USER MOD reduce.3.24.130724 H: found=0, std=0, add=1375, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1375 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 31 ASN : amide:sc= -0.333 K(o=-0.33,f=-4.9!) USER MOD Set 1.2: A 97 MET CE :methyl -143:sc= 0 (180deg=-0.465) USER MOD Set 2.1: A 52 GLN : amide:sc= 1.35 K(o=3.8,f=-7.5!) USER MOD Set 2.2: A 55 LYS NZ :NH3+ 145:sc= 2.44 (180deg=-0.16) USER MOD Set 3.1: A 50 TYR OH : rot 53:sc= 1.12 USER MOD Set 3.2: A 99 LYS NZ :NH3+ 179:sc= 0.758 (180deg=0.696) USER MOD Set 4.1: A 38 LYS NZ :NH3+ -124:sc= 0.0662 (180deg=0) USER MOD Set 4.2: A 43 THR OG1 : rot 180:sc= 0.0284 USER MOD Set 5.1: A 22 THR OG1 : rot 110:sc= 0.828 USER MOD Set 5.2: A 30 SER OG : rot -166:sc= 1.1 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 141:sc= 1.46 (180deg=0.0127) USER MOD Single : A 6 GLN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 9 GLN : amide:sc= 0.0442 K(o=0.044,f=-2.9!) USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 12 MET CE :methyl -121:sc= -0.603 (180deg=-2!) USER MOD Single : A 13 GLN : amide:sc= -0.0333 K(o=-0.033,f=-0.68) USER MOD Single : A 15 THR OG1 : rot 86:sc= -0.414 USER MOD Single : A 18 ASN : amide:sc= -0.442 K(o=-0.44,f=-1.6) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot -19:sc= 1.13 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 156:sc= 0.272 (180deg=0.112) USER MOD Single : A 46 THR OG1 : rot 175:sc= 1.29 USER MOD Single : A 47 SER OG : rot 101:sc= 0.0637 USER MOD Single : A 49 HIS : +bothHN:sc= -2.45 K(o=-2.5,f=-9.1!) USER MOD Single : A 54 GLN :FLIP amide:sc= -0.168 F(o=-2.9!,f=-0.17) USER MOD Single : A 60 LYS NZ :NH3+ -169:sc= -0.0139 (180deg=-0.152) USER MOD Single : A 61 TYR OH : rot -70:sc= 0.0914 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 150:sc= -0.111 USER MOD Single : A 72 MET CE :methyl -140:sc= -2.35! (180deg=-5.13!) USER MOD Single : A 77 MET CE :methyl -109:sc= -0.265 (180deg=-2.43!) USER MOD Single : A 82 SER OG : rot 94:sc= 1.08 USER MOD Single : A 83 LYS NZ :NH3+ -166:sc= 1.19 (180deg=1.06) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 SER OG : rot 20:sc= 0.802 USER MOD Single : A 93 LYS NZ :NH3+ -158:sc= 1.18 (180deg=0.973) USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 LYS NZ :NH3+ -158:sc= 1.77 (180deg=1.22) USER MOD Single : A 107 GLN : amide:sc= -0.489 K(o=-0.49,f=-1.2) USER MOD Single : A 108 HIS : +bothHN:sc= 1.94 K(o=1.9,f=-7.6!) USER MOD Single : A 118 THR OG1 : rot 180:sc=0.000643 USER MOD Single : A 122 LYS NZ :NH3+ 178:sc= -0.671 (180deg=-0.747) USER MOD Single : A 126 HIS : +bothHN:sc= 1.49 K(o=1.5,f=-9!) USER MOD Single : A 127 THR OG1 : rot -108:sc= 1.28 USER MOD Single : A 129 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 TYR OH : rot 167:sc= -0.38 USER MOD Single : A 138 HIS :FLIP no HD1:sc= -0.175 F(o=-0.82,f=-0.17) USER MOD Single : A 140 LYS NZ :NH3+ -171:sc=-0.00655 (180deg=-0.132) USER MOD Single : A 142 LYS NZ :NH3+ -151:sc= 1.23 (180deg=1.06) USER MOD Single : A 143 ASN : amide:sc= -0.492 K(o=-0.49,f=-4!) USER MOD Single : A 147 TYR OH : rot -104:sc= 1.2 USER MOD Single : A 150 MET CE :methyl 168:sc= -1.99 (180deg=-2.11) USER MOD Single : A 155 GLN : amide:sc= -0.0449 X(o=-0.045,f=-0.44) USER MOD Single : A 160 LYS NZ :NH3+ 176:sc= 0.11 (180deg=0.0393) USER MOD Single : A 163 HIS : no HE2:sc= 0.681 K(o=0.68,f=-5.3!) USER MOD Single : A 164 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 165 HIS : no HD1:sc= -0.343 X(o=-0.34,f=-0.094) USER MOD Single : A 166 HIS : no HD1:sc=-0.00562 X(o=-0.0056,f=-0.0073) USER MOD Single : A 167 HIS : no HD1:sc= -0.198 X(o=-0.2,f=-0.17) USER MOD Single : A 168 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 9.501 -0.887 19.312 1.00 0.00 N ATOM 2 CA MET A 1 8.552 -0.092 18.500 1.00 0.00 C ATOM 3 C MET A 1 7.788 -1.000 17.549 1.00 0.00 C ATOM 4 O MET A 1 8.306 -2.029 17.125 1.00 0.00 O ATOM 5 CB MET A 1 9.289 0.979 17.680 1.00 0.00 C ATOM 6 CG MET A 1 10.076 1.986 18.505 1.00 0.00 C ATOM 7 SD MET A 1 11.611 1.311 19.176 1.00 0.00 S ATOM 8 CE MET A 1 12.269 2.750 20.016 1.00 0.00 C ATOM 0 H1 MET A 1 10.388 -0.356 19.428 1.00 0.00 H new ATOM 0 H2 MET A 1 9.085 -1.075 20.247 1.00 0.00 H new ATOM 0 H3 MET A 1 9.697 -1.789 18.833 1.00 0.00 H new ATOM 0 HA MET A 1 7.859 0.398 19.184 1.00 0.00 H new ATOM 0 HB2 MET A 1 9.972 0.482 16.991 1.00 0.00 H new ATOM 0 HB3 MET A 1 8.560 1.517 17.074 1.00 0.00 H new ATOM 0 HG2 MET A 1 10.308 2.852 17.885 1.00 0.00 H new ATOM 0 HG3 MET A 1 9.453 2.340 19.326 1.00 0.00 H new ATOM 0 HE1 MET A 1 13.220 2.495 20.484 1.00 0.00 H new ATOM 0 HE2 MET A 1 12.423 3.553 19.295 1.00 0.00 H new ATOM 0 HE3 MET A 1 11.565 3.079 20.781 1.00 0.00 H new ATOM 20 N PRO A 2 6.532 -0.650 17.220 1.00 0.00 N ATOM 21 CA PRO A 2 5.768 -1.352 16.185 1.00 0.00 C ATOM 22 C PRO A 2 6.318 -1.041 14.799 1.00 0.00 C ATOM 23 O PRO A 2 6.226 -1.853 13.882 1.00 0.00 O ATOM 24 CB PRO A 2 4.341 -0.799 16.335 1.00 0.00 C ATOM 25 CG PRO A 2 4.335 -0.048 17.627 1.00 0.00 C ATOM 26 CD PRO A 2 5.744 0.421 17.840 1.00 0.00 C ATOM 0 HA PRO A 2 5.815 -2.435 16.295 1.00 0.00 H new ATOM 0 HB2 PRO A 2 4.084 -0.146 15.501 1.00 0.00 H new ATOM 0 HB3 PRO A 2 3.607 -1.605 16.347 1.00 0.00 H new ATOM 0 HG2 PRO A 2 3.645 0.795 17.585 1.00 0.00 H new ATOM 0 HG3 PRO A 2 4.008 -0.686 18.448 1.00 0.00 H new ATOM 0 HD2 PRO A 2 5.927 1.386 17.366 1.00 0.00 H new ATOM 0 HD3 PRO A 2 5.978 0.536 18.898 1.00 0.00 H new ATOM 34 N VAL A 3 6.903 0.145 14.678 1.00 0.00 N ATOM 35 CA VAL A 3 7.521 0.595 13.440 1.00 0.00 C ATOM 36 C VAL A 3 8.936 0.032 13.334 1.00 0.00 C ATOM 37 O VAL A 3 9.671 0.004 14.325 1.00 0.00 O ATOM 38 CB VAL A 3 7.586 2.138 13.391 1.00 0.00 C ATOM 39 CG1 VAL A 3 8.122 2.624 12.052 1.00 0.00 C ATOM 40 CG2 VAL A 3 6.216 2.741 13.673 1.00 0.00 C ATOM 0 H VAL A 3 6.961 0.822 15.439 1.00 0.00 H new ATOM 0 HA VAL A 3 6.916 0.239 12.606 1.00 0.00 H new ATOM 0 HB VAL A 3 8.276 2.470 14.167 1.00 0.00 H new ATOM 0 HG11 VAL A 3 8.156 3.713 12.048 1.00 0.00 H new ATOM 0 HG12 VAL A 3 9.126 2.229 11.897 1.00 0.00 H new ATOM 0 HG13 VAL A 3 7.468 2.278 11.251 1.00 0.00 H new ATOM 0 HG21 VAL A 3 6.282 3.828 13.634 1.00 0.00 H new ATOM 0 HG22 VAL A 3 5.504 2.394 12.924 1.00 0.00 H new ATOM 0 HG23 VAL A 3 5.880 2.433 14.663 1.00 0.00 H new ATOM 50 N ARG A 4 9.313 -0.424 12.153 1.00 0.00 N ATOM 51 CA ARG A 4 10.655 -0.940 11.939 1.00 0.00 C ATOM 52 C ARG A 4 11.294 -0.263 10.734 1.00 0.00 C ATOM 53 O ARG A 4 11.821 -0.925 9.836 1.00 0.00 O ATOM 54 CB ARG A 4 10.636 -2.457 11.745 1.00 0.00 C ATOM 55 CG ARG A 4 12.004 -3.108 11.904 1.00 0.00 C ATOM 56 CD ARG A 4 11.935 -4.608 11.684 1.00 0.00 C ATOM 57 NE ARG A 4 13.179 -5.278 12.060 1.00 0.00 N ATOM 58 CZ ARG A 4 13.225 -6.430 12.733 1.00 0.00 C ATOM 59 NH1 ARG A 4 12.104 -7.049 13.080 1.00 0.00 N ATOM 60 NH2 ARG A 4 14.393 -6.972 13.051 1.00 0.00 N ATOM 0 H ARG A 4 8.712 -0.448 11.329 1.00 0.00 H new ATOM 0 HA ARG A 4 11.249 -0.719 12.826 1.00 0.00 H new ATOM 0 HB2 ARG A 4 9.947 -2.899 12.465 1.00 0.00 H new ATOM 0 HB3 ARG A 4 10.248 -2.683 10.752 1.00 0.00 H new ATOM 0 HG2 ARG A 4 12.703 -2.667 11.193 1.00 0.00 H new ATOM 0 HG3 ARG A 4 12.392 -2.903 12.902 1.00 0.00 H new ATOM 0 HD2 ARG A 4 11.111 -5.022 12.266 1.00 0.00 H new ATOM 0 HD3 ARG A 4 11.718 -4.810 10.635 1.00 0.00 H new ATOM 0 HE ARG A 4 14.061 -4.841 11.793 1.00 0.00 H new ATOM 0 HH11 ARG A 4 11.201 -6.645 12.833 1.00 0.00 H new ATOM 0 HH12 ARG A 4 12.145 -7.929 13.594 1.00 0.00 H new ATOM 0 HH21 ARG A 4 15.261 -6.508 12.781 1.00 0.00 H new ATOM 0 HH22 ARG A 4 14.424 -7.852 13.565 1.00 0.00 H new ATOM 74 N ALA A 5 11.246 1.063 10.725 1.00 0.00 N ATOM 75 CA ALA A 5 11.910 1.850 9.693 1.00 0.00 C ATOM 76 C ALA A 5 13.419 1.864 9.934 1.00 0.00 C ATOM 77 O ALA A 5 14.035 2.918 10.109 1.00 0.00 O ATOM 78 CB ALA A 5 11.351 3.266 9.659 1.00 0.00 C ATOM 0 H ALA A 5 10.752 1.618 11.424 1.00 0.00 H new ATOM 0 HA ALA A 5 11.720 1.391 8.723 1.00 0.00 H new ATOM 0 HB1 ALA A 5 11.858 3.839 8.883 1.00 0.00 H new ATOM 0 HB2 ALA A 5 10.283 3.230 9.444 1.00 0.00 H new ATOM 0 HB3 ALA A 5 11.511 3.744 10.626 1.00 0.00 H new ATOM 84 N GLN A 6 13.998 0.674 9.953 1.00 0.00 N ATOM 85 CA GLN A 6 15.411 0.493 10.217 1.00 0.00 C ATOM 86 C GLN A 6 16.192 0.602 8.916 1.00 0.00 C ATOM 87 O GLN A 6 15.846 -0.042 7.925 1.00 0.00 O ATOM 88 CB GLN A 6 15.628 -0.876 10.867 1.00 0.00 C ATOM 89 CG GLN A 6 17.048 -1.138 11.343 1.00 0.00 C ATOM 90 CD GLN A 6 17.197 -2.517 11.959 1.00 0.00 C ATOM 91 OE1 GLN A 6 16.500 -3.460 11.576 1.00 0.00 O ATOM 92 NE2 GLN A 6 18.092 -2.646 12.924 1.00 0.00 N ATOM 0 H GLN A 6 13.495 -0.197 9.784 1.00 0.00 H new ATOM 0 HA GLN A 6 15.766 1.267 10.897 1.00 0.00 H new ATOM 0 HB2 GLN A 6 14.952 -0.970 11.717 1.00 0.00 H new ATOM 0 HB3 GLN A 6 15.351 -1.650 10.152 1.00 0.00 H new ATOM 0 HG2 GLN A 6 17.736 -1.040 10.503 1.00 0.00 H new ATOM 0 HG3 GLN A 6 17.330 -0.382 12.075 1.00 0.00 H new ATOM 0 HE21 GLN A 6 18.650 -1.842 13.213 1.00 0.00 H new ATOM 0 HE22 GLN A 6 18.225 -3.549 13.379 1.00 0.00 H new ATOM 101 N ARG A 7 17.226 1.432 8.914 1.00 0.00 N ATOM 102 CA ARG A 7 18.018 1.652 7.713 1.00 0.00 C ATOM 103 C ARG A 7 18.750 0.379 7.289 1.00 0.00 C ATOM 104 O ARG A 7 19.718 -0.048 7.922 1.00 0.00 O ATOM 105 CB ARG A 7 19.018 2.798 7.912 1.00 0.00 C ATOM 106 CG ARG A 7 19.989 2.585 9.062 1.00 0.00 C ATOM 107 CD ARG A 7 21.085 3.632 9.063 1.00 0.00 C ATOM 108 NE ARG A 7 22.073 3.387 10.108 1.00 0.00 N ATOM 109 CZ ARG A 7 23.146 4.149 10.309 1.00 0.00 C ATOM 110 NH1 ARG A 7 23.406 5.167 9.496 1.00 0.00 N ATOM 111 NH2 ARG A 7 23.969 3.880 11.311 1.00 0.00 N ATOM 0 H ARG A 7 17.535 1.963 9.729 1.00 0.00 H new ATOM 0 HA ARG A 7 17.328 1.931 6.916 1.00 0.00 H new ATOM 0 HB2 ARG A 7 19.586 2.933 6.992 1.00 0.00 H new ATOM 0 HB3 ARG A 7 18.465 3.722 8.084 1.00 0.00 H new ATOM 0 HG2 ARG A 7 19.448 2.621 10.008 1.00 0.00 H new ATOM 0 HG3 ARG A 7 20.433 1.592 8.986 1.00 0.00 H new ATOM 0 HD2 ARG A 7 21.579 3.641 8.092 1.00 0.00 H new ATOM 0 HD3 ARG A 7 20.644 4.619 9.205 1.00 0.00 H new ATOM 0 HE ARG A 7 21.933 2.584 10.721 1.00 0.00 H new ATOM 0 HH11 ARG A 7 22.782 5.367 8.714 1.00 0.00 H new ATOM 0 HH12 ARG A 7 24.229 5.748 9.654 1.00 0.00 H new ATOM 0 HH21 ARG A 7 23.780 3.090 11.928 1.00 0.00 H new ATOM 0 HH22 ARG A 7 24.791 4.463 11.466 1.00 0.00 H new ATOM 125 N ILE A 8 18.268 -0.239 6.229 1.00 0.00 N ATOM 126 CA ILE A 8 18.936 -1.392 5.664 1.00 0.00 C ATOM 127 C ILE A 8 19.990 -0.926 4.668 1.00 0.00 C ATOM 128 O ILE A 8 19.725 -0.789 3.478 1.00 0.00 O ATOM 129 CB ILE A 8 17.948 -2.359 4.975 1.00 0.00 C ATOM 130 CG1 ILE A 8 16.834 -2.756 5.948 1.00 0.00 C ATOM 131 CG2 ILE A 8 18.680 -3.598 4.470 1.00 0.00 C ATOM 132 CD1 ILE A 8 15.780 -3.655 5.338 1.00 0.00 C ATOM 0 H ILE A 8 17.416 0.039 5.742 1.00 0.00 H new ATOM 0 HA ILE A 8 19.407 -1.940 6.480 1.00 0.00 H new ATOM 0 HB ILE A 8 17.501 -1.851 4.120 1.00 0.00 H new ATOM 0 HG12 ILE A 8 17.277 -3.262 6.806 1.00 0.00 H new ATOM 0 HG13 ILE A 8 16.354 -1.852 6.324 1.00 0.00 H new ATOM 0 HG21 ILE A 8 17.969 -4.269 3.987 1.00 0.00 H new ATOM 0 HG22 ILE A 8 19.445 -3.301 3.752 1.00 0.00 H new ATOM 0 HG23 ILE A 8 19.150 -4.110 5.309 1.00 0.00 H new ATOM 0 HD11 ILE A 8 15.026 -3.892 6.088 1.00 0.00 H new ATOM 0 HD12 ILE A 8 15.308 -3.145 4.498 1.00 0.00 H new ATOM 0 HD13 ILE A 8 16.246 -4.576 4.988 1.00 0.00 H new ATOM 144 N GLN A 9 21.173 -0.634 5.175 1.00 0.00 N ATOM 145 CA GLN A 9 22.267 -0.167 4.337 1.00 0.00 C ATOM 146 C GLN A 9 23.210 -1.313 3.991 1.00 0.00 C ATOM 147 O GLN A 9 24.301 -1.104 3.464 1.00 0.00 O ATOM 148 CB GLN A 9 23.024 0.989 5.014 1.00 0.00 C ATOM 149 CG GLN A 9 23.064 0.928 6.539 1.00 0.00 C ATOM 150 CD GLN A 9 23.715 -0.331 7.076 1.00 0.00 C ATOM 151 OE1 GLN A 9 23.040 -1.330 7.332 1.00 0.00 O ATOM 152 NE2 GLN A 9 25.024 -0.293 7.246 1.00 0.00 N ATOM 0 H GLN A 9 21.404 -0.711 6.166 1.00 0.00 H new ATOM 0 HA GLN A 9 21.844 0.212 3.407 1.00 0.00 H new ATOM 0 HB2 GLN A 9 24.047 1.002 4.639 1.00 0.00 H new ATOM 0 HB3 GLN A 9 22.563 1.930 4.715 1.00 0.00 H new ATOM 0 HG2 GLN A 9 23.605 1.796 6.916 1.00 0.00 H new ATOM 0 HG3 GLN A 9 22.047 0.994 6.924 1.00 0.00 H new ATOM 0 HE21 GLN A 9 25.543 0.556 7.021 1.00 0.00 H new ATOM 0 HE22 GLN A 9 25.516 -1.112 7.602 1.00 0.00 H new ATOM 161 N HIS A 10 22.772 -2.526 4.286 1.00 0.00 N ATOM 162 CA HIS A 10 23.532 -3.716 3.950 1.00 0.00 C ATOM 163 C HIS A 10 22.603 -4.806 3.433 1.00 0.00 C ATOM 164 O HIS A 10 21.998 -5.543 4.209 1.00 0.00 O ATOM 165 CB HIS A 10 24.327 -4.224 5.161 1.00 0.00 C ATOM 166 CG HIS A 10 25.052 -5.516 4.911 1.00 0.00 C ATOM 167 ND1 HIS A 10 24.707 -6.704 5.518 1.00 0.00 N ATOM 168 CD2 HIS A 10 26.105 -5.803 4.108 1.00 0.00 C ATOM 169 CE1 HIS A 10 25.514 -7.660 5.104 1.00 0.00 C ATOM 170 NE2 HIS A 10 26.371 -7.143 4.246 1.00 0.00 N ATOM 0 H HIS A 10 21.888 -2.712 4.760 1.00 0.00 H new ATOM 0 HA HIS A 10 24.242 -3.454 3.165 1.00 0.00 H new ATOM 0 HB2 HIS A 10 25.050 -3.463 5.454 1.00 0.00 H new ATOM 0 HB3 HIS A 10 23.646 -4.357 6.001 1.00 0.00 H new ATOM 0 HD2 HIS A 10 26.637 -5.107 3.476 1.00 0.00 H new ATOM 0 HE1 HIS A 10 25.479 -8.694 5.415 1.00 0.00 H new ATOM 0 HE2 HIS A 10 27.110 -7.654 3.764 1.00 0.00 H new ATOM 179 N VAL A 11 22.464 -4.879 2.121 1.00 0.00 N ATOM 180 CA VAL A 11 21.716 -5.959 1.502 1.00 0.00 C ATOM 181 C VAL A 11 22.684 -7.013 0.985 1.00 0.00 C ATOM 182 O VAL A 11 23.898 -6.793 0.975 1.00 0.00 O ATOM 183 CB VAL A 11 20.823 -5.460 0.343 1.00 0.00 C ATOM 184 CG1 VAL A 11 19.814 -4.438 0.846 1.00 0.00 C ATOM 185 CG2 VAL A 11 21.663 -4.877 -0.784 1.00 0.00 C ATOM 0 H VAL A 11 22.858 -4.205 1.465 1.00 0.00 H new ATOM 0 HA VAL A 11 21.060 -6.386 2.260 1.00 0.00 H new ATOM 0 HB VAL A 11 20.277 -6.316 -0.054 1.00 0.00 H new ATOM 0 HG11 VAL A 11 19.195 -4.099 0.016 1.00 0.00 H new ATOM 0 HG12 VAL A 11 19.182 -4.895 1.607 1.00 0.00 H new ATOM 0 HG13 VAL A 11 20.342 -3.587 1.276 1.00 0.00 H new ATOM 0 HG21 VAL A 11 21.009 -4.534 -1.586 1.00 0.00 H new ATOM 0 HG22 VAL A 11 22.245 -4.037 -0.406 1.00 0.00 H new ATOM 0 HG23 VAL A 11 22.337 -5.642 -1.168 1.00 0.00 H new ATOM 195 N MET A 12 22.155 -8.152 0.566 1.00 0.00 N ATOM 196 CA MET A 12 22.987 -9.230 0.047 1.00 0.00 C ATOM 197 C MET A 12 23.513 -8.854 -1.332 1.00 0.00 C ATOM 198 O MET A 12 24.676 -8.485 -1.501 1.00 0.00 O ATOM 199 CB MET A 12 22.180 -10.527 -0.061 1.00 0.00 C ATOM 200 CG MET A 12 21.417 -10.898 1.200 1.00 0.00 C ATOM 201 SD MET A 12 20.313 -12.303 0.939 1.00 0.00 S ATOM 202 CE MET A 12 19.385 -12.300 2.473 1.00 0.00 C ATOM 0 H MET A 12 21.155 -8.355 0.574 1.00 0.00 H new ATOM 0 HA MET A 12 23.820 -9.385 0.733 1.00 0.00 H new ATOM 0 HB2 MET A 12 21.472 -10.433 -0.885 1.00 0.00 H new ATOM 0 HB3 MET A 12 22.858 -11.342 -0.314 1.00 0.00 H new ATOM 0 HG2 MET A 12 22.125 -11.136 1.994 1.00 0.00 H new ATOM 0 HG3 MET A 12 20.836 -10.039 1.537 1.00 0.00 H new ATOM 0 HE1 MET A 12 19.518 -13.256 2.980 1.00 0.00 H new ATOM 0 HE2 MET A 12 19.745 -11.496 3.114 1.00 0.00 H new ATOM 0 HE3 MET A 12 18.327 -12.147 2.258 1.00 0.00 H new ATOM 212 N GLN A 13 22.614 -8.923 -2.301 1.00 0.00 N ATOM 213 CA GLN A 13 22.915 -8.644 -3.698 1.00 0.00 C ATOM 214 C GLN A 13 21.619 -8.723 -4.480 1.00 0.00 C ATOM 215 O GLN A 13 21.208 -7.778 -5.151 1.00 0.00 O ATOM 216 CB GLN A 13 23.929 -9.657 -4.241 1.00 0.00 C ATOM 217 CG GLN A 13 24.249 -9.482 -5.716 1.00 0.00 C ATOM 218 CD GLN A 13 24.846 -8.128 -6.036 1.00 0.00 C ATOM 219 OE1 GLN A 13 25.522 -7.520 -5.208 1.00 0.00 O ATOM 220 NE2 GLN A 13 24.613 -7.659 -7.251 1.00 0.00 N ATOM 0 H GLN A 13 21.640 -9.178 -2.138 1.00 0.00 H new ATOM 0 HA GLN A 13 23.354 -7.651 -3.796 1.00 0.00 H new ATOM 0 HB2 GLN A 13 24.852 -9.575 -3.667 1.00 0.00 H new ATOM 0 HB3 GLN A 13 23.543 -10.664 -4.081 1.00 0.00 H new ATOM 0 HG2 GLN A 13 24.945 -10.262 -6.026 1.00 0.00 H new ATOM 0 HG3 GLN A 13 23.338 -9.618 -6.298 1.00 0.00 H new ATOM 0 HE21 GLN A 13 24.046 -8.198 -7.906 1.00 0.00 H new ATOM 0 HE22 GLN A 13 25.000 -6.759 -7.533 1.00 0.00 H new ATOM 229 N ASP A 14 20.986 -9.869 -4.362 1.00 0.00 N ATOM 230 CA ASP A 14 19.630 -10.061 -4.835 1.00 0.00 C ATOM 231 C ASP A 14 18.806 -10.585 -3.671 1.00 0.00 C ATOM 232 O ASP A 14 18.465 -11.764 -3.598 1.00 0.00 O ATOM 233 CB ASP A 14 19.592 -11.023 -6.023 1.00 0.00 C ATOM 234 CG ASP A 14 18.211 -11.143 -6.637 1.00 0.00 C ATOM 235 OD1 ASP A 14 17.425 -10.172 -6.560 1.00 0.00 O ATOM 236 OD2 ASP A 14 17.911 -12.200 -7.226 1.00 0.00 O ATOM 0 H ASP A 14 21.398 -10.698 -3.934 1.00 0.00 H new ATOM 0 HA ASP A 14 19.216 -9.117 -5.189 1.00 0.00 H new ATOM 0 HB2 ASP A 14 20.295 -10.682 -6.783 1.00 0.00 H new ATOM 0 HB3 ASP A 14 19.927 -12.008 -5.698 1.00 0.00 H new ATOM 241 N THR A 15 18.541 -9.687 -2.736 1.00 0.00 N ATOM 242 CA THR A 15 17.942 -10.038 -1.460 1.00 0.00 C ATOM 243 C THR A 15 16.445 -10.295 -1.621 1.00 0.00 C ATOM 244 O THR A 15 15.823 -9.784 -2.545 1.00 0.00 O ATOM 245 CB THR A 15 18.162 -8.886 -0.456 1.00 0.00 C ATOM 246 OG1 THR A 15 19.502 -8.379 -0.578 1.00 0.00 O ATOM 247 CG2 THR A 15 17.922 -9.336 0.976 1.00 0.00 C ATOM 0 H THR A 15 18.736 -8.691 -2.842 1.00 0.00 H new ATOM 0 HA THR A 15 18.414 -10.948 -1.090 1.00 0.00 H new ATOM 0 HB THR A 15 17.443 -8.101 -0.691 1.00 0.00 H new ATOM 0 HG1 THR A 15 19.532 -7.702 -1.286 1.00 0.00 H new ATOM 0 HG21 THR A 15 18.087 -8.498 1.653 1.00 0.00 H new ATOM 0 HG22 THR A 15 16.896 -9.690 1.079 1.00 0.00 H new ATOM 0 HG23 THR A 15 18.611 -10.143 1.224 1.00 0.00 H new ATOM 255 N ILE A 16 15.876 -11.094 -0.732 1.00 0.00 N ATOM 256 CA ILE A 16 14.446 -11.369 -0.765 1.00 0.00 C ATOM 257 C ILE A 16 13.780 -10.826 0.494 1.00 0.00 C ATOM 258 O ILE A 16 14.183 -11.154 1.610 1.00 0.00 O ATOM 259 CB ILE A 16 14.156 -12.884 -0.887 1.00 0.00 C ATOM 260 CG1 ILE A 16 14.902 -13.486 -2.083 1.00 0.00 C ATOM 261 CG2 ILE A 16 12.660 -13.130 -1.022 1.00 0.00 C ATOM 262 CD1 ILE A 16 14.487 -12.905 -3.419 1.00 0.00 C ATOM 0 H ILE A 16 16.380 -11.563 0.020 1.00 0.00 H new ATOM 0 HA ILE A 16 14.037 -10.873 -1.645 1.00 0.00 H new ATOM 0 HB ILE A 16 14.511 -13.372 0.021 1.00 0.00 H new ATOM 0 HG12 ILE A 16 15.972 -13.331 -1.947 1.00 0.00 H new ATOM 0 HG13 ILE A 16 14.735 -14.563 -2.098 1.00 0.00 H new ATOM 0 HG21 ILE A 16 12.474 -14.201 -1.107 1.00 0.00 H new ATOM 0 HG22 ILE A 16 12.146 -12.741 -0.143 1.00 0.00 H new ATOM 0 HG23 ILE A 16 12.287 -12.625 -1.913 1.00 0.00 H new ATOM 0 HD11 ILE A 16 15.058 -13.381 -4.216 1.00 0.00 H new ATOM 0 HD12 ILE A 16 13.424 -13.083 -3.579 1.00 0.00 H new ATOM 0 HD13 ILE A 16 14.680 -11.832 -3.425 1.00 0.00 H new ATOM 274 N ILE A 17 12.780 -9.979 0.309 1.00 0.00 N ATOM 275 CA ILE A 17 12.040 -9.411 1.426 1.00 0.00 C ATOM 276 C ILE A 17 10.658 -10.043 1.511 1.00 0.00 C ATOM 277 O ILE A 17 9.766 -9.702 0.732 1.00 0.00 O ATOM 278 CB ILE A 17 11.877 -7.878 1.291 1.00 0.00 C ATOM 279 CG1 ILE A 17 13.241 -7.191 1.170 1.00 0.00 C ATOM 280 CG2 ILE A 17 11.103 -7.313 2.477 1.00 0.00 C ATOM 281 CD1 ILE A 17 14.120 -7.348 2.392 1.00 0.00 C ATOM 0 H ILE A 17 12.461 -9.668 -0.608 1.00 0.00 H new ATOM 0 HA ILE A 17 12.611 -9.620 2.330 1.00 0.00 H new ATOM 0 HB ILE A 17 11.312 -7.679 0.380 1.00 0.00 H new ATOM 0 HG12 ILE A 17 13.765 -7.596 0.304 1.00 0.00 H new ATOM 0 HG13 ILE A 17 13.086 -6.129 0.981 1.00 0.00 H new ATOM 0 HG21 ILE A 17 10.999 -6.234 2.363 1.00 0.00 H new ATOM 0 HG22 ILE A 17 10.114 -7.770 2.517 1.00 0.00 H new ATOM 0 HG23 ILE A 17 11.641 -7.530 3.400 1.00 0.00 H new ATOM 0 HD11 ILE A 17 15.067 -6.834 2.227 1.00 0.00 H new ATOM 0 HD12 ILE A 17 13.619 -6.917 3.259 1.00 0.00 H new ATOM 0 HD13 ILE A 17 14.308 -8.407 2.571 1.00 0.00 H new ATOM 293 N ASN A 18 10.490 -10.977 2.433 1.00 0.00 N ATOM 294 CA ASN A 18 9.198 -11.612 2.638 1.00 0.00 C ATOM 295 C ASN A 18 8.504 -10.997 3.838 1.00 0.00 C ATOM 296 O ASN A 18 8.872 -11.261 4.986 1.00 0.00 O ATOM 297 CB ASN A 18 9.346 -13.123 2.848 1.00 0.00 C ATOM 298 CG ASN A 18 9.913 -13.837 1.637 1.00 0.00 C ATOM 299 OD1 ASN A 18 11.122 -14.029 1.526 1.00 0.00 O ATOM 300 ND2 ASN A 18 9.043 -14.230 0.720 1.00 0.00 N ATOM 0 H ASN A 18 11.230 -11.312 3.050 1.00 0.00 H new ATOM 0 HA ASN A 18 8.598 -11.449 1.743 1.00 0.00 H new ATOM 0 HB2 ASN A 18 9.994 -13.303 3.706 1.00 0.00 H new ATOM 0 HB3 ASN A 18 8.372 -13.548 3.090 1.00 0.00 H new ATOM 0 HD21 ASN A 18 9.368 -14.712 -0.118 1.00 0.00 H new ATOM 0 HD22 ASN A 18 8.048 -14.051 0.851 1.00 0.00 H new ATOM 307 N PHE A 19 7.516 -10.162 3.576 1.00 0.00 N ATOM 308 CA PHE A 19 6.784 -9.497 4.642 1.00 0.00 C ATOM 309 C PHE A 19 5.317 -9.901 4.612 1.00 0.00 C ATOM 310 O PHE A 19 4.725 -10.043 3.540 1.00 0.00 O ATOM 311 CB PHE A 19 6.927 -7.970 4.532 1.00 0.00 C ATOM 312 CG PHE A 19 6.439 -7.389 3.230 1.00 0.00 C ATOM 313 CD1 PHE A 19 7.266 -7.350 2.119 1.00 0.00 C ATOM 314 CD2 PHE A 19 5.155 -6.874 3.122 1.00 0.00 C ATOM 315 CE1 PHE A 19 6.825 -6.811 0.927 1.00 0.00 C ATOM 316 CE2 PHE A 19 4.707 -6.335 1.932 1.00 0.00 C ATOM 317 CZ PHE A 19 5.544 -6.303 0.832 1.00 0.00 C ATOM 0 H PHE A 19 7.201 -9.927 2.635 1.00 0.00 H new ATOM 0 HA PHE A 19 7.209 -9.810 5.596 1.00 0.00 H new ATOM 0 HB2 PHE A 19 6.377 -7.506 5.351 1.00 0.00 H new ATOM 0 HB3 PHE A 19 7.976 -7.706 4.663 1.00 0.00 H new ATOM 0 HD1 PHE A 19 8.268 -7.746 2.186 1.00 0.00 H new ATOM 0 HD2 PHE A 19 4.498 -6.895 3.979 1.00 0.00 H new ATOM 0 HE1 PHE A 19 7.481 -6.787 0.069 1.00 0.00 H new ATOM 0 HE2 PHE A 19 3.705 -5.939 1.861 1.00 0.00 H new ATOM 0 HZ PHE A 19 5.197 -5.882 -0.100 1.00 0.00 H new ATOM 327 N TYR A 20 4.751 -10.147 5.784 1.00 0.00 N ATOM 328 CA TYR A 20 3.339 -10.464 5.892 1.00 0.00 C ATOM 329 C TYR A 20 2.789 -9.997 7.233 1.00 0.00 C ATOM 330 O TYR A 20 3.524 -9.968 8.225 1.00 0.00 O ATOM 331 CB TYR A 20 3.111 -11.964 5.716 1.00 0.00 C ATOM 332 CG TYR A 20 1.680 -12.324 5.391 1.00 0.00 C ATOM 333 CD1 TYR A 20 1.016 -11.703 4.342 1.00 0.00 C ATOM 334 CD2 TYR A 20 0.997 -13.288 6.120 1.00 0.00 C ATOM 335 CE1 TYR A 20 -0.285 -12.032 4.025 1.00 0.00 C ATOM 336 CE2 TYR A 20 -0.306 -13.628 5.808 1.00 0.00 C ATOM 337 CZ TYR A 20 -0.942 -12.997 4.759 1.00 0.00 C ATOM 338 OH TYR A 20 -2.237 -13.340 4.436 1.00 0.00 O ATOM 0 H TYR A 20 5.250 -10.133 6.673 1.00 0.00 H new ATOM 0 HA TYR A 20 2.808 -9.939 5.098 1.00 0.00 H new ATOM 0 HB2 TYR A 20 3.759 -12.331 4.920 1.00 0.00 H new ATOM 0 HB3 TYR A 20 3.408 -12.478 6.630 1.00 0.00 H new ATOM 0 HD1 TYR A 20 1.528 -10.948 3.763 1.00 0.00 H new ATOM 0 HD2 TYR A 20 1.492 -13.780 6.944 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -0.787 -11.537 3.207 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -0.823 -14.383 6.382 1.00 0.00 H new ATOM 0 HH TYR A 20 -2.554 -14.036 5.049 1.00 0.00 H new ATOM 348 N SER A 21 1.502 -9.635 7.238 1.00 0.00 N ATOM 349 CA SER A 21 0.763 -9.188 8.429 1.00 0.00 C ATOM 350 C SER A 21 1.285 -7.850 8.957 1.00 0.00 C ATOM 351 O SER A 21 2.441 -7.486 8.746 1.00 0.00 O ATOM 352 CB SER A 21 0.774 -10.247 9.552 1.00 0.00 C ATOM 353 OG SER A 21 2.020 -10.294 10.227 1.00 0.00 O ATOM 0 H SER A 21 0.929 -9.644 6.394 1.00 0.00 H new ATOM 0 HA SER A 21 -0.270 -9.048 8.110 1.00 0.00 H new ATOM 0 HB2 SER A 21 -0.018 -10.025 10.268 1.00 0.00 H new ATOM 0 HB3 SER A 21 0.554 -11.227 9.128 1.00 0.00 H new ATOM 0 HG SER A 21 2.710 -9.876 9.670 1.00 0.00 H new ATOM 359 N THR A 22 0.418 -7.118 9.636 1.00 0.00 N ATOM 360 CA THR A 22 0.792 -5.845 10.221 1.00 0.00 C ATOM 361 C THR A 22 1.216 -6.047 11.675 1.00 0.00 C ATOM 362 O THR A 22 1.568 -5.102 12.380 1.00 0.00 O ATOM 363 CB THR A 22 -0.383 -4.849 10.151 1.00 0.00 C ATOM 364 OG1 THR A 22 -1.106 -5.036 8.923 1.00 0.00 O ATOM 365 CG2 THR A 22 0.117 -3.416 10.219 1.00 0.00 C ATOM 0 H THR A 22 -0.553 -7.386 9.795 1.00 0.00 H new ATOM 0 HA THR A 22 1.628 -5.435 9.655 1.00 0.00 H new ATOM 0 HB THR A 22 -1.038 -5.035 11.002 1.00 0.00 H new ATOM 0 HG1 THR A 22 -1.983 -5.428 9.116 1.00 0.00 H new ATOM 0 HG21 THR A 22 -0.730 -2.732 10.168 1.00 0.00 H new ATOM 0 HG22 THR A 22 0.652 -3.261 11.156 1.00 0.00 H new ATOM 0 HG23 THR A 22 0.789 -3.225 9.382 1.00 0.00 H new ATOM 373 N SER A 23 1.170 -7.300 12.114 1.00 0.00 N ATOM 374 CA SER A 23 1.557 -7.662 13.468 1.00 0.00 C ATOM 375 C SER A 23 3.075 -7.639 13.611 1.00 0.00 C ATOM 376 O SER A 23 3.611 -7.327 14.676 1.00 0.00 O ATOM 377 CB SER A 23 1.012 -9.049 13.794 1.00 0.00 C ATOM 378 OG SER A 23 -0.376 -9.121 13.508 1.00 0.00 O ATOM 0 H SER A 23 0.865 -8.088 11.543 1.00 0.00 H new ATOM 0 HA SER A 23 1.140 -6.938 14.168 1.00 0.00 H new ATOM 0 HB2 SER A 23 1.547 -9.801 13.215 1.00 0.00 H new ATOM 0 HB3 SER A 23 1.184 -9.275 14.846 1.00 0.00 H new ATOM 0 HG SER A 23 -0.708 -10.018 13.722 1.00 0.00 H new ATOM 384 N ASP A 24 3.762 -7.967 12.527 1.00 0.00 N ATOM 385 CA ASP A 24 5.215 -7.940 12.513 1.00 0.00 C ATOM 386 C ASP A 24 5.717 -6.525 12.301 1.00 0.00 C ATOM 387 O ASP A 24 4.985 -5.663 11.822 1.00 0.00 O ATOM 388 CB ASP A 24 5.778 -8.862 11.432 1.00 0.00 C ATOM 389 CG ASP A 24 6.248 -10.186 11.997 1.00 0.00 C ATOM 390 OD1 ASP A 24 7.369 -10.233 12.545 1.00 0.00 O ATOM 391 OD2 ASP A 24 5.501 -11.181 11.897 1.00 0.00 O ATOM 0 H ASP A 24 3.336 -8.255 11.646 1.00 0.00 H new ATOM 0 HA ASP A 24 5.562 -8.300 13.481 1.00 0.00 H new ATOM 0 HB2 ASP A 24 5.013 -9.042 10.676 1.00 0.00 H new ATOM 0 HB3 ASP A 24 6.610 -8.367 10.932 1.00 0.00 H new ATOM 396 N ASP A 25 6.972 -6.300 12.650 1.00 0.00 N ATOM 397 CA ASP A 25 7.575 -4.976 12.570 1.00 0.00 C ATOM 398 C ASP A 25 7.728 -4.542 11.116 1.00 0.00 C ATOM 399 O ASP A 25 7.777 -3.358 10.809 1.00 0.00 O ATOM 400 CB ASP A 25 8.938 -4.983 13.262 1.00 0.00 C ATOM 401 CG ASP A 25 8.872 -5.507 14.682 1.00 0.00 C ATOM 402 OD1 ASP A 25 8.655 -6.728 14.853 1.00 0.00 O ATOM 403 OD2 ASP A 25 9.054 -4.715 15.626 1.00 0.00 O ATOM 0 H ASP A 25 7.601 -7.025 12.996 1.00 0.00 H new ATOM 0 HA ASP A 25 6.921 -4.265 13.074 1.00 0.00 H new ATOM 0 HB2 ASP A 25 9.630 -5.596 12.685 1.00 0.00 H new ATOM 0 HB3 ASP A 25 9.341 -3.970 13.271 1.00 0.00 H new ATOM 408 N TYR A 26 7.801 -5.520 10.220 1.00 0.00 N ATOM 409 CA TYR A 26 7.846 -5.244 8.786 1.00 0.00 C ATOM 410 C TYR A 26 6.464 -4.866 8.264 1.00 0.00 C ATOM 411 O TYR A 26 6.292 -4.573 7.079 1.00 0.00 O ATOM 412 CB TYR A 26 8.392 -6.447 8.012 1.00 0.00 C ATOM 413 CG TYR A 26 9.902 -6.462 7.898 1.00 0.00 C ATOM 414 CD1 TYR A 26 10.543 -5.752 6.890 1.00 0.00 C ATOM 415 CD2 TYR A 26 10.685 -7.178 8.794 1.00 0.00 C ATOM 416 CE1 TYR A 26 11.920 -5.757 6.775 1.00 0.00 C ATOM 417 CE2 TYR A 26 12.064 -7.186 8.688 1.00 0.00 C ATOM 418 CZ TYR A 26 12.677 -6.474 7.676 1.00 0.00 C ATOM 419 OH TYR A 26 14.051 -6.478 7.565 1.00 0.00 O ATOM 0 H TYR A 26 7.830 -6.511 10.460 1.00 0.00 H new ATOM 0 HA TYR A 26 8.519 -4.401 8.631 1.00 0.00 H new ATOM 0 HB2 TYR A 26 8.064 -7.363 8.503 1.00 0.00 H new ATOM 0 HB3 TYR A 26 7.961 -6.450 7.011 1.00 0.00 H new ATOM 0 HD1 TYR A 26 9.954 -5.186 6.184 1.00 0.00 H new ATOM 0 HD2 TYR A 26 10.210 -7.737 9.586 1.00 0.00 H new ATOM 0 HE1 TYR A 26 12.401 -5.202 5.983 1.00 0.00 H new ATOM 0 HE2 TYR A 26 12.659 -7.747 9.394 1.00 0.00 H new ATOM 0 HH TYR A 26 14.435 -7.030 8.278 1.00 0.00 H new ATOM 429 N GLY A 27 5.482 -4.879 9.162 1.00 0.00 N ATOM 430 CA GLY A 27 4.117 -4.554 8.803 1.00 0.00 C ATOM 431 C GLY A 27 3.939 -3.107 8.379 1.00 0.00 C ATOM 432 O GLY A 27 2.844 -2.707 7.989 1.00 0.00 O ATOM 0 H GLY A 27 5.614 -5.113 10.146 1.00 0.00 H new ATOM 0 HA2 GLY A 27 3.797 -5.206 7.990 1.00 0.00 H new ATOM 0 HA3 GLY A 27 3.466 -4.760 9.652 1.00 0.00 H new ATOM 436 N ASP A 28 5.005 -2.320 8.451 1.00 0.00 N ATOM 437 CA ASP A 28 4.975 -0.950 7.949 1.00 0.00 C ATOM 438 C ASP A 28 4.693 -0.935 6.456 1.00 0.00 C ATOM 439 O ASP A 28 4.083 0.003 5.941 1.00 0.00 O ATOM 440 CB ASP A 28 6.291 -0.225 8.229 1.00 0.00 C ATOM 441 CG ASP A 28 6.471 0.106 9.694 1.00 0.00 C ATOM 442 OD1 ASP A 28 5.499 0.584 10.316 1.00 0.00 O ATOM 443 OD2 ASP A 28 7.587 -0.096 10.213 1.00 0.00 O ATOM 0 H ASP A 28 5.899 -2.605 8.851 1.00 0.00 H new ATOM 0 HA ASP A 28 4.175 -0.427 8.473 1.00 0.00 H new ATOM 0 HB2 ASP A 28 7.122 -0.846 7.896 1.00 0.00 H new ATOM 0 HB3 ASP A 28 6.326 0.695 7.645 1.00 0.00 H new ATOM 448 N PHE A 29 5.126 -1.987 5.766 1.00 0.00 N ATOM 449 CA PHE A 29 4.879 -2.128 4.334 1.00 0.00 C ATOM 450 C PHE A 29 3.415 -2.470 4.066 1.00 0.00 C ATOM 451 O PHE A 29 2.891 -2.193 2.988 1.00 0.00 O ATOM 452 CB PHE A 29 5.773 -3.217 3.734 1.00 0.00 C ATOM 453 CG PHE A 29 7.216 -2.821 3.584 1.00 0.00 C ATOM 454 CD1 PHE A 29 8.109 -2.977 4.631 1.00 0.00 C ATOM 455 CD2 PHE A 29 7.677 -2.300 2.386 1.00 0.00 C ATOM 456 CE1 PHE A 29 9.437 -2.621 4.485 1.00 0.00 C ATOM 457 CE2 PHE A 29 9.002 -1.941 2.235 1.00 0.00 C ATOM 458 CZ PHE A 29 9.884 -2.101 3.285 1.00 0.00 C ATOM 0 H PHE A 29 5.652 -2.758 6.178 1.00 0.00 H new ATOM 0 HA PHE A 29 5.113 -1.173 3.863 1.00 0.00 H new ATOM 0 HB2 PHE A 29 5.716 -4.105 4.363 1.00 0.00 H new ATOM 0 HB3 PHE A 29 5.381 -3.494 2.755 1.00 0.00 H new ATOM 0 HD1 PHE A 29 7.764 -3.381 5.571 1.00 0.00 H new ATOM 0 HD2 PHE A 29 6.992 -2.173 1.561 1.00 0.00 H new ATOM 0 HE1 PHE A 29 10.124 -2.749 5.308 1.00 0.00 H new ATOM 0 HE2 PHE A 29 9.348 -1.535 1.296 1.00 0.00 H new ATOM 0 HZ PHE A 29 10.920 -1.821 3.169 1.00 0.00 H new ATOM 468 N SER A 30 2.764 -3.050 5.067 1.00 0.00 N ATOM 469 CA SER A 30 1.385 -3.502 4.942 1.00 0.00 C ATOM 470 C SER A 30 0.451 -2.352 4.574 1.00 0.00 C ATOM 471 O SER A 30 0.563 -1.235 5.098 1.00 0.00 O ATOM 472 CB SER A 30 0.930 -4.157 6.251 1.00 0.00 C ATOM 473 OG SER A 30 -0.445 -4.496 6.220 1.00 0.00 O ATOM 0 H SER A 30 3.176 -3.220 5.985 1.00 0.00 H new ATOM 0 HA SER A 30 1.341 -4.235 4.137 1.00 0.00 H new ATOM 0 HB2 SER A 30 1.521 -5.054 6.433 1.00 0.00 H new ATOM 0 HB3 SER A 30 1.118 -3.477 7.082 1.00 0.00 H new ATOM 0 HG SER A 30 -0.752 -4.700 7.128 1.00 0.00 H new ATOM 479 N ASN A 31 -0.468 -2.634 3.665 1.00 0.00 N ATOM 480 CA ASN A 31 -1.468 -1.663 3.247 1.00 0.00 C ATOM 481 C ASN A 31 -2.514 -1.461 4.340 1.00 0.00 C ATOM 482 O ASN A 31 -3.233 -0.463 4.351 1.00 0.00 O ATOM 483 CB ASN A 31 -2.129 -2.108 1.931 1.00 0.00 C ATOM 484 CG ASN A 31 -2.605 -3.555 1.949 1.00 0.00 C ATOM 485 OD1 ASN A 31 -3.009 -4.085 2.982 1.00 0.00 O ATOM 486 ND2 ASN A 31 -2.549 -4.206 0.798 1.00 0.00 N ATOM 0 H ASN A 31 -0.543 -3.538 3.198 1.00 0.00 H new ATOM 0 HA ASN A 31 -0.972 -0.708 3.075 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -2.978 -1.457 1.722 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -1.419 -1.978 1.115 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -2.847 -5.180 0.748 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -2.208 -3.733 -0.039 1.00 0.00 H new ATOM 493 N PHE A 32 -2.558 -2.404 5.276 1.00 0.00 N ATOM 494 CA PHE A 32 -3.507 -2.360 6.382 1.00 0.00 C ATOM 495 C PHE A 32 -2.899 -1.619 7.577 1.00 0.00 C ATOM 496 O PHE A 32 -3.571 -1.370 8.578 1.00 0.00 O ATOM 497 CB PHE A 32 -3.898 -3.793 6.774 1.00 0.00 C ATOM 498 CG PHE A 32 -5.010 -3.885 7.782 1.00 0.00 C ATOM 499 CD1 PHE A 32 -6.321 -3.629 7.411 1.00 0.00 C ATOM 500 CD2 PHE A 32 -4.747 -4.238 9.096 1.00 0.00 C ATOM 501 CE1 PHE A 32 -7.348 -3.722 8.330 1.00 0.00 C ATOM 502 CE2 PHE A 32 -5.769 -4.331 10.022 1.00 0.00 C ATOM 503 CZ PHE A 32 -7.071 -4.073 9.638 1.00 0.00 C ATOM 0 H PHE A 32 -1.940 -3.216 5.289 1.00 0.00 H new ATOM 0 HA PHE A 32 -4.401 -1.820 6.070 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -4.195 -4.333 5.875 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -3.019 -4.299 7.175 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -6.542 -3.353 6.390 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -3.731 -4.443 9.400 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -8.365 -3.521 8.027 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -5.550 -4.605 11.044 1.00 0.00 H new ATOM 0 HZ PHE A 32 -7.872 -4.146 10.359 1.00 0.00 H new ATOM 513 N ALA A 33 -1.620 -1.260 7.458 1.00 0.00 N ATOM 514 CA ALA A 33 -0.917 -0.557 8.527 1.00 0.00 C ATOM 515 C ALA A 33 -1.535 0.813 8.772 1.00 0.00 C ATOM 516 O ALA A 33 -1.994 1.464 7.841 1.00 0.00 O ATOM 517 CB ALA A 33 0.558 -0.421 8.190 1.00 0.00 C ATOM 0 H ALA A 33 -1.052 -1.445 6.632 1.00 0.00 H new ATOM 0 HA ALA A 33 -1.013 -1.142 9.441 1.00 0.00 H new ATOM 0 HB1 ALA A 33 1.068 0.105 8.997 1.00 0.00 H new ATOM 0 HB2 ALA A 33 0.996 -1.412 8.069 1.00 0.00 H new ATOM 0 HB3 ALA A 33 0.669 0.141 7.263 1.00 0.00 H new ATOM 523 N ALA A 34 -1.513 1.256 10.020 1.00 0.00 N ATOM 524 CA ALA A 34 -2.172 2.496 10.416 1.00 0.00 C ATOM 525 C ALA A 34 -1.326 3.720 10.073 1.00 0.00 C ATOM 526 O ALA A 34 -0.943 4.497 10.947 1.00 0.00 O ATOM 527 CB ALA A 34 -2.495 2.469 11.903 1.00 0.00 C ATOM 0 H ALA A 34 -1.042 0.771 10.784 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.102 2.573 9.852 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -2.986 3.400 12.186 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -3.157 1.630 12.116 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -1.573 2.358 12.474 1.00 0.00 H new ATOM 533 N TRP A 35 -1.028 3.870 8.796 1.00 0.00 N ATOM 534 CA TRP A 35 -0.326 5.044 8.303 1.00 0.00 C ATOM 535 C TRP A 35 -1.271 5.905 7.468 1.00 0.00 C ATOM 536 O TRP A 35 -1.665 5.513 6.370 1.00 0.00 O ATOM 537 CB TRP A 35 0.893 4.641 7.464 1.00 0.00 C ATOM 538 CG TRP A 35 1.942 3.891 8.235 1.00 0.00 C ATOM 539 CD1 TRP A 35 2.143 2.541 8.244 1.00 0.00 C ATOM 540 CD2 TRP A 35 2.932 4.449 9.110 1.00 0.00 C ATOM 541 NE1 TRP A 35 3.198 2.226 9.065 1.00 0.00 N ATOM 542 CE2 TRP A 35 3.697 3.378 9.607 1.00 0.00 C ATOM 543 CE3 TRP A 35 3.250 5.747 9.519 1.00 0.00 C ATOM 544 CZ2 TRP A 35 4.754 3.565 10.492 1.00 0.00 C ATOM 545 CZ3 TRP A 35 4.302 5.931 10.399 1.00 0.00 C ATOM 546 CH2 TRP A 35 5.042 4.842 10.876 1.00 0.00 C ATOM 0 H TRP A 35 -1.263 3.188 8.075 1.00 0.00 H new ATOM 0 HA TRP A 35 0.023 5.619 9.161 1.00 0.00 H new ATOM 0 HB2 TRP A 35 0.559 4.025 6.629 1.00 0.00 H new ATOM 0 HB3 TRP A 35 1.341 5.539 7.038 1.00 0.00 H new ATOM 0 HD1 TRP A 35 1.558 1.825 7.687 1.00 0.00 H new ATOM 0 HE1 TRP A 35 3.552 1.286 9.242 1.00 0.00 H new ATOM 0 HE3 TRP A 35 2.684 6.592 9.155 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 5.327 2.728 10.862 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 4.556 6.929 10.723 1.00 0.00 H new ATOM 0 HH2 TRP A 35 5.858 5.017 11.562 1.00 0.00 H new ATOM 557 N PRO A 36 -1.656 7.083 7.987 1.00 0.00 N ATOM 558 CA PRO A 36 -2.569 7.997 7.289 1.00 0.00 C ATOM 559 C PRO A 36 -1.976 8.517 5.982 1.00 0.00 C ATOM 560 O PRO A 36 -0.786 8.842 5.913 1.00 0.00 O ATOM 561 CB PRO A 36 -2.771 9.146 8.282 1.00 0.00 C ATOM 562 CG PRO A 36 -1.604 9.072 9.208 1.00 0.00 C ATOM 563 CD PRO A 36 -1.233 7.618 9.293 1.00 0.00 C ATOM 0 HA PRO A 36 -3.498 7.502 7.006 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -2.807 10.107 7.770 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -3.711 9.038 8.823 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -0.770 9.666 8.833 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -1.860 9.467 10.191 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -0.163 7.485 9.455 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -1.745 7.120 10.117 1.00 0.00 H new ATOM 571 N ILE A 37 -2.807 8.593 4.949 1.00 0.00 N ATOM 572 CA ILE A 37 -2.354 9.014 3.632 1.00 0.00 C ATOM 573 C ILE A 37 -3.174 10.193 3.115 1.00 0.00 C ATOM 574 O ILE A 37 -4.394 10.236 3.275 1.00 0.00 O ATOM 575 CB ILE A 37 -2.418 7.854 2.610 1.00 0.00 C ATOM 576 CG1 ILE A 37 -3.831 7.259 2.548 1.00 0.00 C ATOM 577 CG2 ILE A 37 -1.400 6.781 2.967 1.00 0.00 C ATOM 578 CD1 ILE A 37 -3.979 6.140 1.536 1.00 0.00 C ATOM 0 H ILE A 37 -3.800 8.368 5.000 1.00 0.00 H new ATOM 0 HA ILE A 37 -1.315 9.325 3.742 1.00 0.00 H new ATOM 0 HB ILE A 37 -2.175 8.250 1.624 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -4.100 6.882 3.535 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -4.539 8.052 2.306 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.455 5.971 2.240 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -0.399 7.211 2.955 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.616 6.391 3.962 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -5.004 5.770 1.550 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -3.742 6.516 0.541 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -3.297 5.328 1.789 1.00 0.00 H new ATOM 590 N LYS A 38 -2.493 11.154 2.508 1.00 0.00 N ATOM 591 CA LYS A 38 -3.153 12.317 1.933 1.00 0.00 C ATOM 592 C LYS A 38 -3.347 12.103 0.436 1.00 0.00 C ATOM 593 O LYS A 38 -2.387 12.157 -0.334 1.00 0.00 O ATOM 594 CB LYS A 38 -2.312 13.573 2.177 1.00 0.00 C ATOM 595 CG LYS A 38 -3.004 14.870 1.792 1.00 0.00 C ATOM 596 CD LYS A 38 -4.102 15.231 2.777 1.00 0.00 C ATOM 597 CE LYS A 38 -4.727 16.572 2.439 1.00 0.00 C ATOM 598 NZ LYS A 38 -5.653 17.045 3.501 1.00 0.00 N ATOM 0 H LYS A 38 -1.479 11.151 2.401 1.00 0.00 H new ATOM 0 HA LYS A 38 -4.125 12.449 2.408 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -2.043 13.617 3.232 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -1.382 13.489 1.614 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -2.271 15.676 1.751 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -3.428 14.774 0.792 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -4.870 14.457 2.769 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -3.692 15.263 3.786 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -3.939 17.311 2.291 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -5.269 16.491 1.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -6.590 17.227 3.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -5.735 16.317 4.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -5.282 17.922 3.919 1.00 0.00 H new ATOM 612 N VAL A 39 -4.582 11.847 0.025 1.00 0.00 N ATOM 613 CA VAL A 39 -4.863 11.514 -1.365 1.00 0.00 C ATOM 614 C VAL A 39 -5.935 12.415 -1.945 1.00 0.00 C ATOM 615 O VAL A 39 -7.018 12.548 -1.370 1.00 0.00 O ATOM 616 CB VAL A 39 -5.335 10.059 -1.519 1.00 0.00 C ATOM 617 CG1 VAL A 39 -5.380 9.663 -2.980 1.00 0.00 C ATOM 618 CG2 VAL A 39 -4.448 9.117 -0.739 1.00 0.00 C ATOM 0 H VAL A 39 -5.402 11.863 0.631 1.00 0.00 H new ATOM 0 HA VAL A 39 -3.926 11.655 -1.903 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.344 9.987 -1.113 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -5.716 8.630 -3.067 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -6.071 10.316 -3.513 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -4.384 9.758 -3.414 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -4.804 8.094 -0.865 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -3.425 9.193 -1.106 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -4.475 9.383 0.318 1.00 0.00 H new ATOM 628 N ASP A 40 -5.613 13.032 -3.081 1.00 0.00 N ATOM 629 CA ASP A 40 -6.566 13.827 -3.858 1.00 0.00 C ATOM 630 C ASP A 40 -7.224 14.919 -3.018 1.00 0.00 C ATOM 631 O ASP A 40 -8.312 15.397 -3.338 1.00 0.00 O ATOM 632 CB ASP A 40 -7.625 12.917 -4.495 1.00 0.00 C ATOM 633 CG ASP A 40 -7.017 11.940 -5.490 1.00 0.00 C ATOM 634 OD1 ASP A 40 -6.307 12.392 -6.418 1.00 0.00 O ATOM 635 OD2 ASP A 40 -7.214 10.712 -5.336 1.00 0.00 O ATOM 0 H ASP A 40 -4.680 12.995 -3.491 1.00 0.00 H new ATOM 0 HA ASP A 40 -6.007 14.327 -4.649 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -8.143 12.362 -3.713 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -8.372 13.529 -5.000 1.00 0.00 H new ATOM 640 N GLY A 41 -6.549 15.318 -1.948 1.00 0.00 N ATOM 641 CA GLY A 41 -7.031 16.413 -1.139 1.00 0.00 C ATOM 642 C GLY A 41 -7.529 15.980 0.226 1.00 0.00 C ATOM 643 O GLY A 41 -7.684 16.816 1.115 1.00 0.00 O ATOM 0 H GLY A 41 -5.675 14.900 -1.628 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -6.230 17.141 -1.011 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -7.839 16.918 -1.669 1.00 0.00 H new ATOM 647 N LYS A 42 -7.755 14.685 0.424 1.00 0.00 N ATOM 648 CA LYS A 42 -8.331 14.226 1.682 1.00 0.00 C ATOM 649 C LYS A 42 -7.418 13.232 2.377 1.00 0.00 C ATOM 650 O LYS A 42 -6.608 12.558 1.739 1.00 0.00 O ATOM 651 CB LYS A 42 -9.733 13.637 1.470 1.00 0.00 C ATOM 652 CG LYS A 42 -10.794 14.713 1.270 1.00 0.00 C ATOM 653 CD LYS A 42 -12.201 14.140 1.182 1.00 0.00 C ATOM 654 CE LYS A 42 -13.242 15.253 1.240 1.00 0.00 C ATOM 655 NZ LYS A 42 -14.634 14.746 1.092 1.00 0.00 N ATOM 0 H LYS A 42 -7.553 13.950 -0.254 1.00 0.00 H new ATOM 0 HA LYS A 42 -8.431 15.094 2.334 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -9.719 12.979 0.601 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -10.000 13.024 2.331 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -10.746 15.423 2.096 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -10.575 15.269 0.358 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -12.313 13.579 0.254 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -12.365 13.439 2.000 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -13.151 15.781 2.189 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -13.038 15.977 0.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -15.297 15.419 1.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -14.860 14.641 0.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -14.719 13.823 1.563 1.00 0.00 H new ATOM 669 N THR A 43 -7.542 13.168 3.691 1.00 0.00 N ATOM 670 CA THR A 43 -6.687 12.324 4.496 1.00 0.00 C ATOM 671 C THR A 43 -7.404 11.028 4.843 1.00 0.00 C ATOM 672 O THR A 43 -8.351 11.016 5.634 1.00 0.00 O ATOM 673 CB THR A 43 -6.263 13.043 5.788 1.00 0.00 C ATOM 674 OG1 THR A 43 -5.811 14.369 5.476 1.00 0.00 O ATOM 675 CG2 THR A 43 -5.155 12.281 6.500 1.00 0.00 C ATOM 0 H THR A 43 -8.233 13.696 4.223 1.00 0.00 H new ATOM 0 HA THR A 43 -5.793 12.098 3.915 1.00 0.00 H new ATOM 0 HB THR A 43 -7.127 13.093 6.451 1.00 0.00 H new ATOM 0 HG1 THR A 43 -5.543 14.826 6.301 1.00 0.00 H new ATOM 0 HG21 THR A 43 -4.875 12.812 7.410 1.00 0.00 H new ATOM 0 HG22 THR A 43 -5.507 11.282 6.757 1.00 0.00 H new ATOM 0 HG23 THR A 43 -4.288 12.203 5.844 1.00 0.00 H new ATOM 683 N TRP A 44 -6.958 9.947 4.232 1.00 0.00 N ATOM 684 CA TRP A 44 -7.562 8.648 4.443 1.00 0.00 C ATOM 685 C TRP A 44 -6.752 7.869 5.467 1.00 0.00 C ATOM 686 O TRP A 44 -5.521 7.861 5.415 1.00 0.00 O ATOM 687 CB TRP A 44 -7.623 7.865 3.128 1.00 0.00 C ATOM 688 CG TRP A 44 -8.224 8.635 1.992 1.00 0.00 C ATOM 689 CD1 TRP A 44 -7.549 9.362 1.054 1.00 0.00 C ATOM 690 CD2 TRP A 44 -9.615 8.756 1.671 1.00 0.00 C ATOM 691 NE1 TRP A 44 -8.433 9.926 0.167 1.00 0.00 N ATOM 692 CE2 TRP A 44 -9.708 9.567 0.523 1.00 0.00 C ATOM 693 CE3 TRP A 44 -10.789 8.258 2.241 1.00 0.00 C ATOM 694 CZ2 TRP A 44 -10.929 9.887 -0.066 1.00 0.00 C ATOM 695 CZ3 TRP A 44 -11.999 8.577 1.656 1.00 0.00 C ATOM 696 CH2 TRP A 44 -12.060 9.383 0.512 1.00 0.00 C ATOM 0 H TRP A 44 -6.173 9.945 3.581 1.00 0.00 H new ATOM 0 HA TRP A 44 -8.578 8.789 4.812 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -6.614 7.557 2.852 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -8.202 6.955 3.284 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -6.476 9.477 1.015 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -8.182 10.515 -0.627 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -10.751 7.635 3.123 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -10.980 10.510 -0.947 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -12.914 8.199 2.088 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -13.022 9.611 0.077 1.00 0.00 H new ATOM 707 N PRO A 45 -7.425 7.221 6.428 1.00 0.00 N ATOM 708 CA PRO A 45 -6.765 6.381 7.430 1.00 0.00 C ATOM 709 C PRO A 45 -6.237 5.069 6.837 1.00 0.00 C ATOM 710 O PRO A 45 -6.637 3.991 7.263 1.00 0.00 O ATOM 711 CB PRO A 45 -7.867 6.106 8.467 1.00 0.00 C ATOM 712 CG PRO A 45 -8.993 7.024 8.117 1.00 0.00 C ATOM 713 CD PRO A 45 -8.874 7.287 6.645 1.00 0.00 C ATOM 0 HA PRO A 45 -5.888 6.872 7.852 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -8.186 5.064 8.432 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -7.508 6.295 9.479 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -9.955 6.569 8.355 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -8.930 7.952 8.685 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -9.407 6.542 6.055 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -9.281 8.260 6.372 1.00 0.00 H new ATOM 721 N THR A 46 -5.378 5.208 5.827 1.00 0.00 N ATOM 722 CA THR A 46 -4.615 4.123 5.196 1.00 0.00 C ATOM 723 C THR A 46 -5.323 3.535 3.982 1.00 0.00 C ATOM 724 O THR A 46 -6.495 3.833 3.716 1.00 0.00 O ATOM 725 CB THR A 46 -4.168 2.989 6.162 1.00 0.00 C ATOM 726 OG1 THR A 46 -2.917 2.468 5.702 1.00 0.00 O ATOM 727 CG2 THR A 46 -5.165 1.830 6.235 1.00 0.00 C ATOM 0 H THR A 46 -5.184 6.117 5.406 1.00 0.00 H new ATOM 0 HA THR A 46 -3.702 4.616 4.863 1.00 0.00 H new ATOM 0 HB THR A 46 -4.096 3.426 7.158 1.00 0.00 H new ATOM 0 HG1 THR A 46 -2.580 1.810 6.345 1.00 0.00 H new ATOM 0 HG21 THR A 46 -4.793 1.073 6.926 1.00 0.00 H new ATOM 0 HG22 THR A 46 -6.128 2.200 6.586 1.00 0.00 H new ATOM 0 HG23 THR A 46 -5.285 1.390 5.245 1.00 0.00 H new ATOM 735 N SER A 47 -4.577 2.698 3.264 1.00 0.00 N ATOM 736 CA SER A 47 -4.979 2.147 1.976 1.00 0.00 C ATOM 737 C SER A 47 -6.383 1.559 2.006 1.00 0.00 C ATOM 738 O SER A 47 -7.190 1.858 1.135 1.00 0.00 O ATOM 739 CB SER A 47 -3.983 1.067 1.560 1.00 0.00 C ATOM 740 OG SER A 47 -2.656 1.458 1.878 1.00 0.00 O ATOM 0 H SER A 47 -3.658 2.379 3.569 1.00 0.00 H new ATOM 0 HA SER A 47 -4.986 2.964 1.255 1.00 0.00 H new ATOM 0 HB2 SER A 47 -4.222 0.131 2.065 1.00 0.00 H new ATOM 0 HB3 SER A 47 -4.066 0.882 0.489 1.00 0.00 H new ATOM 0 HG SER A 47 -2.373 1.014 2.705 1.00 0.00 H new ATOM 746 N GLU A 48 -6.671 0.745 3.017 1.00 0.00 N ATOM 747 CA GLU A 48 -7.953 0.042 3.111 1.00 0.00 C ATOM 748 C GLU A 48 -9.137 1.013 3.026 1.00 0.00 C ATOM 749 O GLU A 48 -10.185 0.685 2.471 1.00 0.00 O ATOM 750 CB GLU A 48 -8.014 -0.754 4.417 1.00 0.00 C ATOM 751 CG GLU A 48 -9.162 -1.752 4.480 1.00 0.00 C ATOM 752 CD GLU A 48 -9.097 -2.791 3.373 1.00 0.00 C ATOM 753 OE1 GLU A 48 -8.037 -3.432 3.219 1.00 0.00 O ATOM 754 OE2 GLU A 48 -10.113 -2.976 2.667 1.00 0.00 O ATOM 0 H GLU A 48 -6.032 0.553 3.788 1.00 0.00 H new ATOM 0 HA GLU A 48 -8.026 -0.642 2.265 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -7.073 -1.289 4.549 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -8.105 -0.058 5.251 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -9.148 -2.256 5.447 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -10.109 -1.215 4.414 1.00 0.00 H new ATOM 761 N HIS A 49 -8.966 2.221 3.553 1.00 0.00 N ATOM 762 CA HIS A 49 -10.036 3.211 3.517 1.00 0.00 C ATOM 763 C HIS A 49 -10.172 3.810 2.125 1.00 0.00 C ATOM 764 O HIS A 49 -11.281 3.969 1.623 1.00 0.00 O ATOM 765 CB HIS A 49 -9.812 4.316 4.549 1.00 0.00 C ATOM 766 CG HIS A 49 -10.143 3.898 5.947 1.00 0.00 C ATOM 767 ND1 HIS A 49 -9.193 3.494 6.856 1.00 0.00 N ATOM 768 CD2 HIS A 49 -11.332 3.827 6.596 1.00 0.00 C ATOM 769 CE1 HIS A 49 -9.779 3.189 7.997 1.00 0.00 C ATOM 770 NE2 HIS A 49 -11.075 3.384 7.868 1.00 0.00 N ATOM 0 H HIS A 49 -8.107 2.536 4.005 1.00 0.00 H new ATOM 0 HA HIS A 49 -10.964 2.698 3.769 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -8.770 4.634 4.510 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -10.420 5.181 4.282 1.00 0.00 H new ATOM 0 HD1 HIS A 49 -8.191 3.439 6.675 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -12.301 4.073 6.187 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -9.280 2.838 8.888 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -11.773 3.231 8.595 1.00 0.00 H new ATOM 779 N TYR A 50 -9.044 4.134 1.504 1.00 0.00 N ATOM 780 CA TYR A 50 -9.058 4.665 0.143 1.00 0.00 C ATOM 781 C TYR A 50 -9.455 3.573 -0.851 1.00 0.00 C ATOM 782 O TYR A 50 -9.993 3.856 -1.920 1.00 0.00 O ATOM 783 CB TYR A 50 -7.692 5.256 -0.223 1.00 0.00 C ATOM 784 CG TYR A 50 -7.677 5.977 -1.555 1.00 0.00 C ATOM 785 CD1 TYR A 50 -8.489 7.084 -1.774 1.00 0.00 C ATOM 786 CD2 TYR A 50 -6.849 5.558 -2.591 1.00 0.00 C ATOM 787 CE1 TYR A 50 -8.476 7.753 -2.983 1.00 0.00 C ATOM 788 CE2 TYR A 50 -6.833 6.222 -3.803 1.00 0.00 C ATOM 789 CZ TYR A 50 -7.647 7.319 -3.994 1.00 0.00 C ATOM 790 OH TYR A 50 -7.625 7.987 -5.199 1.00 0.00 O ATOM 0 H TYR A 50 -8.115 4.040 1.915 1.00 0.00 H new ATOM 0 HA TYR A 50 -9.798 5.464 0.094 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -7.385 5.950 0.559 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -6.954 4.455 -0.245 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -9.142 7.427 -0.985 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -6.209 4.700 -2.446 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -9.113 8.612 -3.135 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -6.185 5.883 -4.598 1.00 0.00 H new ATOM 0 HH TYR A 50 -7.468 8.941 -5.041 1.00 0.00 H new ATOM 800 N PHE A 51 -9.190 2.326 -0.481 1.00 0.00 N ATOM 801 CA PHE A 51 -9.577 1.173 -1.283 1.00 0.00 C ATOM 802 C PHE A 51 -11.098 1.116 -1.393 1.00 0.00 C ATOM 803 O PHE A 51 -11.651 1.063 -2.489 1.00 0.00 O ATOM 804 CB PHE A 51 -9.028 -0.108 -0.643 1.00 0.00 C ATOM 805 CG PHE A 51 -9.020 -1.305 -1.550 1.00 0.00 C ATOM 806 CD1 PHE A 51 -8.155 -1.363 -2.630 1.00 0.00 C ATOM 807 CD2 PHE A 51 -9.863 -2.378 -1.314 1.00 0.00 C ATOM 808 CE1 PHE A 51 -8.133 -2.467 -3.460 1.00 0.00 C ATOM 809 CE2 PHE A 51 -9.844 -3.487 -2.139 1.00 0.00 C ATOM 810 CZ PHE A 51 -8.978 -3.530 -3.214 1.00 0.00 C ATOM 0 H PHE A 51 -8.702 2.086 0.382 1.00 0.00 H new ATOM 0 HA PHE A 51 -9.159 1.264 -2.286 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -8.010 0.079 -0.301 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -9.623 -0.341 0.240 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -7.490 -0.535 -2.826 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -10.543 -2.348 -0.476 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -7.455 -2.498 -4.300 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -10.505 -4.318 -1.943 1.00 0.00 H new ATOM 0 HZ PHE A 51 -8.962 -4.394 -3.861 1.00 0.00 H new ATOM 820 N GLN A 52 -11.769 1.155 -0.247 1.00 0.00 N ATOM 821 CA GLN A 52 -13.227 1.222 -0.215 1.00 0.00 C ATOM 822 C GLN A 52 -13.719 2.513 -0.861 1.00 0.00 C ATOM 823 O GLN A 52 -14.764 2.536 -1.513 1.00 0.00 O ATOM 824 CB GLN A 52 -13.740 1.136 1.223 1.00 0.00 C ATOM 825 CG GLN A 52 -14.108 -0.269 1.670 1.00 0.00 C ATOM 826 CD GLN A 52 -12.948 -1.237 1.592 1.00 0.00 C ATOM 827 OE1 GLN A 52 -12.730 -1.873 0.565 1.00 0.00 O ATOM 828 NE2 GLN A 52 -12.218 -1.374 2.679 1.00 0.00 N ATOM 0 H GLN A 52 -11.327 1.141 0.672 1.00 0.00 H new ATOM 0 HA GLN A 52 -13.615 0.374 -0.779 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -12.976 1.530 1.893 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -14.615 1.778 1.324 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -14.476 -0.233 2.695 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -14.925 -0.639 1.051 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -12.434 -0.825 3.511 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -11.436 -2.029 2.689 1.00 0.00 H new ATOM 837 N ALA A 53 -12.944 3.577 -0.686 1.00 0.00 N ATOM 838 CA ALA A 53 -13.281 4.882 -1.236 1.00 0.00 C ATOM 839 C ALA A 53 -13.256 4.875 -2.760 1.00 0.00 C ATOM 840 O ALA A 53 -13.966 5.644 -3.404 1.00 0.00 O ATOM 841 CB ALA A 53 -12.324 5.935 -0.706 1.00 0.00 C ATOM 0 H ALA A 53 -12.069 3.559 -0.162 1.00 0.00 H new ATOM 0 HA ALA A 53 -14.296 5.122 -0.920 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -12.585 6.907 -1.124 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -12.394 5.976 0.381 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -11.305 5.678 -0.994 1.00 0.00 H new ATOM 847 N GLN A 54 -12.428 4.020 -3.335 1.00 0.00 N ATOM 848 CA GLN A 54 -12.349 3.912 -4.779 1.00 0.00 C ATOM 849 C GLN A 54 -13.041 2.635 -5.247 1.00 0.00 C ATOM 850 O GLN A 54 -13.033 2.306 -6.429 1.00 0.00 O ATOM 851 CB GLN A 54 -10.891 3.934 -5.241 1.00 0.00 C ATOM 852 CG GLN A 54 -10.698 4.587 -6.602 1.00 0.00 C ATOM 853 CD GLN A 54 -10.703 6.110 -6.549 1.00 0.00 C ATOM 854 OE1 GLN A 54 -11.374 6.684 -5.557 1.00 0.00 O flip ATOM 855 NE2 GLN A 54 -10.094 6.768 -7.392 1.00 0.00 N flip ATOM 0 H GLN A 54 -11.804 3.394 -2.826 1.00 0.00 H new ATOM 0 HA GLN A 54 -12.858 4.768 -5.222 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -10.292 4.466 -4.503 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -10.515 2.912 -5.280 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -9.754 4.249 -7.028 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -11.489 4.252 -7.273 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -9.589 6.295 -8.141 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -10.095 7.787 -7.342 1.00 0.00 H new ATOM 864 N LYS A 55 -13.622 1.912 -4.299 1.00 0.00 N ATOM 865 CA LYS A 55 -14.425 0.737 -4.608 1.00 0.00 C ATOM 866 C LYS A 55 -15.848 1.150 -4.961 1.00 0.00 C ATOM 867 O LYS A 55 -16.340 0.869 -6.056 1.00 0.00 O ATOM 868 CB LYS A 55 -14.434 -0.219 -3.408 1.00 0.00 C ATOM 869 CG LYS A 55 -15.348 -1.423 -3.573 1.00 0.00 C ATOM 870 CD LYS A 55 -15.333 -2.304 -2.333 1.00 0.00 C ATOM 871 CE LYS A 55 -14.003 -3.026 -2.166 1.00 0.00 C ATOM 872 NZ LYS A 55 -13.919 -3.747 -0.867 1.00 0.00 N ATOM 0 H LYS A 55 -13.551 2.121 -3.303 1.00 0.00 H new ATOM 0 HA LYS A 55 -13.988 0.225 -5.466 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -13.418 -0.571 -3.231 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -14.739 0.335 -2.520 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -16.366 -1.085 -3.769 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -15.033 -2.005 -4.439 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -15.528 -1.693 -1.451 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -16.138 -3.036 -2.398 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -13.870 -3.735 -2.983 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -13.188 -2.305 -2.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -13.380 -4.627 -0.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -13.441 -3.145 -0.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -14.878 -3.973 -0.533 1.00 0.00 H new ATOM 886 N PHE A 56 -16.497 1.837 -4.036 1.00 0.00 N ATOM 887 CA PHE A 56 -17.868 2.275 -4.235 1.00 0.00 C ATOM 888 C PHE A 56 -17.873 3.630 -4.925 1.00 0.00 C ATOM 889 O PHE A 56 -17.003 4.461 -4.673 1.00 0.00 O ATOM 890 CB PHE A 56 -18.603 2.346 -2.895 1.00 0.00 C ATOM 891 CG PHE A 56 -18.528 1.064 -2.113 1.00 0.00 C ATOM 892 CD1 PHE A 56 -19.216 -0.061 -2.531 1.00 0.00 C ATOM 893 CD2 PHE A 56 -17.763 0.986 -0.962 1.00 0.00 C ATOM 894 CE1 PHE A 56 -19.142 -1.241 -1.816 1.00 0.00 C ATOM 895 CE2 PHE A 56 -17.687 -0.191 -0.241 1.00 0.00 C ATOM 896 CZ PHE A 56 -18.377 -1.305 -0.669 1.00 0.00 C ATOM 0 H PHE A 56 -16.095 2.104 -3.137 1.00 0.00 H new ATOM 0 HA PHE A 56 -18.388 1.556 -4.867 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -18.180 3.154 -2.298 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -19.649 2.595 -3.074 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -19.818 -0.016 -3.427 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -17.219 1.855 -0.623 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -19.682 -2.113 -2.154 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -17.088 -0.238 0.656 1.00 0.00 H new ATOM 0 HZ PHE A 56 -18.319 -2.226 -0.108 1.00 0.00 H new ATOM 906 N LEU A 57 -18.831 3.847 -5.811 1.00 0.00 N ATOM 907 CA LEU A 57 -18.862 5.072 -6.604 1.00 0.00 C ATOM 908 C LEU A 57 -19.887 6.065 -6.066 1.00 0.00 C ATOM 909 O LEU A 57 -20.157 7.092 -6.694 1.00 0.00 O ATOM 910 CB LEU A 57 -19.150 4.765 -8.082 1.00 0.00 C ATOM 911 CG LEU A 57 -20.556 4.244 -8.406 1.00 0.00 C ATOM 912 CD1 LEU A 57 -20.813 4.327 -9.898 1.00 0.00 C ATOM 913 CD2 LEU A 57 -20.735 2.810 -7.937 1.00 0.00 C ATOM 0 H LEU A 57 -19.594 3.198 -6.001 1.00 0.00 H new ATOM 0 HA LEU A 57 -17.875 5.529 -6.527 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -18.980 5.674 -8.660 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -18.424 4.028 -8.426 1.00 0.00 H new ATOM 0 HG LEU A 57 -21.274 4.871 -7.877 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -21.814 3.955 -10.116 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -20.733 5.364 -10.224 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -20.077 3.722 -10.428 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -21.741 2.470 -8.181 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -20.006 2.171 -8.434 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -20.587 2.759 -6.858 1.00 0.00 H new ATOM 925 N ASP A 58 -20.447 5.772 -4.904 1.00 0.00 N ATOM 926 CA ASP A 58 -21.419 6.668 -4.292 1.00 0.00 C ATOM 927 C ASP A 58 -20.714 7.682 -3.401 1.00 0.00 C ATOM 928 O ASP A 58 -20.006 7.310 -2.468 1.00 0.00 O ATOM 929 CB ASP A 58 -22.454 5.891 -3.479 1.00 0.00 C ATOM 930 CG ASP A 58 -23.500 6.810 -2.880 1.00 0.00 C ATOM 931 OD1 ASP A 58 -24.473 7.152 -3.589 1.00 0.00 O ATOM 932 OD2 ASP A 58 -23.344 7.207 -1.710 1.00 0.00 O ATOM 0 H ASP A 58 -20.248 4.928 -4.367 1.00 0.00 H new ATOM 0 HA ASP A 58 -21.939 7.194 -5.093 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -22.940 5.154 -4.118 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -21.953 5.341 -2.682 1.00 0.00 H new ATOM 937 N GLU A 59 -20.912 8.959 -3.704 1.00 0.00 N ATOM 938 CA GLU A 59 -20.249 10.049 -2.994 1.00 0.00 C ATOM 939 C GLU A 59 -20.577 10.025 -1.503 1.00 0.00 C ATOM 940 O GLU A 59 -19.688 10.158 -0.658 1.00 0.00 O ATOM 941 CB GLU A 59 -20.677 11.389 -3.602 1.00 0.00 C ATOM 942 CG GLU A 59 -19.870 12.584 -3.116 1.00 0.00 C ATOM 943 CD GLU A 59 -18.427 12.552 -3.585 1.00 0.00 C ATOM 944 OE1 GLU A 59 -18.101 11.747 -4.489 1.00 0.00 O ATOM 945 OE2 GLU A 59 -17.611 13.339 -3.061 1.00 0.00 O ATOM 0 H GLU A 59 -21.536 9.270 -4.448 1.00 0.00 H new ATOM 0 HA GLU A 59 -19.172 9.922 -3.100 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -20.593 11.326 -4.687 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -21.729 11.559 -3.373 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -20.341 13.502 -3.468 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -19.892 12.612 -2.027 1.00 0.00 H new ATOM 952 N LYS A 60 -21.850 9.828 -1.188 1.00 0.00 N ATOM 953 CA LYS A 60 -22.321 9.907 0.190 1.00 0.00 C ATOM 954 C LYS A 60 -21.779 8.755 1.034 1.00 0.00 C ATOM 955 O LYS A 60 -21.188 8.974 2.094 1.00 0.00 O ATOM 956 CB LYS A 60 -23.850 9.908 0.221 1.00 0.00 C ATOM 957 CG LYS A 60 -24.472 11.052 -0.562 1.00 0.00 C ATOM 958 CD LYS A 60 -25.987 10.942 -0.594 1.00 0.00 C ATOM 959 CE LYS A 60 -26.615 12.052 -1.425 1.00 0.00 C ATOM 960 NZ LYS A 60 -26.310 13.401 -0.878 1.00 0.00 N ATOM 0 H LYS A 60 -22.578 9.612 -1.869 1.00 0.00 H new ATOM 0 HA LYS A 60 -21.950 10.838 0.619 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -24.214 8.963 -0.181 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -24.184 9.963 1.257 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -24.184 12.002 -0.112 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -24.084 11.051 -1.581 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -26.273 9.974 -1.005 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -26.376 10.984 0.423 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -26.252 11.986 -2.451 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -27.695 11.911 -1.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -26.902 14.111 -1.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -26.508 13.415 0.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -25.307 13.622 -1.039 1.00 0.00 H new ATOM 974 N TYR A 61 -21.971 7.530 0.563 1.00 0.00 N ATOM 975 CA TYR A 61 -21.526 6.356 1.306 1.00 0.00 C ATOM 976 C TYR A 61 -20.002 6.298 1.369 1.00 0.00 C ATOM 977 O TYR A 61 -19.428 5.804 2.341 1.00 0.00 O ATOM 978 CB TYR A 61 -22.080 5.074 0.680 1.00 0.00 C ATOM 979 CG TYR A 61 -21.835 3.841 1.521 1.00 0.00 C ATOM 980 CD1 TYR A 61 -22.360 3.738 2.804 1.00 0.00 C ATOM 981 CD2 TYR A 61 -21.075 2.783 1.036 1.00 0.00 C ATOM 982 CE1 TYR A 61 -22.138 2.615 3.578 1.00 0.00 C ATOM 983 CE2 TYR A 61 -20.850 1.657 1.805 1.00 0.00 C ATOM 984 CZ TYR A 61 -21.384 1.577 3.074 1.00 0.00 C ATOM 985 OH TYR A 61 -21.166 0.456 3.840 1.00 0.00 O ATOM 0 H TYR A 61 -22.429 7.323 -0.325 1.00 0.00 H new ATOM 0 HA TYR A 61 -21.910 6.438 2.323 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -23.152 5.190 0.522 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -21.626 4.932 -0.301 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -22.951 4.549 3.203 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -20.654 2.842 0.043 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -22.553 2.551 4.573 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -20.258 0.843 1.414 1.00 0.00 H new ATOM 0 HH TYR A 61 -20.560 0.677 4.578 1.00 0.00 H new ATOM 995 N ARG A 62 -19.344 6.816 0.342 1.00 0.00 N ATOM 996 CA ARG A 62 -17.889 6.858 0.323 1.00 0.00 C ATOM 997 C ARG A 62 -17.393 7.848 1.378 1.00 0.00 C ATOM 998 O ARG A 62 -16.357 7.638 2.019 1.00 0.00 O ATOM 999 CB ARG A 62 -17.395 7.236 -1.079 1.00 0.00 C ATOM 1000 CG ARG A 62 -15.906 7.033 -1.297 1.00 0.00 C ATOM 1001 CD ARG A 62 -15.095 8.226 -0.826 1.00 0.00 C ATOM 1002 NE ARG A 62 -15.359 9.417 -1.625 1.00 0.00 N ATOM 1003 CZ ARG A 62 -15.511 10.634 -1.114 1.00 0.00 C ATOM 1004 NH1 ARG A 62 -15.496 10.810 0.205 1.00 0.00 N ATOM 1005 NH2 ARG A 62 -15.691 11.667 -1.920 1.00 0.00 N ATOM 0 H ARG A 62 -19.792 7.211 -0.485 1.00 0.00 H new ATOM 0 HA ARG A 62 -17.487 5.874 0.563 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -17.941 6.645 -1.815 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -17.638 8.282 -1.266 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -15.580 6.140 -0.764 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -15.715 6.860 -2.356 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -15.327 8.432 0.219 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -14.033 7.985 -0.875 1.00 0.00 H new ATOM 0 HE ARG A 62 -15.431 9.309 -2.637 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -15.368 10.010 0.825 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -15.613 11.745 0.596 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -15.713 11.528 -2.930 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -15.808 12.603 -1.531 1.00 0.00 H new ATOM 1019 N GLU A 63 -18.157 8.917 1.575 1.00 0.00 N ATOM 1020 CA GLU A 63 -17.848 9.891 2.610 1.00 0.00 C ATOM 1021 C GLU A 63 -18.027 9.249 3.986 1.00 0.00 C ATOM 1022 O GLU A 63 -17.376 9.634 4.958 1.00 0.00 O ATOM 1023 CB GLU A 63 -18.756 11.115 2.478 1.00 0.00 C ATOM 1024 CG GLU A 63 -18.189 12.365 3.127 1.00 0.00 C ATOM 1025 CD GLU A 63 -17.038 12.956 2.338 1.00 0.00 C ATOM 1026 OE1 GLU A 63 -15.894 12.464 2.467 1.00 0.00 O ATOM 1027 OE2 GLU A 63 -17.266 13.918 1.589 1.00 0.00 O ATOM 0 H GLU A 63 -18.993 9.129 1.031 1.00 0.00 H new ATOM 0 HA GLU A 63 -16.814 10.215 2.496 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -18.933 11.313 1.421 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -19.723 10.890 2.927 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -18.979 13.110 3.225 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -17.850 12.126 4.135 1.00 0.00 H new ATOM 1034 N GLU A 64 -18.910 8.259 4.051 1.00 0.00 N ATOM 1035 CA GLU A 64 -19.136 7.502 5.278 1.00 0.00 C ATOM 1036 C GLU A 64 -17.954 6.573 5.551 1.00 0.00 C ATOM 1037 O GLU A 64 -17.644 6.262 6.699 1.00 0.00 O ATOM 1038 CB GLU A 64 -20.428 6.692 5.170 1.00 0.00 C ATOM 1039 CG GLU A 64 -21.265 6.704 6.438 1.00 0.00 C ATOM 1040 CD GLU A 64 -21.897 8.057 6.704 1.00 0.00 C ATOM 1041 OE1 GLU A 64 -21.186 8.984 7.159 1.00 0.00 O ATOM 1042 OE2 GLU A 64 -23.111 8.207 6.463 1.00 0.00 O ATOM 0 H GLU A 64 -19.485 7.960 3.263 1.00 0.00 H new ATOM 0 HA GLU A 64 -19.230 8.203 6.107 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -21.025 7.085 4.347 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -20.180 5.661 4.919 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -22.048 5.950 6.360 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -20.639 6.426 7.286 1.00 0.00 H new ATOM 1049 N ILE A 65 -17.284 6.148 4.488 1.00 0.00 N ATOM 1050 CA ILE A 65 -16.109 5.294 4.621 1.00 0.00 C ATOM 1051 C ILE A 65 -14.892 6.116 5.051 1.00 0.00 C ATOM 1052 O ILE A 65 -13.930 5.589 5.612 1.00 0.00 O ATOM 1053 CB ILE A 65 -15.817 4.526 3.313 1.00 0.00 C ATOM 1054 CG1 ILE A 65 -17.037 3.680 2.936 1.00 0.00 C ATOM 1055 CG2 ILE A 65 -14.580 3.647 3.463 1.00 0.00 C ATOM 1056 CD1 ILE A 65 -16.826 2.791 1.734 1.00 0.00 C ATOM 0 H ILE A 65 -17.532 6.379 3.526 1.00 0.00 H new ATOM 0 HA ILE A 65 -16.320 4.557 5.396 1.00 0.00 H new ATOM 0 HB ILE A 65 -15.619 5.245 2.518 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -17.312 3.060 3.789 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -17.879 4.344 2.740 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -14.395 3.117 2.529 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -13.718 4.270 3.703 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -14.741 2.926 4.264 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -17.737 2.226 1.535 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -16.582 3.404 0.866 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -16.007 2.100 1.932 1.00 0.00 H new ATOM 1068 N ARG A 66 -14.937 7.415 4.795 1.00 0.00 N ATOM 1069 CA ARG A 66 -13.928 8.315 5.344 1.00 0.00 C ATOM 1070 C ARG A 66 -14.216 8.574 6.824 1.00 0.00 C ATOM 1071 O ARG A 66 -13.333 8.978 7.582 1.00 0.00 O ATOM 1072 CB ARG A 66 -13.890 9.640 4.576 1.00 0.00 C ATOM 1073 CG ARG A 66 -12.794 10.582 5.061 1.00 0.00 C ATOM 1074 CD ARG A 66 -12.810 11.910 4.325 1.00 0.00 C ATOM 1075 NE ARG A 66 -14.104 12.583 4.427 1.00 0.00 N ATOM 1076 CZ ARG A 66 -14.380 13.555 5.298 1.00 0.00 C ATOM 1077 NH1 ARG A 66 -13.468 13.952 6.182 1.00 0.00 N ATOM 1078 NH2 ARG A 66 -15.580 14.120 5.293 1.00 0.00 N ATOM 0 H ARG A 66 -15.648 7.866 4.220 1.00 0.00 H new ATOM 0 HA ARG A 66 -12.953 7.839 5.241 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -13.741 9.434 3.516 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -14.856 10.136 4.672 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -12.917 10.760 6.129 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -11.823 10.106 4.926 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -12.033 12.558 4.731 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -12.571 11.744 3.275 1.00 0.00 H new ATOM 0 HE ARG A 66 -14.845 12.290 3.790 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -12.548 13.512 6.198 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -13.689 14.696 6.844 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -16.286 13.811 4.625 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -15.796 14.864 5.957 1.00 0.00 H new ATOM 1092 N ARG A 67 -15.457 8.321 7.228 1.00 0.00 N ATOM 1093 CA ARG A 67 -15.881 8.535 8.606 1.00 0.00 C ATOM 1094 C ARG A 67 -15.349 7.430 9.508 1.00 0.00 C ATOM 1095 O ARG A 67 -14.871 7.694 10.612 1.00 0.00 O ATOM 1096 CB ARG A 67 -17.409 8.581 8.688 1.00 0.00 C ATOM 1097 CG ARG A 67 -17.948 8.854 10.082 1.00 0.00 C ATOM 1098 CD ARG A 67 -17.556 10.238 10.570 1.00 0.00 C ATOM 1099 NE ARG A 67 -18.093 11.296 9.713 1.00 0.00 N ATOM 1100 CZ ARG A 67 -18.491 12.485 10.166 1.00 0.00 C ATOM 1101 NH1 ARG A 67 -18.445 12.749 11.465 1.00 0.00 N ATOM 1102 NH2 ARG A 67 -18.942 13.403 9.323 1.00 0.00 N ATOM 0 H ARG A 67 -16.191 7.965 6.615 1.00 0.00 H new ATOM 0 HA ARG A 67 -15.476 9.489 8.945 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -17.775 9.353 8.011 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -17.810 7.631 8.335 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -19.034 8.763 10.077 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -17.568 8.102 10.774 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -17.917 10.379 11.589 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -16.469 10.316 10.604 1.00 0.00 H new ATOM 0 HE ARG A 67 -18.167 11.113 8.712 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -18.105 12.042 12.117 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -18.749 13.659 11.812 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -18.985 13.201 8.324 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -19.246 14.312 9.673 1.00 0.00 H new ATOM 1116 N VAL A 68 -15.441 6.193 9.033 1.00 0.00 N ATOM 1117 CA VAL A 68 -14.973 5.050 9.801 1.00 0.00 C ATOM 1118 C VAL A 68 -13.461 5.135 10.017 1.00 0.00 C ATOM 1119 O VAL A 68 -12.681 5.189 9.067 1.00 0.00 O ATOM 1120 CB VAL A 68 -15.358 3.704 9.128 1.00 0.00 C ATOM 1121 CG1 VAL A 68 -14.750 3.567 7.743 1.00 0.00 C ATOM 1122 CG2 VAL A 68 -14.966 2.528 10.007 1.00 0.00 C ATOM 0 H VAL A 68 -15.835 5.958 8.122 1.00 0.00 H new ATOM 0 HA VAL A 68 -15.469 5.080 10.771 1.00 0.00 H new ATOM 0 HB VAL A 68 -16.441 3.701 9.009 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -15.045 2.612 7.309 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -15.105 4.379 7.108 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -13.663 3.612 7.817 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -15.246 1.597 9.515 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -13.889 2.541 10.173 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -15.482 2.601 10.964 1.00 0.00 H new ATOM 1132 N SER A 69 -13.052 5.173 11.271 1.00 0.00 N ATOM 1133 CA SER A 69 -11.646 5.303 11.603 1.00 0.00 C ATOM 1134 C SER A 69 -10.980 3.933 11.627 1.00 0.00 C ATOM 1135 O SER A 69 -9.804 3.794 11.291 1.00 0.00 O ATOM 1136 CB SER A 69 -11.504 6.001 12.953 1.00 0.00 C ATOM 1137 OG SER A 69 -12.240 7.215 12.965 1.00 0.00 O ATOM 0 H SER A 69 -13.674 5.116 12.077 1.00 0.00 H new ATOM 0 HA SER A 69 -11.149 5.905 10.843 1.00 0.00 H new ATOM 0 HB2 SER A 69 -11.860 5.345 13.747 1.00 0.00 H new ATOM 0 HB3 SER A 69 -10.452 6.204 13.155 1.00 0.00 H new ATOM 0 HG SER A 69 -12.140 7.649 13.838 1.00 0.00 H new ATOM 1143 N SER A 70 -11.749 2.922 12.003 1.00 0.00 N ATOM 1144 CA SER A 70 -11.245 1.559 12.068 1.00 0.00 C ATOM 1145 C SER A 70 -11.039 0.990 10.665 1.00 0.00 C ATOM 1146 O SER A 70 -11.966 0.966 9.851 1.00 0.00 O ATOM 1147 CB SER A 70 -12.218 0.678 12.854 1.00 0.00 C ATOM 1148 OG SER A 70 -11.725 -0.645 12.988 1.00 0.00 O ATOM 0 H SER A 70 -12.729 3.021 12.269 1.00 0.00 H new ATOM 0 HA SER A 70 -10.282 1.572 12.578 1.00 0.00 H new ATOM 0 HB2 SER A 70 -12.384 1.108 13.842 1.00 0.00 H new ATOM 0 HB3 SER A 70 -13.184 0.659 12.348 1.00 0.00 H new ATOM 0 HG SER A 70 -12.054 -1.034 13.825 1.00 0.00 H new ATOM 1154 N PRO A 71 -9.814 0.542 10.357 1.00 0.00 N ATOM 1155 CA PRO A 71 -9.500 -0.083 9.072 1.00 0.00 C ATOM 1156 C PRO A 71 -10.192 -1.433 8.919 1.00 0.00 C ATOM 1157 O PRO A 71 -10.614 -1.806 7.825 1.00 0.00 O ATOM 1158 CB PRO A 71 -7.974 -0.261 9.108 1.00 0.00 C ATOM 1159 CG PRO A 71 -7.503 0.585 10.244 1.00 0.00 C ATOM 1160 CD PRO A 71 -8.634 0.617 11.228 1.00 0.00 C ATOM 0 HA PRO A 71 -9.841 0.520 8.230 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -7.704 -1.306 9.258 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -7.519 0.054 8.169 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -6.604 0.167 10.696 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -7.252 1.590 9.905 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -8.590 -0.220 11.925 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -8.627 1.529 11.825 1.00 0.00 H new ATOM 1168 N MET A 72 -10.327 -2.146 10.032 1.00 0.00 N ATOM 1169 CA MET A 72 -10.940 -3.468 10.028 1.00 0.00 C ATOM 1170 C MET A 72 -12.423 -3.368 9.694 1.00 0.00 C ATOM 1171 O MET A 72 -12.928 -4.101 8.846 1.00 0.00 O ATOM 1172 CB MET A 72 -10.756 -4.150 11.388 1.00 0.00 C ATOM 1173 CG MET A 72 -11.221 -5.604 11.436 1.00 0.00 C ATOM 1174 SD MET A 72 -10.070 -6.756 10.645 1.00 0.00 S ATOM 1175 CE MET A 72 -10.332 -6.423 8.904 1.00 0.00 C ATOM 0 H MET A 72 -10.019 -1.829 10.951 1.00 0.00 H new ATOM 0 HA MET A 72 -10.447 -4.069 9.264 1.00 0.00 H new ATOM 0 HB2 MET A 72 -9.701 -4.110 11.660 1.00 0.00 H new ATOM 0 HB3 MET A 72 -11.302 -3.582 12.142 1.00 0.00 H new ATOM 0 HG2 MET A 72 -11.360 -5.899 12.476 1.00 0.00 H new ATOM 0 HG3 MET A 72 -12.193 -5.683 10.950 1.00 0.00 H new ATOM 0 HE1 MET A 72 -10.321 -7.361 8.348 1.00 0.00 H new ATOM 0 HE2 MET A 72 -11.296 -5.932 8.768 1.00 0.00 H new ATOM 0 HE3 MET A 72 -9.539 -5.773 8.535 1.00 0.00 H new ATOM 1185 N VAL A 73 -13.114 -2.441 10.353 1.00 0.00 N ATOM 1186 CA VAL A 73 -14.538 -2.233 10.110 1.00 0.00 C ATOM 1187 C VAL A 73 -14.769 -1.724 8.688 1.00 0.00 C ATOM 1188 O VAL A 73 -15.737 -2.110 8.028 1.00 0.00 O ATOM 1189 CB VAL A 73 -15.149 -1.238 11.123 1.00 0.00 C ATOM 1190 CG1 VAL A 73 -16.632 -1.022 10.848 1.00 0.00 C ATOM 1191 CG2 VAL A 73 -14.938 -1.731 12.546 1.00 0.00 C ATOM 0 H VAL A 73 -12.711 -1.823 11.058 1.00 0.00 H new ATOM 0 HA VAL A 73 -15.033 -3.196 10.236 1.00 0.00 H new ATOM 0 HB VAL A 73 -14.640 -0.281 11.007 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -17.038 -0.318 11.574 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -16.761 -0.621 9.843 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -17.159 -1.972 10.930 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -15.374 -1.019 13.246 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -15.418 -2.702 12.670 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -13.870 -1.826 12.743 1.00 0.00 H new ATOM 1201 N ALA A 74 -13.864 -0.871 8.219 1.00 0.00 N ATOM 1202 CA ALA A 74 -13.939 -0.342 6.864 1.00 0.00 C ATOM 1203 C ALA A 74 -13.918 -1.469 5.841 1.00 0.00 C ATOM 1204 O ALA A 74 -14.733 -1.498 4.921 1.00 0.00 O ATOM 1205 CB ALA A 74 -12.795 0.622 6.607 1.00 0.00 C ATOM 0 H ALA A 74 -13.069 -0.531 8.760 1.00 0.00 H new ATOM 0 HA ALA A 74 -14.881 0.197 6.762 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -12.866 1.008 5.590 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -12.851 1.450 7.314 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -11.846 0.101 6.732 1.00 0.00 H new ATOM 1211 N ALA A 75 -12.983 -2.396 6.013 1.00 0.00 N ATOM 1212 CA ALA A 75 -12.893 -3.560 5.145 1.00 0.00 C ATOM 1213 C ALA A 75 -14.106 -4.460 5.335 1.00 0.00 C ATOM 1214 O ALA A 75 -14.669 -4.976 4.373 1.00 0.00 O ATOM 1215 CB ALA A 75 -11.613 -4.332 5.430 1.00 0.00 C ATOM 0 H ALA A 75 -12.276 -2.362 6.748 1.00 0.00 H new ATOM 0 HA ALA A 75 -12.873 -3.220 4.110 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -11.558 -5.201 4.774 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -10.752 -3.688 5.252 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -11.611 -4.662 6.469 1.00 0.00 H new ATOM 1221 N ARG A 76 -14.509 -4.620 6.591 1.00 0.00 N ATOM 1222 CA ARG A 76 -15.625 -5.484 6.952 1.00 0.00 C ATOM 1223 C ARG A 76 -16.888 -5.098 6.184 1.00 0.00 C ATOM 1224 O ARG A 76 -17.492 -5.935 5.515 1.00 0.00 O ATOM 1225 CB ARG A 76 -15.877 -5.398 8.459 1.00 0.00 C ATOM 1226 CG ARG A 76 -16.778 -6.491 9.011 1.00 0.00 C ATOM 1227 CD ARG A 76 -16.135 -7.864 8.884 1.00 0.00 C ATOM 1228 NE ARG A 76 -16.730 -8.831 9.806 1.00 0.00 N ATOM 1229 CZ ARG A 76 -16.455 -10.137 9.803 1.00 0.00 C ATOM 1230 NH1 ARG A 76 -15.679 -10.656 8.860 1.00 0.00 N ATOM 1231 NH2 ARG A 76 -16.963 -10.926 10.742 1.00 0.00 N ATOM 0 H ARG A 76 -14.071 -4.155 7.386 1.00 0.00 H new ATOM 0 HA ARG A 76 -15.369 -6.509 6.686 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -14.919 -5.438 8.978 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -16.322 -4.429 8.685 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -16.998 -6.287 10.059 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -17.729 -6.483 8.478 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -16.244 -8.223 7.861 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -15.066 -7.784 9.081 1.00 0.00 H new ATOM 0 HE ARG A 76 -17.398 -8.485 10.495 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -15.289 -10.056 8.133 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -15.472 -11.655 8.862 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -17.564 -10.534 11.467 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -16.752 -11.924 10.739 1.00 0.00 H new ATOM 1245 N MET A 77 -17.273 -3.827 6.261 1.00 0.00 N ATOM 1246 CA MET A 77 -18.482 -3.368 5.583 1.00 0.00 C ATOM 1247 C MET A 77 -18.212 -3.124 4.101 1.00 0.00 C ATOM 1248 O MET A 77 -19.124 -3.171 3.279 1.00 0.00 O ATOM 1249 CB MET A 77 -19.048 -2.098 6.240 1.00 0.00 C ATOM 1250 CG MET A 77 -18.227 -0.835 6.011 1.00 0.00 C ATOM 1251 SD MET A 77 -19.015 0.628 6.720 1.00 0.00 S ATOM 1252 CE MET A 77 -17.900 1.932 6.195 1.00 0.00 C ATOM 0 H MET A 77 -16.773 -3.105 6.779 1.00 0.00 H new ATOM 0 HA MET A 77 -19.229 -4.156 5.676 1.00 0.00 H new ATOM 0 HB2 MET A 77 -20.057 -1.931 5.863 1.00 0.00 H new ATOM 0 HB3 MET A 77 -19.133 -2.269 7.313 1.00 0.00 H new ATOM 0 HG2 MET A 77 -17.238 -0.962 6.451 1.00 0.00 H new ATOM 0 HG3 MET A 77 -18.084 -0.686 4.941 1.00 0.00 H new ATOM 0 HE1 MET A 77 -17.348 2.307 7.057 1.00 0.00 H new ATOM 0 HE2 MET A 77 -17.200 1.537 5.459 1.00 0.00 H new ATOM 0 HE3 MET A 77 -18.474 2.745 5.750 1.00 0.00 H new ATOM 1262 N GLY A 78 -16.951 -2.875 3.765 1.00 0.00 N ATOM 1263 CA GLY A 78 -16.577 -2.658 2.382 1.00 0.00 C ATOM 1264 C GLY A 78 -16.510 -3.944 1.578 1.00 0.00 C ATOM 1265 O GLY A 78 -16.327 -3.912 0.362 1.00 0.00 O ATOM 0 H GLY A 78 -16.179 -2.820 4.430 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -17.296 -1.983 1.918 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -15.607 -2.163 2.347 1.00 0.00 H new ATOM 1269 N ARG A 79 -16.626 -5.083 2.250 1.00 0.00 N ATOM 1270 CA ARG A 79 -16.661 -6.365 1.559 1.00 0.00 C ATOM 1271 C ARG A 79 -18.090 -6.747 1.193 1.00 0.00 C ATOM 1272 O ARG A 79 -18.315 -7.732 0.487 1.00 0.00 O ATOM 1273 CB ARG A 79 -16.016 -7.463 2.406 1.00 0.00 C ATOM 1274 CG ARG A 79 -14.506 -7.323 2.521 1.00 0.00 C ATOM 1275 CD ARG A 79 -13.899 -8.424 3.372 1.00 0.00 C ATOM 1276 NE ARG A 79 -12.451 -8.264 3.517 1.00 0.00 N ATOM 1277 CZ ARG A 79 -11.620 -9.249 3.869 1.00 0.00 C ATOM 1278 NH1 ARG A 79 -12.088 -10.473 4.096 1.00 0.00 N ATOM 1279 NH2 ARG A 79 -10.319 -9.008 3.988 1.00 0.00 N ATOM 0 H ARG A 79 -16.697 -5.145 3.266 1.00 0.00 H new ATOM 0 HA ARG A 79 -16.086 -6.262 0.639 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -16.453 -7.446 3.404 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -16.252 -8.434 1.971 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -14.062 -7.347 1.526 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -14.263 -6.353 2.955 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -14.365 -8.421 4.357 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -14.114 -9.393 2.921 1.00 0.00 H new ATOM 0 HE ARG A 79 -12.052 -7.343 3.338 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -13.086 -10.663 4.002 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -11.449 -11.222 4.364 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -9.955 -8.072 3.811 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -9.684 -9.759 4.257 1.00 0.00 H new ATOM 1293 N ASP A 80 -19.053 -5.961 1.667 1.00 0.00 N ATOM 1294 CA ASP A 80 -20.452 -6.187 1.326 1.00 0.00 C ATOM 1295 C ASP A 80 -20.701 -5.804 -0.124 1.00 0.00 C ATOM 1296 O ASP A 80 -20.409 -4.685 -0.543 1.00 0.00 O ATOM 1297 CB ASP A 80 -21.386 -5.396 2.244 1.00 0.00 C ATOM 1298 CG ASP A 80 -22.828 -5.439 1.773 1.00 0.00 C ATOM 1299 OD1 ASP A 80 -23.464 -6.515 1.857 1.00 0.00 O ATOM 1300 OD2 ASP A 80 -23.337 -4.398 1.314 1.00 0.00 O ATOM 0 H ASP A 80 -18.890 -5.166 2.285 1.00 0.00 H new ATOM 0 HA ASP A 80 -20.665 -7.247 1.463 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -21.324 -5.798 3.255 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -21.052 -4.359 2.292 1.00 0.00 H new ATOM 1305 N ARG A 81 -21.242 -6.741 -0.883 1.00 0.00 N ATOM 1306 CA ARG A 81 -21.432 -6.550 -2.310 1.00 0.00 C ATOM 1307 C ARG A 81 -22.862 -6.090 -2.605 1.00 0.00 C ATOM 1308 O ARG A 81 -23.323 -6.123 -3.747 1.00 0.00 O ATOM 1309 CB ARG A 81 -21.097 -7.857 -3.041 1.00 0.00 C ATOM 1310 CG ARG A 81 -20.992 -7.719 -4.547 1.00 0.00 C ATOM 1311 CD ARG A 81 -20.286 -8.911 -5.172 1.00 0.00 C ATOM 1312 NE ARG A 81 -18.876 -8.988 -4.778 1.00 0.00 N ATOM 1313 CZ ARG A 81 -17.901 -9.412 -5.586 1.00 0.00 C ATOM 1314 NH1 ARG A 81 -18.185 -9.831 -6.813 1.00 0.00 N ATOM 1315 NH2 ARG A 81 -16.642 -9.431 -5.161 1.00 0.00 N ATOM 0 H ARG A 81 -21.559 -7.645 -0.533 1.00 0.00 H new ATOM 0 HA ARG A 81 -20.762 -5.768 -2.669 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -20.153 -8.243 -2.656 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -21.863 -8.597 -2.808 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -21.990 -7.622 -4.974 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -20.450 -6.805 -4.792 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -20.795 -9.829 -4.876 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -20.355 -8.844 -6.258 1.00 0.00 H new ATOM 0 HE ARG A 81 -18.625 -8.701 -3.832 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -19.151 -9.830 -7.142 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -17.438 -10.154 -7.427 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -16.418 -9.121 -4.215 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -15.899 -9.755 -5.780 1.00 0.00 H new ATOM 1329 N SER A 82 -23.554 -5.642 -1.565 1.00 0.00 N ATOM 1330 CA SER A 82 -24.911 -5.135 -1.709 1.00 0.00 C ATOM 1331 C SER A 82 -24.881 -3.628 -1.942 1.00 0.00 C ATOM 1332 O SER A 82 -25.905 -3.005 -2.227 1.00 0.00 O ATOM 1333 CB SER A 82 -25.727 -5.462 -0.459 1.00 0.00 C ATOM 1334 OG SER A 82 -25.493 -6.798 -0.041 1.00 0.00 O ATOM 0 H SER A 82 -23.196 -5.620 -0.610 1.00 0.00 H new ATOM 0 HA SER A 82 -25.381 -5.614 -2.568 1.00 0.00 H new ATOM 0 HB2 SER A 82 -25.463 -4.773 0.344 1.00 0.00 H new ATOM 0 HB3 SER A 82 -26.788 -5.321 -0.664 1.00 0.00 H new ATOM 0 HG SER A 82 -24.784 -6.810 0.636 1.00 0.00 H new ATOM 1340 N LYS A 83 -23.695 -3.053 -1.805 1.00 0.00 N ATOM 1341 CA LYS A 83 -23.486 -1.638 -2.056 1.00 0.00 C ATOM 1342 C LYS A 83 -23.144 -1.429 -3.528 1.00 0.00 C ATOM 1343 O LYS A 83 -22.775 -2.385 -4.215 1.00 0.00 O ATOM 1344 CB LYS A 83 -22.355 -1.114 -1.166 1.00 0.00 C ATOM 1345 CG LYS A 83 -22.571 -1.373 0.316 1.00 0.00 C ATOM 1346 CD LYS A 83 -23.750 -0.585 0.859 1.00 0.00 C ATOM 1347 CE LYS A 83 -24.051 -0.971 2.296 1.00 0.00 C ATOM 1348 NZ LYS A 83 -24.585 -2.352 2.397 1.00 0.00 N ATOM 0 H LYS A 83 -22.854 -3.554 -1.518 1.00 0.00 H new ATOM 0 HA LYS A 83 -24.397 -1.087 -1.821 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -21.418 -1.578 -1.474 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -22.247 -0.041 -1.326 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -22.739 -2.438 0.478 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -21.670 -1.105 0.867 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -23.535 0.482 0.803 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -24.628 -0.766 0.239 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -23.142 -0.889 2.892 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -24.773 -0.271 2.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -24.997 -2.497 3.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -25.319 -2.494 1.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -23.814 -3.034 2.247 1.00 0.00 H new ATOM 1362 N PRO A 84 -23.266 -0.195 -4.046 1.00 0.00 N ATOM 1363 CA PRO A 84 -22.994 0.081 -5.455 1.00 0.00 C ATOM 1364 C PRO A 84 -21.513 -0.056 -5.803 1.00 0.00 C ATOM 1365 O PRO A 84 -20.701 0.827 -5.507 1.00 0.00 O ATOM 1366 CB PRO A 84 -23.463 1.526 -5.640 1.00 0.00 C ATOM 1367 CG PRO A 84 -23.367 2.131 -4.284 1.00 0.00 C ATOM 1368 CD PRO A 84 -23.675 1.020 -3.315 1.00 0.00 C ATOM 0 HA PRO A 84 -23.502 -0.627 -6.110 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -22.836 2.057 -6.356 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -24.484 1.565 -6.020 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -22.372 2.539 -4.108 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -24.073 2.954 -4.172 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -23.121 1.134 -2.383 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -24.733 0.995 -3.055 1.00 0.00 H new ATOM 1376 N LEU A 85 -21.168 -1.184 -6.401 1.00 0.00 N ATOM 1377 CA LEU A 85 -19.820 -1.409 -6.893 1.00 0.00 C ATOM 1378 C LEU A 85 -19.674 -0.806 -8.278 1.00 0.00 C ATOM 1379 O LEU A 85 -20.642 -0.725 -9.033 1.00 0.00 O ATOM 1380 CB LEU A 85 -19.511 -2.907 -6.969 1.00 0.00 C ATOM 1381 CG LEU A 85 -19.504 -3.660 -5.639 1.00 0.00 C ATOM 1382 CD1 LEU A 85 -19.257 -5.138 -5.881 1.00 0.00 C ATOM 1383 CD2 LEU A 85 -18.442 -3.100 -4.710 1.00 0.00 C ATOM 0 H LEU A 85 -21.808 -1.963 -6.558 1.00 0.00 H new ATOM 0 HA LEU A 85 -19.122 -0.937 -6.202 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -20.245 -3.376 -7.625 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -18.536 -3.033 -7.440 1.00 0.00 H new ATOM 0 HG LEU A 85 -20.477 -3.533 -5.165 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -19.254 -5.667 -4.928 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -20.047 -5.540 -6.516 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -18.293 -5.270 -6.373 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -18.455 -3.650 -3.769 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -17.462 -3.200 -5.176 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -18.646 -2.047 -4.517 1.00 0.00 H new ATOM 1395 N ARG A 86 -18.474 -0.376 -8.615 1.00 0.00 N ATOM 1396 CA ARG A 86 -18.210 0.096 -9.959 1.00 0.00 C ATOM 1397 C ARG A 86 -17.938 -1.096 -10.871 1.00 0.00 C ATOM 1398 O ARG A 86 -17.332 -2.081 -10.450 1.00 0.00 O ATOM 1399 CB ARG A 86 -17.054 1.099 -9.964 1.00 0.00 C ATOM 1400 CG ARG A 86 -15.777 0.588 -9.326 1.00 0.00 C ATOM 1401 CD ARG A 86 -14.810 1.728 -9.066 1.00 0.00 C ATOM 1402 NE ARG A 86 -15.311 2.658 -8.050 1.00 0.00 N ATOM 1403 CZ ARG A 86 -15.089 3.976 -8.071 1.00 0.00 C ATOM 1404 NH1 ARG A 86 -14.489 4.533 -9.113 1.00 0.00 N ATOM 1405 NH2 ARG A 86 -15.489 4.742 -7.058 1.00 0.00 N ATOM 0 H ARG A 86 -17.674 -0.344 -7.983 1.00 0.00 H new ATOM 0 HA ARG A 86 -19.085 0.622 -10.339 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -16.842 1.385 -10.994 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -17.370 2.002 -9.442 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -16.011 0.083 -8.389 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -15.309 -0.150 -9.978 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -13.851 1.322 -8.744 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -14.631 2.269 -9.995 1.00 0.00 H new ATOM 0 HE ARG A 86 -15.862 2.277 -7.281 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -14.196 3.956 -9.901 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -14.321 5.539 -9.127 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -15.968 4.324 -6.260 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -15.317 5.747 -7.080 1.00 0.00 H new ATOM 1419 N LYS A 87 -18.402 -1.003 -12.110 1.00 0.00 N ATOM 1420 CA LYS A 87 -18.412 -2.140 -13.033 1.00 0.00 C ATOM 1421 C LYS A 87 -17.017 -2.727 -13.263 1.00 0.00 C ATOM 1422 O LYS A 87 -16.873 -3.927 -13.481 1.00 0.00 O ATOM 1423 CB LYS A 87 -19.027 -1.712 -14.368 1.00 0.00 C ATOM 1424 CG LYS A 87 -19.263 -2.863 -15.332 1.00 0.00 C ATOM 1425 CD LYS A 87 -19.917 -2.384 -16.616 1.00 0.00 C ATOM 1426 CE LYS A 87 -20.218 -3.543 -17.551 1.00 0.00 C ATOM 1427 NZ LYS A 87 -20.884 -3.089 -18.800 1.00 0.00 N ATOM 0 H LYS A 87 -18.781 -0.143 -12.506 1.00 0.00 H new ATOM 0 HA LYS A 87 -19.015 -2.925 -12.576 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -19.976 -1.211 -14.176 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -18.371 -0.982 -14.842 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -18.314 -3.346 -15.564 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -19.895 -3.613 -14.858 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -20.841 -1.855 -16.380 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -19.261 -1.672 -17.116 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -19.291 -4.058 -17.801 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -20.856 -4.265 -17.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -21.072 -3.909 -19.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -21.782 -2.620 -18.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -20.265 -2.420 -19.300 1.00 0.00 H new ATOM 1441 N ASN A 88 -15.994 -1.891 -13.203 1.00 0.00 N ATOM 1442 CA ASN A 88 -14.636 -2.342 -13.490 1.00 0.00 C ATOM 1443 C ASN A 88 -13.822 -2.494 -12.212 1.00 0.00 C ATOM 1444 O ASN A 88 -12.589 -2.488 -12.254 1.00 0.00 O ATOM 1445 CB ASN A 88 -13.934 -1.354 -14.428 1.00 0.00 C ATOM 1446 CG ASN A 88 -14.701 -1.119 -15.716 1.00 0.00 C ATOM 1447 OD1 ASN A 88 -15.547 -0.229 -15.791 1.00 0.00 O ATOM 1448 ND2 ASN A 88 -14.408 -1.909 -16.738 1.00 0.00 N ATOM 0 H ASN A 88 -16.073 -0.903 -12.960 1.00 0.00 H new ATOM 0 HA ASN A 88 -14.707 -3.316 -13.974 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -13.800 -0.403 -13.912 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -12.939 -1.731 -14.666 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -14.891 -1.791 -17.629 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -13.700 -2.635 -16.634 1.00 0.00 H new ATOM 1455 N TRP A 89 -14.505 -2.654 -11.085 1.00 0.00 N ATOM 1456 CA TRP A 89 -13.831 -2.747 -9.795 1.00 0.00 C ATOM 1457 C TRP A 89 -12.840 -3.909 -9.765 1.00 0.00 C ATOM 1458 O TRP A 89 -11.683 -3.733 -9.378 1.00 0.00 O ATOM 1459 CB TRP A 89 -14.843 -2.896 -8.656 1.00 0.00 C ATOM 1460 CG TRP A 89 -14.185 -3.132 -7.336 1.00 0.00 C ATOM 1461 CD1 TRP A 89 -14.399 -4.176 -6.486 1.00 0.00 C ATOM 1462 CD2 TRP A 89 -13.171 -2.322 -6.735 1.00 0.00 C ATOM 1463 NE1 TRP A 89 -13.582 -4.061 -5.387 1.00 0.00 N ATOM 1464 CE2 TRP A 89 -12.815 -2.928 -5.520 1.00 0.00 C ATOM 1465 CE3 TRP A 89 -12.531 -1.141 -7.110 1.00 0.00 C ATOM 1466 CZ2 TRP A 89 -11.846 -2.388 -4.677 1.00 0.00 C ATOM 1467 CZ3 TRP A 89 -11.572 -0.610 -6.278 1.00 0.00 C ATOM 1468 CH2 TRP A 89 -11.234 -1.231 -5.073 1.00 0.00 C ATOM 0 H TRP A 89 -15.522 -2.722 -11.038 1.00 0.00 H new ATOM 0 HA TRP A 89 -13.277 -1.819 -9.654 1.00 0.00 H new ATOM 0 HB2 TRP A 89 -15.455 -1.996 -8.598 1.00 0.00 H new ATOM 0 HB3 TRP A 89 -15.515 -3.725 -8.877 1.00 0.00 H new ATOM 0 HD1 TRP A 89 -15.106 -4.975 -6.652 1.00 0.00 H new ATOM 0 HE1 TRP A 89 -13.550 -4.710 -4.601 1.00 0.00 H new ATOM 0 HE3 TRP A 89 -12.784 -0.651 -8.039 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 -11.587 -2.866 -3.744 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 -11.071 0.304 -6.562 1.00 0.00 H new ATOM 0 HH2 TRP A 89 -10.476 -0.789 -4.443 1.00 0.00 H new ATOM 1479 N GLU A 90 -13.292 -5.079 -10.199 1.00 0.00 N ATOM 1480 CA GLU A 90 -12.472 -6.291 -10.170 1.00 0.00 C ATOM 1481 C GLU A 90 -11.147 -6.117 -10.919 1.00 0.00 C ATOM 1482 O GLU A 90 -10.179 -6.827 -10.646 1.00 0.00 O ATOM 1483 CB GLU A 90 -13.250 -7.472 -10.758 1.00 0.00 C ATOM 1484 CG GLU A 90 -13.894 -8.376 -9.713 1.00 0.00 C ATOM 1485 CD GLU A 90 -14.856 -7.649 -8.797 1.00 0.00 C ATOM 1486 OE1 GLU A 90 -15.953 -7.272 -9.262 1.00 0.00 O ATOM 1487 OE2 GLU A 90 -14.517 -7.460 -7.610 1.00 0.00 O ATOM 0 H GLU A 90 -14.229 -5.218 -10.578 1.00 0.00 H new ATOM 0 HA GLU A 90 -12.234 -6.491 -9.125 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -14.027 -7.088 -11.419 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -12.575 -8.068 -11.372 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -14.425 -9.182 -10.219 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -13.111 -8.838 -9.112 1.00 0.00 H new ATOM 1494 N SER A 91 -11.098 -5.175 -11.851 1.00 0.00 N ATOM 1495 CA SER A 91 -9.902 -4.978 -12.658 1.00 0.00 C ATOM 1496 C SER A 91 -9.039 -3.808 -12.162 1.00 0.00 C ATOM 1497 O SER A 91 -7.863 -3.717 -12.506 1.00 0.00 O ATOM 1498 CB SER A 91 -10.296 -4.776 -14.122 1.00 0.00 C ATOM 1499 OG SER A 91 -11.438 -3.938 -14.237 1.00 0.00 O ATOM 0 H SER A 91 -11.866 -4.540 -12.066 1.00 0.00 H new ATOM 0 HA SER A 91 -9.290 -5.875 -12.563 1.00 0.00 H new ATOM 0 HB2 SER A 91 -9.462 -4.335 -14.668 1.00 0.00 H new ATOM 0 HB3 SER A 91 -10.503 -5.742 -14.582 1.00 0.00 H new ATOM 0 HG SER A 91 -11.544 -3.415 -13.415 1.00 0.00 H new ATOM 1505 N VAL A 92 -9.608 -2.924 -11.344 1.00 0.00 N ATOM 1506 CA VAL A 92 -8.887 -1.715 -10.935 1.00 0.00 C ATOM 1507 C VAL A 92 -8.389 -1.791 -9.492 1.00 0.00 C ATOM 1508 O VAL A 92 -7.858 -0.813 -8.963 1.00 0.00 O ATOM 1509 CB VAL A 92 -9.749 -0.442 -11.105 1.00 0.00 C ATOM 1510 CG1 VAL A 92 -10.128 -0.239 -12.565 1.00 0.00 C ATOM 1511 CG2 VAL A 92 -10.991 -0.500 -10.227 1.00 0.00 C ATOM 0 H VAL A 92 -10.547 -3.016 -10.957 1.00 0.00 H new ATOM 0 HA VAL A 92 -8.024 -1.654 -11.598 1.00 0.00 H new ATOM 0 HB VAL A 92 -9.153 0.413 -10.785 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -10.734 0.662 -12.662 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -9.224 -0.134 -13.164 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -10.698 -1.099 -12.916 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -11.578 0.408 -10.367 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -11.592 -1.367 -10.503 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -10.694 -0.582 -9.182 1.00 0.00 H new ATOM 1521 N LYS A 93 -8.536 -2.953 -8.867 1.00 0.00 N ATOM 1522 CA LYS A 93 -8.098 -3.145 -7.482 1.00 0.00 C ATOM 1523 C LYS A 93 -6.598 -2.885 -7.339 1.00 0.00 C ATOM 1524 O LYS A 93 -6.152 -2.243 -6.388 1.00 0.00 O ATOM 1525 CB LYS A 93 -8.441 -4.561 -7.014 1.00 0.00 C ATOM 1526 CG LYS A 93 -9.932 -4.844 -7.031 1.00 0.00 C ATOM 1527 CD LYS A 93 -10.252 -6.280 -6.656 1.00 0.00 C ATOM 1528 CE LYS A 93 -11.745 -6.536 -6.767 1.00 0.00 C ATOM 1529 NZ LYS A 93 -12.114 -7.942 -6.460 1.00 0.00 N ATOM 0 H LYS A 93 -8.955 -3.779 -9.294 1.00 0.00 H new ATOM 0 HA LYS A 93 -8.625 -2.427 -6.854 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -7.932 -5.283 -7.653 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -8.060 -4.706 -6.003 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -10.435 -4.170 -6.338 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -10.328 -4.634 -8.025 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -9.710 -6.963 -7.310 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -9.917 -6.480 -5.638 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -12.275 -5.870 -6.086 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -12.077 -6.290 -7.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -13.033 -8.162 -6.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -11.389 -8.582 -6.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -12.179 -8.067 -5.430 1.00 0.00 H new ATOM 1543 N GLU A 94 -5.831 -3.370 -8.303 1.00 0.00 N ATOM 1544 CA GLU A 94 -4.385 -3.180 -8.308 1.00 0.00 C ATOM 1545 C GLU A 94 -4.019 -1.737 -8.658 1.00 0.00 C ATOM 1546 O GLU A 94 -2.957 -1.243 -8.275 1.00 0.00 O ATOM 1547 CB GLU A 94 -3.735 -4.169 -9.278 1.00 0.00 C ATOM 1548 CG GLU A 94 -4.492 -4.329 -10.588 1.00 0.00 C ATOM 1549 CD GLU A 94 -4.047 -5.549 -11.362 1.00 0.00 C ATOM 1550 OE1 GLU A 94 -4.231 -6.675 -10.854 1.00 0.00 O ATOM 1551 OE2 GLU A 94 -3.522 -5.395 -12.482 1.00 0.00 O ATOM 0 H GLU A 94 -6.187 -3.902 -9.098 1.00 0.00 H new ATOM 0 HA GLU A 94 -4.003 -3.375 -7.306 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -2.719 -3.838 -9.494 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -3.657 -5.142 -8.793 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -5.560 -4.402 -10.382 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -4.346 -3.439 -11.201 1.00 0.00 H new ATOM 1558 N GLN A 95 -4.916 -1.056 -9.360 1.00 0.00 N ATOM 1559 CA GLN A 95 -4.706 0.342 -9.711 1.00 0.00 C ATOM 1560 C GLN A 95 -4.861 1.223 -8.476 1.00 0.00 C ATOM 1561 O GLN A 95 -4.066 2.133 -8.246 1.00 0.00 O ATOM 1562 CB GLN A 95 -5.690 0.780 -10.797 1.00 0.00 C ATOM 1563 CG GLN A 95 -5.564 2.249 -11.175 1.00 0.00 C ATOM 1564 CD GLN A 95 -6.542 2.660 -12.256 1.00 0.00 C ATOM 1565 OE1 GLN A 95 -6.235 2.589 -13.445 1.00 0.00 O ATOM 1566 NE2 GLN A 95 -7.725 3.093 -11.853 1.00 0.00 N ATOM 0 H GLN A 95 -5.795 -1.449 -9.697 1.00 0.00 H new ATOM 0 HA GLN A 95 -3.693 0.451 -10.099 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -5.533 0.170 -11.686 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -6.707 0.587 -10.454 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -5.728 2.863 -10.290 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -4.548 2.446 -11.516 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -7.940 3.136 -10.857 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -8.422 3.383 -12.538 1.00 0.00 H new ATOM 1575 N VAL A 96 -5.886 0.938 -7.680 1.00 0.00 N ATOM 1576 CA VAL A 96 -6.116 1.669 -6.440 1.00 0.00 C ATOM 1577 C VAL A 96 -4.942 1.474 -5.489 1.00 0.00 C ATOM 1578 O VAL A 96 -4.518 2.410 -4.809 1.00 0.00 O ATOM 1579 CB VAL A 96 -7.420 1.223 -5.745 1.00 0.00 C ATOM 1580 CG1 VAL A 96 -7.643 1.996 -4.454 1.00 0.00 C ATOM 1581 CG2 VAL A 96 -8.602 1.401 -6.680 1.00 0.00 C ATOM 0 H VAL A 96 -6.570 0.206 -7.872 1.00 0.00 H new ATOM 0 HA VAL A 96 -6.212 2.724 -6.697 1.00 0.00 H new ATOM 0 HB VAL A 96 -7.327 0.167 -5.493 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -8.569 1.662 -3.985 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -6.808 1.820 -3.776 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -7.712 3.061 -4.675 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -9.515 1.083 -6.177 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -8.689 2.451 -6.960 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -8.452 0.798 -7.575 1.00 0.00 H new ATOM 1591 N MET A 97 -4.408 0.256 -5.467 1.00 0.00 N ATOM 1592 CA MET A 97 -3.235 -0.048 -4.658 1.00 0.00 C ATOM 1593 C MET A 97 -2.054 0.823 -5.068 1.00 0.00 C ATOM 1594 O MET A 97 -1.305 1.288 -4.219 1.00 0.00 O ATOM 1595 CB MET A 97 -2.867 -1.531 -4.765 1.00 0.00 C ATOM 1596 CG MET A 97 -3.798 -2.445 -3.987 1.00 0.00 C ATOM 1597 SD MET A 97 -3.713 -2.168 -2.205 1.00 0.00 S ATOM 1598 CE MET A 97 -4.938 -3.337 -1.617 1.00 0.00 C ATOM 0 H MET A 97 -4.770 -0.535 -6.000 1.00 0.00 H new ATOM 0 HA MET A 97 -3.479 0.170 -3.618 1.00 0.00 H new ATOM 0 HB2 MET A 97 -2.876 -1.825 -5.815 1.00 0.00 H new ATOM 0 HB3 MET A 97 -1.848 -1.671 -4.404 1.00 0.00 H new ATOM 0 HG2 MET A 97 -4.822 -2.289 -4.327 1.00 0.00 H new ATOM 0 HG3 MET A 97 -3.545 -3.483 -4.202 1.00 0.00 H new ATOM 0 HE1 MET A 97 -5.475 -2.907 -0.772 1.00 0.00 H new ATOM 0 HE2 MET A 97 -5.642 -3.560 -2.419 1.00 0.00 H new ATOM 0 HE3 MET A 97 -4.443 -4.256 -1.303 1.00 0.00 H new ATOM 1608 N ARG A 98 -1.905 1.058 -6.370 1.00 0.00 N ATOM 1609 CA ARG A 98 -0.843 1.934 -6.868 1.00 0.00 C ATOM 1610 C ARG A 98 -0.975 3.336 -6.276 1.00 0.00 C ATOM 1611 O ARG A 98 0.007 3.932 -5.832 1.00 0.00 O ATOM 1612 CB ARG A 98 -0.887 2.030 -8.396 1.00 0.00 C ATOM 1613 CG ARG A 98 -0.632 0.715 -9.111 1.00 0.00 C ATOM 1614 CD ARG A 98 -0.709 0.888 -10.621 1.00 0.00 C ATOM 1615 NE ARG A 98 -0.469 -0.365 -11.334 1.00 0.00 N ATOM 1616 CZ ARG A 98 0.022 -0.434 -12.571 1.00 0.00 C ATOM 1617 NH1 ARG A 98 0.262 0.674 -13.264 1.00 0.00 N ATOM 1618 NH2 ARG A 98 0.238 -1.615 -13.129 1.00 0.00 N ATOM 0 H ARG A 98 -2.500 0.658 -7.095 1.00 0.00 H new ATOM 0 HA ARG A 98 0.109 1.501 -6.562 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -1.863 2.411 -8.697 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -0.146 2.759 -8.724 1.00 0.00 H new ATOM 0 HG2 ARG A 98 0.351 0.332 -8.835 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -1.364 -0.025 -8.789 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -1.692 1.275 -10.891 1.00 0.00 H new ATOM 0 HD3 ARG A 98 0.024 1.630 -10.938 1.00 0.00 H new ATOM 0 HE ARG A 98 -0.690 -1.239 -10.856 1.00 0.00 H new ATOM 0 HH11 ARG A 98 0.070 1.586 -12.850 1.00 0.00 H new ATOM 0 HH12 ARG A 98 0.638 0.612 -14.210 1.00 0.00 H new ATOM 0 HH21 ARG A 98 0.029 -2.469 -12.612 1.00 0.00 H new ATOM 0 HH22 ARG A 98 0.614 -1.671 -14.076 1.00 0.00 H new ATOM 1632 N LYS A 99 -2.201 3.846 -6.269 1.00 0.00 N ATOM 1633 CA LYS A 99 -2.479 5.187 -5.768 1.00 0.00 C ATOM 1634 C LYS A 99 -2.230 5.260 -4.263 1.00 0.00 C ATOM 1635 O LYS A 99 -1.533 6.155 -3.778 1.00 0.00 O ATOM 1636 CB LYS A 99 -3.934 5.560 -6.070 1.00 0.00 C ATOM 1637 CG LYS A 99 -4.120 6.966 -6.630 1.00 0.00 C ATOM 1638 CD LYS A 99 -3.700 8.049 -5.651 1.00 0.00 C ATOM 1639 CE LYS A 99 -3.797 9.431 -6.285 1.00 0.00 C ATOM 1640 NZ LYS A 99 -5.156 9.710 -6.831 1.00 0.00 N ATOM 0 H LYS A 99 -3.024 3.347 -6.607 1.00 0.00 H new ATOM 0 HA LYS A 99 -1.812 5.890 -6.266 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -4.340 4.842 -6.782 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -4.518 5.466 -5.154 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -3.540 7.067 -7.547 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -5.167 7.110 -6.898 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -4.333 8.007 -4.765 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -2.677 7.868 -5.321 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -3.544 10.187 -5.542 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -3.062 9.513 -7.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -5.177 10.667 -7.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -5.382 9.015 -7.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -5.858 9.642 -6.067 1.00 0.00 H new ATOM 1654 N ALA A 100 -2.795 4.302 -3.539 1.00 0.00 N ATOM 1655 CA ALA A 100 -2.714 4.281 -2.084 1.00 0.00 C ATOM 1656 C ALA A 100 -1.293 4.014 -1.602 1.00 0.00 C ATOM 1657 O ALA A 100 -0.790 4.717 -0.725 1.00 0.00 O ATOM 1658 CB ALA A 100 -3.667 3.238 -1.522 1.00 0.00 C ATOM 0 H ALA A 100 -3.318 3.524 -3.940 1.00 0.00 H new ATOM 0 HA ALA A 100 -3.005 5.266 -1.720 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -3.598 3.231 -0.434 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -4.687 3.480 -1.820 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -3.399 2.255 -1.909 1.00 0.00 H new ATOM 1664 N LEU A 101 -0.646 3.009 -2.181 1.00 0.00 N ATOM 1665 CA LEU A 101 0.697 2.624 -1.761 1.00 0.00 C ATOM 1666 C LEU A 101 1.706 3.725 -2.032 1.00 0.00 C ATOM 1667 O LEU A 101 2.627 3.928 -1.243 1.00 0.00 O ATOM 1668 CB LEU A 101 1.136 1.329 -2.442 1.00 0.00 C ATOM 1669 CG LEU A 101 0.520 0.061 -1.854 1.00 0.00 C ATOM 1670 CD1 LEU A 101 0.918 -1.158 -2.672 1.00 0.00 C ATOM 1671 CD2 LEU A 101 0.951 -0.101 -0.404 1.00 0.00 C ATOM 0 H LEU A 101 -1.028 2.447 -2.941 1.00 0.00 H new ATOM 0 HA LEU A 101 0.660 2.457 -0.685 1.00 0.00 H new ATOM 0 HB2 LEU A 101 0.879 1.385 -3.500 1.00 0.00 H new ATOM 0 HB3 LEU A 101 2.222 1.252 -2.381 1.00 0.00 H new ATOM 0 HG LEU A 101 -0.566 0.150 -1.889 1.00 0.00 H new ATOM 0 HD11 LEU A 101 0.469 -2.051 -2.237 1.00 0.00 H new ATOM 0 HD12 LEU A 101 0.567 -1.039 -3.697 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.003 -1.259 -2.669 1.00 0.00 H new ATOM 0 HD21 LEU A 101 0.508 -1.007 0.008 1.00 0.00 H new ATOM 0 HD22 LEU A 101 2.037 -0.173 -0.353 1.00 0.00 H new ATOM 0 HD23 LEU A 101 0.617 0.761 0.173 1.00 0.00 H new ATOM 1683 N ARG A 102 1.541 4.446 -3.134 1.00 0.00 N ATOM 1684 CA ARG A 102 2.447 5.542 -3.418 1.00 0.00 C ATOM 1685 C ARG A 102 2.291 6.625 -2.363 1.00 0.00 C ATOM 1686 O ARG A 102 3.263 7.010 -1.727 1.00 0.00 O ATOM 1687 CB ARG A 102 2.238 6.139 -4.810 1.00 0.00 C ATOM 1688 CG ARG A 102 3.291 7.190 -5.121 1.00 0.00 C ATOM 1689 CD ARG A 102 3.129 7.821 -6.488 1.00 0.00 C ATOM 1690 NE ARG A 102 4.192 8.794 -6.730 1.00 0.00 N ATOM 1691 CZ ARG A 102 4.485 9.320 -7.913 1.00 0.00 C ATOM 1692 NH1 ARG A 102 3.756 9.029 -8.983 1.00 0.00 N ATOM 1693 NH2 ARG A 102 5.508 10.154 -8.017 1.00 0.00 N ATOM 0 H ARG A 102 0.808 4.295 -3.827 1.00 0.00 H new ATOM 0 HA ARG A 102 3.458 5.136 -3.394 1.00 0.00 H new ATOM 0 HB2 ARG A 102 2.279 5.347 -5.558 1.00 0.00 H new ATOM 0 HB3 ARG A 102 1.246 6.585 -4.872 1.00 0.00 H new ATOM 0 HG2 ARG A 102 3.249 7.971 -4.362 1.00 0.00 H new ATOM 0 HG3 ARG A 102 4.279 6.734 -5.055 1.00 0.00 H new ATOM 0 HD2 ARG A 102 3.152 7.049 -7.257 1.00 0.00 H new ATOM 0 HD3 ARG A 102 2.157 8.310 -6.557 1.00 0.00 H new ATOM 0 HE ARG A 102 4.751 9.091 -5.930 1.00 0.00 H new ATOM 0 HH11 ARG A 102 2.961 8.395 -8.901 1.00 0.00 H new ATOM 0 HH12 ARG A 102 3.991 9.439 -9.887 1.00 0.00 H new ATOM 0 HH21 ARG A 102 6.062 10.387 -7.193 1.00 0.00 H new ATOM 0 HH22 ARG A 102 5.742 10.564 -8.921 1.00 0.00 H new ATOM 1707 N ALA A 103 1.059 7.086 -2.157 1.00 0.00 N ATOM 1708 CA ALA A 103 0.782 8.129 -1.169 1.00 0.00 C ATOM 1709 C ALA A 103 1.250 7.700 0.218 1.00 0.00 C ATOM 1710 O ALA A 103 1.683 8.524 1.024 1.00 0.00 O ATOM 1711 CB ALA A 103 -0.702 8.461 -1.150 1.00 0.00 C ATOM 0 H ALA A 103 0.236 6.754 -2.660 1.00 0.00 H new ATOM 0 HA ALA A 103 1.335 9.024 -1.453 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -0.891 9.238 -0.410 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -1.008 8.815 -2.134 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -1.271 7.568 -0.892 1.00 0.00 H new ATOM 1717 N LYS A 104 1.162 6.401 0.473 1.00 0.00 N ATOM 1718 CA LYS A 104 1.647 5.803 1.710 1.00 0.00 C ATOM 1719 C LYS A 104 3.116 6.159 1.951 1.00 0.00 C ATOM 1720 O LYS A 104 3.476 6.666 3.018 1.00 0.00 O ATOM 1721 CB LYS A 104 1.459 4.285 1.626 1.00 0.00 C ATOM 1722 CG LYS A 104 2.039 3.495 2.786 1.00 0.00 C ATOM 1723 CD LYS A 104 1.885 2.003 2.539 1.00 0.00 C ATOM 1724 CE LYS A 104 2.598 1.178 3.593 1.00 0.00 C ATOM 1725 NZ LYS A 104 1.933 1.258 4.919 1.00 0.00 N ATOM 0 H LYS A 104 0.750 5.730 -0.175 1.00 0.00 H new ATOM 0 HA LYS A 104 1.078 6.196 2.553 1.00 0.00 H new ATOM 0 HB2 LYS A 104 0.392 4.071 1.559 1.00 0.00 H new ATOM 0 HB3 LYS A 104 1.914 3.929 0.702 1.00 0.00 H new ATOM 0 HG2 LYS A 104 3.093 3.743 2.912 1.00 0.00 H new ATOM 0 HG3 LYS A 104 1.534 3.771 3.711 1.00 0.00 H new ATOM 0 HD2 LYS A 104 0.826 1.744 2.530 1.00 0.00 H new ATOM 0 HD3 LYS A 104 2.282 1.755 1.554 1.00 0.00 H new ATOM 0 HE2 LYS A 104 2.637 0.137 3.271 1.00 0.00 H new ATOM 0 HE3 LYS A 104 3.628 1.522 3.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 2.615 1.012 5.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 1.584 2.225 5.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 1.134 0.593 4.947 1.00 0.00 H new ATOM 1739 N PHE A 105 3.955 5.903 0.955 1.00 0.00 N ATOM 1740 CA PHE A 105 5.385 6.186 1.067 1.00 0.00 C ATOM 1741 C PHE A 105 5.707 7.656 0.771 1.00 0.00 C ATOM 1742 O PHE A 105 6.657 8.208 1.321 1.00 0.00 O ATOM 1743 CB PHE A 105 6.184 5.270 0.134 1.00 0.00 C ATOM 1744 CG PHE A 105 6.105 3.815 0.511 1.00 0.00 C ATOM 1745 CD1 PHE A 105 6.896 3.308 1.528 1.00 0.00 C ATOM 1746 CD2 PHE A 105 5.243 2.958 -0.148 1.00 0.00 C ATOM 1747 CE1 PHE A 105 6.829 1.974 1.880 1.00 0.00 C ATOM 1748 CE2 PHE A 105 5.168 1.622 0.197 1.00 0.00 C ATOM 1749 CZ PHE A 105 5.963 1.129 1.213 1.00 0.00 C ATOM 0 H PHE A 105 3.673 5.501 0.061 1.00 0.00 H new ATOM 0 HA PHE A 105 5.675 5.990 2.099 1.00 0.00 H new ATOM 0 HB2 PHE A 105 5.818 5.394 -0.885 1.00 0.00 H new ATOM 0 HB3 PHE A 105 7.228 5.582 0.138 1.00 0.00 H new ATOM 0 HD1 PHE A 105 7.574 3.964 2.053 1.00 0.00 H new ATOM 0 HD2 PHE A 105 4.619 3.338 -0.944 1.00 0.00 H new ATOM 0 HE1 PHE A 105 7.452 1.592 2.675 1.00 0.00 H new ATOM 0 HE2 PHE A 105 4.489 0.965 -0.327 1.00 0.00 H new ATOM 0 HZ PHE A 105 5.908 0.085 1.485 1.00 0.00 H new ATOM 1759 N GLU A 106 4.921 8.284 -0.098 1.00 0.00 N ATOM 1760 CA GLU A 106 5.120 9.694 -0.438 1.00 0.00 C ATOM 1761 C GLU A 106 4.914 10.601 0.777 1.00 0.00 C ATOM 1762 O GLU A 106 5.754 11.454 1.073 1.00 0.00 O ATOM 1763 CB GLU A 106 4.173 10.122 -1.565 1.00 0.00 C ATOM 1764 CG GLU A 106 4.491 9.490 -2.914 1.00 0.00 C ATOM 1765 CD GLU A 106 5.588 10.205 -3.682 1.00 0.00 C ATOM 1766 OE1 GLU A 106 6.257 11.089 -3.105 1.00 0.00 O ATOM 1767 OE2 GLU A 106 5.779 9.880 -4.874 1.00 0.00 O ATOM 0 H GLU A 106 4.139 7.841 -0.581 1.00 0.00 H new ATOM 0 HA GLU A 106 6.151 9.800 -0.776 1.00 0.00 H new ATOM 0 HB2 GLU A 106 3.152 9.863 -1.286 1.00 0.00 H new ATOM 0 HB3 GLU A 106 4.211 11.207 -1.665 1.00 0.00 H new ATOM 0 HG2 GLU A 106 4.786 8.452 -2.758 1.00 0.00 H new ATOM 0 HG3 GLU A 106 3.586 9.476 -3.521 1.00 0.00 H new ATOM 1774 N GLN A 107 3.808 10.409 1.488 1.00 0.00 N ATOM 1775 CA GLN A 107 3.467 11.284 2.606 1.00 0.00 C ATOM 1776 C GLN A 107 4.339 11.006 3.826 1.00 0.00 C ATOM 1777 O GLN A 107 4.477 11.857 4.706 1.00 0.00 O ATOM 1778 CB GLN A 107 1.989 11.140 2.983 1.00 0.00 C ATOM 1779 CG GLN A 107 1.028 11.552 1.879 1.00 0.00 C ATOM 1780 CD GLN A 107 1.251 12.974 1.396 1.00 0.00 C ATOM 1781 OE1 GLN A 107 1.699 13.842 2.150 1.00 0.00 O ATOM 1782 NE2 GLN A 107 0.922 13.225 0.139 1.00 0.00 N ATOM 0 H GLN A 107 3.136 9.662 1.313 1.00 0.00 H new ATOM 0 HA GLN A 107 3.653 12.307 2.279 1.00 0.00 H new ATOM 0 HB2 GLN A 107 1.793 10.103 3.253 1.00 0.00 H new ATOM 0 HB3 GLN A 107 1.790 11.743 3.869 1.00 0.00 H new ATOM 0 HG2 GLN A 107 1.136 10.868 1.038 1.00 0.00 H new ATOM 0 HG3 GLN A 107 0.005 11.454 2.241 1.00 0.00 H new ATOM 0 HE21 GLN A 107 0.555 12.478 -0.451 1.00 0.00 H new ATOM 0 HE22 GLN A 107 1.036 14.165 -0.240 1.00 0.00 H new ATOM 1791 N HIS A 108 4.930 9.821 3.883 1.00 0.00 N ATOM 1792 CA HIS A 108 5.746 9.444 5.024 1.00 0.00 C ATOM 1793 C HIS A 108 7.194 9.233 4.617 1.00 0.00 C ATOM 1794 O HIS A 108 7.537 8.218 4.010 1.00 0.00 O ATOM 1795 CB HIS A 108 5.204 8.176 5.683 1.00 0.00 C ATOM 1796 CG HIS A 108 3.881 8.366 6.352 1.00 0.00 C ATOM 1797 ND1 HIS A 108 3.755 8.684 7.684 1.00 0.00 N ATOM 1798 CD2 HIS A 108 2.621 8.287 5.864 1.00 0.00 C ATOM 1799 CE1 HIS A 108 2.476 8.792 7.990 1.00 0.00 C ATOM 1800 NE2 HIS A 108 1.766 8.555 6.902 1.00 0.00 N ATOM 0 H HIS A 108 4.859 9.109 3.156 1.00 0.00 H new ATOM 0 HA HIS A 108 5.703 10.263 5.742 1.00 0.00 H new ATOM 0 HB2 HIS A 108 5.111 7.396 4.928 1.00 0.00 H new ATOM 0 HB3 HIS A 108 5.926 7.822 6.419 1.00 0.00 H new ATOM 0 HD1 HIS A 108 4.530 8.816 8.334 1.00 0.00 H new ATOM 0 HD2 HIS A 108 2.341 8.056 4.847 1.00 0.00 H new ATOM 0 HE1 HIS A 108 2.078 9.033 8.964 1.00 0.00 H new ATOM 0 HE2 HIS A 108 0.748 8.569 6.843 1.00 0.00 H new ATOM 1809 N ALA A 109 8.045 10.192 4.961 1.00 0.00 N ATOM 1810 CA ALA A 109 9.469 10.081 4.689 1.00 0.00 C ATOM 1811 C ALA A 109 10.057 8.894 5.441 1.00 0.00 C ATOM 1812 O ALA A 109 11.046 8.301 5.007 1.00 0.00 O ATOM 1813 CB ALA A 109 10.188 11.366 5.071 1.00 0.00 C ATOM 0 H ALA A 109 7.771 11.056 5.429 1.00 0.00 H new ATOM 0 HA ALA A 109 9.607 9.918 3.620 1.00 0.00 H new ATOM 0 HB1 ALA A 109 11.253 11.264 4.860 1.00 0.00 H new ATOM 0 HB2 ALA A 109 9.782 12.196 4.493 1.00 0.00 H new ATOM 0 HB3 ALA A 109 10.046 11.560 6.134 1.00 0.00 H new ATOM 1819 N GLU A 110 9.430 8.558 6.568 1.00 0.00 N ATOM 1820 CA GLU A 110 9.811 7.391 7.352 1.00 0.00 C ATOM 1821 C GLU A 110 9.734 6.141 6.483 1.00 0.00 C ATOM 1822 O GLU A 110 10.686 5.367 6.382 1.00 0.00 O ATOM 1823 CB GLU A 110 8.881 7.209 8.566 1.00 0.00 C ATOM 1824 CG GLU A 110 8.490 8.498 9.282 1.00 0.00 C ATOM 1825 CD GLU A 110 7.309 9.200 8.633 1.00 0.00 C ATOM 1826 OE1 GLU A 110 6.150 8.834 8.931 1.00 0.00 O ATOM 1827 OE2 GLU A 110 7.531 10.122 7.821 1.00 0.00 O ATOM 0 H GLU A 110 8.649 9.085 6.959 1.00 0.00 H new ATOM 0 HA GLU A 110 10.830 7.543 7.708 1.00 0.00 H new ATOM 0 HB2 GLU A 110 7.972 6.706 8.236 1.00 0.00 H new ATOM 0 HB3 GLU A 110 9.369 6.548 9.282 1.00 0.00 H new ATOM 0 HG2 GLU A 110 8.246 8.271 10.320 1.00 0.00 H new ATOM 0 HG3 GLU A 110 9.345 9.174 9.296 1.00 0.00 H new ATOM 1834 N LEU A 111 8.589 5.976 5.832 1.00 0.00 N ATOM 1835 CA LEU A 111 8.332 4.802 5.014 1.00 0.00 C ATOM 1836 C LEU A 111 9.132 4.853 3.724 1.00 0.00 C ATOM 1837 O LEU A 111 9.646 3.833 3.267 1.00 0.00 O ATOM 1838 CB LEU A 111 6.840 4.696 4.690 1.00 0.00 C ATOM 1839 CG LEU A 111 5.908 4.650 5.903 1.00 0.00 C ATOM 1840 CD1 LEU A 111 4.468 4.457 5.458 1.00 0.00 C ATOM 1841 CD2 LEU A 111 6.325 3.542 6.861 1.00 0.00 C ATOM 0 H LEU A 111 7.821 6.646 5.857 1.00 0.00 H new ATOM 0 HA LEU A 111 8.641 3.924 5.581 1.00 0.00 H new ATOM 0 HB2 LEU A 111 6.559 5.546 4.069 1.00 0.00 H new ATOM 0 HB3 LEU A 111 6.678 3.798 4.094 1.00 0.00 H new ATOM 0 HG LEU A 111 5.983 5.601 6.430 1.00 0.00 H new ATOM 0 HD11 LEU A 111 3.818 4.426 6.332 1.00 0.00 H new ATOM 0 HD12 LEU A 111 4.172 5.285 4.815 1.00 0.00 H new ATOM 0 HD13 LEU A 111 4.380 3.520 4.907 1.00 0.00 H new ATOM 0 HD21 LEU A 111 5.649 3.527 7.716 1.00 0.00 H new ATOM 0 HD22 LEU A 111 6.282 2.582 6.347 1.00 0.00 H new ATOM 0 HD23 LEU A 111 7.343 3.723 7.206 1.00 0.00 H new ATOM 1853 N ARG A 112 9.237 6.043 3.139 1.00 0.00 N ATOM 1854 CA ARG A 112 9.978 6.221 1.896 1.00 0.00 C ATOM 1855 C ARG A 112 11.425 5.768 2.065 1.00 0.00 C ATOM 1856 O ARG A 112 11.970 5.067 1.214 1.00 0.00 O ATOM 1857 CB ARG A 112 9.950 7.684 1.447 1.00 0.00 C ATOM 1858 CG ARG A 112 10.524 7.890 0.054 1.00 0.00 C ATOM 1859 CD ARG A 112 10.703 9.363 -0.281 1.00 0.00 C ATOM 1860 NE ARG A 112 9.466 10.127 -0.131 1.00 0.00 N ATOM 1861 CZ ARG A 112 8.716 10.549 -1.150 1.00 0.00 C ATOM 1862 NH1 ARG A 112 9.016 10.213 -2.398 1.00 0.00 N ATOM 1863 NH2 ARG A 112 7.646 11.286 -0.924 1.00 0.00 N ATOM 0 H ARG A 112 8.818 6.897 3.506 1.00 0.00 H new ATOM 0 HA ARG A 112 9.497 5.609 1.133 1.00 0.00 H new ATOM 0 HB2 ARG A 112 8.922 8.045 1.467 1.00 0.00 H new ATOM 0 HB3 ARG A 112 10.513 8.287 2.159 1.00 0.00 H new ATOM 0 HG2 ARG A 112 11.486 7.383 -0.019 1.00 0.00 H new ATOM 0 HG3 ARG A 112 9.864 7.429 -0.681 1.00 0.00 H new ATOM 0 HD2 ARG A 112 11.470 9.789 0.367 1.00 0.00 H new ATOM 0 HD3 ARG A 112 11.063 9.458 -1.306 1.00 0.00 H new ATOM 0 HE ARG A 112 9.156 10.352 0.814 1.00 0.00 H new ATOM 0 HH11 ARG A 112 9.828 9.625 -2.587 1.00 0.00 H new ATOM 0 HH12 ARG A 112 8.434 10.542 -3.169 1.00 0.00 H new ATOM 0 HH21 ARG A 112 7.390 11.534 0.032 1.00 0.00 H new ATOM 0 HH22 ARG A 112 7.074 11.608 -1.705 1.00 0.00 H new ATOM 1877 N ALA A 113 12.035 6.165 3.175 1.00 0.00 N ATOM 1878 CA ALA A 113 13.415 5.797 3.458 1.00 0.00 C ATOM 1879 C ALA A 113 13.544 4.292 3.656 1.00 0.00 C ATOM 1880 O ALA A 113 14.491 3.675 3.169 1.00 0.00 O ATOM 1881 CB ALA A 113 13.923 6.543 4.682 1.00 0.00 C ATOM 0 H ALA A 113 11.596 6.741 3.893 1.00 0.00 H new ATOM 0 HA ALA A 113 14.027 6.080 2.602 1.00 0.00 H new ATOM 0 HB1 ALA A 113 14.956 6.257 4.880 1.00 0.00 H new ATOM 0 HB2 ALA A 113 13.873 7.617 4.501 1.00 0.00 H new ATOM 0 HB3 ALA A 113 13.305 6.291 5.544 1.00 0.00 H new ATOM 1887 N LEU A 114 12.579 3.709 4.360 1.00 0.00 N ATOM 1888 CA LEU A 114 12.557 2.269 4.589 1.00 0.00 C ATOM 1889 C LEU A 114 12.428 1.517 3.264 1.00 0.00 C ATOM 1890 O LEU A 114 13.099 0.509 3.038 1.00 0.00 O ATOM 1891 CB LEU A 114 11.399 1.903 5.525 1.00 0.00 C ATOM 1892 CG LEU A 114 11.263 0.413 5.853 1.00 0.00 C ATOM 1893 CD1 LEU A 114 12.524 -0.107 6.527 1.00 0.00 C ATOM 1894 CD2 LEU A 114 10.050 0.176 6.739 1.00 0.00 C ATOM 0 H LEU A 114 11.800 4.214 4.783 1.00 0.00 H new ATOM 0 HA LEU A 114 13.496 1.976 5.059 1.00 0.00 H new ATOM 0 HB2 LEU A 114 11.521 2.453 6.458 1.00 0.00 H new ATOM 0 HB3 LEU A 114 10.468 2.244 5.073 1.00 0.00 H new ATOM 0 HG LEU A 114 11.125 -0.133 4.920 1.00 0.00 H new ATOM 0 HD11 LEU A 114 12.406 -1.167 6.751 1.00 0.00 H new ATOM 0 HD12 LEU A 114 13.376 0.030 5.861 1.00 0.00 H new ATOM 0 HD13 LEU A 114 12.695 0.443 7.453 1.00 0.00 H new ATOM 0 HD21 LEU A 114 9.966 -0.887 6.964 1.00 0.00 H new ATOM 0 HD22 LEU A 114 10.163 0.736 7.668 1.00 0.00 H new ATOM 0 HD23 LEU A 114 9.151 0.510 6.221 1.00 0.00 H new ATOM 1906 N LEU A 115 11.573 2.025 2.385 1.00 0.00 N ATOM 1907 CA LEU A 115 11.372 1.419 1.073 1.00 0.00 C ATOM 1908 C LEU A 115 12.640 1.512 0.231 1.00 0.00 C ATOM 1909 O LEU A 115 13.002 0.570 -0.466 1.00 0.00 O ATOM 1910 CB LEU A 115 10.207 2.093 0.343 1.00 0.00 C ATOM 1911 CG LEU A 115 9.917 1.553 -1.061 1.00 0.00 C ATOM 1912 CD1 LEU A 115 9.560 0.075 -1.005 1.00 0.00 C ATOM 1913 CD2 LEU A 115 8.801 2.352 -1.716 1.00 0.00 C ATOM 0 H LEU A 115 11.007 2.856 2.556 1.00 0.00 H new ATOM 0 HA LEU A 115 11.133 0.366 1.222 1.00 0.00 H new ATOM 0 HB2 LEU A 115 9.308 1.985 0.949 1.00 0.00 H new ATOM 0 HB3 LEU A 115 10.415 3.160 0.269 1.00 0.00 H new ATOM 0 HG LEU A 115 10.818 1.661 -1.665 1.00 0.00 H new ATOM 0 HD11 LEU A 115 9.358 -0.289 -2.012 1.00 0.00 H new ATOM 0 HD12 LEU A 115 10.392 -0.484 -0.577 1.00 0.00 H new ATOM 0 HD13 LEU A 115 8.674 -0.062 -0.385 1.00 0.00 H new ATOM 0 HD21 LEU A 115 8.607 1.956 -2.713 1.00 0.00 H new ATOM 0 HD22 LEU A 115 7.896 2.276 -1.113 1.00 0.00 H new ATOM 0 HD23 LEU A 115 9.099 3.398 -1.793 1.00 0.00 H new ATOM 1925 N LEU A 116 13.320 2.645 0.307 1.00 0.00 N ATOM 1926 CA LEU A 116 14.536 2.844 -0.469 1.00 0.00 C ATOM 1927 C LEU A 116 15.733 2.188 0.211 1.00 0.00 C ATOM 1928 O LEU A 116 16.832 2.158 -0.341 1.00 0.00 O ATOM 1929 CB LEU A 116 14.799 4.337 -0.692 1.00 0.00 C ATOM 1930 CG LEU A 116 13.671 5.091 -1.404 1.00 0.00 C ATOM 1931 CD1 LEU A 116 14.100 6.506 -1.751 1.00 0.00 C ATOM 1932 CD2 LEU A 116 13.236 4.347 -2.653 1.00 0.00 C ATOM 0 H LEU A 116 13.054 3.436 0.893 1.00 0.00 H new ATOM 0 HA LEU A 116 14.394 2.369 -1.440 1.00 0.00 H new ATOM 0 HB2 LEU A 116 14.978 4.808 0.275 1.00 0.00 H new ATOM 0 HB3 LEU A 116 15.714 4.447 -1.274 1.00 0.00 H new ATOM 0 HG LEU A 116 12.822 5.150 -0.723 1.00 0.00 H new ATOM 0 HD11 LEU A 116 13.282 7.021 -2.256 1.00 0.00 H new ATOM 0 HD12 LEU A 116 14.358 7.042 -0.838 1.00 0.00 H new ATOM 0 HD13 LEU A 116 14.968 6.472 -2.409 1.00 0.00 H new ATOM 0 HD21 LEU A 116 12.434 4.898 -3.144 1.00 0.00 H new ATOM 0 HD22 LEU A 116 14.082 4.253 -3.334 1.00 0.00 H new ATOM 0 HD23 LEU A 116 12.879 3.354 -2.379 1.00 0.00 H new ATOM 1944 N ALA A 117 15.520 1.678 1.418 1.00 0.00 N ATOM 1945 CA ALA A 117 16.567 0.971 2.143 1.00 0.00 C ATOM 1946 C ALA A 117 16.618 -0.498 1.738 1.00 0.00 C ATOM 1947 O ALA A 117 17.682 -1.107 1.724 1.00 0.00 O ATOM 1948 CB ALA A 117 16.354 1.099 3.643 1.00 0.00 C ATOM 0 H ALA A 117 14.631 1.741 1.915 1.00 0.00 H new ATOM 0 HA ALA A 117 17.523 1.427 1.885 1.00 0.00 H new ATOM 0 HB1 ALA A 117 17.145 0.565 4.170 1.00 0.00 H new ATOM 0 HB2 ALA A 117 16.377 2.152 3.925 1.00 0.00 H new ATOM 0 HB3 ALA A 117 15.387 0.672 3.911 1.00 0.00 H new ATOM 1954 N THR A 118 15.469 -1.066 1.395 1.00 0.00 N ATOM 1955 CA THR A 118 15.409 -2.472 1.023 1.00 0.00 C ATOM 1956 C THR A 118 16.021 -2.705 -0.355 1.00 0.00 C ATOM 1957 O THR A 118 16.427 -3.817 -0.677 1.00 0.00 O ATOM 1958 CB THR A 118 13.965 -3.009 1.048 1.00 0.00 C ATOM 1959 OG1 THR A 118 13.102 -2.141 0.309 1.00 0.00 O ATOM 1960 CG2 THR A 118 13.460 -3.138 2.476 1.00 0.00 C ATOM 0 H THR A 118 14.573 -0.579 1.367 1.00 0.00 H new ATOM 0 HA THR A 118 15.991 -3.018 1.765 1.00 0.00 H new ATOM 0 HB THR A 118 13.963 -3.997 0.587 1.00 0.00 H new ATOM 0 HG1 THR A 118 12.188 -2.493 0.331 1.00 0.00 H new ATOM 0 HG21 THR A 118 12.439 -3.519 2.468 1.00 0.00 H new ATOM 0 HG22 THR A 118 14.100 -3.827 3.027 1.00 0.00 H new ATOM 0 HG23 THR A 118 13.479 -2.161 2.958 1.00 0.00 H new ATOM 1968 N ALA A 119 16.084 -1.649 -1.162 1.00 0.00 N ATOM 1969 CA ALA A 119 16.669 -1.727 -2.498 1.00 0.00 C ATOM 1970 C ALA A 119 18.073 -2.332 -2.459 1.00 0.00 C ATOM 1971 O ALA A 119 18.866 -2.019 -1.569 1.00 0.00 O ATOM 1972 CB ALA A 119 16.715 -0.344 -3.131 1.00 0.00 C ATOM 0 H ALA A 119 15.735 -0.724 -0.912 1.00 0.00 H new ATOM 0 HA ALA A 119 16.038 -2.380 -3.102 1.00 0.00 H new ATOM 0 HB1 ALA A 119 17.153 -0.414 -4.127 1.00 0.00 H new ATOM 0 HB2 ALA A 119 15.704 0.055 -3.207 1.00 0.00 H new ATOM 0 HB3 ALA A 119 17.321 0.319 -2.514 1.00 0.00 H new ATOM 1978 N PRO A 120 18.408 -3.206 -3.427 1.00 0.00 N ATOM 1979 CA PRO A 120 17.519 -3.618 -4.509 1.00 0.00 C ATOM 1980 C PRO A 120 16.860 -4.982 -4.265 1.00 0.00 C ATOM 1981 O PRO A 120 16.729 -5.784 -5.188 1.00 0.00 O ATOM 1982 CB PRO A 120 18.509 -3.715 -5.666 1.00 0.00 C ATOM 1983 CG PRO A 120 19.764 -4.241 -5.037 1.00 0.00 C ATOM 1984 CD PRO A 120 19.727 -3.840 -3.577 1.00 0.00 C ATOM 0 HA PRO A 120 16.679 -2.938 -4.653 1.00 0.00 H new ATOM 0 HB2 PRO A 120 18.145 -4.383 -6.446 1.00 0.00 H new ATOM 0 HB3 PRO A 120 18.674 -2.743 -6.131 1.00 0.00 H new ATOM 0 HG2 PRO A 120 19.822 -5.325 -5.138 1.00 0.00 H new ATOM 0 HG3 PRO A 120 20.645 -3.828 -5.529 1.00 0.00 H new ATOM 0 HD2 PRO A 120 19.834 -4.704 -2.921 1.00 0.00 H new ATOM 0 HD3 PRO A 120 20.534 -3.150 -3.330 1.00 0.00 H new ATOM 1992 N ALA A 121 16.440 -5.235 -3.029 1.00 0.00 N ATOM 1993 CA ALA A 121 15.851 -6.521 -2.671 1.00 0.00 C ATOM 1994 C ALA A 121 14.507 -6.751 -3.363 1.00 0.00 C ATOM 1995 O ALA A 121 13.803 -5.806 -3.725 1.00 0.00 O ATOM 1996 CB ALA A 121 15.684 -6.629 -1.164 1.00 0.00 C ATOM 0 H ALA A 121 16.496 -4.568 -2.260 1.00 0.00 H new ATOM 0 HA ALA A 121 16.537 -7.295 -3.015 1.00 0.00 H new ATOM 0 HB1 ALA A 121 15.243 -7.594 -0.915 1.00 0.00 H new ATOM 0 HB2 ALA A 121 16.658 -6.540 -0.683 1.00 0.00 H new ATOM 0 HB3 ALA A 121 15.031 -5.830 -0.812 1.00 0.00 H new ATOM 2002 N LYS A 122 14.163 -8.020 -3.529 1.00 0.00 N ATOM 2003 CA LYS A 122 12.914 -8.417 -4.158 1.00 0.00 C ATOM 2004 C LYS A 122 11.786 -8.364 -3.134 1.00 0.00 C ATOM 2005 O LYS A 122 11.829 -9.065 -2.122 1.00 0.00 O ATOM 2006 CB LYS A 122 13.038 -9.840 -4.712 1.00 0.00 C ATOM 2007 CG LYS A 122 12.273 -10.071 -6.007 1.00 0.00 C ATOM 2008 CD LYS A 122 13.081 -9.628 -7.223 1.00 0.00 C ATOM 2009 CE LYS A 122 13.983 -10.744 -7.751 1.00 0.00 C ATOM 2010 NZ LYS A 122 14.978 -11.213 -6.746 1.00 0.00 N ATOM 0 H LYS A 122 14.744 -8.804 -3.231 1.00 0.00 H new ATOM 0 HA LYS A 122 12.693 -7.732 -4.977 1.00 0.00 H new ATOM 0 HB2 LYS A 122 14.092 -10.062 -4.880 1.00 0.00 H new ATOM 0 HB3 LYS A 122 12.680 -10.544 -3.960 1.00 0.00 H new ATOM 0 HG2 LYS A 122 12.025 -11.128 -6.100 1.00 0.00 H new ATOM 0 HG3 LYS A 122 11.331 -9.524 -5.976 1.00 0.00 H new ATOM 0 HD2 LYS A 122 12.401 -9.308 -8.013 1.00 0.00 H new ATOM 0 HD3 LYS A 122 13.691 -8.764 -6.958 1.00 0.00 H new ATOM 0 HE2 LYS A 122 13.365 -11.586 -8.063 1.00 0.00 H new ATOM 0 HE3 LYS A 122 14.509 -10.390 -8.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 15.538 -11.992 -7.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 15.610 -10.428 -6.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 14.481 -11.547 -5.896 1.00 0.00 H new ATOM 2024 N LEU A 123 10.789 -7.535 -3.393 1.00 0.00 N ATOM 2025 CA LEU A 123 9.685 -7.347 -2.459 1.00 0.00 C ATOM 2026 C LEU A 123 8.600 -8.396 -2.689 1.00 0.00 C ATOM 2027 O LEU A 123 7.942 -8.405 -3.730 1.00 0.00 O ATOM 2028 CB LEU A 123 9.103 -5.939 -2.620 1.00 0.00 C ATOM 2029 CG LEU A 123 10.146 -4.817 -2.686 1.00 0.00 C ATOM 2030 CD1 LEU A 123 9.474 -3.465 -2.839 1.00 0.00 C ATOM 2031 CD2 LEU A 123 11.035 -4.830 -1.452 1.00 0.00 C ATOM 0 H LEU A 123 10.719 -6.978 -4.245 1.00 0.00 H new ATOM 0 HA LEU A 123 10.063 -7.464 -1.443 1.00 0.00 H new ATOM 0 HB2 LEU A 123 8.502 -5.911 -3.529 1.00 0.00 H new ATOM 0 HB3 LEU A 123 8.430 -5.742 -1.786 1.00 0.00 H new ATOM 0 HG LEU A 123 10.772 -4.992 -3.561 1.00 0.00 H new ATOM 0 HD11 LEU A 123 10.233 -2.684 -2.884 1.00 0.00 H new ATOM 0 HD12 LEU A 123 8.886 -3.453 -3.757 1.00 0.00 H new ATOM 0 HD13 LEU A 123 8.819 -3.286 -1.986 1.00 0.00 H new ATOM 0 HD21 LEU A 123 11.767 -4.025 -1.522 1.00 0.00 H new ATOM 0 HD22 LEU A 123 10.423 -4.688 -0.561 1.00 0.00 H new ATOM 0 HD23 LEU A 123 11.553 -5.787 -1.387 1.00 0.00 H new ATOM 2043 N VAL A 124 8.425 -9.285 -1.720 1.00 0.00 N ATOM 2044 CA VAL A 124 7.458 -10.367 -1.837 1.00 0.00 C ATOM 2045 C VAL A 124 6.548 -10.425 -0.612 1.00 0.00 C ATOM 2046 O VAL A 124 7.020 -10.470 0.524 1.00 0.00 O ATOM 2047 CB VAL A 124 8.161 -11.735 -2.001 1.00 0.00 C ATOM 2048 CG1 VAL A 124 7.141 -12.857 -2.131 1.00 0.00 C ATOM 2049 CG2 VAL A 124 9.099 -11.726 -3.200 1.00 0.00 C ATOM 0 H VAL A 124 8.943 -9.277 -0.841 1.00 0.00 H new ATOM 0 HA VAL A 124 6.860 -10.162 -2.725 1.00 0.00 H new ATOM 0 HB VAL A 124 8.755 -11.914 -1.105 1.00 0.00 H new ATOM 0 HG11 VAL A 124 7.660 -13.809 -2.245 1.00 0.00 H new ATOM 0 HG12 VAL A 124 6.518 -12.888 -1.237 1.00 0.00 H new ATOM 0 HG13 VAL A 124 6.513 -12.679 -3.004 1.00 0.00 H new ATOM 0 HG21 VAL A 124 9.580 -12.700 -3.293 1.00 0.00 H new ATOM 0 HG22 VAL A 124 8.530 -11.515 -4.105 1.00 0.00 H new ATOM 0 HG23 VAL A 124 9.859 -10.957 -3.062 1.00 0.00 H new ATOM 2059 N GLU A 125 5.244 -10.421 -0.845 1.00 0.00 N ATOM 2060 CA GLU A 125 4.289 -10.598 0.232 1.00 0.00 C ATOM 2061 C GLU A 125 3.857 -12.054 0.268 1.00 0.00 C ATOM 2062 O GLU A 125 3.483 -12.623 -0.760 1.00 0.00 O ATOM 2063 CB GLU A 125 3.064 -9.697 0.041 1.00 0.00 C ATOM 2064 CG GLU A 125 2.060 -9.805 1.180 1.00 0.00 C ATOM 2065 CD GLU A 125 0.749 -9.107 0.884 1.00 0.00 C ATOM 2066 OE1 GLU A 125 -0.155 -9.756 0.313 1.00 0.00 O ATOM 2067 OE2 GLU A 125 0.612 -7.918 1.233 1.00 0.00 O ATOM 0 H GLU A 125 4.827 -10.297 -1.768 1.00 0.00 H new ATOM 0 HA GLU A 125 4.763 -10.321 1.173 1.00 0.00 H new ATOM 0 HB2 GLU A 125 3.392 -8.662 -0.049 1.00 0.00 H new ATOM 0 HB3 GLU A 125 2.571 -9.958 -0.896 1.00 0.00 H new ATOM 0 HG2 GLU A 125 1.866 -10.857 1.387 1.00 0.00 H new ATOM 0 HG3 GLU A 125 2.496 -9.378 2.083 1.00 0.00 H new ATOM 2074 N HIS A 126 3.924 -12.670 1.433 1.00 0.00 N ATOM 2075 CA HIS A 126 3.512 -14.054 1.553 1.00 0.00 C ATOM 2076 C HIS A 126 2.041 -14.108 1.925 1.00 0.00 C ATOM 2077 O HIS A 126 1.683 -14.350 3.076 1.00 0.00 O ATOM 2078 CB HIS A 126 4.377 -14.788 2.590 1.00 0.00 C ATOM 2079 CG HIS A 126 3.960 -16.208 2.848 1.00 0.00 C ATOM 2080 ND1 HIS A 126 3.704 -17.116 1.845 1.00 0.00 N ATOM 2081 CD2 HIS A 126 3.744 -16.867 4.010 1.00 0.00 C ATOM 2082 CE1 HIS A 126 3.354 -18.268 2.377 1.00 0.00 C ATOM 2083 NE2 HIS A 126 3.368 -18.146 3.689 1.00 0.00 N ATOM 0 H HIS A 126 4.255 -12.241 2.297 1.00 0.00 H new ATOM 0 HA HIS A 126 3.651 -14.559 0.597 1.00 0.00 H new ATOM 0 HB2 HIS A 126 5.413 -14.782 2.252 1.00 0.00 H new ATOM 0 HB3 HIS A 126 4.345 -14.236 3.529 1.00 0.00 H new ATOM 0 HD1 HIS A 126 3.775 -16.926 0.845 1.00 0.00 H new ATOM 0 HD2 HIS A 126 3.848 -16.461 5.005 1.00 0.00 H new ATOM 0 HE1 HIS A 126 3.098 -19.163 1.830 1.00 0.00 H new ATOM 0 HE2 HIS A 126 3.137 -18.882 4.356 1.00 0.00 H new ATOM 2092 N THR A 127 1.194 -13.881 0.938 1.00 0.00 N ATOM 2093 CA THR A 127 -0.236 -13.853 1.152 1.00 0.00 C ATOM 2094 C THR A 127 -0.772 -15.273 1.269 1.00 0.00 C ATOM 2095 O THR A 127 -1.190 -15.870 0.287 1.00 0.00 O ATOM 2096 CB THR A 127 -0.942 -13.118 -0.001 1.00 0.00 C ATOM 2097 OG1 THR A 127 -0.018 -12.222 -0.635 1.00 0.00 O ATOM 2098 CG2 THR A 127 -2.142 -12.332 0.509 1.00 0.00 C ATOM 0 H THR A 127 1.478 -13.712 -0.027 1.00 0.00 H new ATOM 0 HA THR A 127 -0.437 -13.317 2.079 1.00 0.00 H new ATOM 0 HB THR A 127 -1.294 -13.859 -0.719 1.00 0.00 H new ATOM 0 HG1 THR A 127 -0.248 -11.298 -0.404 1.00 0.00 H new ATOM 0 HG21 THR A 127 -2.624 -11.822 -0.325 1.00 0.00 H new ATOM 0 HG22 THR A 127 -2.852 -13.014 0.976 1.00 0.00 H new ATOM 0 HG23 THR A 127 -1.810 -11.596 1.242 1.00 0.00 H new ATOM 2106 N GLU A 128 -0.728 -15.813 2.477 1.00 0.00 N ATOM 2107 CA GLU A 128 -1.110 -17.200 2.714 1.00 0.00 C ATOM 2108 C GLU A 128 -2.630 -17.352 2.707 1.00 0.00 C ATOM 2109 O GLU A 128 -3.161 -18.454 2.553 1.00 0.00 O ATOM 2110 CB GLU A 128 -0.539 -17.669 4.054 1.00 0.00 C ATOM 2111 CG GLU A 128 -0.576 -19.175 4.244 1.00 0.00 C ATOM 2112 CD GLU A 128 0.789 -19.813 4.113 1.00 0.00 C ATOM 2113 OE1 GLU A 128 1.587 -19.736 5.074 1.00 0.00 O ATOM 2114 OE2 GLU A 128 1.081 -20.390 3.051 1.00 0.00 O ATOM 0 H GLU A 128 -0.430 -15.311 3.313 1.00 0.00 H new ATOM 0 HA GLU A 128 -0.703 -17.817 1.913 1.00 0.00 H new ATOM 0 HB2 GLU A 128 0.493 -17.327 4.138 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -1.098 -17.197 4.862 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -0.986 -19.403 5.228 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -1.250 -19.614 3.508 1.00 0.00 H new ATOM 2121 N ASN A 129 -3.326 -16.236 2.873 1.00 0.00 N ATOM 2122 CA ASN A 129 -4.782 -16.246 2.954 1.00 0.00 C ATOM 2123 C ASN A 129 -5.423 -16.077 1.579 1.00 0.00 C ATOM 2124 O ASN A 129 -6.508 -16.599 1.321 1.00 0.00 O ATOM 2125 CB ASN A 129 -5.258 -15.136 3.902 1.00 0.00 C ATOM 2126 CG ASN A 129 -6.772 -15.037 3.992 1.00 0.00 C ATOM 2127 OD1 ASN A 129 -7.406 -15.768 4.751 1.00 0.00 O ATOM 2128 ND2 ASN A 129 -7.356 -14.106 3.248 1.00 0.00 N ATOM 0 H ASN A 129 -2.906 -15.310 2.954 1.00 0.00 H new ATOM 0 HA ASN A 129 -5.092 -17.215 3.345 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -4.852 -15.318 4.897 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -4.857 -14.181 3.564 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -8.367 -13.977 3.293 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -6.794 -13.520 2.631 1.00 0.00 H new ATOM 2135 N ASP A 130 -4.740 -15.372 0.686 1.00 0.00 N ATOM 2136 CA ASP A 130 -5.325 -15.015 -0.602 1.00 0.00 C ATOM 2137 C ASP A 130 -4.263 -15.010 -1.697 1.00 0.00 C ATOM 2138 O ASP A 130 -3.146 -14.551 -1.479 1.00 0.00 O ATOM 2139 CB ASP A 130 -5.975 -13.630 -0.498 1.00 0.00 C ATOM 2140 CG ASP A 130 -6.918 -13.327 -1.646 1.00 0.00 C ATOM 2141 OD1 ASP A 130 -6.472 -13.312 -2.804 1.00 0.00 O ATOM 2142 OD2 ASP A 130 -8.116 -13.084 -1.385 1.00 0.00 O ATOM 0 H ASP A 130 -3.787 -15.038 0.827 1.00 0.00 H new ATOM 0 HA ASP A 130 -6.080 -15.757 -0.863 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -6.523 -13.562 0.442 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -5.194 -12.870 -0.467 1.00 0.00 H new ATOM 2147 N ALA A 131 -4.606 -15.526 -2.867 1.00 0.00 N ATOM 2148 CA ALA A 131 -3.694 -15.509 -4.001 1.00 0.00 C ATOM 2149 C ALA A 131 -4.053 -14.365 -4.948 1.00 0.00 C ATOM 2150 O ALA A 131 -4.813 -14.552 -5.903 1.00 0.00 O ATOM 2151 CB ALA A 131 -3.733 -16.840 -4.739 1.00 0.00 C ATOM 0 H ALA A 131 -5.509 -15.962 -3.057 1.00 0.00 H new ATOM 0 HA ALA A 131 -2.681 -15.352 -3.630 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -3.045 -16.808 -5.584 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -3.438 -17.641 -4.061 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.744 -17.025 -5.102 1.00 0.00 H new ATOM 2157 N TYR A 132 -3.526 -13.178 -4.668 1.00 0.00 N ATOM 2158 CA TYR A 132 -3.844 -11.995 -5.464 1.00 0.00 C ATOM 2159 C TYR A 132 -2.689 -10.994 -5.441 1.00 0.00 C ATOM 2160 O TYR A 132 -2.429 -10.309 -6.435 1.00 0.00 O ATOM 2161 CB TYR A 132 -5.112 -11.329 -4.909 1.00 0.00 C ATOM 2162 CG TYR A 132 -5.846 -10.423 -5.883 1.00 0.00 C ATOM 2163 CD1 TYR A 132 -5.276 -9.246 -6.355 1.00 0.00 C ATOM 2164 CD2 TYR A 132 -7.127 -10.743 -6.313 1.00 0.00 C ATOM 2165 CE1 TYR A 132 -5.962 -8.418 -7.225 1.00 0.00 C ATOM 2166 CE2 TYR A 132 -7.817 -9.921 -7.183 1.00 0.00 C ATOM 2167 CZ TYR A 132 -7.230 -8.762 -7.636 1.00 0.00 C ATOM 2168 OH TYR A 132 -7.917 -7.941 -8.501 1.00 0.00 O ATOM 0 H TYR A 132 -2.878 -13.008 -3.898 1.00 0.00 H new ATOM 0 HA TYR A 132 -4.009 -12.307 -6.495 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -5.797 -12.109 -4.576 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -4.841 -10.746 -4.029 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -4.281 -8.974 -6.037 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -7.593 -11.652 -5.961 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -5.505 -7.506 -7.580 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -8.813 -10.187 -7.506 1.00 0.00 H new ATOM 0 HH TYR A 132 -8.694 -8.419 -8.858 1.00 0.00 H new ATOM 2178 N TRP A 133 -1.998 -10.909 -4.306 1.00 0.00 N ATOM 2179 CA TRP A 133 -0.986 -9.875 -4.113 1.00 0.00 C ATOM 2180 C TRP A 133 0.413 -10.453 -3.871 1.00 0.00 C ATOM 2181 O TRP A 133 1.379 -9.702 -3.727 1.00 0.00 O ATOM 2182 CB TRP A 133 -1.370 -8.984 -2.928 1.00 0.00 C ATOM 2183 CG TRP A 133 -2.737 -8.368 -3.030 1.00 0.00 C ATOM 2184 CD1 TRP A 133 -3.810 -8.635 -2.230 1.00 0.00 C ATOM 2185 CD2 TRP A 133 -3.178 -7.387 -3.980 1.00 0.00 C ATOM 2186 NE1 TRP A 133 -4.889 -7.875 -2.616 1.00 0.00 N ATOM 2187 CE2 TRP A 133 -4.528 -7.103 -3.689 1.00 0.00 C ATOM 2188 CE3 TRP A 133 -2.567 -6.719 -5.046 1.00 0.00 C ATOM 2189 CZ2 TRP A 133 -5.271 -6.180 -4.423 1.00 0.00 C ATOM 2190 CZ3 TRP A 133 -3.307 -5.806 -5.774 1.00 0.00 C ATOM 2191 CH2 TRP A 133 -4.646 -5.545 -5.461 1.00 0.00 C ATOM 0 H TRP A 133 -2.119 -11.538 -3.513 1.00 0.00 H new ATOM 0 HA TRP A 133 -0.950 -9.294 -5.035 1.00 0.00 H new ATOM 0 HB2 TRP A 133 -1.319 -9.575 -2.014 1.00 0.00 H new ATOM 0 HB3 TRP A 133 -0.632 -8.187 -2.834 1.00 0.00 H new ATOM 0 HD1 TRP A 133 -3.811 -9.341 -1.412 1.00 0.00 H new ATOM 0 HE1 TRP A 133 -5.809 -7.884 -2.175 1.00 0.00 H new ATOM 0 HE3 TRP A 133 -1.534 -6.913 -5.296 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -6.303 -5.974 -4.181 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 -2.844 -5.285 -6.599 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -5.197 -4.828 -6.051 1.00 0.00 H new ATOM 2202 N GLY A 134 0.545 -11.772 -3.859 1.00 0.00 N ATOM 2203 CA GLY A 134 1.812 -12.363 -3.468 1.00 0.00 C ATOM 2204 C GLY A 134 2.025 -13.746 -4.039 1.00 0.00 C ATOM 2205 O GLY A 134 2.047 -13.929 -5.253 1.00 0.00 O ATOM 0 H GLY A 134 -0.188 -12.436 -4.108 1.00 0.00 H new ATOM 0 HA2 GLY A 134 2.624 -11.713 -3.794 1.00 0.00 H new ATOM 0 HA3 GLY A 134 1.861 -12.414 -2.380 1.00 0.00 H new ATOM 2209 N ASP A 135 2.205 -14.724 -3.165 1.00 0.00 N ATOM 2210 CA ASP A 135 2.415 -16.099 -3.607 1.00 0.00 C ATOM 2211 C ASP A 135 1.162 -16.943 -3.372 1.00 0.00 C ATOM 2212 O ASP A 135 1.067 -18.081 -3.838 1.00 0.00 O ATOM 2213 CB ASP A 135 3.612 -16.727 -2.891 1.00 0.00 C ATOM 2214 CG ASP A 135 3.260 -17.244 -1.517 1.00 0.00 C ATOM 2215 OD1 ASP A 135 3.196 -16.433 -0.574 1.00 0.00 O ATOM 2216 OD2 ASP A 135 3.032 -18.463 -1.384 1.00 0.00 O ATOM 0 H ASP A 135 2.210 -14.596 -2.153 1.00 0.00 H new ATOM 0 HA ASP A 135 2.624 -16.075 -4.676 1.00 0.00 H new ATOM 0 HB2 ASP A 135 4.003 -17.546 -3.494 1.00 0.00 H new ATOM 0 HB3 ASP A 135 4.408 -15.987 -2.804 1.00 0.00 H new ATOM 2221 N GLY A 136 0.207 -16.383 -2.642 1.00 0.00 N ATOM 2222 CA GLY A 136 -1.075 -17.042 -2.456 1.00 0.00 C ATOM 2223 C GLY A 136 -1.008 -18.248 -1.540 1.00 0.00 C ATOM 2224 O GLY A 136 -1.958 -19.025 -1.462 1.00 0.00 O ATOM 0 H GLY A 136 0.296 -15.481 -2.173 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -1.787 -16.325 -2.048 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -1.458 -17.354 -3.427 1.00 0.00 H new ATOM 2228 N GLY A 137 0.105 -18.399 -0.841 1.00 0.00 N ATOM 2229 CA GLY A 137 0.285 -19.538 0.037 1.00 0.00 C ATOM 2230 C GLY A 137 0.699 -20.797 -0.706 1.00 0.00 C ATOM 2231 O GLY A 137 0.543 -21.908 -0.190 1.00 0.00 O ATOM 0 H GLY A 137 0.892 -17.750 -0.865 1.00 0.00 H new ATOM 0 HA2 GLY A 137 1.041 -19.298 0.785 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -0.645 -19.728 0.573 1.00 0.00 H new ATOM 2235 N HIS A 138 1.223 -20.633 -1.918 1.00 0.00 N ATOM 2236 CA HIS A 138 1.667 -21.776 -2.719 1.00 0.00 C ATOM 2237 C HIS A 138 2.586 -21.352 -3.867 1.00 0.00 C ATOM 2238 O HIS A 138 2.772 -22.103 -4.824 1.00 0.00 O ATOM 2239 CB HIS A 138 0.469 -22.575 -3.265 1.00 0.00 C ATOM 2240 CG HIS A 138 -0.582 -21.747 -3.941 1.00 0.00 C ATOM 2241 ND1 HIS A 138 -1.734 -21.226 -3.461 1.00 0.00 N flip ATOM 2242 CD2 HIS A 138 -0.513 -21.360 -5.259 1.00 0.00 C flip ATOM 2243 CE1 HIS A 138 -2.335 -20.539 -4.484 1.00 0.00 C flip ATOM 2244 NE2 HIS A 138 -1.573 -20.631 -5.557 1.00 0.00 N flip ATOM 0 H HIS A 138 1.351 -19.726 -2.367 1.00 0.00 H new ATOM 0 HA HIS A 138 2.241 -22.420 -2.053 1.00 0.00 H new ATOM 0 HB2 HIS A 138 0.838 -23.318 -3.973 1.00 0.00 H new ATOM 0 HB3 HIS A 138 0.008 -23.120 -2.441 1.00 0.00 H new ATOM 0 HD2 HIS A 138 0.283 -21.613 -5.943 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -3.275 -20.011 -4.422 1.00 0.00 H new ATOM 0 HE2 HIS A 138 -1.770 -20.210 -6.465 1.00 0.00 H new ATOM 2253 N GLY A 139 3.168 -20.160 -3.773 1.00 0.00 N ATOM 2254 CA GLY A 139 4.151 -19.734 -4.763 1.00 0.00 C ATOM 2255 C GLY A 139 3.548 -19.216 -6.063 1.00 0.00 C ATOM 2256 O GLY A 139 4.279 -18.818 -6.970 1.00 0.00 O ATOM 0 H GLY A 139 2.980 -19.482 -3.034 1.00 0.00 H new ATOM 0 HA2 GLY A 139 4.772 -18.952 -4.327 1.00 0.00 H new ATOM 0 HA3 GLY A 139 4.808 -20.574 -4.990 1.00 0.00 H new ATOM 2260 N LYS A 140 2.225 -19.213 -6.165 1.00 0.00 N ATOM 2261 CA LYS A 140 1.550 -18.766 -7.385 1.00 0.00 C ATOM 2262 C LYS A 140 0.338 -17.913 -7.031 1.00 0.00 C ATOM 2263 O LYS A 140 -0.801 -18.345 -7.170 1.00 0.00 O ATOM 2264 CB LYS A 140 1.112 -19.962 -8.246 1.00 0.00 C ATOM 2265 CG LYS A 140 2.246 -20.896 -8.635 1.00 0.00 C ATOM 2266 CD LYS A 140 1.768 -22.004 -9.558 1.00 0.00 C ATOM 2267 CE LYS A 140 2.873 -23.009 -9.845 1.00 0.00 C ATOM 2268 NZ LYS A 140 4.073 -22.368 -10.451 1.00 0.00 N ATOM 0 H LYS A 140 1.596 -19.514 -5.421 1.00 0.00 H new ATOM 0 HA LYS A 140 2.256 -18.169 -7.962 1.00 0.00 H new ATOM 0 HB2 LYS A 140 0.358 -20.531 -7.702 1.00 0.00 H new ATOM 0 HB3 LYS A 140 0.636 -19.588 -9.153 1.00 0.00 H new ATOM 0 HG2 LYS A 140 3.034 -20.326 -9.127 1.00 0.00 H new ATOM 0 HG3 LYS A 140 2.682 -21.333 -7.737 1.00 0.00 H new ATOM 0 HD2 LYS A 140 0.919 -22.515 -9.104 1.00 0.00 H new ATOM 0 HD3 LYS A 140 1.416 -21.572 -10.495 1.00 0.00 H new ATOM 0 HE2 LYS A 140 3.158 -23.507 -8.918 1.00 0.00 H new ATOM 0 HE3 LYS A 140 2.496 -23.779 -10.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 4.736 -23.103 -10.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 3.783 -21.788 -11.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 4.539 -21.764 -9.744 1.00 0.00 H new ATOM 2282 N GLY A 141 0.591 -16.706 -6.558 1.00 0.00 N ATOM 2283 CA GLY A 141 -0.476 -15.876 -6.044 1.00 0.00 C ATOM 2284 C GLY A 141 -0.494 -14.485 -6.630 1.00 0.00 C ATOM 2285 O GLY A 141 -1.114 -13.592 -6.062 1.00 0.00 O ATOM 0 H GLY A 141 1.519 -16.284 -6.520 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -1.431 -16.359 -6.247 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -0.379 -15.804 -4.961 1.00 0.00 H new ATOM 2289 N LYS A 142 0.231 -14.292 -7.730 1.00 0.00 N ATOM 2290 CA LYS A 142 0.285 -12.998 -8.405 1.00 0.00 C ATOM 2291 C LYS A 142 1.020 -11.969 -7.537 1.00 0.00 C ATOM 2292 O LYS A 142 0.418 -11.142 -6.858 1.00 0.00 O ATOM 2293 CB LYS A 142 -1.134 -12.541 -8.782 1.00 0.00 C ATOM 2294 CG LYS A 142 -1.208 -11.237 -9.555 1.00 0.00 C ATOM 2295 CD LYS A 142 -2.500 -11.167 -10.354 1.00 0.00 C ATOM 2296 CE LYS A 142 -2.788 -9.764 -10.857 1.00 0.00 C ATOM 2297 NZ LYS A 142 -3.409 -8.926 -9.800 1.00 0.00 N ATOM 0 H LYS A 142 0.791 -15.019 -8.174 1.00 0.00 H new ATOM 0 HA LYS A 142 0.853 -13.095 -9.330 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -1.605 -13.324 -9.376 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -1.720 -12.437 -7.869 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -1.153 -10.395 -8.866 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -0.353 -11.156 -10.226 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -2.438 -11.849 -11.202 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -3.329 -11.505 -9.732 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -1.861 -9.299 -11.194 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -3.452 -9.814 -11.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -4.020 -8.208 -10.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -3.979 -9.527 -9.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -2.664 -8.455 -9.248 1.00 0.00 H new ATOM 2311 N ASN A 143 2.343 -12.051 -7.593 1.00 0.00 N ATOM 2312 CA ASN A 143 3.262 -11.230 -6.796 1.00 0.00 C ATOM 2313 C ASN A 143 3.246 -9.774 -7.271 1.00 0.00 C ATOM 2314 O ASN A 143 4.027 -8.948 -6.806 1.00 0.00 O ATOM 2315 CB ASN A 143 4.678 -11.821 -6.911 1.00 0.00 C ATOM 2316 CG ASN A 143 5.603 -11.506 -5.737 1.00 0.00 C ATOM 2317 OD1 ASN A 143 6.443 -12.326 -5.374 1.00 0.00 O ATOM 2318 ND2 ASN A 143 5.491 -10.323 -5.159 1.00 0.00 N ATOM 0 H ASN A 143 2.825 -12.706 -8.209 1.00 0.00 H new ATOM 0 HA ASN A 143 2.943 -11.238 -5.754 1.00 0.00 H new ATOM 0 HB2 ASN A 143 4.597 -12.903 -7.011 1.00 0.00 H new ATOM 0 HB3 ASN A 143 5.138 -11.450 -7.827 1.00 0.00 H new ATOM 0 HD21 ASN A 143 6.112 -10.070 -4.390 1.00 0.00 H new ATOM 0 HD22 ASN A 143 4.784 -9.663 -5.482 1.00 0.00 H new ATOM 2325 N ARG A 144 2.355 -9.480 -8.213 1.00 0.00 N ATOM 2326 CA ARG A 144 2.258 -8.163 -8.840 1.00 0.00 C ATOM 2327 C ARG A 144 2.251 -7.023 -7.816 1.00 0.00 C ATOM 2328 O ARG A 144 2.676 -5.916 -8.129 1.00 0.00 O ATOM 2329 CB ARG A 144 0.997 -8.093 -9.703 1.00 0.00 C ATOM 2330 CG ARG A 144 0.988 -6.940 -10.696 1.00 0.00 C ATOM 2331 CD ARG A 144 -0.284 -6.950 -11.524 1.00 0.00 C ATOM 2332 NE ARG A 144 -0.211 -6.061 -12.679 1.00 0.00 N ATOM 2333 CZ ARG A 144 -0.749 -6.348 -13.863 1.00 0.00 C ATOM 2334 NH1 ARG A 144 -1.297 -7.539 -14.069 1.00 0.00 N ATOM 2335 NH2 ARG A 144 -0.703 -5.466 -14.853 1.00 0.00 N ATOM 0 H ARG A 144 1.674 -10.153 -8.566 1.00 0.00 H new ATOM 0 HA ARG A 144 3.145 -8.034 -9.460 1.00 0.00 H new ATOM 0 HB2 ARG A 144 0.891 -9.030 -10.250 1.00 0.00 H new ATOM 0 HB3 ARG A 144 0.128 -8.004 -9.051 1.00 0.00 H new ATOM 0 HG2 ARG A 144 1.072 -5.994 -10.162 1.00 0.00 H new ATOM 0 HG3 ARG A 144 1.855 -7.013 -11.353 1.00 0.00 H new ATOM 0 HD2 ARG A 144 -0.483 -7.966 -11.865 1.00 0.00 H new ATOM 0 HD3 ARG A 144 -1.124 -6.654 -10.896 1.00 0.00 H new ATOM 0 HE ARG A 144 0.278 -5.172 -12.574 1.00 0.00 H new ATOM 0 HH11 ARG A 144 -1.306 -8.233 -13.321 1.00 0.00 H new ATOM 0 HH12 ARG A 144 -1.710 -7.761 -14.975 1.00 0.00 H new ATOM 0 HH21 ARG A 144 -0.254 -4.562 -14.710 1.00 0.00 H new ATOM 0 HH22 ARG A 144 -1.117 -5.692 -15.757 1.00 0.00 H new ATOM 2349 N LEU A 145 1.790 -7.291 -6.593 1.00 0.00 N ATOM 2350 CA LEU A 145 1.789 -6.261 -5.546 1.00 0.00 C ATOM 2351 C LEU A 145 3.219 -5.856 -5.208 1.00 0.00 C ATOM 2352 O LEU A 145 3.547 -4.670 -5.151 1.00 0.00 O ATOM 2353 CB LEU A 145 1.093 -6.742 -4.273 1.00 0.00 C ATOM 2354 CG LEU A 145 1.018 -5.698 -3.152 1.00 0.00 C ATOM 2355 CD1 LEU A 145 0.048 -4.588 -3.518 1.00 0.00 C ATOM 2356 CD2 LEU A 145 0.626 -6.341 -1.831 1.00 0.00 C ATOM 0 H LEU A 145 1.418 -8.196 -6.303 1.00 0.00 H new ATOM 0 HA LEU A 145 1.238 -5.405 -5.936 1.00 0.00 H new ATOM 0 HB2 LEU A 145 0.081 -7.058 -4.525 1.00 0.00 H new ATOM 0 HB3 LEU A 145 1.617 -7.621 -3.898 1.00 0.00 H new ATOM 0 HG LEU A 145 2.010 -5.262 -3.031 1.00 0.00 H new ATOM 0 HD11 LEU A 145 0.009 -3.858 -2.710 1.00 0.00 H new ATOM 0 HD12 LEU A 145 0.383 -4.099 -4.433 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -0.945 -5.009 -3.674 1.00 0.00 H new ATOM 0 HD21 LEU A 145 0.581 -5.578 -1.054 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -0.351 -6.814 -1.932 1.00 0.00 H new ATOM 0 HD23 LEU A 145 1.367 -7.093 -1.558 1.00 0.00 H new ATOM 2368 N GLY A 146 4.066 -6.855 -4.988 1.00 0.00 N ATOM 2369 CA GLY A 146 5.462 -6.601 -4.721 1.00 0.00 C ATOM 2370 C GLY A 146 6.150 -5.977 -5.912 1.00 0.00 C ATOM 2371 O GLY A 146 7.101 -5.220 -5.757 1.00 0.00 O ATOM 0 H GLY A 146 3.805 -7.841 -4.991 1.00 0.00 H new ATOM 0 HA2 GLY A 146 5.554 -5.940 -3.859 1.00 0.00 H new ATOM 0 HA3 GLY A 146 5.959 -7.535 -4.461 1.00 0.00 H new ATOM 2375 N TYR A 147 5.657 -6.287 -7.107 1.00 0.00 N ATOM 2376 CA TYR A 147 6.181 -5.690 -8.327 1.00 0.00 C ATOM 2377 C TYR A 147 5.795 -4.212 -8.397 1.00 0.00 C ATOM 2378 O TYR A 147 6.592 -3.375 -8.823 1.00 0.00 O ATOM 2379 CB TYR A 147 5.669 -6.436 -9.563 1.00 0.00 C ATOM 2380 CG TYR A 147 6.193 -5.870 -10.862 1.00 0.00 C ATOM 2381 CD1 TYR A 147 7.487 -6.141 -11.284 1.00 0.00 C ATOM 2382 CD2 TYR A 147 5.399 -5.058 -11.660 1.00 0.00 C ATOM 2383 CE1 TYR A 147 7.978 -5.617 -12.462 1.00 0.00 C ATOM 2384 CE2 TYR A 147 5.881 -4.528 -12.840 1.00 0.00 C ATOM 2385 CZ TYR A 147 7.171 -4.809 -13.239 1.00 0.00 C ATOM 2386 OH TYR A 147 7.654 -4.279 -14.416 1.00 0.00 O ATOM 0 H TYR A 147 4.895 -6.949 -7.255 1.00 0.00 H new ATOM 0 HA TYR A 147 7.268 -5.770 -8.310 1.00 0.00 H new ATOM 0 HB2 TYR A 147 5.955 -7.485 -9.490 1.00 0.00 H new ATOM 0 HB3 TYR A 147 4.580 -6.403 -9.573 1.00 0.00 H new ATOM 0 HD1 TYR A 147 8.121 -6.773 -10.680 1.00 0.00 H new ATOM 0 HD2 TYR A 147 4.387 -4.837 -11.353 1.00 0.00 H new ATOM 0 HE1 TYR A 147 8.988 -5.837 -12.775 1.00 0.00 H new ATOM 0 HE2 TYR A 147 5.251 -3.896 -13.448 1.00 0.00 H new ATOM 0 HH TYR A 147 7.872 -3.333 -14.284 1.00 0.00 H new ATOM 2396 N LEU A 148 4.573 -3.900 -7.969 1.00 0.00 N ATOM 2397 CA LEU A 148 4.123 -2.514 -7.875 1.00 0.00 C ATOM 2398 C LEU A 148 5.052 -1.739 -6.952 1.00 0.00 C ATOM 2399 O LEU A 148 5.549 -0.668 -7.299 1.00 0.00 O ATOM 2400 CB LEU A 148 2.688 -2.439 -7.334 1.00 0.00 C ATOM 2401 CG LEU A 148 1.618 -3.141 -8.175 1.00 0.00 C ATOM 2402 CD1 LEU A 148 0.273 -3.100 -7.466 1.00 0.00 C ATOM 2403 CD2 LEU A 148 1.511 -2.505 -9.551 1.00 0.00 C ATOM 0 H LEU A 148 3.878 -4.589 -7.682 1.00 0.00 H new ATOM 0 HA LEU A 148 4.141 -2.077 -8.874 1.00 0.00 H new ATOM 0 HB2 LEU A 148 2.675 -2.869 -6.332 1.00 0.00 H new ATOM 0 HB3 LEU A 148 2.413 -1.389 -7.234 1.00 0.00 H new ATOM 0 HG LEU A 148 1.913 -4.183 -8.302 1.00 0.00 H new ATOM 0 HD11 LEU A 148 -0.476 -3.603 -8.077 1.00 0.00 H new ATOM 0 HD12 LEU A 148 0.354 -3.604 -6.503 1.00 0.00 H new ATOM 0 HD13 LEU A 148 -0.024 -2.063 -7.309 1.00 0.00 H new ATOM 0 HD21 LEU A 148 0.745 -3.020 -10.131 1.00 0.00 H new ATOM 0 HD22 LEU A 148 1.242 -1.454 -9.446 1.00 0.00 H new ATOM 0 HD23 LEU A 148 2.469 -2.585 -10.064 1.00 0.00 H new ATOM 2415 N LEU A 149 5.292 -2.309 -5.777 1.00 0.00 N ATOM 2416 CA LEU A 149 6.195 -1.715 -4.799 1.00 0.00 C ATOM 2417 C LEU A 149 7.625 -1.690 -5.325 1.00 0.00 C ATOM 2418 O LEU A 149 8.399 -0.796 -4.993 1.00 0.00 O ATOM 2419 CB LEU A 149 6.137 -2.495 -3.484 1.00 0.00 C ATOM 2420 CG LEU A 149 4.810 -2.411 -2.733 1.00 0.00 C ATOM 2421 CD1 LEU A 149 4.826 -3.331 -1.524 1.00 0.00 C ATOM 2422 CD2 LEU A 149 4.533 -0.978 -2.308 1.00 0.00 C ATOM 0 H LEU A 149 4.870 -3.188 -5.477 1.00 0.00 H new ATOM 0 HA LEU A 149 5.875 -0.688 -4.620 1.00 0.00 H new ATOM 0 HB2 LEU A 149 6.352 -3.543 -3.693 1.00 0.00 H new ATOM 0 HB3 LEU A 149 6.929 -2.131 -2.830 1.00 0.00 H new ATOM 0 HG LEU A 149 4.012 -2.734 -3.401 1.00 0.00 H new ATOM 0 HD11 LEU A 149 3.873 -3.259 -1.000 1.00 0.00 H new ATOM 0 HD12 LEU A 149 4.984 -4.359 -1.851 1.00 0.00 H new ATOM 0 HD13 LEU A 149 5.633 -3.036 -0.853 1.00 0.00 H new ATOM 0 HD21 LEU A 149 3.584 -0.934 -1.774 1.00 0.00 H new ATOM 0 HD22 LEU A 149 5.334 -0.631 -1.655 1.00 0.00 H new ATOM 0 HD23 LEU A 149 4.483 -0.340 -3.190 1.00 0.00 H new ATOM 2434 N MET A 150 7.965 -2.677 -6.146 1.00 0.00 N ATOM 2435 CA MET A 150 9.295 -2.773 -6.731 1.00 0.00 C ATOM 2436 C MET A 150 9.571 -1.556 -7.606 1.00 0.00 C ATOM 2437 O MET A 150 10.575 -0.864 -7.431 1.00 0.00 O ATOM 2438 CB MET A 150 9.416 -4.044 -7.577 1.00 0.00 C ATOM 2439 CG MET A 150 10.802 -4.661 -7.566 1.00 0.00 C ATOM 2440 SD MET A 150 11.050 -5.776 -6.171 1.00 0.00 S ATOM 2441 CE MET A 150 9.856 -7.054 -6.563 1.00 0.00 C ATOM 0 H MET A 150 7.331 -3.427 -6.423 1.00 0.00 H new ATOM 0 HA MET A 150 10.024 -2.812 -5.922 1.00 0.00 H new ATOM 0 HB2 MET A 150 8.699 -4.780 -7.214 1.00 0.00 H new ATOM 0 HB3 MET A 150 9.141 -3.811 -8.606 1.00 0.00 H new ATOM 0 HG2 MET A 150 10.961 -5.207 -8.496 1.00 0.00 H new ATOM 0 HG3 MET A 150 11.549 -3.868 -7.530 1.00 0.00 H new ATOM 0 HE1 MET A 150 10.026 -7.919 -5.923 1.00 0.00 H new ATOM 0 HE2 MET A 150 8.848 -6.673 -6.398 1.00 0.00 H new ATOM 0 HE3 MET A 150 9.967 -7.348 -7.607 1.00 0.00 H new ATOM 2451 N GLU A 151 8.659 -1.292 -8.537 1.00 0.00 N ATOM 2452 CA GLU A 151 8.796 -0.154 -9.434 1.00 0.00 C ATOM 2453 C GLU A 151 8.617 1.151 -8.672 1.00 0.00 C ATOM 2454 O GLU A 151 9.254 2.151 -8.993 1.00 0.00 O ATOM 2455 CB GLU A 151 7.792 -0.234 -10.582 1.00 0.00 C ATOM 2456 CG GLU A 151 7.966 -1.462 -11.458 1.00 0.00 C ATOM 2457 CD GLU A 151 7.141 -1.394 -12.726 1.00 0.00 C ATOM 2458 OE1 GLU A 151 5.925 -1.143 -12.636 1.00 0.00 O ATOM 2459 OE2 GLU A 151 7.706 -1.608 -13.821 1.00 0.00 O ATOM 0 H GLU A 151 7.819 -1.851 -8.688 1.00 0.00 H new ATOM 0 HA GLU A 151 9.801 -0.181 -9.856 1.00 0.00 H new ATOM 0 HB2 GLU A 151 6.782 -0.231 -10.171 1.00 0.00 H new ATOM 0 HB3 GLU A 151 7.887 0.659 -11.200 1.00 0.00 H new ATOM 0 HG2 GLU A 151 9.019 -1.571 -11.719 1.00 0.00 H new ATOM 0 HG3 GLU A 151 7.684 -2.350 -10.893 1.00 0.00 H new ATOM 2466 N LEU A 152 7.752 1.134 -7.664 1.00 0.00 N ATOM 2467 CA LEU A 152 7.564 2.290 -6.793 1.00 0.00 C ATOM 2468 C LEU A 152 8.872 2.631 -6.086 1.00 0.00 C ATOM 2469 O LEU A 152 9.283 3.789 -6.036 1.00 0.00 O ATOM 2470 CB LEU A 152 6.467 2.004 -5.761 1.00 0.00 C ATOM 2471 CG LEU A 152 6.180 3.140 -4.776 1.00 0.00 C ATOM 2472 CD1 LEU A 152 5.716 4.384 -5.514 1.00 0.00 C ATOM 2473 CD2 LEU A 152 5.140 2.708 -3.752 1.00 0.00 C ATOM 0 H LEU A 152 7.168 0.331 -7.429 1.00 0.00 H new ATOM 0 HA LEU A 152 7.259 3.141 -7.402 1.00 0.00 H new ATOM 0 HB2 LEU A 152 5.546 1.765 -6.292 1.00 0.00 H new ATOM 0 HB3 LEU A 152 6.748 1.116 -5.194 1.00 0.00 H new ATOM 0 HG LEU A 152 7.104 3.379 -4.249 1.00 0.00 H new ATOM 0 HD11 LEU A 152 5.517 5.180 -4.796 1.00 0.00 H new ATOM 0 HD12 LEU A 152 6.493 4.706 -6.208 1.00 0.00 H new ATOM 0 HD13 LEU A 152 4.805 4.159 -6.068 1.00 0.00 H new ATOM 0 HD21 LEU A 152 4.948 3.528 -3.060 1.00 0.00 H new ATOM 0 HD22 LEU A 152 4.215 2.441 -4.263 1.00 0.00 H new ATOM 0 HD23 LEU A 152 5.511 1.845 -3.199 1.00 0.00 H new ATOM 2485 N ARG A 153 9.524 1.607 -5.556 1.00 0.00 N ATOM 2486 CA ARG A 153 10.811 1.767 -4.897 1.00 0.00 C ATOM 2487 C ARG A 153 11.843 2.362 -5.849 1.00 0.00 C ATOM 2488 O ARG A 153 12.516 3.337 -5.522 1.00 0.00 O ATOM 2489 CB ARG A 153 11.294 0.414 -4.360 1.00 0.00 C ATOM 2490 CG ARG A 153 12.743 0.414 -3.901 1.00 0.00 C ATOM 2491 CD ARG A 153 13.128 -0.893 -3.217 1.00 0.00 C ATOM 2492 NE ARG A 153 12.852 -2.081 -4.034 1.00 0.00 N ATOM 2493 CZ ARG A 153 13.576 -2.465 -5.091 1.00 0.00 C ATOM 2494 NH1 ARG A 153 14.558 -1.701 -5.556 1.00 0.00 N ATOM 2495 NH2 ARG A 153 13.313 -3.615 -5.692 1.00 0.00 N ATOM 0 H ARG A 153 9.178 0.647 -5.570 1.00 0.00 H new ATOM 0 HA ARG A 153 10.688 2.458 -4.063 1.00 0.00 H new ATOM 0 HB2 ARG A 153 10.659 0.118 -3.525 1.00 0.00 H new ATOM 0 HB3 ARG A 153 11.170 -0.340 -5.138 1.00 0.00 H new ATOM 0 HG2 ARG A 153 13.395 0.579 -4.759 1.00 0.00 H new ATOM 0 HG3 ARG A 153 12.905 1.244 -3.213 1.00 0.00 H new ATOM 0 HD2 ARG A 153 14.190 -0.868 -2.973 1.00 0.00 H new ATOM 0 HD3 ARG A 153 12.586 -0.975 -2.275 1.00 0.00 H new ATOM 0 HE ARG A 153 12.049 -2.656 -3.777 1.00 0.00 H new ATOM 0 HH11 ARG A 153 14.767 -0.810 -5.106 1.00 0.00 H new ATOM 0 HH12 ARG A 153 15.103 -2.005 -6.363 1.00 0.00 H new ATOM 0 HH21 ARG A 153 12.558 -4.209 -5.349 1.00 0.00 H new ATOM 0 HH22 ARG A 153 13.866 -3.907 -6.498 1.00 0.00 H new ATOM 2509 N GLU A 154 11.951 1.788 -7.036 1.00 0.00 N ATOM 2510 CA GLU A 154 12.954 2.227 -7.992 1.00 0.00 C ATOM 2511 C GLU A 154 12.620 3.593 -8.587 1.00 0.00 C ATOM 2512 O GLU A 154 13.523 4.370 -8.885 1.00 0.00 O ATOM 2513 CB GLU A 154 13.142 1.183 -9.088 1.00 0.00 C ATOM 2514 CG GLU A 154 13.859 -0.059 -8.590 1.00 0.00 C ATOM 2515 CD GLU A 154 14.069 -1.098 -9.669 1.00 0.00 C ATOM 2516 OE1 GLU A 154 14.884 -0.857 -10.582 1.00 0.00 O ATOM 2517 OE2 GLU A 154 13.425 -2.162 -9.609 1.00 0.00 O ATOM 0 H GLU A 154 11.360 1.022 -7.359 1.00 0.00 H new ATOM 0 HA GLU A 154 13.895 2.337 -7.453 1.00 0.00 H new ATOM 0 HB2 GLU A 154 12.168 0.901 -9.488 1.00 0.00 H new ATOM 0 HB3 GLU A 154 13.709 1.621 -9.910 1.00 0.00 H new ATOM 0 HG2 GLU A 154 14.826 0.228 -8.178 1.00 0.00 H new ATOM 0 HG3 GLU A 154 13.284 -0.501 -7.776 1.00 0.00 H new ATOM 2524 N GLN A 155 11.336 3.905 -8.738 1.00 0.00 N ATOM 2525 CA GLN A 155 10.953 5.201 -9.292 1.00 0.00 C ATOM 2526 C GLN A 155 11.229 6.313 -8.285 1.00 0.00 C ATOM 2527 O GLN A 155 11.566 7.429 -8.669 1.00 0.00 O ATOM 2528 CB GLN A 155 9.480 5.230 -9.726 1.00 0.00 C ATOM 2529 CG GLN A 155 8.491 5.389 -8.584 1.00 0.00 C ATOM 2530 CD GLN A 155 7.056 5.468 -9.062 1.00 0.00 C ATOM 2531 OE1 GLN A 155 6.685 4.862 -10.066 1.00 0.00 O ATOM 2532 NE2 GLN A 155 6.244 6.236 -8.356 1.00 0.00 N ATOM 0 H GLN A 155 10.558 3.294 -8.491 1.00 0.00 H new ATOM 0 HA GLN A 155 11.560 5.365 -10.182 1.00 0.00 H new ATOM 0 HB2 GLN A 155 9.338 6.050 -10.430 1.00 0.00 H new ATOM 0 HB3 GLN A 155 9.253 4.308 -10.261 1.00 0.00 H new ATOM 0 HG2 GLN A 155 8.596 4.548 -7.898 1.00 0.00 H new ATOM 0 HG3 GLN A 155 8.733 6.291 -8.022 1.00 0.00 H new ATOM 0 HE21 GLN A 155 6.592 6.722 -7.529 1.00 0.00 H new ATOM 0 HE22 GLN A 155 5.270 6.343 -8.638 1.00 0.00 H new ATOM 2541 N LEU A 156 11.105 6.004 -6.993 1.00 0.00 N ATOM 2542 CA LEU A 156 11.413 6.977 -5.953 1.00 0.00 C ATOM 2543 C LEU A 156 12.923 7.150 -5.850 1.00 0.00 C ATOM 2544 O LEU A 156 13.417 8.195 -5.425 1.00 0.00 O ATOM 2545 CB LEU A 156 10.825 6.547 -4.604 1.00 0.00 C ATOM 2546 CG LEU A 156 9.292 6.504 -4.537 1.00 0.00 C ATOM 2547 CD1 LEU A 156 8.828 6.062 -3.157 1.00 0.00 C ATOM 2548 CD2 LEU A 156 8.695 7.861 -4.883 1.00 0.00 C ATOM 0 H LEU A 156 10.796 5.095 -6.648 1.00 0.00 H new ATOM 0 HA LEU A 156 10.960 7.932 -6.220 1.00 0.00 H new ATOM 0 HB2 LEU A 156 11.210 5.558 -4.358 1.00 0.00 H new ATOM 0 HB3 LEU A 156 11.186 7.230 -3.835 1.00 0.00 H new ATOM 0 HG LEU A 156 8.944 5.778 -5.271 1.00 0.00 H new ATOM 0 HD11 LEU A 156 7.739 6.038 -3.130 1.00 0.00 H new ATOM 0 HD12 LEU A 156 9.218 5.067 -2.943 1.00 0.00 H new ATOM 0 HD13 LEU A 156 9.194 6.764 -2.408 1.00 0.00 H new ATOM 0 HD21 LEU A 156 7.608 7.805 -4.829 1.00 0.00 H new ATOM 0 HD22 LEU A 156 9.056 8.608 -4.176 1.00 0.00 H new ATOM 0 HD23 LEU A 156 8.994 8.143 -5.893 1.00 0.00 H new ATOM 2560 N ALA A 157 13.650 6.111 -6.249 1.00 0.00 N ATOM 2561 CA ALA A 157 15.099 6.180 -6.336 1.00 0.00 C ATOM 2562 C ALA A 157 15.511 7.048 -7.520 1.00 0.00 C ATOM 2563 O ALA A 157 16.404 7.883 -7.409 1.00 0.00 O ATOM 2564 CB ALA A 157 15.695 4.784 -6.459 1.00 0.00 C ATOM 0 H ALA A 157 13.255 5.210 -6.517 1.00 0.00 H new ATOM 0 HA ALA A 157 15.484 6.633 -5.422 1.00 0.00 H new ATOM 0 HB1 ALA A 157 16.781 4.856 -6.523 1.00 0.00 H new ATOM 0 HB2 ALA A 157 15.422 4.193 -5.585 1.00 0.00 H new ATOM 0 HB3 ALA A 157 15.310 4.302 -7.358 1.00 0.00 H new ATOM 2570 N ILE A 158 14.844 6.857 -8.653 1.00 0.00 N ATOM 2571 CA ILE A 158 15.074 7.689 -9.828 1.00 0.00 C ATOM 2572 C ILE A 158 14.700 9.136 -9.519 1.00 0.00 C ATOM 2573 O ILE A 158 15.426 10.061 -9.871 1.00 0.00 O ATOM 2574 CB ILE A 158 14.260 7.190 -11.044 1.00 0.00 C ATOM 2575 CG1 ILE A 158 14.659 5.753 -11.391 1.00 0.00 C ATOM 2576 CG2 ILE A 158 14.466 8.104 -12.247 1.00 0.00 C ATOM 2577 CD1 ILE A 158 13.778 5.105 -12.438 1.00 0.00 C ATOM 0 H ILE A 158 14.138 6.132 -8.782 1.00 0.00 H new ATOM 0 HA ILE A 158 16.132 7.627 -10.081 1.00 0.00 H new ATOM 0 HB ILE A 158 13.202 7.209 -10.781 1.00 0.00 H new ATOM 0 HG12 ILE A 158 15.690 5.749 -11.745 1.00 0.00 H new ATOM 0 HG13 ILE A 158 14.631 5.150 -10.484 1.00 0.00 H new ATOM 0 HG21 ILE A 158 13.883 7.733 -13.090 1.00 0.00 H new ATOM 0 HG22 ILE A 158 14.140 9.114 -11.997 1.00 0.00 H new ATOM 0 HG23 ILE A 158 15.522 8.120 -12.515 1.00 0.00 H new ATOM 0 HD11 ILE A 158 14.126 4.090 -12.628 1.00 0.00 H new ATOM 0 HD12 ILE A 158 12.749 5.075 -12.080 1.00 0.00 H new ATOM 0 HD13 ILE A 158 13.824 5.683 -13.361 1.00 0.00 H new ATOM 2589 N GLU A 159 13.571 9.312 -8.837 1.00 0.00 N ATOM 2590 CA GLU A 159 13.124 10.627 -8.389 1.00 0.00 C ATOM 2591 C GLU A 159 14.187 11.267 -7.493 1.00 0.00 C ATOM 2592 O GLU A 159 14.345 12.486 -7.463 1.00 0.00 O ATOM 2593 CB GLU A 159 11.808 10.498 -7.618 1.00 0.00 C ATOM 2594 CG GLU A 159 11.057 11.809 -7.451 1.00 0.00 C ATOM 2595 CD GLU A 159 10.396 12.267 -8.735 1.00 0.00 C ATOM 2596 OE1 GLU A 159 9.252 11.842 -8.998 1.00 0.00 O ATOM 2597 OE2 GLU A 159 11.009 13.050 -9.488 1.00 0.00 O ATOM 0 H GLU A 159 12.943 8.550 -8.581 1.00 0.00 H new ATOM 0 HA GLU A 159 12.966 11.260 -9.262 1.00 0.00 H new ATOM 0 HB2 GLU A 159 11.165 9.786 -8.135 1.00 0.00 H new ATOM 0 HB3 GLU A 159 12.016 10.082 -6.632 1.00 0.00 H new ATOM 0 HG2 GLU A 159 10.298 11.693 -6.677 1.00 0.00 H new ATOM 0 HG3 GLU A 159 11.748 12.579 -7.107 1.00 0.00 H new ATOM 2604 N LYS A 160 14.918 10.425 -6.769 1.00 0.00 N ATOM 2605 CA LYS A 160 16.004 10.888 -5.917 1.00 0.00 C ATOM 2606 C LYS A 160 17.131 11.453 -6.773 1.00 0.00 C ATOM 2607 O LYS A 160 17.719 12.478 -6.442 1.00 0.00 O ATOM 2608 CB LYS A 160 16.524 9.745 -5.034 1.00 0.00 C ATOM 2609 CG LYS A 160 17.608 10.145 -4.034 1.00 0.00 C ATOM 2610 CD LYS A 160 17.059 10.984 -2.885 1.00 0.00 C ATOM 2611 CE LYS A 160 16.728 12.399 -3.323 1.00 0.00 C ATOM 2612 NZ LYS A 160 16.058 13.174 -2.252 1.00 0.00 N ATOM 0 H LYS A 160 14.776 9.415 -6.757 1.00 0.00 H new ATOM 0 HA LYS A 160 15.625 11.676 -5.266 1.00 0.00 H new ATOM 0 HB2 LYS A 160 15.684 9.318 -4.486 1.00 0.00 H new ATOM 0 HB3 LYS A 160 16.917 8.958 -5.678 1.00 0.00 H new ATOM 0 HG2 LYS A 160 18.077 9.247 -3.632 1.00 0.00 H new ATOM 0 HG3 LYS A 160 18.386 10.707 -4.551 1.00 0.00 H new ATOM 0 HD2 LYS A 160 16.163 10.509 -2.485 1.00 0.00 H new ATOM 0 HD3 LYS A 160 17.790 11.016 -2.077 1.00 0.00 H new ATOM 0 HE2 LYS A 160 17.644 12.909 -3.620 1.00 0.00 H new ATOM 0 HE3 LYS A 160 16.084 12.364 -4.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 15.912 14.153 -2.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 15.138 12.740 -2.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 16.653 13.173 -1.399 1.00 0.00 H new ATOM 2626 N LEU A 161 17.413 10.791 -7.885 1.00 0.00 N ATOM 2627 CA LEU A 161 18.431 11.255 -8.824 1.00 0.00 C ATOM 2628 C LEU A 161 17.994 12.557 -9.493 1.00 0.00 C ATOM 2629 O LEU A 161 18.824 13.346 -9.955 1.00 0.00 O ATOM 2630 CB LEU A 161 18.708 10.184 -9.888 1.00 0.00 C ATOM 2631 CG LEU A 161 19.736 9.106 -9.512 1.00 0.00 C ATOM 2632 CD1 LEU A 161 19.334 8.366 -8.247 1.00 0.00 C ATOM 2633 CD2 LEU A 161 19.915 8.126 -10.661 1.00 0.00 C ATOM 0 H LEU A 161 16.950 9.926 -8.163 1.00 0.00 H new ATOM 0 HA LEU A 161 19.348 11.442 -8.266 1.00 0.00 H new ATOM 0 HB2 LEU A 161 17.767 9.690 -10.131 1.00 0.00 H new ATOM 0 HB3 LEU A 161 19.050 10.682 -10.795 1.00 0.00 H new ATOM 0 HG LEU A 161 20.685 9.606 -9.317 1.00 0.00 H new ATOM 0 HD11 LEU A 161 20.085 7.612 -8.013 1.00 0.00 H new ATOM 0 HD12 LEU A 161 19.259 9.073 -7.420 1.00 0.00 H new ATOM 0 HD13 LEU A 161 18.369 7.882 -8.399 1.00 0.00 H new ATOM 0 HD21 LEU A 161 20.646 7.367 -10.382 1.00 0.00 H new ATOM 0 HD22 LEU A 161 18.961 7.647 -10.882 1.00 0.00 H new ATOM 0 HD23 LEU A 161 20.266 8.660 -11.544 1.00 0.00 H new ATOM 2645 N GLU A 162 16.691 12.783 -9.520 1.00 0.00 N ATOM 2646 CA GLU A 162 16.119 13.980 -10.123 1.00 0.00 C ATOM 2647 C GLU A 162 16.094 15.143 -9.127 1.00 0.00 C ATOM 2648 O GLU A 162 15.452 16.166 -9.383 1.00 0.00 O ATOM 2649 CB GLU A 162 14.699 13.694 -10.622 1.00 0.00 C ATOM 2650 CG GLU A 162 14.604 12.532 -11.601 1.00 0.00 C ATOM 2651 CD GLU A 162 15.360 12.777 -12.892 1.00 0.00 C ATOM 2652 OE1 GLU A 162 14.842 13.516 -13.756 1.00 0.00 O ATOM 2653 OE2 GLU A 162 16.467 12.224 -13.056 1.00 0.00 O ATOM 0 H GLU A 162 16.000 12.145 -9.126 1.00 0.00 H new ATOM 0 HA GLU A 162 16.748 14.264 -10.967 1.00 0.00 H new ATOM 0 HB2 GLU A 162 14.060 13.485 -9.764 1.00 0.00 H new ATOM 0 HB3 GLU A 162 14.307 14.591 -11.101 1.00 0.00 H new ATOM 0 HG2 GLU A 162 14.992 11.631 -11.125 1.00 0.00 H new ATOM 0 HG3 GLU A 162 13.555 12.344 -11.831 1.00 0.00 H new ATOM 2660 N HIS A 163 16.774 14.984 -7.986 1.00 0.00 N ATOM 2661 CA HIS A 163 16.789 16.024 -6.953 1.00 0.00 C ATOM 2662 C HIS A 163 17.289 17.358 -7.504 1.00 0.00 C ATOM 2663 O HIS A 163 18.337 17.432 -8.147 1.00 0.00 O ATOM 2664 CB HIS A 163 17.609 15.609 -5.706 1.00 0.00 C ATOM 2665 CG HIS A 163 19.054 15.224 -5.934 1.00 0.00 C ATOM 2666 ND1 HIS A 163 19.900 15.866 -6.815 1.00 0.00 N ATOM 2667 CD2 HIS A 163 19.802 14.254 -5.353 1.00 0.00 C ATOM 2668 CE1 HIS A 163 21.096 15.310 -6.766 1.00 0.00 C ATOM 2669 NE2 HIS A 163 21.064 14.330 -5.886 1.00 0.00 N ATOM 0 H HIS A 163 17.317 14.152 -7.756 1.00 0.00 H new ATOM 0 HA HIS A 163 15.754 16.151 -6.635 1.00 0.00 H new ATOM 0 HB2 HIS A 163 17.586 16.435 -4.995 1.00 0.00 H new ATOM 0 HB3 HIS A 163 17.104 14.767 -5.233 1.00 0.00 H new ATOM 0 HD1 HIS A 163 19.641 16.651 -7.413 1.00 0.00 H new ATOM 0 HD2 HIS A 163 19.466 13.550 -4.607 1.00 0.00 H new ATOM 0 HE1 HIS A 163 21.955 15.608 -7.349 1.00 0.00 H new ATOM 2678 N HIS A 164 16.517 18.407 -7.267 1.00 0.00 N ATOM 2679 CA HIS A 164 16.891 19.746 -7.699 1.00 0.00 C ATOM 2680 C HIS A 164 16.135 20.801 -6.890 1.00 0.00 C ATOM 2681 O HIS A 164 16.573 21.947 -6.787 1.00 0.00 O ATOM 2682 CB HIS A 164 16.600 19.918 -9.194 1.00 0.00 C ATOM 2683 CG HIS A 164 17.396 21.008 -9.847 1.00 0.00 C ATOM 2684 ND1 HIS A 164 16.828 22.134 -10.398 1.00 0.00 N ATOM 2685 CD2 HIS A 164 18.728 21.121 -10.061 1.00 0.00 C ATOM 2686 CE1 HIS A 164 17.774 22.888 -10.924 1.00 0.00 C ATOM 2687 NE2 HIS A 164 18.938 22.298 -10.734 1.00 0.00 N ATOM 0 H HIS A 164 15.624 18.357 -6.776 1.00 0.00 H new ATOM 0 HA HIS A 164 17.959 19.880 -7.529 1.00 0.00 H new ATOM 0 HB2 HIS A 164 16.804 18.977 -9.704 1.00 0.00 H new ATOM 0 HB3 HIS A 164 15.539 20.128 -9.326 1.00 0.00 H new ATOM 0 HD2 HIS A 164 19.486 20.414 -9.758 1.00 0.00 H new ATOM 0 HE1 HIS A 164 17.621 23.832 -11.427 1.00 0.00 H new ATOM 0 HE2 HIS A 164 19.843 22.657 -11.037 1.00 0.00 H new ATOM 2696 N HIS A 165 14.993 20.411 -6.327 1.00 0.00 N ATOM 2697 CA HIS A 165 14.193 21.322 -5.512 1.00 0.00 C ATOM 2698 C HIS A 165 13.905 20.748 -4.131 1.00 0.00 C ATOM 2699 O HIS A 165 12.825 20.207 -3.894 1.00 0.00 O ATOM 2700 CB HIS A 165 12.867 21.657 -6.200 1.00 0.00 C ATOM 2701 CG HIS A 165 12.917 22.878 -7.061 1.00 0.00 C ATOM 2702 ND1 HIS A 165 12.014 23.124 -8.071 1.00 0.00 N ATOM 2703 CD2 HIS A 165 13.748 23.946 -7.033 1.00 0.00 C ATOM 2704 CE1 HIS A 165 12.286 24.286 -8.628 1.00 0.00 C ATOM 2705 NE2 HIS A 165 13.334 24.806 -8.017 1.00 0.00 N ATOM 0 H HIS A 165 14.602 19.473 -6.420 1.00 0.00 H new ATOM 0 HA HIS A 165 14.783 22.231 -5.395 1.00 0.00 H new ATOM 0 HB2 HIS A 165 12.562 20.807 -6.811 1.00 0.00 H new ATOM 0 HB3 HIS A 165 12.099 21.794 -5.438 1.00 0.00 H new ATOM 0 HD2 HIS A 165 14.581 24.093 -6.361 1.00 0.00 H new ATOM 0 HE1 HIS A 165 11.744 24.737 -9.446 1.00 0.00 H new ATOM 0 HE2 HIS A 165 13.766 25.703 -8.241 1.00 0.00 H new ATOM 2714 N HIS A 166 14.881 20.851 -3.233 1.00 0.00 N ATOM 2715 CA HIS A 166 14.680 20.504 -1.829 1.00 0.00 C ATOM 2716 C HIS A 166 15.957 20.761 -1.034 1.00 0.00 C ATOM 2717 O HIS A 166 16.276 21.902 -0.710 1.00 0.00 O ATOM 2718 CB HIS A 166 14.232 19.041 -1.667 1.00 0.00 C ATOM 2719 CG HIS A 166 13.717 18.706 -0.298 1.00 0.00 C ATOM 2720 ND1 HIS A 166 12.550 19.222 0.216 1.00 0.00 N ATOM 2721 CD2 HIS A 166 14.223 17.900 0.667 1.00 0.00 C ATOM 2722 CE1 HIS A 166 12.359 18.751 1.433 1.00 0.00 C ATOM 2723 NE2 HIS A 166 13.360 17.947 1.731 1.00 0.00 N ATOM 0 H HIS A 166 15.823 21.173 -3.454 1.00 0.00 H new ATOM 0 HA HIS A 166 13.884 21.138 -1.439 1.00 0.00 H new ATOM 0 HB2 HIS A 166 13.453 18.828 -2.399 1.00 0.00 H new ATOM 0 HB3 HIS A 166 15.073 18.387 -1.897 1.00 0.00 H new ATOM 0 HD2 HIS A 166 15.137 17.327 0.609 1.00 0.00 H new ATOM 0 HE1 HIS A 166 11.524 18.985 2.077 1.00 0.00 H new ATOM 0 HE2 HIS A 166 13.474 17.442 2.610 1.00 0.00 H new ATOM 2732 N HIS A 167 16.697 19.698 -0.753 1.00 0.00 N ATOM 2733 CA HIS A 167 17.937 19.776 0.017 1.00 0.00 C ATOM 2734 C HIS A 167 18.805 18.586 -0.349 1.00 0.00 C ATOM 2735 O HIS A 167 19.879 18.730 -0.927 1.00 0.00 O ATOM 2736 CB HIS A 167 17.669 19.779 1.536 1.00 0.00 C ATOM 2737 CG HIS A 167 17.101 21.064 2.065 1.00 0.00 C ATOM 2738 ND1 HIS A 167 17.882 22.137 2.434 1.00 0.00 N ATOM 2739 CD2 HIS A 167 15.818 21.448 2.275 1.00 0.00 C ATOM 2740 CE1 HIS A 167 17.105 23.125 2.843 1.00 0.00 C ATOM 2741 NE2 HIS A 167 15.850 22.730 2.755 1.00 0.00 N ATOM 0 H HIS A 167 16.456 18.753 -1.052 1.00 0.00 H new ATOM 0 HA HIS A 167 18.441 20.711 -0.226 1.00 0.00 H new ATOM 0 HB2 HIS A 167 16.981 18.968 1.772 1.00 0.00 H new ATOM 0 HB3 HIS A 167 18.602 19.567 2.057 1.00 0.00 H new ATOM 0 HD2 HIS A 167 14.934 20.853 2.097 1.00 0.00 H new ATOM 0 HE1 HIS A 167 17.441 24.091 3.190 1.00 0.00 H new ATOM 0 HE2 HIS A 167 15.034 23.289 3.004 1.00 0.00 H new ATOM 2750 N HIS A 168 18.315 17.408 -0.005 1.00 0.00 N ATOM 2751 CA HIS A 168 18.918 16.162 -0.437 1.00 0.00 C ATOM 2752 C HIS A 168 17.852 15.320 -1.108 1.00 0.00 C ATOM 2753 O HIS A 168 17.689 15.428 -2.337 1.00 0.00 O ATOM 2754 CB HIS A 168 19.523 15.393 0.742 1.00 0.00 C ATOM 2755 CG HIS A 168 20.745 16.029 1.326 1.00 0.00 C ATOM 2756 ND1 HIS A 168 22.021 15.593 1.054 1.00 0.00 N ATOM 2757 CD2 HIS A 168 20.879 17.071 2.178 1.00 0.00 C ATOM 2758 CE1 HIS A 168 22.888 16.335 1.713 1.00 0.00 C ATOM 2759 NE2 HIS A 168 22.220 17.241 2.402 1.00 0.00 N ATOM 2760 OXT HIS A 168 17.143 14.588 -0.391 1.00 0.00 O ATOM 0 H HIS A 168 17.489 17.290 0.581 1.00 0.00 H new ATOM 0 HA HIS A 168 19.726 16.383 -1.134 1.00 0.00 H new ATOM 0 HB2 HIS A 168 18.769 15.296 1.523 1.00 0.00 H new ATOM 0 HB3 HIS A 168 19.774 14.384 0.413 1.00 0.00 H new ATOM 0 HD2 HIS A 168 20.079 17.659 2.602 1.00 0.00 H new ATOM 0 HE1 HIS A 168 23.962 16.221 1.693 1.00 0.00 H new ATOM 0 HE2 HIS A 168 22.635 17.952 3.004 1.00 0.00 H new TER 2769 HIS A 168