USER MOD reduce.3.24.130724 H: found=0, std=0, add=1075, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1071 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 52 CYS SG : rot 89:sc= 0.376 USER MOD Set 1.2: A 54 TYR OH : rot -102:sc= 0.602 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 155:sc= 0.671 (180deg=0.4) USER MOD Single : A 7 HIS : no HE2:sc= 0.547 K(o=0.55,f=-1.8!) USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 ASN : amide:sc= -0.48 X(o=-0.48,f=-0.22) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= -0.0643 X(o=-0.064,f=-0.13) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= 0.104 K(o=0.1,f=-2.3) USER MOD Single : A 38 ASN : amide:sc= -0.0774 X(o=-0.077,f=-0.39) USER MOD Single : A 39 CYS SG : rot -131:sc= 0.0964 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 CYS SG : rot -157:sc= -0.662 USER MOD Single : A 45 ASN : amide:sc= -1.11 K(o=-1.1,f=-2.6!) USER MOD Single : A 49 CYS SG : rot 57:sc= 0.878 USER MOD Single : A 55 SER OG : rot 180:sc= 0.00163 USER MOD Single : A 60 MET CE :methyl 177:sc= 0 (180deg=-0.0183) USER MOD Single : A 61 GLN : amide:sc= -0.214 X(o=-0.21,f=-0.45) USER MOD Single : A 64 CYS SG : rot 180:sc= 0.014 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 CYS SG : rot 180:sc= 0 USER MOD Single : A 70 HIS : no HE2:sc= -2 X(o=-2,f=-2.3) USER MOD Single : A 74 THR OG1 : rot -90:sc= 1.58 USER MOD Single : A 75 GLN : amide:sc= 0.862 K(o=0.86,f=-8.2!) USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 84 GLN : amide:sc= -0.0206 X(o=-0.021,f=-0.021) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00248) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 CYS SG : rot 180:sc= 0 USER MOD Single : A 108 CYS SG : rot -52:sc= 0.494 USER MOD Single : A 116 LYS NZ :NH3+ -135:sc= 0.0165 (180deg=0) USER MOD Single : A 117 ASN : amide:sc= 0.584 K(o=0.58,f=-3.2!) USER MOD Single : A 124 MET CE :methyl -116:sc= 0 (180deg=-0.105) USER MOD Single : A 128 ASN : amide:sc= 0.769 K(o=0.77,f=-0.47) USER MOD Single : A 133 MET CE :methyl 174:sc= 0 (180deg=-0.0392) USER MOD Single : A 135 LYS NZ :NH3+ 179:sc= 0.96 (180deg=0.959) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -11.786 26.105 3.210 1.00 0.00 N ATOM 2 CA MET A 1 -11.626 24.717 3.743 1.00 0.00 C ATOM 3 C MET A 1 -11.693 23.681 2.603 1.00 0.00 C ATOM 4 O MET A 1 -12.415 23.916 1.628 1.00 0.00 O ATOM 5 CB MET A 1 -12.674 24.375 4.833 1.00 0.00 C ATOM 6 CG MET A 1 -12.416 25.038 6.196 1.00 0.00 C ATOM 7 SD MET A 1 -12.664 26.836 6.284 1.00 0.00 S ATOM 8 CE MET A 1 -12.300 27.110 8.040 1.00 0.00 C ATOM 0 H1 MET A 1 -12.156 26.724 3.959 1.00 0.00 H new ATOM 0 H2 MET A 1 -10.863 26.462 2.890 1.00 0.00 H new ATOM 0 H3 MET A 1 -12.450 26.095 2.410 1.00 0.00 H new ATOM 0 HA MET A 1 -10.642 24.675 4.210 1.00 0.00 H new ATOM 0 HB2 MET A 1 -13.660 24.675 4.478 1.00 0.00 H new ATOM 0 HB3 MET A 1 -12.699 23.294 4.968 1.00 0.00 H new ATOM 0 HG2 MET A 1 -13.067 24.568 6.933 1.00 0.00 H new ATOM 0 HG3 MET A 1 -11.390 24.820 6.492 1.00 0.00 H new ATOM 0 HE1 MET A 1 -12.405 28.170 8.272 1.00 0.00 H new ATOM 0 HE2 MET A 1 -12.996 26.534 8.650 1.00 0.00 H new ATOM 0 HE3 MET A 1 -11.280 26.791 8.254 1.00 0.00 H new ATOM 18 N PRO A 2 -10.971 22.541 2.703 1.00 0.00 N ATOM 19 CA PRO A 2 -11.003 21.467 1.705 1.00 0.00 C ATOM 20 C PRO A 2 -12.321 20.677 1.756 1.00 0.00 C ATOM 21 O PRO A 2 -13.018 20.680 2.773 1.00 0.00 O ATOM 22 CB PRO A 2 -9.795 20.578 2.027 1.00 0.00 C ATOM 23 CG PRO A 2 -9.649 20.730 3.539 1.00 0.00 C ATOM 24 CD PRO A 2 -10.040 22.190 3.776 1.00 0.00 C ATOM 0 HA PRO A 2 -10.950 21.863 0.691 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -9.970 19.541 1.741 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -8.900 20.908 1.500 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -10.302 20.044 4.079 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -8.630 20.526 3.869 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -10.507 22.315 4.753 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -9.162 22.836 3.757 1.00 0.00 H new ATOM 32 N VAL A 3 -12.647 19.978 0.660 1.00 0.00 N ATOM 33 CA VAL A 3 -13.858 19.144 0.518 1.00 0.00 C ATOM 34 C VAL A 3 -13.495 17.831 -0.194 1.00 0.00 C ATOM 35 O VAL A 3 -12.783 17.843 -1.198 1.00 0.00 O ATOM 36 CB VAL A 3 -14.987 19.885 -0.250 1.00 0.00 C ATOM 37 CG1 VAL A 3 -16.281 19.050 -0.284 1.00 0.00 C ATOM 38 CG2 VAL A 3 -15.328 21.253 0.369 1.00 0.00 C ATOM 0 H VAL A 3 -12.063 19.974 -0.176 1.00 0.00 H new ATOM 0 HA VAL A 3 -14.239 18.927 1.516 1.00 0.00 H new ATOM 0 HB VAL A 3 -14.601 20.036 -1.258 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -17.052 19.596 -0.828 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -16.088 18.100 -0.783 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -16.620 18.863 0.735 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -16.123 21.726 -0.208 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -15.660 21.114 1.398 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -14.443 21.889 0.356 1.00 0.00 H new ATOM 48 N ARG A 4 -13.998 16.703 0.329 1.00 0.00 N ATOM 49 CA ARG A 4 -13.705 15.334 -0.142 1.00 0.00 C ATOM 50 C ARG A 4 -14.786 14.766 -1.092 1.00 0.00 C ATOM 51 O ARG A 4 -15.115 13.578 -1.044 1.00 0.00 O ATOM 52 CB ARG A 4 -13.368 14.412 1.054 1.00 0.00 C ATOM 53 CG ARG A 4 -14.445 14.312 2.156 1.00 0.00 C ATOM 54 CD ARG A 4 -14.150 15.235 3.349 1.00 0.00 C ATOM 55 NE ARG A 4 -15.210 15.146 4.368 1.00 0.00 N ATOM 56 CZ ARG A 4 -15.267 15.831 5.507 1.00 0.00 C ATOM 57 NH1 ARG A 4 -14.338 16.701 5.849 1.00 0.00 N ATOM 58 NH2 ARG A 4 -16.277 15.646 6.330 1.00 0.00 N ATOM 0 H ARG A 4 -14.643 16.715 1.119 1.00 0.00 H new ATOM 0 HA ARG A 4 -12.814 15.381 -0.769 1.00 0.00 H new ATOM 0 HB2 ARG A 4 -13.174 13.410 0.671 1.00 0.00 H new ATOM 0 HB3 ARG A 4 -12.442 14.764 1.509 1.00 0.00 H new ATOM 0 HG2 ARG A 4 -15.417 14.567 1.734 1.00 0.00 H new ATOM 0 HG3 ARG A 4 -14.510 13.281 2.505 1.00 0.00 H new ATOM 0 HD2 ARG A 4 -13.192 14.964 3.793 1.00 0.00 H new ATOM 0 HD3 ARG A 4 -14.061 16.265 3.002 1.00 0.00 H new ATOM 0 HE ARG A 4 -15.974 14.496 4.182 1.00 0.00 H new ATOM 0 HH11 ARG A 4 -13.543 16.867 5.232 1.00 0.00 H new ATOM 0 HH12 ARG A 4 -14.414 17.209 6.730 1.00 0.00 H new ATOM 0 HH21 ARG A 4 -17.012 14.980 6.094 1.00 0.00 H new ATOM 0 HH22 ARG A 4 -16.325 16.169 7.204 1.00 0.00 H new ATOM 72 N ARG A 5 -15.358 15.631 -1.940 1.00 0.00 N ATOM 73 CA ARG A 5 -16.382 15.314 -2.955 1.00 0.00 C ATOM 74 C ARG A 5 -15.871 15.625 -4.375 1.00 0.00 C ATOM 75 O ARG A 5 -14.989 16.469 -4.558 1.00 0.00 O ATOM 76 CB ARG A 5 -17.672 16.109 -2.662 1.00 0.00 C ATOM 77 CG ARG A 5 -18.332 15.796 -1.306 1.00 0.00 C ATOM 78 CD ARG A 5 -18.831 14.350 -1.193 1.00 0.00 C ATOM 79 NE ARG A 5 -19.555 14.137 0.071 1.00 0.00 N ATOM 80 CZ ARG A 5 -20.191 13.028 0.439 1.00 0.00 C ATOM 81 NH1 ARG A 5 -20.224 11.954 -0.325 1.00 0.00 N ATOM 82 NH2 ARG A 5 -20.814 12.985 1.597 1.00 0.00 N ATOM 0 H ARG A 5 -15.110 16.620 -1.940 1.00 0.00 H new ATOM 0 HA ARG A 5 -16.599 14.247 -2.904 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -17.442 17.174 -2.701 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -18.393 15.910 -3.455 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -17.615 15.989 -0.508 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -19.170 16.475 -1.153 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -19.486 14.121 -2.034 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -17.986 13.665 -1.252 1.00 0.00 H new ATOM 0 HE ARG A 5 -19.571 14.916 0.729 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -19.752 11.957 -1.229 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -20.721 11.120 -0.012 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -20.808 13.800 2.210 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -21.303 12.136 1.882 1.00 0.00 H new ATOM 96 N GLY A 6 -16.429 14.947 -5.383 1.00 0.00 N ATOM 97 CA GLY A 6 -16.017 15.050 -6.793 1.00 0.00 C ATOM 98 C GLY A 6 -16.743 16.173 -7.533 1.00 0.00 C ATOM 99 O GLY A 6 -17.858 15.977 -8.016 1.00 0.00 O ATOM 0 H GLY A 6 -17.200 14.294 -5.241 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -14.942 15.222 -6.843 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -16.212 14.103 -7.295 1.00 0.00 H new ATOM 103 N HIS A 7 -16.089 17.329 -7.657 1.00 0.00 N ATOM 104 CA HIS A 7 -16.541 18.516 -8.402 1.00 0.00 C ATOM 105 C HIS A 7 -15.381 19.529 -8.582 1.00 0.00 C ATOM 106 O HIS A 7 -14.349 19.421 -7.912 1.00 0.00 O ATOM 107 CB HIS A 7 -17.752 19.167 -7.695 1.00 0.00 C ATOM 108 CG HIS A 7 -17.479 19.647 -6.288 1.00 0.00 C ATOM 109 ND1 HIS A 7 -16.943 20.864 -5.924 1.00 0.00 N ATOM 110 CD2 HIS A 7 -17.750 18.966 -5.132 1.00 0.00 C ATOM 111 CE1 HIS A 7 -16.884 20.905 -4.582 1.00 0.00 C ATOM 112 NE2 HIS A 7 -17.369 19.768 -4.049 1.00 0.00 N ATOM 0 H HIS A 7 -15.180 17.475 -7.218 1.00 0.00 H new ATOM 0 HA HIS A 7 -16.860 18.201 -9.396 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -18.093 20.012 -8.293 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -18.569 18.446 -7.666 1.00 0.00 H new ATOM 0 HD1 HIS A 7 -16.644 21.603 -6.561 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -18.183 17.979 -5.066 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -16.500 21.736 -4.010 1.00 0.00 H new ATOM 120 N VAL A 8 -15.554 20.536 -9.452 1.00 0.00 N ATOM 121 CA VAL A 8 -14.608 21.667 -9.588 1.00 0.00 C ATOM 122 C VAL A 8 -14.750 22.611 -8.385 1.00 0.00 C ATOM 123 O VAL A 8 -15.854 22.852 -7.893 1.00 0.00 O ATOM 124 CB VAL A 8 -14.790 22.427 -10.928 1.00 0.00 C ATOM 125 CG1 VAL A 8 -13.905 23.681 -11.050 1.00 0.00 C ATOM 126 CG2 VAL A 8 -14.463 21.499 -12.112 1.00 0.00 C ATOM 0 H VAL A 8 -16.353 20.594 -10.084 1.00 0.00 H new ATOM 0 HA VAL A 8 -13.597 21.261 -9.602 1.00 0.00 H new ATOM 0 HB VAL A 8 -15.832 22.747 -10.946 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -14.085 24.161 -12.012 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -14.147 24.376 -10.246 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -12.856 23.394 -10.979 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -14.594 22.043 -13.048 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -13.431 21.157 -12.032 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -15.132 20.639 -12.096 1.00 0.00 H new ATOM 136 N ALA A 9 -13.618 23.147 -7.924 1.00 0.00 N ATOM 137 CA ALA A 9 -13.493 24.088 -6.809 1.00 0.00 C ATOM 138 C ALA A 9 -12.210 24.937 -6.976 1.00 0.00 C ATOM 139 O ALA A 9 -11.302 24.504 -7.699 1.00 0.00 O ATOM 140 CB ALA A 9 -13.476 23.271 -5.504 1.00 0.00 C ATOM 0 H ALA A 9 -12.714 22.924 -8.342 1.00 0.00 H new ATOM 0 HA ALA A 9 -14.333 24.783 -6.785 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -13.383 23.946 -4.653 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -14.403 22.704 -5.418 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -12.630 22.584 -5.516 1.00 0.00 H new ATOM 146 N PRO A 10 -12.098 26.113 -6.320 1.00 0.00 N ATOM 147 CA PRO A 10 -10.872 26.908 -6.325 1.00 0.00 C ATOM 148 C PRO A 10 -9.771 26.170 -5.551 1.00 0.00 C ATOM 149 O PRO A 10 -9.796 26.079 -4.322 1.00 0.00 O ATOM 150 CB PRO A 10 -11.252 28.261 -5.709 1.00 0.00 C ATOM 151 CG PRO A 10 -12.442 27.930 -4.809 1.00 0.00 C ATOM 152 CD PRO A 10 -13.138 26.792 -5.557 1.00 0.00 C ATOM 0 HA PRO A 10 -10.466 27.065 -7.324 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -10.426 28.687 -5.140 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -11.520 28.988 -6.475 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -12.121 27.621 -3.814 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -13.100 28.789 -4.679 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -13.621 26.106 -4.861 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -13.916 27.177 -6.216 1.00 0.00 H new ATOM 160 N GLN A 11 -8.809 25.622 -6.296 1.00 0.00 N ATOM 161 CA GLN A 11 -7.644 24.908 -5.762 1.00 0.00 C ATOM 162 C GLN A 11 -6.552 25.882 -5.285 1.00 0.00 C ATOM 163 O GLN A 11 -6.562 27.074 -5.608 1.00 0.00 O ATOM 164 CB GLN A 11 -7.089 23.960 -6.842 1.00 0.00 C ATOM 165 CG GLN A 11 -8.028 22.767 -7.100 1.00 0.00 C ATOM 166 CD GLN A 11 -7.591 21.933 -8.307 1.00 0.00 C ATOM 167 OE1 GLN A 11 -6.785 21.015 -8.209 1.00 0.00 O ATOM 168 NE2 GLN A 11 -8.097 22.220 -9.493 1.00 0.00 N ATOM 0 H GLN A 11 -8.818 25.663 -7.315 1.00 0.00 H new ATOM 0 HA GLN A 11 -7.961 24.329 -4.895 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -6.943 24.513 -7.770 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -6.111 23.591 -6.533 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -8.057 22.132 -6.214 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -9.041 23.134 -7.263 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -8.769 22.981 -9.590 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -7.816 21.680 -10.312 1.00 0.00 H new ATOM 177 N ASN A 12 -5.569 25.366 -4.539 1.00 0.00 N ATOM 178 CA ASN A 12 -4.389 26.128 -4.145 1.00 0.00 C ATOM 179 C ASN A 12 -3.487 26.431 -5.358 1.00 0.00 C ATOM 180 O ASN A 12 -3.361 25.626 -6.284 1.00 0.00 O ATOM 181 CB ASN A 12 -3.648 25.404 -3.006 1.00 0.00 C ATOM 182 CG ASN A 12 -3.351 23.925 -3.268 1.00 0.00 C ATOM 183 OD1 ASN A 12 -3.816 23.051 -2.549 1.00 0.00 O ATOM 184 ND2 ASN A 12 -2.595 23.591 -4.298 1.00 0.00 N ATOM 0 H ASN A 12 -5.574 24.406 -4.193 1.00 0.00 H new ATOM 0 HA ASN A 12 -4.703 27.098 -3.759 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -2.707 25.921 -2.818 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -4.243 25.485 -2.096 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -2.401 22.608 -4.491 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -2.205 24.316 -4.901 1.00 0.00 H new ATOM 191 N THR A 13 -2.826 27.589 -5.312 1.00 0.00 N ATOM 192 CA THR A 13 -1.988 28.149 -6.393 1.00 0.00 C ATOM 193 C THR A 13 -0.518 28.275 -5.998 1.00 0.00 C ATOM 194 O THR A 13 0.350 27.970 -6.812 1.00 0.00 O ATOM 195 CB THR A 13 -2.542 29.514 -6.825 1.00 0.00 C ATOM 196 OG1 THR A 13 -2.665 30.350 -5.689 1.00 0.00 O ATOM 197 CG2 THR A 13 -3.922 29.369 -7.477 1.00 0.00 C ATOM 0 H THR A 13 -2.856 28.193 -4.490 1.00 0.00 H new ATOM 0 HA THR A 13 -2.029 27.450 -7.228 1.00 0.00 H new ATOM 0 HB THR A 13 -1.853 29.947 -7.550 1.00 0.00 H new ATOM 0 HG1 THR A 13 -3.017 31.223 -5.962 1.00 0.00 H new ATOM 0 HG21 THR A 13 -4.290 30.352 -7.773 1.00 0.00 H new ATOM 0 HG22 THR A 13 -3.843 28.731 -8.357 1.00 0.00 H new ATOM 0 HG23 THR A 13 -4.616 28.921 -6.765 1.00 0.00 H new ATOM 205 N PHE A 14 -0.229 28.665 -4.751 1.00 0.00 N ATOM 206 CA PHE A 14 1.137 28.773 -4.220 1.00 0.00 C ATOM 207 C PHE A 14 1.700 27.414 -3.801 1.00 0.00 C ATOM 208 O PHE A 14 2.818 27.056 -4.167 1.00 0.00 O ATOM 209 CB PHE A 14 1.126 29.726 -3.019 1.00 0.00 C ATOM 210 CG PHE A 14 2.509 30.206 -2.615 1.00 0.00 C ATOM 211 CD1 PHE A 14 3.049 31.367 -3.200 1.00 0.00 C ATOM 212 CD2 PHE A 14 3.267 29.479 -1.675 1.00 0.00 C ATOM 213 CE1 PHE A 14 4.338 31.803 -2.843 1.00 0.00 C ATOM 214 CE2 PHE A 14 4.557 29.915 -1.320 1.00 0.00 C ATOM 215 CZ PHE A 14 5.092 31.078 -1.904 1.00 0.00 C ATOM 0 H PHE A 14 -0.947 28.918 -4.072 1.00 0.00 H new ATOM 0 HA PHE A 14 1.782 29.159 -5.009 1.00 0.00 H new ATOM 0 HB2 PHE A 14 0.505 30.590 -3.256 1.00 0.00 H new ATOM 0 HB3 PHE A 14 0.662 29.223 -2.170 1.00 0.00 H new ATOM 0 HD1 PHE A 14 2.473 31.924 -3.924 1.00 0.00 H new ATOM 0 HD2 PHE A 14 2.857 28.586 -1.227 1.00 0.00 H new ATOM 0 HE1 PHE A 14 4.749 32.696 -3.291 1.00 0.00 H new ATOM 0 HE2 PHE A 14 5.136 29.357 -0.599 1.00 0.00 H new ATOM 0 HZ PHE A 14 6.082 31.413 -1.631 1.00 0.00 H new ATOM 225 N LEU A 15 0.902 26.640 -3.053 1.00 0.00 N ATOM 226 CA LEU A 15 1.263 25.287 -2.617 1.00 0.00 C ATOM 227 C LEU A 15 1.491 24.365 -3.821 1.00 0.00 C ATOM 228 O LEU A 15 2.404 23.547 -3.804 1.00 0.00 O ATOM 229 CB LEU A 15 0.172 24.757 -1.667 1.00 0.00 C ATOM 230 CG LEU A 15 0.410 23.308 -1.196 1.00 0.00 C ATOM 231 CD1 LEU A 15 1.704 23.156 -0.384 1.00 0.00 C ATOM 232 CD2 LEU A 15 -0.772 22.836 -0.341 1.00 0.00 C ATOM 0 H LEU A 15 -0.019 26.939 -2.732 1.00 0.00 H new ATOM 0 HA LEU A 15 2.206 25.314 -2.072 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.115 25.408 -0.795 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.793 24.812 -2.170 1.00 0.00 H new ATOM 0 HG LEU A 15 0.505 22.696 -2.093 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.822 22.116 -0.078 1.00 0.00 H new ATOM 0 HD12 LEU A 15 2.555 23.452 -0.997 1.00 0.00 H new ATOM 0 HD13 LEU A 15 1.655 23.791 0.500 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -0.597 21.812 -0.012 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -0.873 23.484 0.529 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -1.687 22.876 -0.932 1.00 0.00 H new ATOM 244 N ASP A 16 0.726 24.551 -4.898 1.00 0.00 N ATOM 245 CA ASP A 16 0.879 23.806 -6.160 1.00 0.00 C ATOM 246 C ASP A 16 2.294 23.883 -6.761 1.00 0.00 C ATOM 247 O ASP A 16 2.748 22.934 -7.404 1.00 0.00 O ATOM 248 CB ASP A 16 -0.131 24.362 -7.162 1.00 0.00 C ATOM 249 CG ASP A 16 -0.297 23.446 -8.385 1.00 0.00 C ATOM 250 OD1 ASP A 16 -0.850 22.331 -8.227 1.00 0.00 O ATOM 251 OD2 ASP A 16 0.109 23.849 -9.501 1.00 0.00 O ATOM 0 H ASP A 16 -0.031 25.234 -4.924 1.00 0.00 H new ATOM 0 HA ASP A 16 0.702 22.753 -5.942 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -1.096 24.489 -6.671 1.00 0.00 H new ATOM 0 HB3 ASP A 16 0.192 25.350 -7.491 1.00 0.00 H new ATOM 256 N THR A 17 3.008 24.984 -6.495 1.00 0.00 N ATOM 257 CA THR A 17 4.416 25.185 -6.887 1.00 0.00 C ATOM 258 C THR A 17 5.356 24.295 -6.074 1.00 0.00 C ATOM 259 O THR A 17 6.407 23.896 -6.570 1.00 0.00 O ATOM 260 CB THR A 17 4.809 26.665 -6.749 1.00 0.00 C ATOM 261 OG1 THR A 17 3.883 27.446 -7.480 1.00 0.00 O ATOM 262 CG2 THR A 17 6.203 26.969 -7.309 1.00 0.00 C ATOM 0 H THR A 17 2.618 25.780 -5.990 1.00 0.00 H new ATOM 0 HA THR A 17 4.515 24.897 -7.934 1.00 0.00 H new ATOM 0 HB THR A 17 4.810 26.898 -5.684 1.00 0.00 H new ATOM 0 HG1 THR A 17 4.119 28.394 -7.400 1.00 0.00 H new ATOM 0 HG21 THR A 17 6.423 28.029 -7.182 1.00 0.00 H new ATOM 0 HG22 THR A 17 6.947 26.378 -6.774 1.00 0.00 H new ATOM 0 HG23 THR A 17 6.232 26.716 -8.369 1.00 0.00 H new ATOM 270 N ILE A 18 4.975 23.929 -4.847 1.00 0.00 N ATOM 271 CA ILE A 18 5.778 23.085 -3.947 1.00 0.00 C ATOM 272 C ILE A 18 5.635 21.617 -4.349 1.00 0.00 C ATOM 273 O ILE A 18 6.612 20.875 -4.332 1.00 0.00 O ATOM 274 CB ILE A 18 5.368 23.313 -2.472 1.00 0.00 C ATOM 275 CG1 ILE A 18 5.165 24.804 -2.104 1.00 0.00 C ATOM 276 CG2 ILE A 18 6.386 22.657 -1.521 1.00 0.00 C ATOM 277 CD1 ILE A 18 6.370 25.726 -2.325 1.00 0.00 C ATOM 0 H ILE A 18 4.084 24.214 -4.440 1.00 0.00 H new ATOM 0 HA ILE A 18 6.828 23.363 -4.038 1.00 0.00 H new ATOM 0 HB ILE A 18 4.395 22.837 -2.352 1.00 0.00 H new ATOM 0 HG12 ILE A 18 4.328 25.189 -2.686 1.00 0.00 H new ATOM 0 HG13 ILE A 18 4.877 24.862 -1.054 1.00 0.00 H new ATOM 0 HG21 ILE A 18 6.082 22.828 -0.488 1.00 0.00 H new ATOM 0 HG22 ILE A 18 6.427 21.585 -1.715 1.00 0.00 H new ATOM 0 HG23 ILE A 18 7.371 23.093 -1.686 1.00 0.00 H new ATOM 0 HD11 ILE A 18 6.108 26.743 -2.033 1.00 0.00 H new ATOM 0 HD12 ILE A 18 7.209 25.379 -1.722 1.00 0.00 H new ATOM 0 HD13 ILE A 18 6.650 25.712 -3.378 1.00 0.00 H new ATOM 289 N ILE A 19 4.453 21.212 -4.822 1.00 0.00 N ATOM 290 CA ILE A 19 4.238 19.891 -5.433 1.00 0.00 C ATOM 291 C ILE A 19 5.240 19.649 -6.572 1.00 0.00 C ATOM 292 O ILE A 19 5.811 18.564 -6.644 1.00 0.00 O ATOM 293 CB ILE A 19 2.756 19.745 -5.871 1.00 0.00 C ATOM 294 CG1 ILE A 19 1.832 19.405 -4.678 1.00 0.00 C ATOM 295 CG2 ILE A 19 2.567 18.643 -6.934 1.00 0.00 C ATOM 296 CD1 ILE A 19 1.625 20.487 -3.619 1.00 0.00 C ATOM 0 H ILE A 19 3.614 21.791 -4.793 1.00 0.00 H new ATOM 0 HA ILE A 19 4.427 19.109 -4.697 1.00 0.00 H new ATOM 0 HB ILE A 19 2.485 20.714 -6.291 1.00 0.00 H new ATOM 0 HG12 ILE A 19 0.855 19.132 -5.076 1.00 0.00 H new ATOM 0 HG13 ILE A 19 2.233 18.521 -4.182 1.00 0.00 H new ATOM 0 HG21 ILE A 19 1.514 18.579 -7.208 1.00 0.00 H new ATOM 0 HG22 ILE A 19 3.158 18.884 -7.817 1.00 0.00 H new ATOM 0 HG23 ILE A 19 2.895 17.686 -6.528 1.00 0.00 H new ATOM 0 HD11 ILE A 19 0.957 20.114 -2.843 1.00 0.00 H new ATOM 0 HD12 ILE A 19 2.585 20.750 -3.175 1.00 0.00 H new ATOM 0 HD13 ILE A 19 1.185 21.370 -4.082 1.00 0.00 H new ATOM 308 N ARG A 20 5.540 20.660 -7.402 1.00 0.00 N ATOM 309 CA ARG A 20 6.496 20.511 -8.514 1.00 0.00 C ATOM 310 C ARG A 20 7.923 20.194 -8.030 1.00 0.00 C ATOM 311 O ARG A 20 8.672 19.498 -8.716 1.00 0.00 O ATOM 312 CB ARG A 20 6.533 21.764 -9.406 1.00 0.00 C ATOM 313 CG ARG A 20 5.184 22.370 -9.841 1.00 0.00 C ATOM 314 CD ARG A 20 4.090 21.385 -10.284 1.00 0.00 C ATOM 315 NE ARG A 20 4.569 20.381 -11.244 1.00 0.00 N ATOM 316 CZ ARG A 20 4.819 20.517 -12.536 1.00 0.00 C ATOM 317 NH1 ARG A 20 4.688 21.658 -13.181 1.00 0.00 N ATOM 318 NH2 ARG A 20 5.215 19.446 -13.183 1.00 0.00 N ATOM 0 H ARG A 20 5.134 21.592 -7.325 1.00 0.00 H new ATOM 0 HA ARG A 20 6.135 19.664 -9.098 1.00 0.00 H new ATOM 0 HB2 ARG A 20 7.093 22.536 -8.878 1.00 0.00 H new ATOM 0 HB3 ARG A 20 7.097 21.519 -10.306 1.00 0.00 H new ATOM 0 HG2 ARG A 20 4.794 22.960 -9.012 1.00 0.00 H new ATOM 0 HG3 ARG A 20 5.372 23.061 -10.663 1.00 0.00 H new ATOM 0 HD2 ARG A 20 3.690 20.877 -9.406 1.00 0.00 H new ATOM 0 HD3 ARG A 20 3.268 21.943 -10.732 1.00 0.00 H new ATOM 0 HE ARG A 20 4.731 19.450 -10.861 1.00 0.00 H new ATOM 0 HH11 ARG A 20 4.380 22.493 -12.683 1.00 0.00 H new ATOM 0 HH12 ARG A 20 4.895 21.706 -14.179 1.00 0.00 H new ATOM 0 HH21 ARG A 20 5.317 18.560 -12.688 1.00 0.00 H new ATOM 0 HH22 ARG A 20 5.420 19.500 -14.181 1.00 0.00 H new ATOM 332 N LYS A 21 8.299 20.663 -6.834 1.00 0.00 N ATOM 333 CA LYS A 21 9.581 20.349 -6.185 1.00 0.00 C ATOM 334 C LYS A 21 9.597 18.909 -5.637 1.00 0.00 C ATOM 335 O LYS A 21 10.597 18.202 -5.781 1.00 0.00 O ATOM 336 CB LYS A 21 9.840 21.370 -5.058 1.00 0.00 C ATOM 337 CG LYS A 21 9.887 22.827 -5.557 1.00 0.00 C ATOM 338 CD LYS A 21 10.011 23.846 -4.416 1.00 0.00 C ATOM 339 CE LYS A 21 11.345 23.706 -3.666 1.00 0.00 C ATOM 340 NZ LYS A 21 11.527 24.778 -2.649 1.00 0.00 N ATOM 0 H LYS A 21 7.710 21.284 -6.278 1.00 0.00 H new ATOM 0 HA LYS A 21 10.378 20.417 -6.926 1.00 0.00 H new ATOM 0 HB2 LYS A 21 9.058 21.276 -4.305 1.00 0.00 H new ATOM 0 HB3 LYS A 21 10.784 21.130 -4.569 1.00 0.00 H new ATOM 0 HG2 LYS A 21 10.731 22.946 -6.237 1.00 0.00 H new ATOM 0 HG3 LYS A 21 8.984 23.039 -6.130 1.00 0.00 H new ATOM 0 HD2 LYS A 21 9.925 24.855 -4.819 1.00 0.00 H new ATOM 0 HD3 LYS A 21 9.186 23.711 -3.717 1.00 0.00 H new ATOM 0 HE2 LYS A 21 11.386 22.732 -3.178 1.00 0.00 H new ATOM 0 HE3 LYS A 21 12.168 23.740 -4.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 12.439 24.647 -2.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 11.513 25.707 -3.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 10.756 24.730 -1.952 1.00 0.00 H new ATOM 354 N PHE A 22 8.471 18.448 -5.072 1.00 0.00 N ATOM 355 CA PHE A 22 8.301 17.092 -4.533 1.00 0.00 C ATOM 356 C PHE A 22 8.097 16.027 -5.625 1.00 0.00 C ATOM 357 O PHE A 22 8.413 14.859 -5.394 1.00 0.00 O ATOM 358 CB PHE A 22 7.159 17.092 -3.504 1.00 0.00 C ATOM 359 CG PHE A 22 7.597 17.492 -2.104 1.00 0.00 C ATOM 360 CD1 PHE A 22 7.875 18.838 -1.798 1.00 0.00 C ATOM 361 CD2 PHE A 22 7.751 16.509 -1.107 1.00 0.00 C ATOM 362 CE1 PHE A 22 8.296 19.201 -0.506 1.00 0.00 C ATOM 363 CE2 PHE A 22 8.175 16.871 0.185 1.00 0.00 C ATOM 364 CZ PHE A 22 8.447 18.217 0.486 1.00 0.00 C ATOM 0 H PHE A 22 7.634 19.022 -4.975 1.00 0.00 H new ATOM 0 HA PHE A 22 9.229 16.810 -4.036 1.00 0.00 H new ATOM 0 HB2 PHE A 22 6.379 17.775 -3.840 1.00 0.00 H new ATOM 0 HB3 PHE A 22 6.716 16.097 -3.466 1.00 0.00 H new ATOM 0 HD1 PHE A 22 7.764 19.596 -2.560 1.00 0.00 H new ATOM 0 HD2 PHE A 22 7.543 15.474 -1.335 1.00 0.00 H new ATOM 0 HE1 PHE A 22 8.503 20.236 -0.276 1.00 0.00 H new ATOM 0 HE2 PHE A 22 8.292 16.114 0.946 1.00 0.00 H new ATOM 0 HZ PHE A 22 8.771 18.494 1.478 1.00 0.00 H new ATOM 374 N GLU A 23 7.654 16.414 -6.829 1.00 0.00 N ATOM 375 CA GLU A 23 7.645 15.532 -8.011 1.00 0.00 C ATOM 376 C GLU A 23 9.053 15.066 -8.439 1.00 0.00 C ATOM 377 O GLU A 23 9.182 14.075 -9.163 1.00 0.00 O ATOM 378 CB GLU A 23 6.950 16.208 -9.205 1.00 0.00 C ATOM 379 CG GLU A 23 5.424 16.179 -9.092 1.00 0.00 C ATOM 380 CD GLU A 23 4.760 16.553 -10.427 1.00 0.00 C ATOM 381 OE1 GLU A 23 5.071 17.631 -10.988 1.00 0.00 O ATOM 382 OE2 GLU A 23 3.919 15.768 -10.928 1.00 0.00 O ATOM 0 H GLU A 23 7.290 17.349 -7.014 1.00 0.00 H new ATOM 0 HA GLU A 23 7.084 14.648 -7.708 1.00 0.00 H new ATOM 0 HB2 GLU A 23 7.286 17.243 -9.278 1.00 0.00 H new ATOM 0 HB3 GLU A 23 7.252 15.709 -10.126 1.00 0.00 H new ATOM 0 HG2 GLU A 23 5.098 15.185 -8.787 1.00 0.00 H new ATOM 0 HG3 GLU A 23 5.101 16.872 -8.315 1.00 0.00 H new ATOM 389 N GLY A 24 10.115 15.715 -7.947 1.00 0.00 N ATOM 390 CA GLY A 24 11.526 15.354 -8.138 1.00 0.00 C ATOM 391 C GLY A 24 11.960 14.163 -7.278 1.00 0.00 C ATOM 392 O GLY A 24 13.034 14.201 -6.679 1.00 0.00 O ATOM 0 H GLY A 24 10.008 16.552 -7.374 1.00 0.00 H new ATOM 0 HA2 GLY A 24 11.696 15.118 -9.188 1.00 0.00 H new ATOM 0 HA3 GLY A 24 12.151 16.214 -7.899 1.00 0.00 H new ATOM 396 N GLN A 25 11.111 13.127 -7.218 1.00 0.00 N ATOM 397 CA GLN A 25 11.354 11.802 -6.621 1.00 0.00 C ATOM 398 C GLN A 25 11.228 11.796 -5.078 1.00 0.00 C ATOM 399 O GLN A 25 11.643 10.843 -4.419 1.00 0.00 O ATOM 400 CB GLN A 25 12.707 11.247 -7.127 1.00 0.00 C ATOM 401 CG GLN A 25 12.784 9.711 -7.215 1.00 0.00 C ATOM 402 CD GLN A 25 11.886 9.139 -8.315 1.00 0.00 C ATOM 403 OE1 GLN A 25 10.745 8.757 -8.087 1.00 0.00 O ATOM 404 NE2 GLN A 25 12.343 9.082 -9.551 1.00 0.00 N ATOM 0 H GLN A 25 10.172 13.195 -7.611 1.00 0.00 H new ATOM 0 HA GLN A 25 10.565 11.128 -6.953 1.00 0.00 H new ATOM 0 HB2 GLN A 25 12.908 11.664 -8.114 1.00 0.00 H new ATOM 0 HB3 GLN A 25 13.498 11.599 -6.465 1.00 0.00 H new ATOM 0 HG2 GLN A 25 13.816 9.413 -7.401 1.00 0.00 H new ATOM 0 HG3 GLN A 25 12.496 9.281 -6.256 1.00 0.00 H new ATOM 0 HE21 GLN A 25 13.291 9.396 -9.759 1.00 0.00 H new ATOM 0 HE22 GLN A 25 11.748 8.724 -10.299 1.00 0.00 H new ATOM 413 N SER A 26 10.656 12.843 -4.469 1.00 0.00 N ATOM 414 CA SER A 26 10.599 13.008 -3.003 1.00 0.00 C ATOM 415 C SER A 26 9.467 12.205 -2.331 1.00 0.00 C ATOM 416 O SER A 26 9.350 12.204 -1.101 1.00 0.00 O ATOM 417 CB SER A 26 10.435 14.499 -2.657 1.00 0.00 C ATOM 418 OG SER A 26 11.349 15.338 -3.362 1.00 0.00 O ATOM 0 H SER A 26 10.215 13.608 -4.980 1.00 0.00 H new ATOM 0 HA SER A 26 11.538 12.615 -2.614 1.00 0.00 H new ATOM 0 HB2 SER A 26 9.415 14.809 -2.885 1.00 0.00 H new ATOM 0 HB3 SER A 26 10.578 14.636 -1.585 1.00 0.00 H new ATOM 0 HG SER A 26 11.200 16.272 -3.106 1.00 0.00 H new ATOM 424 N ARG A 27 8.601 11.555 -3.124 1.00 0.00 N ATOM 425 CA ARG A 27 7.416 10.830 -2.645 1.00 0.00 C ATOM 426 C ARG A 27 7.740 9.421 -2.122 1.00 0.00 C ATOM 427 O ARG A 27 8.835 8.888 -2.301 1.00 0.00 O ATOM 428 CB ARG A 27 6.346 10.735 -3.747 1.00 0.00 C ATOM 429 CG ARG A 27 6.032 12.022 -4.531 1.00 0.00 C ATOM 430 CD ARG A 27 5.700 13.220 -3.634 1.00 0.00 C ATOM 431 NE ARG A 27 4.878 14.200 -4.369 1.00 0.00 N ATOM 432 CZ ARG A 27 3.932 14.980 -3.855 1.00 0.00 C ATOM 433 NH1 ARG A 27 3.789 15.151 -2.557 1.00 0.00 N ATOM 434 NH2 ARG A 27 3.099 15.603 -4.657 1.00 0.00 N ATOM 0 H ARG A 27 8.708 11.519 -4.138 1.00 0.00 H new ATOM 0 HA ARG A 27 7.031 11.410 -1.806 1.00 0.00 H new ATOM 0 HB2 ARG A 27 6.661 9.973 -4.460 1.00 0.00 H new ATOM 0 HB3 ARG A 27 5.421 10.382 -3.291 1.00 0.00 H new ATOM 0 HG2 ARG A 27 6.887 12.274 -5.158 1.00 0.00 H new ATOM 0 HG3 ARG A 27 5.191 11.835 -5.199 1.00 0.00 H new ATOM 0 HD2 ARG A 27 5.166 12.881 -2.746 1.00 0.00 H new ATOM 0 HD3 ARG A 27 6.621 13.692 -3.291 1.00 0.00 H new ATOM 0 HE ARG A 27 5.053 14.288 -5.370 1.00 0.00 H new ATOM 0 HH11 ARG A 27 4.417 14.677 -1.908 1.00 0.00 H new ATOM 0 HH12 ARG A 27 3.051 15.758 -2.201 1.00 0.00 H new ATOM 0 HH21 ARG A 27 3.180 15.487 -5.667 1.00 0.00 H new ATOM 0 HH22 ARG A 27 2.371 16.203 -4.270 1.00 0.00 H new ATOM 448 N LYS A 28 6.739 8.781 -1.511 1.00 0.00 N ATOM 449 CA LYS A 28 6.816 7.412 -0.982 1.00 0.00 C ATOM 450 C LYS A 28 6.007 6.445 -1.860 1.00 0.00 C ATOM 451 O LYS A 28 4.854 6.728 -2.177 1.00 0.00 O ATOM 452 CB LYS A 28 6.285 7.407 0.465 1.00 0.00 C ATOM 453 CG LYS A 28 6.936 8.474 1.363 1.00 0.00 C ATOM 454 CD LYS A 28 6.020 9.699 1.572 1.00 0.00 C ATOM 455 CE LYS A 28 6.876 10.876 2.050 1.00 0.00 C ATOM 456 NZ LYS A 28 6.123 12.164 2.122 1.00 0.00 N ATOM 0 H LYS A 28 5.826 9.211 -1.365 1.00 0.00 H new ATOM 0 HA LYS A 28 7.853 7.076 -0.990 1.00 0.00 H new ATOM 0 HB2 LYS A 28 5.207 7.567 0.448 1.00 0.00 H new ATOM 0 HB3 LYS A 28 6.455 6.423 0.902 1.00 0.00 H new ATOM 0 HG2 LYS A 28 7.177 8.034 2.331 1.00 0.00 H new ATOM 0 HG3 LYS A 28 7.876 8.798 0.916 1.00 0.00 H new ATOM 0 HD2 LYS A 28 5.512 9.954 0.642 1.00 0.00 H new ATOM 0 HD3 LYS A 28 5.246 9.472 2.306 1.00 0.00 H new ATOM 0 HE2 LYS A 28 7.281 10.645 3.035 1.00 0.00 H new ATOM 0 HE3 LYS A 28 7.724 10.996 1.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 6.758 12.919 2.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 5.758 12.406 1.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 5.329 12.065 2.786 1.00 0.00 H new ATOM 470 N PHE A 29 6.575 5.291 -2.213 1.00 0.00 N ATOM 471 CA PHE A 29 5.913 4.253 -3.009 1.00 0.00 C ATOM 472 C PHE A 29 6.592 2.888 -2.890 1.00 0.00 C ATOM 473 O PHE A 29 7.772 2.795 -2.553 1.00 0.00 O ATOM 474 CB PHE A 29 5.815 4.690 -4.484 1.00 0.00 C ATOM 475 CG PHE A 29 7.146 5.000 -5.147 1.00 0.00 C ATOM 476 CD1 PHE A 29 7.932 3.963 -5.686 1.00 0.00 C ATOM 477 CD2 PHE A 29 7.606 6.330 -5.215 1.00 0.00 C ATOM 478 CE1 PHE A 29 9.177 4.251 -6.273 1.00 0.00 C ATOM 479 CE2 PHE A 29 8.848 6.618 -5.807 1.00 0.00 C ATOM 480 CZ PHE A 29 9.635 5.579 -6.333 1.00 0.00 C ATOM 0 H PHE A 29 7.529 5.045 -1.948 1.00 0.00 H new ATOM 0 HA PHE A 29 4.908 4.134 -2.603 1.00 0.00 H new ATOM 0 HB2 PHE A 29 5.318 3.902 -5.050 1.00 0.00 H new ATOM 0 HB3 PHE A 29 5.180 5.574 -4.545 1.00 0.00 H new ATOM 0 HD1 PHE A 29 7.577 2.944 -5.648 1.00 0.00 H new ATOM 0 HD2 PHE A 29 7.003 7.130 -4.811 1.00 0.00 H new ATOM 0 HE1 PHE A 29 9.781 3.452 -6.678 1.00 0.00 H new ATOM 0 HE2 PHE A 29 9.198 7.639 -5.858 1.00 0.00 H new ATOM 0 HZ PHE A 29 10.591 5.801 -6.783 1.00 0.00 H new ATOM 490 N ILE A 30 5.839 1.831 -3.201 1.00 0.00 N ATOM 491 CA ILE A 30 6.296 0.434 -3.230 1.00 0.00 C ATOM 492 C ILE A 30 5.683 -0.314 -4.420 1.00 0.00 C ATOM 493 O ILE A 30 4.573 -0.002 -4.843 1.00 0.00 O ATOM 494 CB ILE A 30 5.998 -0.273 -1.885 1.00 0.00 C ATOM 495 CG1 ILE A 30 4.486 -0.488 -1.642 1.00 0.00 C ATOM 496 CG2 ILE A 30 6.630 0.495 -0.710 1.00 0.00 C ATOM 497 CD1 ILE A 30 4.188 -1.018 -0.238 1.00 0.00 C ATOM 0 H ILE A 30 4.854 1.925 -3.450 1.00 0.00 H new ATOM 0 HA ILE A 30 7.378 0.427 -3.365 1.00 0.00 H new ATOM 0 HB ILE A 30 6.452 -1.262 -1.948 1.00 0.00 H new ATOM 0 HG12 ILE A 30 3.960 0.455 -1.790 1.00 0.00 H new ATOM 0 HG13 ILE A 30 4.098 -1.189 -2.381 1.00 0.00 H new ATOM 0 HG21 ILE A 30 6.407 -0.021 0.224 1.00 0.00 H new ATOM 0 HG22 ILE A 30 7.710 0.546 -0.847 1.00 0.00 H new ATOM 0 HG23 ILE A 30 6.221 1.505 -0.673 1.00 0.00 H new ATOM 0 HD11 ILE A 30 3.113 -1.151 -0.120 1.00 0.00 H new ATOM 0 HD12 ILE A 30 4.690 -1.975 -0.096 1.00 0.00 H new ATOM 0 HD13 ILE A 30 4.549 -0.306 0.504 1.00 0.00 H new ATOM 509 N ILE A 31 6.402 -1.296 -4.962 1.00 0.00 N ATOM 510 CA ILE A 31 6.006 -2.120 -6.107 1.00 0.00 C ATOM 511 C ILE A 31 5.703 -3.535 -5.616 1.00 0.00 C ATOM 512 O ILE A 31 6.534 -4.172 -4.965 1.00 0.00 O ATOM 513 CB ILE A 31 7.116 -2.139 -7.188 1.00 0.00 C ATOM 514 CG1 ILE A 31 7.469 -0.713 -7.685 1.00 0.00 C ATOM 515 CG2 ILE A 31 6.637 -2.987 -8.391 1.00 0.00 C ATOM 516 CD1 ILE A 31 8.646 -0.052 -6.954 1.00 0.00 C ATOM 0 H ILE A 31 7.320 -1.552 -4.599 1.00 0.00 H new ATOM 0 HA ILE A 31 5.113 -1.694 -6.566 1.00 0.00 H new ATOM 0 HB ILE A 31 8.011 -2.570 -6.739 1.00 0.00 H new ATOM 0 HG12 ILE A 31 7.700 -0.761 -8.749 1.00 0.00 H new ATOM 0 HG13 ILE A 31 6.590 -0.078 -7.578 1.00 0.00 H new ATOM 0 HG21 ILE A 31 7.413 -3.005 -9.156 1.00 0.00 H new ATOM 0 HG22 ILE A 31 6.431 -4.005 -8.060 1.00 0.00 H new ATOM 0 HG23 ILE A 31 5.729 -2.550 -8.806 1.00 0.00 H new ATOM 0 HD11 ILE A 31 8.820 0.941 -7.368 1.00 0.00 H new ATOM 0 HD12 ILE A 31 8.413 0.033 -5.893 1.00 0.00 H new ATOM 0 HD13 ILE A 31 9.541 -0.660 -7.082 1.00 0.00 H new ATOM 528 N ALA A 32 4.526 -4.039 -5.970 1.00 0.00 N ATOM 529 CA ALA A 32 4.048 -5.364 -5.610 1.00 0.00 C ATOM 530 C ALA A 32 3.621 -6.154 -6.848 1.00 0.00 C ATOM 531 O ALA A 32 3.007 -5.606 -7.764 1.00 0.00 O ATOM 532 CB ALA A 32 2.902 -5.169 -4.617 1.00 0.00 C ATOM 0 H ALA A 32 3.857 -3.516 -6.535 1.00 0.00 H new ATOM 0 HA ALA A 32 4.840 -5.955 -5.149 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.510 -6.141 -4.318 1.00 0.00 H new ATOM 0 HB2 ALA A 32 3.269 -4.639 -3.738 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.109 -4.587 -5.087 1.00 0.00 H new ATOM 538 N ASN A 33 3.933 -7.449 -6.881 1.00 0.00 N ATOM 539 CA ASN A 33 3.536 -8.327 -7.973 1.00 0.00 C ATOM 540 C ASN A 33 2.020 -8.601 -7.932 1.00 0.00 C ATOM 541 O ASN A 33 1.508 -9.120 -6.940 1.00 0.00 O ATOM 542 CB ASN A 33 4.361 -9.614 -7.877 1.00 0.00 C ATOM 543 CG ASN A 33 4.344 -10.357 -9.202 1.00 0.00 C ATOM 544 OD1 ASN A 33 3.314 -10.837 -9.651 1.00 0.00 O ATOM 545 ND2 ASN A 33 5.475 -10.407 -9.877 1.00 0.00 N ATOM 0 H ASN A 33 4.469 -7.916 -6.149 1.00 0.00 H new ATOM 0 HA ASN A 33 3.734 -7.852 -8.934 1.00 0.00 H new ATOM 0 HB2 ASN A 33 5.388 -9.375 -7.601 1.00 0.00 H new ATOM 0 HB3 ASN A 33 3.959 -10.252 -7.090 1.00 0.00 H new ATOM 0 HD21 ASN A 33 5.502 -10.853 -10.794 1.00 0.00 H new ATOM 0 HD22 ASN A 33 6.323 -10.000 -9.482 1.00 0.00 H new ATOM 552 N ALA A 34 1.298 -8.270 -9.008 1.00 0.00 N ATOM 553 CA ALA A 34 -0.159 -8.445 -9.088 1.00 0.00 C ATOM 554 C ALA A 34 -0.566 -9.921 -9.262 1.00 0.00 C ATOM 555 O ALA A 34 -1.614 -10.343 -8.773 1.00 0.00 O ATOM 556 CB ALA A 34 -0.695 -7.575 -10.235 1.00 0.00 C ATOM 0 H ALA A 34 1.708 -7.871 -9.852 1.00 0.00 H new ATOM 0 HA ALA A 34 -0.602 -8.126 -8.145 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -1.776 -7.694 -10.307 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -0.457 -6.529 -10.040 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -0.232 -7.884 -11.173 1.00 0.00 H new ATOM 562 N ARG A 35 0.292 -10.742 -9.884 1.00 0.00 N ATOM 563 CA ARG A 35 0.069 -12.172 -10.179 1.00 0.00 C ATOM 564 C ARG A 35 0.274 -13.077 -8.938 1.00 0.00 C ATOM 565 O ARG A 35 0.839 -14.167 -9.033 1.00 0.00 O ATOM 566 CB ARG A 35 0.967 -12.593 -11.369 1.00 0.00 C ATOM 567 CG ARG A 35 0.880 -11.696 -12.621 1.00 0.00 C ATOM 568 CD ARG A 35 -0.490 -11.719 -13.311 1.00 0.00 C ATOM 569 NE ARG A 35 -0.765 -13.024 -13.937 1.00 0.00 N ATOM 570 CZ ARG A 35 -1.869 -13.369 -14.592 1.00 0.00 C ATOM 571 NH1 ARG A 35 -2.884 -12.542 -14.741 1.00 0.00 N ATOM 572 NH2 ARG A 35 -1.965 -14.571 -15.117 1.00 0.00 N ATOM 0 H ARG A 35 1.202 -10.417 -10.211 1.00 0.00 H new ATOM 0 HA ARG A 35 -0.975 -12.308 -10.460 1.00 0.00 H new ATOM 0 HB2 ARG A 35 2.003 -12.613 -11.030 1.00 0.00 H new ATOM 0 HB3 ARG A 35 0.706 -13.612 -11.655 1.00 0.00 H new ATOM 0 HG2 ARG A 35 1.115 -10.670 -12.337 1.00 0.00 H new ATOM 0 HG3 ARG A 35 1.640 -12.012 -13.335 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -1.268 -11.494 -12.582 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -0.528 -10.937 -14.069 1.00 0.00 H new ATOM 0 HE ARG A 35 -0.036 -13.733 -13.860 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -2.838 -11.602 -14.347 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -3.716 -12.842 -15.250 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -1.195 -15.233 -15.020 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -2.810 -14.842 -15.621 1.00 0.00 H new ATOM 586 N VAL A 36 -0.145 -12.602 -7.760 1.00 0.00 N ATOM 587 CA VAL A 36 0.069 -13.208 -6.428 1.00 0.00 C ATOM 588 C VAL A 36 -1.166 -12.934 -5.563 1.00 0.00 C ATOM 589 O VAL A 36 -1.666 -11.812 -5.553 1.00 0.00 O ATOM 590 CB VAL A 36 1.342 -12.645 -5.734 1.00 0.00 C ATOM 591 CG1 VAL A 36 1.551 -13.240 -4.331 1.00 0.00 C ATOM 592 CG2 VAL A 36 2.621 -12.893 -6.549 1.00 0.00 C ATOM 0 H VAL A 36 -0.675 -11.733 -7.700 1.00 0.00 H new ATOM 0 HA VAL A 36 0.218 -14.281 -6.552 1.00 0.00 H new ATOM 0 HB VAL A 36 1.166 -11.572 -5.658 1.00 0.00 H new ATOM 0 HG11 VAL A 36 2.452 -12.817 -3.887 1.00 0.00 H new ATOM 0 HG12 VAL A 36 0.691 -13.004 -3.704 1.00 0.00 H new ATOM 0 HG13 VAL A 36 1.658 -14.322 -4.407 1.00 0.00 H new ATOM 0 HG21 VAL A 36 3.478 -12.479 -6.017 1.00 0.00 H new ATOM 0 HG22 VAL A 36 2.763 -13.965 -6.687 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.531 -12.411 -7.523 1.00 0.00 H new ATOM 602 N GLU A 37 -1.633 -13.946 -4.823 1.00 0.00 N ATOM 603 CA GLU A 37 -2.912 -13.935 -4.087 1.00 0.00 C ATOM 604 C GLU A 37 -3.103 -12.765 -3.105 1.00 0.00 C ATOM 605 O GLU A 37 -4.217 -12.266 -2.937 1.00 0.00 O ATOM 606 CB GLU A 37 -3.085 -15.274 -3.348 1.00 0.00 C ATOM 607 CG GLU A 37 -2.014 -15.607 -2.297 1.00 0.00 C ATOM 608 CD GLU A 37 -2.241 -17.010 -1.717 1.00 0.00 C ATOM 609 OE1 GLU A 37 -1.706 -17.997 -2.277 1.00 0.00 O ATOM 610 OE2 GLU A 37 -2.949 -17.138 -0.689 1.00 0.00 O ATOM 0 H GLU A 37 -1.121 -14.821 -4.714 1.00 0.00 H new ATOM 0 HA GLU A 37 -3.683 -13.791 -4.844 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -4.059 -15.273 -2.858 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -3.102 -16.075 -4.087 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -1.024 -15.551 -2.749 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -2.041 -14.868 -1.496 1.00 0.00 H new ATOM 617 N ASN A 38 -2.015 -12.319 -2.469 1.00 0.00 N ATOM 618 CA ASN A 38 -1.999 -11.242 -1.469 1.00 0.00 C ATOM 619 C ASN A 38 -1.367 -9.931 -1.997 1.00 0.00 C ATOM 620 O ASN A 38 -1.273 -8.956 -1.255 1.00 0.00 O ATOM 621 CB ASN A 38 -1.292 -11.783 -0.212 1.00 0.00 C ATOM 622 CG ASN A 38 0.182 -12.104 -0.441 1.00 0.00 C ATOM 623 OD1 ASN A 38 1.044 -11.237 -0.377 1.00 0.00 O ATOM 624 ND2 ASN A 38 0.498 -13.349 -0.756 1.00 0.00 N ATOM 0 H ASN A 38 -1.089 -12.710 -2.641 1.00 0.00 H new ATOM 0 HA ASN A 38 -3.022 -10.958 -1.224 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -1.377 -11.048 0.589 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -1.805 -12.684 0.126 1.00 0.00 H new ATOM 0 HD21 ASN A 38 1.469 -13.596 -0.949 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -0.229 -14.063 -0.806 1.00 0.00 H new ATOM 631 N CYS A 39 -0.913 -9.912 -3.262 1.00 0.00 N ATOM 632 CA CYS A 39 -0.122 -8.831 -3.884 1.00 0.00 C ATOM 633 C CYS A 39 1.140 -8.490 -3.060 1.00 0.00 C ATOM 634 O CYS A 39 1.223 -7.452 -2.399 1.00 0.00 O ATOM 635 CB CYS A 39 -1.018 -7.612 -4.166 1.00 0.00 C ATOM 636 SG CYS A 39 -2.263 -8.045 -5.418 1.00 0.00 S ATOM 0 H CYS A 39 -1.094 -10.681 -3.908 1.00 0.00 H new ATOM 0 HA CYS A 39 0.253 -9.181 -4.846 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -1.508 -7.289 -3.248 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -0.412 -6.776 -4.515 1.00 0.00 H new ATOM 0 HG CYS A 39 -2.276 -7.137 -6.349 1.00 0.00 H new ATOM 642 N ALA A 40 2.123 -9.395 -3.080 1.00 0.00 N ATOM 643 CA ALA A 40 3.356 -9.284 -2.295 1.00 0.00 C ATOM 644 C ALA A 40 4.262 -8.139 -2.793 1.00 0.00 C ATOM 645 O ALA A 40 4.556 -8.073 -3.987 1.00 0.00 O ATOM 646 CB ALA A 40 4.084 -10.635 -2.340 1.00 0.00 C ATOM 0 H ALA A 40 2.084 -10.239 -3.651 1.00 0.00 H new ATOM 0 HA ALA A 40 3.100 -9.036 -1.265 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.005 -10.571 -1.761 1.00 0.00 H new ATOM 0 HB2 ALA A 40 3.442 -11.408 -1.918 1.00 0.00 H new ATOM 0 HB3 ALA A 40 4.322 -10.886 -3.374 1.00 0.00 H new ATOM 652 N VAL A 41 4.748 -7.276 -1.890 1.00 0.00 N ATOM 653 CA VAL A 41 5.757 -6.237 -2.201 1.00 0.00 C ATOM 654 C VAL A 41 7.066 -6.912 -2.610 1.00 0.00 C ATOM 655 O VAL A 41 7.626 -7.700 -1.846 1.00 0.00 O ATOM 656 CB VAL A 41 6.033 -5.248 -1.040 1.00 0.00 C ATOM 657 CG1 VAL A 41 6.998 -4.131 -1.451 1.00 0.00 C ATOM 658 CG2 VAL A 41 4.726 -4.604 -0.545 1.00 0.00 C ATOM 0 H VAL A 41 4.454 -7.274 -0.913 1.00 0.00 H new ATOM 0 HA VAL A 41 5.341 -5.643 -3.015 1.00 0.00 H new ATOM 0 HB VAL A 41 6.489 -5.833 -0.241 1.00 0.00 H new ATOM 0 HG11 VAL A 41 7.162 -3.462 -0.606 1.00 0.00 H new ATOM 0 HG12 VAL A 41 7.949 -4.566 -1.759 1.00 0.00 H new ATOM 0 HG13 VAL A 41 6.571 -3.568 -2.281 1.00 0.00 H new ATOM 0 HG21 VAL A 41 4.946 -3.914 0.270 1.00 0.00 H new ATOM 0 HG22 VAL A 41 4.255 -4.060 -1.364 1.00 0.00 H new ATOM 0 HG23 VAL A 41 4.049 -5.381 -0.190 1.00 0.00 H new ATOM 668 N ILE A 42 7.550 -6.580 -3.807 1.00 0.00 N ATOM 669 CA ILE A 42 8.815 -7.083 -4.374 1.00 0.00 C ATOM 670 C ILE A 42 9.931 -6.030 -4.337 1.00 0.00 C ATOM 671 O ILE A 42 11.108 -6.385 -4.405 1.00 0.00 O ATOM 672 CB ILE A 42 8.595 -7.615 -5.813 1.00 0.00 C ATOM 673 CG1 ILE A 42 7.967 -6.562 -6.759 1.00 0.00 C ATOM 674 CG2 ILE A 42 7.752 -8.902 -5.755 1.00 0.00 C ATOM 675 CD1 ILE A 42 7.945 -6.986 -8.232 1.00 0.00 C ATOM 0 H ILE A 42 7.064 -5.936 -4.431 1.00 0.00 H new ATOM 0 HA ILE A 42 9.145 -7.910 -3.745 1.00 0.00 H new ATOM 0 HB ILE A 42 9.572 -7.841 -6.241 1.00 0.00 H new ATOM 0 HG12 ILE A 42 6.947 -6.359 -6.434 1.00 0.00 H new ATOM 0 HG13 ILE A 42 8.523 -5.629 -6.668 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.595 -9.280 -6.765 1.00 0.00 H new ATOM 0 HG22 ILE A 42 8.275 -9.653 -5.164 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.788 -8.685 -5.295 1.00 0.00 H new ATOM 0 HD11 ILE A 42 7.491 -6.197 -8.831 1.00 0.00 H new ATOM 0 HD12 ILE A 42 8.965 -7.161 -8.576 1.00 0.00 H new ATOM 0 HD13 ILE A 42 7.364 -7.902 -8.338 1.00 0.00 H new ATOM 687 N TYR A 43 9.575 -4.749 -4.195 1.00 0.00 N ATOM 688 CA TYR A 43 10.511 -3.621 -4.172 1.00 0.00 C ATOM 689 C TYR A 43 9.884 -2.395 -3.494 1.00 0.00 C ATOM 690 O TYR A 43 8.716 -2.094 -3.723 1.00 0.00 O ATOM 691 CB TYR A 43 10.905 -3.272 -5.618 1.00 0.00 C ATOM 692 CG TYR A 43 12.294 -2.689 -5.775 1.00 0.00 C ATOM 693 CD1 TYR A 43 12.491 -1.297 -5.701 1.00 0.00 C ATOM 694 CD2 TYR A 43 13.389 -3.541 -6.018 1.00 0.00 C ATOM 695 CE1 TYR A 43 13.780 -0.756 -5.869 1.00 0.00 C ATOM 696 CE2 TYR A 43 14.679 -3.005 -6.199 1.00 0.00 C ATOM 697 CZ TYR A 43 14.878 -1.607 -6.126 1.00 0.00 C ATOM 698 OH TYR A 43 16.123 -1.078 -6.289 1.00 0.00 O ATOM 0 H TYR A 43 8.602 -4.461 -4.090 1.00 0.00 H new ATOM 0 HA TYR A 43 11.393 -3.907 -3.599 1.00 0.00 H new ATOM 0 HB2 TYR A 43 10.834 -4.173 -6.227 1.00 0.00 H new ATOM 0 HB3 TYR A 43 10.181 -2.561 -6.015 1.00 0.00 H new ATOM 0 HD1 TYR A 43 11.652 -0.643 -5.515 1.00 0.00 H new ATOM 0 HD2 TYR A 43 13.239 -4.609 -6.066 1.00 0.00 H new ATOM 0 HE1 TYR A 43 13.930 0.311 -5.801 1.00 0.00 H new ATOM 0 HE2 TYR A 43 15.515 -3.661 -6.393 1.00 0.00 H new ATOM 0 HH TYR A 43 16.765 -1.799 -6.457 1.00 0.00 H new ATOM 708 N CYS A 44 10.648 -1.643 -2.708 1.00 0.00 N ATOM 709 CA CYS A 44 10.213 -0.364 -2.121 1.00 0.00 C ATOM 710 C CYS A 44 11.142 0.808 -2.509 1.00 0.00 C ATOM 711 O CYS A 44 12.261 0.581 -2.974 1.00 0.00 O ATOM 712 CB CYS A 44 10.129 -0.511 -0.595 1.00 0.00 C ATOM 713 SG CYS A 44 9.439 -2.101 -0.048 1.00 0.00 S ATOM 0 H CYS A 44 11.601 -1.902 -2.453 1.00 0.00 H new ATOM 0 HA CYS A 44 9.229 -0.124 -2.523 1.00 0.00 H new ATOM 0 HB2 CYS A 44 11.127 -0.394 -0.173 1.00 0.00 H new ATOM 0 HB3 CYS A 44 9.517 0.297 -0.195 1.00 0.00 H new ATOM 0 HG CYS A 44 8.965 -1.977 1.156 1.00 0.00 H new ATOM 719 N ASN A 45 10.699 2.051 -2.271 1.00 0.00 N ATOM 720 CA ASN A 45 11.571 3.241 -2.383 1.00 0.00 C ATOM 721 C ASN A 45 12.554 3.347 -1.180 1.00 0.00 C ATOM 722 O ASN A 45 12.881 2.339 -0.555 1.00 0.00 O ATOM 723 CB ASN A 45 10.693 4.505 -2.573 1.00 0.00 C ATOM 724 CG ASN A 45 11.455 5.690 -3.184 1.00 0.00 C ATOM 725 OD1 ASN A 45 12.580 5.563 -3.651 1.00 0.00 O ATOM 726 ND2 ASN A 45 10.912 6.892 -3.142 1.00 0.00 N ATOM 0 H ASN A 45 9.739 2.264 -1.999 1.00 0.00 H new ATOM 0 HA ASN A 45 12.207 3.145 -3.263 1.00 0.00 H new ATOM 0 HB2 ASN A 45 9.847 4.258 -3.214 1.00 0.00 H new ATOM 0 HB3 ASN A 45 10.285 4.804 -1.607 1.00 0.00 H new ATOM 0 HD21 ASN A 45 11.428 7.698 -3.495 1.00 0.00 H new ATOM 0 HD22 ASN A 45 9.976 7.016 -2.756 1.00 0.00 H new ATOM 733 N ASP A 46 12.987 4.556 -0.795 1.00 0.00 N ATOM 734 CA ASP A 46 13.627 4.855 0.502 1.00 0.00 C ATOM 735 C ASP A 46 12.775 5.776 1.403 1.00 0.00 C ATOM 736 O ASP A 46 12.918 5.745 2.624 1.00 0.00 O ATOM 737 CB ASP A 46 14.998 5.497 0.247 1.00 0.00 C ATOM 738 CG ASP A 46 15.996 4.513 -0.387 1.00 0.00 C ATOM 739 OD1 ASP A 46 16.552 3.664 0.350 1.00 0.00 O ATOM 740 OD2 ASP A 46 16.244 4.609 -1.614 1.00 0.00 O ATOM 0 H ASP A 46 12.901 5.379 -1.392 1.00 0.00 H new ATOM 0 HA ASP A 46 13.734 3.912 1.038 1.00 0.00 H new ATOM 0 HB2 ASP A 46 14.876 6.360 -0.408 1.00 0.00 H new ATOM 0 HB3 ASP A 46 15.404 5.866 1.189 1.00 0.00 H new ATOM 745 N GLY A 47 11.849 6.559 0.828 1.00 0.00 N ATOM 746 CA GLY A 47 11.009 7.515 1.564 1.00 0.00 C ATOM 747 C GLY A 47 9.907 6.837 2.371 1.00 0.00 C ATOM 748 O GLY A 47 9.579 7.280 3.467 1.00 0.00 O ATOM 0 H GLY A 47 11.661 6.545 -0.174 1.00 0.00 H new ATOM 0 HA2 GLY A 47 11.637 8.100 2.236 1.00 0.00 H new ATOM 0 HA3 GLY A 47 10.559 8.214 0.859 1.00 0.00 H new ATOM 752 N PHE A 48 9.371 5.723 1.851 1.00 0.00 N ATOM 753 CA PHE A 48 8.353 4.896 2.515 1.00 0.00 C ATOM 754 C PHE A 48 8.838 4.395 3.899 1.00 0.00 C ATOM 755 O PHE A 48 8.080 4.387 4.866 1.00 0.00 O ATOM 756 CB PHE A 48 7.956 3.739 1.559 1.00 0.00 C ATOM 757 CG PHE A 48 8.853 2.510 1.648 1.00 0.00 C ATOM 758 CD1 PHE A 48 10.234 2.604 1.384 1.00 0.00 C ATOM 759 CD2 PHE A 48 8.336 1.319 2.184 1.00 0.00 C ATOM 760 CE1 PHE A 48 11.103 1.592 1.834 1.00 0.00 C ATOM 761 CE2 PHE A 48 9.204 0.294 2.595 1.00 0.00 C ATOM 762 CZ PHE A 48 10.590 0.453 2.470 1.00 0.00 C ATOM 0 H PHE A 48 9.640 5.364 0.935 1.00 0.00 H new ATOM 0 HA PHE A 48 7.466 5.495 2.721 1.00 0.00 H new ATOM 0 HB2 PHE A 48 6.930 3.441 1.776 1.00 0.00 H new ATOM 0 HB3 PHE A 48 7.970 4.110 0.534 1.00 0.00 H new ATOM 0 HD1 PHE A 48 10.625 3.450 0.838 1.00 0.00 H new ATOM 0 HD2 PHE A 48 7.268 1.191 2.280 1.00 0.00 H new ATOM 0 HE1 PHE A 48 12.168 1.693 1.689 1.00 0.00 H new ATOM 0 HE2 PHE A 48 8.802 -0.619 3.008 1.00 0.00 H new ATOM 0 HZ PHE A 48 11.260 -0.298 2.862 1.00 0.00 H new ATOM 772 N CYS A 49 10.130 4.048 4.007 1.00 0.00 N ATOM 773 CA CYS A 49 10.800 3.644 5.249 1.00 0.00 C ATOM 774 C CYS A 49 10.763 4.762 6.301 1.00 0.00 C ATOM 775 O CYS A 49 10.276 4.537 7.407 1.00 0.00 O ATOM 776 CB CYS A 49 12.226 3.182 4.888 1.00 0.00 C ATOM 777 SG CYS A 49 13.272 2.991 6.362 1.00 0.00 S ATOM 0 H CYS A 49 10.757 4.041 3.203 1.00 0.00 H new ATOM 0 HA CYS A 49 10.274 2.811 5.717 1.00 0.00 H new ATOM 0 HB2 CYS A 49 12.176 2.233 4.354 1.00 0.00 H new ATOM 0 HB3 CYS A 49 12.681 3.905 4.211 1.00 0.00 H new ATOM 0 HG CYS A 49 12.718 2.147 7.181 1.00 0.00 H new ATOM 783 N GLU A 50 11.208 5.971 5.950 1.00 0.00 N ATOM 784 CA GLU A 50 11.256 7.108 6.881 1.00 0.00 C ATOM 785 C GLU A 50 9.862 7.662 7.235 1.00 0.00 C ATOM 786 O GLU A 50 9.678 8.218 8.321 1.00 0.00 O ATOM 787 CB GLU A 50 12.152 8.217 6.313 1.00 0.00 C ATOM 788 CG GLU A 50 13.603 7.740 6.201 1.00 0.00 C ATOM 789 CD GLU A 50 14.543 8.905 5.860 1.00 0.00 C ATOM 790 OE1 GLU A 50 14.674 9.259 4.664 1.00 0.00 O ATOM 791 OE2 GLU A 50 15.162 9.480 6.787 1.00 0.00 O ATOM 0 H GLU A 50 11.546 6.192 5.013 1.00 0.00 H new ATOM 0 HA GLU A 50 11.682 6.736 7.813 1.00 0.00 H new ATOM 0 HB2 GLU A 50 11.787 8.519 5.331 1.00 0.00 H new ATOM 0 HB3 GLU A 50 12.102 9.096 6.956 1.00 0.00 H new ATOM 0 HG2 GLU A 50 13.912 7.282 7.141 1.00 0.00 H new ATOM 0 HG3 GLU A 50 13.678 6.971 5.432 1.00 0.00 H new ATOM 798 N LEU A 51 8.870 7.469 6.356 1.00 0.00 N ATOM 799 CA LEU A 51 7.455 7.749 6.622 1.00 0.00 C ATOM 800 C LEU A 51 6.912 6.885 7.775 1.00 0.00 C ATOM 801 O LEU A 51 6.196 7.398 8.636 1.00 0.00 O ATOM 802 CB LEU A 51 6.681 7.508 5.308 1.00 0.00 C ATOM 803 CG LEU A 51 5.154 7.694 5.374 1.00 0.00 C ATOM 804 CD1 LEU A 51 4.782 9.174 5.494 1.00 0.00 C ATOM 805 CD2 LEU A 51 4.483 7.062 4.149 1.00 0.00 C ATOM 0 H LEU A 51 9.034 7.105 5.418 1.00 0.00 H new ATOM 0 HA LEU A 51 7.329 8.782 6.945 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.076 8.184 4.549 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.888 6.493 4.970 1.00 0.00 H new ATOM 0 HG LEU A 51 4.790 7.186 6.267 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.698 9.274 5.539 1.00 0.00 H new ATOM 0 HD12 LEU A 51 5.222 9.587 6.401 1.00 0.00 H new ATOM 0 HD13 LEU A 51 5.161 9.716 4.628 1.00 0.00 H new ATOM 0 HD21 LEU A 51 3.404 7.203 4.212 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.859 7.537 3.243 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.709 5.996 4.120 1.00 0.00 H new ATOM 817 N CYS A 52 7.220 5.580 7.777 1.00 0.00 N ATOM 818 CA CYS A 52 6.554 4.596 8.644 1.00 0.00 C ATOM 819 C CYS A 52 7.383 4.121 9.854 1.00 0.00 C ATOM 820 O CYS A 52 6.808 3.807 10.900 1.00 0.00 O ATOM 821 CB CYS A 52 6.125 3.414 7.766 1.00 0.00 C ATOM 822 SG CYS A 52 5.042 3.999 6.426 1.00 0.00 S ATOM 0 H CYS A 52 7.939 5.176 7.177 1.00 0.00 H new ATOM 0 HA CYS A 52 5.696 5.091 9.099 1.00 0.00 H new ATOM 0 HB2 CYS A 52 7.004 2.923 7.347 1.00 0.00 H new ATOM 0 HB3 CYS A 52 5.603 2.672 8.370 1.00 0.00 H new ATOM 0 HG CYS A 52 5.766 4.343 5.402 1.00 0.00 H new ATOM 828 N GLY A 53 8.711 4.048 9.713 1.00 0.00 N ATOM 829 CA GLY A 53 9.666 3.602 10.738 1.00 0.00 C ATOM 830 C GLY A 53 10.034 2.114 10.662 1.00 0.00 C ATOM 831 O GLY A 53 10.765 1.627 11.524 1.00 0.00 O ATOM 0 H GLY A 53 9.172 4.310 8.842 1.00 0.00 H new ATOM 0 HA2 GLY A 53 10.577 4.193 10.649 1.00 0.00 H new ATOM 0 HA3 GLY A 53 9.246 3.809 11.722 1.00 0.00 H new ATOM 835 N TYR A 54 9.546 1.390 9.645 1.00 0.00 N ATOM 836 CA TYR A 54 9.955 0.015 9.321 1.00 0.00 C ATOM 837 C TYR A 54 11.246 -0.025 8.457 1.00 0.00 C ATOM 838 O TYR A 54 12.009 0.939 8.434 1.00 0.00 O ATOM 839 CB TYR A 54 8.742 -0.715 8.709 1.00 0.00 C ATOM 840 CG TYR A 54 7.973 -0.049 7.574 1.00 0.00 C ATOM 841 CD1 TYR A 54 8.626 0.653 6.544 1.00 0.00 C ATOM 842 CD2 TYR A 54 6.568 -0.169 7.540 1.00 0.00 C ATOM 843 CE1 TYR A 54 7.884 1.221 5.494 1.00 0.00 C ATOM 844 CE2 TYR A 54 5.823 0.377 6.474 1.00 0.00 C ATOM 845 CZ TYR A 54 6.483 1.066 5.435 1.00 0.00 C ATOM 846 OH TYR A 54 5.778 1.575 4.387 1.00 0.00 O ATOM 0 H TYR A 54 8.837 1.754 9.008 1.00 0.00 H new ATOM 0 HA TYR A 54 10.243 -0.523 10.224 1.00 0.00 H new ATOM 0 HB2 TYR A 54 9.089 -1.683 8.348 1.00 0.00 H new ATOM 0 HB3 TYR A 54 8.035 -0.910 9.515 1.00 0.00 H new ATOM 0 HD1 TYR A 54 9.701 0.756 6.560 1.00 0.00 H new ATOM 0 HD2 TYR A 54 6.057 -0.685 8.339 1.00 0.00 H new ATOM 0 HE1 TYR A 54 8.392 1.782 4.724 1.00 0.00 H new ATOM 0 HE2 TYR A 54 4.749 0.268 6.453 1.00 0.00 H new ATOM 0 HH TYR A 54 5.343 2.410 4.660 1.00 0.00 H new ATOM 856 N SER A 55 11.487 -1.095 7.690 1.00 0.00 N ATOM 857 CA SER A 55 12.560 -1.170 6.679 1.00 0.00 C ATOM 858 C SER A 55 12.190 -2.143 5.550 1.00 0.00 C ATOM 859 O SER A 55 11.230 -2.916 5.670 1.00 0.00 O ATOM 860 CB SER A 55 13.890 -1.570 7.335 1.00 0.00 C ATOM 861 OG SER A 55 14.979 -1.365 6.443 1.00 0.00 O ATOM 0 H SER A 55 10.935 -1.950 7.752 1.00 0.00 H new ATOM 0 HA SER A 55 12.680 -0.181 6.237 1.00 0.00 H new ATOM 0 HB2 SER A 55 14.043 -0.985 8.242 1.00 0.00 H new ATOM 0 HB3 SER A 55 13.852 -2.618 7.634 1.00 0.00 H new ATOM 0 HG SER A 55 15.815 -1.625 6.883 1.00 0.00 H new ATOM 867 N ARG A 56 12.956 -2.143 4.452 1.00 0.00 N ATOM 868 CA ARG A 56 12.642 -2.915 3.247 1.00 0.00 C ATOM 869 C ARG A 56 12.537 -4.404 3.541 1.00 0.00 C ATOM 870 O ARG A 56 11.536 -5.013 3.201 1.00 0.00 O ATOM 871 CB ARG A 56 13.668 -2.628 2.132 1.00 0.00 C ATOM 872 CG ARG A 56 12.889 -2.238 0.884 1.00 0.00 C ATOM 873 CD ARG A 56 13.768 -1.977 -0.340 1.00 0.00 C ATOM 874 NE ARG A 56 14.022 -3.240 -1.046 1.00 0.00 N ATOM 875 CZ ARG A 56 14.689 -3.385 -2.187 1.00 0.00 C ATOM 876 NH1 ARG A 56 15.217 -2.355 -2.815 1.00 0.00 N ATOM 877 NH2 ARG A 56 14.831 -4.579 -2.718 1.00 0.00 N ATOM 0 H ARG A 56 13.818 -1.602 4.376 1.00 0.00 H new ATOM 0 HA ARG A 56 11.662 -2.594 2.893 1.00 0.00 H new ATOM 0 HB2 ARG A 56 14.343 -1.825 2.429 1.00 0.00 H new ATOM 0 HB3 ARG A 56 14.283 -3.507 1.941 1.00 0.00 H new ATOM 0 HG2 ARG A 56 12.180 -3.032 0.647 1.00 0.00 H new ATOM 0 HG3 ARG A 56 12.305 -1.343 1.097 1.00 0.00 H new ATOM 0 HD2 ARG A 56 13.277 -1.268 -1.007 1.00 0.00 H new ATOM 0 HD3 ARG A 56 14.711 -1.525 -0.033 1.00 0.00 H new ATOM 0 HE ARG A 56 13.650 -4.089 -0.619 1.00 0.00 H new ATOM 0 HH11 ARG A 56 15.119 -1.417 -2.427 1.00 0.00 H new ATOM 0 HH12 ARG A 56 15.724 -2.496 -3.689 1.00 0.00 H new ATOM 0 HH21 ARG A 56 14.429 -5.394 -2.255 1.00 0.00 H new ATOM 0 HH22 ARG A 56 15.343 -4.690 -3.593 1.00 0.00 H new ATOM 891 N ALA A 57 13.481 -4.954 4.298 1.00 0.00 N ATOM 892 CA ALA A 57 13.469 -6.351 4.753 1.00 0.00 C ATOM 893 C ALA A 57 12.189 -6.757 5.522 1.00 0.00 C ATOM 894 O ALA A 57 11.824 -7.933 5.518 1.00 0.00 O ATOM 895 CB ALA A 57 14.712 -6.546 5.629 1.00 0.00 C ATOM 0 H ALA A 57 14.296 -4.434 4.623 1.00 0.00 H new ATOM 0 HA ALA A 57 13.479 -6.999 3.877 1.00 0.00 H new ATOM 0 HB1 ALA A 57 14.745 -7.574 5.991 1.00 0.00 H new ATOM 0 HB2 ALA A 57 15.607 -6.339 5.042 1.00 0.00 H new ATOM 0 HB3 ALA A 57 14.669 -5.864 6.478 1.00 0.00 H new ATOM 901 N GLU A 58 11.499 -5.797 6.154 1.00 0.00 N ATOM 902 CA GLU A 58 10.265 -6.018 6.916 1.00 0.00 C ATOM 903 C GLU A 58 9.021 -5.914 6.022 1.00 0.00 C ATOM 904 O GLU A 58 8.079 -6.686 6.204 1.00 0.00 O ATOM 905 CB GLU A 58 10.144 -4.980 8.045 1.00 0.00 C ATOM 906 CG GLU A 58 11.439 -4.754 8.832 1.00 0.00 C ATOM 907 CD GLU A 58 11.941 -6.030 9.529 1.00 0.00 C ATOM 908 OE1 GLU A 58 11.227 -6.566 10.410 1.00 0.00 O ATOM 909 OE2 GLU A 58 13.062 -6.493 9.217 1.00 0.00 O ATOM 0 H GLU A 58 11.793 -4.820 6.148 1.00 0.00 H new ATOM 0 HA GLU A 58 10.319 -7.025 7.331 1.00 0.00 H new ATOM 0 HB2 GLU A 58 9.822 -4.031 7.617 1.00 0.00 H new ATOM 0 HB3 GLU A 58 9.364 -5.300 8.735 1.00 0.00 H new ATOM 0 HG2 GLU A 58 12.211 -4.387 8.156 1.00 0.00 H new ATOM 0 HG3 GLU A 58 11.274 -3.978 9.579 1.00 0.00 H new ATOM 916 N VAL A 59 9.018 -4.961 5.078 1.00 0.00 N ATOM 917 CA VAL A 59 7.896 -4.683 4.155 1.00 0.00 C ATOM 918 C VAL A 59 7.934 -5.575 2.901 1.00 0.00 C ATOM 919 O VAL A 59 6.894 -5.850 2.306 1.00 0.00 O ATOM 920 CB VAL A 59 7.862 -3.180 3.783 1.00 0.00 C ATOM 921 CG1 VAL A 59 6.756 -2.818 2.773 1.00 0.00 C ATOM 922 CG2 VAL A 59 7.634 -2.359 5.060 1.00 0.00 C ATOM 0 H VAL A 59 9.815 -4.343 4.928 1.00 0.00 H new ATOM 0 HA VAL A 59 6.972 -4.930 4.678 1.00 0.00 H new ATOM 0 HB VAL A 59 8.818 -2.953 3.311 1.00 0.00 H new ATOM 0 HG11 VAL A 59 6.793 -1.750 2.560 1.00 0.00 H new ATOM 0 HG12 VAL A 59 6.909 -3.377 1.850 1.00 0.00 H new ATOM 0 HG13 VAL A 59 5.783 -3.070 3.193 1.00 0.00 H new ATOM 0 HG21 VAL A 59 7.608 -1.298 4.811 1.00 0.00 H new ATOM 0 HG22 VAL A 59 6.686 -2.648 5.514 1.00 0.00 H new ATOM 0 HG23 VAL A 59 8.446 -2.547 5.763 1.00 0.00 H new ATOM 932 N MET A 60 9.105 -6.086 2.511 1.00 0.00 N ATOM 933 CA MET A 60 9.236 -7.092 1.443 1.00 0.00 C ATOM 934 C MET A 60 8.527 -8.400 1.834 1.00 0.00 C ATOM 935 O MET A 60 8.579 -8.820 2.990 1.00 0.00 O ATOM 936 CB MET A 60 10.717 -7.346 1.120 1.00 0.00 C ATOM 937 CG MET A 60 11.321 -6.183 0.319 1.00 0.00 C ATOM 938 SD MET A 60 13.130 -6.209 0.193 1.00 0.00 S ATOM 939 CE MET A 60 13.356 -7.707 -0.801 1.00 0.00 C ATOM 0 H MET A 60 9.996 -5.815 2.927 1.00 0.00 H new ATOM 0 HA MET A 60 8.753 -6.704 0.546 1.00 0.00 H new ATOM 0 HB2 MET A 60 11.275 -7.481 2.046 1.00 0.00 H new ATOM 0 HB3 MET A 60 10.814 -8.271 0.552 1.00 0.00 H new ATOM 0 HG2 MET A 60 10.900 -6.195 -0.686 1.00 0.00 H new ATOM 0 HG3 MET A 60 11.016 -5.244 0.781 1.00 0.00 H new ATOM 0 HE1 MET A 60 14.415 -7.843 -1.018 1.00 0.00 H new ATOM 0 HE2 MET A 60 12.985 -8.570 -0.248 1.00 0.00 H new ATOM 0 HE3 MET A 60 12.804 -7.610 -1.736 1.00 0.00 H new ATOM 949 N GLN A 61 7.833 -9.015 0.865 1.00 0.00 N ATOM 950 CA GLN A 61 7.033 -10.253 0.997 1.00 0.00 C ATOM 951 C GLN A 61 5.678 -10.046 1.708 1.00 0.00 C ATOM 952 O GLN A 61 4.842 -10.948 1.740 1.00 0.00 O ATOM 953 CB GLN A 61 7.904 -11.395 1.582 1.00 0.00 C ATOM 954 CG GLN A 61 7.448 -12.832 1.253 1.00 0.00 C ATOM 955 CD GLN A 61 6.407 -13.418 2.217 1.00 0.00 C ATOM 956 OE1 GLN A 61 6.476 -13.276 3.435 1.00 0.00 O ATOM 957 NE2 GLN A 61 5.418 -14.135 1.718 1.00 0.00 N ATOM 0 H GLN A 61 7.810 -8.646 -0.086 1.00 0.00 H new ATOM 0 HA GLN A 61 6.733 -10.566 -0.003 1.00 0.00 H new ATOM 0 HB2 GLN A 61 8.925 -11.268 1.221 1.00 0.00 H new ATOM 0 HB3 GLN A 61 7.933 -11.284 2.666 1.00 0.00 H new ATOM 0 HG2 GLN A 61 7.035 -12.844 0.244 1.00 0.00 H new ATOM 0 HG3 GLN A 61 8.323 -13.482 1.247 1.00 0.00 H new ATOM 0 HE21 GLN A 61 5.341 -14.266 0.709 1.00 0.00 H new ATOM 0 HE22 GLN A 61 4.730 -14.558 2.341 1.00 0.00 H new ATOM 966 N ARG A 62 5.410 -8.831 2.193 1.00 0.00 N ATOM 967 CA ARG A 62 4.119 -8.428 2.776 1.00 0.00 C ATOM 968 C ARG A 62 3.094 -8.112 1.681 1.00 0.00 C ATOM 969 O ARG A 62 3.507 -7.719 0.583 1.00 0.00 O ATOM 970 CB ARG A 62 4.262 -7.172 3.657 1.00 0.00 C ATOM 971 CG ARG A 62 5.233 -7.316 4.827 1.00 0.00 C ATOM 972 CD ARG A 62 4.819 -8.341 5.884 1.00 0.00 C ATOM 973 NE ARG A 62 5.925 -8.522 6.836 1.00 0.00 N ATOM 974 CZ ARG A 62 5.990 -9.375 7.848 1.00 0.00 C ATOM 975 NH1 ARG A 62 5.001 -10.193 8.144 1.00 0.00 N ATOM 976 NH2 ARG A 62 7.079 -9.413 8.587 1.00 0.00 N ATOM 0 H ARG A 62 6.099 -8.079 2.193 1.00 0.00 H new ATOM 0 HA ARG A 62 3.781 -9.269 3.382 1.00 0.00 H new ATOM 0 HB2 ARG A 62 4.590 -6.342 3.031 1.00 0.00 H new ATOM 0 HB3 ARG A 62 3.280 -6.907 4.049 1.00 0.00 H new ATOM 0 HG2 ARG A 62 6.212 -7.594 4.436 1.00 0.00 H new ATOM 0 HG3 ARG A 62 5.346 -6.345 5.308 1.00 0.00 H new ATOM 0 HD2 ARG A 62 3.924 -8.002 6.407 1.00 0.00 H new ATOM 0 HD3 ARG A 62 4.571 -9.291 5.410 1.00 0.00 H new ATOM 0 HE ARG A 62 6.738 -7.920 6.702 1.00 0.00 H new ATOM 0 HH11 ARG A 62 4.147 -10.184 7.586 1.00 0.00 H new ATOM 0 HH12 ARG A 62 5.089 -10.836 8.931 1.00 0.00 H new ATOM 0 HH21 ARG A 62 7.859 -8.791 8.378 1.00 0.00 H new ATOM 0 HH22 ARG A 62 7.142 -10.065 9.369 1.00 0.00 H new ATOM 990 N PRO A 63 1.785 -8.181 1.985 1.00 0.00 N ATOM 991 CA PRO A 63 0.753 -7.638 1.115 1.00 0.00 C ATOM 992 C PRO A 63 0.857 -6.110 1.069 1.00 0.00 C ATOM 993 O PRO A 63 1.015 -5.459 2.103 1.00 0.00 O ATOM 994 CB PRO A 63 -0.571 -8.109 1.717 1.00 0.00 C ATOM 995 CG PRO A 63 -0.272 -8.317 3.198 1.00 0.00 C ATOM 996 CD PRO A 63 1.207 -8.694 3.225 1.00 0.00 C ATOM 0 HA PRO A 63 0.848 -7.977 0.083 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -1.357 -7.368 1.572 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -0.913 -9.032 1.249 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -0.464 -7.413 3.775 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -0.893 -9.105 3.624 1.00 0.00 H new ATOM 0 HD2 PRO A 63 1.703 -8.260 4.093 1.00 0.00 H new ATOM 0 HD3 PRO A 63 1.331 -9.775 3.294 1.00 0.00 H new ATOM 1004 N CYS A 64 0.741 -5.528 -0.128 1.00 0.00 N ATOM 1005 CA CYS A 64 0.836 -4.076 -0.345 1.00 0.00 C ATOM 1006 C CYS A 64 -0.328 -3.255 0.252 1.00 0.00 C ATOM 1007 O CYS A 64 -0.315 -2.022 0.183 1.00 0.00 O ATOM 1008 CB CYS A 64 1.001 -3.836 -1.850 1.00 0.00 C ATOM 1009 SG CYS A 64 -0.511 -4.317 -2.734 1.00 0.00 S ATOM 0 H CYS A 64 0.577 -6.055 -0.985 1.00 0.00 H new ATOM 0 HA CYS A 64 1.705 -3.711 0.202 1.00 0.00 H new ATOM 0 HB2 CYS A 64 1.220 -2.785 -2.036 1.00 0.00 H new ATOM 0 HB3 CYS A 64 1.848 -4.409 -2.226 1.00 0.00 H new ATOM 0 HG CYS A 64 -0.355 -4.105 -4.007 1.00 0.00 H new ATOM 1015 N THR A 65 -1.315 -3.932 0.857 1.00 0.00 N ATOM 1016 CA THR A 65 -2.382 -3.339 1.675 1.00 0.00 C ATOM 1017 C THR A 65 -1.842 -2.698 2.954 1.00 0.00 C ATOM 1018 O THR A 65 -2.442 -1.736 3.434 1.00 0.00 O ATOM 1019 CB THR A 65 -3.421 -4.398 2.052 1.00 0.00 C ATOM 1020 OG1 THR A 65 -2.755 -5.455 2.712 1.00 0.00 O ATOM 1021 CG2 THR A 65 -4.138 -4.971 0.828 1.00 0.00 C ATOM 0 H THR A 65 -1.395 -4.946 0.787 1.00 0.00 H new ATOM 0 HA THR A 65 -2.844 -2.560 1.069 1.00 0.00 H new ATOM 0 HB THR A 65 -4.169 -3.925 2.688 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.405 -6.144 2.964 1.00 0.00 H new ATOM 0 HG21 THR A 65 -4.865 -5.718 1.148 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.652 -4.169 0.298 1.00 0.00 H new ATOM 0 HG23 THR A 65 -3.409 -5.436 0.164 1.00 0.00 H new ATOM 1029 N CYS A 66 -0.726 -3.219 3.487 1.00 0.00 N ATOM 1030 CA CYS A 66 -0.049 -2.733 4.696 1.00 0.00 C ATOM 1031 C CYS A 66 -0.969 -2.751 5.937 1.00 0.00 C ATOM 1032 O CYS A 66 -0.963 -1.823 6.747 1.00 0.00 O ATOM 1033 CB CYS A 66 0.623 -1.374 4.418 1.00 0.00 C ATOM 1034 SG CYS A 66 1.917 -1.565 3.155 1.00 0.00 S ATOM 0 H CYS A 66 -0.253 -4.021 3.070 1.00 0.00 H new ATOM 0 HA CYS A 66 0.750 -3.427 4.954 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -0.122 -0.653 4.081 1.00 0.00 H new ATOM 0 HB3 CYS A 66 1.056 -0.979 5.337 1.00 0.00 H new ATOM 0 HG CYS A 66 2.475 -0.413 2.928 1.00 0.00 H new ATOM 1040 N ASP A 67 -1.744 -3.832 6.105 1.00 0.00 N ATOM 1041 CA ASP A 67 -2.729 -4.001 7.185 1.00 0.00 C ATOM 1042 C ASP A 67 -2.113 -3.885 8.592 1.00 0.00 C ATOM 1043 O ASP A 67 -2.774 -3.445 9.534 1.00 0.00 O ATOM 1044 CB ASP A 67 -3.436 -5.352 6.999 1.00 0.00 C ATOM 1045 CG ASP A 67 -4.459 -5.654 8.110 1.00 0.00 C ATOM 1046 OD1 ASP A 67 -5.577 -5.086 8.079 1.00 0.00 O ATOM 1047 OD2 ASP A 67 -4.150 -6.490 8.994 1.00 0.00 O ATOM 0 H ASP A 67 -1.703 -4.635 5.477 1.00 0.00 H new ATOM 0 HA ASP A 67 -3.449 -3.186 7.116 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -3.943 -5.361 6.034 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -2.690 -6.146 6.974 1.00 0.00 H new ATOM 1052 N PHE A 68 -0.821 -4.205 8.718 1.00 0.00 N ATOM 1053 CA PHE A 68 -0.042 -4.038 9.942 1.00 0.00 C ATOM 1054 C PHE A 68 0.072 -2.570 10.418 1.00 0.00 C ATOM 1055 O PHE A 68 0.403 -2.341 11.583 1.00 0.00 O ATOM 1056 CB PHE A 68 1.334 -4.696 9.741 1.00 0.00 C ATOM 1057 CG PHE A 68 2.105 -4.214 8.524 1.00 0.00 C ATOM 1058 CD1 PHE A 68 2.843 -3.017 8.585 1.00 0.00 C ATOM 1059 CD2 PHE A 68 2.073 -4.951 7.323 1.00 0.00 C ATOM 1060 CE1 PHE A 68 3.534 -2.557 7.451 1.00 0.00 C ATOM 1061 CE2 PHE A 68 2.769 -4.489 6.192 1.00 0.00 C ATOM 1062 CZ PHE A 68 3.497 -3.290 6.253 1.00 0.00 C ATOM 0 H PHE A 68 -0.277 -4.597 7.949 1.00 0.00 H new ATOM 0 HA PHE A 68 -0.575 -4.536 10.752 1.00 0.00 H new ATOM 0 HB2 PHE A 68 1.939 -4.517 10.630 1.00 0.00 H new ATOM 0 HB3 PHE A 68 1.196 -5.774 9.661 1.00 0.00 H new ATOM 0 HD1 PHE A 68 2.878 -2.451 9.504 1.00 0.00 H new ATOM 0 HD2 PHE A 68 1.513 -5.873 7.271 1.00 0.00 H new ATOM 0 HE1 PHE A 68 4.096 -1.636 7.501 1.00 0.00 H new ATOM 0 HE2 PHE A 68 2.744 -5.058 5.274 1.00 0.00 H new ATOM 0 HZ PHE A 68 4.027 -2.933 5.382 1.00 0.00 H new ATOM 1072 N LEU A 69 -0.228 -1.580 9.562 1.00 0.00 N ATOM 1073 CA LEU A 69 -0.317 -0.158 9.934 1.00 0.00 C ATOM 1074 C LEU A 69 -1.678 0.244 10.526 1.00 0.00 C ATOM 1075 O LEU A 69 -1.801 1.354 11.043 1.00 0.00 O ATOM 1076 CB LEU A 69 -0.034 0.729 8.708 1.00 0.00 C ATOM 1077 CG LEU A 69 1.347 0.571 8.045 1.00 0.00 C ATOM 1078 CD1 LEU A 69 1.428 1.583 6.896 1.00 0.00 C ATOM 1079 CD2 LEU A 69 2.503 0.816 9.028 1.00 0.00 C ATOM 0 H LEU A 69 -0.419 -1.748 8.574 1.00 0.00 H new ATOM 0 HA LEU A 69 0.433 -0.008 10.711 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.797 0.525 7.957 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -0.151 1.771 9.007 1.00 0.00 H new ATOM 0 HG LEU A 69 1.449 -0.454 7.689 1.00 0.00 H new ATOM 0 HD11 LEU A 69 2.397 1.498 6.403 1.00 0.00 H new ATOM 0 HD12 LEU A 69 0.635 1.380 6.176 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.310 2.592 7.291 1.00 0.00 H new ATOM 0 HD21 LEU A 69 3.454 0.692 8.510 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.435 1.829 9.424 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.441 0.101 9.848 1.00 0.00 H new ATOM 1091 N HIS A 70 -2.710 -0.599 10.450 1.00 0.00 N ATOM 1092 CA HIS A 70 -4.030 -0.286 10.981 1.00 0.00 C ATOM 1093 C HIS A 70 -4.024 -0.344 12.526 1.00 0.00 C ATOM 1094 O HIS A 70 -3.809 -1.404 13.127 1.00 0.00 O ATOM 1095 CB HIS A 70 -5.074 -1.235 10.364 1.00 0.00 C ATOM 1096 CG HIS A 70 -5.150 -1.253 8.848 1.00 0.00 C ATOM 1097 ND1 HIS A 70 -5.750 -2.229 8.085 1.00 0.00 N ATOM 1098 CD2 HIS A 70 -4.670 -0.314 7.967 1.00 0.00 C ATOM 1099 CE1 HIS A 70 -5.646 -1.881 6.791 1.00 0.00 C ATOM 1100 NE2 HIS A 70 -4.998 -0.713 6.666 1.00 0.00 N ATOM 0 H HIS A 70 -2.649 -1.520 10.016 1.00 0.00 H new ATOM 0 HA HIS A 70 -4.302 0.733 10.706 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -4.863 -2.247 10.709 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -6.056 -0.964 10.753 1.00 0.00 H new ATOM 0 HD1 HIS A 70 -6.198 -3.073 8.441 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -4.130 0.582 8.234 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -6.031 -2.462 5.966 1.00 0.00 H new ATOM 1108 N GLY A 71 -4.257 0.808 13.162 1.00 0.00 N ATOM 1109 CA GLY A 71 -4.353 0.991 14.616 1.00 0.00 C ATOM 1110 C GLY A 71 -5.810 1.101 15.100 1.00 0.00 C ATOM 1111 O GLY A 71 -6.729 0.744 14.356 1.00 0.00 O ATOM 0 H GLY A 71 -4.391 1.682 12.653 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -3.869 0.153 15.117 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -3.809 1.891 14.903 1.00 0.00 H new ATOM 1115 N PRO A 72 -6.047 1.617 16.324 1.00 0.00 N ATOM 1116 CA PRO A 72 -7.392 1.768 16.882 1.00 0.00 C ATOM 1117 C PRO A 72 -8.219 2.861 16.180 1.00 0.00 C ATOM 1118 O PRO A 72 -9.447 2.768 16.165 1.00 0.00 O ATOM 1119 CB PRO A 72 -7.178 2.082 18.368 1.00 0.00 C ATOM 1120 CG PRO A 72 -5.813 2.766 18.401 1.00 0.00 C ATOM 1121 CD PRO A 72 -5.044 2.048 17.292 1.00 0.00 C ATOM 0 HA PRO A 72 -7.976 0.859 16.734 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -7.961 2.733 18.757 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -7.187 1.176 18.974 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -5.893 3.836 18.210 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -5.327 2.651 19.370 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -4.315 2.713 16.829 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -4.492 1.196 17.688 1.00 0.00 H new ATOM 1129 N ARG A 73 -7.573 3.871 15.571 1.00 0.00 N ATOM 1130 CA ARG A 73 -8.249 4.961 14.851 1.00 0.00 C ATOM 1131 C ARG A 73 -8.633 4.587 13.403 1.00 0.00 C ATOM 1132 O ARG A 73 -9.453 5.283 12.796 1.00 0.00 O ATOM 1133 CB ARG A 73 -7.331 6.205 14.908 1.00 0.00 C ATOM 1134 CG ARG A 73 -7.885 7.528 14.361 1.00 0.00 C ATOM 1135 CD ARG A 73 -9.142 8.027 15.077 1.00 0.00 C ATOM 1136 NE ARG A 73 -10.364 7.355 14.596 1.00 0.00 N ATOM 1137 CZ ARG A 73 -11.565 7.384 15.163 1.00 0.00 C ATOM 1138 NH1 ARG A 73 -11.812 8.091 16.246 1.00 0.00 N ATOM 1139 NH2 ARG A 73 -12.548 6.686 14.637 1.00 0.00 N ATOM 0 H ARG A 73 -6.556 3.953 15.566 1.00 0.00 H new ATOM 0 HA ARG A 73 -9.201 5.173 15.338 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -7.048 6.365 15.948 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -6.417 5.973 14.361 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -7.111 8.292 14.436 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -8.109 7.404 13.301 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -9.037 7.861 16.149 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -9.239 9.103 14.929 1.00 0.00 H new ATOM 0 HE ARG A 73 -10.278 6.811 13.738 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -11.068 8.640 16.677 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -12.747 8.089 16.654 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -12.385 6.127 13.799 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -13.473 6.703 15.067 1.00 0.00 H new ATOM 1153 N THR A 74 -8.037 3.529 12.835 1.00 0.00 N ATOM 1154 CA THR A 74 -8.109 3.186 11.403 1.00 0.00 C ATOM 1155 C THR A 74 -9.524 2.798 10.967 1.00 0.00 C ATOM 1156 O THR A 74 -10.243 2.102 11.682 1.00 0.00 O ATOM 1157 CB THR A 74 -7.086 2.099 11.063 1.00 0.00 C ATOM 1158 OG1 THR A 74 -5.825 2.552 11.493 1.00 0.00 O ATOM 1159 CG2 THR A 74 -7.017 1.869 9.562 1.00 0.00 C ATOM 0 H THR A 74 -7.475 2.868 13.372 1.00 0.00 H new ATOM 0 HA THR A 74 -7.855 4.081 10.835 1.00 0.00 H new ATOM 0 HB THR A 74 -7.375 1.167 11.549 1.00 0.00 H new ATOM 0 HG1 THR A 74 -5.388 3.043 10.766 1.00 0.00 H new ATOM 0 HG21 THR A 74 -6.283 1.092 9.346 1.00 0.00 H new ATOM 0 HG22 THR A 74 -7.995 1.556 9.197 1.00 0.00 H new ATOM 0 HG23 THR A 74 -6.723 2.794 9.065 1.00 0.00 H new ATOM 1167 N GLN A 75 -9.917 3.272 9.783 1.00 0.00 N ATOM 1168 CA GLN A 75 -11.270 3.170 9.238 1.00 0.00 C ATOM 1169 C GLN A 75 -11.469 1.815 8.537 1.00 0.00 C ATOM 1170 O GLN A 75 -10.824 1.538 7.524 1.00 0.00 O ATOM 1171 CB GLN A 75 -11.519 4.329 8.246 1.00 0.00 C ATOM 1172 CG GLN A 75 -11.426 5.745 8.849 1.00 0.00 C ATOM 1173 CD GLN A 75 -10.008 6.261 9.120 1.00 0.00 C ATOM 1174 OE1 GLN A 75 -9.000 5.707 8.693 1.00 0.00 O ATOM 1175 NE2 GLN A 75 -9.872 7.337 9.862 1.00 0.00 N ATOM 0 H GLN A 75 -9.276 3.756 9.154 1.00 0.00 H new ATOM 0 HA GLN A 75 -11.987 3.239 10.056 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -10.798 4.250 7.433 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -12.509 4.203 7.807 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -11.923 6.441 8.173 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -11.983 5.758 9.786 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -10.697 7.813 10.227 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -8.941 7.697 10.073 1.00 0.00 H new ATOM 1184 N ARG A 76 -12.405 0.987 9.026 1.00 0.00 N ATOM 1185 CA ARG A 76 -12.669 -0.362 8.488 1.00 0.00 C ATOM 1186 C ARG A 76 -13.097 -0.357 7.010 1.00 0.00 C ATOM 1187 O ARG A 76 -12.705 -1.252 6.261 1.00 0.00 O ATOM 1188 CB ARG A 76 -13.732 -1.070 9.352 1.00 0.00 C ATOM 1189 CG ARG A 76 -13.228 -1.496 10.743 1.00 0.00 C ATOM 1190 CD ARG A 76 -12.200 -2.635 10.676 1.00 0.00 C ATOM 1191 NE ARG A 76 -11.864 -3.132 12.021 1.00 0.00 N ATOM 1192 CZ ARG A 76 -11.157 -4.223 12.304 1.00 0.00 C ATOM 1193 NH1 ARG A 76 -10.644 -4.990 11.363 1.00 0.00 N ATOM 1194 NH2 ARG A 76 -10.956 -4.561 13.559 1.00 0.00 N ATOM 0 H ARG A 76 -13.006 1.234 9.812 1.00 0.00 H new ATOM 0 HA ARG A 76 -11.727 -0.909 8.531 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -14.587 -0.405 9.475 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -14.088 -1.952 8.820 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -12.780 -0.637 11.242 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -14.076 -1.812 11.351 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -12.597 -3.451 10.073 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -11.296 -2.283 10.180 1.00 0.00 H new ATOM 0 HE ARG A 76 -12.206 -2.587 12.812 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -10.784 -4.754 10.380 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -10.107 -5.819 11.617 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -11.341 -3.988 14.310 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -10.415 -5.396 13.782 1.00 0.00 H new ATOM 1208 N ARG A 77 -13.830 0.675 6.562 1.00 0.00 N ATOM 1209 CA ARG A 77 -14.162 0.878 5.139 1.00 0.00 C ATOM 1210 C ARG A 77 -12.900 1.114 4.304 1.00 0.00 C ATOM 1211 O ARG A 77 -12.652 0.387 3.351 1.00 0.00 O ATOM 1212 CB ARG A 77 -15.171 2.034 4.966 1.00 0.00 C ATOM 1213 CG ARG A 77 -16.594 1.712 5.454 1.00 0.00 C ATOM 1214 CD ARG A 77 -17.282 0.613 4.629 1.00 0.00 C ATOM 1215 NE ARG A 77 -18.690 0.446 5.032 1.00 0.00 N ATOM 1216 CZ ARG A 77 -19.592 -0.334 4.442 1.00 0.00 C ATOM 1217 NH1 ARG A 77 -19.297 -1.081 3.396 1.00 0.00 N ATOM 1218 NH2 ARG A 77 -20.822 -0.373 4.905 1.00 0.00 N ATOM 0 H ARG A 77 -14.211 1.395 7.176 1.00 0.00 H new ATOM 0 HA ARG A 77 -14.634 -0.034 4.773 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -14.803 2.906 5.507 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -15.214 2.308 3.912 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -16.552 1.401 6.498 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -17.198 2.618 5.416 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -17.232 0.865 3.570 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -16.750 -0.329 4.758 1.00 0.00 H new ATOM 0 HE ARG A 77 -19.003 0.981 5.842 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -18.351 -1.073 3.014 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -20.014 -1.667 2.969 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -21.081 0.193 5.713 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -21.517 -0.969 4.456 1.00 0.00 H new ATOM 1232 N ALA A 78 -12.045 2.069 4.666 1.00 0.00 N ATOM 1233 CA ALA A 78 -10.838 2.373 3.888 1.00 0.00 C ATOM 1234 C ALA A 78 -9.815 1.221 3.885 1.00 0.00 C ATOM 1235 O ALA A 78 -9.233 0.921 2.842 1.00 0.00 O ATOM 1236 CB ALA A 78 -10.254 3.673 4.425 1.00 0.00 C ATOM 0 H ALA A 78 -12.164 2.650 5.496 1.00 0.00 H new ATOM 0 HA ALA A 78 -11.106 2.494 2.838 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.354 3.926 3.865 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -10.986 4.473 4.316 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -10.004 3.552 5.479 1.00 0.00 H new ATOM 1242 N ALA A 79 -9.673 0.510 5.011 1.00 0.00 N ATOM 1243 CA ALA A 79 -8.876 -0.718 5.107 1.00 0.00 C ATOM 1244 C ALA A 79 -9.300 -1.777 4.066 1.00 0.00 C ATOM 1245 O ALA A 79 -8.452 -2.470 3.501 1.00 0.00 O ATOM 1246 CB ALA A 79 -9.011 -1.250 6.539 1.00 0.00 C ATOM 0 H ALA A 79 -10.114 0.775 5.891 1.00 0.00 H new ATOM 0 HA ALA A 79 -7.833 -0.493 4.883 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -8.428 -2.165 6.644 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -8.642 -0.503 7.241 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -10.059 -1.461 6.752 1.00 0.00 H new ATOM 1252 N ALA A 80 -10.603 -1.852 3.767 1.00 0.00 N ATOM 1253 CA ALA A 80 -11.164 -2.689 2.707 1.00 0.00 C ATOM 1254 C ALA A 80 -10.948 -2.096 1.318 1.00 0.00 C ATOM 1255 O ALA A 80 -10.552 -2.824 0.414 1.00 0.00 O ATOM 1256 CB ALA A 80 -12.666 -2.844 2.953 1.00 0.00 C ATOM 0 H ALA A 80 -11.311 -1.318 4.270 1.00 0.00 H new ATOM 0 HA ALA A 80 -10.653 -3.651 2.735 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -13.101 -3.466 2.171 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -12.829 -3.314 3.923 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -13.140 -1.862 2.941 1.00 0.00 H new ATOM 1262 N GLN A 81 -11.198 -0.795 1.126 1.00 0.00 N ATOM 1263 CA GLN A 81 -11.087 -0.157 -0.191 1.00 0.00 C ATOM 1264 C GLN A 81 -9.669 -0.314 -0.766 1.00 0.00 C ATOM 1265 O GLN A 81 -9.543 -0.574 -1.958 1.00 0.00 O ATOM 1266 CB GLN A 81 -11.507 1.324 -0.138 1.00 0.00 C ATOM 1267 CG GLN A 81 -12.991 1.573 0.187 1.00 0.00 C ATOM 1268 CD GLN A 81 -13.395 3.054 0.159 1.00 0.00 C ATOM 1269 OE1 GLN A 81 -12.671 3.936 -0.288 1.00 0.00 O ATOM 1270 NE2 GLN A 81 -14.571 3.389 0.651 1.00 0.00 N ATOM 0 H GLN A 81 -11.481 -0.160 1.872 1.00 0.00 H new ATOM 0 HA GLN A 81 -11.777 -0.668 -0.862 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -10.898 1.831 0.610 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -11.280 1.784 -1.100 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -13.606 1.025 -0.527 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -13.210 1.166 1.174 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -15.189 2.671 1.028 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -14.863 4.366 0.655 1.00 0.00 H new ATOM 1279 N ILE A 82 -8.605 -0.253 0.053 1.00 0.00 N ATOM 1280 CA ILE A 82 -7.230 -0.544 -0.413 1.00 0.00 C ATOM 1281 C ILE A 82 -7.095 -1.986 -0.934 1.00 0.00 C ATOM 1282 O ILE A 82 -6.455 -2.199 -1.962 1.00 0.00 O ATOM 1283 CB ILE A 82 -6.204 -0.229 0.706 1.00 0.00 C ATOM 1284 CG1 ILE A 82 -6.193 1.290 0.975 1.00 0.00 C ATOM 1285 CG2 ILE A 82 -4.782 -0.684 0.325 1.00 0.00 C ATOM 1286 CD1 ILE A 82 -5.491 1.702 2.268 1.00 0.00 C ATOM 0 H ILE A 82 -8.666 -0.005 1.041 1.00 0.00 H new ATOM 0 HA ILE A 82 -7.013 0.107 -1.259 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.506 -0.776 1.599 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.707 1.790 0.138 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -7.222 1.648 1.006 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -4.094 -0.445 1.136 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -4.779 -1.760 0.152 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -4.466 -0.169 -0.582 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -5.532 2.786 2.375 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -5.989 1.235 3.117 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -4.450 1.380 2.236 1.00 0.00 H new ATOM 1298 N ALA A 83 -7.717 -2.968 -0.275 1.00 0.00 N ATOM 1299 CA ALA A 83 -7.716 -4.367 -0.716 1.00 0.00 C ATOM 1300 C ALA A 83 -8.601 -4.599 -1.958 1.00 0.00 C ATOM 1301 O ALA A 83 -8.229 -5.365 -2.846 1.00 0.00 O ATOM 1302 CB ALA A 83 -8.140 -5.248 0.467 1.00 0.00 C ATOM 0 H ALA A 83 -8.240 -2.814 0.587 1.00 0.00 H new ATOM 0 HA ALA A 83 -6.709 -4.639 -1.031 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -8.145 -6.293 0.159 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -7.437 -5.116 1.289 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -9.139 -4.961 0.794 1.00 0.00 H new ATOM 1308 N GLN A 84 -9.747 -3.914 -2.054 1.00 0.00 N ATOM 1309 CA GLN A 84 -10.632 -3.954 -3.226 1.00 0.00 C ATOM 1310 C GLN A 84 -9.978 -3.291 -4.447 1.00 0.00 C ATOM 1311 O GLN A 84 -10.169 -3.761 -5.564 1.00 0.00 O ATOM 1312 CB GLN A 84 -11.978 -3.271 -2.914 1.00 0.00 C ATOM 1313 CG GLN A 84 -12.839 -3.961 -1.838 1.00 0.00 C ATOM 1314 CD GLN A 84 -13.306 -5.362 -2.242 1.00 0.00 C ATOM 1315 OE1 GLN A 84 -14.252 -5.537 -2.999 1.00 0.00 O ATOM 1316 NE2 GLN A 84 -12.665 -6.410 -1.763 1.00 0.00 N ATOM 0 H GLN A 84 -10.091 -3.308 -1.309 1.00 0.00 H new ATOM 0 HA GLN A 84 -10.812 -5.002 -3.464 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -11.781 -2.247 -2.595 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -12.558 -3.212 -3.835 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -12.266 -4.029 -0.913 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -13.711 -3.341 -1.628 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -11.875 -6.280 -1.131 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -12.959 -7.351 -2.024 1.00 0.00 H new ATOM 1325 N ALA A 85 -9.156 -2.251 -4.264 1.00 0.00 N ATOM 1326 CA ALA A 85 -8.462 -1.570 -5.359 1.00 0.00 C ATOM 1327 C ALA A 85 -7.563 -2.515 -6.188 1.00 0.00 C ATOM 1328 O ALA A 85 -7.322 -2.266 -7.370 1.00 0.00 O ATOM 1329 CB ALA A 85 -7.642 -0.415 -4.783 1.00 0.00 C ATOM 0 H ALA A 85 -8.954 -1.857 -3.345 1.00 0.00 H new ATOM 0 HA ALA A 85 -9.217 -1.193 -6.049 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -7.121 0.099 -5.590 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -8.306 0.285 -4.276 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -6.914 -0.805 -4.072 1.00 0.00 H new ATOM 1335 N LEU A 86 -7.091 -3.608 -5.572 1.00 0.00 N ATOM 1336 CA LEU A 86 -6.221 -4.624 -6.176 1.00 0.00 C ATOM 1337 C LEU A 86 -6.973 -5.620 -7.079 1.00 0.00 C ATOM 1338 O LEU A 86 -6.332 -6.285 -7.895 1.00 0.00 O ATOM 1339 CB LEU A 86 -5.481 -5.386 -5.059 1.00 0.00 C ATOM 1340 CG LEU A 86 -4.701 -4.509 -4.055 1.00 0.00 C ATOM 1341 CD1 LEU A 86 -4.137 -5.382 -2.929 1.00 0.00 C ATOM 1342 CD2 LEU A 86 -3.571 -3.716 -4.724 1.00 0.00 C ATOM 0 H LEU A 86 -7.315 -3.816 -4.599 1.00 0.00 H new ATOM 0 HA LEU A 86 -5.517 -4.098 -6.821 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -6.208 -5.980 -4.506 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -4.784 -6.085 -5.521 1.00 0.00 H new ATOM 0 HG LEU A 86 -5.403 -3.783 -3.644 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.588 -4.757 -2.224 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -4.956 -5.881 -2.410 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -3.465 -6.130 -3.350 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -3.054 -3.116 -3.975 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -2.865 -4.407 -5.185 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -3.989 -3.061 -5.488 1.00 0.00 H new ATOM 1354 N LEU A 87 -8.307 -5.739 -6.965 1.00 0.00 N ATOM 1355 CA LEU A 87 -9.102 -6.567 -7.897 1.00 0.00 C ATOM 1356 C LEU A 87 -9.449 -5.810 -9.193 1.00 0.00 C ATOM 1357 O LEU A 87 -9.723 -6.437 -10.218 1.00 0.00 O ATOM 1358 CB LEU A 87 -10.314 -7.199 -7.173 1.00 0.00 C ATOM 1359 CG LEU A 87 -11.597 -6.345 -7.038 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -12.570 -6.530 -8.211 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -12.337 -6.721 -5.746 1.00 0.00 C ATOM 0 H LEU A 87 -8.858 -5.276 -6.242 1.00 0.00 H new ATOM 0 HA LEU A 87 -8.489 -7.404 -8.232 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -10.576 -8.118 -7.698 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -9.994 -7.485 -6.171 1.00 0.00 H new ATOM 0 HG LEU A 87 -11.272 -5.305 -7.027 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -13.449 -5.904 -8.057 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -12.078 -6.242 -9.140 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -12.874 -7.575 -8.270 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -13.240 -6.117 -5.655 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -12.608 -7.776 -5.776 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -11.689 -6.537 -4.889 1.00 0.00 H new ATOM 1373 N GLY A 88 -9.398 -4.473 -9.157 1.00 0.00 N ATOM 1374 CA GLY A 88 -9.627 -3.589 -10.306 1.00 0.00 C ATOM 1375 C GLY A 88 -8.390 -3.443 -11.201 1.00 0.00 C ATOM 1376 O GLY A 88 -7.252 -3.588 -10.752 1.00 0.00 O ATOM 0 H GLY A 88 -9.190 -3.960 -8.300 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -10.455 -3.979 -10.899 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -9.928 -2.605 -9.947 1.00 0.00 H new ATOM 1380 N ALA A 89 -8.625 -3.120 -12.476 1.00 0.00 N ATOM 1381 CA ALA A 89 -7.589 -2.960 -13.508 1.00 0.00 C ATOM 1382 C ALA A 89 -7.125 -1.500 -13.720 1.00 0.00 C ATOM 1383 O ALA A 89 -6.314 -1.236 -14.612 1.00 0.00 O ATOM 1384 CB ALA A 89 -8.158 -3.549 -14.805 1.00 0.00 C ATOM 0 H ALA A 89 -9.567 -2.957 -12.832 1.00 0.00 H new ATOM 0 HA ALA A 89 -6.690 -3.483 -13.182 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -7.421 -3.452 -15.602 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -8.393 -4.603 -14.654 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -9.065 -3.011 -15.082 1.00 0.00 H new ATOM 1390 N GLU A 90 -7.674 -0.558 -12.949 1.00 0.00 N ATOM 1391 CA GLU A 90 -7.543 0.894 -13.128 1.00 0.00 C ATOM 1392 C GLU A 90 -7.054 1.587 -11.838 1.00 0.00 C ATOM 1393 O GLU A 90 -7.129 1.028 -10.741 1.00 0.00 O ATOM 1394 CB GLU A 90 -8.900 1.465 -13.576 1.00 0.00 C ATOM 1395 CG GLU A 90 -9.272 1.045 -15.005 1.00 0.00 C ATOM 1396 CD GLU A 90 -10.593 1.693 -15.441 1.00 0.00 C ATOM 1397 OE1 GLU A 90 -11.672 1.096 -15.212 1.00 0.00 O ATOM 1398 OE2 GLU A 90 -10.566 2.803 -16.023 1.00 0.00 O ATOM 0 H GLU A 90 -8.251 -0.797 -12.142 1.00 0.00 H new ATOM 0 HA GLU A 90 -6.791 1.088 -13.893 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -9.676 1.130 -12.888 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -8.870 2.553 -13.517 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -8.477 1.334 -15.692 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -9.360 -0.040 -15.058 1.00 0.00 H new ATOM 1405 N GLU A 91 -6.532 2.811 -11.981 1.00 0.00 N ATOM 1406 CA GLU A 91 -5.964 3.620 -10.892 1.00 0.00 C ATOM 1407 C GLU A 91 -7.010 3.970 -9.817 1.00 0.00 C ATOM 1408 O GLU A 91 -8.171 4.254 -10.135 1.00 0.00 O ATOM 1409 CB GLU A 91 -5.335 4.880 -11.510 1.00 0.00 C ATOM 1410 CG GLU A 91 -4.535 5.747 -10.534 1.00 0.00 C ATOM 1411 CD GLU A 91 -4.008 7.000 -11.250 1.00 0.00 C ATOM 1412 OE1 GLU A 91 -2.988 6.911 -11.974 1.00 0.00 O ATOM 1413 OE2 GLU A 91 -4.634 8.081 -11.126 1.00 0.00 O ATOM 0 H GLU A 91 -6.491 3.282 -12.885 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.199 3.041 -10.374 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -4.679 4.578 -12.326 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -6.128 5.487 -11.947 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -5.165 6.037 -9.693 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -3.702 5.175 -10.126 1.00 0.00 H new ATOM 1420 N ARG A 92 -6.592 3.958 -8.540 1.00 0.00 N ATOM 1421 CA ARG A 92 -7.491 4.089 -7.383 1.00 0.00 C ATOM 1422 C ARG A 92 -6.805 4.707 -6.165 1.00 0.00 C ATOM 1423 O ARG A 92 -5.822 4.167 -5.654 1.00 0.00 O ATOM 1424 CB ARG A 92 -8.040 2.693 -7.034 1.00 0.00 C ATOM 1425 CG ARG A 92 -9.156 2.668 -5.973 1.00 0.00 C ATOM 1426 CD ARG A 92 -10.352 3.572 -6.310 1.00 0.00 C ATOM 1427 NE ARG A 92 -11.544 3.203 -5.524 1.00 0.00 N ATOM 1428 CZ ARG A 92 -12.440 2.264 -5.822 1.00 0.00 C ATOM 1429 NH1 ARG A 92 -12.337 1.506 -6.896 1.00 0.00 N ATOM 1430 NH2 ARG A 92 -13.471 2.074 -5.028 1.00 0.00 N ATOM 0 H ARG A 92 -5.611 3.856 -8.280 1.00 0.00 H new ATOM 0 HA ARG A 92 -8.299 4.768 -7.655 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -8.419 2.232 -7.946 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -7.214 2.074 -6.683 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -9.509 1.644 -5.854 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -8.739 2.975 -5.014 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -10.091 4.612 -6.112 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -10.578 3.497 -7.374 1.00 0.00 H new ATOM 0 HE ARG A 92 -11.699 3.722 -4.660 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -11.550 1.628 -7.533 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -13.044 0.797 -7.090 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -13.581 2.644 -4.189 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -14.161 1.356 -5.251 1.00 0.00 H new ATOM 1444 N LYS A 93 -7.393 5.784 -5.635 1.00 0.00 N ATOM 1445 CA LYS A 93 -7.010 6.420 -4.370 1.00 0.00 C ATOM 1446 C LYS A 93 -7.966 6.024 -3.222 1.00 0.00 C ATOM 1447 O LYS A 93 -9.180 5.990 -3.410 1.00 0.00 O ATOM 1448 CB LYS A 93 -6.984 7.949 -4.556 1.00 0.00 C ATOM 1449 CG LYS A 93 -6.062 8.389 -5.708 1.00 0.00 C ATOM 1450 CD LYS A 93 -5.771 9.896 -5.740 1.00 0.00 C ATOM 1451 CE LYS A 93 -7.063 10.728 -5.739 1.00 0.00 C ATOM 1452 NZ LYS A 93 -6.789 12.184 -5.899 1.00 0.00 N ATOM 0 H LYS A 93 -8.176 6.253 -6.090 1.00 0.00 H new ATOM 0 HA LYS A 93 -6.015 6.071 -4.093 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -7.996 8.305 -4.749 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -6.652 8.418 -3.630 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -5.118 7.850 -5.629 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -6.518 8.098 -6.655 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -5.164 10.167 -4.876 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -5.186 10.134 -6.628 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -7.712 10.390 -6.547 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -7.601 10.561 -4.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -7.687 12.709 -5.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -6.190 12.513 -5.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -6.298 12.348 -6.801 1.00 0.00 H new ATOM 1466 N VAL A 94 -7.413 5.768 -2.033 1.00 0.00 N ATOM 1467 CA VAL A 94 -8.140 5.572 -0.756 1.00 0.00 C ATOM 1468 C VAL A 94 -7.431 6.391 0.328 1.00 0.00 C ATOM 1469 O VAL A 94 -6.206 6.500 0.296 1.00 0.00 O ATOM 1470 CB VAL A 94 -8.221 4.073 -0.354 1.00 0.00 C ATOM 1471 CG1 VAL A 94 -8.965 3.889 0.973 1.00 0.00 C ATOM 1472 CG2 VAL A 94 -8.878 3.258 -1.463 1.00 0.00 C ATOM 0 H VAL A 94 -6.403 5.686 -1.919 1.00 0.00 H new ATOM 0 HA VAL A 94 -9.169 5.912 -0.875 1.00 0.00 H new ATOM 0 HB VAL A 94 -7.204 3.708 -0.213 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -9.004 2.829 1.225 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -8.442 4.430 1.761 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -9.979 4.276 0.878 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -8.927 2.211 -1.165 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -9.886 3.632 -1.641 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -8.291 3.348 -2.377 1.00 0.00 H new ATOM 1482 N GLU A 95 -8.181 6.976 1.265 1.00 0.00 N ATOM 1483 CA GLU A 95 -7.650 7.783 2.369 1.00 0.00 C ATOM 1484 C GLU A 95 -7.916 7.102 3.725 1.00 0.00 C ATOM 1485 O GLU A 95 -9.014 6.595 3.953 1.00 0.00 O ATOM 1486 CB GLU A 95 -8.301 9.173 2.306 1.00 0.00 C ATOM 1487 CG GLU A 95 -7.698 10.171 3.296 1.00 0.00 C ATOM 1488 CD GLU A 95 -8.451 11.510 3.232 1.00 0.00 C ATOM 1489 OE1 GLU A 95 -8.339 12.227 2.209 1.00 0.00 O ATOM 1490 OE2 GLU A 95 -9.172 11.847 4.201 1.00 0.00 O ATOM 0 H GLU A 95 -9.198 6.901 1.278 1.00 0.00 H new ATOM 0 HA GLU A 95 -6.569 7.882 2.271 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -8.199 9.568 1.295 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -9.368 9.076 2.504 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.748 9.766 4.307 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -6.644 10.328 3.068 1.00 0.00 H new ATOM 1497 N ILE A 96 -6.926 7.072 4.631 1.00 0.00 N ATOM 1498 CA ILE A 96 -6.917 6.170 5.802 1.00 0.00 C ATOM 1499 C ILE A 96 -5.939 6.630 6.897 1.00 0.00 C ATOM 1500 O ILE A 96 -4.888 7.192 6.597 1.00 0.00 O ATOM 1501 CB ILE A 96 -6.612 4.727 5.317 1.00 0.00 C ATOM 1502 CG1 ILE A 96 -6.828 3.697 6.440 1.00 0.00 C ATOM 1503 CG2 ILE A 96 -5.211 4.596 4.692 1.00 0.00 C ATOM 1504 CD1 ILE A 96 -6.833 2.251 5.934 1.00 0.00 C ATOM 0 H ILE A 96 -6.104 7.674 4.575 1.00 0.00 H new ATOM 0 HA ILE A 96 -7.901 6.194 6.270 1.00 0.00 H new ATOM 0 HB ILE A 96 -7.327 4.509 4.524 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -6.042 3.812 7.187 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -7.775 3.905 6.939 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -5.051 3.567 4.370 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -5.133 5.261 3.832 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.456 4.867 5.430 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.989 1.573 6.773 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -7.636 2.122 5.208 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.877 2.028 5.460 1.00 0.00 H new ATOM 1516 N ALA A 97 -6.258 6.403 8.174 1.00 0.00 N ATOM 1517 CA ALA A 97 -5.335 6.659 9.287 1.00 0.00 C ATOM 1518 C ALA A 97 -4.390 5.468 9.505 1.00 0.00 C ATOM 1519 O ALA A 97 -4.846 4.357 9.771 1.00 0.00 O ATOM 1520 CB ALA A 97 -6.138 6.995 10.554 1.00 0.00 C ATOM 0 H ALA A 97 -7.164 6.036 8.467 1.00 0.00 H new ATOM 0 HA ALA A 97 -4.707 7.516 9.043 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -5.452 7.185 11.380 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -6.745 7.882 10.375 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -6.787 6.156 10.807 1.00 0.00 H new ATOM 1526 N PHE A 98 -3.080 5.712 9.433 1.00 0.00 N ATOM 1527 CA PHE A 98 -2.025 4.750 9.744 1.00 0.00 C ATOM 1528 C PHE A 98 -1.303 5.089 11.055 1.00 0.00 C ATOM 1529 O PHE A 98 -1.095 6.254 11.391 1.00 0.00 O ATOM 1530 CB PHE A 98 -1.028 4.732 8.575 1.00 0.00 C ATOM 1531 CG PHE A 98 -1.482 4.088 7.273 1.00 0.00 C ATOM 1532 CD1 PHE A 98 -2.483 3.095 7.240 1.00 0.00 C ATOM 1533 CD2 PHE A 98 -0.821 4.432 6.080 1.00 0.00 C ATOM 1534 CE1 PHE A 98 -2.773 2.422 6.041 1.00 0.00 C ATOM 1535 CE2 PHE A 98 -1.119 3.769 4.877 1.00 0.00 C ATOM 1536 CZ PHE A 98 -2.086 2.751 4.862 1.00 0.00 C ATOM 0 H PHE A 98 -2.713 6.619 9.146 1.00 0.00 H new ATOM 0 HA PHE A 98 -2.475 3.767 9.879 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -0.744 5.762 8.359 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -0.128 4.216 8.909 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -3.029 2.851 8.140 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -0.076 5.214 6.088 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -3.527 1.649 6.027 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -0.606 4.042 3.967 1.00 0.00 H new ATOM 0 HZ PHE A 98 -2.301 2.222 3.945 1.00 0.00 H new ATOM 1546 N TYR A 99 -0.869 4.042 11.761 1.00 0.00 N ATOM 1547 CA TYR A 99 -0.108 4.099 13.016 1.00 0.00 C ATOM 1548 C TYR A 99 1.349 3.653 12.788 1.00 0.00 C ATOM 1549 O TYR A 99 1.612 2.667 12.097 1.00 0.00 O ATOM 1550 CB TYR A 99 -0.815 3.209 14.050 1.00 0.00 C ATOM 1551 CG TYR A 99 -0.067 3.037 15.361 1.00 0.00 C ATOM 1552 CD1 TYR A 99 -0.217 3.982 16.394 1.00 0.00 C ATOM 1553 CD2 TYR A 99 0.780 1.927 15.545 1.00 0.00 C ATOM 1554 CE1 TYR A 99 0.468 3.815 17.613 1.00 0.00 C ATOM 1555 CE2 TYR A 99 1.472 1.756 16.759 1.00 0.00 C ATOM 1556 CZ TYR A 99 1.314 2.698 17.801 1.00 0.00 C ATOM 1557 OH TYR A 99 1.967 2.514 18.984 1.00 0.00 O ATOM 0 H TYR A 99 -1.046 3.084 11.460 1.00 0.00 H new ATOM 0 HA TYR A 99 -0.071 5.123 13.388 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -1.797 3.632 14.261 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -0.979 2.225 13.610 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -0.860 4.838 16.251 1.00 0.00 H new ATOM 0 HD2 TYR A 99 0.899 1.204 14.752 1.00 0.00 H new ATOM 0 HE1 TYR A 99 0.347 4.540 18.404 1.00 0.00 H new ATOM 0 HE2 TYR A 99 2.123 0.905 16.894 1.00 0.00 H new ATOM 0 HH TYR A 99 2.503 1.695 18.938 1.00 0.00 H new ATOM 1567 N ARG A 100 2.297 4.440 13.308 1.00 0.00 N ATOM 1568 CA ARG A 100 3.731 4.387 12.983 1.00 0.00 C ATOM 1569 C ARG A 100 4.562 3.782 14.127 1.00 0.00 C ATOM 1570 O ARG A 100 4.144 3.780 15.285 1.00 0.00 O ATOM 1571 CB ARG A 100 4.212 5.813 12.628 1.00 0.00 C ATOM 1572 CG ARG A 100 3.848 6.248 11.195 1.00 0.00 C ATOM 1573 CD ARG A 100 2.352 6.363 10.849 1.00 0.00 C ATOM 1574 NE ARG A 100 2.141 6.702 9.428 1.00 0.00 N ATOM 1575 CZ ARG A 100 2.346 5.920 8.373 1.00 0.00 C ATOM 1576 NH1 ARG A 100 2.721 4.663 8.496 1.00 0.00 N ATOM 1577 NH2 ARG A 100 2.168 6.391 7.159 1.00 0.00 N ATOM 0 H ARG A 100 2.080 5.162 13.995 1.00 0.00 H new ATOM 0 HA ARG A 100 3.875 3.729 12.126 1.00 0.00 H new ATOM 0 HB2 ARG A 100 3.778 6.520 13.335 1.00 0.00 H new ATOM 0 HB3 ARG A 100 5.294 5.863 12.750 1.00 0.00 H new ATOM 0 HG2 ARG A 100 4.312 7.216 11.008 1.00 0.00 H new ATOM 0 HG3 ARG A 100 4.301 5.539 10.502 1.00 0.00 H new ATOM 0 HD2 ARG A 100 1.853 5.421 11.075 1.00 0.00 H new ATOM 0 HD3 ARG A 100 1.892 7.126 11.477 1.00 0.00 H new ATOM 0 HE ARG A 100 1.799 7.643 9.234 1.00 0.00 H new ATOM 0 HH11 ARG A 100 2.863 4.262 9.423 1.00 0.00 H new ATOM 0 HH12 ARG A 100 2.869 4.091 7.664 1.00 0.00 H new ATOM 0 HH21 ARG A 100 1.872 7.358 7.025 1.00 0.00 H new ATOM 0 HH22 ARG A 100 2.326 5.790 6.350 1.00 0.00 H new ATOM 1591 N LYS A 101 5.777 3.310 13.815 1.00 0.00 N ATOM 1592 CA LYS A 101 6.683 2.654 14.787 1.00 0.00 C ATOM 1593 C LYS A 101 7.157 3.590 15.923 1.00 0.00 C ATOM 1594 O LYS A 101 7.504 3.117 17.007 1.00 0.00 O ATOM 1595 CB LYS A 101 7.894 2.044 14.046 1.00 0.00 C ATOM 1596 CG LYS A 101 7.707 0.586 13.599 1.00 0.00 C ATOM 1597 CD LYS A 101 6.803 0.432 12.368 1.00 0.00 C ATOM 1598 CE LYS A 101 6.639 -1.039 11.949 1.00 0.00 C ATOM 1599 NZ LYS A 101 5.847 -1.844 12.925 1.00 0.00 N ATOM 0 H LYS A 101 6.168 3.370 12.875 1.00 0.00 H new ATOM 0 HA LYS A 101 6.105 1.866 15.270 1.00 0.00 H new ATOM 0 HB2 LYS A 101 8.110 2.654 13.169 1.00 0.00 H new ATOM 0 HB3 LYS A 101 8.767 2.101 14.697 1.00 0.00 H new ATOM 0 HG2 LYS A 101 8.683 0.154 13.379 1.00 0.00 H new ATOM 0 HG3 LYS A 101 7.284 0.013 14.424 1.00 0.00 H new ATOM 0 HD2 LYS A 101 5.823 0.858 12.583 1.00 0.00 H new ATOM 0 HD3 LYS A 101 7.222 1.000 11.538 1.00 0.00 H new ATOM 0 HE2 LYS A 101 6.152 -1.080 10.974 1.00 0.00 H new ATOM 0 HE3 LYS A 101 7.625 -1.489 11.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 5.758 -2.820 12.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 6.330 -1.846 13.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 4.900 -1.427 13.032 1.00 0.00 H new ATOM 1613 N ASP A 102 7.133 4.908 15.703 1.00 0.00 N ATOM 1614 CA ASP A 102 7.464 5.932 16.711 1.00 0.00 C ATOM 1615 C ASP A 102 6.339 6.157 17.751 1.00 0.00 C ATOM 1616 O ASP A 102 6.532 6.885 18.727 1.00 0.00 O ATOM 1617 CB ASP A 102 7.815 7.233 15.969 1.00 0.00 C ATOM 1618 CG ASP A 102 8.489 8.278 16.877 1.00 0.00 C ATOM 1619 OD1 ASP A 102 9.560 7.973 17.456 1.00 0.00 O ATOM 1620 OD2 ASP A 102 7.973 9.418 16.974 1.00 0.00 O ATOM 0 H ASP A 102 6.878 5.307 14.800 1.00 0.00 H new ATOM 0 HA ASP A 102 8.316 5.582 17.294 1.00 0.00 H new ATOM 0 HB2 ASP A 102 8.478 7.002 15.135 1.00 0.00 H new ATOM 0 HB3 ASP A 102 6.906 7.660 15.545 1.00 0.00 H new ATOM 1625 N GLY A 103 5.165 5.537 17.550 1.00 0.00 N ATOM 1626 CA GLY A 103 3.978 5.647 18.410 1.00 0.00 C ATOM 1627 C GLY A 103 2.965 6.703 17.954 1.00 0.00 C ATOM 1628 O GLY A 103 1.934 6.881 18.602 1.00 0.00 O ATOM 0 H GLY A 103 5.012 4.921 16.752 1.00 0.00 H new ATOM 0 HA2 GLY A 103 3.482 4.677 18.450 1.00 0.00 H new ATOM 0 HA3 GLY A 103 4.299 5.883 19.425 1.00 0.00 H new ATOM 1632 N SER A 104 3.241 7.402 16.854 1.00 0.00 N ATOM 1633 CA SER A 104 2.364 8.437 16.279 1.00 0.00 C ATOM 1634 C SER A 104 1.343 7.855 15.283 1.00 0.00 C ATOM 1635 O SER A 104 1.538 6.769 14.732 1.00 0.00 O ATOM 1636 CB SER A 104 3.214 9.510 15.572 1.00 0.00 C ATOM 1637 OG SER A 104 4.100 10.149 16.485 1.00 0.00 O ATOM 0 H SER A 104 4.100 7.266 16.321 1.00 0.00 H new ATOM 0 HA SER A 104 1.806 8.880 17.104 1.00 0.00 H new ATOM 0 HB2 SER A 104 3.787 9.051 14.766 1.00 0.00 H new ATOM 0 HB3 SER A 104 2.560 10.253 15.115 1.00 0.00 H new ATOM 0 HG SER A 104 4.628 10.824 16.010 1.00 0.00 H new ATOM 1643 N CYS A 105 0.278 8.604 14.978 1.00 0.00 N ATOM 1644 CA CYS A 105 -0.647 8.291 13.881 1.00 0.00 C ATOM 1645 C CYS A 105 -1.051 9.547 13.091 1.00 0.00 C ATOM 1646 O CYS A 105 -0.981 10.668 13.600 1.00 0.00 O ATOM 1647 CB CYS A 105 -1.856 7.501 14.419 1.00 0.00 C ATOM 1648 SG CYS A 105 -2.886 8.517 15.520 1.00 0.00 S ATOM 0 H CYS A 105 0.031 9.451 15.489 1.00 0.00 H new ATOM 0 HA CYS A 105 -0.132 7.653 13.163 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -2.458 7.144 13.584 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.505 6.621 14.958 1.00 0.00 H new ATOM 0 HG CYS A 105 -3.892 7.812 15.946 1.00 0.00 H new ATOM 1654 N PHE A 106 -1.447 9.343 11.832 1.00 0.00 N ATOM 1655 CA PHE A 106 -1.812 10.403 10.881 1.00 0.00 C ATOM 1656 C PHE A 106 -2.543 9.865 9.642 1.00 0.00 C ATOM 1657 O PHE A 106 -2.427 8.687 9.299 1.00 0.00 O ATOM 1658 CB PHE A 106 -0.583 11.266 10.521 1.00 0.00 C ATOM 1659 CG PHE A 106 0.725 10.559 10.206 1.00 0.00 C ATOM 1660 CD1 PHE A 106 1.660 10.318 11.235 1.00 0.00 C ATOM 1661 CD2 PHE A 106 1.069 10.258 8.875 1.00 0.00 C ATOM 1662 CE1 PHE A 106 2.943 9.835 10.932 1.00 0.00 C ATOM 1663 CE2 PHE A 106 2.357 9.775 8.575 1.00 0.00 C ATOM 1664 CZ PHE A 106 3.301 9.584 9.598 1.00 0.00 C ATOM 0 H PHE A 106 -1.526 8.408 11.432 1.00 0.00 H new ATOM 0 HA PHE A 106 -2.532 11.052 11.379 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -0.847 11.877 9.658 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -0.401 11.948 11.351 1.00 0.00 H new ATOM 0 HD1 PHE A 106 1.387 10.506 12.263 1.00 0.00 H new ATOM 0 HD2 PHE A 106 0.346 10.397 8.085 1.00 0.00 H new ATOM 0 HE1 PHE A 106 3.654 9.657 11.725 1.00 0.00 H new ATOM 0 HE2 PHE A 106 2.621 9.550 7.552 1.00 0.00 H new ATOM 0 HZ PHE A 106 4.298 9.245 9.359 1.00 0.00 H new ATOM 1674 N LEU A 107 -3.314 10.737 8.977 1.00 0.00 N ATOM 1675 CA LEU A 107 -4.037 10.404 7.746 1.00 0.00 C ATOM 1676 C LEU A 107 -3.079 10.343 6.554 1.00 0.00 C ATOM 1677 O LEU A 107 -2.432 11.329 6.188 1.00 0.00 O ATOM 1678 CB LEU A 107 -5.145 11.436 7.465 1.00 0.00 C ATOM 1679 CG LEU A 107 -6.563 11.165 8.004 1.00 0.00 C ATOM 1680 CD1 LEU A 107 -7.130 9.819 7.542 1.00 0.00 C ATOM 1681 CD2 LEU A 107 -6.624 11.252 9.529 1.00 0.00 C ATOM 0 H LEU A 107 -3.453 11.700 9.282 1.00 0.00 H new ATOM 0 HA LEU A 107 -4.494 9.424 7.885 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -4.815 12.393 7.869 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -5.219 11.555 6.384 1.00 0.00 H new ATOM 0 HG LEU A 107 -7.186 11.953 7.581 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -8.130 9.685 7.954 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -7.180 9.800 6.453 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -6.484 9.013 7.890 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -7.642 11.054 9.864 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -5.949 10.514 9.963 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -6.324 12.250 9.849 1.00 0.00 H new ATOM 1693 N CYS A 108 -3.075 9.191 5.897 1.00 0.00 N ATOM 1694 CA CYS A 108 -2.358 8.905 4.667 1.00 0.00 C ATOM 1695 C CYS A 108 -3.359 8.751 3.507 1.00 0.00 C ATOM 1696 O CYS A 108 -4.399 8.101 3.644 1.00 0.00 O ATOM 1697 CB CYS A 108 -1.561 7.616 4.921 1.00 0.00 C ATOM 1698 SG CYS A 108 -0.265 7.418 3.670 1.00 0.00 S ATOM 0 H CYS A 108 -3.604 8.385 6.230 1.00 0.00 H new ATOM 0 HA CYS A 108 -1.679 9.710 4.386 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -1.114 7.647 5.915 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -2.231 6.756 4.899 1.00 0.00 H new ATOM 0 HG CYS A 108 -0.789 7.513 2.484 1.00 0.00 H new ATOM 1704 N LEU A 109 -3.032 9.303 2.342 1.00 0.00 N ATOM 1705 CA LEU A 109 -3.580 8.862 1.062 1.00 0.00 C ATOM 1706 C LEU A 109 -2.755 7.657 0.599 1.00 0.00 C ATOM 1707 O LEU A 109 -1.535 7.654 0.744 1.00 0.00 O ATOM 1708 CB LEU A 109 -3.511 10.030 0.055 1.00 0.00 C ATOM 1709 CG LEU A 109 -4.410 9.956 -1.199 1.00 0.00 C ATOM 1710 CD1 LEU A 109 -4.122 8.779 -2.134 1.00 0.00 C ATOM 1711 CD2 LEU A 109 -5.903 10.018 -0.847 1.00 0.00 C ATOM 0 H LEU A 109 -2.373 10.077 2.259 1.00 0.00 H new ATOM 0 HA LEU A 109 -4.625 8.565 1.147 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -3.757 10.948 0.589 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -2.478 10.123 -0.279 1.00 0.00 H new ATOM 0 HG LEU A 109 -4.144 10.850 -1.764 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -4.804 8.814 -2.984 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -3.094 8.841 -2.491 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -4.263 7.843 -1.594 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -6.495 9.963 -1.761 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -6.159 9.181 -0.198 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -6.117 10.955 -0.332 1.00 0.00 H new ATOM 1723 N VAL A 110 -3.429 6.666 0.029 1.00 0.00 N ATOM 1724 CA VAL A 110 -2.829 5.529 -0.682 1.00 0.00 C ATOM 1725 C VAL A 110 -3.412 5.474 -2.096 1.00 0.00 C ATOM 1726 O VAL A 110 -4.609 5.227 -2.250 1.00 0.00 O ATOM 1727 CB VAL A 110 -3.075 4.185 0.040 1.00 0.00 C ATOM 1728 CG1 VAL A 110 -2.205 3.102 -0.596 1.00 0.00 C ATOM 1729 CG2 VAL A 110 -2.792 4.265 1.549 1.00 0.00 C ATOM 0 H VAL A 110 -4.448 6.625 0.046 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.750 5.679 -0.713 1.00 0.00 H new ATOM 0 HB VAL A 110 -4.131 3.939 -0.073 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.377 2.153 -0.088 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.462 3.001 -1.650 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -1.155 3.378 -0.503 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.981 3.294 2.007 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.751 4.546 1.710 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -3.443 5.012 2.002 1.00 0.00 H new ATOM 1739 N ASP A 111 -2.601 5.736 -3.121 1.00 0.00 N ATOM 1740 CA ASP A 111 -2.953 5.576 -4.529 1.00 0.00 C ATOM 1741 C ASP A 111 -2.308 4.304 -5.089 1.00 0.00 C ATOM 1742 O ASP A 111 -1.083 4.188 -5.059 1.00 0.00 O ATOM 1743 CB ASP A 111 -2.474 6.819 -5.294 1.00 0.00 C ATOM 1744 CG ASP A 111 -2.803 6.786 -6.798 1.00 0.00 C ATOM 1745 OD1 ASP A 111 -3.773 6.098 -7.194 1.00 0.00 O ATOM 1746 OD2 ASP A 111 -2.103 7.489 -7.564 1.00 0.00 O ATOM 0 H ASP A 111 -1.649 6.077 -2.988 1.00 0.00 H new ATOM 0 HA ASP A 111 -4.033 5.478 -4.641 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -2.929 7.705 -4.851 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -1.396 6.918 -5.169 1.00 0.00 H new ATOM 1751 N VAL A 112 -3.105 3.369 -5.613 1.00 0.00 N ATOM 1752 CA VAL A 112 -2.597 2.249 -6.424 1.00 0.00 C ATOM 1753 C VAL A 112 -2.604 2.639 -7.895 1.00 0.00 C ATOM 1754 O VAL A 112 -3.644 2.980 -8.453 1.00 0.00 O ATOM 1755 CB VAL A 112 -3.317 0.902 -6.206 1.00 0.00 C ATOM 1756 CG1 VAL A 112 -4.827 0.959 -6.183 1.00 0.00 C ATOM 1757 CG2 VAL A 112 -2.898 -0.189 -7.199 1.00 0.00 C ATOM 0 H VAL A 112 -4.118 3.363 -5.490 1.00 0.00 H new ATOM 0 HA VAL A 112 -1.578 2.070 -6.081 1.00 0.00 H new ATOM 0 HB VAL A 112 -2.981 0.643 -5.202 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -5.227 -0.043 -6.024 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -5.154 1.613 -5.375 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -5.191 1.348 -7.134 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -3.446 -1.107 -6.984 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -3.122 0.138 -8.214 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -1.828 -0.375 -7.105 1.00 0.00 H new ATOM 1767 N VAL A 113 -1.431 2.526 -8.511 1.00 0.00 N ATOM 1768 CA VAL A 113 -1.204 2.755 -9.938 1.00 0.00 C ATOM 1769 C VAL A 113 -0.934 1.386 -10.578 1.00 0.00 C ATOM 1770 O VAL A 113 0.089 0.775 -10.256 1.00 0.00 O ATOM 1771 CB VAL A 113 -0.029 3.738 -10.144 1.00 0.00 C ATOM 1772 CG1 VAL A 113 0.322 3.898 -11.632 1.00 0.00 C ATOM 1773 CG2 VAL A 113 -0.346 5.121 -9.552 1.00 0.00 C ATOM 0 H VAL A 113 -0.580 2.263 -8.014 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.072 3.214 -10.411 1.00 0.00 H new ATOM 0 HB VAL A 113 0.828 3.311 -9.622 1.00 0.00 H new ATOM 0 HG11 VAL A 113 1.152 4.596 -11.737 1.00 0.00 H new ATOM 0 HG12 VAL A 113 0.607 2.930 -12.045 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -0.545 4.281 -12.171 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.500 5.789 -9.714 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -1.230 5.532 -10.040 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -0.533 5.025 -8.483 1.00 0.00 H new ATOM 1783 N PRO A 114 -1.836 0.862 -11.433 1.00 0.00 N ATOM 1784 CA PRO A 114 -1.647 -0.423 -12.092 1.00 0.00 C ATOM 1785 C PRO A 114 -0.605 -0.291 -13.204 1.00 0.00 C ATOM 1786 O PRO A 114 -0.690 0.600 -14.048 1.00 0.00 O ATOM 1787 CB PRO A 114 -3.022 -0.821 -12.634 1.00 0.00 C ATOM 1788 CG PRO A 114 -3.701 0.522 -12.884 1.00 0.00 C ATOM 1789 CD PRO A 114 -3.143 1.411 -11.774 1.00 0.00 C ATOM 0 HA PRO A 114 -1.272 -1.189 -11.413 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -2.940 -1.407 -13.549 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -3.578 -1.426 -11.917 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -3.463 0.915 -13.872 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -4.786 0.441 -12.827 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -3.056 2.444 -12.109 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -3.803 1.412 -10.907 1.00 0.00 H new ATOM 1797 N VAL A 115 0.370 -1.201 -13.203 1.00 0.00 N ATOM 1798 CA VAL A 115 1.389 -1.320 -14.259 1.00 0.00 C ATOM 1799 C VAL A 115 1.011 -2.482 -15.171 1.00 0.00 C ATOM 1800 O VAL A 115 0.851 -3.613 -14.708 1.00 0.00 O ATOM 1801 CB VAL A 115 2.804 -1.532 -13.673 1.00 0.00 C ATOM 1802 CG1 VAL A 115 3.876 -1.660 -14.769 1.00 0.00 C ATOM 1803 CG2 VAL A 115 3.191 -0.383 -12.730 1.00 0.00 C ATOM 0 H VAL A 115 0.480 -1.889 -12.458 1.00 0.00 H new ATOM 0 HA VAL A 115 1.417 -0.389 -14.826 1.00 0.00 H new ATOM 0 HB VAL A 115 2.765 -2.468 -13.116 1.00 0.00 H new ATOM 0 HG11 VAL A 115 4.852 -1.807 -14.307 1.00 0.00 H new ATOM 0 HG12 VAL A 115 3.644 -2.513 -15.407 1.00 0.00 H new ATOM 0 HG13 VAL A 115 3.892 -0.751 -15.370 1.00 0.00 H new ATOM 0 HG21 VAL A 115 4.191 -0.559 -12.333 1.00 0.00 H new ATOM 0 HG22 VAL A 115 3.179 0.558 -13.280 1.00 0.00 H new ATOM 0 HG23 VAL A 115 2.478 -0.332 -11.907 1.00 0.00 H new ATOM 1813 N LYS A 116 0.891 -2.205 -16.472 1.00 0.00 N ATOM 1814 CA LYS A 116 0.634 -3.222 -17.499 1.00 0.00 C ATOM 1815 C LYS A 116 1.902 -3.682 -18.228 1.00 0.00 C ATOM 1816 O LYS A 116 2.888 -2.950 -18.340 1.00 0.00 O ATOM 1817 CB LYS A 116 -0.427 -2.736 -18.495 1.00 0.00 C ATOM 1818 CG LYS A 116 -1.777 -2.572 -17.790 1.00 0.00 C ATOM 1819 CD LYS A 116 -2.916 -2.393 -18.797 1.00 0.00 C ATOM 1820 CE LYS A 116 -4.235 -2.851 -18.162 1.00 0.00 C ATOM 1821 NZ LYS A 116 -4.909 -1.763 -17.394 1.00 0.00 N ATOM 0 H LYS A 116 0.970 -1.260 -16.847 1.00 0.00 H new ATOM 0 HA LYS A 116 0.251 -4.097 -16.975 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.119 -1.786 -18.932 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -0.520 -3.448 -19.315 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -1.973 -3.446 -17.169 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -1.739 -1.710 -17.124 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -2.989 -1.348 -19.099 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -2.713 -2.972 -19.698 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -4.906 -3.209 -18.943 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -4.041 -3.693 -17.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -5.239 -2.136 -16.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -4.237 -0.987 -17.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -5.721 -1.407 -17.937 1.00 0.00 H new ATOM 1835 N ASN A 117 1.846 -4.916 -18.737 1.00 0.00 N ATOM 1836 CA ASN A 117 2.913 -5.527 -19.529 1.00 0.00 C ATOM 1837 C ASN A 117 2.688 -5.305 -21.036 1.00 0.00 C ATOM 1838 O ASN A 117 1.735 -4.646 -21.456 1.00 0.00 O ATOM 1839 CB ASN A 117 3.063 -7.013 -19.139 1.00 0.00 C ATOM 1840 CG ASN A 117 2.055 -7.943 -19.805 1.00 0.00 C ATOM 1841 OD1 ASN A 117 2.374 -8.618 -20.771 1.00 0.00 O ATOM 1842 ND2 ASN A 117 0.813 -7.973 -19.361 1.00 0.00 N ATOM 0 H ASN A 117 1.041 -5.529 -18.607 1.00 0.00 H new ATOM 0 HA ASN A 117 3.861 -5.039 -19.304 1.00 0.00 H new ATOM 0 HB2 ASN A 117 4.069 -7.344 -19.396 1.00 0.00 H new ATOM 0 HB3 ASN A 117 2.964 -7.104 -18.057 1.00 0.00 H new ATOM 0 HD21 ASN A 117 0.120 -8.560 -19.825 1.00 0.00 H new ATOM 0 HD22 ASN A 117 0.546 -7.409 -18.554 1.00 0.00 H new ATOM 1849 N GLU A 118 3.549 -5.922 -21.839 1.00 0.00 N ATOM 1850 CA GLU A 118 3.517 -5.873 -23.311 1.00 0.00 C ATOM 1851 C GLU A 118 2.212 -6.416 -23.941 1.00 0.00 C ATOM 1852 O GLU A 118 1.880 -6.049 -25.070 1.00 0.00 O ATOM 1853 CB GLU A 118 4.744 -6.610 -23.878 1.00 0.00 C ATOM 1854 CG GLU A 118 4.863 -8.068 -23.408 1.00 0.00 C ATOM 1855 CD GLU A 118 6.001 -8.789 -24.144 1.00 0.00 C ATOM 1856 OE1 GLU A 118 7.163 -8.737 -23.672 1.00 0.00 O ATOM 1857 OE2 GLU A 118 5.748 -9.417 -25.200 1.00 0.00 O ATOM 0 H GLU A 118 4.316 -6.490 -21.479 1.00 0.00 H new ATOM 0 HA GLU A 118 3.547 -4.818 -23.585 1.00 0.00 H new ATOM 0 HB2 GLU A 118 4.696 -6.592 -24.967 1.00 0.00 H new ATOM 0 HB3 GLU A 118 5.646 -6.070 -23.589 1.00 0.00 H new ATOM 0 HG2 GLU A 118 5.045 -8.094 -22.334 1.00 0.00 H new ATOM 0 HG3 GLU A 118 3.922 -8.589 -23.585 1.00 0.00 H new ATOM 1864 N ASP A 119 1.450 -7.254 -23.226 1.00 0.00 N ATOM 1865 CA ASP A 119 0.177 -7.839 -23.681 1.00 0.00 C ATOM 1866 C ASP A 119 -1.056 -6.991 -23.292 1.00 0.00 C ATOM 1867 O ASP A 119 -2.180 -7.301 -23.694 1.00 0.00 O ATOM 1868 CB ASP A 119 0.074 -9.263 -23.105 1.00 0.00 C ATOM 1869 CG ASP A 119 -1.072 -10.085 -23.721 1.00 0.00 C ATOM 1870 OD1 ASP A 119 -1.057 -10.312 -24.956 1.00 0.00 O ATOM 1871 OD2 ASP A 119 -1.961 -10.542 -22.962 1.00 0.00 O ATOM 0 H ASP A 119 1.708 -7.554 -22.286 1.00 0.00 H new ATOM 0 HA ASP A 119 0.177 -7.863 -24.771 1.00 0.00 H new ATOM 0 HB2 ASP A 119 1.017 -9.784 -23.272 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -0.070 -9.202 -22.026 1.00 0.00 H new ATOM 1876 N GLY A 120 -0.862 -5.922 -22.503 1.00 0.00 N ATOM 1877 CA GLY A 120 -1.937 -5.041 -22.025 1.00 0.00 C ATOM 1878 C GLY A 120 -2.737 -5.610 -20.845 1.00 0.00 C ATOM 1879 O GLY A 120 -3.889 -5.222 -20.650 1.00 0.00 O ATOM 0 H GLY A 120 0.062 -5.642 -22.174 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -1.504 -4.085 -21.729 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -2.621 -4.840 -22.850 1.00 0.00 H new ATOM 1883 N ALA A 121 -2.131 -6.500 -20.049 1.00 0.00 N ATOM 1884 CA ALA A 121 -2.680 -7.022 -18.790 1.00 0.00 C ATOM 1885 C ALA A 121 -1.901 -6.445 -17.602 1.00 0.00 C ATOM 1886 O ALA A 121 -0.718 -6.129 -17.743 1.00 0.00 O ATOM 1887 CB ALA A 121 -2.629 -8.561 -18.806 1.00 0.00 C ATOM 0 H ALA A 121 -1.215 -6.890 -20.271 1.00 0.00 H new ATOM 0 HA ALA A 121 -3.721 -6.717 -18.685 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -3.036 -8.948 -17.872 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -3.219 -8.936 -19.642 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -1.595 -8.890 -18.915 1.00 0.00 H new ATOM 1893 N VAL A 122 -2.537 -6.322 -16.437 1.00 0.00 N ATOM 1894 CA VAL A 122 -1.905 -5.766 -15.222 1.00 0.00 C ATOM 1895 C VAL A 122 -1.054 -6.851 -14.551 1.00 0.00 C ATOM 1896 O VAL A 122 -1.555 -7.938 -14.266 1.00 0.00 O ATOM 1897 CB VAL A 122 -2.933 -5.188 -14.215 1.00 0.00 C ATOM 1898 CG1 VAL A 122 -2.219 -4.360 -13.138 1.00 0.00 C ATOM 1899 CG2 VAL A 122 -3.959 -4.257 -14.880 1.00 0.00 C ATOM 0 H VAL A 122 -3.508 -6.603 -16.300 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.276 -4.932 -15.533 1.00 0.00 H new ATOM 0 HB VAL A 122 -3.447 -6.050 -13.791 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -2.954 -3.961 -12.439 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -1.513 -4.993 -12.600 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -1.682 -3.537 -13.609 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -4.652 -3.883 -14.127 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -3.441 -3.418 -15.345 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -4.512 -4.809 -15.640 1.00 0.00 H new ATOM 1909 N ILE A 123 0.231 -6.560 -14.306 1.00 0.00 N ATOM 1910 CA ILE A 123 1.191 -7.535 -13.726 1.00 0.00 C ATOM 1911 C ILE A 123 1.912 -7.038 -12.468 1.00 0.00 C ATOM 1912 O ILE A 123 2.287 -7.847 -11.623 1.00 0.00 O ATOM 1913 CB ILE A 123 2.182 -8.068 -14.790 1.00 0.00 C ATOM 1914 CG1 ILE A 123 3.358 -7.133 -15.155 1.00 0.00 C ATOM 1915 CG2 ILE A 123 1.443 -8.561 -16.046 1.00 0.00 C ATOM 1916 CD1 ILE A 123 3.036 -5.723 -15.657 1.00 0.00 C ATOM 0 H ILE A 123 0.642 -5.647 -14.500 1.00 0.00 H new ATOM 0 HA ILE A 123 0.580 -8.372 -13.388 1.00 0.00 H new ATOM 0 HB ILE A 123 2.665 -8.913 -14.299 1.00 0.00 H new ATOM 0 HG12 ILE A 123 3.991 -7.035 -14.273 1.00 0.00 H new ATOM 0 HG13 ILE A 123 3.953 -7.631 -15.921 1.00 0.00 H new ATOM 0 HG21 ILE A 123 2.167 -8.929 -16.773 1.00 0.00 H new ATOM 0 HG22 ILE A 123 0.761 -9.366 -15.774 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.877 -7.738 -16.482 1.00 0.00 H new ATOM 0 HD11 ILE A 123 3.964 -5.192 -15.870 1.00 0.00 H new ATOM 0 HD12 ILE A 123 2.438 -5.788 -16.566 1.00 0.00 H new ATOM 0 HD13 ILE A 123 2.477 -5.184 -14.893 1.00 0.00 H new ATOM 1928 N MET A 124 2.040 -5.723 -12.291 1.00 0.00 N ATOM 1929 CA MET A 124 2.467 -5.086 -11.031 1.00 0.00 C ATOM 1930 C MET A 124 1.534 -3.942 -10.609 1.00 0.00 C ATOM 1931 O MET A 124 0.924 -3.271 -11.441 1.00 0.00 O ATOM 1932 CB MET A 124 3.915 -4.579 -11.163 1.00 0.00 C ATOM 1933 CG MET A 124 4.930 -5.728 -11.135 1.00 0.00 C ATOM 1934 SD MET A 124 6.615 -5.236 -11.578 1.00 0.00 S ATOM 1935 CE MET A 124 6.411 -5.075 -13.371 1.00 0.00 C ATOM 0 H MET A 124 1.847 -5.050 -13.033 1.00 0.00 H new ATOM 0 HA MET A 124 2.416 -5.842 -10.248 1.00 0.00 H new ATOM 0 HB2 MET A 124 4.021 -4.024 -12.095 1.00 0.00 H new ATOM 0 HB3 MET A 124 4.131 -3.884 -10.352 1.00 0.00 H new ATOM 0 HG2 MET A 124 4.941 -6.165 -10.136 1.00 0.00 H new ATOM 0 HG3 MET A 124 4.599 -6.508 -11.820 1.00 0.00 H new ATOM 0 HE1 MET A 124 7.034 -5.813 -13.876 1.00 0.00 H new ATOM 0 HE2 MET A 124 5.366 -5.241 -13.635 1.00 0.00 H new ATOM 0 HE3 MET A 124 6.709 -4.074 -13.683 1.00 0.00 H new ATOM 1945 N PHE A 125 1.474 -3.689 -9.303 1.00 0.00 N ATOM 1946 CA PHE A 125 0.861 -2.513 -8.689 1.00 0.00 C ATOM 1947 C PHE A 125 1.949 -1.665 -8.033 1.00 0.00 C ATOM 1948 O PHE A 125 2.789 -2.186 -7.304 1.00 0.00 O ATOM 1949 CB PHE A 125 -0.160 -2.977 -7.636 1.00 0.00 C ATOM 1950 CG PHE A 125 -1.388 -3.661 -8.205 1.00 0.00 C ATOM 1951 CD1 PHE A 125 -2.249 -2.951 -9.062 1.00 0.00 C ATOM 1952 CD2 PHE A 125 -1.689 -4.992 -7.856 1.00 0.00 C ATOM 1953 CE1 PHE A 125 -3.402 -3.569 -9.576 1.00 0.00 C ATOM 1954 CE2 PHE A 125 -2.843 -5.609 -8.371 1.00 0.00 C ATOM 1955 CZ PHE A 125 -3.692 -4.900 -9.239 1.00 0.00 C ATOM 0 H PHE A 125 1.869 -4.327 -8.613 1.00 0.00 H new ATOM 0 HA PHE A 125 0.352 -1.914 -9.444 1.00 0.00 H new ATOM 0 HB2 PHE A 125 0.334 -3.662 -6.947 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -0.479 -2.113 -7.053 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -2.023 -1.928 -9.326 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -1.034 -5.538 -7.193 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -4.064 -3.020 -10.229 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -3.077 -6.628 -8.100 1.00 0.00 H new ATOM 0 HZ PHE A 125 -4.569 -5.381 -9.647 1.00 0.00 H new ATOM 1965 N ILE A 126 1.911 -0.350 -8.251 1.00 0.00 N ATOM 1966 CA ILE A 126 2.675 0.618 -7.451 1.00 0.00 C ATOM 1967 C ILE A 126 1.688 1.247 -6.469 1.00 0.00 C ATOM 1968 O ILE A 126 0.728 1.873 -6.916 1.00 0.00 O ATOM 1969 CB ILE A 126 3.357 1.692 -8.334 1.00 0.00 C ATOM 1970 CG1 ILE A 126 4.189 1.078 -9.483 1.00 0.00 C ATOM 1971 CG2 ILE A 126 4.244 2.585 -7.445 1.00 0.00 C ATOM 1972 CD1 ILE A 126 4.629 2.107 -10.532 1.00 0.00 C ATOM 0 H ILE A 126 1.350 0.078 -8.987 1.00 0.00 H new ATOM 0 HA ILE A 126 3.487 0.118 -6.923 1.00 0.00 H new ATOM 0 HB ILE A 126 2.574 2.287 -8.804 1.00 0.00 H new ATOM 0 HG12 ILE A 126 5.072 0.596 -9.065 1.00 0.00 H new ATOM 0 HG13 ILE A 126 3.602 0.300 -9.971 1.00 0.00 H new ATOM 0 HG21 ILE A 126 4.728 3.344 -8.060 1.00 0.00 H new ATOM 0 HG22 ILE A 126 3.629 3.070 -6.687 1.00 0.00 H new ATOM 0 HG23 ILE A 126 5.004 1.974 -6.958 1.00 0.00 H new ATOM 0 HD11 ILE A 126 5.209 1.609 -11.309 1.00 0.00 H new ATOM 0 HD12 ILE A 126 3.749 2.572 -10.977 1.00 0.00 H new ATOM 0 HD13 ILE A 126 5.242 2.872 -10.056 1.00 0.00 H new ATOM 1984 N LEU A 127 1.899 1.075 -5.163 1.00 0.00 N ATOM 1985 CA LEU A 127 1.117 1.730 -4.105 1.00 0.00 C ATOM 1986 C LEU A 127 1.946 2.916 -3.609 1.00 0.00 C ATOM 1987 O LEU A 127 3.125 2.747 -3.303 1.00 0.00 O ATOM 1988 CB LEU A 127 0.802 0.736 -2.959 1.00 0.00 C ATOM 1989 CG LEU A 127 -0.430 -0.181 -3.160 1.00 0.00 C ATOM 1990 CD1 LEU A 127 -1.738 0.569 -2.924 1.00 0.00 C ATOM 1991 CD2 LEU A 127 -0.437 -0.905 -4.511 1.00 0.00 C ATOM 0 H LEU A 127 2.632 0.465 -4.801 1.00 0.00 H new ATOM 0 HA LEU A 127 0.155 2.075 -4.485 1.00 0.00 H new ATOM 0 HB2 LEU A 127 1.677 0.104 -2.805 1.00 0.00 H new ATOM 0 HB3 LEU A 127 0.656 1.307 -2.042 1.00 0.00 H new ATOM 0 HG LEU A 127 -0.346 -0.958 -2.401 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -2.578 -0.109 -3.075 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -1.759 0.952 -1.904 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -1.812 1.400 -3.625 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -1.327 -1.530 -4.585 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.441 -0.171 -5.317 1.00 0.00 H new ATOM 0 HD23 LEU A 127 0.452 -1.530 -4.594 1.00 0.00 H new ATOM 2003 N ASN A 128 1.355 4.109 -3.561 1.00 0.00 N ATOM 2004 CA ASN A 128 2.048 5.366 -3.262 1.00 0.00 C ATOM 2005 C ASN A 128 1.398 6.059 -2.058 1.00 0.00 C ATOM 2006 O ASN A 128 0.179 6.233 -2.042 1.00 0.00 O ATOM 2007 CB ASN A 128 2.046 6.323 -4.470 1.00 0.00 C ATOM 2008 CG ASN A 128 2.307 5.682 -5.835 1.00 0.00 C ATOM 2009 OD1 ASN A 128 3.375 5.821 -6.414 1.00 0.00 O ATOM 2010 ND2 ASN A 128 1.330 4.998 -6.405 1.00 0.00 N ATOM 0 H ASN A 128 0.357 4.234 -3.733 1.00 0.00 H new ATOM 0 HA ASN A 128 3.083 5.118 -3.028 1.00 0.00 H new ATOM 0 HB2 ASN A 128 1.081 6.828 -4.507 1.00 0.00 H new ATOM 0 HB3 ASN A 128 2.801 7.091 -4.301 1.00 0.00 H new ATOM 0 HD21 ASN A 128 1.467 4.586 -7.328 1.00 0.00 H new ATOM 0 HD22 ASN A 128 0.439 4.882 -5.922 1.00 0.00 H new ATOM 2017 N PHE A 129 2.204 6.464 -1.072 1.00 0.00 N ATOM 2018 CA PHE A 129 1.752 7.031 0.199 1.00 0.00 C ATOM 2019 C PHE A 129 2.004 8.548 0.249 1.00 0.00 C ATOM 2020 O PHE A 129 3.079 9.011 -0.137 1.00 0.00 O ATOM 2021 CB PHE A 129 2.471 6.300 1.350 1.00 0.00 C ATOM 2022 CG PHE A 129 2.440 4.781 1.291 1.00 0.00 C ATOM 2023 CD1 PHE A 129 1.215 4.104 1.149 1.00 0.00 C ATOM 2024 CD2 PHE A 129 3.636 4.042 1.384 1.00 0.00 C ATOM 2025 CE1 PHE A 129 1.183 2.699 1.103 1.00 0.00 C ATOM 2026 CE2 PHE A 129 3.604 2.636 1.338 1.00 0.00 C ATOM 2027 CZ PHE A 129 2.377 1.965 1.195 1.00 0.00 C ATOM 0 H PHE A 129 3.220 6.404 -1.140 1.00 0.00 H new ATOM 0 HA PHE A 129 0.676 6.889 0.301 1.00 0.00 H new ATOM 0 HB2 PHE A 129 3.512 6.623 1.366 1.00 0.00 H new ATOM 0 HB3 PHE A 129 2.024 6.617 2.292 1.00 0.00 H new ATOM 0 HD1 PHE A 129 0.295 4.666 1.075 1.00 0.00 H new ATOM 0 HD2 PHE A 129 4.580 4.556 1.491 1.00 0.00 H new ATOM 0 HE1 PHE A 129 0.240 2.184 0.997 1.00 0.00 H new ATOM 0 HE2 PHE A 129 4.522 2.072 1.413 1.00 0.00 H new ATOM 0 HZ PHE A 129 2.352 0.886 1.156 1.00 0.00 H new ATOM 2037 N GLU A 130 1.043 9.324 0.758 1.00 0.00 N ATOM 2038 CA GLU A 130 1.143 10.780 0.931 1.00 0.00 C ATOM 2039 C GLU A 130 0.444 11.189 2.233 1.00 0.00 C ATOM 2040 O GLU A 130 -0.680 10.764 2.480 1.00 0.00 O ATOM 2041 CB GLU A 130 0.482 11.511 -0.254 1.00 0.00 C ATOM 2042 CG GLU A 130 1.348 11.530 -1.519 1.00 0.00 C ATOM 2043 CD GLU A 130 0.668 12.351 -2.626 1.00 0.00 C ATOM 2044 OE1 GLU A 130 0.719 13.604 -2.572 1.00 0.00 O ATOM 2045 OE2 GLU A 130 0.082 11.751 -3.558 1.00 0.00 O ATOM 0 H GLU A 130 0.148 8.948 1.071 1.00 0.00 H new ATOM 0 HA GLU A 130 2.197 11.056 0.972 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -0.470 11.031 -0.482 1.00 0.00 H new ATOM 0 HB3 GLU A 130 0.260 12.537 0.040 1.00 0.00 H new ATOM 0 HG2 GLU A 130 2.325 11.955 -1.291 1.00 0.00 H new ATOM 0 HG3 GLU A 130 1.517 10.511 -1.866 1.00 0.00 H new ATOM 2052 N VAL A 131 1.071 12.024 3.065 1.00 0.00 N ATOM 2053 CA VAL A 131 0.473 12.477 4.337 1.00 0.00 C ATOM 2054 C VAL A 131 -0.515 13.607 4.044 1.00 0.00 C ATOM 2055 O VAL A 131 -0.106 14.670 3.575 1.00 0.00 O ATOM 2056 CB VAL A 131 1.540 12.921 5.365 1.00 0.00 C ATOM 2057 CG1 VAL A 131 0.881 13.364 6.686 1.00 0.00 C ATOM 2058 CG2 VAL A 131 2.511 11.771 5.644 1.00 0.00 C ATOM 0 H VAL A 131 1.999 12.406 2.884 1.00 0.00 H new ATOM 0 HA VAL A 131 -0.052 11.636 4.791 1.00 0.00 H new ATOM 0 HB VAL A 131 2.084 13.766 4.943 1.00 0.00 H new ATOM 0 HG11 VAL A 131 1.652 13.671 7.392 1.00 0.00 H new ATOM 0 HG12 VAL A 131 0.210 14.201 6.495 1.00 0.00 H new ATOM 0 HG13 VAL A 131 0.314 12.533 7.106 1.00 0.00 H new ATOM 0 HG21 VAL A 131 3.258 12.094 6.369 1.00 0.00 H new ATOM 0 HG22 VAL A 131 1.961 10.919 6.044 1.00 0.00 H new ATOM 0 HG23 VAL A 131 3.006 11.480 4.718 1.00 0.00 H new ATOM 2068 N VAL A 132 -1.803 13.368 4.310 1.00 0.00 N ATOM 2069 CA VAL A 132 -2.881 14.333 3.999 1.00 0.00 C ATOM 2070 C VAL A 132 -3.306 15.188 5.207 1.00 0.00 C ATOM 2071 O VAL A 132 -3.676 16.344 5.010 1.00 0.00 O ATOM 2072 CB VAL A 132 -4.074 13.651 3.289 1.00 0.00 C ATOM 2073 CG1 VAL A 132 -4.975 12.827 4.197 1.00 0.00 C ATOM 2074 CG2 VAL A 132 -4.910 14.659 2.483 1.00 0.00 C ATOM 0 H VAL A 132 -2.134 12.507 4.745 1.00 0.00 H new ATOM 0 HA VAL A 132 -2.459 15.045 3.290 1.00 0.00 H new ATOM 0 HB VAL A 132 -3.607 12.940 2.608 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -5.782 12.389 3.609 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -4.393 12.032 4.663 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -5.397 13.469 4.970 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -5.738 14.141 1.999 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -5.302 15.424 3.153 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -4.283 15.128 1.725 1.00 0.00 H new ATOM 2084 N MET A 133 -3.179 14.674 6.444 1.00 0.00 N ATOM 2085 CA MET A 133 -3.294 15.461 7.691 1.00 0.00 C ATOM 2086 C MET A 133 -2.735 14.734 8.923 1.00 0.00 C ATOM 2087 O MET A 133 -2.801 13.510 9.010 1.00 0.00 O ATOM 2088 CB MET A 133 -4.729 15.973 7.944 1.00 0.00 C ATOM 2089 CG MET A 133 -5.776 14.875 8.138 1.00 0.00 C ATOM 2090 SD MET A 133 -7.462 15.458 8.459 1.00 0.00 S ATOM 2091 CE MET A 133 -7.903 16.054 6.805 1.00 0.00 C ATOM 0 H MET A 133 -2.991 13.685 6.611 1.00 0.00 H new ATOM 0 HA MET A 133 -2.662 16.335 7.532 1.00 0.00 H new ATOM 0 HB2 MET A 133 -4.722 16.610 8.829 1.00 0.00 H new ATOM 0 HB3 MET A 133 -5.030 16.599 7.104 1.00 0.00 H new ATOM 0 HG2 MET A 133 -5.790 14.248 7.247 1.00 0.00 H new ATOM 0 HG3 MET A 133 -5.464 14.242 8.968 1.00 0.00 H new ATOM 0 HE1 MET A 133 -8.951 16.352 6.793 1.00 0.00 H new ATOM 0 HE2 MET A 133 -7.280 16.911 6.549 1.00 0.00 H new ATOM 0 HE3 MET A 133 -7.744 15.258 6.077 1.00 0.00 H new ATOM 2101 N GLU A 134 -2.206 15.482 9.891 1.00 0.00 N ATOM 2102 CA GLU A 134 -1.666 14.942 11.144 1.00 0.00 C ATOM 2103 C GLU A 134 -2.755 14.887 12.227 1.00 0.00 C ATOM 2104 O GLU A 134 -3.468 15.873 12.453 1.00 0.00 O ATOM 2105 CB GLU A 134 -0.459 15.787 11.582 1.00 0.00 C ATOM 2106 CG GLU A 134 0.290 15.183 12.774 1.00 0.00 C ATOM 2107 CD GLU A 134 1.517 16.036 13.132 1.00 0.00 C ATOM 2108 OE1 GLU A 134 1.380 17.006 13.915 1.00 0.00 O ATOM 2109 OE2 GLU A 134 2.630 15.744 12.633 1.00 0.00 O ATOM 0 H GLU A 134 -2.138 16.498 9.828 1.00 0.00 H new ATOM 0 HA GLU A 134 -1.328 13.918 10.986 1.00 0.00 H new ATOM 0 HB2 GLU A 134 0.228 15.892 10.743 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -0.799 16.789 11.843 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -0.377 15.117 13.634 1.00 0.00 H new ATOM 0 HG3 GLU A 134 0.604 14.167 12.536 1.00 0.00 H new ATOM 2116 N LYS A 135 -2.891 13.727 12.883 1.00 0.00 N ATOM 2117 CA LYS A 135 -3.919 13.461 13.905 1.00 0.00 C ATOM 2118 C LYS A 135 -3.543 13.851 15.340 1.00 0.00 C ATOM 2119 O LYS A 135 -4.503 14.014 16.131 1.00 0.00 O ATOM 2120 CB LYS A 135 -4.335 11.981 13.831 1.00 0.00 C ATOM 2121 CG LYS A 135 -5.364 11.736 12.721 1.00 0.00 C ATOM 2122 CD LYS A 135 -6.737 12.389 12.952 1.00 0.00 C ATOM 2123 CE LYS A 135 -7.346 12.090 14.328 1.00 0.00 C ATOM 2124 NZ LYS A 135 -7.110 13.172 15.332 1.00 0.00 N ATOM 2125 OXT LYS A 135 -2.344 13.975 15.679 1.00 0.00 O ATOM 0 H LYS A 135 -2.278 12.929 12.717 1.00 0.00 H new ATOM 0 HA LYS A 135 -4.756 14.117 13.664 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -3.454 11.364 13.653 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -4.753 11.672 14.789 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -4.956 12.106 11.780 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -5.504 10.661 12.607 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -6.639 13.468 12.836 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -7.425 12.047 12.179 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -8.419 11.937 14.216 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -6.929 11.157 14.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -7.561 12.914 16.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -6.087 13.292 15.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -7.517 14.064 14.984 1.00 0.00 H new TER 2139 LYS A 135