USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 972 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 57 GLN : amide:sc= 0.169 K(o=0.94,f=0.28) USER MOD Set 1.2: A 93 THR OG1 : rot -174:sc= 0.77 USER MOD Set 2.1: A 84 SER OG : rot 67:sc= 0.12 USER MOD Set 2.2: A 123 TYR OH : rot 30:sc= 0.143 USER MOD Set 3.1: A 75 ASN :FLIP amide:sc= 0.0343 F(o=-0.64,f=0.022) USER MOD Set 3.2: A 104 ASN :FLIP amide:sc= -0.0123 F(o=-0.64,f=0.022) USER MOD Set 4.1: A 25 ASN : amide:sc= 0 X(o=1.2,f=1.2) USER MOD Set 4.2: A 31 SER OG : rot -172:sc= 1.24 USER MOD Single : A 1 GLY N :NH3+ -103:sc= 0.047 (180deg=0) USER MOD Single : A 2 MET CE :methyl 159:sc= -0.157 (180deg=-0.639) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0355) USER MOD Single : A 6 THR OG1 : rot -140:sc= -0.0467 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 TYR OH : rot 180:sc= -0.0158 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 92:sc= 1.4 USER MOD Single : A 18 LYS NZ :NH3+ -104:sc= 1.23 (180deg=-0.152) USER MOD Single : A 19 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0165) USER MOD Single : A 20 MET CE :methyl -139:sc= -1.79 (180deg=-6.01!) USER MOD Single : A 23 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.00856) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ -153:sc= 0.834 (180deg=-0.236) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0503) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= 0.0793 USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=-0.0088) USER MOD Single : A 61 ASN : amide:sc= -0.737 X(o=-0.74,f=-0.38) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= 0.147 X(o=0.15,f=-0.19) USER MOD Single : A 71 ASN : amide:sc= -0.125 X(o=-0.13,f=0) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 ASN : amide:sc= -0.331 K(o=-0.33,f=-3.3!) USER MOD Single : A 77 TYR OH : rot 5:sc= 1.26 USER MOD Single : A 88 SER OG : rot 180:sc=-0.00764 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 102 MET CE :methyl -177:sc= -0.0868 (180deg=-0.0978) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 TYR OH : rot 163:sc= 0.0404 USER MOD Single : A 111 SER OG : rot 30:sc= 1.27 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot -140:sc= 0 USER MOD Single : A 118 THR OG1 : rot -124:sc= 0.336 USER MOD Single : A 119 ASN :FLIP amide:sc= -0.144 F(o=-1.3,f=-0.14) USER MOD Single : A 120 HIS : no HE2:sc= -0.0678 X(o=-0.068,f=-0.25) USER MOD Single : A 121 LYS NZ :NH3+ -108:sc= 0.931 (180deg=0.0253) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 HIS : no HD1:sc= -0.131 K(o=-0.13,f=-0.75) USER MOD Single : A 128 ASN : amide:sc= 0.13 X(o=0.13,f=-0.18) USER MOD Single : A 135 ASN :FLIP amide:sc= -0.316 F(o=-0.98,f=-0.32) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ -170:sc= 0.126 (180deg=0.0661) USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -3.954 -25.642 -11.461 1.00 3.00 N ATOM 2 CA GLY A 1 -2.908 -24.690 -11.855 1.00 52.11 C ATOM 3 C GLY A 1 -2.138 -24.159 -10.656 1.00 61.52 C ATOM 4 O GLY A 1 -2.673 -24.112 -9.548 1.00 73.43 O ATOM 0 H1 GLY A 1 -3.635 -26.611 -11.661 1.00 3.00 H new ATOM 0 H2 GLY A 1 -4.147 -25.544 -10.444 1.00 3.00 H new ATOM 0 H3 GLY A 1 -4.822 -25.446 -11.998 1.00 3.00 H new ATOM 0 HA2 GLY A 1 -2.216 -25.176 -12.543 1.00 52.11 H new ATOM 0 HA3 GLY A 1 -3.360 -23.857 -12.393 1.00 52.11 H new ATOM 8 N MET A 2 -0.908 -23.694 -10.887 1.00 53.33 N ATOM 9 CA MET A 2 -0.085 -22.904 -9.984 1.00 23.44 C ATOM 10 C MET A 2 0.718 -21.891 -10.811 1.00 53.13 C ATOM 11 O MET A 2 1.447 -22.277 -11.731 1.00 43.25 O ATOM 12 CB MET A 2 0.894 -23.802 -9.215 1.00 20.54 C ATOM 13 CG MET A 2 0.202 -24.674 -8.164 1.00 22.33 C ATOM 14 SD MET A 2 1.330 -25.620 -7.104 1.00 34.34 S ATOM 15 CE MET A 2 2.219 -24.263 -6.289 1.00 42.13 C ATOM 0 H MET A 2 -0.434 -23.875 -11.772 1.00 53.33 H new ATOM 0 HA MET A 2 -0.732 -22.396 -9.269 1.00 23.44 H new ATOM 0 HB2 MET A 2 1.422 -24.443 -9.921 1.00 20.54 H new ATOM 0 HB3 MET A 2 1.644 -23.179 -8.727 1.00 20.54 H new ATOM 0 HG2 MET A 2 -0.418 -24.037 -7.534 1.00 22.33 H new ATOM 0 HG3 MET A 2 -0.467 -25.369 -8.671 1.00 22.33 H new ATOM 0 HE1 MET A 2 2.668 -24.626 -5.364 1.00 42.13 H new ATOM 0 HE2 MET A 2 3.001 -23.891 -6.951 1.00 42.13 H new ATOM 0 HE3 MET A 2 1.522 -23.456 -6.062 1.00 42.13 H new ATOM 23 N ALA A 3 0.608 -20.605 -10.474 1.00 14.03 N ATOM 24 CA ALA A 3 1.567 -19.560 -10.826 1.00 4.30 C ATOM 25 C ALA A 3 1.301 -18.359 -9.929 1.00 75.15 C ATOM 26 O ALA A 3 0.338 -17.620 -10.138 1.00 14.12 O ATOM 27 CB ALA A 3 1.445 -19.109 -12.280 1.00 51.22 C ATOM 0 H ALA A 3 -0.179 -20.252 -9.930 1.00 14.03 H new ATOM 0 HA ALA A 3 2.570 -19.966 -10.692 1.00 4.30 H new ATOM 0 HB1 ALA A 3 2.182 -18.332 -12.483 1.00 51.22 H new ATOM 0 HB2 ALA A 3 1.621 -19.958 -12.940 1.00 51.22 H new ATOM 0 HB3 ALA A 3 0.444 -18.714 -12.456 1.00 51.22 H new ATOM 33 N LYS A 4 2.123 -18.167 -8.906 1.00 71.14 N ATOM 34 CA LYS A 4 1.975 -17.035 -8.007 1.00 51.33 C ATOM 35 C LYS A 4 2.607 -15.797 -8.626 1.00 12.43 C ATOM 36 O LYS A 4 3.829 -15.634 -8.575 1.00 73.12 O ATOM 37 CB LYS A 4 2.552 -17.363 -6.634 1.00 41.13 C ATOM 38 CG LYS A 4 1.735 -18.488 -5.981 1.00 15.11 C ATOM 39 CD LYS A 4 2.121 -18.584 -4.513 1.00 61.14 C ATOM 40 CE LYS A 4 1.075 -19.312 -3.665 1.00 33.14 C ATOM 41 NZ LYS A 4 0.889 -20.721 -4.065 1.00 22.43 N ATOM 0 H LYS A 4 2.902 -18.785 -8.679 1.00 71.14 H new ATOM 0 HA LYS A 4 0.916 -16.822 -7.859 1.00 51.33 H new ATOM 0 HB2 LYS A 4 3.594 -17.667 -6.731 1.00 41.13 H new ATOM 0 HB3 LYS A 4 2.536 -16.475 -6.001 1.00 41.13 H new ATOM 0 HG2 LYS A 4 0.668 -18.286 -6.079 1.00 15.11 H new ATOM 0 HG3 LYS A 4 1.927 -19.435 -6.485 1.00 15.11 H new ATOM 0 HD2 LYS A 4 3.075 -19.104 -4.427 1.00 61.14 H new ATOM 0 HD3 LYS A 4 2.268 -17.580 -4.115 1.00 61.14 H new ATOM 0 HE2 LYS A 4 1.374 -19.274 -2.617 1.00 33.14 H new ATOM 0 HE3 LYS A 4 0.122 -18.788 -3.744 1.00 33.14 H new ATOM 0 HZ1 LYS A 4 0.170 -21.163 -3.457 1.00 22.43 H new ATOM 0 HZ2 LYS A 4 0.577 -20.762 -5.056 1.00 22.43 H new ATOM 0 HZ3 LYS A 4 1.789 -21.232 -3.964 1.00 22.43 H new ATOM 51 N LYS A 5 1.790 -14.965 -9.266 1.00 73.35 N ATOM 52 CA LYS A 5 2.207 -13.649 -9.738 1.00 44.02 C ATOM 53 C LYS A 5 2.233 -12.687 -8.572 1.00 1.43 C ATOM 54 O LYS A 5 1.569 -12.910 -7.557 1.00 43.01 O ATOM 55 CB LYS A 5 1.270 -13.032 -10.786 1.00 11.33 C ATOM 56 CG LYS A 5 0.819 -13.936 -11.915 1.00 40.31 C ATOM 57 CD LYS A 5 -0.446 -14.678 -11.510 1.00 61.22 C ATOM 58 CE LYS A 5 -0.723 -15.885 -12.401 1.00 42.34 C ATOM 59 NZ LYS A 5 -0.853 -15.506 -13.820 1.00 21.30 N ATOM 0 H LYS A 5 0.816 -15.186 -9.472 1.00 73.35 H new ATOM 0 HA LYS A 5 3.184 -13.800 -10.196 1.00 44.02 H new ATOM 0 HB2 LYS A 5 0.383 -12.661 -10.272 1.00 11.33 H new ATOM 0 HB3 LYS A 5 1.770 -12.167 -11.222 1.00 11.33 H new ATOM 0 HG2 LYS A 5 0.634 -13.346 -12.813 1.00 40.31 H new ATOM 0 HG3 LYS A 5 1.607 -14.649 -12.159 1.00 40.31 H new ATOM 0 HD2 LYS A 5 -0.355 -15.007 -10.475 1.00 61.22 H new ATOM 0 HD3 LYS A 5 -1.294 -13.995 -11.554 1.00 61.22 H new ATOM 0 HE2 LYS A 5 0.084 -16.609 -12.292 1.00 42.34 H new ATOM 0 HE3 LYS A 5 -1.639 -16.376 -12.072 1.00 42.34 H new ATOM 0 HZ1 LYS A 5 -1.141 -16.336 -14.376 1.00 21.30 H new ATOM 0 HZ2 LYS A 5 -1.571 -14.760 -13.916 1.00 21.30 H new ATOM 0 HZ3 LYS A 5 0.061 -15.154 -14.170 1.00 21.30 H new ATOM 69 N THR A 6 2.847 -11.548 -8.835 1.00 4.32 N ATOM 70 CA THR A 6 3.046 -10.477 -7.868 1.00 3.13 C ATOM 71 C THR A 6 2.868 -9.125 -8.570 1.00 72.32 C ATOM 72 O THR A 6 3.179 -9.013 -9.754 1.00 43.21 O ATOM 73 CB THR A 6 4.429 -10.649 -7.201 1.00 75.32 C ATOM 74 OG1 THR A 6 4.622 -12.016 -6.888 1.00 42.41 O ATOM 75 CG2 THR A 6 4.626 -9.768 -5.961 1.00 51.04 C ATOM 0 H THR A 6 3.234 -11.333 -9.754 1.00 4.32 H new ATOM 0 HA THR A 6 2.304 -10.517 -7.071 1.00 3.13 H new ATOM 0 HB THR A 6 5.182 -10.315 -7.915 1.00 75.32 H new ATOM 0 HG1 THR A 6 5.058 -12.093 -6.014 1.00 42.41 H new ATOM 0 HG21 THR A 6 5.619 -9.941 -5.545 1.00 51.04 H new ATOM 0 HG22 THR A 6 4.528 -8.719 -6.241 1.00 51.04 H new ATOM 0 HG23 THR A 6 3.872 -10.017 -5.214 1.00 51.04 H new ATOM 83 N LEU A 7 2.408 -8.084 -7.869 1.00 71.11 N ATOM 84 CA LEU A 7 2.332 -6.713 -8.385 1.00 2.00 C ATOM 85 C LEU A 7 2.827 -5.766 -7.300 1.00 71.54 C ATOM 86 O LEU A 7 2.572 -5.992 -6.112 1.00 3.42 O ATOM 87 CB LEU A 7 0.899 -6.421 -8.864 1.00 60.55 C ATOM 88 CG LEU A 7 0.552 -5.041 -9.474 1.00 62.12 C ATOM 89 CD1 LEU A 7 0.241 -3.986 -8.412 1.00 4.42 C ATOM 90 CD2 LEU A 7 1.542 -4.497 -10.516 1.00 0.41 C ATOM 0 H LEU A 7 2.072 -8.172 -6.910 1.00 71.11 H new ATOM 0 HA LEU A 7 2.973 -6.571 -9.255 1.00 2.00 H new ATOM 0 HB2 LEU A 7 0.646 -7.177 -9.607 1.00 60.55 H new ATOM 0 HB3 LEU A 7 0.235 -6.575 -8.013 1.00 60.55 H new ATOM 0 HG LEU A 7 -0.358 -5.250 -10.036 1.00 62.12 H new ATOM 0 HD11 LEU A 7 0.005 -3.039 -8.898 1.00 4.42 H new ATOM 0 HD12 LEU A 7 -0.612 -4.310 -7.816 1.00 4.42 H new ATOM 0 HD13 LEU A 7 1.108 -3.855 -7.764 1.00 4.42 H new ATOM 0 HD21 LEU A 7 1.197 -3.527 -10.873 1.00 0.41 H new ATOM 0 HD22 LEU A 7 2.526 -4.387 -10.060 1.00 0.41 H new ATOM 0 HD23 LEU A 7 1.606 -5.191 -11.354 1.00 0.41 H new ATOM 101 N ILE A 8 3.567 -4.741 -7.712 1.00 41.43 N ATOM 102 CA ILE A 8 4.191 -3.737 -6.870 1.00 15.14 C ATOM 103 C ILE A 8 3.697 -2.372 -7.365 1.00 31.43 C ATOM 104 O ILE A 8 3.698 -2.109 -8.574 1.00 41.05 O ATOM 105 CB ILE A 8 5.733 -3.867 -6.972 1.00 61.34 C ATOM 106 CG1 ILE A 8 6.247 -5.271 -6.554 1.00 22.54 C ATOM 107 CG2 ILE A 8 6.427 -2.792 -6.115 1.00 13.01 C ATOM 108 CD1 ILE A 8 7.613 -5.602 -7.160 1.00 3.01 C ATOM 0 H ILE A 8 3.756 -4.584 -8.702 1.00 41.43 H new ATOM 0 HA ILE A 8 3.928 -3.861 -5.819 1.00 15.14 H new ATOM 0 HB ILE A 8 5.984 -3.723 -8.023 1.00 61.34 H new ATOM 0 HG12 ILE A 8 6.314 -5.321 -5.467 1.00 22.54 H new ATOM 0 HG13 ILE A 8 5.524 -6.026 -6.863 1.00 22.54 H new ATOM 0 HG21 ILE A 8 7.508 -2.901 -6.200 1.00 13.01 H new ATOM 0 HG22 ILE A 8 6.133 -1.802 -6.465 1.00 13.01 H new ATOM 0 HG23 ILE A 8 6.132 -2.911 -5.073 1.00 13.01 H new ATOM 0 HD11 ILE A 8 7.924 -6.595 -6.835 1.00 3.01 H new ATOM 0 HD12 ILE A 8 7.543 -5.582 -8.248 1.00 3.01 H new ATOM 0 HD13 ILE A 8 8.346 -4.866 -6.830 1.00 3.01 H new ATOM 119 N LEU A 9 3.304 -1.497 -6.433 1.00 35.14 N ATOM 120 CA LEU A 9 3.083 -0.078 -6.678 1.00 75.45 C ATOM 121 C LEU A 9 3.831 0.765 -5.652 1.00 40.42 C ATOM 122 O LEU A 9 4.105 0.341 -4.524 1.00 24.20 O ATOM 123 CB LEU A 9 1.588 0.253 -6.577 1.00 21.41 C ATOM 124 CG LEU A 9 0.731 -0.280 -7.732 1.00 71.24 C ATOM 125 CD1 LEU A 9 -0.745 -0.091 -7.374 1.00 3.43 C ATOM 126 CD2 LEU A 9 1.036 0.406 -9.069 1.00 14.42 C ATOM 0 H LEU A 9 3.128 -1.768 -5.466 1.00 35.14 H new ATOM 0 HA LEU A 9 3.449 0.148 -7.679 1.00 75.45 H new ATOM 0 HB2 LEU A 9 1.203 -0.152 -5.641 1.00 21.41 H new ATOM 0 HB3 LEU A 9 1.473 1.336 -6.527 1.00 21.41 H new ATOM 0 HG LEU A 9 0.969 -1.336 -7.864 1.00 71.24 H new ATOM 0 HD11 LEU A 9 -1.367 -0.466 -8.187 1.00 3.43 H new ATOM 0 HD12 LEU A 9 -0.971 -0.641 -6.460 1.00 3.43 H new ATOM 0 HD13 LEU A 9 -0.949 0.969 -7.220 1.00 3.43 H new ATOM 0 HD21 LEU A 9 0.398 -0.014 -9.847 1.00 14.42 H new ATOM 0 HD22 LEU A 9 0.845 1.476 -8.981 1.00 14.42 H new ATOM 0 HD23 LEU A 9 2.082 0.244 -9.331 1.00 14.42 H new ATOM 137 N TYR A 10 4.094 2.017 -6.021 1.00 24.53 N ATOM 138 CA TYR A 10 4.678 3.025 -5.158 1.00 13.12 C ATOM 139 C TYR A 10 4.165 4.411 -5.556 1.00 74.13 C ATOM 140 O TYR A 10 3.740 4.613 -6.696 1.00 44.45 O ATOM 141 CB TYR A 10 6.207 2.962 -5.278 1.00 31.10 C ATOM 142 CG TYR A 10 6.751 3.188 -6.680 1.00 14.20 C ATOM 143 CD1 TYR A 10 6.899 4.487 -7.205 1.00 41.31 C ATOM 144 CD2 TYR A 10 7.108 2.085 -7.467 1.00 20.11 C ATOM 145 CE1 TYR A 10 7.451 4.687 -8.484 1.00 21.51 C ATOM 146 CE2 TYR A 10 7.661 2.274 -8.742 1.00 13.31 C ATOM 147 CZ TYR A 10 7.847 3.575 -9.261 1.00 2.33 C ATOM 148 OH TYR A 10 8.403 3.729 -10.497 1.00 35.44 O ATOM 0 H TYR A 10 3.898 2.362 -6.960 1.00 24.53 H new ATOM 0 HA TYR A 10 4.392 2.837 -4.123 1.00 13.12 H new ATOM 0 HB2 TYR A 10 6.640 3.708 -4.612 1.00 31.10 H new ATOM 0 HB3 TYR A 10 6.544 1.987 -4.926 1.00 31.10 H new ATOM 0 HD1 TYR A 10 6.585 5.339 -6.620 1.00 41.31 H new ATOM 0 HD2 TYR A 10 6.957 1.084 -7.090 1.00 20.11 H new ATOM 0 HE1 TYR A 10 7.572 5.688 -8.871 1.00 21.51 H new ATOM 0 HE2 TYR A 10 7.948 1.417 -9.333 1.00 13.31 H new ATOM 0 HH TYR A 10 8.610 2.849 -10.875 1.00 35.44 H new ATOM 157 N TYR A 11 4.289 5.379 -4.643 1.00 4.34 N ATOM 158 CA TYR A 11 4.035 6.797 -4.872 1.00 32.34 C ATOM 159 C TYR A 11 5.175 7.571 -4.204 1.00 71.12 C ATOM 160 O TYR A 11 5.120 7.846 -3.007 1.00 31.34 O ATOM 161 CB TYR A 11 2.641 7.177 -4.336 1.00 3.23 C ATOM 162 CG TYR A 11 2.285 8.660 -4.337 1.00 63.44 C ATOM 163 CD1 TYR A 11 1.645 9.248 -5.446 1.00 51.13 C ATOM 164 CD2 TYR A 11 2.543 9.448 -3.197 1.00 54.21 C ATOM 165 CE1 TYR A 11 1.270 10.606 -5.417 1.00 63.41 C ATOM 166 CE2 TYR A 11 2.151 10.797 -3.152 1.00 35.34 C ATOM 167 CZ TYR A 11 1.500 11.384 -4.259 1.00 33.13 C ATOM 168 OH TYR A 11 1.092 12.683 -4.189 1.00 22.41 O ATOM 0 H TYR A 11 4.582 5.184 -3.686 1.00 4.34 H new ATOM 0 HA TYR A 11 4.019 7.045 -5.933 1.00 32.34 H new ATOM 0 HB2 TYR A 11 1.894 6.648 -4.927 1.00 3.23 H new ATOM 0 HB3 TYR A 11 2.558 6.808 -3.314 1.00 3.23 H new ATOM 0 HD1 TYR A 11 1.440 8.654 -6.324 1.00 51.13 H new ATOM 0 HD2 TYR A 11 3.048 9.010 -2.348 1.00 54.21 H new ATOM 0 HE1 TYR A 11 0.805 11.054 -6.283 1.00 63.41 H new ATOM 0 HE2 TYR A 11 2.348 11.386 -2.269 1.00 35.34 H new ATOM 0 HH TYR A 11 1.336 13.056 -3.316 1.00 22.41 H new ATOM 177 N SER A 12 6.225 7.858 -4.974 1.00 71.22 N ATOM 178 CA SER A 12 7.300 8.814 -4.689 1.00 73.41 C ATOM 179 C SER A 12 8.148 8.975 -5.970 1.00 31.11 C ATOM 180 O SER A 12 9.374 9.046 -5.934 1.00 21.13 O ATOM 181 CB SER A 12 8.104 8.435 -3.429 1.00 63.12 C ATOM 182 OG SER A 12 8.328 9.549 -2.582 1.00 33.53 O ATOM 0 H SER A 12 6.358 7.398 -5.875 1.00 71.22 H new ATOM 0 HA SER A 12 6.885 9.789 -4.435 1.00 73.41 H new ATOM 0 HB2 SER A 12 7.568 7.663 -2.877 1.00 63.12 H new ATOM 0 HB3 SER A 12 9.062 8.008 -3.726 1.00 63.12 H new ATOM 0 HG SER A 12 8.839 9.265 -1.796 1.00 33.53 H new ATOM 187 N TRP A 13 7.474 9.019 -7.126 1.00 24.31 N ATOM 188 CA TRP A 13 8.018 9.227 -8.464 1.00 31.44 C ATOM 189 C TRP A 13 9.166 8.281 -8.839 1.00 64.32 C ATOM 190 O TRP A 13 9.466 7.289 -8.170 1.00 71.55 O ATOM 191 CB TRP A 13 8.332 10.722 -8.675 1.00 31.53 C ATOM 192 CG TRP A 13 7.947 11.300 -10.009 1.00 42.14 C ATOM 193 CD1 TRP A 13 6.677 11.576 -10.388 1.00 23.51 C ATOM 194 CD2 TRP A 13 8.797 11.818 -11.084 1.00 63.14 C ATOM 195 NE1 TRP A 13 6.685 12.241 -11.599 1.00 31.20 N ATOM 196 CE2 TRP A 13 7.965 12.442 -12.060 1.00 21.44 C ATOM 197 CE3 TRP A 13 10.188 11.878 -11.314 1.00 51.03 C ATOM 198 CZ2 TRP A 13 8.485 13.117 -13.176 1.00 34.41 C ATOM 199 CZ3 TRP A 13 10.724 12.575 -12.413 1.00 73.41 C ATOM 200 CH2 TRP A 13 9.876 13.201 -13.342 1.00 74.23 C ATOM 0 H TRP A 13 6.461 8.901 -7.147 1.00 24.31 H new ATOM 0 HA TRP A 13 7.245 8.946 -9.179 1.00 31.44 H new ATOM 0 HB2 TRP A 13 7.825 11.292 -7.896 1.00 31.53 H new ATOM 0 HB3 TRP A 13 9.403 10.870 -8.533 1.00 31.53 H new ATOM 0 HD1 TRP A 13 5.791 11.316 -9.828 1.00 23.51 H new ATOM 0 HE1 TRP A 13 5.845 12.545 -12.091 1.00 31.20 H new ATOM 0 HE3 TRP A 13 10.857 11.377 -10.630 1.00 51.03 H new ATOM 0 HZ2 TRP A 13 7.821 13.567 -13.899 1.00 34.41 H new ATOM 0 HZ3 TRP A 13 11.795 12.629 -12.543 1.00 73.41 H new ATOM 0 HH2 TRP A 13 10.292 13.743 -14.178 1.00 74.23 H new ATOM 210 N SER A 14 9.775 8.550 -9.989 1.00 63.43 N ATOM 211 CA SER A 14 10.813 7.749 -10.618 1.00 61.55 C ATOM 212 C SER A 14 12.201 7.950 -9.990 1.00 42.23 C ATOM 213 O SER A 14 13.196 7.901 -10.710 1.00 3.13 O ATOM 214 CB SER A 14 10.825 8.108 -12.104 1.00 4.40 C ATOM 215 OG SER A 14 9.524 7.957 -12.652 1.00 42.35 O ATOM 0 H SER A 14 9.543 9.379 -10.536 1.00 63.43 H new ATOM 0 HA SER A 14 10.586 6.694 -10.467 1.00 61.55 H new ATOM 0 HB2 SER A 14 11.167 9.135 -12.235 1.00 4.40 H new ATOM 0 HB3 SER A 14 11.529 7.467 -12.635 1.00 4.40 H new ATOM 0 HG SER A 14 9.541 8.191 -13.604 1.00 42.35 H new ATOM 220 N GLY A 15 12.291 8.174 -8.679 1.00 71.42 N ATOM 221 CA GLY A 15 13.567 8.290 -7.993 1.00 44.13 C ATOM 222 C GLY A 15 13.439 7.765 -6.576 1.00 63.32 C ATOM 223 O GLY A 15 13.925 6.675 -6.269 1.00 41.35 O ATOM 0 H GLY A 15 11.481 8.279 -8.069 1.00 71.42 H new ATOM 0 HA2 GLY A 15 14.331 7.729 -8.531 1.00 44.13 H new ATOM 0 HA3 GLY A 15 13.888 9.332 -7.977 1.00 44.13 H new ATOM 227 N GLU A 16 12.754 8.522 -5.723 1.00 33.42 N ATOM 228 CA GLU A 16 12.651 8.280 -4.292 1.00 33.12 C ATOM 229 C GLU A 16 12.249 6.831 -3.984 1.00 32.14 C ATOM 230 O GLU A 16 13.045 6.107 -3.385 1.00 42.43 O ATOM 231 CB GLU A 16 11.734 9.341 -3.658 1.00 71.12 C ATOM 232 CG GLU A 16 12.528 10.449 -2.956 1.00 2.20 C ATOM 233 CD GLU A 16 13.028 9.964 -1.604 1.00 53.24 C ATOM 234 OE1 GLU A 16 14.098 9.319 -1.535 1.00 2.14 O ATOM 235 OE2 GLU A 16 12.300 10.172 -0.603 1.00 42.23 O ATOM 0 H GLU A 16 12.238 9.349 -6.023 1.00 33.42 H new ATOM 0 HA GLU A 16 13.632 8.390 -3.830 1.00 33.12 H new ATOM 0 HB2 GLU A 16 11.104 9.782 -4.430 1.00 71.12 H new ATOM 0 HB3 GLU A 16 11.070 8.862 -2.939 1.00 71.12 H new ATOM 0 HG2 GLU A 16 13.372 10.750 -3.577 1.00 2.20 H new ATOM 0 HG3 GLU A 16 11.899 11.329 -2.824 1.00 2.20 H new ATOM 240 N THR A 17 11.082 6.363 -4.427 1.00 61.24 N ATOM 241 CA THR A 17 10.673 4.973 -4.192 1.00 73.52 C ATOM 242 C THR A 17 11.182 3.988 -5.255 1.00 60.13 C ATOM 243 O THR A 17 11.008 2.775 -5.092 1.00 40.32 O ATOM 244 CB THR A 17 9.143 4.883 -4.098 1.00 2.34 C ATOM 245 OG1 THR A 17 8.528 5.759 -5.026 1.00 62.12 O ATOM 246 CG2 THR A 17 8.623 5.213 -2.697 1.00 41.01 C ATOM 0 H THR A 17 10.405 6.920 -4.948 1.00 61.24 H new ATOM 0 HA THR A 17 11.134 4.678 -3.249 1.00 73.52 H new ATOM 0 HB THR A 17 8.885 3.849 -4.329 1.00 2.34 H new ATOM 0 HG1 THR A 17 8.365 5.283 -5.867 1.00 62.12 H new ATOM 0 HG21 THR A 17 7.536 5.135 -2.685 1.00 41.01 H new ATOM 0 HG22 THR A 17 9.046 4.512 -1.978 1.00 41.01 H new ATOM 0 HG23 THR A 17 8.917 6.228 -2.430 1.00 41.01 H new ATOM 254 N LYS A 18 11.761 4.478 -6.358 1.00 24.13 N ATOM 255 CA LYS A 18 12.059 3.665 -7.540 1.00 35.34 C ATOM 256 C LYS A 18 12.986 2.510 -7.183 1.00 24.21 C ATOM 257 O LYS A 18 12.703 1.375 -7.559 1.00 3.04 O ATOM 258 CB LYS A 18 12.640 4.562 -8.647 1.00 11.10 C ATOM 259 CG LYS A 18 12.978 3.801 -9.938 1.00 43.41 C ATOM 260 CD LYS A 18 13.421 4.762 -11.048 1.00 33.50 C ATOM 261 CE LYS A 18 13.918 4.044 -12.306 1.00 63.22 C ATOM 262 NZ LYS A 18 12.827 3.375 -13.046 1.00 11.43 N ATOM 0 H LYS A 18 12.037 5.455 -6.454 1.00 24.13 H new ATOM 0 HA LYS A 18 11.139 3.219 -7.918 1.00 35.34 H new ATOM 0 HB2 LYS A 18 11.925 5.352 -8.877 1.00 11.10 H new ATOM 0 HB3 LYS A 18 13.542 5.048 -8.274 1.00 11.10 H new ATOM 0 HG2 LYS A 18 13.770 3.079 -9.741 1.00 43.41 H new ATOM 0 HG3 LYS A 18 12.107 3.236 -10.269 1.00 43.41 H new ATOM 0 HD2 LYS A 18 12.585 5.410 -11.314 1.00 33.50 H new ATOM 0 HD3 LYS A 18 14.214 5.405 -10.667 1.00 33.50 H new ATOM 0 HE2 LYS A 18 14.408 4.764 -12.961 1.00 63.22 H new ATOM 0 HE3 LYS A 18 14.669 3.305 -12.026 1.00 63.22 H new ATOM 0 HZ1 LYS A 18 12.868 2.350 -12.874 1.00 11.43 H new ATOM 0 HZ2 LYS A 18 11.910 3.744 -12.722 1.00 11.43 H new ATOM 0 HZ3 LYS A 18 12.934 3.559 -14.064 1.00 11.43 H new ATOM 272 N LYS A 19 14.068 2.796 -6.454 1.00 63.54 N ATOM 273 CA LYS A 19 15.100 1.843 -6.080 1.00 51.25 C ATOM 274 C LYS A 19 14.495 0.581 -5.477 1.00 73.13 C ATOM 275 O LYS A 19 14.679 -0.515 -6.002 1.00 75.13 O ATOM 276 CB LYS A 19 16.048 2.554 -5.090 1.00 51.45 C ATOM 277 CG LYS A 19 17.461 2.781 -5.640 1.00 14.22 C ATOM 278 CD LYS A 19 18.439 1.648 -5.299 1.00 34.11 C ATOM 279 CE LYS A 19 18.674 1.571 -3.790 1.00 60.25 C ATOM 280 NZ LYS A 19 19.478 2.689 -3.269 1.00 15.43 N ATOM 0 H LYS A 19 14.250 3.734 -6.098 1.00 63.54 H new ATOM 0 HA LYS A 19 15.656 1.518 -6.959 1.00 51.25 H new ATOM 0 HB2 LYS A 19 15.616 3.516 -4.816 1.00 51.45 H new ATOM 0 HB3 LYS A 19 16.114 1.963 -4.177 1.00 51.45 H new ATOM 0 HG2 LYS A 19 17.408 2.891 -6.723 1.00 14.22 H new ATOM 0 HG3 LYS A 19 17.851 3.719 -5.243 1.00 14.22 H new ATOM 0 HD2 LYS A 19 18.043 0.699 -5.659 1.00 34.11 H new ATOM 0 HD3 LYS A 19 19.387 1.813 -5.812 1.00 34.11 H new ATOM 0 HE2 LYS A 19 17.711 1.556 -3.279 1.00 60.25 H new ATOM 0 HE3 LYS A 19 19.174 0.632 -3.554 1.00 60.25 H new ATOM 0 HZ1 LYS A 19 19.687 2.527 -2.263 1.00 15.43 H new ATOM 0 HZ2 LYS A 19 20.369 2.754 -3.802 1.00 15.43 H new ATOM 0 HZ3 LYS A 19 18.947 3.577 -3.373 1.00 15.43 H new ATOM 290 N MET A 20 13.780 0.737 -4.364 1.00 52.23 N ATOM 291 CA MET A 20 13.250 -0.376 -3.590 1.00 62.33 C ATOM 292 C MET A 20 12.290 -1.219 -4.441 1.00 4.02 C ATOM 293 O MET A 20 12.333 -2.449 -4.413 1.00 20.24 O ATOM 294 CB MET A 20 12.549 0.198 -2.344 1.00 73.33 C ATOM 295 CG MET A 20 12.686 -0.537 -1.011 1.00 3.04 C ATOM 296 SD MET A 20 12.385 -2.303 -1.070 1.00 4.41 S ATOM 297 CE MET A 20 14.094 -2.823 -1.294 1.00 60.43 C ATOM 0 H MET A 20 13.552 1.651 -3.973 1.00 52.23 H new ATOM 0 HA MET A 20 14.057 -1.039 -3.278 1.00 62.33 H new ATOM 0 HB2 MET A 20 12.916 1.214 -2.199 1.00 73.33 H new ATOM 0 HB3 MET A 20 11.485 0.273 -2.570 1.00 73.33 H new ATOM 0 HG2 MET A 20 13.692 -0.370 -0.626 1.00 3.04 H new ATOM 0 HG3 MET A 20 11.993 -0.091 -0.297 1.00 3.04 H new ATOM 0 HE1 MET A 20 14.135 -3.634 -2.021 1.00 60.43 H new ATOM 0 HE2 MET A 20 14.686 -1.982 -1.654 1.00 60.43 H new ATOM 0 HE3 MET A 20 14.497 -3.169 -0.342 1.00 60.43 H new ATOM 305 N ALA A 21 11.427 -0.548 -5.210 1.00 41.03 N ATOM 306 CA ALA A 21 10.427 -1.203 -6.040 1.00 64.52 C ATOM 307 C ALA A 21 11.093 -2.045 -7.150 1.00 53.45 C ATOM 308 O ALA A 21 10.759 -3.216 -7.335 1.00 0.14 O ATOM 309 CB ALA A 21 9.494 -0.132 -6.593 1.00 11.03 C ATOM 0 H ALA A 21 11.407 0.470 -5.270 1.00 41.03 H new ATOM 0 HA ALA A 21 9.841 -1.906 -5.448 1.00 64.52 H new ATOM 0 HB1 ALA A 21 8.734 -0.599 -7.220 1.00 11.03 H new ATOM 0 HB2 ALA A 21 9.012 0.392 -5.768 1.00 11.03 H new ATOM 0 HB3 ALA A 21 10.068 0.579 -7.188 1.00 11.03 H new ATOM 315 N GLU A 22 12.063 -1.465 -7.869 1.00 42.44 N ATOM 316 CA GLU A 22 12.846 -2.126 -8.919 1.00 2.31 C ATOM 317 C GLU A 22 13.655 -3.296 -8.347 1.00 0.21 C ATOM 318 O GLU A 22 13.831 -4.304 -9.033 1.00 64.15 O ATOM 319 CB GLU A 22 13.798 -1.125 -9.604 1.00 21.43 C ATOM 320 CG GLU A 22 13.071 -0.036 -10.409 1.00 4.32 C ATOM 321 CD GLU A 22 13.037 -0.277 -11.924 1.00 71.12 C ATOM 322 OE1 GLU A 22 12.660 -1.377 -12.385 1.00 20.50 O ATOM 323 OE2 GLU A 22 13.428 0.667 -12.662 1.00 40.03 O ATOM 0 H GLU A 22 12.332 -0.491 -7.731 1.00 42.44 H new ATOM 0 HA GLU A 22 12.145 -2.512 -9.658 1.00 2.31 H new ATOM 0 HB2 GLU A 22 14.419 -0.650 -8.845 1.00 21.43 H new ATOM 0 HB3 GLU A 22 14.468 -1.670 -10.269 1.00 21.43 H new ATOM 0 HG2 GLU A 22 12.047 0.044 -10.044 1.00 4.32 H new ATOM 0 HG3 GLU A 22 13.554 0.922 -10.218 1.00 4.32 H new ATOM 328 N LYS A 23 14.134 -3.183 -7.099 1.00 63.35 N ATOM 329 CA LYS A 23 14.760 -4.290 -6.379 1.00 22.50 C ATOM 330 C LYS A 23 13.766 -5.435 -6.299 1.00 42.23 C ATOM 331 O LYS A 23 13.960 -6.442 -6.971 1.00 44.24 O ATOM 332 CB LYS A 23 15.250 -3.869 -4.975 1.00 44.04 C ATOM 333 CG LYS A 23 16.763 -3.764 -4.864 1.00 33.34 C ATOM 334 CD LYS A 23 17.285 -2.360 -5.123 1.00 21.54 C ATOM 335 CE LYS A 23 17.403 -2.068 -6.616 1.00 22.51 C ATOM 336 NZ LYS A 23 18.590 -2.697 -7.219 1.00 24.44 N ATOM 0 H LYS A 23 14.095 -2.316 -6.563 1.00 63.35 H new ATOM 0 HA LYS A 23 15.649 -4.610 -6.923 1.00 22.50 H new ATOM 0 HB2 LYS A 23 14.808 -2.906 -4.719 1.00 44.04 H new ATOM 0 HB3 LYS A 23 14.890 -4.591 -4.242 1.00 44.04 H new ATOM 0 HG2 LYS A 23 17.071 -4.081 -3.868 1.00 33.34 H new ATOM 0 HG3 LYS A 23 17.222 -4.452 -5.574 1.00 33.34 H new ATOM 0 HD2 LYS A 23 16.617 -1.633 -4.662 1.00 21.54 H new ATOM 0 HD3 LYS A 23 18.260 -2.242 -4.651 1.00 21.54 H new ATOM 0 HE2 LYS A 23 16.508 -2.425 -7.125 1.00 22.51 H new ATOM 0 HE3 LYS A 23 17.449 -0.990 -6.770 1.00 22.51 H new ATOM 0 HZ1 LYS A 23 18.673 -2.401 -8.213 1.00 24.44 H new ATOM 0 HZ2 LYS A 23 19.441 -2.403 -6.698 1.00 24.44 H new ATOM 0 HZ3 LYS A 23 18.496 -3.732 -7.173 1.00 24.44 H new ATOM 346 N ILE A 24 12.703 -5.282 -5.506 1.00 33.21 N ATOM 347 CA ILE A 24 11.818 -6.391 -5.153 1.00 55.02 C ATOM 348 C ILE A 24 11.217 -7.027 -6.413 1.00 2.22 C ATOM 349 O ILE A 24 11.076 -8.245 -6.456 1.00 21.21 O ATOM 350 CB ILE A 24 10.765 -5.900 -4.131 1.00 64.25 C ATOM 351 CG1 ILE A 24 11.485 -5.581 -2.793 1.00 1.21 C ATOM 352 CG2 ILE A 24 9.665 -6.946 -3.879 1.00 60.44 C ATOM 353 CD1 ILE A 24 10.599 -5.138 -1.619 1.00 34.33 C ATOM 0 H ILE A 24 12.433 -4.389 -5.093 1.00 33.21 H new ATOM 0 HA ILE A 24 12.381 -7.188 -4.668 1.00 55.02 H new ATOM 0 HB ILE A 24 10.283 -5.012 -4.541 1.00 64.25 H new ATOM 0 HG12 ILE A 24 12.039 -6.468 -2.485 1.00 1.21 H new ATOM 0 HG13 ILE A 24 12.218 -4.797 -2.980 1.00 1.21 H new ATOM 0 HG21 ILE A 24 8.950 -6.555 -3.155 1.00 60.44 H new ATOM 0 HG22 ILE A 24 9.151 -7.166 -4.815 1.00 60.44 H new ATOM 0 HG23 ILE A 24 10.114 -7.859 -3.489 1.00 60.44 H new ATOM 0 HD11 ILE A 24 11.222 -4.946 -0.745 1.00 34.33 H new ATOM 0 HD12 ILE A 24 10.064 -4.228 -1.890 1.00 34.33 H new ATOM 0 HD13 ILE A 24 9.882 -5.925 -1.387 1.00 34.33 H new ATOM 364 N ASN A 25 10.911 -6.237 -7.448 1.00 4.44 N ATOM 365 CA ASN A 25 10.485 -6.755 -8.742 1.00 3.41 C ATOM 366 C ASN A 25 11.426 -7.852 -9.256 1.00 63.12 C ATOM 367 O ASN A 25 10.957 -8.940 -9.583 1.00 42.44 O ATOM 368 CB ASN A 25 10.362 -5.606 -9.746 1.00 1.33 C ATOM 369 CG ASN A 25 10.243 -6.153 -11.164 1.00 55.22 C ATOM 370 OD1 ASN A 25 11.146 -6.000 -11.975 1.00 41.32 O ATOM 371 ND2 ASN A 25 9.168 -6.858 -11.477 1.00 15.31 N ATOM 0 H ASN A 25 10.954 -5.219 -7.406 1.00 4.44 H new ATOM 0 HA ASN A 25 9.506 -7.219 -8.620 1.00 3.41 H new ATOM 0 HB2 ASN A 25 9.489 -4.999 -9.509 1.00 1.33 H new ATOM 0 HB3 ASN A 25 11.233 -4.955 -9.672 1.00 1.33 H new ATOM 0 HD21 ASN A 25 9.086 -7.280 -12.402 1.00 15.31 H new ATOM 0 HD22 ASN A 25 8.421 -6.979 -10.793 1.00 15.31 H new ATOM 377 N SER A 26 12.727 -7.573 -9.338 1.00 54.05 N ATOM 378 CA SER A 26 13.727 -8.462 -9.918 1.00 2.10 C ATOM 379 C SER A 26 13.897 -9.765 -9.120 1.00 62.15 C ATOM 380 O SER A 26 14.315 -10.781 -9.681 1.00 63.14 O ATOM 381 CB SER A 26 15.038 -7.661 -9.992 1.00 55.24 C ATOM 382 OG SER A 26 16.090 -8.393 -10.590 1.00 55.14 O ATOM 0 H SER A 26 13.122 -6.698 -8.993 1.00 54.05 H new ATOM 0 HA SER A 26 13.411 -8.785 -10.910 1.00 2.10 H new ATOM 0 HB2 SER A 26 14.869 -6.746 -10.560 1.00 55.24 H new ATOM 0 HB3 SER A 26 15.334 -7.362 -8.986 1.00 55.24 H new ATOM 0 HG SER A 26 16.900 -7.841 -10.615 1.00 55.14 H new ATOM 387 N GLU A 27 13.610 -9.735 -7.815 1.00 2.02 N ATOM 388 CA GLU A 27 13.896 -10.823 -6.879 1.00 74.14 C ATOM 389 C GLU A 27 12.780 -11.880 -6.898 1.00 41.23 C ATOM 390 O GLU A 27 12.871 -12.904 -6.211 1.00 24.13 O ATOM 391 CB GLU A 27 14.033 -10.251 -5.455 1.00 31.43 C ATOM 392 CG GLU A 27 15.005 -9.068 -5.300 1.00 60.24 C ATOM 393 CD GLU A 27 16.492 -9.410 -5.185 1.00 11.21 C ATOM 394 OE1 GLU A 27 16.966 -10.456 -5.695 1.00 61.45 O ATOM 395 OE2 GLU A 27 17.245 -8.588 -4.611 1.00 60.32 O ATOM 0 H GLU A 27 13.162 -8.934 -7.371 1.00 2.02 H new ATOM 0 HA GLU A 27 14.827 -11.301 -7.184 1.00 74.14 H new ATOM 0 HB2 GLU A 27 13.047 -9.934 -5.115 1.00 31.43 H new ATOM 0 HB3 GLU A 27 14.357 -11.053 -4.791 1.00 31.43 H new ATOM 0 HG2 GLU A 27 14.874 -8.405 -6.156 1.00 60.24 H new ATOM 0 HG3 GLU A 27 14.716 -8.504 -4.413 1.00 60.24 H new ATOM 400 N ILE A 28 11.706 -11.633 -7.652 1.00 13.34 N ATOM 401 CA ILE A 28 10.462 -12.399 -7.613 1.00 35.31 C ATOM 402 C ILE A 28 10.111 -12.858 -9.027 1.00 4.33 C ATOM 403 O ILE A 28 10.140 -12.074 -9.975 1.00 61.23 O ATOM 404 CB ILE A 28 9.350 -11.527 -6.985 1.00 55.41 C ATOM 405 CG1 ILE A 28 9.719 -11.122 -5.538 1.00 31.12 C ATOM 406 CG2 ILE A 28 8.011 -12.274 -6.956 1.00 42.11 C ATOM 407 CD1 ILE A 28 8.684 -10.217 -4.869 1.00 52.43 C ATOM 0 H ILE A 28 11.679 -10.869 -8.328 1.00 13.34 H new ATOM 0 HA ILE A 28 10.573 -13.290 -6.995 1.00 35.31 H new ATOM 0 HB ILE A 28 9.255 -10.635 -7.604 1.00 55.41 H new ATOM 0 HG12 ILE A 28 9.842 -12.024 -4.938 1.00 31.12 H new ATOM 0 HG13 ILE A 28 10.682 -10.612 -5.548 1.00 31.12 H new ATOM 0 HG21 ILE A 28 7.248 -11.636 -6.509 1.00 42.11 H new ATOM 0 HG22 ILE A 28 7.717 -12.533 -7.973 1.00 42.11 H new ATOM 0 HG23 ILE A 28 8.115 -13.184 -6.365 1.00 42.11 H new ATOM 0 HD11 ILE A 28 9.011 -9.975 -3.858 1.00 52.43 H new ATOM 0 HD12 ILE A 28 8.578 -9.298 -5.445 1.00 52.43 H new ATOM 0 HD13 ILE A 28 7.724 -10.732 -4.826 1.00 52.43 H new ATOM 418 N LYS A 29 9.732 -14.130 -9.177 1.00 22.52 N ATOM 419 CA LYS A 29 9.217 -14.651 -10.434 1.00 32.23 C ATOM 420 C LYS A 29 7.839 -14.072 -10.679 1.00 60.42 C ATOM 421 O LYS A 29 7.038 -14.012 -9.745 1.00 34.10 O ATOM 422 CB LYS A 29 9.097 -16.180 -10.352 1.00 31.30 C ATOM 423 CG LYS A 29 10.061 -16.892 -11.297 1.00 34.34 C ATOM 424 CD LYS A 29 11.494 -16.888 -10.760 1.00 43.41 C ATOM 425 CE LYS A 29 12.427 -17.473 -11.820 1.00 72.51 C ATOM 426 NZ LYS A 29 13.622 -18.090 -11.217 1.00 41.02 N ATOM 0 H LYS A 29 9.776 -14.822 -8.429 1.00 22.52 H new ATOM 0 HA LYS A 29 9.895 -14.378 -11.242 1.00 32.23 H new ATOM 0 HB2 LYS A 29 9.291 -16.502 -9.329 1.00 31.30 H new ATOM 0 HB3 LYS A 29 8.075 -16.475 -10.591 1.00 31.30 H new ATOM 0 HG2 LYS A 29 9.731 -17.920 -11.444 1.00 34.34 H new ATOM 0 HG3 LYS A 29 10.038 -16.407 -12.273 1.00 34.34 H new ATOM 0 HD2 LYS A 29 11.799 -15.872 -10.510 1.00 43.41 H new ATOM 0 HD3 LYS A 29 11.553 -17.473 -9.842 1.00 43.41 H new ATOM 0 HE2 LYS A 29 11.889 -18.219 -12.406 1.00 72.51 H new ATOM 0 HE3 LYS A 29 12.733 -16.686 -12.509 1.00 72.51 H new ATOM 0 HZ1 LYS A 29 14.230 -18.475 -11.968 1.00 41.02 H new ATOM 0 HZ2 LYS A 29 14.149 -17.373 -10.679 1.00 41.02 H new ATOM 0 HZ3 LYS A 29 13.332 -18.858 -10.579 1.00 41.02 H new ATOM 436 N ASP A 30 7.517 -13.789 -11.940 1.00 1.21 N ATOM 437 CA ASP A 30 6.146 -13.501 -12.375 1.00 12.23 C ATOM 438 C ASP A 30 5.588 -12.243 -11.687 1.00 52.11 C ATOM 439 O ASP A 30 4.376 -12.044 -11.594 1.00 3.33 O ATOM 440 CB ASP A 30 5.290 -14.762 -12.163 1.00 61.33 C ATOM 441 CG ASP A 30 4.179 -15.007 -13.177 1.00 55.33 C ATOM 442 OD1 ASP A 30 3.851 -14.154 -14.033 1.00 51.14 O ATOM 443 OD2 ASP A 30 3.705 -16.169 -13.188 1.00 72.33 O ATOM 0 H ASP A 30 8.202 -13.752 -12.695 1.00 1.21 H new ATOM 0 HA ASP A 30 6.127 -13.262 -13.438 1.00 12.23 H new ATOM 0 HB2 ASP A 30 5.952 -15.628 -12.166 1.00 61.33 H new ATOM 0 HB3 ASP A 30 4.841 -14.707 -11.171 1.00 61.33 H new ATOM 447 N SER A 31 6.477 -11.399 -11.152 1.00 0.21 N ATOM 448 CA SER A 31 6.159 -10.096 -10.615 1.00 32.40 C ATOM 449 C SER A 31 5.814 -9.117 -11.740 1.00 35.33 C ATOM 450 O SER A 31 6.073 -9.375 -12.918 1.00 55.43 O ATOM 451 CB SER A 31 7.375 -9.634 -9.799 1.00 13.13 C ATOM 452 OG SER A 31 8.541 -9.708 -10.602 1.00 20.21 O ATOM 0 H SER A 31 7.470 -11.624 -11.084 1.00 0.21 H new ATOM 0 HA SER A 31 5.280 -10.139 -9.972 1.00 32.40 H new ATOM 0 HB2 SER A 31 7.225 -8.612 -9.451 1.00 13.13 H new ATOM 0 HB3 SER A 31 7.490 -10.259 -8.913 1.00 13.13 H new ATOM 0 HG SER A 31 9.331 -9.535 -10.049 1.00 20.21 H new ATOM 457 N GLU A 32 5.296 -7.949 -11.384 1.00 73.25 N ATOM 458 CA GLU A 32 5.112 -6.789 -12.236 1.00 51.12 C ATOM 459 C GLU A 32 5.314 -5.553 -11.367 1.00 22.30 C ATOM 460 O GLU A 32 5.162 -5.612 -10.143 1.00 62.54 O ATOM 461 CB GLU A 32 3.715 -6.829 -12.890 1.00 51.02 C ATOM 462 CG GLU A 32 3.803 -7.344 -14.336 1.00 14.22 C ATOM 463 CD GLU A 32 2.657 -8.279 -14.735 1.00 35.23 C ATOM 464 OE1 GLU A 32 1.479 -7.870 -14.685 1.00 41.04 O ATOM 465 OE2 GLU A 32 2.938 -9.432 -15.159 1.00 24.13 O ATOM 0 H GLU A 32 4.974 -7.779 -10.431 1.00 73.25 H new ATOM 0 HA GLU A 32 5.832 -6.773 -13.054 1.00 51.12 H new ATOM 0 HB2 GLU A 32 3.055 -7.474 -12.309 1.00 51.02 H new ATOM 0 HB3 GLU A 32 3.276 -5.832 -12.881 1.00 51.02 H new ATOM 0 HG2 GLU A 32 3.815 -6.491 -15.015 1.00 14.22 H new ATOM 0 HG3 GLU A 32 4.749 -7.869 -14.467 1.00 14.22 H new ATOM 470 N LEU A 33 5.679 -4.446 -12.007 1.00 32.12 N ATOM 471 CA LEU A 33 6.010 -3.173 -11.411 1.00 71.33 C ATOM 472 C LEU A 33 5.215 -2.107 -12.149 1.00 75.21 C ATOM 473 O LEU A 33 5.215 -2.095 -13.380 1.00 20.22 O ATOM 474 CB LEU A 33 7.529 -2.932 -11.486 1.00 22.44 C ATOM 475 CG LEU A 33 8.166 -2.537 -12.842 1.00 75.21 C ATOM 476 CD1 LEU A 33 9.604 -2.052 -12.632 1.00 60.55 C ATOM 477 CD2 LEU A 33 8.180 -3.692 -13.852 1.00 35.10 C ATOM 0 H LEU A 33 5.754 -4.422 -13.024 1.00 32.12 H new ATOM 0 HA LEU A 33 5.748 -3.146 -10.353 1.00 71.33 H new ATOM 0 HB2 LEU A 33 7.773 -2.148 -10.769 1.00 22.44 H new ATOM 0 HB3 LEU A 33 8.023 -3.842 -11.144 1.00 22.44 H new ATOM 0 HG LEU A 33 7.546 -1.739 -13.251 1.00 75.21 H new ATOM 0 HD11 LEU A 33 10.039 -1.778 -13.593 1.00 60.55 H new ATOM 0 HD12 LEU A 33 9.603 -1.184 -11.973 1.00 60.55 H new ATOM 0 HD13 LEU A 33 10.195 -2.849 -12.180 1.00 60.55 H new ATOM 0 HD21 LEU A 33 8.638 -3.356 -14.782 1.00 35.10 H new ATOM 0 HD22 LEU A 33 8.754 -4.524 -13.445 1.00 35.10 H new ATOM 0 HD23 LEU A 33 7.158 -4.017 -14.047 1.00 35.10 H new ATOM 488 N LYS A 34 4.517 -1.237 -11.428 1.00 55.03 N ATOM 489 CA LYS A 34 3.800 -0.082 -11.975 1.00 75.52 C ATOM 490 C LYS A 34 4.084 1.113 -11.034 1.00 1.43 C ATOM 491 O LYS A 34 4.687 0.927 -9.973 1.00 32.54 O ATOM 492 CB LYS A 34 2.299 -0.451 -12.113 1.00 4.12 C ATOM 493 CG LYS A 34 1.851 -1.007 -13.486 1.00 1.33 C ATOM 494 CD LYS A 34 2.176 -2.492 -13.741 1.00 20.20 C ATOM 495 CE LYS A 34 0.976 -3.305 -14.261 1.00 42.23 C ATOM 496 NZ LYS A 34 0.721 -3.135 -15.709 1.00 31.40 N ATOM 0 H LYS A 34 4.429 -1.315 -10.415 1.00 55.03 H new ATOM 0 HA LYS A 34 4.130 0.202 -12.974 1.00 75.52 H new ATOM 0 HB2 LYS A 34 2.057 -1.190 -11.350 1.00 4.12 H new ATOM 0 HB3 LYS A 34 1.707 0.438 -11.895 1.00 4.12 H new ATOM 0 HG2 LYS A 34 0.774 -0.868 -13.580 1.00 1.33 H new ATOM 0 HG3 LYS A 34 2.319 -0.411 -14.270 1.00 1.33 H new ATOM 0 HD2 LYS A 34 2.990 -2.558 -14.463 1.00 20.20 H new ATOM 0 HD3 LYS A 34 2.535 -2.941 -12.815 1.00 20.20 H new ATOM 0 HE2 LYS A 34 1.147 -4.361 -14.053 1.00 42.23 H new ATOM 0 HE3 LYS A 34 0.084 -3.012 -13.708 1.00 42.23 H new ATOM 0 HZ1 LYS A 34 -0.099 -3.711 -15.987 1.00 31.40 H new ATOM 0 HZ2 LYS A 34 0.526 -2.134 -15.912 1.00 31.40 H new ATOM 0 HZ3 LYS A 34 1.557 -3.441 -16.247 1.00 31.40 H new ATOM 506 N GLU A 35 3.684 2.340 -11.394 1.00 63.51 N ATOM 507 CA GLU A 35 3.808 3.524 -10.524 1.00 64.13 C ATOM 508 C GLU A 35 2.440 4.154 -10.259 1.00 11.40 C ATOM 509 O GLU A 35 1.478 3.895 -10.991 1.00 72.43 O ATOM 510 CB GLU A 35 4.836 4.547 -11.058 1.00 33.34 C ATOM 511 CG GLU A 35 4.389 5.438 -12.249 1.00 71.31 C ATOM 512 CD GLU A 35 4.826 6.918 -12.204 1.00 73.34 C ATOM 513 OE1 GLU A 35 5.565 7.324 -11.277 1.00 61.15 O ATOM 514 OE2 GLU A 35 4.478 7.720 -13.111 1.00 24.53 O ATOM 0 H GLU A 35 3.263 2.543 -12.301 1.00 63.51 H new ATOM 0 HA GLU A 35 4.202 3.184 -9.566 1.00 64.13 H new ATOM 0 HB2 GLU A 35 5.123 5.201 -10.234 1.00 33.34 H new ATOM 0 HB3 GLU A 35 5.731 4.003 -11.359 1.00 33.34 H new ATOM 0 HG2 GLU A 35 4.773 4.997 -13.168 1.00 71.31 H new ATOM 0 HG3 GLU A 35 3.301 5.405 -12.310 1.00 71.31 H new ATOM 519 N VAL A 36 2.355 5.027 -9.250 1.00 40.41 N ATOM 520 CA VAL A 36 1.121 5.704 -8.852 1.00 14.01 C ATOM 521 C VAL A 36 1.381 7.213 -8.762 1.00 61.12 C ATOM 522 O VAL A 36 2.518 7.661 -8.558 1.00 41.25 O ATOM 523 CB VAL A 36 0.595 5.130 -7.521 1.00 62.25 C ATOM 524 CG1 VAL A 36 -0.802 5.644 -7.167 1.00 1.20 C ATOM 525 CG2 VAL A 36 0.481 3.611 -7.596 1.00 2.20 C ATOM 0 H VAL A 36 3.158 5.286 -8.678 1.00 40.41 H new ATOM 0 HA VAL A 36 0.347 5.533 -9.600 1.00 14.01 H new ATOM 0 HB VAL A 36 1.313 5.449 -6.765 1.00 62.25 H new ATOM 0 HG11 VAL A 36 -1.122 5.207 -6.221 1.00 1.20 H new ATOM 0 HG12 VAL A 36 -0.778 6.730 -7.075 1.00 1.20 H new ATOM 0 HG13 VAL A 36 -1.503 5.362 -7.952 1.00 1.20 H new ATOM 0 HG21 VAL A 36 0.108 3.227 -6.647 1.00 2.20 H new ATOM 0 HG22 VAL A 36 -0.209 3.337 -8.394 1.00 2.20 H new ATOM 0 HG23 VAL A 36 1.462 3.182 -7.801 1.00 2.20 H new ATOM 535 N LYS A 37 0.319 8.002 -8.923 1.00 31.54 N ATOM 536 CA LYS A 37 0.248 9.462 -8.997 1.00 21.42 C ATOM 537 C LYS A 37 -1.063 9.890 -8.313 1.00 63.54 C ATOM 538 O LYS A 37 -1.739 9.022 -7.750 1.00 43.11 O ATOM 539 CB LYS A 37 0.271 9.855 -10.486 1.00 63.32 C ATOM 540 CG LYS A 37 1.519 9.379 -11.248 1.00 62.31 C ATOM 541 CD LYS A 37 2.802 10.170 -10.952 1.00 44.31 C ATOM 542 CE LYS A 37 3.204 11.090 -12.109 1.00 34.54 C ATOM 543 NZ LYS A 37 3.367 10.362 -13.385 1.00 32.30 N ATOM 0 H LYS A 37 -0.610 7.591 -9.014 1.00 31.54 H new ATOM 0 HA LYS A 37 1.083 9.954 -8.497 1.00 21.42 H new ATOM 0 HB2 LYS A 37 -0.615 9.445 -10.971 1.00 63.32 H new ATOM 0 HB3 LYS A 37 0.204 10.940 -10.564 1.00 63.32 H new ATOM 0 HG2 LYS A 37 1.694 8.330 -11.009 1.00 62.31 H new ATOM 0 HG3 LYS A 37 1.316 9.433 -12.318 1.00 62.31 H new ATOM 0 HD2 LYS A 37 2.658 10.766 -10.051 1.00 44.31 H new ATOM 0 HD3 LYS A 37 3.615 9.474 -10.746 1.00 44.31 H new ATOM 0 HE2 LYS A 37 2.447 11.865 -12.231 1.00 34.54 H new ATOM 0 HE3 LYS A 37 4.138 11.593 -11.860 1.00 34.54 H new ATOM 0 HZ1 LYS A 37 4.043 10.870 -13.991 1.00 32.30 H new ATOM 0 HZ2 LYS A 37 3.724 9.404 -13.195 1.00 32.30 H new ATOM 0 HZ3 LYS A 37 2.448 10.299 -13.869 1.00 32.30 H new ATOM 553 N VAL A 38 -1.458 11.165 -8.339 1.00 13.43 N ATOM 554 CA VAL A 38 -2.764 11.606 -7.827 1.00 54.13 C ATOM 555 C VAL A 38 -3.620 12.222 -8.937 1.00 31.53 C ATOM 556 O VAL A 38 -3.109 12.843 -9.871 1.00 0.03 O ATOM 557 CB VAL A 38 -2.640 12.536 -6.598 1.00 72.12 C ATOM 558 CG1 VAL A 38 -2.344 11.721 -5.331 1.00 2.22 C ATOM 559 CG2 VAL A 38 -1.580 13.632 -6.751 1.00 61.53 C ATOM 0 H VAL A 38 -0.886 11.921 -8.714 1.00 13.43 H new ATOM 0 HA VAL A 38 -3.282 10.714 -7.474 1.00 54.13 H new ATOM 0 HB VAL A 38 -3.605 13.036 -6.515 1.00 72.12 H new ATOM 0 HG11 VAL A 38 -2.260 12.393 -4.477 1.00 2.22 H new ATOM 0 HG12 VAL A 38 -3.154 11.012 -5.157 1.00 2.22 H new ATOM 0 HG13 VAL A 38 -1.408 11.178 -5.458 1.00 2.22 H new ATOM 0 HG21 VAL A 38 -1.554 14.242 -5.848 1.00 61.53 H new ATOM 0 HG22 VAL A 38 -0.603 13.174 -6.908 1.00 61.53 H new ATOM 0 HG23 VAL A 38 -1.827 14.261 -7.606 1.00 61.53 H new ATOM 569 N SER A 39 -4.935 12.026 -8.820 1.00 13.42 N ATOM 570 CA SER A 39 -5.986 12.612 -9.631 1.00 42.24 C ATOM 571 C SER A 39 -6.005 14.144 -9.503 1.00 61.42 C ATOM 572 O SER A 39 -5.167 14.753 -8.835 1.00 73.43 O ATOM 573 CB SER A 39 -7.304 11.970 -9.165 1.00 35.31 C ATOM 574 OG SER A 39 -8.339 12.149 -10.108 1.00 14.42 O ATOM 0 H SER A 39 -5.313 11.408 -8.102 1.00 13.42 H new ATOM 0 HA SER A 39 -5.824 12.415 -10.691 1.00 42.24 H new ATOM 0 HB2 SER A 39 -7.149 10.905 -8.994 1.00 35.31 H new ATOM 0 HB3 SER A 39 -7.603 12.405 -8.211 1.00 35.31 H new ATOM 0 HG SER A 39 -9.159 11.726 -9.778 1.00 14.42 H new ATOM 579 N GLU A 40 -6.973 14.774 -10.169 1.00 54.14 N ATOM 580 CA GLU A 40 -7.337 16.178 -9.988 1.00 3.03 C ATOM 581 C GLU A 40 -7.887 16.416 -8.578 1.00 53.24 C ATOM 582 O GLU A 40 -8.041 15.469 -7.803 1.00 64.42 O ATOM 583 CB GLU A 40 -8.396 16.565 -11.043 1.00 54.31 C ATOM 584 CG GLU A 40 -7.862 17.469 -12.157 1.00 22.54 C ATOM 585 CD GLU A 40 -7.402 18.851 -11.688 1.00 32.41 C ATOM 586 OE1 GLU A 40 -7.312 19.106 -10.467 1.00 43.03 O ATOM 587 OE2 GLU A 40 -6.960 19.640 -12.553 1.00 62.13 O ATOM 0 H GLU A 40 -7.544 14.305 -10.872 1.00 54.14 H new ATOM 0 HA GLU A 40 -6.449 16.797 -10.114 1.00 3.03 H new ATOM 0 HB2 GLU A 40 -8.799 15.656 -11.489 1.00 54.31 H new ATOM 0 HB3 GLU A 40 -9.223 17.070 -10.544 1.00 54.31 H new ATOM 0 HG2 GLU A 40 -7.026 16.968 -12.644 1.00 22.54 H new ATOM 0 HG3 GLU A 40 -8.640 17.595 -12.909 1.00 22.54 H new ATOM 592 N GLY A 41 -8.242 17.662 -8.273 1.00 35.14 N ATOM 593 CA GLY A 41 -9.174 17.994 -7.209 1.00 31.51 C ATOM 594 C GLY A 41 -8.530 18.782 -6.076 1.00 2.00 C ATOM 595 O GLY A 41 -8.899 18.556 -4.920 1.00 20.41 O ATOM 0 H GLY A 41 -7.883 18.478 -8.768 1.00 35.14 H new ATOM 0 HA2 GLY A 41 -9.999 18.574 -7.624 1.00 31.51 H new ATOM 0 HA3 GLY A 41 -9.601 17.075 -6.808 1.00 31.51 H new ATOM 599 N THR A 42 -7.601 19.690 -6.386 1.00 15.33 N ATOM 600 CA THR A 42 -6.871 20.487 -5.400 1.00 4.02 C ATOM 601 C THR A 42 -7.247 21.975 -5.539 1.00 24.51 C ATOM 602 O THR A 42 -7.761 22.401 -6.581 1.00 2.23 O ATOM 603 CB THR A 42 -5.346 20.258 -5.565 1.00 20.21 C ATOM 604 OG1 THR A 42 -5.016 19.007 -6.153 1.00 62.24 O ATOM 605 CG2 THR A 42 -4.655 20.272 -4.202 1.00 11.44 C ATOM 0 H THR A 42 -7.331 19.895 -7.348 1.00 15.33 H new ATOM 0 HA THR A 42 -7.149 20.171 -4.394 1.00 4.02 H new ATOM 0 HB THR A 42 -5.012 21.065 -6.217 1.00 20.21 H new ATOM 0 HG1 THR A 42 -4.042 18.928 -6.229 1.00 62.24 H new ATOM 0 HG21 THR A 42 -3.585 20.110 -4.335 1.00 11.44 H new ATOM 0 HG22 THR A 42 -4.819 21.236 -3.721 1.00 11.44 H new ATOM 0 HG23 THR A 42 -5.067 19.480 -3.577 1.00 11.44 H new ATOM 613 N PHE A 43 -6.958 22.791 -4.517 1.00 51.41 N ATOM 614 CA PHE A 43 -6.894 24.245 -4.674 1.00 0.44 C ATOM 615 C PHE A 43 -5.751 24.602 -5.642 1.00 43.42 C ATOM 616 O PHE A 43 -4.837 23.799 -5.834 1.00 63.55 O ATOM 617 CB PHE A 43 -6.672 24.923 -3.310 1.00 52.42 C ATOM 618 CG PHE A 43 -7.730 24.680 -2.243 1.00 40.24 C ATOM 619 CD1 PHE A 43 -9.106 24.734 -2.549 1.00 44.05 C ATOM 620 CD2 PHE A 43 -7.329 24.438 -0.914 1.00 14.04 C ATOM 621 CE1 PHE A 43 -10.063 24.534 -1.537 1.00 55.24 C ATOM 622 CE2 PHE A 43 -8.285 24.244 0.099 1.00 3.23 C ATOM 623 CZ PHE A 43 -9.654 24.292 -0.215 1.00 62.31 C ATOM 0 H PHE A 43 -6.765 22.465 -3.570 1.00 51.41 H new ATOM 0 HA PHE A 43 -7.838 24.605 -5.083 1.00 0.44 H new ATOM 0 HB2 PHE A 43 -5.711 24.590 -2.918 1.00 52.42 H new ATOM 0 HB3 PHE A 43 -6.595 25.998 -3.473 1.00 52.42 H new ATOM 0 HD1 PHE A 43 -9.426 24.929 -3.562 1.00 44.05 H new ATOM 0 HD2 PHE A 43 -6.277 24.401 -0.671 1.00 14.04 H new ATOM 0 HE1 PHE A 43 -11.115 24.567 -1.777 1.00 55.24 H new ATOM 0 HE2 PHE A 43 -7.968 24.059 1.115 1.00 3.23 H new ATOM 0 HZ PHE A 43 -10.391 24.143 0.560 1.00 62.31 H new ATOM 632 N ASP A 44 -5.793 25.810 -6.203 1.00 53.04 N ATOM 633 CA ASP A 44 -4.942 26.306 -7.295 1.00 2.10 C ATOM 634 C ASP A 44 -3.471 26.083 -6.963 1.00 75.54 C ATOM 635 O ASP A 44 -3.025 26.573 -5.916 1.00 11.11 O ATOM 636 CB ASP A 44 -5.197 27.801 -7.569 1.00 74.31 C ATOM 637 CG ASP A 44 -6.676 28.157 -7.561 1.00 31.44 C ATOM 638 OD1 ASP A 44 -7.331 28.088 -8.624 1.00 61.14 O ATOM 639 OD2 ASP A 44 -7.183 28.431 -6.445 1.00 3.11 O ATOM 0 H ASP A 44 -6.461 26.515 -5.891 1.00 53.04 H new ATOM 0 HA ASP A 44 -5.196 25.746 -8.195 1.00 2.10 H new ATOM 0 HB2 ASP A 44 -4.680 28.397 -6.817 1.00 74.31 H new ATOM 0 HB3 ASP A 44 -4.769 28.067 -8.536 1.00 74.31 H new ATOM 643 N ALA A 45 -2.737 25.323 -7.786 1.00 73.15 N ATOM 644 CA ALA A 45 -1.355 24.952 -7.516 1.00 35.40 C ATOM 645 C ALA A 45 -0.516 24.706 -8.771 1.00 3.23 C ATOM 646 O ALA A 45 -1.004 24.200 -9.782 1.00 73.52 O ATOM 647 CB ALA A 45 -1.359 23.658 -6.705 1.00 3.00 C ATOM 0 H ALA A 45 -3.095 24.948 -8.664 1.00 73.15 H new ATOM 0 HA ALA A 45 -0.905 25.792 -6.987 1.00 35.40 H new ATOM 0 HB1 ALA A 45 -0.333 23.360 -6.490 1.00 3.00 H new ATOM 0 HB2 ALA A 45 -1.894 23.817 -5.769 1.00 3.00 H new ATOM 0 HB3 ALA A 45 -1.853 22.872 -7.276 1.00 3.00 H new ATOM 653 N ASP A 46 0.796 24.912 -8.628 1.00 15.12 N ATOM 654 CA ASP A 46 1.852 24.497 -9.555 1.00 35.51 C ATOM 655 C ASP A 46 2.118 22.993 -9.401 1.00 31.52 C ATOM 656 O ASP A 46 3.206 22.599 -8.982 1.00 2.33 O ATOM 657 CB ASP A 46 3.153 25.285 -9.279 1.00 3.20 C ATOM 658 CG ASP A 46 3.145 26.688 -9.854 1.00 75.55 C ATOM 659 OD1 ASP A 46 3.519 26.856 -11.045 1.00 31.23 O ATOM 660 OD2 ASP A 46 2.858 27.650 -9.135 1.00 40.25 O ATOM 0 H ASP A 46 1.171 25.401 -7.815 1.00 15.12 H new ATOM 0 HA ASP A 46 1.523 24.706 -10.573 1.00 35.51 H new ATOM 0 HB2 ASP A 46 3.311 25.343 -8.202 1.00 3.20 H new ATOM 0 HB3 ASP A 46 3.997 24.735 -9.696 1.00 3.20 H new ATOM 664 N MET A 47 1.151 22.135 -9.744 1.00 15.04 N ATOM 665 CA MET A 47 1.244 20.668 -9.696 1.00 55.13 C ATOM 666 C MET A 47 1.635 20.109 -8.317 1.00 75.41 C ATOM 667 O MET A 47 0.770 19.678 -7.558 1.00 43.23 O ATOM 668 CB MET A 47 2.176 20.137 -10.809 1.00 22.24 C ATOM 669 CG MET A 47 1.637 20.285 -12.235 1.00 71.34 C ATOM 670 SD MET A 47 2.925 20.069 -13.499 1.00 11.11 S ATOM 671 CE MET A 47 1.932 19.642 -14.957 1.00 22.22 C ATOM 0 H MET A 47 0.242 22.456 -10.077 1.00 15.04 H new ATOM 0 HA MET A 47 0.235 20.299 -9.879 1.00 55.13 H new ATOM 0 HB2 MET A 47 3.130 20.660 -10.742 1.00 22.24 H new ATOM 0 HB3 MET A 47 2.376 19.082 -10.621 1.00 22.24 H new ATOM 0 HG2 MET A 47 0.847 19.552 -12.398 1.00 71.34 H new ATOM 0 HG3 MET A 47 1.185 21.271 -12.348 1.00 71.34 H new ATOM 0 HE1 MET A 47 2.590 19.481 -15.811 1.00 22.22 H new ATOM 0 HE2 MET A 47 1.366 18.732 -14.758 1.00 22.22 H new ATOM 0 HE3 MET A 47 1.243 20.457 -15.179 1.00 22.22 H new ATOM 679 N TYR A 48 2.930 20.047 -8.008 1.00 53.43 N ATOM 680 CA TYR A 48 3.523 19.430 -6.833 1.00 11.41 C ATOM 681 C TYR A 48 3.127 20.207 -5.577 1.00 64.13 C ATOM 682 O TYR A 48 3.768 21.198 -5.218 1.00 54.45 O ATOM 683 CB TYR A 48 5.042 19.346 -7.048 1.00 4.20 C ATOM 684 CG TYR A 48 5.425 18.315 -8.094 1.00 22.31 C ATOM 685 CD1 TYR A 48 5.291 16.950 -7.786 1.00 0.23 C ATOM 686 CD2 TYR A 48 5.859 18.708 -9.375 1.00 3.12 C ATOM 687 CE1 TYR A 48 5.566 15.980 -8.762 1.00 64.14 C ATOM 688 CE2 TYR A 48 6.148 17.736 -10.350 1.00 52.42 C ATOM 689 CZ TYR A 48 5.991 16.367 -10.046 1.00 1.21 C ATOM 690 OH TYR A 48 6.228 15.403 -10.973 1.00 12.43 O ATOM 0 H TYR A 48 3.637 20.457 -8.618 1.00 53.43 H new ATOM 0 HA TYR A 48 3.151 18.416 -6.686 1.00 11.41 H new ATOM 0 HB2 TYR A 48 5.417 20.323 -7.351 1.00 4.20 H new ATOM 0 HB3 TYR A 48 5.526 19.098 -6.104 1.00 4.20 H new ATOM 0 HD1 TYR A 48 4.976 16.648 -6.798 1.00 0.23 H new ATOM 0 HD2 TYR A 48 5.970 19.757 -9.609 1.00 3.12 H new ATOM 0 HE1 TYR A 48 5.451 14.932 -8.527 1.00 64.14 H new ATOM 0 HE2 TYR A 48 6.489 18.037 -11.329 1.00 52.42 H new ATOM 0 HH TYR A 48 6.514 15.820 -11.813 1.00 12.43 H new ATOM 699 N LYS A 49 2.055 19.760 -4.909 1.00 73.53 N ATOM 700 CA LYS A 49 1.434 20.492 -3.802 1.00 55.31 C ATOM 701 C LYS A 49 0.860 19.559 -2.733 1.00 32.24 C ATOM 702 O LYS A 49 0.317 20.041 -1.739 1.00 52.32 O ATOM 703 CB LYS A 49 0.347 21.410 -4.395 1.00 60.34 C ATOM 704 CG LYS A 49 0.093 22.686 -3.580 1.00 34.22 C ATOM 705 CD LYS A 49 1.202 23.739 -3.732 1.00 64.22 C ATOM 706 CE LYS A 49 0.941 24.960 -2.841 1.00 0.42 C ATOM 707 NZ LYS A 49 1.128 24.651 -1.408 1.00 32.54 N ATOM 0 H LYS A 49 1.594 18.876 -5.124 1.00 73.53 H new ATOM 0 HA LYS A 49 2.192 21.085 -3.291 1.00 55.31 H new ATOM 0 HB2 LYS A 49 0.636 21.690 -5.408 1.00 60.34 H new ATOM 0 HB3 LYS A 49 -0.585 20.849 -4.472 1.00 60.34 H new ATOM 0 HG2 LYS A 49 -0.857 23.122 -3.889 1.00 34.22 H new ATOM 0 HG3 LYS A 49 -0.005 22.422 -2.527 1.00 34.22 H new ATOM 0 HD2 LYS A 49 2.164 23.297 -3.473 1.00 64.22 H new ATOM 0 HD3 LYS A 49 1.266 24.054 -4.774 1.00 64.22 H new ATOM 0 HE2 LYS A 49 1.613 25.768 -3.128 1.00 0.42 H new ATOM 0 HE3 LYS A 49 -0.076 25.318 -3.005 1.00 0.42 H new ATOM 0 HZ1 LYS A 49 1.075 25.529 -0.854 1.00 32.54 H new ATOM 0 HZ2 LYS A 49 0.382 23.998 -1.093 1.00 32.54 H new ATOM 0 HZ3 LYS A 49 2.058 24.208 -1.267 1.00 32.54 H new ATOM 717 N THR A 50 1.009 18.245 -2.911 1.00 21.14 N ATOM 718 CA THR A 50 0.422 17.220 -2.053 1.00 13.44 C ATOM 719 C THR A 50 1.387 16.051 -1.826 1.00 4.23 C ATOM 720 O THR A 50 1.395 15.458 -0.743 1.00 55.13 O ATOM 721 CB THR A 50 -0.896 16.793 -2.716 1.00 52.24 C ATOM 722 OG1 THR A 50 -1.833 17.850 -2.612 1.00 55.12 O ATOM 723 CG2 THR A 50 -1.537 15.520 -2.157 1.00 42.03 C ATOM 0 H THR A 50 1.557 17.856 -3.678 1.00 21.14 H new ATOM 0 HA THR A 50 0.223 17.608 -1.054 1.00 13.44 H new ATOM 0 HB THR A 50 -0.632 16.564 -3.749 1.00 52.24 H new ATOM 0 HG1 THR A 50 -2.676 17.583 -3.035 1.00 55.12 H new ATOM 0 HG21 THR A 50 -2.461 15.311 -2.696 1.00 42.03 H new ATOM 0 HG22 THR A 50 -0.849 14.683 -2.277 1.00 42.03 H new ATOM 0 HG23 THR A 50 -1.758 15.658 -1.099 1.00 42.03 H new ATOM 731 N SER A 51 2.236 15.694 -2.794 1.00 1.44 N ATOM 732 CA SER A 51 3.363 14.816 -2.517 1.00 2.30 C ATOM 733 C SER A 51 4.412 15.581 -1.707 1.00 2.04 C ATOM 734 O SER A 51 4.463 16.812 -1.747 1.00 73.25 O ATOM 735 CB SER A 51 3.958 14.262 -3.821 1.00 33.20 C ATOM 736 OG SER A 51 3.727 15.069 -4.968 1.00 1.30 O ATOM 0 H SER A 51 2.161 15.999 -3.765 1.00 1.44 H new ATOM 0 HA SER A 51 3.020 13.963 -1.932 1.00 2.30 H new ATOM 0 HB2 SER A 51 5.033 14.139 -3.691 1.00 33.20 H new ATOM 0 HB3 SER A 51 3.543 13.270 -4.001 1.00 33.20 H new ATOM 0 HG SER A 51 4.138 14.648 -5.752 1.00 1.30 H new ATOM 741 N ASP A 52 5.297 14.846 -1.034 1.00 20.21 N ATOM 742 CA ASP A 52 6.591 15.290 -0.497 1.00 53.03 C ATOM 743 C ASP A 52 6.474 16.220 0.723 1.00 23.22 C ATOM 744 O ASP A 52 7.485 16.707 1.236 1.00 34.54 O ATOM 745 CB ASP A 52 7.486 15.901 -1.596 1.00 13.21 C ATOM 746 CG ASP A 52 7.515 15.084 -2.888 1.00 60.54 C ATOM 747 OD1 ASP A 52 7.881 13.885 -2.842 1.00 24.34 O ATOM 748 OD2 ASP A 52 7.146 15.618 -3.960 1.00 51.44 O ATOM 0 H ASP A 52 5.122 13.861 -0.835 1.00 20.21 H new ATOM 0 HA ASP A 52 7.078 14.387 -0.129 1.00 53.03 H new ATOM 0 HB2 ASP A 52 7.134 16.908 -1.821 1.00 13.21 H new ATOM 0 HB3 ASP A 52 8.502 15.996 -1.214 1.00 13.21 H new ATOM 752 N ILE A 53 5.263 16.450 1.227 1.00 35.50 N ATOM 753 CA ILE A 53 4.981 17.271 2.404 1.00 34.31 C ATOM 754 C ILE A 53 4.793 16.318 3.603 1.00 20.12 C ATOM 755 O ILE A 53 5.055 15.113 3.491 1.00 15.14 O ATOM 756 CB ILE A 53 3.786 18.211 2.081 1.00 13.21 C ATOM 757 CG1 ILE A 53 4.013 19.060 0.801 1.00 4.20 C ATOM 758 CG2 ILE A 53 3.496 19.238 3.192 1.00 24.31 C ATOM 759 CD1 ILE A 53 2.686 19.297 0.082 1.00 55.14 C ATOM 0 H ILE A 53 4.419 16.055 0.812 1.00 35.50 H new ATOM 0 HA ILE A 53 5.795 17.941 2.679 1.00 34.31 H new ATOM 0 HB ILE A 53 2.955 17.515 1.961 1.00 13.21 H new ATOM 0 HG12 ILE A 53 4.467 20.015 1.065 1.00 4.20 H new ATOM 0 HG13 ILE A 53 4.709 18.549 0.136 1.00 4.20 H new ATOM 0 HG21 ILE A 53 2.650 19.861 2.900 1.00 24.31 H new ATOM 0 HG22 ILE A 53 3.259 18.715 4.118 1.00 24.31 H new ATOM 0 HG23 ILE A 53 4.374 19.866 3.345 1.00 24.31 H new ATOM 0 HD11 ILE A 53 2.859 19.893 -0.814 1.00 55.14 H new ATOM 0 HD12 ILE A 53 2.248 18.339 -0.199 1.00 55.14 H new ATOM 0 HD13 ILE A 53 2.003 19.828 0.745 1.00 55.14 H new ATOM 770 N ALA A 54 4.441 16.846 4.778 1.00 63.13 N ATOM 771 CA ALA A 54 3.901 16.134 5.930 1.00 74.34 C ATOM 772 C ALA A 54 2.869 17.040 6.616 1.00 53.04 C ATOM 773 O ALA A 54 2.898 18.254 6.411 1.00 32.54 O ATOM 774 CB ALA A 54 5.028 15.789 6.911 1.00 21.42 C ATOM 0 H ALA A 54 4.533 17.846 4.957 1.00 63.13 H new ATOM 0 HA ALA A 54 3.430 15.205 5.607 1.00 74.34 H new ATOM 0 HB1 ALA A 54 4.614 15.257 7.768 1.00 21.42 H new ATOM 0 HB2 ALA A 54 5.763 15.157 6.413 1.00 21.42 H new ATOM 0 HB3 ALA A 54 5.508 16.707 7.251 1.00 21.42 H new ATOM 780 N LEU A 55 2.029 16.485 7.500 1.00 60.34 N ATOM 781 CA LEU A 55 1.050 17.193 8.314 1.00 53.22 C ATOM 782 C LEU A 55 -0.013 17.965 7.509 1.00 54.21 C ATOM 783 O LEU A 55 -0.774 18.737 8.093 1.00 64.35 O ATOM 784 CB LEU A 55 1.774 18.032 9.356 1.00 71.13 C ATOM 785 CG LEU A 55 2.690 17.265 10.334 1.00 53.11 C ATOM 786 CD1 LEU A 55 2.654 18.028 11.652 1.00 55.45 C ATOM 787 CD2 LEU A 55 2.274 15.821 10.669 1.00 11.02 C ATOM 0 H LEU A 55 2.019 15.479 7.670 1.00 60.34 H new ATOM 0 HA LEU A 55 0.448 16.448 8.835 1.00 53.22 H new ATOM 0 HB2 LEU A 55 2.376 18.778 8.837 1.00 71.13 H new ATOM 0 HB3 LEU A 55 1.028 18.573 9.938 1.00 71.13 H new ATOM 0 HG LEU A 55 3.661 17.200 9.842 1.00 53.11 H new ATOM 0 HD11 LEU A 55 3.289 17.525 12.381 1.00 55.45 H new ATOM 0 HD12 LEU A 55 3.017 19.044 11.495 1.00 55.45 H new ATOM 0 HD13 LEU A 55 1.630 18.063 12.025 1.00 55.45 H new ATOM 0 HD21 LEU A 55 2.993 15.387 11.364 1.00 11.02 H new ATOM 0 HD22 LEU A 55 1.284 15.824 11.126 1.00 11.02 H new ATOM 0 HD23 LEU A 55 2.249 15.228 9.755 1.00 11.02 H new ATOM 798 N ASP A 56 -0.139 17.720 6.205 1.00 23.43 N ATOM 799 CA ASP A 56 -0.966 18.499 5.280 1.00 24.33 C ATOM 800 C ASP A 56 -2.351 17.879 5.042 1.00 21.20 C ATOM 801 O ASP A 56 -3.290 18.567 4.633 1.00 40.35 O ATOM 802 CB ASP A 56 -0.200 18.596 3.958 1.00 74.25 C ATOM 803 CG ASP A 56 -0.711 19.722 3.078 1.00 1.12 C ATOM 804 OD1 ASP A 56 -0.190 20.855 3.206 1.00 64.14 O ATOM 805 OD2 ASP A 56 -1.610 19.495 2.240 1.00 12.00 O ATOM 0 H ASP A 56 0.347 16.949 5.747 1.00 23.43 H new ATOM 0 HA ASP A 56 -1.150 19.481 5.716 1.00 24.33 H new ATOM 0 HB2 ASP A 56 0.859 18.751 4.165 1.00 74.25 H new ATOM 0 HB3 ASP A 56 -0.285 17.651 3.421 1.00 74.25 H new ATOM 809 N GLN A 57 -2.494 16.580 5.329 1.00 64.33 N ATOM 810 CA GLN A 57 -3.665 15.764 4.995 1.00 34.33 C ATOM 811 C GLN A 57 -4.118 14.858 6.155 1.00 75.15 C ATOM 812 O GLN A 57 -4.674 13.789 5.924 1.00 4.44 O ATOM 813 CB GLN A 57 -3.396 15.006 3.680 1.00 0.41 C ATOM 814 CG GLN A 57 -2.294 13.940 3.754 1.00 21.41 C ATOM 815 CD GLN A 57 -1.496 13.901 2.456 1.00 55.43 C ATOM 816 OE1 GLN A 57 -0.512 14.616 2.324 1.00 20.23 O ATOM 817 NE2 GLN A 57 -1.862 13.072 1.494 1.00 73.34 N ATOM 0 H GLN A 57 -1.772 16.050 5.817 1.00 64.33 H new ATOM 0 HA GLN A 57 -4.519 16.422 4.834 1.00 34.33 H new ATOM 0 HB2 GLN A 57 -4.321 14.527 3.359 1.00 0.41 H new ATOM 0 HB3 GLN A 57 -3.128 15.730 2.910 1.00 0.41 H new ATOM 0 HG2 GLN A 57 -1.628 14.155 4.590 1.00 21.41 H new ATOM 0 HG3 GLN A 57 -2.738 12.963 3.943 1.00 21.41 H new ATOM 0 HE21 GLN A 57 -2.684 12.481 1.616 1.00 73.34 H new ATOM 0 HE22 GLN A 57 -1.322 13.023 0.630 1.00 73.34 H new ATOM 824 N ILE A 58 -3.869 15.264 7.404 1.00 60.24 N ATOM 825 CA ILE A 58 -4.073 14.471 8.614 1.00 63.45 C ATOM 826 C ILE A 58 -5.278 15.055 9.363 1.00 15.42 C ATOM 827 O ILE A 58 -6.348 14.441 9.403 1.00 21.42 O ATOM 828 CB ILE A 58 -2.799 14.482 9.504 1.00 4.44 C ATOM 829 CG1 ILE A 58 -1.510 13.854 8.917 1.00 24.11 C ATOM 830 CG2 ILE A 58 -3.038 13.749 10.842 1.00 31.50 C ATOM 831 CD1 ILE A 58 -1.005 14.462 7.611 1.00 75.14 C ATOM 0 H ILE A 58 -3.504 16.195 7.605 1.00 60.24 H new ATOM 0 HA ILE A 58 -4.268 13.431 8.354 1.00 63.45 H new ATOM 0 HB ILE A 58 -2.627 15.553 9.607 1.00 4.44 H new ATOM 0 HG12 ILE A 58 -0.719 13.934 9.662 1.00 24.11 H new ATOM 0 HG13 ILE A 58 -1.689 12.791 8.755 1.00 24.11 H new ATOM 0 HG21 ILE A 58 -2.127 13.776 11.439 1.00 31.50 H new ATOM 0 HG22 ILE A 58 -3.844 14.240 11.387 1.00 31.50 H new ATOM 0 HG23 ILE A 58 -3.312 12.713 10.645 1.00 31.50 H new ATOM 0 HD11 ILE A 58 -0.099 13.944 7.295 1.00 75.14 H new ATOM 0 HD12 ILE A 58 -1.770 14.358 6.841 1.00 75.14 H new ATOM 0 HD13 ILE A 58 -0.785 15.519 7.763 1.00 75.14 H new ATOM 842 N GLN A 59 -5.085 16.216 10.001 1.00 0.14 N ATOM 843 CA GLN A 59 -6.039 16.833 10.913 1.00 42.31 C ATOM 844 C GLN A 59 -7.071 17.577 10.086 1.00 72.52 C ATOM 845 O GLN A 59 -6.698 18.451 9.305 1.00 72.34 O ATOM 846 CB GLN A 59 -5.329 17.841 11.829 1.00 40.23 C ATOM 847 CG GLN A 59 -4.507 17.183 12.939 1.00 60.35 C ATOM 848 CD GLN A 59 -3.764 18.241 13.753 1.00 22.31 C ATOM 849 OE1 GLN A 59 -4.335 19.224 14.222 1.00 60.34 O ATOM 850 NE2 GLN A 59 -2.465 18.099 13.913 1.00 4.03 N ATOM 0 H GLN A 59 -4.232 16.764 9.889 1.00 0.14 H new ATOM 0 HA GLN A 59 -6.505 16.062 11.526 1.00 42.31 H new ATOM 0 HB2 GLN A 59 -4.673 18.469 11.226 1.00 40.23 H new ATOM 0 HB3 GLN A 59 -6.073 18.498 12.279 1.00 40.23 H new ATOM 0 HG2 GLN A 59 -5.162 16.607 13.592 1.00 60.35 H new ATOM 0 HG3 GLN A 59 -3.794 16.482 12.505 1.00 60.35 H new ATOM 0 HE21 GLN A 59 -1.989 17.284 13.525 1.00 4.03 H new ATOM 0 HE22 GLN A 59 -1.934 18.804 14.425 1.00 4.03 H new ATOM 857 N GLY A 60 -8.352 17.251 10.231 1.00 3.23 N ATOM 858 CA GLY A 60 -9.437 17.982 9.592 1.00 1.12 C ATOM 859 C GLY A 60 -9.558 17.718 8.093 1.00 24.24 C ATOM 860 O GLY A 60 -10.662 17.849 7.566 1.00 71.41 O ATOM 0 H GLY A 60 -8.667 16.465 10.800 1.00 3.23 H new ATOM 0 HA2 GLY A 60 -10.377 17.715 10.076 1.00 1.12 H new ATOM 0 HA3 GLY A 60 -9.288 19.050 9.753 1.00 1.12 H new ATOM 864 N ASN A 61 -8.481 17.313 7.407 1.00 22.40 N ATOM 865 CA ASN A 61 -8.535 16.846 6.026 1.00 64.32 C ATOM 866 C ASN A 61 -9.388 15.576 6.009 1.00 24.44 C ATOM 867 O ASN A 61 -8.893 14.523 6.425 1.00 31.43 O ATOM 868 CB ASN A 61 -7.109 16.575 5.526 1.00 64.34 C ATOM 869 CG ASN A 61 -7.114 16.074 4.089 1.00 60.54 C ATOM 870 OD1 ASN A 61 -6.761 16.811 3.175 1.00 21.50 O ATOM 871 ND2 ASN A 61 -7.526 14.843 3.856 1.00 0.34 N ATOM 0 H ASN A 61 -7.541 17.302 7.804 1.00 22.40 H new ATOM 0 HA ASN A 61 -8.978 17.591 5.365 1.00 64.32 H new ATOM 0 HB2 ASN A 61 -6.518 17.488 5.593 1.00 64.34 H new ATOM 0 HB3 ASN A 61 -6.630 15.837 6.169 1.00 64.34 H new ATOM 0 HD21 ASN A 61 -7.555 14.487 2.900 1.00 0.34 H new ATOM 0 HD22 ASN A 61 -7.815 14.247 4.631 1.00 0.34 H new ATOM 877 N LYS A 62 -10.667 15.662 5.635 1.00 61.15 N ATOM 878 CA LYS A 62 -11.631 14.608 5.965 1.00 72.31 C ATOM 879 C LYS A 62 -11.900 13.643 4.821 1.00 53.24 C ATOM 880 O LYS A 62 -12.560 12.626 5.044 1.00 54.21 O ATOM 881 CB LYS A 62 -12.939 15.222 6.472 1.00 12.00 C ATOM 882 CG LYS A 62 -13.642 14.287 7.475 1.00 12.33 C ATOM 883 CD LYS A 62 -14.008 15.034 8.753 1.00 14.03 C ATOM 884 CE LYS A 62 -12.733 15.323 9.556 1.00 15.23 C ATOM 885 NZ LYS A 62 -13.037 16.094 10.770 1.00 11.14 N ATOM 0 H LYS A 62 -11.057 16.443 5.108 1.00 61.15 H new ATOM 0 HA LYS A 62 -11.174 14.014 6.756 1.00 72.31 H new ATOM 0 HB2 LYS A 62 -12.733 16.181 6.948 1.00 12.00 H new ATOM 0 HB3 LYS A 62 -13.602 15.420 5.629 1.00 12.00 H new ATOM 0 HG2 LYS A 62 -14.542 13.872 7.022 1.00 12.33 H new ATOM 0 HG3 LYS A 62 -12.989 13.447 7.714 1.00 12.33 H new ATOM 0 HD2 LYS A 62 -14.517 15.967 8.509 1.00 14.03 H new ATOM 0 HD3 LYS A 62 -14.700 14.440 9.350 1.00 14.03 H new ATOM 0 HE2 LYS A 62 -12.250 14.384 9.829 1.00 15.23 H new ATOM 0 HE3 LYS A 62 -12.027 15.876 8.937 1.00 15.23 H new ATOM 0 HZ1 LYS A 62 -12.158 16.276 11.295 1.00 11.14 H new ATOM 0 HZ2 LYS A 62 -13.476 16.999 10.506 1.00 11.14 H new ATOM 0 HZ3 LYS A 62 -13.692 15.553 11.370 1.00 11.14 H new ATOM 895 N ASP A 63 -11.375 13.918 3.630 1.00 24.24 N ATOM 896 CA ASP A 63 -11.262 12.908 2.593 1.00 1.11 C ATOM 897 C ASP A 63 -9.889 13.041 1.968 1.00 74.45 C ATOM 898 O ASP A 63 -9.360 14.149 1.855 1.00 13.03 O ATOM 899 CB ASP A 63 -12.382 13.003 1.551 1.00 54.11 C ATOM 900 CG ASP A 63 -13.524 12.041 1.874 1.00 55.31 C ATOM 901 OD1 ASP A 63 -13.259 10.826 2.041 1.00 72.43 O ATOM 902 OD2 ASP A 63 -14.691 12.494 1.916 1.00 32.50 O ATOM 0 H ASP A 63 -11.021 14.837 3.363 1.00 24.24 H new ATOM 0 HA ASP A 63 -11.377 11.919 3.036 1.00 1.11 H new ATOM 0 HB2 ASP A 63 -12.763 14.024 1.515 1.00 54.11 H new ATOM 0 HB3 ASP A 63 -11.982 12.777 0.562 1.00 54.11 H new ATOM 906 N PHE A 64 -9.267 11.910 1.650 1.00 40.34 N ATOM 907 CA PHE A 64 -7.927 11.882 1.084 1.00 62.23 C ATOM 908 C PHE A 64 -7.984 11.950 -0.447 1.00 11.41 C ATOM 909 O PHE A 64 -8.958 11.471 -1.033 1.00 60.14 O ATOM 910 CB PHE A 64 -7.240 10.606 1.567 1.00 32.34 C ATOM 911 CG PHE A 64 -7.266 10.427 3.071 1.00 53.14 C ATOM 912 CD1 PHE A 64 -6.847 11.459 3.936 1.00 51.31 C ATOM 913 CD2 PHE A 64 -7.768 9.233 3.610 1.00 21.31 C ATOM 914 CE1 PHE A 64 -6.928 11.287 5.328 1.00 63.12 C ATOM 915 CE2 PHE A 64 -7.814 9.050 5.000 1.00 2.32 C ATOM 916 CZ PHE A 64 -7.396 10.075 5.863 1.00 61.54 C ATOM 0 H PHE A 64 -9.681 10.987 1.779 1.00 40.34 H new ATOM 0 HA PHE A 64 -7.355 12.750 1.414 1.00 62.23 H new ATOM 0 HB2 PHE A 64 -7.722 9.747 1.100 1.00 32.34 H new ATOM 0 HB3 PHE A 64 -6.204 10.613 1.230 1.00 32.34 H new ATOM 0 HD1 PHE A 64 -6.463 12.382 3.528 1.00 51.31 H new ATOM 0 HD2 PHE A 64 -8.120 8.452 2.952 1.00 21.31 H new ATOM 0 HE1 PHE A 64 -6.630 12.088 5.988 1.00 63.12 H new ATOM 0 HE2 PHE A 64 -8.173 8.116 5.408 1.00 2.32 H new ATOM 0 HZ PHE A 64 -7.434 9.933 6.933 1.00 61.54 H new ATOM 925 N PRO A 65 -6.950 12.505 -1.105 1.00 64.35 N ATOM 926 CA PRO A 65 -6.980 12.755 -2.539 1.00 0.03 C ATOM 927 C PRO A 65 -6.894 11.456 -3.338 1.00 52.32 C ATOM 928 O PRO A 65 -6.074 10.585 -3.019 1.00 35.40 O ATOM 929 CB PRO A 65 -5.783 13.669 -2.816 1.00 64.12 C ATOM 930 CG PRO A 65 -4.805 13.321 -1.698 1.00 43.31 C ATOM 931 CD PRO A 65 -5.734 13.054 -0.519 1.00 20.53 C ATOM 0 HA PRO A 65 -7.917 13.219 -2.846 1.00 0.03 H new ATOM 0 HB2 PRO A 65 -5.353 13.480 -3.799 1.00 64.12 H new ATOM 0 HB3 PRO A 65 -6.066 14.721 -2.789 1.00 64.12 H new ATOM 0 HG2 PRO A 65 -4.201 12.448 -1.944 1.00 43.31 H new ATOM 0 HG3 PRO A 65 -4.114 14.139 -1.493 1.00 43.31 H new ATOM 0 HD2 PRO A 65 -5.285 12.353 0.185 1.00 20.53 H new ATOM 0 HD3 PRO A 65 -5.942 13.970 0.033 1.00 20.53 H new ATOM 936 N GLU A 66 -7.720 11.334 -4.377 1.00 72.31 N ATOM 937 CA GLU A 66 -7.772 10.169 -5.244 1.00 24.43 C ATOM 938 C GLU A 66 -6.475 10.002 -6.047 1.00 31.54 C ATOM 939 O GLU A 66 -5.709 10.942 -6.277 1.00 54.44 O ATOM 940 CB GLU A 66 -9.000 10.235 -6.168 1.00 40.31 C ATOM 941 CG GLU A 66 -10.333 10.150 -5.406 1.00 44.05 C ATOM 942 CD GLU A 66 -10.993 11.514 -5.210 1.00 15.02 C ATOM 943 OE1 GLU A 66 -10.476 12.351 -4.421 1.00 72.41 O ATOM 944 OE2 GLU A 66 -12.050 11.765 -5.810 1.00 42.31 O ATOM 0 H GLU A 66 -8.384 12.062 -4.641 1.00 72.31 H new ATOM 0 HA GLU A 66 -7.871 9.287 -4.612 1.00 24.43 H new ATOM 0 HB2 GLU A 66 -8.971 11.165 -6.735 1.00 40.31 H new ATOM 0 HB3 GLU A 66 -8.948 9.420 -6.890 1.00 40.31 H new ATOM 0 HG2 GLU A 66 -11.015 9.496 -5.949 1.00 44.05 H new ATOM 0 HG3 GLU A 66 -10.161 9.692 -4.432 1.00 44.05 H new ATOM 949 N ILE A 67 -6.223 8.774 -6.490 1.00 24.32 N ATOM 950 CA ILE A 67 -4.976 8.354 -7.121 1.00 3.43 C ATOM 951 C ILE A 67 -5.087 8.450 -8.646 1.00 44.45 C ATOM 952 O ILE A 67 -6.179 8.634 -9.184 1.00 14.32 O ATOM 953 CB ILE A 67 -4.624 6.922 -6.659 1.00 22.20 C ATOM 954 CG1 ILE A 67 -5.777 5.920 -6.909 1.00 60.52 C ATOM 955 CG2 ILE A 67 -4.239 6.962 -5.171 1.00 24.30 C ATOM 956 CD1 ILE A 67 -5.342 4.457 -6.779 1.00 51.34 C ATOM 0 H ILE A 67 -6.904 8.018 -6.417 1.00 24.32 H new ATOM 0 HA ILE A 67 -4.168 9.020 -6.816 1.00 3.43 H new ATOM 0 HB ILE A 67 -3.781 6.566 -7.251 1.00 22.20 H new ATOM 0 HG12 ILE A 67 -6.582 6.118 -6.201 1.00 60.52 H new ATOM 0 HG13 ILE A 67 -6.183 6.085 -7.907 1.00 60.52 H new ATOM 0 HG21 ILE A 67 -3.988 5.957 -4.833 1.00 24.30 H new ATOM 0 HG22 ILE A 67 -3.377 7.616 -5.036 1.00 24.30 H new ATOM 0 HG23 ILE A 67 -5.078 7.342 -4.588 1.00 24.30 H new ATOM 0 HD11 ILE A 67 -6.196 3.806 -6.966 1.00 51.34 H new ATOM 0 HD12 ILE A 67 -4.558 4.245 -7.506 1.00 51.34 H new ATOM 0 HD13 ILE A 67 -4.963 4.278 -5.773 1.00 51.34 H new ATOM 967 N GLN A 68 -3.971 8.258 -9.348 1.00 21.50 N ATOM 968 CA GLN A 68 -3.934 7.803 -10.729 1.00 71.35 C ATOM 969 C GLN A 68 -2.908 6.693 -10.830 1.00 32.54 C ATOM 970 O GLN A 68 -1.880 6.709 -10.150 1.00 14.02 O ATOM 971 CB GLN A 68 -3.549 8.920 -11.707 1.00 61.15 C ATOM 972 CG GLN A 68 -4.671 9.908 -11.964 1.00 53.15 C ATOM 973 CD GLN A 68 -5.896 9.262 -12.592 1.00 35.20 C ATOM 974 OE1 GLN A 68 -5.862 8.861 -13.753 1.00 54.01 O ATOM 975 NE2 GLN A 68 -6.963 9.135 -11.823 1.00 62.53 N ATOM 0 H GLN A 68 -3.043 8.421 -8.956 1.00 21.50 H new ATOM 0 HA GLN A 68 -4.933 7.462 -11.000 1.00 71.35 H new ATOM 0 HB2 GLN A 68 -2.686 9.456 -11.313 1.00 61.15 H new ATOM 0 HB3 GLN A 68 -3.243 8.475 -12.654 1.00 61.15 H new ATOM 0 HG2 GLN A 68 -4.957 10.378 -11.023 1.00 53.15 H new ATOM 0 HG3 GLN A 68 -4.308 10.700 -12.619 1.00 53.15 H new ATOM 0 HE21 GLN A 68 -6.945 9.483 -10.864 1.00 62.53 H new ATOM 0 HE22 GLN A 68 -7.804 8.689 -12.188 1.00 62.53 H new ATOM 982 N LEU A 69 -3.195 5.743 -11.705 1.00 32.40 N ATOM 983 CA LEU A 69 -2.318 4.644 -12.082 1.00 63.54 C ATOM 984 C LEU A 69 -2.792 4.063 -13.407 1.00 72.41 C ATOM 985 O LEU A 69 -3.697 4.611 -14.044 1.00 62.12 O ATOM 986 CB LEU A 69 -2.159 3.590 -10.957 1.00 53.43 C ATOM 987 CG LEU A 69 -3.242 2.512 -10.780 1.00 64.33 C ATOM 988 CD1 LEU A 69 -2.912 1.733 -9.506 1.00 33.51 C ATOM 989 CD2 LEU A 69 -4.665 3.056 -10.668 1.00 3.30 C ATOM 0 H LEU A 69 -4.089 5.715 -12.196 1.00 32.40 H new ATOM 0 HA LEU A 69 -1.307 5.026 -12.225 1.00 63.54 H new ATOM 0 HB2 LEU A 69 -1.210 3.078 -11.119 1.00 53.43 H new ATOM 0 HB3 LEU A 69 -2.074 4.128 -10.013 1.00 53.43 H new ATOM 0 HG LEU A 69 -3.229 1.892 -11.676 1.00 64.33 H new ATOM 0 HD11 LEU A 69 -3.662 0.958 -9.349 1.00 33.51 H new ATOM 0 HD12 LEU A 69 -1.929 1.272 -9.606 1.00 33.51 H new ATOM 0 HD13 LEU A 69 -2.909 2.413 -8.654 1.00 33.51 H new ATOM 0 HD21 LEU A 69 -5.363 2.228 -10.546 1.00 3.30 H new ATOM 0 HD22 LEU A 69 -4.734 3.719 -9.806 1.00 3.30 H new ATOM 0 HD23 LEU A 69 -4.915 3.610 -11.573 1.00 3.30 H new ATOM 1000 N ASP A 70 -2.122 3.003 -13.841 1.00 23.54 N ATOM 1001 CA ASP A 70 -2.429 2.273 -15.062 1.00 74.34 C ATOM 1002 C ASP A 70 -3.747 1.505 -14.918 1.00 0.01 C ATOM 1003 O ASP A 70 -4.341 1.468 -13.839 1.00 60.43 O ATOM 1004 CB ASP A 70 -1.260 1.340 -15.377 1.00 1.12 C ATOM 1005 CG ASP A 70 -0.997 1.275 -16.874 1.00 42.24 C ATOM 1006 OD1 ASP A 70 -1.880 0.804 -17.619 1.00 14.24 O ATOM 1007 OD2 ASP A 70 0.144 1.604 -17.280 1.00 20.40 O ATOM 0 H ASP A 70 -1.325 2.616 -13.336 1.00 23.54 H new ATOM 0 HA ASP A 70 -2.561 2.969 -15.891 1.00 74.34 H new ATOM 0 HB2 ASP A 70 -0.364 1.688 -14.862 1.00 1.12 H new ATOM 0 HB3 ASP A 70 -1.477 0.341 -14.999 1.00 1.12 H new ATOM 1011 N ASN A 71 -4.212 0.850 -15.982 1.00 4.32 N ATOM 1012 CA ASN A 71 -5.406 0.018 -15.895 1.00 24.15 C ATOM 1013 C ASN A 71 -5.012 -1.344 -15.323 1.00 42.04 C ATOM 1014 O ASN A 71 -4.653 -2.265 -16.059 1.00 51.21 O ATOM 1015 CB ASN A 71 -6.129 -0.110 -17.235 1.00 44.00 C ATOM 1016 CG ASN A 71 -7.572 -0.513 -16.974 1.00 32.44 C ATOM 1017 OD1 ASN A 71 -8.464 0.324 -17.052 1.00 1.21 O ATOM 1018 ND2 ASN A 71 -7.853 -1.747 -16.613 1.00 53.14 N ATOM 0 H ASN A 71 -3.782 0.880 -16.906 1.00 4.32 H new ATOM 0 HA ASN A 71 -6.122 0.497 -15.228 1.00 24.15 H new ATOM 0 HB2 ASN A 71 -6.093 0.836 -17.776 1.00 44.00 H new ATOM 0 HB3 ASN A 71 -5.636 -0.854 -17.861 1.00 44.00 H new ATOM 0 HD21 ASN A 71 -8.815 -2.009 -16.397 1.00 53.14 H new ATOM 0 HD22 ASN A 71 -7.109 -2.442 -16.549 1.00 53.14 H new ATOM 1024 N ILE A 72 -5.015 -1.449 -14.001 1.00 73.15 N ATOM 1025 CA ILE A 72 -4.591 -2.634 -13.255 1.00 34.43 C ATOM 1026 C ILE A 72 -5.814 -3.328 -12.679 1.00 72.51 C ATOM 1027 O ILE A 72 -6.659 -2.706 -12.024 1.00 63.54 O ATOM 1028 CB ILE A 72 -3.560 -2.285 -12.150 1.00 54.33 C ATOM 1029 CG1 ILE A 72 -2.429 -1.380 -12.691 1.00 34.52 C ATOM 1030 CG2 ILE A 72 -2.965 -3.574 -11.549 1.00 73.51 C ATOM 1031 CD1 ILE A 72 -1.387 -1.000 -11.635 1.00 1.41 C ATOM 0 H ILE A 72 -5.322 -0.688 -13.395 1.00 73.15 H new ATOM 0 HA ILE A 72 -4.085 -3.315 -13.940 1.00 34.43 H new ATOM 0 HB ILE A 72 -4.085 -1.733 -11.370 1.00 54.33 H new ATOM 0 HG12 ILE A 72 -1.930 -1.891 -13.514 1.00 34.52 H new ATOM 0 HG13 ILE A 72 -2.868 -0.470 -13.100 1.00 34.52 H new ATOM 0 HG21 ILE A 72 -2.243 -3.315 -10.775 1.00 73.51 H new ATOM 0 HG22 ILE A 72 -3.764 -4.175 -11.114 1.00 73.51 H new ATOM 0 HG23 ILE A 72 -2.467 -4.145 -12.333 1.00 73.51 H new ATOM 0 HD11 ILE A 72 -0.625 -0.365 -12.087 1.00 1.41 H new ATOM 0 HD12 ILE A 72 -1.873 -0.461 -10.822 1.00 1.41 H new ATOM 0 HD13 ILE A 72 -0.920 -1.904 -11.243 1.00 1.41 H new ATOM 1042 N ASP A 73 -5.887 -4.629 -12.943 1.00 20.52 N ATOM 1043 CA ASP A 73 -6.711 -5.570 -12.207 1.00 15.41 C ATOM 1044 C ASP A 73 -5.832 -6.188 -11.134 1.00 32.44 C ATOM 1045 O ASP A 73 -4.745 -6.663 -11.454 1.00 62.42 O ATOM 1046 CB ASP A 73 -7.178 -6.669 -13.150 1.00 35.12 C ATOM 1047 CG ASP A 73 -8.139 -7.592 -12.417 1.00 74.42 C ATOM 1048 OD1 ASP A 73 -9.288 -7.166 -12.151 1.00 33.24 O ATOM 1049 OD2 ASP A 73 -7.759 -8.742 -12.115 1.00 22.50 O ATOM 0 H ASP A 73 -5.358 -5.066 -13.697 1.00 20.52 H new ATOM 0 HA ASP A 73 -7.579 -5.073 -11.773 1.00 15.41 H new ATOM 0 HB2 ASP A 73 -7.669 -6.232 -14.020 1.00 35.12 H new ATOM 0 HB3 ASP A 73 -6.322 -7.235 -13.518 1.00 35.12 H new ATOM 1053 N TYR A 74 -6.244 -6.140 -9.871 1.00 3.42 N ATOM 1054 CA TYR A 74 -5.508 -6.766 -8.778 1.00 1.14 C ATOM 1055 C TYR A 74 -5.815 -8.261 -8.711 1.00 54.04 C ATOM 1056 O TYR A 74 -4.953 -9.044 -8.323 1.00 15.22 O ATOM 1057 CB TYR A 74 -5.870 -6.092 -7.446 1.00 73.25 C ATOM 1058 CG TYR A 74 -5.759 -4.582 -7.499 1.00 22.53 C ATOM 1059 CD1 TYR A 74 -4.496 -3.968 -7.605 1.00 14.14 C ATOM 1060 CD2 TYR A 74 -6.927 -3.801 -7.537 1.00 71.55 C ATOM 1061 CE1 TYR A 74 -4.404 -2.576 -7.786 1.00 13.34 C ATOM 1062 CE2 TYR A 74 -6.844 -2.417 -7.740 1.00 23.23 C ATOM 1063 CZ TYR A 74 -5.583 -1.802 -7.889 1.00 54.11 C ATOM 1064 OH TYR A 74 -5.506 -0.476 -8.169 1.00 31.22 O ATOM 0 H TYR A 74 -7.098 -5.666 -9.576 1.00 3.42 H new ATOM 0 HA TYR A 74 -4.441 -6.640 -8.961 1.00 1.14 H new ATOM 0 HB2 TYR A 74 -6.888 -6.367 -7.171 1.00 73.25 H new ATOM 0 HB3 TYR A 74 -5.214 -6.472 -6.663 1.00 73.25 H new ATOM 0 HD1 TYR A 74 -3.598 -4.566 -7.547 1.00 14.14 H new ATOM 0 HD2 TYR A 74 -7.892 -4.269 -7.409 1.00 71.55 H new ATOM 0 HE1 TYR A 74 -3.436 -2.100 -7.846 1.00 13.34 H new ATOM 0 HE2 TYR A 74 -7.744 -1.822 -7.782 1.00 23.23 H new ATOM 0 HH TYR A 74 -6.409 -0.096 -8.205 1.00 31.22 H new ATOM 1073 N ASN A 75 -7.049 -8.656 -9.049 1.00 75.33 N ATOM 1074 CA ASN A 75 -7.602 -10.009 -8.907 1.00 62.21 C ATOM 1075 C ASN A 75 -6.692 -11.050 -9.540 1.00 71.12 C ATOM 1076 O ASN A 75 -6.456 -12.113 -8.964 1.00 14.20 O ATOM 1077 CB ASN A 75 -8.988 -10.071 -9.583 1.00 64.43 C ATOM 1078 CG ASN A 75 -10.040 -10.883 -8.842 1.00 44.15 C ATOM 1079 OD1 ASN A 75 -11.190 -10.269 -8.628 1.00 11.31 O flip ATOM 1080 ND2 ASN A 75 -9.871 -12.053 -8.499 1.00 54.34 N flip ATOM 0 H ASN A 75 -7.725 -8.006 -9.450 1.00 75.33 H new ATOM 0 HA ASN A 75 -7.688 -10.229 -7.843 1.00 62.21 H new ATOM 0 HB2 ASN A 75 -9.359 -9.054 -9.706 1.00 64.43 H new ATOM 0 HB3 ASN A 75 -8.868 -10.490 -10.582 1.00 64.43 H new ATOM 0 HD21 ASN A 75 -8.976 -12.511 -8.672 1.00 54.34 H new ATOM 0 HD22 ASN A 75 -10.626 -12.564 -8.042 1.00 54.34 H new ATOM 1086 N ASN A 76 -6.161 -10.721 -10.715 1.00 51.44 N ATOM 1087 CA ASN A 76 -5.313 -11.610 -11.482 1.00 52.12 C ATOM 1088 C ASN A 76 -3.935 -11.875 -10.856 1.00 51.41 C ATOM 1089 O ASN A 76 -3.241 -12.724 -11.415 1.00 21.13 O ATOM 1090 CB ASN A 76 -5.210 -11.151 -12.953 1.00 23.40 C ATOM 1091 CG ASN A 76 -4.390 -9.887 -13.201 1.00 4.43 C ATOM 1092 OD1 ASN A 76 -3.631 -9.426 -12.370 1.00 32.54 O ATOM 1093 ND2 ASN A 76 -4.487 -9.301 -14.385 1.00 23.24 N ATOM 0 H ASN A 76 -6.314 -9.816 -11.161 1.00 51.44 H new ATOM 0 HA ASN A 76 -5.810 -12.580 -11.462 1.00 52.12 H new ATOM 0 HB2 ASN A 76 -4.776 -11.963 -13.537 1.00 23.40 H new ATOM 0 HB3 ASN A 76 -6.218 -10.987 -13.334 1.00 23.40 H new ATOM 0 HD21 ASN A 76 -3.929 -8.473 -14.591 1.00 23.24 H new ATOM 0 HD22 ASN A 76 -5.120 -9.678 -15.090 1.00 23.24 H new ATOM 1099 N TYR A 77 -3.537 -11.252 -9.734 1.00 60.25 N ATOM 1100 CA TYR A 77 -2.255 -11.532 -9.065 1.00 75.44 C ATOM 1101 C TYR A 77 -2.460 -12.441 -7.844 1.00 52.02 C ATOM 1102 O TYR A 77 -3.566 -12.518 -7.308 1.00 34.40 O ATOM 1103 CB TYR A 77 -1.544 -10.229 -8.652 1.00 55.11 C ATOM 1104 CG TYR A 77 -1.185 -9.313 -9.809 1.00 55.11 C ATOM 1105 CD1 TYR A 77 -0.097 -9.609 -10.652 1.00 2.30 C ATOM 1106 CD2 TYR A 77 -1.945 -8.157 -10.052 1.00 11.42 C ATOM 1107 CE1 TYR A 77 0.189 -8.803 -11.767 1.00 11.12 C ATOM 1108 CE2 TYR A 77 -1.645 -7.323 -11.142 1.00 40.22 C ATOM 1109 CZ TYR A 77 -0.600 -7.661 -12.029 1.00 63.21 C ATOM 1110 OH TYR A 77 -0.368 -6.885 -13.124 1.00 21.42 O ATOM 0 H TYR A 77 -4.096 -10.539 -9.265 1.00 60.25 H new ATOM 0 HA TYR A 77 -1.618 -12.053 -9.780 1.00 75.44 H new ATOM 0 HB2 TYR A 77 -2.185 -9.684 -7.959 1.00 55.11 H new ATOM 0 HB3 TYR A 77 -0.633 -10.483 -8.110 1.00 55.11 H new ATOM 0 HD1 TYR A 77 0.525 -10.466 -10.439 1.00 2.30 H new ATOM 0 HD2 TYR A 77 -2.766 -7.907 -9.396 1.00 11.42 H new ATOM 0 HE1 TYR A 77 1.010 -9.056 -12.422 1.00 11.12 H new ATOM 0 HE2 TYR A 77 -2.216 -6.420 -11.302 1.00 40.22 H new ATOM 0 HH TYR A 77 0.331 -7.296 -13.674 1.00 21.42 H new ATOM 1119 N ASP A 78 -1.398 -13.106 -7.362 1.00 42.11 N ATOM 1120 CA ASP A 78 -1.465 -13.965 -6.163 1.00 34.30 C ATOM 1121 C ASP A 78 -0.885 -13.262 -4.927 1.00 72.44 C ATOM 1122 O ASP A 78 -1.135 -13.674 -3.794 1.00 64.54 O ATOM 1123 CB ASP A 78 -0.715 -15.285 -6.409 1.00 62.54 C ATOM 1124 CG ASP A 78 -1.357 -16.497 -5.719 1.00 32.33 C ATOM 1125 OD1 ASP A 78 -1.057 -16.799 -4.538 1.00 42.22 O ATOM 1126 OD2 ASP A 78 -2.091 -17.237 -6.413 1.00 40.15 O ATOM 0 H ASP A 78 -0.472 -13.066 -7.788 1.00 42.11 H new ATOM 0 HA ASP A 78 -2.517 -14.174 -5.970 1.00 34.30 H new ATOM 0 HB2 ASP A 78 -0.668 -15.472 -7.482 1.00 62.54 H new ATOM 0 HB3 ASP A 78 0.312 -15.180 -6.058 1.00 62.54 H new ATOM 1130 N LEU A 79 -0.109 -12.191 -5.127 1.00 23.14 N ATOM 1131 CA LEU A 79 0.720 -11.539 -4.115 1.00 2.11 C ATOM 1132 C LEU A 79 0.771 -10.036 -4.450 1.00 62.41 C ATOM 1133 O LEU A 79 0.889 -9.693 -5.626 1.00 53.32 O ATOM 1134 CB LEU A 79 2.122 -12.196 -4.200 1.00 60.51 C ATOM 1135 CG LEU A 79 3.034 -12.132 -2.957 1.00 44.31 C ATOM 1136 CD1 LEU A 79 2.889 -10.852 -2.150 1.00 11.01 C ATOM 1137 CD2 LEU A 79 2.750 -13.298 -2.012 1.00 41.35 C ATOM 0 H LEU A 79 -0.041 -11.738 -6.038 1.00 23.14 H new ATOM 0 HA LEU A 79 0.332 -11.650 -3.103 1.00 2.11 H new ATOM 0 HB2 LEU A 79 1.983 -13.246 -4.457 1.00 60.51 H new ATOM 0 HB3 LEU A 79 2.657 -11.733 -5.029 1.00 60.51 H new ATOM 0 HG LEU A 79 4.047 -12.175 -3.357 1.00 44.31 H new ATOM 0 HD11 LEU A 79 3.562 -10.884 -1.294 1.00 11.01 H new ATOM 0 HD12 LEU A 79 3.139 -9.996 -2.777 1.00 11.01 H new ATOM 0 HD13 LEU A 79 1.861 -10.757 -1.800 1.00 11.01 H new ATOM 0 HD21 LEU A 79 3.405 -13.231 -1.144 1.00 41.35 H new ATOM 0 HD22 LEU A 79 1.711 -13.257 -1.686 1.00 41.35 H new ATOM 0 HD23 LEU A 79 2.931 -14.239 -2.531 1.00 41.35 H new ATOM 1148 N ILE A 80 0.667 -9.122 -3.478 1.00 23.13 N ATOM 1149 CA ILE A 80 0.727 -7.678 -3.720 1.00 23.34 C ATOM 1150 C ILE A 80 1.618 -6.985 -2.683 1.00 31.13 C ATOM 1151 O ILE A 80 1.545 -7.268 -1.482 1.00 41.34 O ATOM 1152 CB ILE A 80 -0.709 -7.101 -3.792 1.00 44.25 C ATOM 1153 CG1 ILE A 80 -1.352 -7.585 -5.116 1.00 31.33 C ATOM 1154 CG2 ILE A 80 -0.730 -5.566 -3.694 1.00 12.31 C ATOM 1155 CD1 ILE A 80 -2.702 -6.968 -5.492 1.00 31.44 C ATOM 0 H ILE A 80 0.538 -9.366 -2.496 1.00 23.13 H new ATOM 0 HA ILE A 80 1.196 -7.483 -4.684 1.00 23.34 H new ATOM 0 HB ILE A 80 -1.281 -7.461 -2.937 1.00 44.25 H new ATOM 0 HG12 ILE A 80 -0.650 -7.388 -5.927 1.00 31.33 H new ATOM 0 HG13 ILE A 80 -1.477 -8.666 -5.058 1.00 31.33 H new ATOM 0 HG21 ILE A 80 -1.759 -5.212 -3.750 1.00 12.31 H new ATOM 0 HG22 ILE A 80 -0.290 -5.256 -2.746 1.00 12.31 H new ATOM 0 HG23 ILE A 80 -0.155 -5.141 -4.517 1.00 12.31 H new ATOM 0 HD11 ILE A 80 -3.044 -7.389 -6.437 1.00 31.44 H new ATOM 0 HD12 ILE A 80 -3.432 -7.186 -4.712 1.00 31.44 H new ATOM 0 HD13 ILE A 80 -2.593 -5.888 -5.594 1.00 31.44 H new ATOM 1166 N LEU A 81 2.422 -6.028 -3.164 1.00 33.33 N ATOM 1167 CA LEU A 81 3.225 -5.067 -2.420 1.00 72.51 C ATOM 1168 C LEU A 81 2.736 -3.652 -2.730 1.00 2.34 C ATOM 1169 O LEU A 81 2.352 -3.364 -3.864 1.00 20.53 O ATOM 1170 CB LEU A 81 4.688 -5.180 -2.888 1.00 63.15 C ATOM 1171 CG LEU A 81 5.565 -6.237 -2.203 1.00 75.55 C ATOM 1172 CD1 LEU A 81 5.812 -5.838 -0.745 1.00 11.03 C ATOM 1173 CD2 LEU A 81 5.022 -7.666 -2.278 1.00 53.35 C ATOM 0 H LEU A 81 2.532 -5.901 -4.170 1.00 33.33 H new ATOM 0 HA LEU A 81 3.142 -5.269 -1.352 1.00 72.51 H new ATOM 0 HB2 LEU A 81 4.685 -5.386 -3.958 1.00 63.15 H new ATOM 0 HB3 LEU A 81 5.162 -4.208 -2.752 1.00 63.15 H new ATOM 0 HG LEU A 81 6.501 -6.256 -2.762 1.00 75.55 H new ATOM 0 HD11 LEU A 81 6.435 -6.591 -0.262 1.00 11.03 H new ATOM 0 HD12 LEU A 81 6.318 -4.873 -0.713 1.00 11.03 H new ATOM 0 HD13 LEU A 81 4.859 -5.766 -0.221 1.00 11.03 H new ATOM 0 HD21 LEU A 81 5.707 -8.343 -1.768 1.00 53.35 H new ATOM 0 HD22 LEU A 81 4.044 -7.709 -1.798 1.00 53.35 H new ATOM 0 HD23 LEU A 81 4.927 -7.965 -3.322 1.00 53.35 H new ATOM 1184 N ILE A 82 2.809 -2.741 -1.756 1.00 12.01 N ATOM 1185 CA ILE A 82 2.459 -1.325 -1.909 1.00 40.35 C ATOM 1186 C ILE A 82 3.452 -0.496 -1.079 1.00 24.31 C ATOM 1187 O ILE A 82 3.827 -0.954 0.002 1.00 31.51 O ATOM 1188 CB ILE A 82 1.002 -1.064 -1.426 1.00 35.53 C ATOM 1189 CG1 ILE A 82 -0.010 -2.210 -1.690 1.00 20.52 C ATOM 1190 CG2 ILE A 82 0.530 0.222 -2.113 1.00 35.41 C ATOM 1191 CD1 ILE A 82 -1.431 -1.945 -1.171 1.00 21.32 C ATOM 0 H ILE A 82 3.122 -2.974 -0.813 1.00 12.01 H new ATOM 0 HA ILE A 82 2.515 -1.040 -2.960 1.00 40.35 H new ATOM 0 HB ILE A 82 1.031 -0.985 -0.339 1.00 35.53 H new ATOM 0 HG12 ILE A 82 -0.058 -2.393 -2.763 1.00 20.52 H new ATOM 0 HG13 ILE A 82 0.367 -3.122 -1.228 1.00 20.52 H new ATOM 0 HG21 ILE A 82 -0.491 0.446 -1.804 1.00 35.41 H new ATOM 0 HG22 ILE A 82 1.184 1.047 -1.830 1.00 35.41 H new ATOM 0 HG23 ILE A 82 0.560 0.089 -3.194 1.00 35.41 H new ATOM 0 HD11 ILE A 82 -2.067 -2.800 -1.401 1.00 21.32 H new ATOM 0 HD12 ILE A 82 -1.402 -1.794 -0.092 1.00 21.32 H new ATOM 0 HD13 ILE A 82 -1.834 -1.053 -1.652 1.00 21.32 H new ATOM 1202 N GLY A 83 3.865 0.715 -1.480 1.00 41.21 N ATOM 1203 CA GLY A 83 4.789 1.487 -0.642 1.00 24.10 C ATOM 1204 C GLY A 83 4.764 3.000 -0.798 1.00 73.44 C ATOM 1205 O GLY A 83 4.297 3.538 -1.806 1.00 74.12 O ATOM 0 H GLY A 83 3.585 1.168 -2.350 1.00 41.21 H new ATOM 0 HA2 GLY A 83 4.578 1.251 0.401 1.00 24.10 H new ATOM 0 HA3 GLY A 83 5.802 1.142 -0.849 1.00 24.10 H new ATOM 1209 N SER A 84 5.315 3.672 0.218 1.00 53.03 N ATOM 1210 CA SER A 84 5.138 5.100 0.486 1.00 63.31 C ATOM 1211 C SER A 84 6.175 5.610 1.511 1.00 34.10 C ATOM 1212 O SER A 84 6.816 4.777 2.159 1.00 23.51 O ATOM 1213 CB SER A 84 3.705 5.299 1.006 1.00 44.23 C ATOM 1214 OG SER A 84 3.257 4.229 1.823 1.00 23.50 O ATOM 0 H SER A 84 5.920 3.217 0.902 1.00 53.03 H new ATOM 0 HA SER A 84 5.294 5.675 -0.427 1.00 63.31 H new ATOM 0 HB2 SER A 84 3.657 6.228 1.575 1.00 44.23 H new ATOM 0 HB3 SER A 84 3.029 5.409 0.158 1.00 44.23 H new ATOM 0 HG SER A 84 3.776 4.213 2.654 1.00 23.50 H new ATOM 1219 N PRO A 85 6.364 6.938 1.658 1.00 13.10 N ATOM 1220 CA PRO A 85 7.250 7.543 2.660 1.00 54.43 C ATOM 1221 C PRO A 85 6.620 7.622 4.066 1.00 12.23 C ATOM 1222 O PRO A 85 5.404 7.461 4.230 1.00 32.53 O ATOM 1223 CB PRO A 85 7.525 8.955 2.126 1.00 2.40 C ATOM 1224 CG PRO A 85 6.245 9.299 1.368 1.00 75.33 C ATOM 1225 CD PRO A 85 5.849 7.962 0.754 1.00 24.52 C ATOM 0 HA PRO A 85 8.149 6.940 2.789 1.00 54.43 H new ATOM 0 HB2 PRO A 85 7.716 9.661 2.934 1.00 2.40 H new ATOM 0 HB3 PRO A 85 8.397 8.975 1.473 1.00 2.40 H new ATOM 0 HG2 PRO A 85 5.472 9.684 2.033 1.00 75.33 H new ATOM 0 HG3 PRO A 85 6.418 10.059 0.606 1.00 75.33 H new ATOM 0 HD2 PRO A 85 4.767 7.884 0.652 1.00 24.52 H new ATOM 0 HD3 PRO A 85 6.272 7.850 -0.244 1.00 24.52 H new ATOM 1230 N VAL A 86 7.439 7.943 5.082 1.00 64.12 N ATOM 1231 CA VAL A 86 7.000 8.184 6.457 1.00 34.41 C ATOM 1232 C VAL A 86 7.987 9.045 7.260 1.00 24.21 C ATOM 1233 O VAL A 86 9.123 8.639 7.498 1.00 74.23 O ATOM 1234 CB VAL A 86 6.691 6.860 7.177 1.00 15.24 C ATOM 1235 CG1 VAL A 86 7.819 5.839 7.255 1.00 21.11 C ATOM 1236 CG2 VAL A 86 6.204 7.152 8.600 1.00 55.42 C ATOM 0 H VAL A 86 8.447 8.043 4.962 1.00 64.12 H new ATOM 0 HA VAL A 86 6.078 8.762 6.394 1.00 34.41 H new ATOM 0 HB VAL A 86 5.929 6.395 6.551 1.00 15.24 H new ATOM 0 HG11 VAL A 86 7.472 4.953 7.786 1.00 21.11 H new ATOM 0 HG12 VAL A 86 8.128 5.560 6.247 1.00 21.11 H new ATOM 0 HG13 VAL A 86 8.666 6.272 7.787 1.00 21.11 H new ATOM 0 HG21 VAL A 86 5.985 6.214 9.109 1.00 55.42 H new ATOM 0 HG22 VAL A 86 6.979 7.690 9.147 1.00 55.42 H new ATOM 0 HG23 VAL A 86 5.301 7.761 8.558 1.00 55.42 H new ATOM 1246 N TRP A 87 7.546 10.187 7.794 1.00 31.11 N ATOM 1247 CA TRP A 87 8.415 11.011 8.642 1.00 52.33 C ATOM 1248 C TRP A 87 7.662 11.767 9.747 1.00 13.10 C ATOM 1249 O TRP A 87 8.278 12.305 10.662 1.00 35.24 O ATOM 1250 CB TRP A 87 9.258 11.890 7.705 1.00 40.11 C ATOM 1251 CG TRP A 87 10.231 12.848 8.326 1.00 61.22 C ATOM 1252 CD1 TRP A 87 11.195 12.518 9.216 1.00 51.25 C ATOM 1253 CD2 TRP A 87 10.404 14.276 8.076 1.00 63.44 C ATOM 1254 NE1 TRP A 87 11.902 13.644 9.583 1.00 43.13 N ATOM 1255 CE2 TRP A 87 11.450 14.760 8.916 1.00 63.23 C ATOM 1256 CE3 TRP A 87 9.797 15.211 7.212 1.00 2.24 C ATOM 1257 CZ2 TRP A 87 11.839 16.106 8.931 1.00 71.43 C ATOM 1258 CZ3 TRP A 87 10.207 16.558 7.188 1.00 61.52 C ATOM 1259 CH2 TRP A 87 11.207 17.009 8.066 1.00 12.10 C ATOM 0 H TRP A 87 6.606 10.559 7.658 1.00 31.11 H new ATOM 0 HA TRP A 87 9.084 10.381 9.229 1.00 52.33 H new ATOM 0 HB2 TRP A 87 9.816 11.230 7.041 1.00 40.11 H new ATOM 0 HB3 TRP A 87 8.574 12.466 7.082 1.00 40.11 H new ATOM 0 HD1 TRP A 87 11.383 11.520 9.585 1.00 51.25 H new ATOM 0 HE1 TRP A 87 12.663 13.649 10.262 1.00 43.13 H new ATOM 0 HE3 TRP A 87 9.002 14.888 6.556 1.00 2.24 H new ATOM 0 HZ2 TRP A 87 12.616 16.443 9.601 1.00 71.43 H new ATOM 0 HZ3 TRP A 87 9.751 17.247 6.492 1.00 61.52 H new ATOM 0 HH2 TRP A 87 11.488 18.052 8.074 1.00 12.10 H new ATOM 1269 N SER A 88 6.328 11.723 9.761 1.00 4.02 N ATOM 1270 CA SER A 88 5.516 12.262 10.855 1.00 1.12 C ATOM 1271 C SER A 88 4.317 11.346 11.118 1.00 41.14 C ATOM 1272 O SER A 88 3.171 11.784 11.226 1.00 64.55 O ATOM 1273 CB SER A 88 5.117 13.715 10.560 1.00 34.51 C ATOM 1274 OG SER A 88 6.207 14.457 10.045 1.00 23.24 O ATOM 0 H SER A 88 5.777 11.310 9.009 1.00 4.02 H new ATOM 0 HA SER A 88 6.101 12.285 11.774 1.00 1.12 H new ATOM 0 HB2 SER A 88 4.295 13.730 9.845 1.00 34.51 H new ATOM 0 HB3 SER A 88 4.753 14.186 11.473 1.00 34.51 H new ATOM 0 HG SER A 88 5.921 15.377 9.866 1.00 23.24 H new ATOM 1279 N GLY A 89 4.568 10.034 11.136 1.00 74.41 N ATOM 1280 CA GLY A 89 3.546 9.004 11.270 1.00 55.35 C ATOM 1281 C GLY A 89 2.918 8.713 9.919 1.00 51.24 C ATOM 1282 O GLY A 89 3.088 7.621 9.375 1.00 14.01 O ATOM 0 H GLY A 89 5.511 9.654 11.056 1.00 74.41 H new ATOM 0 HA2 GLY A 89 3.987 8.095 11.678 1.00 55.35 H new ATOM 0 HA3 GLY A 89 2.780 9.330 11.973 1.00 55.35 H new ATOM 1286 N TYR A 90 2.258 9.715 9.353 1.00 73.15 N ATOM 1287 CA TYR A 90 1.549 9.686 8.086 1.00 0.04 C ATOM 1288 C TYR A 90 1.762 11.043 7.415 1.00 1.31 C ATOM 1289 O TYR A 90 0.951 11.948 7.576 1.00 35.24 O ATOM 1290 CB TYR A 90 0.060 9.321 8.275 1.00 55.02 C ATOM 1291 CG TYR A 90 -0.605 9.601 9.625 1.00 24.33 C ATOM 1292 CD1 TYR A 90 -0.361 10.786 10.351 1.00 3.11 C ATOM 1293 CD2 TYR A 90 -1.458 8.621 10.175 1.00 60.52 C ATOM 1294 CE1 TYR A 90 -0.886 10.939 11.647 1.00 53.44 C ATOM 1295 CE2 TYR A 90 -1.993 8.772 11.465 1.00 13.14 C ATOM 1296 CZ TYR A 90 -1.664 9.913 12.227 1.00 42.12 C ATOM 1297 OH TYR A 90 -2.110 10.040 13.504 1.00 75.34 O ATOM 0 H TYR A 90 2.202 10.630 9.800 1.00 73.15 H new ATOM 0 HA TYR A 90 1.941 8.903 7.437 1.00 0.04 H new ATOM 0 HB2 TYR A 90 -0.509 9.851 7.511 1.00 55.02 H new ATOM 0 HB3 TYR A 90 -0.047 8.256 8.070 1.00 55.02 H new ATOM 0 HD1 TYR A 90 0.229 11.576 9.911 1.00 3.11 H new ATOM 0 HD2 TYR A 90 -1.703 7.743 9.596 1.00 60.52 H new ATOM 0 HE1 TYR A 90 -0.693 11.846 12.201 1.00 53.44 H new ATOM 0 HE2 TYR A 90 -2.652 8.019 11.871 1.00 13.14 H new ATOM 0 HH TYR A 90 -2.631 9.247 13.749 1.00 75.34 H new ATOM 1306 N PRO A 91 2.888 11.245 6.712 1.00 4.30 N ATOM 1307 CA PRO A 91 3.105 12.454 5.933 1.00 22.34 C ATOM 1308 C PRO A 91 2.298 12.464 4.627 1.00 14.23 C ATOM 1309 O PRO A 91 2.322 13.479 3.939 1.00 24.53 O ATOM 1310 CB PRO A 91 4.608 12.460 5.643 1.00 40.05 C ATOM 1311 CG PRO A 91 4.922 10.979 5.508 1.00 1.21 C ATOM 1312 CD PRO A 91 4.047 10.373 6.609 1.00 2.13 C ATOM 0 HA PRO A 91 2.774 13.339 6.477 1.00 22.34 H new ATOM 0 HB2 PRO A 91 4.843 13.010 4.732 1.00 40.05 H new ATOM 0 HB3 PRO A 91 5.175 12.923 6.450 1.00 40.05 H new ATOM 0 HG2 PRO A 91 4.663 10.594 4.522 1.00 1.21 H new ATOM 0 HG3 PRO A 91 5.980 10.769 5.664 1.00 1.21 H new ATOM 0 HD2 PRO A 91 3.750 9.355 6.358 1.00 2.13 H new ATOM 0 HD3 PRO A 91 4.586 10.324 7.555 1.00 2.13 H new ATOM 1317 N ALA A 92 1.603 11.380 4.270 1.00 73.23 N ATOM 1318 CA ALA A 92 0.934 11.199 2.993 1.00 73.55 C ATOM 1319 C ALA A 92 -0.311 10.326 3.214 1.00 1.40 C ATOM 1320 O ALA A 92 -0.421 9.678 4.259 1.00 61.41 O ATOM 1321 CB ALA A 92 1.931 10.522 2.036 1.00 33.20 C ATOM 0 H ALA A 92 1.491 10.578 4.891 1.00 73.23 H new ATOM 0 HA ALA A 92 0.614 12.148 2.562 1.00 73.55 H new ATOM 0 HB1 ALA A 92 1.459 10.371 1.065 1.00 33.20 H new ATOM 0 HB2 ALA A 92 2.810 11.156 1.917 1.00 33.20 H new ATOM 0 HB3 ALA A 92 2.232 9.558 2.446 1.00 33.20 H new ATOM 1327 N THR A 93 -1.185 10.206 2.209 1.00 73.51 N ATOM 1328 CA THR A 93 -2.221 9.168 2.144 1.00 61.23 C ATOM 1329 C THR A 93 -2.314 8.492 0.757 1.00 43.23 C ATOM 1330 O THR A 93 -3.406 8.338 0.200 1.00 62.25 O ATOM 1331 CB THR A 93 -3.590 9.706 2.616 1.00 72.35 C ATOM 1332 OG1 THR A 93 -3.829 11.035 2.181 1.00 21.33 O ATOM 1333 CG2 THR A 93 -3.690 9.704 4.136 1.00 20.30 C ATOM 0 H THR A 93 -1.193 10.836 1.406 1.00 73.51 H new ATOM 0 HA THR A 93 -1.916 8.385 2.838 1.00 61.23 H new ATOM 0 HB THR A 93 -4.332 9.038 2.177 1.00 72.35 H new ATOM 0 HG1 THR A 93 -4.657 11.368 2.585 1.00 21.33 H new ATOM 0 HG21 THR A 93 -4.665 10.088 4.437 1.00 20.30 H new ATOM 0 HG22 THR A 93 -3.571 8.686 4.507 1.00 20.30 H new ATOM 0 HG23 THR A 93 -2.906 10.336 4.553 1.00 20.30 H new ATOM 1341 N PRO A 94 -1.204 7.966 0.215 1.00 1.03 N ATOM 1342 CA PRO A 94 -1.165 7.165 -0.999 1.00 43.43 C ATOM 1343 C PRO A 94 -1.488 5.695 -0.742 1.00 74.21 C ATOM 1344 O PRO A 94 -1.476 4.908 -1.685 1.00 61.25 O ATOM 1345 CB PRO A 94 0.269 7.311 -1.510 1.00 12.34 C ATOM 1346 CG PRO A 94 1.077 7.415 -0.226 1.00 14.34 C ATOM 1347 CD PRO A 94 0.153 8.245 0.628 1.00 23.12 C ATOM 0 HA PRO A 94 -1.914 7.504 -1.715 1.00 43.43 H new ATOM 0 HB2 PRO A 94 0.573 6.454 -2.111 1.00 12.34 H new ATOM 0 HB3 PRO A 94 0.387 8.196 -2.135 1.00 12.34 H new ATOM 0 HG2 PRO A 94 1.280 6.439 0.214 1.00 14.34 H new ATOM 0 HG3 PRO A 94 2.040 7.900 -0.383 1.00 14.34 H new ATOM 0 HD2 PRO A 94 0.288 8.004 1.682 1.00 23.12 H new ATOM 0 HD3 PRO A 94 0.377 9.306 0.513 1.00 23.12 H new ATOM 1352 N ILE A 95 -1.766 5.285 0.495 1.00 51.43 N ATOM 1353 CA ILE A 95 -2.270 3.950 0.799 1.00 32.43 C ATOM 1354 C ILE A 95 -3.549 4.178 1.604 1.00 35.33 C ATOM 1355 O ILE A 95 -3.596 4.057 2.830 1.00 21.42 O ATOM 1356 CB ILE A 95 -1.213 3.077 1.505 1.00 14.40 C ATOM 1357 CG1 ILE A 95 0.269 3.447 1.259 1.00 3.41 C ATOM 1358 CG2 ILE A 95 -1.485 1.599 1.196 1.00 43.42 C ATOM 1359 CD1 ILE A 95 0.798 3.418 -0.185 1.00 40.14 C ATOM 0 H ILE A 95 -1.646 5.875 1.318 1.00 51.43 H new ATOM 0 HA ILE A 95 -2.494 3.374 -0.099 1.00 32.43 H new ATOM 0 HB ILE A 95 -1.337 3.282 2.568 1.00 14.40 H new ATOM 0 HG12 ILE A 95 0.431 4.451 1.652 1.00 3.41 H new ATOM 0 HG13 ILE A 95 0.884 2.770 1.852 1.00 3.41 H new ATOM 0 HG21 ILE A 95 -0.739 0.980 1.694 1.00 43.42 H new ATOM 0 HG22 ILE A 95 -2.478 1.329 1.554 1.00 43.42 H new ATOM 0 HG23 ILE A 95 -1.431 1.436 0.120 1.00 43.42 H new ATOM 0 HD11 ILE A 95 1.851 3.701 -0.193 1.00 40.14 H new ATOM 0 HD12 ILE A 95 0.689 2.413 -0.592 1.00 40.14 H new ATOM 0 HD13 ILE A 95 0.229 4.120 -0.795 1.00 40.14 H new ATOM 1370 N LYS A 96 -4.568 4.637 0.890 1.00 24.50 N ATOM 1371 CA LYS A 96 -5.957 4.710 1.304 1.00 74.42 C ATOM 1372 C LYS A 96 -6.860 4.405 0.110 1.00 41.31 C ATOM 1373 O LYS A 96 -7.526 3.376 0.115 1.00 35.30 O ATOM 1374 CB LYS A 96 -6.230 6.071 1.980 1.00 32.14 C ATOM 1375 CG LYS A 96 -6.663 5.869 3.435 1.00 24.52 C ATOM 1376 CD LYS A 96 -8.100 5.344 3.549 1.00 23.31 C ATOM 1377 CE LYS A 96 -8.394 4.991 5.007 1.00 33.40 C ATOM 1378 NZ LYS A 96 -9.765 4.478 5.174 1.00 3.23 N ATOM 0 H LYS A 96 -4.434 4.991 -0.057 1.00 24.50 H new ATOM 0 HA LYS A 96 -6.183 3.955 2.056 1.00 74.42 H new ATOM 0 HB2 LYS A 96 -5.332 6.688 1.944 1.00 32.14 H new ATOM 0 HB3 LYS A 96 -7.007 6.606 1.434 1.00 32.14 H new ATOM 0 HG2 LYS A 96 -5.983 5.168 3.920 1.00 24.52 H new ATOM 0 HG3 LYS A 96 -6.581 6.815 3.971 1.00 24.52 H new ATOM 0 HD2 LYS A 96 -8.804 6.098 3.196 1.00 23.31 H new ATOM 0 HD3 LYS A 96 -8.230 4.466 2.917 1.00 23.31 H new ATOM 0 HE2 LYS A 96 -7.680 4.243 5.352 1.00 33.40 H new ATOM 0 HE3 LYS A 96 -8.257 5.874 5.631 1.00 33.40 H new ATOM 0 HZ1 LYS A 96 -9.930 4.249 6.175 1.00 3.23 H new ATOM 0 HZ2 LYS A 96 -10.446 5.202 4.868 1.00 3.23 H new ATOM 0 HZ3 LYS A 96 -9.888 3.621 4.598 1.00 3.23 H new ATOM 1388 N THR A 97 -6.830 5.213 -0.949 1.00 2.43 N ATOM 1389 CA THR A 97 -7.805 5.082 -2.036 1.00 75.43 C ATOM 1390 C THR A 97 -7.651 3.775 -2.844 1.00 44.22 C ATOM 1391 O THR A 97 -8.636 3.216 -3.323 1.00 72.22 O ATOM 1392 CB THR A 97 -7.715 6.368 -2.869 1.00 20.42 C ATOM 1393 OG1 THR A 97 -8.015 7.458 -2.010 1.00 24.32 O ATOM 1394 CG2 THR A 97 -8.716 6.398 -4.020 1.00 72.21 C ATOM 0 H THR A 97 -6.148 5.960 -1.079 1.00 2.43 H new ATOM 0 HA THR A 97 -8.815 4.983 -1.638 1.00 75.43 H new ATOM 0 HB THR A 97 -6.713 6.423 -3.295 1.00 20.42 H new ATOM 0 HG1 THR A 97 -7.964 8.296 -2.515 1.00 24.32 H new ATOM 0 HG21 THR A 97 -8.606 7.331 -4.574 1.00 72.21 H new ATOM 0 HG22 THR A 97 -8.529 5.556 -4.687 1.00 72.21 H new ATOM 0 HG23 THR A 97 -9.729 6.329 -3.623 1.00 72.21 H new ATOM 1402 N LEU A 98 -6.442 3.230 -2.955 1.00 20.11 N ATOM 1403 CA LEU A 98 -6.114 1.968 -3.617 1.00 72.32 C ATOM 1404 C LEU A 98 -6.812 0.797 -2.930 1.00 23.13 C ATOM 1405 O LEU A 98 -7.420 -0.038 -3.596 1.00 60.25 O ATOM 1406 CB LEU A 98 -4.576 1.824 -3.574 1.00 53.41 C ATOM 1407 CG LEU A 98 -3.909 0.839 -4.555 1.00 71.53 C ATOM 1408 CD1 LEU A 98 -4.487 -0.569 -4.563 1.00 53.14 C ATOM 1409 CD2 LEU A 98 -3.945 1.404 -5.975 1.00 11.11 C ATOM 0 H LEU A 98 -5.617 3.683 -2.563 1.00 20.11 H new ATOM 0 HA LEU A 98 -6.462 1.965 -4.650 1.00 72.32 H new ATOM 0 HB2 LEU A 98 -4.144 2.810 -3.747 1.00 53.41 H new ATOM 0 HB3 LEU A 98 -4.297 1.527 -2.563 1.00 53.41 H new ATOM 0 HG LEU A 98 -2.887 0.737 -4.191 1.00 71.53 H new ATOM 0 HD11 LEU A 98 -3.947 -1.180 -5.286 1.00 53.14 H new ATOM 0 HD12 LEU A 98 -4.388 -1.009 -3.571 1.00 53.14 H new ATOM 0 HD13 LEU A 98 -5.541 -0.528 -4.838 1.00 53.14 H new ATOM 0 HD21 LEU A 98 -3.471 0.700 -6.659 1.00 11.11 H new ATOM 0 HD22 LEU A 98 -4.980 1.563 -6.277 1.00 11.11 H new ATOM 0 HD23 LEU A 98 -3.409 2.353 -6.003 1.00 11.11 H new ATOM 1420 N LEU A 99 -6.778 0.752 -1.596 1.00 14.04 N ATOM 1421 CA LEU A 99 -7.414 -0.291 -0.805 1.00 22.54 C ATOM 1422 C LEU A 99 -8.879 -0.469 -1.182 1.00 1.21 C ATOM 1423 O LEU A 99 -9.332 -1.600 -1.356 1.00 35.52 O ATOM 1424 CB LEU A 99 -7.299 0.066 0.682 1.00 52.32 C ATOM 1425 CG LEU A 99 -5.904 -0.082 1.340 1.00 75.52 C ATOM 1426 CD1 LEU A 99 -4.735 -0.551 0.470 1.00 2.22 C ATOM 1427 CD2 LEU A 99 -5.480 1.224 2.010 1.00 0.42 C ATOM 0 H LEU A 99 -6.299 1.453 -1.031 1.00 14.04 H new ATOM 0 HA LEU A 99 -6.905 -1.233 -1.007 1.00 22.54 H new ATOM 0 HB2 LEU A 99 -7.624 1.099 0.808 1.00 52.32 H new ATOM 0 HB3 LEU A 99 -8.001 -0.558 1.235 1.00 52.32 H new ATOM 0 HG LEU A 99 -6.082 -0.897 2.042 1.00 75.52 H new ATOM 0 HD11 LEU A 99 -3.830 -0.604 1.075 1.00 2.22 H new ATOM 0 HD12 LEU A 99 -4.957 -1.537 0.063 1.00 2.22 H new ATOM 0 HD13 LEU A 99 -4.584 0.154 -0.348 1.00 2.22 H new ATOM 0 HD21 LEU A 99 -4.498 1.097 2.465 1.00 0.42 H new ATOM 0 HD22 LEU A 99 -5.434 2.017 1.264 1.00 0.42 H new ATOM 0 HD23 LEU A 99 -6.205 1.490 2.779 1.00 0.42 H new ATOM 1438 N ASP A 100 -9.600 0.636 -1.369 1.00 64.52 N ATOM 1439 CA ASP A 100 -10.994 0.601 -1.812 1.00 24.50 C ATOM 1440 C ASP A 100 -11.172 -0.133 -3.143 1.00 31.10 C ATOM 1441 O ASP A 100 -12.121 -0.890 -3.325 1.00 4.44 O ATOM 1442 CB ASP A 100 -11.515 2.026 -1.925 1.00 32.50 C ATOM 1443 CG ASP A 100 -12.992 2.056 -2.311 1.00 52.23 C ATOM 1444 OD1 ASP A 100 -13.838 1.952 -1.384 1.00 75.13 O ATOM 1445 OD2 ASP A 100 -13.335 2.251 -3.490 1.00 52.03 O ATOM 0 H ASP A 100 -9.237 1.577 -1.219 1.00 64.52 H new ATOM 0 HA ASP A 100 -11.566 0.044 -1.070 1.00 24.50 H new ATOM 0 HB2 ASP A 100 -11.376 2.541 -0.974 1.00 32.50 H new ATOM 0 HB3 ASP A 100 -10.933 2.569 -2.670 1.00 32.50 H new ATOM 1449 N GLN A 101 -10.240 0.049 -4.076 1.00 20.40 N ATOM 1450 CA GLN A 101 -10.284 -0.579 -5.393 1.00 72.33 C ATOM 1451 C GLN A 101 -10.032 -2.088 -5.278 1.00 2.30 C ATOM 1452 O GLN A 101 -10.675 -2.878 -5.971 1.00 2.43 O ATOM 1453 CB GLN A 101 -9.299 0.138 -6.341 1.00 71.23 C ATOM 1454 CG GLN A 101 -9.650 1.630 -6.389 1.00 54.11 C ATOM 1455 CD GLN A 101 -9.019 2.469 -7.496 1.00 62.35 C ATOM 1456 OE1 GLN A 101 -8.590 1.974 -8.535 1.00 31.11 O ATOM 1457 NE2 GLN A 101 -9.018 3.777 -7.307 1.00 11.31 N ATOM 0 H GLN A 101 -9.423 0.644 -3.936 1.00 20.40 H new ATOM 0 HA GLN A 101 -11.278 -0.473 -5.827 1.00 72.33 H new ATOM 0 HB2 GLN A 101 -8.275 0.003 -5.992 1.00 71.23 H new ATOM 0 HB3 GLN A 101 -9.355 -0.294 -7.340 1.00 71.23 H new ATOM 0 HG2 GLN A 101 -10.733 1.718 -6.477 1.00 54.11 H new ATOM 0 HG3 GLN A 101 -9.371 2.072 -5.432 1.00 54.11 H new ATOM 0 HE21 GLN A 101 -9.379 4.167 -6.436 1.00 11.31 H new ATOM 0 HE22 GLN A 101 -8.656 4.397 -8.032 1.00 11.31 H new ATOM 1464 N MET A 102 -9.190 -2.516 -4.332 1.00 41.35 N ATOM 1465 CA MET A 102 -8.820 -3.912 -4.078 1.00 62.52 C ATOM 1466 C MET A 102 -9.968 -4.779 -3.515 1.00 71.32 C ATOM 1467 O MET A 102 -9.732 -5.927 -3.142 1.00 42.01 O ATOM 1468 CB MET A 102 -7.631 -3.955 -3.106 1.00 73.41 C ATOM 1469 CG MET A 102 -6.355 -3.282 -3.622 1.00 13.21 C ATOM 1470 SD MET A 102 -5.040 -4.414 -4.148 1.00 73.45 S ATOM 1471 CE MET A 102 -4.555 -5.142 -2.560 1.00 75.11 C ATOM 0 H MET A 102 -8.727 -1.869 -3.694 1.00 41.35 H new ATOM 0 HA MET A 102 -8.560 -4.339 -5.047 1.00 62.52 H new ATOM 0 HB2 MET A 102 -7.926 -3.476 -2.172 1.00 73.41 H new ATOM 0 HB3 MET A 102 -7.407 -4.996 -2.873 1.00 73.41 H new ATOM 0 HG2 MET A 102 -6.617 -2.640 -4.463 1.00 13.21 H new ATOM 0 HG3 MET A 102 -5.963 -2.635 -2.838 1.00 13.21 H new ATOM 0 HE1 MET A 102 -3.716 -5.822 -2.712 1.00 75.11 H new ATOM 0 HE2 MET A 102 -4.260 -4.350 -1.872 1.00 75.11 H new ATOM 0 HE3 MET A 102 -5.397 -5.693 -2.140 1.00 75.11 H new ATOM 1479 N LYS A 103 -11.215 -4.297 -3.452 1.00 33.22 N ATOM 1480 CA LYS A 103 -12.401 -4.965 -2.881 1.00 74.24 C ATOM 1481 C LYS A 103 -12.833 -6.292 -3.528 1.00 14.20 C ATOM 1482 O LYS A 103 -13.951 -6.767 -3.317 1.00 53.42 O ATOM 1483 CB LYS A 103 -13.558 -3.944 -2.917 1.00 42.35 C ATOM 1484 CG LYS A 103 -13.520 -3.055 -1.683 1.00 61.23 C ATOM 1485 CD LYS A 103 -14.155 -3.786 -0.490 1.00 4.10 C ATOM 1486 CE LYS A 103 -13.691 -3.237 0.856 1.00 0.21 C ATOM 1487 NZ LYS A 103 -14.365 -1.993 1.256 1.00 51.45 N ATOM 0 H LYS A 103 -11.442 -3.373 -3.820 1.00 33.22 H new ATOM 0 HA LYS A 103 -12.125 -5.270 -1.872 1.00 74.24 H new ATOM 0 HB2 LYS A 103 -13.484 -3.332 -3.816 1.00 42.35 H new ATOM 0 HB3 LYS A 103 -14.512 -4.468 -2.966 1.00 42.35 H new ATOM 0 HG2 LYS A 103 -12.490 -2.787 -1.449 1.00 61.23 H new ATOM 0 HG3 LYS A 103 -14.055 -2.126 -1.877 1.00 61.23 H new ATOM 0 HD2 LYS A 103 -15.240 -3.705 -0.556 1.00 4.10 H new ATOM 0 HD3 LYS A 103 -13.911 -4.847 -0.548 1.00 4.10 H new ATOM 0 HE2 LYS A 103 -13.859 -3.993 1.623 1.00 0.21 H new ATOM 0 HE3 LYS A 103 -12.616 -3.059 0.814 1.00 0.21 H new ATOM 0 HZ1 LYS A 103 -13.999 -1.681 2.178 1.00 51.45 H new ATOM 0 HZ2 LYS A 103 -14.185 -1.256 0.545 1.00 51.45 H new ATOM 0 HZ3 LYS A 103 -15.389 -2.161 1.329 1.00 51.45 H new ATOM 1497 N ASN A 104 -12.019 -6.846 -4.410 1.00 64.33 N ATOM 1498 CA ASN A 104 -12.204 -8.081 -5.132 1.00 20.22 C ATOM 1499 C ASN A 104 -10.884 -8.849 -5.252 1.00 53.11 C ATOM 1500 O ASN A 104 -10.910 -9.988 -5.712 1.00 42.01 O ATOM 1501 CB ASN A 104 -12.808 -7.780 -6.510 1.00 1.21 C ATOM 1502 CG ASN A 104 -12.086 -6.717 -7.334 1.00 22.20 C ATOM 1503 OD1 ASN A 104 -12.140 -5.459 -6.903 1.00 75.45 O flip ATOM 1504 ND2 ASN A 104 -11.507 -7.017 -8.375 1.00 60.21 N flip ATOM 0 H ASN A 104 -11.136 -6.399 -4.657 1.00 64.33 H new ATOM 0 HA ASN A 104 -12.895 -8.719 -4.581 1.00 20.22 H new ATOM 0 HB2 ASN A 104 -12.831 -8.705 -7.086 1.00 1.21 H new ATOM 0 HB3 ASN A 104 -13.842 -7.465 -6.371 1.00 1.21 H new ATOM 0 HD21 ASN A 104 -11.481 -7.989 -8.682 1.00 60.21 H new ATOM 0 HD22 ASN A 104 -11.052 -6.294 -8.932 1.00 60.21 H new ATOM 1510 N TYR A 105 -9.753 -8.267 -4.828 1.00 74.34 N ATOM 1511 CA TYR A 105 -8.465 -8.941 -4.771 1.00 72.15 C ATOM 1512 C TYR A 105 -8.564 -10.161 -3.860 1.00 53.03 C ATOM 1513 O TYR A 105 -9.321 -10.125 -2.895 1.00 71.23 O ATOM 1514 CB TYR A 105 -7.402 -7.975 -4.227 1.00 40.44 C ATOM 1515 CG TYR A 105 -6.040 -8.616 -4.088 1.00 63.25 C ATOM 1516 CD1 TYR A 105 -5.464 -9.242 -5.205 1.00 23.54 C ATOM 1517 CD2 TYR A 105 -5.387 -8.665 -2.842 1.00 21.14 C ATOM 1518 CE1 TYR A 105 -4.235 -9.904 -5.099 1.00 33.44 C ATOM 1519 CE2 TYR A 105 -4.143 -9.309 -2.735 1.00 41.05 C ATOM 1520 CZ TYR A 105 -3.563 -9.932 -3.861 1.00 21.24 C ATOM 1521 OH TYR A 105 -2.377 -10.581 -3.742 1.00 72.35 O ATOM 0 H TYR A 105 -9.716 -7.298 -4.512 1.00 74.34 H new ATOM 0 HA TYR A 105 -8.181 -9.263 -5.773 1.00 72.15 H new ATOM 0 HB2 TYR A 105 -7.327 -7.114 -4.891 1.00 40.44 H new ATOM 0 HB3 TYR A 105 -7.722 -7.600 -3.255 1.00 40.44 H new ATOM 0 HD1 TYR A 105 -5.975 -9.213 -6.156 1.00 23.54 H new ATOM 0 HD2 TYR A 105 -5.840 -8.210 -1.973 1.00 21.14 H new ATOM 0 HE1 TYR A 105 -3.804 -10.391 -5.962 1.00 33.44 H new ATOM 0 HE2 TYR A 105 -3.628 -9.327 -1.786 1.00 41.05 H new ATOM 0 HH TYR A 105 -1.926 -10.290 -2.922 1.00 72.35 H new ATOM 1530 N ARG A 106 -7.800 -11.219 -4.152 1.00 52.44 N ATOM 1531 CA ARG A 106 -7.973 -12.553 -3.574 1.00 64.23 C ATOM 1532 C ARG A 106 -6.639 -13.199 -3.198 1.00 3.04 C ATOM 1533 O ARG A 106 -6.557 -14.429 -3.140 1.00 73.51 O ATOM 1534 CB ARG A 106 -8.789 -13.401 -4.573 1.00 14.44 C ATOM 1535 CG ARG A 106 -10.282 -13.039 -4.513 1.00 31.51 C ATOM 1536 CD ARG A 106 -11.132 -14.204 -4.011 1.00 74.22 C ATOM 1537 NE ARG A 106 -11.337 -15.213 -5.062 1.00 33.14 N ATOM 1538 CZ ARG A 106 -11.079 -16.523 -4.998 1.00 12.12 C ATOM 1539 NH1 ARG A 106 -10.417 -17.048 -3.968 1.00 15.44 N ATOM 1540 NH2 ARG A 106 -11.489 -17.302 -5.995 1.00 53.04 N ATOM 0 H ARG A 106 -7.025 -11.168 -4.814 1.00 52.44 H new ATOM 0 HA ARG A 106 -8.519 -12.481 -2.633 1.00 64.23 H new ATOM 0 HB2 ARG A 106 -8.413 -13.241 -5.583 1.00 14.44 H new ATOM 0 HB3 ARG A 106 -8.659 -14.460 -4.348 1.00 14.44 H new ATOM 0 HG2 ARG A 106 -10.421 -12.180 -3.857 1.00 31.51 H new ATOM 0 HG3 ARG A 106 -10.623 -12.742 -5.505 1.00 31.51 H new ATOM 0 HD2 ARG A 106 -10.647 -14.666 -3.151 1.00 74.22 H new ATOM 0 HD3 ARG A 106 -12.098 -13.831 -3.670 1.00 74.22 H new ATOM 0 HE ARG A 106 -11.721 -14.873 -5.943 1.00 33.14 H new ATOM 0 HH11 ARG A 106 -10.096 -16.448 -3.208 1.00 15.44 H new ATOM 0 HH12 ARG A 106 -10.231 -18.050 -3.939 1.00 15.44 H new ATOM 0 HH21 ARG A 106 -11.989 -16.897 -6.786 1.00 53.04 H new ATOM 0 HH22 ARG A 106 -11.304 -18.305 -5.968 1.00 53.04 H new ATOM 1551 N GLY A 107 -5.592 -12.409 -2.976 1.00 41.23 N ATOM 1552 CA GLY A 107 -4.290 -12.889 -2.530 1.00 13.04 C ATOM 1553 C GLY A 107 -3.869 -12.145 -1.270 1.00 21.11 C ATOM 1554 O GLY A 107 -4.723 -11.749 -0.471 1.00 53.24 O ATOM 0 H GLY A 107 -5.627 -11.398 -3.104 1.00 41.23 H new ATOM 0 HA2 GLY A 107 -4.335 -13.960 -2.333 1.00 13.04 H new ATOM 0 HA3 GLY A 107 -3.549 -12.741 -3.316 1.00 13.04 H new ATOM 1558 N GLU A 108 -2.564 -11.949 -1.091 1.00 51.31 N ATOM 1559 CA GLU A 108 -1.982 -11.493 0.151 1.00 1.44 C ATOM 1560 C GLU A 108 -1.449 -10.092 -0.058 1.00 33.22 C ATOM 1561 O GLU A 108 -0.839 -9.795 -1.093 1.00 24.52 O ATOM 1562 CB GLU A 108 -0.801 -12.399 0.508 1.00 1.21 C ATOM 1563 CG GLU A 108 -1.174 -13.829 0.916 1.00 14.31 C ATOM 1564 CD GLU A 108 -2.202 -13.976 2.042 1.00 71.11 C ATOM 1565 OE1 GLU A 108 -3.404 -13.723 1.796 1.00 14.42 O ATOM 1566 OE2 GLU A 108 -1.816 -14.364 3.176 1.00 4.32 O ATOM 0 H GLU A 108 -1.875 -12.109 -1.826 1.00 51.31 H new ATOM 0 HA GLU A 108 -2.730 -11.512 0.944 1.00 1.44 H new ATOM 0 HB2 GLU A 108 -0.129 -12.447 -0.349 1.00 1.21 H new ATOM 0 HB3 GLU A 108 -0.245 -11.939 1.325 1.00 1.21 H new ATOM 0 HG2 GLU A 108 -1.557 -14.345 0.036 1.00 14.31 H new ATOM 0 HG3 GLU A 108 -0.263 -14.346 1.217 1.00 14.31 H new ATOM 1571 N VAL A 109 -1.557 -9.269 0.980 1.00 51.01 N ATOM 1572 CA VAL A 109 -1.086 -7.886 0.920 1.00 3.32 C ATOM 1573 C VAL A 109 0.062 -7.662 1.904 1.00 34.13 C ATOM 1574 O VAL A 109 0.031 -8.086 3.061 1.00 35.43 O ATOM 1575 CB VAL A 109 -2.226 -6.873 1.119 1.00 4.34 C ATOM 1576 CG1 VAL A 109 -1.793 -5.483 0.619 1.00 71.51 C ATOM 1577 CG2 VAL A 109 -3.519 -7.244 0.368 1.00 32.23 C ATOM 0 H VAL A 109 -1.967 -9.535 1.875 1.00 51.01 H new ATOM 0 HA VAL A 109 -0.701 -7.712 -0.085 1.00 3.32 H new ATOM 0 HB VAL A 109 -2.434 -6.877 2.189 1.00 4.34 H new ATOM 0 HG11 VAL A 109 -2.608 -4.774 0.765 1.00 71.51 H new ATOM 0 HG12 VAL A 109 -0.919 -5.151 1.179 1.00 71.51 H new ATOM 0 HG13 VAL A 109 -1.546 -5.538 -0.441 1.00 71.51 H new ATOM 0 HG21 VAL A 109 -4.279 -6.485 0.555 1.00 32.23 H new ATOM 0 HG22 VAL A 109 -3.316 -7.299 -0.701 1.00 32.23 H new ATOM 0 HG23 VAL A 109 -3.879 -8.211 0.719 1.00 32.23 H new ATOM 1587 N ALA A 110 1.078 -6.956 1.423 1.00 3.00 N ATOM 1588 CA ALA A 110 2.285 -6.563 2.114 1.00 24.42 C ATOM 1589 C ALA A 110 2.542 -5.117 1.716 1.00 4.41 C ATOM 1590 O ALA A 110 2.013 -4.621 0.714 1.00 32.54 O ATOM 1591 CB ALA A 110 3.440 -7.480 1.682 1.00 53.23 C ATOM 0 H ALA A 110 1.071 -6.620 0.460 1.00 3.00 H new ATOM 0 HA ALA A 110 2.194 -6.650 3.197 1.00 24.42 H new ATOM 0 HB1 ALA A 110 4.352 -7.186 2.202 1.00 53.23 H new ATOM 0 HB2 ALA A 110 3.197 -8.513 1.931 1.00 53.23 H new ATOM 0 HB3 ALA A 110 3.591 -7.392 0.606 1.00 53.23 H new ATOM 1597 N SER A 111 3.370 -4.419 2.475 1.00 60.25 N ATOM 1598 CA SER A 111 3.764 -3.072 2.147 1.00 40.11 C ATOM 1599 C SER A 111 5.209 -2.819 2.571 1.00 64.12 C ATOM 1600 O SER A 111 5.655 -3.282 3.624 1.00 73.25 O ATOM 1601 CB SER A 111 2.743 -2.130 2.790 1.00 60.15 C ATOM 1602 OG SER A 111 3.042 -0.771 2.537 1.00 1.03 O ATOM 0 H SER A 111 3.785 -4.777 3.336 1.00 60.25 H new ATOM 0 HA SER A 111 3.757 -2.894 1.072 1.00 40.11 H new ATOM 0 HB2 SER A 111 1.748 -2.359 2.409 1.00 60.15 H new ATOM 0 HB3 SER A 111 2.719 -2.302 3.866 1.00 60.15 H new ATOM 0 HG SER A 111 3.503 -0.692 1.676 1.00 1.03 H new ATOM 1607 N PHE A 112 5.920 -2.028 1.779 1.00 34.11 N ATOM 1608 CA PHE A 112 7.326 -1.714 1.942 1.00 53.14 C ATOM 1609 C PHE A 112 7.464 -0.201 2.030 1.00 75.42 C ATOM 1610 O PHE A 112 6.761 0.528 1.331 1.00 75.52 O ATOM 1611 CB PHE A 112 8.129 -2.330 0.785 1.00 22.13 C ATOM 1612 CG PHE A 112 7.837 -1.797 -0.618 1.00 42.44 C ATOM 1613 CD1 PHE A 112 6.589 -2.018 -1.239 1.00 0.12 C ATOM 1614 CD2 PHE A 112 8.841 -1.119 -1.336 1.00 4.40 C ATOM 1615 CE1 PHE A 112 6.337 -1.534 -2.534 1.00 4.23 C ATOM 1616 CE2 PHE A 112 8.602 -0.679 -2.650 1.00 24.31 C ATOM 1617 CZ PHE A 112 7.346 -0.870 -3.246 1.00 33.50 C ATOM 0 H PHE A 112 5.509 -1.567 0.967 1.00 34.11 H new ATOM 0 HA PHE A 112 7.731 -2.142 2.859 1.00 53.14 H new ATOM 0 HB2 PHE A 112 9.189 -2.182 0.991 1.00 22.13 H new ATOM 0 HB3 PHE A 112 7.952 -3.406 0.783 1.00 22.13 H new ATOM 0 HD1 PHE A 112 5.820 -2.565 -0.714 1.00 0.12 H new ATOM 0 HD2 PHE A 112 9.800 -0.936 -0.875 1.00 4.40 H new ATOM 0 HE1 PHE A 112 5.364 -1.674 -2.982 1.00 4.23 H new ATOM 0 HE2 PHE A 112 9.390 -0.191 -3.204 1.00 24.31 H new ATOM 0 HZ PHE A 112 7.158 -0.508 -4.246 1.00 33.50 H new ATOM 1626 N PHE A 113 8.353 0.289 2.886 1.00 14.03 N ATOM 1627 CA PHE A 113 8.657 1.710 2.993 1.00 35.32 C ATOM 1628 C PHE A 113 10.171 1.896 2.990 1.00 42.43 C ATOM 1629 O PHE A 113 10.929 0.939 3.148 1.00 64.51 O ATOM 1630 CB PHE A 113 7.951 2.370 4.194 1.00 4.42 C ATOM 1631 CG PHE A 113 8.040 1.603 5.494 1.00 43.23 C ATOM 1632 CD1 PHE A 113 7.134 0.557 5.724 1.00 42.33 C ATOM 1633 CD2 PHE A 113 9.024 1.898 6.452 1.00 55.02 C ATOM 1634 CE1 PHE A 113 7.256 -0.256 6.860 1.00 1.10 C ATOM 1635 CE2 PHE A 113 9.138 1.096 7.599 1.00 40.21 C ATOM 1636 CZ PHE A 113 8.288 -0.009 7.776 1.00 35.54 C ATOM 0 H PHE A 113 8.887 -0.294 3.530 1.00 14.03 H new ATOM 0 HA PHE A 113 8.255 2.234 2.126 1.00 35.32 H new ATOM 0 HB2 PHE A 113 8.378 3.362 4.346 1.00 4.42 H new ATOM 0 HB3 PHE A 113 6.899 2.510 3.945 1.00 4.42 H new ATOM 0 HD1 PHE A 113 6.335 0.376 5.020 1.00 42.33 H new ATOM 0 HD2 PHE A 113 9.689 2.737 6.307 1.00 55.02 H new ATOM 0 HE1 PHE A 113 6.561 -1.065 7.028 1.00 1.10 H new ATOM 0 HE2 PHE A 113 9.881 1.329 8.347 1.00 40.21 H new ATOM 0 HZ PHE A 113 8.430 -0.669 8.619 1.00 35.54 H new ATOM 1645 N THR A 114 10.608 3.132 2.781 1.00 22.31 N ATOM 1646 CA THR A 114 12.000 3.507 2.553 1.00 33.12 C ATOM 1647 C THR A 114 12.394 4.668 3.490 1.00 42.13 C ATOM 1648 O THR A 114 13.356 5.391 3.234 1.00 24.42 O ATOM 1649 CB THR A 114 12.182 3.885 1.071 1.00 11.13 C ATOM 1650 OG1 THR A 114 11.175 4.790 0.647 1.00 31.42 O ATOM 1651 CG2 THR A 114 12.160 2.667 0.156 1.00 54.02 C ATOM 0 H THR A 114 9.977 3.934 2.765 1.00 22.31 H new ATOM 0 HA THR A 114 12.658 2.667 2.778 1.00 33.12 H new ATOM 0 HB THR A 114 13.161 4.358 0.998 1.00 11.13 H new ATOM 0 HG1 THR A 114 11.314 5.015 -0.297 1.00 31.42 H new ATOM 0 HG21 THR A 114 12.292 2.986 -0.878 1.00 54.02 H new ATOM 0 HG22 THR A 114 12.968 1.989 0.433 1.00 54.02 H new ATOM 0 HG23 THR A 114 11.204 2.153 0.258 1.00 54.02 H new ATOM 1659 N SER A 115 11.613 4.904 4.544 1.00 0.34 N ATOM 1660 CA SER A 115 11.697 6.074 5.402 1.00 3.23 C ATOM 1661 C SER A 115 11.665 5.573 6.842 1.00 53.12 C ATOM 1662 O SER A 115 10.761 4.812 7.187 1.00 61.24 O ATOM 1663 CB SER A 115 10.482 6.956 5.106 1.00 34.11 C ATOM 1664 OG SER A 115 10.492 7.535 3.817 1.00 11.24 O ATOM 0 H SER A 115 10.878 4.257 4.830 1.00 0.34 H new ATOM 0 HA SER A 115 12.605 6.654 5.235 1.00 3.23 H new ATOM 0 HB2 SER A 115 9.577 6.359 5.218 1.00 34.11 H new ATOM 0 HB3 SER A 115 10.433 7.751 5.850 1.00 34.11 H new ATOM 0 HG SER A 115 10.166 8.458 3.870 1.00 11.24 H new ATOM 1669 N ALA A 116 12.632 5.954 7.679 1.00 60.53 N ATOM 1670 CA ALA A 116 12.789 5.396 9.025 1.00 32.22 C ATOM 1671 C ALA A 116 13.220 6.407 10.094 1.00 23.30 C ATOM 1672 O ALA A 116 13.156 6.065 11.277 1.00 61.21 O ATOM 1673 CB ALA A 116 13.796 4.239 8.966 1.00 71.32 C ATOM 0 H ALA A 116 13.330 6.659 7.443 1.00 60.53 H new ATOM 0 HA ALA A 116 11.801 5.055 9.334 1.00 32.22 H new ATOM 0 HB1 ALA A 116 13.922 3.815 9.962 1.00 71.32 H new ATOM 0 HB2 ALA A 116 13.427 3.470 8.288 1.00 71.32 H new ATOM 0 HB3 ALA A 116 14.756 4.610 8.606 1.00 71.32 H new ATOM 1679 N GLY A 117 13.652 7.616 9.712 1.00 1.03 N ATOM 1680 CA GLY A 117 14.462 8.495 10.549 1.00 35.52 C ATOM 1681 C GLY A 117 13.886 8.821 11.927 1.00 4.21 C ATOM 1682 O GLY A 117 14.666 9.066 12.852 1.00 4.00 O ATOM 0 H GLY A 117 13.442 8.013 8.796 1.00 1.03 H new ATOM 0 HA2 GLY A 117 15.441 8.035 10.685 1.00 35.52 H new ATOM 0 HA3 GLY A 117 14.621 9.430 10.013 1.00 35.52 H new ATOM 1686 N THR A 118 12.563 8.827 12.096 1.00 34.20 N ATOM 1687 CA THR A 118 11.926 9.244 13.347 1.00 62.43 C ATOM 1688 C THR A 118 10.680 8.427 13.696 1.00 51.05 C ATOM 1689 O THR A 118 10.305 8.353 14.866 1.00 23.42 O ATOM 1690 CB THR A 118 11.547 10.730 13.231 1.00 74.31 C ATOM 1691 OG1 THR A 118 10.903 10.963 11.997 1.00 61.15 O ATOM 1692 CG2 THR A 118 12.760 11.661 13.312 1.00 3.21 C ATOM 0 H THR A 118 11.904 8.544 11.371 1.00 34.20 H new ATOM 0 HA THR A 118 12.643 9.075 14.151 1.00 62.43 H new ATOM 0 HB THR A 118 10.890 10.948 14.073 1.00 74.31 H new ATOM 0 HG1 THR A 118 11.376 11.669 11.509 1.00 61.15 H new ATOM 0 HG21 THR A 118 12.431 12.696 13.224 1.00 3.21 H new ATOM 0 HG22 THR A 118 13.263 11.520 14.268 1.00 3.21 H new ATOM 0 HG23 THR A 118 13.451 11.430 12.501 1.00 3.21 H new ATOM 1700 N ASN A 119 10.009 7.832 12.710 1.00 61.54 N ATOM 1701 CA ASN A 119 8.638 7.347 12.817 1.00 23.43 C ATOM 1702 C ASN A 119 8.577 6.014 12.081 1.00 21.53 C ATOM 1703 O ASN A 119 8.419 5.976 10.855 1.00 11.30 O ATOM 1704 CB ASN A 119 7.688 8.422 12.236 1.00 71.34 C ATOM 1705 CG ASN A 119 6.749 9.033 13.256 1.00 71.23 C ATOM 1706 OD1 ASN A 119 5.784 8.261 13.712 1.00 2.34 O flip ATOM 1707 ND2 ASN A 119 6.846 10.208 13.584 1.00 53.34 N flip ATOM 0 H ASN A 119 10.418 7.671 11.790 1.00 61.54 H new ATOM 0 HA ASN A 119 8.322 7.179 13.846 1.00 23.43 H new ATOM 0 HB2 ASN A 119 8.286 9.215 11.787 1.00 71.34 H new ATOM 0 HB3 ASN A 119 7.098 7.976 11.436 1.00 71.34 H new ATOM 0 HD21 ASN A 119 7.605 10.780 13.213 1.00 53.34 H new ATOM 0 HD22 ASN A 119 6.168 10.615 14.228 1.00 53.34 H new ATOM 1713 N HIS A 120 8.708 4.923 12.834 1.00 51.14 N ATOM 1714 CA HIS A 120 8.570 3.550 12.377 1.00 4.14 C ATOM 1715 C HIS A 120 7.377 2.911 13.057 1.00 75.35 C ATOM 1716 O HIS A 120 6.333 2.769 12.432 1.00 11.03 O ATOM 1717 CB HIS A 120 9.861 2.737 12.590 1.00 2.32 C ATOM 1718 CG HIS A 120 9.672 1.284 12.221 1.00 54.04 C ATOM 1719 ND1 HIS A 120 9.885 0.178 13.019 1.00 64.55 N ATOM 1720 CD2 HIS A 120 9.102 0.849 11.058 1.00 32.22 C ATOM 1721 CE1 HIS A 120 9.462 -0.900 12.336 1.00 54.14 C ATOM 1722 NE2 HIS A 120 8.968 -0.540 11.138 1.00 22.20 N ATOM 0 H HIS A 120 8.924 4.981 13.829 1.00 51.14 H new ATOM 0 HA HIS A 120 8.397 3.556 11.301 1.00 4.14 H new ATOM 0 HB2 HIS A 120 10.664 3.164 11.989 1.00 2.32 H new ATOM 0 HB3 HIS A 120 10.170 2.811 13.633 1.00 2.32 H new ATOM 0 HD1 HIS A 120 10.289 0.179 13.955 1.00 64.55 H new ATOM 0 HD2 HIS A 120 8.807 1.469 10.224 1.00 32.22 H new ATOM 0 HE1 HIS A 120 9.512 -1.916 12.700 1.00 54.14 H new ATOM 1729 N LYS A 121 7.497 2.530 14.330 1.00 1.11 N ATOM 1730 CA LYS A 121 6.523 1.648 14.968 1.00 43.31 C ATOM 1731 C LYS A 121 5.118 2.265 15.050 1.00 4.32 C ATOM 1732 O LYS A 121 4.161 1.503 15.213 1.00 54.15 O ATOM 1733 CB LYS A 121 7.093 1.171 16.311 1.00 41.04 C ATOM 1734 CG LYS A 121 6.432 -0.119 16.825 1.00 3.40 C ATOM 1735 CD LYS A 121 5.411 0.116 17.947 1.00 35.43 C ATOM 1736 CE LYS A 121 4.339 -0.975 17.918 1.00 34.52 C ATOM 1737 NZ LYS A 121 3.282 -0.670 16.930 1.00 0.14 N ATOM 0 H LYS A 121 8.262 2.820 14.939 1.00 1.11 H new ATOM 0 HA LYS A 121 6.366 0.768 14.345 1.00 43.31 H new ATOM 0 HB2 LYS A 121 8.165 1.005 16.205 1.00 41.04 H new ATOM 0 HB3 LYS A 121 6.964 1.959 17.053 1.00 41.04 H new ATOM 0 HG2 LYS A 121 5.936 -0.619 15.993 1.00 3.40 H new ATOM 0 HG3 LYS A 121 7.207 -0.795 17.187 1.00 3.40 H new ATOM 0 HD2 LYS A 121 5.915 0.116 18.914 1.00 35.43 H new ATOM 0 HD3 LYS A 121 4.948 1.095 17.829 1.00 35.43 H new ATOM 0 HE2 LYS A 121 4.800 -1.933 17.676 1.00 34.52 H new ATOM 0 HE3 LYS A 121 3.895 -1.076 18.908 1.00 34.52 H new ATOM 0 HZ1 LYS A 121 2.410 -0.400 17.427 1.00 0.14 H new ATOM 0 HZ2 LYS A 121 3.591 0.115 16.322 1.00 0.14 H new ATOM 0 HZ3 LYS A 121 3.101 -1.511 16.345 1.00 0.14 H new ATOM 1747 N ALA A 122 4.976 3.588 14.881 1.00 31.24 N ATOM 1748 CA ALA A 122 3.683 4.239 14.704 1.00 14.04 C ATOM 1749 C ALA A 122 2.999 3.853 13.382 1.00 44.03 C ATOM 1750 O ALA A 122 1.804 3.563 13.372 1.00 15.04 O ATOM 1751 CB ALA A 122 3.885 5.756 14.785 1.00 61.42 C ATOM 0 H ALA A 122 5.765 4.235 14.864 1.00 31.24 H new ATOM 0 HA ALA A 122 3.018 3.900 15.499 1.00 14.04 H new ATOM 0 HB1 ALA A 122 2.926 6.258 14.654 1.00 61.42 H new ATOM 0 HB2 ALA A 122 4.301 6.016 15.758 1.00 61.42 H new ATOM 0 HB3 ALA A 122 4.571 6.074 14.000 1.00 61.42 H new ATOM 1757 N TYR A 123 3.745 3.813 12.271 1.00 35.42 N ATOM 1758 CA TYR A 123 3.260 3.526 10.915 1.00 13.02 C ATOM 1759 C TYR A 123 2.484 2.217 10.881 1.00 23.51 C ATOM 1760 O TYR A 123 1.452 2.133 10.225 1.00 44.34 O ATOM 1761 CB TYR A 123 4.451 3.437 9.951 1.00 32.32 C ATOM 1762 CG TYR A 123 4.133 3.258 8.480 1.00 42.43 C ATOM 1763 CD1 TYR A 123 3.963 1.971 7.932 1.00 13.32 C ATOM 1764 CD2 TYR A 123 4.092 4.383 7.638 1.00 23.51 C ATOM 1765 CE1 TYR A 123 3.763 1.820 6.547 1.00 4.44 C ATOM 1766 CE2 TYR A 123 3.953 4.232 6.252 1.00 2.02 C ATOM 1767 CZ TYR A 123 3.785 2.951 5.698 1.00 1.00 C ATOM 1768 OH TYR A 123 3.615 2.840 4.354 1.00 34.51 O ATOM 0 H TYR A 123 4.750 3.988 12.294 1.00 35.42 H new ATOM 0 HA TYR A 123 2.594 4.333 10.610 1.00 13.02 H new ATOM 0 HB2 TYR A 123 5.045 4.344 10.061 1.00 32.32 H new ATOM 0 HB3 TYR A 123 5.080 2.604 10.265 1.00 32.32 H new ATOM 0 HD1 TYR A 123 3.986 1.102 8.573 1.00 13.32 H new ATOM 0 HD2 TYR A 123 4.168 5.373 8.063 1.00 23.51 H new ATOM 0 HE1 TYR A 123 3.592 0.838 6.131 1.00 4.44 H new ATOM 0 HE2 TYR A 123 3.975 5.100 5.609 1.00 2.02 H new ATOM 0 HH TYR A 123 3.042 2.069 4.159 1.00 34.51 H new ATOM 1777 N VAL A 124 2.973 1.212 11.610 1.00 2.14 N ATOM 1778 CA VAL A 124 2.357 -0.100 11.687 1.00 71.11 C ATOM 1779 C VAL A 124 0.902 0.008 12.158 1.00 22.22 C ATOM 1780 O VAL A 124 0.044 -0.673 11.606 1.00 61.34 O ATOM 1781 CB VAL A 124 3.219 -1.036 12.561 1.00 71.41 C ATOM 1782 CG1 VAL A 124 2.684 -2.472 12.517 1.00 71.23 C ATOM 1783 CG2 VAL A 124 4.683 -1.060 12.092 1.00 72.23 C ATOM 0 H VAL A 124 3.822 1.295 12.170 1.00 2.14 H new ATOM 0 HA VAL A 124 2.316 -0.546 10.693 1.00 71.11 H new ATOM 0 HB VAL A 124 3.168 -0.645 13.577 1.00 71.41 H new ATOM 0 HG11 VAL A 124 3.308 -3.112 13.141 1.00 71.23 H new ATOM 0 HG12 VAL A 124 1.660 -2.490 12.889 1.00 71.23 H new ATOM 0 HG13 VAL A 124 2.703 -2.836 11.490 1.00 71.23 H new ATOM 0 HG21 VAL A 124 5.259 -1.729 12.731 1.00 72.23 H new ATOM 0 HG22 VAL A 124 4.729 -1.413 11.062 1.00 72.23 H new ATOM 0 HG23 VAL A 124 5.100 -0.055 12.150 1.00 72.23 H new ATOM 1793 N SER A 125 0.605 0.867 13.134 1.00 61.35 N ATOM 1794 CA SER A 125 -0.769 1.128 13.530 1.00 75.13 C ATOM 1795 C SER A 125 -1.485 1.837 12.385 1.00 0.02 C ATOM 1796 O SER A 125 -2.467 1.322 11.852 1.00 33.13 O ATOM 1797 CB SER A 125 -0.775 1.955 14.821 1.00 44.32 C ATOM 1798 OG SER A 125 -2.073 2.389 15.178 1.00 12.31 O ATOM 0 H SER A 125 1.302 1.392 13.662 1.00 61.35 H new ATOM 0 HA SER A 125 -1.301 0.199 13.734 1.00 75.13 H new ATOM 0 HB2 SER A 125 -0.358 1.359 15.633 1.00 44.32 H new ATOM 0 HB3 SER A 125 -0.126 2.822 14.697 1.00 44.32 H new ATOM 0 HG SER A 125 -2.027 2.910 16.007 1.00 12.31 H new ATOM 1803 N HIS A 126 -0.977 3.010 11.994 1.00 43.13 N ATOM 1804 CA HIS A 126 -1.620 3.901 11.039 1.00 33.24 C ATOM 1805 C HIS A 126 -2.090 3.159 9.789 1.00 41.23 C ATOM 1806 O HIS A 126 -3.256 3.259 9.404 1.00 24.52 O ATOM 1807 CB HIS A 126 -0.639 5.019 10.664 1.00 1.04 C ATOM 1808 CG HIS A 126 -0.148 5.868 11.813 1.00 40.11 C ATOM 1809 ND1 HIS A 126 -0.775 6.103 13.015 1.00 43.15 N ATOM 1810 CD2 HIS A 126 1.015 6.581 11.822 1.00 35.52 C ATOM 1811 CE1 HIS A 126 -0.010 6.961 13.711 1.00 20.22 C ATOM 1812 NE2 HIS A 126 1.102 7.289 13.026 1.00 24.33 N ATOM 0 H HIS A 126 -0.088 3.369 12.343 1.00 43.13 H new ATOM 0 HA HIS A 126 -2.509 4.325 11.506 1.00 33.24 H new ATOM 0 HB2 HIS A 126 0.224 4.571 10.172 1.00 1.04 H new ATOM 0 HB3 HIS A 126 -1.120 5.670 9.934 1.00 1.04 H new ATOM 0 HD2 HIS A 126 1.749 6.597 11.030 1.00 35.52 H new ATOM 0 HE1 HIS A 126 -0.255 7.339 14.693 1.00 20.22 H new ATOM 0 HE2 HIS A 126 1.848 7.919 13.321 1.00 24.33 H new ATOM 1819 N PHE A 127 -1.182 2.407 9.170 1.00 44.11 N ATOM 1820 CA PHE A 127 -1.440 1.649 7.965 1.00 55.05 C ATOM 1821 C PHE A 127 -2.479 0.549 8.192 1.00 24.31 C ATOM 1822 O PHE A 127 -3.335 0.363 7.333 1.00 62.52 O ATOM 1823 CB PHE A 127 -0.114 1.077 7.453 1.00 12.20 C ATOM 1824 CG PHE A 127 -0.231 0.154 6.255 1.00 74.45 C ATOM 1825 CD1 PHE A 127 -1.101 0.454 5.187 1.00 43.42 C ATOM 1826 CD2 PHE A 127 0.531 -1.026 6.220 1.00 23.22 C ATOM 1827 CE1 PHE A 127 -1.203 -0.427 4.098 1.00 73.51 C ATOM 1828 CE2 PHE A 127 0.425 -1.904 5.131 1.00 32.14 C ATOM 1829 CZ PHE A 127 -0.425 -1.592 4.062 1.00 1.13 C ATOM 0 H PHE A 127 -0.224 2.311 9.508 1.00 44.11 H new ATOM 0 HA PHE A 127 -1.865 2.311 7.211 1.00 55.05 H new ATOM 0 HB2 PHE A 127 0.544 1.905 7.191 1.00 12.20 H new ATOM 0 HB3 PHE A 127 0.367 0.533 8.266 1.00 12.20 H new ATOM 0 HD1 PHE A 127 -1.688 1.360 5.206 1.00 43.42 H new ATOM 0 HD2 PHE A 127 1.201 -1.258 7.035 1.00 23.22 H new ATOM 0 HE1 PHE A 127 -1.882 -0.206 3.287 1.00 73.51 H new ATOM 0 HE2 PHE A 127 0.998 -2.819 5.117 1.00 32.14 H new ATOM 0 HZ PHE A 127 -0.481 -2.251 3.208 1.00 1.13 H new ATOM 1838 N ASN A 128 -2.414 -0.181 9.311 1.00 72.42 N ATOM 1839 CA ASN A 128 -3.390 -1.221 9.628 1.00 40.14 C ATOM 1840 C ASN A 128 -4.791 -0.655 9.617 1.00 23.43 C ATOM 1841 O ASN A 128 -5.658 -1.245 8.973 1.00 32.11 O ATOM 1842 CB ASN A 128 -3.118 -1.914 10.969 1.00 21.43 C ATOM 1843 CG ASN A 128 -2.234 -3.136 10.801 1.00 71.21 C ATOM 1844 OD1 ASN A 128 -2.531 -4.026 10.003 1.00 55.45 O ATOM 1845 ND2 ASN A 128 -1.104 -3.173 11.481 1.00 75.54 N ATOM 0 H ASN A 128 -1.686 -0.066 10.017 1.00 72.42 H new ATOM 0 HA ASN A 128 -3.292 -1.979 8.851 1.00 40.14 H new ATOM 0 HB2 ASN A 128 -2.641 -1.211 11.652 1.00 21.43 H new ATOM 0 HB3 ASN A 128 -4.063 -2.209 11.425 1.00 21.43 H new ATOM 0 HD21 ASN A 128 -0.456 -3.950 11.351 1.00 75.54 H new ATOM 0 HD22 ASN A 128 -0.879 -2.425 12.137 1.00 75.54 H new ATOM 1851 N GLU A 129 -5.015 0.473 10.286 1.00 55.32 N ATOM 1852 CA GLU A 129 -6.348 1.042 10.343 1.00 15.13 C ATOM 1853 C GLU A 129 -6.791 1.493 8.966 1.00 0.40 C ATOM 1854 O GLU A 129 -7.933 1.266 8.563 1.00 3.03 O ATOM 1855 CB GLU A 129 -6.395 2.232 11.306 1.00 75.23 C ATOM 1856 CG GLU A 129 -5.810 1.970 12.695 1.00 22.42 C ATOM 1857 CD GLU A 129 -6.224 0.618 13.287 1.00 54.05 C ATOM 1858 OE1 GLU A 129 -7.425 0.445 13.581 1.00 35.23 O ATOM 1859 OE2 GLU A 129 -5.358 -0.278 13.459 1.00 13.14 O ATOM 0 H GLU A 129 -4.300 1.000 10.787 1.00 55.32 H new ATOM 0 HA GLU A 129 -7.024 0.268 10.705 1.00 15.13 H new ATOM 0 HB2 GLU A 129 -5.857 3.066 10.854 1.00 75.23 H new ATOM 0 HB3 GLU A 129 -7.433 2.546 11.420 1.00 75.23 H new ATOM 0 HG2 GLU A 129 -4.722 2.015 12.637 1.00 22.42 H new ATOM 0 HG3 GLU A 129 -6.126 2.765 13.370 1.00 22.42 H new ATOM 1864 N TRP A 130 -5.882 2.123 8.229 1.00 51.32 N ATOM 1865 CA TRP A 130 -6.196 2.727 6.958 1.00 24.54 C ATOM 1866 C TRP A 130 -6.441 1.684 5.865 1.00 74.43 C ATOM 1867 O TRP A 130 -7.080 2.017 4.869 1.00 0.10 O ATOM 1868 CB TRP A 130 -5.067 3.710 6.641 1.00 14.42 C ATOM 1869 CG TRP A 130 -5.071 4.975 7.463 1.00 4.21 C ATOM 1870 CD1 TRP A 130 -5.917 5.289 8.478 1.00 1.30 C ATOM 1871 CD2 TRP A 130 -4.201 6.135 7.318 1.00 21.50 C ATOM 1872 NE1 TRP A 130 -5.744 6.611 8.829 1.00 62.55 N ATOM 1873 CE2 TRP A 130 -4.726 7.195 8.113 1.00 23.11 C ATOM 1874 CE3 TRP A 130 -3.026 6.399 6.585 1.00 55.43 C ATOM 1875 CZ2 TRP A 130 -4.204 8.494 8.067 1.00 52.32 C ATOM 1876 CZ3 TRP A 130 -2.461 7.689 6.567 1.00 0.14 C ATOM 1877 CH2 TRP A 130 -3.082 8.743 7.264 1.00 11.30 C ATOM 0 H TRP A 130 -4.906 2.224 8.506 1.00 51.32 H new ATOM 0 HA TRP A 130 -7.140 3.270 7.005 1.00 24.54 H new ATOM 0 HB2 TRP A 130 -4.113 3.203 6.787 1.00 14.42 H new ATOM 0 HB3 TRP A 130 -5.126 3.980 5.587 1.00 14.42 H new ATOM 0 HD1 TRP A 130 -6.617 4.608 8.939 1.00 1.30 H new ATOM 0 HE1 TRP A 130 -6.302 7.095 9.532 1.00 62.55 H new ATOM 0 HE3 TRP A 130 -2.553 5.602 6.030 1.00 55.43 H new ATOM 0 HZ2 TRP A 130 -4.658 9.289 8.640 1.00 52.32 H new ATOM 0 HZ3 TRP A 130 -1.549 7.870 6.017 1.00 0.14 H new ATOM 0 HH2 TRP A 130 -2.693 9.747 7.180 1.00 11.30 H new ATOM 1887 N ALA A 131 -6.029 0.431 6.070 1.00 33.32 N ATOM 1888 CA ALA A 131 -6.202 -0.672 5.133 1.00 54.43 C ATOM 1889 C ALA A 131 -7.328 -1.627 5.550 1.00 14.23 C ATOM 1890 O ALA A 131 -7.606 -2.596 4.845 1.00 63.21 O ATOM 1891 CB ALA A 131 -4.868 -1.420 5.035 1.00 43.03 C ATOM 0 H ALA A 131 -5.549 0.151 6.925 1.00 33.32 H new ATOM 0 HA ALA A 131 -6.493 -0.269 4.163 1.00 54.43 H new ATOM 0 HB1 ALA A 131 -4.968 -2.253 4.339 1.00 43.03 H new ATOM 0 HB2 ALA A 131 -4.095 -0.740 4.678 1.00 43.03 H new ATOM 0 HB3 ALA A 131 -4.591 -1.800 6.018 1.00 43.03 H new ATOM 1897 N ASP A 132 -7.946 -1.393 6.707 1.00 31.32 N ATOM 1898 CA ASP A 132 -8.572 -2.437 7.501 1.00 3.20 C ATOM 1899 C ASP A 132 -9.737 -3.148 6.810 1.00 13.40 C ATOM 1900 O ASP A 132 -10.802 -2.558 6.577 1.00 72.42 O ATOM 1901 CB ASP A 132 -9.037 -1.870 8.836 1.00 15.33 C ATOM 1902 CG ASP A 132 -9.547 -3.001 9.712 1.00 4.12 C ATOM 1903 OD1 ASP A 132 -8.767 -3.942 9.955 1.00 20.50 O ATOM 1904 OD2 ASP A 132 -10.719 -2.922 10.153 1.00 20.24 O ATOM 0 H ASP A 132 -8.024 -0.463 7.119 1.00 31.32 H new ATOM 0 HA ASP A 132 -7.802 -3.194 7.648 1.00 3.20 H new ATOM 0 HB2 ASP A 132 -8.214 -1.354 9.331 1.00 15.33 H new ATOM 0 HB3 ASP A 132 -9.825 -1.134 8.677 1.00 15.33 H new ATOM 1908 N GLY A 133 -9.527 -4.438 6.557 1.00 33.20 N ATOM 1909 CA GLY A 133 -10.491 -5.413 6.063 1.00 22.52 C ATOM 1910 C GLY A 133 -9.872 -6.339 5.014 1.00 33.21 C ATOM 1911 O GLY A 133 -10.269 -7.502 4.916 1.00 4.14 O ATOM 0 H GLY A 133 -8.609 -4.858 6.704 1.00 33.20 H new ATOM 0 HA2 GLY A 133 -10.867 -6.007 6.896 1.00 22.52 H new ATOM 0 HA3 GLY A 133 -11.346 -4.893 5.630 1.00 22.52 H new ATOM 1915 N LEU A 134 -8.873 -5.869 4.263 1.00 20.14 N ATOM 1916 CA LEU A 134 -8.029 -6.740 3.445 1.00 54.25 C ATOM 1917 C LEU A 134 -7.135 -7.561 4.371 1.00 15.34 C ATOM 1918 O LEU A 134 -6.901 -7.181 5.521 1.00 41.13 O ATOM 1919 CB LEU A 134 -7.145 -5.911 2.502 1.00 62.35 C ATOM 1920 CG LEU A 134 -7.897 -5.252 1.340 1.00 74.13 C ATOM 1921 CD1 LEU A 134 -7.023 -4.164 0.707 1.00 55.13 C ATOM 1922 CD2 LEU A 134 -8.314 -6.251 0.254 1.00 23.30 C ATOM 0 H LEU A 134 -8.628 -4.880 4.205 1.00 20.14 H new ATOM 0 HA LEU A 134 -8.665 -7.390 2.845 1.00 54.25 H new ATOM 0 HB2 LEU A 134 -6.646 -5.135 3.082 1.00 62.35 H new ATOM 0 HB3 LEU A 134 -6.366 -6.555 2.095 1.00 62.35 H new ATOM 0 HG LEU A 134 -8.807 -4.823 1.759 1.00 74.13 H new ATOM 0 HD11 LEU A 134 -7.562 -3.699 -0.118 1.00 55.13 H new ATOM 0 HD12 LEU A 134 -6.783 -3.409 1.455 1.00 55.13 H new ATOM 0 HD13 LEU A 134 -6.101 -4.610 0.333 1.00 55.13 H new ATOM 0 HD21 LEU A 134 -8.842 -5.725 -0.541 1.00 23.30 H new ATOM 0 HD22 LEU A 134 -7.427 -6.733 -0.157 1.00 23.30 H new ATOM 0 HD23 LEU A 134 -8.970 -7.006 0.687 1.00 23.30 H new ATOM 1933 N ASN A 135 -6.604 -8.666 3.853 1.00 74.23 N ATOM 1934 CA ASN A 135 -5.643 -9.483 4.574 1.00 4.04 C ATOM 1935 C ASN A 135 -4.290 -8.781 4.576 1.00 20.24 C ATOM 1936 O ASN A 135 -4.021 -7.971 3.685 1.00 15.24 O ATOM 1937 CB ASN A 135 -5.514 -10.837 3.876 1.00 3.03 C ATOM 1938 CG ASN A 135 -4.668 -11.780 4.713 1.00 40.03 C ATOM 1939 OD1 ASN A 135 -3.609 -12.319 4.150 1.00 74.42 O flip ATOM 1940 ND2 ASN A 135 -4.954 -12.002 5.884 1.00 72.52 N flip ATOM 0 H ASN A 135 -6.830 -9.016 2.922 1.00 74.23 H new ATOM 0 HA ASN A 135 -5.978 -9.631 5.601 1.00 4.04 H new ATOM 0 HB2 ASN A 135 -6.502 -11.268 3.717 1.00 3.03 H new ATOM 0 HB3 ASN A 135 -5.061 -10.706 2.893 1.00 3.03 H new ATOM 0 HD21 ASN A 135 -5.781 -11.571 6.297 1.00 72.52 H new ATOM 0 HD22 ASN A 135 -4.365 -12.617 6.445 1.00 72.52 H new ATOM 1946 N VAL A 136 -3.407 -9.101 5.522 1.00 33.14 N ATOM 1947 CA VAL A 136 -2.053 -8.571 5.558 1.00 60.44 C ATOM 1948 C VAL A 136 -1.076 -9.647 6.037 1.00 63.42 C ATOM 1949 O VAL A 136 -1.387 -10.423 6.950 1.00 53.32 O ATOM 1950 CB VAL A 136 -1.975 -7.318 6.462 1.00 12.22 C ATOM 1951 CG1 VAL A 136 -0.759 -6.476 6.029 1.00 52.21 C ATOM 1952 CG2 VAL A 136 -3.231 -6.432 6.450 1.00 23.10 C ATOM 0 H VAL A 136 -3.617 -9.740 6.288 1.00 33.14 H new ATOM 0 HA VAL A 136 -1.773 -8.273 4.548 1.00 60.44 H new ATOM 0 HB VAL A 136 -1.883 -7.684 7.484 1.00 12.22 H new ATOM 0 HG11 VAL A 136 -0.689 -5.588 6.657 1.00 52.21 H new ATOM 0 HG12 VAL A 136 0.150 -7.068 6.136 1.00 52.21 H new ATOM 0 HG13 VAL A 136 -0.876 -6.176 4.988 1.00 52.21 H new ATOM 0 HG21 VAL A 136 -3.081 -5.580 7.113 1.00 23.10 H new ATOM 0 HG22 VAL A 136 -3.415 -6.076 5.437 1.00 23.10 H new ATOM 0 HG23 VAL A 136 -4.088 -7.012 6.792 1.00 23.10 H new ATOM 1962 N ILE A 137 0.138 -9.654 5.479 1.00 0.22 N ATOM 1963 CA ILE A 137 1.240 -10.546 5.886 1.00 12.14 C ATOM 1964 C ILE A 137 2.587 -9.839 6.097 1.00 31.31 C ATOM 1965 O ILE A 137 3.562 -10.484 6.501 1.00 3.00 O ATOM 1966 CB ILE A 137 1.347 -11.783 4.960 1.00 73.35 C ATOM 1967 CG1 ILE A 137 1.428 -11.512 3.447 1.00 14.33 C ATOM 1968 CG2 ILE A 137 0.136 -12.685 5.208 1.00 52.25 C ATOM 1969 CD1 ILE A 137 2.824 -11.226 2.925 1.00 41.11 C ATOM 0 H ILE A 137 0.393 -9.028 4.715 1.00 0.22 H new ATOM 0 HA ILE A 137 0.972 -10.905 6.879 1.00 12.14 H new ATOM 0 HB ILE A 137 2.302 -12.238 5.224 1.00 73.35 H new ATOM 0 HG12 ILE A 137 1.026 -12.375 2.916 1.00 14.33 H new ATOM 0 HG13 ILE A 137 0.786 -10.664 3.209 1.00 14.33 H new ATOM 0 HG21 ILE A 137 0.197 -13.561 4.563 1.00 52.25 H new ATOM 0 HG22 ILE A 137 0.126 -13.002 6.251 1.00 52.25 H new ATOM 0 HG23 ILE A 137 -0.779 -12.135 4.987 1.00 52.25 H new ATOM 0 HD11 ILE A 137 2.781 -11.048 1.851 1.00 41.11 H new ATOM 0 HD12 ILE A 137 3.225 -10.344 3.424 1.00 41.11 H new ATOM 0 HD13 ILE A 137 3.470 -12.081 3.125 1.00 41.11 H new ATOM 1980 N GLY A 138 2.663 -8.520 5.916 1.00 22.40 N ATOM 1981 CA GLY A 138 3.856 -7.776 6.300 1.00 20.20 C ATOM 1982 C GLY A 138 3.630 -6.277 6.398 1.00 40.02 C ATOM 1983 O GLY A 138 2.742 -5.738 5.729 1.00 34.51 O ATOM 0 H GLY A 138 1.919 -7.952 5.510 1.00 22.40 H new ATOM 0 HA2 GLY A 138 4.211 -8.146 7.262 1.00 20.20 H new ATOM 0 HA3 GLY A 138 4.645 -7.970 5.573 1.00 20.20 H new ATOM 1987 N VAL A 139 4.482 -5.626 7.202 1.00 55.31 N ATOM 1988 CA VAL A 139 4.723 -4.191 7.269 1.00 31.43 C ATOM 1989 C VAL A 139 6.191 -4.048 7.713 1.00 41.02 C ATOM 1990 O VAL A 139 6.480 -4.187 8.904 1.00 14.23 O ATOM 1991 CB VAL A 139 3.739 -3.525 8.271 1.00 24.44 C ATOM 1992 CG1 VAL A 139 3.927 -2.005 8.343 1.00 63.34 C ATOM 1993 CG2 VAL A 139 2.263 -3.771 7.935 1.00 71.33 C ATOM 0 H VAL A 139 5.061 -6.134 7.870 1.00 55.31 H new ATOM 0 HA VAL A 139 4.557 -3.692 6.314 1.00 31.43 H new ATOM 0 HB VAL A 139 3.980 -3.995 9.224 1.00 24.44 H new ATOM 0 HG11 VAL A 139 3.218 -1.584 9.056 1.00 63.34 H new ATOM 0 HG12 VAL A 139 4.943 -1.779 8.666 1.00 63.34 H new ATOM 0 HG13 VAL A 139 3.754 -1.570 7.359 1.00 63.34 H new ATOM 0 HG21 VAL A 139 1.634 -3.277 8.676 1.00 71.33 H new ATOM 0 HG22 VAL A 139 2.043 -3.369 6.946 1.00 71.33 H new ATOM 0 HG23 VAL A 139 2.061 -4.842 7.944 1.00 71.33 H new ATOM 2003 N ALA A 140 7.146 -3.850 6.793 1.00 71.55 N ATOM 2004 CA ALA A 140 8.563 -3.669 7.136 1.00 13.42 C ATOM 2005 C ALA A 140 9.234 -2.744 6.112 1.00 71.15 C ATOM 2006 O ALA A 140 8.737 -2.634 4.988 1.00 64.15 O ATOM 2007 CB ALA A 140 9.263 -5.037 7.172 1.00 15.41 C ATOM 0 H ALA A 140 6.958 -3.811 5.791 1.00 71.55 H new ATOM 0 HA ALA A 140 8.644 -3.208 8.121 1.00 13.42 H new ATOM 0 HB1 ALA A 140 10.314 -4.901 7.427 1.00 15.41 H new ATOM 0 HB2 ALA A 140 8.787 -5.670 7.921 1.00 15.41 H new ATOM 0 HB3 ALA A 140 9.185 -5.512 6.194 1.00 15.41 H new ATOM 2013 N ARG A 141 10.343 -2.080 6.477 1.00 64.53 N ATOM 2014 CA ARG A 141 11.099 -1.290 5.506 1.00 55.05 C ATOM 2015 C ARG A 141 11.922 -2.203 4.621 1.00 23.54 C ATOM 2016 O ARG A 141 12.304 -3.297 5.054 1.00 51.13 O ATOM 2017 CB ARG A 141 12.007 -0.231 6.162 1.00 44.33 C ATOM 2018 CG ARG A 141 13.248 -0.727 6.919 1.00 62.41 C ATOM 2019 CD ARG A 141 13.967 0.483 7.540 1.00 52.24 C ATOM 2020 NE ARG A 141 14.790 0.111 8.699 1.00 54.25 N ATOM 2021 CZ ARG A 141 16.078 0.387 8.934 1.00 21.12 C ATOM 2022 NH1 ARG A 141 16.898 0.890 8.018 1.00 34.14 N ATOM 2023 NH2 ARG A 141 16.558 0.148 10.138 1.00 51.22 N ATOM 0 H ARG A 141 10.727 -2.077 7.422 1.00 64.53 H new ATOM 0 HA ARG A 141 10.368 -0.748 4.906 1.00 55.05 H new ATOM 0 HB2 ARG A 141 12.341 0.454 5.383 1.00 44.33 H new ATOM 0 HB3 ARG A 141 11.399 0.348 6.857 1.00 44.33 H new ATOM 0 HG2 ARG A 141 12.958 -1.434 7.697 1.00 62.41 H new ATOM 0 HG3 ARG A 141 13.917 -1.256 6.241 1.00 62.41 H new ATOM 0 HD2 ARG A 141 14.598 0.954 6.786 1.00 52.24 H new ATOM 0 HD3 ARG A 141 13.228 1.224 7.845 1.00 52.24 H new ATOM 0 HE ARG A 141 14.316 -0.430 9.422 1.00 54.25 H new ATOM 0 HH11 ARG A 141 16.554 1.086 7.078 1.00 34.14 H new ATOM 0 HH12 ARG A 141 17.872 1.081 8.255 1.00 34.14 H new ATOM 0 HH21 ARG A 141 15.951 -0.238 10.862 1.00 51.22 H new ATOM 0 HH22 ARG A 141 17.536 0.349 10.346 1.00 51.22 H new ATOM 2034 N ASP A 142 12.331 -1.667 3.475 1.00 42.41 N ATOM 2035 CA ASP A 142 13.260 -2.306 2.553 1.00 11.02 C ATOM 2036 C ASP A 142 12.791 -3.744 2.231 1.00 13.04 C ATOM 2037 O ASP A 142 11.593 -4.043 2.242 1.00 14.33 O ATOM 2038 CB ASP A 142 14.714 -2.179 3.080 1.00 60.11 C ATOM 2039 CG ASP A 142 15.445 -0.899 2.679 1.00 15.23 C ATOM 2040 OD1 ASP A 142 14.862 0.058 2.119 1.00 63.21 O ATOM 2041 OD2 ASP A 142 16.660 -0.822 2.983 1.00 13.14 O ATOM 0 H ASP A 142 12.016 -0.751 3.155 1.00 42.41 H new ATOM 0 HA ASP A 142 13.265 -1.791 1.592 1.00 11.02 H new ATOM 0 HB2 ASP A 142 14.695 -2.241 4.168 1.00 60.11 H new ATOM 0 HB3 ASP A 142 15.289 -3.033 2.722 1.00 60.11 H new ATOM 2045 N ASP A 143 13.728 -4.615 1.867 1.00 53.34 N ATOM 2046 CA ASP A 143 13.614 -5.962 1.318 1.00 15.40 C ATOM 2047 C ASP A 143 14.138 -7.009 2.317 1.00 32.42 C ATOM 2048 O ASP A 143 14.804 -7.974 1.937 1.00 31.13 O ATOM 2049 CB ASP A 143 14.377 -6.027 -0.026 1.00 11.41 C ATOM 2050 CG ASP A 143 15.821 -5.484 0.016 1.00 35.34 C ATOM 2051 OD1 ASP A 143 16.336 -5.117 1.110 1.00 43.12 O ATOM 2052 OD2 ASP A 143 16.371 -5.227 -1.078 1.00 12.34 O ATOM 0 H ASP A 143 14.711 -4.359 1.963 1.00 53.34 H new ATOM 0 HA ASP A 143 12.564 -6.193 1.138 1.00 15.40 H new ATOM 0 HB2 ASP A 143 14.405 -7.064 -0.361 1.00 11.41 H new ATOM 0 HB3 ASP A 143 13.815 -5.466 -0.773 1.00 11.41 H new ATOM 2056 N SER A 144 13.889 -6.817 3.612 1.00 63.45 N ATOM 2057 CA SER A 144 14.303 -7.738 4.670 1.00 34.32 C ATOM 2058 C SER A 144 13.390 -8.977 4.725 1.00 11.22 C ATOM 2059 O SER A 144 13.806 -10.019 5.226 1.00 31.13 O ATOM 2060 CB SER A 144 14.286 -6.954 5.993 1.00 31.43 C ATOM 2061 OG SER A 144 14.839 -7.672 7.080 1.00 1.04 O ATOM 0 H SER A 144 13.385 -6.002 3.962 1.00 63.45 H new ATOM 0 HA SER A 144 15.306 -8.117 4.475 1.00 34.32 H new ATOM 0 HB2 SER A 144 14.839 -6.024 5.863 1.00 31.43 H new ATOM 0 HB3 SER A 144 13.258 -6.682 6.232 1.00 31.43 H new ATOM 0 HG SER A 144 14.801 -7.121 7.889 1.00 1.04 H new ATOM 2066 N GLU A 145 12.147 -8.889 4.242 1.00 14.00 N ATOM 2067 CA GLU A 145 11.113 -9.907 4.455 1.00 31.23 C ATOM 2068 C GLU A 145 10.600 -10.505 3.130 1.00 52.12 C ATOM 2069 O GLU A 145 9.566 -11.174 3.115 1.00 62.22 O ATOM 2070 CB GLU A 145 9.960 -9.297 5.268 1.00 24.42 C ATOM 2071 CG GLU A 145 10.257 -8.857 6.713 1.00 20.13 C ATOM 2072 CD GLU A 145 9.017 -8.924 7.632 1.00 21.20 C ATOM 2073 OE1 GLU A 145 7.853 -8.785 7.181 1.00 4.10 O ATOM 2074 OE2 GLU A 145 9.174 -9.182 8.848 1.00 52.01 O ATOM 0 H GLU A 145 11.826 -8.098 3.684 1.00 14.00 H new ATOM 0 HA GLU A 145 11.556 -10.732 5.013 1.00 31.23 H new ATOM 0 HB2 GLU A 145 9.588 -8.429 4.723 1.00 24.42 H new ATOM 0 HB3 GLU A 145 9.150 -10.025 5.299 1.00 24.42 H new ATOM 0 HG2 GLU A 145 11.043 -9.490 7.125 1.00 20.13 H new ATOM 0 HG3 GLU A 145 10.641 -7.837 6.705 1.00 20.13 H new ATOM 2079 N VAL A 146 11.280 -10.279 2.001 1.00 73.41 N ATOM 2080 CA VAL A 146 10.824 -10.765 0.691 1.00 52.15 C ATOM 2081 C VAL A 146 10.597 -12.289 0.733 1.00 14.03 C ATOM 2082 O VAL A 146 9.579 -12.774 0.234 1.00 72.53 O ATOM 2083 CB VAL A 146 11.819 -10.337 -0.411 1.00 60.53 C ATOM 2084 CG1 VAL A 146 11.347 -10.746 -1.813 1.00 63.23 C ATOM 2085 CG2 VAL A 146 12.019 -8.812 -0.419 1.00 72.15 C ATOM 0 H VAL A 146 12.156 -9.758 1.967 1.00 73.41 H new ATOM 0 HA VAL A 146 9.863 -10.311 0.447 1.00 52.15 H new ATOM 0 HB VAL A 146 12.754 -10.847 -0.177 1.00 60.53 H new ATOM 0 HG11 VAL A 146 12.080 -10.423 -2.552 1.00 63.23 H new ATOM 0 HG12 VAL A 146 11.239 -11.830 -1.859 1.00 63.23 H new ATOM 0 HG13 VAL A 146 10.387 -10.276 -2.025 1.00 63.23 H new ATOM 0 HG21 VAL A 146 12.724 -8.542 -1.205 1.00 72.15 H new ATOM 0 HG22 VAL A 146 11.064 -8.321 -0.604 1.00 72.15 H new ATOM 0 HG23 VAL A 146 12.411 -8.491 0.546 1.00 72.15 H new ATOM 2095 N ASP A 147 11.491 -13.019 1.408 1.00 40.34 N ATOM 2096 CA ASP A 147 11.494 -14.473 1.592 1.00 54.11 C ATOM 2097 C ASP A 147 10.276 -14.977 2.368 1.00 40.13 C ATOM 2098 O ASP A 147 10.058 -16.186 2.450 1.00 12.14 O ATOM 2099 CB ASP A 147 12.753 -14.906 2.363 1.00 62.24 C ATOM 2100 CG ASP A 147 14.046 -14.574 1.633 1.00 13.34 C ATOM 2101 OD1 ASP A 147 14.428 -13.386 1.616 1.00 63.25 O ATOM 2102 OD2 ASP A 147 14.718 -15.483 1.094 1.00 75.55 O ATOM 0 H ASP A 147 12.286 -12.579 1.872 1.00 40.34 H new ATOM 0 HA ASP A 147 11.471 -14.905 0.591 1.00 54.11 H new ATOM 0 HB2 ASP A 147 12.759 -14.420 3.339 1.00 62.24 H new ATOM 0 HB3 ASP A 147 12.710 -15.980 2.542 1.00 62.24 H new ATOM 2106 N LYS A 148 9.469 -14.095 2.962 1.00 14.14 N ATOM 2107 CA LYS A 148 8.242 -14.448 3.668 1.00 23.20 C ATOM 2108 C LYS A 148 7.015 -13.773 3.077 1.00 61.23 C ATOM 2109 O LYS A 148 5.917 -14.015 3.569 1.00 52.44 O ATOM 2110 CB LYS A 148 8.381 -14.216 5.175 1.00 12.33 C ATOM 2111 CG LYS A 148 8.712 -12.770 5.551 1.00 20.40 C ATOM 2112 CD LYS A 148 8.486 -12.457 7.034 1.00 20.34 C ATOM 2113 CE LYS A 148 7.173 -11.703 7.265 1.00 60.12 C ATOM 2114 NZ LYS A 148 5.962 -12.526 7.075 1.00 20.21 N ATOM 0 H LYS A 148 9.658 -13.093 2.964 1.00 14.14 H new ATOM 0 HA LYS A 148 8.083 -15.517 3.526 1.00 23.20 H new ATOM 0 HB2 LYS A 148 7.451 -14.505 5.665 1.00 12.33 H new ATOM 0 HB3 LYS A 148 9.162 -14.870 5.563 1.00 12.33 H new ATOM 0 HG2 LYS A 148 9.753 -12.567 5.299 1.00 20.40 H new ATOM 0 HG3 LYS A 148 8.101 -12.097 4.949 1.00 20.40 H new ATOM 0 HD2 LYS A 148 8.476 -13.386 7.604 1.00 20.34 H new ATOM 0 HD3 LYS A 148 9.318 -11.861 7.410 1.00 20.34 H new ATOM 0 HE2 LYS A 148 7.171 -11.302 8.278 1.00 60.12 H new ATOM 0 HE3 LYS A 148 7.131 -10.852 6.585 1.00 60.12 H new ATOM 0 HZ1 LYS A 148 5.122 -11.913 7.081 1.00 20.21 H new ATOM 0 HZ2 LYS A 148 6.020 -13.025 6.164 1.00 20.21 H new ATOM 0 HZ3 LYS A 148 5.890 -13.220 7.846 1.00 20.21 H new ATOM 2124 N TRP A 149 7.155 -12.964 2.035 1.00 72.25 N ATOM 2125 CA TRP A 149 6.029 -12.432 1.267 1.00 64.55 C ATOM 2126 C TRP A 149 5.996 -13.058 -0.129 1.00 3.21 C ATOM 2127 O TRP A 149 5.814 -12.367 -1.130 1.00 12.30 O ATOM 2128 CB TRP A 149 6.123 -10.910 1.180 1.00 2.13 C ATOM 2129 CG TRP A 149 6.397 -10.136 2.434 1.00 12.43 C ATOM 2130 CD1 TRP A 149 6.004 -10.483 3.677 1.00 51.34 C ATOM 2131 CD2 TRP A 149 7.070 -8.845 2.575 1.00 11.23 C ATOM 2132 NE1 TRP A 149 6.374 -9.503 4.564 1.00 52.33 N ATOM 2133 CE2 TRP A 149 7.008 -8.452 3.940 1.00 61.35 C ATOM 2134 CE3 TRP A 149 7.700 -7.945 1.688 1.00 64.51 C ATOM 2135 CZ2 TRP A 149 7.509 -7.221 4.394 1.00 12.03 C ATOM 2136 CZ3 TRP A 149 8.176 -6.691 2.123 1.00 34.13 C ATOM 2137 CH2 TRP A 149 8.062 -6.315 3.474 1.00 62.42 C ATOM 0 H TRP A 149 8.064 -12.653 1.692 1.00 72.25 H new ATOM 0 HA TRP A 149 5.100 -12.689 1.777 1.00 64.55 H new ATOM 0 HB2 TRP A 149 6.907 -10.667 0.463 1.00 2.13 H new ATOM 0 HB3 TRP A 149 5.185 -10.544 0.763 1.00 2.13 H new ATOM 0 HD1 TRP A 149 5.479 -11.391 3.934 1.00 51.34 H new ATOM 0 HE1 TRP A 149 6.200 -9.548 5.568 1.00 52.33 H new ATOM 0 HE3 TRP A 149 7.820 -8.224 0.652 1.00 64.51 H new ATOM 0 HZ2 TRP A 149 7.469 -6.972 5.444 1.00 12.03 H new ATOM 0 HZ3 TRP A 149 8.631 -6.015 1.414 1.00 34.13 H new ATOM 0 HH2 TRP A 149 8.396 -5.341 3.800 1.00 62.42 H new ATOM 2147 N SER A 150 6.228 -14.360 -0.221 1.00 1.01 N ATOM 2148 CA SER A 150 6.142 -15.102 -1.469 1.00 4.20 C ATOM 2149 C SER A 150 5.940 -16.597 -1.188 1.00 22.10 C ATOM 2150 O SER A 150 5.054 -17.214 -1.785 1.00 55.32 O ATOM 2151 CB SER A 150 7.417 -14.799 -2.296 1.00 4.21 C ATOM 2152 OG SER A 150 7.391 -15.414 -3.574 1.00 73.31 O ATOM 0 H SER A 150 6.484 -14.937 0.580 1.00 1.01 H new ATOM 0 HA SER A 150 5.276 -14.792 -2.055 1.00 4.20 H new ATOM 0 HB2 SER A 150 7.521 -13.721 -2.417 1.00 4.21 H new ATOM 0 HB3 SER A 150 8.293 -15.144 -1.747 1.00 4.21 H new ATOM 0 HG SER A 150 8.213 -15.194 -4.060 1.00 73.31 H new ATOM 2157 N LYS A 151 6.764 -17.148 -0.289 1.00 22.13 N ATOM 2158 CA LYS A 151 6.988 -18.570 -0.028 1.00 75.52 C ATOM 2159 C LYS A 151 5.715 -19.396 0.043 1.00 11.12 C ATOM 2160 O LYS A 151 5.618 -20.424 -0.658 1.00 12.13 O ATOM 2161 CB LYS A 151 7.846 -18.695 1.252 1.00 42.42 C ATOM 2162 CG LYS A 151 7.200 -18.090 2.517 1.00 61.33 C ATOM 2163 CD LYS A 151 6.635 -19.134 3.490 1.00 63.44 C ATOM 2164 CE LYS A 151 5.444 -18.555 4.262 1.00 33.50 C ATOM 2165 NZ LYS A 151 4.180 -18.746 3.532 1.00 73.44 N ATOM 0 H LYS A 151 7.335 -16.563 0.321 1.00 22.13 H new ATOM 0 HA LYS A 151 7.521 -18.995 -0.879 1.00 75.52 H new ATOM 0 HB2 LYS A 151 8.053 -19.750 1.434 1.00 42.42 H new ATOM 0 HB3 LYS A 151 8.805 -18.207 1.080 1.00 42.42 H new ATOM 0 HG2 LYS A 151 7.943 -17.487 3.039 1.00 61.33 H new ATOM 0 HG3 LYS A 151 6.397 -17.417 2.216 1.00 61.33 H new ATOM 0 HD2 LYS A 151 6.323 -20.022 2.940 1.00 63.44 H new ATOM 0 HD3 LYS A 151 7.411 -19.448 4.188 1.00 63.44 H new ATOM 0 HE2 LYS A 151 5.376 -19.033 5.239 1.00 33.50 H new ATOM 0 HE3 LYS A 151 5.606 -17.492 4.438 1.00 33.50 H new ATOM 0 HZ1 LYS A 151 3.396 -18.342 4.084 1.00 73.44 H new ATOM 0 HZ2 LYS A 151 4.236 -18.269 2.610 1.00 73.44 H new ATOM 0 HZ3 LYS A 151 4.013 -19.762 3.386 1.00 73.44 H new TER 2175 LYS A 151