USER MOD reduce.3.24.130724 H: found=0, std=0, add=1288, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1288 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 9 ASN : amide:sc= -0.171 X(o=-0.17,f=-0.18) USER MOD Set 1.2: B 10 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: B 6 LYS NZ :NH3+ -173:sc= 0.962 (180deg=0.87) USER MOD Set 2.2: B 7 TYR OH : rot 170:sc= 0.739 USER MOD Set 3.1: A 55 GLN : amide:sc= -2.03 K(o=-1.5,f=-12!) USER MOD Set 3.2: B 70 LYS NZ :NH3+ -175:sc= 0.56 (180deg=-0.264) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 TYR OH : rot 38:sc= 1.24 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= 0 X(o=0,f=-0.026) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0.0126 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 SER OG : rot 76:sc= 1.24 USER MOD Single : A 25 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0208) USER MOD Single : A 26 HIS : no HD1:sc= 1.02 K(o=1,f=-5!) USER MOD Single : A 27 LYS NZ :NH3+ 141:sc= 1.77 (180deg=1.09) USER MOD Single : A 30 THR OG1 : rot 180:sc= -1.64! USER MOD Single : A 33 SER OG : rot -75:sc= -0.457 USER MOD Single : A 35 MET CE :methyl 146:sc= 0 (180deg=-0.0191) USER MOD Single : A 39 ASN : amide:sc= -1.04 K(o=-1,f=-0.51) USER MOD Single : A 40 CYS SG : rot 170:sc= 0 USER MOD Single : A 42 THR OG1 : rot 98:sc= -0.616! USER MOD Single : A 43 HIS : no HE2:sc= 1.06 K(o=1.1,f=-6.5!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 60 GLN : amide:sc= -0.848 K(o=-0.85,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 68 SER OG : rot 75:sc= 1.24 USER MOD Single : A 70 LYS NZ :NH3+ 178:sc= 1.1 (180deg=0.986) USER MOD Single : A 71 SER OG : rot -84:sc= 0.833 USER MOD Single : A 72 ASN : amide:sc= 1.14 K(o=1.1,f=-1.8!) USER MOD Single : A 75 HIS : no HD1:sc= -0.136 X(o=-0.14,f=0) USER MOD Single : A 76 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 77 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 78 HIS : no HD1:sc= -0.0163 X(o=-0.016,f=0) USER MOD Single : A 79 HIS : no HD1:sc= -0.129 X(o=-0.13,f=-0.19) USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 1 MET CE :methyl -160:sc= -0.139 (180deg=-0.644) USER MOD Single : B 1 MET N :NH3+ -115:sc= 0.0519 (180deg=-0.0443) USER MOD Single : B 4 GLN : amide:sc= -1.65! C(o=-1.7!,f=-4!) USER MOD Single : B 5 SER OG : rot 180:sc= 0 USER MOD Single : B 8 SER OG : rot 180:sc= 0 USER MOD Single : B 11 GLN : amide:sc= 0.472 X(o=0.47,f=0) USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 HIS : no HD1:sc= -0.133 K(o=-0.13,f=-5.8!) USER MOD Single : B 27 LYS NZ :NH3+ -171:sc=-0.00953 (180deg=-0.168) USER MOD Single : B 30 THR OG1 : rot 100:sc= -1.9! USER MOD Single : B 33 SER OG : rot 72:sc= 0.803 USER MOD Single : B 35 MET CE :methyl 160:sc= -0.207 (180deg=-0.843) USER MOD Single : B 39 ASN : amide:sc= 1.2 K(o=1.2,f=-0.0047) USER MOD Single : B 40 CYS SG : rot 65:sc= 0.236 USER MOD Single : B 42 THR OG1 : rot -80:sc= 0.336 USER MOD Single : B 43 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 48 LYS NZ :NH3+ 168:sc= -0.0271 (180deg=-0.196) USER MOD Single : B 51 SER OG : rot 180:sc= -0.845 USER MOD Single : B 53 SER OG : rot 180:sc= 0 USER MOD Single : B 55 GLN : amide:sc= -0.639 K(o=-0.64,f=-3.7!) USER MOD Single : B 60 GLN : amide:sc= -0.0693 X(o=-0.069,f=-0.0018) USER MOD Single : B 63 LYS NZ :NH3+ -170:sc= 1.21 (180deg=1.01) USER MOD Single : B 67 GLN : amide:sc= -2.2! K(o=-2.2!,f=-0.6) USER MOD Single : B 68 SER OG : rot 180:sc= 0 USER MOD Single : B 71 SER OG : rot -99:sc= 1.28 USER MOD Single : B 72 ASN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : B 75 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 76 HIS : no HD1:sc= 0 X(o=0,f=-0.053) USER MOD Single : B 77 HIS : no HD1:sc= 0 X(o=0,f=-0.0042) USER MOD Single : B 78 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 79 HIS : no HD1:sc= 0 X(o=0,f=-0.0049) USER MOD Single : B 80 HIS : no HD1:sc= 0 X(o=0,f=-0.0016) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -9.662 30.064 -3.096 1.00 0.00 N ATOM 2 CA MET A 1 -10.191 31.249 -3.806 1.00 0.00 C ATOM 3 C MET A 1 -10.484 30.909 -5.265 1.00 0.00 C ATOM 4 O MET A 1 -11.633 30.647 -5.630 1.00 0.00 O ATOM 5 CB MET A 1 -9.196 32.413 -3.718 1.00 0.00 C ATOM 6 CG MET A 1 -9.706 33.702 -4.348 1.00 0.00 C ATOM 7 SD MET A 1 -8.502 35.044 -4.276 1.00 0.00 S ATOM 8 CE MET A 1 -9.438 36.375 -5.029 1.00 0.00 C ATOM 0 H1 MET A 1 -9.468 30.311 -2.105 1.00 0.00 H new ATOM 0 H2 MET A 1 -10.363 29.297 -3.130 1.00 0.00 H new ATOM 0 H3 MET A 1 -8.782 29.749 -3.553 1.00 0.00 H new ATOM 0 HA MET A 1 -11.122 31.552 -3.327 1.00 0.00 H new ATOM 0 HB2 MET A 1 -8.960 32.599 -2.670 1.00 0.00 H new ATOM 0 HB3 MET A 1 -8.266 32.123 -4.207 1.00 0.00 H new ATOM 0 HG2 MET A 1 -9.969 33.512 -5.389 1.00 0.00 H new ATOM 0 HG3 MET A 1 -10.619 34.012 -3.840 1.00 0.00 H new ATOM 0 HE1 MET A 1 -8.828 37.278 -5.058 1.00 0.00 H new ATOM 0 HE2 MET A 1 -9.718 36.094 -6.044 1.00 0.00 H new ATOM 0 HE3 MET A 1 -10.338 36.564 -4.443 1.00 0.00 H new ATOM 20 N ALA A 2 -9.450 30.892 -6.096 1.00 0.00 N ATOM 21 CA ALA A 2 -9.622 30.606 -7.514 1.00 0.00 C ATOM 22 C ALA A 2 -8.665 29.513 -7.976 1.00 0.00 C ATOM 23 O ALA A 2 -9.062 28.611 -8.716 1.00 0.00 O ATOM 24 CB ALA A 2 -9.429 31.868 -8.343 1.00 0.00 C ATOM 0 H ALA A 2 -8.487 31.072 -5.814 1.00 0.00 H new ATOM 0 HA ALA A 2 -10.640 30.246 -7.661 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -9.562 31.633 -9.399 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -10.162 32.616 -8.043 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -8.425 32.259 -8.182 1.00 0.00 H new ATOM 30 N ILE A 3 -7.411 29.591 -7.541 1.00 0.00 N ATOM 31 CA ILE A 3 -6.411 28.602 -7.934 1.00 0.00 C ATOM 32 C ILE A 3 -6.794 27.213 -7.429 1.00 0.00 C ATOM 33 O ILE A 3 -7.487 27.082 -6.414 1.00 0.00 O ATOM 34 CB ILE A 3 -4.996 28.965 -7.430 1.00 0.00 C ATOM 35 CG1 ILE A 3 -4.974 29.106 -5.904 1.00 0.00 C ATOM 36 CG2 ILE A 3 -4.516 30.248 -8.093 1.00 0.00 C ATOM 37 CD1 ILE A 3 -3.598 29.374 -5.333 1.00 0.00 C ATOM 0 H ILE A 3 -7.064 30.323 -6.921 1.00 0.00 H new ATOM 0 HA ILE A 3 -6.388 28.599 -9.024 1.00 0.00 H new ATOM 0 HB ILE A 3 -4.318 28.155 -7.700 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -5.641 29.918 -5.614 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -5.370 28.193 -5.459 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -3.518 30.494 -7.730 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -4.485 30.110 -9.174 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -5.201 31.061 -7.851 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -3.665 29.461 -4.249 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -2.931 28.551 -5.590 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -3.206 30.303 -5.748 1.00 0.00 H new ATOM 49 N GLN A 4 -6.345 26.189 -8.151 1.00 0.00 N ATOM 50 CA GLN A 4 -6.701 24.804 -7.859 1.00 0.00 C ATOM 51 C GLN A 4 -6.447 24.451 -6.399 1.00 0.00 C ATOM 52 O GLN A 4 -5.336 24.595 -5.885 1.00 0.00 O ATOM 53 CB GLN A 4 -5.944 23.842 -8.782 1.00 0.00 C ATOM 54 CG GLN A 4 -4.445 24.067 -8.807 1.00 0.00 C ATOM 55 CD GLN A 4 -3.714 23.060 -9.671 1.00 0.00 C ATOM 56 OE1 GLN A 4 -4.132 21.909 -9.802 1.00 0.00 O ATOM 57 NE2 GLN A 4 -2.626 23.495 -10.282 1.00 0.00 N ATOM 0 H GLN A 4 -5.725 26.296 -8.954 1.00 0.00 H new ATOM 0 HA GLN A 4 -7.770 24.698 -8.044 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -6.143 22.818 -8.465 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -6.334 23.944 -9.795 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -4.239 25.072 -9.175 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -4.057 24.015 -7.790 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -2.315 24.457 -10.146 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -2.098 22.869 -10.890 1.00 0.00 H new ATOM 66 N SER A 5 -7.501 24.011 -5.738 1.00 0.00 N ATOM 67 CA SER A 5 -7.436 23.651 -4.335 1.00 0.00 C ATOM 68 C SER A 5 -7.443 22.137 -4.174 1.00 0.00 C ATOM 69 O SER A 5 -7.611 21.615 -3.071 1.00 0.00 O ATOM 70 CB SER A 5 -8.616 24.280 -3.599 1.00 0.00 C ATOM 71 OG SER A 5 -8.717 25.661 -3.915 1.00 0.00 O ATOM 0 H SER A 5 -8.423 23.893 -6.157 1.00 0.00 H new ATOM 0 HA SER A 5 -6.507 24.028 -3.906 1.00 0.00 H new ATOM 0 HB2 SER A 5 -9.539 23.769 -3.874 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.491 24.155 -2.524 1.00 0.00 H new ATOM 0 HG SER A 5 -9.479 26.051 -3.438 1.00 0.00 H new ATOM 77 N LYS A 6 -7.254 21.442 -5.288 1.00 0.00 N ATOM 78 CA LYS A 6 -7.179 19.992 -5.277 1.00 0.00 C ATOM 79 C LYS A 6 -5.778 19.552 -4.872 1.00 0.00 C ATOM 80 O LYS A 6 -4.837 19.642 -5.665 1.00 0.00 O ATOM 81 CB LYS A 6 -7.549 19.418 -6.648 1.00 0.00 C ATOM 82 CG LYS A 6 -7.523 17.895 -6.701 1.00 0.00 C ATOM 83 CD LYS A 6 -7.976 17.372 -8.056 1.00 0.00 C ATOM 84 CE LYS A 6 -7.839 15.860 -8.140 1.00 0.00 C ATOM 85 NZ LYS A 6 -8.288 15.331 -9.456 1.00 0.00 N ATOM 0 H LYS A 6 -7.150 21.863 -6.211 1.00 0.00 H new ATOM 0 HA LYS A 6 -7.895 19.609 -4.549 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -8.546 19.765 -6.921 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -6.859 19.811 -7.395 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -6.513 17.541 -6.493 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -8.169 17.492 -5.921 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -9.014 17.655 -8.229 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -7.384 17.837 -8.844 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -6.799 15.581 -7.973 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -8.425 15.398 -7.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -8.178 14.297 -9.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -9.288 15.575 -9.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -7.713 15.751 -10.214 1.00 0.00 H new ATOM 99 N TYR A 7 -5.664 19.107 -3.621 1.00 0.00 N ATOM 100 CA TYR A 7 -4.400 18.650 -3.033 1.00 0.00 C ATOM 101 C TYR A 7 -3.492 19.825 -2.693 1.00 0.00 C ATOM 102 O TYR A 7 -3.858 20.990 -2.859 1.00 0.00 O ATOM 103 CB TYR A 7 -3.636 17.686 -3.954 1.00 0.00 C ATOM 104 CG TYR A 7 -4.365 16.411 -4.302 1.00 0.00 C ATOM 105 CD1 TYR A 7 -4.863 15.572 -3.315 1.00 0.00 C ATOM 106 CD2 TYR A 7 -4.537 16.045 -5.626 1.00 0.00 C ATOM 107 CE1 TYR A 7 -5.515 14.399 -3.646 1.00 0.00 C ATOM 108 CE2 TYR A 7 -5.182 14.875 -5.965 1.00 0.00 C ATOM 109 CZ TYR A 7 -5.671 14.056 -4.973 1.00 0.00 C ATOM 110 OH TYR A 7 -6.307 12.885 -5.314 1.00 0.00 O ATOM 0 H TYR A 7 -6.454 19.052 -2.978 1.00 0.00 H new ATOM 0 HA TYR A 7 -4.672 18.116 -2.122 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -3.393 18.210 -4.879 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -2.691 17.426 -3.477 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -4.740 15.839 -2.276 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -4.159 16.688 -6.407 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -5.900 13.754 -2.870 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -5.303 14.603 -7.003 1.00 0.00 H new ATOM 0 HH TYR A 7 -7.058 12.730 -4.703 1.00 0.00 H new ATOM 120 N SER A 8 -2.313 19.494 -2.192 1.00 0.00 N ATOM 121 CA SER A 8 -1.268 20.466 -1.920 1.00 0.00 C ATOM 122 C SER A 8 0.048 19.723 -1.729 1.00 0.00 C ATOM 123 O SER A 8 0.068 18.642 -1.139 1.00 0.00 O ATOM 124 CB SER A 8 -1.602 21.301 -0.676 1.00 0.00 C ATOM 125 OG SER A 8 -0.581 22.247 -0.407 1.00 0.00 O ATOM 0 H SER A 8 -2.053 18.535 -1.961 1.00 0.00 H new ATOM 0 HA SER A 8 -1.186 21.155 -2.761 1.00 0.00 H new ATOM 0 HB2 SER A 8 -2.550 21.817 -0.825 1.00 0.00 H new ATOM 0 HB3 SER A 8 -1.728 20.643 0.184 1.00 0.00 H new ATOM 0 HG SER A 8 -0.818 22.767 0.389 1.00 0.00 H new ATOM 131 N ASN A 9 1.135 20.287 -2.241 1.00 0.00 N ATOM 132 CA ASN A 9 2.441 19.636 -2.163 1.00 0.00 C ATOM 133 C ASN A 9 2.853 19.439 -0.709 1.00 0.00 C ATOM 134 O ASN A 9 3.291 18.356 -0.321 1.00 0.00 O ATOM 135 CB ASN A 9 3.497 20.456 -2.913 1.00 0.00 C ATOM 136 CG ASN A 9 4.875 19.816 -2.880 1.00 0.00 C ATOM 137 OD1 ASN A 9 5.674 20.078 -1.985 1.00 0.00 O ATOM 138 ND2 ASN A 9 5.171 18.981 -3.866 1.00 0.00 N ATOM 0 H ASN A 9 1.141 21.191 -2.714 1.00 0.00 H new ATOM 0 HA ASN A 9 2.366 18.657 -2.636 1.00 0.00 H new ATOM 0 HB2 ASN A 9 3.184 20.580 -3.950 1.00 0.00 H new ATOM 0 HB3 ASN A 9 3.554 21.453 -2.475 1.00 0.00 H new ATOM 0 HD21 ASN A 9 6.087 18.533 -3.897 1.00 0.00 H new ATOM 0 HD22 ASN A 9 4.483 18.786 -4.593 1.00 0.00 H new ATOM 145 N THR A 10 2.672 20.483 0.094 1.00 0.00 N ATOM 146 CA THR A 10 2.993 20.431 1.511 1.00 0.00 C ATOM 147 C THR A 10 2.124 19.392 2.216 1.00 0.00 C ATOM 148 O THR A 10 2.614 18.590 3.014 1.00 0.00 O ATOM 149 CB THR A 10 2.772 21.807 2.166 1.00 0.00 C ATOM 150 OG1 THR A 10 3.253 22.840 1.294 1.00 0.00 O ATOM 151 CG2 THR A 10 3.488 21.897 3.506 1.00 0.00 C ATOM 0 H THR A 10 2.302 21.381 -0.218 1.00 0.00 H new ATOM 0 HA THR A 10 4.042 20.151 1.609 1.00 0.00 H new ATOM 0 HB THR A 10 1.703 21.936 2.338 1.00 0.00 H new ATOM 0 HG1 THR A 10 3.110 23.714 1.713 1.00 0.00 H new ATOM 0 HG21 THR A 10 3.315 22.879 3.946 1.00 0.00 H new ATOM 0 HG22 THR A 10 3.105 21.127 4.176 1.00 0.00 H new ATOM 0 HG23 THR A 10 4.558 21.750 3.358 1.00 0.00 H new ATOM 159 N GLN A 11 0.833 19.411 1.894 1.00 0.00 N ATOM 160 CA GLN A 11 -0.132 18.478 2.461 1.00 0.00 C ATOM 161 C GLN A 11 0.294 17.031 2.224 1.00 0.00 C ATOM 162 O GLN A 11 0.486 16.269 3.173 1.00 0.00 O ATOM 163 CB GLN A 11 -1.509 18.726 1.838 1.00 0.00 C ATOM 164 CG GLN A 11 -2.587 17.761 2.300 1.00 0.00 C ATOM 165 CD GLN A 11 -3.906 17.993 1.587 1.00 0.00 C ATOM 166 OE1 GLN A 11 -4.159 17.425 0.527 1.00 0.00 O ATOM 167 NE2 GLN A 11 -4.751 18.835 2.159 1.00 0.00 N ATOM 0 H GLN A 11 0.428 20.074 1.233 1.00 0.00 H new ATOM 0 HA GLN A 11 -0.180 18.643 3.537 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -1.823 19.743 2.073 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -1.421 18.662 0.753 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -2.256 16.737 2.124 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -2.733 17.869 3.375 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -4.504 19.286 3.040 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -5.650 19.033 1.719 1.00 0.00 H new ATOM 176 N VAL A 12 0.461 16.671 0.957 1.00 0.00 N ATOM 177 CA VAL A 12 0.776 15.298 0.583 1.00 0.00 C ATOM 178 C VAL A 12 2.101 14.848 1.192 1.00 0.00 C ATOM 179 O VAL A 12 2.191 13.759 1.759 1.00 0.00 O ATOM 180 CB VAL A 12 0.827 15.129 -0.952 1.00 0.00 C ATOM 181 CG1 VAL A 12 1.123 13.684 -1.329 1.00 0.00 C ATOM 182 CG2 VAL A 12 -0.482 15.585 -1.582 1.00 0.00 C ATOM 0 H VAL A 12 0.383 17.314 0.169 1.00 0.00 H new ATOM 0 HA VAL A 12 -0.023 14.670 0.977 1.00 0.00 H new ATOM 0 HB VAL A 12 1.634 15.753 -1.336 1.00 0.00 H new ATOM 0 HG11 VAL A 12 1.154 13.590 -2.415 1.00 0.00 H new ATOM 0 HG12 VAL A 12 2.086 13.389 -0.912 1.00 0.00 H new ATOM 0 HG13 VAL A 12 0.342 13.037 -0.931 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -0.429 15.459 -2.663 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -1.303 14.987 -1.187 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -0.652 16.636 -1.347 1.00 0.00 H new ATOM 192 N GLU A 13 3.116 15.701 1.099 1.00 0.00 N ATOM 193 CA GLU A 13 4.442 15.363 1.601 1.00 0.00 C ATOM 194 C GLU A 13 4.417 15.137 3.111 1.00 0.00 C ATOM 195 O GLU A 13 5.002 14.175 3.611 1.00 0.00 O ATOM 196 CB GLU A 13 5.442 16.464 1.252 1.00 0.00 C ATOM 197 CG GLU A 13 6.871 16.126 1.642 1.00 0.00 C ATOM 198 CD GLU A 13 7.850 17.207 1.249 1.00 0.00 C ATOM 199 OE1 GLU A 13 8.180 17.309 0.050 1.00 0.00 O ATOM 200 OE2 GLU A 13 8.293 17.965 2.136 1.00 0.00 O ATOM 0 H GLU A 13 3.046 16.629 0.682 1.00 0.00 H new ATOM 0 HA GLU A 13 4.755 14.436 1.121 1.00 0.00 H new ATOM 0 HB2 GLU A 13 5.401 16.655 0.180 1.00 0.00 H new ATOM 0 HB3 GLU A 13 5.145 17.386 1.752 1.00 0.00 H new ATOM 0 HG2 GLU A 13 6.922 15.968 2.719 1.00 0.00 H new ATOM 0 HG3 GLU A 13 7.161 15.188 1.168 1.00 0.00 H new ATOM 207 N SER A 14 3.725 16.018 3.830 1.00 0.00 N ATOM 208 CA SER A 14 3.626 15.902 5.280 1.00 0.00 C ATOM 209 C SER A 14 2.891 14.626 5.670 1.00 0.00 C ATOM 210 O SER A 14 3.252 13.965 6.645 1.00 0.00 O ATOM 211 CB SER A 14 2.918 17.124 5.867 1.00 0.00 C ATOM 212 OG SER A 14 3.596 18.320 5.515 1.00 0.00 O ATOM 0 H SER A 14 3.228 16.815 3.433 1.00 0.00 H new ATOM 0 HA SER A 14 4.636 15.855 5.688 1.00 0.00 H new ATOM 0 HB2 SER A 14 1.891 17.163 5.504 1.00 0.00 H new ATOM 0 HB3 SER A 14 2.869 17.035 6.952 1.00 0.00 H new ATOM 0 HG SER A 14 3.402 18.543 4.581 1.00 0.00 H new ATOM 218 N LEU A 15 1.866 14.274 4.899 1.00 0.00 N ATOM 219 CA LEU A 15 1.135 13.036 5.129 1.00 0.00 C ATOM 220 C LEU A 15 2.046 11.832 4.929 1.00 0.00 C ATOM 221 O LEU A 15 2.211 11.029 5.841 1.00 0.00 O ATOM 222 CB LEU A 15 -0.085 12.936 4.209 1.00 0.00 C ATOM 223 CG LEU A 15 -1.414 13.383 4.830 1.00 0.00 C ATOM 224 CD1 LEU A 15 -1.358 14.840 5.260 1.00 0.00 C ATOM 225 CD2 LEU A 15 -2.555 13.162 3.851 1.00 0.00 C ATOM 0 H LEU A 15 1.525 14.827 4.113 1.00 0.00 H new ATOM 0 HA LEU A 15 0.783 13.042 6.161 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.102 13.537 3.319 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.187 11.902 3.879 1.00 0.00 H new ATOM 0 HG LEU A 15 -1.591 12.778 5.719 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -2.315 15.128 5.696 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -0.568 14.971 5.999 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -1.151 15.468 4.393 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -3.492 13.484 4.306 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -2.374 13.740 2.945 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -2.619 12.103 3.599 1.00 0.00 H new ATOM 237 N ILE A 16 2.653 11.736 3.745 1.00 0.00 N ATOM 238 CA ILE A 16 3.553 10.628 3.418 1.00 0.00 C ATOM 239 C ILE A 16 4.616 10.457 4.495 1.00 0.00 C ATOM 240 O ILE A 16 4.862 9.348 4.973 1.00 0.00 O ATOM 241 CB ILE A 16 4.246 10.853 2.054 1.00 0.00 C ATOM 242 CG1 ILE A 16 3.205 10.942 0.936 1.00 0.00 C ATOM 243 CG2 ILE A 16 5.250 9.740 1.764 1.00 0.00 C ATOM 244 CD1 ILE A 16 3.785 11.341 -0.404 1.00 0.00 C ATOM 0 H ILE A 16 2.537 12.415 2.993 1.00 0.00 H new ATOM 0 HA ILE A 16 2.945 9.725 3.363 1.00 0.00 H new ATOM 0 HB ILE A 16 4.790 11.796 2.099 1.00 0.00 H new ATOM 0 HG12 ILE A 16 2.710 9.976 0.835 1.00 0.00 H new ATOM 0 HG13 ILE A 16 2.440 11.664 1.221 1.00 0.00 H new ATOM 0 HG21 ILE A 16 5.724 9.920 0.799 1.00 0.00 H new ATOM 0 HG22 ILE A 16 6.010 9.723 2.545 1.00 0.00 H new ATOM 0 HG23 ILE A 16 4.733 8.781 1.740 1.00 0.00 H new ATOM 0 HD11 ILE A 16 2.989 11.383 -1.147 1.00 0.00 H new ATOM 0 HD12 ILE A 16 4.255 12.321 -0.320 1.00 0.00 H new ATOM 0 HD13 ILE A 16 4.529 10.607 -0.712 1.00 0.00 H new ATOM 256 N ALA A 17 5.229 11.569 4.885 1.00 0.00 N ATOM 257 CA ALA A 17 6.252 11.555 5.916 1.00 0.00 C ATOM 258 C ALA A 17 5.714 10.976 7.219 1.00 0.00 C ATOM 259 O ALA A 17 6.308 10.067 7.792 1.00 0.00 O ATOM 260 CB ALA A 17 6.783 12.961 6.144 1.00 0.00 C ATOM 0 H ALA A 17 5.032 12.493 4.499 1.00 0.00 H new ATOM 0 HA ALA A 17 7.067 10.916 5.576 1.00 0.00 H new ATOM 0 HB1 ALA A 17 7.549 12.939 6.919 1.00 0.00 H new ATOM 0 HB2 ALA A 17 7.214 13.342 5.218 1.00 0.00 H new ATOM 0 HB3 ALA A 17 5.967 13.611 6.459 1.00 0.00 H new ATOM 266 N GLU A 18 4.568 11.485 7.661 1.00 0.00 N ATOM 267 CA GLU A 18 4.002 11.095 8.944 1.00 0.00 C ATOM 268 C GLU A 18 3.593 9.620 8.950 1.00 0.00 C ATOM 269 O GLU A 18 3.749 8.938 9.964 1.00 0.00 O ATOM 270 CB GLU A 18 2.815 11.995 9.296 1.00 0.00 C ATOM 271 CG GLU A 18 2.239 11.740 10.678 1.00 0.00 C ATOM 272 CD GLU A 18 1.352 12.871 11.152 1.00 0.00 C ATOM 273 OE1 GLU A 18 0.170 12.912 10.770 1.00 0.00 O ATOM 274 OE2 GLU A 18 1.842 13.735 11.914 1.00 0.00 O ATOM 0 H GLU A 18 4.014 12.170 7.147 1.00 0.00 H new ATOM 0 HA GLU A 18 4.771 11.222 9.706 1.00 0.00 H new ATOM 0 HB2 GLU A 18 3.129 13.037 9.230 1.00 0.00 H new ATOM 0 HB3 GLU A 18 2.030 11.852 8.554 1.00 0.00 H new ATOM 0 HG2 GLU A 18 1.665 10.813 10.664 1.00 0.00 H new ATOM 0 HG3 GLU A 18 3.054 11.599 11.388 1.00 0.00 H new ATOM 281 N ILE A 19 3.092 9.128 7.818 1.00 0.00 N ATOM 282 CA ILE A 19 2.740 7.713 7.699 1.00 0.00 C ATOM 283 C ILE A 19 3.982 6.857 7.950 1.00 0.00 C ATOM 284 O ILE A 19 3.955 5.885 8.713 1.00 0.00 O ATOM 285 CB ILE A 19 2.179 7.353 6.297 1.00 0.00 C ATOM 286 CG1 ILE A 19 1.118 8.356 5.833 1.00 0.00 C ATOM 287 CG2 ILE A 19 1.580 5.955 6.319 1.00 0.00 C ATOM 288 CD1 ILE A 19 -0.209 8.241 6.550 1.00 0.00 C ATOM 0 H ILE A 19 2.922 9.681 6.978 1.00 0.00 H new ATOM 0 HA ILE A 19 1.963 7.516 8.438 1.00 0.00 H new ATOM 0 HB ILE A 19 3.010 7.390 5.592 1.00 0.00 H new ATOM 0 HG12 ILE A 19 1.505 9.365 5.971 1.00 0.00 H new ATOM 0 HG13 ILE A 19 0.952 8.222 4.764 1.00 0.00 H new ATOM 0 HG21 ILE A 19 1.189 5.711 5.331 1.00 0.00 H new ATOM 0 HG22 ILE A 19 2.350 5.234 6.593 1.00 0.00 H new ATOM 0 HG23 ILE A 19 0.771 5.917 7.049 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -0.900 8.988 6.159 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -0.623 7.245 6.391 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -0.062 8.407 7.617 1.00 0.00 H new ATOM 300 N LEU A 20 5.080 7.254 7.312 1.00 0.00 N ATOM 301 CA LEU A 20 6.349 6.547 7.434 1.00 0.00 C ATOM 302 C LEU A 20 6.934 6.708 8.832 1.00 0.00 C ATOM 303 O LEU A 20 7.556 5.783 9.361 1.00 0.00 O ATOM 304 CB LEU A 20 7.345 7.059 6.391 1.00 0.00 C ATOM 305 CG LEU A 20 6.918 6.865 4.935 1.00 0.00 C ATOM 306 CD1 LEU A 20 7.933 7.494 3.996 1.00 0.00 C ATOM 307 CD2 LEU A 20 6.748 5.387 4.619 1.00 0.00 C ATOM 0 H LEU A 20 5.114 8.069 6.700 1.00 0.00 H new ATOM 0 HA LEU A 20 6.161 5.488 7.260 1.00 0.00 H new ATOM 0 HB2 LEU A 20 7.515 8.122 6.565 1.00 0.00 H new ATOM 0 HB3 LEU A 20 8.299 6.554 6.544 1.00 0.00 H new ATOM 0 HG LEU A 20 5.958 7.360 4.790 1.00 0.00 H new ATOM 0 HD11 LEU A 20 7.614 7.347 2.964 1.00 0.00 H new ATOM 0 HD12 LEU A 20 8.008 8.561 4.204 1.00 0.00 H new ATOM 0 HD13 LEU A 20 8.906 7.026 4.145 1.00 0.00 H new ATOM 0 HD21 LEU A 20 6.444 5.270 3.579 1.00 0.00 H new ATOM 0 HD22 LEU A 20 7.693 4.869 4.781 1.00 0.00 H new ATOM 0 HD23 LEU A 20 5.985 4.961 5.270 1.00 0.00 H new ATOM 319 N VAL A 21 6.738 7.881 9.428 1.00 0.00 N ATOM 320 CA VAL A 21 7.202 8.133 10.787 1.00 0.00 C ATOM 321 C VAL A 21 6.536 7.169 11.761 1.00 0.00 C ATOM 322 O VAL A 21 7.172 6.694 12.692 1.00 0.00 O ATOM 323 CB VAL A 21 6.944 9.592 11.235 1.00 0.00 C ATOM 324 CG1 VAL A 21 7.293 9.779 12.705 1.00 0.00 C ATOM 325 CG2 VAL A 21 7.749 10.564 10.386 1.00 0.00 C ATOM 0 H VAL A 21 6.262 8.670 8.991 1.00 0.00 H new ATOM 0 HA VAL A 21 8.280 7.973 10.791 1.00 0.00 H new ATOM 0 HB VAL A 21 5.883 9.799 11.100 1.00 0.00 H new ATOM 0 HG11 VAL A 21 7.103 10.812 12.995 1.00 0.00 H new ATOM 0 HG12 VAL A 21 6.680 9.113 13.312 1.00 0.00 H new ATOM 0 HG13 VAL A 21 8.346 9.546 12.861 1.00 0.00 H new ATOM 0 HG21 VAL A 21 7.554 11.584 10.717 1.00 0.00 H new ATOM 0 HG22 VAL A 21 8.812 10.346 10.492 1.00 0.00 H new ATOM 0 HG23 VAL A 21 7.459 10.460 9.340 1.00 0.00 H new ATOM 335 N VAL A 22 5.262 6.869 11.533 1.00 0.00 N ATOM 336 CA VAL A 22 4.552 5.896 12.360 1.00 0.00 C ATOM 337 C VAL A 22 5.205 4.522 12.259 1.00 0.00 C ATOM 338 O VAL A 22 5.508 3.892 13.277 1.00 0.00 O ATOM 339 CB VAL A 22 3.062 5.788 11.968 1.00 0.00 C ATOM 340 CG1 VAL A 22 2.384 4.645 12.711 1.00 0.00 C ATOM 341 CG2 VAL A 22 2.350 7.098 12.256 1.00 0.00 C ATOM 0 H VAL A 22 4.701 7.282 10.788 1.00 0.00 H new ATOM 0 HA VAL A 22 4.611 6.250 13.389 1.00 0.00 H new ATOM 0 HB VAL A 22 3.004 5.579 10.900 1.00 0.00 H new ATOM 0 HG11 VAL A 22 1.336 4.591 12.417 1.00 0.00 H new ATOM 0 HG12 VAL A 22 2.879 3.706 12.464 1.00 0.00 H new ATOM 0 HG13 VAL A 22 2.451 4.819 13.785 1.00 0.00 H new ATOM 0 HG21 VAL A 22 1.300 7.011 11.976 1.00 0.00 H new ATOM 0 HG22 VAL A 22 2.424 7.326 13.319 1.00 0.00 H new ATOM 0 HG23 VAL A 22 2.814 7.899 11.680 1.00 0.00 H new ATOM 351 N LEU A 23 5.412 4.062 11.029 1.00 0.00 N ATOM 352 CA LEU A 23 6.110 2.798 10.784 1.00 0.00 C ATOM 353 C LEU A 23 7.460 2.749 11.506 1.00 0.00 C ATOM 354 O LEU A 23 7.747 1.803 12.244 1.00 0.00 O ATOM 355 CB LEU A 23 6.324 2.600 9.283 1.00 0.00 C ATOM 356 CG LEU A 23 5.047 2.563 8.445 1.00 0.00 C ATOM 357 CD1 LEU A 23 5.382 2.475 6.969 1.00 0.00 C ATOM 358 CD2 LEU A 23 4.169 1.392 8.857 1.00 0.00 C ATOM 0 H LEU A 23 5.107 4.544 10.183 1.00 0.00 H new ATOM 0 HA LEU A 23 5.486 1.995 11.177 1.00 0.00 H new ATOM 0 HB2 LEU A 23 6.959 3.405 8.913 1.00 0.00 H new ATOM 0 HB3 LEU A 23 6.868 1.668 9.129 1.00 0.00 H new ATOM 0 HG LEU A 23 4.496 3.487 8.622 1.00 0.00 H new ATOM 0 HD11 LEU A 23 4.460 2.450 6.388 1.00 0.00 H new ATOM 0 HD12 LEU A 23 5.971 3.344 6.677 1.00 0.00 H new ATOM 0 HD13 LEU A 23 5.956 1.568 6.780 1.00 0.00 H new ATOM 0 HD21 LEU A 23 3.265 1.383 8.248 1.00 0.00 H new ATOM 0 HD22 LEU A 23 4.714 0.459 8.710 1.00 0.00 H new ATOM 0 HD23 LEU A 23 3.898 1.493 9.908 1.00 0.00 H new ATOM 370 N GLU A 24 8.276 3.779 11.303 1.00 0.00 N ATOM 371 CA GLU A 24 9.618 3.826 11.882 1.00 0.00 C ATOM 372 C GLU A 24 9.597 4.075 13.390 1.00 0.00 C ATOM 373 O GLU A 24 10.543 3.714 14.093 1.00 0.00 O ATOM 374 CB GLU A 24 10.457 4.899 11.189 1.00 0.00 C ATOM 375 CG GLU A 24 11.161 4.398 9.944 1.00 0.00 C ATOM 376 CD GLU A 24 12.182 3.323 10.264 1.00 0.00 C ATOM 377 OE1 GLU A 24 13.033 3.558 11.147 1.00 0.00 O ATOM 378 OE2 GLU A 24 12.151 2.250 9.632 1.00 0.00 O ATOM 0 H GLU A 24 8.032 4.595 10.741 1.00 0.00 H new ATOM 0 HA GLU A 24 10.068 2.846 11.721 1.00 0.00 H new ATOM 0 HB2 GLU A 24 9.813 5.737 10.922 1.00 0.00 H new ATOM 0 HB3 GLU A 24 11.200 5.279 11.890 1.00 0.00 H new ATOM 0 HG2 GLU A 24 10.424 4.002 9.245 1.00 0.00 H new ATOM 0 HG3 GLU A 24 11.656 5.232 9.447 1.00 0.00 H new ATOM 385 N LYS A 25 8.527 4.690 13.880 1.00 0.00 N ATOM 386 CA LYS A 25 8.368 4.944 15.310 1.00 0.00 C ATOM 387 C LYS A 25 8.254 3.625 16.061 1.00 0.00 C ATOM 388 O LYS A 25 8.806 3.460 17.149 1.00 0.00 O ATOM 389 CB LYS A 25 7.126 5.808 15.558 1.00 0.00 C ATOM 390 CG LYS A 25 6.929 6.231 17.007 1.00 0.00 C ATOM 391 CD LYS A 25 5.714 7.138 17.159 1.00 0.00 C ATOM 392 CE LYS A 25 5.883 8.444 16.394 1.00 0.00 C ATOM 393 NZ LYS A 25 6.902 9.327 17.019 1.00 0.00 N ATOM 0 H LYS A 25 7.752 5.024 13.306 1.00 0.00 H new ATOM 0 HA LYS A 25 9.243 5.482 15.675 1.00 0.00 H new ATOM 0 HB2 LYS A 25 7.191 6.702 14.938 1.00 0.00 H new ATOM 0 HB3 LYS A 25 6.244 5.257 15.231 1.00 0.00 H new ATOM 0 HG2 LYS A 25 6.806 5.347 17.633 1.00 0.00 H new ATOM 0 HG3 LYS A 25 7.820 6.750 17.361 1.00 0.00 H new ATOM 0 HD2 LYS A 25 4.826 6.619 16.799 1.00 0.00 H new ATOM 0 HD3 LYS A 25 5.552 7.354 18.215 1.00 0.00 H new ATOM 0 HE2 LYS A 25 6.173 8.227 15.366 1.00 0.00 H new ATOM 0 HE3 LYS A 25 4.927 8.966 16.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 6.914 10.244 16.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 6.667 9.473 18.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 7.839 8.883 16.944 1.00 0.00 H new ATOM 407 N HIS A 26 7.542 2.679 15.459 1.00 0.00 N ATOM 408 CA HIS A 26 7.421 1.338 16.023 1.00 0.00 C ATOM 409 C HIS A 26 8.611 0.486 15.595 1.00 0.00 C ATOM 410 O HIS A 26 8.767 -0.651 16.044 1.00 0.00 O ATOM 411 CB HIS A 26 6.113 0.667 15.583 1.00 0.00 C ATOM 412 CG HIS A 26 4.878 1.282 16.171 1.00 0.00 C ATOM 413 ND1 HIS A 26 4.300 0.837 17.341 1.00 0.00 N ATOM 414 CD2 HIS A 26 4.100 2.303 15.739 1.00 0.00 C ATOM 415 CE1 HIS A 26 3.227 1.556 17.602 1.00 0.00 C ATOM 416 NE2 HIS A 26 3.082 2.452 16.649 1.00 0.00 N ATOM 0 H HIS A 26 7.040 2.815 14.581 1.00 0.00 H new ATOM 0 HA HIS A 26 7.409 1.426 17.109 1.00 0.00 H new ATOM 0 HB2 HIS A 26 6.044 0.709 14.496 1.00 0.00 H new ATOM 0 HB3 HIS A 26 6.147 -0.387 15.860 1.00 0.00 H new ATOM 0 HD2 HIS A 26 4.252 2.890 14.846 1.00 0.00 H new ATOM 0 HE1 HIS A 26 2.576 1.431 18.455 1.00 0.00 H new ATOM 0 HE2 HIS A 26 2.335 3.145 16.595 1.00 0.00 H new ATOM 425 N LYS A 27 9.443 1.062 14.726 1.00 0.00 N ATOM 426 CA LYS A 27 10.619 0.387 14.182 1.00 0.00 C ATOM 427 C LYS A 27 10.232 -0.885 13.452 1.00 0.00 C ATOM 428 O LYS A 27 10.878 -1.924 13.591 1.00 0.00 O ATOM 429 CB LYS A 27 11.645 0.106 15.280 1.00 0.00 C ATOM 430 CG LYS A 27 12.650 1.232 15.438 1.00 0.00 C ATOM 431 CD LYS A 27 13.598 1.284 14.249 1.00 0.00 C ATOM 432 CE LYS A 27 14.366 2.592 14.191 1.00 0.00 C ATOM 433 NZ LYS A 27 13.505 3.720 13.745 1.00 0.00 N ATOM 0 H LYS A 27 9.318 2.013 14.379 1.00 0.00 H new ATOM 0 HA LYS A 27 11.083 1.055 13.456 1.00 0.00 H new ATOM 0 HB2 LYS A 27 11.127 -0.049 16.226 1.00 0.00 H new ATOM 0 HB3 LYS A 27 12.174 -0.819 15.051 1.00 0.00 H new ATOM 0 HG2 LYS A 27 12.125 2.183 15.532 1.00 0.00 H new ATOM 0 HG3 LYS A 27 13.220 1.090 16.356 1.00 0.00 H new ATOM 0 HD2 LYS A 27 14.301 0.453 14.309 1.00 0.00 H new ATOM 0 HD3 LYS A 27 13.031 1.155 13.327 1.00 0.00 H new ATOM 0 HE2 LYS A 27 14.777 2.816 15.175 1.00 0.00 H new ATOM 0 HE3 LYS A 27 15.210 2.488 13.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 13.744 4.575 14.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 13.662 3.898 12.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 12.506 3.478 13.903 1.00 0.00 H new ATOM 447 N ALA A 28 9.182 -0.783 12.654 1.00 0.00 N ATOM 448 CA ALA A 28 8.725 -1.895 11.847 1.00 0.00 C ATOM 449 C ALA A 28 9.687 -2.137 10.693 1.00 0.00 C ATOM 450 O ALA A 28 9.995 -1.217 9.933 1.00 0.00 O ATOM 451 CB ALA A 28 7.324 -1.622 11.319 1.00 0.00 C ATOM 0 H ALA A 28 8.628 0.067 12.550 1.00 0.00 H new ATOM 0 HA ALA A 28 8.694 -2.790 12.469 1.00 0.00 H new ATOM 0 HB1 ALA A 28 6.992 -2.466 10.714 1.00 0.00 H new ATOM 0 HB2 ALA A 28 6.640 -1.485 12.156 1.00 0.00 H new ATOM 0 HB3 ALA A 28 7.335 -0.719 10.708 1.00 0.00 H new ATOM 457 N PRO A 29 10.208 -3.367 10.570 1.00 0.00 N ATOM 458 CA PRO A 29 11.069 -3.748 9.447 1.00 0.00 C ATOM 459 C PRO A 29 10.348 -3.569 8.116 1.00 0.00 C ATOM 460 O PRO A 29 9.122 -3.461 8.089 1.00 0.00 O ATOM 461 CB PRO A 29 11.366 -5.230 9.703 1.00 0.00 C ATOM 462 CG PRO A 29 11.119 -5.426 11.158 1.00 0.00 C ATOM 463 CD PRO A 29 10.018 -4.472 11.522 1.00 0.00 C ATOM 0 HA PRO A 29 11.969 -3.136 9.385 1.00 0.00 H new ATOM 0 HB2 PRO A 29 10.720 -5.871 9.103 1.00 0.00 H new ATOM 0 HB3 PRO A 29 12.394 -5.478 9.440 1.00 0.00 H new ATOM 0 HG2 PRO A 29 10.829 -6.455 11.370 1.00 0.00 H new ATOM 0 HG3 PRO A 29 12.019 -5.223 11.738 1.00 0.00 H new ATOM 0 HD2 PRO A 29 9.035 -4.931 11.416 1.00 0.00 H new ATOM 0 HD3 PRO A 29 10.102 -4.134 12.555 1.00 0.00 H new ATOM 471 N THR A 30 11.097 -3.533 7.022 1.00 0.00 N ATOM 472 CA THR A 30 10.504 -3.375 5.698 1.00 0.00 C ATOM 473 C THR A 30 9.457 -4.458 5.449 1.00 0.00 C ATOM 474 O THR A 30 8.391 -4.196 4.898 1.00 0.00 O ATOM 475 CB THR A 30 11.581 -3.435 4.604 1.00 0.00 C ATOM 476 OG1 THR A 30 12.689 -2.612 4.979 1.00 0.00 O ATOM 477 CG2 THR A 30 11.035 -2.965 3.264 1.00 0.00 C ATOM 0 H THR A 30 12.114 -3.611 7.023 1.00 0.00 H new ATOM 0 HA THR A 30 10.023 -2.398 5.661 1.00 0.00 H new ATOM 0 HB THR A 30 11.901 -4.472 4.499 1.00 0.00 H new ATOM 0 HG1 THR A 30 13.377 -2.652 4.282 1.00 0.00 H new ATOM 0 HG21 THR A 30 11.822 -3.020 2.511 1.00 0.00 H new ATOM 0 HG22 THR A 30 10.203 -3.603 2.966 1.00 0.00 H new ATOM 0 HG23 THR A 30 10.689 -1.935 3.353 1.00 0.00 H new ATOM 485 N ASP A 31 9.771 -5.665 5.897 1.00 0.00 N ATOM 486 CA ASP A 31 8.860 -6.801 5.810 1.00 0.00 C ATOM 487 C ASP A 31 7.519 -6.472 6.477 1.00 0.00 C ATOM 488 O ASP A 31 6.454 -6.639 5.880 1.00 0.00 O ATOM 489 CB ASP A 31 9.517 -8.012 6.482 1.00 0.00 C ATOM 490 CG ASP A 31 8.690 -9.280 6.417 1.00 0.00 C ATOM 491 OD1 ASP A 31 8.754 -9.984 5.390 1.00 0.00 O ATOM 492 OD2 ASP A 31 8.021 -9.606 7.417 1.00 0.00 O ATOM 0 H ASP A 31 10.666 -5.886 6.332 1.00 0.00 H new ATOM 0 HA ASP A 31 8.660 -7.029 4.763 1.00 0.00 H new ATOM 0 HB2 ASP A 31 10.482 -8.196 6.011 1.00 0.00 H new ATOM 0 HB3 ASP A 31 9.713 -7.772 7.527 1.00 0.00 H new ATOM 497 N LEU A 32 7.587 -5.953 7.699 1.00 0.00 N ATOM 498 CA LEU A 32 6.388 -5.652 8.478 1.00 0.00 C ATOM 499 C LEU A 32 5.678 -4.403 7.963 1.00 0.00 C ATOM 500 O LEU A 32 4.451 -4.364 7.893 1.00 0.00 O ATOM 501 CB LEU A 32 6.745 -5.468 9.954 1.00 0.00 C ATOM 502 CG LEU A 32 5.566 -5.129 10.873 1.00 0.00 C ATOM 503 CD1 LEU A 32 4.516 -6.226 10.827 1.00 0.00 C ATOM 504 CD2 LEU A 32 6.046 -4.908 12.300 1.00 0.00 C ATOM 0 H LEU A 32 8.462 -5.731 8.174 1.00 0.00 H new ATOM 0 HA LEU A 32 5.709 -6.497 8.369 1.00 0.00 H new ATOM 0 HB2 LEU A 32 7.215 -6.383 10.315 1.00 0.00 H new ATOM 0 HB3 LEU A 32 7.488 -4.675 10.035 1.00 0.00 H new ATOM 0 HG LEU A 32 5.110 -4.205 10.516 1.00 0.00 H new ATOM 0 HD11 LEU A 32 3.688 -5.965 11.486 1.00 0.00 H new ATOM 0 HD12 LEU A 32 4.147 -6.334 9.807 1.00 0.00 H new ATOM 0 HD13 LEU A 32 4.958 -7.167 11.155 1.00 0.00 H new ATOM 0 HD21 LEU A 32 5.195 -4.668 12.937 1.00 0.00 H new ATOM 0 HD22 LEU A 32 6.529 -5.814 12.666 1.00 0.00 H new ATOM 0 HD23 LEU A 32 6.758 -4.083 12.321 1.00 0.00 H new ATOM 516 N SER A 33 6.447 -3.383 7.610 1.00 0.00 N ATOM 517 CA SER A 33 5.871 -2.130 7.146 1.00 0.00 C ATOM 518 C SER A 33 5.124 -2.329 5.832 1.00 0.00 C ATOM 519 O SER A 33 4.047 -1.767 5.636 1.00 0.00 O ATOM 520 CB SER A 33 6.956 -1.062 7.003 1.00 0.00 C ATOM 521 OG SER A 33 8.099 -1.580 6.348 1.00 0.00 O ATOM 0 H SER A 33 7.467 -3.398 7.636 1.00 0.00 H new ATOM 0 HA SER A 33 5.152 -1.787 7.890 1.00 0.00 H new ATOM 0 HB2 SER A 33 6.564 -0.214 6.441 1.00 0.00 H new ATOM 0 HB3 SER A 33 7.236 -0.689 7.988 1.00 0.00 H new ATOM 0 HG SER A 33 8.600 -2.151 6.967 1.00 0.00 H new ATOM 527 N LEU A 34 5.681 -3.149 4.947 1.00 0.00 N ATOM 528 CA LEU A 34 5.015 -3.472 3.692 1.00 0.00 C ATOM 529 C LEU A 34 3.740 -4.269 3.951 1.00 0.00 C ATOM 530 O LEU A 34 2.745 -4.095 3.250 1.00 0.00 O ATOM 531 CB LEU A 34 5.950 -4.240 2.757 1.00 0.00 C ATOM 532 CG LEU A 34 7.151 -3.439 2.251 1.00 0.00 C ATOM 533 CD1 LEU A 34 8.031 -4.305 1.369 1.00 0.00 C ATOM 534 CD2 LEU A 34 6.688 -2.202 1.494 1.00 0.00 C ATOM 0 H LEU A 34 6.587 -3.600 5.075 1.00 0.00 H new ATOM 0 HA LEU A 34 4.744 -2.536 3.203 1.00 0.00 H new ATOM 0 HB2 LEU A 34 6.315 -5.125 3.278 1.00 0.00 H new ATOM 0 HB3 LEU A 34 5.376 -4.589 1.899 1.00 0.00 H new ATOM 0 HG LEU A 34 7.737 -3.115 3.111 1.00 0.00 H new ATOM 0 HD11 LEU A 34 8.881 -3.720 1.017 1.00 0.00 H new ATOM 0 HD12 LEU A 34 8.391 -5.160 1.941 1.00 0.00 H new ATOM 0 HD13 LEU A 34 7.454 -4.658 0.514 1.00 0.00 H new ATOM 0 HD21 LEU A 34 7.556 -1.645 1.142 1.00 0.00 H new ATOM 0 HD22 LEU A 34 6.080 -2.504 0.641 1.00 0.00 H new ATOM 0 HD23 LEU A 34 6.096 -1.570 2.156 1.00 0.00 H new ATOM 546 N MET A 35 3.773 -5.138 4.961 1.00 0.00 N ATOM 547 CA MET A 35 2.567 -5.846 5.393 1.00 0.00 C ATOM 548 C MET A 35 1.502 -4.853 5.833 1.00 0.00 C ATOM 549 O MET A 35 0.383 -4.856 5.319 1.00 0.00 O ATOM 550 CB MET A 35 2.870 -6.797 6.554 1.00 0.00 C ATOM 551 CG MET A 35 3.665 -8.028 6.167 1.00 0.00 C ATOM 552 SD MET A 35 3.993 -9.099 7.582 1.00 0.00 S ATOM 553 CE MET A 35 4.888 -10.433 6.795 1.00 0.00 C ATOM 0 H MET A 35 4.613 -5.368 5.492 1.00 0.00 H new ATOM 0 HA MET A 35 2.204 -6.427 4.545 1.00 0.00 H new ATOM 0 HB2 MET A 35 3.420 -6.251 7.320 1.00 0.00 H new ATOM 0 HB3 MET A 35 1.929 -7.114 7.002 1.00 0.00 H new ATOM 0 HG2 MET A 35 3.118 -8.588 5.408 1.00 0.00 H new ATOM 0 HG3 MET A 35 4.610 -7.722 5.718 1.00 0.00 H new ATOM 0 HE1 MET A 35 5.641 -10.821 7.481 1.00 0.00 H new ATOM 0 HE2 MET A 35 4.194 -11.230 6.530 1.00 0.00 H new ATOM 0 HE3 MET A 35 5.376 -10.062 5.894 1.00 0.00 H new ATOM 563 N ALA A 36 1.874 -3.992 6.775 1.00 0.00 N ATOM 564 CA ALA A 36 0.960 -3.004 7.330 1.00 0.00 C ATOM 565 C ALA A 36 0.392 -2.099 6.245 1.00 0.00 C ATOM 566 O ALA A 36 -0.814 -1.872 6.193 1.00 0.00 O ATOM 567 CB ALA A 36 1.661 -2.176 8.396 1.00 0.00 C ATOM 0 H ALA A 36 2.813 -3.961 7.172 1.00 0.00 H new ATOM 0 HA ALA A 36 0.128 -3.539 7.787 1.00 0.00 H new ATOM 0 HB1 ALA A 36 0.965 -1.441 8.802 1.00 0.00 H new ATOM 0 HB2 ALA A 36 2.006 -2.830 9.197 1.00 0.00 H new ATOM 0 HB3 ALA A 36 2.515 -1.662 7.954 1.00 0.00 H new ATOM 573 N LEU A 37 1.258 -1.592 5.377 1.00 0.00 N ATOM 574 CA LEU A 37 0.819 -0.712 4.299 1.00 0.00 C ATOM 575 C LEU A 37 -0.045 -1.470 3.303 1.00 0.00 C ATOM 576 O LEU A 37 -1.058 -0.955 2.835 1.00 0.00 O ATOM 577 CB LEU A 37 2.013 -0.090 3.576 1.00 0.00 C ATOM 578 CG LEU A 37 2.913 0.797 4.437 1.00 0.00 C ATOM 579 CD1 LEU A 37 3.960 1.476 3.573 1.00 0.00 C ATOM 580 CD2 LEU A 37 2.091 1.830 5.192 1.00 0.00 C ATOM 0 H LEU A 37 2.262 -1.773 5.397 1.00 0.00 H new ATOM 0 HA LEU A 37 0.228 0.087 4.747 1.00 0.00 H new ATOM 0 HB2 LEU A 37 2.619 -0.892 3.154 1.00 0.00 H new ATOM 0 HB3 LEU A 37 1.641 0.502 2.740 1.00 0.00 H new ATOM 0 HG LEU A 37 3.419 0.168 5.169 1.00 0.00 H new ATOM 0 HD11 LEU A 37 4.595 2.105 4.197 1.00 0.00 H new ATOM 0 HD12 LEU A 37 4.571 0.720 3.080 1.00 0.00 H new ATOM 0 HD13 LEU A 37 3.467 2.092 2.820 1.00 0.00 H new ATOM 0 HD21 LEU A 37 2.753 2.449 5.798 1.00 0.00 H new ATOM 0 HD22 LEU A 37 1.555 2.459 4.481 1.00 0.00 H new ATOM 0 HD23 LEU A 37 1.375 1.323 5.839 1.00 0.00 H new ATOM 592 N GLY A 38 0.362 -2.695 2.989 1.00 0.00 N ATOM 593 CA GLY A 38 -0.408 -3.529 2.089 1.00 0.00 C ATOM 594 C GLY A 38 -1.809 -3.752 2.604 1.00 0.00 C ATOM 595 O GLY A 38 -2.784 -3.573 1.876 1.00 0.00 O ATOM 0 H GLY A 38 1.216 -3.126 3.344 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -0.451 -3.062 1.105 1.00 0.00 H new ATOM 0 HA3 GLY A 38 0.092 -4.489 1.964 1.00 0.00 H new ATOM 599 N ASN A 39 -1.910 -4.120 3.871 1.00 0.00 N ATOM 600 CA ASN A 39 -3.207 -4.327 4.497 1.00 0.00 C ATOM 601 C ASN A 39 -3.967 -3.013 4.594 1.00 0.00 C ATOM 602 O ASN A 39 -5.179 -2.982 4.416 1.00 0.00 O ATOM 603 CB ASN A 39 -3.054 -4.942 5.891 1.00 0.00 C ATOM 604 CG ASN A 39 -2.429 -6.328 5.874 1.00 0.00 C ATOM 605 OD1 ASN A 39 -1.765 -6.727 6.828 1.00 0.00 O ATOM 606 ND2 ASN A 39 -2.634 -7.075 4.795 1.00 0.00 N ATOM 0 H ASN A 39 -1.112 -4.281 4.485 1.00 0.00 H new ATOM 0 HA ASN A 39 -3.771 -5.020 3.873 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -2.441 -4.283 6.506 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -4.034 -4.999 6.364 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -2.235 -8.012 4.740 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -3.191 -6.712 4.021 1.00 0.00 H new ATOM 613 N CYS A 40 -3.239 -1.931 4.857 1.00 0.00 N ATOM 614 CA CYS A 40 -3.832 -0.602 4.975 1.00 0.00 C ATOM 615 C CYS A 40 -4.545 -0.207 3.683 1.00 0.00 C ATOM 616 O CYS A 40 -5.742 0.093 3.687 1.00 0.00 O ATOM 617 CB CYS A 40 -2.751 0.433 5.316 1.00 0.00 C ATOM 618 SG CYS A 40 -3.372 2.119 5.521 1.00 0.00 S ATOM 0 H CYS A 40 -2.228 -1.950 4.994 1.00 0.00 H new ATOM 0 HA CYS A 40 -4.567 -0.628 5.779 1.00 0.00 H new ATOM 0 HB2 CYS A 40 -2.250 0.129 6.235 1.00 0.00 H new ATOM 0 HB3 CYS A 40 -1.999 0.429 4.527 1.00 0.00 H new ATOM 0 HG CYS A 40 -2.432 2.871 6.012 1.00 0.00 H new ATOM 624 N VAL A 41 -3.808 -0.239 2.579 1.00 0.00 N ATOM 625 CA VAL A 41 -4.349 0.145 1.278 1.00 0.00 C ATOM 626 C VAL A 41 -5.523 -0.750 0.888 1.00 0.00 C ATOM 627 O VAL A 41 -6.557 -0.271 0.418 1.00 0.00 O ATOM 628 CB VAL A 41 -3.262 0.073 0.180 1.00 0.00 C ATOM 629 CG1 VAL A 41 -3.833 0.430 -1.185 1.00 0.00 C ATOM 630 CG2 VAL A 41 -2.098 0.988 0.522 1.00 0.00 C ATOM 0 H VAL A 41 -2.830 -0.528 2.558 1.00 0.00 H new ATOM 0 HA VAL A 41 -4.699 1.174 1.364 1.00 0.00 H new ATOM 0 HB VAL A 41 -2.899 -0.954 0.136 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -3.045 0.370 -1.936 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.630 -0.268 -1.440 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -4.233 1.444 -1.158 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -1.343 0.924 -0.261 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -2.454 2.015 0.601 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -1.661 0.681 1.473 1.00 0.00 H new ATOM 640 N THR A 42 -5.374 -2.049 1.110 1.00 0.00 N ATOM 641 CA THR A 42 -6.404 -3.005 0.736 1.00 0.00 C ATOM 642 C THR A 42 -7.628 -2.879 1.653 1.00 0.00 C ATOM 643 O THR A 42 -8.759 -3.139 1.240 1.00 0.00 O ATOM 644 CB THR A 42 -5.845 -4.439 0.761 1.00 0.00 C ATOM 645 OG1 THR A 42 -4.547 -4.450 0.166 1.00 0.00 O ATOM 646 CG2 THR A 42 -6.736 -5.397 -0.012 1.00 0.00 C ATOM 0 H THR A 42 -4.551 -2.463 1.547 1.00 0.00 H new ATOM 0 HA THR A 42 -6.724 -2.781 -0.282 1.00 0.00 H new ATOM 0 HB THR A 42 -5.800 -4.763 1.801 1.00 0.00 H new ATOM 0 HG1 THR A 42 -3.865 -4.417 0.869 1.00 0.00 H new ATOM 0 HG21 THR A 42 -6.311 -6.400 0.026 1.00 0.00 H new ATOM 0 HG22 THR A 42 -7.731 -5.407 0.432 1.00 0.00 H new ATOM 0 HG23 THR A 42 -6.805 -5.072 -1.050 1.00 0.00 H new ATOM 654 N HIS A 43 -7.393 -2.459 2.896 1.00 0.00 N ATOM 655 CA HIS A 43 -8.475 -2.163 3.832 1.00 0.00 C ATOM 656 C HIS A 43 -9.272 -0.959 3.344 1.00 0.00 C ATOM 657 O HIS A 43 -10.494 -0.943 3.431 1.00 0.00 O ATOM 658 CB HIS A 43 -7.913 -1.910 5.242 1.00 0.00 C ATOM 659 CG HIS A 43 -8.890 -1.321 6.224 1.00 0.00 C ATOM 660 ND1 HIS A 43 -10.201 -1.729 6.341 1.00 0.00 N ATOM 661 CD2 HIS A 43 -8.730 -0.333 7.136 1.00 0.00 C ATOM 662 CE1 HIS A 43 -10.800 -1.025 7.280 1.00 0.00 C ATOM 663 NE2 HIS A 43 -9.930 -0.168 7.779 1.00 0.00 N ATOM 0 H HIS A 43 -6.458 -2.316 3.278 1.00 0.00 H new ATOM 0 HA HIS A 43 -9.142 -3.023 3.883 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -7.543 -2.854 5.643 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -7.057 -1.241 5.160 1.00 0.00 H new ATOM 0 HD1 HIS A 43 -10.640 -2.463 5.786 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -7.823 0.223 7.323 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -11.829 -1.132 7.589 1.00 0.00 H new ATOM 672 N LEU A 44 -8.574 0.046 2.826 1.00 0.00 N ATOM 673 CA LEU A 44 -9.233 1.221 2.266 1.00 0.00 C ATOM 674 C LEU A 44 -10.116 0.812 1.092 1.00 0.00 C ATOM 675 O LEU A 44 -11.218 1.338 0.910 1.00 0.00 O ATOM 676 CB LEU A 44 -8.193 2.253 1.815 1.00 0.00 C ATOM 677 CG LEU A 44 -7.290 2.791 2.926 1.00 0.00 C ATOM 678 CD1 LEU A 44 -6.256 3.748 2.357 1.00 0.00 C ATOM 679 CD2 LEU A 44 -8.117 3.479 4.003 1.00 0.00 C ATOM 0 H LEU A 44 -7.555 0.071 2.782 1.00 0.00 H new ATOM 0 HA LEU A 44 -9.857 1.674 3.036 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.567 1.802 1.045 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -8.713 3.092 1.352 1.00 0.00 H new ATOM 0 HG LEU A 44 -6.767 1.949 3.380 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -5.623 4.120 3.162 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -5.641 3.226 1.624 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -6.761 4.585 1.876 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -7.456 3.855 4.784 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -8.668 4.310 3.563 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -8.819 2.765 4.434 1.00 0.00 H new ATOM 691 N LEU A 45 -9.630 -0.149 0.317 1.00 0.00 N ATOM 692 CA LEU A 45 -10.376 -0.691 -0.809 1.00 0.00 C ATOM 693 C LEU A 45 -11.692 -1.316 -0.366 1.00 0.00 C ATOM 694 O LEU A 45 -12.752 -0.932 -0.847 1.00 0.00 O ATOM 695 CB LEU A 45 -9.534 -1.726 -1.552 1.00 0.00 C ATOM 696 CG LEU A 45 -8.475 -1.143 -2.482 1.00 0.00 C ATOM 697 CD1 LEU A 45 -7.499 -2.222 -2.923 1.00 0.00 C ATOM 698 CD2 LEU A 45 -9.142 -0.506 -3.691 1.00 0.00 C ATOM 0 H LEU A 45 -8.712 -0.572 0.451 1.00 0.00 H new ATOM 0 HA LEU A 45 -10.607 0.138 -1.478 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -9.041 -2.366 -0.820 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -10.199 -2.363 -2.136 1.00 0.00 H new ATOM 0 HG LEU A 45 -7.917 -0.378 -1.942 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -6.751 -1.787 -3.586 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -7.006 -2.646 -2.048 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -8.039 -3.007 -3.451 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -8.380 -0.092 -4.351 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -9.717 -1.260 -4.229 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -9.808 0.291 -3.361 1.00 0.00 H new ATOM 710 N GLU A 46 -11.634 -2.263 0.561 1.00 0.00 N ATOM 711 CA GLU A 46 -12.834 -2.979 0.979 1.00 0.00 C ATOM 712 C GLU A 46 -13.694 -2.143 1.924 1.00 0.00 C ATOM 713 O GLU A 46 -14.809 -2.534 2.277 1.00 0.00 O ATOM 714 CB GLU A 46 -12.469 -4.340 1.595 1.00 0.00 C ATOM 715 CG GLU A 46 -11.510 -4.282 2.774 1.00 0.00 C ATOM 716 CD GLU A 46 -12.201 -4.058 4.107 1.00 0.00 C ATOM 717 OE1 GLU A 46 -13.291 -4.629 4.325 1.00 0.00 O ATOM 718 OE2 GLU A 46 -11.639 -3.340 4.954 1.00 0.00 O ATOM 0 H GLU A 46 -10.778 -2.552 1.035 1.00 0.00 H new ATOM 0 HA GLU A 46 -13.437 -3.165 0.090 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -13.386 -4.832 1.918 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -12.028 -4.965 0.819 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -10.945 -5.213 2.819 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -10.790 -3.480 2.608 1.00 0.00 H new ATOM 725 N ARG A 47 -13.188 -0.980 2.302 1.00 0.00 N ATOM 726 CA ARG A 47 -13.915 -0.086 3.182 1.00 0.00 C ATOM 727 C ARG A 47 -14.768 0.874 2.366 1.00 0.00 C ATOM 728 O ARG A 47 -15.978 0.981 2.576 1.00 0.00 O ATOM 729 CB ARG A 47 -12.938 0.701 4.059 1.00 0.00 C ATOM 730 CG ARG A 47 -13.614 1.488 5.166 1.00 0.00 C ATOM 731 CD ARG A 47 -12.598 2.199 6.046 1.00 0.00 C ATOM 732 NE ARG A 47 -13.205 2.675 7.288 1.00 0.00 N ATOM 733 CZ ARG A 47 -12.641 3.553 8.116 1.00 0.00 C ATOM 734 NH1 ARG A 47 -11.462 4.090 7.829 1.00 0.00 N ATOM 735 NH2 ARG A 47 -13.263 3.897 9.236 1.00 0.00 N ATOM 0 H ARG A 47 -12.274 -0.634 2.011 1.00 0.00 H new ATOM 0 HA ARG A 47 -14.566 -0.680 3.823 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -12.222 0.009 4.502 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -12.371 1.388 3.431 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -14.294 2.220 4.730 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -14.217 0.815 5.776 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -11.777 1.520 6.278 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -12.171 3.042 5.502 1.00 0.00 H new ATOM 0 HE ARG A 47 -14.124 2.310 7.538 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -10.980 3.831 6.968 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -11.038 4.761 8.469 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -14.171 3.489 9.461 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -12.834 4.569 9.872 1.00 0.00 H new ATOM 749 N LYS A 48 -14.137 1.552 1.416 1.00 0.00 N ATOM 750 CA LYS A 48 -14.801 2.604 0.666 1.00 0.00 C ATOM 751 C LYS A 48 -15.307 2.091 -0.683 1.00 0.00 C ATOM 752 O LYS A 48 -16.398 2.455 -1.126 1.00 0.00 O ATOM 753 CB LYS A 48 -13.832 3.783 0.472 1.00 0.00 C ATOM 754 CG LYS A 48 -14.504 5.111 0.132 1.00 0.00 C ATOM 755 CD LYS A 48 -14.968 5.179 -1.315 1.00 0.00 C ATOM 756 CE LYS A 48 -15.622 6.514 -1.623 1.00 0.00 C ATOM 757 NZ LYS A 48 -16.154 6.567 -3.009 1.00 0.00 N ATOM 0 H LYS A 48 -13.166 1.390 1.148 1.00 0.00 H new ATOM 0 HA LYS A 48 -15.670 2.941 1.231 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -13.248 3.910 1.384 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -13.130 3.532 -0.324 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -15.359 5.260 0.791 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -13.807 5.926 0.325 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -14.117 5.027 -1.979 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -15.674 4.372 -1.511 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -16.433 6.692 -0.917 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -14.896 7.314 -1.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -16.592 7.495 -3.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -15.377 6.423 -3.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -16.866 5.820 -3.136 1.00 0.00 H new ATOM 771 N VAL A 49 -14.530 1.232 -1.321 1.00 0.00 N ATOM 772 CA VAL A 49 -14.821 0.816 -2.686 1.00 0.00 C ATOM 773 C VAL A 49 -15.617 -0.492 -2.715 1.00 0.00 C ATOM 774 O VAL A 49 -15.237 -1.477 -2.074 1.00 0.00 O ATOM 775 CB VAL A 49 -13.519 0.650 -3.501 1.00 0.00 C ATOM 776 CG1 VAL A 49 -13.821 0.468 -4.978 1.00 0.00 C ATOM 777 CG2 VAL A 49 -12.595 1.838 -3.290 1.00 0.00 C ATOM 0 H VAL A 49 -13.694 0.809 -0.918 1.00 0.00 H new ATOM 0 HA VAL A 49 -15.427 1.600 -3.139 1.00 0.00 H new ATOM 0 HB VAL A 49 -13.013 -0.247 -3.144 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -12.887 0.353 -5.529 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -14.436 -0.421 -5.117 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -14.357 1.341 -5.350 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -11.685 1.699 -3.873 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -13.097 2.751 -3.612 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -12.340 1.917 -2.233 1.00 0.00 H new ATOM 787 N PRO A 50 -16.741 -0.511 -3.460 1.00 0.00 N ATOM 788 CA PRO A 50 -17.574 -1.710 -3.627 1.00 0.00 C ATOM 789 C PRO A 50 -16.785 -2.873 -4.221 1.00 0.00 C ATOM 790 O PRO A 50 -15.851 -2.660 -4.988 1.00 0.00 O ATOM 791 CB PRO A 50 -18.676 -1.262 -4.597 1.00 0.00 C ATOM 792 CG PRO A 50 -18.156 -0.017 -5.232 1.00 0.00 C ATOM 793 CD PRO A 50 -17.288 0.637 -4.197 1.00 0.00 C ATOM 0 HA PRO A 50 -17.958 -2.073 -2.674 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -18.879 -2.030 -5.344 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -19.612 -1.074 -4.070 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -17.586 -0.246 -6.133 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -18.973 0.641 -5.530 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -16.501 1.239 -4.651 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -17.861 1.299 -3.548 1.00 0.00 H new ATOM 801 N SER A 51 -17.188 -4.092 -3.878 1.00 0.00 N ATOM 802 CA SER A 51 -16.447 -5.308 -4.216 1.00 0.00 C ATOM 803 C SER A 51 -16.013 -5.374 -5.685 1.00 0.00 C ATOM 804 O SER A 51 -14.878 -5.754 -5.976 1.00 0.00 O ATOM 805 CB SER A 51 -17.298 -6.524 -3.871 1.00 0.00 C ATOM 806 OG SER A 51 -17.700 -6.485 -2.511 1.00 0.00 O ATOM 0 H SER A 51 -18.045 -4.268 -3.353 1.00 0.00 H new ATOM 0 HA SER A 51 -15.529 -5.296 -3.628 1.00 0.00 H new ATOM 0 HB2 SER A 51 -18.177 -6.553 -4.515 1.00 0.00 H new ATOM 0 HB3 SER A 51 -16.732 -7.436 -4.062 1.00 0.00 H new ATOM 0 HG SER A 51 -18.247 -7.273 -2.309 1.00 0.00 H new ATOM 812 N GLU A 52 -16.904 -5.005 -6.600 1.00 0.00 N ATOM 813 CA GLU A 52 -16.593 -5.050 -8.029 1.00 0.00 C ATOM 814 C GLU A 52 -15.406 -4.145 -8.357 1.00 0.00 C ATOM 815 O GLU A 52 -14.369 -4.606 -8.842 1.00 0.00 O ATOM 816 CB GLU A 52 -17.806 -4.631 -8.872 1.00 0.00 C ATOM 817 CG GLU A 52 -18.967 -5.617 -8.845 1.00 0.00 C ATOM 818 CD GLU A 52 -19.594 -5.757 -7.477 1.00 0.00 C ATOM 819 OE1 GLU A 52 -20.042 -4.732 -6.919 1.00 0.00 O ATOM 820 OE2 GLU A 52 -19.643 -6.888 -6.953 1.00 0.00 O ATOM 0 H GLU A 52 -17.843 -4.673 -6.381 1.00 0.00 H new ATOM 0 HA GLU A 52 -16.333 -6.080 -8.274 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -18.160 -3.663 -8.519 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -17.485 -4.496 -9.905 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -19.728 -5.293 -9.555 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -18.615 -6.593 -9.178 1.00 0.00 H new ATOM 827 N SER A 53 -15.553 -2.862 -8.057 1.00 0.00 N ATOM 828 CA SER A 53 -14.532 -1.873 -8.382 1.00 0.00 C ATOM 829 C SER A 53 -13.344 -1.985 -7.430 1.00 0.00 C ATOM 830 O SER A 53 -12.269 -1.446 -7.690 1.00 0.00 O ATOM 831 CB SER A 53 -15.141 -0.473 -8.317 1.00 0.00 C ATOM 832 OG SER A 53 -16.344 -0.416 -9.064 1.00 0.00 O ATOM 0 H SER A 53 -16.373 -2.479 -7.587 1.00 0.00 H new ATOM 0 HA SER A 53 -14.168 -2.060 -9.392 1.00 0.00 H new ATOM 0 HB2 SER A 53 -15.338 -0.204 -7.279 1.00 0.00 H new ATOM 0 HB3 SER A 53 -14.431 0.257 -8.706 1.00 0.00 H new ATOM 0 HG SER A 53 -16.720 0.487 -9.009 1.00 0.00 H new ATOM 838 N ARG A 54 -13.558 -2.688 -6.327 1.00 0.00 N ATOM 839 CA ARG A 54 -12.523 -2.950 -5.342 1.00 0.00 C ATOM 840 C ARG A 54 -11.344 -3.653 -5.996 1.00 0.00 C ATOM 841 O ARG A 54 -10.190 -3.345 -5.708 1.00 0.00 O ATOM 842 CB ARG A 54 -13.107 -3.811 -4.222 1.00 0.00 C ATOM 843 CG ARG A 54 -12.180 -4.056 -3.051 1.00 0.00 C ATOM 844 CD ARG A 54 -12.886 -4.878 -1.984 1.00 0.00 C ATOM 845 NE ARG A 54 -14.126 -4.240 -1.529 1.00 0.00 N ATOM 846 CZ ARG A 54 -15.144 -4.896 -0.971 1.00 0.00 C ATOM 847 NH1 ARG A 54 -15.073 -6.205 -0.775 1.00 0.00 N ATOM 848 NH2 ARG A 54 -16.231 -4.233 -0.596 1.00 0.00 N ATOM 0 H ARG A 54 -14.463 -3.095 -6.090 1.00 0.00 H new ATOM 0 HA ARG A 54 -12.167 -2.008 -4.924 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -14.015 -3.333 -3.853 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -13.401 -4.774 -4.640 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -11.285 -4.578 -3.390 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -11.854 -3.105 -2.631 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -13.112 -5.868 -2.380 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -12.218 -5.019 -1.134 1.00 0.00 H new ATOM 0 HE ARG A 54 -14.215 -3.231 -1.647 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -14.236 -6.717 -1.052 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -15.856 -6.700 -0.348 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -16.286 -3.224 -0.735 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -17.011 -4.733 -0.169 1.00 0.00 H new ATOM 862 N GLN A 55 -11.648 -4.584 -6.894 1.00 0.00 N ATOM 863 CA GLN A 55 -10.614 -5.273 -7.648 1.00 0.00 C ATOM 864 C GLN A 55 -9.999 -4.336 -8.672 1.00 0.00 C ATOM 865 O GLN A 55 -8.782 -4.255 -8.791 1.00 0.00 O ATOM 866 CB GLN A 55 -11.176 -6.503 -8.354 1.00 0.00 C ATOM 867 CG GLN A 55 -11.649 -7.590 -7.409 1.00 0.00 C ATOM 868 CD GLN A 55 -12.019 -8.865 -8.138 1.00 0.00 C ATOM 869 OE1 GLN A 55 -11.869 -9.963 -7.604 1.00 0.00 O ATOM 870 NE2 GLN A 55 -12.502 -8.729 -9.363 1.00 0.00 N ATOM 0 H GLN A 55 -12.600 -4.876 -7.115 1.00 0.00 H new ATOM 0 HA GLN A 55 -9.847 -5.597 -6.945 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -12.009 -6.198 -8.987 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -10.410 -6.914 -9.011 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -10.864 -7.804 -6.683 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -12.512 -7.231 -6.849 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -12.610 -7.799 -9.768 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -12.766 -9.554 -9.902 1.00 0.00 H new ATOM 879 N ALA A 56 -10.854 -3.613 -9.386 1.00 0.00 N ATOM 880 CA ALA A 56 -10.408 -2.699 -10.431 1.00 0.00 C ATOM 881 C ALA A 56 -9.399 -1.689 -9.895 1.00 0.00 C ATOM 882 O ALA A 56 -8.322 -1.516 -10.465 1.00 0.00 O ATOM 883 CB ALA A 56 -11.601 -1.982 -11.044 1.00 0.00 C ATOM 0 H ALA A 56 -11.866 -3.643 -9.259 1.00 0.00 H new ATOM 0 HA ALA A 56 -9.911 -3.287 -11.202 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -11.256 -1.302 -11.823 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -12.282 -2.714 -11.477 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -12.121 -1.415 -10.272 1.00 0.00 H new ATOM 889 N VAL A 57 -9.743 -1.035 -8.789 1.00 0.00 N ATOM 890 CA VAL A 57 -8.855 -0.050 -8.182 1.00 0.00 C ATOM 891 C VAL A 57 -7.587 -0.719 -7.655 1.00 0.00 C ATOM 892 O VAL A 57 -6.491 -0.173 -7.788 1.00 0.00 O ATOM 893 CB VAL A 57 -9.546 0.723 -7.036 1.00 0.00 C ATOM 894 CG1 VAL A 57 -8.609 1.766 -6.442 1.00 0.00 C ATOM 895 CG2 VAL A 57 -10.823 1.386 -7.525 1.00 0.00 C ATOM 0 H VAL A 57 -10.626 -1.169 -8.297 1.00 0.00 H new ATOM 0 HA VAL A 57 -8.592 0.664 -8.963 1.00 0.00 H new ATOM 0 HB VAL A 57 -9.803 0.005 -6.257 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -9.118 2.297 -5.638 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -7.721 1.274 -6.046 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -8.316 2.475 -7.216 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -11.292 1.924 -6.701 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -10.586 2.085 -8.327 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -11.508 0.625 -7.898 1.00 0.00 H new ATOM 905 N ALA A 58 -7.741 -1.906 -7.073 1.00 0.00 N ATOM 906 CA ALA A 58 -6.600 -2.667 -6.574 1.00 0.00 C ATOM 907 C ALA A 58 -5.618 -2.958 -7.701 1.00 0.00 C ATOM 908 O ALA A 58 -4.408 -2.769 -7.550 1.00 0.00 O ATOM 909 CB ALA A 58 -7.058 -3.968 -5.926 1.00 0.00 C ATOM 0 H ALA A 58 -8.644 -2.361 -6.936 1.00 0.00 H new ATOM 0 HA ALA A 58 -6.096 -2.065 -5.818 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -6.190 -4.518 -5.562 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -7.723 -3.745 -5.091 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -7.589 -4.573 -6.661 1.00 0.00 H new ATOM 915 N GLU A 59 -6.148 -3.403 -8.834 1.00 0.00 N ATOM 916 CA GLU A 59 -5.331 -3.671 -10.004 1.00 0.00 C ATOM 917 C GLU A 59 -4.639 -2.396 -10.466 1.00 0.00 C ATOM 918 O GLU A 59 -3.429 -2.382 -10.667 1.00 0.00 O ATOM 919 CB GLU A 59 -6.178 -4.231 -11.146 1.00 0.00 C ATOM 920 CG GLU A 59 -6.906 -5.522 -10.812 1.00 0.00 C ATOM 921 CD GLU A 59 -7.736 -6.022 -11.974 1.00 0.00 C ATOM 922 OE1 GLU A 59 -8.410 -5.196 -12.625 1.00 0.00 O ATOM 923 OE2 GLU A 59 -7.702 -7.239 -12.257 1.00 0.00 O ATOM 0 H GLU A 59 -7.143 -3.585 -8.964 1.00 0.00 H new ATOM 0 HA GLU A 59 -4.582 -4.413 -9.727 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -6.911 -3.480 -11.440 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -5.535 -4.404 -12.009 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -6.180 -6.285 -10.530 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -7.551 -5.361 -9.948 1.00 0.00 H new ATOM 930 N GLN A 60 -5.419 -1.326 -10.622 1.00 0.00 N ATOM 931 CA GLN A 60 -4.886 -0.037 -11.059 1.00 0.00 C ATOM 932 C GLN A 60 -3.759 0.418 -10.142 1.00 0.00 C ATOM 933 O GLN A 60 -2.695 0.815 -10.612 1.00 0.00 O ATOM 934 CB GLN A 60 -5.987 1.028 -11.089 1.00 0.00 C ATOM 935 CG GLN A 60 -7.092 0.746 -12.095 1.00 0.00 C ATOM 936 CD GLN A 60 -8.199 1.786 -12.062 1.00 0.00 C ATOM 937 OE1 GLN A 60 -9.366 1.478 -12.313 1.00 0.00 O ATOM 938 NE2 GLN A 60 -7.846 3.028 -11.764 1.00 0.00 N ATOM 0 H GLN A 60 -6.425 -1.328 -10.451 1.00 0.00 H new ATOM 0 HA GLN A 60 -4.494 -0.165 -12.068 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -6.427 1.110 -10.095 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -5.538 1.994 -11.319 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -6.664 0.709 -13.097 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -7.518 -0.237 -11.894 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -6.870 3.246 -11.562 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -8.550 3.766 -11.737 1.00 0.00 H new ATOM 947 N PHE A 61 -3.995 0.337 -8.837 1.00 0.00 N ATOM 948 CA PHE A 61 -2.999 0.731 -7.852 1.00 0.00 C ATOM 949 C PHE A 61 -1.741 -0.121 -7.985 1.00 0.00 C ATOM 950 O PHE A 61 -0.634 0.406 -8.019 1.00 0.00 O ATOM 951 CB PHE A 61 -3.560 0.616 -6.432 1.00 0.00 C ATOM 952 CG PHE A 61 -2.575 1.010 -5.371 1.00 0.00 C ATOM 953 CD1 PHE A 61 -2.238 2.340 -5.180 1.00 0.00 C ATOM 954 CD2 PHE A 61 -1.978 0.048 -4.572 1.00 0.00 C ATOM 955 CE1 PHE A 61 -1.326 2.702 -4.210 1.00 0.00 C ATOM 956 CE2 PHE A 61 -1.066 0.405 -3.601 1.00 0.00 C ATOM 957 CZ PHE A 61 -0.739 1.734 -3.419 1.00 0.00 C ATOM 0 H PHE A 61 -4.871 0.001 -8.438 1.00 0.00 H new ATOM 0 HA PHE A 61 -2.739 1.773 -8.040 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -4.446 1.245 -6.347 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -3.880 -0.411 -6.257 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -2.694 3.101 -5.796 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -2.230 -0.993 -4.711 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -1.071 3.742 -4.069 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -0.608 -0.354 -2.984 1.00 0.00 H new ATOM 0 HZ PHE A 61 -0.025 2.016 -2.659 1.00 0.00 H new ATOM 967 N ALA A 62 -1.922 -1.433 -8.076 1.00 0.00 N ATOM 968 CA ALA A 62 -0.800 -2.358 -8.193 1.00 0.00 C ATOM 969 C ALA A 62 -0.014 -2.112 -9.479 1.00 0.00 C ATOM 970 O ALA A 62 1.219 -2.135 -9.481 1.00 0.00 O ATOM 971 CB ALA A 62 -1.295 -3.795 -8.134 1.00 0.00 C ATOM 0 H ALA A 62 -2.838 -1.882 -8.071 1.00 0.00 H new ATOM 0 HA ALA A 62 -0.127 -2.184 -7.354 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -0.448 -4.475 -8.222 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -1.801 -3.967 -7.184 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -1.991 -3.974 -8.953 1.00 0.00 H new ATOM 977 N LYS A 63 -0.736 -1.866 -10.568 1.00 0.00 N ATOM 978 CA LYS A 63 -0.117 -1.584 -11.857 1.00 0.00 C ATOM 979 C LYS A 63 0.621 -0.248 -11.815 1.00 0.00 C ATOM 980 O LYS A 63 1.756 -0.145 -12.274 1.00 0.00 O ATOM 981 CB LYS A 63 -1.173 -1.587 -12.971 1.00 0.00 C ATOM 982 CG LYS A 63 -1.830 -2.945 -13.174 1.00 0.00 C ATOM 983 CD LYS A 63 -3.055 -2.857 -14.074 1.00 0.00 C ATOM 984 CE LYS A 63 -3.761 -4.203 -14.175 1.00 0.00 C ATOM 985 NZ LYS A 63 -5.051 -4.118 -14.918 1.00 0.00 N ATOM 0 H LYS A 63 -1.756 -1.857 -10.582 1.00 0.00 H new ATOM 0 HA LYS A 63 0.609 -2.368 -12.072 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -1.942 -0.851 -12.736 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -0.707 -1.273 -13.905 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -1.108 -3.635 -13.611 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -2.119 -3.356 -12.207 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -3.745 -2.110 -13.682 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -2.756 -2.524 -15.068 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -3.105 -4.917 -14.673 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -3.948 -4.588 -13.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -5.491 -5.059 -14.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -5.690 -3.458 -14.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -4.873 -3.777 -15.884 1.00 0.00 H new ATOM 999 N ALA A 64 -0.019 0.762 -11.233 1.00 0.00 N ATOM 1000 CA ALA A 64 0.586 2.085 -11.096 1.00 0.00 C ATOM 1001 C ALA A 64 1.802 2.033 -10.178 1.00 0.00 C ATOM 1002 O ALA A 64 2.822 2.673 -10.443 1.00 0.00 O ATOM 1003 CB ALA A 64 -0.434 3.080 -10.559 1.00 0.00 C ATOM 0 H ALA A 64 -0.960 0.690 -10.847 1.00 0.00 H new ATOM 0 HA ALA A 64 0.914 2.413 -12.082 1.00 0.00 H new ATOM 0 HB1 ALA A 64 0.031 4.061 -10.462 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -1.277 3.144 -11.247 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -0.787 2.748 -9.583 1.00 0.00 H new ATOM 1009 N LEU A 65 1.681 1.266 -9.103 1.00 0.00 N ATOM 1010 CA LEU A 65 2.761 1.093 -8.142 1.00 0.00 C ATOM 1011 C LEU A 65 3.989 0.514 -8.833 1.00 0.00 C ATOM 1012 O LEU A 65 5.075 1.093 -8.787 1.00 0.00 O ATOM 1013 CB LEU A 65 2.310 0.156 -7.016 1.00 0.00 C ATOM 1014 CG LEU A 65 3.167 0.177 -5.750 1.00 0.00 C ATOM 1015 CD1 LEU A 65 2.930 1.460 -4.968 1.00 0.00 C ATOM 1016 CD2 LEU A 65 2.868 -1.039 -4.889 1.00 0.00 C ATOM 0 H LEU A 65 0.833 0.747 -8.873 1.00 0.00 H new ATOM 0 HA LEU A 65 3.017 2.065 -7.720 1.00 0.00 H new ATOM 0 HB2 LEU A 65 1.286 0.413 -6.743 1.00 0.00 H new ATOM 0 HB3 LEU A 65 2.291 -0.863 -7.402 1.00 0.00 H new ATOM 0 HG LEU A 65 4.217 0.143 -6.041 1.00 0.00 H new ATOM 0 HD11 LEU A 65 3.548 1.458 -4.070 1.00 0.00 H new ATOM 0 HD12 LEU A 65 3.193 2.317 -5.588 1.00 0.00 H new ATOM 0 HD13 LEU A 65 1.879 1.525 -4.685 1.00 0.00 H new ATOM 0 HD21 LEU A 65 3.486 -1.010 -3.991 1.00 0.00 H new ATOM 0 HD22 LEU A 65 1.816 -1.034 -4.606 1.00 0.00 H new ATOM 0 HD23 LEU A 65 3.088 -1.946 -5.452 1.00 0.00 H new ATOM 1028 N ALA A 66 3.796 -0.620 -9.498 1.00 0.00 N ATOM 1029 CA ALA A 66 4.878 -1.298 -10.193 1.00 0.00 C ATOM 1030 C ALA A 66 5.421 -0.445 -11.334 1.00 0.00 C ATOM 1031 O ALA A 66 6.627 -0.423 -11.582 1.00 0.00 O ATOM 1032 CB ALA A 66 4.406 -2.645 -10.717 1.00 0.00 C ATOM 0 H ALA A 66 2.893 -1.089 -9.569 1.00 0.00 H new ATOM 0 HA ALA A 66 5.687 -1.460 -9.481 1.00 0.00 H new ATOM 0 HB1 ALA A 66 5.226 -3.142 -11.235 1.00 0.00 H new ATOM 0 HB2 ALA A 66 4.076 -3.264 -9.883 1.00 0.00 H new ATOM 0 HB3 ALA A 66 3.577 -2.496 -11.409 1.00 0.00 H new ATOM 1038 N GLN A 67 4.530 0.268 -12.013 1.00 0.00 N ATOM 1039 CA GLN A 67 4.914 1.119 -13.134 1.00 0.00 C ATOM 1040 C GLN A 67 5.827 2.246 -12.662 1.00 0.00 C ATOM 1041 O GLN A 67 6.779 2.618 -13.350 1.00 0.00 O ATOM 1042 CB GLN A 67 3.671 1.702 -13.807 1.00 0.00 C ATOM 1043 CG GLN A 67 3.947 2.331 -15.162 1.00 0.00 C ATOM 1044 CD GLN A 67 2.702 2.914 -15.801 1.00 0.00 C ATOM 1045 OE1 GLN A 67 1.803 3.409 -15.115 1.00 0.00 O ATOM 1046 NE2 GLN A 67 2.627 2.835 -17.119 1.00 0.00 N ATOM 0 H GLN A 67 3.531 0.274 -11.806 1.00 0.00 H new ATOM 0 HA GLN A 67 5.456 0.510 -13.858 1.00 0.00 H new ATOM 0 HB2 GLN A 67 2.930 0.912 -13.928 1.00 0.00 H new ATOM 0 HB3 GLN A 67 3.232 2.453 -13.150 1.00 0.00 H new ATOM 0 HG2 GLN A 67 4.694 3.117 -15.048 1.00 0.00 H new ATOM 0 HG3 GLN A 67 4.374 1.580 -15.827 1.00 0.00 H new ATOM 0 HE21 GLN A 67 3.392 2.418 -17.649 1.00 0.00 H new ATOM 0 HE22 GLN A 67 1.804 3.191 -17.605 1.00 0.00 H new ATOM 1055 N SER A 68 5.542 2.773 -11.479 1.00 0.00 N ATOM 1056 CA SER A 68 6.344 3.846 -10.909 1.00 0.00 C ATOM 1057 C SER A 68 7.740 3.342 -10.558 1.00 0.00 C ATOM 1058 O SER A 68 8.726 4.060 -10.706 1.00 0.00 O ATOM 1059 CB SER A 68 5.652 4.415 -9.673 1.00 0.00 C ATOM 1060 OG SER A 68 4.357 4.894 -10.001 1.00 0.00 O ATOM 0 H SER A 68 4.761 2.474 -10.895 1.00 0.00 H new ATOM 0 HA SER A 68 6.446 4.639 -11.649 1.00 0.00 H new ATOM 0 HB2 SER A 68 5.577 3.645 -8.905 1.00 0.00 H new ATOM 0 HB3 SER A 68 6.250 5.225 -9.255 1.00 0.00 H new ATOM 0 HG SER A 68 3.749 4.135 -10.125 1.00 0.00 H new ATOM 1066 N VAL A 69 7.815 2.097 -10.107 1.00 0.00 N ATOM 1067 CA VAL A 69 9.094 1.473 -9.810 1.00 0.00 C ATOM 1068 C VAL A 69 9.849 1.165 -11.101 1.00 0.00 C ATOM 1069 O VAL A 69 11.060 1.359 -11.191 1.00 0.00 O ATOM 1070 CB VAL A 69 8.909 0.171 -9.002 1.00 0.00 C ATOM 1071 CG1 VAL A 69 10.254 -0.461 -8.674 1.00 0.00 C ATOM 1072 CG2 VAL A 69 8.115 0.437 -7.734 1.00 0.00 C ATOM 0 H VAL A 69 7.005 1.501 -9.939 1.00 0.00 H new ATOM 0 HA VAL A 69 9.671 2.176 -9.209 1.00 0.00 H new ATOM 0 HB VAL A 69 8.348 -0.533 -9.616 1.00 0.00 H new ATOM 0 HG11 VAL A 69 10.096 -1.377 -8.104 1.00 0.00 H new ATOM 0 HG12 VAL A 69 10.781 -0.695 -9.599 1.00 0.00 H new ATOM 0 HG13 VAL A 69 10.849 0.236 -8.083 1.00 0.00 H new ATOM 0 HG21 VAL A 69 7.995 -0.493 -7.178 1.00 0.00 H new ATOM 0 HG22 VAL A 69 8.646 1.162 -7.118 1.00 0.00 H new ATOM 0 HG23 VAL A 69 7.134 0.832 -7.996 1.00 0.00 H new ATOM 1082 N LYS A 70 9.119 0.688 -12.102 1.00 0.00 N ATOM 1083 CA LYS A 70 9.713 0.336 -13.383 1.00 0.00 C ATOM 1084 C LYS A 70 10.278 1.557 -14.096 1.00 0.00 C ATOM 1085 O LYS A 70 11.391 1.515 -14.608 1.00 0.00 O ATOM 1086 CB LYS A 70 8.690 -0.345 -14.296 1.00 0.00 C ATOM 1087 CG LYS A 70 9.236 -0.624 -15.691 1.00 0.00 C ATOM 1088 CD LYS A 70 8.165 -1.130 -16.641 1.00 0.00 C ATOM 1089 CE LYS A 70 8.715 -1.280 -18.052 1.00 0.00 C ATOM 1090 NZ LYS A 70 9.160 0.024 -18.620 1.00 0.00 N ATOM 0 H LYS A 70 8.112 0.536 -12.049 1.00 0.00 H new ATOM 0 HA LYS A 70 10.528 -0.356 -13.170 1.00 0.00 H new ATOM 0 HB2 LYS A 70 8.372 -1.283 -13.841 1.00 0.00 H new ATOM 0 HB3 LYS A 70 7.805 0.286 -14.377 1.00 0.00 H new ATOM 0 HG2 LYS A 70 9.675 0.288 -16.095 1.00 0.00 H new ATOM 0 HG3 LYS A 70 10.036 -1.361 -15.624 1.00 0.00 H new ATOM 0 HD2 LYS A 70 7.787 -2.090 -16.290 1.00 0.00 H new ATOM 0 HD3 LYS A 70 7.323 -0.438 -16.647 1.00 0.00 H new ATOM 0 HE2 LYS A 70 9.554 -1.976 -18.042 1.00 0.00 H new ATOM 0 HE3 LYS A 70 7.949 -1.713 -18.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 9.559 -0.128 -19.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 8.347 0.670 -18.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 9.885 0.442 -18.003 1.00 0.00 H new ATOM 1104 N SER A 71 9.509 2.640 -14.118 1.00 0.00 N ATOM 1105 CA SER A 71 9.856 3.820 -14.909 1.00 0.00 C ATOM 1106 C SER A 71 11.151 4.489 -14.440 1.00 0.00 C ATOM 1107 O SER A 71 11.774 5.237 -15.188 1.00 0.00 O ATOM 1108 CB SER A 71 8.698 4.821 -14.894 1.00 0.00 C ATOM 1109 OG SER A 71 8.205 5.021 -13.582 1.00 0.00 O ATOM 0 H SER A 71 8.637 2.727 -13.596 1.00 0.00 H new ATOM 0 HA SER A 71 10.032 3.482 -15.930 1.00 0.00 H new ATOM 0 HB2 SER A 71 9.032 5.772 -15.308 1.00 0.00 H new ATOM 0 HB3 SER A 71 7.894 4.459 -15.535 1.00 0.00 H new ATOM 0 HG SER A 71 7.559 4.317 -13.364 1.00 0.00 H new ATOM 1115 N ASN A 72 11.559 4.217 -13.206 1.00 0.00 N ATOM 1116 CA ASN A 72 12.819 4.753 -12.697 1.00 0.00 C ATOM 1117 C ASN A 72 14.002 3.970 -13.244 1.00 0.00 C ATOM 1118 O ASN A 72 15.123 4.478 -13.309 1.00 0.00 O ATOM 1119 CB ASN A 72 12.829 4.759 -11.165 1.00 0.00 C ATOM 1120 CG ASN A 72 12.014 5.905 -10.600 1.00 0.00 C ATOM 1121 OD1 ASN A 72 11.897 6.963 -11.220 1.00 0.00 O ATOM 1122 ND2 ASN A 72 11.453 5.711 -9.421 1.00 0.00 N ATOM 0 H ASN A 72 11.044 3.636 -12.545 1.00 0.00 H new ATOM 0 HA ASN A 72 12.911 5.784 -13.040 1.00 0.00 H new ATOM 0 HB2 ASN A 72 12.431 3.814 -10.795 1.00 0.00 H new ATOM 0 HB3 ASN A 72 13.856 4.834 -10.809 1.00 0.00 H new ATOM 0 HD21 ASN A 72 10.899 6.452 -8.992 1.00 0.00 H new ATOM 0 HD22 ASN A 72 11.574 4.820 -8.939 1.00 0.00 H new ATOM 1129 N LEU A 73 13.746 2.731 -13.649 1.00 0.00 N ATOM 1130 CA LEU A 73 14.773 1.892 -14.253 1.00 0.00 C ATOM 1131 C LEU A 73 14.612 1.873 -15.775 1.00 0.00 C ATOM 1132 O LEU A 73 15.475 2.353 -16.509 1.00 0.00 O ATOM 1133 CB LEU A 73 14.696 0.450 -13.718 1.00 0.00 C ATOM 1134 CG LEU A 73 15.226 0.231 -12.291 1.00 0.00 C ATOM 1135 CD1 LEU A 73 14.327 0.890 -11.258 1.00 0.00 C ATOM 1136 CD2 LEU A 73 15.354 -1.256 -12.010 1.00 0.00 C ATOM 0 H LEU A 73 12.832 2.285 -13.569 1.00 0.00 H new ATOM 0 HA LEU A 73 15.744 2.313 -13.991 1.00 0.00 H new ATOM 0 HB2 LEU A 73 13.656 0.126 -13.752 1.00 0.00 H new ATOM 0 HB3 LEU A 73 15.253 -0.198 -14.395 1.00 0.00 H new ATOM 0 HG LEU A 73 16.209 0.696 -12.218 1.00 0.00 H new ATOM 0 HD11 LEU A 73 14.730 0.716 -10.261 1.00 0.00 H new ATOM 0 HD12 LEU A 73 14.279 1.962 -11.448 1.00 0.00 H new ATOM 0 HD13 LEU A 73 13.325 0.465 -11.323 1.00 0.00 H new ATOM 0 HD21 LEU A 73 15.730 -1.404 -10.998 1.00 0.00 H new ATOM 0 HD22 LEU A 73 14.377 -1.730 -12.107 1.00 0.00 H new ATOM 0 HD23 LEU A 73 16.047 -1.703 -12.723 1.00 0.00 H new ATOM 1148 N GLU A 74 13.488 1.342 -16.231 1.00 0.00 N ATOM 1149 CA GLU A 74 13.208 1.202 -17.654 1.00 0.00 C ATOM 1150 C GLU A 74 12.095 2.175 -18.038 1.00 0.00 C ATOM 1151 O GLU A 74 10.958 2.053 -17.567 1.00 0.00 O ATOM 1152 CB GLU A 74 12.805 -0.248 -17.948 1.00 0.00 C ATOM 1153 CG GLU A 74 13.128 -0.727 -19.357 1.00 0.00 C ATOM 1154 CD GLU A 74 12.266 -0.086 -20.423 1.00 0.00 C ATOM 1155 OE1 GLU A 74 11.039 -0.310 -20.410 1.00 0.00 O ATOM 1156 OE2 GLU A 74 12.816 0.635 -21.282 1.00 0.00 O ATOM 0 H GLU A 74 12.743 0.996 -15.626 1.00 0.00 H new ATOM 0 HA GLU A 74 14.093 1.437 -18.245 1.00 0.00 H new ATOM 0 HB2 GLU A 74 13.306 -0.901 -17.233 1.00 0.00 H new ATOM 0 HB3 GLU A 74 11.733 -0.354 -17.780 1.00 0.00 H new ATOM 0 HG2 GLU A 74 14.176 -0.517 -19.573 1.00 0.00 H new ATOM 0 HG3 GLU A 74 13.004 -1.809 -19.402 1.00 0.00 H new ATOM 1163 N HIS A 75 12.428 3.131 -18.893 1.00 0.00 N ATOM 1164 CA HIS A 75 11.537 4.250 -19.193 1.00 0.00 C ATOM 1165 C HIS A 75 10.470 3.883 -20.221 1.00 0.00 C ATOM 1166 O HIS A 75 10.380 2.743 -20.674 1.00 0.00 O ATOM 1167 CB HIS A 75 12.344 5.444 -19.714 1.00 0.00 C ATOM 1168 CG HIS A 75 13.289 6.028 -18.711 1.00 0.00 C ATOM 1169 ND1 HIS A 75 14.654 6.065 -18.893 1.00 0.00 N ATOM 1170 CD2 HIS A 75 13.058 6.606 -17.511 1.00 0.00 C ATOM 1171 CE1 HIS A 75 15.218 6.637 -17.848 1.00 0.00 C ATOM 1172 NE2 HIS A 75 14.273 6.977 -16.993 1.00 0.00 N ATOM 0 H HIS A 75 13.315 3.157 -19.396 1.00 0.00 H new ATOM 0 HA HIS A 75 11.033 4.511 -18.262 1.00 0.00 H new ATOM 0 HB2 HIS A 75 12.910 5.131 -20.591 1.00 0.00 H new ATOM 0 HB3 HIS A 75 11.653 6.221 -20.041 1.00 0.00 H new ATOM 0 HD2 HIS A 75 12.094 6.749 -17.046 1.00 0.00 H new ATOM 0 HE1 HIS A 75 16.277 6.800 -17.714 1.00 0.00 H new ATOM 0 HE2 HIS A 75 14.421 7.439 -16.096 1.00 0.00 H new ATOM 1181 N HIS A 76 9.648 4.863 -20.564 1.00 0.00 N ATOM 1182 CA HIS A 76 8.658 4.709 -21.618 1.00 0.00 C ATOM 1183 C HIS A 76 8.562 5.985 -22.439 1.00 0.00 C ATOM 1184 O HIS A 76 8.373 7.072 -21.893 1.00 0.00 O ATOM 1185 CB HIS A 76 7.278 4.362 -21.040 1.00 0.00 C ATOM 1186 CG HIS A 76 6.187 4.335 -22.074 1.00 0.00 C ATOM 1187 ND1 HIS A 76 6.020 3.299 -22.968 1.00 0.00 N ATOM 1188 CD2 HIS A 76 5.220 5.238 -22.369 1.00 0.00 C ATOM 1189 CE1 HIS A 76 5.005 3.566 -23.766 1.00 0.00 C ATOM 1190 NE2 HIS A 76 4.503 4.735 -23.425 1.00 0.00 N ATOM 0 H HIS A 76 9.648 5.782 -20.122 1.00 0.00 H new ATOM 0 HA HIS A 76 8.979 3.888 -22.259 1.00 0.00 H new ATOM 0 HB2 HIS A 76 7.331 3.388 -20.553 1.00 0.00 H new ATOM 0 HB3 HIS A 76 7.021 5.090 -20.270 1.00 0.00 H new ATOM 0 HD2 HIS A 76 5.046 6.178 -21.866 1.00 0.00 H new ATOM 0 HE1 HIS A 76 4.646 2.933 -24.564 1.00 0.00 H new ATOM 0 HE2 HIS A 76 3.709 5.192 -23.874 1.00 0.00 H new ATOM 1199 N HIS A 77 8.701 5.852 -23.744 1.00 0.00 N ATOM 1200 CA HIS A 77 8.497 6.970 -24.648 1.00 0.00 C ATOM 1201 C HIS A 77 7.356 6.668 -25.597 1.00 0.00 C ATOM 1202 O HIS A 77 7.389 5.666 -26.312 1.00 0.00 O ATOM 1203 CB HIS A 77 9.768 7.283 -25.438 1.00 0.00 C ATOM 1204 CG HIS A 77 10.809 7.985 -24.632 1.00 0.00 C ATOM 1205 ND1 HIS A 77 10.987 9.349 -24.671 1.00 0.00 N ATOM 1206 CD2 HIS A 77 11.723 7.512 -23.754 1.00 0.00 C ATOM 1207 CE1 HIS A 77 11.965 9.685 -23.854 1.00 0.00 C ATOM 1208 NE2 HIS A 77 12.427 8.589 -23.282 1.00 0.00 N ATOM 0 H HIS A 77 8.955 4.978 -24.204 1.00 0.00 H new ATOM 0 HA HIS A 77 8.247 7.847 -24.051 1.00 0.00 H new ATOM 0 HB2 HIS A 77 10.185 6.353 -25.825 1.00 0.00 H new ATOM 0 HB3 HIS A 77 9.509 7.899 -26.299 1.00 0.00 H new ATOM 0 HD2 HIS A 77 11.870 6.479 -23.477 1.00 0.00 H new ATOM 0 HE1 HIS A 77 12.327 10.688 -23.682 1.00 0.00 H new ATOM 0 HE2 HIS A 77 13.184 8.550 -22.600 1.00 0.00 H new ATOM 1217 N HIS A 78 6.334 7.518 -25.573 1.00 0.00 N ATOM 1218 CA HIS A 78 5.199 7.385 -26.477 1.00 0.00 C ATOM 1219 C HIS A 78 5.701 7.347 -27.915 1.00 0.00 C ATOM 1220 O HIS A 78 5.354 6.448 -28.675 1.00 0.00 O ATOM 1221 CB HIS A 78 4.232 8.558 -26.277 1.00 0.00 C ATOM 1222 CG HIS A 78 2.916 8.399 -26.977 1.00 0.00 C ATOM 1223 ND1 HIS A 78 1.751 8.076 -26.319 1.00 0.00 N ATOM 1224 CD2 HIS A 78 2.581 8.537 -28.280 1.00 0.00 C ATOM 1225 CE1 HIS A 78 0.759 8.020 -27.185 1.00 0.00 C ATOM 1226 NE2 HIS A 78 1.234 8.297 -28.381 1.00 0.00 N ATOM 0 H HIS A 78 6.270 8.310 -24.933 1.00 0.00 H new ATOM 0 HA HIS A 78 4.667 6.459 -26.262 1.00 0.00 H new ATOM 0 HB2 HIS A 78 4.050 8.685 -25.210 1.00 0.00 H new ATOM 0 HB3 HIS A 78 4.710 9.472 -26.630 1.00 0.00 H new ATOM 0 HD2 HIS A 78 3.249 8.789 -29.090 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -0.270 7.786 -26.953 1.00 0.00 H new ATOM 0 HE2 HIS A 78 0.689 8.328 -29.243 1.00 0.00 H new ATOM 1235 N HIS A 79 6.528 8.337 -28.249 1.00 0.00 N ATOM 1236 CA HIS A 79 7.219 8.422 -29.538 1.00 0.00 C ATOM 1237 C HIS A 79 7.914 9.769 -29.643 1.00 0.00 C ATOM 1238 O HIS A 79 9.098 9.855 -29.967 1.00 0.00 O ATOM 1239 CB HIS A 79 6.268 8.244 -30.732 1.00 0.00 C ATOM 1240 CG HIS A 79 6.439 6.931 -31.444 1.00 0.00 C ATOM 1241 ND1 HIS A 79 7.623 6.542 -32.036 1.00 0.00 N ATOM 1242 CD2 HIS A 79 5.571 5.910 -31.645 1.00 0.00 C ATOM 1243 CE1 HIS A 79 7.475 5.343 -32.567 1.00 0.00 C ATOM 1244 NE2 HIS A 79 6.242 4.938 -32.344 1.00 0.00 N ATOM 0 H HIS A 79 6.741 9.114 -27.624 1.00 0.00 H new ATOM 0 HA HIS A 79 7.942 7.608 -29.577 1.00 0.00 H new ATOM 0 HB2 HIS A 79 5.239 8.327 -30.382 1.00 0.00 H new ATOM 0 HB3 HIS A 79 6.431 9.056 -31.440 1.00 0.00 H new ATOM 0 HD2 HIS A 79 4.543 5.869 -31.316 1.00 0.00 H new ATOM 0 HE1 HIS A 79 8.236 4.788 -33.095 1.00 0.00 H new ATOM 0 HE2 HIS A 79 5.849 4.045 -32.643 1.00 0.00 H new ATOM 1253 N HIS A 80 7.165 10.819 -29.351 1.00 0.00 N ATOM 1254 CA HIS A 80 7.689 12.172 -29.385 1.00 0.00 C ATOM 1255 C HIS A 80 6.867 13.061 -28.462 1.00 0.00 C ATOM 1256 O HIS A 80 5.702 13.348 -28.807 1.00 0.00 O ATOM 1257 CB HIS A 80 7.671 12.720 -30.815 1.00 0.00 C ATOM 1258 CG HIS A 80 8.182 14.121 -30.928 1.00 0.00 C ATOM 1259 ND1 HIS A 80 7.356 15.210 -31.068 1.00 0.00 N ATOM 1260 CD2 HIS A 80 9.444 14.609 -30.913 1.00 0.00 C ATOM 1261 CE1 HIS A 80 8.083 16.306 -31.132 1.00 0.00 C ATOM 1262 NE2 HIS A 80 9.357 15.973 -31.041 1.00 0.00 N ATOM 1263 OXT HIS A 80 7.386 13.457 -27.402 1.00 0.00 O ATOM 0 H HIS A 80 6.182 10.758 -29.085 1.00 0.00 H new ATOM 0 HA HIS A 80 8.723 12.161 -29.041 1.00 0.00 H new ATOM 0 HB2 HIS A 80 8.273 12.071 -31.451 1.00 0.00 H new ATOM 0 HB3 HIS A 80 6.650 12.683 -31.196 1.00 0.00 H new ATOM 0 HD2 HIS A 80 10.352 14.032 -30.818 1.00 0.00 H new ATOM 0 HE1 HIS A 80 7.701 17.310 -31.241 1.00 0.00 H new ATOM 0 HE2 HIS A 80 10.145 16.621 -31.062 1.00 0.00 H new TER 1272 HIS A 80 ATOM 1273 N MET B 1 10.094 -26.722 21.099 1.00 0.00 N ATOM 1274 CA MET B 1 9.375 -25.457 20.830 1.00 0.00 C ATOM 1275 C MET B 1 10.124 -24.636 19.791 1.00 0.00 C ATOM 1276 O MET B 1 11.344 -24.749 19.657 1.00 0.00 O ATOM 1277 CB MET B 1 9.218 -24.639 22.115 1.00 0.00 C ATOM 1278 CG MET B 1 8.290 -25.273 23.138 1.00 0.00 C ATOM 1279 SD MET B 1 8.134 -24.283 24.640 1.00 0.00 S ATOM 1280 CE MET B 1 9.820 -24.318 25.250 1.00 0.00 C ATOM 0 H1 MET B 1 9.511 -27.525 20.789 1.00 0.00 H new ATOM 0 H2 MET B 1 10.995 -26.727 20.579 1.00 0.00 H new ATOM 0 H3 MET B 1 10.282 -26.804 22.118 1.00 0.00 H new ATOM 0 HA MET B 1 8.385 -25.705 20.448 1.00 0.00 H new ATOM 0 HB2 MET B 1 10.200 -24.499 22.567 1.00 0.00 H new ATOM 0 HB3 MET B 1 8.840 -23.649 21.860 1.00 0.00 H new ATOM 0 HG2 MET B 1 7.304 -25.410 22.693 1.00 0.00 H new ATOM 0 HG3 MET B 1 8.663 -26.264 23.397 1.00 0.00 H new ATOM 0 HE1 MET B 1 9.828 -24.073 26.312 1.00 0.00 H new ATOM 0 HE2 MET B 1 10.239 -25.314 25.104 1.00 0.00 H new ATOM 0 HE3 MET B 1 10.419 -23.589 24.705 1.00 0.00 H new ATOM 1292 N ALA B 2 9.390 -23.816 19.056 1.00 0.00 N ATOM 1293 CA ALA B 2 9.984 -22.979 18.031 1.00 0.00 C ATOM 1294 C ALA B 2 9.161 -21.714 17.830 1.00 0.00 C ATOM 1295 O ALA B 2 8.125 -21.734 17.166 1.00 0.00 O ATOM 1296 CB ALA B 2 10.112 -23.744 16.721 1.00 0.00 C ATOM 0 H ALA B 2 8.380 -23.714 19.152 1.00 0.00 H new ATOM 0 HA ALA B 2 10.983 -22.692 18.361 1.00 0.00 H new ATOM 0 HB1 ALA B 2 10.560 -23.099 15.965 1.00 0.00 H new ATOM 0 HB2 ALA B 2 10.744 -24.619 16.871 1.00 0.00 H new ATOM 0 HB3 ALA B 2 9.124 -24.062 16.388 1.00 0.00 H new ATOM 1302 N ILE B 3 9.609 -20.628 18.433 1.00 0.00 N ATOM 1303 CA ILE B 3 8.965 -19.339 18.255 1.00 0.00 C ATOM 1304 C ILE B 3 10.015 -18.236 18.172 1.00 0.00 C ATOM 1305 O ILE B 3 10.704 -17.931 19.146 1.00 0.00 O ATOM 1306 CB ILE B 3 7.939 -19.039 19.381 1.00 0.00 C ATOM 1307 CG1 ILE B 3 7.366 -17.626 19.222 1.00 0.00 C ATOM 1308 CG2 ILE B 3 8.561 -19.224 20.760 1.00 0.00 C ATOM 1309 CD1 ILE B 3 6.292 -17.284 20.233 1.00 0.00 C ATOM 0 H ILE B 3 10.419 -20.613 19.052 1.00 0.00 H new ATOM 0 HA ILE B 3 8.409 -19.373 17.318 1.00 0.00 H new ATOM 0 HB ILE B 3 7.121 -19.754 19.292 1.00 0.00 H new ATOM 0 HG12 ILE B 3 8.177 -16.903 19.309 1.00 0.00 H new ATOM 0 HG13 ILE B 3 6.953 -17.522 18.218 1.00 0.00 H new ATOM 0 HG21 ILE B 3 7.817 -19.006 21.527 1.00 0.00 H new ATOM 0 HG22 ILE B 3 8.905 -20.253 20.869 1.00 0.00 H new ATOM 0 HG23 ILE B 3 9.407 -18.545 20.872 1.00 0.00 H new ATOM 0 HD11 ILE B 3 5.936 -16.269 20.056 1.00 0.00 H new ATOM 0 HD12 ILE B 3 5.461 -17.983 20.132 1.00 0.00 H new ATOM 0 HD13 ILE B 3 6.704 -17.354 21.240 1.00 0.00 H new ATOM 1321 N GLN B 4 10.150 -17.664 16.987 1.00 0.00 N ATOM 1322 CA GLN B 4 11.120 -16.605 16.748 1.00 0.00 C ATOM 1323 C GLN B 4 10.479 -15.247 16.996 1.00 0.00 C ATOM 1324 O GLN B 4 11.136 -14.209 16.896 1.00 0.00 O ATOM 1325 CB GLN B 4 11.677 -16.679 15.315 1.00 0.00 C ATOM 1326 CG GLN B 4 10.668 -16.352 14.215 1.00 0.00 C ATOM 1327 CD GLN B 4 9.533 -17.357 14.127 1.00 0.00 C ATOM 1328 OE1 GLN B 4 8.498 -17.196 14.774 1.00 0.00 O ATOM 1329 NE2 GLN B 4 9.723 -18.402 13.339 1.00 0.00 N ATOM 0 H GLN B 4 9.596 -17.917 16.169 1.00 0.00 H new ATOM 0 HA GLN B 4 11.951 -16.739 17.440 1.00 0.00 H new ATOM 0 HB2 GLN B 4 12.519 -15.991 15.232 1.00 0.00 H new ATOM 0 HB3 GLN B 4 12.067 -17.682 15.144 1.00 0.00 H new ATOM 0 HG2 GLN B 4 10.253 -15.360 14.394 1.00 0.00 H new ATOM 0 HG3 GLN B 4 11.185 -16.313 13.256 1.00 0.00 H new ATOM 0 HE21 GLN B 4 10.596 -18.497 12.820 1.00 0.00 H new ATOM 0 HE22 GLN B 4 8.997 -19.113 13.250 1.00 0.00 H new ATOM 1338 N SER B 5 9.190 -15.276 17.321 1.00 0.00 N ATOM 1339 CA SER B 5 8.419 -14.072 17.598 1.00 0.00 C ATOM 1340 C SER B 5 8.413 -13.132 16.396 1.00 0.00 C ATOM 1341 O SER B 5 8.791 -11.962 16.504 1.00 0.00 O ATOM 1342 CB SER B 5 8.965 -13.353 18.840 1.00 0.00 C ATOM 1343 OG SER B 5 8.931 -14.201 19.977 1.00 0.00 O ATOM 0 H SER B 5 8.651 -16.138 17.399 1.00 0.00 H new ATOM 0 HA SER B 5 7.390 -14.373 17.795 1.00 0.00 H new ATOM 0 HB2 SER B 5 9.989 -13.028 18.655 1.00 0.00 H new ATOM 0 HB3 SER B 5 8.376 -12.456 19.033 1.00 0.00 H new ATOM 0 HG SER B 5 9.285 -13.721 20.754 1.00 0.00 H new ATOM 1349 N LYS B 6 7.996 -13.650 15.245 1.00 0.00 N ATOM 1350 CA LYS B 6 7.849 -12.822 14.062 1.00 0.00 C ATOM 1351 C LYS B 6 6.589 -11.976 14.189 1.00 0.00 C ATOM 1352 O LYS B 6 5.498 -12.401 13.796 1.00 0.00 O ATOM 1353 CB LYS B 6 7.799 -13.668 12.784 1.00 0.00 C ATOM 1354 CG LYS B 6 7.693 -12.833 11.513 1.00 0.00 C ATOM 1355 CD LYS B 6 7.600 -13.694 10.261 1.00 0.00 C ATOM 1356 CE LYS B 6 7.394 -12.844 9.013 1.00 0.00 C ATOM 1357 NZ LYS B 6 8.549 -11.942 8.747 1.00 0.00 N ATOM 0 H LYS B 6 7.756 -14.632 15.110 1.00 0.00 H new ATOM 0 HA LYS B 6 8.720 -12.171 13.987 1.00 0.00 H new ATOM 0 HB2 LYS B 6 8.695 -14.287 12.731 1.00 0.00 H new ATOM 0 HB3 LYS B 6 6.947 -14.345 12.838 1.00 0.00 H new ATOM 0 HG2 LYS B 6 6.815 -12.191 11.575 1.00 0.00 H new ATOM 0 HG3 LYS B 6 8.562 -12.179 11.437 1.00 0.00 H new ATOM 0 HD2 LYS B 6 8.511 -14.283 10.155 1.00 0.00 H new ATOM 0 HD3 LYS B 6 6.775 -14.399 10.363 1.00 0.00 H new ATOM 0 HE2 LYS B 6 7.239 -13.496 8.153 1.00 0.00 H new ATOM 0 HE3 LYS B 6 6.489 -12.248 9.128 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 8.316 -11.302 7.962 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 8.757 -11.383 9.599 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 9.382 -12.510 8.494 1.00 0.00 H new ATOM 1371 N TYR B 7 6.750 -10.796 14.782 1.00 0.00 N ATOM 1372 CA TYR B 7 5.650 -9.860 15.000 1.00 0.00 C ATOM 1373 C TYR B 7 4.557 -10.507 15.850 1.00 0.00 C ATOM 1374 O TYR B 7 4.837 -11.352 16.702 1.00 0.00 O ATOM 1375 CB TYR B 7 5.063 -9.388 13.661 1.00 0.00 C ATOM 1376 CG TYR B 7 6.102 -9.122 12.593 1.00 0.00 C ATOM 1377 CD1 TYR B 7 7.182 -8.277 12.825 1.00 0.00 C ATOM 1378 CD2 TYR B 7 6.002 -9.731 11.351 1.00 0.00 C ATOM 1379 CE1 TYR B 7 8.131 -8.050 11.846 1.00 0.00 C ATOM 1380 CE2 TYR B 7 6.944 -9.507 10.370 1.00 0.00 C ATOM 1381 CZ TYR B 7 8.005 -8.669 10.620 1.00 0.00 C ATOM 1382 OH TYR B 7 8.946 -8.457 9.640 1.00 0.00 O ATOM 0 H TYR B 7 7.650 -10.461 15.126 1.00 0.00 H new ATOM 0 HA TYR B 7 6.044 -8.994 15.532 1.00 0.00 H new ATOM 0 HB2 TYR B 7 4.366 -10.142 13.296 1.00 0.00 H new ATOM 0 HB3 TYR B 7 4.488 -8.477 13.829 1.00 0.00 H new ATOM 0 HD1 TYR B 7 7.281 -7.791 13.784 1.00 0.00 H new ATOM 0 HD2 TYR B 7 5.172 -10.392 11.149 1.00 0.00 H new ATOM 0 HE1 TYR B 7 8.965 -7.392 12.040 1.00 0.00 H new ATOM 0 HE2 TYR B 7 6.849 -9.988 9.408 1.00 0.00 H new ATOM 0 HH TYR B 7 8.798 -9.086 8.903 1.00 0.00 H new ATOM 1392 N SER B 8 3.319 -10.100 15.618 1.00 0.00 N ATOM 1393 CA SER B 8 2.178 -10.627 16.345 1.00 0.00 C ATOM 1394 C SER B 8 0.898 -10.231 15.623 1.00 0.00 C ATOM 1395 O SER B 8 0.857 -9.188 14.968 1.00 0.00 O ATOM 1396 CB SER B 8 2.167 -10.089 17.783 1.00 0.00 C ATOM 1397 OG SER B 8 0.952 -10.402 18.446 1.00 0.00 O ATOM 0 H SER B 8 3.078 -9.396 14.921 1.00 0.00 H new ATOM 0 HA SER B 8 2.248 -11.714 16.388 1.00 0.00 H new ATOM 0 HB2 SER B 8 3.005 -10.512 18.337 1.00 0.00 H new ATOM 0 HB3 SER B 8 2.307 -9.008 17.769 1.00 0.00 H new ATOM 0 HG SER B 8 0.977 -10.048 19.359 1.00 0.00 H new ATOM 1403 N ASN B 9 -0.138 -11.056 15.738 1.00 0.00 N ATOM 1404 CA ASN B 9 -1.431 -10.751 15.130 1.00 0.00 C ATOM 1405 C ASN B 9 -1.958 -9.424 15.668 1.00 0.00 C ATOM 1406 O ASN B 9 -2.529 -8.620 14.929 1.00 0.00 O ATOM 1407 CB ASN B 9 -2.442 -11.883 15.385 1.00 0.00 C ATOM 1408 CG ASN B 9 -2.783 -12.071 16.856 1.00 0.00 C ATOM 1409 OD1 ASN B 9 -2.084 -12.781 17.581 1.00 0.00 O ATOM 1410 ND2 ASN B 9 -3.869 -11.460 17.300 1.00 0.00 N ATOM 0 H ASN B 9 -0.109 -11.940 16.246 1.00 0.00 H new ATOM 0 HA ASN B 9 -1.296 -10.665 14.052 1.00 0.00 H new ATOM 0 HB2 ASN B 9 -3.357 -11.673 14.832 1.00 0.00 H new ATOM 0 HB3 ASN B 9 -2.038 -12.816 14.992 1.00 0.00 H new ATOM 0 HD21 ASN B 9 -4.153 -11.569 18.274 1.00 0.00 H new ATOM 0 HD22 ASN B 9 -4.422 -10.880 16.669 1.00 0.00 H new ATOM 1417 N THR B 10 -1.727 -9.186 16.953 1.00 0.00 N ATOM 1418 CA THR B 10 -2.131 -7.944 17.583 1.00 0.00 C ATOM 1419 C THR B 10 -1.196 -6.812 17.165 1.00 0.00 C ATOM 1420 O THR B 10 -1.636 -5.698 16.892 1.00 0.00 O ATOM 1421 CB THR B 10 -2.128 -8.081 19.118 1.00 0.00 C ATOM 1422 OG1 THR B 10 -2.847 -9.265 19.498 1.00 0.00 O ATOM 1423 CG2 THR B 10 -2.764 -6.866 19.778 1.00 0.00 C ATOM 0 H THR B 10 -1.260 -9.843 17.578 1.00 0.00 H new ATOM 0 HA THR B 10 -3.145 -7.713 17.256 1.00 0.00 H new ATOM 0 HB THR B 10 -1.093 -8.152 19.453 1.00 0.00 H new ATOM 0 HG1 THR B 10 -2.843 -9.351 20.474 1.00 0.00 H new ATOM 0 HG21 THR B 10 -2.748 -6.990 20.861 1.00 0.00 H new ATOM 0 HG22 THR B 10 -2.205 -5.970 19.507 1.00 0.00 H new ATOM 0 HG23 THR B 10 -3.795 -6.766 19.439 1.00 0.00 H new ATOM 1431 N GLN B 11 0.095 -7.125 17.085 1.00 0.00 N ATOM 1432 CA GLN B 11 1.109 -6.142 16.716 1.00 0.00 C ATOM 1433 C GLN B 11 0.848 -5.572 15.325 1.00 0.00 C ATOM 1434 O GLN B 11 0.864 -4.354 15.135 1.00 0.00 O ATOM 1435 CB GLN B 11 2.506 -6.772 16.766 1.00 0.00 C ATOM 1436 CG GLN B 11 3.621 -5.836 16.323 1.00 0.00 C ATOM 1437 CD GLN B 11 3.784 -4.635 17.232 1.00 0.00 C ATOM 1438 OE1 GLN B 11 4.548 -4.669 18.196 1.00 0.00 O ATOM 1439 NE2 GLN B 11 3.069 -3.561 16.934 1.00 0.00 N ATOM 0 H GLN B 11 0.465 -8.057 17.272 1.00 0.00 H new ATOM 0 HA GLN B 11 1.057 -5.325 17.436 1.00 0.00 H new ATOM 0 HB2 GLN B 11 2.707 -7.105 17.784 1.00 0.00 H new ATOM 0 HB3 GLN B 11 2.517 -7.659 16.133 1.00 0.00 H new ATOM 0 HG2 GLN B 11 4.560 -6.389 16.289 1.00 0.00 H new ATOM 0 HG3 GLN B 11 3.417 -5.492 15.309 1.00 0.00 H new ATOM 0 HE21 GLN B 11 2.446 -3.571 16.126 1.00 0.00 H new ATOM 0 HE22 GLN B 11 3.141 -2.724 17.512 1.00 0.00 H new ATOM 1448 N VAL B 12 0.607 -6.450 14.358 1.00 0.00 N ATOM 1449 CA VAL B 12 0.377 -6.022 12.984 1.00 0.00 C ATOM 1450 C VAL B 12 -0.933 -5.245 12.874 1.00 0.00 C ATOM 1451 O VAL B 12 -0.970 -4.165 12.286 1.00 0.00 O ATOM 1452 CB VAL B 12 0.358 -7.222 12.008 1.00 0.00 C ATOM 1453 CG1 VAL B 12 0.180 -6.753 10.569 1.00 0.00 C ATOM 1454 CG2 VAL B 12 1.630 -8.047 12.144 1.00 0.00 C ATOM 0 H VAL B 12 0.566 -7.459 14.500 1.00 0.00 H new ATOM 0 HA VAL B 12 1.205 -5.370 12.705 1.00 0.00 H new ATOM 0 HB VAL B 12 -0.493 -7.852 12.269 1.00 0.00 H new ATOM 0 HG11 VAL B 12 0.170 -7.616 9.904 1.00 0.00 H new ATOM 0 HG12 VAL B 12 -0.762 -6.213 10.476 1.00 0.00 H new ATOM 0 HG13 VAL B 12 1.005 -6.094 10.296 1.00 0.00 H new ATOM 0 HG21 VAL B 12 1.596 -8.886 11.449 1.00 0.00 H new ATOM 0 HG22 VAL B 12 2.494 -7.423 11.917 1.00 0.00 H new ATOM 0 HG23 VAL B 12 1.712 -8.424 13.163 1.00 0.00 H new ATOM 1464 N GLU B 13 -1.995 -5.778 13.473 1.00 0.00 N ATOM 1465 CA GLU B 13 -3.301 -5.129 13.426 1.00 0.00 C ATOM 1466 C GLU B 13 -3.253 -3.753 14.092 1.00 0.00 C ATOM 1467 O GLU B 13 -3.810 -2.783 13.575 1.00 0.00 O ATOM 1468 CB GLU B 13 -4.358 -6.008 14.098 1.00 0.00 C ATOM 1469 CG GLU B 13 -5.754 -5.410 14.061 1.00 0.00 C ATOM 1470 CD GLU B 13 -6.801 -6.333 14.644 1.00 0.00 C ATOM 1471 OE1 GLU B 13 -6.823 -6.508 15.879 1.00 0.00 O ATOM 1472 OE2 GLU B 13 -7.617 -6.876 13.867 1.00 0.00 O ATOM 0 H GLU B 13 -1.977 -6.654 13.995 1.00 0.00 H new ATOM 0 HA GLU B 13 -3.573 -4.991 12.380 1.00 0.00 H new ATOM 0 HB2 GLU B 13 -4.375 -6.981 13.608 1.00 0.00 H new ATOM 0 HB3 GLU B 13 -4.071 -6.178 15.136 1.00 0.00 H new ATOM 0 HG2 GLU B 13 -5.757 -4.470 14.613 1.00 0.00 H new ATOM 0 HG3 GLU B 13 -6.017 -5.175 13.030 1.00 0.00 H new ATOM 1479 N SER B 14 -2.571 -3.667 15.230 1.00 0.00 N ATOM 1480 CA SER B 14 -2.431 -2.403 15.933 1.00 0.00 C ATOM 1481 C SER B 14 -1.622 -1.417 15.097 1.00 0.00 C ATOM 1482 O SER B 14 -1.889 -0.219 15.113 1.00 0.00 O ATOM 1483 CB SER B 14 -1.768 -2.610 17.299 1.00 0.00 C ATOM 1484 OG SER B 14 -1.720 -1.397 18.034 1.00 0.00 O ATOM 0 H SER B 14 -2.109 -4.457 15.681 1.00 0.00 H new ATOM 0 HA SER B 14 -3.427 -1.991 16.095 1.00 0.00 H new ATOM 0 HB2 SER B 14 -2.321 -3.360 17.865 1.00 0.00 H new ATOM 0 HB3 SER B 14 -0.758 -2.995 17.161 1.00 0.00 H new ATOM 0 HG SER B 14 -1.294 -1.557 18.902 1.00 0.00 H new ATOM 1490 N LEU B 15 -0.641 -1.931 14.359 1.00 0.00 N ATOM 1491 CA LEU B 15 0.178 -1.092 13.496 1.00 0.00 C ATOM 1492 C LEU B 15 -0.671 -0.527 12.367 1.00 0.00 C ATOM 1493 O LEU B 15 -0.560 0.649 12.027 1.00 0.00 O ATOM 1494 CB LEU B 15 1.358 -1.886 12.932 1.00 0.00 C ATOM 1495 CG LEU B 15 2.366 -1.063 12.122 1.00 0.00 C ATOM 1496 CD1 LEU B 15 2.948 0.058 12.969 1.00 0.00 C ATOM 1497 CD2 LEU B 15 3.478 -1.952 11.592 1.00 0.00 C ATOM 0 H LEU B 15 -0.396 -2.921 14.343 1.00 0.00 H new ATOM 0 HA LEU B 15 0.576 -0.267 14.086 1.00 0.00 H new ATOM 0 HB2 LEU B 15 1.883 -2.364 13.759 1.00 0.00 H new ATOM 0 HB3 LEU B 15 0.970 -2.683 12.298 1.00 0.00 H new ATOM 0 HG LEU B 15 1.841 -0.621 11.276 1.00 0.00 H new ATOM 0 HD11 LEU B 15 3.661 0.630 12.375 1.00 0.00 H new ATOM 0 HD12 LEU B 15 2.145 0.715 13.304 1.00 0.00 H new ATOM 0 HD13 LEU B 15 3.455 -0.366 13.835 1.00 0.00 H new ATOM 0 HD21 LEU B 15 4.184 -1.350 11.020 1.00 0.00 H new ATOM 0 HD22 LEU B 15 3.997 -2.423 12.427 1.00 0.00 H new ATOM 0 HD23 LEU B 15 3.053 -2.722 10.948 1.00 0.00 H new ATOM 1509 N ILE B 16 -1.529 -1.369 11.797 1.00 0.00 N ATOM 1510 CA ILE B 16 -2.471 -0.932 10.774 1.00 0.00 C ATOM 1511 C ILE B 16 -3.365 0.174 11.325 1.00 0.00 C ATOM 1512 O ILE B 16 -3.569 1.206 10.683 1.00 0.00 O ATOM 1513 CB ILE B 16 -3.353 -2.099 10.275 1.00 0.00 C ATOM 1514 CG1 ILE B 16 -2.480 -3.239 9.743 1.00 0.00 C ATOM 1515 CG2 ILE B 16 -4.316 -1.620 9.195 1.00 0.00 C ATOM 1516 CD1 ILE B 16 -3.259 -4.496 9.423 1.00 0.00 C ATOM 0 H ILE B 16 -1.590 -2.361 12.028 1.00 0.00 H new ATOM 0 HA ILE B 16 -1.890 -0.557 9.932 1.00 0.00 H new ATOM 0 HB ILE B 16 -3.937 -2.472 11.116 1.00 0.00 H new ATOM 0 HG12 ILE B 16 -1.964 -2.902 8.844 1.00 0.00 H new ATOM 0 HG13 ILE B 16 -1.713 -3.474 10.481 1.00 0.00 H new ATOM 0 HG21 ILE B 16 -4.928 -2.456 8.857 1.00 0.00 H new ATOM 0 HG22 ILE B 16 -4.960 -0.840 9.601 1.00 0.00 H new ATOM 0 HG23 ILE B 16 -3.750 -1.221 8.353 1.00 0.00 H new ATOM 0 HD11 ILE B 16 -2.578 -5.261 9.051 1.00 0.00 H new ATOM 0 HD12 ILE B 16 -3.753 -4.857 10.325 1.00 0.00 H new ATOM 0 HD13 ILE B 16 -4.008 -4.276 8.662 1.00 0.00 H new ATOM 1528 N ALA B 17 -3.870 -0.046 12.536 1.00 0.00 N ATOM 1529 CA ALA B 17 -4.716 0.930 13.211 1.00 0.00 C ATOM 1530 C ALA B 17 -3.995 2.264 13.369 1.00 0.00 C ATOM 1531 O ALA B 17 -4.597 3.321 13.182 1.00 0.00 O ATOM 1532 CB ALA B 17 -5.160 0.401 14.567 1.00 0.00 C ATOM 0 H ALA B 17 -3.706 -0.898 13.072 1.00 0.00 H new ATOM 0 HA ALA B 17 -5.600 1.095 12.594 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -5.791 1.142 15.058 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -5.723 -0.522 14.431 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -4.284 0.204 15.185 1.00 0.00 H new ATOM 1538 N GLU B 18 -2.702 2.207 13.694 1.00 0.00 N ATOM 1539 CA GLU B 18 -1.881 3.409 13.839 1.00 0.00 C ATOM 1540 C GLU B 18 -1.936 4.253 12.572 1.00 0.00 C ATOM 1541 O GLU B 18 -2.154 5.464 12.620 1.00 0.00 O ATOM 1542 CB GLU B 18 -0.425 3.028 14.113 1.00 0.00 C ATOM 1543 CG GLU B 18 -0.196 2.337 15.444 1.00 0.00 C ATOM 1544 CD GLU B 18 -0.222 3.292 16.615 1.00 0.00 C ATOM 1545 OE1 GLU B 18 0.846 3.857 16.933 1.00 0.00 O ATOM 1546 OE2 GLU B 18 -1.290 3.463 17.236 1.00 0.00 O ATOM 0 H GLU B 18 -2.199 1.336 13.862 1.00 0.00 H new ATOM 0 HA GLU B 18 -2.276 3.985 14.676 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -0.077 2.374 13.314 1.00 0.00 H new ATOM 0 HB3 GLU B 18 0.187 3.930 14.076 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -0.961 1.573 15.587 1.00 0.00 H new ATOM 0 HG3 GLU B 18 0.766 1.825 15.421 1.00 0.00 H new ATOM 1553 N ILE B 19 -1.745 3.592 11.439 1.00 0.00 N ATOM 1554 CA ILE B 19 -1.714 4.266 10.151 1.00 0.00 C ATOM 1555 C ILE B 19 -3.089 4.847 9.814 1.00 0.00 C ATOM 1556 O ILE B 19 -3.195 5.937 9.249 1.00 0.00 O ATOM 1557 CB ILE B 19 -1.272 3.303 9.029 1.00 0.00 C ATOM 1558 CG1 ILE B 19 -0.178 2.361 9.537 1.00 0.00 C ATOM 1559 CG2 ILE B 19 -0.757 4.090 7.838 1.00 0.00 C ATOM 1560 CD1 ILE B 19 0.165 1.247 8.572 1.00 0.00 C ATOM 0 H ILE B 19 -1.608 2.583 11.387 1.00 0.00 H new ATOM 0 HA ILE B 19 -0.989 5.077 10.221 1.00 0.00 H new ATOM 0 HB ILE B 19 -2.134 2.711 8.721 1.00 0.00 H new ATOM 0 HG12 ILE B 19 0.722 2.941 9.742 1.00 0.00 H new ATOM 0 HG13 ILE B 19 -0.498 1.924 10.483 1.00 0.00 H new ATOM 0 HG21 ILE B 19 -0.448 3.400 7.052 1.00 0.00 H new ATOM 0 HG22 ILE B 19 -1.548 4.739 7.461 1.00 0.00 H new ATOM 0 HG23 ILE B 19 0.095 4.697 8.144 1.00 0.00 H new ATOM 0 HD11 ILE B 19 0.947 0.622 9.002 1.00 0.00 H new ATOM 0 HD12 ILE B 19 -0.722 0.642 8.385 1.00 0.00 H new ATOM 0 HD13 ILE B 19 0.517 1.674 7.633 1.00 0.00 H new ATOM 1572 N LEU B 20 -4.138 4.114 10.180 1.00 0.00 N ATOM 1573 CA LEU B 20 -5.509 4.575 9.970 1.00 0.00 C ATOM 1574 C LEU B 20 -5.809 5.797 10.832 1.00 0.00 C ATOM 1575 O LEU B 20 -6.586 6.671 10.438 1.00 0.00 O ATOM 1576 CB LEU B 20 -6.512 3.458 10.278 1.00 0.00 C ATOM 1577 CG LEU B 20 -6.936 2.593 9.083 1.00 0.00 C ATOM 1578 CD1 LEU B 20 -7.692 3.427 8.059 1.00 0.00 C ATOM 1579 CD2 LEU B 20 -5.733 1.924 8.436 1.00 0.00 C ATOM 0 H LEU B 20 -4.065 3.198 10.623 1.00 0.00 H new ATOM 0 HA LEU B 20 -5.609 4.855 8.921 1.00 0.00 H new ATOM 0 HB2 LEU B 20 -6.080 2.807 11.038 1.00 0.00 H new ATOM 0 HB3 LEU B 20 -7.405 3.907 10.712 1.00 0.00 H new ATOM 0 HG LEU B 20 -7.599 1.812 9.455 1.00 0.00 H new ATOM 0 HD11 LEU B 20 -7.984 2.796 7.220 1.00 0.00 H new ATOM 0 HD12 LEU B 20 -8.583 3.851 8.522 1.00 0.00 H new ATOM 0 HD13 LEU B 20 -7.051 4.233 7.701 1.00 0.00 H new ATOM 0 HD21 LEU B 20 -6.064 1.318 7.593 1.00 0.00 H new ATOM 0 HD22 LEU B 20 -5.038 2.687 8.084 1.00 0.00 H new ATOM 0 HD23 LEU B 20 -5.234 1.287 9.167 1.00 0.00 H new ATOM 1591 N VAL B 21 -5.198 5.854 12.012 1.00 0.00 N ATOM 1592 CA VAL B 21 -5.342 7.009 12.888 1.00 0.00 C ATOM 1593 C VAL B 21 -4.823 8.258 12.190 1.00 0.00 C ATOM 1594 O VAL B 21 -5.491 9.289 12.168 1.00 0.00 O ATOM 1595 CB VAL B 21 -4.598 6.822 14.232 1.00 0.00 C ATOM 1596 CG1 VAL B 21 -4.646 8.096 15.060 1.00 0.00 C ATOM 1597 CG2 VAL B 21 -5.196 5.667 15.019 1.00 0.00 C ATOM 0 H VAL B 21 -4.600 5.115 12.382 1.00 0.00 H new ATOM 0 HA VAL B 21 -6.404 7.116 13.109 1.00 0.00 H new ATOM 0 HB VAL B 21 -3.556 6.593 14.009 1.00 0.00 H new ATOM 0 HG11 VAL B 21 -4.116 7.939 16.000 1.00 0.00 H new ATOM 0 HG12 VAL B 21 -4.172 8.907 14.507 1.00 0.00 H new ATOM 0 HG13 VAL B 21 -5.684 8.356 15.268 1.00 0.00 H new ATOM 0 HG21 VAL B 21 -4.659 5.552 15.961 1.00 0.00 H new ATOM 0 HG22 VAL B 21 -6.247 5.871 15.223 1.00 0.00 H new ATOM 0 HG23 VAL B 21 -5.111 4.748 14.438 1.00 0.00 H new ATOM 1607 N VAL B 22 -3.642 8.145 11.594 1.00 0.00 N ATOM 1608 CA VAL B 22 -3.034 9.259 10.875 1.00 0.00 C ATOM 1609 C VAL B 22 -3.937 9.735 9.739 1.00 0.00 C ATOM 1610 O VAL B 22 -4.326 10.905 9.698 1.00 0.00 O ATOM 1611 CB VAL B 22 -1.657 8.874 10.304 1.00 0.00 C ATOM 1612 CG1 VAL B 22 -1.014 10.053 9.589 1.00 0.00 C ATOM 1613 CG2 VAL B 22 -0.754 8.359 11.411 1.00 0.00 C ATOM 0 H VAL B 22 -3.085 7.291 11.594 1.00 0.00 H new ATOM 0 HA VAL B 22 -2.903 10.069 11.592 1.00 0.00 H new ATOM 0 HB VAL B 22 -1.800 8.078 9.573 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -0.043 9.754 9.195 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -1.655 10.374 8.768 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -0.883 10.877 10.291 1.00 0.00 H new ATOM 0 HG21 VAL B 22 0.216 8.090 10.994 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -0.623 9.136 12.164 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -1.207 7.481 11.871 1.00 0.00 H new ATOM 1623 N LEU B 23 -4.259 8.821 8.826 1.00 0.00 N ATOM 1624 CA LEU B 23 -5.150 9.116 7.700 1.00 0.00 C ATOM 1625 C LEU B 23 -6.409 9.877 8.129 1.00 0.00 C ATOM 1626 O LEU B 23 -6.659 10.987 7.653 1.00 0.00 O ATOM 1627 CB LEU B 23 -5.551 7.819 6.997 1.00 0.00 C ATOM 1628 CG LEU B 23 -4.410 7.069 6.312 1.00 0.00 C ATOM 1629 CD1 LEU B 23 -4.912 5.762 5.719 1.00 0.00 C ATOM 1630 CD2 LEU B 23 -3.777 7.934 5.231 1.00 0.00 C ATOM 0 H LEU B 23 -3.914 7.861 8.843 1.00 0.00 H new ATOM 0 HA LEU B 23 -4.596 9.759 7.016 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -6.012 7.156 7.729 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -6.312 8.049 6.251 1.00 0.00 H new ATOM 0 HG LEU B 23 -3.651 6.840 7.060 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -4.086 5.241 5.235 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -5.321 5.136 6.512 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -5.690 5.971 4.984 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -2.966 7.384 4.753 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -4.529 8.192 4.485 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -3.382 8.846 5.679 1.00 0.00 H new ATOM 1642 N GLU B 24 -7.186 9.295 9.037 1.00 0.00 N ATOM 1643 CA GLU B 24 -8.475 9.874 9.414 1.00 0.00 C ATOM 1644 C GLU B 24 -8.326 11.101 10.317 1.00 0.00 C ATOM 1645 O GLU B 24 -9.263 11.889 10.452 1.00 0.00 O ATOM 1646 CB GLU B 24 -9.364 8.827 10.086 1.00 0.00 C ATOM 1647 CG GLU B 24 -9.839 7.738 9.139 1.00 0.00 C ATOM 1648 CD GLU B 24 -10.825 6.791 9.789 1.00 0.00 C ATOM 1649 OE1 GLU B 24 -11.889 7.259 10.250 1.00 0.00 O ATOM 1650 OE2 GLU B 24 -10.553 5.571 9.827 1.00 0.00 O ATOM 0 H GLU B 24 -6.950 8.430 9.523 1.00 0.00 H new ATOM 0 HA GLU B 24 -8.950 10.208 8.491 1.00 0.00 H new ATOM 0 HB2 GLU B 24 -8.814 8.368 10.908 1.00 0.00 H new ATOM 0 HB3 GLU B 24 -10.232 9.323 10.521 1.00 0.00 H new ATOM 0 HG2 GLU B 24 -10.303 8.198 8.266 1.00 0.00 H new ATOM 0 HG3 GLU B 24 -8.979 7.172 8.781 1.00 0.00 H new ATOM 1657 N LYS B 25 -7.158 11.275 10.924 1.00 0.00 N ATOM 1658 CA LYS B 25 -6.912 12.442 11.769 1.00 0.00 C ATOM 1659 C LYS B 25 -6.658 13.673 10.900 1.00 0.00 C ATOM 1660 O LYS B 25 -6.802 14.810 11.347 1.00 0.00 O ATOM 1661 CB LYS B 25 -5.733 12.191 12.716 1.00 0.00 C ATOM 1662 CG LYS B 25 -5.526 13.293 13.744 1.00 0.00 C ATOM 1663 CD LYS B 25 -4.495 12.905 14.790 1.00 0.00 C ATOM 1664 CE LYS B 25 -4.952 11.705 15.604 1.00 0.00 C ATOM 1665 NZ LYS B 25 -3.991 11.372 16.687 1.00 0.00 N ATOM 0 H LYS B 25 -6.371 10.630 10.849 1.00 0.00 H new ATOM 0 HA LYS B 25 -7.797 12.623 12.379 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -5.892 11.247 13.236 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -4.823 12.081 12.127 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -5.206 14.205 13.240 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -6.474 13.516 14.234 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -3.548 12.675 14.301 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -4.314 13.750 15.455 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -5.930 11.912 16.038 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -5.070 10.844 14.946 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -4.339 10.549 17.219 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -3.064 11.150 16.272 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -3.897 12.184 17.330 1.00 0.00 H new ATOM 1679 N HIS B 26 -6.283 13.438 9.650 1.00 0.00 N ATOM 1680 CA HIS B 26 -6.124 14.523 8.688 1.00 0.00 C ATOM 1681 C HIS B 26 -7.344 14.597 7.784 1.00 0.00 C ATOM 1682 O HIS B 26 -7.466 15.507 6.967 1.00 0.00 O ATOM 1683 CB HIS B 26 -4.862 14.335 7.840 1.00 0.00 C ATOM 1684 CG HIS B 26 -3.586 14.488 8.607 1.00 0.00 C ATOM 1685 ND1 HIS B 26 -2.870 15.665 8.656 1.00 0.00 N ATOM 1686 CD2 HIS B 26 -2.892 13.601 9.355 1.00 0.00 C ATOM 1687 CE1 HIS B 26 -1.793 15.491 9.400 1.00 0.00 C ATOM 1688 NE2 HIS B 26 -1.783 14.248 9.834 1.00 0.00 N ATOM 0 H HIS B 26 -6.083 12.509 9.278 1.00 0.00 H new ATOM 0 HA HIS B 26 -6.024 15.455 9.245 1.00 0.00 H new ATOM 0 HB2 HIS B 26 -4.885 13.344 7.387 1.00 0.00 H new ATOM 0 HB3 HIS B 26 -4.873 15.058 7.025 1.00 0.00 H new ATOM 0 HD2 HIS B 26 -3.162 12.572 9.541 1.00 0.00 H new ATOM 0 HE1 HIS B 26 -1.047 16.241 9.616 1.00 0.00 H new ATOM 0 HE2 HIS B 26 -1.066 13.834 10.430 1.00 0.00 H new ATOM 1697 N LYS B 27 -8.236 13.620 7.951 1.00 0.00 N ATOM 1698 CA LYS B 27 -9.452 13.506 7.143 1.00 0.00 C ATOM 1699 C LYS B 27 -9.086 13.322 5.674 1.00 0.00 C ATOM 1700 O LYS B 27 -9.751 13.843 4.778 1.00 0.00 O ATOM 1701 CB LYS B 27 -10.356 14.735 7.333 1.00 0.00 C ATOM 1702 CG LYS B 27 -11.786 14.522 6.849 1.00 0.00 C ATOM 1703 CD LYS B 27 -12.657 15.743 7.097 1.00 0.00 C ATOM 1704 CE LYS B 27 -12.707 16.110 8.572 1.00 0.00 C ATOM 1705 NZ LYS B 27 -13.185 14.983 9.418 1.00 0.00 N ATOM 0 H LYS B 27 -8.136 12.885 8.651 1.00 0.00 H new ATOM 0 HA LYS B 27 -10.010 12.631 7.476 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -10.375 15.002 8.390 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -9.923 15.580 6.799 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -11.778 14.292 5.784 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -12.217 13.660 7.358 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -12.271 16.587 6.525 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -13.667 15.549 6.736 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -11.714 16.414 8.903 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -13.365 16.968 8.709 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -13.348 15.322 10.388 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -14.073 14.609 9.028 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -12.468 14.230 9.430 1.00 0.00 H new ATOM 1719 N ALA B 28 -8.029 12.554 5.442 1.00 0.00 N ATOM 1720 CA ALA B 28 -7.547 12.301 4.096 1.00 0.00 C ATOM 1721 C ALA B 28 -8.550 11.461 3.314 1.00 0.00 C ATOM 1722 O ALA B 28 -8.857 10.333 3.698 1.00 0.00 O ATOM 1723 CB ALA B 28 -6.193 11.609 4.144 1.00 0.00 C ATOM 0 H ALA B 28 -7.489 12.095 6.175 1.00 0.00 H new ATOM 0 HA ALA B 28 -7.432 13.256 3.584 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -5.842 11.425 3.129 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -5.478 12.245 4.665 1.00 0.00 H new ATOM 0 HB3 ALA B 28 -6.288 10.661 4.673 1.00 0.00 H new ATOM 1729 N PRO B 29 -9.088 12.012 2.216 1.00 0.00 N ATOM 1730 CA PRO B 29 -10.025 11.293 1.350 1.00 0.00 C ATOM 1731 C PRO B 29 -9.404 10.024 0.776 1.00 0.00 C ATOM 1732 O PRO B 29 -8.182 9.861 0.792 1.00 0.00 O ATOM 1733 CB PRO B 29 -10.331 12.293 0.230 1.00 0.00 C ATOM 1734 CG PRO B 29 -9.967 13.625 0.787 1.00 0.00 C ATOM 1735 CD PRO B 29 -8.835 13.381 1.741 1.00 0.00 C ATOM 0 HA PRO B 29 -10.913 10.967 1.891 1.00 0.00 H new ATOM 0 HB2 PRO B 29 -9.753 12.070 -0.667 1.00 0.00 H new ATOM 0 HB3 PRO B 29 -11.383 12.258 -0.053 1.00 0.00 H new ATOM 0 HG2 PRO B 29 -9.668 14.311 -0.006 1.00 0.00 H new ATOM 0 HG3 PRO B 29 -10.816 14.079 1.298 1.00 0.00 H new ATOM 0 HD2 PRO B 29 -7.867 13.464 1.247 1.00 0.00 H new ATOM 0 HD3 PRO B 29 -8.837 14.099 2.561 1.00 0.00 H new ATOM 1743 N THR B 30 -10.245 9.140 0.258 1.00 0.00 N ATOM 1744 CA THR B 30 -9.792 7.860 -0.272 1.00 0.00 C ATOM 1745 C THR B 30 -8.739 8.055 -1.365 1.00 0.00 C ATOM 1746 O THR B 30 -7.701 7.389 -1.366 1.00 0.00 O ATOM 1747 CB THR B 30 -10.981 7.055 -0.829 1.00 0.00 C ATOM 1748 OG1 THR B 30 -12.032 7.021 0.146 1.00 0.00 O ATOM 1749 CG2 THR B 30 -10.573 5.629 -1.170 1.00 0.00 C ATOM 0 H THR B 30 -11.252 9.287 0.193 1.00 0.00 H new ATOM 0 HA THR B 30 -9.338 7.304 0.548 1.00 0.00 H new ATOM 0 HB THR B 30 -11.324 7.544 -1.741 1.00 0.00 H new ATOM 0 HG1 THR B 30 -12.712 7.689 -0.082 1.00 0.00 H new ATOM 0 HG21 THR B 30 -11.435 5.088 -1.561 1.00 0.00 H new ATOM 0 HG22 THR B 30 -9.784 5.646 -1.922 1.00 0.00 H new ATOM 0 HG23 THR B 30 -10.208 5.130 -0.272 1.00 0.00 H new ATOM 1757 N ASP B 31 -8.991 8.999 -2.264 1.00 0.00 N ATOM 1758 CA ASP B 31 -8.071 9.284 -3.364 1.00 0.00 C ATOM 1759 C ASP B 31 -6.740 9.825 -2.843 1.00 0.00 C ATOM 1760 O ASP B 31 -5.675 9.465 -3.346 1.00 0.00 O ATOM 1761 CB ASP B 31 -8.699 10.275 -4.354 1.00 0.00 C ATOM 1762 CG ASP B 31 -9.125 11.577 -3.706 1.00 0.00 C ATOM 1763 OD1 ASP B 31 -10.037 11.549 -2.856 1.00 0.00 O ATOM 1764 OD2 ASP B 31 -8.563 12.636 -4.055 1.00 0.00 O ATOM 0 H ASP B 31 -9.827 9.583 -2.254 1.00 0.00 H new ATOM 0 HA ASP B 31 -7.876 8.347 -3.886 1.00 0.00 H new ATOM 0 HB2 ASP B 31 -7.983 10.489 -5.148 1.00 0.00 H new ATOM 0 HB3 ASP B 31 -9.566 9.810 -4.823 1.00 0.00 H new ATOM 1769 N LEU B 32 -6.803 10.673 -1.822 1.00 0.00 N ATOM 1770 CA LEU B 32 -5.599 11.227 -1.215 1.00 0.00 C ATOM 1771 C LEU B 32 -4.836 10.140 -0.467 1.00 0.00 C ATOM 1772 O LEU B 32 -3.608 10.062 -0.545 1.00 0.00 O ATOM 1773 CB LEU B 32 -5.959 12.374 -0.263 1.00 0.00 C ATOM 1774 CG LEU B 32 -4.780 13.010 0.482 1.00 0.00 C ATOM 1775 CD1 LEU B 32 -3.770 13.590 -0.497 1.00 0.00 C ATOM 1776 CD2 LEU B 32 -5.275 14.088 1.436 1.00 0.00 C ATOM 0 H LEU B 32 -7.674 10.991 -1.398 1.00 0.00 H new ATOM 0 HA LEU B 32 -4.961 11.620 -2.007 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -6.466 13.151 -0.834 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -6.672 12.002 0.472 1.00 0.00 H new ATOM 0 HG LEU B 32 -4.283 12.232 1.062 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -2.943 14.036 0.055 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -3.391 12.797 -1.141 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -4.252 14.354 -1.107 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -4.426 14.530 1.958 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -5.797 14.861 0.872 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -5.957 13.646 2.162 1.00 0.00 H new ATOM 1788 N SER B 33 -5.574 9.291 0.238 1.00 0.00 N ATOM 1789 CA SER B 33 -4.980 8.197 0.994 1.00 0.00 C ATOM 1790 C SER B 33 -4.246 7.227 0.070 1.00 0.00 C ATOM 1791 O SER B 33 -3.141 6.784 0.381 1.00 0.00 O ATOM 1792 CB SER B 33 -6.059 7.466 1.796 1.00 0.00 C ATOM 1793 OG SER B 33 -6.700 8.348 2.704 1.00 0.00 O ATOM 0 H SER B 33 -6.591 9.341 0.301 1.00 0.00 H new ATOM 0 HA SER B 33 -4.250 8.615 1.687 1.00 0.00 H new ATOM 0 HB2 SER B 33 -6.796 7.039 1.116 1.00 0.00 H new ATOM 0 HB3 SER B 33 -5.612 6.636 2.343 1.00 0.00 H new ATOM 0 HG SER B 33 -7.274 8.968 2.208 1.00 0.00 H new ATOM 1799 N LEU B 34 -4.855 6.921 -1.074 1.00 0.00 N ATOM 1800 CA LEU B 34 -4.237 6.034 -2.056 1.00 0.00 C ATOM 1801 C LEU B 34 -2.904 6.602 -2.535 1.00 0.00 C ATOM 1802 O LEU B 34 -1.904 5.887 -2.616 1.00 0.00 O ATOM 1803 CB LEU B 34 -5.172 5.822 -3.253 1.00 0.00 C ATOM 1804 CG LEU B 34 -6.480 5.088 -2.950 1.00 0.00 C ATOM 1805 CD1 LEU B 34 -7.382 5.091 -4.176 1.00 0.00 C ATOM 1806 CD2 LEU B 34 -6.200 3.662 -2.502 1.00 0.00 C ATOM 0 H LEU B 34 -5.774 7.274 -1.343 1.00 0.00 H new ATOM 0 HA LEU B 34 -4.055 5.073 -1.574 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -5.413 6.796 -3.679 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -4.632 5.264 -4.018 1.00 0.00 H new ATOM 0 HG LEU B 34 -6.990 5.609 -2.140 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -8.309 4.566 -3.947 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -7.608 6.119 -4.459 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -6.876 4.590 -5.001 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -7.142 3.155 -2.291 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -5.671 3.130 -3.292 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -5.586 3.677 -1.601 1.00 0.00 H new ATOM 1818 N MET B 35 -2.893 7.894 -2.837 1.00 0.00 N ATOM 1819 CA MET B 35 -1.690 8.554 -3.327 1.00 0.00 C ATOM 1820 C MET B 35 -0.626 8.636 -2.234 1.00 0.00 C ATOM 1821 O MET B 35 0.563 8.437 -2.499 1.00 0.00 O ATOM 1822 CB MET B 35 -2.028 9.952 -3.851 1.00 0.00 C ATOM 1823 CG MET B 35 -0.822 10.717 -4.380 1.00 0.00 C ATOM 1824 SD MET B 35 -1.262 12.325 -5.070 1.00 0.00 S ATOM 1825 CE MET B 35 -2.158 13.044 -3.698 1.00 0.00 C ATOM 0 H MET B 35 -3.704 8.506 -2.751 1.00 0.00 H new ATOM 0 HA MET B 35 -1.286 7.960 -4.147 1.00 0.00 H new ATOM 0 HB2 MET B 35 -2.768 9.863 -4.647 1.00 0.00 H new ATOM 0 HB3 MET B 35 -2.490 10.529 -3.050 1.00 0.00 H new ATOM 0 HG2 MET B 35 -0.104 10.858 -3.572 1.00 0.00 H new ATOM 0 HG3 MET B 35 -0.327 10.121 -5.147 1.00 0.00 H new ATOM 0 HE1 MET B 35 -2.188 14.128 -3.811 1.00 0.00 H new ATOM 0 HE2 MET B 35 -3.175 12.652 -3.682 1.00 0.00 H new ATOM 0 HE3 MET B 35 -1.657 12.791 -2.764 1.00 0.00 H new ATOM 1835 N ALA B 36 -1.055 8.925 -1.010 1.00 0.00 N ATOM 1836 CA ALA B 36 -0.139 9.005 0.121 1.00 0.00 C ATOM 1837 C ALA B 36 0.506 7.647 0.384 1.00 0.00 C ATOM 1838 O ALA B 36 1.727 7.508 0.307 1.00 0.00 O ATOM 1839 CB ALA B 36 -0.867 9.497 1.363 1.00 0.00 C ATOM 0 H ALA B 36 -2.031 9.108 -0.776 1.00 0.00 H new ATOM 0 HA ALA B 36 0.647 9.719 -0.124 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -0.168 9.551 2.197 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -1.282 10.487 1.173 1.00 0.00 H new ATOM 0 HB3 ALA B 36 -1.674 8.807 1.609 1.00 0.00 H new ATOM 1845 N LEU B 37 -0.328 6.653 0.678 1.00 0.00 N ATOM 1846 CA LEU B 37 0.132 5.284 0.909 1.00 0.00 C ATOM 1847 C LEU B 37 0.960 4.762 -0.263 1.00 0.00 C ATOM 1848 O LEU B 37 1.987 4.115 -0.060 1.00 0.00 O ATOM 1849 CB LEU B 37 -1.062 4.351 1.150 1.00 0.00 C ATOM 1850 CG LEU B 37 -1.549 4.245 2.600 1.00 0.00 C ATOM 1851 CD1 LEU B 37 -0.474 3.622 3.473 1.00 0.00 C ATOM 1852 CD2 LEU B 37 -1.955 5.605 3.145 1.00 0.00 C ATOM 0 H LEU B 37 -1.338 6.771 0.763 1.00 0.00 H new ATOM 0 HA LEU B 37 0.767 5.300 1.795 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -1.893 4.690 0.532 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -0.794 3.353 0.804 1.00 0.00 H new ATOM 0 HG LEU B 37 -2.429 3.603 2.614 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -0.834 3.553 4.500 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -0.238 2.624 3.103 1.00 0.00 H new ATOM 0 HD13 LEU B 37 0.423 4.241 3.444 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -2.296 5.497 4.175 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -1.099 6.279 3.115 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -2.762 6.015 2.537 1.00 0.00 H new ATOM 1864 N GLY B 38 0.516 5.054 -1.483 1.00 0.00 N ATOM 1865 CA GLY B 38 1.221 4.598 -2.670 1.00 0.00 C ATOM 1866 C GLY B 38 2.662 5.067 -2.714 1.00 0.00 C ATOM 1867 O GLY B 38 3.564 4.296 -3.050 1.00 0.00 O ATOM 0 H GLY B 38 -0.324 5.601 -1.671 1.00 0.00 H new ATOM 0 HA2 GLY B 38 1.197 3.509 -2.705 1.00 0.00 H new ATOM 0 HA3 GLY B 38 0.700 4.957 -3.557 1.00 0.00 H new ATOM 1871 N ASN B 39 2.883 6.325 -2.361 1.00 0.00 N ATOM 1872 CA ASN B 39 4.232 6.878 -2.336 1.00 0.00 C ATOM 1873 C ASN B 39 5.009 6.353 -1.138 1.00 0.00 C ATOM 1874 O ASN B 39 6.231 6.265 -1.179 1.00 0.00 O ATOM 1875 CB ASN B 39 4.207 8.408 -2.313 1.00 0.00 C ATOM 1876 CG ASN B 39 3.986 9.015 -3.687 1.00 0.00 C ATOM 1877 OD1 ASN B 39 4.937 9.283 -4.421 1.00 0.00 O ATOM 1878 ND2 ASN B 39 2.731 9.242 -4.045 1.00 0.00 N ATOM 0 H ASN B 39 2.150 6.980 -2.089 1.00 0.00 H new ATOM 0 HA ASN B 39 4.733 6.558 -3.249 1.00 0.00 H new ATOM 0 HB2 ASN B 39 3.417 8.744 -1.642 1.00 0.00 H new ATOM 0 HB3 ASN B 39 5.149 8.776 -1.906 1.00 0.00 H new ATOM 0 HD21 ASN B 39 2.527 9.652 -4.956 1.00 0.00 H new ATOM 0 HD22 ASN B 39 1.969 9.006 -3.409 1.00 0.00 H new ATOM 1885 N CYS B 40 4.299 5.997 -0.078 1.00 0.00 N ATOM 1886 CA CYS B 40 4.934 5.420 1.098 1.00 0.00 C ATOM 1887 C CYS B 40 5.524 4.052 0.766 1.00 0.00 C ATOM 1888 O CYS B 40 6.685 3.774 1.074 1.00 0.00 O ATOM 1889 CB CYS B 40 3.929 5.292 2.245 1.00 0.00 C ATOM 1890 SG CYS B 40 3.206 6.862 2.775 1.00 0.00 S ATOM 0 H CYS B 40 3.286 6.097 -0.007 1.00 0.00 H new ATOM 0 HA CYS B 40 5.739 6.085 1.412 1.00 0.00 H new ATOM 0 HB2 CYS B 40 3.127 4.621 1.937 1.00 0.00 H new ATOM 0 HB3 CYS B 40 4.424 4.827 3.097 1.00 0.00 H new ATOM 0 HG CYS B 40 2.485 7.355 1.812 1.00 0.00 H new ATOM 1896 N VAL B 41 4.721 3.213 0.112 1.00 0.00 N ATOM 1897 CA VAL B 41 5.147 1.867 -0.258 1.00 0.00 C ATOM 1898 C VAL B 41 6.349 1.922 -1.197 1.00 0.00 C ATOM 1899 O VAL B 41 7.340 1.225 -0.988 1.00 0.00 O ATOM 1900 CB VAL B 41 3.997 1.076 -0.929 1.00 0.00 C ATOM 1901 CG1 VAL B 41 4.423 -0.351 -1.248 1.00 0.00 C ATOM 1902 CG2 VAL B 41 2.758 1.071 -0.045 1.00 0.00 C ATOM 0 H VAL B 41 3.769 3.444 -0.172 1.00 0.00 H new ATOM 0 HA VAL B 41 5.432 1.351 0.659 1.00 0.00 H new ATOM 0 HB VAL B 41 3.754 1.576 -1.866 1.00 0.00 H new ATOM 0 HG11 VAL B 41 3.595 -0.881 -1.718 1.00 0.00 H new ATOM 0 HG12 VAL B 41 5.275 -0.333 -1.928 1.00 0.00 H new ATOM 0 HG13 VAL B 41 4.704 -0.861 -0.327 1.00 0.00 H new ATOM 0 HG21 VAL B 41 1.963 0.510 -0.536 1.00 0.00 H new ATOM 0 HG22 VAL B 41 2.995 0.604 0.911 1.00 0.00 H new ATOM 0 HG23 VAL B 41 2.428 2.096 0.124 1.00 0.00 H new ATOM 1912 N THR B 42 6.273 2.776 -2.211 1.00 0.00 N ATOM 1913 CA THR B 42 7.356 2.909 -3.178 1.00 0.00 C ATOM 1914 C THR B 42 8.605 3.514 -2.539 1.00 0.00 C ATOM 1915 O THR B 42 9.725 3.081 -2.813 1.00 0.00 O ATOM 1916 CB THR B 42 6.926 3.768 -4.383 1.00 0.00 C ATOM 1917 OG1 THR B 42 6.122 4.868 -3.938 1.00 0.00 O ATOM 1918 CG2 THR B 42 6.150 2.940 -5.394 1.00 0.00 C ATOM 0 H THR B 42 5.474 3.386 -2.385 1.00 0.00 H new ATOM 0 HA THR B 42 7.594 1.904 -3.527 1.00 0.00 H new ATOM 0 HB THR B 42 7.825 4.148 -4.868 1.00 0.00 H new ATOM 0 HG1 THR B 42 5.203 4.562 -3.789 1.00 0.00 H new ATOM 0 HG21 THR B 42 5.859 3.571 -6.234 1.00 0.00 H new ATOM 0 HG22 THR B 42 6.777 2.124 -5.753 1.00 0.00 H new ATOM 0 HG23 THR B 42 5.257 2.531 -4.921 1.00 0.00 H new ATOM 1926 N HIS B 43 8.403 4.498 -1.667 1.00 0.00 N ATOM 1927 CA HIS B 43 9.506 5.173 -0.985 1.00 0.00 C ATOM 1928 C HIS B 43 10.348 4.170 -0.202 1.00 0.00 C ATOM 1929 O HIS B 43 11.570 4.298 -0.122 1.00 0.00 O ATOM 1930 CB HIS B 43 8.959 6.252 -0.043 1.00 0.00 C ATOM 1931 CG HIS B 43 9.995 7.186 0.498 1.00 0.00 C ATOM 1932 ND1 HIS B 43 10.416 8.308 -0.178 1.00 0.00 N ATOM 1933 CD2 HIS B 43 10.680 7.175 1.665 1.00 0.00 C ATOM 1934 CE1 HIS B 43 11.313 8.947 0.546 1.00 0.00 C ATOM 1935 NE2 HIS B 43 11.492 8.281 1.669 1.00 0.00 N ATOM 0 H HIS B 43 7.479 4.848 -1.414 1.00 0.00 H new ATOM 0 HA HIS B 43 10.141 5.644 -1.735 1.00 0.00 H new ATOM 0 HB2 HIS B 43 8.206 6.833 -0.575 1.00 0.00 H new ATOM 0 HB3 HIS B 43 8.455 5.766 0.792 1.00 0.00 H new ATOM 0 HD2 HIS B 43 10.602 6.434 2.447 1.00 0.00 H new ATOM 0 HE1 HIS B 43 11.816 9.861 0.266 1.00 0.00 H new ATOM 0 HE2 HIS B 43 12.131 8.545 2.419 1.00 0.00 H new ATOM 1944 N LEU B 44 9.686 3.173 0.372 1.00 0.00 N ATOM 1945 CA LEU B 44 10.374 2.126 1.115 1.00 0.00 C ATOM 1946 C LEU B 44 10.920 1.069 0.160 1.00 0.00 C ATOM 1947 O LEU B 44 12.066 0.637 0.279 1.00 0.00 O ATOM 1948 CB LEU B 44 9.421 1.472 2.121 1.00 0.00 C ATOM 1949 CG LEU B 44 8.787 2.422 3.141 1.00 0.00 C ATOM 1950 CD1 LEU B 44 7.875 1.654 4.084 1.00 0.00 C ATOM 1951 CD2 LEU B 44 9.858 3.165 3.928 1.00 0.00 C ATOM 0 H LEU B 44 8.672 3.068 0.337 1.00 0.00 H new ATOM 0 HA LEU B 44 11.205 2.578 1.656 1.00 0.00 H new ATOM 0 HB2 LEU B 44 8.624 0.974 1.569 1.00 0.00 H new ATOM 0 HB3 LEU B 44 9.966 0.698 2.661 1.00 0.00 H new ATOM 0 HG LEU B 44 8.191 3.156 2.599 1.00 0.00 H new ATOM 0 HD11 LEU B 44 7.432 2.343 4.803 1.00 0.00 H new ATOM 0 HD12 LEU B 44 7.084 1.169 3.511 1.00 0.00 H new ATOM 0 HD13 LEU B 44 8.454 0.898 4.615 1.00 0.00 H new ATOM 0 HD21 LEU B 44 9.384 3.834 4.646 1.00 0.00 H new ATOM 0 HD22 LEU B 44 10.483 2.447 4.459 1.00 0.00 H new ATOM 0 HD23 LEU B 44 10.475 3.747 3.243 1.00 0.00 H new ATOM 1963 N LEU B 45 10.090 0.684 -0.801 1.00 0.00 N ATOM 1964 CA LEU B 45 10.417 -0.380 -1.744 1.00 0.00 C ATOM 1965 C LEU B 45 11.664 -0.046 -2.564 1.00 0.00 C ATOM 1966 O LEU B 45 12.460 -0.926 -2.881 1.00 0.00 O ATOM 1967 CB LEU B 45 9.206 -0.630 -2.656 1.00 0.00 C ATOM 1968 CG LEU B 45 9.322 -1.791 -3.648 1.00 0.00 C ATOM 1969 CD1 LEU B 45 7.950 -2.381 -3.920 1.00 0.00 C ATOM 1970 CD2 LEU B 45 9.940 -1.322 -4.953 1.00 0.00 C ATOM 0 H LEU B 45 9.171 1.100 -0.949 1.00 0.00 H new ATOM 0 HA LEU B 45 10.645 -1.288 -1.185 1.00 0.00 H new ATOM 0 HB2 LEU B 45 8.335 -0.807 -2.025 1.00 0.00 H new ATOM 0 HB3 LEU B 45 9.011 0.282 -3.220 1.00 0.00 H new ATOM 0 HG LEU B 45 9.965 -2.553 -3.209 1.00 0.00 H new ATOM 0 HD11 LEU B 45 8.042 -3.206 -4.626 1.00 0.00 H new ATOM 0 HD12 LEU B 45 7.520 -2.748 -2.988 1.00 0.00 H new ATOM 0 HD13 LEU B 45 7.301 -1.613 -4.341 1.00 0.00 H new ATOM 0 HD21 LEU B 45 10.013 -2.162 -5.644 1.00 0.00 H new ATOM 0 HD22 LEU B 45 9.315 -0.544 -5.393 1.00 0.00 H new ATOM 0 HD23 LEU B 45 10.936 -0.922 -4.761 1.00 0.00 H new ATOM 1982 N GLU B 46 11.842 1.221 -2.904 1.00 0.00 N ATOM 1983 CA GLU B 46 12.981 1.623 -3.716 1.00 0.00 C ATOM 1984 C GLU B 46 14.247 1.805 -2.883 1.00 0.00 C ATOM 1985 O GLU B 46 15.316 1.319 -3.252 1.00 0.00 O ATOM 1986 CB GLU B 46 12.689 2.918 -4.469 1.00 0.00 C ATOM 1987 CG GLU B 46 11.605 2.792 -5.524 1.00 0.00 C ATOM 1988 CD GLU B 46 11.563 4.002 -6.429 1.00 0.00 C ATOM 1989 OE1 GLU B 46 11.032 5.050 -6.006 1.00 0.00 O ATOM 1990 OE2 GLU B 46 12.098 3.923 -7.555 1.00 0.00 O ATOM 0 H GLU B 46 11.219 1.982 -2.634 1.00 0.00 H new ATOM 0 HA GLU B 46 13.150 0.816 -4.429 1.00 0.00 H new ATOM 0 HB2 GLU B 46 12.395 3.684 -3.752 1.00 0.00 H new ATOM 0 HB3 GLU B 46 13.606 3.263 -4.946 1.00 0.00 H new ATOM 0 HG2 GLU B 46 11.780 1.897 -6.121 1.00 0.00 H new ATOM 0 HG3 GLU B 46 10.637 2.667 -5.038 1.00 0.00 H new ATOM 1997 N ARG B 47 14.132 2.500 -1.764 1.00 0.00 N ATOM 1998 CA ARG B 47 15.316 2.926 -1.027 1.00 0.00 C ATOM 1999 C ARG B 47 15.751 1.904 0.020 1.00 0.00 C ATOM 2000 O ARG B 47 16.911 1.892 0.431 1.00 0.00 O ATOM 2001 CB ARG B 47 15.075 4.287 -0.371 1.00 0.00 C ATOM 2002 CG ARG B 47 14.721 5.382 -1.368 1.00 0.00 C ATOM 2003 CD ARG B 47 14.679 6.750 -0.711 1.00 0.00 C ATOM 2004 NE ARG B 47 15.993 7.177 -0.238 1.00 0.00 N ATOM 2005 CZ ARG B 47 16.208 8.303 0.441 1.00 0.00 C ATOM 2006 NH1 ARG B 47 15.209 9.139 0.686 1.00 0.00 N ATOM 2007 NH2 ARG B 47 17.427 8.610 0.862 1.00 0.00 N ATOM 0 H ARG B 47 13.244 2.780 -1.348 1.00 0.00 H new ATOM 0 HA ARG B 47 16.128 3.012 -1.750 1.00 0.00 H new ATOM 0 HB2 ARG B 47 14.269 4.194 0.357 1.00 0.00 H new ATOM 0 HB3 ARG B 47 15.969 4.581 0.179 1.00 0.00 H new ATOM 0 HG2 ARG B 47 15.453 5.389 -2.176 1.00 0.00 H new ATOM 0 HG3 ARG B 47 13.752 5.165 -1.818 1.00 0.00 H new ATOM 0 HD2 ARG B 47 14.296 7.481 -1.423 1.00 0.00 H new ATOM 0 HD3 ARG B 47 13.983 6.727 0.128 1.00 0.00 H new ATOM 0 HE ARG B 47 16.794 6.578 -0.439 1.00 0.00 H new ATOM 0 HH11 ARG B 47 14.269 8.922 0.354 1.00 0.00 H new ATOM 0 HH12 ARG B 47 15.380 9.999 1.206 1.00 0.00 H new ATOM 0 HH21 ARG B 47 18.207 7.983 0.667 1.00 0.00 H new ATOM 0 HH22 ARG B 47 17.585 9.474 1.381 1.00 0.00 H new ATOM 2021 N LYS B 48 14.836 1.053 0.457 1.00 0.00 N ATOM 2022 CA LYS B 48 15.163 0.067 1.483 1.00 0.00 C ATOM 2023 C LYS B 48 15.298 -1.330 0.883 1.00 0.00 C ATOM 2024 O LYS B 48 15.795 -2.253 1.535 1.00 0.00 O ATOM 2025 CB LYS B 48 14.103 0.081 2.588 1.00 0.00 C ATOM 2026 CG LYS B 48 14.008 1.418 3.305 1.00 0.00 C ATOM 2027 CD LYS B 48 12.942 1.411 4.391 1.00 0.00 C ATOM 2028 CE LYS B 48 13.268 0.431 5.508 1.00 0.00 C ATOM 2029 NZ LYS B 48 14.557 0.746 6.177 1.00 0.00 N ATOM 0 H LYS B 48 13.872 1.022 0.124 1.00 0.00 H new ATOM 0 HA LYS B 48 16.126 0.335 1.918 1.00 0.00 H new ATOM 0 HB2 LYS B 48 13.133 -0.163 2.156 1.00 0.00 H new ATOM 0 HB3 LYS B 48 14.333 -0.699 3.314 1.00 0.00 H new ATOM 0 HG2 LYS B 48 14.974 1.661 3.748 1.00 0.00 H new ATOM 0 HG3 LYS B 48 13.783 2.202 2.582 1.00 0.00 H new ATOM 0 HD2 LYS B 48 12.842 2.414 4.807 1.00 0.00 H new ATOM 0 HD3 LYS B 48 11.979 1.151 3.951 1.00 0.00 H new ATOM 0 HE2 LYS B 48 12.466 0.445 6.246 1.00 0.00 H new ATOM 0 HE3 LYS B 48 13.310 -0.579 5.101 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 14.640 0.187 7.050 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 15.345 0.512 5.540 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 14.589 1.759 6.410 1.00 0.00 H new ATOM 2043 N VAL B 49 14.866 -1.481 -0.359 1.00 0.00 N ATOM 2044 CA VAL B 49 14.952 -2.757 -1.055 1.00 0.00 C ATOM 2045 C VAL B 49 15.823 -2.621 -2.304 1.00 0.00 C ATOM 2046 O VAL B 49 15.648 -1.684 -3.089 1.00 0.00 O ATOM 2047 CB VAL B 49 13.549 -3.281 -1.454 1.00 0.00 C ATOM 2048 CG1 VAL B 49 13.645 -4.622 -2.165 1.00 0.00 C ATOM 2049 CG2 VAL B 49 12.648 -3.387 -0.233 1.00 0.00 C ATOM 0 H VAL B 49 14.449 -0.730 -0.910 1.00 0.00 H new ATOM 0 HA VAL B 49 15.404 -3.476 -0.372 1.00 0.00 H new ATOM 0 HB VAL B 49 13.109 -2.564 -2.147 1.00 0.00 H new ATOM 0 HG11 VAL B 49 12.645 -4.964 -2.433 1.00 0.00 H new ATOM 0 HG12 VAL B 49 14.245 -4.513 -3.068 1.00 0.00 H new ATOM 0 HG13 VAL B 49 14.113 -5.351 -1.504 1.00 0.00 H new ATOM 0 HG21 VAL B 49 11.668 -3.757 -0.535 1.00 0.00 H new ATOM 0 HG22 VAL B 49 13.090 -4.076 0.487 1.00 0.00 H new ATOM 0 HG23 VAL B 49 12.540 -2.404 0.226 1.00 0.00 H new ATOM 2059 N PRO B 50 16.794 -3.540 -2.483 1.00 0.00 N ATOM 2060 CA PRO B 50 17.685 -3.551 -3.651 1.00 0.00 C ATOM 2061 C PRO B 50 16.924 -3.462 -4.970 1.00 0.00 C ATOM 2062 O PRO B 50 15.851 -4.050 -5.117 1.00 0.00 O ATOM 2063 CB PRO B 50 18.396 -4.900 -3.538 1.00 0.00 C ATOM 2064 CG PRO B 50 18.388 -5.208 -2.083 1.00 0.00 C ATOM 2065 CD PRO B 50 17.108 -4.632 -1.542 1.00 0.00 C ATOM 0 HA PRO B 50 18.358 -2.693 -3.655 1.00 0.00 H new ATOM 0 HB2 PRO B 50 17.878 -5.670 -4.109 1.00 0.00 H new ATOM 0 HB3 PRO B 50 19.413 -4.846 -3.926 1.00 0.00 H new ATOM 0 HG2 PRO B 50 18.434 -6.284 -1.912 1.00 0.00 H new ATOM 0 HG3 PRO B 50 19.253 -4.769 -1.587 1.00 0.00 H new ATOM 0 HD2 PRO B 50 16.313 -5.378 -1.513 1.00 0.00 H new ATOM 0 HD3 PRO B 50 17.234 -4.261 -0.525 1.00 0.00 H new ATOM 2073 N SER B 51 17.503 -2.736 -5.919 1.00 0.00 N ATOM 2074 CA SER B 51 16.885 -2.490 -7.219 1.00 0.00 C ATOM 2075 C SER B 51 16.404 -3.787 -7.877 1.00 0.00 C ATOM 2076 O SER B 51 15.286 -3.855 -8.389 1.00 0.00 O ATOM 2077 CB SER B 51 17.886 -1.773 -8.131 1.00 0.00 C ATOM 2078 OG SER B 51 17.314 -1.460 -9.390 1.00 0.00 O ATOM 0 H SER B 51 18.418 -2.299 -5.809 1.00 0.00 H new ATOM 0 HA SER B 51 16.008 -1.861 -7.064 1.00 0.00 H new ATOM 0 HB2 SER B 51 18.228 -0.857 -7.648 1.00 0.00 H new ATOM 0 HB3 SER B 51 18.763 -2.403 -8.276 1.00 0.00 H new ATOM 0 HG SER B 51 17.978 -1.002 -9.946 1.00 0.00 H new ATOM 2084 N GLU B 52 17.240 -4.813 -7.827 1.00 0.00 N ATOM 2085 CA GLU B 52 16.943 -6.097 -8.462 1.00 0.00 C ATOM 2086 C GLU B 52 15.716 -6.759 -7.840 1.00 0.00 C ATOM 2087 O GLU B 52 15.027 -7.547 -8.487 1.00 0.00 O ATOM 2088 CB GLU B 52 18.142 -7.047 -8.342 1.00 0.00 C ATOM 2089 CG GLU B 52 19.384 -6.608 -9.109 1.00 0.00 C ATOM 2090 CD GLU B 52 19.953 -5.291 -8.628 1.00 0.00 C ATOM 2091 OE1 GLU B 52 19.991 -5.066 -7.402 1.00 0.00 O ATOM 2092 OE2 GLU B 52 20.370 -4.473 -9.477 1.00 0.00 O ATOM 0 H GLU B 52 18.140 -4.784 -7.349 1.00 0.00 H new ATOM 0 HA GLU B 52 16.736 -5.897 -9.513 1.00 0.00 H new ATOM 0 HB2 GLU B 52 18.401 -7.152 -7.288 1.00 0.00 H new ATOM 0 HB3 GLU B 52 17.843 -8.034 -8.696 1.00 0.00 H new ATOM 0 HG2 GLU B 52 20.149 -7.380 -9.020 1.00 0.00 H new ATOM 0 HG3 GLU B 52 19.138 -6.524 -10.167 1.00 0.00 H new ATOM 2099 N SER B 53 15.438 -6.427 -6.591 1.00 0.00 N ATOM 2100 CA SER B 53 14.378 -7.090 -5.848 1.00 0.00 C ATOM 2101 C SER B 53 13.115 -6.234 -5.790 1.00 0.00 C ATOM 2102 O SER B 53 12.084 -6.673 -5.283 1.00 0.00 O ATOM 2103 CB SER B 53 14.875 -7.400 -4.439 1.00 0.00 C ATOM 2104 OG SER B 53 16.143 -8.028 -4.492 1.00 0.00 O ATOM 0 H SER B 53 15.931 -5.702 -6.069 1.00 0.00 H new ATOM 0 HA SER B 53 14.119 -8.016 -6.361 1.00 0.00 H new ATOM 0 HB2 SER B 53 14.941 -6.480 -3.859 1.00 0.00 H new ATOM 0 HB3 SER B 53 14.162 -8.048 -3.929 1.00 0.00 H new ATOM 0 HG SER B 53 16.451 -8.220 -3.582 1.00 0.00 H new ATOM 2110 N ARG B 54 13.194 -5.024 -6.333 1.00 0.00 N ATOM 2111 CA ARG B 54 12.076 -4.088 -6.286 1.00 0.00 C ATOM 2112 C ARG B 54 10.853 -4.638 -7.013 1.00 0.00 C ATOM 2113 O ARG B 54 9.741 -4.596 -6.488 1.00 0.00 O ATOM 2114 CB ARG B 54 12.476 -2.745 -6.890 1.00 0.00 C ATOM 2115 CG ARG B 54 13.504 -1.990 -6.065 1.00 0.00 C ATOM 2116 CD ARG B 54 13.863 -0.663 -6.706 1.00 0.00 C ATOM 2117 NE ARG B 54 14.904 0.041 -5.963 1.00 0.00 N ATOM 2118 CZ ARG B 54 15.709 0.959 -6.497 1.00 0.00 C ATOM 2119 NH1 ARG B 54 15.593 1.273 -7.783 1.00 0.00 N ATOM 2120 NH2 ARG B 54 16.616 1.566 -5.744 1.00 0.00 N ATOM 0 H ARG B 54 14.021 -4.668 -6.811 1.00 0.00 H new ATOM 0 HA ARG B 54 11.813 -3.947 -5.238 1.00 0.00 H new ATOM 0 HB2 ARG B 54 12.876 -2.910 -7.890 1.00 0.00 H new ATOM 0 HB3 ARG B 54 11.586 -2.126 -7.001 1.00 0.00 H new ATOM 0 HG2 ARG B 54 13.112 -1.817 -5.063 1.00 0.00 H new ATOM 0 HG3 ARG B 54 14.402 -2.598 -5.956 1.00 0.00 H new ATOM 0 HD2 ARG B 54 14.200 -0.834 -7.728 1.00 0.00 H new ATOM 0 HD3 ARG B 54 12.973 -0.036 -6.765 1.00 0.00 H new ATOM 0 HE ARG B 54 15.022 -0.183 -4.975 1.00 0.00 H new ATOM 0 HH11 ARG B 54 14.889 0.812 -8.359 1.00 0.00 H new ATOM 0 HH12 ARG B 54 16.208 1.975 -8.194 1.00 0.00 H new ATOM 0 HH21 ARG B 54 16.698 1.330 -4.755 1.00 0.00 H new ATOM 0 HH22 ARG B 54 17.232 2.268 -6.154 1.00 0.00 H new ATOM 2134 N GLN B 55 11.065 -5.162 -8.215 1.00 0.00 N ATOM 2135 CA GLN B 55 9.971 -5.710 -9.015 1.00 0.00 C ATOM 2136 C GLN B 55 9.411 -6.970 -8.364 1.00 0.00 C ATOM 2137 O GLN B 55 8.221 -7.264 -8.478 1.00 0.00 O ATOM 2138 CB GLN B 55 10.430 -6.018 -10.447 1.00 0.00 C ATOM 2139 CG GLN B 55 10.810 -4.787 -11.265 1.00 0.00 C ATOM 2140 CD GLN B 55 12.107 -4.148 -10.809 1.00 0.00 C ATOM 2141 OE1 GLN B 55 12.999 -4.826 -10.300 1.00 0.00 O ATOM 2142 NE2 GLN B 55 12.219 -2.843 -10.984 1.00 0.00 N ATOM 0 H GLN B 55 11.982 -5.220 -8.658 1.00 0.00 H new ATOM 0 HA GLN B 55 9.185 -4.956 -9.063 1.00 0.00 H new ATOM 0 HB2 GLN B 55 11.287 -6.690 -10.404 1.00 0.00 H new ATOM 0 HB3 GLN B 55 9.633 -6.551 -10.965 1.00 0.00 H new ATOM 0 HG2 GLN B 55 10.900 -5.069 -12.314 1.00 0.00 H new ATOM 0 HG3 GLN B 55 10.007 -4.053 -11.200 1.00 0.00 H new ATOM 0 HE21 GLN B 55 11.455 -2.318 -11.410 1.00 0.00 H new ATOM 0 HE22 GLN B 55 13.069 -2.361 -10.693 1.00 0.00 H new ATOM 2151 N ALA B 56 10.274 -7.703 -7.671 1.00 0.00 N ATOM 2152 CA ALA B 56 9.862 -8.909 -6.970 1.00 0.00 C ATOM 2153 C ALA B 56 8.897 -8.561 -5.845 1.00 0.00 C ATOM 2154 O ALA B 56 7.807 -9.126 -5.747 1.00 0.00 O ATOM 2155 CB ALA B 56 11.077 -9.642 -6.424 1.00 0.00 C ATOM 0 H ALA B 56 11.265 -7.481 -7.580 1.00 0.00 H new ATOM 0 HA ALA B 56 9.350 -9.566 -7.673 1.00 0.00 H new ATOM 0 HB1 ALA B 56 10.754 -10.543 -5.902 1.00 0.00 H new ATOM 0 HB2 ALA B 56 11.737 -9.917 -7.247 1.00 0.00 H new ATOM 0 HB3 ALA B 56 11.612 -8.993 -5.731 1.00 0.00 H new ATOM 2161 N VAL B 57 9.296 -7.606 -5.012 1.00 0.00 N ATOM 2162 CA VAL B 57 8.460 -7.157 -3.908 1.00 0.00 C ATOM 2163 C VAL B 57 7.155 -6.565 -4.431 1.00 0.00 C ATOM 2164 O VAL B 57 6.098 -6.750 -3.831 1.00 0.00 O ATOM 2165 CB VAL B 57 9.189 -6.111 -3.036 1.00 0.00 C ATOM 2166 CG1 VAL B 57 8.293 -5.618 -1.910 1.00 0.00 C ATOM 2167 CG2 VAL B 57 10.476 -6.689 -2.474 1.00 0.00 C ATOM 0 H VAL B 57 10.195 -7.128 -5.082 1.00 0.00 H new ATOM 0 HA VAL B 57 8.241 -8.028 -3.290 1.00 0.00 H new ATOM 0 HB VAL B 57 9.437 -5.259 -3.670 1.00 0.00 H new ATOM 0 HG11 VAL B 57 8.831 -4.883 -1.312 1.00 0.00 H new ATOM 0 HG12 VAL B 57 7.399 -5.159 -2.331 1.00 0.00 H new ATOM 0 HG13 VAL B 57 8.006 -6.459 -1.279 1.00 0.00 H new ATOM 0 HG21 VAL B 57 10.976 -5.938 -1.862 1.00 0.00 H new ATOM 0 HG22 VAL B 57 10.246 -7.561 -1.862 1.00 0.00 H new ATOM 0 HG23 VAL B 57 11.131 -6.984 -3.294 1.00 0.00 H new ATOM 2177 N ALA B 58 7.234 -5.869 -5.562 1.00 0.00 N ATOM 2178 CA ALA B 58 6.053 -5.277 -6.184 1.00 0.00 C ATOM 2179 C ALA B 58 5.027 -6.349 -6.541 1.00 0.00 C ATOM 2180 O ALA B 58 3.834 -6.196 -6.269 1.00 0.00 O ATOM 2181 CB ALA B 58 6.446 -4.484 -7.422 1.00 0.00 C ATOM 0 H ALA B 58 8.104 -5.701 -6.067 1.00 0.00 H new ATOM 0 HA ALA B 58 5.596 -4.598 -5.465 1.00 0.00 H new ATOM 0 HB1 ALA B 58 5.554 -4.049 -7.874 1.00 0.00 H new ATOM 0 HB2 ALA B 58 7.135 -3.688 -7.140 1.00 0.00 H new ATOM 0 HB3 ALA B 58 6.930 -5.146 -8.140 1.00 0.00 H new ATOM 2187 N GLU B 59 5.496 -7.439 -7.139 1.00 0.00 N ATOM 2188 CA GLU B 59 4.619 -8.546 -7.497 1.00 0.00 C ATOM 2189 C GLU B 59 4.046 -9.212 -6.252 1.00 0.00 C ATOM 2190 O GLU B 59 2.856 -9.523 -6.203 1.00 0.00 O ATOM 2191 CB GLU B 59 5.363 -9.576 -8.347 1.00 0.00 C ATOM 2192 CG GLU B 59 5.622 -9.112 -9.770 1.00 0.00 C ATOM 2193 CD GLU B 59 4.344 -8.754 -10.500 1.00 0.00 C ATOM 2194 OE1 GLU B 59 3.409 -9.586 -10.516 1.00 0.00 O ATOM 2195 OE2 GLU B 59 4.260 -7.640 -11.052 1.00 0.00 O ATOM 0 H GLU B 59 6.476 -7.579 -7.385 1.00 0.00 H new ATOM 0 HA GLU B 59 3.795 -8.140 -8.083 1.00 0.00 H new ATOM 0 HB2 GLU B 59 6.315 -9.810 -7.870 1.00 0.00 H new ATOM 0 HB3 GLU B 59 4.785 -10.500 -8.374 1.00 0.00 H new ATOM 0 HG2 GLU B 59 6.283 -8.245 -9.752 1.00 0.00 H new ATOM 0 HG3 GLU B 59 6.142 -9.898 -10.317 1.00 0.00 H new ATOM 2202 N GLN B 60 4.893 -9.421 -5.251 1.00 0.00 N ATOM 2203 CA GLN B 60 4.455 -9.998 -3.984 1.00 0.00 C ATOM 2204 C GLN B 60 3.400 -9.116 -3.326 1.00 0.00 C ATOM 2205 O GLN B 60 2.372 -9.606 -2.860 1.00 0.00 O ATOM 2206 CB GLN B 60 5.642 -10.198 -3.036 1.00 0.00 C ATOM 2207 CG GLN B 60 6.203 -11.614 -3.032 1.00 0.00 C ATOM 2208 CD GLN B 60 6.689 -12.068 -4.394 1.00 0.00 C ATOM 2209 OE1 GLN B 60 7.853 -11.884 -4.746 1.00 0.00 O ATOM 2210 NE2 GLN B 60 5.804 -12.677 -5.164 1.00 0.00 N ATOM 0 H GLN B 60 5.888 -9.200 -5.291 1.00 0.00 H new ATOM 0 HA GLN B 60 4.013 -10.972 -4.194 1.00 0.00 H new ATOM 0 HB2 GLN B 60 6.436 -9.505 -3.314 1.00 0.00 H new ATOM 0 HB3 GLN B 60 5.332 -9.938 -2.024 1.00 0.00 H new ATOM 0 HG2 GLN B 60 7.028 -11.669 -2.322 1.00 0.00 H new ATOM 0 HG3 GLN B 60 5.434 -12.302 -2.680 1.00 0.00 H new ATOM 0 HE21 GLN B 60 4.848 -12.810 -4.835 1.00 0.00 H new ATOM 0 HE22 GLN B 60 6.077 -13.014 -6.087 1.00 0.00 H new ATOM 2219 N PHE B 61 3.658 -7.814 -3.314 1.00 0.00 N ATOM 2220 CA PHE B 61 2.739 -6.843 -2.735 1.00 0.00 C ATOM 2221 C PHE B 61 1.404 -6.864 -3.474 1.00 0.00 C ATOM 2222 O PHE B 61 0.344 -6.977 -2.861 1.00 0.00 O ATOM 2223 CB PHE B 61 3.358 -5.443 -2.802 1.00 0.00 C ATOM 2224 CG PHE B 61 2.592 -4.393 -2.051 1.00 0.00 C ATOM 2225 CD1 PHE B 61 1.556 -3.699 -2.656 1.00 0.00 C ATOM 2226 CD2 PHE B 61 2.919 -4.093 -0.739 1.00 0.00 C ATOM 2227 CE1 PHE B 61 0.863 -2.726 -1.967 1.00 0.00 C ATOM 2228 CE2 PHE B 61 2.226 -3.123 -0.044 1.00 0.00 C ATOM 2229 CZ PHE B 61 1.198 -2.438 -0.660 1.00 0.00 C ATOM 0 H PHE B 61 4.506 -7.403 -3.704 1.00 0.00 H new ATOM 0 HA PHE B 61 2.559 -7.106 -1.693 1.00 0.00 H new ATOM 0 HB2 PHE B 61 4.373 -5.488 -2.407 1.00 0.00 H new ATOM 0 HB3 PHE B 61 3.435 -5.142 -3.847 1.00 0.00 H new ATOM 0 HD1 PHE B 61 1.289 -3.923 -3.678 1.00 0.00 H new ATOM 0 HD2 PHE B 61 3.725 -4.624 -0.255 1.00 0.00 H new ATOM 0 HE1 PHE B 61 0.059 -2.190 -2.450 1.00 0.00 H new ATOM 0 HE2 PHE B 61 2.487 -2.900 0.980 1.00 0.00 H new ATOM 0 HZ PHE B 61 0.656 -1.677 -0.119 1.00 0.00 H new ATOM 2239 N ALA B 62 1.467 -6.771 -4.796 1.00 0.00 N ATOM 2240 CA ALA B 62 0.271 -6.755 -5.628 1.00 0.00 C ATOM 2241 C ALA B 62 -0.534 -8.039 -5.464 1.00 0.00 C ATOM 2242 O ALA B 62 -1.762 -8.006 -5.373 1.00 0.00 O ATOM 2243 CB ALA B 62 0.651 -6.554 -7.083 1.00 0.00 C ATOM 0 H ALA B 62 2.341 -6.705 -5.318 1.00 0.00 H new ATOM 0 HA ALA B 62 -0.355 -5.924 -5.305 1.00 0.00 H new ATOM 0 HB1 ALA B 62 -0.250 -6.544 -7.696 1.00 0.00 H new ATOM 0 HB2 ALA B 62 1.177 -5.606 -7.194 1.00 0.00 H new ATOM 0 HB3 ALA B 62 1.300 -7.368 -7.405 1.00 0.00 H new ATOM 2249 N LYS B 63 0.165 -9.169 -5.419 1.00 0.00 N ATOM 2250 CA LYS B 63 -0.487 -10.459 -5.235 1.00 0.00 C ATOM 2251 C LYS B 63 -1.140 -10.534 -3.860 1.00 0.00 C ATOM 2252 O LYS B 63 -2.203 -11.132 -3.702 1.00 0.00 O ATOM 2253 CB LYS B 63 0.512 -11.610 -5.402 1.00 0.00 C ATOM 2254 CG LYS B 63 0.352 -12.415 -6.692 1.00 0.00 C ATOM 2255 CD LYS B 63 1.064 -11.784 -7.887 1.00 0.00 C ATOM 2256 CE LYS B 63 0.364 -10.529 -8.390 1.00 0.00 C ATOM 2257 NZ LYS B 63 0.923 -10.058 -9.687 1.00 0.00 N ATOM 0 H LYS B 63 1.180 -9.217 -5.507 1.00 0.00 H new ATOM 0 HA LYS B 63 -1.257 -10.557 -6.001 1.00 0.00 H new ATOM 0 HB2 LYS B 63 1.523 -11.203 -5.367 1.00 0.00 H new ATOM 0 HB3 LYS B 63 0.411 -12.286 -4.553 1.00 0.00 H new ATOM 0 HG2 LYS B 63 0.741 -13.421 -6.535 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -0.709 -12.515 -6.921 1.00 0.00 H new ATOM 0 HD2 LYS B 63 2.088 -11.537 -7.606 1.00 0.00 H new ATOM 0 HD3 LYS B 63 1.123 -12.512 -8.696 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -0.701 -10.730 -8.506 1.00 0.00 H new ATOM 0 HE3 LYS B 63 0.459 -9.738 -7.646 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 0.540 -9.117 -9.909 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 1.959 -10.003 -9.619 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 0.661 -10.725 -10.441 1.00 0.00 H new ATOM 2271 N ALA B 64 -0.503 -9.906 -2.876 1.00 0.00 N ATOM 2272 CA ALA B 64 -1.014 -9.888 -1.511 1.00 0.00 C ATOM 2273 C ALA B 64 -2.378 -9.210 -1.443 1.00 0.00 C ATOM 2274 O ALA B 64 -3.306 -9.732 -0.822 1.00 0.00 O ATOM 2275 CB ALA B 64 -0.032 -9.188 -0.581 1.00 0.00 C ATOM 0 H ALA B 64 0.374 -9.400 -3.001 1.00 0.00 H new ATOM 0 HA ALA B 64 -1.131 -10.922 -1.185 1.00 0.00 H new ATOM 0 HB1 ALA B 64 -0.431 -9.185 0.433 1.00 0.00 H new ATOM 0 HB2 ALA B 64 0.921 -9.716 -0.594 1.00 0.00 H new ATOM 0 HB3 ALA B 64 0.117 -8.161 -0.916 1.00 0.00 H new ATOM 2281 N LEU B 65 -2.499 -8.052 -2.091 1.00 0.00 N ATOM 2282 CA LEU B 65 -3.753 -7.302 -2.074 1.00 0.00 C ATOM 2283 C LEU B 65 -4.839 -8.098 -2.793 1.00 0.00 C ATOM 2284 O LEU B 65 -5.950 -8.261 -2.285 1.00 0.00 O ATOM 2285 CB LEU B 65 -3.611 -5.930 -2.754 1.00 0.00 C ATOM 2286 CG LEU B 65 -2.272 -5.202 -2.590 1.00 0.00 C ATOM 2287 CD1 LEU B 65 -2.372 -3.801 -3.168 1.00 0.00 C ATOM 2288 CD2 LEU B 65 -1.825 -5.137 -1.138 1.00 0.00 C ATOM 0 H LEU B 65 -1.751 -7.616 -2.630 1.00 0.00 H new ATOM 0 HA LEU B 65 -4.023 -7.141 -1.030 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -3.796 -6.061 -3.820 1.00 0.00 H new ATOM 0 HB3 LEU B 65 -4.398 -5.280 -2.371 1.00 0.00 H new ATOM 0 HG LEU B 65 -1.520 -5.773 -3.134 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -1.417 -3.289 -3.048 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -2.621 -3.861 -4.227 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -3.150 -3.246 -2.644 1.00 0.00 H new ATOM 0 HD21 LEU B 65 -0.872 -4.612 -1.074 1.00 0.00 H new ATOM 0 HD22 LEU B 65 -2.573 -4.604 -0.551 1.00 0.00 H new ATOM 0 HD23 LEU B 65 -1.709 -6.148 -0.747 1.00 0.00 H new ATOM 2300 N ALA B 66 -4.496 -8.607 -3.972 1.00 0.00 N ATOM 2301 CA ALA B 66 -5.431 -9.371 -4.791 1.00 0.00 C ATOM 2302 C ALA B 66 -5.937 -10.600 -4.043 1.00 0.00 C ATOM 2303 O ALA B 66 -7.127 -10.910 -4.079 1.00 0.00 O ATOM 2304 CB ALA B 66 -4.777 -9.777 -6.103 1.00 0.00 C ATOM 0 H ALA B 66 -3.569 -8.503 -4.385 1.00 0.00 H new ATOM 0 HA ALA B 66 -6.288 -8.734 -5.011 1.00 0.00 H new ATOM 0 HB1 ALA B 66 -5.487 -10.346 -6.703 1.00 0.00 H new ATOM 0 HB2 ALA B 66 -4.474 -8.884 -6.650 1.00 0.00 H new ATOM 0 HB3 ALA B 66 -3.901 -10.392 -5.898 1.00 0.00 H new ATOM 2310 N GLN B 67 -5.029 -11.281 -3.352 1.00 0.00 N ATOM 2311 CA GLN B 67 -5.379 -12.465 -2.578 1.00 0.00 C ATOM 2312 C GLN B 67 -6.354 -12.103 -1.461 1.00 0.00 C ATOM 2313 O GLN B 67 -7.242 -12.882 -1.126 1.00 0.00 O ATOM 2314 CB GLN B 67 -4.104 -13.113 -2.013 1.00 0.00 C ATOM 2315 CG GLN B 67 -4.325 -14.446 -1.302 1.00 0.00 C ATOM 2316 CD GLN B 67 -4.687 -14.301 0.168 1.00 0.00 C ATOM 2317 OE1 GLN B 67 -5.405 -15.131 0.728 1.00 0.00 O ATOM 2318 NE2 GLN B 67 -4.188 -13.251 0.805 1.00 0.00 N ATOM 0 H GLN B 67 -4.041 -11.031 -3.313 1.00 0.00 H new ATOM 0 HA GLN B 67 -5.873 -13.186 -3.230 1.00 0.00 H new ATOM 0 HB2 GLN B 67 -3.398 -13.265 -2.829 1.00 0.00 H new ATOM 0 HB3 GLN B 67 -3.638 -12.417 -1.315 1.00 0.00 H new ATOM 0 HG2 GLN B 67 -5.119 -14.992 -1.811 1.00 0.00 H new ATOM 0 HG3 GLN B 67 -3.420 -15.048 -1.387 1.00 0.00 H new ATOM 0 HE21 GLN B 67 -3.597 -12.585 0.307 1.00 0.00 H new ATOM 0 HE22 GLN B 67 -4.395 -13.109 1.794 1.00 0.00 H new ATOM 2327 N SER B 68 -6.199 -10.908 -0.910 1.00 0.00 N ATOM 2328 CA SER B 68 -7.046 -10.454 0.182 1.00 0.00 C ATOM 2329 C SER B 68 -8.435 -10.056 -0.326 1.00 0.00 C ATOM 2330 O SER B 68 -9.401 -10.051 0.436 1.00 0.00 O ATOM 2331 CB SER B 68 -6.387 -9.274 0.905 1.00 0.00 C ATOM 2332 OG SER B 68 -7.110 -8.907 2.068 1.00 0.00 O ATOM 0 H SER B 68 -5.492 -10.234 -1.203 1.00 0.00 H new ATOM 0 HA SER B 68 -7.167 -11.279 0.884 1.00 0.00 H new ATOM 0 HB2 SER B 68 -5.366 -9.538 1.179 1.00 0.00 H new ATOM 0 HB3 SER B 68 -6.325 -8.421 0.229 1.00 0.00 H new ATOM 0 HG SER B 68 -6.663 -8.153 2.507 1.00 0.00 H new ATOM 2338 N VAL B 69 -8.533 -9.717 -1.607 1.00 0.00 N ATOM 2339 CA VAL B 69 -9.810 -9.303 -2.183 1.00 0.00 C ATOM 2340 C VAL B 69 -10.541 -10.466 -2.861 1.00 0.00 C ATOM 2341 O VAL B 69 -11.718 -10.710 -2.588 1.00 0.00 O ATOM 2342 CB VAL B 69 -9.626 -8.162 -3.213 1.00 0.00 C ATOM 2343 CG1 VAL B 69 -10.967 -7.746 -3.808 1.00 0.00 C ATOM 2344 CG2 VAL B 69 -8.936 -6.967 -2.575 1.00 0.00 C ATOM 0 H VAL B 69 -7.752 -9.720 -2.262 1.00 0.00 H new ATOM 0 HA VAL B 69 -10.413 -8.946 -1.348 1.00 0.00 H new ATOM 0 HB VAL B 69 -8.994 -8.535 -4.019 1.00 0.00 H new ATOM 0 HG11 VAL B 69 -10.812 -6.943 -4.529 1.00 0.00 H new ATOM 0 HG12 VAL B 69 -11.424 -8.600 -4.309 1.00 0.00 H new ATOM 0 HG13 VAL B 69 -11.626 -7.397 -3.013 1.00 0.00 H new ATOM 0 HG21 VAL B 69 -8.817 -6.177 -3.317 1.00 0.00 H new ATOM 0 HG22 VAL B 69 -9.540 -6.598 -1.746 1.00 0.00 H new ATOM 0 HG23 VAL B 69 -7.956 -7.268 -2.205 1.00 0.00 H new ATOM 2354 N LYS B 70 -9.843 -11.189 -3.727 1.00 0.00 N ATOM 2355 CA LYS B 70 -10.484 -12.195 -4.576 1.00 0.00 C ATOM 2356 C LYS B 70 -10.921 -13.426 -3.788 1.00 0.00 C ATOM 2357 O LYS B 70 -11.800 -14.167 -4.231 1.00 0.00 O ATOM 2358 CB LYS B 70 -9.557 -12.614 -5.718 1.00 0.00 C ATOM 2359 CG LYS B 70 -9.163 -11.467 -6.636 1.00 0.00 C ATOM 2360 CD LYS B 70 -8.519 -11.977 -7.913 1.00 0.00 C ATOM 2361 CE LYS B 70 -9.519 -12.743 -8.768 1.00 0.00 C ATOM 2362 NZ LYS B 70 -10.642 -11.878 -9.221 1.00 0.00 N ATOM 0 H LYS B 70 -8.836 -11.101 -3.863 1.00 0.00 H new ATOM 0 HA LYS B 70 -11.379 -11.730 -4.989 1.00 0.00 H new ATOM 0 HB2 LYS B 70 -8.655 -13.058 -5.298 1.00 0.00 H new ATOM 0 HB3 LYS B 70 -10.048 -13.388 -6.308 1.00 0.00 H new ATOM 0 HG2 LYS B 70 -10.045 -10.876 -6.882 1.00 0.00 H new ATOM 0 HG3 LYS B 70 -8.471 -10.804 -6.117 1.00 0.00 H new ATOM 0 HD2 LYS B 70 -8.119 -11.138 -8.482 1.00 0.00 H new ATOM 0 HD3 LYS B 70 -7.678 -12.624 -7.665 1.00 0.00 H new ATOM 0 HE2 LYS B 70 -9.009 -13.160 -9.637 1.00 0.00 H new ATOM 0 HE3 LYS B 70 -9.915 -13.583 -8.198 1.00 0.00 H new ATOM 0 HZ1 LYS B 70 -11.343 -12.456 -9.728 1.00 0.00 H new ATOM 0 HZ2 LYS B 70 -11.092 -11.433 -8.396 1.00 0.00 H new ATOM 0 HZ3 LYS B 70 -10.277 -11.140 -9.856 1.00 0.00 H new ATOM 2376 N SER B 71 -10.324 -13.639 -2.624 1.00 0.00 N ATOM 2377 CA SER B 71 -10.666 -14.791 -1.801 1.00 0.00 C ATOM 2378 C SER B 71 -12.096 -14.687 -1.282 1.00 0.00 C ATOM 2379 O SER B 71 -12.744 -15.697 -1.002 1.00 0.00 O ATOM 2380 CB SER B 71 -9.684 -14.909 -0.639 1.00 0.00 C ATOM 2381 OG SER B 71 -9.516 -13.660 0.007 1.00 0.00 O ATOM 0 H SER B 71 -9.604 -13.033 -2.230 1.00 0.00 H new ATOM 0 HA SER B 71 -10.598 -15.688 -2.417 1.00 0.00 H new ATOM 0 HB2 SER B 71 -10.047 -15.647 0.076 1.00 0.00 H new ATOM 0 HB3 SER B 71 -8.722 -15.266 -1.005 1.00 0.00 H new ATOM 0 HG SER B 71 -8.693 -13.234 -0.313 1.00 0.00 H new ATOM 2387 N ASN B 72 -12.593 -13.459 -1.180 1.00 0.00 N ATOM 2388 CA ASN B 72 -13.937 -13.214 -0.677 1.00 0.00 C ATOM 2389 C ASN B 72 -14.988 -13.641 -1.702 1.00 0.00 C ATOM 2390 O ASN B 72 -16.096 -14.036 -1.339 1.00 0.00 O ATOM 2391 CB ASN B 72 -14.110 -11.732 -0.328 1.00 0.00 C ATOM 2392 CG ASN B 72 -15.441 -11.431 0.338 1.00 0.00 C ATOM 2393 OD1 ASN B 72 -16.002 -12.263 1.054 1.00 0.00 O ATOM 2394 ND2 ASN B 72 -15.955 -10.234 0.106 1.00 0.00 N ATOM 0 H ASN B 72 -12.082 -12.616 -1.441 1.00 0.00 H new ATOM 0 HA ASN B 72 -14.078 -13.809 0.225 1.00 0.00 H new ATOM 0 HB2 ASN B 72 -13.301 -11.423 0.334 1.00 0.00 H new ATOM 0 HB3 ASN B 72 -14.022 -11.138 -1.237 1.00 0.00 H new ATOM 0 HD21 ASN B 72 -16.847 -9.972 0.526 1.00 0.00 H new ATOM 0 HD22 ASN B 72 -15.459 -9.573 -0.493 1.00 0.00 H new ATOM 2401 N LEU B 73 -14.628 -13.586 -2.982 1.00 0.00 N ATOM 2402 CA LEU B 73 -15.561 -13.931 -4.053 1.00 0.00 C ATOM 2403 C LEU B 73 -15.946 -15.402 -3.988 1.00 0.00 C ATOM 2404 O LEU B 73 -17.118 -15.742 -3.822 1.00 0.00 O ATOM 2405 CB LEU B 73 -14.959 -13.620 -5.427 1.00 0.00 C ATOM 2406 CG LEU B 73 -14.647 -12.148 -5.690 1.00 0.00 C ATOM 2407 CD1 LEU B 73 -14.137 -11.969 -7.109 1.00 0.00 C ATOM 2408 CD2 LEU B 73 -15.878 -11.284 -5.447 1.00 0.00 C ATOM 0 H LEU B 73 -13.701 -13.307 -3.303 1.00 0.00 H new ATOM 0 HA LEU B 73 -16.456 -13.324 -3.913 1.00 0.00 H new ATOM 0 HB2 LEU B 73 -14.039 -14.194 -5.540 1.00 0.00 H new ATOM 0 HB3 LEU B 73 -15.649 -13.970 -6.194 1.00 0.00 H new ATOM 0 HG LEU B 73 -13.869 -11.828 -4.997 1.00 0.00 H new ATOM 0 HD11 LEU B 73 -13.917 -10.916 -7.287 1.00 0.00 H new ATOM 0 HD12 LEU B 73 -13.230 -12.557 -7.246 1.00 0.00 H new ATOM 0 HD13 LEU B 73 -14.897 -12.305 -7.814 1.00 0.00 H new ATOM 0 HD21 LEU B 73 -15.633 -10.240 -5.640 1.00 0.00 H new ATOM 0 HD22 LEU B 73 -16.680 -11.598 -6.114 1.00 0.00 H new ATOM 0 HD23 LEU B 73 -16.202 -11.395 -4.412 1.00 0.00 H new ATOM 2420 N GLU B 74 -14.949 -16.275 -4.086 1.00 0.00 N ATOM 2421 CA GLU B 74 -15.188 -17.713 -4.069 1.00 0.00 C ATOM 2422 C GLU B 74 -15.315 -18.228 -2.639 1.00 0.00 C ATOM 2423 O GLU B 74 -15.209 -19.431 -2.380 1.00 0.00 O ATOM 2424 CB GLU B 74 -14.081 -18.455 -4.820 1.00 0.00 C ATOM 2425 CG GLU B 74 -14.088 -18.179 -6.316 1.00 0.00 C ATOM 2426 CD GLU B 74 -13.050 -18.979 -7.076 1.00 0.00 C ATOM 2427 OE1 GLU B 74 -13.275 -20.186 -7.312 1.00 0.00 O ATOM 2428 OE2 GLU B 74 -12.010 -18.399 -7.453 1.00 0.00 O ATOM 0 H GLU B 74 -13.968 -16.012 -4.178 1.00 0.00 H new ATOM 0 HA GLU B 74 -16.132 -17.905 -4.579 1.00 0.00 H new ATOM 0 HB2 GLU B 74 -13.114 -18.167 -4.408 1.00 0.00 H new ATOM 0 HB3 GLU B 74 -14.192 -19.526 -4.653 1.00 0.00 H new ATOM 0 HG2 GLU B 74 -15.076 -18.406 -6.716 1.00 0.00 H new ATOM 0 HG3 GLU B 74 -13.912 -17.116 -6.484 1.00 0.00 H new ATOM 2435 N HIS B 75 -15.542 -17.305 -1.713 1.00 0.00 N ATOM 2436 CA HIS B 75 -15.862 -17.658 -0.338 1.00 0.00 C ATOM 2437 C HIS B 75 -17.379 -17.751 -0.201 1.00 0.00 C ATOM 2438 O HIS B 75 -17.904 -18.251 0.793 1.00 0.00 O ATOM 2439 CB HIS B 75 -15.292 -16.613 0.624 1.00 0.00 C ATOM 2440 CG HIS B 75 -15.194 -17.074 2.048 1.00 0.00 C ATOM 2441 ND1 HIS B 75 -14.090 -17.730 2.548 1.00 0.00 N ATOM 2442 CD2 HIS B 75 -16.061 -16.960 3.085 1.00 0.00 C ATOM 2443 CE1 HIS B 75 -14.277 -17.997 3.826 1.00 0.00 C ATOM 2444 NE2 HIS B 75 -15.463 -17.540 4.177 1.00 0.00 N ATOM 0 H HIS B 75 -15.510 -16.301 -1.892 1.00 0.00 H new ATOM 0 HA HIS B 75 -15.415 -18.620 -0.086 1.00 0.00 H new ATOM 0 HB2 HIS B 75 -14.300 -16.322 0.279 1.00 0.00 H new ATOM 0 HB3 HIS B 75 -15.917 -15.721 0.585 1.00 0.00 H new ATOM 0 HD2 HIS B 75 -17.038 -16.500 3.057 1.00 0.00 H new ATOM 0 HE1 HIS B 75 -13.578 -18.504 4.475 1.00 0.00 H new ATOM 0 HE2 HIS B 75 -15.871 -17.607 5.110 1.00 0.00 H new ATOM 2453 N HIS B 76 -18.065 -17.255 -1.223 1.00 0.00 N ATOM 2454 CA HIS B 76 -19.518 -17.327 -1.299 1.00 0.00 C ATOM 2455 C HIS B 76 -19.936 -18.630 -1.969 1.00 0.00 C ATOM 2456 O HIS B 76 -19.529 -18.902 -3.100 1.00 0.00 O ATOM 2457 CB HIS B 76 -20.062 -16.126 -2.088 1.00 0.00 C ATOM 2458 CG HIS B 76 -21.523 -16.219 -2.426 1.00 0.00 C ATOM 2459 ND1 HIS B 76 -21.981 -16.675 -3.644 1.00 0.00 N ATOM 2460 CD2 HIS B 76 -22.626 -15.907 -1.707 1.00 0.00 C ATOM 2461 CE1 HIS B 76 -23.298 -16.638 -3.660 1.00 0.00 C ATOM 2462 NE2 HIS B 76 -23.718 -16.178 -2.497 1.00 0.00 N ATOM 0 H HIS B 76 -17.630 -16.792 -2.021 1.00 0.00 H new ATOM 0 HA HIS B 76 -19.931 -17.300 -0.291 1.00 0.00 H new ATOM 0 HB2 HIS B 76 -19.892 -15.218 -1.509 1.00 0.00 H new ATOM 0 HB3 HIS B 76 -19.493 -16.025 -3.012 1.00 0.00 H new ATOM 0 HD2 HIS B 76 -22.645 -15.518 -0.700 1.00 0.00 H new ATOM 0 HE1 HIS B 76 -23.928 -16.934 -4.486 1.00 0.00 H new ATOM 0 HE2 HIS B 76 -24.693 -16.045 -2.228 1.00 0.00 H new ATOM 2471 N HIS B 77 -20.754 -19.413 -1.263 1.00 0.00 N ATOM 2472 CA HIS B 77 -21.223 -20.719 -1.738 1.00 0.00 C ATOM 2473 C HIS B 77 -20.077 -21.730 -1.763 1.00 0.00 C ATOM 2474 O HIS B 77 -18.986 -21.444 -2.252 1.00 0.00 O ATOM 2475 CB HIS B 77 -21.872 -20.600 -3.126 1.00 0.00 C ATOM 2476 CG HIS B 77 -22.511 -21.864 -3.616 1.00 0.00 C ATOM 2477 ND1 HIS B 77 -22.058 -22.564 -4.713 1.00 0.00 N ATOM 2478 CD2 HIS B 77 -23.593 -22.539 -3.168 1.00 0.00 C ATOM 2479 CE1 HIS B 77 -22.833 -23.609 -4.917 1.00 0.00 C ATOM 2480 NE2 HIS B 77 -23.772 -23.619 -3.992 1.00 0.00 N ATOM 0 H HIS B 77 -21.112 -19.159 -0.342 1.00 0.00 H new ATOM 0 HA HIS B 77 -21.980 -21.078 -1.041 1.00 0.00 H new ATOM 0 HB2 HIS B 77 -22.626 -19.813 -3.096 1.00 0.00 H new ATOM 0 HB3 HIS B 77 -21.113 -20.288 -3.844 1.00 0.00 H new ATOM 0 HD2 HIS B 77 -24.204 -22.276 -2.317 1.00 0.00 H new ATOM 0 HE1 HIS B 77 -22.719 -24.335 -5.708 1.00 0.00 H new ATOM 0 HE2 HIS B 77 -24.511 -24.317 -3.904 1.00 0.00 H new ATOM 2489 N HIS B 78 -20.322 -22.915 -1.229 1.00 0.00 N ATOM 2490 CA HIS B 78 -19.289 -23.936 -1.160 1.00 0.00 C ATOM 2491 C HIS B 78 -19.147 -24.670 -2.485 1.00 0.00 C ATOM 2492 O HIS B 78 -20.010 -25.456 -2.878 1.00 0.00 O ATOM 2493 CB HIS B 78 -19.569 -24.927 -0.028 1.00 0.00 C ATOM 2494 CG HIS B 78 -19.107 -24.443 1.313 1.00 0.00 C ATOM 2495 ND1 HIS B 78 -19.966 -24.049 2.315 1.00 0.00 N ATOM 2496 CD2 HIS B 78 -17.858 -24.303 1.817 1.00 0.00 C ATOM 2497 CE1 HIS B 78 -19.268 -23.686 3.374 1.00 0.00 C ATOM 2498 NE2 HIS B 78 -17.985 -23.829 3.097 1.00 0.00 N ATOM 0 H HIS B 78 -21.222 -23.193 -0.839 1.00 0.00 H new ATOM 0 HA HIS B 78 -18.346 -23.432 -0.949 1.00 0.00 H new ATOM 0 HB2 HIS B 78 -20.640 -25.126 0.015 1.00 0.00 H new ATOM 0 HB3 HIS B 78 -19.078 -25.874 -0.254 1.00 0.00 H new ATOM 0 HD2 HIS B 78 -16.933 -24.524 1.305 1.00 0.00 H new ATOM 0 HE1 HIS B 78 -19.677 -23.332 4.309 1.00 0.00 H new ATOM 0 HE2 HIS B 78 -17.214 -23.621 3.732 1.00 0.00 H new ATOM 2507 N HIS B 79 -18.062 -24.374 -3.180 1.00 0.00 N ATOM 2508 CA HIS B 79 -17.719 -25.062 -4.414 1.00 0.00 C ATOM 2509 C HIS B 79 -16.228 -25.376 -4.423 1.00 0.00 C ATOM 2510 O HIS B 79 -15.799 -26.414 -4.921 1.00 0.00 O ATOM 2511 CB HIS B 79 -18.090 -24.207 -5.632 1.00 0.00 C ATOM 2512 CG HIS B 79 -17.836 -24.884 -6.948 1.00 0.00 C ATOM 2513 ND1 HIS B 79 -16.866 -24.472 -7.837 1.00 0.00 N ATOM 2514 CD2 HIS B 79 -18.432 -25.958 -7.521 1.00 0.00 C ATOM 2515 CE1 HIS B 79 -16.879 -25.259 -8.896 1.00 0.00 C ATOM 2516 NE2 HIS B 79 -17.820 -26.170 -8.732 1.00 0.00 N ATOM 0 H HIS B 79 -17.395 -23.652 -2.906 1.00 0.00 H new ATOM 0 HA HIS B 79 -18.284 -25.993 -4.469 1.00 0.00 H new ATOM 0 HB2 HIS B 79 -19.145 -23.940 -5.569 1.00 0.00 H new ATOM 0 HB3 HIS B 79 -17.523 -23.277 -5.597 1.00 0.00 H new ATOM 0 HD2 HIS B 79 -19.240 -26.540 -7.102 1.00 0.00 H new ATOM 0 HE1 HIS B 79 -16.228 -25.172 -9.754 1.00 0.00 H new ATOM 0 HE2 HIS B 79 -18.054 -26.909 -9.395 1.00 0.00 H new ATOM 2525 N HIS B 80 -15.446 -24.471 -3.855 1.00 0.00 N ATOM 2526 CA HIS B 80 -14.006 -24.638 -3.787 1.00 0.00 C ATOM 2527 C HIS B 80 -13.585 -24.936 -2.353 1.00 0.00 C ATOM 2528 O HIS B 80 -13.328 -23.983 -1.594 1.00 0.00 O ATOM 2529 CB HIS B 80 -13.308 -23.374 -4.310 1.00 0.00 C ATOM 2530 CG HIS B 80 -11.810 -23.436 -4.259 1.00 0.00 C ATOM 2531 ND1 HIS B 80 -11.055 -22.600 -3.466 1.00 0.00 N ATOM 2532 CD2 HIS B 80 -10.927 -24.225 -4.918 1.00 0.00 C ATOM 2533 CE1 HIS B 80 -9.777 -22.872 -3.635 1.00 0.00 C ATOM 2534 NE2 HIS B 80 -9.672 -23.855 -4.509 1.00 0.00 N ATOM 2535 OXT HIS B 80 -13.534 -26.124 -1.980 1.00 0.00 O ATOM 0 H HIS B 80 -15.789 -23.608 -3.432 1.00 0.00 H new ATOM 0 HA HIS B 80 -13.710 -25.479 -4.414 1.00 0.00 H new ATOM 0 HB2 HIS B 80 -13.619 -23.200 -5.340 1.00 0.00 H new ATOM 0 HB3 HIS B 80 -13.646 -22.518 -3.726 1.00 0.00 H new ATOM 0 HD2 HIS B 80 -11.167 -25.000 -5.631 1.00 0.00 H new ATOM 0 HE1 HIS B 80 -8.955 -22.375 -3.142 1.00 0.00 H new ATOM 0 HE2 HIS B 80 -8.798 -24.272 -4.829 1.00 0.00 H new TER 2544 HIS B 80