USER MOD reduce.3.24.130724 H: found=0, std=0, add=759, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 757 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 118 THR OG1 : rot 145:sc= -1.17! USER MOD Set 1.2: A 123 HIS : no HD1:sc= -16.8! C(o=-18!,f=-24!) USER MOD Set 2.1: A 57 LYS NZ :NH3+ -178:sc= 0.243 (180deg=0) USER MOD Set 2.2: A 71 TYR OH : rot 57:sc= -1.63 USER MOD Set 3.1: A 55 MET CE :methyl -142:sc= 0 (180deg=-1.48!) USER MOD Set 3.2: A 59 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.113) USER MOD Single : A 36 ASN :FLIP amide:sc= -0.415 F(o=-2.1,f=-0.42) USER MOD Single : A 39 LYS NZ :NH3+ -125:sc= -2.62! (180deg=-4.36!) USER MOD Single : A 42 HIS :FLIP no HE2:sc= -2.9! C(o=-8.1!,f=-2.9!) USER MOD Single : A 45 CYS SG : rot 58:sc= -1.98! USER MOD Single : A 47 LYS NZ :NH3+ -129:sc= -1.49 (180deg=-3.48!) USER MOD Single : A 48 HIS :FLIP no HE2:sc= -5.65! C(o=-6.2!,f=-5.6!) USER MOD Single : A 50 LYS NZ :NH3+ 160:sc= -0.0162 (180deg=-0.565) USER MOD Single : A 52 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 62 MET CE :methyl 153:sc= -0.293 (180deg=-1.25) USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 70 GLN :FLIP amide:sc= -0.965 F(o=-3.8!,f=-0.96) USER MOD Single : A 72 SER OG : rot 48:sc= 0.991 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= -0.801 X(o=-0.8,f=-0.42) USER MOD Single : A 85 MET CE :methyl 155:sc= -0.833 (180deg=-1.49) USER MOD Single : A 86 THR OG1 : rot 180:sc= -0.0199 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -3.19! C(o=-3.2!,f=-4.9!) USER MOD Single : A 104 SER OG : rot 180:sc= -0.294 USER MOD Single : A 106 MET CE :methyl -160:sc= -0.0337 (180deg=-0.588) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot -153:sc= -1.8! USER MOD Single : A 117 LYS NZ :NH3+ -140:sc= 0 (180deg=-0.0688) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 TYR OH : rot -15:sc= 0.662 USER MOD Single : A 126 MET CE :methyl -116:sc= -0.444 (180deg=-1.12) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 36 2.207 -16.159 -13.188 1.00 0.00 N ATOM 2 CA ASN A 36 1.749 -15.791 -14.558 1.00 0.00 C ATOM 3 C ASN A 36 0.581 -14.803 -14.485 1.00 0.00 C ATOM 4 O ASN A 36 0.688 -13.670 -14.912 1.00 0.00 O ATOM 5 CB ASN A 36 1.300 -17.108 -15.190 1.00 0.00 C ATOM 6 CG ASN A 36 1.153 -16.927 -16.700 1.00 0.00 C ATOM 7 OD1 ASN A 36 0.071 -17.355 -17.289 1.00 0.00 O flip ATOM 8 ND2 ASN A 36 2.029 -16.392 -17.350 1.00 0.00 N flip ATOM 0 HA ASN A 36 2.534 -15.305 -15.138 1.00 0.00 H new ATOM 0 HB2 ASN A 36 2.027 -17.892 -14.976 1.00 0.00 H new ATOM 0 HB3 ASN A 36 0.351 -17.426 -14.757 1.00 0.00 H new ATOM 0 HD21 ASN A 36 2.875 -16.058 -16.888 1.00 0.00 H new ATOM 0 HD22 ASN A 36 1.919 -16.277 -18.357 1.00 0.00 H new ATOM 15 N ALA A 37 -0.537 -15.221 -13.954 1.00 0.00 N ATOM 16 CA ALA A 37 -1.704 -14.300 -13.863 1.00 0.00 C ATOM 17 C ALA A 37 -1.352 -13.072 -13.030 1.00 0.00 C ATOM 18 O ALA A 37 -0.662 -13.159 -12.035 1.00 0.00 O ATOM 19 CB ALA A 37 -2.806 -15.121 -13.193 1.00 0.00 C ATOM 0 H ALA A 37 -0.691 -16.158 -13.581 1.00 0.00 H new ATOM 0 HA ALA A 37 -2.015 -13.930 -14.840 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -3.703 -14.510 -13.090 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -3.031 -15.995 -13.804 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -2.471 -15.444 -12.207 1.00 0.00 H new ATOM 25 N VAL A 38 -1.797 -11.920 -13.453 1.00 0.00 N ATOM 26 CA VAL A 38 -1.466 -10.674 -12.709 1.00 0.00 C ATOM 27 C VAL A 38 -2.605 -9.658 -12.793 1.00 0.00 C ATOM 28 O VAL A 38 -3.469 -9.748 -13.642 1.00 0.00 O ATOM 29 CB VAL A 38 -0.247 -10.120 -13.438 1.00 0.00 C ATOM 30 CG1 VAL A 38 0.912 -11.102 -13.314 1.00 0.00 C ATOM 31 CG2 VAL A 38 -0.589 -9.921 -14.917 1.00 0.00 C ATOM 0 H VAL A 38 -2.376 -11.789 -14.283 1.00 0.00 H new ATOM 0 HA VAL A 38 -1.294 -10.870 -11.651 1.00 0.00 H new ATOM 0 HB VAL A 38 0.038 -9.165 -12.996 1.00 0.00 H new ATOM 0 HG11 VAL A 38 1.783 -10.705 -13.836 1.00 0.00 H new ATOM 0 HG12 VAL A 38 1.155 -11.247 -12.261 1.00 0.00 H new ATOM 0 HG13 VAL A 38 0.629 -12.057 -13.756 1.00 0.00 H new ATOM 0 HG21 VAL A 38 0.281 -9.525 -15.441 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -0.873 -10.877 -15.357 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -1.418 -9.219 -15.007 1.00 0.00 H new ATOM 41 N LYS A 39 -2.573 -8.658 -11.955 1.00 0.00 N ATOM 42 CA LYS A 39 -3.611 -7.592 -12.019 1.00 0.00 C ATOM 43 C LYS A 39 -3.028 -6.429 -12.826 1.00 0.00 C ATOM 44 O LYS A 39 -1.943 -5.960 -12.547 1.00 0.00 O ATOM 45 CB LYS A 39 -3.873 -7.184 -10.568 1.00 0.00 C ATOM 46 CG LYS A 39 -5.241 -6.511 -10.467 1.00 0.00 C ATOM 47 CD LYS A 39 -5.057 -4.994 -10.433 1.00 0.00 C ATOM 48 CE LYS A 39 -4.434 -4.580 -9.097 1.00 0.00 C ATOM 49 NZ LYS A 39 -4.675 -3.112 -8.998 1.00 0.00 N ATOM 0 H LYS A 39 -1.870 -8.534 -11.227 1.00 0.00 H new ATOM 0 HA LYS A 39 -4.539 -7.910 -12.494 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -3.838 -8.060 -9.921 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -3.095 -6.503 -10.224 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -5.862 -6.794 -11.317 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -5.758 -6.846 -9.568 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -4.418 -4.677 -11.257 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -6.019 -4.498 -10.566 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -4.894 -5.113 -8.265 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -3.368 -4.808 -9.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -3.771 -2.621 -8.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -5.110 -2.771 -9.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -5.312 -2.918 -8.199 1.00 0.00 H new ATOM 63 N VAL A 40 -3.706 -5.985 -13.847 1.00 0.00 N ATOM 64 CA VAL A 40 -3.128 -4.886 -14.674 1.00 0.00 C ATOM 65 C VAL A 40 -4.033 -3.653 -14.712 1.00 0.00 C ATOM 66 O VAL A 40 -5.223 -3.742 -14.942 1.00 0.00 O ATOM 67 CB VAL A 40 -2.994 -5.495 -16.073 1.00 0.00 C ATOM 68 CG1 VAL A 40 -2.663 -4.400 -17.094 1.00 0.00 C ATOM 69 CG2 VAL A 40 -1.871 -6.534 -16.064 1.00 0.00 C ATOM 0 H VAL A 40 -4.620 -6.327 -14.143 1.00 0.00 H new ATOM 0 HA VAL A 40 -2.180 -4.537 -14.266 1.00 0.00 H new ATOM 0 HB VAL A 40 -3.936 -5.968 -16.350 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -2.570 -4.843 -18.085 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -3.461 -3.657 -17.102 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.723 -3.920 -16.821 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -1.771 -6.971 -17.058 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -0.934 -6.054 -15.783 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.107 -7.318 -15.345 1.00 0.00 H new ATOM 79 N ARG A 41 -3.451 -2.499 -14.526 1.00 0.00 N ATOM 80 CA ARG A 41 -4.236 -1.231 -14.589 1.00 0.00 C ATOM 81 C ARG A 41 -3.750 -0.427 -15.796 1.00 0.00 C ATOM 82 O ARG A 41 -2.571 -0.186 -15.944 1.00 0.00 O ATOM 83 CB ARG A 41 -3.930 -0.486 -13.288 1.00 0.00 C ATOM 84 CG ARG A 41 -4.160 -1.411 -12.092 1.00 0.00 C ATOM 85 CD ARG A 41 -4.138 -0.584 -10.804 1.00 0.00 C ATOM 86 NE ARG A 41 -2.960 0.313 -10.945 1.00 0.00 N ATOM 87 CZ ARG A 41 -1.858 0.038 -10.305 1.00 0.00 C ATOM 88 NH1 ARG A 41 -1.083 -0.925 -10.725 1.00 0.00 N ATOM 89 NH2 ARG A 41 -1.537 0.719 -9.241 1.00 0.00 N ATOM 0 H ARG A 41 -2.457 -2.379 -14.331 1.00 0.00 H new ATOM 0 HA ARG A 41 -5.308 -1.398 -14.695 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -2.898 -0.135 -13.294 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -4.566 0.395 -13.205 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -5.116 -1.924 -12.193 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -3.388 -2.180 -12.058 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -5.058 -0.012 -10.686 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -4.045 -1.223 -9.926 1.00 0.00 H new ATOM 0 HE ARG A 41 -3.014 1.140 -11.540 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -1.340 -1.462 -11.553 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -0.221 -1.141 -10.225 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -2.148 1.466 -8.910 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -0.675 0.505 -8.739 1.00 0.00 H new ATOM 103 N HIS A 42 -4.623 -0.029 -16.678 1.00 0.00 N ATOM 104 CA HIS A 42 -4.137 0.725 -17.868 1.00 0.00 C ATOM 105 C HIS A 42 -4.980 1.974 -18.147 1.00 0.00 C ATOM 106 O HIS A 42 -6.162 2.025 -17.868 1.00 0.00 O ATOM 107 CB HIS A 42 -4.230 -0.278 -19.032 1.00 0.00 C ATOM 108 CG HIS A 42 -5.549 -0.139 -19.752 1.00 0.00 C ATOM 109 ND1 HIS A 42 -6.847 -0.308 -19.332 1.00 0.00 N flip ATOM 110 CD2 HIS A 42 -5.629 0.239 -21.084 1.00 0.00 C flip ATOM 111 CE1 HIS A 42 -7.717 -0.040 -20.385 1.00 0.00 C flip ATOM 112 NE2 HIS A 42 -6.933 0.285 -21.416 1.00 0.00 N flip ATOM 0 H HIS A 42 -5.629 -0.188 -16.631 1.00 0.00 H new ATOM 0 HA HIS A 42 -3.123 1.096 -17.717 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -3.410 -0.110 -19.730 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -4.123 -1.294 -18.652 1.00 0.00 H new ATOM 0 HD1 HIS A 42 -7.129 -0.587 -18.392 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -4.796 0.457 -21.736 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -8.796 -0.085 -20.371 1.00 0.00 H new ATOM 120 N ILE A 43 -4.370 2.965 -18.733 1.00 0.00 N ATOM 121 CA ILE A 43 -5.109 4.206 -19.084 1.00 0.00 C ATOM 122 C ILE A 43 -5.167 4.313 -20.608 1.00 0.00 C ATOM 123 O ILE A 43 -4.153 4.228 -21.277 1.00 0.00 O ATOM 124 CB ILE A 43 -4.286 5.352 -18.496 1.00 0.00 C ATOM 125 CG1 ILE A 43 -4.182 5.182 -16.979 1.00 0.00 C ATOM 126 CG2 ILE A 43 -4.967 6.684 -18.813 1.00 0.00 C ATOM 127 CD1 ILE A 43 -3.228 6.236 -16.414 1.00 0.00 C ATOM 0 H ILE A 43 -3.382 2.967 -18.986 1.00 0.00 H new ATOM 0 HA ILE A 43 -6.129 4.222 -18.700 1.00 0.00 H new ATOM 0 HB ILE A 43 -3.287 5.341 -18.932 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -5.166 5.284 -16.522 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -3.821 4.182 -16.738 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -4.380 7.501 -18.394 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -5.040 6.807 -19.894 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -5.966 6.694 -18.378 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -3.153 6.116 -15.333 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -2.242 6.112 -16.862 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -3.608 7.231 -16.643 1.00 0.00 H new ATOM 139 N LEU A 44 -6.333 4.475 -21.165 1.00 0.00 N ATOM 140 CA LEU A 44 -6.435 4.561 -22.648 1.00 0.00 C ATOM 141 C LEU A 44 -6.898 5.948 -23.083 1.00 0.00 C ATOM 142 O LEU A 44 -7.967 6.399 -22.723 1.00 0.00 O ATOM 143 CB LEU A 44 -7.475 3.515 -23.039 1.00 0.00 C ATOM 144 CG LEU A 44 -7.141 2.963 -24.424 1.00 0.00 C ATOM 145 CD1 LEU A 44 -7.891 1.650 -24.653 1.00 0.00 C ATOM 146 CD2 LEU A 44 -7.551 3.973 -25.498 1.00 0.00 C ATOM 0 H LEU A 44 -7.216 4.551 -20.661 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.471 4.386 -23.126 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.488 2.708 -22.307 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -8.470 3.959 -23.042 1.00 0.00 H new ATOM 0 HG LEU A 44 -6.067 2.784 -24.484 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -7.649 1.261 -25.642 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.595 0.925 -23.895 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -8.964 1.827 -24.585 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -7.310 3.574 -26.483 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -8.623 4.158 -25.433 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -7.012 4.908 -25.343 1.00 0.00 H new ATOM 158 N CYS A 45 -6.111 6.619 -23.874 1.00 0.00 N ATOM 159 CA CYS A 45 -6.522 7.965 -24.354 1.00 0.00 C ATOM 160 C CYS A 45 -6.289 8.057 -25.862 1.00 0.00 C ATOM 161 O CYS A 45 -5.804 7.130 -26.479 1.00 0.00 O ATOM 162 CB CYS A 45 -5.644 8.963 -23.595 1.00 0.00 C ATOM 163 SG CYS A 45 -3.942 8.854 -24.187 1.00 0.00 S ATOM 0 H CYS A 45 -5.203 6.295 -24.208 1.00 0.00 H new ATOM 0 HA CYS A 45 -7.578 8.168 -24.177 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -6.023 9.975 -23.735 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -5.681 8.754 -22.526 1.00 0.00 H new ATOM 0 HG CYS A 45 -3.913 9.076 -25.468 1.00 0.00 H new ATOM 169 N GLU A 46 -6.641 9.155 -26.463 1.00 0.00 N ATOM 170 CA GLU A 46 -6.449 9.289 -27.934 1.00 0.00 C ATOM 171 C GLU A 46 -4.957 9.247 -28.289 1.00 0.00 C ATOM 172 O GLU A 46 -4.106 9.498 -27.459 1.00 0.00 O ATOM 173 CB GLU A 46 -7.066 10.640 -28.274 1.00 0.00 C ATOM 174 CG GLU A 46 -8.552 10.619 -27.911 1.00 0.00 C ATOM 175 CD GLU A 46 -9.243 9.485 -28.671 1.00 0.00 C ATOM 176 OE1 GLU A 46 -8.684 9.035 -29.658 1.00 0.00 O ATOM 177 OE2 GLU A 46 -10.317 9.085 -28.254 1.00 0.00 O ATOM 0 H GLU A 46 -7.053 9.966 -26.002 1.00 0.00 H new ATOM 0 HA GLU A 46 -6.912 8.478 -28.496 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -6.557 11.434 -27.727 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -6.942 10.853 -29.336 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -8.674 10.479 -26.837 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -9.013 11.574 -28.162 1.00 0.00 H new ATOM 184 N LYS A 47 -4.633 8.916 -29.514 1.00 0.00 N ATOM 185 CA LYS A 47 -3.194 8.842 -29.914 1.00 0.00 C ATOM 186 C LYS A 47 -2.781 10.087 -30.706 1.00 0.00 C ATOM 187 O LYS A 47 -2.609 10.034 -31.908 1.00 0.00 O ATOM 188 CB LYS A 47 -3.092 7.596 -30.799 1.00 0.00 C ATOM 189 CG LYS A 47 -1.709 7.536 -31.455 1.00 0.00 C ATOM 190 CD LYS A 47 -1.854 7.163 -32.932 1.00 0.00 C ATOM 191 CE LYS A 47 -2.515 5.786 -33.049 1.00 0.00 C ATOM 192 NZ LYS A 47 -3.206 5.795 -34.371 1.00 0.00 N ATOM 0 H LYS A 47 -5.301 8.694 -30.253 1.00 0.00 H new ATOM 0 HA LYS A 47 -2.537 8.791 -29.046 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -3.260 6.700 -30.202 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -3.867 7.619 -31.565 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -1.209 8.500 -31.361 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -1.085 6.802 -30.944 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -2.454 7.911 -33.450 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -0.876 7.151 -33.413 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -1.774 4.988 -32.997 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -3.222 5.618 -32.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -4.194 5.495 -34.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -3.182 6.756 -34.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -2.724 5.140 -35.019 1.00 0.00 H new ATOM 206 N HIS A 48 -2.637 11.212 -30.057 1.00 0.00 N ATOM 207 CA HIS A 48 -2.253 12.446 -30.806 1.00 0.00 C ATOM 208 C HIS A 48 -1.154 13.232 -30.080 1.00 0.00 C ATOM 209 O HIS A 48 -1.268 14.423 -29.870 1.00 0.00 O ATOM 210 CB HIS A 48 -3.546 13.245 -30.884 1.00 0.00 C ATOM 211 CG HIS A 48 -4.602 12.349 -31.459 1.00 0.00 C ATOM 212 ND1 HIS A 48 -4.679 11.682 -32.656 1.00 0.00 N flip ATOM 213 CD2 HIS A 48 -5.733 11.988 -30.751 1.00 0.00 C flip ATOM 214 CE1 HIS A 48 -5.837 10.913 -32.691 1.00 0.00 C flip ATOM 215 NE2 HIS A 48 -6.433 11.132 -31.517 1.00 0.00 N flip ATOM 0 H HIS A 48 -2.767 11.331 -29.052 1.00 0.00 H new ATOM 0 HA HIS A 48 -1.838 12.221 -31.788 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -3.839 13.595 -29.894 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -3.413 14.128 -31.508 1.00 0.00 H new ATOM 0 HD1 HIS A 48 -3.991 11.741 -33.407 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -6.005 12.331 -29.764 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -6.180 10.277 -33.494 1.00 0.00 H new ATOM 223 N GLY A 49 -0.081 12.580 -29.718 1.00 0.00 N ATOM 224 CA GLY A 49 1.036 13.297 -29.031 1.00 0.00 C ATOM 225 C GLY A 49 0.751 13.437 -27.533 1.00 0.00 C ATOM 226 O GLY A 49 1.610 13.827 -26.767 1.00 0.00 O ATOM 0 H GLY A 49 0.071 11.583 -29.868 1.00 0.00 H new ATOM 0 HA2 GLY A 49 1.969 12.753 -29.179 1.00 0.00 H new ATOM 0 HA3 GLY A 49 1.168 14.284 -29.475 1.00 0.00 H new ATOM 230 N LYS A 50 -0.443 13.132 -27.103 1.00 0.00 N ATOM 231 CA LYS A 50 -0.761 13.264 -25.651 1.00 0.00 C ATOM 232 C LYS A 50 -0.044 12.179 -24.839 1.00 0.00 C ATOM 233 O LYS A 50 0.056 12.263 -23.632 1.00 0.00 O ATOM 234 CB LYS A 50 -2.276 13.088 -25.555 1.00 0.00 C ATOM 235 CG LYS A 50 -2.741 13.433 -24.139 1.00 0.00 C ATOM 236 CD LYS A 50 -4.221 13.076 -23.985 1.00 0.00 C ATOM 237 CE LYS A 50 -4.625 13.195 -22.511 1.00 0.00 C ATOM 238 NZ LYS A 50 -4.512 14.648 -22.189 1.00 0.00 N ATOM 0 H LYS A 50 -1.208 12.799 -27.689 1.00 0.00 H new ATOM 0 HA LYS A 50 -0.434 14.223 -25.250 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -2.774 13.732 -26.280 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -2.550 12.062 -25.799 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -2.146 12.887 -23.407 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -2.590 14.495 -23.944 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -4.832 13.741 -24.595 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -4.400 12.062 -24.342 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -5.641 12.834 -22.351 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -3.971 12.599 -21.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -5.076 14.861 -21.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -3.516 14.888 -22.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -4.866 15.210 -22.990 1.00 0.00 H new ATOM 252 N ILE A 51 0.454 11.162 -25.489 1.00 0.00 N ATOM 253 CA ILE A 51 1.160 10.079 -24.743 1.00 0.00 C ATOM 254 C ILE A 51 2.257 10.680 -23.855 1.00 0.00 C ATOM 255 O ILE A 51 2.508 10.216 -22.758 1.00 0.00 O ATOM 256 CB ILE A 51 1.761 9.182 -25.829 1.00 0.00 C ATOM 257 CG1 ILE A 51 2.125 7.823 -25.228 1.00 0.00 C ATOM 258 CG2 ILE A 51 3.021 9.831 -26.406 1.00 0.00 C ATOM 259 CD1 ILE A 51 2.070 6.753 -26.321 1.00 0.00 C ATOM 0 H ILE A 51 0.403 11.034 -26.500 1.00 0.00 H new ATOM 0 HA ILE A 51 0.495 9.522 -24.083 1.00 0.00 H new ATOM 0 HB ILE A 51 1.027 9.049 -26.624 1.00 0.00 H new ATOM 0 HG12 ILE A 51 3.123 7.862 -24.791 1.00 0.00 H new ATOM 0 HG13 ILE A 51 1.434 7.572 -24.423 1.00 0.00 H new ATOM 0 HG21 ILE A 51 3.442 9.186 -27.178 1.00 0.00 H new ATOM 0 HG22 ILE A 51 2.766 10.798 -26.840 1.00 0.00 H new ATOM 0 HG23 ILE A 51 3.754 9.972 -25.612 1.00 0.00 H new ATOM 0 HD11 ILE A 51 2.329 5.784 -25.895 1.00 0.00 H new ATOM 0 HD12 ILE A 51 1.063 6.709 -26.737 1.00 0.00 H new ATOM 0 HD13 ILE A 51 2.778 7.003 -27.111 1.00 0.00 H new ATOM 271 N MET A 52 2.906 11.711 -24.323 1.00 0.00 N ATOM 272 CA MET A 52 3.985 12.349 -23.514 1.00 0.00 C ATOM 273 C MET A 52 3.388 13.016 -22.271 1.00 0.00 C ATOM 274 O MET A 52 3.946 12.954 -21.194 1.00 0.00 O ATOM 275 CB MET A 52 4.605 13.392 -24.445 1.00 0.00 C ATOM 276 CG MET A 52 5.628 14.228 -23.677 1.00 0.00 C ATOM 277 SD MET A 52 6.438 15.379 -24.816 1.00 0.00 S ATOM 278 CE MET A 52 7.416 16.272 -23.583 1.00 0.00 C ATOM 0 H MET A 52 2.736 12.140 -25.232 1.00 0.00 H new ATOM 0 HA MET A 52 4.723 11.629 -23.160 1.00 0.00 H new ATOM 0 HB2 MET A 52 5.085 12.899 -25.290 1.00 0.00 H new ATOM 0 HB3 MET A 52 3.827 14.037 -24.853 1.00 0.00 H new ATOM 0 HG2 MET A 52 5.136 14.778 -22.875 1.00 0.00 H new ATOM 0 HG3 MET A 52 6.369 13.578 -23.211 1.00 0.00 H new ATOM 0 HE1 MET A 52 8.005 17.045 -24.076 1.00 0.00 H new ATOM 0 HE2 MET A 52 6.749 16.733 -22.854 1.00 0.00 H new ATOM 0 HE3 MET A 52 8.084 15.576 -23.075 1.00 0.00 H new ATOM 288 N GLU A 53 2.256 13.652 -22.411 1.00 0.00 N ATOM 289 CA GLU A 53 1.625 14.317 -21.234 1.00 0.00 C ATOM 290 C GLU A 53 1.157 13.262 -20.228 1.00 0.00 C ATOM 291 O GLU A 53 1.201 13.469 -19.031 1.00 0.00 O ATOM 292 CB GLU A 53 0.433 15.086 -21.804 1.00 0.00 C ATOM 293 CG GLU A 53 0.938 16.247 -22.663 1.00 0.00 C ATOM 294 CD GLU A 53 -0.253 17.049 -23.191 1.00 0.00 C ATOM 295 OE1 GLU A 53 -1.336 16.492 -23.253 1.00 0.00 O ATOM 296 OE2 GLU A 53 -0.060 18.206 -23.527 1.00 0.00 O ATOM 0 H GLU A 53 1.742 13.740 -23.287 1.00 0.00 H new ATOM 0 HA GLU A 53 2.316 14.976 -20.708 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -0.190 14.421 -22.402 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -0.191 15.464 -20.994 1.00 0.00 H new ATOM 0 HG2 GLU A 53 1.591 16.891 -22.074 1.00 0.00 H new ATOM 0 HG3 GLU A 53 1.531 15.867 -23.495 1.00 0.00 H new ATOM 303 N ALA A 54 0.711 12.133 -20.705 1.00 0.00 N ATOM 304 CA ALA A 54 0.244 11.064 -19.777 1.00 0.00 C ATOM 305 C ALA A 54 1.393 10.606 -18.877 1.00 0.00 C ATOM 306 O ALA A 54 1.347 10.749 -17.672 1.00 0.00 O ATOM 307 CB ALA A 54 -0.206 9.920 -20.686 1.00 0.00 C ATOM 0 H ALA A 54 0.650 11.904 -21.697 1.00 0.00 H new ATOM 0 HA ALA A 54 -0.557 11.408 -19.123 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -0.565 9.091 -20.077 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -1.009 10.267 -21.337 1.00 0.00 H new ATOM 0 HB3 ALA A 54 0.635 9.586 -21.294 1.00 0.00 H new ATOM 313 N MET A 55 2.421 10.053 -19.457 1.00 0.00 N ATOM 314 CA MET A 55 3.578 9.574 -18.644 1.00 0.00 C ATOM 315 C MET A 55 4.155 10.709 -17.786 1.00 0.00 C ATOM 316 O MET A 55 4.622 10.489 -16.685 1.00 0.00 O ATOM 317 CB MET A 55 4.610 9.109 -19.675 1.00 0.00 C ATOM 318 CG MET A 55 5.284 10.328 -20.311 1.00 0.00 C ATOM 319 SD MET A 55 6.553 9.777 -21.478 1.00 0.00 S ATOM 320 CE MET A 55 7.401 11.368 -21.654 1.00 0.00 C ATOM 0 H MET A 55 2.512 9.911 -20.463 1.00 0.00 H new ATOM 0 HA MET A 55 3.290 8.781 -17.953 1.00 0.00 H new ATOM 0 HB2 MET A 55 5.357 8.476 -19.197 1.00 0.00 H new ATOM 0 HB3 MET A 55 4.126 8.506 -20.443 1.00 0.00 H new ATOM 0 HG2 MET A 55 4.543 10.939 -20.826 1.00 0.00 H new ATOM 0 HG3 MET A 55 5.732 10.953 -19.539 1.00 0.00 H new ATOM 0 HE1 MET A 55 7.716 11.500 -22.689 1.00 0.00 H new ATOM 0 HE2 MET A 55 6.723 12.175 -21.376 1.00 0.00 H new ATOM 0 HE3 MET A 55 8.275 11.388 -21.003 1.00 0.00 H new ATOM 330 N GLU A 56 4.143 11.915 -18.285 1.00 0.00 N ATOM 331 CA GLU A 56 4.712 13.052 -17.502 1.00 0.00 C ATOM 332 C GLU A 56 3.836 13.386 -16.289 1.00 0.00 C ATOM 333 O GLU A 56 4.331 13.658 -15.214 1.00 0.00 O ATOM 334 CB GLU A 56 4.741 14.232 -18.473 1.00 0.00 C ATOM 335 CG GLU A 56 5.319 15.459 -17.763 1.00 0.00 C ATOM 336 CD GLU A 56 5.375 16.639 -18.734 1.00 0.00 C ATOM 337 OE1 GLU A 56 5.107 16.433 -19.906 1.00 0.00 O ATOM 338 OE2 GLU A 56 5.685 17.732 -18.287 1.00 0.00 O ATOM 0 H GLU A 56 3.765 12.163 -19.199 1.00 0.00 H new ATOM 0 HA GLU A 56 5.701 12.810 -17.112 1.00 0.00 H new ATOM 0 HB2 GLU A 56 5.345 13.985 -19.346 1.00 0.00 H new ATOM 0 HB3 GLU A 56 3.735 14.446 -18.833 1.00 0.00 H new ATOM 0 HG2 GLU A 56 4.704 15.715 -16.900 1.00 0.00 H new ATOM 0 HG3 GLU A 56 6.318 15.237 -17.388 1.00 0.00 H new ATOM 345 N LYS A 57 2.542 13.389 -16.456 1.00 0.00 N ATOM 346 CA LYS A 57 1.645 13.732 -15.311 1.00 0.00 C ATOM 347 C LYS A 57 1.454 12.532 -14.376 1.00 0.00 C ATOM 348 O LYS A 57 1.160 12.693 -13.208 1.00 0.00 O ATOM 349 CB LYS A 57 0.318 14.124 -15.958 1.00 0.00 C ATOM 350 CG LYS A 57 0.506 15.416 -16.754 1.00 0.00 C ATOM 351 CD LYS A 57 -0.835 15.857 -17.343 1.00 0.00 C ATOM 352 CE LYS A 57 -1.761 16.323 -16.216 1.00 0.00 C ATOM 353 NZ LYS A 57 -2.856 17.062 -16.903 1.00 0.00 N ATOM 0 H LYS A 57 2.066 13.170 -17.331 1.00 0.00 H new ATOM 0 HA LYS A 57 2.061 14.531 -14.698 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -0.029 13.326 -16.614 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -0.446 14.263 -15.193 1.00 0.00 H new ATOM 0 HG2 LYS A 57 0.905 16.198 -16.108 1.00 0.00 H new ATOM 0 HG3 LYS A 57 1.232 15.261 -17.552 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -0.682 16.664 -18.059 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -1.294 15.032 -17.887 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -2.150 15.477 -15.649 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -1.233 16.964 -15.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -3.515 17.443 -16.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -2.453 17.844 -17.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -3.366 16.415 -17.538 1.00 0.00 H new ATOM 367 N LEU A 58 1.613 11.333 -14.868 1.00 0.00 N ATOM 368 CA LEU A 58 1.428 10.147 -13.983 1.00 0.00 C ATOM 369 C LEU A 58 2.784 9.548 -13.603 1.00 0.00 C ATOM 370 O LEU A 58 2.860 8.543 -12.922 1.00 0.00 O ATOM 371 CB LEU A 58 0.609 9.154 -14.808 1.00 0.00 C ATOM 372 CG LEU A 58 1.496 8.515 -15.877 1.00 0.00 C ATOM 373 CD1 LEU A 58 2.016 7.168 -15.372 1.00 0.00 C ATOM 374 CD2 LEU A 58 0.678 8.298 -17.151 1.00 0.00 C ATOM 0 H LEU A 58 1.861 11.124 -15.835 1.00 0.00 H new ATOM 0 HA LEU A 58 0.928 10.406 -13.050 1.00 0.00 H new ATOM 0 HB2 LEU A 58 0.193 8.383 -14.159 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -0.232 9.664 -15.277 1.00 0.00 H new ATOM 0 HG LEU A 58 2.339 9.172 -16.090 1.00 0.00 H new ATOM 0 HD11 LEU A 58 2.648 6.713 -16.135 1.00 0.00 H new ATOM 0 HD12 LEU A 58 2.597 7.320 -14.462 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.174 6.510 -15.159 1.00 0.00 H new ATOM 0 HD21 LEU A 58 1.308 7.842 -17.915 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -0.164 7.640 -16.935 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.306 9.257 -17.512 1.00 0.00 H new ATOM 386 N LYS A 59 3.856 10.156 -14.030 1.00 0.00 N ATOM 387 CA LYS A 59 5.202 9.620 -13.682 1.00 0.00 C ATOM 388 C LYS A 59 5.287 9.350 -12.178 1.00 0.00 C ATOM 389 O LYS A 59 4.353 9.596 -11.440 1.00 0.00 O ATOM 390 CB LYS A 59 6.181 10.724 -14.075 1.00 0.00 C ATOM 391 CG LYS A 59 7.060 10.238 -15.226 1.00 0.00 C ATOM 392 CD LYS A 59 7.718 11.438 -15.905 1.00 0.00 C ATOM 393 CE LYS A 59 7.776 11.201 -17.415 1.00 0.00 C ATOM 394 NZ LYS A 59 8.264 12.486 -17.987 1.00 0.00 N ATOM 0 H LYS A 59 3.858 10.999 -14.604 1.00 0.00 H new ATOM 0 HA LYS A 59 5.416 8.681 -14.192 1.00 0.00 H new ATOM 0 HB2 LYS A 59 5.636 11.620 -14.373 1.00 0.00 H new ATOM 0 HB3 LYS A 59 6.800 10.997 -13.220 1.00 0.00 H new ATOM 0 HG2 LYS A 59 7.823 9.555 -14.852 1.00 0.00 H new ATOM 0 HG3 LYS A 59 6.460 9.682 -15.947 1.00 0.00 H new ATOM 0 HD2 LYS A 59 7.154 12.346 -15.690 1.00 0.00 H new ATOM 0 HD3 LYS A 59 8.723 11.587 -15.511 1.00 0.00 H new ATOM 0 HE2 LYS A 59 8.448 10.379 -17.660 1.00 0.00 H new ATOM 0 HE3 LYS A 59 6.795 10.939 -17.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 8.062 12.511 -19.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 7.782 13.280 -17.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 9.290 12.566 -17.835 1.00 0.00 H new ATOM 408 N SER A 60 6.399 8.849 -11.719 1.00 0.00 N ATOM 409 CA SER A 60 6.545 8.568 -10.262 1.00 0.00 C ATOM 410 C SER A 60 6.190 9.816 -9.447 1.00 0.00 C ATOM 411 O SER A 60 6.537 10.923 -9.810 1.00 0.00 O ATOM 412 CB SER A 60 8.017 8.203 -10.077 1.00 0.00 C ATOM 413 OG SER A 60 8.230 7.756 -8.746 1.00 0.00 O ATOM 0 H SER A 60 7.214 8.622 -12.289 1.00 0.00 H new ATOM 0 HA SER A 60 5.883 7.771 -9.924 1.00 0.00 H new ATOM 0 HB2 SER A 60 8.301 7.423 -10.784 1.00 0.00 H new ATOM 0 HB3 SER A 60 8.646 9.068 -10.287 1.00 0.00 H new ATOM 0 HG SER A 60 9.174 7.520 -8.627 1.00 0.00 H new ATOM 419 N GLY A 61 5.500 9.649 -8.354 1.00 0.00 N ATOM 420 CA GLY A 61 5.124 10.829 -7.523 1.00 0.00 C ATOM 421 C GLY A 61 3.717 11.290 -7.909 1.00 0.00 C ATOM 422 O GLY A 61 3.116 12.106 -7.240 1.00 0.00 O ATOM 0 H GLY A 61 5.180 8.748 -7.999 1.00 0.00 H new ATOM 0 HA2 GLY A 61 5.157 10.569 -6.465 1.00 0.00 H new ATOM 0 HA3 GLY A 61 5.839 11.638 -7.674 1.00 0.00 H new ATOM 426 N MET A 62 3.190 10.771 -8.984 1.00 0.00 N ATOM 427 CA MET A 62 1.822 11.175 -9.416 1.00 0.00 C ATOM 428 C MET A 62 0.803 10.108 -9.008 1.00 0.00 C ATOM 429 O MET A 62 1.155 8.990 -8.684 1.00 0.00 O ATOM 430 CB MET A 62 1.901 11.285 -10.939 1.00 0.00 C ATOM 431 CG MET A 62 2.994 12.284 -11.323 1.00 0.00 C ATOM 432 SD MET A 62 2.446 13.961 -10.920 1.00 0.00 S ATOM 433 CE MET A 62 3.759 14.351 -9.736 1.00 0.00 C ATOM 0 H MET A 62 3.648 10.084 -9.583 1.00 0.00 H new ATOM 0 HA MET A 62 1.505 12.111 -8.957 1.00 0.00 H new ATOM 0 HB2 MET A 62 2.117 10.309 -11.374 1.00 0.00 H new ATOM 0 HB3 MET A 62 0.941 11.608 -11.341 1.00 0.00 H new ATOM 0 HG2 MET A 62 3.916 12.053 -10.790 1.00 0.00 H new ATOM 0 HG3 MET A 62 3.214 12.208 -12.388 1.00 0.00 H new ATOM 0 HE1 MET A 62 3.922 15.429 -9.715 1.00 0.00 H new ATOM 0 HE2 MET A 62 3.467 14.009 -8.743 1.00 0.00 H new ATOM 0 HE3 MET A 62 4.680 13.851 -10.036 1.00 0.00 H new ATOM 443 N ARG A 63 -0.455 10.449 -9.017 1.00 0.00 N ATOM 444 CA ARG A 63 -1.502 9.460 -8.628 1.00 0.00 C ATOM 445 C ARG A 63 -2.047 8.748 -9.869 1.00 0.00 C ATOM 446 O ARG A 63 -2.940 9.233 -10.534 1.00 0.00 O ATOM 447 CB ARG A 63 -2.597 10.293 -7.960 1.00 0.00 C ATOM 448 CG ARG A 63 -3.683 9.365 -7.415 1.00 0.00 C ATOM 449 CD ARG A 63 -3.988 9.739 -5.963 1.00 0.00 C ATOM 450 NE ARG A 63 -2.719 9.485 -5.225 1.00 0.00 N ATOM 451 CZ ARG A 63 -2.434 10.181 -4.158 1.00 0.00 C ATOM 452 NH1 ARG A 63 -2.389 11.483 -4.221 1.00 0.00 N ATOM 453 NH2 ARG A 63 -2.194 9.573 -3.027 1.00 0.00 N ATOM 0 H ARG A 63 -0.805 11.371 -9.277 1.00 0.00 H new ATOM 0 HA ARG A 63 -1.116 8.685 -7.966 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -2.173 10.889 -7.151 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -3.027 10.991 -8.678 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -4.585 9.448 -8.021 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -3.354 8.328 -7.474 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -4.291 10.783 -5.880 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -4.804 9.137 -5.563 1.00 0.00 H new ATOM 0 HE ARG A 63 -2.073 8.767 -5.553 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -2.577 11.958 -5.104 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -2.166 12.027 -3.387 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -2.229 8.555 -2.978 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -1.971 10.116 -2.193 1.00 0.00 H new ATOM 467 N PHE A 64 -1.515 7.599 -10.189 1.00 0.00 N ATOM 468 CA PHE A 64 -2.003 6.860 -11.387 1.00 0.00 C ATOM 469 C PHE A 64 -3.536 6.832 -11.408 1.00 0.00 C ATOM 470 O PHE A 64 -4.148 6.823 -12.457 1.00 0.00 O ATOM 471 CB PHE A 64 -1.438 5.446 -11.235 1.00 0.00 C ATOM 472 CG PHE A 64 -1.789 4.625 -12.453 1.00 0.00 C ATOM 473 CD1 PHE A 64 -1.138 4.861 -13.671 1.00 0.00 C ATOM 474 CD2 PHE A 64 -2.766 3.626 -12.365 1.00 0.00 C ATOM 475 CE1 PHE A 64 -1.465 4.097 -14.799 1.00 0.00 C ATOM 476 CE2 PHE A 64 -3.092 2.863 -13.492 1.00 0.00 C ATOM 477 CZ PHE A 64 -2.442 3.099 -14.709 1.00 0.00 C ATOM 0 H PHE A 64 -0.764 7.141 -9.672 1.00 0.00 H new ATOM 0 HA PHE A 64 -1.686 7.327 -12.319 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -0.356 5.488 -11.112 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.843 4.976 -10.339 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -0.384 5.632 -13.740 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -3.269 3.444 -11.427 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.963 4.278 -15.738 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -3.845 2.092 -13.423 1.00 0.00 H new ATOM 0 HZ PHE A 64 -2.695 2.511 -15.579 1.00 0.00 H new ATOM 487 N ASN A 65 -4.161 6.822 -10.262 1.00 0.00 N ATOM 488 CA ASN A 65 -5.653 6.798 -10.235 1.00 0.00 C ATOM 489 C ASN A 65 -6.208 8.098 -10.819 1.00 0.00 C ATOM 490 O ASN A 65 -7.170 8.097 -11.560 1.00 0.00 O ATOM 491 CB ASN A 65 -6.029 6.674 -8.758 1.00 0.00 C ATOM 492 CG ASN A 65 -7.550 6.569 -8.629 1.00 0.00 C ATOM 493 OD1 ASN A 65 -8.168 5.746 -9.275 1.00 0.00 O ATOM 494 ND2 ASN A 65 -8.185 7.374 -7.821 1.00 0.00 N ATOM 0 H ASN A 65 -3.707 6.829 -9.348 1.00 0.00 H new ATOM 0 HA ASN A 65 -6.061 5.978 -10.826 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -5.554 5.795 -8.323 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -5.665 7.539 -8.205 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -9.199 7.312 -7.732 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -7.667 8.065 -7.278 1.00 0.00 H new ATOM 501 N GLU A 66 -5.607 9.208 -10.491 1.00 0.00 N ATOM 502 CA GLU A 66 -6.101 10.508 -11.028 1.00 0.00 C ATOM 503 C GLU A 66 -5.836 10.591 -12.536 1.00 0.00 C ATOM 504 O GLU A 66 -6.655 11.072 -13.294 1.00 0.00 O ATOM 505 CB GLU A 66 -5.299 11.574 -10.278 1.00 0.00 C ATOM 506 CG GLU A 66 -5.689 11.565 -8.796 1.00 0.00 C ATOM 507 CD GLU A 66 -6.207 12.947 -8.386 1.00 0.00 C ATOM 508 OE1 GLU A 66 -6.125 13.855 -9.196 1.00 0.00 O ATOM 509 OE2 GLU A 66 -6.679 13.072 -7.268 1.00 0.00 O ATOM 0 H GLU A 66 -4.796 9.272 -9.875 1.00 0.00 H new ATOM 0 HA GLU A 66 -7.175 10.635 -10.889 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -4.231 11.382 -10.384 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -5.490 12.557 -10.709 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.456 10.812 -8.617 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -4.828 11.294 -8.186 1.00 0.00 H new ATOM 516 N VAL A 67 -4.697 10.122 -12.976 1.00 0.00 N ATOM 517 CA VAL A 67 -4.381 10.175 -14.434 1.00 0.00 C ATOM 518 C VAL A 67 -5.286 9.211 -15.209 1.00 0.00 C ATOM 519 O VAL A 67 -5.730 9.504 -16.302 1.00 0.00 O ATOM 520 CB VAL A 67 -2.914 9.743 -14.535 1.00 0.00 C ATOM 521 CG1 VAL A 67 -2.536 9.523 -16.001 1.00 0.00 C ATOM 522 CG2 VAL A 67 -2.024 10.835 -13.941 1.00 0.00 C ATOM 0 H VAL A 67 -3.974 9.705 -12.390 1.00 0.00 H new ATOM 0 HA VAL A 67 -4.543 11.166 -14.858 1.00 0.00 H new ATOM 0 HB VAL A 67 -2.774 8.812 -13.985 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -1.492 9.216 -16.065 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -3.170 8.745 -16.427 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -2.676 10.450 -16.556 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -0.980 10.531 -14.011 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -2.170 11.763 -14.493 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -2.287 10.990 -12.895 1.00 0.00 H new ATOM 532 N ALA A 68 -5.558 8.063 -14.655 1.00 0.00 N ATOM 533 CA ALA A 68 -6.430 7.083 -15.362 1.00 0.00 C ATOM 534 C ALA A 68 -7.879 7.574 -15.383 1.00 0.00 C ATOM 535 O ALA A 68 -8.515 7.623 -16.417 1.00 0.00 O ATOM 536 CB ALA A 68 -6.312 5.796 -14.545 1.00 0.00 C ATOM 0 H ALA A 68 -5.215 7.760 -13.743 1.00 0.00 H new ATOM 0 HA ALA A 68 -6.133 6.940 -16.401 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -6.927 5.019 -14.999 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -5.272 5.471 -14.526 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -6.653 5.979 -13.526 1.00 0.00 H new ATOM 542 N ALA A 69 -8.406 7.934 -14.246 1.00 0.00 N ATOM 543 CA ALA A 69 -9.816 8.416 -14.194 1.00 0.00 C ATOM 544 C ALA A 69 -10.012 9.617 -15.126 1.00 0.00 C ATOM 545 O ALA A 69 -11.081 9.824 -15.668 1.00 0.00 O ATOM 546 CB ALA A 69 -10.034 8.827 -12.738 1.00 0.00 C ATOM 0 H ALA A 69 -7.921 7.915 -13.349 1.00 0.00 H new ATOM 0 HA ALA A 69 -10.523 7.652 -14.518 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -11.052 9.196 -12.612 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -9.877 7.965 -12.089 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -9.328 9.614 -12.472 1.00 0.00 H new ATOM 552 N GLN A 70 -8.997 10.418 -15.311 1.00 0.00 N ATOM 553 CA GLN A 70 -9.144 11.608 -16.202 1.00 0.00 C ATOM 554 C GLN A 70 -8.746 11.261 -17.641 1.00 0.00 C ATOM 555 O GLN A 70 -9.106 11.951 -18.574 1.00 0.00 O ATOM 556 CB GLN A 70 -8.189 12.655 -15.625 1.00 0.00 C ATOM 557 CG GLN A 70 -8.605 13.011 -14.199 1.00 0.00 C ATOM 558 CD GLN A 70 -10.055 13.479 -14.198 1.00 0.00 C ATOM 559 OE1 GLN A 70 -11.003 12.591 -14.247 1.00 0.00 O flip ATOM 560 NE2 GLN A 70 -10.329 14.662 -14.155 1.00 0.00 N flip ATOM 0 H GLN A 70 -8.077 10.302 -14.887 1.00 0.00 H new ATOM 0 HA GLN A 70 -10.174 11.963 -16.238 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -7.169 12.271 -15.630 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -8.196 13.549 -16.249 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -8.490 12.145 -13.548 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -7.958 13.794 -13.804 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -9.584 15.357 -14.117 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -11.305 14.960 -14.157 1.00 0.00 H new ATOM 569 N TYR A 71 -7.998 10.207 -17.830 1.00 0.00 N ATOM 570 CA TYR A 71 -7.571 9.834 -19.212 1.00 0.00 C ATOM 571 C TYR A 71 -8.296 8.572 -19.691 1.00 0.00 C ATOM 572 O TYR A 71 -7.952 8.002 -20.708 1.00 0.00 O ATOM 573 CB TYR A 71 -6.067 9.575 -19.104 1.00 0.00 C ATOM 574 CG TYR A 71 -5.346 10.837 -18.677 1.00 0.00 C ATOM 575 CD1 TYR A 71 -6.012 12.069 -18.681 1.00 0.00 C ATOM 576 CD2 TYR A 71 -4.007 10.769 -18.274 1.00 0.00 C ATOM 577 CE1 TYR A 71 -5.340 13.230 -18.283 1.00 0.00 C ATOM 578 CE2 TYR A 71 -3.336 11.932 -17.875 1.00 0.00 C ATOM 579 CZ TYR A 71 -4.002 13.162 -17.880 1.00 0.00 C ATOM 580 OH TYR A 71 -3.342 14.308 -17.483 1.00 0.00 O ATOM 0 H TYR A 71 -7.664 9.589 -17.090 1.00 0.00 H new ATOM 0 HA TYR A 71 -7.807 10.617 -19.932 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -5.879 8.779 -18.384 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -5.680 9.234 -20.064 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -7.045 12.123 -18.991 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -3.491 9.820 -18.271 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -5.855 14.179 -18.287 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -2.303 11.879 -17.563 1.00 0.00 H new ATOM 0 HH TYR A 71 -3.829 14.726 -16.743 1.00 0.00 H new ATOM 590 N SER A 72 -9.294 8.126 -18.976 1.00 0.00 N ATOM 591 CA SER A 72 -10.026 6.902 -19.413 1.00 0.00 C ATOM 592 C SER A 72 -10.966 7.236 -20.575 1.00 0.00 C ATOM 593 O SER A 72 -11.892 8.012 -20.434 1.00 0.00 O ATOM 594 CB SER A 72 -10.822 6.451 -18.189 1.00 0.00 C ATOM 595 OG SER A 72 -9.946 5.814 -17.266 1.00 0.00 O ATOM 0 H SER A 72 -9.632 8.553 -18.114 1.00 0.00 H new ATOM 0 HA SER A 72 -9.351 6.122 -19.765 1.00 0.00 H new ATOM 0 HB2 SER A 72 -11.304 7.308 -17.718 1.00 0.00 H new ATOM 0 HB3 SER A 72 -11.614 5.765 -18.489 1.00 0.00 H new ATOM 0 HG SER A 72 -9.148 6.367 -17.137 1.00 0.00 H new ATOM 601 N GLU A 73 -10.737 6.659 -21.724 1.00 0.00 N ATOM 602 CA GLU A 73 -11.617 6.945 -22.895 1.00 0.00 C ATOM 603 C GLU A 73 -12.563 5.766 -23.148 1.00 0.00 C ATOM 604 O GLU A 73 -13.232 5.701 -24.161 1.00 0.00 O ATOM 605 CB GLU A 73 -10.659 7.123 -24.075 1.00 0.00 C ATOM 606 CG GLU A 73 -11.450 7.480 -25.336 1.00 0.00 C ATOM 607 CD GLU A 73 -12.357 8.679 -25.049 1.00 0.00 C ATOM 608 OE1 GLU A 73 -11.901 9.597 -24.388 1.00 0.00 O ATOM 609 OE2 GLU A 73 -13.492 8.657 -25.496 1.00 0.00 O ATOM 0 H GLU A 73 -9.978 6.001 -21.903 1.00 0.00 H new ATOM 0 HA GLU A 73 -12.241 7.825 -22.737 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -9.936 7.908 -23.853 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -10.093 6.206 -24.237 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -10.767 7.715 -26.152 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -12.048 6.627 -25.656 1.00 0.00 H new ATOM 616 N ASP A 74 -12.622 4.832 -22.239 1.00 0.00 N ATOM 617 CA ASP A 74 -13.525 3.657 -22.436 1.00 0.00 C ATOM 618 C ASP A 74 -14.634 3.649 -21.381 1.00 0.00 C ATOM 619 O ASP A 74 -14.396 3.379 -20.222 1.00 0.00 O ATOM 620 CB ASP A 74 -12.623 2.434 -22.274 1.00 0.00 C ATOM 621 CG ASP A 74 -13.327 1.204 -22.847 1.00 0.00 C ATOM 622 OD1 ASP A 74 -13.588 1.197 -24.040 1.00 0.00 O ATOM 623 OD2 ASP A 74 -13.597 0.291 -22.085 1.00 0.00 O ATOM 0 H ASP A 74 -12.087 4.829 -21.371 1.00 0.00 H new ATOM 0 HA ASP A 74 -14.018 3.677 -23.408 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -11.676 2.597 -22.788 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -12.391 2.276 -21.221 1.00 0.00 H new ATOM 628 N LYS A 75 -15.844 3.943 -21.778 1.00 0.00 N ATOM 629 CA LYS A 75 -16.974 3.956 -20.800 1.00 0.00 C ATOM 630 C LYS A 75 -17.165 2.570 -20.179 1.00 0.00 C ATOM 631 O LYS A 75 -17.684 2.434 -19.089 1.00 0.00 O ATOM 632 CB LYS A 75 -18.206 4.339 -21.620 1.00 0.00 C ATOM 633 CG LYS A 75 -18.427 3.303 -22.723 1.00 0.00 C ATOM 634 CD LYS A 75 -19.530 3.789 -23.663 1.00 0.00 C ATOM 635 CE LYS A 75 -19.064 5.059 -24.379 1.00 0.00 C ATOM 636 NZ LYS A 75 -20.112 5.328 -25.400 1.00 0.00 N ATOM 0 H LYS A 75 -16.100 4.175 -22.738 1.00 0.00 H new ATOM 0 HA LYS A 75 -16.791 4.650 -19.979 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -19.083 4.392 -20.975 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -18.072 5.328 -22.057 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -17.503 3.146 -23.279 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -18.703 2.344 -22.286 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -19.770 3.015 -24.392 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -20.441 3.989 -23.099 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -18.967 5.892 -23.683 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -18.088 4.916 -24.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -19.864 6.185 -25.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -20.177 4.520 -26.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -21.029 5.467 -24.929 1.00 0.00 H new ATOM 650 N ALA A 76 -16.758 1.537 -20.865 1.00 0.00 N ATOM 651 CA ALA A 76 -16.926 0.162 -20.311 1.00 0.00 C ATOM 652 C ALA A 76 -15.755 -0.189 -19.390 1.00 0.00 C ATOM 653 O ALA A 76 -15.859 -1.057 -18.546 1.00 0.00 O ATOM 654 CB ALA A 76 -16.940 -0.753 -21.537 1.00 0.00 C ATOM 0 H ALA A 76 -16.317 1.585 -21.784 1.00 0.00 H new ATOM 0 HA ALA A 76 -17.833 0.064 -19.715 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -17.060 -1.788 -21.217 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -17.769 -0.476 -22.189 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -16.001 -0.648 -22.080 1.00 0.00 H new ATOM 660 N ARG A 77 -14.642 0.475 -19.543 1.00 0.00 N ATOM 661 CA ARG A 77 -13.467 0.171 -18.674 1.00 0.00 C ATOM 662 C ARG A 77 -12.910 1.460 -18.059 1.00 0.00 C ATOM 663 O ARG A 77 -11.748 1.542 -17.718 1.00 0.00 O ATOM 664 CB ARG A 77 -12.440 -0.464 -19.615 1.00 0.00 C ATOM 665 CG ARG A 77 -11.685 -1.575 -18.882 1.00 0.00 C ATOM 666 CD ARG A 77 -11.773 -2.874 -19.689 1.00 0.00 C ATOM 667 NE ARG A 77 -12.559 -3.807 -18.833 1.00 0.00 N ATOM 668 CZ ARG A 77 -12.163 -5.041 -18.678 1.00 0.00 C ATOM 669 NH1 ARG A 77 -12.493 -5.948 -19.556 1.00 0.00 N ATOM 670 NH2 ARG A 77 -11.437 -5.368 -17.645 1.00 0.00 N ATOM 0 H ARG A 77 -14.494 1.214 -20.231 1.00 0.00 H new ATOM 0 HA ARG A 77 -13.725 -0.486 -17.844 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -12.940 -0.870 -20.494 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -11.740 0.293 -19.968 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -10.642 -1.290 -18.744 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -12.109 -1.723 -17.889 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -12.264 -2.710 -20.648 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -10.782 -3.274 -19.902 1.00 0.00 H new ATOM 0 HE ARG A 77 -13.406 -3.481 -18.368 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -13.061 -5.693 -20.364 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -12.183 -6.912 -19.434 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -11.179 -4.659 -16.958 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -11.128 -6.332 -17.524 1.00 0.00 H new ATOM 684 N GLN A 78 -13.729 2.467 -17.917 1.00 0.00 N ATOM 685 CA GLN A 78 -13.244 3.751 -17.326 1.00 0.00 C ATOM 686 C GLN A 78 -12.362 3.480 -16.105 1.00 0.00 C ATOM 687 O GLN A 78 -11.486 4.254 -15.775 1.00 0.00 O ATOM 688 CB GLN A 78 -14.512 4.493 -16.900 1.00 0.00 C ATOM 689 CG GLN A 78 -15.212 5.063 -18.132 1.00 0.00 C ATOM 690 CD GLN A 78 -16.397 5.928 -17.694 1.00 0.00 C ATOM 691 OE1 GLN A 78 -16.216 7.038 -17.234 1.00 0.00 O ATOM 692 NE2 GLN A 78 -17.609 5.464 -17.819 1.00 0.00 N ATOM 0 H GLN A 78 -14.713 2.458 -18.184 1.00 0.00 H new ATOM 0 HA GLN A 78 -12.644 4.324 -18.033 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -15.181 3.815 -16.370 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -14.260 5.297 -16.208 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -14.512 5.658 -18.718 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -15.558 4.253 -18.774 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -17.761 4.532 -18.205 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -18.405 6.033 -17.531 1.00 0.00 H new ATOM 701 N GLY A 79 -12.597 2.392 -15.426 1.00 0.00 N ATOM 702 CA GLY A 79 -11.784 2.076 -14.217 1.00 0.00 C ATOM 703 C GLY A 79 -10.297 2.025 -14.577 1.00 0.00 C ATOM 704 O GLY A 79 -9.444 2.055 -13.712 1.00 0.00 O ATOM 0 H GLY A 79 -13.317 1.707 -15.656 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -11.954 2.830 -13.449 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -12.097 1.119 -13.799 1.00 0.00 H new ATOM 708 N GLY A 80 -9.976 1.939 -15.838 1.00 0.00 N ATOM 709 CA GLY A 80 -8.542 1.879 -16.231 1.00 0.00 C ATOM 710 C GLY A 80 -7.906 0.631 -15.620 1.00 0.00 C ATOM 711 O GLY A 80 -6.711 0.566 -15.420 1.00 0.00 O ATOM 0 H GLY A 80 -10.642 1.908 -16.610 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -8.451 1.854 -17.317 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -8.021 2.773 -15.888 1.00 0.00 H new ATOM 715 N ASP A 81 -8.700 -0.364 -15.321 1.00 0.00 N ATOM 716 CA ASP A 81 -8.138 -1.610 -14.721 1.00 0.00 C ATOM 717 C ASP A 81 -8.650 -2.843 -15.469 1.00 0.00 C ATOM 718 O ASP A 81 -9.787 -2.899 -15.892 1.00 0.00 O ATOM 719 CB ASP A 81 -8.631 -1.618 -13.273 1.00 0.00 C ATOM 720 CG ASP A 81 -8.067 -2.843 -12.548 1.00 0.00 C ATOM 721 OD1 ASP A 81 -7.194 -3.489 -13.104 1.00 0.00 O ATOM 722 OD2 ASP A 81 -8.518 -3.113 -11.447 1.00 0.00 O ATOM 0 H ASP A 81 -9.710 -0.368 -15.466 1.00 0.00 H new ATOM 0 HA ASP A 81 -7.050 -1.635 -14.780 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -8.317 -0.706 -12.766 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -9.721 -1.638 -13.249 1.00 0.00 H new ATOM 727 N LEU A 82 -7.817 -3.835 -15.633 1.00 0.00 N ATOM 728 CA LEU A 82 -8.257 -5.065 -16.350 1.00 0.00 C ATOM 729 C LEU A 82 -8.518 -6.194 -15.348 1.00 0.00 C ATOM 730 O LEU A 82 -9.225 -7.139 -15.635 1.00 0.00 O ATOM 731 CB LEU A 82 -7.097 -5.417 -17.282 1.00 0.00 C ATOM 732 CG LEU A 82 -7.142 -4.515 -18.518 1.00 0.00 C ATOM 733 CD1 LEU A 82 -6.703 -3.100 -18.136 1.00 0.00 C ATOM 734 CD2 LEU A 82 -6.204 -5.070 -19.592 1.00 0.00 C ATOM 0 H LEU A 82 -6.852 -3.846 -15.302 1.00 0.00 H new ATOM 0 HA LEU A 82 -9.185 -4.916 -16.902 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -6.148 -5.291 -16.762 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -7.161 -6.464 -17.580 1.00 0.00 H new ATOM 0 HG LEU A 82 -8.160 -4.485 -18.907 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -6.735 -2.459 -19.017 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -7.374 -2.704 -17.374 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -5.686 -3.128 -17.745 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -6.237 -4.427 -20.471 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -5.186 -5.103 -19.204 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -6.520 -6.076 -19.866 1.00 0.00 H new ATOM 746 N GLY A 83 -7.961 -6.098 -14.169 1.00 0.00 N ATOM 747 CA GLY A 83 -8.187 -7.161 -13.147 1.00 0.00 C ATOM 748 C GLY A 83 -7.106 -8.238 -13.262 1.00 0.00 C ATOM 749 O GLY A 83 -6.128 -8.082 -13.965 1.00 0.00 O ATOM 0 H GLY A 83 -7.360 -5.330 -13.870 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -8.172 -6.725 -12.148 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -9.172 -7.607 -13.286 1.00 0.00 H new ATOM 753 N TRP A 84 -7.281 -9.332 -12.570 1.00 0.00 N ATOM 754 CA TRP A 84 -6.273 -10.430 -12.626 1.00 0.00 C ATOM 755 C TRP A 84 -6.532 -11.328 -13.837 1.00 0.00 C ATOM 756 O TRP A 84 -7.628 -11.813 -14.040 1.00 0.00 O ATOM 757 CB TRP A 84 -6.474 -11.211 -11.326 1.00 0.00 C ATOM 758 CG TRP A 84 -6.182 -10.319 -10.165 1.00 0.00 C ATOM 759 CD1 TRP A 84 -4.976 -10.197 -9.567 1.00 0.00 C ATOM 760 CD2 TRP A 84 -7.084 -9.421 -9.456 1.00 0.00 C ATOM 761 NE1 TRP A 84 -5.079 -9.284 -8.535 1.00 0.00 N ATOM 762 CE2 TRP A 84 -6.359 -8.776 -8.425 1.00 0.00 C ATOM 763 CE3 TRP A 84 -8.448 -9.105 -9.603 1.00 0.00 C ATOM 764 CZ2 TRP A 84 -6.964 -7.851 -7.572 1.00 0.00 C ATOM 765 CZ3 TRP A 84 -9.059 -8.174 -8.747 1.00 0.00 C ATOM 766 CH2 TRP A 84 -8.319 -7.550 -7.733 1.00 0.00 C ATOM 0 H TRP A 84 -8.083 -9.513 -11.966 1.00 0.00 H new ATOM 0 HA TRP A 84 -5.255 -10.053 -12.726 1.00 0.00 H new ATOM 0 HB2 TRP A 84 -7.497 -11.582 -11.266 1.00 0.00 H new ATOM 0 HB3 TRP A 84 -5.817 -12.081 -11.305 1.00 0.00 H new ATOM 0 HD1 TRP A 84 -4.078 -10.727 -9.850 1.00 0.00 H new ATOM 0 HE1 TRP A 84 -4.304 -9.017 -7.928 1.00 0.00 H new ATOM 0 HE3 TRP A 84 -9.028 -9.582 -10.379 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 -6.389 -7.372 -6.794 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 -10.105 -7.937 -8.871 1.00 0.00 H new ATOM 0 HH2 TRP A 84 -8.796 -6.837 -7.077 1.00 0.00 H new ATOM 777 N MET A 85 -5.532 -11.554 -14.641 1.00 0.00 N ATOM 778 CA MET A 85 -5.717 -12.419 -15.839 1.00 0.00 C ATOM 779 C MET A 85 -4.485 -13.304 -16.031 1.00 0.00 C ATOM 780 O MET A 85 -3.371 -12.853 -15.890 1.00 0.00 O ATOM 781 CB MET A 85 -5.873 -11.443 -17.007 1.00 0.00 C ATOM 782 CG MET A 85 -4.512 -10.831 -17.353 1.00 0.00 C ATOM 783 SD MET A 85 -4.669 -9.803 -18.835 1.00 0.00 S ATOM 784 CE MET A 85 -5.398 -8.351 -18.036 1.00 0.00 C ATOM 0 H MET A 85 -4.592 -11.176 -14.520 1.00 0.00 H new ATOM 0 HA MET A 85 -6.577 -13.083 -15.751 1.00 0.00 H new ATOM 0 HB2 MET A 85 -6.281 -11.961 -17.875 1.00 0.00 H new ATOM 0 HB3 MET A 85 -6.580 -10.656 -16.744 1.00 0.00 H new ATOM 0 HG2 MET A 85 -4.149 -10.231 -16.519 1.00 0.00 H new ATOM 0 HG3 MET A 85 -3.779 -11.620 -17.521 1.00 0.00 H new ATOM 0 HE1 MET A 85 -5.180 -7.462 -18.628 1.00 0.00 H new ATOM 0 HE2 MET A 85 -6.478 -8.481 -17.961 1.00 0.00 H new ATOM 0 HE3 MET A 85 -4.976 -8.235 -17.038 1.00 0.00 H new ATOM 794 N THR A 86 -4.675 -14.556 -16.349 1.00 0.00 N ATOM 795 CA THR A 86 -3.504 -15.462 -16.549 1.00 0.00 C ATOM 796 C THR A 86 -2.857 -15.182 -17.910 1.00 0.00 C ATOM 797 O THR A 86 -1.678 -14.902 -18.002 1.00 0.00 O ATOM 798 CB THR A 86 -4.080 -16.876 -16.495 1.00 0.00 C ATOM 799 OG1 THR A 86 -4.794 -17.044 -15.278 1.00 0.00 O ATOM 800 CG2 THR A 86 -2.947 -17.898 -16.571 1.00 0.00 C ATOM 0 H THR A 86 -5.588 -14.991 -16.479 1.00 0.00 H new ATOM 0 HA THR A 86 -2.730 -15.319 -15.795 1.00 0.00 H new ATOM 0 HB THR A 86 -4.754 -17.027 -17.338 1.00 0.00 H new ATOM 0 HG1 THR A 86 -5.167 -17.949 -15.240 1.00 0.00 H new ATOM 0 HG21 THR A 86 -3.362 -18.905 -16.532 1.00 0.00 H new ATOM 0 HG22 THR A 86 -2.400 -17.767 -17.505 1.00 0.00 H new ATOM 0 HG23 THR A 86 -2.269 -17.753 -15.730 1.00 0.00 H new ATOM 808 N ARG A 87 -3.625 -15.238 -18.965 1.00 0.00 N ATOM 809 CA ARG A 87 -3.061 -14.956 -20.316 1.00 0.00 C ATOM 810 C ARG A 87 -3.636 -13.636 -20.842 1.00 0.00 C ATOM 811 O ARG A 87 -4.334 -12.933 -20.138 1.00 0.00 O ATOM 812 CB ARG A 87 -3.504 -16.133 -21.191 1.00 0.00 C ATOM 813 CG ARG A 87 -5.023 -16.102 -21.363 1.00 0.00 C ATOM 814 CD ARG A 87 -5.412 -16.924 -22.594 1.00 0.00 C ATOM 815 NE ARG A 87 -6.893 -16.800 -22.686 1.00 0.00 N ATOM 816 CZ ARG A 87 -7.659 -17.631 -22.033 1.00 0.00 C ATOM 817 NH1 ARG A 87 -7.870 -17.460 -20.757 1.00 0.00 N ATOM 818 NH2 ARG A 87 -8.212 -18.636 -22.655 1.00 0.00 N ATOM 0 H ARG A 87 -4.619 -15.467 -18.949 1.00 0.00 H new ATOM 0 HA ARG A 87 -1.976 -14.856 -20.308 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -3.017 -16.079 -22.164 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -3.199 -17.074 -20.734 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -5.509 -16.505 -20.474 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -5.366 -15.074 -21.475 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -4.927 -16.543 -23.493 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -5.109 -17.965 -22.486 1.00 0.00 H new ATOM 0 HE ARG A 87 -7.309 -16.066 -23.259 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -7.436 -16.676 -20.269 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -8.469 -18.110 -20.248 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -8.046 -18.773 -23.652 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -8.810 -19.285 -22.144 1.00 0.00 H new ATOM 832 N GLY A 88 -3.354 -13.290 -22.068 1.00 0.00 N ATOM 833 CA GLY A 88 -3.892 -12.014 -22.619 1.00 0.00 C ATOM 834 C GLY A 88 -4.103 -12.159 -24.127 1.00 0.00 C ATOM 835 O GLY A 88 -3.366 -12.850 -24.801 1.00 0.00 O ATOM 0 H GLY A 88 -2.777 -13.833 -22.710 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -4.834 -11.764 -22.132 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -3.200 -11.197 -22.415 1.00 0.00 H new ATOM 839 N SER A 89 -5.107 -11.523 -24.661 1.00 0.00 N ATOM 840 CA SER A 89 -5.360 -11.641 -26.125 1.00 0.00 C ATOM 841 C SER A 89 -5.726 -10.280 -26.724 1.00 0.00 C ATOM 842 O SER A 89 -6.232 -10.192 -27.825 1.00 0.00 O ATOM 843 CB SER A 89 -6.532 -12.612 -26.237 1.00 0.00 C ATOM 844 OG SER A 89 -7.697 -12.008 -25.689 1.00 0.00 O ATOM 0 H SER A 89 -5.761 -10.929 -24.151 1.00 0.00 H new ATOM 0 HA SER A 89 -4.481 -11.989 -26.668 1.00 0.00 H new ATOM 0 HB2 SER A 89 -6.702 -12.876 -27.281 1.00 0.00 H new ATOM 0 HB3 SER A 89 -6.305 -13.537 -25.707 1.00 0.00 H new ATOM 0 HG SER A 89 -8.452 -12.629 -25.761 1.00 0.00 H new ATOM 850 N MET A 90 -5.460 -9.217 -26.016 1.00 0.00 N ATOM 851 CA MET A 90 -5.779 -7.866 -26.558 1.00 0.00 C ATOM 852 C MET A 90 -4.501 -7.227 -27.103 1.00 0.00 C ATOM 853 O MET A 90 -3.625 -6.848 -26.357 1.00 0.00 O ATOM 854 CB MET A 90 -6.314 -7.068 -25.367 1.00 0.00 C ATOM 855 CG MET A 90 -7.680 -7.617 -24.952 1.00 0.00 C ATOM 856 SD MET A 90 -8.899 -7.237 -26.235 1.00 0.00 S ATOM 857 CE MET A 90 -10.317 -6.998 -25.140 1.00 0.00 C ATOM 0 H MET A 90 -5.037 -9.225 -25.088 1.00 0.00 H new ATOM 0 HA MET A 90 -6.504 -7.900 -27.371 1.00 0.00 H new ATOM 0 HB2 MET A 90 -5.617 -7.131 -24.532 1.00 0.00 H new ATOM 0 HB3 MET A 90 -6.400 -6.014 -25.632 1.00 0.00 H new ATOM 0 HG2 MET A 90 -7.620 -8.695 -24.800 1.00 0.00 H new ATOM 0 HG3 MET A 90 -7.987 -7.178 -24.003 1.00 0.00 H new ATOM 0 HE1 MET A 90 -11.197 -6.750 -25.733 1.00 0.00 H new ATOM 0 HE2 MET A 90 -10.503 -7.915 -24.581 1.00 0.00 H new ATOM 0 HE3 MET A 90 -10.107 -6.185 -24.445 1.00 0.00 H new ATOM 867 N VAL A 91 -4.386 -7.120 -28.398 1.00 0.00 N ATOM 868 CA VAL A 91 -3.159 -6.520 -28.999 1.00 0.00 C ATOM 869 C VAL A 91 -1.944 -7.408 -28.695 1.00 0.00 C ATOM 870 O VAL A 91 -1.583 -7.618 -27.554 1.00 0.00 O ATOM 871 CB VAL A 91 -3.011 -5.144 -28.347 1.00 0.00 C ATOM 872 CG1 VAL A 91 -1.962 -4.330 -29.104 1.00 0.00 C ATOM 873 CG2 VAL A 91 -4.350 -4.399 -28.390 1.00 0.00 C ATOM 0 H VAL A 91 -5.091 -7.423 -29.069 1.00 0.00 H new ATOM 0 HA VAL A 91 -3.229 -6.434 -30.083 1.00 0.00 H new ATOM 0 HB VAL A 91 -2.701 -5.274 -27.310 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -1.857 -3.350 -28.639 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -1.005 -4.851 -29.073 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -2.275 -4.208 -30.141 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -4.237 -3.420 -27.924 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -4.663 -4.273 -29.426 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -5.103 -4.973 -27.850 1.00 0.00 H new ATOM 883 N GLY A 92 -1.325 -7.939 -29.715 1.00 0.00 N ATOM 884 CA GLY A 92 -0.144 -8.831 -29.515 1.00 0.00 C ATOM 885 C GLY A 92 0.912 -8.172 -28.615 1.00 0.00 C ATOM 886 O GLY A 92 1.352 -8.764 -27.647 1.00 0.00 O ATOM 0 H GLY A 92 -1.589 -7.792 -30.689 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -0.468 -9.771 -29.069 1.00 0.00 H new ATOM 0 HA3 GLY A 92 0.299 -9.072 -30.481 1.00 0.00 H new ATOM 890 N PRO A 93 1.310 -6.979 -28.972 1.00 0.00 N ATOM 891 CA PRO A 93 2.350 -6.263 -28.187 1.00 0.00 C ATOM 892 C PRO A 93 1.857 -5.915 -26.777 1.00 0.00 C ATOM 893 O PRO A 93 2.625 -5.899 -25.836 1.00 0.00 O ATOM 894 CB PRO A 93 2.625 -5.010 -29.017 1.00 0.00 C ATOM 895 CG PRO A 93 1.385 -4.807 -29.822 1.00 0.00 C ATOM 896 CD PRO A 93 0.841 -6.181 -30.113 1.00 0.00 C ATOM 0 HA PRO A 93 3.245 -6.864 -28.025 1.00 0.00 H new ATOM 0 HB2 PRO A 93 2.828 -4.150 -28.379 1.00 0.00 H new ATOM 0 HB3 PRO A 93 3.496 -5.144 -29.659 1.00 0.00 H new ATOM 0 HG2 PRO A 93 0.658 -4.209 -29.272 1.00 0.00 H new ATOM 0 HG3 PRO A 93 1.604 -4.272 -30.746 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -0.247 -6.177 -30.181 1.00 0.00 H new ATOM 0 HD3 PRO A 93 1.218 -6.571 -31.059 1.00 0.00 H new ATOM 904 N PHE A 94 0.590 -5.645 -26.612 1.00 0.00 N ATOM 905 CA PHE A 94 0.080 -5.312 -25.247 1.00 0.00 C ATOM 906 C PHE A 94 0.250 -6.517 -24.318 1.00 0.00 C ATOM 907 O PHE A 94 0.814 -6.412 -23.247 1.00 0.00 O ATOM 908 CB PHE A 94 -1.402 -4.999 -25.439 1.00 0.00 C ATOM 909 CG PHE A 94 -1.982 -4.450 -24.156 1.00 0.00 C ATOM 910 CD1 PHE A 94 -2.425 -5.323 -23.154 1.00 0.00 C ATOM 911 CD2 PHE A 94 -2.085 -3.065 -23.971 1.00 0.00 C ATOM 912 CE1 PHE A 94 -2.969 -4.812 -21.968 1.00 0.00 C ATOM 913 CE2 PHE A 94 -2.630 -2.555 -22.787 1.00 0.00 C ATOM 914 CZ PHE A 94 -3.071 -3.428 -21.785 1.00 0.00 C ATOM 0 H PHE A 94 -0.110 -5.640 -27.354 1.00 0.00 H new ATOM 0 HA PHE A 94 0.618 -4.477 -24.799 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -1.528 -4.275 -26.244 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -1.938 -5.901 -25.734 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -2.347 -6.391 -23.296 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -1.744 -2.391 -24.742 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -3.309 -5.486 -21.196 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -2.710 -1.487 -22.646 1.00 0.00 H new ATOM 0 HZ PHE A 94 -3.490 -3.034 -20.871 1.00 0.00 H new ATOM 924 N GLN A 95 -0.234 -7.660 -24.724 1.00 0.00 N ATOM 925 CA GLN A 95 -0.102 -8.875 -23.868 1.00 0.00 C ATOM 926 C GLN A 95 1.369 -9.114 -23.513 1.00 0.00 C ATOM 927 O GLN A 95 1.708 -9.379 -22.377 1.00 0.00 O ATOM 928 CB GLN A 95 -0.639 -10.024 -24.724 1.00 0.00 C ATOM 929 CG GLN A 95 -0.684 -11.309 -23.894 1.00 0.00 C ATOM 930 CD GLN A 95 -0.818 -12.515 -24.828 1.00 0.00 C ATOM 931 OE1 GLN A 95 -0.871 -12.361 -26.031 1.00 0.00 O ATOM 932 NE2 GLN A 95 -0.878 -13.716 -24.320 1.00 0.00 N ATOM 0 H GLN A 95 -0.715 -7.805 -25.612 1.00 0.00 H new ATOM 0 HA GLN A 95 -0.645 -8.778 -22.928 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -1.636 -9.782 -25.091 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -0.004 -10.166 -25.598 1.00 0.00 H new ATOM 0 HG2 GLN A 95 0.222 -11.399 -23.294 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -1.524 -11.277 -23.200 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -0.833 -13.845 -23.309 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -0.969 -14.525 -24.934 1.00 0.00 H new ATOM 941 N GLU A 96 2.244 -9.028 -24.478 1.00 0.00 N ATOM 942 CA GLU A 96 3.691 -9.256 -24.191 1.00 0.00 C ATOM 943 C GLU A 96 4.190 -8.266 -23.134 1.00 0.00 C ATOM 944 O GLU A 96 4.837 -8.642 -22.177 1.00 0.00 O ATOM 945 CB GLU A 96 4.401 -9.019 -25.524 1.00 0.00 C ATOM 946 CG GLU A 96 4.065 -10.152 -26.495 1.00 0.00 C ATOM 947 CD GLU A 96 4.794 -9.919 -27.819 1.00 0.00 C ATOM 948 OE1 GLU A 96 5.882 -9.367 -27.784 1.00 0.00 O ATOM 949 OE2 GLU A 96 4.254 -10.298 -28.845 1.00 0.00 O ATOM 0 H GLU A 96 2.022 -8.811 -25.449 1.00 0.00 H new ATOM 0 HA GLU A 96 3.879 -10.256 -23.799 1.00 0.00 H new ATOM 0 HB2 GLU A 96 4.093 -8.062 -25.946 1.00 0.00 H new ATOM 0 HB3 GLU A 96 5.479 -8.967 -25.369 1.00 0.00 H new ATOM 0 HG2 GLU A 96 4.360 -11.111 -26.069 1.00 0.00 H new ATOM 0 HG3 GLU A 96 2.989 -10.195 -26.662 1.00 0.00 H new ATOM 956 N ALA A 97 3.903 -7.004 -23.301 1.00 0.00 N ATOM 957 CA ALA A 97 4.371 -5.997 -22.305 1.00 0.00 C ATOM 958 C ALA A 97 3.666 -6.209 -20.962 1.00 0.00 C ATOM 959 O ALA A 97 4.234 -5.991 -19.909 1.00 0.00 O ATOM 960 CB ALA A 97 3.988 -4.641 -22.901 1.00 0.00 C ATOM 0 H ALA A 97 3.366 -6.627 -24.082 1.00 0.00 H new ATOM 0 HA ALA A 97 5.442 -6.073 -22.116 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.300 -3.845 -22.225 1.00 0.00 H new ATOM 0 HB2 ALA A 97 4.483 -4.514 -23.864 1.00 0.00 H new ATOM 0 HB3 ALA A 97 2.908 -4.597 -23.040 1.00 0.00 H new ATOM 966 N ALA A 98 2.431 -6.628 -20.990 1.00 0.00 N ATOM 967 CA ALA A 98 1.686 -6.850 -19.716 1.00 0.00 C ATOM 968 C ALA A 98 2.381 -7.915 -18.860 1.00 0.00 C ATOM 969 O ALA A 98 2.461 -7.794 -17.653 1.00 0.00 O ATOM 970 CB ALA A 98 0.303 -7.333 -20.150 1.00 0.00 C ATOM 0 H ALA A 98 1.904 -6.827 -21.840 1.00 0.00 H new ATOM 0 HA ALA A 98 1.636 -5.946 -19.109 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -0.310 -7.520 -19.269 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -0.172 -6.570 -20.767 1.00 0.00 H new ATOM 0 HB3 ALA A 98 0.403 -8.254 -20.724 1.00 0.00 H new ATOM 976 N PHE A 99 2.872 -8.960 -19.468 1.00 0.00 N ATOM 977 CA PHE A 99 3.547 -10.030 -18.677 1.00 0.00 C ATOM 978 C PHE A 99 5.068 -9.937 -18.819 1.00 0.00 C ATOM 979 O PHE A 99 5.789 -10.844 -18.452 1.00 0.00 O ATOM 980 CB PHE A 99 3.031 -11.340 -19.267 1.00 0.00 C ATOM 981 CG PHE A 99 1.705 -11.677 -18.636 1.00 0.00 C ATOM 982 CD1 PHE A 99 0.660 -10.748 -18.673 1.00 0.00 C ATOM 983 CD2 PHE A 99 1.521 -12.915 -18.009 1.00 0.00 C ATOM 984 CE1 PHE A 99 -0.571 -11.056 -18.084 1.00 0.00 C ATOM 985 CE2 PHE A 99 0.290 -13.223 -17.421 1.00 0.00 C ATOM 986 CZ PHE A 99 -0.755 -12.293 -17.458 1.00 0.00 C ATOM 0 H PHE A 99 2.836 -9.120 -20.475 1.00 0.00 H new ATOM 0 HA PHE A 99 3.332 -9.945 -17.612 1.00 0.00 H new ATOM 0 HB2 PHE A 99 2.921 -11.248 -20.347 1.00 0.00 H new ATOM 0 HB3 PHE A 99 3.748 -12.141 -19.087 1.00 0.00 H new ATOM 0 HD1 PHE A 99 0.803 -9.793 -19.156 1.00 0.00 H new ATOM 0 HD2 PHE A 99 2.329 -13.631 -17.979 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -1.378 -10.339 -18.113 1.00 0.00 H new ATOM 0 HE2 PHE A 99 0.146 -14.178 -16.938 1.00 0.00 H new ATOM 0 HZ PHE A 99 -1.705 -12.531 -17.002 1.00 0.00 H new ATOM 996 N ALA A 100 5.565 -8.852 -19.343 1.00 0.00 N ATOM 997 CA ALA A 100 7.040 -8.710 -19.498 1.00 0.00 C ATOM 998 C ALA A 100 7.501 -7.359 -18.942 1.00 0.00 C ATOM 999 O ALA A 100 8.660 -7.007 -19.017 1.00 0.00 O ATOM 1000 CB ALA A 100 7.293 -8.792 -21.003 1.00 0.00 C ATOM 0 H ALA A 100 5.015 -8.058 -19.670 1.00 0.00 H new ATOM 0 HA ALA A 100 7.589 -9.479 -18.955 1.00 0.00 H new ATOM 0 HB1 ALA A 100 8.361 -8.695 -21.198 1.00 0.00 H new ATOM 0 HB2 ALA A 100 6.941 -9.752 -21.379 1.00 0.00 H new ATOM 0 HB3 ALA A 100 6.758 -7.987 -21.506 1.00 0.00 H new ATOM 1006 N LEU A 101 6.599 -6.604 -18.383 1.00 0.00 N ATOM 1007 CA LEU A 101 6.972 -5.277 -17.815 1.00 0.00 C ATOM 1008 C LEU A 101 7.845 -5.432 -16.553 1.00 0.00 C ATOM 1009 O LEU A 101 8.764 -4.663 -16.351 1.00 0.00 O ATOM 1010 CB LEU A 101 5.636 -4.621 -17.464 1.00 0.00 C ATOM 1011 CG LEU A 101 5.877 -3.224 -16.892 1.00 0.00 C ATOM 1012 CD1 LEU A 101 6.561 -2.349 -17.943 1.00 0.00 C ATOM 1013 CD2 LEU A 101 4.536 -2.597 -16.505 1.00 0.00 C ATOM 0 H LEU A 101 5.613 -6.849 -18.294 1.00 0.00 H new ATOM 0 HA LEU A 101 7.559 -4.686 -18.517 1.00 0.00 H new ATOM 0 HB2 LEU A 101 5.008 -4.556 -18.353 1.00 0.00 H new ATOM 0 HB3 LEU A 101 5.100 -5.233 -16.739 1.00 0.00 H new ATOM 0 HG LEU A 101 6.516 -3.298 -16.012 1.00 0.00 H new ATOM 0 HD11 LEU A 101 6.732 -1.354 -17.533 1.00 0.00 H new ATOM 0 HD12 LEU A 101 7.516 -2.795 -18.222 1.00 0.00 H new ATOM 0 HD13 LEU A 101 5.924 -2.274 -18.824 1.00 0.00 H new ATOM 0 HD21 LEU A 101 4.705 -1.601 -16.097 1.00 0.00 H new ATOM 0 HD22 LEU A 101 3.900 -2.525 -17.387 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.047 -3.218 -15.755 1.00 0.00 H new ATOM 1025 N PRO A 102 7.524 -6.405 -15.730 1.00 0.00 N ATOM 1026 CA PRO A 102 8.293 -6.619 -14.476 1.00 0.00 C ATOM 1027 C PRO A 102 9.646 -7.295 -14.740 1.00 0.00 C ATOM 1028 O PRO A 102 10.389 -7.578 -13.821 1.00 0.00 O ATOM 1029 CB PRO A 102 7.389 -7.531 -13.651 1.00 0.00 C ATOM 1030 CG PRO A 102 6.530 -8.246 -14.644 1.00 0.00 C ATOM 1031 CD PRO A 102 6.435 -7.383 -15.877 1.00 0.00 C ATOM 0 HA PRO A 102 8.533 -5.680 -13.977 1.00 0.00 H new ATOM 0 HB2 PRO A 102 7.975 -8.235 -13.061 1.00 0.00 H new ATOM 0 HB3 PRO A 102 6.784 -6.955 -12.951 1.00 0.00 H new ATOM 0 HG2 PRO A 102 6.958 -9.218 -14.890 1.00 0.00 H new ATOM 0 HG3 PRO A 102 5.539 -8.430 -14.229 1.00 0.00 H new ATOM 0 HD2 PRO A 102 6.553 -7.974 -16.785 1.00 0.00 H new ATOM 0 HD3 PRO A 102 5.465 -6.890 -15.942 1.00 0.00 H new ATOM 1039 N VAL A 103 9.983 -7.558 -15.974 1.00 0.00 N ATOM 1040 CA VAL A 103 11.296 -8.215 -16.252 1.00 0.00 C ATOM 1041 C VAL A 103 12.428 -7.185 -16.202 1.00 0.00 C ATOM 1042 O VAL A 103 13.562 -7.508 -15.904 1.00 0.00 O ATOM 1043 CB VAL A 103 11.171 -8.798 -17.658 1.00 0.00 C ATOM 1044 CG1 VAL A 103 9.896 -9.637 -17.757 1.00 0.00 C ATOM 1045 CG2 VAL A 103 11.114 -7.658 -18.676 1.00 0.00 C ATOM 0 H VAL A 103 9.414 -7.350 -16.795 1.00 0.00 H new ATOM 0 HA VAL A 103 11.529 -8.983 -15.514 1.00 0.00 H new ATOM 0 HB VAL A 103 12.034 -9.431 -17.866 1.00 0.00 H new ATOM 0 HG11 VAL A 103 9.810 -10.051 -18.762 1.00 0.00 H new ATOM 0 HG12 VAL A 103 9.938 -10.450 -17.032 1.00 0.00 H new ATOM 0 HG13 VAL A 103 9.030 -9.009 -17.548 1.00 0.00 H new ATOM 0 HG21 VAL A 103 11.025 -8.071 -19.681 1.00 0.00 H new ATOM 0 HG22 VAL A 103 10.252 -7.025 -18.466 1.00 0.00 H new ATOM 0 HG23 VAL A 103 12.025 -7.064 -18.608 1.00 0.00 H new ATOM 1055 N SER A 104 12.135 -5.948 -16.495 1.00 0.00 N ATOM 1056 CA SER A 104 13.199 -4.902 -16.467 1.00 0.00 C ATOM 1057 C SER A 104 13.027 -3.999 -15.244 1.00 0.00 C ATOM 1058 O SER A 104 13.548 -2.902 -15.193 1.00 0.00 O ATOM 1059 CB SER A 104 12.996 -4.103 -17.752 1.00 0.00 C ATOM 1060 OG SER A 104 13.144 -4.968 -18.870 1.00 0.00 O ATOM 0 H SER A 104 11.206 -5.615 -16.753 1.00 0.00 H new ATOM 0 HA SER A 104 14.198 -5.332 -16.403 1.00 0.00 H new ATOM 0 HB2 SER A 104 12.006 -3.648 -17.758 1.00 0.00 H new ATOM 0 HB3 SER A 104 13.721 -3.291 -17.807 1.00 0.00 H new ATOM 0 HG SER A 104 13.013 -4.459 -19.697 1.00 0.00 H new ATOM 1066 N GLY A 105 12.299 -4.448 -14.258 1.00 0.00 N ATOM 1067 CA GLY A 105 12.095 -3.611 -13.041 1.00 0.00 C ATOM 1068 C GLY A 105 13.263 -3.819 -12.073 1.00 0.00 C ATOM 1069 O GLY A 105 13.556 -4.926 -11.670 1.00 0.00 O ATOM 0 H GLY A 105 11.837 -5.357 -14.242 1.00 0.00 H new ATOM 0 HA2 GLY A 105 12.022 -2.559 -13.319 1.00 0.00 H new ATOM 0 HA3 GLY A 105 11.156 -3.878 -12.557 1.00 0.00 H new ATOM 1073 N MET A 106 13.929 -2.761 -11.695 1.00 0.00 N ATOM 1074 CA MET A 106 15.075 -2.900 -10.750 1.00 0.00 C ATOM 1075 C MET A 106 14.613 -3.594 -9.466 1.00 0.00 C ATOM 1076 O MET A 106 15.347 -4.346 -8.855 1.00 0.00 O ATOM 1077 CB MET A 106 15.522 -1.468 -10.451 1.00 0.00 C ATOM 1078 CG MET A 106 15.888 -0.761 -11.758 1.00 0.00 C ATOM 1079 SD MET A 106 17.046 -1.786 -12.695 1.00 0.00 S ATOM 1080 CE MET A 106 18.471 -1.573 -11.600 1.00 0.00 C ATOM 0 H MET A 106 13.730 -1.808 -11.999 1.00 0.00 H new ATOM 0 HA MET A 106 15.884 -3.499 -11.167 1.00 0.00 H new ATOM 0 HB2 MET A 106 14.724 -0.926 -9.944 1.00 0.00 H new ATOM 0 HB3 MET A 106 16.379 -1.477 -9.778 1.00 0.00 H new ATOM 0 HG2 MET A 106 14.990 -0.576 -12.348 1.00 0.00 H new ATOM 0 HG3 MET A 106 16.335 0.210 -11.546 1.00 0.00 H new ATOM 0 HE1 MET A 106 19.386 -1.814 -12.142 1.00 0.00 H new ATOM 0 HE2 MET A 106 18.515 -0.539 -11.256 1.00 0.00 H new ATOM 0 HE3 MET A 106 18.372 -2.237 -10.741 1.00 0.00 H new ATOM 1090 N ASP A 107 13.398 -3.349 -9.055 1.00 0.00 N ATOM 1091 CA ASP A 107 12.885 -3.995 -7.814 1.00 0.00 C ATOM 1092 C ASP A 107 11.421 -4.409 -8.005 1.00 0.00 C ATOM 1093 O ASP A 107 11.076 -5.569 -7.899 1.00 0.00 O ATOM 1094 CB ASP A 107 13.008 -2.923 -6.732 1.00 0.00 C ATOM 1095 CG ASP A 107 14.481 -2.752 -6.352 1.00 0.00 C ATOM 1096 OD1 ASP A 107 15.251 -3.661 -6.619 1.00 0.00 O ATOM 1097 OD2 ASP A 107 14.814 -1.715 -5.803 1.00 0.00 O ATOM 0 H ASP A 107 12.739 -2.729 -9.526 1.00 0.00 H new ATOM 0 HA ASP A 107 13.438 -4.898 -7.554 1.00 0.00 H new ATOM 0 HB2 ASP A 107 12.602 -1.978 -7.093 1.00 0.00 H new ATOM 0 HB3 ASP A 107 12.425 -3.206 -5.856 1.00 0.00 H new ATOM 1102 N LYS A 108 10.561 -3.471 -8.295 1.00 0.00 N ATOM 1103 CA LYS A 108 9.124 -3.817 -8.503 1.00 0.00 C ATOM 1104 C LYS A 108 8.636 -3.237 -9.836 1.00 0.00 C ATOM 1105 O LYS A 108 9.229 -2.320 -10.369 1.00 0.00 O ATOM 1106 CB LYS A 108 8.382 -3.186 -7.323 1.00 0.00 C ATOM 1107 CG LYS A 108 8.454 -1.662 -7.421 1.00 0.00 C ATOM 1108 CD LYS A 108 7.631 -1.043 -6.288 1.00 0.00 C ATOM 1109 CE LYS A 108 6.142 -1.161 -6.617 1.00 0.00 C ATOM 1110 NZ LYS A 108 5.444 -0.507 -5.475 1.00 0.00 N ATOM 0 H LYS A 108 10.789 -2.482 -8.397 1.00 0.00 H new ATOM 0 HA LYS A 108 8.956 -4.893 -8.546 1.00 0.00 H new ATOM 0 HB2 LYS A 108 7.341 -3.511 -7.320 1.00 0.00 H new ATOM 0 HB3 LYS A 108 8.823 -3.520 -6.384 1.00 0.00 H new ATOM 0 HG2 LYS A 108 9.490 -1.330 -7.356 1.00 0.00 H new ATOM 0 HG3 LYS A 108 8.073 -1.330 -8.387 1.00 0.00 H new ATOM 0 HD2 LYS A 108 7.848 -1.550 -5.348 1.00 0.00 H new ATOM 0 HD3 LYS A 108 7.903 0.004 -6.156 1.00 0.00 H new ATOM 0 HE2 LYS A 108 5.905 -0.667 -7.560 1.00 0.00 H new ATOM 0 HE3 LYS A 108 5.841 -2.204 -6.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 4.416 -0.548 -5.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 5.683 -1.002 -4.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 5.745 0.486 -5.407 1.00 0.00 H new ATOM 1124 N PRO A 109 7.573 -3.807 -10.337 1.00 0.00 N ATOM 1125 CA PRO A 109 7.002 -3.359 -11.633 1.00 0.00 C ATOM 1126 C PRO A 109 6.299 -2.006 -11.504 1.00 0.00 C ATOM 1127 O PRO A 109 5.894 -1.594 -10.435 1.00 0.00 O ATOM 1128 CB PRO A 109 5.999 -4.451 -11.980 1.00 0.00 C ATOM 1129 CG PRO A 109 5.624 -5.068 -10.669 1.00 0.00 C ATOM 1130 CD PRO A 109 6.809 -4.913 -9.750 1.00 0.00 C ATOM 0 HA PRO A 109 7.769 -3.218 -12.395 1.00 0.00 H new ATOM 0 HB2 PRO A 109 5.126 -4.038 -12.485 1.00 0.00 H new ATOM 0 HB3 PRO A 109 6.437 -5.189 -12.652 1.00 0.00 H new ATOM 0 HG2 PRO A 109 4.745 -4.578 -10.250 1.00 0.00 H new ATOM 0 HG3 PRO A 109 5.371 -6.121 -10.797 1.00 0.00 H new ATOM 0 HD2 PRO A 109 6.496 -4.685 -8.731 1.00 0.00 H new ATOM 0 HD3 PRO A 109 7.401 -5.827 -9.705 1.00 0.00 H new ATOM 1138 N VAL A 110 6.150 -1.320 -12.604 1.00 0.00 N ATOM 1139 CA VAL A 110 5.471 0.007 -12.594 1.00 0.00 C ATOM 1140 C VAL A 110 4.611 0.139 -13.863 1.00 0.00 C ATOM 1141 O VAL A 110 3.963 -0.808 -14.272 1.00 0.00 O ATOM 1142 CB VAL A 110 6.621 1.023 -12.575 1.00 0.00 C ATOM 1143 CG1 VAL A 110 7.231 1.143 -13.974 1.00 0.00 C ATOM 1144 CG2 VAL A 110 6.097 2.389 -12.121 1.00 0.00 C ATOM 0 H VAL A 110 6.474 -1.627 -13.521 1.00 0.00 H new ATOM 0 HA VAL A 110 4.802 0.154 -11.746 1.00 0.00 H new ATOM 0 HB VAL A 110 7.387 0.682 -11.879 1.00 0.00 H new ATOM 0 HG11 VAL A 110 8.047 1.866 -13.954 1.00 0.00 H new ATOM 0 HG12 VAL A 110 7.614 0.172 -14.289 1.00 0.00 H new ATOM 0 HG13 VAL A 110 6.467 1.477 -14.676 1.00 0.00 H new ATOM 0 HG21 VAL A 110 6.917 3.107 -12.109 1.00 0.00 H new ATOM 0 HG22 VAL A 110 5.325 2.730 -12.811 1.00 0.00 H new ATOM 0 HG23 VAL A 110 5.676 2.303 -11.120 1.00 0.00 H new ATOM 1154 N PHE A 111 4.596 1.285 -14.495 1.00 0.00 N ATOM 1155 CA PHE A 111 3.779 1.436 -15.736 1.00 0.00 C ATOM 1156 C PHE A 111 4.680 1.375 -16.970 1.00 0.00 C ATOM 1157 O PHE A 111 5.871 1.608 -16.899 1.00 0.00 O ATOM 1158 CB PHE A 111 3.109 2.805 -15.623 1.00 0.00 C ATOM 1159 CG PHE A 111 4.125 3.896 -15.858 1.00 0.00 C ATOM 1160 CD1 PHE A 111 4.930 4.341 -14.803 1.00 0.00 C ATOM 1161 CD2 PHE A 111 4.258 4.467 -17.129 1.00 0.00 C ATOM 1162 CE1 PHE A 111 5.869 5.357 -15.020 1.00 0.00 C ATOM 1163 CE2 PHE A 111 5.196 5.482 -17.347 1.00 0.00 C ATOM 1164 CZ PHE A 111 6.001 5.928 -16.292 1.00 0.00 C ATOM 0 H PHE A 111 5.111 2.117 -14.208 1.00 0.00 H new ATOM 0 HA PHE A 111 3.042 0.639 -15.839 1.00 0.00 H new ATOM 0 HB2 PHE A 111 2.302 2.885 -16.351 1.00 0.00 H new ATOM 0 HB3 PHE A 111 2.661 2.920 -14.636 1.00 0.00 H new ATOM 0 HD1 PHE A 111 4.827 3.901 -13.822 1.00 0.00 H new ATOM 0 HD2 PHE A 111 3.636 4.124 -17.942 1.00 0.00 H new ATOM 0 HE1 PHE A 111 6.491 5.700 -14.207 1.00 0.00 H new ATOM 0 HE2 PHE A 111 5.299 5.921 -18.328 1.00 0.00 H new ATOM 0 HZ PHE A 111 6.724 6.713 -16.459 1.00 0.00 H new ATOM 1174 N THR A 112 4.115 1.053 -18.099 1.00 0.00 N ATOM 1175 CA THR A 112 4.923 0.960 -19.349 1.00 0.00 C ATOM 1176 C THR A 112 5.947 2.097 -19.426 1.00 0.00 C ATOM 1177 O THR A 112 5.603 3.262 -19.397 1.00 0.00 O ATOM 1178 CB THR A 112 3.908 1.080 -20.484 1.00 0.00 C ATOM 1179 OG1 THR A 112 2.843 0.167 -20.262 1.00 0.00 O ATOM 1180 CG2 THR A 112 4.591 0.758 -21.810 1.00 0.00 C ATOM 0 H THR A 112 3.122 0.849 -18.212 1.00 0.00 H new ATOM 0 HA THR A 112 5.490 0.030 -19.396 1.00 0.00 H new ATOM 0 HB THR A 112 3.513 2.096 -20.517 1.00 0.00 H new ATOM 0 HG1 THR A 112 2.441 -0.081 -21.120 1.00 0.00 H new ATOM 0 HG21 THR A 112 3.868 0.843 -22.622 1.00 0.00 H new ATOM 0 HG22 THR A 112 5.409 1.459 -21.978 1.00 0.00 H new ATOM 0 HG23 THR A 112 4.984 -0.258 -21.779 1.00 0.00 H new ATOM 1188 N ASP A 113 7.203 1.762 -19.528 1.00 0.00 N ATOM 1189 CA ASP A 113 8.258 2.812 -19.611 1.00 0.00 C ATOM 1190 C ASP A 113 9.241 2.477 -20.741 1.00 0.00 C ATOM 1191 O ASP A 113 10.064 1.596 -20.590 1.00 0.00 O ATOM 1192 CB ASP A 113 8.973 2.756 -18.260 1.00 0.00 C ATOM 1193 CG ASP A 113 9.475 1.334 -18.009 1.00 0.00 C ATOM 1194 OD1 ASP A 113 9.118 0.456 -18.777 1.00 0.00 O ATOM 1195 OD2 ASP A 113 10.209 1.144 -17.052 1.00 0.00 O ATOM 0 H ASP A 113 7.546 0.802 -19.558 1.00 0.00 H new ATOM 0 HA ASP A 113 7.846 3.799 -19.820 1.00 0.00 H new ATOM 0 HB2 ASP A 113 9.809 3.456 -18.249 1.00 0.00 H new ATOM 0 HB3 ASP A 113 8.293 3.059 -17.464 1.00 0.00 H new ATOM 1200 N PRO A 114 9.136 3.180 -21.845 1.00 0.00 N ATOM 1201 CA PRO A 114 8.119 4.256 -22.007 1.00 0.00 C ATOM 1202 C PRO A 114 6.736 3.651 -22.270 1.00 0.00 C ATOM 1203 O PRO A 114 6.600 2.450 -22.394 1.00 0.00 O ATOM 1204 CB PRO A 114 8.607 5.019 -23.236 1.00 0.00 C ATOM 1205 CG PRO A 114 9.420 4.037 -24.017 1.00 0.00 C ATOM 1206 CD PRO A 114 9.969 3.027 -23.042 1.00 0.00 C ATOM 0 HA PRO A 114 8.017 4.885 -21.123 1.00 0.00 H new ATOM 0 HB2 PRO A 114 7.769 5.392 -23.825 1.00 0.00 H new ATOM 0 HB3 PRO A 114 9.205 5.884 -22.949 1.00 0.00 H new ATOM 0 HG2 PRO A 114 8.807 3.546 -24.773 1.00 0.00 H new ATOM 0 HG3 PRO A 114 10.230 4.542 -24.543 1.00 0.00 H new ATOM 0 HD2 PRO A 114 9.907 2.015 -23.442 1.00 0.00 H new ATOM 0 HD3 PRO A 114 11.019 3.219 -22.822 1.00 0.00 H new ATOM 1214 N PRO A 115 5.752 4.508 -22.366 1.00 0.00 N ATOM 1215 CA PRO A 115 4.371 4.045 -22.641 1.00 0.00 C ATOM 1216 C PRO A 115 4.281 3.514 -24.073 1.00 0.00 C ATOM 1217 O PRO A 115 5.171 3.719 -24.873 1.00 0.00 O ATOM 1218 CB PRO A 115 3.526 5.306 -22.465 1.00 0.00 C ATOM 1219 CG PRO A 115 4.475 6.436 -22.703 1.00 0.00 C ATOM 1220 CD PRO A 115 5.827 5.969 -22.231 1.00 0.00 C ATOM 0 HA PRO A 115 4.043 3.235 -21.990 1.00 0.00 H new ATOM 0 HB2 PRO A 115 2.697 5.329 -23.173 1.00 0.00 H new ATOM 0 HB3 PRO A 115 3.093 5.356 -21.466 1.00 0.00 H new ATOM 0 HG2 PRO A 115 4.504 6.702 -23.760 1.00 0.00 H new ATOM 0 HG3 PRO A 115 4.161 7.327 -22.159 1.00 0.00 H new ATOM 0 HD2 PRO A 115 6.630 6.387 -22.837 1.00 0.00 H new ATOM 0 HD3 PRO A 115 6.017 6.268 -21.200 1.00 0.00 H new ATOM 1228 N VAL A 116 3.223 2.826 -24.404 1.00 0.00 N ATOM 1229 CA VAL A 116 3.101 2.284 -25.787 1.00 0.00 C ATOM 1230 C VAL A 116 2.005 3.018 -26.559 1.00 0.00 C ATOM 1231 O VAL A 116 0.944 3.302 -26.039 1.00 0.00 O ATOM 1232 CB VAL A 116 2.724 0.813 -25.612 1.00 0.00 C ATOM 1233 CG1 VAL A 116 3.829 0.084 -24.845 1.00 0.00 C ATOM 1234 CG2 VAL A 116 1.412 0.716 -24.832 1.00 0.00 C ATOM 0 H VAL A 116 2.443 2.617 -23.782 1.00 0.00 H new ATOM 0 HA VAL A 116 4.026 2.408 -26.350 1.00 0.00 H new ATOM 0 HB VAL A 116 2.603 0.351 -26.592 1.00 0.00 H new ATOM 0 HG11 VAL A 116 3.556 -0.964 -24.722 1.00 0.00 H new ATOM 0 HG12 VAL A 116 4.764 0.153 -25.401 1.00 0.00 H new ATOM 0 HG13 VAL A 116 3.955 0.543 -23.864 1.00 0.00 H new ATOM 0 HG21 VAL A 116 1.140 -0.332 -24.706 1.00 0.00 H new ATOM 0 HG22 VAL A 116 1.536 1.179 -23.853 1.00 0.00 H new ATOM 0 HG23 VAL A 116 0.624 1.231 -25.381 1.00 0.00 H new ATOM 1244 N LYS A 117 2.251 3.308 -27.805 1.00 0.00 N ATOM 1245 CA LYS A 117 1.226 4.004 -28.629 1.00 0.00 C ATOM 1246 C LYS A 117 0.754 3.060 -29.735 1.00 0.00 C ATOM 1247 O LYS A 117 1.551 2.451 -30.419 1.00 0.00 O ATOM 1248 CB LYS A 117 1.946 5.212 -29.224 1.00 0.00 C ATOM 1249 CG LYS A 117 3.061 4.735 -30.155 1.00 0.00 C ATOM 1250 CD LYS A 117 4.336 5.530 -29.872 1.00 0.00 C ATOM 1251 CE LYS A 117 5.405 5.171 -30.906 1.00 0.00 C ATOM 1252 NZ LYS A 117 5.096 6.021 -32.089 1.00 0.00 N ATOM 0 H LYS A 117 3.122 3.092 -28.290 1.00 0.00 H new ATOM 0 HA LYS A 117 0.351 4.306 -28.054 1.00 0.00 H new ATOM 0 HB2 LYS A 117 1.240 5.835 -29.774 1.00 0.00 H new ATOM 0 HB3 LYS A 117 2.362 5.829 -28.428 1.00 0.00 H new ATOM 0 HG2 LYS A 117 3.243 3.671 -30.007 1.00 0.00 H new ATOM 0 HG3 LYS A 117 2.762 4.865 -31.195 1.00 0.00 H new ATOM 0 HD2 LYS A 117 4.126 6.599 -29.908 1.00 0.00 H new ATOM 0 HD3 LYS A 117 4.698 5.310 -28.868 1.00 0.00 H new ATOM 0 HE2 LYS A 117 6.406 5.373 -30.525 1.00 0.00 H new ATOM 0 HE3 LYS A 117 5.368 4.112 -31.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 5.235 5.469 -32.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 4.108 6.342 -32.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 5.728 6.847 -32.098 1.00 0.00 H new ATOM 1266 N THR A 118 -0.528 2.920 -29.915 1.00 0.00 N ATOM 1267 CA THR A 118 -1.017 1.998 -30.977 1.00 0.00 C ATOM 1268 C THR A 118 -2.135 2.650 -31.790 1.00 0.00 C ATOM 1269 O THR A 118 -2.561 3.750 -31.509 1.00 0.00 O ATOM 1270 CB THR A 118 -1.540 0.771 -30.235 1.00 0.00 C ATOM 1271 OG1 THR A 118 -2.576 1.163 -29.345 1.00 0.00 O ATOM 1272 CG2 THR A 118 -0.400 0.123 -29.448 1.00 0.00 C ATOM 0 H THR A 118 -1.253 3.398 -29.379 1.00 0.00 H new ATOM 0 HA THR A 118 -0.228 1.742 -31.684 1.00 0.00 H new ATOM 0 HB THR A 118 -1.934 0.052 -30.953 1.00 0.00 H new ATOM 0 HG1 THR A 118 -3.252 0.455 -29.297 1.00 0.00 H new ATOM 0 HG21 THR A 118 -0.775 -0.753 -28.919 1.00 0.00 H new ATOM 0 HG22 THR A 118 0.391 -0.179 -30.135 1.00 0.00 H new ATOM 0 HG23 THR A 118 -0.002 0.839 -28.729 1.00 0.00 H new ATOM 1280 N LYS A 119 -2.599 1.973 -32.803 1.00 0.00 N ATOM 1281 CA LYS A 119 -3.677 2.541 -33.660 1.00 0.00 C ATOM 1282 C LYS A 119 -4.956 2.797 -32.853 1.00 0.00 C ATOM 1283 O LYS A 119 -5.886 3.406 -33.342 1.00 0.00 O ATOM 1284 CB LYS A 119 -3.925 1.479 -34.730 1.00 0.00 C ATOM 1285 CG LYS A 119 -4.638 0.279 -34.104 1.00 0.00 C ATOM 1286 CD LYS A 119 -4.870 -0.789 -35.172 1.00 0.00 C ATOM 1287 CE LYS A 119 -5.902 -0.287 -36.182 1.00 0.00 C ATOM 1288 NZ LYS A 119 -5.723 -1.156 -37.377 1.00 0.00 N ATOM 0 H LYS A 119 -2.276 1.045 -33.076 1.00 0.00 H new ATOM 0 HA LYS A 119 -3.389 3.503 -34.084 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -4.530 1.894 -35.536 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -2.979 1.164 -35.171 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -4.039 -0.129 -33.290 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -5.590 0.591 -33.674 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -3.933 -1.021 -35.679 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -5.219 -1.712 -34.708 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -6.914 -0.365 -35.785 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -5.736 0.762 -36.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -6.398 -0.873 -38.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -4.752 -1.056 -37.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -5.894 -2.148 -37.114 1.00 0.00 H new ATOM 1302 N PHE A 120 -5.022 2.350 -31.626 1.00 0.00 N ATOM 1303 CA PHE A 120 -6.261 2.601 -30.833 1.00 0.00 C ATOM 1304 C PHE A 120 -5.980 3.562 -29.669 1.00 0.00 C ATOM 1305 O PHE A 120 -6.532 3.427 -28.595 1.00 0.00 O ATOM 1306 CB PHE A 120 -6.748 1.232 -30.328 1.00 0.00 C ATOM 1307 CG PHE A 120 -5.617 0.426 -29.725 1.00 0.00 C ATOM 1308 CD1 PHE A 120 -4.738 -0.287 -30.550 1.00 0.00 C ATOM 1309 CD2 PHE A 120 -5.466 0.373 -28.336 1.00 0.00 C ATOM 1310 CE1 PHE A 120 -3.707 -1.048 -29.984 1.00 0.00 C ATOM 1311 CE2 PHE A 120 -4.434 -0.386 -27.770 1.00 0.00 C ATOM 1312 CZ PHE A 120 -3.554 -1.096 -28.593 1.00 0.00 C ATOM 0 H PHE A 120 -4.286 1.831 -31.146 1.00 0.00 H new ATOM 0 HA PHE A 120 -7.028 3.077 -31.444 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -7.531 1.376 -29.583 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -7.192 0.676 -31.154 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -4.855 -0.250 -31.623 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -6.146 0.918 -27.699 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -3.030 -1.598 -30.621 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -4.318 -0.423 -26.697 1.00 0.00 H new ATOM 0 HZ PHE A 120 -2.758 -1.680 -28.156 1.00 0.00 H new ATOM 1322 N GLY A 121 -5.148 4.550 -29.888 1.00 0.00 N ATOM 1323 CA GLY A 121 -4.859 5.538 -28.804 1.00 0.00 C ATOM 1324 C GLY A 121 -3.533 5.210 -28.111 1.00 0.00 C ATOM 1325 O GLY A 121 -2.815 4.314 -28.506 1.00 0.00 O ATOM 0 H GLY A 121 -4.658 4.715 -30.767 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -4.817 6.543 -29.223 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -5.668 5.531 -28.074 1.00 0.00 H new ATOM 1329 N TYR A 122 -3.223 5.917 -27.054 1.00 0.00 N ATOM 1330 CA TYR A 122 -1.965 5.638 -26.299 1.00 0.00 C ATOM 1331 C TYR A 122 -2.313 4.783 -25.079 1.00 0.00 C ATOM 1332 O TYR A 122 -3.455 4.748 -24.651 1.00 0.00 O ATOM 1333 CB TYR A 122 -1.431 7.003 -25.863 1.00 0.00 C ATOM 1334 CG TYR A 122 -1.018 7.819 -27.067 1.00 0.00 C ATOM 1335 CD1 TYR A 122 -0.390 7.199 -28.155 1.00 0.00 C ATOM 1336 CD2 TYR A 122 -1.246 9.203 -27.087 1.00 0.00 C ATOM 1337 CE1 TYR A 122 0.006 7.961 -29.262 1.00 0.00 C ATOM 1338 CE2 TYR A 122 -0.844 9.963 -28.192 1.00 0.00 C ATOM 1339 CZ TYR A 122 -0.218 9.341 -29.280 1.00 0.00 C ATOM 1340 OH TYR A 122 0.179 10.091 -30.370 1.00 0.00 O ATOM 0 H TYR A 122 -3.790 6.678 -26.680 1.00 0.00 H new ATOM 0 HA TYR A 122 -1.224 5.103 -26.892 1.00 0.00 H new ATOM 0 HB2 TYR A 122 -2.197 7.537 -25.300 1.00 0.00 H new ATOM 0 HB3 TYR A 122 -0.579 6.871 -25.196 1.00 0.00 H new ATOM 0 HD1 TYR A 122 -0.211 6.134 -28.140 1.00 0.00 H new ATOM 0 HD2 TYR A 122 -1.732 9.682 -26.250 1.00 0.00 H new ATOM 0 HE1 TYR A 122 0.485 7.482 -30.103 1.00 0.00 H new ATOM 0 HE2 TYR A 122 -1.017 11.029 -28.206 1.00 0.00 H new ATOM 0 HH TYR A 122 0.800 9.568 -30.918 1.00 0.00 H new ATOM 1350 N HIS A 123 -1.363 4.074 -24.521 1.00 0.00 N ATOM 1351 CA HIS A 123 -1.700 3.211 -23.351 1.00 0.00 C ATOM 1352 C HIS A 123 -0.609 3.203 -22.278 1.00 0.00 C ATOM 1353 O HIS A 123 0.569 3.094 -22.560 1.00 0.00 O ATOM 1354 CB HIS A 123 -1.850 1.814 -23.944 1.00 0.00 C ATOM 1355 CG HIS A 123 -2.786 1.888 -25.110 1.00 0.00 C ATOM 1356 ND1 HIS A 123 -4.156 1.863 -24.945 1.00 0.00 N ATOM 1357 CD2 HIS A 123 -2.570 2.030 -26.457 1.00 0.00 C ATOM 1358 CE1 HIS A 123 -4.714 1.997 -26.160 1.00 0.00 C ATOM 1359 NE2 HIS A 123 -3.791 2.102 -27.120 1.00 0.00 N ATOM 0 H HIS A 123 -0.388 4.055 -24.819 1.00 0.00 H new ATOM 0 HA HIS A 123 -2.596 3.576 -22.848 1.00 0.00 H new ATOM 0 HB2 HIS A 123 -0.880 1.432 -24.261 1.00 0.00 H new ATOM 0 HB3 HIS A 123 -2.235 1.124 -23.193 1.00 0.00 H new ATOM 0 HD2 HIS A 123 -1.601 2.078 -26.930 1.00 0.00 H new ATOM 0 HE1 HIS A 123 -5.779 2.017 -26.339 1.00 0.00 H new ATOM 0 HE2 HIS A 123 -3.948 2.211 -28.122 1.00 0.00 H new ATOM 1367 N ILE A 124 -1.022 3.272 -21.042 1.00 0.00 N ATOM 1368 CA ILE A 124 -0.061 3.221 -19.904 1.00 0.00 C ATOM 1369 C ILE A 124 -0.543 2.139 -18.932 1.00 0.00 C ATOM 1370 O ILE A 124 -1.418 2.373 -18.122 1.00 0.00 O ATOM 1371 CB ILE A 124 -0.123 4.604 -19.253 1.00 0.00 C ATOM 1372 CG1 ILE A 124 0.397 5.654 -20.238 1.00 0.00 C ATOM 1373 CG2 ILE A 124 0.744 4.615 -17.992 1.00 0.00 C ATOM 1374 CD1 ILE A 124 -0.070 7.042 -19.799 1.00 0.00 C ATOM 0 H ILE A 124 -2.000 3.363 -20.769 1.00 0.00 H new ATOM 0 HA ILE A 124 0.959 2.984 -20.206 1.00 0.00 H new ATOM 0 HB ILE A 124 -1.155 4.834 -18.986 1.00 0.00 H new ATOM 0 HG12 ILE A 124 1.486 5.621 -20.279 1.00 0.00 H new ATOM 0 HG13 ILE A 124 0.033 5.437 -21.242 1.00 0.00 H new ATOM 0 HG21 ILE A 124 0.700 5.601 -17.528 1.00 0.00 H new ATOM 0 HG22 ILE A 124 0.375 3.867 -17.290 1.00 0.00 H new ATOM 0 HG23 ILE A 124 1.776 4.385 -18.258 1.00 0.00 H new ATOM 0 HD11 ILE A 124 0.301 7.789 -20.501 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -1.159 7.070 -19.780 1.00 0.00 H new ATOM 0 HD13 ILE A 124 0.316 7.257 -18.802 1.00 0.00 H new ATOM 1386 N ILE A 125 -0.015 0.948 -19.025 1.00 0.00 N ATOM 1387 CA ILE A 125 -0.496 -0.139 -18.122 1.00 0.00 C ATOM 1388 C ILE A 125 0.492 -0.422 -16.987 1.00 0.00 C ATOM 1389 O ILE A 125 1.690 -0.490 -17.181 1.00 0.00 O ATOM 1390 CB ILE A 125 -0.643 -1.371 -19.019 1.00 0.00 C ATOM 1391 CG1 ILE A 125 0.742 -1.932 -19.355 1.00 0.00 C ATOM 1392 CG2 ILE A 125 -1.362 -0.985 -20.313 1.00 0.00 C ATOM 1393 CD1 ILE A 125 0.585 -3.230 -20.149 1.00 0.00 C ATOM 0 H ILE A 125 0.721 0.682 -19.679 1.00 0.00 H new ATOM 0 HA ILE A 125 -1.432 0.142 -17.639 1.00 0.00 H new ATOM 0 HB ILE A 125 -1.225 -2.128 -18.493 1.00 0.00 H new ATOM 0 HG12 ILE A 125 1.310 -1.205 -19.935 1.00 0.00 H new ATOM 0 HG13 ILE A 125 1.303 -2.118 -18.439 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -1.465 -1.865 -20.949 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -2.350 -0.591 -20.076 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -0.784 -0.224 -20.837 1.00 0.00 H new ATOM 0 HD11 ILE A 125 1.570 -3.631 -20.389 1.00 0.00 H new ATOM 0 HD12 ILE A 125 0.033 -3.957 -19.553 1.00 0.00 H new ATOM 0 HD13 ILE A 125 0.040 -3.029 -21.071 1.00 0.00 H new ATOM 1405 N MET A 126 -0.028 -0.613 -15.805 1.00 0.00 N ATOM 1406 CA MET A 126 0.829 -0.927 -14.630 1.00 0.00 C ATOM 1407 C MET A 126 0.634 -2.397 -14.267 1.00 0.00 C ATOM 1408 O MET A 126 -0.460 -2.919 -14.358 1.00 0.00 O ATOM 1409 CB MET A 126 0.306 -0.033 -13.503 1.00 0.00 C ATOM 1410 CG MET A 126 0.534 1.435 -13.859 1.00 0.00 C ATOM 1411 SD MET A 126 0.503 2.433 -12.349 1.00 0.00 S ATOM 1412 CE MET A 126 2.084 1.871 -11.672 1.00 0.00 C ATOM 0 H MET A 126 -1.026 -0.564 -15.603 1.00 0.00 H new ATOM 0 HA MET A 126 1.889 -0.757 -14.817 1.00 0.00 H new ATOM 0 HB2 MET A 126 -0.756 -0.217 -13.344 1.00 0.00 H new ATOM 0 HB3 MET A 126 0.815 -0.274 -12.570 1.00 0.00 H new ATOM 0 HG2 MET A 126 1.492 1.553 -14.366 1.00 0.00 H new ATOM 0 HG3 MET A 126 -0.237 1.777 -14.550 1.00 0.00 H new ATOM 0 HE1 MET A 126 1.911 1.342 -10.735 1.00 0.00 H new ATOM 0 HE2 MET A 126 2.567 1.201 -12.384 1.00 0.00 H new ATOM 0 HE3 MET A 126 2.728 2.731 -11.489 1.00 0.00 H new ATOM 1422 N VAL A 127 1.666 -3.082 -13.871 1.00 0.00 N ATOM 1423 CA VAL A 127 1.480 -4.522 -13.531 1.00 0.00 C ATOM 1424 C VAL A 127 1.853 -4.809 -12.076 1.00 0.00 C ATOM 1425 O VAL A 127 2.951 -4.532 -11.634 1.00 0.00 O ATOM 1426 CB VAL A 127 2.401 -5.280 -14.480 1.00 0.00 C ATOM 1427 CG1 VAL A 127 2.166 -6.782 -14.313 1.00 0.00 C ATOM 1428 CG2 VAL A 127 2.091 -4.873 -15.920 1.00 0.00 C ATOM 0 H VAL A 127 2.614 -2.719 -13.768 1.00 0.00 H new ATOM 0 HA VAL A 127 0.438 -4.823 -13.639 1.00 0.00 H new ATOM 0 HB VAL A 127 3.440 -5.044 -14.252 1.00 0.00 H new ATOM 0 HG11 VAL A 127 2.822 -7.330 -14.989 1.00 0.00 H new ATOM 0 HG12 VAL A 127 2.381 -7.072 -13.284 1.00 0.00 H new ATOM 0 HG13 VAL A 127 1.127 -7.016 -14.546 1.00 0.00 H new ATOM 0 HG21 VAL A 127 2.749 -5.414 -16.601 1.00 0.00 H new ATOM 0 HG22 VAL A 127 1.053 -5.113 -16.151 1.00 0.00 H new ATOM 0 HG23 VAL A 127 2.250 -3.801 -16.037 1.00 0.00 H new ATOM 1438 N GLU A 128 0.946 -5.388 -11.339 1.00 0.00 N ATOM 1439 CA GLU A 128 1.232 -5.730 -9.919 1.00 0.00 C ATOM 1440 C GLU A 128 1.390 -7.246 -9.792 1.00 0.00 C ATOM 1441 O GLU A 128 2.331 -7.737 -9.200 1.00 0.00 O ATOM 1442 CB GLU A 128 0.012 -5.246 -9.134 1.00 0.00 C ATOM 1443 CG GLU A 128 0.174 -5.611 -7.657 1.00 0.00 C ATOM 1444 CD GLU A 128 -0.885 -4.879 -6.832 1.00 0.00 C ATOM 1445 OE1 GLU A 128 -1.618 -4.091 -7.408 1.00 0.00 O ATOM 1446 OE2 GLU A 128 -0.947 -5.119 -5.637 1.00 0.00 O ATOM 0 H GLU A 128 0.012 -5.640 -11.663 1.00 0.00 H new ATOM 0 HA GLU A 128 2.148 -5.270 -9.549 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -0.098 -4.167 -9.242 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -0.894 -5.701 -9.534 1.00 0.00 H new ATOM 0 HG2 GLU A 128 0.073 -6.688 -7.524 1.00 0.00 H new ATOM 0 HG3 GLU A 128 1.171 -5.339 -7.311 1.00 0.00 H new ATOM 1453 N GLY A 129 0.479 -7.990 -10.359 1.00 0.00 N ATOM 1454 CA GLY A 129 0.575 -9.475 -10.290 1.00 0.00 C ATOM 1455 C GLY A 129 -0.654 -10.044 -9.582 1.00 0.00 C ATOM 1456 O GLY A 129 -1.505 -9.317 -9.109 1.00 0.00 O ATOM 0 H GLY A 129 -0.329 -7.632 -10.868 1.00 0.00 H new ATOM 0 HA2 GLY A 129 0.651 -9.890 -11.295 1.00 0.00 H new ATOM 0 HA3 GLY A 129 1.480 -9.765 -9.756 1.00 0.00 H new ATOM 1460 N ARG A 130 -0.744 -11.344 -9.501 1.00 0.00 N ATOM 1461 CA ARG A 130 -1.904 -11.980 -8.814 1.00 0.00 C ATOM 1462 C ARG A 130 -1.401 -12.760 -7.602 1.00 0.00 C ATOM 1463 O ARG A 130 -1.919 -12.639 -6.509 1.00 0.00 O ATOM 1464 CB ARG A 130 -2.513 -12.934 -9.845 1.00 0.00 C ATOM 1465 CG ARG A 130 -3.475 -13.900 -9.148 1.00 0.00 C ATOM 1466 CD ARG A 130 -4.685 -13.129 -8.620 1.00 0.00 C ATOM 1467 NE ARG A 130 -5.487 -14.138 -7.874 1.00 0.00 N ATOM 1468 CZ ARG A 130 -5.093 -14.545 -6.698 1.00 0.00 C ATOM 1469 NH1 ARG A 130 -5.210 -13.760 -5.662 1.00 0.00 N ATOM 1470 NH2 ARG A 130 -4.579 -15.736 -6.557 1.00 0.00 N ATOM 0 H ARG A 130 -0.060 -11.996 -9.884 1.00 0.00 H new ATOM 0 HA ARG A 130 -2.635 -11.251 -8.464 1.00 0.00 H new ATOM 0 HB2 ARG A 130 -3.043 -12.367 -10.611 1.00 0.00 H new ATOM 0 HB3 ARG A 130 -1.724 -13.492 -10.349 1.00 0.00 H new ATOM 0 HG2 ARG A 130 -3.800 -14.672 -9.846 1.00 0.00 H new ATOM 0 HG3 ARG A 130 -2.967 -14.406 -8.327 1.00 0.00 H new ATOM 0 HD2 ARG A 130 -4.378 -12.309 -7.970 1.00 0.00 H new ATOM 0 HD3 ARG A 130 -5.261 -12.691 -9.435 1.00 0.00 H new ATOM 0 HE ARG A 130 -6.344 -14.511 -8.282 1.00 0.00 H new ATOM 0 HH11 ARG A 130 -5.610 -12.828 -5.771 1.00 0.00 H new ATOM 0 HH12 ARG A 130 -4.902 -14.079 -4.743 1.00 0.00 H new ATOM 0 HH21 ARG A 130 -4.485 -16.350 -7.366 1.00 0.00 H new ATOM 0 HH22 ARG A 130 -4.271 -16.053 -5.638 1.00 0.00 H new ATOM 1484 N LYS A 131 -0.387 -13.561 -7.792 1.00 0.00 N ATOM 1485 CA LYS A 131 0.165 -14.356 -6.658 1.00 0.00 C ATOM 1486 C LYS A 131 1.218 -13.540 -5.902 1.00 0.00 C ATOM 1487 O LYS A 131 1.103 -13.442 -4.690 1.00 0.00 O ATOM 1488 CB LYS A 131 0.802 -15.579 -7.315 1.00 0.00 C ATOM 1489 CG LYS A 131 -0.287 -16.600 -7.644 1.00 0.00 C ATOM 1490 CD LYS A 131 -0.454 -16.692 -9.162 1.00 0.00 C ATOM 1491 CE LYS A 131 -0.211 -18.133 -9.612 1.00 0.00 C ATOM 1492 NZ LYS A 131 -0.712 -18.187 -11.013 1.00 0.00 N ATOM 1493 OXT LYS A 131 2.118 -13.029 -6.545 1.00 0.00 O ATOM 0 H LYS A 131 0.084 -13.699 -8.686 1.00 0.00 H new ATOM 0 HA LYS A 131 -0.600 -14.632 -5.932 1.00 0.00 H new ATOM 0 HB2 LYS A 131 1.328 -15.286 -8.224 1.00 0.00 H new ATOM 0 HB3 LYS A 131 1.541 -16.021 -6.647 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -0.022 -17.575 -7.236 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -1.229 -16.306 -7.180 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -1.456 -16.374 -9.449 1.00 0.00 H new ATOM 0 HD3 LYS A 131 0.248 -16.021 -9.658 1.00 0.00 H new ATOM 0 HE2 LYS A 131 0.847 -18.390 -9.561 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -0.742 -18.841 -8.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -0.580 -19.146 -11.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -1.723 -17.945 -11.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -0.184 -17.508 -11.597 1.00 0.00 H new TER 1507 LYS A 131