1.771 -3.894 10.192 1.00 0.00 H new ATOM 0 HG3 LYS A 60 1.896 -5.390 11.096 1.00 0.00 H new ATOM 0 HD2 LYS A 60 2.324 -3.535 12.610 1.00 0.00 H new ATOM 0 HD3 LYS A 60 3.812 -4.435 12.393 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.396 -2.117 12.263 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.501 -2.749 10.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 3.387 -0.642 10.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 2.273 -1.849 10.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 2.239 -1.182 11.758 1.00 0.00 H new ATOM 948 N PHE A 61 2.681 -4.634 6.741 1.00 0.00 N ATOM 949 CA PHE A 61 1.927 -3.993 5.671 1.00 0.00 C ATOM 950 C PHE A 61 1.152 -5.026 4.863 1.00 0.00 C ATOM 951 O PHE A 61 -0.067 -4.931 4.718 1.00 0.00 O ATOM 952 CB PHE A 61 2.883 -3.228 4.750 1.00 0.00 C ATOM 953 CG PHE A 61 2.215 -2.553 3.584 1.00 0.00 C ATOM 954 CD1 PHE A 61 1.461 -1.408 3.766 1.00 0.00 C ATOM 955 CD2 PHE A 61 2.354 -3.062 2.305 1.00 0.00 C ATOM 956 CE1 PHE A 61 0.859 -0.780 2.694 1.00 0.00 C ATOM 957 CE2 PHE A 61 1.752 -2.443 1.229 1.00 0.00 C ATOM 958 CZ PHE A 61 1.003 -1.300 1.423 1.00 0.00 C ATOM 0 H PHE A 61 3.689 -4.489 6.681 1.00 0.00 H new ATOM 0 HA PHE A 61 1.216 -3.298 6.118 1.00 0.00 H new ATOM 0 HB2 PHE A 61 3.409 -2.475 5.337 1.00 0.00 H new ATOM 0 HB3 PHE A 61 3.635 -3.920 4.371 1.00 0.00 H new ATOM 0 HD1 PHE A 61 1.342 -1.000 4.759 1.00 0.00 H new ATOM 0 HD2 PHE A 61 2.941 -3.955 2.147 1.00 0.00 H new ATOM 0 HE1 PHE A 61 0.277 0.116 2.849 1.00 0.00 H new ATOM 0 HE2 PHE A 61 1.867 -2.852 0.236 1.00 0.00 H new ATOM 0 HZ PHE A 61 0.531 -0.813 0.582 1.00 0.00 H new ATOM 968 N ALA A 62 1.874 -6.020 4.362 1.00 0.00 N ATOM 969 CA ALA A 62 1.296 -7.045 3.504 1.00 0.00 C ATOM 970 C ALA A 62 0.193 -7.814 4.221 1.00 0.00 C ATOM 971 O ALA A 62 -0.901 -7.976 3.691 1.00 0.00 O ATOM 972 CB ALA A 62 2.380 -7.997 3.019 1.00 0.00 C ATOM 0 H ALA A 62 2.872 -6.138 4.538 1.00 0.00 H new ATOM 0 HA ALA A 62 0.848 -6.549 2.643 1.00 0.00 H new ATOM 0 HB1 ALA A 62 1.935 -8.759 2.379 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.128 -7.440 2.455 1.00 0.00 H new ATOM 0 HB3 ALA A 62 2.854 -8.475 3.876 1.00 0.00 H new ATOM 978 N GLN A 63 0.471 -8.267 5.437 1.00 0.00 N ATOM 979 CA GLN A 63 -0.498 -9.062 6.180 1.00 0.00 C ATOM 980 C GLN A 63 -1.806 -8.297 6.368 1.00 0.00 C ATOM 981 O GLN A 63 -2.891 -8.861 6.222 1.00 0.00 O ATOM 982 CB GLN A 63 0.057 -9.475 7.543 1.00 0.00 C ATOM 983 CG GLN A 63 1.336 -10.295 7.467 1.00 0.00 C ATOM 984 CD GLN A 63 1.165 -11.601 6.712 1.00 0.00 C ATOM 985 OE1 GLN A 63 -0.009 -12.205 6.812 1.00 0.00 O flip ATOM 986 NE2 GLN A 63 2.093 -12.074 6.061 1.00 0.00 N flip ATOM 0 H GLN A 63 1.351 -8.100 5.926 1.00 0.00 H new ATOM 0 HA GLN A 63 -0.696 -9.961 5.596 1.00 0.00 H new ATOM 0 HB2 GLN A 63 0.247 -8.579 8.133 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -0.701 -10.051 8.073 1.00 0.00 H new ATOM 0 HG2 GLN A 63 2.112 -9.702 6.983 1.00 0.00 H new ATOM 0 HG3 GLN A 63 1.683 -10.510 8.478 1.00 0.00 H new ATOM 0 HE21 GLN A 63 2.983 -11.579 6.008 1.00 0.00 H new ATOM 0 HE22 GLN A 63 1.974 -12.962 5.574 1.00 0.00 H new ATOM 995 N ALA A 64 -1.698 -7.008 6.675 1.00 0.00 N ATOM 996 CA ALA A 64 -2.879 -6.172 6.869 1.00 0.00 C ATOM 997 C ALA A 64 -3.627 -5.973 5.552 1.00 0.00 C ATOM 998 O ALA A 64 -4.859 -5.996 5.515 1.00 0.00 O ATOM 999 CB ALA A 64 -2.482 -4.830 7.464 1.00 0.00 C ATOM 0 H ALA A 64 -0.810 -6.521 6.794 1.00 0.00 H new ATOM 0 HA ALA A 64 -3.548 -6.679 7.565 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -3.372 -4.216 7.604 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -1.996 -4.988 8.427 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.793 -4.322 6.789 1.00 0.00 H new ATOM 1005 N LEU A 65 -2.866 -5.802 4.481 1.00 0.00 N ATOM 1006 CA LEU A 65 -3.426 -5.568 3.157 1.00 0.00 C ATOM 1007 C LEU A 65 -4.212 -6.784 2.677 1.00 0.00 C ATOM 1008 O LEU A 65 -5.305 -6.658 2.131 1.00 0.00 O ATOM 1009 CB LEU A 65 -2.306 -5.242 2.166 1.00 0.00 C ATOM 1010 CG LEU A 65 -2.773 -4.838 0.768 1.00 0.00 C ATOM 1011 CD1 LEU A 65 -3.666 -3.617 0.844 1.00 0.00 C ATOM 1012 CD2 LEU A 65 -1.585 -4.555 -0.135 1.00 0.00 C ATOM 0 H LEU A 65 -1.846 -5.821 4.504 1.00 0.00 H new ATOM 0 HA LEU A 65 -4.109 -4.721 3.217 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -1.702 -4.434 2.578 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.656 -6.112 2.077 1.00 0.00 H new ATOM 0 HG LEU A 65 -3.340 -5.667 0.346 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -3.991 -3.341 -0.159 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -4.538 -3.841 1.459 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -3.113 -2.789 1.287 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -1.940 -4.269 -1.125 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -0.993 -3.743 0.286 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.968 -5.450 -0.215 1.00 0.00 H new ATOM 1024 N MET A 66 -3.654 -7.964 2.901 1.00 0.00 N ATOM 1025 CA MET A 66 -4.306 -9.207 2.505 1.00 0.00 C ATOM 1026 C MET A 66 -5.511 -9.493 3.392 1.00 0.00 C ATOM 1027 O MET A 66 -6.445 -10.182 2.988 1.00 0.00 O ATOM 1028 CB MET A 66 -3.313 -10.373 2.551 1.00 0.00 C ATOM 1029 CG MET A 66 -2.365 -10.426 1.359 1.00 0.00 C ATOM 1030 SD MET A 66 -1.596 -8.834 0.993 1.00 0.00 S ATOM 1031 CE MET A 66 -0.381 -9.302 -0.222 1.00 0.00 C ATOM 0 H MET A 66 -2.750 -8.089 3.356 1.00 0.00 H new ATOM 0 HA MET A 66 -4.659 -9.095 1.480 1.00 0.00 H new ATOM 0 HB2 MET A 66 -2.726 -10.301 3.466 1.00 0.00 H new ATOM 0 HB3 MET A 66 -3.869 -11.309 2.602 1.00 0.00 H new ATOM 0 HG2 MET A 66 -1.586 -11.163 1.555 1.00 0.00 H new ATOM 0 HG3 MET A 66 -2.913 -10.768 0.481 1.00 0.00 H new ATOM 0 HE1 MET A 66 -0.133 -8.439 -0.840 1.00 0.00 H new ATOM 0 HE2 MET A 66 0.518 -9.659 0.281 1.00 0.00 H new ATOM 0 HE3 MET A 66 -0.783 -10.095 -0.852 1.00 0.00 H new ATOM 1041 N SER A 67 -5.494 -8.948 4.599 1.00 0.00 N ATOM 1042 CA SER A 67 -6.623 -9.082 5.507 1.00 0.00 C ATOM 1043 C SER A 67 -7.780 -8.190 5.054 1.00 0.00 C ATOM 1044 O SER A 67 -8.947 -8.476 5.328 1.00 0.00 O ATOM 1045 CB SER A 67 -6.196 -8.724 6.932 1.00 0.00 C ATOM 1046 OG SER A 67 -5.167 -9.589 7.385 1.00 0.00 O ATOM 0 H SER A 67 -4.712 -8.410 4.972 1.00 0.00 H new ATOM 0 HA SER A 67 -6.963 -10.118 5.494 1.00 0.00 H new ATOM 0 HB2 SER A 67 -5.848 -7.691 6.963 1.00 0.00 H new ATOM 0 HB3 SER A 67 -7.054 -8.792 7.601 1.00 0.00 H new ATOM 0 HG SER A 67 -4.297 -9.154 7.265 1.00 0.00 H new ATOM 1052 N SER A 68 -7.446 -7.114 4.353 1.00 0.00 N ATOM 1053 CA SER A 68 -8.451 -6.196 3.831 1.00 0.00 C ATOM 1054 C SER A 68 -8.705 -6.439 2.338 1.00 0.00 C ATOM 1055 O SER A 68 -9.415 -5.677 1.678 1.00 0.00 O ATOM 1056 CB SER A 68 -7.999 -4.757 4.082 1.00 0.00 C ATOM 1057 OG SER A 68 -6.608 -4.618 3.851 1.00 0.00 O ATOM 0 H SER A 68 -6.484 -6.855 4.132 1.00 0.00 H new ATOM 0 HA SER A 68 -9.393 -6.372 4.350 1.00 0.00 H new ATOM 0 HB2 SER A 68 -8.550 -4.079 3.430 1.00 0.00 H new ATOM 0 HB3 SER A 68 -8.232 -4.472 5.108 1.00 0.00 H new ATOM 0 HG SER A 68 -6.111 -5.032 4.587 1.00 0.00 H new ATOM 1063 N LEU A 69 -8.157 -7.539 1.826 1.00 0.00 N ATOM 1064 CA LEU A 69 -8.270 -7.894 0.410 1.00 0.00 C ATOM 1065 C LEU A 69 -9.580 -8.645 0.134 1.00 0.00 C ATOM 1066 O LEU A 69 -9.757 -9.240 -0.933 1.00 0.00 O ATOM 1067 CB LEU A 69 -7.062 -8.759 0.016 1.00 0.00 C ATOM 1068 CG LEU A 69 -6.960 -9.155 -1.461 1.00 0.00 C ATOM 1069 CD1 LEU A 69 -6.799 -7.925 -2.339 1.00 0.00 C ATOM 1070 CD2 LEU A 69 -5.804 -10.121 -1.672 1.00 0.00 C ATOM 0 H LEU A 69 -7.623 -8.209 2.379 1.00 0.00 H new ATOM 0 HA LEU A 69 -8.281 -6.983 -0.188 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.154 -8.222 0.289 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.085 -9.671 0.613 1.00 0.00 H new ATOM 0 HG LEU A 69 -7.885 -9.656 -1.747 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -6.729 -8.230 -3.383 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.661 -7.270 -2.210 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -5.892 -7.391 -2.055 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -5.745 -10.393 -2.726 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -4.872 -9.645 -1.367 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -5.966 -11.018 -1.074 1.00 0.00 H new ATOM 1082 N GLU A 70 -10.503 -8.576 1.097 1.00 0.00 N ATOM 1083 CA GLU A 70 -11.757 -9.337 1.065 1.00 0.00 C ATOM 1084 C GLU A 70 -11.486 -10.830 1.211 1.00 0.00 C ATOM 1085 O GLU A 70 -11.793 -11.421 2.244 1.00 0.00 O ATOM 1086 CB GLU A 70 -12.567 -9.089 -0.218 1.00 0.00 C ATOM 1087 CG GLU A 70 -13.122 -7.682 -0.355 1.00 0.00 C ATOM 1088 CD GLU A 70 -14.119 -7.574 -1.493 1.00 0.00 C ATOM 1089 OE1 GLU A 70 -13.705 -7.291 -2.636 1.00 0.00 O ATOM 1090 OE2 GLU A 70 -15.328 -7.781 -1.249 1.00 0.00 O ATOM 0 H GLU A 70 -10.402 -7.989 1.925 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.352 -8.985 1.908 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -11.933 -9.300 -1.079 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.395 -9.797 -0.251 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -13.604 -7.390 0.578 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -12.302 -6.983 -0.523 1.00 0.00 H new ATOM 1097 N THR A 71 -10.884 -11.414 0.178 1.00 0.00 N ATOM 1098 CA THR A 71 -10.638 -12.847 0.115 1.00 0.00 C ATOM 1099 C THR A 71 -11.958 -13.623 0.112 1.00 0.00 C ATOM 1100 O THR A 71 -12.514 -13.939 1.165 1.00 0.00 O ATOM 1101 CB THR A 71 -9.742 -13.318 1.280 1.00 0.00 C ATOM 1102 OG1 THR A 71 -8.561 -12.506 1.336 1.00 0.00 O ATOM 1103 CG2 THR A 71 -9.340 -14.775 1.108 1.00 0.00 C ATOM 0 H THR A 71 -10.553 -10.903 -0.640 1.00 0.00 H new ATOM 0 HA THR A 71 -10.111 -13.049 -0.817 1.00 0.00 H new ATOM 0 HB THR A 71 -10.309 -13.221 2.206 1.00 0.00 H new ATOM 0 HG1 THR A 71 -7.994 -12.805 2.077 1.00 0.00 H new ATOM 0 HG21 THR A 71 -8.709 -15.079 1.943 1.00 0.00 H new ATOM 0 HG22 THR A 71 -10.234 -15.398 1.082 1.00 0.00 H new ATOM 0 HG23 THR A 71 -8.789 -14.893 0.175 1.00 0.00 H new ATOM 1111 N PRO A 72 -12.494 -13.913 -1.088 1.00 0.00 N ATOM 1112 CA PRO A 72 -13.778 -14.603 -1.232 1.00 0.00 C ATOM 1113 C PRO A 72 -13.718 -16.058 -0.776 1.00 0.00 C ATOM 1114 O PRO A 72 -13.492 -16.970 -1.577 1.00 0.00 O ATOM 1115 CB PRO A 72 -14.066 -14.517 -2.731 1.00 0.00 C ATOM 1116 CG PRO A 72 -12.728 -14.373 -3.368 1.00 0.00 C ATOM 1117 CD PRO A 72 -11.892 -13.588 -2.397 1.00 0.00 C ATOM 0 HA PRO A 72 -14.551 -14.150 -0.612 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -14.579 -15.410 -3.087 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -14.708 -13.667 -2.962 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -12.283 -15.348 -3.567 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -12.804 -13.856 -4.325 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -10.843 -13.881 -2.441 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -11.933 -12.519 -2.604 1.00 0.00 H new ATOM 1125 N LYS A 73 -13.884 -16.263 0.521 1.00 0.00 N ATOM 1126 CA LYS A 73 -13.912 -17.599 1.094 1.00 0.00 C ATOM 1127 C LYS A 73 -15.336 -17.983 1.462 1.00 0.00 C ATOM 1128 O LYS A 73 -15.984 -17.298 2.255 1.00 0.00 O ATOM 1129 CB LYS A 73 -13.037 -17.678 2.351 1.00 0.00 C ATOM 1130 CG LYS A 73 -11.555 -17.392 2.134 1.00 0.00 C ATOM 1131 CD LYS A 73 -10.853 -18.496 1.351 1.00 0.00 C ATOM 1132 CE LYS A 73 -11.049 -18.343 -0.148 1.00 0.00 C ATOM 1133 NZ LYS A 73 -10.334 -19.393 -0.918 1.00 0.00 N ATOM 0 H LYS A 73 -14.002 -15.513 1.202 1.00 0.00 H new ATOM 0 HA LYS A 73 -13.523 -18.289 0.345 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -13.422 -16.972 3.086 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -13.138 -18.674 2.782 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -11.445 -16.448 1.601 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -11.067 -17.271 3.101 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -9.788 -18.482 1.581 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -11.235 -19.466 1.670 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -12.113 -18.386 -0.380 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -10.694 -17.361 -0.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -10.577 -19.311 -1.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -9.308 -19.273 -0.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -10.615 -20.332 -0.569 1.00 0.00 H new ATOM 1147 N THR A 74 -15.828 -19.059 0.876 1.00 0.00 N ATOM 1148 CA THR A 74 -17.117 -19.597 1.254 1.00 0.00 C ATOM 1149 C THR A 74 -16.985 -20.374 2.558 1.00 0.00 C ATOM 1150 O THR A 74 -15.895 -20.856 2.885 1.00 0.00 O ATOM 1151 CB THR A 74 -17.683 -20.501 0.142 1.00 0.00 C ATOM 1152 OG1 THR A 74 -16.620 -21.241 -0.472 1.00 0.00 O ATOM 1153 CG2 THR A 74 -18.410 -19.680 -0.912 1.00 0.00 C ATOM 0 H THR A 74 -15.353 -19.576 0.136 1.00 0.00 H new ATOM 0 HA THR A 74 -17.813 -18.770 1.399 1.00 0.00 H new ATOM 0 HB THR A 74 -18.396 -21.191 0.594 1.00 0.00 H new ATOM 0 HG1 THR A 74 -16.986 -21.815 -1.177 1.00 0.00 H new ATOM 0 HG21 THR A 74 -18.799 -20.343 -1.685 1.00 0.00 H new ATOM 0 HG22 THR A 74 -19.235 -19.140 -0.447 1.00 0.00 H new ATOM 0 HG23 THR A 74 -17.717 -18.968 -1.360 1.00 0.00 H new ATOM 1161 N HIS A 75 -18.075 -20.468 3.314 1.00 0.00 N ATOM 1162 CA HIS A 75 -18.055 -21.152 4.605 1.00 0.00 C ATOM 1163 C HIS A 75 -17.560 -22.585 4.454 1.00 0.00 C ATOM 1164 O HIS A 75 -16.793 -23.078 5.285 1.00 0.00 O ATOM 1165 CB HIS A 75 -19.437 -21.124 5.261 1.00 0.00 C ATOM 1166 CG HIS A 75 -19.844 -19.758 5.715 1.00 0.00 C ATOM 1167 ND1 HIS A 75 -21.139 -19.292 5.660 1.00 0.00 N ATOM 1168 CD2 HIS A 75 -19.108 -18.753 6.239 1.00 0.00 C ATOM 1169 CE1 HIS A 75 -21.180 -18.059 6.130 1.00 0.00 C ATOM 1170 NE2 HIS A 75 -19.959 -17.709 6.489 1.00 0.00 N ATOM 0 H HIS A 75 -18.982 -20.080 3.056 1.00 0.00 H new ATOM 0 HA HIS A 75 -17.361 -20.619 5.255 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -20.176 -21.500 4.554 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -19.441 -21.800 6.116 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -18.044 -18.770 6.426 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -22.063 -17.442 6.208 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -19.693 -16.809 6.887 1.00 0.00 H new ATOM 1179 N LEU A 76 -17.993 -23.248 3.397 1.00 0.00 N ATOM 1180 CA LEU A 76 -17.448 -24.545 3.046 1.00 0.00 C ATOM 1181 C LEU A 76 -16.945 -24.512 1.609 1.00 0.00 C ATOM 1182 O LEU A 76 -17.715 -24.657 0.656 1.00 0.00 O ATOM 1183 CB LEU A 76 -18.475 -25.669 3.254 1.00 0.00 C ATOM 1184 CG LEU A 76 -19.817 -25.497 2.536 1.00 0.00 C ATOM 1185 CD1 LEU A 76 -20.112 -26.706 1.660 1.00 0.00 C ATOM 1186 CD2 LEU A 76 -20.935 -25.291 3.547 1.00 0.00 C ATOM 0 H LEU A 76 -18.720 -22.909 2.767 1.00 0.00 H new ATOM 0 HA LEU A 76 -16.611 -24.762 3.710 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -18.028 -26.607 2.926 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -18.667 -25.764 4.323 1.00 0.00 H new ATOM 0 HG LEU A 76 -19.757 -24.615 1.898 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -21.069 -26.566 1.158 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -19.324 -26.817 0.915 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -20.154 -27.602 2.279 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -21.883 -25.170 3.022 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -20.993 -26.157 4.206 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -20.731 -24.398 4.138 1.00 0.00 H new ATOM 1198 N GLU A 77 -15.655 -24.262 1.453 1.00 0.00 N ATOM 1199 CA GLU A 77 -15.057 -24.213 0.132 1.00 0.00 C ATOM 1200 C GLU A 77 -14.375 -25.540 -0.182 1.00 0.00 C ATOM 1201 O GLU A 77 -15.052 -26.514 -0.511 1.00 0.00 O ATOM 1202 CB GLU A 77 -14.070 -23.045 0.011 1.00 0.00 C ATOM 1203 CG GLU A 77 -13.530 -22.842 -1.398 1.00 0.00 C ATOM 1204 CD GLU A 77 -12.524 -21.713 -1.480 1.00 0.00 C ATOM 1205 OE1 GLU A 77 -11.500 -21.772 -0.765 1.00 0.00 O ATOM 1206 OE2 GLU A 77 -12.751 -20.758 -2.255 1.00 0.00 O ATOM 0 H GLU A 77 -15.006 -24.091 2.221 1.00 0.00 H new ATOM 0 HA GLU A 77 -15.849 -24.046 -0.598 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -14.563 -22.129 0.337 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -13.234 -23.216 0.690 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -13.063 -23.765 -1.740 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -14.359 -22.634 -2.074 1.00 0.00 H new ATOM 1213 N HIS A 78 -13.042 -25.581 -0.046 1.00 0.00 N ATOM 1214 CA HIS A 78 -12.234 -26.763 -0.393 1.00 0.00 C ATOM 1215 C HIS A 78 -12.258 -27.047 -1.895 1.00 0.00 C ATOM 1216 O HIS A 78 -11.225 -27.354 -2.491 1.00 0.00 O ATOM 1217 CB HIS A 78 -12.679 -28.004 0.388 1.00 0.00 C ATOM 1218 CG HIS A 78 -12.140 -28.056 1.782 1.00 0.00 C ATOM 1219 ND1 HIS A 78 -11.952 -29.232 2.468 1.00 0.00 N ATOM 1220 CD2 HIS A 78 -11.734 -27.069 2.614 1.00 0.00 C ATOM 1221 CE1 HIS A 78 -11.454 -28.968 3.660 1.00 0.00 C ATOM 1222 NE2 HIS A 78 -11.309 -27.661 3.775 1.00 0.00 N ATOM 0 H HIS A 78 -12.492 -24.798 0.307 1.00 0.00 H new ATOM 0 HA HIS A 78 -11.208 -26.531 -0.108 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -13.768 -28.028 0.427 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -12.359 -28.896 -0.150 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -11.743 -26.010 2.402 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -11.206 -29.699 4.416 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -10.942 -27.173 4.592 1.00 0.00 H new ATOM 1231 N HIS A 79 -13.431 -26.949 -2.497 1.00 0.00 N ATOM 1232 CA HIS A 79 -13.585 -27.111 -3.931 1.00 0.00 C ATOM 1233 C HIS A 79 -13.036 -25.878 -4.643 1.00 0.00 C ATOM 1234 O HIS A 79 -13.779 -24.969 -5.004 1.00 0.00 O ATOM 1235 CB HIS A 79 -15.065 -27.328 -4.271 1.00 0.00 C ATOM 1236 CG HIS A 79 -15.318 -27.841 -5.656 1.00 0.00 C ATOM 1237 ND1 HIS A 79 -16.328 -27.365 -6.461 1.00 0.00 N ATOM 1238 CD2 HIS A 79 -14.714 -28.827 -6.358 1.00 0.00 C ATOM 1239 CE1 HIS A 79 -16.334 -28.034 -7.597 1.00 0.00 C ATOM 1240 NE2 HIS A 79 -15.365 -28.930 -7.562 1.00 0.00 N ATOM 0 H HIS A 79 -14.303 -26.755 -2.005 1.00 0.00 H new ATOM 0 HA HIS A 79 -13.025 -27.984 -4.267 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -15.490 -28.031 -3.554 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -15.595 -26.384 -4.145 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -13.875 -29.423 -6.031 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -17.017 -27.876 -8.418 1.00 0.00 H new ATOM 0 HE2 HIS A 79 -15.138 -29.589 -8.306 1.00 0.00 H new ATOM 1249 N HIS A 80 -11.718 -25.846 -4.801 1.00 0.00 N ATOM 1250 CA HIS A 80 -11.034 -24.714 -5.415 1.00 0.00 C ATOM 1251 C HIS A 80 -11.192 -24.767 -6.921 1.00 0.00 C ATOM 1252 O HIS A 80 -11.088 -23.750 -7.608 1.00 0.00 O ATOM 1253 CB HIS A 80 -9.542 -24.719 -5.063 1.00 0.00 C ATOM 1254 CG HIS A 80 -9.256 -24.652 -3.594 1.00 0.00 C ATOM 1255 ND1 HIS A 80 -8.796 -25.729 -2.874 1.00 0.00 N ATOM 1256 CD2 HIS A 80 -9.349 -23.626 -2.715 1.00 0.00 C ATOM 1257 CE1 HIS A 80 -8.619 -25.370 -1.615 1.00 0.00 C ATOM 1258 NE2 HIS A 80 -8.946 -24.097 -1.490 1.00 0.00 N ATOM 0 H HIS A 80 -11.096 -26.600 -4.509 1.00 0.00 H new ATOM 0 HA HIS A 80 -11.483 -23.799 -5.029 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -9.088 -25.623 -5.469 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -9.062 -23.873 -5.554 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -9.679 -22.622 -2.937 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -8.266 -26.011 -0.821 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -8.906 -23.554 -0.627 1.00 0.00 H new ATOM 1267 N HIS A 81 -11.445 -25.965 -7.426 1.00 0.00 N ATOM 1268 CA HIS A 81 -11.620 -26.179 -8.855 1.00 0.00 C ATOM 1269 C HIS A 81 -13.000 -25.695 -9.299 1.00 0.00 C ATOM 1270 O HIS A 81 -13.835 -26.492 -9.726 1.00 0.00 O ATOM 1271 CB HIS A 81 -11.441 -27.666 -9.181 1.00 0.00 C ATOM 1272 CG HIS A 81 -11.034 -27.937 -10.597 1.00 0.00 C ATOM 1273 ND1 HIS A 81 -9.771 -28.365 -10.938 1.00 0.00 N ATOM 1274 CD2 HIS A 81 -11.724 -27.848 -11.759 1.00 0.00 C ATOM 1275 CE1 HIS A 81 -9.697 -28.523 -12.244 1.00 0.00 C ATOM 1276 NE2 HIS A 81 -10.867 -28.217 -12.766 1.00 0.00 N ATOM 0 H HIS A 81 -11.534 -26.810 -6.862 1.00 0.00 H new ATOM 0 HA HIS A 81 -10.867 -25.606 -9.396 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -10.690 -28.086 -8.512 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -12.377 -28.187 -8.977 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -12.754 -27.544 -11.872 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -8.826 -28.848 -12.793 1.00 0.00 H new ATOM 0 HE2 HIS A 81 -11.099 -28.249 -13.759 1.00 0.00 H new ATOM 1285 N HIS A 82 -13.219 -24.384 -9.175 1.00 0.00 N ATOM 1286 CA HIS A 82 -14.482 -23.736 -9.546 1.00 0.00 C ATOM 1287 C HIS A 82 -15.617 -24.099 -8.594 1.00 0.00 C ATOM 1288 O HIS A 82 -16.061 -25.241 -8.540 1.00 0.00 O ATOM 1289 CB HIS A 82 -14.889 -24.069 -10.985 1.00 0.00 C ATOM 1290 CG HIS A 82 -14.526 -23.003 -11.965 1.00 0.00 C ATOM 1291 ND1 HIS A 82 -15.304 -21.891 -12.172 1.00 0.00 N ATOM 1292 CD2 HIS A 82 -13.462 -22.875 -12.791 1.00 0.00 C ATOM 1293 CE1 HIS A 82 -14.742 -21.123 -13.082 1.00 0.00 C ATOM 1294 NE2 HIS A 82 -13.619 -21.695 -13.477 1.00 0.00 N ATOM 0 H HIS A 82 -12.520 -23.736 -8.812 1.00 0.00 H new ATOM 0 HA HIS A 82 -14.304 -22.663 -9.472 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -14.413 -25.003 -11.283 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -15.966 -24.234 -11.021 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -12.642 -23.571 -12.892 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -15.133 -20.184 -13.444 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -12.975 -21.323 -14.175 1.00 0.00 H new ATOM 1303 N HIS A 83 -16.085 -23.113 -7.842 1.00 0.00 N ATOM 1304 CA HIS A 83 -17.235 -23.304 -6.972 1.00 0.00 C ATOM 1305 C HIS A 83 -18.259 -22.202 -7.208 1.00 0.00 C ATOM 1306 O HIS A 83 -19.373 -22.526 -7.660 1.00 0.00 O ATOM 1307 CB HIS A 83 -16.838 -23.385 -5.485 1.00 0.00 C ATOM 1308 CG HIS A 83 -16.091 -22.202 -4.940 1.00 0.00 C ATOM 1309 ND1 HIS A 83 -16.711 -21.077 -4.441 1.00 0.00 N ATOM 1310 CD2 HIS A 83 -14.767 -21.999 -4.770 1.00 0.00 C ATOM 1311 CE1 HIS A 83 -15.799 -20.240 -3.987 1.00 0.00 C ATOM 1312 NE2 HIS A 83 -14.606 -20.774 -4.171 1.00 0.00 N ATOM 1313 OXT HIS A 83 -17.933 -21.017 -6.988 1.00 0.00 O ATOM 0 H HIS A 83 -15.686 -22.174 -7.817 1.00 0.00 H new ATOM 0 HA HIS A 83 -17.685 -24.264 -7.225 1.00 0.00 H new ATOM 0 HB2 HIS A 83 -17.744 -23.522 -4.894 1.00 0.00 H new ATOM 0 HB3 HIS A 83 -16.226 -24.275 -5.340 1.00 0.00 H new ATOM 0 HD2 HIS A 83 -13.977 -22.678 -5.054 1.00 0.00 H new ATOM 0 HE1 HIS A 83 -15.995 -19.277 -3.539 1.00 0.00 H new ATOM 0 HE2 HIS A 83 -13.716 -20.349 -3.912 1.00 0.00 H new TER 1322 HIS A 83 ATOM 1323 N MET B 1 3.074 -7.239 -22.263 1.00 0.00 N ATOM 1324 CA MET B 1 3.069 -5.780 -22.028 1.00 0.00 C ATOM 1325 C MET B 1 2.914 -5.499 -20.542 1.00 0.00 C ATOM 1326 O MET B 1 2.105 -6.137 -19.863 1.00 0.00 O ATOM 1327 CB MET B 1 1.931 -5.117 -22.813 1.00 0.00 C ATOM 1328 CG MET B 1 2.080 -5.242 -24.321 1.00 0.00 C ATOM 1329 SD MET B 1 0.681 -4.555 -25.227 1.00 0.00 S ATOM 1330 CE MET B 1 1.230 -4.806 -26.914 1.00 0.00 C ATOM 0 H1 MET B 1 3.413 -7.434 -23.227 1.00 0.00 H new ATOM 0 H2 MET B 1 3.703 -7.699 -21.575 1.00 0.00 H new ATOM 0 H3 MET B 1 2.109 -7.612 -22.153 1.00 0.00 H new ATOM 0 HA MET B 1 4.015 -5.364 -22.373 1.00 0.00 H new ATOM 0 HB2 MET B 1 0.984 -5.564 -22.511 1.00 0.00 H new ATOM 0 HB3 MET B 1 1.884 -4.061 -22.547 1.00 0.00 H new ATOM 0 HG2 MET B 1 2.993 -4.735 -24.634 1.00 0.00 H new ATOM 0 HG3 MET B 1 2.194 -6.294 -24.583 1.00 0.00 H new ATOM 0 HE1 MET B 1 0.472 -4.432 -27.603 1.00 0.00 H new ATOM 0 HE2 MET B 1 2.165 -4.269 -27.076 1.00 0.00 H new ATOM 0 HE3 MET B 1 1.388 -5.870 -27.091 1.00 0.00 H new ATOM 1339 N PRO B 2 3.703 -4.555 -20.012 1.00 0.00 N ATOM 1340 CA PRO B 2 3.741 -4.263 -18.581 1.00 0.00 C ATOM 1341 C PRO B 2 2.487 -3.556 -18.082 1.00 0.00 C ATOM 1342 O PRO B 2 2.266 -2.377 -18.372 1.00 0.00 O ATOM 1343 CB PRO B 2 4.967 -3.347 -18.417 1.00 0.00 C ATOM 1344 CG PRO B 2 5.675 -3.378 -19.732 1.00 0.00 C ATOM 1345 CD PRO B 2 4.627 -3.694 -20.759 1.00 0.00 C ATOM 0 HA PRO B 2 3.797 -5.182 -17.998 1.00 0.00 H new ATOM 0 HB2 PRO B 2 4.665 -2.332 -18.159 1.00 0.00 H new ATOM 0 HB3 PRO B 2 5.615 -3.701 -17.615 1.00 0.00 H new ATOM 0 HG2 PRO B 2 6.150 -2.420 -19.942 1.00 0.00 H new ATOM 0 HG3 PRO B 2 6.462 -4.132 -19.733 1.00 0.00 H new ATOM 0 HD2 PRO B 2 4.135 -2.794 -21.128 1.00 0.00 H new ATOM 0 HD3 PRO B 2 5.048 -4.205 -21.625 1.00 0.00 H new ATOM 1353 N ILE B 3 1.648 -4.291 -17.361 1.00 0.00 N ATOM 1354 CA ILE B 3 0.549 -3.682 -16.633 1.00 0.00 C ATOM 1355 C ILE B 3 1.128 -2.842 -15.500 1.00 0.00 C ATOM 1356 O ILE B 3 2.114 -3.242 -14.877 1.00 0.00 O ATOM 1357 CB ILE B 3 -0.435 -4.732 -16.062 1.00 0.00 C ATOM 1358 CG1 ILE B 3 -1.482 -4.043 -15.175 1.00 0.00 C ATOM 1359 CG2 ILE B 3 0.312 -5.815 -15.295 1.00 0.00 C ATOM 1360 CD1 ILE B 3 -2.375 -4.993 -14.413 1.00 0.00 C ATOM 0 H ILE B 3 1.710 -5.305 -17.267 1.00 0.00 H new ATOM 0 HA ILE B 3 -0.019 -3.062 -17.326 1.00 0.00 H new ATOM 0 HB ILE B 3 -0.952 -5.216 -16.891 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -0.969 -3.396 -14.463 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -2.103 -3.401 -15.799 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -0.401 -6.541 -14.903 1.00 0.00 H new ATOM 0 HG22 ILE B 3 1.012 -6.317 -15.963 1.00 0.00 H new ATOM 0 HG23 ILE B 3 0.861 -5.363 -14.469 1.00 0.00 H new ATOM 0 HD11 ILE B 3 -3.084 -4.423 -13.813 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -2.919 -5.624 -15.116 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -1.767 -5.619 -13.760 1.00 0.00 H new ATOM 1372 N THR B 4 0.520 -1.688 -15.247 1.00 0.00 N ATOM 1373 CA THR B 4 1.064 -0.716 -14.312 1.00 0.00 C ATOM 1374 C THR B 4 2.323 -0.096 -14.907 1.00 0.00 C ATOM 1375 O THR B 4 3.437 -0.594 -14.733 1.00 0.00 O ATOM 1376 CB THR B 4 1.365 -1.324 -12.933 1.00 0.00 C ATOM 1377 OG1 THR B 4 0.217 -2.045 -12.458 1.00 0.00 O ATOM 1378 CG2 THR B 4 1.722 -0.227 -11.950 1.00 0.00 C ATOM 0 H THR B 4 -0.358 -1.403 -15.682 1.00 0.00 H new ATOM 0 HA THR B 4 0.307 0.052 -14.153 1.00 0.00 H new ATOM 0 HB THR B 4 2.208 -2.009 -13.024 1.00 0.00 H new ATOM 0 HG1 THR B 4 0.414 -2.432 -11.580 1.00 0.00 H new ATOM 0 HG21 THR B 4 1.934 -0.667 -10.975 1.00 0.00 H new ATOM 0 HG22 THR B 4 2.602 0.308 -12.306 1.00 0.00 H new ATOM 0 HG23 THR B 4 0.887 0.468 -11.861 1.00 0.00 H new ATOM 1386 N SER B 5 2.117 0.985 -15.626 1.00 0.00 N ATOM 1387 CA SER B 5 3.144 1.554 -16.472 1.00 0.00 C ATOM 1388 C SER B 5 4.082 2.495 -15.730 1.00 0.00 C ATOM 1389 O SER B 5 3.766 3.005 -14.652 1.00 0.00 O ATOM 1390 CB SER B 5 2.480 2.296 -17.624 1.00 0.00 C ATOM 1391 OG SER B 5 1.490 3.203 -17.158 1.00 0.00 O ATOM 0 H SER B 5 1.234 1.495 -15.641 1.00 0.00 H new ATOM 0 HA SER B 5 3.757 0.730 -16.837 1.00 0.00 H new ATOM 0 HB2 SER B 5 3.235 2.840 -18.191 1.00 0.00 H new ATOM 0 HB3 SER B 5 2.025 1.578 -18.306 1.00 0.00 H new ATOM 0 HG SER B 5 0.733 2.701 -16.790 1.00 0.00 H new ATOM 1397 N LYS B 6 5.246 2.712 -16.332 1.00 0.00 N ATOM 1398 CA LYS B 6 6.164 3.741 -15.883 1.00 0.00 C ATOM 1399 C LYS B 6 5.681 5.101 -16.370 1.00 0.00 C ATOM 1400 O LYS B 6 6.247 5.669 -17.306 1.00 0.00 O ATOM 1401 CB LYS B 6 7.581 3.476 -16.403 1.00 0.00 C ATOM 1402 CG LYS B 6 8.460 2.659 -15.469 1.00 0.00 C ATOM 1403 CD LYS B 6 8.956 3.494 -14.294 1.00 0.00 C ATOM 1404 CE LYS B 6 10.089 2.801 -13.549 1.00 0.00 C ATOM 1405 NZ LYS B 6 9.650 1.549 -12.877 1.00 0.00 N ATOM 0 H LYS B 6 5.574 2.181 -17.139 1.00 0.00 H new ATOM 0 HA LYS B 6 6.193 3.729 -14.793 1.00 0.00 H new ATOM 0 HB2 LYS B 6 7.511 2.958 -17.359 1.00 0.00 H new ATOM 0 HB3 LYS B 6 8.068 4.432 -16.594 1.00 0.00 H new ATOM 0 HG2 LYS B 6 7.899 1.802 -15.096 1.00 0.00 H new ATOM 0 HG3 LYS B 6 9.313 2.265 -16.022 1.00 0.00 H new ATOM 0 HD2 LYS B 6 9.298 4.464 -14.655 1.00 0.00 H new ATOM 0 HD3 LYS B 6 8.131 3.682 -13.607 1.00 0.00 H new ATOM 0 HE2 LYS B 6 10.892 2.571 -14.249 1.00 0.00 H new ATOM 0 HE3 LYS B 6 10.501 3.483 -12.805 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 10.458 1.117 -12.385 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 8.902 1.769 -12.188 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 9.282 0.884 -13.587 1.00 0.00 H new ATOM 1419 N TYR B 7 4.582 5.569 -15.785 1.00 0.00 N ATOM 1420 CA TYR B 7 4.088 6.923 -16.035 1.00 0.00 C ATOM 1421 C TYR B 7 5.198 7.957 -15.905 1.00 0.00 C ATOM 1422 O TYR B 7 6.223 7.707 -15.266 1.00 0.00 O ATOM 1423 CB TYR B 7 2.978 7.292 -15.049 1.00 0.00 C ATOM 1424 CG TYR B 7 1.683 6.552 -15.254 1.00 0.00 C ATOM 1425 CD1 TYR B 7 0.806 6.928 -16.257 1.00 0.00 C ATOM 1426 CD2 TYR B 7 1.336 5.486 -14.440 1.00 0.00 C ATOM 1427 CE1 TYR B 7 -0.390 6.267 -16.443 1.00 0.00 C ATOM 1428 CE2 TYR B 7 0.143 4.820 -14.614 1.00 0.00 C ATOM 1429 CZ TYR B 7 -0.716 5.211 -15.621 1.00 0.00 C ATOM 1430 OH TYR B 7 -1.910 4.553 -15.801 1.00 0.00 O ATOM 0 H TYR B 7 4.014 5.030 -15.132 1.00 0.00 H new ATOM 0 HA TYR B 7 3.702 6.929 -17.054 1.00 0.00 H new ATOM 0 HB2 TYR B 7 3.333 7.102 -14.036 1.00 0.00 H new ATOM 0 HB3 TYR B 7 2.785 8.362 -15.124 1.00 0.00 H new ATOM 0 HD1 TYR B 7 1.063 7.753 -16.905 1.00 0.00 H new ATOM 0 HD2 TYR B 7 2.011 5.173 -13.657 1.00 0.00 H new ATOM 0 HE1 TYR B 7 -1.066 6.575 -17.227 1.00 0.00 H new ATOM 0 HE2 TYR B 7 -0.119 3.997 -13.966 1.00 0.00 H new ATOM 0 HH TYR B 7 -1.784 3.813 -16.431 1.00 0.00 H new ATOM 1440 N THR B 8 4.971 9.116 -16.506 1.00 0.00 N ATOM 1441 CA THR B 8 5.897 10.231 -16.418 1.00 0.00 C ATOM 1442 C THR B 8 6.296 10.482 -14.964 1.00 0.00 C ATOM 1443 O THR B 8 5.440 10.745 -14.114 1.00 0.00 O ATOM 1444 CB THR B 8 5.254 11.496 -17.013 1.00 0.00 C ATOM 1445 OG1 THR B 8 4.712 11.194 -18.306 1.00 0.00 O ATOM 1446 CG2 THR B 8 6.271 12.620 -17.135 1.00 0.00 C ATOM 0 H THR B 8 4.141 9.308 -17.067 1.00 0.00 H new ATOM 0 HA THR B 8 6.794 9.985 -16.987 1.00 0.00 H new ATOM 0 HB THR B 8 4.458 11.826 -16.345 1.00 0.00 H new ATOM 0 HG1 THR B 8 4.301 11.999 -18.685 1.00 0.00 H new ATOM 0 HG21 THR B 8 5.790 13.502 -17.558 1.00 0.00 H new ATOM 0 HG22 THR B 8 6.667 12.861 -16.148 1.00 0.00 H new ATOM 0 HG23 THR B 8 7.086 12.304 -17.786 1.00 0.00 H new ATOM 1454 N ASP B 9 7.595 10.380 -14.691 1.00 0.00 N ATOM 1455 CA ASP B 9 8.129 10.492 -13.330 1.00 0.00 C ATOM 1456 C ASP B 9 7.654 11.772 -12.639 1.00 0.00 C ATOM 1457 O ASP B 9 7.289 11.752 -11.463 1.00 0.00 O ATOM 1458 CB ASP B 9 9.659 10.448 -13.372 1.00 0.00 C ATOM 1459 CG ASP B 9 10.292 10.433 -11.996 1.00 0.00 C ATOM 1460 OD1 ASP B 9 10.308 9.361 -11.355 1.00 0.00 O ATOM 1461 OD2 ASP B 9 10.791 11.489 -11.559 1.00 0.00 O ATOM 0 H ASP B 9 8.307 10.218 -15.403 1.00 0.00 H new ATOM 0 HA ASP B 9 7.755 9.649 -12.749 1.00 0.00 H new ATOM 0 HB2 ASP B 9 9.976 9.561 -13.921 1.00 0.00 H new ATOM 0 HB3 ASP B 9 10.026 11.313 -13.925 1.00 0.00 H new ATOM 1466 N GLU B 10 7.636 12.871 -13.388 1.00 0.00 N ATOM 1467 CA GLU B 10 7.184 14.161 -12.869 1.00 0.00 C ATOM 1468 C GLU B 10 5.761 14.072 -12.310 1.00 0.00 C ATOM 1469 O GLU B 10 5.456 14.659 -11.273 1.00 0.00 O ATOM 1470 CB GLU B 10 7.242 15.231 -13.965 1.00 0.00 C ATOM 1471 CG GLU B 10 8.648 15.702 -14.323 1.00 0.00 C ATOM 1472 CD GLU B 10 9.542 14.599 -14.856 1.00 0.00 C ATOM 1473 OE1 GLU B 10 9.073 13.798 -15.691 1.00 0.00 O ATOM 1474 OE2 GLU B 10 10.721 14.537 -14.454 1.00 0.00 O ATOM 0 H GLU B 10 7.931 12.895 -14.364 1.00 0.00 H new ATOM 0 HA GLU B 10 7.855 14.440 -12.057 1.00 0.00 H new ATOM 0 HB2 GLU B 10 6.766 14.838 -14.863 1.00 0.00 H new ATOM 0 HB3 GLU B 10 6.656 16.092 -13.644 1.00 0.00 H new ATOM 0 HG2 GLU B 10 8.578 16.493 -15.069 1.00 0.00 H new ATOM 0 HG3 GLU B 10 9.112 16.138 -13.438 1.00 0.00 H new ATOM 1481 N GLN B 11 4.901 13.327 -12.999 1.00 0.00 N ATOM 1482 CA GLN B 11 3.516 13.152 -12.570 1.00 0.00 C ATOM 1483 C GLN B 11 3.453 12.366 -11.271 1.00 0.00 C ATOM 1484 O GLN B 11 2.837 12.802 -10.298 1.00 0.00 O ATOM 1485 CB GLN B 11 2.707 12.427 -13.646 1.00 0.00 C ATOM 1486 CG GLN B 11 2.430 13.271 -14.871 1.00 0.00 C ATOM 1487 CD GLN B 11 1.880 12.464 -16.032 1.00 0.00 C ATOM 1488 OE1 GLN B 11 1.135 11.409 -15.734 1.00 0.00 O flip ATOM 1489 NE2 GLN B 11 2.122 12.791 -17.191 1.00 0.00 N flip ATOM 0 H GLN B 11 5.139 12.833 -13.859 1.00 0.00 H new ATOM 0 HA GLN B 11 3.087 14.141 -12.408 1.00 0.00 H new ATOM 0 HB2 GLN B 11 3.245 11.529 -13.949 1.00 0.00 H new ATOM 0 HB3 GLN B 11 1.759 12.102 -13.218 1.00 0.00 H new ATOM 0 HG2 GLN B 11 1.720 14.056 -14.612 1.00 0.00 H new ATOM 0 HG3 GLN B 11 3.351 13.764 -15.182 1.00 0.00 H new ATOM 0 HE21 GLN B 11 2.700 13.610 -17.380 1.00 0.00 H new ATOM 0 HE22 GLN B 11 1.745 12.244 -17.965 1.00 0.00 H new ATOM 1498 N VAL B 12 4.111 11.214 -11.265 1.00 0.00 N ATOM 1499 CA VAL B 12 4.098 10.333 -10.108 1.00 0.00 C ATOM 1500 C VAL B 12 4.682 11.043 -8.889 1.00 0.00 C ATOM 1501 O VAL B 12 4.097 11.013 -7.805 1.00 0.00 O ATOM 1502 CB VAL B 12 4.882 9.026 -10.381 1.00 0.00 C ATOM 1503 CG1 VAL B 12 4.841 8.112 -9.167 1.00 0.00 C ATOM 1504 CG2 VAL B 12 4.323 8.311 -11.606 1.00 0.00 C ATOM 0 H VAL B 12 4.661 10.869 -12.051 1.00 0.00 H new ATOM 0 HA VAL B 12 3.059 10.071 -9.907 1.00 0.00 H new ATOM 0 HB VAL B 12 5.922 9.287 -10.579 1.00 0.00 H new ATOM 0 HG11 VAL B 12 5.398 7.199 -9.380 1.00 0.00 H new ATOM 0 HG12 VAL B 12 5.290 8.620 -8.314 1.00 0.00 H new ATOM 0 HG13 VAL B 12 3.806 7.860 -8.936 1.00 0.00 H new ATOM 0 HG21 VAL B 12 4.887 7.395 -11.782 1.00 0.00 H new ATOM 0 HG22 VAL B 12 3.275 8.065 -11.437 1.00 0.00 H new ATOM 0 HG23 VAL B 12 4.407 8.961 -12.477 1.00 0.00 H new ATOM 1514 N GLU B 13 5.816 11.712 -9.086 1.00 0.00 N ATOM 1515 CA GLU B 13 6.480 12.444 -8.011 1.00 0.00 C ATOM 1516 C GLU B 13 5.567 13.526 -7.444 1.00 0.00 C ATOM 1517 O GLU B 13 5.491 13.712 -6.230 1.00 0.00 O ATOM 1518 CB GLU B 13 7.768 13.099 -8.513 1.00 0.00 C ATOM 1519 CG GLU B 13 8.551 13.796 -7.411 1.00 0.00 C ATOM 1520 CD GLU B 13 9.235 15.058 -7.887 1.00 0.00 C ATOM 1521 OE1 GLU B 13 10.209 14.962 -8.655 1.00 0.00 O ATOM 1522 OE2 GLU B 13 8.799 16.163 -7.490 1.00 0.00 O ATOM 0 H GLU B 13 6.296 11.762 -9.985 1.00 0.00 H new ATOM 0 HA GLU B 13 6.719 11.724 -7.228 1.00 0.00 H new ATOM 0 HB2 GLU B 13 8.399 12.339 -8.974 1.00 0.00 H new ATOM 0 HB3 GLU B 13 7.522 13.823 -9.289 1.00 0.00 H new ATOM 0 HG2 GLU B 13 7.876 14.041 -6.591 1.00 0.00 H new ATOM 0 HG3 GLU B 13 9.299 13.110 -7.014 1.00 0.00 H new ATOM 1529 N LYS B 14 4.876 14.236 -8.328 1.00 0.00 N ATOM 1530 CA LYS B 14 4.029 15.347 -7.913 1.00 0.00 C ATOM 1531 C LYS B 14 2.902 14.862 -7.014 1.00 0.00 C ATOM 1532 O LYS B 14 2.636 15.455 -5.970 1.00 0.00 O ATOM 1533 CB LYS B 14 3.453 16.080 -9.129 1.00 0.00 C ATOM 1534 CG LYS B 14 3.827 17.560 -9.195 1.00 0.00 C ATOM 1535 CD LYS B 14 5.152 17.798 -9.915 1.00 0.00 C ATOM 1536 CE LYS B 14 6.338 17.178 -9.186 1.00 0.00 C ATOM 1537 NZ LYS B 14 6.642 17.863 -7.900 1.00 0.00 N ATOM 0 H LYS B 14 4.885 14.063 -9.333 1.00 0.00 H new ATOM 0 HA LYS B 14 4.649 16.044 -7.349 1.00 0.00 H new ATOM 0 HB2 LYS B 14 3.801 15.587 -10.037 1.00 0.00 H new ATOM 0 HB3 LYS B 14 2.367 15.990 -9.114 1.00 0.00 H new ATOM 0 HG2 LYS B 14 3.036 18.109 -9.706 1.00 0.00 H new ATOM 0 HG3 LYS B 14 3.890 17.961 -8.183 1.00 0.00 H new ATOM 0 HD2 LYS B 14 5.093 17.384 -10.922 1.00 0.00 H new ATOM 0 HD3 LYS B 14 5.316 18.870 -10.020 1.00 0.00 H new ATOM 0 HE2 LYS B 14 6.131 16.126 -8.992 1.00 0.00 H new ATOM 0 HE3 LYS B 14 7.216 17.217 -9.830 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 7.467 17.413 -7.454 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 6.850 18.866 -8.082 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 5.822 17.789 -7.265 1.00 0.00 H new ATOM 1551 N ILE B 15 2.254 13.773 -7.413 1.00 0.00 N ATOM 1552 CA ILE B 15 1.172 13.205 -6.622 1.00 0.00 C ATOM 1553 C ILE B 15 1.707 12.701 -5.283 1.00 0.00 C ATOM 1554 O ILE B 15 1.112 12.953 -4.236 1.00 0.00 O ATOM 1555 CB ILE B 15 0.461 12.054 -7.367 1.00 0.00 C ATOM 1556 CG1 ILE B 15 0.011 12.519 -8.755 1.00 0.00 C ATOM 1557 CG2 ILE B 15 -0.735 11.561 -6.560 1.00 0.00 C ATOM 1558 CD1 ILE B 15 -0.627 11.429 -9.588 1.00 0.00 C ATOM 0 H ILE B 15 2.459 13.269 -8.276 1.00 0.00 H new ATOM 0 HA ILE B 15 0.441 13.995 -6.450 1.00 0.00 H new ATOM 0 HB ILE B 15 1.163 11.229 -7.487 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -0.699 13.338 -8.641 1.00 0.00 H new ATOM 0 HG13 ILE B 15 0.873 12.916 -9.292 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -1.227 10.750 -7.097 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -0.395 11.200 -5.589 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -1.439 12.380 -6.416 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -0.919 11.835 -10.556 1.00 0.00 H new ATOM 0 HD12 ILE B 15 0.087 10.618 -9.735 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -1.509 11.047 -9.074 1.00 0.00 H new ATOM 1570 N LEU B 16 2.850 12.016 -5.327 1.00 0.00 N ATOM 1571 CA LEU B 16 3.502 11.518 -4.117 1.00 0.00 C ATOM 1572 C LEU B 16 3.783 12.655 -3.147 1.00 0.00 C ATOM 1573 O LEU B 16 3.499 12.550 -1.953 1.00 0.00 O ATOM 1574 CB LEU B 16 4.818 10.819 -4.461 1.00 0.00 C ATOM 1575 CG LEU B 16 4.691 9.499 -5.218 1.00 0.00 C ATOM 1576 CD1 LEU B 16 6.061 9.035 -5.685 1.00 0.00 C ATOM 1577 CD2 LEU B 16 4.045 8.444 -4.337 1.00 0.00 C ATOM 0 H LEU B 16 3.344 11.793 -6.191 1.00 0.00 H new ATOM 0 HA LEU B 16 2.824 10.804 -3.648 1.00 0.00 H new ATOM 0 HB2 LEU B 16 5.425 11.501 -5.057 1.00 0.00 H new ATOM 0 HB3 LEU B 16 5.362 10.634 -3.535 1.00 0.00 H new ATOM 0 HG LEU B 16 4.056 9.653 -6.091 1.00 0.00 H new ATOM 0 HD11 LEU B 16 5.962 8.093 -6.224 1.00 0.00 H new ATOM 0 HD12 LEU B 16 6.494 9.787 -6.345 1.00 0.00 H new ATOM 0 HD13 LEU B 16 6.711 8.892 -4.821 1.00 0.00 H new ATOM 0 HD21 LEU B 16 3.961 7.509 -4.891 1.00 0.00 H new ATOM 0 HD22 LEU B 16 4.658 8.286 -3.449 1.00 0.00 H new ATOM 0 HD23 LEU B 16 3.052 8.778 -4.038 1.00 0.00 H new ATOM 1589 N ALA B 17 4.337 13.744 -3.677 1.00 0.00 N ATOM 1590 CA ALA B 17 4.680 14.908 -2.875 1.00 0.00 C ATOM 1591 C ALA B 17 3.460 15.439 -2.136 1.00 0.00 C ATOM 1592 O ALA B 17 3.524 15.711 -0.939 1.00 0.00 O ATOM 1593 CB ALA B 17 5.287 15.996 -3.749 1.00 0.00 C ATOM 0 H ALA B 17 4.558 13.841 -4.668 1.00 0.00 H new ATOM 0 HA ALA B 17 5.419 14.603 -2.134 1.00 0.00 H new ATOM 0 HB1 ALA B 17 5.538 16.860 -3.133 1.00 0.00 H new ATOM 0 HB2 ALA B 17 6.190 15.617 -4.227 1.00 0.00 H new ATOM 0 HB3 ALA B 17 4.568 16.292 -4.513 1.00 0.00 H new ATOM 1599 N GLU B 18 2.345 15.565 -2.847 1.00 0.00 N ATOM 1600 CA GLU B 18 1.124 16.092 -2.255 1.00 0.00 C ATOM 1601 C GLU B 18 0.545 15.120 -1.233 1.00 0.00 C ATOM 1602 O GLU B 18 0.099 15.536 -0.167 1.00 0.00 O ATOM 1603 CB GLU B 18 0.089 16.410 -3.333 1.00 0.00 C ATOM 1604 CG GLU B 18 0.596 17.390 -4.374 1.00 0.00 C ATOM 1605 CD GLU B 18 -0.509 17.959 -5.238 1.00 0.00 C ATOM 1606 OE1 GLU B 18 -1.286 17.178 -5.816 1.00 0.00 O ATOM 1607 OE2 GLU B 18 -0.604 19.201 -5.337 1.00 0.00 O ATOM 0 H GLU B 18 2.263 15.310 -3.831 1.00 0.00 H new ATOM 0 HA GLU B 18 1.379 17.017 -1.738 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -0.208 15.485 -3.827 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -0.804 16.820 -2.861 1.00 0.00 H new ATOM 0 HG2 GLU B 18 1.115 18.207 -3.873 1.00 0.00 H new ATOM 0 HG3 GLU B 18 1.326 16.890 -5.010 1.00 0.00 H new ATOM 1614 N VAL B 19 0.561 13.828 -1.553 1.00 0.00 N ATOM 1615 CA VAL B 19 0.076 12.806 -0.627 1.00 0.00 C ATOM 1616 C VAL B 19 0.884 12.831 0.669 1.00 0.00 C ATOM 1617 O VAL B 19 0.323 12.795 1.765 1.00 0.00 O ATOM 1618 CB VAL B 19 0.138 11.392 -1.253 1.00 0.00 C ATOM 1619 CG1 VAL B 19 -0.213 10.322 -0.228 1.00 0.00 C ATOM 1620 CG2 VAL B 19 -0.792 11.297 -2.451 1.00 0.00 C ATOM 0 H VAL B 19 0.903 13.464 -2.443 1.00 0.00 H new ATOM 0 HA VAL B 19 -0.967 13.035 -0.408 1.00 0.00 H new ATOM 0 HB VAL B 19 1.161 11.220 -1.588 1.00 0.00 H new ATOM 0 HG11 VAL B 19 -0.161 9.339 -0.696 1.00 0.00 H new ATOM 0 HG12 VAL B 19 0.493 10.367 0.601 1.00 0.00 H new ATOM 0 HG13 VAL B 19 -1.223 10.493 0.146 1.00 0.00 H new ATOM 0 HG21 VAL B 19 -0.735 10.296 -2.878 1.00 0.00 H new ATOM 0 HG22 VAL B 19 -1.815 11.498 -2.134 1.00 0.00 H new ATOM 0 HG23 VAL B 19 -0.494 12.029 -3.202 1.00 0.00 H new ATOM 1630 N ALA B 20 2.203 12.911 0.533 1.00 0.00 N ATOM 1631 CA ALA B 20 3.087 12.987 1.688 1.00 0.00 C ATOM 1632 C ALA B 20 2.841 14.272 2.472 1.00 0.00 C ATOM 1633 O ALA B 20 2.892 14.281 3.703 1.00 0.00 O ATOM 1634 CB ALA B 20 4.541 12.895 1.251 1.00 0.00 C ATOM 0 H ALA B 20 2.683 12.925 -0.367 1.00 0.00 H new ATOM 0 HA ALA B 20 2.870 12.143 2.343 1.00 0.00 H new ATOM 0 HB1 ALA B 20 5.188 12.953 2.126 1.00 0.00 H new ATOM 0 HB2 ALA B 20 4.708 11.947 0.739 1.00 0.00 H new ATOM 0 HB3 ALA B 20 4.770 13.718 0.574 1.00 0.00 H new ATOM 1640 N LEU B 21 2.549 15.355 1.755 1.00 0.00 N ATOM 1641 CA LEU B 21 2.265 16.635 2.389 1.00 0.00 C ATOM 1642 C LEU B 21 0.959 16.594 3.168 1.00 0.00 C ATOM 1643 O LEU B 21 0.813 17.299 4.156 1.00 0.00 O ATOM 1644 CB LEU B 21 2.225 17.769 1.363 1.00 0.00 C ATOM 1645 CG LEU B 21 3.587 18.186 0.807 1.00 0.00 C ATOM 1646 CD1 LEU B 21 3.428 19.318 -0.192 1.00 0.00 C ATOM 1647 CD2 LEU B 21 4.523 18.600 1.933 1.00 0.00 C ATOM 0 H LEU B 21 2.504 15.369 0.736 1.00 0.00 H new ATOM 0 HA LEU B 21 3.078 16.829 3.089 1.00 0.00 H new ATOM 0 HB2 LEU B 21 1.588 17.465 0.532 1.00 0.00 H new ATOM 0 HB3 LEU B 21 1.756 18.639 1.823 1.00 0.00 H new ATOM 0 HG LEU B 21 4.024 17.329 0.295 1.00 0.00 H new ATOM 0 HD11 LEU B 21 4.407 19.603 -0.578 1.00 0.00 H new ATOM 0 HD12 LEU B 21 2.794 18.990 -1.016 1.00 0.00 H new ATOM 0 HD13 LEU B 21 2.969 20.175 0.300 1.00 0.00 H new ATOM 0 HD21 LEU B 21 5.487 18.893 1.516 1.00 0.00 H new ATOM 0 HD22 LEU B 21 4.091 19.442 2.474 1.00 0.00 H new ATOM 0 HD23 LEU B 21 4.663 17.762 2.616 1.00 0.00 H new ATOM 1659 N VAL B 22 0.010 15.770 2.731 1.00 0.00 N ATOM 1660 CA VAL B 22 -1.239 15.598 3.470 1.00 0.00 C ATOM 1661 C VAL B 22 -0.951 14.935 4.814 1.00 0.00 C ATOM 1662 O VAL B 22 -1.568 15.252 5.834 1.00 0.00 O ATOM 1663 CB VAL B 22 -2.268 14.749 2.684 1.00 0.00 C ATOM 1664 CG1 VAL B 22 -3.517 14.496 3.516 1.00 0.00 C ATOM 1665 CG2 VAL B 22 -2.641 15.431 1.375 1.00 0.00 C ATOM 0 H VAL B 22 0.080 15.216 1.878 1.00 0.00 H new ATOM 0 HA VAL B 22 -1.672 16.587 3.622 1.00 0.00 H new ATOM 0 HB VAL B 22 -1.804 13.789 2.459 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -4.223 13.898 2.940 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -3.246 13.961 4.426 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -3.978 15.448 3.779 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -3.365 14.818 0.839 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -3.078 16.407 1.585 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -1.748 15.557 0.763 1.00 0.00 H new ATOM 1675 N LEU B 23 0.018 14.037 4.807 1.00 0.00 N ATOM 1676 CA LEU B 23 0.435 13.343 6.014 1.00 0.00 C ATOM 1677 C LEU B 23 1.183 14.297 6.939 1.00 0.00 C ATOM 1678 O LEU B 23 0.912 14.355 8.139 1.00 0.00 O ATOM 1679 CB LEU B 23 1.311 12.147 5.648 1.00 0.00 C ATOM 1680 CG LEU B 23 0.652 11.149 4.693 1.00 0.00 C ATOM 1681 CD1 LEU B 23 1.615 10.039 4.323 1.00 0.00 C ATOM 1682 CD2 LEU B 23 -0.606 10.571 5.316 1.00 0.00 C ATOM 0 H LEU B 23 0.536 13.769 3.970 1.00 0.00 H new ATOM 0 HA LEU B 23 -0.448 12.980 6.540 1.00 0.00 H new ATOM 0 HB2 LEU B 23 2.232 12.512 5.194 1.00 0.00 H new ATOM 0 HB3 LEU B 23 1.592 11.625 6.562 1.00 0.00 H new ATOM 0 HG LEU B 23 0.378 11.681 3.782 1.00 0.00 H new ATOM 0 HD11 LEU B 23 1.124 9.342 3.644 1.00 0.00 H new ATOM 0 HD12 LEU B 23 2.491 10.465 3.834 1.00 0.00 H new ATOM 0 HD13 LEU B 23 1.924 9.510 5.224 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -1.063 9.863 4.624 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -0.350 10.058 6.243 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -1.310 11.376 5.528 1.00 0.00 H new ATOM 1694 N GLU B 24 2.110 15.059 6.368 1.00 0.00 N ATOM 1695 CA GLU B 24 2.841 16.079 7.118 1.00 0.00 C ATOM 1696 C GLU B 24 1.900 17.183 7.595 1.00 0.00 C ATOM 1697 O GLU B 24 2.149 17.836 8.609 1.00 0.00 O ATOM 1698 CB GLU B 24 3.965 16.677 6.261 1.00 0.00 C ATOM 1699 CG GLU B 24 5.332 16.049 6.510 1.00 0.00 C ATOM 1700 CD GLU B 24 5.376 14.559 6.230 1.00 0.00 C ATOM 1701 OE1 GLU B 24 4.788 13.785 7.014 1.00 0.00 O ATOM 1702 OE2 GLU B 24 6.022 14.153 5.239 1.00 0.00 O ATOM 0 H GLU B 24 2.375 14.990 5.385 1.00 0.00 H new ATOM 0 HA GLU B 24 3.283 15.601 7.992 1.00 0.00 H new ATOM 0 HB2 GLU B 24 3.708 16.559 5.208 1.00 0.00 H new ATOM 0 HB3 GLU B 24 4.027 17.748 6.456 1.00 0.00 H new ATOM 0 HG2 GLU B 24 6.072 16.550 5.885 1.00 0.00 H new ATOM 0 HG3 GLU B 24 5.620 16.224 7.547 1.00 0.00 H new ATOM 1709 N LYS B 25 0.818 17.376 6.857 1.00 0.00 N ATOM 1710 CA LYS B 25 -0.203 18.364 7.190 1.00 0.00 C ATOM 1711 C LYS B 25 -0.884 18.033 8.514 1.00 0.00 C ATOM 1712 O LYS B 25 -1.143 18.915 9.331 1.00 0.00 O ATOM 1713 CB LYS B 25 -1.242 18.407 6.068 1.00 0.00 C ATOM 1714 CG LYS B 25 -2.392 19.375 6.290 1.00 0.00 C ATOM 1715 CD LYS B 25 -3.418 19.244 5.176 1.00 0.00 C ATOM 1716 CE LYS B 25 -4.569 20.222 5.338 1.00 0.00 C ATOM 1717 NZ LYS B 25 -5.561 20.089 4.236 1.00 0.00 N ATOM 0 H LYS B 25 0.620 16.850 6.006 1.00 0.00 H new ATOM 0 HA LYS B 25 0.276 19.337 7.295 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -0.739 18.672 5.138 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -1.651 17.406 5.935 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -2.863 19.175 7.252 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -2.014 20.397 6.326 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -2.932 19.413 4.215 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -3.808 18.226 5.161 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -5.062 20.049 6.295 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -4.181 21.241 5.358 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -6.050 20.996 4.098 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -5.071 19.822 3.358 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -6.256 19.355 4.481 1.00 0.00 H new ATOM 1731 N HIS B 26 -1.172 16.757 8.723 1.00 0.00 N ATOM 1732 CA HIS B 26 -1.898 16.331 9.916 1.00 0.00 C ATOM 1733 C HIS B 26 -0.963 15.711 10.945 1.00 0.00 C ATOM 1734 O HIS B 26 -1.425 15.122 11.922 1.00 0.00 O ATOM 1735 CB HIS B 26 -2.998 15.331 9.554 1.00 0.00 C ATOM 1736 CG HIS B 26 -4.110 15.910 8.731 1.00 0.00 C ATOM 1737 ND1 HIS B 26 -5.316 16.308 9.265 1.00 0.00 N ATOM 1738 CD2 HIS B 26 -4.201 16.129 7.400 1.00 0.00 C ATOM 1739 CE1 HIS B 26 -6.101 16.742 8.296 1.00 0.00 C ATOM 1740 NE2 HIS B 26 -5.447 16.644 7.154 1.00 0.00 N ATOM 0 H HIS B 26 -0.917 16.001 8.088 1.00 0.00 H new ATOM 0 HA HIS B 26 -2.352 17.220 10.353 1.00 0.00 H new ATOM 0 HB2 HIS B 26 -2.552 14.500 9.008 1.00 0.00 H new ATOM 0 HB3 HIS B 26 -3.417 14.921 10.473 1.00 0.00 H new ATOM 0 HD2 HIS B 26 -3.433 15.934 6.666 1.00 0.00 H new ATOM 0 HE1 HIS B 26 -7.108 17.114 8.417 1.00 0.00 H new ATOM 0 HE2 HIS B 26 -5.810 16.908 6.238 1.00 0.00 H new ATOM 1749 N ALA B 27 0.344 15.851 10.719 1.00 0.00 N ATOM 1750 CA ALA B 27 1.358 15.298 11.619 1.00 0.00 C ATOM 1751 C ALA B 27 1.198 13.786 11.761 1.00 0.00 C ATOM 1752 O ALA B 27 1.201 13.242 12.867 1.00 0.00 O ATOM 1753 CB ALA B 27 1.288 15.984 12.977 1.00 0.00 C ATOM 0 H ALA B 27 0.728 16.346 9.914 1.00 0.00 H new ATOM 0 HA ALA B 27 2.341 15.487 11.188 1.00 0.00 H new ATOM 0 HB1 ALA B 27 2.047 15.564 13.637 1.00 0.00 H new ATOM 0 HB2 ALA B 27 1.465 17.052 12.854 1.00 0.00 H new ATOM 0 HB3 ALA B 27 0.301 15.828 13.413 1.00 0.00 H new ATOM 1759 N ALA B 28 1.054 13.115 10.627 1.00 0.00 N ATOM 1760 CA ALA B 28 0.869 11.672 10.602 1.00 0.00 C ATOM 1761 C ALA B 28 2.160 10.938 10.947 1.00 0.00 C ATOM 1762 O ALA B 28 3.239 11.285 10.454 1.00 0.00 O ATOM 1763 CB ALA B 28 0.368 11.228 9.235 1.00 0.00 C ATOM 0 H ALA B 28 1.062 13.552 9.705 1.00 0.00 H new ATOM 0 HA ALA B 28 0.125 11.420 11.357 1.00 0.00 H new ATOM 0 HB1 ALA B 28 0.234 10.146 9.230 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -0.585 11.713 9.022 1.00 0.00 H new ATOM 0 HB3 ALA B 28 1.096 11.507 8.473 1.00 0.00 H new ATOM 1769 N SER B 29 2.036 9.926 11.795 1.00 0.00 N ATOM 1770 CA SER B 29 3.160 9.082 12.183 1.00 0.00 C ATOM 1771 C SER B 29 3.609 8.213 11.007 1.00 0.00 C ATOM 1772 O SER B 29 2.877 8.071 10.025 1.00 0.00 O ATOM 1773 CB SER B 29 2.741 8.195 13.360 1.00 0.00 C ATOM 1774 OG SER B 29 1.608 7.411 13.024 1.00 0.00 O ATOM 0 H SER B 29 1.153 9.666 12.234 1.00 0.00 H new ATOM 0 HA SER B 29 3.996 9.715 12.480 1.00 0.00 H new ATOM 0 HB2 SER B 29 3.568 7.544 13.642 1.00 0.00 H new ATOM 0 HB3 SER B 29 2.514 8.816 14.226 1.00 0.00 H new ATOM 0 HG SER B 29 1.189 7.074 13.843 1.00 0.00 H new ATOM 1780 N PRO B 30 4.821 7.633 11.077 1.00 0.00 N ATOM 1781 CA PRO B 30 5.305 6.697 10.059 1.00 0.00 C ATOM 1782 C PRO B 30 4.347 5.523 9.874 1.00 0.00 C ATOM 1783 O PRO B 30 4.049 5.120 8.750 1.00 0.00 O ATOM 1784 CB PRO B 30 6.652 6.207 10.610 1.00 0.00 C ATOM 1785 CG PRO B 30 6.673 6.625 12.044 1.00 0.00 C ATOM 1786 CD PRO B 30 5.825 7.860 12.126 1.00 0.00 C ATOM 0 HA PRO B 30 5.390 7.169 9.080 1.00 0.00 H new ATOM 0 HB2 PRO B 30 6.744 5.125 10.515 1.00 0.00 H new ATOM 0 HB3 PRO B 30 7.484 6.647 10.061 1.00 0.00 H new ATOM 0 HG2 PRO B 30 6.279 5.837 12.686 1.00 0.00 H new ATOM 0 HG3 PRO B 30 7.691 6.828 12.377 1.00 0.00 H new ATOM 0 HD2 PRO B 30 5.366 7.972 13.108 1.00 0.00 H new ATOM 0 HD3 PRO B 30 6.406 8.763 11.941 1.00 0.00 H new ATOM 1794 N GLU B 31 3.854 5.001 10.990 1.00 0.00 N ATOM 1795 CA GLU B 31 2.893 3.906 10.979 1.00 0.00 C ATOM 1796 C GLU B 31 1.597 4.322 10.297 1.00 0.00 C ATOM 1797 O GLU B 31 1.092 3.612 9.429 1.00 0.00 O ATOM 1798 CB GLU B 31 2.618 3.445 12.406 1.00 0.00 C ATOM 1799 CG GLU B 31 3.744 2.615 13.000 1.00 0.00 C ATOM 1800 CD GLU B 31 3.738 1.185 12.497 1.00 0.00 C ATOM 1801 OE1 GLU B 31 3.857 0.968 11.274 1.00 0.00 O ATOM 1802 OE2 GLU B 31 3.585 0.267 13.328 1.00 0.00 O ATOM 0 H GLU B 31 4.108 5.323 11.924 1.00 0.00 H new ATOM 0 HA GLU B 31 3.319 3.079 10.411 1.00 0.00 H new ATOM 0 HB2 GLU B 31 2.449 4.318 13.036 1.00 0.00 H new ATOM 0 HB3 GLU B 31 1.699 2.860 12.420 1.00 0.00 H new ATOM 0 HG2 GLU B 31 4.700 3.078 12.757 1.00 0.00 H new ATOM 0 HG3 GLU B 31 3.657 2.615 14.087 1.00 0.00 H new ATOM 1809 N LEU B 32 1.064 5.478 10.685 1.00 0.00 N ATOM 1810 CA LEU B 32 -0.135 6.008 10.050 1.00 0.00 C ATOM 1811 C LEU B 32 0.116 6.209 8.561 1.00 0.00 C ATOM 1812 O LEU B 32 -0.714 5.852 7.733 1.00 0.00 O ATOM 1813 CB LEU B 32 -0.555 7.330 10.704 1.00 0.00 C ATOM 1814 CG LEU B 32 -1.829 7.966 10.141 1.00 0.00 C ATOM 1815 CD1 LEU B 32 -3.014 7.027 10.296 1.00 0.00 C ATOM 1816 CD2 LEU B 32 -2.115 9.288 10.831 1.00 0.00 C ATOM 0 H LEU B 32 1.442 6.061 11.432 1.00 0.00 H new ATOM 0 HA LEU B 32 -0.946 5.292 10.181 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -0.696 7.159 11.771 1.00 0.00 H new ATOM 0 HB3 LEU B 32 0.263 8.043 10.600 1.00 0.00 H new ATOM 0 HG LEU B 32 -1.673 8.153 9.079 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -3.908 7.499 9.889 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -2.817 6.100 9.758 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -3.168 6.807 11.352 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -3.024 9.725 10.418 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -2.247 9.120 11.900 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -1.280 9.970 10.672 1.00 0.00 H new ATOM 1828 N THR B 33 1.282 6.756 8.241 1.00 0.00 N ATOM 1829 CA THR B 33 1.707 6.958 6.859 1.00 0.00 C ATOM 1830 C THR B 33 1.586 5.670 6.049 1.00 0.00 C ATOM 1831 O THR B 33 0.913 5.624 5.016 1.00 0.00 O ATOM 1832 CB THR B 33 3.173 7.434 6.813 1.00 0.00 C ATOM 1833 OG1 THR B 33 3.295 8.736 7.408 1.00 0.00 O ATOM 1834 CG2 THR B 33 3.704 7.451 5.385 1.00 0.00 C ATOM 0 H THR B 33 1.962 7.073 8.932 1.00 0.00 H new ATOM 0 HA THR B 33 1.054 7.715 6.425 1.00 0.00 H new ATOM 0 HB THR B 33 3.774 6.727 7.386 1.00 0.00 H new ATOM 0 HG1 THR B 33 3.276 8.653 8.384 1.00 0.00 H new ATOM 0 HG21 THR B 33 4.740 7.791 5.386 1.00 0.00 H new ATOM 0 HG22 THR B 33 3.652 6.446 4.966 1.00 0.00 H new ATOM 0 HG23 THR B 33 3.100 8.128 4.780 1.00 0.00 H new ATOM 1842 N LEU B 34 2.233 4.627 6.540 1.00 0.00 N ATOM 1843 CA LEU B 34 2.279 3.362 5.839 1.00 0.00 C ATOM 1844 C LEU B 34 0.904 2.697 5.829 1.00 0.00 C ATOM 1845 O LEU B 34 0.529 2.037 4.859 1.00 0.00 O ATOM 1846 CB LEU B 34 3.337 2.462 6.484 1.00 0.00 C ATOM 1847 CG LEU B 34 3.534 1.100 5.821 1.00 0.00 C ATOM 1848 CD1 LEU B 34 5.003 0.705 5.845 1.00 0.00 C ATOM 1849 CD2 LEU B 34 2.694 0.046 6.529 1.00 0.00 C ATOM 0 H LEU B 34 2.736 4.635 7.427 1.00 0.00 H new ATOM 0 HA LEU B 34 2.558 3.534 4.799 1.00 0.00 H new ATOM 0 HB2 LEU B 34 4.290 2.990 6.479 1.00 0.00 H new ATOM 0 HB3 LEU B 34 3.066 2.303 7.528 1.00 0.00 H new ATOM 0 HG LEU B 34 3.211 1.168 4.782 1.00 0.00 H new ATOM 0 HD11 LEU B 34 5.126 -0.268 5.369 1.00 0.00 H new ATOM 0 HD12 LEU B 34 5.589 1.450 5.306 1.00 0.00 H new ATOM 0 HD13 LEU B 34 5.348 0.650 6.877 1.00 0.00 H new ATOM 0 HD21 LEU B 34 2.842 -0.921 6.048 1.00 0.00 H new ATOM 0 HD22 LEU B 34 2.996 -0.019 7.574 1.00 0.00 H new ATOM 0 HD23 LEU B 34 1.641 0.322 6.472 1.00 0.00 H new ATOM 1861 N MET B 35 0.148 2.889 6.902 1.00 0.00 N ATOM 1862 CA MET B 35 -1.197 2.337 6.991 1.00 0.00 C ATOM 1863 C MET B 35 -2.125 3.031 5.995 1.00 0.00 C ATOM 1864 O MET B 35 -3.028 2.406 5.442 1.00 0.00 O ATOM 1865 CB MET B 35 -1.744 2.467 8.414 1.00 0.00 C ATOM 1866 CG MET B 35 -3.080 1.763 8.617 1.00 0.00 C ATOM 1867 SD MET B 35 -3.614 1.744 10.340 1.00 0.00 S ATOM 1868 CE MET B 35 -3.761 3.497 10.671 1.00 0.00 C ATOM 0 H MET B 35 0.442 3.421 7.721 1.00 0.00 H new ATOM 0 HA MET B 35 -1.149 1.277 6.740 1.00 0.00 H new ATOM 0 HB2 MET B 35 -1.016 2.057 9.114 1.00 0.00 H new ATOM 0 HB3 MET B 35 -1.858 3.524 8.656 1.00 0.00 H new ATOM 0 HG2 MET B 35 -3.840 2.258 8.012 1.00 0.00 H new ATOM 0 HG3 MET B 35 -3.002 0.738 8.255 1.00 0.00 H new ATOM 0 HE1 MET B 35 -4.498 3.658 11.458 1.00 0.00 H new ATOM 0 HE2 MET B 35 -2.796 3.889 10.992 1.00 0.00 H new ATOM 0 HE3 MET B 35 -4.079 4.013 9.765 1.00 0.00 H new ATOM 1878 N ILE B 36 -1.895 4.322 5.763 1.00 0.00 N ATOM 1879 CA ILE B 36 -2.637 5.059 4.745 1.00 0.00 C ATOM 1880 C ILE B 36 -2.377 4.455 3.373 1.00 0.00 C ATOM 1881 O ILE B 36 -3.306 4.244 2.595 1.00 0.00 O ATOM 1882 CB ILE B 36 -2.267 6.564 4.728 1.00 0.00 C ATOM 1883 CG1 ILE B 36 -2.700 7.240 6.031 1.00 0.00 C ATOM 1884 CG2 ILE B 36 -2.891 7.270 3.532 1.00 0.00 C ATOM 1885 CD1 ILE B 36 -4.150 7.002 6.396 1.00 0.00 C ATOM 0 H ILE B 36 -1.202 4.877 6.265 1.00 0.00 H new ATOM 0 HA ILE B 36 -3.695 4.979 4.993 1.00 0.00 H new ATOM 0 HB ILE B 36 -1.183 6.640 4.639 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -2.068 6.880 6.843 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -2.529 8.313 5.946 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -2.614 8.324 3.547 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -2.530 6.813 2.611 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -3.976 7.179 3.581 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -4.379 7.513 7.331 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -4.792 7.388 5.605 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -4.324 5.933 6.515 1.00 0.00 H new ATOM 1897 N ALA B 37 -1.110 4.157 3.094 1.00 0.00 N ATOM 1898 CA ALA B 37 -0.733 3.493 1.849 1.00 0.00 C ATOM 1899 C ALA B 37 -1.481 2.172 1.703 1.00 0.00 C ATOM 1900 O ALA B 37 -1.960 1.830 0.619 1.00 0.00 O ATOM 1901 CB ALA B 37 0.769 3.256 1.811 1.00 0.00 C ATOM 0 H ALA B 37 -0.327 4.365 3.714 1.00 0.00 H new ATOM 0 HA ALA B 37 -1.005 4.140 1.015 1.00 0.00 H new ATOM 0 HB1 ALA B 37 1.036 2.760 0.878 1.00 0.00 H new ATOM 0 HB2 ALA B 37 1.290 4.211 1.876 1.00 0.00 H new ATOM 0 HB3 ALA B 37 1.059 2.626 2.652 1.00 0.00 H new ATOM 1907 N GLY B 38 -1.581 1.444 2.809 1.00 0.00 N ATOM 1908 CA GLY B 38 -2.340 0.211 2.824 1.00 0.00 C ATOM 1909 C GLY B 38 -3.797 0.441 2.493 1.00 0.00 C ATOM 1910 O GLY B 38 -4.371 -0.263 1.665 1.00 0.00 O ATOM 0 H GLY B 38 -1.147 1.689 3.699 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -1.911 -0.488 2.106 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -2.260 -0.252 3.807 1.00 0.00 H new ATOM 1914 N ASN B 39 -4.389 1.445 3.128 1.00 0.00 N ATOM 1915 CA ASN B 39 -5.789 1.790 2.896 1.00 0.00 C ATOM 1916 C ASN B 39 -6.019 2.204 1.444 1.00 0.00 C ATOM 1917 O ASN B 39 -7.066 1.908 0.865 1.00 0.00 O ATOM 1918 CB ASN B 39 -6.228 2.917 3.835 1.00 0.00 C ATOM 1919 CG ASN B 39 -6.288 2.483 5.288 1.00 0.00 C ATOM 1920 OD1 ASN B 39 -6.584 1.330 5.597 1.00 0.00 O ATOM 1921 ND2 ASN B 39 -6.004 3.407 6.195 1.00 0.00 N ATOM 0 H ASN B 39 -3.919 2.039 3.812 1.00 0.00 H new ATOM 0 HA ASN B 39 -6.389 0.903 3.101 1.00 0.00 H new ATOM 0 HB2 ASN B 39 -5.536 3.754 3.739 1.00 0.00 H new ATOM 0 HB3 ASN B 39 -7.209 3.278 3.528 1.00 0.00 H new ATOM 0 HD21 ASN B 39 -6.027 3.172 7.187 1.00 0.00 H new ATOM 0 HD22 ASN B 39 -5.763 4.353 5.901 1.00 0.00 H new ATOM 1928 N ILE B 40 -5.037 2.889 0.858 1.00 0.00 N ATOM 1929 CA ILE B 40 -5.100 3.253 -0.552 1.00 0.00 C ATOM 1930 C ILE B 40 -5.190 1.996 -1.409 1.00 0.00 C ATOM 1931 O ILE B 40 -6.120 1.840 -2.200 1.00 0.00 O ATOM 1932 CB ILE B 40 -3.873 4.073 -1.008 1.00 0.00 C ATOM 1933 CG1 ILE B 40 -3.801 5.405 -0.259 1.00 0.00 C ATOM 1934 CG2 ILE B 40 -3.921 4.315 -2.513 1.00 0.00 C ATOM 1935 CD1 ILE B 40 -2.574 6.222 -0.602 1.00 0.00 C ATOM 0 H ILE B 40 -4.193 3.201 1.338 1.00 0.00 H new ATOM 0 HA ILE B 40 -5.988 3.873 -0.677 1.00 0.00 H new ATOM 0 HB ILE B 40 -2.976 3.499 -0.775 1.00 0.00 H new ATOM 0 HG12 ILE B 40 -4.693 5.990 -0.486 1.00 0.00 H new ATOM 0 HG13 ILE B 40 -3.811 5.211 0.814 1.00 0.00 H new ATOM 0 HG21 ILE B 40 -3.049 4.894 -2.816 1.00 0.00 H new ATOM 0 HG22 ILE B 40 -3.921 3.358 -3.036 1.00 0.00 H new ATOM 0 HG23 ILE B 40 -4.827 4.866 -2.764 1.00 0.00 H new ATOM 0 HD11 ILE B 40 -2.587 7.153 -0.036 1.00 0.00 H new ATOM 0 HD12 ILE B 40 -1.678 5.656 -0.349 1.00 0.00 H new ATOM 0 HD13 ILE B 40 -2.573 6.446 -1.669 1.00 0.00 H new ATOM 1947 N ALA B 41 -4.221 1.098 -1.227 1.00 0.00 N ATOM 1948 CA ALA B 41 -4.189 -0.146 -1.974 1.00 0.00 C ATOM 1949 C ALA B 41 -5.464 -0.942 -1.741 1.00 0.00 C ATOM 1950 O ALA B 41 -6.011 -1.527 -2.669 1.00 0.00 O ATOM 1951 CB ALA B 41 -2.966 -0.964 -1.593 1.00 0.00 C ATOM 0 H ALA B 41 -3.451 1.215 -0.568 1.00 0.00 H new ATOM 0 HA ALA B 41 -4.125 0.090 -3.036 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -2.958 -1.893 -2.163 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -2.064 -0.394 -1.815 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -2.998 -1.192 -0.528 1.00 0.00 H new ATOM 1957 N THR B 42 -5.940 -0.933 -0.501 1.00 0.00 N ATOM 1958 CA THR B 42 -7.170 -1.619 -0.136 1.00 0.00 C ATOM 1959 C THR B 42 -8.339 -1.153 -1.004 1.00 0.00 C ATOM 1960 O THR B 42 -8.997 -1.964 -1.644 1.00 0.00 O ATOM 1961 CB THR B 42 -7.513 -1.391 1.351 1.00 0.00 C ATOM 1962 OG1 THR B 42 -6.432 -1.840 2.178 1.00 0.00 O ATOM 1963 CG2 THR B 42 -8.787 -2.126 1.740 1.00 0.00 C ATOM 0 H THR B 42 -5.485 -0.452 0.275 1.00 0.00 H new ATOM 0 HA THR B 42 -7.007 -2.684 -0.303 1.00 0.00 H new ATOM 0 HB THR B 42 -7.670 -0.323 1.499 1.00 0.00 H new ATOM 0 HG1 THR B 42 -5.699 -1.191 2.139 1.00 0.00 H new ATOM 0 HG21 THR B 42 -9.003 -1.947 2.793 1.00 0.00 H new ATOM 0 HG22 THR B 42 -9.616 -1.764 1.132 1.00 0.00 H new ATOM 0 HG23 THR B 42 -8.656 -3.195 1.574 1.00 0.00 H new ATOM 1971 N ASN B 43 -8.569 0.158 -1.040 1.00 0.00 N ATOM 1972 CA ASN B 43 -9.675 0.726 -1.813 1.00 0.00 C ATOM 1973 C ASN B 43 -9.539 0.351 -3.288 1.00 0.00 C ATOM 1974 O ASN B 43 -10.518 -0.024 -3.943 1.00 0.00 O ATOM 1975 CB ASN B 43 -9.704 2.254 -1.653 1.00 0.00 C ATOM 1976 CG ASN B 43 -10.976 2.901 -2.187 1.00 0.00 C ATOM 1977 OD1 ASN B 43 -11.607 2.410 -3.122 1.00 0.00 O ATOM 1978 ND2 ASN B 43 -11.358 4.021 -1.594 1.00 0.00 N ATOM 0 H ASN B 43 -8.005 0.848 -0.544 1.00 0.00 H new ATOM 0 HA ASN B 43 -10.612 0.316 -1.435 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -9.596 2.502 -0.597 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -8.845 2.681 -2.170 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -12.199 4.504 -1.910 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -10.811 4.401 -0.821 1.00 0.00 H new ATOM 1985 N VAL B 44 -8.317 0.430 -3.803 1.00 0.00 N ATOM 1986 CA VAL B 44 -8.048 0.026 -5.177 1.00 0.00 C ATOM 1987 C VAL B 44 -8.368 -1.453 -5.357 1.00 0.00 C ATOM 1988 O VAL B 44 -8.977 -1.850 -6.344 1.00 0.00 O ATOM 1989 CB VAL B 44 -6.578 0.283 -5.578 1.00 0.00 C ATOM 1990 CG1 VAL B 44 -6.358 -0.049 -7.048 1.00 0.00 C ATOM 1991 CG2 VAL B 44 -6.185 1.724 -5.294 1.00 0.00 C ATOM 0 H VAL B 44 -7.501 0.768 -3.293 1.00 0.00 H new ATOM 0 HA VAL B 44 -8.685 0.629 -5.824 1.00 0.00 H new ATOM 0 HB VAL B 44 -5.944 -0.369 -4.978 1.00 0.00 H new ATOM 0 HG11 VAL B 44 -5.317 0.138 -7.311 1.00 0.00 H new ATOM 0 HG12 VAL B 44 -6.593 -1.099 -7.223 1.00 0.00 H new ATOM 0 HG13 VAL B 44 -7.006 0.576 -7.663 1.00 0.00 H new ATOM 0 HG21 VAL B 44 -5.146 1.882 -5.584 1.00 0.00 H new ATOM 0 HG22 VAL B 44 -6.827 2.395 -5.864 1.00 0.00 H new ATOM 0 HG23 VAL B 44 -6.300 1.929 -4.230 1.00 0.00 H new ATOM 2001 N LEU B 45 -7.991 -2.251 -4.367 1.00 0.00 N ATOM 2002 CA LEU B 45 -8.225 -3.689 -4.387 1.00 0.00 C ATOM 2003 C LEU B 45 -9.678 -4.024 -4.065 1.00 0.00 C ATOM 2004 O LEU B 45 -10.075 -5.186 -4.087 1.00 0.00 O ATOM 2005 CB LEU B 45 -7.296 -4.393 -3.392 1.00 0.00 C ATOM 2006 CG LEU B 45 -5.807 -4.325 -3.741 1.00 0.00 C ATOM 2007 CD1 LEU B 45 -4.963 -4.904 -2.618 1.00 0.00 C ATOM 2008 CD2 LEU B 45 -5.531 -5.060 -5.042 1.00 0.00 C ATOM 0 H LEU B 45 -7.515 -1.920 -3.528 1.00 0.00 H new ATOM 0 HA LEU B 45 -8.011 -4.044 -5.395 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -7.444 -3.953 -2.406 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -7.590 -5.440 -3.321 1.00 0.00 H new ATOM 0 HG LEU B 45 -5.536 -3.277 -3.869 1.00 0.00 H new ATOM 0 HD11 LEU B 45 -3.909 -4.845 -2.888 1.00 0.00 H new ATOM 0 HD12 LEU B 45 -5.136 -4.337 -1.703 1.00 0.00 H new ATOM 0 HD13 LEU B 45 -5.238 -5.946 -2.456 1.00 0.00 H new ATOM 0 HD21 LEU B 45 -4.468 -5.001 -5.275 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -5.823 -6.105 -4.938 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -6.104 -4.601 -5.848 1.00 0.00 H new ATOM 2020 N ASN B 46 -10.466 -3.006 -3.741 1.00 0.00 N ATOM 2021 CA ASN B 46 -11.891 -3.198 -3.500 1.00 0.00 C ATOM 2022 C ASN B 46 -12.702 -2.809 -4.728 1.00 0.00 C ATOM 2023 O ASN B 46 -13.384 -3.643 -5.327 1.00 0.00 O ATOM 2024 CB ASN B 46 -12.379 -2.375 -2.298 1.00 0.00 C ATOM 2025 CG ASN B 46 -11.757 -2.786 -0.977 1.00 0.00 C ATOM 2026 OD1 ASN B 46 -11.649 -1.975 -0.058 1.00 0.00 O ATOM 2027 ND2 ASN B 46 -11.327 -4.035 -0.873 1.00 0.00 N ATOM 0 H ASN B 46 -10.145 -2.043 -3.639 1.00 0.00 H new ATOM 0 HA ASN B 46 -12.037 -4.256 -3.283 1.00 0.00 H new ATOM 0 HB2 ASN B 46 -12.161 -1.322 -2.479 1.00 0.00 H new ATOM 0 HB3 ASN B 46 -13.462 -2.468 -2.223 1.00 0.00 H new ATOM 0 HD21 ASN B 46 -10.889 -4.353 -0.009 1.00 0.00 H new ATOM 0 HD22 ASN B 46 -11.434 -4.678 -1.657 1.00 0.00 H new ATOM 2034 N GLN B 47 -12.613 -1.540 -5.110 1.00 0.00 N ATOM 2035 CA GLN B 47 -13.476 -0.992 -6.147 1.00 0.00 C ATOM 2036 C GLN B 47 -12.743 -0.818 -7.478 1.00 0.00 C ATOM 2037 O GLN B 47 -13.301 -1.098 -8.537 1.00 0.00 O ATOM 2038 CB GLN B 47 -14.042 0.358 -5.697 1.00 0.00 C ATOM 2039 CG GLN B 47 -14.759 0.309 -4.353 1.00 0.00 C ATOM 2040 CD GLN B 47 -15.339 1.652 -3.941 1.00 0.00 C ATOM 2041 OE1 GLN B 47 -14.692 2.734 -4.344 1.00 0.00 O flip ATOM 2042 NE2 GLN B 47 -16.356 1.714 -3.248 1.00 0.00 N flip ATOM 0 H GLN B 47 -11.951 -0.872 -4.716 1.00 0.00 H new ATOM 0 HA GLN B 47 -14.285 -1.705 -6.303 1.00 0.00 H new ATOM 0 HB2 GLN B 47 -13.228 1.081 -5.638 1.00 0.00 H new ATOM 0 HB3 GLN B 47 -14.736 0.721 -6.455 1.00 0.00 H new ATOM 0 HG2 GLN B 47 -15.561 -0.428 -4.402 1.00 0.00 H new ATOM 0 HG3 GLN B 47 -14.061 -0.030 -3.587 1.00 0.00 H new ATOM 0 HE21 GLN B 47 -16.828 0.858 -2.957 1.00 0.00 H new ATOM 0 HE22 GLN B 47 -16.726 2.622 -2.966 1.00 0.00 H new ATOM 2051 N ARG B 48 -11.491 -0.378 -7.423 1.00 0.00 N ATOM 2052 CA ARG B 48 -10.769 0.015 -8.632 1.00 0.00 C ATOM 2053 C ARG B 48 -10.003 -1.143 -9.272 1.00 0.00 C ATOM 2054 O ARG B 48 -9.122 -0.916 -10.101 1.00 0.00 O ATOM 2055 CB ARG B 48 -9.803 1.164 -8.326 1.00 0.00 C ATOM 2056 CG ARG B 48 -10.474 2.525 -8.225 1.00 0.00 C ATOM 2057 CD ARG B 48 -9.449 3.637 -8.070 1.00 0.00 C ATOM 2058 NE ARG B 48 -10.039 4.958 -8.279 1.00 0.00 N ATOM 2059 CZ ARG B 48 -9.433 5.950 -8.939 1.00 0.00 C ATOM 2060 NH1 ARG B 48 -8.196 5.785 -9.402 1.00 0.00 N ATOM 2061 NH2 ARG B 48 -10.055 7.108 -9.118 1.00 0.00 N ATOM 0 H ARG B 48 -10.955 -0.284 -6.560 1.00 0.00 H new ATOM 0 HA ARG B 48 -11.522 0.341 -9.350 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -9.289 0.953 -7.388 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -9.042 1.202 -9.105 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -11.075 2.703 -9.117 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -11.155 2.535 -7.374 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -9.010 3.589 -7.073 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -8.638 3.485 -8.783 1.00 0.00 H new ATOM 0 HE ARG B 48 -10.969 5.133 -7.898 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -7.710 4.901 -9.253 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -7.735 6.543 -9.905 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -10.997 7.243 -8.752 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -9.591 7.864 -9.622 1.00 0.00 H new ATOM 2075 N VAL B 49 -10.341 -2.372 -8.917 1.00 0.00 N ATOM 2076 CA VAL B 49 -9.677 -3.527 -9.506 1.00 0.00 C ATOM 2077 C VAL B 49 -10.685 -4.638 -9.787 1.00 0.00 C ATOM 2078 O VAL B 49 -11.767 -4.666 -9.199 1.00 0.00 O ATOM 2079 CB VAL B 49 -8.546 -4.066 -8.595 1.00 0.00 C ATOM 2080 CG1 VAL B 49 -9.110 -4.876 -7.437 1.00 0.00 C ATOM 2081 CG2 VAL B 49 -7.545 -4.886 -9.395 1.00 0.00 C ATOM 0 H VAL B 49 -11.063 -2.596 -8.232 1.00 0.00 H new ATOM 0 HA VAL B 49 -9.229 -3.199 -10.444 1.00 0.00 H new ATOM 0 HB VAL B 49 -8.021 -3.208 -8.176 1.00 0.00 H new ATOM 0 HG11 VAL B 49 -8.292 -5.241 -6.816 1.00 0.00 H new ATOM 0 HG12 VAL B 49 -9.767 -4.246 -6.838 1.00 0.00 H new ATOM 0 HG13 VAL B 49 -9.675 -5.723 -7.826 1.00 0.00 H new ATOM 0 HG21 VAL B 49 -6.762 -5.252 -8.731 1.00 0.00 H new ATOM 0 HG22 VAL B 49 -8.054 -5.732 -9.857 1.00 0.00 H new ATOM 0 HG23 VAL B 49 -7.101 -4.262 -10.171 1.00 0.00 H new ATOM 2091 N ALA B 50 -10.331 -5.538 -10.690 1.00 0.00 N ATOM 2092 CA ALA B 50 -11.185 -6.667 -11.024 1.00 0.00 C ATOM 2093 C ALA B 50 -10.993 -7.797 -10.023 1.00 0.00 C ATOM 2094 O ALA B 50 -9.897 -7.982 -9.504 1.00 0.00 O ATOM 2095 CB ALA B 50 -10.885 -7.152 -12.431 1.00 0.00 C ATOM 0 H ALA B 50 -9.453 -5.508 -11.208 1.00 0.00 H new ATOM 0 HA ALA B 50 -12.224 -6.341 -10.979 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -11.530 -7.997 -12.670 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -11.067 -6.345 -13.141 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -9.842 -7.463 -12.494 1.00 0.00 H new ATOM 2101 N ALA B 51 -12.054 -8.546 -9.753 1.00 0.00 N ATOM 2102 CA ALA B 51 -11.986 -9.685 -8.842 1.00 0.00 C ATOM 2103 C ALA B 51 -10.958 -10.708 -9.313 1.00 0.00 C ATOM 2104 O ALA B 51 -10.204 -11.254 -8.508 1.00 0.00 O ATOM 2105 CB ALA B 51 -13.351 -10.340 -8.697 1.00 0.00 C ATOM 0 H ALA B 51 -12.978 -8.385 -10.154 1.00 0.00 H new ATOM 0 HA ALA B 51 -11.672 -9.311 -7.868 1.00 0.00 H new ATOM 0 HB1 ALA B 51 -13.278 -11.186 -8.014 1.00 0.00 H new ATOM 0 HB2 ALA B 51 -14.062 -9.615 -8.301 1.00 0.00 H new ATOM 0 HB3 ALA B 51 -13.693 -10.689 -9.672 1.00 0.00 H new ATOM 2111 N SER B 52 -10.924 -10.956 -10.618 1.00 0.00 N ATOM 2112 CA SER B 52 -9.965 -11.891 -11.197 1.00 0.00 C ATOM 2113 C SER B 52 -8.539 -11.358 -11.063 1.00 0.00 C ATOM 2114 O SER B 52 -7.575 -12.124 -11.072 1.00 0.00 O ATOM 2115 CB SER B 52 -10.290 -12.136 -12.675 1.00 0.00 C ATOM 2116 OG SER B 52 -9.454 -13.139 -13.233 1.00 0.00 O ATOM 0 H SER B 52 -11.550 -10.522 -11.296 1.00 0.00 H new ATOM 0 HA SER B 52 -10.037 -12.833 -10.653 1.00 0.00 H new ATOM 0 HB2 SER B 52 -11.334 -12.434 -12.774 1.00 0.00 H new ATOM 0 HB3 SER B 52 -10.169 -11.208 -13.234 1.00 0.00 H new ATOM 0 HG SER B 52 -9.688 -13.272 -14.175 1.00 0.00 H new ATOM 2122 N GLN B 53 -8.419 -10.046 -10.929 1.00 0.00 N ATOM 2123 CA GLN B 53 -7.119 -9.396 -10.857 1.00 0.00 C ATOM 2124 C GLN B 53 -6.710 -9.190 -9.402 1.00 0.00 C ATOM 2125 O GLN B 53 -5.534 -9.025 -9.098 1.00 0.00 O ATOM 2126 CB GLN B 53 -7.185 -8.040 -11.568 1.00 0.00 C ATOM 2127 CG GLN B 53 -5.829 -7.457 -11.939 1.00 0.00 C ATOM 2128 CD GLN B 53 -4.982 -8.413 -12.759 1.00 0.00 C ATOM 2129 OE1 GLN B 53 -4.164 -9.158 -12.221 1.00 0.00 O ATOM 2130 NE2 GLN B 53 -5.189 -8.416 -14.065 1.00 0.00 N ATOM 0 H GLN B 53 -9.212 -9.407 -10.868 1.00 0.00 H new ATOM 0 HA GLN B 53 -6.379 -10.031 -11.345 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -7.781 -8.148 -12.474 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -7.708 -7.332 -10.925 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -5.977 -6.535 -12.502 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -5.291 -7.192 -11.029 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -5.876 -7.783 -14.474 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -4.661 -9.051 -14.664 1.00 0.00 H new ATOM 2139 N ARG B 54 -7.699 -9.240 -8.515 1.00 0.00 N ATOM 2140 CA ARG B 54 -7.536 -8.838 -7.119 1.00 0.00 C ATOM 2141 C ARG B 54 -6.363 -9.551 -6.441 1.00 0.00 C ATOM 2142 O ARG B 54 -5.458 -8.905 -5.918 1.00 0.00 O ATOM 2143 CB ARG B 54 -8.832 -9.106 -6.349 1.00 0.00 C ATOM 2144 CG ARG B 54 -9.090 -8.115 -5.224 1.00 0.00 C ATOM 2145 CD ARG B 54 -10.378 -8.425 -4.471 1.00 0.00 C ATOM 2146 NE ARG B 54 -11.529 -8.583 -5.365 1.00 0.00 N ATOM 2147 CZ ARG B 54 -12.362 -7.595 -5.698 1.00 0.00 C ATOM 2148 NH1 ARG B 54 -12.125 -6.351 -5.312 1.00 0.00 N ATOM 2149 NH2 ARG B 54 -13.436 -7.850 -6.432 1.00 0.00 N ATOM 0 H ARG B 54 -8.640 -9.561 -8.743 1.00 0.00 H new ATOM 0 HA ARG B 54 -7.313 -7.771 -7.108 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -9.670 -9.078 -7.045 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -8.796 -10.113 -5.933 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -8.251 -8.131 -4.528 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -9.144 -7.107 -5.635 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -10.245 -9.338 -3.891 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -10.581 -7.623 -3.761 1.00 0.00 H new ATOM 0 HE ARG B 54 -11.705 -9.508 -5.758 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -11.298 -6.139 -4.754 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -12.769 -5.605 -5.573 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -13.627 -8.802 -6.743 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -14.072 -7.094 -6.686 1.00 0.00 H new ATOM 2163 N LYS B 55 -6.377 -10.879 -6.456 1.00 0.00 N ATOM 2164 CA LYS B 55 -5.316 -11.651 -5.815 1.00 0.00 C ATOM 2165 C LYS B 55 -3.991 -11.467 -6.547 1.00 0.00 C ATOM 2166 O LYS B 55 -2.952 -11.266 -5.920 1.00 0.00 O ATOM 2167 CB LYS B 55 -5.673 -13.141 -5.754 1.00 0.00 C ATOM 2168 CG LYS B 55 -4.545 -14.002 -5.201 1.00 0.00 C ATOM 2169 CD LYS B 55 -4.213 -13.636 -3.761 1.00 0.00 C ATOM 2170 CE LYS B 55 -2.748 -13.904 -3.431 1.00 0.00 C ATOM 2171 NZ LYS B 55 -2.356 -15.322 -3.656 1.00 0.00 N ATOM 0 H LYS B 55 -7.104 -11.440 -6.900 1.00 0.00 H new ATOM 0 HA LYS B 55 -5.211 -11.277 -4.796 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -6.560 -13.271 -5.133 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -5.931 -13.488 -6.755 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -4.830 -15.053 -5.253 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -3.657 -13.881 -5.821 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -4.436 -12.582 -3.593 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -4.848 -14.208 -3.085 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -2.119 -13.257 -4.042 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -2.561 -13.641 -2.390 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -2.119 -15.765 -2.746 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -3.146 -15.835 -4.096 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -1.528 -15.358 -4.284 1.00 0.00 H new ATOM 2185 N LEU B 56 -4.040 -11.523 -7.870 1.00 0.00 N ATOM 2186 CA LEU B 56 -2.833 -11.466 -8.684 1.00 0.00 C ATOM 2187 C LEU B 56 -2.110 -10.141 -8.511 1.00 0.00 C ATOM 2188 O LEU B 56 -0.916 -10.113 -8.222 1.00 0.00 O ATOM 2189 CB LEU B 56 -3.177 -11.684 -10.157 1.00 0.00 C ATOM 2190 CG LEU B 56 -3.709 -13.075 -10.500 1.00 0.00 C ATOM 2191 CD1 LEU B 56 -4.066 -13.160 -11.976 1.00 0.00 C ATOM 2192 CD2 LEU B 56 -2.679 -14.133 -10.136 1.00 0.00 C ATOM 0 H LEU B 56 -4.905 -11.608 -8.404 1.00 0.00 H new ATOM 0 HA LEU B 56 -2.167 -12.261 -8.348 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -3.921 -10.944 -10.454 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -2.285 -11.496 -10.754 1.00 0.00 H new ATOM 0 HG LEU B 56 -4.614 -13.257 -9.920 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -4.443 -14.157 -12.202 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -4.833 -12.421 -12.208 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -3.178 -12.963 -12.577 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -3.068 -15.120 -10.384 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -1.760 -13.954 -10.695 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -2.469 -14.084 -9.068 1.00 0.00 H new ATOM 2204 N ILE B 57 -2.838 -9.047 -8.667 1.00 0.00 N ATOM 2205 CA ILE B 57 -2.239 -7.727 -8.606 1.00 0.00 C ATOM 2206 C ILE B 57 -1.749 -7.411 -7.190 1.00 0.00 C ATOM 2207 O ILE B 57 -0.746 -6.724 -7.017 1.00 0.00 O ATOM 2208 CB ILE B 57 -3.225 -6.642 -9.105 1.00 0.00 C ATOM 2209 CG1 ILE B 57 -2.481 -5.348 -9.435 1.00 0.00 C ATOM 2210 CG2 ILE B 57 -4.320 -6.379 -8.078 1.00 0.00 C ATOM 2211 CD1 ILE B 57 -3.335 -4.338 -10.171 1.00 0.00 C ATOM 0 H ILE B 57 -3.844 -9.049 -8.837 1.00 0.00 H new ATOM 0 HA ILE B 57 -1.375 -7.724 -9.270 1.00 0.00 H new ATOM 0 HB ILE B 57 -3.697 -7.013 -10.015 1.00 0.00 H new ATOM 0 HG12 ILE B 57 -2.117 -4.900 -8.510 1.00 0.00 H new ATOM 0 HG13 ILE B 57 -1.606 -5.584 -10.041 1.00 0.00 H new ATOM 0 HG21 ILE B 57 -4.997 -5.613 -8.456 1.00 0.00 H new ATOM 0 HG22 ILE B 57 -4.877 -7.298 -7.897 1.00 0.00 H new ATOM 0 HG23 ILE B 57 -3.870 -6.038 -7.146 1.00 0.00 H new ATOM 0 HD11 ILE B 57 -2.747 -3.443 -10.374 1.00 0.00 H new ATOM 0 HD12 ILE B 57 -3.678 -4.768 -11.112 1.00 0.00 H new ATOM 0 HD13 ILE B 57 -4.196 -4.074 -9.557 1.00 0.00 H new ATOM 2223 N ALA B 58 -2.437 -7.946 -6.182 1.00 0.00 N ATOM 2224 CA ALA B 58 -2.029 -7.754 -4.795 1.00 0.00 C ATOM 2225 C ALA B 58 -0.771 -8.561 -4.486 1.00 0.00 C ATOM 2226 O ALA B 58 0.134 -8.084 -3.797 1.00 0.00 O ATOM 2227 CB ALA B 58 -3.154 -8.146 -3.851 1.00 0.00 C ATOM 0 H ALA B 58 -3.276 -8.513 -6.301 1.00 0.00 H new ATOM 0 HA ALA B 58 -1.804 -6.698 -4.648 1.00 0.00 H new ATOM 0 HB1 ALA B 58 -2.833 -7.997 -2.820 1.00 0.00 H new ATOM 0 HB2 ALA B 58 -4.029 -7.528 -4.052 1.00 0.00 H new ATOM 0 HB3 ALA B 58 -3.408 -9.195 -4.003 1.00 0.00 H new ATOM 2233 N GLU B 59 -0.720 -9.783 -5.008 1.00 0.00 N ATOM 2234 CA GLU B 59 0.441 -10.648 -4.841 1.00 0.00 C ATOM 2235 C GLU B 59 1.655 -10.021 -5.518 1.00 0.00 C ATOM 2236 O GLU B 59 2.718 -9.880 -4.913 1.00 0.00 O ATOM 2237 CB GLU B 59 0.150 -12.034 -5.429 1.00 0.00 C ATOM 2238 CG GLU B 59 1.268 -13.043 -5.230 1.00 0.00 C ATOM 2239 CD GLU B 59 0.898 -14.418 -5.749 1.00 0.00 C ATOM 2240 OE1 GLU B 59 0.183 -15.151 -5.036 1.00 0.00 O ATOM 2241 OE2 GLU B 59 1.304 -14.770 -6.875 1.00 0.00 O ATOM 0 H GLU B 59 -1.475 -10.198 -5.554 1.00 0.00 H new ATOM 0 HA GLU B 59 0.656 -10.762 -3.778 1.00 0.00 H new ATOM 0 HB2 GLU B 59 -0.761 -12.424 -4.976 1.00 0.00 H new ATOM 0 HB3 GLU B 59 -0.044 -11.930 -6.496 1.00 0.00 H new ATOM 0 HG2 GLU B 59 2.166 -12.693 -5.740 1.00 0.00 H new ATOM 0 HG3 GLU B 59 1.510 -13.110 -4.169 1.00 0.00 H new ATOM 2248 N LYS B 60 1.469 -9.627 -6.770 1.00 0.00 N ATOM 2249 CA LYS B 60 2.511 -8.952 -7.535 1.00 0.00 C ATOM 2250 C LYS B 60 2.956 -7.669 -6.844 1.00 0.00 C ATOM 2251 O LYS B 60 4.139 -7.342 -6.833 1.00 0.00 O ATOM 2252 CB LYS B 60 2.005 -8.630 -8.940 1.00 0.00 C ATOM 2253 CG LYS B 60 1.795 -9.861 -9.807 1.00 0.00 C ATOM 2254 CD LYS B 60 1.056 -9.526 -11.096 1.00 0.00 C ATOM 2255 CE LYS B 60 1.744 -8.415 -11.873 1.00 0.00 C ATOM 2256 NZ LYS B 60 1.167 -8.255 -13.232 1.00 0.00 N ATOM 0 H LYS B 60 0.598 -9.764 -7.282 1.00 0.00 H new ATOM 0 HA LYS B 60 3.368 -9.623 -7.601 1.00 0.00 H new ATOM 0 HB2 LYS B 60 1.064 -8.085 -8.863 1.00 0.00 H new ATOM 0 HB3 LYS B 60 2.717 -7.967 -9.431 1.00 0.00 H new ATOM 0 HG2 LYS B 60 2.761 -10.306 -10.047 1.00 0.00 H new ATOM 0 HG3 LYS B 60 1.231 -10.607 -9.248 1.00 0.00 H new ATOM 0 HD2 LYS B 60 0.991 -10.418 -11.719 1.00 0.00 H new ATOM 0 HD3 LYS B 60 0.035 -9.226 -10.861 1.00 0.00 H new ATOM 0 HE2 LYS B 60 1.651 -7.477 -11.326 1.00 0.00 H new ATOM 0 HE3 LYS B 60 2.809 -8.633 -11.953 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 1.695 -7.523 -13.749 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 1.232 -9.157 -13.745 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 0.169 -7.972 -13.154 1.00 0.00 H new ATOM 2270 N PHE B 61 1.999 -6.946 -6.278 1.00 0.00 N ATOM 2271 CA PHE B 61 2.288 -5.714 -5.552 1.00 0.00 C ATOM 2272 C PHE B 61 3.232 -5.977 -4.382 1.00 0.00 C ATOM 2273 O PHE B 61 4.222 -5.270 -4.202 1.00 0.00 O ATOM 2274 CB PHE B 61 0.985 -5.085 -5.049 1.00 0.00 C ATOM 2275 CG PHE B 61 1.180 -3.899 -4.149 1.00 0.00 C ATOM 2276 CD1 PHE B 61 1.709 -2.716 -4.638 1.00 0.00 C ATOM 2277 CD2 PHE B 61 0.814 -3.964 -2.814 1.00 0.00 C ATOM 2278 CE1 PHE B 61 1.876 -1.626 -3.812 1.00 0.00 C ATOM 2279 CE2 PHE B 61 0.982 -2.876 -1.983 1.00 0.00 C ATOM 2280 CZ PHE B 61 1.510 -1.704 -2.483 1.00 0.00 C ATOM 0 H PHE B 61 1.010 -7.192 -6.308 1.00 0.00 H new ATOM 0 HA PHE B 61 2.780 -5.021 -6.235 1.00 0.00 H new ATOM 0 HB2 PHE B 61 0.387 -4.780 -5.908 1.00 0.00 H new ATOM 0 HB3 PHE B 61 0.412 -5.842 -4.514 1.00 0.00 H new ATOM 0 HD1 PHE B 61 1.994 -2.647 -5.678 1.00 0.00 H new ATOM 0 HD2 PHE B 61 0.392 -4.877 -2.420 1.00 0.00 H new ATOM 0 HE1 PHE B 61 2.293 -0.710 -4.204 1.00 0.00 H new ATOM 0 HE2 PHE B 61 0.701 -2.942 -0.942 1.00 0.00 H new ATOM 0 HZ PHE B 61 1.637 -0.849 -1.836 1.00 0.00 H new ATOM 2290 N ALA B 62 2.923 -7.001 -3.597 1.00 0.00 N ATOM 2291 CA ALA B 62 3.756 -7.370 -2.461 1.00 0.00 C ATOM 2292 C ALA B 62 5.159 -7.736 -2.923 1.00 0.00 C ATOM 2293 O ALA B 62 6.150 -7.243 -2.390 1.00 0.00 O ATOM 2294 CB ALA B 62 3.127 -8.533 -1.706 1.00 0.00 C ATOM 0 H ALA B 62 2.101 -7.591 -3.727 1.00 0.00 H new ATOM 0 HA ALA B 62 3.828 -6.514 -1.791 1.00 0.00 H new ATOM 0 HB1 ALA B 62 3.758 -8.801 -0.859 1.00 0.00 H new ATOM 0 HB2 ALA B 62 2.140 -8.242 -1.346 1.00 0.00 H new ATOM 0 HB3 ALA B 62 3.032 -9.390 -2.372 1.00 0.00 H new ATOM 2300 N GLN B 63 5.232 -8.588 -3.935 1.00 0.00 N ATOM 2301 CA GLN B 63 6.512 -9.018 -4.476 1.00 0.00 C ATOM 2302 C GLN B 63 7.294 -7.820 -5.013 1.00 0.00 C ATOM 2303 O GLN B 63 8.508 -7.729 -4.837 1.00 0.00 O ATOM 2304 CB GLN B 63 6.302 -10.054 -5.588 1.00 0.00 C ATOM 2305 CG GLN B 63 5.543 -11.290 -5.133 1.00 0.00 C ATOM 2306 CD GLN B 63 5.215 -12.235 -6.275 1.00 0.00 C ATOM 2307 OE1 GLN B 63 5.040 -11.815 -7.420 1.00 0.00 O ATOM 2308 NE2 GLN B 63 5.134 -13.521 -5.971 1.00 0.00 N ATOM 0 H GLN B 63 4.419 -8.995 -4.398 1.00 0.00 H new ATOM 0 HA GLN B 63 7.088 -9.479 -3.673 1.00 0.00 H new ATOM 0 HB2 GLN B 63 5.760 -9.587 -6.410 1.00 0.00 H new ATOM 0 HB3 GLN B 63 7.273 -10.358 -5.978 1.00 0.00 H new ATOM 0 HG2 GLN B 63 6.136 -11.821 -4.388 1.00 0.00 H new ATOM 0 HG3 GLN B 63 4.618 -10.983 -4.645 1.00 0.00 H new ATOM 0 HE21 GLN B 63 5.286 -13.829 -5.010 1.00 0.00 H new ATOM 0 HE22 GLN B 63 4.920 -14.204 -6.697 1.00 0.00 H new ATOM 2317 N ALA B 64 6.584 -6.892 -5.649 1.00 0.00 N ATOM 2318 CA ALA B 64 7.206 -5.694 -6.203 1.00 0.00 C ATOM 2319 C ALA B 64 7.712 -4.773 -5.099 1.00 0.00 C ATOM 2320 O ALA B 64 8.754 -4.137 -5.247 1.00 0.00 O ATOM 2321 CB ALA B 64 6.231 -4.952 -7.106 1.00 0.00 C ATOM 0 H ALA B 64 5.576 -6.947 -5.793 1.00 0.00 H new ATOM 0 HA ALA B 64 8.063 -6.010 -6.798 1.00 0.00 H new ATOM 0 HB1 ALA B 64 6.714 -4.062 -7.509 1.00 0.00 H new ATOM 0 HB2 ALA B 64 5.927 -5.603 -7.926 1.00 0.00 H new ATOM 0 HB3 ALA B 64 5.353 -4.659 -6.531 1.00 0.00 H new ATOM 2327 N LEU B 65 6.980 -4.716 -3.991 1.00 0.00 N ATOM 2328 CA LEU B 65 7.386 -3.911 -2.844 1.00 0.00 C ATOM 2329 C LEU B 65 8.725 -4.405 -2.307 1.00 0.00 C ATOM 2330 O LEU B 65 9.617 -3.613 -2.006 1.00 0.00 O ATOM 2331 CB LEU B 65 6.318 -3.962 -1.745 1.00 0.00 C ATOM 2332 CG LEU B 65 6.568 -3.040 -0.549 1.00 0.00 C ATOM 2333 CD1 LEU B 65 6.672 -1.598 -1.006 1.00 0.00 C ATOM 2334 CD2 LEU B 65 5.463 -3.184 0.484 1.00 0.00 C ATOM 0 H LEU B 65 6.102 -5.218 -3.863 1.00 0.00 H new ATOM 0 HA LEU B 65 7.496 -2.876 -3.166 1.00 0.00 H new ATOM 0 HB2 LEU B 65 5.354 -3.706 -2.185 1.00 0.00 H new ATOM 0 HB3 LEU B 65 6.241 -4.987 -1.383 1.00 0.00 H new ATOM 0 HG LEU B 65 7.511 -3.331 -0.087 1.00 0.00 H new ATOM 0 HD11 LEU B 65 6.850 -0.955 -0.144 1.00 0.00 H new ATOM 0 HD12 LEU B 65 7.498 -1.498 -1.710 1.00 0.00 H new ATOM 0 HD13 LEU B 65 5.743 -1.303 -1.493 1.00 0.00 H new ATOM 0 HD21 LEU B 65 5.662 -2.519 1.325 1.00 0.00 H new ATOM 0 HD22 LEU B 65 4.506 -2.921 0.032 1.00 0.00 H new ATOM 0 HD23 LEU B 65 5.427 -4.215 0.837 1.00 0.00 H new ATOM 2346 N MET B 66 8.870 -5.721 -2.215 1.00 0.00 N ATOM 2347 CA MET B 66 10.114 -6.320 -1.740 1.00 0.00 C ATOM 2348 C MET B 66 11.227 -6.193 -2.775 1.00 0.00 C ATOM 2349 O MET B 66 12.406 -6.272 -2.437 1.00 0.00 O ATOM 2350 CB MET B 66 9.904 -7.791 -1.376 1.00 0.00 C ATOM 2351 CG MET B 66 9.246 -8.002 -0.018 1.00 0.00 C ATOM 2352 SD MET B 66 7.670 -7.139 0.146 1.00 0.00 S ATOM 2353 CE MET B 66 7.185 -7.620 1.794 1.00 0.00 C ATOM 0 H MET B 66 8.144 -6.394 -2.462 1.00 0.00 H new ATOM 0 HA MET B 66 10.417 -5.774 -0.846 1.00 0.00 H new ATOM 0 HB2 MET B 66 9.289 -8.261 -2.144 1.00 0.00 H new ATOM 0 HB3 MET B 66 10.868 -8.299 -1.385 1.00 0.00 H new ATOM 0 HG2 MET B 66 9.088 -9.069 0.141 1.00 0.00 H new ATOM 0 HG3 MET B 66 9.924 -7.661 0.764 1.00 0.00 H new ATOM 0 HE1 MET B 66 6.226 -7.163 2.039 1.00 0.00 H new ATOM 0 HE2 MET B 66 7.093 -8.705 1.844 1.00 0.00 H new ATOM 0 HE3 MET B 66 7.939 -7.286 2.507 1.00 0.00 H new ATOM 2363 N SER B 67 10.853 -6.001 -4.034 1.00 0.00 N ATOM 2364 CA SER B 67 11.831 -5.800 -5.096 1.00 0.00 C ATOM 2365 C SER B 67 12.291 -4.344 -5.099 1.00 0.00 C ATOM 2366 O SER B 67 13.451 -4.044 -5.383 1.00 0.00 O ATOM 2367 CB SER B 67 11.231 -6.180 -6.457 1.00 0.00 C ATOM 2368 OG SER B 67 12.225 -6.252 -7.467 1.00 0.00 O ATOM 0 H SER B 67 9.882 -5.980 -4.344 1.00 0.00 H new ATOM 0 HA SER B 67 12.692 -6.443 -4.915 1.00 0.00 H new ATOM 0 HB2 SER B 67 10.725 -7.142 -6.376 1.00 0.00 H new ATOM 0 HB3 SER B 67 10.477 -5.446 -6.740 1.00 0.00 H new ATOM 0 HG SER B 67 11.808 -6.498 -8.319 1.00 0.00 H new ATOM 2374 N SER B 68 11.366 -3.452 -4.766 1.00 0.00 N ATOM 2375 CA SER B 68 11.654 -2.028 -4.668 1.00 0.00 C ATOM 2376 C SER B 68 12.502 -1.754 -3.428 1.00 0.00 C ATOM 2377 O SER B 68 13.332 -0.840 -3.410 1.00 0.00 O ATOM 2378 CB SER B 68 10.336 -1.245 -4.609 1.00 0.00 C ATOM 2379 OG SER B 68 10.550 0.153 -4.655 1.00 0.00 O ATOM 0 H SER B 68 10.398 -3.695 -4.557 1.00 0.00 H new ATOM 0 HA SER B 68 12.215 -1.705 -5.545 1.00 0.00 H new ATOM 0 HB2 SER B 68 9.700 -1.542 -5.442 1.00 0.00 H new ATOM 0 HB3 SER B 68 9.803 -1.501 -3.693 1.00 0.00 H new ATOM 0 HG SER B 68 9.688 0.617 -4.617 1.00 0.00 H new ATOM 2385 N LEU B 69 12.283 -2.562 -2.397 1.00 0.00 N ATOM 2386 CA LEU B 69 13.050 -2.481 -1.164 1.00 0.00 C ATOM 2387 C LEU B 69 14.535 -2.709 -1.428 1.00 0.00 C ATOM 2388 O LEU B 69 14.933 -3.774 -1.903 1.00 0.00 O ATOM 2389 CB LEU B 69 12.558 -3.533 -0.169 1.00 0.00 C ATOM 2390 CG LEU B 69 13.356 -3.601 1.133 1.00 0.00 C ATOM 2391 CD1 LEU B 69 12.780 -2.658 2.175 1.00 0.00 C ATOM 2392 CD2 LEU B 69 13.412 -5.025 1.655 1.00 0.00 C ATOM 0 H LEU B 69 11.569 -3.290 -2.394 1.00 0.00 H new ATOM 0 HA LEU B 69 12.911 -1.482 -0.750 1.00 0.00 H new ATOM 0 HB2 LEU B 69 11.515 -3.328 0.070 1.00 0.00 H new ATOM 0 HB3 LEU B 69 12.588 -4.511 -0.650 1.00 0.00 H new ATOM 0 HG LEU B 69 14.376 -3.279 0.923 1.00 0.00 H new ATOM 0 HD11 LEU B 69 13.366 -2.726 3.091 1.00 0.00 H new ATOM 0 HD12 LEU B 69 12.813 -1.636 1.798 1.00 0.00 H new ATOM 0 HD13 LEU B 69 11.747 -2.934 2.384 1.00 0.00 H new ATOM 0 HD21 LEU B 69 13.985 -5.050 2.582 1.00 0.00 H new ATOM 0 HD22 LEU B 69 12.400 -5.383 1.844 1.00 0.00 H new ATOM 0 HD23 LEU B 69 13.892 -5.665 0.915 1.00 0.00 H new ATOM 2404 N GLU B 70 15.348 -1.714 -1.124 1.00 0.00 N ATOM 2405 CA GLU B 70 16.786 -1.859 -1.223 1.00 0.00 C ATOM 2406 C GLU B 70 17.387 -2.063 0.164 1.00 0.00 C ATOM 2407 O GLU B 70 16.881 -1.525 1.152 1.00 0.00 O ATOM 2408 CB GLU B 70 17.404 -0.649 -1.931 1.00 0.00 C ATOM 2409 CG GLU B 70 16.945 0.695 -1.386 1.00 0.00 C ATOM 2410 CD GLU B 70 17.347 1.844 -2.287 1.00 0.00 C ATOM 2411 OE1 GLU B 70 16.645 2.083 -3.293 1.00 0.00 O ATOM 2412 OE2 GLU B 70 18.366 2.506 -2.006 1.00 0.00 O ATOM 0 H GLU B 70 15.035 -0.797 -0.806 1.00 0.00 H new ATOM 0 HA GLU B 70 17.013 -2.740 -1.824 1.00 0.00 H new ATOM 0 HB2 GLU B 70 18.489 -0.710 -1.849 1.00 0.00 H new ATOM 0 HB3 GLU B 70 17.161 -0.700 -2.992 1.00 0.00 H new ATOM 0 HG2 GLU B 70 15.861 0.688 -1.271 1.00 0.00 H new ATOM 0 HG3 GLU B 70 17.370 0.847 -0.394 1.00 0.00 H new ATOM 2419 N THR B 71 18.426 -2.887 0.226 1.00 0.00 N ATOM 2420 CA THR B 71 19.112 -3.208 1.476 1.00 0.00 C ATOM 2421 C THR B 71 19.450 -1.941 2.279 1.00 0.00 C ATOM 2422 O THR B 71 19.934 -0.949 1.727 1.00 0.00 O ATOM 2423 CB THR B 71 20.397 -4.028 1.196 1.00 0.00 C ATOM 2424 OG1 THR B 71 21.046 -4.392 2.422 1.00 0.00 O ATOM 2425 CG2 THR B 71 21.364 -3.252 0.311 1.00 0.00 C ATOM 0 H THR B 71 18.819 -3.354 -0.591 1.00 0.00 H new ATOM 0 HA THR B 71 18.433 -3.811 2.078 1.00 0.00 H new ATOM 0 HB THR B 71 20.098 -4.935 0.671 1.00 0.00 H new ATOM 0 HG1 THR B 71 21.645 -5.151 2.262 1.00 0.00 H new ATOM 0 HG21 THR B 71 22.256 -3.853 0.132 1.00 0.00 H new ATOM 0 HG22 THR B 71 20.883 -3.024 -0.640 1.00 0.00 H new ATOM 0 HG23 THR B 71 21.646 -2.323 0.807 1.00 0.00 H new ATOM 2433 N PRO B 72 19.194 -1.972 3.602 1.00 0.00 N ATOM 2434 CA PRO B 72 19.352 -0.806 4.488 1.00 0.00 C ATOM 2435 C PRO B 72 20.810 -0.460 4.801 1.00 0.00 C ATOM 2436 O PRO B 72 21.124 -0.014 5.906 1.00 0.00 O ATOM 2437 CB PRO B 72 18.636 -1.249 5.767 1.00 0.00 C ATOM 2438 CG PRO B 72 18.775 -2.729 5.780 1.00 0.00 C ATOM 2439 CD PRO B 72 18.711 -3.157 4.339 1.00 0.00 C ATOM 0 HA PRO B 72 18.953 0.097 4.025 1.00 0.00 H new ATOM 0 HB2 PRO B 72 19.089 -0.800 6.651 1.00 0.00 H new ATOM 0 HB3 PRO B 72 17.588 -0.949 5.759 1.00 0.00 H new ATOM 0 HG2 PRO B 72 19.718 -3.030 6.236 1.00 0.00 H new ATOM 0 HG3 PRO B 72 17.978 -3.192 6.362 1.00 0.00 H new ATOM 0 HD2 PRO B 72 19.338 -4.029 4.152 1.00 0.00 H new ATOM 0 HD3 PRO B 72 17.696 -3.425 4.045 1.00 0.00 H new ATOM 2447 N LYS B 73 21.689 -0.645 3.827 1.00 0.00 N ATOM 2448 CA LYS B 73 23.099 -0.324 4.001 1.00 0.00 C ATOM 2449 C LYS B 73 23.295 1.187 4.068 1.00 0.00 C ATOM 2450 O LYS B 73 23.900 1.694 5.012 1.00 0.00 O ATOM 2451 CB LYS B 73 23.929 -0.910 2.859 1.00 0.00 C ATOM 2452 CG LYS B 73 23.918 -2.429 2.817 1.00 0.00 C ATOM 2453 CD LYS B 73 24.751 -2.962 1.662 1.00 0.00 C ATOM 2454 CE LYS B 73 24.761 -4.482 1.637 1.00 0.00 C ATOM 2455 NZ LYS B 73 25.319 -5.050 2.893 1.00 0.00 N ATOM 0 H LYS B 73 21.451 -1.016 2.907 1.00 0.00 H new ATOM 0 HA LYS B 73 23.437 -0.765 4.939 1.00 0.00 H new ATOM 0 HB2 LYS B 73 23.551 -0.526 1.912 1.00 0.00 H new ATOM 0 HB3 LYS B 73 24.958 -0.565 2.955 1.00 0.00 H new ATOM 0 HG2 LYS B 73 24.304 -2.823 3.757 1.00 0.00 H new ATOM 0 HG3 LYS B 73 22.892 -2.784 2.721 1.00 0.00 H new ATOM 0 HD2 LYS B 73 24.353 -2.584 0.720 1.00 0.00 H new ATOM 0 HD3 LYS B 73 25.773 -2.592 1.748 1.00 0.00 H new ATOM 0 HE2 LYS B 73 23.745 -4.850 1.491 1.00 0.00 H new ATOM 0 HE3 LYS B 73 25.351 -4.828 0.788 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 25.562 -6.050 2.744 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 26.173 -4.522 3.163 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 24.612 -4.976 3.652 1.00 0.00 H new ATOM 2469 N THR B 74 22.762 1.890 3.066 1.00 0.00 N ATOM 2470 CA THR B 74 22.840 3.354 2.977 1.00 0.00 C ATOM 2471 C THR B 74 24.235 3.888 3.314 1.00 0.00 C ATOM 2472 O THR B 74 24.479 4.386 4.414 1.00 0.00 O ATOM 2473 CB THR B 74 21.780 4.040 3.873 1.00 0.00 C ATOM 2474 OG1 THR B 74 21.773 3.460 5.186 1.00 0.00 O ATOM 2475 CG2 THR B 74 20.395 3.919 3.260 1.00 0.00 C ATOM 0 H THR B 74 22.261 1.460 2.289 1.00 0.00 H new ATOM 0 HA THR B 74 22.630 3.602 1.937 1.00 0.00 H new ATOM 0 HB THR B 74 22.044 5.095 3.950 1.00 0.00 H new ATOM 0 HG1 THR B 74 22.695 3.357 5.503 1.00 0.00 H new ATOM 0 HG21 THR B 74 19.667 4.408 3.907 1.00 0.00 H new ATOM 0 HG22 THR B 74 20.388 4.396 2.280 1.00 0.00 H new ATOM 0 HG23 THR B 74 20.135 2.866 3.153 1.00 0.00 H new ATOM 2483 N HIS B 75 25.149 3.769 2.362 1.00 0.00 N ATOM 2484 CA HIS B 75 26.527 4.194 2.568 1.00 0.00 C ATOM 2485 C HIS B 75 26.889 5.324 1.610 1.00 0.00 C ATOM 2486 O HIS B 75 26.993 5.108 0.403 1.00 0.00 O ATOM 2487 CB HIS B 75 27.480 3.003 2.383 1.00 0.00 C ATOM 2488 CG HIS B 75 28.931 3.352 2.528 1.00 0.00 C ATOM 2489 ND1 HIS B 75 29.515 3.648 3.740 1.00 0.00 N ATOM 2490 CD2 HIS B 75 29.916 3.453 1.605 1.00 0.00 C ATOM 2491 CE1 HIS B 75 30.794 3.915 3.557 1.00 0.00 C ATOM 2492 NE2 HIS B 75 31.061 3.805 2.270 1.00 0.00 N ATOM 0 H HIS B 75 24.961 3.381 1.438 1.00 0.00 H new ATOM 0 HA HIS B 75 26.628 4.567 3.587 1.00 0.00 H new ATOM 0 HB2 HIS B 75 27.228 2.233 3.112 1.00 0.00 H new ATOM 0 HB3 HIS B 75 27.318 2.572 1.395 1.00 0.00 H new ATOM 0 HD2 HIS B 75 29.818 3.287 0.542 1.00 0.00 H new ATOM 0 HE1 HIS B 75 31.502 4.179 4.329 1.00 0.00 H new ATOM 0 HE2 HIS B 75 31.973 3.957 1.839 1.00 0.00 H new ATOM 2501 N LEU B 76 27.080 6.517 2.169 1.00 0.00 N ATOM 2502 CA LEU B 76 27.428 7.709 1.397 1.00 0.00 C ATOM 2503 C LEU B 76 26.388 8.013 0.323 1.00 0.00 C ATOM 2504 O LEU B 76 26.590 7.722 -0.857 1.00 0.00 O ATOM 2505 CB LEU B 76 28.816 7.570 0.757 1.00 0.00 C ATOM 2506 CG LEU B 76 29.983 7.468 1.740 1.00 0.00 C ATOM 2507 CD1 LEU B 76 31.301 7.327 0.992 1.00 0.00 C ATOM 2508 CD2 LEU B 76 30.020 8.684 2.655 1.00 0.00 C ATOM 0 H LEU B 76 26.998 6.685 3.172 1.00 0.00 H new ATOM 0 HA LEU B 76 27.446 8.544 2.098 1.00 0.00 H new ATOM 0 HB2 LEU B 76 28.818 6.683 0.123 1.00 0.00 H new ATOM 0 HB3 LEU B 76 28.985 8.428 0.106 1.00 0.00 H new ATOM 0 HG LEU B 76 29.837 6.579 2.353 1.00 0.00 H new ATOM 0 HD11 LEU B 76 32.120 7.256 1.708 1.00 0.00 H new ATOM 0 HD12 LEU B 76 31.276 6.427 0.378 1.00 0.00 H new ATOM 0 HD13 LEU B 76 31.452 8.197 0.354 1.00 0.00 H new ATOM 0 HD21 LEU B 76 30.857 8.593 3.347 1.00 0.00 H new ATOM 0 HD22 LEU B 76 30.141 9.587 2.056 1.00 0.00 H new ATOM 0 HD23 LEU B 76 29.089 8.744 3.218 1.00 0.00 H new ATOM 2520 N GLU B 77 25.264 8.575 0.737 1.00 0.00 N ATOM 2521 CA GLU B 77 24.242 8.992 -0.204 1.00 0.00 C ATOM 2522 C GLU B 77 24.594 10.373 -0.739 1.00 0.00 C ATOM 2523 O GLU B 77 24.611 11.353 0.006 1.00 0.00 O ATOM 2524 CB GLU B 77 22.866 9.009 0.464 1.00 0.00 C ATOM 2525 CG GLU B 77 21.776 8.335 -0.358 1.00 0.00 C ATOM 2526 CD GLU B 77 21.608 8.941 -1.735 1.00 0.00 C ATOM 2527 OE1 GLU B 77 22.382 8.579 -2.649 1.00 0.00 O ATOM 2528 OE2 GLU B 77 20.690 9.767 -1.919 1.00 0.00 O ATOM 0 H GLU B 77 25.038 8.752 1.716 1.00 0.00 H new ATOM 0 HA GLU B 77 24.201 8.282 -1.030 1.00 0.00 H new ATOM 0 HB2 GLU B 77 22.936 8.514 1.433 1.00 0.00 H new ATOM 0 HB3 GLU B 77 22.578 10.043 0.655 1.00 0.00 H new ATOM 0 HG2 GLU B 77 22.010 7.275 -0.460 1.00 0.00 H new ATOM 0 HG3 GLU B 77 20.830 8.402 0.180 1.00 0.00 H new ATOM 2535 N HIS B 78 24.897 10.440 -2.023 1.00 0.00 N ATOM 2536 CA HIS B 78 25.347 11.676 -2.637 1.00 0.00 C ATOM 2537 C HIS B 78 25.178 11.592 -4.147 1.00 0.00 C ATOM 2538 O HIS B 78 25.690 10.673 -4.786 1.00 0.00 O ATOM 2539 CB HIS B 78 26.814 11.944 -2.271 1.00 0.00 C ATOM 2540 CG HIS B 78 27.364 13.238 -2.799 1.00 0.00 C ATOM 2541 ND1 HIS B 78 28.673 13.386 -3.205 1.00 0.00 N ATOM 2542 CD2 HIS B 78 26.786 14.455 -2.964 1.00 0.00 C ATOM 2543 CE1 HIS B 78 28.875 14.628 -3.597 1.00 0.00 C ATOM 2544 NE2 HIS B 78 27.748 15.299 -3.461 1.00 0.00 N ATOM 0 H HIS B 78 24.839 9.648 -2.664 1.00 0.00 H new ATOM 0 HA HIS B 78 24.743 12.503 -2.263 1.00 0.00 H new ATOM 0 HB2 HIS B 78 26.910 11.940 -1.185 1.00 0.00 H new ATOM 0 HB3 HIS B 78 27.425 11.124 -2.649 1.00 0.00 H new ATOM 0 HD2 HIS B 78 25.760 14.712 -2.745 1.00 0.00 H new ATOM 0 HE1 HIS B 78 29.807 15.029 -3.967 1.00 0.00 H new ATOM 0 HE2 HIS B 78 27.613 16.284 -3.688 1.00 0.00 H new ATOM 2553 N HIS B 79 24.453 12.550 -4.704 1.00 0.00 N ATOM 2554 CA HIS B 79 24.192 12.585 -6.138 1.00 0.00 C ATOM 2555 C HIS B 79 25.485 12.734 -6.924 1.00 0.00 C ATOM 2556 O HIS B 79 26.366 13.511 -6.552 1.00 0.00 O ATOM 2557 CB HIS B 79 23.240 13.734 -6.487 1.00 0.00 C ATOM 2558 CG HIS B 79 21.863 13.558 -5.929 1.00 0.00 C ATOM 2559 ND1 HIS B 79 21.082 14.608 -5.495 1.00 0.00 N ATOM 2560 CD2 HIS B 79 21.124 12.441 -5.740 1.00 0.00 C ATOM 2561 CE1 HIS B 79 19.928 14.142 -5.062 1.00 0.00 C ATOM 2562 NE2 HIS B 79 19.927 12.831 -5.200 1.00 0.00 N ATOM 0 H HIS B 79 24.032 13.319 -4.182 1.00 0.00 H new ATOM 0 HA HIS B 79 23.724 11.640 -6.412 1.00 0.00 H new ATOM 0 HB2 HIS B 79 23.658 14.668 -6.113 1.00 0.00 H new ATOM 0 HB3 HIS B 79 23.175 13.825 -7.571 1.00 0.00 H new ATOM 0 HD2 HIS B 79 21.422 11.429 -5.972 1.00 0.00 H new ATOM 0 HE1 HIS B 79 19.119 14.735 -4.661 1.00 0.00 H new ATOM 0 HE2 HIS B 79 19.160 12.208 -4.946 1.00 0.00 H new ATOM 2571 N HIS B 80 25.596 11.978 -8.005 1.00 0.00 N ATOM 2572 CA HIS B 80 26.756 12.060 -8.873 1.00 0.00 C ATOM 2573 C HIS B 80 26.484 13.088 -9.959 1.00 0.00 C ATOM 2574 O HIS B 80 27.400 13.661 -10.548 1.00 0.00 O ATOM 2575 CB HIS B 80 27.063 10.695 -9.488 1.00 0.00 C ATOM 2576 CG HIS B 80 28.525 10.382 -9.535 1.00 0.00 C ATOM 2577 ND1 HIS B 80 29.198 9.804 -8.482 1.00 0.00 N ATOM 2578 CD2 HIS B 80 29.447 10.571 -10.508 1.00 0.00 C ATOM 2579 CE1 HIS B 80 30.466 9.651 -8.803 1.00 0.00 C ATOM 2580 NE2 HIS B 80 30.646 10.107 -10.027 1.00 0.00 N ATOM 0 H HIS B 80 24.894 11.300 -8.301 1.00 0.00 H new ATOM 0 HA HIS B 80 27.626 12.366 -8.292 1.00 0.00 H new ATOM 0 HB2 HIS B 80 26.551 9.922 -8.914 1.00 0.00 H new ATOM 0 HB3 HIS B 80 26.659 10.661 -10.500 1.00 0.00 H new ATOM 0 HD2 HIS B 80 29.272 11.006 -11.481 1.00 0.00 H new ATOM 0 HE1 HIS B 80 31.230 9.224 -8.170 1.00 0.00 H new ATOM 0 HE2 HIS B 80 31.531 10.114 -10.534 1.00 0.00 H new ATOM 2589 N HIS B 81 25.201 13.304 -10.211 1.00 0.00 N ATOM 2590 CA HIS B 81 24.747 14.363 -11.093 1.00 0.00 C ATOM 2591 C HIS B 81 24.833 15.688 -10.339 1.00 0.00 C ATOM 2592 O HIS B 81 24.120 15.887 -9.358 1.00 0.00 O ATOM 2593 CB HIS B 81 23.303 14.078 -11.535 1.00 0.00 C ATOM 2594 CG HIS B 81 22.755 15.015 -12.578 1.00 0.00 C ATOM 2595 ND1 HIS B 81 22.069 14.578 -13.688 1.00 0.00 N ATOM 2596 CD2 HIS B 81 22.754 16.364 -12.651 1.00 0.00 C ATOM 2597 CE1 HIS B 81 21.672 15.618 -14.397 1.00 0.00 C ATOM 2598 NE2 HIS B 81 22.073 16.717 -13.788 1.00 0.00 N ATOM 0 H HIS B 81 24.447 12.748 -9.808 1.00 0.00 H new ATOM 0 HA HIS B 81 25.372 14.415 -11.985 1.00 0.00 H new ATOM 0 HB2 HIS B 81 23.253 13.060 -11.922 1.00 0.00 H new ATOM 0 HB3 HIS B 81 22.657 14.118 -10.658 1.00 0.00 H new ATOM 0 HD2 HIS B 81 23.207 17.042 -11.943 1.00 0.00 H new ATOM 0 HE1 HIS B 81 21.113 15.576 -15.320 1.00 0.00 H new ATOM 0 HE2 HIS B 81 21.905 17.670 -14.109 1.00 0.00 H new ATOM 2607 N HIS B 82 25.718 16.571 -10.791 1.00 0.00 N ATOM 2608 CA HIS B 82 25.954 17.846 -10.114 1.00 0.00 C ATOM 2609 C HIS B 82 24.671 18.669 -10.007 1.00 0.00 C ATOM 2610 O HIS B 82 24.201 18.956 -8.907 1.00 0.00 O ATOM 2611 CB HIS B 82 27.034 18.639 -10.859 1.00 0.00 C ATOM 2612 CG HIS B 82 27.329 19.987 -10.270 1.00 0.00 C ATOM 2613 ND1 HIS B 82 26.923 21.169 -10.852 1.00 0.00 N ATOM 2614 CD2 HIS B 82 28.011 20.337 -9.154 1.00 0.00 C ATOM 2615 CE1 HIS B 82 27.341 22.185 -10.121 1.00 0.00 C ATOM 2616 NE2 HIS B 82 28.004 21.708 -9.084 1.00 0.00 N ATOM 0 H HIS B 82 26.286 16.428 -11.626 1.00 0.00 H new ATOM 0 HA HIS B 82 26.296 17.634 -9.101 1.00 0.00 H new ATOM 0 HB2 HIS B 82 27.953 18.053 -10.873 1.00 0.00 H new ATOM 0 HB3 HIS B 82 26.722 18.769 -11.895 1.00 0.00 H new ATOM 0 HD2 HIS B 82 28.475 19.663 -8.449 1.00 0.00 H new ATOM 0 HE1 HIS B 82 27.170 23.230 -10.335 1.00 0.00 H new ATOM 0 HE2 HIS B 82 28.440 22.267 -8.350 1.00 0.00 H new ATOM 2625 N HIS B 83 24.122 19.048 -11.151 1.00 0.00 N ATOM 2626 CA HIS B 83 22.906 19.846 -11.199 1.00 0.00 C ATOM 2627 C HIS B 83 22.414 19.939 -12.632 1.00 0.00 C ATOM 2628 O HIS B 83 21.501 19.180 -13.002 1.00 0.00 O ATOM 2629 CB HIS B 83 23.154 21.251 -10.630 1.00 0.00 C ATOM 2630 CG HIS B 83 21.940 22.131 -10.633 1.00 0.00 C ATOM 2631 ND1 HIS B 83 20.960 22.064 -9.669 1.00 0.00 N ATOM 2632 CD2 HIS B 83 21.561 23.114 -11.483 1.00 0.00 C ATOM 2633 CE1 HIS B 83 20.033 22.964 -9.924 1.00 0.00 C ATOM 2634 NE2 HIS B 83 20.370 23.619 -11.018 1.00 0.00 N ATOM 2635 OXT HIS B 83 22.978 20.742 -13.395 1.00 0.00 O ATOM 0 H HIS B 83 24.504 18.813 -12.067 1.00 0.00 H new ATOM 0 HA HIS B 83 22.145 19.362 -10.587 1.00 0.00 H new ATOM 0 HB2 HIS B 83 23.521 21.159 -9.608 1.00 0.00 H new ATOM 0 HB3 HIS B 83 23.942 21.733 -11.209 1.00 0.00 H new ATOM 0 HD2 HIS B 83 22.095 23.441 -12.363 1.00 0.00 H new ATOM 0 HE1 HIS B 83 19.144 23.137 -9.335 1.00 0.00 H new ATOM 0 HE2 HIS B 83 19.836 24.374 -11.448 1.00 0.00 H new TER 2644 HIS B 83