USER MOD reduce.3.24.130724 H: found=0, std=0, add=853, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 853 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: A 53 MET CE :methyl 173:sc= -0.843 (180deg=-0.429) USER MOD Set 1.2: A 57 MET CE :methyl -134:sc= -1.35 (180deg=-3.85!) USER MOD Set 2.1: A 43 CYS SG : rot -160:sc= 0.645 USER MOD Set 2.2: A 45 SER OG : rot 99:sc= -0.356 USER MOD Set 3.1: A 7 MET CE :methyl -150:sc= -1.7 (180deg=-1.52) USER MOD Set 3.2: A 41 SER OG : rot -52:sc= -0.168 USER MOD Set 4.1: A 25 MET CE :methyl -137:sc= -1.24 (180deg=-2.74!) USER MOD Set 4.2: A 74 GLN : amide:sc= -0.467 X(o=-1.7,f=-1.3) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -163:sc= -0.0319 (180deg=-0.379) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 57:sc= 0.892 USER MOD Single : A 6 ASN : amide:sc= -4.27! C(o=-4.3!,f=-6.6!) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot -140:sc= -0.0901 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -2.01! C(o=-2!,f=-3.9!) USER MOD Single : A 18 ASN : amide:sc= -0.626 K(o=-0.63,f=-0.069) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 172:sc= -0.0219 (180deg=-0.145) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 124:sc= 0.674 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 38 ASN : amide:sc= -1.24! X(o=-1.2!,f=-1.4) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 153:sc= -0.0676 (180deg=-0.502) USER MOD Single : A 52 LYS NZ :NH3+ -164:sc= -0.0154 (180deg=-0.221) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.217) USER MOD Single : A 64 ASN : amide:sc= -4.89! C(o=-4.9!,f=-10!) USER MOD Single : A 69 CYS SG : rot 180:sc= -1.27 USER MOD Single : A 77 SER OG : rot 89:sc= 1.31 USER MOD Single : A 79 SER OG : rot -47:sc= -0.359 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= -0.168 X(o=-0.17,f=-0.17) USER MOD Single : A 88 SER OG : rot -60:sc= 0.597 USER MOD Single : A 90 HIS : no HD1:sc= -3.18! C(o=-3.2!,f=-6!) USER MOD Single : A 91 SER OG : rot -85:sc= 0.834 USER MOD Single : A 93 SER OG : rot -139:sc= 1.86 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 HIS : no HD1:sc= -0.0328 X(o=-0.033,f=0) USER MOD Single : A 102 HIS : no HD1:sc= -2.44! K(o=-2.4!,f=-1.3) USER MOD Single : A 103 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 104 HIS : no HD1:sc= -0.0942 X(o=-0.094,f=-0.56) USER MOD Single : A 105 HIS : no HD1:sc= -0.971 K(o=-0.97,f=-0.0033) USER MOD Single : A 106 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 12.310 14.150 2.424 1.00 1.00 N ATOM 2 CA MET A 1 11.182 13.424 1.774 1.00 1.00 C ATOM 3 C MET A 1 11.599 11.976 1.520 1.00 1.00 C ATOM 4 O MET A 1 11.800 11.206 2.458 1.00 1.00 O ATOM 5 CB MET A 1 10.835 14.108 0.448 1.00 1.00 C ATOM 6 CG MET A 1 10.277 15.506 0.722 1.00 1.00 C ATOM 7 SD MET A 1 9.807 16.286 -0.843 1.00 1.00 S ATOM 8 CE MET A 1 9.509 17.944 -0.181 1.00 1.00 C ATOM 0 H1 MET A 1 11.955 15.027 2.857 1.00 1.00 H new ATOM 0 H2 MET A 1 12.733 13.548 3.159 1.00 1.00 H new ATOM 0 H3 MET A 1 13.030 14.383 1.711 1.00 1.00 H new ATOM 0 HA MET A 1 10.307 13.439 2.423 1.00 1.00 H new ATOM 0 HB2 MET A 1 11.723 14.177 -0.181 1.00 1.00 H new ATOM 0 HB3 MET A 1 10.103 13.514 -0.099 1.00 1.00 H new ATOM 0 HG2 MET A 1 9.412 15.441 1.382 1.00 1.00 H new ATOM 0 HG3 MET A 1 11.024 16.113 1.234 1.00 1.00 H new ATOM 0 HE1 MET A 1 9.201 18.608 -0.988 1.00 1.00 H new ATOM 0 HE2 MET A 1 8.722 17.899 0.572 1.00 1.00 H new ATOM 0 HE3 MET A 1 10.424 18.324 0.273 1.00 1.00 H new ATOM 20 N LYS A 2 11.730 11.616 0.247 1.00 1.00 N ATOM 21 CA LYS A 2 12.130 10.261 -0.113 1.00 1.00 C ATOM 22 C LYS A 2 11.299 9.241 0.660 1.00 1.00 C ATOM 23 O LYS A 2 11.826 8.498 1.489 1.00 1.00 O ATOM 24 CB LYS A 2 13.611 10.051 0.211 1.00 1.00 C ATOM 25 CG LYS A 2 14.423 11.252 -0.280 1.00 1.00 C ATOM 26 CD LYS A 2 15.921 10.968 -0.101 1.00 1.00 C ATOM 27 CE LYS A 2 16.238 10.746 1.383 1.00 1.00 C ATOM 28 NZ LYS A 2 17.689 10.987 1.629 1.00 1.00 N ATOM 0 H LYS A 2 11.567 12.237 -0.545 1.00 1.00 H new ATOM 0 HA LYS A 2 11.965 10.124 -1.182 1.00 1.00 H new ATOM 0 HB2 LYS A 2 13.744 9.925 1.286 1.00 1.00 H new ATOM 0 HB3 LYS A 2 13.971 9.138 -0.264 1.00 1.00 H new ATOM 0 HG2 LYS A 2 14.203 11.448 -1.329 1.00 1.00 H new ATOM 0 HG3 LYS A 2 14.143 12.146 0.277 1.00 1.00 H new ATOM 0 HD2 LYS A 2 16.204 10.088 -0.678 1.00 1.00 H new ATOM 0 HD3 LYS A 2 16.507 11.803 -0.486 1.00 1.00 H new ATOM 0 HE2 LYS A 2 15.639 11.418 1.997 1.00 1.00 H new ATOM 0 HE3 LYS A 2 15.974 9.729 1.673 1.00 1.00 H new ATOM 0 HZ1 LYS A 2 17.900 10.836 2.636 1.00 1.00 H new ATOM 0 HZ2 LYS A 2 18.253 10.329 1.054 1.00 1.00 H new ATOM 0 HZ3 LYS A 2 17.927 11.965 1.369 1.00 1.00 H new ATOM 42 N PRO A 3 10.017 9.199 0.415 1.00 1.00 N ATOM 43 CA PRO A 3 9.097 8.260 1.110 1.00 1.00 C ATOM 44 C PRO A 3 9.104 6.869 0.473 1.00 1.00 C ATOM 45 O PRO A 3 9.312 5.866 1.156 1.00 1.00 O ATOM 46 CB PRO A 3 7.731 8.936 0.946 1.00 1.00 C ATOM 47 CG PRO A 3 7.822 9.655 -0.364 1.00 1.00 C ATOM 48 CD PRO A 3 9.299 10.039 -0.559 1.00 1.00 C ATOM 0 HA PRO A 3 9.378 8.089 2.149 1.00 1.00 H new ATOM 0 HB2 PRO A 3 6.924 8.203 0.941 1.00 1.00 H new ATOM 0 HB3 PRO A 3 7.529 9.627 1.765 1.00 1.00 H new ATOM 0 HG2 PRO A 3 7.477 9.019 -1.179 1.00 1.00 H new ATOM 0 HG3 PRO A 3 7.189 10.542 -0.363 1.00 1.00 H new ATOM 0 HD2 PRO A 3 9.632 9.842 -1.578 1.00 1.00 H new ATOM 0 HD3 PRO A 3 9.464 11.100 -0.370 1.00 1.00 H new ATOM 56 N LEU A 4 8.855 6.817 -0.838 1.00 1.00 N ATOM 57 CA LEU A 4 8.811 5.546 -1.566 1.00 1.00 C ATOM 58 C LEU A 4 10.077 5.302 -2.383 1.00 1.00 C ATOM 59 O LEU A 4 10.205 4.262 -3.029 1.00 1.00 O ATOM 60 CB LEU A 4 7.604 5.545 -2.508 1.00 1.00 C ATOM 61 CG LEU A 4 6.297 5.618 -1.689 1.00 1.00 C ATOM 62 CD1 LEU A 4 5.075 5.718 -2.633 1.00 1.00 C ATOM 63 CD2 LEU A 4 6.169 4.378 -0.769 1.00 1.00 C ATOM 0 H LEU A 4 8.681 7.639 -1.416 1.00 1.00 H new ATOM 0 HA LEU A 4 8.731 4.748 -0.828 1.00 1.00 H new ATOM 0 HB2 LEU A 4 7.664 6.393 -3.190 1.00 1.00 H new ATOM 0 HB3 LEU A 4 7.610 4.643 -3.120 1.00 1.00 H new ATOM 0 HG LEU A 4 6.327 6.511 -1.065 1.00 1.00 H new ATOM 0 HD11 LEU A 4 4.161 5.769 -2.041 1.00 1.00 H new ATOM 0 HD12 LEU A 4 5.161 6.616 -3.245 1.00 1.00 H new ATOM 0 HD13 LEU A 4 5.041 4.840 -3.278 1.00 1.00 H new ATOM 0 HD21 LEU A 4 5.243 4.443 -0.198 1.00 1.00 H new ATOM 0 HD22 LEU A 4 6.158 3.473 -1.377 1.00 1.00 H new ATOM 0 HD23 LEU A 4 7.016 4.344 -0.084 1.00 1.00 H new ATOM 75 N SER A 5 11.004 6.255 -2.370 1.00 1.00 N ATOM 76 CA SER A 5 12.240 6.103 -3.135 1.00 1.00 C ATOM 77 C SER A 5 13.262 5.304 -2.348 1.00 1.00 C ATOM 78 O SER A 5 14.050 5.869 -1.592 1.00 1.00 O ATOM 79 CB SER A 5 12.804 7.472 -3.475 1.00 1.00 C ATOM 80 OG SER A 5 13.247 8.114 -2.287 1.00 1.00 O ATOM 0 H SER A 5 10.927 7.128 -1.848 1.00 1.00 H new ATOM 0 HA SER A 5 12.016 5.564 -4.056 1.00 1.00 H new ATOM 0 HB2 SER A 5 13.632 7.371 -4.176 1.00 1.00 H new ATOM 0 HB3 SER A 5 12.043 8.078 -3.966 1.00 1.00 H new ATOM 0 HG SER A 5 13.905 7.546 -1.834 1.00 1.00 H new ATOM 86 N ASN A 6 13.223 3.987 -2.547 1.00 1.00 N ATOM 87 CA ASN A 6 14.121 3.036 -1.880 1.00 1.00 C ATOM 88 C ASN A 6 13.382 1.720 -1.668 1.00 1.00 C ATOM 89 O ASN A 6 13.963 0.737 -1.208 1.00 1.00 O ATOM 90 CB ASN A 6 14.592 3.553 -0.508 1.00 1.00 C ATOM 91 CG ASN A 6 13.413 4.144 0.259 1.00 1.00 C ATOM 92 OD1 ASN A 6 12.362 3.511 0.365 1.00 1.00 O ATOM 93 ND2 ASN A 6 13.517 5.331 0.791 1.00 1.00 N ATOM 0 H ASN A 6 12.561 3.542 -3.182 1.00 1.00 H new ATOM 0 HA ASN A 6 14.996 2.903 -2.517 1.00 1.00 H new ATOM 0 HB2 ASN A 6 15.037 2.739 0.064 1.00 1.00 H new ATOM 0 HB3 ASN A 6 15.366 4.309 -0.641 1.00 1.00 H new ATOM 0 HD21 ASN A 6 12.728 5.735 1.295 1.00 1.00 H new ATOM 0 HD22 ASN A 6 14.388 5.855 0.703 1.00 1.00 H new ATOM 100 N MET A 7 12.082 1.719 -1.975 1.00 1.00 N ATOM 101 CA MET A 7 11.250 0.528 -1.777 1.00 1.00 C ATOM 102 C MET A 7 10.363 0.244 -2.989 1.00 1.00 C ATOM 103 O MET A 7 9.947 1.161 -3.698 1.00 1.00 O ATOM 104 CB MET A 7 10.360 0.753 -0.551 1.00 1.00 C ATOM 105 CG MET A 7 9.461 1.971 -0.801 1.00 1.00 C ATOM 106 SD MET A 7 8.444 2.307 0.662 1.00 1.00 S ATOM 107 CE MET A 7 7.107 1.136 0.315 1.00 1.00 C ATOM 0 H MET A 7 11.585 2.523 -2.359 1.00 1.00 H new ATOM 0 HA MET A 7 11.908 -0.329 -1.636 1.00 1.00 H new ATOM 0 HB2 MET A 7 9.751 -0.131 -0.361 1.00 1.00 H new ATOM 0 HB3 MET A 7 10.974 0.914 0.335 1.00 1.00 H new ATOM 0 HG2 MET A 7 10.073 2.842 -1.036 1.00 1.00 H new ATOM 0 HG3 MET A 7 8.821 1.789 -1.664 1.00 1.00 H new ATOM 0 HE1 MET A 7 6.175 1.513 0.735 1.00 1.00 H new ATOM 0 HE2 MET A 7 6.998 1.018 -0.763 1.00 1.00 H new ATOM 0 HE3 MET A 7 7.343 0.171 0.764 1.00 1.00 H new ATOM 117 N LYS A 8 10.043 -1.034 -3.194 1.00 1.00 N ATOM 118 CA LYS A 8 9.165 -1.446 -4.293 1.00 1.00 C ATOM 119 C LYS A 8 7.725 -1.518 -3.767 1.00 1.00 C ATOM 120 O LYS A 8 7.511 -1.642 -2.561 1.00 1.00 O ATOM 121 CB LYS A 8 9.620 -2.803 -4.861 1.00 1.00 C ATOM 122 CG LYS A 8 10.614 -2.594 -6.013 1.00 1.00 C ATOM 123 CD LYS A 8 11.901 -1.956 -5.489 1.00 1.00 C ATOM 124 CE LYS A 8 12.874 -1.769 -6.655 1.00 1.00 C ATOM 125 NZ LYS A 8 14.115 -1.098 -6.176 1.00 1.00 N ATOM 0 H LYS A 8 10.378 -1.803 -2.614 1.00 1.00 H new ATOM 0 HA LYS A 8 9.214 -0.720 -5.105 1.00 1.00 H new ATOM 0 HB2 LYS A 8 10.085 -3.397 -4.074 1.00 1.00 H new ATOM 0 HB3 LYS A 8 8.756 -3.365 -5.215 1.00 1.00 H new ATOM 0 HG2 LYS A 8 10.840 -3.549 -6.487 1.00 1.00 H new ATOM 0 HG3 LYS A 8 10.168 -1.957 -6.777 1.00 1.00 H new ATOM 0 HD2 LYS A 8 11.682 -0.995 -5.023 1.00 1.00 H new ATOM 0 HD3 LYS A 8 12.349 -2.588 -4.722 1.00 1.00 H new ATOM 0 HE2 LYS A 8 13.119 -2.736 -7.094 1.00 1.00 H new ATOM 0 HE3 LYS A 8 12.406 -1.172 -7.438 1.00 1.00 H new ATOM 0 HZ1 LYS A 8 14.772 -0.974 -6.973 1.00 1.00 H new ATOM 0 HZ2 LYS A 8 13.875 -0.168 -5.777 1.00 1.00 H new ATOM 0 HZ3 LYS A 8 14.566 -1.683 -5.444 1.00 1.00 H new ATOM 139 N ILE A 9 6.742 -1.369 -4.663 1.00 1.00 N ATOM 140 CA ILE A 9 5.328 -1.346 -4.249 1.00 1.00 C ATOM 141 C ILE A 9 4.445 -2.321 -5.032 1.00 1.00 C ATOM 142 O ILE A 9 4.723 -2.673 -6.177 1.00 1.00 O ATOM 143 CB ILE A 9 4.801 0.066 -4.446 1.00 1.00 C ATOM 144 CG1 ILE A 9 5.552 1.012 -3.509 1.00 1.00 C ATOM 145 CG2 ILE A 9 3.294 0.124 -4.139 1.00 1.00 C ATOM 146 CD1 ILE A 9 5.277 2.451 -3.926 1.00 1.00 C ATOM 0 H ILE A 9 6.893 -1.264 -5.666 1.00 1.00 H new ATOM 0 HA ILE A 9 5.287 -1.659 -3.206 1.00 1.00 H new ATOM 0 HB ILE A 9 4.956 0.366 -5.482 1.00 1.00 H new ATOM 0 HG12 ILE A 9 5.233 0.852 -2.479 1.00 1.00 H new ATOM 0 HG13 ILE A 9 6.622 0.808 -3.547 1.00 1.00 H new ATOM 0 HG21 ILE A 9 2.932 1.142 -4.285 1.00 1.00 H new ATOM 0 HG22 ILE A 9 2.760 -0.550 -4.808 1.00 1.00 H new ATOM 0 HG23 ILE A 9 3.121 -0.178 -3.106 1.00 1.00 H new ATOM 0 HD11 ILE A 9 5.810 3.131 -3.261 1.00 1.00 H new ATOM 0 HD12 ILE A 9 5.617 2.604 -4.950 1.00 1.00 H new ATOM 0 HD13 ILE A 9 4.207 2.649 -3.865 1.00 1.00 H new ATOM 158 N LEU A 10 3.359 -2.732 -4.371 1.00 1.00 N ATOM 159 CA LEU A 10 2.375 -3.655 -4.942 1.00 1.00 C ATOM 160 C LEU A 10 0.961 -3.143 -4.689 1.00 1.00 C ATOM 161 O LEU A 10 0.703 -2.489 -3.683 1.00 1.00 O ATOM 162 CB LEU A 10 2.529 -5.032 -4.289 1.00 1.00 C ATOM 163 CG LEU A 10 1.547 -6.061 -4.920 1.00 1.00 C ATOM 164 CD1 LEU A 10 2.244 -7.416 -5.081 1.00 1.00 C ATOM 165 CD2 LEU A 10 0.319 -6.258 -4.015 1.00 1.00 C ATOM 0 H LEU A 10 3.137 -2.433 -3.421 1.00 1.00 H new ATOM 0 HA LEU A 10 2.545 -3.728 -6.016 1.00 1.00 H new ATOM 0 HB2 LEU A 10 3.554 -5.382 -4.408 1.00 1.00 H new ATOM 0 HB3 LEU A 10 2.341 -4.954 -3.218 1.00 1.00 H new ATOM 0 HG LEU A 10 1.233 -5.678 -5.891 1.00 1.00 H new ATOM 0 HD11 LEU A 10 1.551 -8.131 -5.523 1.00 1.00 H new ATOM 0 HD12 LEU A 10 3.113 -7.304 -5.730 1.00 1.00 H new ATOM 0 HD13 LEU A 10 2.565 -7.778 -4.104 1.00 1.00 H new ATOM 0 HD21 LEU A 10 -0.357 -6.981 -4.472 1.00 1.00 H new ATOM 0 HD22 LEU A 10 0.640 -6.627 -3.041 1.00 1.00 H new ATOM 0 HD23 LEU A 10 -0.198 -5.306 -3.890 1.00 1.00 H new ATOM 177 N THR A 11 0.034 -3.465 -5.584 1.00 1.00 N ATOM 178 CA THR A 11 -1.364 -3.057 -5.401 1.00 1.00 C ATOM 179 C THR A 11 -2.268 -4.251 -5.672 1.00 1.00 C ATOM 180 O THR A 11 -1.958 -5.093 -6.516 1.00 1.00 O ATOM 181 CB THR A 11 -1.721 -1.874 -6.309 1.00 1.00 C ATOM 182 OG1 THR A 11 -2.954 -1.314 -5.879 1.00 1.00 O ATOM 183 CG2 THR A 11 -1.862 -2.337 -7.752 1.00 1.00 C ATOM 0 H THR A 11 0.216 -3.999 -6.434 1.00 1.00 H new ATOM 0 HA THR A 11 -1.508 -2.723 -4.374 1.00 1.00 H new ATOM 0 HB THR A 11 -0.927 -1.130 -6.251 1.00 1.00 H new ATOM 0 HG1 THR A 11 -3.492 -1.069 -6.660 1.00 1.00 H new ATOM 0 HG21 THR A 11 -2.116 -1.486 -8.384 1.00 1.00 H new ATOM 0 HG22 THR A 11 -0.921 -2.771 -8.088 1.00 1.00 H new ATOM 0 HG23 THR A 11 -2.651 -3.086 -7.818 1.00 1.00 H new ATOM 191 N LEU A 12 -3.363 -4.353 -4.916 1.00 1.00 N ATOM 192 CA LEU A 12 -4.270 -5.495 -5.053 1.00 1.00 C ATOM 193 C LEU A 12 -5.662 -5.069 -5.528 1.00 1.00 C ATOM 194 O LEU A 12 -6.331 -4.257 -4.891 1.00 1.00 O ATOM 195 CB LEU A 12 -4.399 -6.181 -3.690 1.00 1.00 C ATOM 196 CG LEU A 12 -4.998 -7.586 -3.865 1.00 1.00 C ATOM 197 CD1 LEU A 12 -3.975 -8.523 -4.559 1.00 1.00 C ATOM 198 CD2 LEU A 12 -5.385 -8.145 -2.483 1.00 1.00 C ATOM 0 H LEU A 12 -3.641 -3.669 -4.212 1.00 1.00 H new ATOM 0 HA LEU A 12 -3.855 -6.172 -5.800 1.00 1.00 H new ATOM 0 HB2 LEU A 12 -3.421 -6.250 -3.214 1.00 1.00 H new ATOM 0 HB3 LEU A 12 -5.032 -5.586 -3.032 1.00 1.00 H new ATOM 0 HG LEU A 12 -5.887 -7.527 -4.493 1.00 1.00 H new ATOM 0 HD11 LEU A 12 -4.412 -9.515 -4.677 1.00 1.00 H new ATOM 0 HD12 LEU A 12 -3.719 -8.120 -5.539 1.00 1.00 H new ATOM 0 HD13 LEU A 12 -3.074 -8.593 -3.949 1.00 1.00 H new ATOM 0 HD21 LEU A 12 -5.811 -9.142 -2.600 1.00 1.00 H new ATOM 0 HD22 LEU A 12 -4.498 -8.201 -1.852 1.00 1.00 H new ATOM 0 HD23 LEU A 12 -6.121 -7.489 -2.018 1.00 1.00 H new ATOM 210 N GLY A 13 -6.097 -5.665 -6.634 1.00 1.00 N ATOM 211 CA GLY A 13 -7.425 -5.401 -7.183 1.00 1.00 C ATOM 212 C GLY A 13 -7.704 -3.920 -7.438 1.00 1.00 C ATOM 213 O GLY A 13 -6.929 -3.218 -8.088 1.00 1.00 O ATOM 0 H GLY A 13 -5.548 -6.337 -7.170 1.00 1.00 H new ATOM 0 HA2 GLY A 13 -7.536 -5.948 -8.119 1.00 1.00 H new ATOM 0 HA3 GLY A 13 -8.176 -5.789 -6.495 1.00 1.00 H new ATOM 217 N LYS A 14 -8.861 -3.485 -6.941 1.00 1.00 N ATOM 218 CA LYS A 14 -9.342 -2.115 -7.117 1.00 1.00 C ATOM 219 C LYS A 14 -8.408 -1.069 -6.521 1.00 1.00 C ATOM 220 O LYS A 14 -7.900 -1.215 -5.409 1.00 1.00 O ATOM 221 CB LYS A 14 -10.717 -1.985 -6.464 1.00 1.00 C ATOM 222 CG LYS A 14 -11.323 -0.613 -6.792 1.00 1.00 C ATOM 223 CD LYS A 14 -12.695 -0.463 -6.120 1.00 1.00 C ATOM 224 CE LYS A 14 -13.745 -1.300 -6.859 1.00 1.00 C ATOM 225 NZ LYS A 14 -15.102 -0.945 -6.355 1.00 1.00 N ATOM 0 H LYS A 14 -9.494 -4.076 -6.402 1.00 1.00 H new ATOM 0 HA LYS A 14 -9.390 -1.926 -8.189 1.00 1.00 H new ATOM 0 HB2 LYS A 14 -11.375 -2.778 -6.820 1.00 1.00 H new ATOM 0 HB3 LYS A 14 -10.629 -2.105 -5.384 1.00 1.00 H new ATOM 0 HG2 LYS A 14 -10.655 0.178 -6.451 1.00 1.00 H new ATOM 0 HG3 LYS A 14 -11.425 -0.501 -7.871 1.00 1.00 H new ATOM 0 HD2 LYS A 14 -12.634 -0.781 -5.079 1.00 1.00 H new ATOM 0 HD3 LYS A 14 -12.993 0.586 -6.116 1.00 1.00 H new ATOM 0 HE2 LYS A 14 -13.684 -1.117 -7.932 1.00 1.00 H new ATOM 0 HE3 LYS A 14 -13.554 -2.362 -6.706 1.00 1.00 H new ATOM 0 HZ1 LYS A 14 -15.817 -1.511 -6.855 1.00 1.00 H new ATOM 0 HZ2 LYS A 14 -15.156 -1.141 -5.335 1.00 1.00 H new ATOM 0 HZ3 LYS A 14 -15.281 0.066 -6.523 1.00 1.00 H new ATOM 239 N LEU A 15 -8.220 0.005 -7.284 1.00 1.00 N ATOM 240 CA LEU A 15 -7.380 1.136 -6.876 1.00 1.00 C ATOM 241 C LEU A 15 -8.198 2.427 -6.938 1.00 1.00 C ATOM 242 O LEU A 15 -8.820 2.718 -7.961 1.00 1.00 O ATOM 243 CB LEU A 15 -6.180 1.248 -7.818 1.00 1.00 C ATOM 244 CG LEU A 15 -5.206 2.326 -7.319 1.00 1.00 C ATOM 245 CD1 LEU A 15 -4.566 1.902 -5.981 1.00 1.00 C ATOM 246 CD2 LEU A 15 -4.117 2.527 -8.376 1.00 1.00 C ATOM 0 H LEU A 15 -8.645 0.119 -8.204 1.00 1.00 H new ATOM 0 HA LEU A 15 -7.028 0.977 -5.857 1.00 1.00 H new ATOM 0 HB2 LEU A 15 -5.668 0.288 -7.881 1.00 1.00 H new ATOM 0 HB3 LEU A 15 -6.521 1.494 -8.824 1.00 1.00 H new ATOM 0 HG LEU A 15 -5.748 3.257 -7.156 1.00 1.00 H new ATOM 0 HD11 LEU A 15 -3.879 2.678 -5.644 1.00 1.00 H new ATOM 0 HD12 LEU A 15 -5.346 1.758 -5.234 1.00 1.00 H new ATOM 0 HD13 LEU A 15 -4.019 0.969 -6.119 1.00 1.00 H new ATOM 0 HD21 LEU A 15 -3.417 3.290 -8.036 1.00 1.00 H new ATOM 0 HD22 LEU A 15 -3.584 1.589 -8.532 1.00 1.00 H new ATOM 0 HD23 LEU A 15 -4.574 2.845 -9.313 1.00 1.00 H new ATOM 258 N SER A 16 -8.197 3.200 -5.858 1.00 1.00 N ATOM 259 CA SER A 16 -8.951 4.454 -5.841 1.00 1.00 C ATOM 260 C SER A 16 -8.425 5.404 -6.914 1.00 1.00 C ATOM 261 O SER A 16 -9.195 6.040 -7.634 1.00 1.00 O ATOM 262 CB SER A 16 -8.848 5.123 -4.472 1.00 1.00 C ATOM 263 OG SER A 16 -9.498 4.315 -3.500 1.00 1.00 O ATOM 0 H SER A 16 -7.694 2.989 -4.996 1.00 1.00 H new ATOM 0 HA SER A 16 -9.997 4.225 -6.046 1.00 1.00 H new ATOM 0 HB2 SER A 16 -7.801 5.264 -4.202 1.00 1.00 H new ATOM 0 HB3 SER A 16 -9.305 6.112 -4.503 1.00 1.00 H new ATOM 0 HG SER A 16 -9.431 4.743 -2.621 1.00 1.00 H new ATOM 269 N GLN A 17 -7.106 5.485 -7.012 1.00 1.00 N ATOM 270 CA GLN A 17 -6.457 6.346 -7.994 1.00 1.00 C ATOM 271 C GLN A 17 -6.593 5.766 -9.396 1.00 1.00 C ATOM 272 O GLN A 17 -6.657 4.549 -9.574 1.00 1.00 O ATOM 273 CB GLN A 17 -4.980 6.497 -7.619 1.00 1.00 C ATOM 274 CG GLN A 17 -4.848 7.452 -6.421 1.00 1.00 C ATOM 275 CD GLN A 17 -3.598 7.132 -5.605 1.00 1.00 C ATOM 276 OE1 GLN A 17 -2.509 6.980 -6.160 1.00 1.00 O ATOM 277 NE2 GLN A 17 -3.703 7.019 -4.306 1.00 1.00 N ATOM 0 H GLN A 17 -6.460 4.962 -6.421 1.00 1.00 H new ATOM 0 HA GLN A 17 -6.939 7.324 -7.992 1.00 1.00 H new ATOM 0 HB2 GLN A 17 -4.556 5.524 -7.370 1.00 1.00 H new ATOM 0 HB3 GLN A 17 -4.416 6.883 -8.468 1.00 1.00 H new ATOM 0 HG2 GLN A 17 -4.802 8.482 -6.775 1.00 1.00 H new ATOM 0 HG3 GLN A 17 -5.731 7.372 -5.787 1.00 1.00 H new ATOM 0 HE21 GLN A 17 -4.609 7.146 -3.855 1.00 1.00 H new ATOM 0 HE22 GLN A 17 -2.879 6.803 -3.745 1.00 1.00 H new ATOM 286 N ASN A 18 -6.654 6.652 -10.384 1.00 1.00 N ATOM 287 CA ASN A 18 -6.802 6.234 -11.772 1.00 1.00 C ATOM 288 C ASN A 18 -5.470 5.768 -12.337 1.00 1.00 C ATOM 289 O ASN A 18 -4.544 5.457 -11.595 1.00 1.00 O ATOM 290 CB ASN A 18 -7.310 7.404 -12.618 1.00 1.00 C ATOM 291 CG ASN A 18 -8.454 8.111 -11.908 1.00 1.00 C ATOM 292 OD1 ASN A 18 -9.586 7.627 -11.906 1.00 1.00 O ATOM 293 ND2 ASN A 18 -8.214 9.238 -11.291 1.00 1.00 N ATOM 0 H ASN A 18 -6.603 7.662 -10.249 1.00 1.00 H new ATOM 0 HA ASN A 18 -7.516 5.411 -11.803 1.00 1.00 H new ATOM 0 HB2 ASN A 18 -6.498 8.107 -12.803 1.00 1.00 H new ATOM 0 HB3 ASN A 18 -7.645 7.041 -13.590 1.00 1.00 H new ATOM 0 HD21 ASN A 18 -8.967 9.723 -10.803 1.00 1.00 H new ATOM 0 HD22 ASN A 18 -7.273 9.633 -11.297 1.00 1.00 H new ATOM 300 N LYS A 19 -5.389 5.731 -13.662 1.00 1.00 N ATOM 301 CA LYS A 19 -4.170 5.316 -14.340 1.00 1.00 C ATOM 302 C LYS A 19 -3.056 6.348 -14.176 1.00 1.00 C ATOM 303 O LYS A 19 -2.055 6.097 -13.510 1.00 1.00 O ATOM 304 CB LYS A 19 -4.459 5.070 -15.836 1.00 1.00 C ATOM 305 CG LYS A 19 -3.142 5.013 -16.625 1.00 1.00 C ATOM 306 CD LYS A 19 -3.391 4.615 -18.070 1.00 1.00 C ATOM 307 CE LYS A 19 -2.044 4.612 -18.778 1.00 1.00 C ATOM 308 NZ LYS A 19 -2.212 4.151 -20.186 1.00 1.00 N ATOM 0 H LYS A 19 -6.154 5.984 -14.287 1.00 1.00 H new ATOM 0 HA LYS A 19 -3.828 4.388 -13.882 1.00 1.00 H new ATOM 0 HB2 LYS A 19 -5.007 4.136 -15.960 1.00 1.00 H new ATOM 0 HB3 LYS A 19 -5.093 5.866 -16.228 1.00 1.00 H new ATOM 0 HG2 LYS A 19 -2.651 5.986 -16.591 1.00 1.00 H new ATOM 0 HG3 LYS A 19 -2.465 4.298 -16.158 1.00 1.00 H new ATOM 0 HD2 LYS A 19 -3.855 3.630 -18.123 1.00 1.00 H new ATOM 0 HD3 LYS A 19 -4.075 5.315 -18.549 1.00 1.00 H new ATOM 0 HE2 LYS A 19 -1.613 5.613 -18.763 1.00 1.00 H new ATOM 0 HE3 LYS A 19 -1.349 3.958 -18.252 1.00 1.00 H new ATOM 0 HZ1 LYS A 19 -1.288 4.151 -20.664 1.00 1.00 H new ATOM 0 HZ2 LYS A 19 -2.604 3.188 -20.191 1.00 1.00 H new ATOM 0 HZ3 LYS A 19 -2.861 4.792 -20.686 1.00 1.00 H new ATOM 322 N ASP A 20 -3.208 7.479 -14.846 1.00 1.00 N ATOM 323 CA ASP A 20 -2.170 8.494 -14.824 1.00 1.00 C ATOM 324 C ASP A 20 -1.902 9.007 -13.412 1.00 1.00 C ATOM 325 O ASP A 20 -0.749 9.173 -13.025 1.00 1.00 O ATOM 326 CB ASP A 20 -2.558 9.658 -15.737 1.00 1.00 C ATOM 327 CG ASP A 20 -1.462 10.716 -15.732 1.00 1.00 C ATOM 328 OD1 ASP A 20 -0.364 10.406 -16.163 1.00 1.00 O ATOM 329 OD2 ASP A 20 -1.737 11.827 -15.306 1.00 1.00 O ATOM 0 H ASP A 20 -4.029 7.715 -15.404 1.00 1.00 H new ATOM 0 HA ASP A 20 -1.251 8.033 -15.187 1.00 1.00 H new ATOM 0 HB2 ASP A 20 -2.720 9.296 -16.752 1.00 1.00 H new ATOM 0 HB3 ASP A 20 -3.498 10.096 -15.401 1.00 1.00 H new ATOM 334 N GLU A 21 -2.957 9.261 -12.649 1.00 1.00 N ATOM 335 CA GLU A 21 -2.791 9.768 -11.290 1.00 1.00 C ATOM 336 C GLU A 21 -2.072 8.761 -10.391 1.00 1.00 C ATOM 337 O GLU A 21 -1.256 9.149 -9.556 1.00 1.00 O ATOM 338 CB GLU A 21 -4.152 10.123 -10.685 1.00 1.00 C ATOM 339 CG GLU A 21 -4.734 11.326 -11.428 1.00 1.00 C ATOM 340 CD GLU A 21 -6.104 11.686 -10.863 1.00 1.00 C ATOM 341 OE1 GLU A 21 -6.523 11.041 -9.914 1.00 1.00 O ATOM 342 OE2 GLU A 21 -6.710 12.609 -11.379 1.00 1.00 O ATOM 0 H GLU A 21 -3.925 9.127 -12.941 1.00 1.00 H new ATOM 0 HA GLU A 21 -2.174 10.665 -11.350 1.00 1.00 H new ATOM 0 HB2 GLU A 21 -4.829 9.272 -10.759 1.00 1.00 H new ATOM 0 HB3 GLU A 21 -4.043 10.353 -9.625 1.00 1.00 H new ATOM 0 HG2 GLU A 21 -4.061 12.178 -11.338 1.00 1.00 H new ATOM 0 HG3 GLU A 21 -4.820 11.099 -12.491 1.00 1.00 H new ATOM 349 N ALA A 22 -2.370 7.478 -10.546 1.00 1.00 N ATOM 350 CA ALA A 22 -1.719 6.473 -9.708 1.00 1.00 C ATOM 351 C ALA A 22 -0.244 6.314 -10.070 1.00 1.00 C ATOM 352 O ALA A 22 0.638 6.614 -9.276 1.00 1.00 O ATOM 353 CB ALA A 22 -2.402 5.112 -9.865 1.00 1.00 C ATOM 0 H ALA A 22 -3.039 7.112 -11.224 1.00 1.00 H new ATOM 0 HA ALA A 22 -1.803 6.818 -8.677 1.00 1.00 H new ATOM 0 HB1 ALA A 22 -1.902 4.379 -9.233 1.00 1.00 H new ATOM 0 HB2 ALA A 22 -3.448 5.193 -9.569 1.00 1.00 H new ATOM 0 HB3 ALA A 22 -2.344 4.794 -10.906 1.00 1.00 H new ATOM 359 N LYS A 23 0.014 5.830 -11.273 1.00 1.00 N ATOM 360 CA LYS A 23 1.381 5.589 -11.722 1.00 1.00 C ATOM 361 C LYS A 23 2.232 6.857 -11.708 1.00 1.00 C ATOM 362 O LYS A 23 3.408 6.797 -11.353 1.00 1.00 O ATOM 363 CB LYS A 23 1.365 5.006 -13.145 1.00 1.00 C ATOM 364 CG LYS A 23 0.829 3.546 -13.149 1.00 1.00 C ATOM 365 CD LYS A 23 -0.656 3.519 -13.530 1.00 1.00 C ATOM 366 CE LYS A 23 -1.135 2.068 -13.595 1.00 1.00 C ATOM 367 NZ LYS A 23 -2.565 2.030 -14.012 1.00 1.00 N ATOM 0 H LYS A 23 -0.703 5.595 -11.959 1.00 1.00 H new ATOM 0 HA LYS A 23 1.829 4.882 -11.024 1.00 1.00 H new ATOM 0 HB2 LYS A 23 0.741 5.627 -13.788 1.00 1.00 H new ATOM 0 HB3 LYS A 23 2.372 5.027 -13.561 1.00 1.00 H new ATOM 0 HG2 LYS A 23 1.402 2.944 -13.854 1.00 1.00 H new ATOM 0 HG3 LYS A 23 0.966 3.100 -12.164 1.00 1.00 H new ATOM 0 HD2 LYS A 23 -1.241 4.075 -12.797 1.00 1.00 H new ATOM 0 HD3 LYS A 23 -0.805 4.007 -14.493 1.00 1.00 H new ATOM 0 HE2 LYS A 23 -0.525 1.505 -14.301 1.00 1.00 H new ATOM 0 HE3 LYS A 23 -1.017 1.592 -12.622 1.00 1.00 H new ATOM 0 HZ1 LYS A 23 -2.850 1.045 -14.187 1.00 1.00 H new ATOM 0 HZ2 LYS A 23 -3.157 2.433 -13.258 1.00 1.00 H new ATOM 0 HZ3 LYS A 23 -2.688 2.585 -14.883 1.00 1.00 H new ATOM 381 N ALA A 24 1.673 7.991 -12.115 1.00 1.00 N ATOM 382 CA ALA A 24 2.458 9.217 -12.141 1.00 1.00 C ATOM 383 C ALA A 24 2.908 9.640 -10.744 1.00 1.00 C ATOM 384 O ALA A 24 4.054 10.050 -10.562 1.00 1.00 O ATOM 385 CB ALA A 24 1.663 10.362 -12.774 1.00 1.00 C ATOM 0 H ALA A 24 0.706 8.087 -12.424 1.00 1.00 H new ATOM 0 HA ALA A 24 3.342 9.005 -12.742 1.00 1.00 H new ATOM 0 HB1 ALA A 24 2.271 11.267 -12.782 1.00 1.00 H new ATOM 0 HB2 ALA A 24 1.394 10.097 -13.797 1.00 1.00 H new ATOM 0 HB3 ALA A 24 0.757 10.539 -12.195 1.00 1.00 H new ATOM 391 N MET A 25 2.011 9.566 -9.757 1.00 1.00 N ATOM 392 CA MET A 25 2.379 9.975 -8.400 1.00 1.00 C ATOM 393 C MET A 25 3.331 8.971 -7.737 1.00 1.00 C ATOM 394 O MET A 25 4.270 9.376 -7.055 1.00 1.00 O ATOM 395 CB MET A 25 1.132 10.273 -7.541 1.00 1.00 C ATOM 396 CG MET A 25 0.540 9.007 -6.914 1.00 1.00 C ATOM 397 SD MET A 25 -0.894 9.472 -5.902 1.00 1.00 S ATOM 398 CE MET A 25 -0.006 10.422 -4.641 1.00 1.00 C ATOM 0 H MET A 25 1.052 9.237 -9.866 1.00 1.00 H new ATOM 0 HA MET A 25 2.933 10.910 -8.478 1.00 1.00 H new ATOM 0 HB2 MET A 25 1.397 10.976 -6.752 1.00 1.00 H new ATOM 0 HB3 MET A 25 0.376 10.757 -8.159 1.00 1.00 H new ATOM 0 HG2 MET A 25 0.241 8.305 -7.692 1.00 1.00 H new ATOM 0 HG3 MET A 25 1.288 8.504 -6.301 1.00 1.00 H new ATOM 0 HE1 MET A 25 -0.396 10.171 -3.655 1.00 1.00 H new ATOM 0 HE2 MET A 25 1.056 10.180 -4.684 1.00 1.00 H new ATOM 0 HE3 MET A 25 -0.143 11.488 -4.825 1.00 1.00 H new ATOM 408 N ILE A 26 3.126 7.671 -7.956 1.00 1.00 N ATOM 409 CA ILE A 26 4.037 6.676 -7.375 1.00 1.00 C ATOM 410 C ILE A 26 5.453 6.885 -7.927 1.00 1.00 C ATOM 411 O ILE A 26 6.422 6.879 -7.168 1.00 1.00 O ATOM 412 CB ILE A 26 3.521 5.227 -7.649 1.00 1.00 C ATOM 413 CG1 ILE A 26 2.475 4.792 -6.581 1.00 1.00 C ATOM 414 CG2 ILE A 26 4.678 4.214 -7.672 1.00 1.00 C ATOM 415 CD1 ILE A 26 1.072 5.229 -6.985 1.00 1.00 C ATOM 0 H ILE A 26 2.363 7.288 -8.513 1.00 1.00 H new ATOM 0 HA ILE A 26 4.069 6.808 -6.294 1.00 1.00 H new ATOM 0 HB ILE A 26 3.045 5.239 -8.630 1.00 1.00 H new ATOM 0 HG12 ILE A 26 2.502 3.709 -6.459 1.00 1.00 H new ATOM 0 HG13 ILE A 26 2.732 5.228 -5.616 1.00 1.00 H new ATOM 0 HG21 ILE A 26 4.284 3.216 -7.865 1.00 1.00 H new ATOM 0 HG22 ILE A 26 5.383 4.484 -8.458 1.00 1.00 H new ATOM 0 HG23 ILE A 26 5.188 4.223 -6.709 1.00 1.00 H new ATOM 0 HD11 ILE A 26 0.359 4.914 -6.223 1.00 1.00 H new ATOM 0 HD12 ILE A 26 1.043 6.314 -7.082 1.00 1.00 H new ATOM 0 HD13 ILE A 26 0.809 4.772 -7.939 1.00 1.00 H new ATOM 427 N GLU A 27 5.572 7.091 -9.235 1.00 1.00 N ATOM 428 CA GLU A 27 6.884 7.320 -9.837 1.00 1.00 C ATOM 429 C GLU A 27 7.430 8.702 -9.482 1.00 1.00 C ATOM 430 O GLU A 27 8.640 8.924 -9.513 1.00 1.00 O ATOM 431 CB GLU A 27 6.825 7.140 -11.356 1.00 1.00 C ATOM 432 CG GLU A 27 6.617 5.655 -11.671 1.00 1.00 C ATOM 433 CD GLU A 27 6.455 5.445 -13.173 1.00 1.00 C ATOM 434 OE1 GLU A 27 6.458 6.426 -13.897 1.00 1.00 O ATOM 435 OE2 GLU A 27 6.337 4.299 -13.577 1.00 1.00 O ATOM 0 H GLU A 27 4.791 7.104 -9.891 1.00 1.00 H new ATOM 0 HA GLU A 27 7.567 6.576 -9.426 1.00 1.00 H new ATOM 0 HB2 GLU A 27 6.011 7.732 -11.775 1.00 1.00 H new ATOM 0 HB3 GLU A 27 7.747 7.497 -11.814 1.00 1.00 H new ATOM 0 HG2 GLU A 27 7.467 5.077 -11.307 1.00 1.00 H new ATOM 0 HG3 GLU A 27 5.734 5.287 -11.149 1.00 1.00 H new ATOM 442 N LYS A 28 6.543 9.632 -9.136 1.00 1.00 N ATOM 443 CA LYS A 28 6.983 10.976 -8.772 1.00 1.00 C ATOM 444 C LYS A 28 7.902 10.898 -7.557 1.00 1.00 C ATOM 445 O LYS A 28 8.987 11.477 -7.537 1.00 1.00 O ATOM 446 CB LYS A 28 5.764 11.838 -8.422 1.00 1.00 C ATOM 447 CG LYS A 28 6.203 13.280 -8.116 1.00 1.00 C ATOM 448 CD LYS A 28 4.992 14.116 -7.675 1.00 1.00 C ATOM 449 CE LYS A 28 4.145 14.533 -8.883 1.00 1.00 C ATOM 450 NZ LYS A 28 3.051 15.435 -8.424 1.00 1.00 N ATOM 0 H LYS A 28 5.534 9.485 -9.100 1.00 1.00 H new ATOM 0 HA LYS A 28 7.518 11.419 -9.612 1.00 1.00 H new ATOM 0 HB2 LYS A 28 5.056 11.834 -9.251 1.00 1.00 H new ATOM 0 HB3 LYS A 28 5.247 11.417 -7.560 1.00 1.00 H new ATOM 0 HG2 LYS A 28 6.960 13.280 -7.332 1.00 1.00 H new ATOM 0 HG3 LYS A 28 6.660 13.725 -9.000 1.00 1.00 H new ATOM 0 HD2 LYS A 28 4.382 13.540 -6.979 1.00 1.00 H new ATOM 0 HD3 LYS A 28 5.333 15.003 -7.141 1.00 1.00 H new ATOM 0 HE2 LYS A 28 4.766 15.041 -9.621 1.00 1.00 H new ATOM 0 HE3 LYS A 28 3.727 13.653 -9.371 1.00 1.00 H new ATOM 0 HZ1 LYS A 28 2.472 15.722 -9.239 1.00 1.00 H new ATOM 0 HZ2 LYS A 28 2.454 14.934 -7.735 1.00 1.00 H new ATOM 0 HZ3 LYS A 28 3.462 16.279 -7.977 1.00 1.00 H new ATOM 464 N LEU A 29 7.449 10.165 -6.550 1.00 1.00 N ATOM 465 CA LEU A 29 8.218 9.985 -5.320 1.00 1.00 C ATOM 466 C LEU A 29 9.487 9.222 -5.619 1.00 1.00 C ATOM 467 O LEU A 29 10.559 9.499 -5.083 1.00 1.00 O ATOM 468 CB LEU A 29 7.405 9.155 -4.328 1.00 1.00 C ATOM 469 CG LEU A 29 5.997 9.735 -4.187 1.00 1.00 C ATOM 470 CD1 LEU A 29 5.137 8.852 -3.263 1.00 1.00 C ATOM 471 CD2 LEU A 29 6.081 11.155 -3.627 1.00 1.00 C ATOM 0 H LEU A 29 6.550 9.683 -6.558 1.00 1.00 H new ATOM 0 HA LEU A 29 8.449 10.966 -4.906 1.00 1.00 H new ATOM 0 HB2 LEU A 29 7.348 8.121 -4.668 1.00 1.00 H new ATOM 0 HB3 LEU A 29 7.901 9.145 -3.358 1.00 1.00 H new ATOM 0 HG LEU A 29 5.527 9.762 -5.170 1.00 1.00 H new ATOM 0 HD11 LEU A 29 4.139 9.281 -3.175 1.00 1.00 H new ATOM 0 HD12 LEU A 29 5.065 7.849 -3.682 1.00 1.00 H new ATOM 0 HD13 LEU A 29 5.598 8.801 -2.277 1.00 1.00 H new ATOM 0 HD21 LEU A 29 5.077 11.567 -3.527 1.00 1.00 H new ATOM 0 HD22 LEU A 29 6.563 11.133 -2.650 1.00 1.00 H new ATOM 0 HD23 LEU A 29 6.663 11.779 -4.304 1.00 1.00 H new ATOM 483 N GLY A 30 9.317 8.219 -6.461 1.00 1.00 N ATOM 484 CA GLY A 30 10.393 7.327 -6.844 1.00 1.00 C ATOM 485 C GLY A 30 9.906 5.901 -6.690 1.00 1.00 C ATOM 486 O GLY A 30 10.600 4.948 -7.046 1.00 1.00 O ATOM 0 H GLY A 30 8.423 8.000 -6.900 1.00 1.00 H new ATOM 0 HA2 GLY A 30 10.694 7.516 -7.874 1.00 1.00 H new ATOM 0 HA3 GLY A 30 11.269 7.499 -6.219 1.00 1.00 H new ATOM 490 N GLY A 31 8.693 5.763 -6.148 1.00 1.00 N ATOM 491 CA GLY A 31 8.110 4.446 -5.944 1.00 1.00 C ATOM 492 C GLY A 31 7.906 3.733 -7.282 1.00 1.00 C ATOM 493 O GLY A 31 7.722 4.377 -8.313 1.00 1.00 O ATOM 0 H GLY A 31 8.106 6.541 -5.847 1.00 1.00 H new ATOM 0 HA2 GLY A 31 8.760 3.850 -5.304 1.00 1.00 H new ATOM 0 HA3 GLY A 31 7.155 4.541 -5.428 1.00 1.00 H new ATOM 497 N LYS A 32 7.950 2.396 -7.258 1.00 1.00 N ATOM 498 CA LYS A 32 7.779 1.594 -8.477 1.00 1.00 C ATOM 499 C LYS A 32 6.833 0.421 -8.225 1.00 1.00 C ATOM 500 O LYS A 32 6.647 -0.009 -7.087 1.00 1.00 O ATOM 501 CB LYS A 32 9.141 1.090 -8.963 1.00 1.00 C ATOM 502 CG LYS A 32 9.971 2.294 -9.410 1.00 1.00 C ATOM 503 CD LYS A 32 11.363 1.843 -9.883 1.00 1.00 C ATOM 504 CE LYS A 32 11.285 1.209 -11.283 1.00 1.00 C ATOM 505 NZ LYS A 32 12.595 1.381 -11.973 1.00 1.00 N ATOM 0 H LYS A 32 8.102 1.847 -6.412 1.00 1.00 H new ATOM 0 HA LYS A 32 7.338 2.223 -9.250 1.00 1.00 H new ATOM 0 HB2 LYS A 32 9.653 0.552 -8.165 1.00 1.00 H new ATOM 0 HB3 LYS A 32 9.014 0.390 -9.789 1.00 1.00 H new ATOM 0 HG2 LYS A 32 9.458 2.817 -10.217 1.00 1.00 H new ATOM 0 HG3 LYS A 32 10.072 3.000 -8.586 1.00 1.00 H new ATOM 0 HD2 LYS A 32 12.040 2.697 -9.903 1.00 1.00 H new ATOM 0 HD3 LYS A 32 11.777 1.124 -9.176 1.00 1.00 H new ATOM 0 HE2 LYS A 32 11.039 0.150 -11.203 1.00 1.00 H new ATOM 0 HE3 LYS A 32 10.490 1.677 -11.864 1.00 1.00 H new ATOM 0 HZ1 LYS A 32 12.547 0.954 -12.920 1.00 1.00 H new ATOM 0 HZ2 LYS A 32 12.811 2.395 -12.061 1.00 1.00 H new ATOM 0 HZ3 LYS A 32 13.342 0.915 -11.420 1.00 1.00 H new ATOM 519 N LEU A 33 6.208 -0.065 -9.300 1.00 1.00 N ATOM 520 CA LEU A 33 5.237 -1.160 -9.208 1.00 1.00 C ATOM 521 C LEU A 33 5.839 -2.494 -9.662 1.00 1.00 C ATOM 522 O LEU A 33 6.374 -2.603 -10.764 1.00 1.00 O ATOM 523 CB LEU A 33 4.052 -0.829 -10.121 1.00 1.00 C ATOM 524 CG LEU A 33 3.360 0.463 -9.654 1.00 1.00 C ATOM 525 CD1 LEU A 33 2.451 0.979 -10.773 1.00 1.00 C ATOM 526 CD2 LEU A 33 2.492 0.199 -8.414 1.00 1.00 C ATOM 0 H LEU A 33 6.357 0.283 -10.247 1.00 1.00 H new ATOM 0 HA LEU A 33 4.930 -1.261 -8.167 1.00 1.00 H new ATOM 0 HB2 LEU A 33 4.397 -0.713 -11.148 1.00 1.00 H new ATOM 0 HB3 LEU A 33 3.339 -1.653 -10.115 1.00 1.00 H new ATOM 0 HG LEU A 33 4.129 1.195 -9.407 1.00 1.00 H new ATOM 0 HD11 LEU A 33 1.958 1.895 -10.448 1.00 1.00 H new ATOM 0 HD12 LEU A 33 3.048 1.184 -11.661 1.00 1.00 H new ATOM 0 HD13 LEU A 33 1.699 0.226 -11.008 1.00 1.00 H new ATOM 0 HD21 LEU A 33 2.012 1.127 -8.101 1.00 1.00 H new ATOM 0 HD22 LEU A 33 1.729 -0.541 -8.655 1.00 1.00 H new ATOM 0 HD23 LEU A 33 3.118 -0.176 -7.605 1.00 1.00 H new ATOM 538 N THR A 34 5.711 -3.516 -8.814 1.00 1.00 N ATOM 539 CA THR A 34 6.209 -4.854 -9.146 1.00 1.00 C ATOM 540 C THR A 34 5.136 -5.658 -9.872 1.00 1.00 C ATOM 541 O THR A 34 3.963 -5.278 -9.876 1.00 1.00 O ATOM 542 CB THR A 34 6.622 -5.608 -7.882 1.00 1.00 C ATOM 543 OG1 THR A 34 5.461 -6.057 -7.198 1.00 1.00 O ATOM 544 CG2 THR A 34 7.439 -4.693 -6.977 1.00 1.00 C ATOM 0 H THR A 34 5.270 -3.445 -7.897 1.00 1.00 H new ATOM 0 HA THR A 34 7.077 -4.733 -9.794 1.00 1.00 H new ATOM 0 HB THR A 34 7.232 -6.468 -8.157 1.00 1.00 H new ATOM 0 HG1 THR A 34 5.510 -7.028 -7.074 1.00 1.00 H new ATOM 0 HG21 THR A 34 7.730 -5.236 -6.078 1.00 1.00 H new ATOM 0 HG22 THR A 34 8.332 -4.361 -7.506 1.00 1.00 H new ATOM 0 HG23 THR A 34 6.839 -3.826 -6.699 1.00 1.00 H new ATOM 552 N GLY A 35 5.541 -6.779 -10.473 1.00 1.00 N ATOM 553 CA GLY A 35 4.605 -7.648 -11.193 1.00 1.00 C ATOM 554 C GLY A 35 4.435 -8.983 -10.470 1.00 1.00 C ATOM 555 O GLY A 35 3.902 -9.939 -11.033 1.00 1.00 O ATOM 0 H GLY A 35 6.507 -7.106 -10.476 1.00 1.00 H new ATOM 0 HA2 GLY A 35 3.638 -7.153 -11.283 1.00 1.00 H new ATOM 0 HA3 GLY A 35 4.969 -7.822 -12.206 1.00 1.00 H new ATOM 559 N SER A 36 4.895 -9.042 -9.219 1.00 1.00 N ATOM 560 CA SER A 36 4.790 -10.270 -8.428 1.00 1.00 C ATOM 561 C SER A 36 4.703 -9.942 -6.939 1.00 1.00 C ATOM 562 O SER A 36 5.002 -8.824 -6.522 1.00 1.00 O ATOM 563 CB SER A 36 5.999 -11.169 -8.687 1.00 1.00 C ATOM 564 OG SER A 36 7.195 -10.426 -8.490 1.00 1.00 O ATOM 0 H SER A 36 5.340 -8.262 -8.735 1.00 1.00 H new ATOM 0 HA SER A 36 3.882 -10.794 -8.727 1.00 1.00 H new ATOM 0 HB2 SER A 36 5.977 -12.028 -8.016 1.00 1.00 H new ATOM 0 HB3 SER A 36 5.964 -11.559 -9.704 1.00 1.00 H new ATOM 0 HG SER A 36 7.970 -11.003 -8.654 1.00 1.00 H new ATOM 570 N ALA A 37 4.266 -10.922 -6.150 1.00 1.00 N ATOM 571 CA ALA A 37 4.111 -10.731 -4.711 1.00 1.00 C ATOM 572 C ALA A 37 5.441 -10.868 -3.962 1.00 1.00 C ATOM 573 O ALA A 37 6.415 -11.416 -4.476 1.00 1.00 O ATOM 574 CB ALA A 37 3.098 -11.738 -4.158 1.00 1.00 C ATOM 0 H ALA A 37 4.014 -11.853 -6.482 1.00 1.00 H new ATOM 0 HA ALA A 37 3.749 -9.715 -4.554 1.00 1.00 H new ATOM 0 HB1 ALA A 37 2.987 -11.590 -3.084 1.00 1.00 H new ATOM 0 HB2 ALA A 37 2.135 -11.590 -4.646 1.00 1.00 H new ATOM 0 HB3 ALA A 37 3.450 -12.751 -4.350 1.00 1.00 H new ATOM 580 N ASN A 38 5.448 -10.340 -2.741 1.00 1.00 N ATOM 581 CA ASN A 38 6.619 -10.356 -1.863 1.00 1.00 C ATOM 582 C ASN A 38 7.795 -9.583 -2.454 1.00 1.00 C ATOM 583 O ASN A 38 8.666 -9.120 -1.718 1.00 1.00 O ATOM 584 CB ASN A 38 7.045 -11.780 -1.530 1.00 1.00 C ATOM 585 CG ASN A 38 8.064 -11.737 -0.395 1.00 1.00 C ATOM 586 OD1 ASN A 38 9.180 -12.237 -0.533 1.00 1.00 O ATOM 587 ND2 ASN A 38 7.741 -11.148 0.726 1.00 1.00 N ATOM 0 H ASN A 38 4.634 -9.884 -2.328 1.00 1.00 H new ATOM 0 HA ASN A 38 6.319 -9.856 -0.942 1.00 1.00 H new ATOM 0 HB2 ASN A 38 6.179 -12.374 -1.237 1.00 1.00 H new ATOM 0 HB3 ASN A 38 7.478 -12.259 -2.408 1.00 1.00 H new ATOM 0 HD21 ASN A 38 8.415 -11.102 1.490 1.00 1.00 H new ATOM 0 HD22 ASN A 38 6.815 -10.735 0.837 1.00 1.00 H new ATOM 594 N LYS A 39 7.810 -9.423 -3.769 1.00 1.00 N ATOM 595 CA LYS A 39 8.879 -8.679 -4.415 1.00 1.00 C ATOM 596 C LYS A 39 8.841 -7.243 -3.907 1.00 1.00 C ATOM 597 O LYS A 39 9.875 -6.602 -3.712 1.00 1.00 O ATOM 598 CB LYS A 39 8.681 -8.717 -5.935 1.00 1.00 C ATOM 599 CG LYS A 39 9.999 -8.390 -6.664 1.00 1.00 C ATOM 600 CD LYS A 39 10.833 -9.666 -6.842 1.00 1.00 C ATOM 601 CE LYS A 39 12.067 -9.355 -7.690 1.00 1.00 C ATOM 602 NZ LYS A 39 12.796 -10.621 -7.987 1.00 1.00 N ATOM 0 H LYS A 39 7.102 -9.794 -4.403 1.00 1.00 H new ATOM 0 HA LYS A 39 9.848 -9.121 -4.182 1.00 1.00 H new ATOM 0 HB2 LYS A 39 8.328 -9.703 -6.236 1.00 1.00 H new ATOM 0 HB3 LYS A 39 7.912 -8.001 -6.225 1.00 1.00 H new ATOM 0 HG2 LYS A 39 9.786 -7.947 -7.637 1.00 1.00 H new ATOM 0 HG3 LYS A 39 10.565 -7.652 -6.095 1.00 1.00 H new ATOM 0 HD2 LYS A 39 11.135 -10.054 -5.869 1.00 1.00 H new ATOM 0 HD3 LYS A 39 10.235 -10.440 -7.322 1.00 1.00 H new ATOM 0 HE2 LYS A 39 11.770 -8.867 -8.618 1.00 1.00 H new ATOM 0 HE3 LYS A 39 12.721 -8.662 -7.160 1.00 1.00 H new ATOM 0 HZ1 LYS A 39 13.636 -10.411 -8.564 1.00 1.00 H new ATOM 0 HZ2 LYS A 39 13.091 -11.069 -7.096 1.00 1.00 H new ATOM 0 HZ3 LYS A 39 12.170 -11.268 -8.509 1.00 1.00 H new ATOM 616 N ALA A 40 7.625 -6.758 -3.679 1.00 1.00 N ATOM 617 CA ALA A 40 7.412 -5.404 -3.174 1.00 1.00 C ATOM 618 C ALA A 40 7.531 -5.386 -1.657 1.00 1.00 C ATOM 619 O ALA A 40 7.895 -6.393 -1.051 1.00 1.00 O ATOM 620 CB ALA A 40 6.031 -4.912 -3.588 1.00 1.00 C ATOM 0 H ALA A 40 6.766 -7.285 -3.837 1.00 1.00 H new ATOM 0 HA ALA A 40 8.171 -4.745 -3.596 1.00 1.00 H new ATOM 0 HB1 ALA A 40 5.876 -3.902 -3.209 1.00 1.00 H new ATOM 0 HB2 ALA A 40 5.957 -4.907 -4.676 1.00 1.00 H new ATOM 0 HB3 ALA A 40 5.270 -5.575 -3.176 1.00 1.00 H new ATOM 626 N SER A 41 7.232 -4.236 -1.038 1.00 1.00 N ATOM 627 CA SER A 41 7.318 -4.118 0.423 1.00 1.00 C ATOM 628 C SER A 41 5.962 -3.749 1.014 1.00 1.00 C ATOM 629 O SER A 41 5.511 -4.367 1.978 1.00 1.00 O ATOM 630 CB SER A 41 8.365 -3.063 0.793 1.00 1.00 C ATOM 631 OG SER A 41 8.256 -1.964 -0.101 1.00 1.00 O ATOM 0 H SER A 41 6.933 -3.387 -1.517 1.00 1.00 H new ATOM 0 HA SER A 41 7.617 -5.081 0.837 1.00 1.00 H new ATOM 0 HB2 SER A 41 8.215 -2.729 1.820 1.00 1.00 H new ATOM 0 HB3 SER A 41 9.366 -3.492 0.741 1.00 1.00 H new ATOM 0 HG SER A 41 8.288 -2.289 -1.025 1.00 1.00 H new ATOM 637 N LEU A 42 5.306 -2.744 0.428 1.00 1.00 N ATOM 638 CA LEU A 42 3.986 -2.309 0.900 1.00 1.00 C ATOM 639 C LEU A 42 2.934 -2.493 -0.188 1.00 1.00 C ATOM 640 O LEU A 42 3.056 -1.970 -1.295 1.00 1.00 O ATOM 641 CB LEU A 42 4.031 -0.834 1.347 1.00 1.00 C ATOM 642 CG LEU A 42 4.514 -0.734 2.808 1.00 1.00 C ATOM 643 CD1 LEU A 42 5.928 -1.331 2.941 1.00 1.00 C ATOM 644 CD2 LEU A 42 4.509 0.743 3.265 1.00 1.00 C ATOM 0 H LEU A 42 5.663 -2.218 -0.369 1.00 1.00 H new ATOM 0 HA LEU A 42 3.713 -2.928 1.755 1.00 1.00 H new ATOM 0 HB2 LEU A 42 4.699 -0.270 0.696 1.00 1.00 H new ATOM 0 HB3 LEU A 42 3.041 -0.387 1.252 1.00 1.00 H new ATOM 0 HG LEU A 42 3.836 -1.301 3.446 1.00 1.00 H new ATOM 0 HD11 LEU A 42 6.259 -1.255 3.977 1.00 1.00 H new ATOM 0 HD12 LEU A 42 5.910 -2.379 2.642 1.00 1.00 H new ATOM 0 HD13 LEU A 42 6.617 -0.782 2.299 1.00 1.00 H new ATOM 0 HD21 LEU A 42 4.851 0.805 4.298 1.00 1.00 H new ATOM 0 HD22 LEU A 42 5.175 1.324 2.626 1.00 1.00 H new ATOM 0 HD23 LEU A 42 3.497 1.143 3.193 1.00 1.00 H new ATOM 656 N CYS A 43 1.895 -3.233 0.165 1.00 1.00 N ATOM 657 CA CYS A 43 0.780 -3.504 -0.741 1.00 1.00 C ATOM 658 C CYS A 43 -0.291 -2.419 -0.595 1.00 1.00 C ATOM 659 O CYS A 43 -0.614 -2.017 0.523 1.00 1.00 O ATOM 660 CB CYS A 43 0.174 -4.876 -0.424 1.00 1.00 C ATOM 661 SG CYS A 43 -1.440 -5.037 -1.234 1.00 1.00 S ATOM 0 H CYS A 43 1.797 -3.664 1.084 1.00 1.00 H new ATOM 0 HA CYS A 43 1.149 -3.503 -1.767 1.00 1.00 H new ATOM 0 HB2 CYS A 43 0.843 -5.667 -0.765 1.00 1.00 H new ATOM 0 HB3 CYS A 43 0.064 -4.995 0.654 1.00 1.00 H new ATOM 0 HG CYS A 43 -2.126 -5.975 -0.651 1.00 1.00 H new ATOM 667 N ILE A 44 -0.844 -1.947 -1.718 1.00 1.00 N ATOM 668 CA ILE A 44 -1.880 -0.908 -1.667 1.00 1.00 C ATOM 669 C ILE A 44 -3.274 -1.533 -1.618 1.00 1.00 C ATOM 670 O ILE A 44 -3.767 -2.075 -2.607 1.00 1.00 O ATOM 671 CB ILE A 44 -1.781 0.010 -2.904 1.00 1.00 C ATOM 672 CG1 ILE A 44 -0.454 0.801 -2.886 1.00 1.00 C ATOM 673 CG2 ILE A 44 -2.967 0.984 -2.923 1.00 1.00 C ATOM 674 CD1 ILE A 44 -0.529 2.023 -1.945 1.00 1.00 C ATOM 0 H ILE A 44 -0.598 -2.260 -2.657 1.00 1.00 H new ATOM 0 HA ILE A 44 -1.720 -0.321 -0.763 1.00 1.00 H new ATOM 0 HB ILE A 44 -1.806 -0.608 -3.801 1.00 1.00 H new ATOM 0 HG12 ILE A 44 0.356 0.145 -2.567 1.00 1.00 H new ATOM 0 HG13 ILE A 44 -0.215 1.134 -3.896 1.00 1.00 H new ATOM 0 HG21 ILE A 44 -2.893 1.630 -3.798 1.00 1.00 H new ATOM 0 HG22 ILE A 44 -3.899 0.421 -2.965 1.00 1.00 H new ATOM 0 HG23 ILE A 44 -2.952 1.593 -2.019 1.00 1.00 H new ATOM 0 HD11 ILE A 44 0.423 2.553 -1.960 1.00 1.00 H new ATOM 0 HD12 ILE A 44 -1.322 2.692 -2.280 1.00 1.00 H new ATOM 0 HD13 ILE A 44 -0.742 1.688 -0.930 1.00 1.00 H new ATOM 686 N SER A 45 -3.907 -1.424 -0.453 1.00 1.00 N ATOM 687 CA SER A 45 -5.258 -1.944 -0.253 1.00 1.00 C ATOM 688 C SER A 45 -5.887 -1.304 0.980 1.00 1.00 C ATOM 689 O SER A 45 -5.181 -0.835 1.870 1.00 1.00 O ATOM 690 CB SER A 45 -5.228 -3.462 -0.087 1.00 1.00 C ATOM 691 OG SER A 45 -4.534 -4.040 -1.184 1.00 1.00 O ATOM 0 H SER A 45 -3.504 -0.978 0.371 1.00 1.00 H new ATOM 0 HA SER A 45 -5.856 -1.698 -1.131 1.00 1.00 H new ATOM 0 HB2 SER A 45 -4.737 -3.727 0.849 1.00 1.00 H new ATOM 0 HB3 SER A 45 -6.244 -3.854 -0.037 1.00 1.00 H new ATOM 0 HG SER A 45 -3.613 -4.243 -0.918 1.00 1.00 H new ATOM 697 N THR A 46 -7.219 -1.286 1.027 1.00 1.00 N ATOM 698 CA THR A 46 -7.947 -0.704 2.162 1.00 1.00 C ATOM 699 C THR A 46 -8.670 -1.799 2.934 1.00 1.00 C ATOM 700 O THR A 46 -8.796 -2.921 2.448 1.00 1.00 O ATOM 701 CB THR A 46 -8.971 0.312 1.647 1.00 1.00 C ATOM 702 OG1 THR A 46 -9.959 -0.361 0.882 1.00 1.00 O ATOM 703 CG2 THR A 46 -8.265 1.347 0.772 1.00 1.00 C ATOM 0 H THR A 46 -7.818 -1.667 0.295 1.00 1.00 H new ATOM 0 HA THR A 46 -7.236 -0.208 2.823 1.00 1.00 H new ATOM 0 HB THR A 46 -9.444 0.813 2.491 1.00 1.00 H new ATOM 0 HG1 THR A 46 -10.616 0.288 0.553 1.00 1.00 H new ATOM 0 HG21 THR A 46 -8.993 2.071 0.405 1.00 1.00 H new ATOM 0 HG22 THR A 46 -7.505 1.863 1.359 1.00 1.00 H new ATOM 0 HG23 THR A 46 -7.792 0.847 -0.073 1.00 1.00 H new ATOM 711 N LYS A 47 -9.167 -1.476 4.127 1.00 1.00 N ATOM 712 CA LYS A 47 -9.878 -2.466 4.917 1.00 1.00 C ATOM 713 C LYS A 47 -10.951 -3.133 4.073 1.00 1.00 C ATOM 714 O LYS A 47 -11.054 -4.348 4.059 1.00 1.00 O ATOM 715 CB LYS A 47 -10.545 -1.774 6.129 1.00 1.00 C ATOM 716 CG LYS A 47 -9.746 -2.021 7.406 1.00 1.00 C ATOM 717 CD LYS A 47 -10.065 -3.411 7.970 1.00 1.00 C ATOM 718 CE LYS A 47 -8.997 -3.785 8.994 1.00 1.00 C ATOM 719 NZ LYS A 47 -9.393 -5.030 9.711 1.00 1.00 N ATOM 0 H LYS A 47 -9.091 -0.554 4.557 1.00 1.00 H new ATOM 0 HA LYS A 47 -9.170 -3.220 5.262 1.00 1.00 H new ATOM 0 HB2 LYS A 47 -10.621 -0.702 5.944 1.00 1.00 H new ATOM 0 HB3 LYS A 47 -11.561 -2.149 6.253 1.00 1.00 H new ATOM 0 HG2 LYS A 47 -8.679 -1.941 7.197 1.00 1.00 H new ATOM 0 HG3 LYS A 47 -9.984 -1.257 8.146 1.00 1.00 H new ATOM 0 HD2 LYS A 47 -11.051 -3.412 8.436 1.00 1.00 H new ATOM 0 HD3 LYS A 47 -10.091 -4.147 7.167 1.00 1.00 H new ATOM 0 HE2 LYS A 47 -8.039 -3.932 8.495 1.00 1.00 H new ATOM 0 HE3 LYS A 47 -8.864 -2.971 9.707 1.00 1.00 H new ATOM 0 HZ1 LYS A 47 -8.661 -5.278 10.406 1.00 1.00 H new ATOM 0 HZ2 LYS A 47 -10.297 -4.876 10.201 1.00 1.00 H new ATOM 0 HZ3 LYS A 47 -9.498 -5.806 9.027 1.00 1.00 H new ATOM 733 N LYS A 48 -11.736 -2.329 3.369 1.00 1.00 N ATOM 734 CA LYS A 48 -12.810 -2.861 2.535 1.00 1.00 C ATOM 735 C LYS A 48 -12.359 -4.145 1.844 1.00 1.00 C ATOM 736 O LYS A 48 -13.092 -5.129 1.820 1.00 1.00 O ATOM 737 CB LYS A 48 -13.215 -1.821 1.488 1.00 1.00 C ATOM 738 CG LYS A 48 -13.772 -0.584 2.201 1.00 1.00 C ATOM 739 CD LYS A 48 -14.178 0.490 1.172 1.00 1.00 C ATOM 740 CE LYS A 48 -15.621 0.254 0.710 1.00 1.00 C ATOM 741 NZ LYS A 48 -16.549 0.589 1.827 1.00 1.00 N ATOM 0 H LYS A 48 -11.652 -1.313 3.357 1.00 1.00 H new ATOM 0 HA LYS A 48 -13.668 -3.088 3.168 1.00 1.00 H new ATOM 0 HB2 LYS A 48 -12.355 -1.548 0.877 1.00 1.00 H new ATOM 0 HB3 LYS A 48 -13.965 -2.237 0.815 1.00 1.00 H new ATOM 0 HG2 LYS A 48 -14.635 -0.862 2.806 1.00 1.00 H new ATOM 0 HG3 LYS A 48 -13.023 -0.180 2.882 1.00 1.00 H new ATOM 0 HD2 LYS A 48 -14.087 1.482 1.614 1.00 1.00 H new ATOM 0 HD3 LYS A 48 -13.504 0.459 0.316 1.00 1.00 H new ATOM 0 HE2 LYS A 48 -15.843 0.870 -0.161 1.00 1.00 H new ATOM 0 HE3 LYS A 48 -15.755 -0.785 0.408 1.00 1.00 H new ATOM 0 HZ1 LYS A 48 -17.470 0.878 1.439 1.00 1.00 H new ATOM 0 HZ2 LYS A 48 -16.676 -0.245 2.435 1.00 1.00 H new ATOM 0 HZ3 LYS A 48 -16.150 1.369 2.388 1.00 1.00 H new ATOM 755 N GLU A 49 -11.138 -4.140 1.322 1.00 1.00 N ATOM 756 CA GLU A 49 -10.600 -5.325 0.671 1.00 1.00 C ATOM 757 C GLU A 49 -10.286 -6.405 1.716 1.00 1.00 C ATOM 758 O GLU A 49 -10.575 -7.583 1.511 1.00 1.00 O ATOM 759 CB GLU A 49 -9.316 -4.965 -0.080 1.00 1.00 C ATOM 760 CG GLU A 49 -9.614 -3.861 -1.097 1.00 1.00 C ATOM 761 CD GLU A 49 -10.599 -4.357 -2.152 1.00 1.00 C ATOM 762 OE1 GLU A 49 -10.730 -5.561 -2.296 1.00 1.00 O ATOM 763 OE2 GLU A 49 -11.219 -3.523 -2.789 1.00 1.00 O ATOM 0 H GLU A 49 -10.509 -3.337 1.337 1.00 1.00 H new ATOM 0 HA GLU A 49 -11.342 -5.706 -0.031 1.00 1.00 H new ATOM 0 HB2 GLU A 49 -8.552 -4.631 0.622 1.00 1.00 H new ATOM 0 HB3 GLU A 49 -8.920 -5.845 -0.587 1.00 1.00 H new ATOM 0 HG2 GLU A 49 -10.026 -2.990 -0.587 1.00 1.00 H new ATOM 0 HG3 GLU A 49 -8.689 -3.541 -1.577 1.00 1.00 H new ATOM 770 N VAL A 50 -9.675 -5.984 2.831 1.00 1.00 N ATOM 771 CA VAL A 50 -9.301 -6.910 3.905 1.00 1.00 C ATOM 772 C VAL A 50 -10.539 -7.481 4.606 1.00 1.00 C ATOM 773 O VAL A 50 -10.475 -8.503 5.264 1.00 1.00 O ATOM 774 CB VAL A 50 -8.406 -6.215 4.935 1.00 1.00 C ATOM 775 CG1 VAL A 50 -7.745 -7.262 5.834 1.00 1.00 C ATOM 776 CG2 VAL A 50 -7.320 -5.398 4.226 1.00 1.00 C ATOM 0 H VAL A 50 -9.430 -5.010 3.012 1.00 1.00 H new ATOM 0 HA VAL A 50 -8.750 -7.731 3.447 1.00 1.00 H new ATOM 0 HB VAL A 50 -9.020 -5.547 5.539 1.00 1.00 H new ATOM 0 HG11 VAL A 50 -7.109 -6.764 6.566 1.00 1.00 H new ATOM 0 HG12 VAL A 50 -8.514 -7.835 6.352 1.00 1.00 H new ATOM 0 HG13 VAL A 50 -7.140 -7.934 5.226 1.00 1.00 H new ATOM 0 HG21 VAL A 50 -6.690 -4.908 4.969 1.00 1.00 H new ATOM 0 HG22 VAL A 50 -6.710 -6.060 3.612 1.00 1.00 H new ATOM 0 HG23 VAL A 50 -7.787 -4.644 3.593 1.00 1.00 H new ATOM 786 N GLU A 51 -11.671 -6.824 4.490 1.00 1.00 N ATOM 787 CA GLU A 51 -12.856 -7.340 5.134 1.00 1.00 C ATOM 788 C GLU A 51 -13.245 -8.654 4.457 1.00 1.00 C ATOM 789 O GLU A 51 -13.685 -9.603 5.106 1.00 1.00 O ATOM 790 CB GLU A 51 -14.000 -6.329 5.012 1.00 1.00 C ATOM 791 CG GLU A 51 -13.699 -5.085 5.862 1.00 1.00 C ATOM 792 CD GLU A 51 -14.838 -4.081 5.724 1.00 1.00 C ATOM 793 OE1 GLU A 51 -15.311 -3.901 4.614 1.00 1.00 O ATOM 794 OE2 GLU A 51 -15.225 -3.510 6.730 1.00 1.00 O ATOM 0 H GLU A 51 -11.796 -5.955 3.971 1.00 1.00 H new ATOM 0 HA GLU A 51 -12.658 -7.512 6.192 1.00 1.00 H new ATOM 0 HB2 GLU A 51 -14.133 -6.043 3.969 1.00 1.00 H new ATOM 0 HB3 GLU A 51 -14.935 -6.785 5.339 1.00 1.00 H new ATOM 0 HG2 GLU A 51 -13.575 -5.368 6.907 1.00 1.00 H new ATOM 0 HG3 GLU A 51 -12.761 -4.632 5.541 1.00 1.00 H new ATOM 801 N LYS A 52 -13.087 -8.668 3.135 1.00 1.00 N ATOM 802 CA LYS A 52 -13.427 -9.825 2.307 1.00 1.00 C ATOM 803 C LYS A 52 -12.456 -10.995 2.499 1.00 1.00 C ATOM 804 O LYS A 52 -12.867 -12.153 2.564 1.00 1.00 O ATOM 805 CB LYS A 52 -13.408 -9.409 0.830 1.00 1.00 C ATOM 806 CG LYS A 52 -13.974 -8.007 0.708 1.00 1.00 C ATOM 807 CD LYS A 52 -14.156 -7.654 -0.762 1.00 1.00 C ATOM 808 CE LYS A 52 -14.749 -6.255 -0.866 1.00 1.00 C ATOM 809 NZ LYS A 52 -16.178 -6.283 -0.446 1.00 1.00 N ATOM 0 H LYS A 52 -12.719 -7.877 2.606 1.00 1.00 H new ATOM 0 HA LYS A 52 -14.418 -10.162 2.613 1.00 1.00 H new ATOM 0 HB2 LYS A 52 -12.390 -9.440 0.443 1.00 1.00 H new ATOM 0 HB3 LYS A 52 -13.997 -10.107 0.234 1.00 1.00 H new ATOM 0 HG2 LYS A 52 -14.930 -7.944 1.228 1.00 1.00 H new ATOM 0 HG3 LYS A 52 -13.304 -7.291 1.184 1.00 1.00 H new ATOM 0 HD2 LYS A 52 -13.198 -7.697 -1.281 1.00 1.00 H new ATOM 0 HD3 LYS A 52 -14.812 -8.378 -1.245 1.00 1.00 H new ATOM 0 HE2 LYS A 52 -14.188 -5.564 -0.236 1.00 1.00 H new ATOM 0 HE3 LYS A 52 -14.668 -5.890 -1.890 1.00 1.00 H new ATOM 0 HZ1 LYS A 52 -16.651 -5.414 -0.767 1.00 1.00 H new ATOM 0 HZ2 LYS A 52 -16.648 -7.109 -0.868 1.00 1.00 H new ATOM 0 HZ3 LYS A 52 -16.234 -6.345 0.591 1.00 1.00 H new ATOM 823 N MET A 53 -11.161 -10.676 2.525 1.00 1.00 N ATOM 824 CA MET A 53 -10.116 -11.696 2.634 1.00 1.00 C ATOM 825 C MET A 53 -10.339 -12.747 1.557 1.00 1.00 C ATOM 826 O MET A 53 -10.524 -13.930 1.841 1.00 1.00 O ATOM 827 CB MET A 53 -10.090 -12.352 4.022 1.00 1.00 C ATOM 828 CG MET A 53 -9.976 -11.272 5.105 1.00 1.00 C ATOM 829 SD MET A 53 -8.673 -10.086 4.668 1.00 1.00 S ATOM 830 CE MET A 53 -7.401 -10.581 5.830 1.00 1.00 C ATOM 0 H MET A 53 -10.810 -9.720 2.472 1.00 1.00 H new ATOM 0 HA MET A 53 -9.149 -11.213 2.495 1.00 1.00 H new ATOM 0 HB2 MET A 53 -10.996 -12.938 4.174 1.00 1.00 H new ATOM 0 HB3 MET A 53 -9.249 -13.041 4.093 1.00 1.00 H new ATOM 0 HG2 MET A 53 -10.929 -10.754 5.214 1.00 1.00 H new ATOM 0 HG3 MET A 53 -9.752 -11.733 6.067 1.00 1.00 H new ATOM 0 HE1 MET A 53 -6.481 -10.036 5.616 1.00 1.00 H new ATOM 0 HE2 MET A 53 -7.728 -10.356 6.845 1.00 1.00 H new ATOM 0 HE3 MET A 53 -7.219 -11.652 5.736 1.00 1.00 H new ATOM 840 N SER A 54 -10.321 -12.278 0.315 1.00 1.00 N ATOM 841 CA SER A 54 -10.523 -13.146 -0.841 1.00 1.00 C ATOM 842 C SER A 54 -9.239 -13.890 -1.191 1.00 1.00 C ATOM 843 O SER A 54 -8.241 -13.799 -0.477 1.00 1.00 O ATOM 844 CB SER A 54 -10.959 -12.314 -2.047 1.00 1.00 C ATOM 845 OG SER A 54 -12.187 -11.661 -1.754 1.00 1.00 O ATOM 0 H SER A 54 -10.168 -11.297 0.081 1.00 1.00 H new ATOM 0 HA SER A 54 -11.297 -13.871 -0.589 1.00 1.00 H new ATOM 0 HB2 SER A 54 -10.193 -11.578 -2.291 1.00 1.00 H new ATOM 0 HB3 SER A 54 -11.075 -12.955 -2.921 1.00 1.00 H new ATOM 0 HG SER A 54 -12.466 -11.126 -2.527 1.00 1.00 H new ATOM 851 N LYS A 55 -9.273 -14.617 -2.303 1.00 1.00 N ATOM 852 CA LYS A 55 -8.105 -15.366 -2.750 1.00 1.00 C ATOM 853 C LYS A 55 -6.944 -14.415 -3.007 1.00 1.00 C ATOM 854 O LYS A 55 -5.795 -14.737 -2.723 1.00 1.00 O ATOM 855 CB LYS A 55 -8.421 -16.137 -4.033 1.00 1.00 C ATOM 856 CG LYS A 55 -9.390 -17.286 -3.730 1.00 1.00 C ATOM 857 CD LYS A 55 -9.774 -18.011 -5.030 1.00 1.00 C ATOM 858 CE LYS A 55 -8.647 -18.961 -5.458 1.00 1.00 C ATOM 859 NZ LYS A 55 -9.086 -19.757 -6.638 1.00 1.00 N ATOM 0 H LYS A 55 -10.090 -14.703 -2.907 1.00 1.00 H new ATOM 0 HA LYS A 55 -7.831 -16.074 -1.968 1.00 1.00 H new ATOM 0 HB2 LYS A 55 -8.860 -15.466 -4.772 1.00 1.00 H new ATOM 0 HB3 LYS A 55 -7.501 -16.531 -4.466 1.00 1.00 H new ATOM 0 HG2 LYS A 55 -8.928 -17.988 -3.036 1.00 1.00 H new ATOM 0 HG3 LYS A 55 -10.285 -16.898 -3.243 1.00 1.00 H new ATOM 0 HD2 LYS A 55 -10.697 -18.572 -4.883 1.00 1.00 H new ATOM 0 HD3 LYS A 55 -9.965 -17.283 -5.818 1.00 1.00 H new ATOM 0 HE2 LYS A 55 -7.751 -18.391 -5.704 1.00 1.00 H new ATOM 0 HE3 LYS A 55 -8.386 -19.626 -4.635 1.00 1.00 H new ATOM 0 HZ1 LYS A 55 -8.321 -20.400 -6.927 1.00 1.00 H new ATOM 0 HZ2 LYS A 55 -9.929 -20.312 -6.388 1.00 1.00 H new ATOM 0 HZ3 LYS A 55 -9.314 -19.115 -7.424 1.00 1.00 H new ATOM 873 N LYS A 56 -7.252 -13.247 -3.552 1.00 1.00 N ATOM 874 CA LYS A 56 -6.231 -12.255 -3.849 1.00 1.00 C ATOM 875 C LYS A 56 -5.526 -11.834 -2.560 1.00 1.00 C ATOM 876 O LYS A 56 -4.309 -11.655 -2.538 1.00 1.00 O ATOM 877 CB LYS A 56 -6.878 -11.022 -4.500 1.00 1.00 C ATOM 878 CG LYS A 56 -7.587 -11.376 -5.824 1.00 1.00 C ATOM 879 CD LYS A 56 -6.586 -11.791 -6.915 1.00 1.00 C ATOM 880 CE LYS A 56 -7.355 -12.087 -8.204 1.00 1.00 C ATOM 881 NZ LYS A 56 -6.403 -12.489 -9.277 1.00 1.00 N ATOM 0 H LYS A 56 -8.201 -12.964 -3.797 1.00 1.00 H new ATOM 0 HA LYS A 56 -5.504 -12.690 -4.535 1.00 1.00 H new ATOM 0 HB2 LYS A 56 -7.597 -10.582 -3.809 1.00 1.00 H new ATOM 0 HB3 LYS A 56 -6.114 -10.268 -4.688 1.00 1.00 H new ATOM 0 HG2 LYS A 56 -8.294 -12.187 -5.652 1.00 1.00 H new ATOM 0 HG3 LYS A 56 -8.164 -10.518 -6.168 1.00 1.00 H new ATOM 0 HD2 LYS A 56 -5.860 -10.996 -7.083 1.00 1.00 H new ATOM 0 HD3 LYS A 56 -6.027 -12.671 -6.599 1.00 1.00 H new ATOM 0 HE2 LYS A 56 -8.080 -12.882 -8.031 1.00 1.00 H new ATOM 0 HE3 LYS A 56 -7.916 -11.206 -8.514 1.00 1.00 H new ATOM 0 HZ1 LYS A 56 -6.930 -12.689 -10.151 1.00 1.00 H new ATOM 0 HZ2 LYS A 56 -5.727 -11.717 -9.449 1.00 1.00 H new ATOM 0 HZ3 LYS A 56 -5.886 -13.342 -8.981 1.00 1.00 H new ATOM 895 N MET A 57 -6.297 -11.680 -1.487 1.00 1.00 N ATOM 896 CA MET A 57 -5.739 -11.291 -0.197 1.00 1.00 C ATOM 897 C MET A 57 -4.795 -12.374 0.323 1.00 1.00 C ATOM 898 O MET A 57 -3.741 -12.083 0.889 1.00 1.00 O ATOM 899 CB MET A 57 -6.886 -11.045 0.803 1.00 1.00 C ATOM 900 CG MET A 57 -6.550 -9.870 1.727 1.00 1.00 C ATOM 901 SD MET A 57 -4.981 -10.179 2.579 1.00 1.00 S ATOM 902 CE MET A 57 -5.478 -11.659 3.498 1.00 1.00 C ATOM 0 H MET A 57 -7.308 -11.818 -1.486 1.00 1.00 H new ATOM 0 HA MET A 57 -5.166 -10.372 -0.315 1.00 1.00 H new ATOM 0 HB2 MET A 57 -7.809 -10.837 0.262 1.00 1.00 H new ATOM 0 HB3 MET A 57 -7.059 -11.943 1.396 1.00 1.00 H new ATOM 0 HG2 MET A 57 -6.483 -8.949 1.148 1.00 1.00 H new ATOM 0 HG3 MET A 57 -7.348 -9.731 2.456 1.00 1.00 H new ATOM 0 HE1 MET A 57 -5.148 -11.572 4.533 1.00 1.00 H new ATOM 0 HE2 MET A 57 -6.563 -11.757 3.470 1.00 1.00 H new ATOM 0 HE3 MET A 57 -5.022 -12.539 3.044 1.00 1.00 H new ATOM 912 N GLU A 58 -5.189 -13.626 0.128 1.00 1.00 N ATOM 913 CA GLU A 58 -4.378 -14.751 0.583 1.00 1.00 C ATOM 914 C GLU A 58 -2.979 -14.664 -0.026 1.00 1.00 C ATOM 915 O GLU A 58 -1.997 -15.053 0.602 1.00 1.00 O ATOM 916 CB GLU A 58 -5.033 -16.069 0.161 1.00 1.00 C ATOM 917 CG GLU A 58 -6.355 -16.250 0.911 1.00 1.00 C ATOM 918 CD GLU A 58 -7.068 -17.502 0.411 1.00 1.00 C ATOM 919 OE1 GLU A 58 -6.467 -18.234 -0.358 1.00 1.00 O ATOM 920 OE2 GLU A 58 -8.211 -17.700 0.788 1.00 1.00 O ATOM 0 H GLU A 58 -6.058 -13.888 -0.338 1.00 1.00 H new ATOM 0 HA GLU A 58 -4.303 -14.714 1.670 1.00 1.00 H new ATOM 0 HB2 GLU A 58 -5.211 -16.070 -0.914 1.00 1.00 H new ATOM 0 HB3 GLU A 58 -4.365 -16.903 0.375 1.00 1.00 H new ATOM 0 HG2 GLU A 58 -6.168 -16.331 1.982 1.00 1.00 H new ATOM 0 HG3 GLU A 58 -6.990 -15.376 0.763 1.00 1.00 H new ATOM 927 N GLU A 59 -2.896 -14.152 -1.251 1.00 1.00 N ATOM 928 CA GLU A 59 -1.611 -14.018 -1.935 1.00 1.00 C ATOM 929 C GLU A 59 -0.729 -13.032 -1.175 1.00 1.00 C ATOM 930 O GLU A 59 0.451 -13.290 -0.931 1.00 1.00 O ATOM 931 CB GLU A 59 -1.838 -13.482 -3.357 1.00 1.00 C ATOM 932 CG GLU A 59 -2.899 -14.341 -4.098 1.00 1.00 C ATOM 933 CD GLU A 59 -2.258 -15.471 -4.911 1.00 1.00 C ATOM 934 OE1 GLU A 59 -1.050 -15.464 -5.077 1.00 1.00 O ATOM 935 OE2 GLU A 59 -2.999 -16.322 -5.375 1.00 1.00 O ATOM 0 H GLU A 59 -3.698 -13.824 -1.789 1.00 1.00 H new ATOM 0 HA GLU A 59 -1.127 -14.993 -1.979 1.00 1.00 H new ATOM 0 HB2 GLU A 59 -2.168 -12.444 -3.313 1.00 1.00 H new ATOM 0 HB3 GLU A 59 -0.899 -13.495 -3.911 1.00 1.00 H new ATOM 0 HG2 GLU A 59 -3.593 -14.765 -3.372 1.00 1.00 H new ATOM 0 HG3 GLU A 59 -3.483 -13.703 -4.762 1.00 1.00 H new ATOM 942 N VAL A 60 -1.324 -11.902 -0.795 1.00 1.00 N ATOM 943 CA VAL A 60 -0.607 -10.867 -0.051 1.00 1.00 C ATOM 944 C VAL A 60 -0.166 -11.405 1.309 1.00 1.00 C ATOM 945 O VAL A 60 0.980 -11.228 1.723 1.00 1.00 O ATOM 946 CB VAL A 60 -1.534 -9.650 0.138 1.00 1.00 C ATOM 947 CG1 VAL A 60 -0.905 -8.647 1.109 1.00 1.00 C ATOM 948 CG2 VAL A 60 -1.762 -8.963 -1.215 1.00 1.00 C ATOM 0 H VAL A 60 -2.300 -11.680 -0.990 1.00 1.00 H new ATOM 0 HA VAL A 60 0.281 -10.568 -0.608 1.00 1.00 H new ATOM 0 HB VAL A 60 -2.484 -9.995 0.545 1.00 1.00 H new ATOM 0 HG11 VAL A 60 -1.571 -7.793 1.232 1.00 1.00 H new ATOM 0 HG12 VAL A 60 -0.747 -9.126 2.075 1.00 1.00 H new ATOM 0 HG13 VAL A 60 0.051 -8.307 0.712 1.00 1.00 H new ATOM 0 HG21 VAL A 60 -2.418 -8.103 -1.080 1.00 1.00 H new ATOM 0 HG22 VAL A 60 -0.806 -8.631 -1.620 1.00 1.00 H new ATOM 0 HG23 VAL A 60 -2.225 -9.667 -1.907 1.00 1.00 H new ATOM 958 N LYS A 61 -1.093 -12.067 1.983 1.00 1.00 N ATOM 959 CA LYS A 61 -0.837 -12.655 3.294 1.00 1.00 C ATOM 960 C LYS A 61 0.245 -13.728 3.228 1.00 1.00 C ATOM 961 O LYS A 61 1.130 -13.784 4.083 1.00 1.00 O ATOM 962 CB LYS A 61 -2.151 -13.246 3.807 1.00 1.00 C ATOM 963 CG LYS A 61 -1.961 -13.958 5.150 1.00 1.00 C ATOM 964 CD LYS A 61 -3.310 -14.536 5.582 1.00 1.00 C ATOM 965 CE LYS A 61 -3.142 -15.362 6.855 1.00 1.00 C ATOM 966 NZ LYS A 61 -2.707 -14.488 7.982 1.00 1.00 N ATOM 0 H LYS A 61 -2.043 -12.213 1.640 1.00 1.00 H new ATOM 0 HA LYS A 61 -0.472 -11.885 3.974 1.00 1.00 H new ATOM 0 HB2 LYS A 61 -2.890 -12.452 3.916 1.00 1.00 H new ATOM 0 HB3 LYS A 61 -2.545 -13.950 3.074 1.00 1.00 H new ATOM 0 HG2 LYS A 61 -1.220 -14.752 5.057 1.00 1.00 H new ATOM 0 HG3 LYS A 61 -1.589 -13.260 5.900 1.00 1.00 H new ATOM 0 HD2 LYS A 61 -4.022 -13.729 5.754 1.00 1.00 H new ATOM 0 HD3 LYS A 61 -3.720 -15.158 4.786 1.00 1.00 H new ATOM 0 HE2 LYS A 61 -4.083 -15.851 7.107 1.00 1.00 H new ATOM 0 HE3 LYS A 61 -2.407 -16.150 6.692 1.00 1.00 H new ATOM 0 HZ1 LYS A 61 -2.791 -15.009 8.878 1.00 1.00 H new ATOM 0 HZ2 LYS A 61 -1.717 -14.204 7.839 1.00 1.00 H new ATOM 0 HZ3 LYS A 61 -3.309 -13.641 8.017 1.00 1.00 H new ATOM 980 N ALA A 62 0.162 -14.585 2.222 1.00 1.00 N ATOM 981 CA ALA A 62 1.132 -15.663 2.058 1.00 1.00 C ATOM 982 C ALA A 62 2.379 -15.161 1.346 1.00 1.00 C ATOM 983 O ALA A 62 3.299 -15.931 1.070 1.00 1.00 O ATOM 984 CB ALA A 62 0.503 -16.807 1.262 1.00 1.00 C ATOM 0 H ALA A 62 -0.565 -14.557 1.507 1.00 1.00 H new ATOM 0 HA ALA A 62 1.421 -16.024 3.045 1.00 1.00 H new ATOM 0 HB1 ALA A 62 1.231 -17.610 1.142 1.00 1.00 H new ATOM 0 HB2 ALA A 62 -0.369 -17.185 1.795 1.00 1.00 H new ATOM 0 HB3 ALA A 62 0.199 -16.443 0.281 1.00 1.00 H new ATOM 990 N ALA A 63 2.413 -13.861 1.046 1.00 1.00 N ATOM 991 CA ALA A 63 3.560 -13.262 0.365 1.00 1.00 C ATOM 992 C ALA A 63 4.378 -12.435 1.345 1.00 1.00 C ATOM 993 O ALA A 63 5.493 -12.016 1.038 1.00 1.00 O ATOM 994 CB ALA A 63 3.079 -12.381 -0.788 1.00 1.00 C ATOM 0 H ALA A 63 1.662 -13.206 1.263 1.00 1.00 H new ATOM 0 HA ALA A 63 4.189 -14.058 -0.034 1.00 1.00 H new ATOM 0 HB1 ALA A 63 3.939 -11.938 -1.291 1.00 1.00 H new ATOM 0 HB2 ALA A 63 2.516 -12.986 -1.498 1.00 1.00 H new ATOM 0 HB3 ALA A 63 2.439 -11.589 -0.398 1.00 1.00 H new ATOM 1000 N ASN A 64 3.820 -12.222 2.531 1.00 1.00 N ATOM 1001 CA ASN A 64 4.504 -11.460 3.565 1.00 1.00 C ATOM 1002 C ASN A 64 4.762 -10.020 3.129 1.00 1.00 C ATOM 1003 O ASN A 64 5.907 -9.569 3.080 1.00 1.00 O ATOM 1004 CB ASN A 64 5.827 -12.146 3.928 1.00 1.00 C ATOM 1005 CG ASN A 64 6.264 -11.729 5.328 1.00 1.00 C ATOM 1006 OD1 ASN A 64 7.448 -11.484 5.565 1.00 1.00 O ATOM 1007 ND2 ASN A 64 5.370 -11.636 6.272 1.00 1.00 N ATOM 0 H ASN A 64 2.898 -12.566 2.799 1.00 1.00 H new ATOM 0 HA ASN A 64 3.856 -11.428 4.441 1.00 1.00 H new ATOM 0 HB2 ASN A 64 5.709 -13.229 3.882 1.00 1.00 H new ATOM 0 HB3 ASN A 64 6.596 -11.878 3.203 1.00 1.00 H new ATOM 0 HD21 ASN A 64 5.649 -11.359 7.213 1.00 1.00 H new ATOM 0 HD22 ASN A 64 4.391 -11.840 6.069 1.00 1.00 H new ATOM 1014 N VAL A 65 3.685 -9.299 2.828 1.00 1.00 N ATOM 1015 CA VAL A 65 3.782 -7.899 2.416 1.00 1.00 C ATOM 1016 C VAL A 65 2.856 -7.049 3.279 1.00 1.00 C ATOM 1017 O VAL A 65 1.663 -7.327 3.378 1.00 1.00 O ATOM 1018 CB VAL A 65 3.378 -7.770 0.944 1.00 1.00 C ATOM 1019 CG1 VAL A 65 3.449 -6.307 0.491 1.00 1.00 C ATOM 1020 CG2 VAL A 65 4.336 -8.590 0.092 1.00 1.00 C ATOM 0 H VAL A 65 2.732 -9.661 2.861 1.00 1.00 H new ATOM 0 HA VAL A 65 4.808 -7.554 2.540 1.00 1.00 H new ATOM 0 HB VAL A 65 2.356 -8.130 0.829 1.00 1.00 H new ATOM 0 HG11 VAL A 65 3.158 -6.236 -0.557 1.00 1.00 H new ATOM 0 HG12 VAL A 65 2.772 -5.705 1.097 1.00 1.00 H new ATOM 0 HG13 VAL A 65 4.468 -5.938 0.611 1.00 1.00 H new ATOM 0 HG21 VAL A 65 4.055 -8.503 -0.958 1.00 1.00 H new ATOM 0 HG22 VAL A 65 5.352 -8.219 0.227 1.00 1.00 H new ATOM 0 HG23 VAL A 65 4.288 -9.636 0.395 1.00 1.00 H new ATOM 1030 N ARG A 66 3.403 -6.000 3.882 1.00 1.00 N ATOM 1031 CA ARG A 66 2.588 -5.122 4.710 1.00 1.00 C ATOM 1032 C ARG A 66 1.572 -4.406 3.839 1.00 1.00 C ATOM 1033 O ARG A 66 1.839 -4.104 2.676 1.00 1.00 O ATOM 1034 CB ARG A 66 3.458 -4.107 5.463 1.00 1.00 C ATOM 1035 CG ARG A 66 2.555 -3.150 6.251 1.00 1.00 C ATOM 1036 CD ARG A 66 3.405 -2.303 7.204 1.00 1.00 C ATOM 1037 NE ARG A 66 4.494 -1.658 6.483 1.00 1.00 N ATOM 1038 CZ ARG A 66 5.557 -1.194 7.132 1.00 1.00 C ATOM 1039 NH1 ARG A 66 5.605 -1.249 8.434 1.00 1.00 N ATOM 1040 NH2 ARG A 66 6.554 -0.673 6.469 1.00 1.00 N ATOM 0 H ARG A 66 4.387 -5.741 3.815 1.00 1.00 H new ATOM 0 HA ARG A 66 2.067 -5.726 5.453 1.00 1.00 H new ATOM 0 HB2 ARG A 66 4.137 -4.625 6.140 1.00 1.00 H new ATOM 0 HB3 ARG A 66 4.075 -3.547 4.760 1.00 1.00 H new ATOM 0 HG2 ARG A 66 2.008 -2.504 5.565 1.00 1.00 H new ATOM 0 HG3 ARG A 66 1.814 -3.716 6.815 1.00 1.00 H new ATOM 0 HD2 ARG A 66 2.781 -1.548 7.683 1.00 1.00 H new ATOM 0 HD3 ARG A 66 3.809 -2.933 7.997 1.00 1.00 H new ATOM 0 HE ARG A 66 4.440 -1.561 5.469 1.00 1.00 H new ATOM 0 HH11 ARG A 66 4.826 -1.649 8.957 1.00 1.00 H new ATOM 0 HH12 ARG A 66 6.422 -0.892 8.930 1.00 1.00 H new ATOM 0 HH21 ARG A 66 6.518 -0.621 5.451 1.00 1.00 H new ATOM 0 HH22 ARG A 66 7.369 -0.318 6.969 1.00 1.00 H new ATOM 1054 N VAL A 67 0.388 -4.174 4.394 1.00 1.00 N ATOM 1055 CA VAL A 67 -0.691 -3.531 3.646 1.00 1.00 C ATOM 1056 C VAL A 67 -0.906 -2.098 4.104 1.00 1.00 C ATOM 1057 O VAL A 67 -0.997 -1.820 5.300 1.00 1.00 O ATOM 1058 CB VAL A 67 -1.980 -4.322 3.837 1.00 1.00 C ATOM 1059 CG1 VAL A 67 -3.058 -3.760 2.914 1.00 1.00 C ATOM 1060 CG2 VAL A 67 -1.728 -5.790 3.491 1.00 1.00 C ATOM 0 H VAL A 67 0.149 -4.419 5.355 1.00 1.00 H new ATOM 0 HA VAL A 67 -0.411 -3.513 2.593 1.00 1.00 H new ATOM 0 HB VAL A 67 -2.310 -4.243 4.873 1.00 1.00 H new ATOM 0 HG11 VAL A 67 -3.981 -4.323 3.048 1.00 1.00 H new ATOM 0 HG12 VAL A 67 -3.234 -2.712 3.156 1.00 1.00 H new ATOM 0 HG13 VAL A 67 -2.729 -3.843 1.878 1.00 1.00 H new ATOM 0 HG21 VAL A 67 -2.648 -6.359 3.627 1.00 1.00 H new ATOM 0 HG22 VAL A 67 -1.402 -5.869 2.454 1.00 1.00 H new ATOM 0 HG23 VAL A 67 -0.954 -6.190 4.146 1.00 1.00 H new ATOM 1070 N VAL A 68 -1.000 -1.189 3.134 1.00 1.00 N ATOM 1071 CA VAL A 68 -1.221 0.227 3.426 1.00 1.00 C ATOM 1072 C VAL A 68 -2.365 0.760 2.574 1.00 1.00 C ATOM 1073 O VAL A 68 -2.692 0.200 1.526 1.00 1.00 O ATOM 1074 CB VAL A 68 0.047 1.033 3.140 1.00 1.00 C ATOM 1075 CG1 VAL A 68 1.159 0.630 4.118 1.00 1.00 C ATOM 1076 CG2 VAL A 68 0.512 0.757 1.707 1.00 1.00 C ATOM 0 H VAL A 68 -0.927 -1.407 2.140 1.00 1.00 H new ATOM 0 HA VAL A 68 -1.476 0.329 4.481 1.00 1.00 H new ATOM 0 HB VAL A 68 -0.171 2.094 3.262 1.00 1.00 H new ATOM 0 HG11 VAL A 68 2.058 1.209 3.906 1.00 1.00 H new ATOM 0 HG12 VAL A 68 0.834 0.826 5.140 1.00 1.00 H new ATOM 0 HG13 VAL A 68 1.377 -0.432 4.004 1.00 1.00 H new ATOM 0 HG21 VAL A 68 1.416 1.331 1.501 1.00 1.00 H new ATOM 0 HG22 VAL A 68 0.723 -0.306 1.591 1.00 1.00 H new ATOM 0 HG23 VAL A 68 -0.271 1.050 1.008 1.00 1.00 H new ATOM 1086 N CYS A 69 -2.981 1.837 3.044 1.00 1.00 N ATOM 1087 CA CYS A 69 -4.109 2.445 2.342 1.00 1.00 C ATOM 1088 C CYS A 69 -3.636 3.464 1.296 1.00 1.00 C ATOM 1089 O CYS A 69 -2.509 3.951 1.353 1.00 1.00 O ATOM 1090 CB CYS A 69 -5.042 3.088 3.385 1.00 1.00 C ATOM 1091 SG CYS A 69 -4.641 4.840 3.616 1.00 1.00 S ATOM 0 H CYS A 69 -2.720 2.310 3.909 1.00 1.00 H new ATOM 0 HA CYS A 69 -4.656 1.678 1.793 1.00 1.00 H new ATOM 0 HB2 CYS A 69 -6.079 2.987 3.063 1.00 1.00 H new ATOM 0 HB3 CYS A 69 -4.950 2.561 4.335 1.00 1.00 H new ATOM 0 HG CYS A 69 -5.444 5.356 4.498 1.00 1.00 H new ATOM 1097 N GLU A 70 -4.512 3.767 0.338 1.00 1.00 N ATOM 1098 CA GLU A 70 -4.193 4.715 -0.732 1.00 1.00 C ATOM 1099 C GLU A 70 -3.941 6.117 -0.183 1.00 1.00 C ATOM 1100 O GLU A 70 -3.102 6.852 -0.707 1.00 1.00 O ATOM 1101 CB GLU A 70 -5.347 4.789 -1.745 1.00 1.00 C ATOM 1102 CG GLU A 70 -5.431 3.502 -2.577 1.00 1.00 C ATOM 1103 CD GLU A 70 -6.134 2.395 -1.799 1.00 1.00 C ATOM 1104 OE1 GLU A 70 -6.448 2.614 -0.642 1.00 1.00 O ATOM 1105 OE2 GLU A 70 -6.351 1.343 -2.377 1.00 1.00 O ATOM 0 H GLU A 70 -5.450 3.370 0.280 1.00 1.00 H new ATOM 0 HA GLU A 70 -3.287 4.355 -1.219 1.00 1.00 H new ATOM 0 HB2 GLU A 70 -6.288 4.948 -1.219 1.00 1.00 H new ATOM 0 HB3 GLU A 70 -5.202 5.644 -2.405 1.00 1.00 H new ATOM 0 HG2 GLU A 70 -5.969 3.698 -3.504 1.00 1.00 H new ATOM 0 HG3 GLU A 70 -4.428 3.177 -2.853 1.00 1.00 H new ATOM 1112 N ASP A 71 -4.673 6.494 0.854 1.00 1.00 N ATOM 1113 CA ASP A 71 -4.514 7.824 1.428 1.00 1.00 C ATOM 1114 C ASP A 71 -3.102 7.976 1.978 1.00 1.00 C ATOM 1115 O ASP A 71 -2.649 9.081 2.271 1.00 1.00 O ATOM 1116 CB ASP A 71 -5.543 8.048 2.536 1.00 1.00 C ATOM 1117 CG ASP A 71 -6.949 7.852 1.980 1.00 1.00 C ATOM 1118 OD1 ASP A 71 -7.216 8.359 0.903 1.00 1.00 O ATOM 1119 OD2 ASP A 71 -7.737 7.191 2.637 1.00 1.00 O ATOM 0 H ASP A 71 -5.373 5.909 1.311 1.00 1.00 H new ATOM 0 HA ASP A 71 -4.677 8.572 0.652 1.00 1.00 H new ATOM 0 HB2 ASP A 71 -5.366 7.352 3.356 1.00 1.00 H new ATOM 0 HB3 ASP A 71 -5.440 9.054 2.943 1.00 1.00 H new ATOM 1124 N PHE A 72 -2.403 6.849 2.074 1.00 1.00 N ATOM 1125 CA PHE A 72 -1.022 6.840 2.540 1.00 1.00 C ATOM 1126 C PHE A 72 -0.171 7.676 1.599 1.00 1.00 C ATOM 1127 O PHE A 72 0.664 8.472 2.027 1.00 1.00 O ATOM 1128 CB PHE A 72 -0.483 5.411 2.545 1.00 1.00 C ATOM 1129 CG PHE A 72 0.912 5.392 3.126 1.00 1.00 C ATOM 1130 CD1 PHE A 72 2.007 5.764 2.332 1.00 1.00 C ATOM 1131 CD2 PHE A 72 1.112 4.997 4.454 1.00 1.00 C ATOM 1132 CE1 PHE A 72 3.298 5.737 2.869 1.00 1.00 C ATOM 1133 CE2 PHE A 72 2.405 4.969 4.987 1.00 1.00 C ATOM 1134 CZ PHE A 72 3.497 5.336 4.195 1.00 1.00 C ATOM 0 H PHE A 72 -2.772 5.929 1.834 1.00 1.00 H new ATOM 0 HA PHE A 72 -0.985 7.249 3.550 1.00 1.00 H new ATOM 0 HB2 PHE A 72 -1.139 4.767 3.130 1.00 1.00 H new ATOM 0 HB3 PHE A 72 -0.469 5.014 1.530 1.00 1.00 H new ATOM 0 HD1 PHE A 72 1.853 6.071 1.308 1.00 1.00 H new ATOM 0 HD2 PHE A 72 0.269 4.714 5.067 1.00 1.00 H new ATOM 0 HE1 PHE A 72 4.142 6.026 2.260 1.00 1.00 H new ATOM 0 HE2 PHE A 72 2.560 4.664 6.011 1.00 1.00 H new ATOM 0 HZ PHE A 72 4.495 5.310 4.607 1.00 1.00 H new ATOM 1144 N LEU A 73 -0.395 7.477 0.307 1.00 1.00 N ATOM 1145 CA LEU A 73 0.351 8.200 -0.708 1.00 1.00 C ATOM 1146 C LEU A 73 0.090 9.691 -0.558 1.00 1.00 C ATOM 1147 O LEU A 73 0.999 10.511 -0.678 1.00 1.00 O ATOM 1148 CB LEU A 73 -0.099 7.756 -2.102 1.00 1.00 C ATOM 1149 CG LEU A 73 0.278 6.290 -2.352 1.00 1.00 C ATOM 1150 CD1 LEU A 73 -0.280 5.859 -3.711 1.00 1.00 C ATOM 1151 CD2 LEU A 73 1.807 6.127 -2.342 1.00 1.00 C ATOM 0 H LEU A 73 -1.086 6.822 -0.060 1.00 1.00 H new ATOM 0 HA LEU A 73 1.414 7.991 -0.585 1.00 1.00 H new ATOM 0 HB2 LEU A 73 -1.178 7.881 -2.198 1.00 1.00 H new ATOM 0 HB3 LEU A 73 0.364 8.390 -2.858 1.00 1.00 H new ATOM 0 HG LEU A 73 -0.144 5.666 -1.564 1.00 1.00 H new ATOM 0 HD11 LEU A 73 -0.017 4.818 -3.899 1.00 1.00 H new ATOM 0 HD12 LEU A 73 -1.365 5.965 -3.709 1.00 1.00 H new ATOM 0 HD13 LEU A 73 0.144 6.487 -4.494 1.00 1.00 H new ATOM 0 HD21 LEU A 73 2.063 5.083 -2.520 1.00 1.00 H new ATOM 0 HD22 LEU A 73 2.244 6.747 -3.125 1.00 1.00 H new ATOM 0 HD23 LEU A 73 2.200 6.436 -1.373 1.00 1.00 H new ATOM 1163 N GLN A 74 -1.162 10.027 -0.292 1.00 1.00 N ATOM 1164 CA GLN A 74 -1.550 11.418 -0.119 1.00 1.00 C ATOM 1165 C GLN A 74 -0.871 11.994 1.120 1.00 1.00 C ATOM 1166 O GLN A 74 -0.454 13.151 1.137 1.00 1.00 O ATOM 1167 CB GLN A 74 -3.066 11.510 0.065 1.00 1.00 C ATOM 1168 CG GLN A 74 -3.771 10.764 -1.067 1.00 1.00 C ATOM 1169 CD GLN A 74 -3.386 11.349 -2.421 1.00 1.00 C ATOM 1170 OE1 GLN A 74 -3.527 12.550 -2.648 1.00 1.00 O ATOM 1171 NE2 GLN A 74 -2.889 10.559 -3.331 1.00 1.00 N ATOM 0 H GLN A 74 -1.925 9.358 -0.191 1.00 1.00 H new ATOM 0 HA GLN A 74 -1.247 11.981 -1.002 1.00 1.00 H new ATOM 0 HB2 GLN A 74 -3.351 11.084 1.027 1.00 1.00 H new ATOM 0 HB3 GLN A 74 -3.378 12.554 0.074 1.00 1.00 H new ATOM 0 HG2 GLN A 74 -3.506 9.707 -1.033 1.00 1.00 H new ATOM 0 HG3 GLN A 74 -4.851 10.826 -0.933 1.00 1.00 H new ATOM 0 HE21 GLN A 74 -2.775 9.564 -3.136 1.00 1.00 H new ATOM 0 HE22 GLN A 74 -2.614 10.935 -4.238 1.00 1.00 H new ATOM 1180 N ASP A 75 -0.797 11.172 2.168 1.00 1.00 N ATOM 1181 CA ASP A 75 -0.202 11.590 3.433 1.00 1.00 C ATOM 1182 C ASP A 75 1.278 11.949 3.292 1.00 1.00 C ATOM 1183 O ASP A 75 1.704 13.010 3.734 1.00 1.00 O ATOM 1184 CB ASP A 75 -0.347 10.460 4.454 1.00 1.00 C ATOM 1185 CG ASP A 75 -1.800 10.328 4.898 1.00 1.00 C ATOM 1186 OD1 ASP A 75 -2.522 11.306 4.811 1.00 1.00 O ATOM 1187 OD2 ASP A 75 -2.163 9.250 5.339 1.00 1.00 O ATOM 0 H ASP A 75 -1.143 10.212 2.163 1.00 1.00 H new ATOM 0 HA ASP A 75 -0.729 12.485 3.763 1.00 1.00 H new ATOM 0 HB2 ASP A 75 -0.007 9.521 4.017 1.00 1.00 H new ATOM 0 HB3 ASP A 75 0.287 10.658 5.318 1.00 1.00 H new ATOM 1192 N VAL A 76 2.070 11.076 2.677 1.00 1.00 N ATOM 1193 CA VAL A 76 3.490 11.375 2.515 1.00 1.00 C ATOM 1194 C VAL A 76 3.661 12.551 1.575 1.00 1.00 C ATOM 1195 O VAL A 76 4.537 13.396 1.760 1.00 1.00 O ATOM 1196 CB VAL A 76 4.261 10.175 1.967 1.00 1.00 C ATOM 1197 CG1 VAL A 76 4.288 9.055 3.004 1.00 1.00 C ATOM 1198 CG2 VAL A 76 3.597 9.674 0.683 1.00 1.00 C ATOM 0 H VAL A 76 1.766 10.181 2.293 1.00 1.00 H new ATOM 0 HA VAL A 76 3.892 11.617 3.499 1.00 1.00 H new ATOM 0 HB VAL A 76 5.284 10.481 1.746 1.00 1.00 H new ATOM 0 HG11 VAL A 76 4.839 8.203 2.605 1.00 1.00 H new ATOM 0 HG12 VAL A 76 4.776 9.411 3.911 1.00 1.00 H new ATOM 0 HG13 VAL A 76 3.268 8.750 3.237 1.00 1.00 H new ATOM 0 HG21 VAL A 76 4.151 8.818 0.297 1.00 1.00 H new ATOM 0 HG22 VAL A 76 2.571 9.375 0.897 1.00 1.00 H new ATOM 0 HG23 VAL A 76 3.596 10.471 -0.061 1.00 1.00 H new ATOM 1208 N SER A 77 2.815 12.584 0.559 1.00 1.00 N ATOM 1209 CA SER A 77 2.863 13.646 -0.436 1.00 1.00 C ATOM 1210 C SER A 77 2.640 15.013 0.207 1.00 1.00 C ATOM 1211 O SER A 77 3.286 15.992 -0.169 1.00 1.00 O ATOM 1212 CB SER A 77 1.804 13.402 -1.512 1.00 1.00 C ATOM 1213 OG SER A 77 2.171 12.261 -2.277 1.00 1.00 O ATOM 0 H SER A 77 2.086 11.888 0.400 1.00 1.00 H new ATOM 0 HA SER A 77 3.853 13.639 -0.891 1.00 1.00 H new ATOM 0 HB2 SER A 77 0.828 13.247 -1.051 1.00 1.00 H new ATOM 0 HB3 SER A 77 1.716 14.275 -2.158 1.00 1.00 H new ATOM 0 HG SER A 77 1.797 11.455 -1.863 1.00 1.00 H new ATOM 1219 N ALA A 78 1.713 15.084 1.165 1.00 1.00 N ATOM 1220 CA ALA A 78 1.405 16.352 1.840 1.00 1.00 C ATOM 1221 C ALA A 78 1.895 16.368 3.288 1.00 1.00 C ATOM 1222 O ALA A 78 2.686 17.229 3.672 1.00 1.00 O ATOM 1223 CB ALA A 78 -0.106 16.589 1.822 1.00 1.00 C ATOM 0 H ALA A 78 1.165 14.287 1.490 1.00 1.00 H new ATOM 0 HA ALA A 78 1.924 17.144 1.300 1.00 1.00 H new ATOM 0 HB1 ALA A 78 -0.333 17.530 2.323 1.00 1.00 H new ATOM 0 HB2 ALA A 78 -0.455 16.634 0.790 1.00 1.00 H new ATOM 0 HB3 ALA A 78 -0.609 15.772 2.340 1.00 1.00 H new ATOM 1229 N SER A 79 1.396 15.440 4.098 1.00 1.00 N ATOM 1230 CA SER A 79 1.767 15.396 5.513 1.00 1.00 C ATOM 1231 C SER A 79 3.275 15.191 5.697 1.00 1.00 C ATOM 1232 O SER A 79 3.898 15.866 6.516 1.00 1.00 O ATOM 1233 CB SER A 79 1.005 14.270 6.215 1.00 1.00 C ATOM 1234 OG SER A 79 1.731 13.056 6.078 1.00 1.00 O ATOM 0 H SER A 79 0.741 14.715 3.806 1.00 1.00 H new ATOM 0 HA SER A 79 1.502 16.356 5.957 1.00 1.00 H new ATOM 0 HB2 SER A 79 0.870 14.509 7.270 1.00 1.00 H new ATOM 0 HB3 SER A 79 0.010 14.163 5.782 1.00 1.00 H new ATOM 0 HG SER A 79 2.015 12.948 5.146 1.00 1.00 H new ATOM 1240 N ALA A 80 3.858 14.278 4.923 1.00 1.00 N ATOM 1241 CA ALA A 80 5.298 14.019 5.000 1.00 1.00 C ATOM 1242 C ALA A 80 5.774 13.805 6.442 1.00 1.00 C ATOM 1243 O ALA A 80 6.893 14.182 6.789 1.00 1.00 O ATOM 1244 CB ALA A 80 6.051 15.203 4.394 1.00 1.00 C ATOM 0 H ALA A 80 3.361 13.707 4.239 1.00 1.00 H new ATOM 0 HA ALA A 80 5.501 13.103 4.446 1.00 1.00 H new ATOM 0 HB1 ALA A 80 7.124 15.018 4.448 1.00 1.00 H new ATOM 0 HB2 ALA A 80 5.756 15.327 3.352 1.00 1.00 H new ATOM 0 HB3 ALA A 80 5.811 16.110 4.950 1.00 1.00 H new ATOM 1250 N LYS A 81 4.933 13.200 7.278 1.00 1.00 N ATOM 1251 CA LYS A 81 5.312 12.957 8.670 1.00 1.00 C ATOM 1252 C LYS A 81 6.232 11.759 8.791 1.00 1.00 C ATOM 1253 O LYS A 81 6.732 11.226 7.801 1.00 1.00 O ATOM 1254 CB LYS A 81 4.074 12.691 9.523 1.00 1.00 C ATOM 1255 CG LYS A 81 3.156 13.891 9.427 1.00 1.00 C ATOM 1256 CD LYS A 81 1.927 13.717 10.333 1.00 1.00 C ATOM 1257 CE LYS A 81 1.030 12.593 9.801 1.00 1.00 C ATOM 1258 NZ LYS A 81 -0.306 12.666 10.458 1.00 1.00 N ATOM 0 H LYS A 81 4.001 12.874 7.024 1.00 1.00 H new ATOM 0 HA LYS A 81 5.830 13.850 9.020 1.00 1.00 H new ATOM 0 HB2 LYS A 81 3.561 11.794 9.177 1.00 1.00 H new ATOM 0 HB3 LYS A 81 4.360 12.515 10.560 1.00 1.00 H new ATOM 0 HG2 LYS A 81 3.698 14.792 9.713 1.00 1.00 H new ATOM 0 HG3 LYS A 81 2.835 14.026 8.394 1.00 1.00 H new ATOM 0 HD2 LYS A 81 2.246 13.487 11.350 1.00 1.00 H new ATOM 0 HD3 LYS A 81 1.365 14.650 10.378 1.00 1.00 H new ATOM 0 HE2 LYS A 81 0.920 12.682 8.720 1.00 1.00 H new ATOM 0 HE3 LYS A 81 1.490 11.624 9.996 1.00 1.00 H new ATOM 0 HZ1 LYS A 81 -0.913 11.903 10.096 1.00 1.00 H new ATOM 0 HZ2 LYS A 81 -0.193 12.560 11.486 1.00 1.00 H new ATOM 0 HZ3 LYS A 81 -0.745 13.586 10.251 1.00 1.00 H new ATOM 1272 N SER A 82 6.428 11.339 10.028 1.00 1.00 N ATOM 1273 CA SER A 82 7.279 10.187 10.315 1.00 1.00 C ATOM 1274 C SER A 82 6.682 8.942 9.687 1.00 1.00 C ATOM 1275 O SER A 82 5.466 8.773 9.661 1.00 1.00 O ATOM 1276 CB SER A 82 7.411 9.975 11.822 1.00 1.00 C ATOM 1277 OG SER A 82 8.021 11.111 12.416 1.00 1.00 O ATOM 0 H SER A 82 6.013 11.774 10.852 1.00 1.00 H new ATOM 0 HA SER A 82 8.268 10.377 9.897 1.00 1.00 H new ATOM 0 HB2 SER A 82 6.428 9.807 12.262 1.00 1.00 H new ATOM 0 HB3 SER A 82 8.007 9.084 12.022 1.00 1.00 H new ATOM 0 HG SER A 82 8.102 10.971 13.383 1.00 1.00 H new ATOM 1283 N LEU A 83 7.538 8.077 9.166 1.00 1.00 N ATOM 1284 CA LEU A 83 7.062 6.865 8.528 1.00 1.00 C ATOM 1285 C LEU A 83 6.340 5.964 9.519 1.00 1.00 C ATOM 1286 O LEU A 83 5.293 5.408 9.201 1.00 1.00 O ATOM 1287 CB LEU A 83 8.233 6.097 7.909 1.00 1.00 C ATOM 1288 CG LEU A 83 8.811 6.864 6.690 1.00 1.00 C ATOM 1289 CD1 LEU A 83 10.026 7.693 7.123 1.00 1.00 C ATOM 1290 CD2 LEU A 83 9.249 5.869 5.609 1.00 1.00 C ATOM 0 H LEU A 83 8.552 8.191 9.173 1.00 1.00 H new ATOM 0 HA LEU A 83 6.359 7.158 7.748 1.00 1.00 H new ATOM 0 HB2 LEU A 83 9.013 5.951 8.656 1.00 1.00 H new ATOM 0 HB3 LEU A 83 7.900 5.107 7.597 1.00 1.00 H new ATOM 0 HG LEU A 83 8.039 7.523 6.293 1.00 1.00 H new ATOM 0 HD11 LEU A 83 10.426 8.229 6.262 1.00 1.00 H new ATOM 0 HD12 LEU A 83 9.724 8.409 7.888 1.00 1.00 H new ATOM 0 HD13 LEU A 83 10.792 7.032 7.527 1.00 1.00 H new ATOM 0 HD21 LEU A 83 9.654 6.413 4.756 1.00 1.00 H new ATOM 0 HD22 LEU A 83 10.014 5.206 6.013 1.00 1.00 H new ATOM 0 HD23 LEU A 83 8.391 5.279 5.288 1.00 1.00 H new ATOM 1302 N GLN A 84 6.902 5.825 10.712 1.00 1.00 N ATOM 1303 CA GLN A 84 6.302 4.973 11.734 1.00 1.00 C ATOM 1304 C GLN A 84 4.947 5.520 12.178 1.00 1.00 C ATOM 1305 O GLN A 84 4.004 4.761 12.396 1.00 1.00 O ATOM 1306 CB GLN A 84 7.235 4.881 12.945 1.00 1.00 C ATOM 1307 CG GLN A 84 8.588 4.308 12.508 1.00 1.00 C ATOM 1308 CD GLN A 84 8.411 2.897 11.959 1.00 1.00 C ATOM 1309 OE1 GLN A 84 7.955 2.004 12.674 1.00 1.00 O ATOM 1310 NE2 GLN A 84 8.724 2.650 10.717 1.00 1.00 N ATOM 0 H GLN A 84 7.766 6.287 10.996 1.00 1.00 H new ATOM 0 HA GLN A 84 6.152 3.982 11.306 1.00 1.00 H new ATOM 0 HB2 GLN A 84 7.372 5.868 13.387 1.00 1.00 H new ATOM 0 HB3 GLN A 84 6.791 4.247 13.712 1.00 1.00 H new ATOM 0 HG2 GLN A 84 9.033 4.949 11.747 1.00 1.00 H new ATOM 0 HG3 GLN A 84 9.275 4.293 13.354 1.00 1.00 H new ATOM 0 HE21 GLN A 84 9.101 3.393 10.129 1.00 1.00 H new ATOM 0 HE22 GLN A 84 8.591 1.714 10.334 1.00 1.00 H new ATOM 1319 N GLU A 85 4.861 6.838 12.314 1.00 1.00 N ATOM 1320 CA GLU A 85 3.622 7.476 12.742 1.00 1.00 C ATOM 1321 C GLU A 85 2.515 7.239 11.720 1.00 1.00 C ATOM 1322 O GLU A 85 1.355 7.068 12.079 1.00 1.00 O ATOM 1323 CB GLU A 85 3.852 8.978 12.921 1.00 1.00 C ATOM 1324 CG GLU A 85 2.586 9.640 13.469 1.00 1.00 C ATOM 1325 CD GLU A 85 2.840 11.128 13.689 1.00 1.00 C ATOM 1326 OE1 GLU A 85 3.994 11.520 13.654 1.00 1.00 O ATOM 1327 OE2 GLU A 85 1.879 11.849 13.897 1.00 1.00 O ATOM 0 H GLU A 85 5.631 7.483 12.135 1.00 1.00 H new ATOM 0 HA GLU A 85 3.314 7.040 13.692 1.00 1.00 H new ATOM 0 HB2 GLU A 85 4.685 9.148 13.603 1.00 1.00 H new ATOM 0 HB3 GLU A 85 4.124 9.429 11.967 1.00 1.00 H new ATOM 0 HG2 GLU A 85 1.760 9.501 12.772 1.00 1.00 H new ATOM 0 HG3 GLU A 85 2.294 9.168 14.407 1.00 1.00 H new ATOM 1334 N LEU A 86 2.869 7.222 10.447 1.00 1.00 N ATOM 1335 CA LEU A 86 1.874 6.999 9.404 1.00 1.00 C ATOM 1336 C LEU A 86 1.236 5.611 9.538 1.00 1.00 C ATOM 1337 O LEU A 86 0.033 5.460 9.336 1.00 1.00 O ATOM 1338 CB LEU A 86 2.511 7.156 8.019 1.00 1.00 C ATOM 1339 CG LEU A 86 2.863 8.637 7.770 1.00 1.00 C ATOM 1340 CD1 LEU A 86 3.743 8.748 6.521 1.00 1.00 C ATOM 1341 CD2 LEU A 86 1.584 9.481 7.572 1.00 1.00 C ATOM 0 H LEU A 86 3.822 7.357 10.110 1.00 1.00 H new ATOM 0 HA LEU A 86 1.090 7.747 9.521 1.00 1.00 H new ATOM 0 HB2 LEU A 86 3.410 6.543 7.950 1.00 1.00 H new ATOM 0 HB3 LEU A 86 1.824 6.802 7.250 1.00 1.00 H new ATOM 0 HG LEU A 86 3.399 9.017 8.640 1.00 1.00 H new ATOM 0 HD11 LEU A 86 3.993 9.794 6.344 1.00 1.00 H new ATOM 0 HD12 LEU A 86 4.659 8.176 6.669 1.00 1.00 H new ATOM 0 HD13 LEU A 86 3.204 8.353 5.660 1.00 1.00 H new ATOM 0 HD21 LEU A 86 1.858 10.522 7.398 1.00 1.00 H new ATOM 0 HD22 LEU A 86 1.028 9.104 6.713 1.00 1.00 H new ATOM 0 HD23 LEU A 86 0.962 9.414 8.465 1.00 1.00 H new ATOM 1353 N LEU A 87 2.049 4.602 9.861 1.00 1.00 N ATOM 1354 CA LEU A 87 1.535 3.230 9.993 1.00 1.00 C ATOM 1355 C LEU A 87 0.544 3.195 11.150 1.00 1.00 C ATOM 1356 O LEU A 87 -0.350 2.357 11.209 1.00 1.00 O ATOM 1357 CB LEU A 87 2.661 2.232 10.346 1.00 1.00 C ATOM 1358 CG LEU A 87 3.944 2.582 9.610 1.00 1.00 C ATOM 1359 CD1 LEU A 87 5.011 1.532 9.914 1.00 1.00 C ATOM 1360 CD2 LEU A 87 3.729 2.672 8.094 1.00 1.00 C ATOM 0 H LEU A 87 3.049 4.702 10.034 1.00 1.00 H new ATOM 0 HA LEU A 87 1.082 2.950 9.042 1.00 1.00 H new ATOM 0 HB2 LEU A 87 2.839 2.243 11.421 1.00 1.00 H new ATOM 0 HB3 LEU A 87 2.351 1.220 10.085 1.00 1.00 H new ATOM 0 HG LEU A 87 4.270 3.562 9.958 1.00 1.00 H new ATOM 0 HD11 LEU A 87 5.930 1.784 9.386 1.00 1.00 H new ATOM 0 HD12 LEU A 87 5.204 1.509 10.987 1.00 1.00 H new ATOM 0 HD13 LEU A 87 4.661 0.553 9.587 1.00 1.00 H new ATOM 0 HD21 LEU A 87 4.671 2.924 7.607 1.00 1.00 H new ATOM 0 HD22 LEU A 87 3.372 1.712 7.719 1.00 1.00 H new ATOM 0 HD23 LEU A 87 2.990 3.443 7.876 1.00 1.00 H new ATOM 1372 N SER A 88 0.778 4.077 12.109 1.00 1.00 N ATOM 1373 CA SER A 88 -0.029 4.110 13.319 1.00 1.00 C ATOM 1374 C SER A 88 -1.499 4.319 12.991 1.00 1.00 C ATOM 1375 O SER A 88 -2.377 3.780 13.664 1.00 1.00 O ATOM 1376 CB SER A 88 0.442 5.240 14.235 1.00 1.00 C ATOM 1377 OG SER A 88 -0.077 6.474 13.760 1.00 1.00 O ATOM 0 H SER A 88 1.518 4.778 12.074 1.00 1.00 H new ATOM 0 HA SER A 88 0.088 3.151 13.823 1.00 1.00 H new ATOM 0 HB2 SER A 88 0.107 5.060 15.256 1.00 1.00 H new ATOM 0 HB3 SER A 88 1.531 5.275 14.259 1.00 1.00 H new ATOM 0 HG SER A 88 0.239 6.631 12.846 1.00 1.00 H new ATOM 1383 N ALA A 89 -1.758 5.115 11.962 1.00 1.00 N ATOM 1384 CA ALA A 89 -3.128 5.409 11.544 1.00 1.00 C ATOM 1385 C ALA A 89 -3.434 4.797 10.183 1.00 1.00 C ATOM 1386 O ALA A 89 -4.537 4.959 9.662 1.00 1.00 O ATOM 1387 CB ALA A 89 -3.318 6.925 11.473 1.00 1.00 C ATOM 0 H ALA A 89 -1.039 5.570 11.399 1.00 1.00 H new ATOM 0 HA ALA A 89 -3.811 4.975 12.274 1.00 1.00 H new ATOM 0 HB1 ALA A 89 -4.338 7.150 11.162 1.00 1.00 H new ATOM 0 HB2 ALA A 89 -3.134 7.361 12.455 1.00 1.00 H new ATOM 0 HB3 ALA A 89 -2.618 7.346 10.752 1.00 1.00 H new ATOM 1393 N HIS A 90 -2.446 4.110 9.593 1.00 1.00 N ATOM 1394 CA HIS A 90 -2.634 3.504 8.270 1.00 1.00 C ATOM 1395 C HIS A 90 -2.214 2.036 8.236 1.00 1.00 C ATOM 1396 O HIS A 90 -2.230 1.415 7.173 1.00 1.00 O ATOM 1397 CB HIS A 90 -1.816 4.283 7.246 1.00 1.00 C ATOM 1398 CG HIS A 90 -2.266 5.716 7.259 1.00 1.00 C ATOM 1399 ND1 HIS A 90 -3.604 6.071 7.212 1.00 1.00 N ATOM 1400 CD2 HIS A 90 -1.566 6.892 7.340 1.00 1.00 C ATOM 1401 CE1 HIS A 90 -3.669 7.413 7.260 1.00 1.00 C ATOM 1402 NE2 HIS A 90 -2.454 7.964 7.336 1.00 1.00 N ATOM 0 H HIS A 90 -1.524 3.962 10.003 1.00 1.00 H new ATOM 0 HA HIS A 90 -3.697 3.546 8.035 1.00 1.00 H new ATOM 0 HB2 HIS A 90 -0.754 4.218 7.483 1.00 1.00 H new ATOM 0 HB3 HIS A 90 -1.948 3.855 6.252 1.00 1.00 H new ATOM 0 HD2 HIS A 90 -0.491 6.974 7.398 1.00 1.00 H new ATOM 0 HE1 HIS A 90 -4.590 7.977 7.240 1.00 1.00 H new ATOM 0 HE2 HIS A 90 -2.226 8.957 7.381 1.00 1.00 H new ATOM 1411 N SER A 91 -1.835 1.475 9.380 1.00 1.00 N ATOM 1412 CA SER A 91 -1.421 0.082 9.415 1.00 1.00 C ATOM 1413 C SER A 91 -2.622 -0.830 9.324 1.00 1.00 C ATOM 1414 O SER A 91 -3.317 -1.080 10.310 1.00 1.00 O ATOM 1415 CB SER A 91 -0.646 -0.226 10.686 1.00 1.00 C ATOM 1416 OG SER A 91 -1.329 0.316 11.808 1.00 1.00 O ATOM 0 H SER A 91 -1.807 1.956 10.279 1.00 1.00 H new ATOM 0 HA SER A 91 -0.771 -0.091 8.557 1.00 1.00 H new ATOM 0 HB2 SER A 91 -0.534 -1.304 10.803 1.00 1.00 H new ATOM 0 HB3 SER A 91 0.358 0.194 10.622 1.00 1.00 H new ATOM 0 HG SER A 91 -1.080 1.257 11.919 1.00 1.00 H new ATOM 1422 N LEU A 92 -2.852 -1.320 8.129 1.00 1.00 N ATOM 1423 CA LEU A 92 -3.967 -2.218 7.875 1.00 1.00 C ATOM 1424 C LEU A 92 -3.551 -3.657 8.153 1.00 1.00 C ATOM 1425 O LEU A 92 -4.387 -4.561 8.197 1.00 1.00 O ATOM 1426 CB LEU A 92 -4.395 -2.105 6.417 1.00 1.00 C ATOM 1427 CG LEU A 92 -4.788 -0.661 6.088 1.00 1.00 C ATOM 1428 CD1 LEU A 92 -5.161 -0.588 4.607 1.00 1.00 C ATOM 1429 CD2 LEU A 92 -5.981 -0.218 6.956 1.00 1.00 C ATOM 0 H LEU A 92 -2.281 -1.114 7.309 1.00 1.00 H new ATOM 0 HA LEU A 92 -4.794 -1.942 8.529 1.00 1.00 H new ATOM 0 HB2 LEU A 92 -3.581 -2.425 5.766 1.00 1.00 H new ATOM 0 HB3 LEU A 92 -5.237 -2.771 6.225 1.00 1.00 H new ATOM 0 HG LEU A 92 -3.951 0.006 6.297 1.00 1.00 H new ATOM 0 HD11 LEU A 92 -5.444 0.433 4.353 1.00 1.00 H new ATOM 0 HD12 LEU A 92 -4.306 -0.889 4.001 1.00 1.00 H new ATOM 0 HD13 LEU A 92 -5.999 -1.257 4.409 1.00 1.00 H new ATOM 0 HD21 LEU A 92 -6.248 0.810 6.710 1.00 1.00 H new ATOM 0 HD22 LEU A 92 -6.833 -0.870 6.764 1.00 1.00 H new ATOM 0 HD23 LEU A 92 -5.707 -0.280 8.009 1.00 1.00 H new ATOM 1441 N SER A 93 -2.248 -3.863 8.332 1.00 1.00 N ATOM 1442 CA SER A 93 -1.711 -5.199 8.593 1.00 1.00 C ATOM 1443 C SER A 93 -0.471 -5.122 9.476 1.00 1.00 C ATOM 1444 O SER A 93 0.209 -4.097 9.520 1.00 1.00 O ATOM 1445 CB SER A 93 -1.364 -5.882 7.270 1.00 1.00 C ATOM 1446 OG SER A 93 -2.564 -6.166 6.561 1.00 1.00 O ATOM 0 H SER A 93 -1.545 -3.125 8.301 1.00 1.00 H new ATOM 0 HA SER A 93 -2.470 -5.781 9.116 1.00 1.00 H new ATOM 0 HB2 SER A 93 -0.719 -5.238 6.673 1.00 1.00 H new ATOM 0 HB3 SER A 93 -0.811 -6.803 7.456 1.00 1.00 H new ATOM 0 HG SER A 93 -2.498 -7.052 6.147 1.00 1.00 H new ATOM 1452 N SER A 94 -0.185 -6.212 10.190 1.00 1.00 N ATOM 1453 CA SER A 94 0.976 -6.267 11.082 1.00 1.00 C ATOM 1454 C SER A 94 2.081 -7.141 10.497 1.00 1.00 C ATOM 1455 O SER A 94 3.141 -7.298 11.104 1.00 1.00 O ATOM 1456 CB SER A 94 0.560 -6.820 12.445 1.00 1.00 C ATOM 1457 OG SER A 94 0.078 -8.149 12.290 1.00 1.00 O ATOM 0 H SER A 94 -0.740 -7.068 10.169 1.00 1.00 H new ATOM 0 HA SER A 94 1.360 -5.253 11.196 1.00 1.00 H new ATOM 0 HB2 SER A 94 1.408 -6.807 13.129 1.00 1.00 H new ATOM 0 HB3 SER A 94 -0.213 -6.190 12.884 1.00 1.00 H new ATOM 0 HG SER A 94 -0.187 -8.505 13.164 1.00 1.00 H new ATOM 1463 N TRP A 95 1.832 -7.713 9.318 1.00 1.00 N ATOM 1464 CA TRP A 95 2.819 -8.579 8.664 1.00 1.00 C ATOM 1465 C TRP A 95 3.546 -7.830 7.555 1.00 1.00 C ATOM 1466 O TRP A 95 3.151 -6.730 7.183 1.00 1.00 O ATOM 1467 CB TRP A 95 2.127 -9.821 8.102 1.00 1.00 C ATOM 1468 CG TRP A 95 1.269 -9.474 6.926 1.00 1.00 C ATOM 1469 CD1 TRP A 95 1.721 -9.161 5.691 1.00 1.00 C ATOM 1470 CD2 TRP A 95 -0.190 -9.420 6.848 1.00 1.00 C ATOM 1471 NE1 TRP A 95 0.637 -8.922 4.862 1.00 1.00 N ATOM 1472 CE2 TRP A 95 -0.561 -9.066 5.531 1.00 1.00 C ATOM 1473 CE3 TRP A 95 -1.213 -9.645 7.787 1.00 1.00 C ATOM 1474 CZ2 TRP A 95 -1.904 -8.940 5.156 1.00 1.00 C ATOM 1475 CZ3 TRP A 95 -2.563 -9.519 7.415 1.00 1.00 C ATOM 1476 CH2 TRP A 95 -2.909 -9.168 6.101 1.00 1.00 C ATOM 0 H TRP A 95 0.962 -7.595 8.798 1.00 1.00 H new ATOM 0 HA TRP A 95 3.557 -8.886 9.405 1.00 1.00 H new ATOM 0 HB2 TRP A 95 2.876 -10.556 7.806 1.00 1.00 H new ATOM 0 HB3 TRP A 95 1.517 -10.283 8.878 1.00 1.00 H new ATOM 0 HD1 TRP A 95 2.759 -9.106 5.398 1.00 1.00 H new ATOM 0 HE1 TRP A 95 0.715 -8.670 3.877 1.00 1.00 H new ATOM 0 HE3 TRP A 95 -0.960 -9.917 8.801 1.00 1.00 H new ATOM 0 HZ2 TRP A 95 -2.162 -8.668 4.143 1.00 1.00 H new ATOM 0 HZ3 TRP A 95 -3.339 -9.694 8.145 1.00 1.00 H new ATOM 0 HH2 TRP A 95 -3.948 -9.074 5.821 1.00 1.00 H new ATOM 1487 N GLY A 96 4.626 -8.424 7.044 1.00 1.00 N ATOM 1488 CA GLY A 96 5.417 -7.797 5.982 1.00 1.00 C ATOM 1489 C GLY A 96 6.911 -7.898 6.269 1.00 1.00 C ATOM 1490 O GLY A 96 7.605 -6.886 6.352 1.00 1.00 O ATOM 0 H GLY A 96 4.972 -9.334 7.346 1.00 1.00 H new ATOM 0 HA2 GLY A 96 5.195 -8.277 5.029 1.00 1.00 H new ATOM 0 HA3 GLY A 96 5.133 -6.749 5.885 1.00 1.00 H new ATOM 1494 N ALA A 97 7.401 -9.126 6.402 1.00 1.00 N ATOM 1495 CA ALA A 97 8.820 -9.354 6.663 1.00 1.00 C ATOM 1496 C ALA A 97 9.352 -8.413 7.733 1.00 1.00 C ATOM 1497 O ALA A 97 10.319 -7.687 7.507 1.00 1.00 O ATOM 1498 CB ALA A 97 9.620 -9.142 5.383 1.00 1.00 C ATOM 0 H ALA A 97 6.841 -9.976 6.334 1.00 1.00 H new ATOM 0 HA ALA A 97 8.929 -10.379 7.016 1.00 1.00 H new ATOM 0 HB1 ALA A 97 10.678 -9.313 5.583 1.00 1.00 H new ATOM 0 HB2 ALA A 97 9.277 -9.840 4.620 1.00 1.00 H new ATOM 0 HB3 ALA A 97 9.478 -8.121 5.030 1.00 1.00 H new ATOM 1504 N GLU A 98 8.736 -8.445 8.901 1.00 1.00 N ATOM 1505 CA GLU A 98 9.180 -7.603 10.000 1.00 1.00 C ATOM 1506 C GLU A 98 10.681 -7.789 10.222 1.00 1.00 C ATOM 1507 O GLU A 98 11.235 -8.845 9.917 1.00 1.00 O ATOM 1508 CB GLU A 98 8.421 -7.985 11.262 1.00 1.00 C ATOM 1509 CG GLU A 98 6.939 -7.615 11.137 1.00 1.00 C ATOM 1510 CD GLU A 98 6.770 -6.104 11.008 1.00 1.00 C ATOM 1511 OE1 GLU A 98 7.676 -5.387 11.399 1.00 1.00 O ATOM 1512 OE2 GLU A 98 5.732 -5.686 10.520 1.00 1.00 O ATOM 0 H GLU A 98 7.934 -9.039 9.113 1.00 1.00 H new ATOM 0 HA GLU A 98 8.985 -6.558 9.760 1.00 1.00 H new ATOM 0 HB2 GLU A 98 8.520 -9.056 11.441 1.00 1.00 H new ATOM 0 HB3 GLU A 98 8.856 -7.476 12.122 1.00 1.00 H new ATOM 0 HG2 GLU A 98 6.508 -8.110 10.267 1.00 1.00 H new ATOM 0 HG3 GLU A 98 6.394 -7.974 12.010 1.00 1.00 H new ATOM 1519 N VAL A 99 11.339 -6.744 10.714 1.00 1.00 N ATOM 1520 CA VAL A 99 12.786 -6.785 10.925 1.00 1.00 C ATOM 1521 C VAL A 99 13.243 -7.964 11.788 1.00 1.00 C ATOM 1522 O VAL A 99 13.387 -7.844 13.005 1.00 1.00 O ATOM 1523 CB VAL A 99 13.254 -5.472 11.575 1.00 1.00 C ATOM 1524 CG1 VAL A 99 13.309 -4.356 10.526 1.00 1.00 C ATOM 1525 CG2 VAL A 99 12.274 -5.077 12.691 1.00 1.00 C ATOM 0 H VAL A 99 10.898 -5.862 10.974 1.00 1.00 H new ATOM 0 HA VAL A 99 13.237 -6.915 9.941 1.00 1.00 H new ATOM 0 HB VAL A 99 14.250 -5.617 11.994 1.00 1.00 H new ATOM 0 HG11 VAL A 99 13.641 -3.431 10.996 1.00 1.00 H new ATOM 0 HG12 VAL A 99 14.007 -4.633 9.736 1.00 1.00 H new ATOM 0 HG13 VAL A 99 12.317 -4.210 10.098 1.00 1.00 H new ATOM 0 HG21 VAL A 99 12.604 -4.147 13.153 1.00 1.00 H new ATOM 0 HG22 VAL A 99 11.278 -4.939 12.269 1.00 1.00 H new ATOM 0 HG23 VAL A 99 12.243 -5.865 13.444 1.00 1.00 H new ATOM 1535 N LYS A 100 13.504 -9.089 11.131 1.00 1.00 N ATOM 1536 CA LYS A 100 13.988 -10.291 11.803 1.00 1.00 C ATOM 1537 C LYS A 100 15.224 -10.824 11.087 1.00 1.00 C ATOM 1538 O LYS A 100 15.826 -11.813 11.503 1.00 1.00 O ATOM 1539 CB LYS A 100 12.893 -11.337 11.758 1.00 1.00 C ATOM 1540 CG LYS A 100 11.727 -10.820 12.580 1.00 1.00 C ATOM 1541 CD LYS A 100 10.581 -11.806 12.518 1.00 1.00 C ATOM 1542 CE LYS A 100 9.475 -11.300 13.431 1.00 1.00 C ATOM 1543 NZ LYS A 100 8.314 -12.234 13.396 1.00 1.00 N ATOM 0 H LYS A 100 13.387 -9.194 10.123 1.00 1.00 H new ATOM 0 HA LYS A 100 14.250 -10.058 12.835 1.00 1.00 H new ATOM 0 HB2 LYS A 100 12.583 -11.522 10.729 1.00 1.00 H new ATOM 0 HB3 LYS A 100 13.253 -12.285 12.158 1.00 1.00 H new ATOM 0 HG2 LYS A 100 12.036 -10.672 13.615 1.00 1.00 H new ATOM 0 HG3 LYS A 100 11.405 -9.850 12.202 1.00 1.00 H new ATOM 0 HD2 LYS A 100 10.216 -11.903 11.495 1.00 1.00 H new ATOM 0 HD3 LYS A 100 10.912 -12.795 12.833 1.00 1.00 H new ATOM 0 HE2 LYS A 100 9.848 -11.209 14.451 1.00 1.00 H new ATOM 0 HE3 LYS A 100 9.161 -10.305 13.117 1.00 1.00 H new ATOM 0 HZ1 LYS A 100 7.564 -11.879 14.023 1.00 1.00 H new ATOM 0 HZ2 LYS A 100 7.950 -12.300 12.424 1.00 1.00 H new ATOM 0 HZ3 LYS A 100 8.616 -13.176 13.717 1.00 1.00 H new ATOM 1557 N HIS A 101 15.579 -10.171 9.984 1.00 1.00 N ATOM 1558 CA HIS A 101 16.730 -10.596 9.193 1.00 1.00 C ATOM 1559 C HIS A 101 18.034 -10.422 9.966 1.00 1.00 C ATOM 1560 O HIS A 101 18.836 -11.351 10.042 1.00 1.00 O ATOM 1561 CB HIS A 101 16.794 -9.767 7.907 1.00 1.00 C ATOM 1562 CG HIS A 101 15.595 -10.063 7.042 1.00 1.00 C ATOM 1563 ND1 HIS A 101 15.193 -9.206 6.029 1.00 1.00 N ATOM 1564 CD2 HIS A 101 14.690 -11.106 7.031 1.00 1.00 C ATOM 1565 CE1 HIS A 101 14.093 -9.734 5.461 1.00 1.00 C ATOM 1566 NE2 HIS A 101 13.745 -10.889 6.034 1.00 1.00 N ATOM 0 H HIS A 101 15.091 -9.353 9.620 1.00 1.00 H new ATOM 0 HA HIS A 101 16.609 -11.654 8.960 1.00 1.00 H new ATOM 0 HB2 HIS A 101 16.824 -8.705 8.150 1.00 1.00 H new ATOM 0 HB3 HIS A 101 17.710 -9.995 7.363 1.00 1.00 H new ATOM 0 HD2 HIS A 101 14.713 -11.958 7.694 1.00 1.00 H new ATOM 0 HE1 HIS A 101 13.557 -9.279 4.641 1.00 1.00 H new ATOM 0 HE2 HIS A 101 12.954 -11.486 5.792 1.00 1.00 H new ATOM 1575 N HIS A 102 18.238 -9.231 10.527 1.00 1.00 N ATOM 1576 CA HIS A 102 19.455 -8.934 11.286 1.00 1.00 C ATOM 1577 C HIS A 102 19.533 -7.440 11.608 1.00 1.00 C ATOM 1578 O HIS A 102 18.855 -6.625 10.985 1.00 1.00 O ATOM 1579 CB HIS A 102 20.702 -9.342 10.481 1.00 1.00 C ATOM 1580 CG HIS A 102 20.528 -8.953 9.035 1.00 1.00 C ATOM 1581 ND1 HIS A 102 21.363 -9.436 8.037 1.00 1.00 N ATOM 1582 CD2 HIS A 102 19.625 -8.135 8.400 1.00 1.00 C ATOM 1583 CE1 HIS A 102 20.948 -8.908 6.870 1.00 1.00 C ATOM 1584 NE2 HIS A 102 19.894 -8.104 7.036 1.00 1.00 N ATOM 0 H HIS A 102 17.578 -8.456 10.471 1.00 1.00 H new ATOM 0 HA HIS A 102 19.421 -9.503 12.215 1.00 1.00 H new ATOM 0 HB2 HIS A 102 21.587 -8.857 10.893 1.00 1.00 H new ATOM 0 HB3 HIS A 102 20.862 -10.417 10.561 1.00 1.00 H new ATOM 0 HD2 HIS A 102 18.826 -7.597 8.887 1.00 1.00 H new ATOM 0 HE1 HIS A 102 21.411 -9.110 5.915 1.00 1.00 H new ATOM 0 HE2 HIS A 102 19.394 -7.580 6.317 1.00 1.00 H new ATOM 1593 N HIS A 103 20.380 -7.084 12.570 1.00 1.00 N ATOM 1594 CA HIS A 103 20.556 -5.679 12.925 1.00 1.00 C ATOM 1595 C HIS A 103 21.532 -5.035 11.946 1.00 1.00 C ATOM 1596 O HIS A 103 21.284 -3.951 11.417 1.00 1.00 O ATOM 1597 CB HIS A 103 21.087 -5.557 14.355 1.00 1.00 C ATOM 1598 CG HIS A 103 20.027 -6.010 15.321 1.00 1.00 C ATOM 1599 ND1 HIS A 103 18.970 -5.195 15.692 1.00 1.00 N ATOM 1600 CD2 HIS A 103 19.846 -7.187 16.002 1.00 1.00 C ATOM 1601 CE1 HIS A 103 18.208 -5.885 16.561 1.00 1.00 C ATOM 1602 NE2 HIS A 103 18.698 -7.106 16.784 1.00 1.00 N ATOM 0 H HIS A 103 20.947 -7.737 13.110 1.00 1.00 H new ATOM 0 HA HIS A 103 19.595 -5.168 12.870 1.00 1.00 H new ATOM 0 HB2 HIS A 103 21.986 -6.162 14.474 1.00 1.00 H new ATOM 0 HB3 HIS A 103 21.368 -4.525 14.564 1.00 1.00 H new ATOM 0 HD2 HIS A 103 20.497 -8.047 15.940 1.00 1.00 H new ATOM 0 HE1 HIS A 103 17.311 -5.498 17.021 1.00 1.00 H new ATOM 0 HE2 HIS A 103 18.314 -7.825 17.396 1.00 1.00 H new ATOM 1611 N HIS A 104 22.636 -5.733 11.698 1.00 1.00 N ATOM 1612 CA HIS A 104 23.649 -5.262 10.763 1.00 1.00 C ATOM 1613 C HIS A 104 24.579 -6.405 10.367 1.00 1.00 C ATOM 1614 O HIS A 104 24.705 -7.393 11.092 1.00 1.00 O ATOM 1615 CB HIS A 104 24.459 -4.115 11.371 1.00 1.00 C ATOM 1616 CG HIS A 104 24.961 -4.499 12.735 1.00 1.00 C ATOM 1617 ND1 HIS A 104 26.059 -5.325 12.920 1.00 1.00 N ATOM 1618 CD2 HIS A 104 24.540 -4.148 13.992 1.00 1.00 C ATOM 1619 CE1 HIS A 104 26.257 -5.444 14.246 1.00 1.00 C ATOM 1620 NE2 HIS A 104 25.357 -4.749 14.945 1.00 1.00 N ATOM 0 H HIS A 104 22.851 -6.630 12.134 1.00 1.00 H new ATOM 0 HA HIS A 104 23.142 -4.893 9.872 1.00 1.00 H new ATOM 0 HB2 HIS A 104 25.300 -3.870 10.722 1.00 1.00 H new ATOM 0 HB3 HIS A 104 23.840 -3.221 11.442 1.00 1.00 H new ATOM 0 HD2 HIS A 104 23.702 -3.503 14.209 1.00 1.00 H new ATOM 0 HE1 HIS A 104 27.048 -6.030 14.690 1.00 1.00 H new ATOM 0 HE2 HIS A 104 25.284 -4.674 15.960 1.00 1.00 H new ATOM 1629 N HIS A 105 25.236 -6.264 9.219 1.00 1.00 N ATOM 1630 CA HIS A 105 26.158 -7.293 8.749 1.00 1.00 C ATOM 1631 C HIS A 105 27.505 -7.161 9.454 1.00 1.00 C ATOM 1632 O HIS A 105 27.990 -6.054 9.688 1.00 1.00 O ATOM 1633 CB HIS A 105 26.346 -7.177 7.235 1.00 1.00 C ATOM 1634 CG HIS A 105 27.064 -5.897 6.903 1.00 1.00 C ATOM 1635 ND1 HIS A 105 28.341 -5.884 6.364 1.00 1.00 N ATOM 1636 CD2 HIS A 105 26.689 -4.584 7.011 1.00 1.00 C ATOM 1637 CE1 HIS A 105 28.683 -4.599 6.163 1.00 1.00 C ATOM 1638 NE2 HIS A 105 27.712 -3.764 6.542 1.00 1.00 N ATOM 0 H HIS A 105 25.149 -5.456 8.603 1.00 1.00 H new ATOM 0 HA HIS A 105 25.737 -8.271 8.981 1.00 1.00 H new ATOM 0 HB2 HIS A 105 26.915 -8.030 6.864 1.00 1.00 H new ATOM 0 HB3 HIS A 105 25.377 -7.200 6.737 1.00 1.00 H new ATOM 0 HD2 HIS A 105 25.743 -4.237 7.401 1.00 1.00 H new ATOM 0 HE1 HIS A 105 29.627 -4.281 5.746 1.00 1.00 H new ATOM 0 HE2 HIS A 105 27.718 -2.745 6.497 1.00 1.00 H new ATOM 1647 N HIS A 106 28.093 -8.301 9.800 1.00 1.00 N ATOM 1648 CA HIS A 106 29.376 -8.312 10.495 1.00 1.00 C ATOM 1649 C HIS A 106 30.478 -7.739 9.609 1.00 1.00 C ATOM 1650 O HIS A 106 30.831 -8.390 8.639 1.00 1.00 O ATOM 1651 CB HIS A 106 29.734 -9.746 10.896 1.00 1.00 C ATOM 1652 CG HIS A 106 28.667 -10.289 11.805 1.00 1.00 C ATOM 1653 ND1 HIS A 106 28.540 -9.884 13.123 1.00 1.00 N ATOM 1654 CD2 HIS A 106 27.665 -11.206 11.593 1.00 1.00 C ATOM 1655 CE1 HIS A 106 27.495 -10.547 13.652 1.00 1.00 C ATOM 1656 NE2 HIS A 106 26.927 -11.367 12.763 1.00 1.00 N ATOM 1657 OXT HIS A 106 30.956 -6.661 9.917 1.00 1.00 O ATOM 0 H HIS A 106 27.705 -9.225 9.612 1.00 1.00 H new ATOM 0 HA HIS A 106 29.290 -7.691 11.387 1.00 1.00 H new ATOM 0 HB2 HIS A 106 29.825 -10.372 10.008 1.00 1.00 H new ATOM 0 HB3 HIS A 106 30.701 -9.764 11.399 1.00 1.00 H new ATOM 0 HD2 HIS A 106 27.479 -11.722 10.663 1.00 1.00 H new ATOM 0 HE1 HIS A 106 27.157 -10.430 14.671 1.00 1.00 H new ATOM 0 HE2 HIS A 106 26.125 -11.980 12.910 1.00 1.00 H new TER 1666 HIS A 106