USER MOD reduce.3.24.130724 H: found=0, std=0, add=1198, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1194 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 150 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 151 CYS SG : rot 180:sc= 0 USER MOD Set 2.1: A 131 TYR OH : rot 180:sc= 0.306 USER MOD Set 2.2: A 135 CYS SG : rot -34:sc= 0.231 USER MOD Set 3.1: A 118 SER OG : rot -69:sc= 0.446 USER MOD Set 3.2: A 119 CYS SG : rot 180:sc= 0 USER MOD Set 4.1: A 104 SER OG : rot -170:sc= 1.31 USER MOD Set 4.2: A 107 SER OG : rot 71:sc= 1.21 USER MOD Set 5.1: A 49 TYR OH : rot -1:sc= 1.28 USER MOD Set 5.2: A 81 HIS : no HD1:sc= 1.02 K(o=2.1,f=-6.5!) USER MOD Set 5.3: A 83 HIS : no HD1:sc= -0.171 X(o=2.1,f=1.8) USER MOD Set 6.1: A 59 LYS NZ :NH3+ -173:sc= 0.982 (180deg=0) USER MOD Set 6.2: A 70 GLN : amide:sc= 0.726 K(o=1.7,f=-3.8!) USER MOD Set 7.1: A 29 SER OG : rot -55:sc= 1.19 USER MOD Set 7.2: A 36 GLN : amide:sc= 1.96 K(o=3.1,f=-1.7!) USER MOD Set 8.1: A 33 SER OG : rot 180:sc= 0.737 USER MOD Set 8.2: A 35 THR OG1 : rot -69:sc= 0.8 USER MOD Set 9.1: A 24 THR OG1 : rot -139:sc= 0.477 USER MOD Set 9.2: A 53 LYS NZ :NH3+ -179:sc= 1.24 (180deg=0.731) USER MOD Set10.1: A 23 MET CE :methyl -173:sc= -0.228 (180deg=-0.395) USER MOD Set10.2: A 109 CYS SG : rot 100:sc= -0.575 USER MOD Set11.1: A 1 MET N :NH3+ -178:sc= 1.01 (180deg=-0.148) USER MOD Set11.2: A 5 GLN : amide:sc= 1.82 K(o=2.8,f=-8.1!) USER MOD Single : A 1 MET CE :methyl -144:sc= -0.0042 (180deg=-0.185) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 MET CE :methyl 146:sc= -0.69 (180deg=-0.992) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 GLN : amide:sc= -0.223 X(o=-0.22,f=-0.26) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= -0.12 X(o=-0.12,f=-0.12) USER MOD Single : A 17 ASN : amide:sc= -0.0663 K(o=-0.066,f=-1.7!) USER MOD Single : A 26 ASN : amide:sc= 0.812 K(o=0.81,f=-1.2) USER MOD Single : A 28 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0857) USER MOD Single : A 31 GLN : amide:sc= 0.702 K(o=0.7,f=-0.32) USER MOD Single : A 32 ASN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 41 MET CE :methyl 180:sc= -1.95! (180deg=-1.95!) USER MOD Single : A 47 THR OG1 : rot -44:sc= 1.65 USER MOD Single : A 55 GLN : amide:sc= 0.604 K(o=0.6,f=-0.19) USER MOD Single : A 61 SER OG : rot 179:sc= 0.876 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot -174:sc= 0.621 USER MOD Single : A 68 SER OG : rot 174:sc= 1.25 USER MOD Single : A 72 MET CE :methyl -176:sc= -0.0881 (180deg=-0.108) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 ASN : amide:sc= -0.293 K(o=-0.29,f=-2.3!) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0.0403 K(o=0.04,f=-8.8!) USER MOD Single : A 89 HIS : no HD1:sc= -0.12 K(o=-0.12,f=-0.8) USER MOD Single : A 91 CYS SG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot 143:sc= 0.541! USER MOD Single : A 100 SER OG : rot 180:sc= -0.0845 USER MOD Single : A 106 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 111 SER OG : rot 60:sc= 1.24 USER MOD Single : A 114 SER OG : rot 73:sc= 0.714 USER MOD Single : A 115 MET CE :methyl 170:sc= -0.0298 (180deg=-0.21) USER MOD Single : A 117 SER OG : rot -30:sc= 0.781 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 ASN : amide:sc= 1.18 K(o=1.2,f=-5.5!) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot -68:sc= 1.06 USER MOD Single : A 136 ASN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 ASN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 THR OG1 : rot 180:sc= 0.294 USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD Single : A 147 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.931 -3.561 -24.785 1.00 0.00 N ATOM 2 CA MET A 1 1.539 -3.989 -24.668 1.00 0.00 C ATOM 3 C MET A 1 1.380 -5.291 -23.883 1.00 0.00 C ATOM 4 O MET A 1 0.608 -6.166 -24.280 1.00 0.00 O ATOM 5 CB MET A 1 0.921 -4.143 -26.055 1.00 0.00 C ATOM 6 CG MET A 1 0.832 -2.845 -26.844 1.00 0.00 C ATOM 7 SD MET A 1 -0.176 -1.596 -26.019 1.00 0.00 S ATOM 8 CE MET A 1 -1.812 -2.304 -26.171 1.00 0.00 C ATOM 0 H1 MET A 1 2.974 -2.657 -25.297 1.00 0.00 H new ATOM 0 H2 MET A 1 3.338 -3.441 -23.836 1.00 0.00 H new ATOM 0 H3 MET A 1 3.473 -4.280 -25.306 1.00 0.00 H new ATOM 0 HA MET A 1 1.017 -3.213 -24.109 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.509 -4.862 -26.625 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.080 -4.561 -25.950 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.836 -2.450 -27.001 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.413 -3.051 -27.829 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.540 -1.508 -26.326 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.835 -2.987 -27.020 1.00 0.00 H new ATOM 0 HE3 MET A 1 -2.059 -2.849 -25.260 1.00 0.00 H new ATOM 20 N ALA A 2 2.119 -5.424 -22.785 1.00 0.00 N ATOM 21 CA ALA A 2 2.062 -6.610 -21.937 1.00 0.00 C ATOM 22 C ALA A 2 0.777 -6.590 -21.142 1.00 0.00 C ATOM 23 O ALA A 2 0.269 -5.508 -20.857 1.00 0.00 O ATOM 24 CB ALA A 2 3.258 -6.674 -20.996 1.00 0.00 C ATOM 0 H ALA A 2 2.774 -4.713 -22.459 1.00 0.00 H new ATOM 0 HA ALA A 2 2.091 -7.495 -22.572 1.00 0.00 H new ATOM 0 HB1 ALA A 2 3.187 -7.569 -20.377 1.00 0.00 H new ATOM 0 HB2 ALA A 2 4.178 -6.708 -21.579 1.00 0.00 H new ATOM 0 HB3 ALA A 2 3.266 -5.791 -20.357 1.00 0.00 H new ATOM 30 N SER A 3 0.269 -7.763 -20.762 1.00 0.00 N ATOM 31 CA SER A 3 -0.955 -7.827 -19.965 1.00 0.00 C ATOM 32 C SER A 3 -0.740 -7.194 -18.590 1.00 0.00 C ATOM 33 O SER A 3 -1.696 -6.732 -17.969 1.00 0.00 O ATOM 34 CB SER A 3 -1.408 -9.264 -19.817 1.00 0.00 C ATOM 35 OG SER A 3 -0.500 -10.006 -19.048 1.00 0.00 O ATOM 0 H SER A 3 0.679 -8.669 -20.989 1.00 0.00 H new ATOM 0 HA SER A 3 -1.732 -7.264 -20.482 1.00 0.00 H new ATOM 0 HB2 SER A 3 -2.392 -9.291 -19.349 1.00 0.00 H new ATOM 0 HB3 SER A 3 -1.511 -9.719 -20.802 1.00 0.00 H new ATOM 0 HG SER A 3 -0.818 -10.929 -18.967 1.00 0.00 H new ATOM 41 N MET A 4 0.513 -7.186 -18.137 1.00 0.00 N ATOM 42 CA MET A 4 0.967 -6.517 -16.927 1.00 0.00 C ATOM 43 C MET A 4 0.722 -5.025 -17.047 1.00 0.00 C ATOM 44 O MET A 4 0.154 -4.403 -16.146 1.00 0.00 O ATOM 45 CB MET A 4 2.450 -6.812 -16.705 1.00 0.00 C ATOM 46 CG MET A 4 3.068 -6.151 -15.485 1.00 0.00 C ATOM 47 SD MET A 4 3.586 -4.454 -15.795 1.00 0.00 S ATOM 48 CE MET A 4 4.983 -4.679 -16.890 1.00 0.00 C ATOM 0 H MET A 4 1.268 -7.667 -18.626 1.00 0.00 H new ATOM 0 HA MET A 4 0.409 -6.889 -16.068 1.00 0.00 H new ATOM 0 HB2 MET A 4 2.580 -7.891 -16.618 1.00 0.00 H new ATOM 0 HB3 MET A 4 3.003 -6.494 -17.589 1.00 0.00 H new ATOM 0 HG2 MET A 4 2.347 -6.162 -14.668 1.00 0.00 H new ATOM 0 HG3 MET A 4 3.929 -6.735 -15.159 1.00 0.00 H new ATOM 0 HE1 MET A 4 5.022 -3.856 -17.604 1.00 0.00 H new ATOM 0 HE2 MET A 4 5.903 -4.697 -16.306 1.00 0.00 H new ATOM 0 HE3 MET A 4 4.876 -5.621 -17.428 1.00 0.00 H new ATOM 58 N GLN A 5 1.169 -4.479 -18.176 1.00 0.00 N ATOM 59 CA GLN A 5 1.041 -3.068 -18.484 1.00 0.00 C ATOM 60 C GLN A 5 -0.420 -2.692 -18.639 1.00 0.00 C ATOM 61 O GLN A 5 -0.831 -1.633 -18.168 1.00 0.00 O ATOM 62 CB GLN A 5 1.795 -2.733 -19.777 1.00 0.00 C ATOM 63 CG GLN A 5 3.308 -2.823 -19.692 1.00 0.00 C ATOM 64 CD GLN A 5 3.994 -2.576 -21.025 1.00 0.00 C ATOM 65 OE1 GLN A 5 3.618 -3.117 -22.072 1.00 0.00 O ATOM 66 NE2 GLN A 5 5.026 -1.740 -20.992 1.00 0.00 N ATOM 0 H GLN A 5 1.635 -5.016 -18.907 1.00 0.00 H new ATOM 0 HA GLN A 5 1.472 -2.498 -17.661 1.00 0.00 H new ATOM 0 HB2 GLN A 5 1.452 -3.406 -20.562 1.00 0.00 H new ATOM 0 HB3 GLN A 5 1.525 -1.722 -20.083 1.00 0.00 H new ATOM 0 HG2 GLN A 5 3.669 -2.097 -18.964 1.00 0.00 H new ATOM 0 HG3 GLN A 5 3.587 -3.810 -19.323 1.00 0.00 H new ATOM 0 HE21 GLN A 5 5.308 -1.312 -20.110 1.00 0.00 H new ATOM 0 HE22 GLN A 5 5.536 -1.526 -21.849 1.00 0.00 H new ATOM 75 N LYS A 6 -1.190 -3.560 -19.295 1.00 0.00 N ATOM 76 CA LYS A 6 -2.611 -3.335 -19.502 1.00 0.00 C ATOM 77 C LYS A 6 -3.346 -3.286 -18.175 1.00 0.00 C ATOM 78 O LYS A 6 -4.170 -2.397 -17.966 1.00 0.00 O ATOM 79 CB LYS A 6 -3.195 -4.443 -20.378 1.00 0.00 C ATOM 80 CG LYS A 6 -2.761 -4.422 -21.840 1.00 0.00 C ATOM 81 CD LYS A 6 -3.373 -5.596 -22.591 1.00 0.00 C ATOM 82 CE LYS A 6 -2.953 -5.632 -24.052 1.00 0.00 C ATOM 83 NZ LYS A 6 -3.547 -6.802 -24.764 1.00 0.00 N ATOM 0 H LYS A 6 -0.844 -4.433 -19.694 1.00 0.00 H new ATOM 0 HA LYS A 6 -2.737 -2.376 -20.004 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -2.918 -5.406 -19.949 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -4.282 -4.378 -20.339 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -3.069 -3.485 -22.304 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -1.674 -4.468 -21.904 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -3.077 -6.527 -22.108 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -4.460 -5.536 -22.530 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -3.263 -4.710 -24.544 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -1.866 -5.678 -24.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -3.240 -6.796 -25.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -3.231 -7.682 -24.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -4.585 -6.744 -24.722 1.00 0.00 H new ATOM 97 N ARG A 7 -3.032 -4.228 -17.287 1.00 0.00 N ATOM 98 CA ARG A 7 -3.619 -4.283 -15.958 1.00 0.00 C ATOM 99 C ARG A 7 -3.324 -3.047 -15.132 1.00 0.00 C ATOM 100 O ARG A 7 -4.240 -2.485 -14.523 1.00 0.00 O ATOM 101 CB ARG A 7 -3.106 -5.529 -15.246 1.00 0.00 C ATOM 102 CG ARG A 7 -3.486 -5.663 -13.785 1.00 0.00 C ATOM 103 CD ARG A 7 -4.936 -5.759 -13.506 1.00 0.00 C ATOM 104 NE ARG A 7 -5.136 -5.827 -12.068 1.00 0.00 N ATOM 105 CZ ARG A 7 -5.290 -6.948 -11.335 1.00 0.00 C ATOM 106 NH1 ARG A 7 -5.328 -8.139 -11.884 1.00 0.00 N ATOM 107 NH2 ARG A 7 -5.411 -6.878 -10.023 1.00 0.00 N ATOM 0 H ARG A 7 -2.362 -4.974 -17.474 1.00 0.00 H new ATOM 0 HA ARG A 7 -4.702 -4.324 -16.072 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -3.475 -6.406 -15.779 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -2.019 -5.544 -15.321 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -2.997 -6.550 -13.381 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -3.087 -4.805 -13.244 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -5.457 -4.895 -13.918 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -5.355 -6.643 -13.987 1.00 0.00 H new ATOM 0 HE ARG A 7 -5.162 -4.940 -11.564 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -5.240 -8.237 -12.895 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -5.446 -8.967 -11.299 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -5.388 -5.971 -9.556 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -5.527 -7.731 -9.475 1.00 0.00 H new ATOM 121 N LEU A 8 -2.069 -2.614 -15.125 1.00 0.00 N ATOM 122 CA LEU A 8 -1.723 -1.428 -14.368 1.00 0.00 C ATOM 123 C LEU A 8 -2.313 -0.166 -14.952 1.00 0.00 C ATOM 124 O LEU A 8 -2.717 0.705 -14.185 1.00 0.00 O ATOM 125 CB LEU A 8 -0.209 -1.294 -14.278 1.00 0.00 C ATOM 126 CG LEU A 8 0.434 -2.360 -13.403 1.00 0.00 C ATOM 127 CD1 LEU A 8 1.944 -2.253 -13.493 1.00 0.00 C ATOM 128 CD2 LEU A 8 -0.066 -2.150 -11.988 1.00 0.00 C ATOM 0 H LEU A 8 -1.296 -3.056 -15.622 1.00 0.00 H new ATOM 0 HA LEU A 8 -2.150 -1.551 -13.373 1.00 0.00 H new ATOM 0 HB2 LEU A 8 0.215 -1.351 -15.281 1.00 0.00 H new ATOM 0 HB3 LEU A 8 0.040 -0.309 -13.882 1.00 0.00 H new ATOM 0 HG LEU A 8 0.166 -3.364 -13.733 1.00 0.00 H new ATOM 0 HD11 LEU A 8 2.401 -3.018 -12.865 1.00 0.00 H new ATOM 0 HD12 LEU A 8 2.258 -2.397 -14.527 1.00 0.00 H new ATOM 0 HD13 LEU A 8 2.260 -1.267 -13.152 1.00 0.00 H new ATOM 0 HD21 LEU A 8 0.376 -2.899 -11.331 1.00 0.00 H new ATOM 0 HD22 LEU A 8 0.218 -1.155 -11.646 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -1.152 -2.245 -11.968 1.00 0.00 H new ATOM 140 N GLN A 9 -2.381 -0.072 -16.278 1.00 0.00 N ATOM 141 CA GLN A 9 -2.945 1.108 -16.908 1.00 0.00 C ATOM 142 C GLN A 9 -4.425 1.201 -16.610 1.00 0.00 C ATOM 143 O GLN A 9 -4.923 2.299 -16.369 1.00 0.00 O ATOM 144 CB GLN A 9 -2.720 1.079 -18.416 1.00 0.00 C ATOM 145 CG GLN A 9 -3.150 2.346 -19.134 1.00 0.00 C ATOM 146 CD GLN A 9 -2.341 3.555 -18.699 1.00 0.00 C ATOM 147 OE1 GLN A 9 -1.110 3.503 -18.635 1.00 0.00 O ATOM 148 NE2 GLN A 9 -3.022 4.656 -18.407 1.00 0.00 N ATOM 0 H GLN A 9 -2.056 -0.790 -16.925 1.00 0.00 H new ATOM 0 HA GLN A 9 -2.441 1.985 -16.501 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -1.662 0.906 -18.611 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -3.264 0.234 -18.837 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -3.042 2.207 -20.210 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -4.207 2.530 -18.941 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -4.040 4.658 -18.472 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -2.527 5.500 -18.117 1.00 0.00 H new ATOM 157 N LYS A 10 -5.120 0.066 -16.621 1.00 0.00 N ATOM 158 CA LYS A 10 -6.534 0.068 -16.292 1.00 0.00 C ATOM 159 C LYS A 10 -6.766 0.475 -14.849 1.00 0.00 C ATOM 160 O LYS A 10 -7.725 1.201 -14.583 1.00 0.00 O ATOM 161 CB LYS A 10 -7.151 -1.305 -16.550 1.00 0.00 C ATOM 162 CG LYS A 10 -7.300 -1.667 -18.022 1.00 0.00 C ATOM 163 CD LYS A 10 -7.889 -3.060 -18.184 1.00 0.00 C ATOM 164 CE LYS A 10 -8.032 -3.442 -19.650 1.00 0.00 C ATOM 165 NZ LYS A 10 -8.605 -4.808 -19.811 1.00 0.00 N ATOM 0 H LYS A 10 -4.732 -0.849 -16.850 1.00 0.00 H new ATOM 0 HA LYS A 10 -7.018 0.802 -16.937 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -6.536 -2.062 -16.064 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -8.133 -1.342 -16.079 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -7.941 -0.937 -18.516 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -6.327 -1.620 -18.512 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -7.252 -3.786 -17.679 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -8.865 -3.101 -17.700 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -8.672 -2.717 -20.154 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -7.057 -3.397 -20.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -8.687 -5.033 -20.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -7.982 -5.502 -19.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -9.547 -4.844 -19.371 1.00 0.00 H new ATOM 179 N GLU A 11 -5.915 0.022 -13.922 1.00 0.00 N ATOM 180 CA GLU A 11 -6.114 0.443 -12.543 1.00 0.00 C ATOM 181 C GLU A 11 -5.791 1.928 -12.388 1.00 0.00 C ATOM 182 O GLU A 11 -6.468 2.615 -11.626 1.00 0.00 O ATOM 183 CB GLU A 11 -5.274 -0.384 -11.563 1.00 0.00 C ATOM 184 CG GLU A 11 -5.686 -1.849 -11.425 1.00 0.00 C ATOM 185 CD GLU A 11 -4.958 -2.534 -10.302 1.00 0.00 C ATOM 186 OE1 GLU A 11 -4.967 -1.934 -9.255 1.00 0.00 O ATOM 187 OE2 GLU A 11 -4.434 -3.619 -10.458 1.00 0.00 O ATOM 0 H GLU A 11 -5.126 -0.601 -14.091 1.00 0.00 H new ATOM 0 HA GLU A 11 -7.163 0.275 -12.301 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -4.232 -0.345 -11.881 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -5.325 0.085 -10.580 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -6.760 -1.909 -11.251 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -5.485 -2.372 -12.360 1.00 0.00 H new ATOM 194 N LEU A 12 -4.783 2.430 -13.104 1.00 0.00 N ATOM 195 CA LEU A 12 -4.469 3.854 -13.067 1.00 0.00 C ATOM 196 C LEU A 12 -5.627 4.694 -13.571 1.00 0.00 C ATOM 197 O LEU A 12 -5.940 5.717 -12.964 1.00 0.00 O ATOM 198 CB LEU A 12 -3.224 4.140 -13.920 1.00 0.00 C ATOM 199 CG LEU A 12 -1.880 3.683 -13.348 1.00 0.00 C ATOM 200 CD1 LEU A 12 -0.798 3.764 -14.414 1.00 0.00 C ATOM 201 CD2 LEU A 12 -1.519 4.623 -12.206 1.00 0.00 C ATOM 0 H LEU A 12 -4.177 1.876 -13.710 1.00 0.00 H new ATOM 0 HA LEU A 12 -4.278 4.123 -12.028 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -3.360 3.664 -14.891 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -3.171 5.214 -14.096 1.00 0.00 H new ATOM 0 HG LEU A 12 -1.955 2.652 -13.003 1.00 0.00 H new ATOM 0 HD11 LEU A 12 0.153 3.436 -13.993 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -1.065 3.121 -15.253 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -0.705 4.793 -14.761 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -0.563 4.323 -11.776 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -1.443 5.642 -12.584 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -2.292 4.577 -11.439 1.00 0.00 H new ATOM 213 N LEU A 13 -6.258 4.264 -14.662 1.00 0.00 N ATOM 214 CA LEU A 13 -7.392 4.982 -15.219 1.00 0.00 C ATOM 215 C LEU A 13 -8.603 4.938 -14.307 1.00 0.00 C ATOM 216 O LEU A 13 -9.300 5.945 -14.167 1.00 0.00 O ATOM 217 CB LEU A 13 -7.745 4.377 -16.579 1.00 0.00 C ATOM 218 CG LEU A 13 -6.709 4.621 -17.681 1.00 0.00 C ATOM 219 CD1 LEU A 13 -7.074 3.797 -18.908 1.00 0.00 C ATOM 220 CD2 LEU A 13 -6.670 6.105 -18.004 1.00 0.00 C ATOM 0 H LEU A 13 -6.000 3.421 -15.175 1.00 0.00 H new ATOM 0 HA LEU A 13 -7.108 6.029 -15.328 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -7.880 3.302 -16.458 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.703 4.784 -16.904 1.00 0.00 H new ATOM 0 HG LEU A 13 -5.718 4.313 -17.348 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -6.338 3.969 -19.694 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -7.085 2.739 -18.646 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -8.061 4.092 -19.264 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -5.935 6.288 -18.788 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -7.653 6.429 -18.346 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -6.394 6.665 -17.110 1.00 0.00 H new ATOM 232 N ALA A 14 -8.846 3.786 -13.687 1.00 0.00 N ATOM 233 CA ALA A 14 -9.958 3.623 -12.765 1.00 0.00 C ATOM 234 C ALA A 14 -9.813 4.524 -11.554 1.00 0.00 C ATOM 235 O ALA A 14 -10.787 5.136 -11.114 1.00 0.00 O ATOM 236 CB ALA A 14 -10.053 2.175 -12.315 1.00 0.00 C ATOM 0 H ALA A 14 -8.280 2.947 -13.811 1.00 0.00 H new ATOM 0 HA ALA A 14 -10.870 3.905 -13.291 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -10.889 2.063 -11.625 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -10.210 1.534 -13.182 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -9.128 1.888 -11.815 1.00 0.00 H new ATOM 242 N LEU A 15 -8.595 4.616 -11.030 1.00 0.00 N ATOM 243 CA LEU A 15 -8.389 5.416 -9.843 1.00 0.00 C ATOM 244 C LEU A 15 -8.191 6.879 -10.202 1.00 0.00 C ATOM 245 O LEU A 15 -8.303 7.746 -9.338 1.00 0.00 O ATOM 246 CB LEU A 15 -7.203 4.851 -9.074 1.00 0.00 C ATOM 247 CG LEU A 15 -7.435 3.395 -8.653 1.00 0.00 C ATOM 248 CD1 LEU A 15 -6.214 2.907 -7.890 1.00 0.00 C ATOM 249 CD2 LEU A 15 -8.751 3.295 -7.907 1.00 0.00 C ATOM 0 H LEU A 15 -7.762 4.159 -11.400 1.00 0.00 H new ATOM 0 HA LEU A 15 -9.273 5.372 -9.207 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -6.307 4.912 -9.692 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -7.021 5.460 -8.189 1.00 0.00 H new ATOM 0 HG LEU A 15 -7.538 2.726 -9.508 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -6.366 1.872 -7.584 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -5.335 2.971 -8.531 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -6.065 3.528 -7.007 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -8.921 2.261 -7.605 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -8.717 3.930 -7.022 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -9.563 3.621 -8.557 1.00 0.00 H new ATOM 261 N GLN A 16 -7.851 7.168 -11.456 1.00 0.00 N ATOM 262 CA GLN A 16 -7.815 8.549 -11.905 1.00 0.00 C ATOM 263 C GLN A 16 -9.249 9.056 -11.963 1.00 0.00 C ATOM 264 O GLN A 16 -9.525 10.203 -11.604 1.00 0.00 O ATOM 265 CB GLN A 16 -7.140 8.672 -13.271 1.00 0.00 C ATOM 266 CG GLN A 16 -6.982 10.100 -13.756 1.00 0.00 C ATOM 267 CD GLN A 16 -6.095 10.933 -12.851 1.00 0.00 C ATOM 268 OE1 GLN A 16 -4.964 10.555 -12.533 1.00 0.00 O ATOM 269 NE2 GLN A 16 -6.608 12.083 -12.428 1.00 0.00 N ATOM 0 H GLN A 16 -7.602 6.477 -12.164 1.00 0.00 H new ATOM 0 HA GLN A 16 -7.228 9.149 -11.210 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -6.156 8.205 -13.222 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -7.722 8.113 -14.004 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -6.562 10.093 -14.762 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -7.965 10.567 -13.824 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -7.547 12.358 -12.714 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -6.062 12.691 -11.817 1.00 0.00 H new ATOM 278 N ASN A 17 -10.159 8.198 -12.428 1.00 0.00 N ATOM 279 CA ASN A 17 -11.575 8.527 -12.470 1.00 0.00 C ATOM 280 C ASN A 17 -12.175 8.621 -11.071 1.00 0.00 C ATOM 281 O ASN A 17 -13.075 9.431 -10.843 1.00 0.00 O ATOM 282 CB ASN A 17 -12.321 7.507 -13.305 1.00 0.00 C ATOM 283 CG ASN A 17 -12.048 7.675 -14.773 1.00 0.00 C ATOM 284 OD1 ASN A 17 -11.637 8.750 -15.225 1.00 0.00 O ATOM 285 ND2 ASN A 17 -12.269 6.630 -15.529 1.00 0.00 N ATOM 0 H ASN A 17 -9.934 7.268 -12.781 1.00 0.00 H new ATOM 0 HA ASN A 17 -11.678 9.509 -12.933 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -12.032 6.503 -12.995 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -13.391 7.601 -13.122 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -12.102 6.683 -16.534 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -12.608 5.762 -15.113 1.00 0.00 H new ATOM 292 N ASP A 18 -11.696 7.800 -10.136 1.00 0.00 N ATOM 293 CA ASP A 18 -12.173 7.902 -8.765 1.00 0.00 C ATOM 294 C ASP A 18 -11.084 7.547 -7.751 1.00 0.00 C ATOM 295 O ASP A 18 -10.966 6.383 -7.364 1.00 0.00 O ATOM 296 CB ASP A 18 -13.375 6.973 -8.577 1.00 0.00 C ATOM 297 CG ASP A 18 -14.041 7.091 -7.213 1.00 0.00 C ATOM 298 OD1 ASP A 18 -13.551 7.826 -6.389 1.00 0.00 O ATOM 299 OD2 ASP A 18 -15.039 6.441 -7.008 1.00 0.00 O ATOM 0 H ASP A 18 -10.996 7.076 -10.300 1.00 0.00 H new ATOM 0 HA ASP A 18 -12.463 8.938 -8.587 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -14.113 7.189 -9.350 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -13.051 5.943 -8.724 1.00 0.00 H new ATOM 304 N PRO A 19 -10.283 8.532 -7.320 1.00 0.00 N ATOM 305 CA PRO A 19 -9.236 8.386 -6.329 1.00 0.00 C ATOM 306 C PRO A 19 -9.764 7.830 -5.003 1.00 0.00 C ATOM 307 O PRO A 19 -10.711 8.401 -4.458 1.00 0.00 O ATOM 308 CB PRO A 19 -8.755 9.835 -6.191 1.00 0.00 C ATOM 309 CG PRO A 19 -9.079 10.463 -7.521 1.00 0.00 C ATOM 310 CD PRO A 19 -10.394 9.854 -7.946 1.00 0.00 C ATOM 0 HA PRO A 19 -8.456 7.679 -6.610 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -9.264 10.347 -5.375 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -7.687 9.881 -5.979 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -9.158 11.547 -7.434 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -8.297 10.258 -8.252 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -11.251 10.418 -7.578 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -10.493 9.794 -9.030 1.00 0.00 H new ATOM 318 N PRO A 20 -9.201 6.740 -4.473 1.00 0.00 N ATOM 319 CA PRO A 20 -9.570 6.148 -3.203 1.00 0.00 C ATOM 320 C PRO A 20 -9.362 7.103 -2.035 1.00 0.00 C ATOM 321 O PRO A 20 -8.492 7.971 -2.120 1.00 0.00 O ATOM 322 CB PRO A 20 -8.619 4.958 -3.119 1.00 0.00 C ATOM 323 CG PRO A 20 -8.245 4.699 -4.544 1.00 0.00 C ATOM 324 CD PRO A 20 -8.164 6.038 -5.227 1.00 0.00 C ATOM 0 HA PRO A 20 -10.626 5.882 -3.146 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -7.744 5.187 -2.511 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -9.102 4.091 -2.668 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -7.290 4.177 -4.603 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -8.986 4.063 -5.028 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -7.183 6.503 -5.128 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -8.384 5.981 -6.293 1.00 0.00 H new ATOM 332 N PRO A 21 -10.145 6.975 -0.959 1.00 0.00 N ATOM 333 CA PRO A 21 -10.017 7.786 0.227 1.00 0.00 C ATOM 334 C PRO A 21 -8.591 7.788 0.753 1.00 0.00 C ATOM 335 O PRO A 21 -8.080 6.760 1.193 1.00 0.00 O ATOM 336 CB PRO A 21 -10.977 7.060 1.178 1.00 0.00 C ATOM 337 CG PRO A 21 -11.989 6.424 0.265 1.00 0.00 C ATOM 338 CD PRO A 21 -11.216 5.970 -0.953 1.00 0.00 C ATOM 0 HA PRO A 21 -10.245 8.842 0.080 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -10.456 6.313 1.777 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -11.449 7.754 1.874 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -12.481 5.582 0.752 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -12.769 7.134 -0.009 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -10.835 4.954 -0.851 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -11.817 5.995 -1.862 1.00 0.00 H new ATOM 346 N GLY A 22 -7.960 8.954 0.720 1.00 0.00 N ATOM 347 CA GLY A 22 -6.597 9.096 1.208 1.00 0.00 C ATOM 348 C GLY A 22 -5.520 8.588 0.250 1.00 0.00 C ATOM 349 O GLY A 22 -4.386 8.367 0.668 1.00 0.00 O ATOM 0 H GLY A 22 -8.371 9.815 0.360 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -6.409 10.149 1.419 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -6.506 8.560 2.153 1.00 0.00 H new ATOM 353 N MET A 23 -5.842 8.394 -1.028 1.00 0.00 N ATOM 354 CA MET A 23 -4.847 7.916 -1.990 1.00 0.00 C ATOM 355 C MET A 23 -4.641 8.835 -3.191 1.00 0.00 C ATOM 356 O MET A 23 -5.490 8.906 -4.082 1.00 0.00 O ATOM 357 CB MET A 23 -5.264 6.531 -2.475 1.00 0.00 C ATOM 358 CG MET A 23 -4.345 5.884 -3.502 1.00 0.00 C ATOM 359 SD MET A 23 -4.845 4.202 -3.913 1.00 0.00 S ATOM 360 CE MET A 23 -3.719 3.730 -5.218 1.00 0.00 C ATOM 0 H MET A 23 -6.770 8.557 -1.419 1.00 0.00 H new ATOM 0 HA MET A 23 -3.891 7.892 -1.467 1.00 0.00 H new ATOM 0 HB2 MET A 23 -5.334 5.870 -1.611 1.00 0.00 H new ATOM 0 HB3 MET A 23 -6.264 6.603 -2.904 1.00 0.00 H new ATOM 0 HG2 MET A 23 -4.336 6.489 -4.409 1.00 0.00 H new ATOM 0 HG3 MET A 23 -3.326 5.873 -3.116 1.00 0.00 H new ATOM 0 HE1 MET A 23 -4.019 2.765 -5.626 1.00 0.00 H new ATOM 0 HE2 MET A 23 -3.742 4.481 -6.008 1.00 0.00 H new ATOM 0 HE3 MET A 23 -2.708 3.656 -4.817 1.00 0.00 H new ATOM 370 N THR A 24 -3.501 9.532 -3.211 1.00 0.00 N ATOM 371 CA THR A 24 -3.153 10.422 -4.315 1.00 0.00 C ATOM 372 C THR A 24 -2.169 9.753 -5.273 1.00 0.00 C ATOM 373 O THR A 24 -1.123 9.236 -4.878 1.00 0.00 O ATOM 374 CB THR A 24 -2.559 11.757 -3.813 1.00 0.00 C ATOM 375 OG1 THR A 24 -3.531 12.455 -3.016 1.00 0.00 O ATOM 376 CG2 THR A 24 -2.138 12.630 -4.987 1.00 0.00 C ATOM 0 H THR A 24 -2.802 9.494 -2.469 1.00 0.00 H new ATOM 0 HA THR A 24 -4.080 10.637 -4.847 1.00 0.00 H new ATOM 0 HB THR A 24 -1.680 11.539 -3.206 1.00 0.00 H new ATOM 0 HG1 THR A 24 -3.503 13.411 -3.229 1.00 0.00 H new ATOM 0 HG21 THR A 24 -1.722 13.566 -4.614 1.00 0.00 H new ATOM 0 HG22 THR A 24 -1.385 12.108 -5.577 1.00 0.00 H new ATOM 0 HG23 THR A 24 -3.005 12.842 -5.612 1.00 0.00 H new ATOM 384 N LEU A 25 -2.511 9.799 -6.557 1.00 0.00 N ATOM 385 CA LEU A 25 -1.702 9.177 -7.598 1.00 0.00 C ATOM 386 C LEU A 25 -0.651 10.131 -8.150 1.00 0.00 C ATOM 387 O LEU A 25 -1.003 11.153 -8.740 1.00 0.00 O ATOM 388 CB LEU A 25 -2.582 8.752 -8.786 1.00 0.00 C ATOM 389 CG LEU A 25 -3.764 7.808 -8.530 1.00 0.00 C ATOM 390 CD1 LEU A 25 -4.489 7.580 -9.851 1.00 0.00 C ATOM 391 CD2 LEU A 25 -3.274 6.503 -7.945 1.00 0.00 C ATOM 0 H LEU A 25 -3.350 10.265 -6.903 1.00 0.00 H new ATOM 0 HA LEU A 25 -1.219 8.318 -7.133 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -2.977 9.658 -9.245 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.934 8.278 -9.523 1.00 0.00 H new ATOM 0 HG LEU A 25 -4.453 8.250 -7.810 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -5.334 6.910 -9.691 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.849 8.533 -10.238 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -3.803 7.133 -10.570 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -4.123 5.842 -7.768 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.584 6.028 -8.642 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -2.762 6.696 -7.002 1.00 0.00 H new ATOM 403 N ASN A 26 0.627 9.810 -7.969 1.00 0.00 N ATOM 404 CA ASN A 26 1.678 10.652 -8.528 1.00 0.00 C ATOM 405 C ASN A 26 2.295 10.024 -9.766 1.00 0.00 C ATOM 406 O ASN A 26 2.390 8.801 -9.885 1.00 0.00 O ATOM 407 CB ASN A 26 2.759 10.965 -7.520 1.00 0.00 C ATOM 408 CG ASN A 26 2.289 11.860 -6.414 1.00 0.00 C ATOM 409 OD1 ASN A 26 1.368 12.668 -6.586 1.00 0.00 O ATOM 410 ND2 ASN A 26 2.927 11.746 -5.281 1.00 0.00 N ATOM 0 H ASN A 26 0.954 8.993 -7.453 1.00 0.00 H new ATOM 0 HA ASN A 26 1.199 11.589 -8.810 1.00 0.00 H new ATOM 0 HB2 ASN A 26 3.130 10.033 -7.093 1.00 0.00 H new ATOM 0 HB3 ASN A 26 3.598 11.438 -8.031 1.00 0.00 H new ATOM 0 HD21 ASN A 26 2.672 12.338 -4.490 1.00 0.00 H new ATOM 0 HD22 ASN A 26 3.680 11.065 -5.186 1.00 0.00 H new ATOM 417 N GLU A 27 2.702 10.889 -10.686 1.00 0.00 N ATOM 418 CA GLU A 27 3.325 10.483 -11.935 1.00 0.00 C ATOM 419 C GLU A 27 4.698 9.866 -11.713 1.00 0.00 C ATOM 420 O GLU A 27 5.499 10.352 -10.912 1.00 0.00 O ATOM 421 CB GLU A 27 3.441 11.670 -12.893 1.00 0.00 C ATOM 422 CG GLU A 27 3.991 11.303 -14.266 1.00 0.00 C ATOM 423 CD GLU A 27 4.015 12.452 -15.231 1.00 0.00 C ATOM 424 OE1 GLU A 27 3.559 13.513 -14.876 1.00 0.00 O ATOM 425 OE2 GLU A 27 4.493 12.271 -16.327 1.00 0.00 O ATOM 0 H GLU A 27 2.607 11.899 -10.584 1.00 0.00 H new ATOM 0 HA GLU A 27 2.682 9.723 -12.378 1.00 0.00 H new ATOM 0 HB2 GLU A 27 2.457 12.123 -13.016 1.00 0.00 H new ATOM 0 HB3 GLU A 27 4.086 12.425 -12.444 1.00 0.00 H new ATOM 0 HG2 GLU A 27 5.003 10.915 -14.151 1.00 0.00 H new ATOM 0 HG3 GLU A 27 3.387 10.499 -14.687 1.00 0.00 H new ATOM 432 N LYS A 28 4.941 8.782 -12.438 1.00 0.00 N ATOM 433 CA LYS A 28 6.190 8.035 -12.401 1.00 0.00 C ATOM 434 C LYS A 28 7.327 8.788 -13.083 1.00 0.00 C ATOM 435 O LYS A 28 7.100 9.617 -13.964 1.00 0.00 O ATOM 436 CB LYS A 28 5.943 6.682 -13.064 1.00 0.00 C ATOM 437 CG LYS A 28 5.625 6.784 -14.552 1.00 0.00 C ATOM 438 CD LYS A 28 5.235 5.431 -15.126 1.00 0.00 C ATOM 439 CE LYS A 28 4.899 5.513 -16.611 1.00 0.00 C ATOM 440 NZ LYS A 28 3.690 6.348 -16.869 1.00 0.00 N ATOM 0 H LYS A 28 4.257 8.388 -13.084 1.00 0.00 H new ATOM 0 HA LYS A 28 6.503 7.897 -11.366 1.00 0.00 H new ATOM 0 HB2 LYS A 28 6.824 6.055 -12.931 1.00 0.00 H new ATOM 0 HB3 LYS A 28 5.117 6.183 -12.557 1.00 0.00 H new ATOM 0 HG2 LYS A 28 4.813 7.494 -14.705 1.00 0.00 H new ATOM 0 HG3 LYS A 28 6.492 7.172 -15.086 1.00 0.00 H new ATOM 0 HD2 LYS A 28 6.053 4.726 -14.978 1.00 0.00 H new ATOM 0 HD3 LYS A 28 4.375 5.041 -14.581 1.00 0.00 H new ATOM 0 HE2 LYS A 28 5.749 5.930 -17.152 1.00 0.00 H new ATOM 0 HE3 LYS A 28 4.735 4.508 -17.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 3.409 6.253 -17.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 2.911 6.029 -16.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 3.906 7.344 -16.663 1.00 0.00 H new ATOM 454 N SER A 29 8.559 8.479 -12.688 1.00 0.00 N ATOM 455 CA SER A 29 9.734 9.159 -13.218 1.00 0.00 C ATOM 456 C SER A 29 10.207 8.580 -14.541 1.00 0.00 C ATOM 457 O SER A 29 10.895 9.260 -15.305 1.00 0.00 O ATOM 458 CB SER A 29 10.869 9.070 -12.222 1.00 0.00 C ATOM 459 OG SER A 29 11.318 7.747 -12.106 1.00 0.00 O ATOM 0 H SER A 29 8.769 7.757 -11.998 1.00 0.00 H new ATOM 0 HA SER A 29 9.442 10.195 -13.391 1.00 0.00 H new ATOM 0 HB2 SER A 29 11.690 9.712 -12.539 1.00 0.00 H new ATOM 0 HB3 SER A 29 10.537 9.434 -11.250 1.00 0.00 H new ATOM 0 HG SER A 29 10.564 7.165 -11.876 1.00 0.00 H new ATOM 465 N VAL A 30 9.849 7.328 -14.809 1.00 0.00 N ATOM 466 CA VAL A 30 10.235 6.710 -16.066 1.00 0.00 C ATOM 467 C VAL A 30 8.992 6.507 -16.905 1.00 0.00 C ATOM 468 O VAL A 30 8.150 5.667 -16.593 1.00 0.00 O ATOM 469 CB VAL A 30 10.951 5.365 -15.835 1.00 0.00 C ATOM 470 CG1 VAL A 30 11.325 4.738 -17.170 1.00 0.00 C ATOM 471 CG2 VAL A 30 12.196 5.593 -14.993 1.00 0.00 C ATOM 0 H VAL A 30 9.303 6.734 -14.185 1.00 0.00 H new ATOM 0 HA VAL A 30 10.936 7.365 -16.584 1.00 0.00 H new ATOM 0 HB VAL A 30 10.282 4.685 -15.308 1.00 0.00 H new ATOM 0 HG11 VAL A 30 11.831 3.788 -16.997 1.00 0.00 H new ATOM 0 HG12 VAL A 30 10.423 4.567 -17.757 1.00 0.00 H new ATOM 0 HG13 VAL A 30 11.990 5.409 -17.714 1.00 0.00 H new ATOM 0 HG21 VAL A 30 12.703 4.642 -14.829 1.00 0.00 H new ATOM 0 HG22 VAL A 30 12.867 6.277 -15.513 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.912 6.023 -14.033 1.00 0.00 H new ATOM 481 N GLN A 31 8.927 7.223 -18.022 1.00 0.00 N ATOM 482 CA GLN A 31 7.765 7.195 -18.902 1.00 0.00 C ATOM 483 C GLN A 31 7.580 5.848 -19.587 1.00 0.00 C ATOM 484 O GLN A 31 6.465 5.492 -19.970 1.00 0.00 O ATOM 485 CB GLN A 31 7.885 8.293 -19.957 1.00 0.00 C ATOM 486 CG GLN A 31 7.828 9.707 -19.401 1.00 0.00 C ATOM 487 CD GLN A 31 6.514 10.030 -18.706 1.00 0.00 C ATOM 488 OE1 GLN A 31 5.442 9.610 -19.153 1.00 0.00 O ATOM 489 NE2 GLN A 31 6.593 10.790 -17.620 1.00 0.00 N ATOM 0 H GLN A 31 9.676 7.837 -18.342 1.00 0.00 H new ATOM 0 HA GLN A 31 6.888 7.366 -18.278 1.00 0.00 H new ATOM 0 HB2 GLN A 31 8.825 8.164 -20.493 1.00 0.00 H new ATOM 0 HB3 GLN A 31 7.084 8.169 -20.685 1.00 0.00 H new ATOM 0 HG2 GLN A 31 8.647 9.845 -18.696 1.00 0.00 H new ATOM 0 HG3 GLN A 31 7.984 10.416 -20.214 1.00 0.00 H new ATOM 0 HE21 GLN A 31 7.502 11.113 -17.289 1.00 0.00 H new ATOM 0 HE22 GLN A 31 5.745 11.051 -17.117 1.00 0.00 H new ATOM 498 N ASN A 32 8.669 5.103 -19.726 1.00 0.00 N ATOM 499 CA ASN A 32 8.642 3.788 -20.335 1.00 0.00 C ATOM 500 C ASN A 32 8.532 2.650 -19.319 1.00 0.00 C ATOM 501 O ASN A 32 8.724 1.493 -19.695 1.00 0.00 O ATOM 502 CB ASN A 32 9.878 3.603 -21.189 1.00 0.00 C ATOM 503 CG ASN A 32 9.870 4.491 -22.402 1.00 0.00 C ATOM 504 OD1 ASN A 32 8.826 4.703 -23.028 1.00 0.00 O ATOM 505 ND2 ASN A 32 11.019 5.016 -22.744 1.00 0.00 N ATOM 0 H ASN A 32 9.595 5.398 -19.418 1.00 0.00 H new ATOM 0 HA ASN A 32 7.742 3.740 -20.948 1.00 0.00 H new ATOM 0 HB2 ASN A 32 10.765 3.815 -20.592 1.00 0.00 H new ATOM 0 HB3 ASN A 32 9.947 2.562 -21.504 1.00 0.00 H new ATOM 0 HD21 ASN A 32 11.078 5.628 -23.558 1.00 0.00 H new ATOM 0 HD22 ASN A 32 11.856 4.813 -22.197 1.00 0.00 H new ATOM 512 N SER A 33 8.236 2.939 -18.046 1.00 0.00 N ATOM 513 CA SER A 33 8.100 1.844 -17.092 1.00 0.00 C ATOM 514 C SER A 33 6.987 2.054 -16.091 1.00 0.00 C ATOM 515 O SER A 33 7.187 2.610 -15.007 1.00 0.00 O ATOM 516 CB SER A 33 9.373 1.617 -16.312 1.00 0.00 C ATOM 517 OG SER A 33 9.213 0.547 -15.413 1.00 0.00 O ATOM 0 H SER A 33 8.093 3.876 -17.670 1.00 0.00 H new ATOM 0 HA SER A 33 7.865 0.976 -17.708 1.00 0.00 H new ATOM 0 HB2 SER A 33 10.194 1.405 -16.997 1.00 0.00 H new ATOM 0 HB3 SER A 33 9.639 2.522 -15.766 1.00 0.00 H new ATOM 0 HG SER A 33 10.046 0.410 -14.915 1.00 0.00 H new ATOM 523 N ILE A 34 5.833 1.500 -16.455 1.00 0.00 N ATOM 524 CA ILE A 34 4.574 1.523 -15.713 1.00 0.00 C ATOM 525 C ILE A 34 4.623 0.815 -14.364 1.00 0.00 C ATOM 526 O ILE A 34 3.694 0.934 -13.565 1.00 0.00 O ATOM 527 CB ILE A 34 3.468 0.889 -16.564 1.00 0.00 C ATOM 528 CG1 ILE A 34 2.095 1.291 -16.022 1.00 0.00 C ATOM 529 CG2 ILE A 34 3.639 -0.619 -16.558 1.00 0.00 C ATOM 530 CD1 ILE A 34 0.968 0.969 -16.971 1.00 0.00 C ATOM 0 H ILE A 34 5.746 0.989 -17.334 1.00 0.00 H new ATOM 0 HA ILE A 34 4.372 2.573 -15.504 1.00 0.00 H new ATOM 0 HB ILE A 34 3.539 1.246 -17.591 1.00 0.00 H new ATOM 0 HG12 ILE A 34 1.921 0.781 -15.074 1.00 0.00 H new ATOM 0 HG13 ILE A 34 2.092 2.361 -15.813 1.00 0.00 H new ATOM 0 HG21 ILE A 34 2.855 -1.076 -17.162 1.00 0.00 H new ATOM 0 HG22 ILE A 34 4.613 -0.876 -16.973 1.00 0.00 H new ATOM 0 HG23 ILE A 34 3.571 -0.989 -15.535 1.00 0.00 H new ATOM 0 HD11 ILE A 34 0.021 1.278 -16.529 1.00 0.00 H new ATOM 0 HD12 ILE A 34 1.121 1.500 -17.911 1.00 0.00 H new ATOM 0 HD13 ILE A 34 0.947 -0.104 -17.160 1.00 0.00 H new ATOM 542 N THR A 35 5.701 0.071 -14.116 1.00 0.00 N ATOM 543 CA THR A 35 5.908 -0.647 -12.879 1.00 0.00 C ATOM 544 C THR A 35 6.209 0.290 -11.713 1.00 0.00 C ATOM 545 O THR A 35 6.196 -0.147 -10.563 1.00 0.00 O ATOM 546 CB THR A 35 7.066 -1.644 -13.030 1.00 0.00 C ATOM 547 OG1 THR A 35 8.289 -0.946 -13.323 1.00 0.00 O ATOM 548 CG2 THR A 35 6.751 -2.618 -14.154 1.00 0.00 C ATOM 0 H THR A 35 6.461 -0.045 -14.786 1.00 0.00 H new ATOM 0 HA THR A 35 4.981 -1.177 -12.661 1.00 0.00 H new ATOM 0 HB THR A 35 7.189 -2.191 -12.095 1.00 0.00 H new ATOM 0 HG1 THR A 35 8.239 -0.563 -14.224 1.00 0.00 H new ATOM 0 HG21 THR A 35 7.572 -3.326 -14.262 1.00 0.00 H new ATOM 0 HG22 THR A 35 5.834 -3.159 -13.921 1.00 0.00 H new ATOM 0 HG23 THR A 35 6.621 -2.068 -15.086 1.00 0.00 H new ATOM 556 N GLN A 36 6.555 1.552 -11.989 1.00 0.00 N ATOM 557 CA GLN A 36 6.738 2.508 -10.901 1.00 0.00 C ATOM 558 C GLN A 36 5.401 3.169 -10.567 1.00 0.00 C ATOM 559 O GLN A 36 4.799 3.803 -11.435 1.00 0.00 O ATOM 560 CB GLN A 36 7.769 3.585 -11.261 1.00 0.00 C ATOM 561 CG GLN A 36 8.021 4.557 -10.118 1.00 0.00 C ATOM 562 CD GLN A 36 9.068 5.616 -10.388 1.00 0.00 C ATOM 563 OE1 GLN A 36 9.258 6.082 -11.515 1.00 0.00 O ATOM 564 NE2 GLN A 36 9.774 6.011 -9.335 1.00 0.00 N ATOM 0 H GLN A 36 6.709 1.923 -12.926 1.00 0.00 H new ATOM 0 HA GLN A 36 7.111 1.962 -10.035 1.00 0.00 H new ATOM 0 HB2 GLN A 36 8.708 3.106 -11.540 1.00 0.00 H new ATOM 0 HB3 GLN A 36 7.422 4.138 -12.134 1.00 0.00 H new ATOM 0 HG2 GLN A 36 7.082 5.053 -9.871 1.00 0.00 H new ATOM 0 HG3 GLN A 36 8.322 3.988 -9.239 1.00 0.00 H new ATOM 0 HE21 GLN A 36 9.591 5.605 -8.417 1.00 0.00 H new ATOM 0 HE22 GLN A 36 10.499 6.720 -9.444 1.00 0.00 H new ATOM 573 N TRP A 37 4.924 3.034 -9.330 1.00 0.00 N ATOM 574 CA TRP A 37 3.665 3.683 -8.962 1.00 0.00 C ATOM 575 C TRP A 37 3.747 4.331 -7.581 1.00 0.00 C ATOM 576 O TRP A 37 3.737 3.679 -6.535 1.00 0.00 O ATOM 577 CB TRP A 37 2.546 2.653 -9.057 1.00 0.00 C ATOM 578 CG TRP A 37 1.137 3.091 -8.800 1.00 0.00 C ATOM 579 CD1 TRP A 37 0.736 4.112 -8.000 1.00 0.00 C ATOM 580 CD2 TRP A 37 -0.079 2.514 -9.347 1.00 0.00 C ATOM 581 NE1 TRP A 37 -0.627 4.209 -8.003 1.00 0.00 N ATOM 582 CE2 TRP A 37 -1.146 3.242 -8.819 1.00 0.00 C ATOM 583 CE3 TRP A 37 -0.349 1.455 -10.228 1.00 0.00 C ATOM 584 CZ2 TRP A 37 -2.463 2.952 -9.132 1.00 0.00 C ATOM 585 CZ3 TRP A 37 -1.672 1.161 -10.543 1.00 0.00 C ATOM 586 CH2 TRP A 37 -2.701 1.893 -10.005 1.00 0.00 C ATOM 0 H TRP A 37 5.373 2.499 -8.586 1.00 0.00 H new ATOM 0 HA TRP A 37 3.454 4.498 -9.654 1.00 0.00 H new ATOM 0 HB2 TRP A 37 2.580 2.221 -10.057 1.00 0.00 H new ATOM 0 HB3 TRP A 37 2.775 1.851 -8.355 1.00 0.00 H new ATOM 0 HD1 TRP A 37 1.399 4.755 -7.441 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -1.171 4.894 -7.479 1.00 0.00 H new ATOM 0 HE3 TRP A 37 0.458 0.877 -10.655 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -3.277 3.526 -8.714 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -1.892 0.348 -11.219 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -3.719 1.642 -10.265 1.00 0.00 H new ATOM 597 N ILE A 38 3.847 5.656 -7.614 1.00 0.00 N ATOM 598 CA ILE A 38 4.011 6.486 -6.429 1.00 0.00 C ATOM 599 C ILE A 38 2.678 6.936 -5.826 1.00 0.00 C ATOM 600 O ILE A 38 1.838 7.528 -6.507 1.00 0.00 O ATOM 601 CB ILE A 38 4.856 7.709 -6.802 1.00 0.00 C ATOM 602 CG1 ILE A 38 6.225 7.255 -7.313 1.00 0.00 C ATOM 603 CG2 ILE A 38 5.030 8.577 -5.570 1.00 0.00 C ATOM 604 CD1 ILE A 38 7.017 8.368 -7.958 1.00 0.00 C ATOM 0 H ILE A 38 3.816 6.191 -8.482 1.00 0.00 H new ATOM 0 HA ILE A 38 4.508 5.886 -5.667 1.00 0.00 H new ATOM 0 HB ILE A 38 4.358 8.278 -7.587 1.00 0.00 H new ATOM 0 HG12 ILE A 38 6.798 6.844 -6.482 1.00 0.00 H new ATOM 0 HG13 ILE A 38 6.088 6.450 -8.035 1.00 0.00 H new ATOM 0 HG21 ILE A 38 5.630 9.451 -5.823 1.00 0.00 H new ATOM 0 HG22 ILE A 38 4.053 8.899 -5.211 1.00 0.00 H new ATOM 0 HG23 ILE A 38 5.533 8.005 -4.790 1.00 0.00 H new ATOM 0 HD11 ILE A 38 7.977 7.981 -8.299 1.00 0.00 H new ATOM 0 HD12 ILE A 38 6.462 8.763 -8.809 1.00 0.00 H new ATOM 0 HD13 ILE A 38 7.184 9.164 -7.232 1.00 0.00 H new ATOM 616 N VAL A 39 2.491 6.638 -4.540 1.00 0.00 N ATOM 617 CA VAL A 39 1.273 6.972 -3.807 1.00 0.00 C ATOM 618 C VAL A 39 1.447 7.829 -2.559 1.00 0.00 C ATOM 619 O VAL A 39 2.251 7.520 -1.682 1.00 0.00 O ATOM 620 CB VAL A 39 0.552 5.687 -3.350 1.00 0.00 C ATOM 621 CG1 VAL A 39 -0.667 6.053 -2.519 1.00 0.00 C ATOM 622 CG2 VAL A 39 0.124 4.877 -4.560 1.00 0.00 C ATOM 0 H VAL A 39 3.188 6.154 -3.974 1.00 0.00 H new ATOM 0 HA VAL A 39 0.707 7.560 -4.529 1.00 0.00 H new ATOM 0 HB VAL A 39 1.234 5.090 -2.745 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -1.175 5.144 -2.197 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -0.353 6.622 -1.644 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -1.349 6.656 -3.119 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -0.384 3.971 -4.230 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -0.554 5.470 -5.174 1.00 0.00 H new ATOM 0 HG23 VAL A 39 1.002 4.607 -5.146 1.00 0.00 H new ATOM 632 N ASP A 40 0.688 8.917 -2.463 1.00 0.00 N ATOM 633 CA ASP A 40 0.748 9.690 -1.227 1.00 0.00 C ATOM 634 C ASP A 40 -0.469 9.248 -0.419 1.00 0.00 C ATOM 635 O ASP A 40 -1.618 9.387 -0.844 1.00 0.00 O ATOM 636 CB ASP A 40 0.792 11.194 -1.462 1.00 0.00 C ATOM 637 CG ASP A 40 2.087 11.655 -2.105 1.00 0.00 C ATOM 638 OD1 ASP A 40 3.073 10.971 -1.985 1.00 0.00 O ATOM 639 OD2 ASP A 40 2.084 12.688 -2.732 1.00 0.00 O ATOM 0 H ASP A 40 0.057 9.269 -3.183 1.00 0.00 H new ATOM 0 HA ASP A 40 1.675 9.497 -0.687 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -0.046 11.482 -2.098 1.00 0.00 H new ATOM 0 HB3 ASP A 40 0.662 11.709 -0.510 1.00 0.00 H new ATOM 644 N MET A 41 -0.196 8.675 0.746 1.00 0.00 N ATOM 645 CA MET A 41 -1.201 8.095 1.619 1.00 0.00 C ATOM 646 C MET A 41 -1.576 8.870 2.864 1.00 0.00 C ATOM 647 O MET A 41 -0.741 9.131 3.728 1.00 0.00 O ATOM 648 CB MET A 41 -0.711 6.726 2.049 1.00 0.00 C ATOM 649 CG MET A 41 -1.661 6.010 2.984 1.00 0.00 C ATOM 650 SD MET A 41 -1.056 4.378 3.403 1.00 0.00 S ATOM 651 CE MET A 41 -1.377 3.672 1.796 1.00 0.00 C ATOM 0 H MET A 41 0.752 8.600 1.116 1.00 0.00 H new ATOM 0 HA MET A 41 -2.112 8.085 1.020 1.00 0.00 H new ATOM 0 HB2 MET A 41 -0.553 6.111 1.163 1.00 0.00 H new ATOM 0 HB3 MET A 41 0.257 6.833 2.539 1.00 0.00 H new ATOM 0 HG2 MET A 41 -1.790 6.597 3.894 1.00 0.00 H new ATOM 0 HG3 MET A 41 -2.642 5.927 2.516 1.00 0.00 H new ATOM 0 HE1 MET A 41 -1.077 2.624 1.793 1.00 0.00 H new ATOM 0 HE2 MET A 41 -2.441 3.746 1.572 1.00 0.00 H new ATOM 0 HE3 MET A 41 -0.809 4.214 1.040 1.00 0.00 H new ATOM 661 N GLU A 42 -2.853 9.207 2.973 1.00 0.00 N ATOM 662 CA GLU A 42 -3.335 9.947 4.126 1.00 0.00 C ATOM 663 C GLU A 42 -3.641 8.960 5.234 1.00 0.00 C ATOM 664 O GLU A 42 -4.041 7.827 4.962 1.00 0.00 O ATOM 665 CB GLU A 42 -4.569 10.769 3.767 1.00 0.00 C ATOM 666 CG GLU A 42 -4.259 11.834 2.732 1.00 0.00 C ATOM 667 CD GLU A 42 -5.410 12.695 2.293 1.00 0.00 C ATOM 668 OE1 GLU A 42 -6.493 12.514 2.795 1.00 0.00 O ATOM 669 OE2 GLU A 42 -5.205 13.528 1.435 1.00 0.00 O ATOM 0 H GLU A 42 -3.568 8.981 2.282 1.00 0.00 H new ATOM 0 HA GLU A 42 -2.570 10.648 4.461 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -5.347 10.108 3.385 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -4.965 11.241 4.666 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -3.480 12.483 3.133 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -3.844 11.344 1.851 1.00 0.00 H new ATOM 676 N GLY A 43 -3.434 9.381 6.475 1.00 0.00 N ATOM 677 CA GLY A 43 -3.693 8.486 7.589 1.00 0.00 C ATOM 678 C GLY A 43 -5.165 8.272 7.916 1.00 0.00 C ATOM 679 O GLY A 43 -6.049 8.945 7.387 1.00 0.00 O ATOM 0 H GLY A 43 -3.097 10.310 6.729 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -3.241 7.519 7.371 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -3.193 8.879 8.474 1.00 0.00 H new ATOM 683 N ALA A 44 -5.406 7.333 8.825 1.00 0.00 N ATOM 684 CA ALA A 44 -6.753 6.947 9.216 1.00 0.00 C ATOM 685 C ALA A 44 -7.403 7.942 10.195 1.00 0.00 C ATOM 686 O ALA A 44 -6.790 8.257 11.218 1.00 0.00 O ATOM 687 CB ALA A 44 -6.711 5.564 9.845 1.00 0.00 C ATOM 0 H ALA A 44 -4.671 6.819 9.311 1.00 0.00 H new ATOM 0 HA ALA A 44 -7.366 6.945 8.315 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -7.718 5.268 10.141 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -6.320 4.848 9.123 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -6.066 5.583 10.723 1.00 0.00 H new ATOM 693 N PRO A 45 -8.616 8.439 9.911 1.00 0.00 N ATOM 694 CA PRO A 45 -9.354 9.332 10.777 1.00 0.00 C ATOM 695 C PRO A 45 -9.579 8.753 12.161 1.00 0.00 C ATOM 696 O PRO A 45 -9.978 7.595 12.306 1.00 0.00 O ATOM 697 CB PRO A 45 -10.661 9.495 9.994 1.00 0.00 C ATOM 698 CG PRO A 45 -10.265 9.276 8.561 1.00 0.00 C ATOM 699 CD PRO A 45 -9.202 8.205 8.585 1.00 0.00 C ATOM 0 HA PRO A 45 -8.838 10.270 10.984 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -11.410 8.771 10.315 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -11.092 10.485 10.141 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -11.121 8.964 7.963 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -9.884 10.195 8.116 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -9.621 7.203 8.488 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -8.474 8.326 7.783 1.00 0.00 H new ATOM 707 N GLY A 46 -9.342 9.573 13.178 1.00 0.00 N ATOM 708 CA GLY A 46 -9.503 9.160 14.563 1.00 0.00 C ATOM 709 C GLY A 46 -8.229 8.568 15.165 1.00 0.00 C ATOM 710 O GLY A 46 -8.179 8.327 16.372 1.00 0.00 O ATOM 0 H GLY A 46 -9.034 10.539 13.065 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -9.814 10.019 15.158 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -10.303 8.423 14.625 1.00 0.00 H new ATOM 714 N THR A 47 -7.206 8.329 14.344 1.00 0.00 N ATOM 715 CA THR A 47 -5.955 7.765 14.827 1.00 0.00 C ATOM 716 C THR A 47 -4.901 8.839 14.882 1.00 0.00 C ATOM 717 O THR A 47 -5.118 9.978 14.469 1.00 0.00 O ATOM 718 CB THR A 47 -5.380 6.670 13.922 1.00 0.00 C ATOM 719 OG1 THR A 47 -4.926 7.277 12.707 1.00 0.00 O ATOM 720 CG2 THR A 47 -6.441 5.641 13.601 1.00 0.00 C ATOM 0 H THR A 47 -7.224 8.519 13.342 1.00 0.00 H new ATOM 0 HA THR A 47 -6.192 7.340 15.802 1.00 0.00 H new ATOM 0 HB THR A 47 -4.555 6.173 14.432 1.00 0.00 H new ATOM 0 HG1 THR A 47 -5.595 7.920 12.393 1.00 0.00 H new ATOM 0 HG21 THR A 47 -6.017 4.870 12.958 1.00 0.00 H new ATOM 0 HG22 THR A 47 -6.798 5.186 14.525 1.00 0.00 H new ATOM 0 HG23 THR A 47 -7.273 6.124 13.089 1.00 0.00 H new ATOM 728 N LEU A 48 -3.726 8.435 15.342 1.00 0.00 N ATOM 729 CA LEU A 48 -2.549 9.285 15.431 1.00 0.00 C ATOM 730 C LEU A 48 -2.004 9.703 14.062 1.00 0.00 C ATOM 731 O LEU A 48 -1.093 10.528 13.998 1.00 0.00 O ATOM 732 CB LEU A 48 -1.443 8.545 16.187 1.00 0.00 C ATOM 733 CG LEU A 48 -1.732 8.250 17.663 1.00 0.00 C ATOM 734 CD1 LEU A 48 -0.603 7.403 18.233 1.00 0.00 C ATOM 735 CD2 LEU A 48 -1.871 9.564 18.415 1.00 0.00 C ATOM 0 H LEU A 48 -3.561 7.484 15.672 1.00 0.00 H new ATOM 0 HA LEU A 48 -2.856 10.190 15.956 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -1.249 7.601 15.678 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -0.528 9.135 16.125 1.00 0.00 H new ATOM 0 HG LEU A 48 -2.664 7.694 17.767 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -0.803 7.190 19.283 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -0.535 6.467 17.679 1.00 0.00 H new ATOM 0 HD13 LEU A 48 0.338 7.945 18.146 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -2.077 9.362 19.466 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -0.945 10.132 18.329 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -2.691 10.142 17.989 1.00 0.00 H new ATOM 747 N TYR A 49 -2.544 9.141 12.978 1.00 0.00 N ATOM 748 CA TYR A 49 -2.093 9.452 11.643 1.00 0.00 C ATOM 749 C TYR A 49 -3.073 10.391 10.941 1.00 0.00 C ATOM 750 O TYR A 49 -2.819 10.790 9.805 1.00 0.00 O ATOM 751 CB TYR A 49 -1.978 8.139 10.883 1.00 0.00 C ATOM 752 CG TYR A 49 -1.066 7.175 11.596 1.00 0.00 C ATOM 753 CD1 TYR A 49 0.313 7.225 11.477 1.00 0.00 C ATOM 754 CD2 TYR A 49 -1.664 6.219 12.402 1.00 0.00 C ATOM 755 CE1 TYR A 49 1.081 6.306 12.172 1.00 0.00 C ATOM 756 CE2 TYR A 49 -0.901 5.307 13.093 1.00 0.00 C ATOM 757 CZ TYR A 49 0.480 5.354 12.977 1.00 0.00 C ATOM 758 OH TYR A 49 1.228 4.437 13.679 1.00 0.00 O ATOM 0 H TYR A 49 -3.303 8.461 13.013 1.00 0.00 H new ATOM 0 HA TYR A 49 -1.130 9.961 11.680 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -2.966 7.693 10.770 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -1.598 8.329 9.879 1.00 0.00 H new ATOM 0 HD1 TYR A 49 0.782 7.970 10.851 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -2.740 6.190 12.488 1.00 0.00 H new ATOM 0 HE1 TYR A 49 2.157 6.332 12.085 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -1.372 4.563 13.719 1.00 0.00 H new ATOM 0 HH TYR A 49 2.180 4.581 13.495 1.00 0.00 H new ATOM 768 N GLU A 50 -4.190 10.743 11.591 1.00 0.00 N ATOM 769 CA GLU A 50 -5.143 11.633 10.938 1.00 0.00 C ATOM 770 C GLU A 50 -4.511 12.989 10.680 1.00 0.00 C ATOM 771 O GLU A 50 -3.989 13.634 11.592 1.00 0.00 O ATOM 772 CB GLU A 50 -6.418 11.818 11.764 1.00 0.00 C ATOM 773 CG GLU A 50 -7.437 12.704 11.052 1.00 0.00 C ATOM 774 CD GLU A 50 -8.730 12.916 11.791 1.00 0.00 C ATOM 775 OE1 GLU A 50 -8.931 12.309 12.816 1.00 0.00 O ATOM 776 OE2 GLU A 50 -9.526 13.694 11.322 1.00 0.00 O ATOM 0 H GLU A 50 -4.445 10.437 12.530 1.00 0.00 H new ATOM 0 HA GLU A 50 -5.417 11.166 9.992 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -6.863 10.844 11.967 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -6.165 12.259 12.728 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -6.981 13.676 10.864 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -7.661 12.264 10.080 1.00 0.00 H new ATOM 783 N GLY A 51 -4.577 13.425 9.427 1.00 0.00 N ATOM 784 CA GLY A 51 -4.001 14.697 9.012 1.00 0.00 C ATOM 785 C GLY A 51 -2.569 14.551 8.494 1.00 0.00 C ATOM 786 O GLY A 51 -2.005 15.507 7.959 1.00 0.00 O ATOM 0 H GLY A 51 -5.030 12.908 8.673 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -4.623 15.136 8.232 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -4.010 15.388 9.855 1.00 0.00 H new ATOM 790 N GLU A 52 -1.980 13.367 8.652 1.00 0.00 N ATOM 791 CA GLU A 52 -0.627 13.103 8.194 1.00 0.00 C ATOM 792 C GLU A 52 -0.698 12.432 6.832 1.00 0.00 C ATOM 793 O GLU A 52 -1.682 11.757 6.521 1.00 0.00 O ATOM 794 CB GLU A 52 0.119 12.224 9.198 1.00 0.00 C ATOM 795 CG GLU A 52 0.309 12.860 10.568 1.00 0.00 C ATOM 796 CD GLU A 52 1.049 11.986 11.543 1.00 0.00 C ATOM 797 OE1 GLU A 52 1.204 10.818 11.277 1.00 0.00 O ATOM 798 OE2 GLU A 52 1.472 12.495 12.554 1.00 0.00 O ATOM 0 H GLU A 52 -2.430 12.569 9.100 1.00 0.00 H new ATOM 0 HA GLU A 52 -0.077 14.040 8.109 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -0.425 11.287 9.318 1.00 0.00 H new ATOM 0 HB3 GLU A 52 1.097 11.974 8.788 1.00 0.00 H new ATOM 0 HG2 GLU A 52 0.851 13.798 10.451 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -0.668 13.106 10.983 1.00 0.00 H new ATOM 805 N LYS A 53 0.333 12.613 6.013 1.00 0.00 N ATOM 806 CA LYS A 53 0.313 11.997 4.694 1.00 0.00 C ATOM 807 C LYS A 53 1.727 11.557 4.328 1.00 0.00 C ATOM 808 O LYS A 53 2.664 12.357 4.364 1.00 0.00 O ATOM 809 CB LYS A 53 -0.313 12.977 3.696 1.00 0.00 C ATOM 810 CG LYS A 53 -0.554 12.481 2.276 1.00 0.00 C ATOM 811 CD LYS A 53 -1.412 13.502 1.538 1.00 0.00 C ATOM 812 CE LYS A 53 -1.858 13.011 0.170 1.00 0.00 C ATOM 813 NZ LYS A 53 -2.924 13.871 -0.410 1.00 0.00 N ATOM 0 H LYS A 53 1.165 13.162 6.229 1.00 0.00 H new ATOM 0 HA LYS A 53 -0.304 11.099 4.677 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -1.269 13.306 4.103 1.00 0.00 H new ATOM 0 HB3 LYS A 53 0.330 13.856 3.640 1.00 0.00 H new ATOM 0 HG2 LYS A 53 0.395 12.341 1.759 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -1.053 11.512 2.294 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -2.290 13.736 2.140 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -0.849 14.428 1.422 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -1.002 12.990 -0.505 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -2.223 11.987 0.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -3.211 13.492 -1.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -3.745 13.885 0.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -2.562 14.839 -0.530 1.00 0.00 H new ATOM 827 N PHE A 54 1.874 10.279 3.975 1.00 0.00 N ATOM 828 CA PHE A 54 3.192 9.715 3.708 1.00 0.00 C ATOM 829 C PHE A 54 3.292 9.086 2.328 1.00 0.00 C ATOM 830 O PHE A 54 2.351 8.468 1.838 1.00 0.00 O ATOM 831 CB PHE A 54 3.459 8.619 4.737 1.00 0.00 C ATOM 832 CG PHE A 54 3.422 9.123 6.147 1.00 0.00 C ATOM 833 CD1 PHE A 54 4.525 9.706 6.747 1.00 0.00 C ATOM 834 CD2 PHE A 54 2.243 9.018 6.871 1.00 0.00 C ATOM 835 CE1 PHE A 54 4.452 10.166 8.046 1.00 0.00 C ATOM 836 CE2 PHE A 54 2.169 9.478 8.170 1.00 0.00 C ATOM 837 CZ PHE A 54 3.276 10.053 8.756 1.00 0.00 C ATOM 0 H PHE A 54 1.101 9.622 3.869 1.00 0.00 H new ATOM 0 HA PHE A 54 3.916 10.528 3.764 1.00 0.00 H new ATOM 0 HB2 PHE A 54 2.718 7.829 4.619 1.00 0.00 H new ATOM 0 HB3 PHE A 54 4.434 8.173 4.541 1.00 0.00 H new ATOM 0 HD1 PHE A 54 5.448 9.801 6.195 1.00 0.00 H new ATOM 0 HD2 PHE A 54 1.373 8.571 6.413 1.00 0.00 H new ATOM 0 HE1 PHE A 54 5.319 10.616 8.508 1.00 0.00 H new ATOM 0 HE2 PHE A 54 1.247 9.388 8.725 1.00 0.00 H new ATOM 0 HZ PHE A 54 3.222 10.415 9.772 1.00 0.00 H new ATOM 847 N GLN A 55 4.453 9.208 1.707 1.00 0.00 N ATOM 848 CA GLN A 55 4.643 8.673 0.368 1.00 0.00 C ATOM 849 C GLN A 55 5.192 7.260 0.337 1.00 0.00 C ATOM 850 O GLN A 55 6.081 6.937 1.121 1.00 0.00 O ATOM 851 CB GLN A 55 5.578 9.581 -0.422 1.00 0.00 C ATOM 852 CG GLN A 55 5.766 9.161 -1.866 1.00 0.00 C ATOM 853 CD GLN A 55 6.554 10.199 -2.631 1.00 0.00 C ATOM 854 OE1 GLN A 55 7.764 10.097 -2.860 1.00 0.00 O ATOM 855 NE2 GLN A 55 5.835 11.245 -3.021 1.00 0.00 N ATOM 0 H GLN A 55 5.272 9.668 2.104 1.00 0.00 H new ATOM 0 HA GLN A 55 3.650 8.636 -0.081 1.00 0.00 H new ATOM 0 HB2 GLN A 55 5.187 10.598 -0.398 1.00 0.00 H new ATOM 0 HB3 GLN A 55 6.550 9.601 0.070 1.00 0.00 H new ATOM 0 HG2 GLN A 55 6.284 8.203 -1.906 1.00 0.00 H new ATOM 0 HG3 GLN A 55 4.793 9.017 -2.337 1.00 0.00 H new ATOM 0 HE21 GLN A 55 4.838 11.286 -2.809 1.00 0.00 H new ATOM 0 HE22 GLN A 55 6.280 12.007 -3.532 1.00 0.00 H new ATOM 864 N LEU A 56 4.639 6.428 -0.543 1.00 0.00 N ATOM 865 CA LEU A 56 5.132 5.073 -0.707 1.00 0.00 C ATOM 866 C LEU A 56 5.189 4.700 -2.178 1.00 0.00 C ATOM 867 O LEU A 56 4.591 5.336 -3.045 1.00 0.00 O ATOM 868 CB LEU A 56 4.274 4.050 0.055 1.00 0.00 C ATOM 869 CG LEU A 56 2.801 3.875 -0.304 1.00 0.00 C ATOM 870 CD1 LEU A 56 2.671 3.003 -1.539 1.00 0.00 C ATOM 871 CD2 LEU A 56 2.111 3.199 0.867 1.00 0.00 C ATOM 0 H LEU A 56 3.854 6.671 -1.148 1.00 0.00 H new ATOM 0 HA LEU A 56 6.137 5.047 -0.286 1.00 0.00 H new ATOM 0 HB2 LEU A 56 4.753 3.077 -0.056 1.00 0.00 H new ATOM 0 HB3 LEU A 56 4.322 4.310 1.113 1.00 0.00 H new ATOM 0 HG LEU A 56 2.346 4.844 -0.510 1.00 0.00 H new ATOM 0 HD11 LEU A 56 1.617 2.882 -1.790 1.00 0.00 H new ATOM 0 HD12 LEU A 56 3.191 3.474 -2.373 1.00 0.00 H new ATOM 0 HD13 LEU A 56 3.112 2.026 -1.342 1.00 0.00 H new ATOM 0 HD21 LEU A 56 1.055 3.061 0.637 1.00 0.00 H new ATOM 0 HD22 LEU A 56 2.572 2.228 1.050 1.00 0.00 H new ATOM 0 HD23 LEU A 56 2.210 3.821 1.756 1.00 0.00 H new ATOM 883 N LEU A 57 5.942 3.649 -2.446 1.00 0.00 N ATOM 884 CA LEU A 57 6.170 3.167 -3.789 1.00 0.00 C ATOM 885 C LEU A 57 5.847 1.701 -4.024 1.00 0.00 C ATOM 886 O LEU A 57 6.285 0.819 -3.279 1.00 0.00 O ATOM 887 CB LEU A 57 7.642 3.391 -4.146 1.00 0.00 C ATOM 888 CG LEU A 57 8.071 2.847 -5.510 1.00 0.00 C ATOM 889 CD1 LEU A 57 7.339 3.612 -6.596 1.00 0.00 C ATOM 890 CD2 LEU A 57 9.575 2.987 -5.663 1.00 0.00 C ATOM 0 H LEU A 57 6.416 3.103 -1.727 1.00 0.00 H new ATOM 0 HA LEU A 57 5.482 3.731 -4.419 1.00 0.00 H new ATOM 0 HB2 LEU A 57 7.847 4.461 -4.119 1.00 0.00 H new ATOM 0 HB3 LEU A 57 8.260 2.928 -3.377 1.00 0.00 H new ATOM 0 HG LEU A 57 7.818 1.790 -5.593 1.00 0.00 H new ATOM 0 HD11 LEU A 57 7.638 3.232 -7.573 1.00 0.00 H new ATOM 0 HD12 LEU A 57 6.264 3.484 -6.470 1.00 0.00 H new ATOM 0 HD13 LEU A 57 7.589 4.671 -6.527 1.00 0.00 H new ATOM 0 HD21 LEU A 57 9.880 2.599 -6.635 1.00 0.00 H new ATOM 0 HD22 LEU A 57 9.852 4.039 -5.589 1.00 0.00 H new ATOM 0 HD23 LEU A 57 10.075 2.424 -4.875 1.00 0.00 H new ATOM 902 N PHE A 58 5.030 1.464 -5.046 1.00 0.00 N ATOM 903 CA PHE A 58 4.746 0.117 -5.502 1.00 0.00 C ATOM 904 C PHE A 58 5.731 -0.203 -6.607 1.00 0.00 C ATOM 905 O PHE A 58 5.957 0.597 -7.520 1.00 0.00 O ATOM 906 CB PHE A 58 3.352 -0.015 -6.099 1.00 0.00 C ATOM 907 CG PHE A 58 2.196 0.004 -5.158 1.00 0.00 C ATOM 908 CD1 PHE A 58 1.694 1.179 -4.633 1.00 0.00 C ATOM 909 CD2 PHE A 58 1.592 -1.194 -4.822 1.00 0.00 C ATOM 910 CE1 PHE A 58 0.619 1.134 -3.767 1.00 0.00 C ATOM 911 CE2 PHE A 58 0.517 -1.239 -3.963 1.00 0.00 C ATOM 912 CZ PHE A 58 0.034 -0.067 -3.424 1.00 0.00 C ATOM 0 H PHE A 58 4.553 2.195 -5.573 1.00 0.00 H new ATOM 0 HA PHE A 58 4.820 -0.553 -4.645 1.00 0.00 H new ATOM 0 HB2 PHE A 58 3.215 0.794 -6.816 1.00 0.00 H new ATOM 0 HB3 PHE A 58 3.313 -0.948 -6.660 1.00 0.00 H new ATOM 0 HD1 PHE A 58 2.139 2.127 -4.898 1.00 0.00 H new ATOM 0 HD2 PHE A 58 1.972 -2.114 -5.242 1.00 0.00 H new ATOM 0 HE1 PHE A 58 0.231 2.053 -3.352 1.00 0.00 H new ATOM 0 HE2 PHE A 58 0.057 -2.184 -3.714 1.00 0.00 H new ATOM 0 HZ PHE A 58 -0.799 -0.088 -2.736 1.00 0.00 H new ATOM 922 N LYS A 59 6.331 -1.379 -6.503 1.00 0.00 N ATOM 923 CA LYS A 59 7.253 -1.863 -7.512 1.00 0.00 C ATOM 924 C LYS A 59 6.629 -3.090 -8.136 1.00 0.00 C ATOM 925 O LYS A 59 6.614 -4.165 -7.533 1.00 0.00 O ATOM 926 CB LYS A 59 8.598 -2.216 -6.904 1.00 0.00 C ATOM 927 CG LYS A 59 9.350 -1.062 -6.265 1.00 0.00 C ATOM 928 CD LYS A 59 10.655 -1.595 -5.712 1.00 0.00 C ATOM 929 CE LYS A 59 11.461 -0.553 -4.959 1.00 0.00 C ATOM 930 NZ LYS A 59 12.674 -1.181 -4.371 1.00 0.00 N ATOM 0 H LYS A 59 6.192 -2.019 -5.721 1.00 0.00 H new ATOM 0 HA LYS A 59 7.430 -1.088 -8.258 1.00 0.00 H new ATOM 0 HB2 LYS A 59 8.445 -2.989 -6.150 1.00 0.00 H new ATOM 0 HB3 LYS A 59 9.226 -2.650 -7.682 1.00 0.00 H new ATOM 0 HG2 LYS A 59 9.540 -0.279 -6.999 1.00 0.00 H new ATOM 0 HG3 LYS A 59 8.755 -0.615 -5.469 1.00 0.00 H new ATOM 0 HD2 LYS A 59 10.444 -2.431 -5.046 1.00 0.00 H new ATOM 0 HD3 LYS A 59 11.256 -1.985 -6.533 1.00 0.00 H new ATOM 0 HE2 LYS A 59 11.749 0.254 -5.633 1.00 0.00 H new ATOM 0 HE3 LYS A 59 10.852 -0.109 -4.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 13.159 -0.494 -3.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 12.397 -2.010 -3.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 13.315 -1.479 -5.134 1.00 0.00 H new ATOM 944 N PHE A 60 6.103 -2.946 -9.343 1.00 0.00 N ATOM 945 CA PHE A 60 5.440 -4.098 -9.922 1.00 0.00 C ATOM 946 C PHE A 60 6.373 -5.014 -10.681 1.00 0.00 C ATOM 947 O PHE A 60 7.279 -4.579 -11.391 1.00 0.00 O ATOM 948 CB PHE A 60 4.326 -3.655 -10.855 1.00 0.00 C ATOM 949 CG PHE A 60 3.252 -2.970 -10.081 1.00 0.00 C ATOM 950 CD1 PHE A 60 2.317 -3.681 -9.363 1.00 0.00 C ATOM 951 CD2 PHE A 60 3.198 -1.593 -10.055 1.00 0.00 C ATOM 952 CE1 PHE A 60 1.342 -3.043 -8.622 1.00 0.00 C ATOM 953 CE2 PHE A 60 2.230 -0.958 -9.324 1.00 0.00 C ATOM 954 CZ PHE A 60 1.308 -1.670 -8.606 1.00 0.00 C ATOM 0 H PHE A 60 6.119 -2.098 -9.910 1.00 0.00 H new ATOM 0 HA PHE A 60 5.039 -4.662 -9.080 1.00 0.00 H new ATOM 0 HB2 PHE A 60 4.723 -2.982 -11.615 1.00 0.00 H new ATOM 0 HB3 PHE A 60 3.914 -4.518 -11.378 1.00 0.00 H new ATOM 0 HD1 PHE A 60 2.347 -4.760 -9.380 1.00 0.00 H new ATOM 0 HD2 PHE A 60 3.920 -1.014 -10.612 1.00 0.00 H new ATOM 0 HE1 PHE A 60 0.617 -3.615 -8.063 1.00 0.00 H new ATOM 0 HE2 PHE A 60 2.194 0.121 -9.314 1.00 0.00 H new ATOM 0 HZ PHE A 60 0.556 -1.154 -8.028 1.00 0.00 H new ATOM 964 N SER A 61 6.136 -6.300 -10.488 1.00 0.00 N ATOM 965 CA SER A 61 6.842 -7.352 -11.190 1.00 0.00 C ATOM 966 C SER A 61 6.410 -7.340 -12.631 1.00 0.00 C ATOM 967 O SER A 61 5.256 -7.039 -12.928 1.00 0.00 O ATOM 968 CB SER A 61 6.553 -8.717 -10.605 1.00 0.00 C ATOM 969 OG SER A 61 7.128 -9.733 -11.388 1.00 0.00 O ATOM 0 H SER A 61 5.438 -6.645 -9.830 1.00 0.00 H new ATOM 0 HA SER A 61 7.912 -7.166 -11.094 1.00 0.00 H new ATOM 0 HB2 SER A 61 6.944 -8.771 -9.589 1.00 0.00 H new ATOM 0 HB3 SER A 61 5.475 -8.868 -10.541 1.00 0.00 H new ATOM 0 HG SER A 61 6.947 -10.604 -10.977 1.00 0.00 H new ATOM 975 N SER A 62 7.313 -7.708 -13.532 1.00 0.00 N ATOM 976 CA SER A 62 6.954 -7.769 -14.945 1.00 0.00 C ATOM 977 C SER A 62 5.906 -8.861 -15.200 1.00 0.00 C ATOM 978 O SER A 62 5.259 -8.869 -16.248 1.00 0.00 O ATOM 979 CB SER A 62 8.182 -8.025 -15.794 1.00 0.00 C ATOM 980 OG SER A 62 8.693 -9.310 -15.568 1.00 0.00 O ATOM 0 H SER A 62 8.277 -7.963 -13.318 1.00 0.00 H new ATOM 0 HA SER A 62 6.525 -6.806 -15.222 1.00 0.00 H new ATOM 0 HB2 SER A 62 7.929 -7.911 -16.848 1.00 0.00 H new ATOM 0 HB3 SER A 62 8.946 -7.281 -15.567 1.00 0.00 H new ATOM 0 HG SER A 62 9.484 -9.451 -16.129 1.00 0.00 H new ATOM 986 N ARG A 63 5.756 -9.790 -14.251 1.00 0.00 N ATOM 987 CA ARG A 63 4.744 -10.829 -14.300 1.00 0.00 C ATOM 988 C ARG A 63 3.423 -10.464 -13.607 1.00 0.00 C ATOM 989 O ARG A 63 2.518 -11.295 -13.634 1.00 0.00 O ATOM 990 CB ARG A 63 5.290 -12.098 -13.665 1.00 0.00 C ATOM 991 CG ARG A 63 6.382 -12.832 -14.428 1.00 0.00 C ATOM 992 CD ARG A 63 6.661 -14.123 -13.751 1.00 0.00 C ATOM 993 NE ARG A 63 7.306 -13.880 -12.473 1.00 0.00 N ATOM 994 CZ ARG A 63 8.633 -13.847 -12.262 1.00 0.00 C ATOM 995 NH1 ARG A 63 9.489 -14.096 -13.229 1.00 0.00 N ATOM 996 NH2 ARG A 63 9.041 -13.552 -11.043 1.00 0.00 N ATOM 0 H ARG A 63 6.346 -9.835 -13.420 1.00 0.00 H new ATOM 0 HA ARG A 63 4.514 -10.968 -15.356 1.00 0.00 H new ATOM 0 HB2 ARG A 63 5.677 -11.845 -12.678 1.00 0.00 H new ATOM 0 HB3 ARG A 63 4.459 -12.787 -13.514 1.00 0.00 H new ATOM 0 HG2 ARG A 63 6.069 -13.007 -15.458 1.00 0.00 H new ATOM 0 HG3 ARG A 63 7.286 -12.225 -14.468 1.00 0.00 H new ATOM 0 HD2 ARG A 63 5.732 -14.673 -13.601 1.00 0.00 H new ATOM 0 HD3 ARG A 63 7.301 -14.743 -14.379 1.00 0.00 H new ATOM 0 HE ARG A 63 6.701 -13.721 -11.667 1.00 0.00 H new ATOM 0 HH11 ARG A 63 9.150 -14.320 -14.165 1.00 0.00 H new ATOM 0 HH12 ARG A 63 10.491 -14.065 -13.043 1.00 0.00 H new ATOM 0 HH21 ARG A 63 8.359 -13.361 -10.309 1.00 0.00 H new ATOM 0 HH22 ARG A 63 10.039 -13.515 -10.834 1.00 0.00 H new ATOM 1010 N TYR A 64 3.298 -9.266 -13.010 1.00 0.00 N ATOM 1011 CA TYR A 64 2.080 -8.807 -12.328 1.00 0.00 C ATOM 1012 C TYR A 64 0.878 -8.970 -13.256 1.00 0.00 C ATOM 1013 O TYR A 64 0.947 -8.599 -14.426 1.00 0.00 O ATOM 1014 CB TYR A 64 2.223 -7.337 -11.886 1.00 0.00 C ATOM 1015 CG TYR A 64 1.028 -6.723 -11.175 1.00 0.00 C ATOM 1016 CD1 TYR A 64 0.843 -6.918 -9.812 1.00 0.00 C ATOM 1017 CD2 TYR A 64 0.104 -5.964 -11.882 1.00 0.00 C ATOM 1018 CE1 TYR A 64 -0.246 -6.357 -9.172 1.00 0.00 C ATOM 1019 CE2 TYR A 64 -0.987 -5.410 -11.230 1.00 0.00 C ATOM 1020 CZ TYR A 64 -1.174 -5.597 -9.878 1.00 0.00 C ATOM 1021 OH TYR A 64 -2.254 -5.050 -9.206 1.00 0.00 O ATOM 0 H TYR A 64 4.053 -8.581 -12.989 1.00 0.00 H new ATOM 0 HA TYR A 64 1.927 -9.414 -11.436 1.00 0.00 H new ATOM 0 HB2 TYR A 64 3.088 -7.262 -11.227 1.00 0.00 H new ATOM 0 HB3 TYR A 64 2.441 -6.735 -12.768 1.00 0.00 H new ATOM 0 HD1 TYR A 64 1.552 -7.509 -9.251 1.00 0.00 H new ATOM 0 HD2 TYR A 64 0.236 -5.805 -12.942 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -0.378 -6.510 -8.111 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -1.700 -4.824 -11.790 1.00 0.00 H new ATOM 0 HH TYR A 64 -2.862 -4.631 -9.850 1.00 0.00 H new ATOM 1031 N PRO A 65 -0.247 -9.490 -12.767 1.00 0.00 N ATOM 1032 CA PRO A 65 -0.585 -9.902 -11.418 1.00 0.00 C ATOM 1033 C PRO A 65 -0.256 -11.319 -10.964 1.00 0.00 C ATOM 1034 O PRO A 65 -0.963 -11.862 -10.121 1.00 0.00 O ATOM 1035 CB PRO A 65 -2.099 -9.684 -11.471 1.00 0.00 C ATOM 1036 CG PRO A 65 -2.473 -10.027 -12.884 1.00 0.00 C ATOM 1037 CD PRO A 65 -1.339 -9.501 -13.738 1.00 0.00 C ATOM 0 HA PRO A 65 0.007 -9.351 -10.688 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -2.618 -10.322 -10.756 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -2.362 -8.654 -11.229 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -2.592 -11.103 -13.009 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -3.421 -9.567 -13.162 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -1.128 -10.148 -14.589 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -1.548 -8.508 -14.136 1.00 0.00 H new ATOM 1045 N PHE A 66 0.746 -11.959 -11.544 1.00 0.00 N ATOM 1046 CA PHE A 66 1.185 -13.255 -11.042 1.00 0.00 C ATOM 1047 C PHE A 66 1.848 -13.051 -9.675 1.00 0.00 C ATOM 1048 O PHE A 66 1.521 -13.728 -8.699 1.00 0.00 O ATOM 1049 CB PHE A 66 2.148 -13.906 -12.033 1.00 0.00 C ATOM 1050 CG PHE A 66 2.702 -15.239 -11.634 1.00 0.00 C ATOM 1051 CD1 PHE A 66 1.929 -16.388 -11.710 1.00 0.00 C ATOM 1052 CD2 PHE A 66 4.008 -15.346 -11.189 1.00 0.00 C ATOM 1053 CE1 PHE A 66 2.455 -17.615 -11.346 1.00 0.00 C ATOM 1054 CE2 PHE A 66 4.538 -16.567 -10.825 1.00 0.00 C ATOM 1055 CZ PHE A 66 3.758 -17.704 -10.903 1.00 0.00 C ATOM 0 H PHE A 66 1.265 -11.611 -12.350 1.00 0.00 H new ATOM 0 HA PHE A 66 0.331 -13.923 -10.928 1.00 0.00 H new ATOM 0 HB2 PHE A 66 1.633 -14.020 -12.987 1.00 0.00 H new ATOM 0 HB3 PHE A 66 2.982 -13.224 -12.200 1.00 0.00 H new ATOM 0 HD1 PHE A 66 0.908 -16.325 -12.056 1.00 0.00 H new ATOM 0 HD2 PHE A 66 4.622 -14.460 -11.126 1.00 0.00 H new ATOM 0 HE1 PHE A 66 1.845 -18.504 -11.409 1.00 0.00 H new ATOM 0 HE2 PHE A 66 5.559 -16.633 -10.480 1.00 0.00 H new ATOM 0 HZ PHE A 66 4.168 -18.662 -10.617 1.00 0.00 H new ATOM 1065 N ASP A 67 2.802 -12.121 -9.636 1.00 0.00 N ATOM 1066 CA ASP A 67 3.547 -11.752 -8.435 1.00 0.00 C ATOM 1067 C ASP A 67 2.988 -10.527 -7.721 1.00 0.00 C ATOM 1068 O ASP A 67 2.402 -9.655 -8.364 1.00 0.00 O ATOM 1069 CB ASP A 67 4.989 -11.424 -8.798 1.00 0.00 C ATOM 1070 CG ASP A 67 5.836 -12.577 -9.294 1.00 0.00 C ATOM 1071 OD1 ASP A 67 5.688 -13.681 -8.829 1.00 0.00 O ATOM 1072 OD2 ASP A 67 6.639 -12.328 -10.164 1.00 0.00 O ATOM 0 H ASP A 67 3.084 -11.591 -10.460 1.00 0.00 H new ATOM 0 HA ASP A 67 3.468 -12.612 -7.770 1.00 0.00 H new ATOM 0 HB2 ASP A 67 4.981 -10.651 -9.566 1.00 0.00 H new ATOM 0 HB3 ASP A 67 5.474 -10.996 -7.920 1.00 0.00 H new ATOM 1077 N SER A 68 3.172 -10.454 -6.401 1.00 0.00 N ATOM 1078 CA SER A 68 2.742 -9.265 -5.674 1.00 0.00 C ATOM 1079 C SER A 68 3.795 -8.174 -5.861 1.00 0.00 C ATOM 1080 O SER A 68 4.953 -8.499 -6.123 1.00 0.00 O ATOM 1081 CB SER A 68 2.577 -9.546 -4.186 1.00 0.00 C ATOM 1082 OG SER A 68 3.789 -9.798 -3.530 1.00 0.00 O ATOM 0 H SER A 68 3.603 -11.182 -5.831 1.00 0.00 H new ATOM 0 HA SER A 68 1.775 -8.950 -6.067 1.00 0.00 H new ATOM 0 HB2 SER A 68 2.088 -8.694 -3.715 1.00 0.00 H new ATOM 0 HB3 SER A 68 1.917 -10.404 -4.057 1.00 0.00 H new ATOM 0 HG SER A 68 3.630 -9.874 -2.566 1.00 0.00 H new ATOM 1088 N PRO A 69 3.440 -6.893 -5.739 1.00 0.00 N ATOM 1089 CA PRO A 69 4.365 -5.781 -5.800 1.00 0.00 C ATOM 1090 C PRO A 69 5.153 -5.546 -4.526 1.00 0.00 C ATOM 1091 O PRO A 69 4.695 -5.906 -3.441 1.00 0.00 O ATOM 1092 CB PRO A 69 3.414 -4.628 -6.090 1.00 0.00 C ATOM 1093 CG PRO A 69 2.099 -5.047 -5.490 1.00 0.00 C ATOM 1094 CD PRO A 69 2.012 -6.544 -5.724 1.00 0.00 C ATOM 0 HA PRO A 69 5.155 -5.934 -6.535 1.00 0.00 H new ATOM 0 HB2 PRO A 69 3.772 -3.699 -5.646 1.00 0.00 H new ATOM 0 HB3 PRO A 69 3.321 -4.453 -7.162 1.00 0.00 H new ATOM 0 HG2 PRO A 69 2.059 -4.812 -4.426 1.00 0.00 H new ATOM 0 HG3 PRO A 69 1.267 -4.526 -5.963 1.00 0.00 H new ATOM 0 HD2 PRO A 69 1.468 -7.057 -4.931 1.00 0.00 H new ATOM 0 HD3 PRO A 69 1.515 -6.789 -6.662 1.00 0.00 H new ATOM 1102 N GLN A 70 6.334 -4.947 -4.644 1.00 0.00 N ATOM 1103 CA GLN A 70 7.038 -4.614 -3.415 1.00 0.00 C ATOM 1104 C GLN A 70 6.368 -3.324 -2.981 1.00 0.00 C ATOM 1105 O GLN A 70 6.228 -2.407 -3.788 1.00 0.00 O ATOM 1106 CB GLN A 70 8.554 -4.450 -3.575 1.00 0.00 C ATOM 1107 CG GLN A 70 9.255 -4.216 -2.242 1.00 0.00 C ATOM 1108 CD GLN A 70 10.776 -4.164 -2.307 1.00 0.00 C ATOM 1109 OE1 GLN A 70 11.403 -3.320 -2.959 1.00 0.00 O ATOM 1110 NE2 GLN A 70 11.396 -5.105 -1.604 1.00 0.00 N ATOM 0 H GLN A 70 6.798 -4.696 -5.517 1.00 0.00 H new ATOM 0 HA GLN A 70 6.968 -5.418 -2.683 1.00 0.00 H new ATOM 0 HB2 GLN A 70 8.966 -5.342 -4.048 1.00 0.00 H new ATOM 0 HB3 GLN A 70 8.758 -3.613 -4.242 1.00 0.00 H new ATOM 0 HG2 GLN A 70 8.894 -3.278 -1.820 1.00 0.00 H new ATOM 0 HG3 GLN A 70 8.964 -5.009 -1.553 1.00 0.00 H new ATOM 0 HE21 GLN A 70 10.853 -5.788 -1.076 1.00 0.00 H new ATOM 0 HE22 GLN A 70 12.415 -5.145 -1.592 1.00 0.00 H new ATOM 1119 N VAL A 71 5.901 -3.241 -1.739 1.00 0.00 N ATOM 1120 CA VAL A 71 5.232 -2.006 -1.341 1.00 0.00 C ATOM 1121 C VAL A 71 5.971 -1.434 -0.142 1.00 0.00 C ATOM 1122 O VAL A 71 5.932 -2.019 0.941 1.00 0.00 O ATOM 1123 CB VAL A 71 3.754 -2.260 -0.977 1.00 0.00 C ATOM 1124 CG1 VAL A 71 3.086 -0.937 -0.626 1.00 0.00 C ATOM 1125 CG2 VAL A 71 3.061 -2.981 -2.116 1.00 0.00 C ATOM 0 H VAL A 71 5.966 -3.968 -1.026 1.00 0.00 H new ATOM 0 HA VAL A 71 5.247 -1.303 -2.174 1.00 0.00 H new ATOM 0 HB VAL A 71 3.682 -2.905 -0.101 1.00 0.00 H new ATOM 0 HG11 VAL A 71 2.042 -1.114 -0.368 1.00 0.00 H new ATOM 0 HG12 VAL A 71 3.598 -0.485 0.224 1.00 0.00 H new ATOM 0 HG13 VAL A 71 3.140 -0.264 -1.482 1.00 0.00 H new ATOM 0 HG21 VAL A 71 2.018 -3.158 -1.854 1.00 0.00 H new ATOM 0 HG22 VAL A 71 3.110 -2.370 -3.017 1.00 0.00 H new ATOM 0 HG23 VAL A 71 3.556 -3.935 -2.298 1.00 0.00 H new ATOM 1135 N MET A 72 6.655 -0.309 -0.335 1.00 0.00 N ATOM 1136 CA MET A 72 7.413 0.298 0.760 1.00 0.00 C ATOM 1137 C MET A 72 7.288 1.813 0.812 1.00 0.00 C ATOM 1138 O MET A 72 7.119 2.457 -0.217 1.00 0.00 O ATOM 1139 CB MET A 72 8.898 -0.065 0.632 1.00 0.00 C ATOM 1140 CG MET A 72 9.248 -1.544 0.758 1.00 0.00 C ATOM 1141 SD MET A 72 11.017 -1.862 0.567 1.00 0.00 S ATOM 1142 CE MET A 72 11.748 -1.214 2.065 1.00 0.00 C ATOM 0 H MET A 72 6.702 0.194 -1.221 1.00 0.00 H new ATOM 0 HA MET A 72 6.988 -0.100 1.681 1.00 0.00 H new ATOM 0 HB2 MET A 72 9.254 0.289 -0.335 1.00 0.00 H new ATOM 0 HB3 MET A 72 9.451 0.483 1.395 1.00 0.00 H new ATOM 0 HG2 MET A 72 8.921 -1.909 1.732 1.00 0.00 H new ATOM 0 HG3 MET A 72 8.698 -2.109 0.005 1.00 0.00 H new ATOM 0 HE1 MET A 72 12.833 -1.299 2.007 1.00 0.00 H new ATOM 0 HE2 MET A 72 11.472 -0.166 2.181 1.00 0.00 H new ATOM 0 HE3 MET A 72 11.385 -1.781 2.922 1.00 0.00 H new ATOM 1152 N PHE A 73 7.421 2.389 2.003 1.00 0.00 N ATOM 1153 CA PHE A 73 7.379 3.838 2.155 1.00 0.00 C ATOM 1154 C PHE A 73 8.688 4.403 1.629 1.00 0.00 C ATOM 1155 O PHE A 73 9.740 3.775 1.750 1.00 0.00 O ATOM 1156 CB PHE A 73 7.074 4.310 3.583 1.00 0.00 C ATOM 1157 CG PHE A 73 5.643 4.154 4.015 1.00 0.00 C ATOM 1158 CD1 PHE A 73 4.702 5.114 3.667 1.00 0.00 C ATOM 1159 CD2 PHE A 73 5.223 3.072 4.767 1.00 0.00 C ATOM 1160 CE1 PHE A 73 3.379 4.998 4.046 1.00 0.00 C ATOM 1161 CE2 PHE A 73 3.896 2.952 5.149 1.00 0.00 C ATOM 1162 CZ PHE A 73 2.973 3.910 4.789 1.00 0.00 C ATOM 0 H PHE A 73 7.558 1.876 2.874 1.00 0.00 H new ATOM 0 HA PHE A 73 6.540 4.220 1.573 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.708 3.756 4.275 1.00 0.00 H new ATOM 0 HB3 PHE A 73 7.350 5.361 3.668 1.00 0.00 H new ATOM 0 HD1 PHE A 73 5.012 5.971 3.087 1.00 0.00 H new ATOM 0 HD2 PHE A 73 5.935 2.314 5.059 1.00 0.00 H new ATOM 0 HE1 PHE A 73 2.665 5.757 3.761 1.00 0.00 H new ATOM 0 HE2 PHE A 73 3.583 2.100 5.734 1.00 0.00 H new ATOM 0 HZ PHE A 73 1.940 3.809 5.087 1.00 0.00 H new ATOM 1172 N THR A 74 8.626 5.589 1.040 1.00 0.00 N ATOM 1173 CA THR A 74 9.822 6.191 0.462 1.00 0.00 C ATOM 1174 C THR A 74 9.870 7.705 0.608 1.00 0.00 C ATOM 1175 O THR A 74 8.849 8.391 0.602 1.00 0.00 O ATOM 1176 CB THR A 74 9.917 5.827 -1.034 1.00 0.00 C ATOM 1177 OG1 THR A 74 11.143 6.332 -1.581 1.00 0.00 O ATOM 1178 CG2 THR A 74 8.741 6.420 -1.799 1.00 0.00 C ATOM 0 H THR A 74 7.777 6.146 0.950 1.00 0.00 H new ATOM 0 HA THR A 74 10.668 5.788 1.018 1.00 0.00 H new ATOM 0 HB THR A 74 9.894 4.741 -1.130 1.00 0.00 H new ATOM 0 HG1 THR A 74 11.199 6.097 -2.531 1.00 0.00 H new ATOM 0 HG21 THR A 74 8.822 6.155 -2.853 1.00 0.00 H new ATOM 0 HG22 THR A 74 7.808 6.025 -1.396 1.00 0.00 H new ATOM 0 HG23 THR A 74 8.750 7.505 -1.696 1.00 0.00 H new ATOM 1186 N GLY A 75 11.086 8.225 0.718 1.00 0.00 N ATOM 1187 CA GLY A 75 11.281 9.656 0.895 1.00 0.00 C ATOM 1188 C GLY A 75 11.930 9.950 2.240 1.00 0.00 C ATOM 1189 O GLY A 75 12.454 9.054 2.902 1.00 0.00 O ATOM 0 H GLY A 75 11.947 7.679 0.688 1.00 0.00 H new ATOM 0 HA2 GLY A 75 11.907 10.045 0.091 1.00 0.00 H new ATOM 0 HA3 GLY A 75 10.322 10.169 0.829 1.00 0.00 H new ATOM 1193 N GLU A 76 11.889 11.220 2.632 1.00 0.00 N ATOM 1194 CA GLU A 76 12.481 11.694 3.878 1.00 0.00 C ATOM 1195 C GLU A 76 11.584 11.559 5.109 1.00 0.00 C ATOM 1196 O GLU A 76 12.033 11.826 6.224 1.00 0.00 O ATOM 1197 CB GLU A 76 12.879 13.162 3.724 1.00 0.00 C ATOM 1198 CG GLU A 76 13.986 13.412 2.710 1.00 0.00 C ATOM 1199 CD GLU A 76 14.330 14.868 2.565 1.00 0.00 C ATOM 1200 OE1 GLU A 76 13.682 15.677 3.185 1.00 0.00 O ATOM 1201 OE2 GLU A 76 15.243 15.172 1.834 1.00 0.00 O ATOM 0 H GLU A 76 11.439 11.956 2.088 1.00 0.00 H new ATOM 0 HA GLU A 76 13.343 11.050 4.054 1.00 0.00 H new ATOM 0 HB2 GLU A 76 11.999 13.735 3.431 1.00 0.00 H new ATOM 0 HB3 GLU A 76 13.199 13.542 4.694 1.00 0.00 H new ATOM 0 HG2 GLU A 76 14.878 12.862 3.010 1.00 0.00 H new ATOM 0 HG3 GLU A 76 13.680 13.018 1.741 1.00 0.00 H new ATOM 1208 N ASN A 77 10.329 11.158 4.924 1.00 0.00 N ATOM 1209 CA ASN A 77 9.422 11.037 6.056 1.00 0.00 C ATOM 1210 C ASN A 77 8.711 9.689 6.037 1.00 0.00 C ATOM 1211 O ASN A 77 7.716 9.501 5.337 1.00 0.00 O ATOM 1212 CB ASN A 77 8.431 12.185 6.048 1.00 0.00 C ATOM 1213 CG ASN A 77 7.546 12.208 7.260 1.00 0.00 C ATOM 1214 OD1 ASN A 77 7.682 11.367 8.156 1.00 0.00 O ATOM 1215 ND2 ASN A 77 6.643 13.154 7.305 1.00 0.00 N ATOM 0 H ASN A 77 9.925 10.916 4.019 1.00 0.00 H new ATOM 0 HA ASN A 77 9.999 11.088 6.979 1.00 0.00 H new ATOM 0 HB2 ASN A 77 8.976 13.127 5.986 1.00 0.00 H new ATOM 0 HB3 ASN A 77 7.811 12.116 5.154 1.00 0.00 H new ATOM 0 HD21 ASN A 77 6.013 13.220 8.104 1.00 0.00 H new ATOM 0 HD22 ASN A 77 6.569 13.825 6.541 1.00 0.00 H new ATOM 1222 N ILE A 78 9.255 8.754 6.808 1.00 0.00 N ATOM 1223 CA ILE A 78 8.733 7.399 6.931 1.00 0.00 C ATOM 1224 C ILE A 78 7.911 7.323 8.223 1.00 0.00 C ATOM 1225 O ILE A 78 8.430 7.714 9.270 1.00 0.00 O ATOM 1226 CB ILE A 78 9.888 6.374 6.958 1.00 0.00 C ATOM 1227 CG1 ILE A 78 10.776 6.569 5.722 1.00 0.00 C ATOM 1228 CG2 ILE A 78 9.358 4.949 7.004 1.00 0.00 C ATOM 1229 CD1 ILE A 78 10.056 6.415 4.407 1.00 0.00 C ATOM 0 H ILE A 78 10.086 8.920 7.375 1.00 0.00 H new ATOM 0 HA ILE A 78 8.103 7.160 6.074 1.00 0.00 H new ATOM 0 HB ILE A 78 10.477 6.540 7.860 1.00 0.00 H new ATOM 0 HG12 ILE A 78 11.222 7.563 5.764 1.00 0.00 H new ATOM 0 HG13 ILE A 78 11.594 5.850 5.761 1.00 0.00 H new ATOM 0 HG21 ILE A 78 10.194 4.250 7.022 1.00 0.00 H new ATOM 0 HG22 ILE A 78 8.753 4.815 7.901 1.00 0.00 H new ATOM 0 HG23 ILE A 78 8.746 4.760 6.122 1.00 0.00 H new ATOM 0 HD11 ILE A 78 10.758 6.569 3.588 1.00 0.00 H new ATOM 0 HD12 ILE A 78 9.633 5.413 4.339 1.00 0.00 H new ATOM 0 HD13 ILE A 78 9.255 7.152 4.342 1.00 0.00 H new ATOM 1241 N PRO A 79 6.659 6.851 8.206 1.00 0.00 N ATOM 1242 CA PRO A 79 5.826 6.769 9.387 1.00 0.00 C ATOM 1243 C PRO A 79 6.237 5.721 10.410 1.00 0.00 C ATOM 1244 O PRO A 79 6.864 4.714 10.084 1.00 0.00 O ATOM 1245 CB PRO A 79 4.473 6.418 8.761 1.00 0.00 C ATOM 1246 CG PRO A 79 4.797 5.744 7.462 1.00 0.00 C ATOM 1247 CD PRO A 79 6.064 6.391 6.947 1.00 0.00 C ATOM 0 HA PRO A 79 5.866 7.686 9.975 1.00 0.00 H new ATOM 0 HB2 PRO A 79 3.898 5.760 9.412 1.00 0.00 H new ATOM 0 HB3 PRO A 79 3.871 7.312 8.600 1.00 0.00 H new ATOM 0 HG2 PRO A 79 4.939 4.673 7.606 1.00 0.00 H new ATOM 0 HG3 PRO A 79 3.982 5.865 6.748 1.00 0.00 H new ATOM 0 HD2 PRO A 79 6.705 5.685 6.419 1.00 0.00 H new ATOM 0 HD3 PRO A 79 5.861 7.212 6.260 1.00 0.00 H new ATOM 1255 N VAL A 80 5.863 5.984 11.658 1.00 0.00 N ATOM 1256 CA VAL A 80 6.124 5.081 12.770 1.00 0.00 C ATOM 1257 C VAL A 80 4.859 4.284 13.028 1.00 0.00 C ATOM 1258 O VAL A 80 3.802 4.865 13.265 1.00 0.00 O ATOM 1259 CB VAL A 80 6.548 5.842 14.038 1.00 0.00 C ATOM 1260 CG1 VAL A 80 6.756 4.857 15.179 1.00 0.00 C ATOM 1261 CG2 VAL A 80 7.826 6.617 13.754 1.00 0.00 C ATOM 0 H VAL A 80 5.368 6.834 11.926 1.00 0.00 H new ATOM 0 HA VAL A 80 6.951 4.420 12.511 1.00 0.00 H new ATOM 0 HB VAL A 80 5.768 6.546 14.328 1.00 0.00 H new ATOM 0 HG11 VAL A 80 7.056 5.398 16.076 1.00 0.00 H new ATOM 0 HG12 VAL A 80 5.826 4.322 15.372 1.00 0.00 H new ATOM 0 HG13 VAL A 80 7.535 4.144 14.907 1.00 0.00 H new ATOM 0 HG21 VAL A 80 8.130 7.158 14.650 1.00 0.00 H new ATOM 0 HG22 VAL A 80 8.615 5.923 13.463 1.00 0.00 H new ATOM 0 HG23 VAL A 80 7.650 7.326 12.945 1.00 0.00 H new ATOM 1271 N HIS A 81 4.991 2.967 12.993 1.00 0.00 N ATOM 1272 CA HIS A 81 3.888 2.027 13.134 1.00 0.00 C ATOM 1273 C HIS A 81 4.453 0.660 13.489 1.00 0.00 C ATOM 1274 O HIS A 81 5.546 0.349 13.031 1.00 0.00 O ATOM 1275 CB HIS A 81 3.096 1.965 11.820 1.00 0.00 C ATOM 1276 CG HIS A 81 1.869 1.111 11.825 1.00 0.00 C ATOM 1277 ND1 HIS A 81 1.916 -0.254 11.624 1.00 0.00 N ATOM 1278 CD2 HIS A 81 0.567 1.417 12.025 1.00 0.00 C ATOM 1279 CE1 HIS A 81 0.691 -0.745 11.685 1.00 0.00 C ATOM 1280 NE2 HIS A 81 -0.142 0.247 11.931 1.00 0.00 N ATOM 0 H HIS A 81 5.893 2.509 12.862 1.00 0.00 H new ATOM 0 HA HIS A 81 3.213 2.350 13.926 1.00 0.00 H new ATOM 0 HB2 HIS A 81 2.805 2.980 11.548 1.00 0.00 H new ATOM 0 HB3 HIS A 81 3.761 1.603 11.036 1.00 0.00 H new ATOM 0 HD2 HIS A 81 0.162 2.399 12.222 1.00 0.00 H new ATOM 0 HE1 HIS A 81 0.418 -1.782 11.555 1.00 0.00 H new ATOM 0 HE2 HIS A 81 -1.153 0.158 12.035 1.00 0.00 H new ATOM 1288 N PRO A 82 3.792 -0.188 14.286 1.00 0.00 N ATOM 1289 CA PRO A 82 4.285 -1.518 14.592 1.00 0.00 C ATOM 1290 C PRO A 82 4.712 -2.357 13.383 1.00 0.00 C ATOM 1291 O PRO A 82 5.605 -3.197 13.510 1.00 0.00 O ATOM 1292 CB PRO A 82 3.059 -2.100 15.301 1.00 0.00 C ATOM 1293 CG PRO A 82 2.422 -0.910 15.962 1.00 0.00 C ATOM 1294 CD PRO A 82 2.596 0.251 15.021 1.00 0.00 C ATOM 0 HA PRO A 82 5.210 -1.506 15.168 1.00 0.00 H new ATOM 0 HB2 PRO A 82 2.378 -2.576 14.595 1.00 0.00 H new ATOM 0 HB3 PRO A 82 3.343 -2.858 16.031 1.00 0.00 H new ATOM 0 HG2 PRO A 82 1.366 -1.095 16.157 1.00 0.00 H new ATOM 0 HG3 PRO A 82 2.892 -0.703 16.923 1.00 0.00 H new ATOM 0 HD2 PRO A 82 1.734 0.390 14.368 1.00 0.00 H new ATOM 0 HD3 PRO A 82 2.753 1.193 15.547 1.00 0.00 H new ATOM 1302 N HIS A 83 4.086 -2.153 12.225 1.00 0.00 N ATOM 1303 CA HIS A 83 4.452 -2.879 11.022 1.00 0.00 C ATOM 1304 C HIS A 83 5.198 -2.031 9.991 1.00 0.00 C ATOM 1305 O HIS A 83 5.368 -2.447 8.846 1.00 0.00 O ATOM 1306 CB HIS A 83 3.188 -3.464 10.417 1.00 0.00 C ATOM 1307 CG HIS A 83 2.574 -4.473 11.334 1.00 0.00 C ATOM 1308 ND1 HIS A 83 1.755 -4.122 12.386 1.00 0.00 N ATOM 1309 CD2 HIS A 83 2.666 -5.822 11.362 1.00 0.00 C ATOM 1310 CE1 HIS A 83 1.375 -5.214 13.025 1.00 0.00 C ATOM 1311 NE2 HIS A 83 1.912 -6.259 12.422 1.00 0.00 N ATOM 0 H HIS A 83 3.322 -1.489 12.100 1.00 0.00 H new ATOM 0 HA HIS A 83 5.152 -3.664 11.308 1.00 0.00 H new ATOM 0 HB2 HIS A 83 2.473 -2.666 10.217 1.00 0.00 H new ATOM 0 HB3 HIS A 83 3.421 -3.931 9.460 1.00 0.00 H new ATOM 0 HD2 HIS A 83 3.228 -6.440 10.678 1.00 0.00 H new ATOM 0 HE1 HIS A 83 0.734 -5.247 13.893 1.00 0.00 H new ATOM 0 HE2 HIS A 83 1.787 -7.233 12.699 1.00 0.00 H new ATOM 1319 N VAL A 84 5.660 -0.837 10.362 1.00 0.00 N ATOM 1320 CA VAL A 84 6.407 -0.029 9.404 1.00 0.00 C ATOM 1321 C VAL A 84 7.790 0.272 9.958 1.00 0.00 C ATOM 1322 O VAL A 84 7.955 0.810 11.053 1.00 0.00 O ATOM 1323 CB VAL A 84 5.697 1.286 9.028 1.00 0.00 C ATOM 1324 CG1 VAL A 84 6.581 2.073 8.065 1.00 0.00 C ATOM 1325 CG2 VAL A 84 4.361 0.975 8.364 1.00 0.00 C ATOM 0 H VAL A 84 5.536 -0.421 11.285 1.00 0.00 H new ATOM 0 HA VAL A 84 6.481 -0.615 8.488 1.00 0.00 H new ATOM 0 HB VAL A 84 5.519 1.877 9.926 1.00 0.00 H new ATOM 0 HG11 VAL A 84 6.085 3.005 7.795 1.00 0.00 H new ATOM 0 HG12 VAL A 84 7.534 2.295 8.545 1.00 0.00 H new ATOM 0 HG13 VAL A 84 6.757 1.482 7.166 1.00 0.00 H new ATOM 0 HG21 VAL A 84 3.861 1.907 8.099 1.00 0.00 H new ATOM 0 HG22 VAL A 84 4.531 0.385 7.463 1.00 0.00 H new ATOM 0 HG23 VAL A 84 3.734 0.410 9.054 1.00 0.00 H new ATOM 1335 N TYR A 85 8.789 -0.062 9.162 1.00 0.00 N ATOM 1336 CA TYR A 85 10.176 0.105 9.541 1.00 0.00 C ATOM 1337 C TYR A 85 10.700 1.417 9.001 1.00 0.00 C ATOM 1338 O TYR A 85 10.166 1.932 8.021 1.00 0.00 O ATOM 1339 CB TYR A 85 10.975 -1.077 9.020 1.00 0.00 C ATOM 1340 CG TYR A 85 10.553 -2.364 9.693 1.00 0.00 C ATOM 1341 CD1 TYR A 85 9.515 -3.116 9.161 1.00 0.00 C ATOM 1342 CD2 TYR A 85 11.195 -2.797 10.842 1.00 0.00 C ATOM 1343 CE1 TYR A 85 9.117 -4.288 9.766 1.00 0.00 C ATOM 1344 CE2 TYR A 85 10.800 -3.973 11.451 1.00 0.00 C ATOM 1345 CZ TYR A 85 9.767 -4.717 10.917 1.00 0.00 C ATOM 1346 OH TYR A 85 9.380 -5.888 11.526 1.00 0.00 O ATOM 0 H TYR A 85 8.658 -0.458 8.231 1.00 0.00 H new ATOM 0 HA TYR A 85 10.273 0.134 10.626 1.00 0.00 H new ATOM 0 HB2 TYR A 85 10.837 -1.165 7.942 1.00 0.00 H new ATOM 0 HB3 TYR A 85 12.037 -0.905 9.193 1.00 0.00 H new ATOM 0 HD1 TYR A 85 9.015 -2.780 8.265 1.00 0.00 H new ATOM 0 HD2 TYR A 85 12.003 -2.216 11.261 1.00 0.00 H new ATOM 0 HE1 TYR A 85 8.307 -4.868 9.349 1.00 0.00 H new ATOM 0 HE2 TYR A 85 11.300 -4.311 12.346 1.00 0.00 H new ATOM 0 HH TYR A 85 9.936 -6.044 12.318 1.00 0.00 H new ATOM 1356 N SER A 86 11.749 1.947 9.631 1.00 0.00 N ATOM 1357 CA SER A 86 12.339 3.236 9.265 1.00 0.00 C ATOM 1358 C SER A 86 12.948 3.264 7.866 1.00 0.00 C ATOM 1359 O SER A 86 13.182 4.338 7.312 1.00 0.00 O ATOM 1360 CB SER A 86 13.412 3.607 10.266 1.00 0.00 C ATOM 1361 OG SER A 86 14.504 2.732 10.173 1.00 0.00 O ATOM 0 H SER A 86 12.217 1.491 10.415 1.00 0.00 H new ATOM 0 HA SER A 86 11.519 3.954 9.271 1.00 0.00 H new ATOM 0 HB2 SER A 86 13.744 4.630 10.088 1.00 0.00 H new ATOM 0 HB3 SER A 86 13.001 3.576 11.275 1.00 0.00 H new ATOM 0 HG SER A 86 15.187 2.990 10.827 1.00 0.00 H new ATOM 1367 N ASN A 87 13.214 2.090 7.299 1.00 0.00 N ATOM 1368 CA ASN A 87 13.698 1.982 5.933 1.00 0.00 C ATOM 1369 C ASN A 87 12.554 1.888 4.920 1.00 0.00 C ATOM 1370 O ASN A 87 12.800 1.682 3.732 1.00 0.00 O ATOM 1371 CB ASN A 87 14.614 0.784 5.818 1.00 0.00 C ATOM 1372 CG ASN A 87 13.921 -0.529 6.052 1.00 0.00 C ATOM 1373 OD1 ASN A 87 12.690 -0.617 6.142 1.00 0.00 O ATOM 1374 ND2 ASN A 87 14.704 -1.573 6.160 1.00 0.00 N ATOM 0 H ASN A 87 13.100 1.194 7.773 1.00 0.00 H new ATOM 0 HA ASN A 87 14.252 2.891 5.697 1.00 0.00 H new ATOM 0 HB2 ASN A 87 15.064 0.776 4.825 1.00 0.00 H new ATOM 0 HB3 ASN A 87 15.427 0.889 6.536 1.00 0.00 H new ATOM 0 HD21 ASN A 87 14.303 -2.496 6.324 1.00 0.00 H new ATOM 0 HD22 ASN A 87 15.715 -1.463 6.080 1.00 0.00 H new ATOM 1381 N GLY A 88 11.310 2.034 5.381 1.00 0.00 N ATOM 1382 CA GLY A 88 10.138 1.995 4.526 1.00 0.00 C ATOM 1383 C GLY A 88 9.444 0.637 4.463 1.00 0.00 C ATOM 1384 O GLY A 88 8.362 0.529 3.887 1.00 0.00 O ATOM 0 H GLY A 88 11.094 2.183 6.367 1.00 0.00 H new ATOM 0 HA2 GLY A 88 9.423 2.738 4.878 1.00 0.00 H new ATOM 0 HA3 GLY A 88 10.430 2.286 3.517 1.00 0.00 H new ATOM 1388 N HIS A 89 10.029 -0.407 5.040 1.00 0.00 N ATOM 1389 CA HIS A 89 9.396 -1.716 4.926 1.00 0.00 C ATOM 1390 C HIS A 89 8.030 -1.799 5.590 1.00 0.00 C ATOM 1391 O HIS A 89 7.821 -1.337 6.710 1.00 0.00 O ATOM 1392 CB HIS A 89 10.324 -2.792 5.496 1.00 0.00 C ATOM 1393 CG HIS A 89 9.838 -4.190 5.302 1.00 0.00 C ATOM 1394 ND1 HIS A 89 8.862 -4.756 6.095 1.00 0.00 N ATOM 1395 CD2 HIS A 89 10.191 -5.136 4.403 1.00 0.00 C ATOM 1396 CE1 HIS A 89 8.638 -5.994 5.692 1.00 0.00 C ATOM 1397 NE2 HIS A 89 9.430 -6.248 4.667 1.00 0.00 N ATOM 0 H HIS A 89 10.901 -0.380 5.569 1.00 0.00 H new ATOM 0 HA HIS A 89 9.226 -1.884 3.863 1.00 0.00 H new ATOM 0 HB2 HIS A 89 11.304 -2.693 5.030 1.00 0.00 H new ATOM 0 HB3 HIS A 89 10.458 -2.611 6.563 1.00 0.00 H new ATOM 0 HD2 HIS A 89 10.932 -5.036 3.624 1.00 0.00 H new ATOM 0 HE1 HIS A 89 7.928 -6.681 6.127 1.00 0.00 H new ATOM 0 HE2 HIS A 89 9.470 -7.129 4.154 1.00 0.00 H new ATOM 1405 N ILE A 90 7.084 -2.398 4.870 1.00 0.00 N ATOM 1406 CA ILE A 90 5.723 -2.574 5.365 1.00 0.00 C ATOM 1407 C ILE A 90 5.453 -4.059 5.580 1.00 0.00 C ATOM 1408 O ILE A 90 5.413 -4.835 4.625 1.00 0.00 O ATOM 1409 CB ILE A 90 4.685 -2.000 4.376 1.00 0.00 C ATOM 1410 CG1 ILE A 90 4.944 -0.506 4.154 1.00 0.00 C ATOM 1411 CG2 ILE A 90 3.272 -2.231 4.905 1.00 0.00 C ATOM 1412 CD1 ILE A 90 4.108 0.078 3.042 1.00 0.00 C ATOM 0 H ILE A 90 7.239 -2.772 3.934 1.00 0.00 H new ATOM 0 HA ILE A 90 5.629 -2.033 6.307 1.00 0.00 H new ATOM 0 HB ILE A 90 4.781 -2.513 3.419 1.00 0.00 H new ATOM 0 HG12 ILE A 90 4.738 0.034 5.078 1.00 0.00 H new ATOM 0 HG13 ILE A 90 5.999 -0.356 3.925 1.00 0.00 H new ATOM 0 HG21 ILE A 90 2.548 -1.822 4.200 1.00 0.00 H new ATOM 0 HG22 ILE A 90 3.098 -3.300 5.024 1.00 0.00 H new ATOM 0 HG23 ILE A 90 3.159 -1.735 5.869 1.00 0.00 H new ATOM 0 HD11 ILE A 90 4.336 1.138 2.933 1.00 0.00 H new ATOM 0 HD12 ILE A 90 4.332 -0.439 2.109 1.00 0.00 H new ATOM 0 HD13 ILE A 90 3.051 -0.043 3.279 1.00 0.00 H new ATOM 1424 N CYS A 91 5.265 -4.455 6.834 1.00 0.00 N ATOM 1425 CA CYS A 91 5.007 -5.847 7.160 1.00 0.00 C ATOM 1426 C CYS A 91 3.523 -6.153 7.052 1.00 0.00 C ATOM 1427 O CYS A 91 2.732 -5.760 7.908 1.00 0.00 O ATOM 1428 CB CYS A 91 5.507 -6.173 8.564 1.00 0.00 C ATOM 1429 SG CYS A 91 5.257 -7.898 9.044 1.00 0.00 S ATOM 0 H CYS A 91 5.287 -3.829 7.639 1.00 0.00 H new ATOM 0 HA CYS A 91 5.547 -6.468 6.445 1.00 0.00 H new ATOM 0 HB2 CYS A 91 6.570 -5.939 8.625 1.00 0.00 H new ATOM 0 HB3 CYS A 91 4.997 -5.529 9.280 1.00 0.00 H new ATOM 0 HG CYS A 91 5.712 -8.084 10.247 1.00 0.00 H new ATOM 1435 N LEU A 92 3.151 -6.866 5.998 1.00 0.00 N ATOM 1436 CA LEU A 92 1.754 -7.208 5.784 1.00 0.00 C ATOM 1437 C LEU A 92 1.580 -8.519 5.031 1.00 0.00 C ATOM 1438 O LEU A 92 2.003 -8.643 3.881 1.00 0.00 O ATOM 1439 CB LEU A 92 1.069 -6.056 5.042 1.00 0.00 C ATOM 1440 CG LEU A 92 -0.397 -6.298 4.696 1.00 0.00 C ATOM 1441 CD1 LEU A 92 -1.190 -6.477 5.983 1.00 0.00 C ATOM 1442 CD2 LEU A 92 -0.928 -5.116 3.890 1.00 0.00 C ATOM 0 H LEU A 92 3.791 -7.215 5.285 1.00 0.00 H new ATOM 0 HA LEU A 92 1.287 -7.355 6.758 1.00 0.00 H new ATOM 0 HB2 LEU A 92 1.139 -5.156 5.653 1.00 0.00 H new ATOM 0 HB3 LEU A 92 1.617 -5.859 4.121 1.00 0.00 H new ATOM 0 HG LEU A 92 -0.499 -7.201 4.094 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -2.239 -6.650 5.743 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -0.798 -7.331 6.536 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -1.101 -5.578 6.593 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -1.976 -5.286 3.641 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.839 -4.204 4.480 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -0.349 -5.012 2.972 1.00 0.00 H new ATOM 1454 N SER A 93 0.907 -9.476 5.683 1.00 0.00 N ATOM 1455 CA SER A 93 0.684 -10.820 5.143 1.00 0.00 C ATOM 1456 C SER A 93 -0.121 -10.837 3.855 1.00 0.00 C ATOM 1457 O SER A 93 0.085 -11.713 3.015 1.00 0.00 O ATOM 1458 CB SER A 93 -0.053 -11.671 6.152 1.00 0.00 C ATOM 1459 OG SER A 93 -1.352 -11.182 6.341 1.00 0.00 O ATOM 0 H SER A 93 0.499 -9.336 6.608 1.00 0.00 H new ATOM 0 HA SER A 93 1.677 -11.214 4.927 1.00 0.00 H new ATOM 0 HB2 SER A 93 -0.092 -12.704 5.807 1.00 0.00 H new ATOM 0 HB3 SER A 93 0.485 -11.671 7.100 1.00 0.00 H new ATOM 0 HG SER A 93 -1.820 -11.742 6.995 1.00 0.00 H new ATOM 1465 N ILE A 94 -0.966 -9.824 3.679 1.00 0.00 N ATOM 1466 CA ILE A 94 -1.783 -9.607 2.493 1.00 0.00 C ATOM 1467 C ILE A 94 -0.919 -9.485 1.254 1.00 0.00 C ATOM 1468 O ILE A 94 -1.359 -9.848 0.171 1.00 0.00 O ATOM 1469 CB ILE A 94 -2.671 -8.356 2.589 1.00 0.00 C ATOM 1470 CG1 ILE A 94 -3.757 -8.547 3.648 1.00 0.00 C ATOM 1471 CG2 ILE A 94 -3.287 -8.079 1.235 1.00 0.00 C ATOM 1472 CD1 ILE A 94 -4.506 -7.273 3.972 1.00 0.00 C ATOM 0 H ILE A 94 -1.104 -9.104 4.389 1.00 0.00 H new ATOM 0 HA ILE A 94 -2.431 -10.480 2.424 1.00 0.00 H new ATOM 0 HB ILE A 94 -2.062 -7.503 2.888 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -4.466 -9.299 3.301 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -3.302 -8.935 4.559 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -3.918 -7.192 1.297 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -2.497 -7.911 0.503 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -3.890 -8.933 0.928 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -5.262 -7.478 4.730 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -3.807 -6.526 4.349 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -4.989 -6.896 3.071 1.00 0.00 H new ATOM 1484 N LEU A 95 0.277 -8.920 1.386 1.00 0.00 N ATOM 1485 CA LEU A 95 1.177 -8.721 0.262 1.00 0.00 C ATOM 1486 C LEU A 95 2.083 -9.924 -0.026 1.00 0.00 C ATOM 1487 O LEU A 95 2.836 -9.922 -1.006 1.00 0.00 O ATOM 1488 CB LEU A 95 2.005 -7.472 0.556 1.00 0.00 C ATOM 1489 CG LEU A 95 1.141 -6.213 0.664 1.00 0.00 C ATOM 1490 CD1 LEU A 95 1.995 -5.018 1.065 1.00 0.00 C ATOM 1491 CD2 LEU A 95 0.460 -5.998 -0.677 1.00 0.00 C ATOM 0 H LEU A 95 0.647 -8.588 2.277 1.00 0.00 H new ATOM 0 HA LEU A 95 0.580 -8.601 -0.642 1.00 0.00 H new ATOM 0 HB2 LEU A 95 2.554 -7.614 1.487 1.00 0.00 H new ATOM 0 HB3 LEU A 95 2.745 -7.335 -0.233 1.00 0.00 H new ATOM 0 HG LEU A 95 0.382 -6.330 1.437 1.00 0.00 H new ATOM 0 HD11 LEU A 95 1.367 -4.130 1.138 1.00 0.00 H new ATOM 0 HD12 LEU A 95 2.462 -5.212 2.030 1.00 0.00 H new ATOM 0 HD13 LEU A 95 2.768 -4.855 0.314 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -0.164 -5.105 -0.629 1.00 0.00 H new ATOM 0 HD22 LEU A 95 1.215 -5.872 -1.453 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -0.161 -6.862 -0.913 1.00 0.00 H new ATOM 1503 N THR A 96 2.017 -10.959 0.816 1.00 0.00 N ATOM 1504 CA THR A 96 2.852 -12.137 0.642 1.00 0.00 C ATOM 1505 C THR A 96 1.964 -13.366 0.498 1.00 0.00 C ATOM 1506 O THR A 96 1.365 -13.601 -0.551 1.00 0.00 O ATOM 1507 CB THR A 96 3.812 -12.352 1.828 1.00 0.00 C ATOM 1508 OG1 THR A 96 3.051 -12.482 3.033 1.00 0.00 O ATOM 1509 CG2 THR A 96 4.748 -11.162 1.974 1.00 0.00 C ATOM 0 H THR A 96 1.393 -10.999 1.622 1.00 0.00 H new ATOM 0 HA THR A 96 3.454 -11.983 -0.254 1.00 0.00 H new ATOM 0 HB THR A 96 4.397 -13.253 1.645 1.00 0.00 H new ATOM 0 HG1 THR A 96 3.472 -13.148 3.615 1.00 0.00 H new ATOM 0 HG21 THR A 96 5.420 -11.329 2.816 1.00 0.00 H new ATOM 0 HG22 THR A 96 5.332 -11.044 1.061 1.00 0.00 H new ATOM 0 HG23 THR A 96 4.164 -10.259 2.150 1.00 0.00 H new ATOM 1517 N GLU A 97 1.847 -14.121 1.589 1.00 0.00 N ATOM 1518 CA GLU A 97 1.114 -15.382 1.621 1.00 0.00 C ATOM 1519 C GLU A 97 -0.373 -15.275 1.314 1.00 0.00 C ATOM 1520 O GLU A 97 -0.949 -16.206 0.749 1.00 0.00 O ATOM 1521 CB GLU A 97 1.278 -16.023 2.999 1.00 0.00 C ATOM 1522 CG GLU A 97 2.685 -16.522 3.292 1.00 0.00 C ATOM 1523 CD GLU A 97 2.827 -17.113 4.667 1.00 0.00 C ATOM 1524 OE1 GLU A 97 1.896 -17.032 5.433 1.00 0.00 O ATOM 1525 OE2 GLU A 97 3.871 -17.651 4.952 1.00 0.00 O ATOM 0 H GLU A 97 2.264 -13.870 2.485 1.00 0.00 H new ATOM 0 HA GLU A 97 1.546 -15.988 0.824 1.00 0.00 H new ATOM 0 HB2 GLU A 97 0.996 -15.296 3.761 1.00 0.00 H new ATOM 0 HB3 GLU A 97 0.583 -16.859 3.083 1.00 0.00 H new ATOM 0 HG2 GLU A 97 2.960 -17.272 2.551 1.00 0.00 H new ATOM 0 HG3 GLU A 97 3.387 -15.695 3.184 1.00 0.00 H new ATOM 1532 N ASP A 98 -0.998 -14.161 1.677 1.00 0.00 N ATOM 1533 CA ASP A 98 -2.413 -13.974 1.416 1.00 0.00 C ATOM 1534 C ASP A 98 -2.678 -13.128 0.169 1.00 0.00 C ATOM 1535 O ASP A 98 -3.822 -12.734 -0.066 1.00 0.00 O ATOM 1536 CB ASP A 98 -3.079 -13.345 2.641 1.00 0.00 C ATOM 1537 CG ASP A 98 -3.087 -14.278 3.846 1.00 0.00 C ATOM 1538 OD1 ASP A 98 -3.177 -15.468 3.652 1.00 0.00 O ATOM 1539 OD2 ASP A 98 -3.003 -13.795 4.950 1.00 0.00 O ATOM 0 H ASP A 98 -0.546 -13.379 2.151 1.00 0.00 H new ATOM 0 HA ASP A 98 -2.844 -14.956 1.221 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -2.556 -12.425 2.902 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -4.104 -13.070 2.392 1.00 0.00 H new ATOM 1544 N TRP A 99 -1.647 -12.833 -0.627 1.00 0.00 N ATOM 1545 CA TRP A 99 -1.860 -11.994 -1.796 1.00 0.00 C ATOM 1546 C TRP A 99 -2.610 -12.713 -2.905 1.00 0.00 C ATOM 1547 O TRP A 99 -2.370 -13.887 -3.192 1.00 0.00 O ATOM 1548 CB TRP A 99 -0.536 -11.467 -2.334 1.00 0.00 C ATOM 1549 CG TRP A 99 -0.754 -10.414 -3.370 1.00 0.00 C ATOM 1550 CD1 TRP A 99 -0.997 -9.102 -3.104 1.00 0.00 C ATOM 1551 CD2 TRP A 99 -0.747 -10.534 -4.810 1.00 0.00 C ATOM 1552 NE1 TRP A 99 -1.155 -8.403 -4.269 1.00 0.00 N ATOM 1553 CE2 TRP A 99 -1.006 -9.260 -5.320 1.00 0.00 C ATOM 1554 CE3 TRP A 99 -0.547 -11.601 -5.690 1.00 0.00 C ATOM 1555 CZ2 TRP A 99 -1.076 -9.017 -6.673 1.00 0.00 C ATOM 1556 CZ3 TRP A 99 -0.609 -11.352 -7.050 1.00 0.00 C ATOM 1557 CH2 TRP A 99 -0.867 -10.091 -7.523 1.00 0.00 C ATOM 0 H TRP A 99 -0.689 -13.153 -0.487 1.00 0.00 H new ATOM 0 HA TRP A 99 -2.479 -11.160 -1.465 1.00 0.00 H new ATOM 0 HB2 TRP A 99 0.055 -11.058 -1.515 1.00 0.00 H new ATOM 0 HB3 TRP A 99 0.038 -12.289 -2.762 1.00 0.00 H new ATOM 0 HD1 TRP A 99 -1.057 -8.674 -2.114 1.00 0.00 H new ATOM 0 HE1 TRP A 99 -1.352 -7.405 -4.340 1.00 0.00 H new ATOM 0 HE3 TRP A 99 -0.349 -12.595 -5.318 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 -1.285 -8.029 -7.056 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 -0.452 -12.161 -7.748 1.00 0.00 H new ATOM 0 HH2 TRP A 99 -0.909 -9.930 -8.590 1.00 0.00 H new ATOM 1568 N SER A 100 -3.517 -11.973 -3.530 1.00 0.00 N ATOM 1569 CA SER A 100 -4.355 -12.458 -4.614 1.00 0.00 C ATOM 1570 C SER A 100 -4.263 -11.578 -5.853 1.00 0.00 C ATOM 1571 O SER A 100 -4.203 -10.360 -5.719 1.00 0.00 O ATOM 1572 CB SER A 100 -5.806 -12.493 -4.163 1.00 0.00 C ATOM 1573 OG SER A 100 -6.670 -12.834 -5.215 1.00 0.00 O ATOM 0 H SER A 100 -3.693 -10.997 -3.290 1.00 0.00 H new ATOM 0 HA SER A 100 -3.998 -13.455 -4.871 1.00 0.00 H new ATOM 0 HB2 SER A 100 -5.918 -13.213 -3.353 1.00 0.00 H new ATOM 0 HB3 SER A 100 -6.086 -11.518 -3.764 1.00 0.00 H new ATOM 0 HG SER A 100 -7.594 -12.848 -4.888 1.00 0.00 H new ATOM 1579 N PRO A 101 -4.294 -12.139 -7.068 1.00 0.00 N ATOM 1580 CA PRO A 101 -4.273 -11.400 -8.318 1.00 0.00 C ATOM 1581 C PRO A 101 -5.524 -10.543 -8.516 1.00 0.00 C ATOM 1582 O PRO A 101 -5.547 -9.648 -9.364 1.00 0.00 O ATOM 1583 CB PRO A 101 -4.179 -12.543 -9.337 1.00 0.00 C ATOM 1584 CG PRO A 101 -4.733 -13.748 -8.631 1.00 0.00 C ATOM 1585 CD PRO A 101 -4.307 -13.602 -7.188 1.00 0.00 C ATOM 0 HA PRO A 101 -3.464 -10.673 -8.388 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -4.751 -12.316 -10.237 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -3.148 -12.709 -9.648 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -5.819 -13.789 -8.717 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -4.344 -14.670 -9.064 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -5.009 -14.070 -6.498 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -3.329 -14.044 -6.996 1.00 0.00 H new ATOM 1593 N ALA A 102 -6.575 -10.838 -7.749 1.00 0.00 N ATOM 1594 CA ALA A 102 -7.810 -10.073 -7.765 1.00 0.00 C ATOM 1595 C ALA A 102 -7.702 -8.832 -6.871 1.00 0.00 C ATOM 1596 O ALA A 102 -8.567 -7.956 -6.928 1.00 0.00 O ATOM 1597 CB ALA A 102 -8.965 -10.949 -7.313 1.00 0.00 C ATOM 0 H ALA A 102 -6.587 -11.622 -7.096 1.00 0.00 H new ATOM 0 HA ALA A 102 -7.993 -9.736 -8.785 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -9.888 -10.370 -7.327 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -9.061 -11.801 -7.986 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -8.776 -11.306 -6.301 1.00 0.00 H new ATOM 1603 N LEU A 103 -6.660 -8.758 -6.040 1.00 0.00 N ATOM 1604 CA LEU A 103 -6.458 -7.644 -5.128 1.00 0.00 C ATOM 1605 C LEU A 103 -5.980 -6.438 -5.923 1.00 0.00 C ATOM 1606 O LEU A 103 -5.009 -6.543 -6.674 1.00 0.00 O ATOM 1607 CB LEU A 103 -5.411 -7.997 -4.067 1.00 0.00 C ATOM 1608 CG LEU A 103 -5.210 -6.965 -2.957 1.00 0.00 C ATOM 1609 CD1 LEU A 103 -6.475 -6.921 -2.118 1.00 0.00 C ATOM 1610 CD2 LEU A 103 -4.007 -7.338 -2.120 1.00 0.00 C ATOM 0 H LEU A 103 -5.935 -9.473 -5.985 1.00 0.00 H new ATOM 0 HA LEU A 103 -7.400 -7.420 -4.627 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -5.692 -8.945 -3.608 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -4.455 -8.156 -4.566 1.00 0.00 H new ATOM 0 HG LEU A 103 -5.023 -5.977 -3.378 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -6.356 -6.190 -1.318 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -7.319 -6.636 -2.747 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -6.660 -7.905 -1.686 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -3.869 -6.599 -1.331 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -4.165 -8.320 -1.674 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -3.119 -7.365 -2.751 1.00 0.00 H new ATOM 1622 N SER A 104 -6.658 -5.305 -5.780 1.00 0.00 N ATOM 1623 CA SER A 104 -6.246 -4.106 -6.503 1.00 0.00 C ATOM 1624 C SER A 104 -5.197 -3.299 -5.747 1.00 0.00 C ATOM 1625 O SER A 104 -4.991 -3.510 -4.551 1.00 0.00 O ATOM 1626 CB SER A 104 -7.454 -3.228 -6.795 1.00 0.00 C ATOM 1627 OG SER A 104 -8.032 -2.660 -5.645 1.00 0.00 O ATOM 0 H SER A 104 -7.478 -5.190 -5.184 1.00 0.00 H new ATOM 0 HA SER A 104 -5.793 -4.439 -7.437 1.00 0.00 H new ATOM 0 HB2 SER A 104 -7.156 -2.429 -7.473 1.00 0.00 H new ATOM 0 HB3 SER A 104 -8.207 -3.822 -7.314 1.00 0.00 H new ATOM 0 HG SER A 104 -8.887 -2.242 -5.881 1.00 0.00 H new ATOM 1633 N VAL A 105 -4.558 -2.369 -6.458 1.00 0.00 N ATOM 1634 CA VAL A 105 -3.557 -1.463 -5.895 1.00 0.00 C ATOM 1635 C VAL A 105 -4.265 -0.588 -4.872 1.00 0.00 C ATOM 1636 O VAL A 105 -3.720 -0.312 -3.802 1.00 0.00 O ATOM 1637 CB VAL A 105 -2.889 -0.646 -7.010 1.00 0.00 C ATOM 1638 CG1 VAL A 105 -1.979 0.421 -6.437 1.00 0.00 C ATOM 1639 CG2 VAL A 105 -2.092 -1.603 -7.873 1.00 0.00 C ATOM 0 H VAL A 105 -4.724 -2.222 -7.454 1.00 0.00 H new ATOM 0 HA VAL A 105 -2.754 -2.011 -5.402 1.00 0.00 H new ATOM 0 HB VAL A 105 -3.652 -0.139 -7.600 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -1.520 0.983 -7.250 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -2.561 1.098 -5.811 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -1.200 -0.049 -5.836 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -1.605 -1.049 -8.676 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -1.336 -2.099 -7.264 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -2.761 -2.350 -8.301 1.00 0.00 H new ATOM 1649 N GLN A 106 -5.468 -0.153 -5.249 1.00 0.00 N ATOM 1650 CA GLN A 106 -6.399 0.559 -4.387 1.00 0.00 C ATOM 1651 C GLN A 106 -6.628 -0.167 -3.084 1.00 0.00 C ATOM 1652 O GLN A 106 -6.509 0.435 -2.017 1.00 0.00 O ATOM 1653 CB GLN A 106 -7.749 0.705 -5.082 1.00 0.00 C ATOM 1654 CG GLN A 106 -8.858 1.232 -4.196 1.00 0.00 C ATOM 1655 CD GLN A 106 -10.179 1.337 -4.932 1.00 0.00 C ATOM 1656 OE1 GLN A 106 -10.365 0.708 -5.978 1.00 0.00 O ATOM 1657 NE2 GLN A 106 -11.106 2.123 -4.395 1.00 0.00 N ATOM 0 H GLN A 106 -5.828 -0.293 -6.193 1.00 0.00 H new ATOM 0 HA GLN A 106 -5.957 1.534 -4.181 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -7.634 1.374 -5.935 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -8.047 -0.266 -5.477 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -8.976 0.575 -3.334 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -8.579 2.213 -3.813 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -10.910 2.625 -3.529 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -12.014 2.225 -4.849 1.00 0.00 H new ATOM 1666 N SER A 107 -6.965 -1.454 -3.199 1.00 0.00 N ATOM 1667 CA SER A 107 -7.225 -2.300 -2.050 1.00 0.00 C ATOM 1668 C SER A 107 -6.014 -2.356 -1.134 1.00 0.00 C ATOM 1669 O SER A 107 -6.189 -2.329 0.084 1.00 0.00 O ATOM 1670 CB SER A 107 -7.572 -3.709 -2.480 1.00 0.00 C ATOM 1671 OG SER A 107 -8.756 -3.771 -3.227 1.00 0.00 O ATOM 0 H SER A 107 -7.063 -1.931 -4.095 1.00 0.00 H new ATOM 0 HA SER A 107 -8.069 -1.865 -1.515 1.00 0.00 H new ATOM 0 HB2 SER A 107 -6.752 -4.116 -3.072 1.00 0.00 H new ATOM 0 HB3 SER A 107 -7.671 -4.340 -1.597 1.00 0.00 H new ATOM 0 HG SER A 107 -8.605 -3.378 -4.112 1.00 0.00 H new ATOM 1677 N VAL A 108 -4.809 -2.452 -1.708 1.00 0.00 N ATOM 1678 CA VAL A 108 -3.587 -2.467 -0.908 1.00 0.00 C ATOM 1679 C VAL A 108 -3.399 -1.177 -0.131 1.00 0.00 C ATOM 1680 O VAL A 108 -3.065 -1.231 1.052 1.00 0.00 O ATOM 1681 CB VAL A 108 -2.325 -2.677 -1.761 1.00 0.00 C ATOM 1682 CG1 VAL A 108 -1.101 -2.470 -0.874 1.00 0.00 C ATOM 1683 CG2 VAL A 108 -2.328 -4.072 -2.362 1.00 0.00 C ATOM 0 H VAL A 108 -4.658 -2.520 -2.715 1.00 0.00 H new ATOM 0 HA VAL A 108 -3.712 -3.306 -0.223 1.00 0.00 H new ATOM 0 HB VAL A 108 -2.302 -1.960 -2.582 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -0.196 -2.615 -1.463 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -1.112 -1.458 -0.469 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -1.120 -3.189 -0.055 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -1.430 -4.211 -2.964 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -2.347 -4.813 -1.562 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -3.209 -4.195 -2.991 1.00 0.00 H new ATOM 1693 N CYS A 109 -3.600 -0.033 -0.783 1.00 0.00 N ATOM 1694 CA CYS A 109 -3.436 1.232 -0.080 1.00 0.00 C ATOM 1695 C CYS A 109 -4.459 1.413 1.019 1.00 0.00 C ATOM 1696 O CYS A 109 -4.113 1.875 2.106 1.00 0.00 O ATOM 1697 CB CYS A 109 -3.564 2.417 -1.029 1.00 0.00 C ATOM 1698 SG CYS A 109 -2.185 2.582 -2.171 1.00 0.00 S ATOM 0 H CYS A 109 -3.868 0.043 -1.764 1.00 0.00 H new ATOM 0 HA CYS A 109 -2.437 1.199 0.354 1.00 0.00 H new ATOM 0 HB2 CYS A 109 -4.487 2.316 -1.600 1.00 0.00 H new ATOM 0 HB3 CYS A 109 -3.651 3.332 -0.443 1.00 0.00 H new ATOM 0 HG CYS A 109 -2.519 2.092 -3.328 1.00 0.00 H new ATOM 1704 N LEU A 110 -5.703 1.040 0.743 1.00 0.00 N ATOM 1705 CA LEU A 110 -6.754 1.170 1.732 1.00 0.00 C ATOM 1706 C LEU A 110 -6.529 0.175 2.869 1.00 0.00 C ATOM 1707 O LEU A 110 -6.930 0.455 4.000 1.00 0.00 O ATOM 1708 CB LEU A 110 -8.114 0.976 1.053 1.00 0.00 C ATOM 1709 CG LEU A 110 -8.498 2.095 0.063 1.00 0.00 C ATOM 1710 CD1 LEU A 110 -9.790 1.723 -0.649 1.00 0.00 C ATOM 1711 CD2 LEU A 110 -8.654 3.413 0.808 1.00 0.00 C ATOM 0 H LEU A 110 -6.002 0.649 -0.150 1.00 0.00 H new ATOM 0 HA LEU A 110 -6.737 2.168 2.170 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -8.109 0.024 0.522 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -8.884 0.908 1.822 1.00 0.00 H new ATOM 0 HG LEU A 110 -7.710 2.212 -0.681 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -10.061 2.514 -1.348 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -9.649 0.789 -1.194 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -10.587 1.599 0.084 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -8.925 4.199 0.103 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -9.436 3.315 1.561 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -7.713 3.670 1.294 1.00 0.00 H new ATOM 1723 N SER A 111 -5.925 -0.983 2.571 1.00 0.00 N ATOM 1724 CA SER A 111 -5.580 -1.969 3.587 1.00 0.00 C ATOM 1725 C SER A 111 -4.508 -1.417 4.515 1.00 0.00 C ATOM 1726 O SER A 111 -4.600 -1.627 5.722 1.00 0.00 O ATOM 1727 CB SER A 111 -5.086 -3.259 2.953 1.00 0.00 C ATOM 1728 OG SER A 111 -6.105 -3.885 2.223 1.00 0.00 O ATOM 0 H SER A 111 -5.666 -1.256 1.623 1.00 0.00 H new ATOM 0 HA SER A 111 -6.481 -2.186 4.160 1.00 0.00 H new ATOM 0 HB2 SER A 111 -4.243 -3.045 2.296 1.00 0.00 H new ATOM 0 HB3 SER A 111 -4.723 -3.933 3.729 1.00 0.00 H new ATOM 0 HG SER A 111 -6.415 -3.285 1.513 1.00 0.00 H new ATOM 1734 N ILE A 112 -3.509 -0.726 3.962 1.00 0.00 N ATOM 1735 CA ILE A 112 -2.455 -0.103 4.759 1.00 0.00 C ATOM 1736 C ILE A 112 -3.061 0.989 5.639 1.00 0.00 C ATOM 1737 O ILE A 112 -2.708 1.105 6.812 1.00 0.00 O ATOM 1738 CB ILE A 112 -1.334 0.462 3.873 1.00 0.00 C ATOM 1739 CG1 ILE A 112 -0.583 -0.680 3.180 1.00 0.00 C ATOM 1740 CG2 ILE A 112 -0.362 1.259 4.735 1.00 0.00 C ATOM 1741 CD1 ILE A 112 0.331 -0.209 2.073 1.00 0.00 C ATOM 0 H ILE A 112 -3.410 -0.584 2.957 1.00 0.00 H new ATOM 0 HA ILE A 112 -2.003 -0.865 5.394 1.00 0.00 H new ATOM 0 HB ILE A 112 -1.772 1.111 3.114 1.00 0.00 H new ATOM 0 HG12 ILE A 112 0.005 -1.222 3.921 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -1.306 -1.385 2.770 1.00 0.00 H new ATOM 0 HG21 ILE A 112 0.434 1.661 4.109 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -0.893 2.079 5.218 1.00 0.00 H new ATOM 0 HG23 ILE A 112 0.068 0.607 5.495 1.00 0.00 H new ATOM 0 HD11 ILE A 112 0.832 -1.067 1.625 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -0.255 0.307 1.313 1.00 0.00 H new ATOM 0 HD13 ILE A 112 1.076 0.473 2.482 1.00 0.00 H new ATOM 1753 N ILE A 113 -3.950 1.800 5.066 1.00 0.00 N ATOM 1754 CA ILE A 113 -4.645 2.824 5.834 1.00 0.00 C ATOM 1755 C ILE A 113 -5.441 2.163 6.956 1.00 0.00 C ATOM 1756 O ILE A 113 -5.496 2.688 8.068 1.00 0.00 O ATOM 1757 CB ILE A 113 -5.572 3.674 4.947 1.00 0.00 C ATOM 1758 CG1 ILE A 113 -4.725 4.522 3.997 1.00 0.00 C ATOM 1759 CG2 ILE A 113 -6.432 4.570 5.829 1.00 0.00 C ATOM 1760 CD1 ILE A 113 -5.507 5.182 2.884 1.00 0.00 C ATOM 0 H ILE A 113 -4.203 1.766 4.078 1.00 0.00 H new ATOM 0 HA ILE A 113 -3.900 3.497 6.259 1.00 0.00 H new ATOM 0 HB ILE A 113 -6.222 3.025 4.360 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -4.216 5.294 4.574 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -3.952 3.891 3.557 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -7.090 5.173 5.203 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -7.033 3.954 6.498 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -5.790 5.225 6.418 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -4.830 5.763 2.258 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -5.994 4.418 2.279 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -6.262 5.842 3.311 1.00 0.00 H new ATOM 1772 N SER A 114 -6.102 1.042 6.667 1.00 0.00 N ATOM 1773 CA SER A 114 -6.821 0.302 7.692 1.00 0.00 C ATOM 1774 C SER A 114 -5.868 -0.165 8.794 1.00 0.00 C ATOM 1775 O SER A 114 -6.242 -0.063 9.963 1.00 0.00 O ATOM 1776 CB SER A 114 -7.546 -0.887 7.088 1.00 0.00 C ATOM 1777 OG SER A 114 -8.552 -0.465 6.207 1.00 0.00 O ATOM 0 H SER A 114 -6.152 0.632 5.735 1.00 0.00 H new ATOM 0 HA SER A 114 -7.559 0.971 8.133 1.00 0.00 H new ATOM 0 HB2 SER A 114 -6.835 -1.521 6.558 1.00 0.00 H new ATOM 0 HB3 SER A 114 -7.983 -1.493 7.882 1.00 0.00 H new ATOM 0 HG SER A 114 -8.144 -0.115 5.388 1.00 0.00 H new ATOM 1783 N MET A 115 -4.659 -0.635 8.438 1.00 0.00 N ATOM 1784 CA MET A 115 -3.624 -1.069 9.387 1.00 0.00 C ATOM 1785 C MET A 115 -3.249 0.050 10.341 1.00 0.00 C ATOM 1786 O MET A 115 -2.970 -0.184 11.517 1.00 0.00 O ATOM 1787 CB MET A 115 -2.332 -1.497 8.686 1.00 0.00 C ATOM 1788 CG MET A 115 -2.348 -2.776 7.871 1.00 0.00 C ATOM 1789 SD MET A 115 -0.798 -2.961 6.970 1.00 0.00 S ATOM 1790 CE MET A 115 0.348 -3.349 8.283 1.00 0.00 C ATOM 0 H MET A 115 -4.371 -0.725 7.464 1.00 0.00 H new ATOM 0 HA MET A 115 -4.058 -1.915 9.920 1.00 0.00 H new ATOM 0 HB2 MET A 115 -2.027 -0.685 8.026 1.00 0.00 H new ATOM 0 HB3 MET A 115 -1.558 -1.597 9.447 1.00 0.00 H new ATOM 0 HG2 MET A 115 -2.499 -3.632 8.528 1.00 0.00 H new ATOM 0 HG3 MET A 115 -3.184 -2.759 7.171 1.00 0.00 H new ATOM 0 HE1 MET A 115 1.300 -3.662 7.854 1.00 0.00 H new ATOM 0 HE2 MET A 115 0.502 -2.467 8.904 1.00 0.00 H new ATOM 0 HE3 MET A 115 -0.058 -4.156 8.893 1.00 0.00 H new ATOM 1800 N LEU A 116 -3.267 1.289 9.864 1.00 0.00 N ATOM 1801 CA LEU A 116 -2.957 2.417 10.734 1.00 0.00 C ATOM 1802 C LEU A 116 -3.915 2.504 11.937 1.00 0.00 C ATOM 1803 O LEU A 116 -3.546 3.072 12.966 1.00 0.00 O ATOM 1804 CB LEU A 116 -3.024 3.720 9.933 1.00 0.00 C ATOM 1805 CG LEU A 116 -1.972 3.868 8.826 1.00 0.00 C ATOM 1806 CD1 LEU A 116 -2.252 5.143 8.059 1.00 0.00 C ATOM 1807 CD2 LEU A 116 -0.573 3.868 9.415 1.00 0.00 C ATOM 0 H LEU A 116 -3.488 1.536 8.899 1.00 0.00 H new ATOM 0 HA LEU A 116 -1.950 2.264 11.123 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -4.014 3.799 9.483 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -2.920 4.557 10.624 1.00 0.00 H new ATOM 0 HG LEU A 116 -2.030 3.022 8.142 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -1.512 5.262 7.268 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -3.248 5.092 7.619 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -2.198 5.995 8.737 1.00 0.00 H new ATOM 0 HD21 LEU A 116 0.159 3.974 8.614 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -0.472 4.700 10.112 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -0.400 2.930 9.943 1.00 0.00 H new ATOM 1819 N SER A 117 -5.138 1.968 11.822 1.00 0.00 N ATOM 1820 CA SER A 117 -6.076 1.968 12.936 1.00 0.00 C ATOM 1821 C SER A 117 -6.238 0.595 13.593 1.00 0.00 C ATOM 1822 O SER A 117 -6.464 0.506 14.801 1.00 0.00 O ATOM 1823 CB SER A 117 -7.448 2.390 12.448 1.00 0.00 C ATOM 1824 OG SER A 117 -7.964 1.449 11.546 1.00 0.00 O ATOM 0 H SER A 117 -5.493 1.533 10.970 1.00 0.00 H new ATOM 0 HA SER A 117 -5.666 2.660 13.672 1.00 0.00 H new ATOM 0 HB2 SER A 117 -8.124 2.497 13.296 1.00 0.00 H new ATOM 0 HB3 SER A 117 -7.384 3.366 11.966 1.00 0.00 H new ATOM 0 HG SER A 117 -7.227 1.022 11.061 1.00 0.00 H new ATOM 1830 N SER A 118 -6.133 -0.470 12.793 1.00 0.00 N ATOM 1831 CA SER A 118 -6.322 -1.835 13.278 1.00 0.00 C ATOM 1832 C SER A 118 -5.080 -2.583 13.741 1.00 0.00 C ATOM 1833 O SER A 118 -5.205 -3.553 14.488 1.00 0.00 O ATOM 1834 CB SER A 118 -6.997 -2.662 12.200 1.00 0.00 C ATOM 1835 OG SER A 118 -6.179 -2.806 11.075 1.00 0.00 O ATOM 0 H SER A 118 -5.916 -0.409 11.798 1.00 0.00 H new ATOM 0 HA SER A 118 -6.930 -1.711 14.174 1.00 0.00 H new ATOM 0 HB2 SER A 118 -7.246 -3.646 12.598 1.00 0.00 H new ATOM 0 HB3 SER A 118 -7.935 -2.188 11.911 1.00 0.00 H new ATOM 0 HG SER A 118 -6.090 -1.941 10.622 1.00 0.00 H new ATOM 1841 N CYS A 119 -3.889 -2.167 13.318 1.00 0.00 N ATOM 1842 CA CYS A 119 -2.680 -2.850 13.750 1.00 0.00 C ATOM 1843 C CYS A 119 -1.714 -1.871 14.399 1.00 0.00 C ATOM 1844 O CYS A 119 -0.495 -2.014 14.301 1.00 0.00 O ATOM 1845 CB CYS A 119 -1.993 -3.514 12.555 1.00 0.00 C ATOM 1846 SG CYS A 119 -2.960 -4.800 11.727 1.00 0.00 S ATOM 0 H CYS A 119 -3.739 -1.377 12.690 1.00 0.00 H new ATOM 0 HA CYS A 119 -2.963 -3.610 14.478 1.00 0.00 H new ATOM 0 HB2 CYS A 119 -1.743 -2.743 11.826 1.00 0.00 H new ATOM 0 HB3 CYS A 119 -1.053 -3.950 12.893 1.00 0.00 H new ATOM 0 HG CYS A 119 -2.276 -5.285 10.733 1.00 0.00 H new ATOM 1852 N LYS A 120 -2.288 -0.884 15.080 1.00 0.00 N ATOM 1853 CA LYS A 120 -1.569 0.128 15.842 1.00 0.00 C ATOM 1854 C LYS A 120 -1.073 -0.399 17.192 1.00 0.00 C ATOM 1855 O LYS A 120 -0.188 0.189 17.813 1.00 0.00 O ATOM 1856 CB LYS A 120 -2.485 1.332 16.054 1.00 0.00 C ATOM 1857 CG LYS A 120 -3.654 1.021 16.981 1.00 0.00 C ATOM 1858 CD LYS A 120 -4.590 2.204 17.166 1.00 0.00 C ATOM 1859 CE LYS A 120 -5.714 1.834 18.125 1.00 0.00 C ATOM 1860 NZ LYS A 120 -6.667 2.954 18.348 1.00 0.00 N ATOM 0 H LYS A 120 -3.300 -0.764 15.117 1.00 0.00 H new ATOM 0 HA LYS A 120 -0.686 0.416 15.272 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -1.906 2.156 16.470 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -2.869 1.666 15.090 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -4.216 0.178 16.579 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -3.269 0.713 17.953 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -4.036 3.059 17.554 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -5.006 2.503 16.204 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -6.255 0.974 17.730 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -5.286 1.530 19.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -7.412 2.650 19.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -6.159 3.767 18.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -7.098 3.229 17.442 1.00 0.00 H new ATOM 1874 N GLU A 121 -1.671 -1.500 17.643 1.00 0.00 N ATOM 1875 CA GLU A 121 -1.364 -2.151 18.908 1.00 0.00 C ATOM 1876 C GLU A 121 -0.268 -3.205 18.757 1.00 0.00 C ATOM 1877 O GLU A 121 -0.334 -4.053 17.866 1.00 0.00 O ATOM 1878 CB GLU A 121 -2.666 -2.751 19.452 1.00 0.00 C ATOM 1879 CG GLU A 121 -2.625 -3.402 20.824 1.00 0.00 C ATOM 1880 CD GLU A 121 -3.989 -3.890 21.233 1.00 0.00 C ATOM 1881 OE1 GLU A 121 -4.877 -3.845 20.416 1.00 0.00 O ATOM 1882 OE2 GLU A 121 -4.161 -4.296 22.358 1.00 0.00 O ATOM 0 H GLU A 121 -2.405 -1.976 17.119 1.00 0.00 H new ATOM 0 HA GLU A 121 -0.969 -1.421 19.614 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -3.415 -1.959 19.479 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -3.016 -3.496 18.738 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -1.925 -4.237 20.813 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -2.256 -2.686 21.559 1.00 0.00 H new ATOM 1889 N LYS A 122 0.738 -3.147 19.630 1.00 0.00 N ATOM 1890 CA LYS A 122 1.860 -4.090 19.612 1.00 0.00 C ATOM 1891 C LYS A 122 1.678 -5.307 20.521 1.00 0.00 C ATOM 1892 O LYS A 122 2.548 -6.179 20.574 1.00 0.00 O ATOM 1893 CB LYS A 122 3.151 -3.386 20.035 1.00 0.00 C ATOM 1894 CG LYS A 122 3.645 -2.303 19.092 1.00 0.00 C ATOM 1895 CD LYS A 122 4.940 -1.683 19.594 1.00 0.00 C ATOM 1896 CE LYS A 122 5.462 -0.605 18.654 1.00 0.00 C ATOM 1897 NZ LYS A 122 6.710 0.020 19.180 1.00 0.00 N ATOM 0 H LYS A 122 0.799 -2.447 20.369 1.00 0.00 H new ATOM 0 HA LYS A 122 1.907 -4.449 18.584 1.00 0.00 H new ATOM 0 HB2 LYS A 122 2.997 -2.944 21.019 1.00 0.00 H new ATOM 0 HB3 LYS A 122 3.935 -4.136 20.141 1.00 0.00 H new ATOM 0 HG2 LYS A 122 3.802 -2.726 18.100 1.00 0.00 H new ATOM 0 HG3 LYS A 122 2.884 -1.529 18.992 1.00 0.00 H new ATOM 0 HD2 LYS A 122 4.776 -1.253 20.582 1.00 0.00 H new ATOM 0 HD3 LYS A 122 5.694 -2.462 19.706 1.00 0.00 H new ATOM 0 HE2 LYS A 122 5.656 -1.039 17.673 1.00 0.00 H new ATOM 0 HE3 LYS A 122 4.699 0.162 18.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 7.039 0.750 18.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 6.517 0.455 20.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 7.445 -0.708 19.286 1.00 0.00 H new ATOM 1911 N ARG A 123 0.562 -5.363 21.236 1.00 0.00 N ATOM 1912 CA ARG A 123 0.262 -6.447 22.159 1.00 0.00 C ATOM 1913 C ARG A 123 -0.031 -7.771 21.470 1.00 0.00 C ATOM 1914 O ARG A 123 -0.765 -7.835 20.482 1.00 0.00 O ATOM 1915 CB ARG A 123 -0.921 -6.063 23.024 1.00 0.00 C ATOM 1916 CG ARG A 123 -1.308 -7.062 24.099 1.00 0.00 C ATOM 1917 CD ARG A 123 -2.393 -6.497 24.929 1.00 0.00 C ATOM 1918 NE ARG A 123 -3.563 -6.236 24.113 1.00 0.00 N ATOM 1919 CZ ARG A 123 -4.531 -7.118 23.810 1.00 0.00 C ATOM 1920 NH1 ARG A 123 -4.501 -8.347 24.277 1.00 0.00 N ATOM 1921 NH2 ARG A 123 -5.509 -6.703 23.027 1.00 0.00 N ATOM 0 H ARG A 123 -0.166 -4.650 21.190 1.00 0.00 H new ATOM 0 HA ARG A 123 1.158 -6.596 22.762 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -0.701 -5.109 23.504 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -1.783 -5.903 22.377 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -1.634 -7.996 23.642 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -0.444 -7.296 24.721 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -2.647 -7.191 25.730 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -2.057 -5.574 25.401 1.00 0.00 H new ATOM 0 HE ARG A 123 -3.661 -5.294 23.733 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -3.734 -8.645 24.880 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -5.245 -9.002 24.036 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -5.510 -5.745 22.677 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -6.264 -7.340 22.772 1.00 0.00 H new ATOM 1935 N ARG A 124 0.565 -8.829 22.008 1.00 0.00 N ATOM 1936 CA ARG A 124 0.400 -10.178 21.487 1.00 0.00 C ATOM 1937 C ARG A 124 -0.960 -10.755 21.892 1.00 0.00 C ATOM 1938 O ARG A 124 -1.475 -10.407 22.955 1.00 0.00 O ATOM 1939 CB ARG A 124 1.538 -11.056 21.976 1.00 0.00 C ATOM 1940 CG ARG A 124 2.906 -10.567 21.531 1.00 0.00 C ATOM 1941 CD ARG A 124 2.993 -10.479 20.049 1.00 0.00 C ATOM 1942 NE ARG A 124 2.814 -11.766 19.400 1.00 0.00 N ATOM 1943 CZ ARG A 124 2.663 -11.952 18.076 1.00 0.00 C ATOM 1944 NH1 ARG A 124 2.674 -10.934 17.243 1.00 0.00 N ATOM 1945 NH2 ARG A 124 2.502 -13.189 17.644 1.00 0.00 N ATOM 0 H ARG A 124 1.178 -8.773 22.821 1.00 0.00 H new ATOM 0 HA ARG A 124 0.429 -10.146 20.398 1.00 0.00 H new ATOM 0 HB2 ARG A 124 1.512 -11.100 23.065 1.00 0.00 H new ATOM 0 HB3 ARG A 124 1.386 -12.072 21.612 1.00 0.00 H new ATOM 0 HG2 ARG A 124 3.104 -9.588 21.968 1.00 0.00 H new ATOM 0 HG3 ARG A 124 3.675 -11.244 21.903 1.00 0.00 H new ATOM 0 HD2 ARG A 124 2.236 -9.785 19.685 1.00 0.00 H new ATOM 0 HD3 ARG A 124 3.963 -10.068 19.770 1.00 0.00 H new ATOM 0 HE ARG A 124 2.802 -12.594 19.995 1.00 0.00 H new ATOM 0 HH11 ARG A 124 2.798 -9.986 17.598 1.00 0.00 H new ATOM 0 HH12 ARG A 124 2.558 -11.093 16.242 1.00 0.00 H new ATOM 0 HH21 ARG A 124 2.495 -13.964 18.307 1.00 0.00 H new ATOM 0 HH22 ARG A 124 2.384 -13.370 16.647 1.00 0.00 H new ATOM 1959 N PRO A 125 -1.556 -11.628 21.070 1.00 0.00 N ATOM 1960 CA PRO A 125 -2.863 -12.210 21.294 1.00 0.00 C ATOM 1961 C PRO A 125 -2.945 -13.249 22.415 1.00 0.00 C ATOM 1962 O PRO A 125 -1.924 -13.807 22.817 1.00 0.00 O ATOM 1963 CB PRO A 125 -3.122 -12.858 19.928 1.00 0.00 C ATOM 1964 CG PRO A 125 -1.760 -13.159 19.371 1.00 0.00 C ATOM 1965 CD PRO A 125 -0.879 -12.017 19.826 1.00 0.00 C ATOM 0 HA PRO A 125 -3.587 -11.466 21.627 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -3.716 -13.766 20.029 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -3.676 -12.186 19.272 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -1.387 -14.114 19.740 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -1.786 -13.226 18.283 1.00 0.00 H new ATOM 0 HD2 PRO A 125 0.151 -12.332 19.996 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -0.848 -11.204 19.100 1.00 0.00 H new ATOM 1973 N PRO A 126 -4.152 -13.526 22.931 1.00 0.00 N ATOM 1974 CA PRO A 126 -4.437 -14.509 23.963 1.00 0.00 C ATOM 1975 C PRO A 126 -3.889 -15.904 23.679 1.00 0.00 C ATOM 1976 O PRO A 126 -3.553 -16.642 24.606 1.00 0.00 O ATOM 1977 CB PRO A 126 -5.970 -14.513 23.947 1.00 0.00 C ATOM 1978 CG PRO A 126 -6.345 -13.136 23.485 1.00 0.00 C ATOM 1979 CD PRO A 126 -5.313 -12.765 22.445 1.00 0.00 C ATOM 0 HA PRO A 126 -3.970 -14.256 24.915 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -6.358 -15.277 23.273 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -6.377 -14.724 24.936 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -7.350 -13.124 23.063 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -6.339 -12.428 24.314 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -5.612 -13.063 21.440 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -5.122 -11.692 22.416 1.00 0.00 H new ATOM 1987 N ASP A 127 -3.812 -16.265 22.401 1.00 0.00 N ATOM 1988 CA ASP A 127 -3.309 -17.561 21.987 1.00 0.00 C ATOM 1989 C ASP A 127 -1.902 -17.491 21.397 1.00 0.00 C ATOM 1990 O ASP A 127 -1.541 -18.352 20.596 1.00 0.00 O ATOM 1991 CB ASP A 127 -4.274 -18.190 20.981 1.00 0.00 C ATOM 1992 CG ASP A 127 -4.433 -17.378 19.704 1.00 0.00 C ATOM 1993 OD1 ASP A 127 -3.893 -16.300 19.632 1.00 0.00 O ATOM 1994 OD2 ASP A 127 -5.096 -17.845 18.808 1.00 0.00 O ATOM 0 H ASP A 127 -4.098 -15.664 21.628 1.00 0.00 H new ATOM 0 HA ASP A 127 -3.242 -18.182 22.880 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -3.920 -19.189 20.725 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -5.250 -18.308 21.451 1.00 0.00 H new ATOM 1999 N ASN A 128 -1.134 -16.459 21.756 1.00 0.00 N ATOM 2000 CA ASN A 128 0.246 -16.320 21.309 1.00 0.00 C ATOM 2001 C ASN A 128 1.110 -17.511 21.699 1.00 0.00 C ATOM 2002 O ASN A 128 1.861 -18.010 20.861 1.00 0.00 O ATOM 2003 CB ASN A 128 0.857 -15.050 21.865 1.00 0.00 C ATOM 2004 CG ASN A 128 2.252 -14.803 21.365 1.00 0.00 C ATOM 2005 OD1 ASN A 128 2.485 -14.504 20.187 1.00 0.00 O ATOM 2006 ND2 ASN A 128 3.204 -14.926 22.255 1.00 0.00 N ATOM 0 H ASN A 128 -1.453 -15.703 22.361 1.00 0.00 H new ATOM 0 HA ASN A 128 0.218 -16.274 20.220 1.00 0.00 H new ATOM 0 HB2 ASN A 128 0.226 -14.202 21.598 1.00 0.00 H new ATOM 0 HB3 ASN A 128 0.872 -15.106 22.953 1.00 0.00 H new ATOM 0 HD21 ASN A 128 4.176 -14.774 21.986 1.00 0.00 H new ATOM 0 HD22 ASN A 128 2.974 -15.174 23.217 1.00 0.00 H new ATOM 2013 N SER A 129 1.014 -17.949 22.959 1.00 0.00 N ATOM 2014 CA SER A 129 1.799 -19.086 23.431 1.00 0.00 C ATOM 2015 C SER A 129 1.325 -20.393 22.816 1.00 0.00 C ATOM 2016 O SER A 129 2.114 -21.328 22.688 1.00 0.00 O ATOM 2017 CB SER A 129 1.718 -19.186 24.938 1.00 0.00 C ATOM 2018 OG SER A 129 0.416 -19.511 25.344 1.00 0.00 O ATOM 0 H SER A 129 0.404 -17.534 23.663 1.00 0.00 H new ATOM 0 HA SER A 129 2.831 -18.918 23.124 1.00 0.00 H new ATOM 0 HB2 SER A 129 2.415 -19.944 25.295 1.00 0.00 H new ATOM 0 HB3 SER A 129 2.019 -18.239 25.387 1.00 0.00 H new ATOM 0 HG SER A 129 0.384 -19.573 26.322 1.00 0.00 H new ATOM 2024 N PHE A 130 0.042 -20.451 22.458 1.00 0.00 N ATOM 2025 CA PHE A 130 -0.525 -21.591 21.755 1.00 0.00 C ATOM 2026 C PHE A 130 0.178 -21.688 20.418 1.00 0.00 C ATOM 2027 O PHE A 130 0.599 -22.774 20.017 1.00 0.00 O ATOM 2028 CB PHE A 130 -2.035 -21.496 21.573 1.00 0.00 C ATOM 2029 CG PHE A 130 -2.587 -22.642 20.780 1.00 0.00 C ATOM 2030 CD1 PHE A 130 -2.788 -23.881 21.369 1.00 0.00 C ATOM 2031 CD2 PHE A 130 -2.903 -22.481 19.440 1.00 0.00 C ATOM 2032 CE1 PHE A 130 -3.297 -24.936 20.635 1.00 0.00 C ATOM 2033 CE2 PHE A 130 -3.411 -23.533 18.704 1.00 0.00 C ATOM 2034 CZ PHE A 130 -3.609 -24.762 19.303 1.00 0.00 C ATOM 0 H PHE A 130 -0.629 -19.707 22.649 1.00 0.00 H new ATOM 0 HA PHE A 130 -0.368 -22.490 22.352 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -2.515 -21.469 22.551 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -2.280 -20.559 21.072 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -2.544 -24.023 22.412 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -2.750 -21.522 18.967 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -3.450 -25.896 21.105 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -3.653 -23.395 17.661 1.00 0.00 H new ATOM 0 HZ PHE A 130 -4.008 -25.585 18.729 1.00 0.00 H new ATOM 2044 N TYR A 131 0.234 -20.553 19.715 1.00 0.00 N ATOM 2045 CA TYR A 131 0.944 -20.474 18.452 1.00 0.00 C ATOM 2046 C TYR A 131 2.388 -20.895 18.603 1.00 0.00 C ATOM 2047 O TYR A 131 2.901 -21.574 17.722 1.00 0.00 O ATOM 2048 CB TYR A 131 0.934 -19.098 17.815 1.00 0.00 C ATOM 2049 CG TYR A 131 1.773 -19.230 16.567 1.00 0.00 C ATOM 2050 CD1 TYR A 131 1.229 -19.847 15.451 1.00 0.00 C ATOM 2051 CD2 TYR A 131 3.083 -18.773 16.544 1.00 0.00 C ATOM 2052 CE1 TYR A 131 1.991 -20.009 14.314 1.00 0.00 C ATOM 2053 CE2 TYR A 131 3.845 -18.932 15.403 1.00 0.00 C ATOM 2054 CZ TYR A 131 3.300 -19.549 14.295 1.00 0.00 C ATOM 2055 OH TYR A 131 4.051 -19.732 13.160 1.00 0.00 O ATOM 0 H TYR A 131 -0.207 -19.680 20.006 1.00 0.00 H new ATOM 0 HA TYR A 131 0.399 -21.156 17.799 1.00 0.00 H new ATOM 0 HB2 TYR A 131 -0.082 -18.783 17.575 1.00 0.00 H new ATOM 0 HB3 TYR A 131 1.348 -18.349 18.490 1.00 0.00 H new ATOM 0 HD1 TYR A 131 0.209 -20.200 15.473 1.00 0.00 H new ATOM 0 HD2 TYR A 131 3.505 -18.295 17.415 1.00 0.00 H new ATOM 0 HE1 TYR A 131 1.572 -20.491 13.443 1.00 0.00 H new ATOM 0 HE2 TYR A 131 4.864 -18.575 15.378 1.00 0.00 H new ATOM 0 HH TYR A 131 4.946 -19.357 13.296 1.00 0.00 H new ATOM 2065 N VAL A 132 3.080 -20.441 19.647 1.00 0.00 N ATOM 2066 CA VAL A 132 4.454 -20.885 19.860 1.00 0.00 C ATOM 2067 C VAL A 132 4.526 -22.406 19.974 1.00 0.00 C ATOM 2068 O VAL A 132 5.350 -23.051 19.320 1.00 0.00 O ATOM 2069 CB VAL A 132 5.040 -20.244 21.129 1.00 0.00 C ATOM 2070 CG1 VAL A 132 6.378 -20.885 21.462 1.00 0.00 C ATOM 2071 CG2 VAL A 132 5.214 -18.751 20.900 1.00 0.00 C ATOM 0 H VAL A 132 2.723 -19.784 20.341 1.00 0.00 H new ATOM 0 HA VAL A 132 5.041 -20.570 18.997 1.00 0.00 H new ATOM 0 HB VAL A 132 4.361 -20.403 21.967 1.00 0.00 H new ATOM 0 HG11 VAL A 132 6.787 -20.426 22.362 1.00 0.00 H new ATOM 0 HG12 VAL A 132 6.238 -21.953 21.631 1.00 0.00 H new ATOM 0 HG13 VAL A 132 7.069 -20.736 20.632 1.00 0.00 H new ATOM 0 HG21 VAL A 132 5.629 -18.291 21.797 1.00 0.00 H new ATOM 0 HG22 VAL A 132 5.891 -18.588 20.062 1.00 0.00 H new ATOM 0 HG23 VAL A 132 4.246 -18.302 20.677 1.00 0.00 H new ATOM 2081 N ARG A 133 3.635 -22.999 20.763 1.00 0.00 N ATOM 2082 CA ARG A 133 3.614 -24.448 20.917 1.00 0.00 C ATOM 2083 C ARG A 133 3.280 -25.172 19.613 1.00 0.00 C ATOM 2084 O ARG A 133 3.755 -26.286 19.385 1.00 0.00 O ATOM 2085 CB ARG A 133 2.603 -24.834 21.982 1.00 0.00 C ATOM 2086 CG ARG A 133 3.007 -24.467 23.399 1.00 0.00 C ATOM 2087 CD ARG A 133 1.932 -24.786 24.370 1.00 0.00 C ATOM 2088 NE ARG A 133 2.315 -24.451 25.732 1.00 0.00 N ATOM 2089 CZ ARG A 133 1.483 -24.485 26.790 1.00 0.00 C ATOM 2090 NH1 ARG A 133 0.227 -24.837 26.625 1.00 0.00 N ATOM 2091 NH2 ARG A 133 1.927 -24.163 27.992 1.00 0.00 N ATOM 0 H ARG A 133 2.924 -22.503 21.301 1.00 0.00 H new ATOM 0 HA ARG A 133 4.617 -24.755 21.214 1.00 0.00 H new ATOM 0 HB2 ARG A 133 1.652 -24.353 21.753 1.00 0.00 H new ATOM 0 HB3 ARG A 133 2.436 -25.910 21.933 1.00 0.00 H new ATOM 0 HG2 ARG A 133 3.915 -25.005 23.670 1.00 0.00 H new ATOM 0 HG3 ARG A 133 3.240 -23.403 23.448 1.00 0.00 H new ATOM 0 HD2 ARG A 133 1.027 -24.240 24.103 1.00 0.00 H new ATOM 0 HD3 ARG A 133 1.693 -25.848 24.311 1.00 0.00 H new ATOM 0 HE ARG A 133 3.282 -24.171 25.898 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -0.116 -25.084 25.697 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -0.405 -24.863 27.425 1.00 0.00 H new ATOM 0 HH21 ARG A 133 2.901 -23.888 28.119 1.00 0.00 H new ATOM 0 HH22 ARG A 133 1.296 -24.189 28.793 1.00 0.00 H new ATOM 2105 N THR A 134 2.462 -24.547 18.766 1.00 0.00 N ATOM 2106 CA THR A 134 2.100 -25.095 17.468 1.00 0.00 C ATOM 2107 C THR A 134 2.714 -24.294 16.316 1.00 0.00 C ATOM 2108 O THR A 134 2.105 -24.197 15.249 1.00 0.00 O ATOM 2109 CB THR A 134 0.566 -25.117 17.314 1.00 0.00 C ATOM 2110 OG1 THR A 134 0.049 -23.789 17.472 1.00 0.00 O ATOM 2111 CG2 THR A 134 -0.057 -26.005 18.380 1.00 0.00 C ATOM 0 H THR A 134 2.033 -23.644 18.966 1.00 0.00 H new ATOM 0 HA THR A 134 2.496 -26.110 17.422 1.00 0.00 H new ATOM 0 HB THR A 134 0.322 -25.504 16.325 1.00 0.00 H new ATOM 0 HG1 THR A 134 0.171 -23.499 18.400 1.00 0.00 H new ATOM 0 HG21 THR A 134 -1.140 -26.012 18.260 1.00 0.00 H new ATOM 0 HG22 THR A 134 0.326 -27.020 18.277 1.00 0.00 H new ATOM 0 HG23 THR A 134 0.196 -25.620 19.368 1.00 0.00 H new ATOM 2119 N CYS A 135 3.889 -23.696 16.548 1.00 0.00 N ATOM 2120 CA CYS A 135 4.619 -22.898 15.563 1.00 0.00 C ATOM 2121 C CYS A 135 4.780 -23.549 14.192 1.00 0.00 C ATOM 2122 O CYS A 135 5.196 -24.705 14.080 1.00 0.00 O ATOM 2123 CB CYS A 135 5.996 -22.551 16.124 1.00 0.00 C ATOM 2124 SG CYS A 135 7.030 -21.543 15.036 1.00 0.00 S ATOM 0 H CYS A 135 4.367 -23.757 17.447 1.00 0.00 H new ATOM 0 HA CYS A 135 4.012 -22.009 15.393 1.00 0.00 H new ATOM 0 HB2 CYS A 135 5.865 -22.023 17.068 1.00 0.00 H new ATOM 0 HB3 CYS A 135 6.525 -23.477 16.348 1.00 0.00 H new ATOM 0 HG CYS A 135 6.799 -21.864 13.798 1.00 0.00 H new ATOM 2130 N ASN A 136 4.477 -22.779 13.149 1.00 0.00 N ATOM 2131 CA ASN A 136 4.548 -23.239 11.769 1.00 0.00 C ATOM 2132 C ASN A 136 5.893 -22.909 11.134 1.00 0.00 C ATOM 2133 O ASN A 136 6.672 -22.128 11.679 1.00 0.00 O ATOM 2134 CB ASN A 136 3.411 -22.642 10.962 1.00 0.00 C ATOM 2135 CG ASN A 136 2.070 -23.175 11.385 1.00 0.00 C ATOM 2136 OD1 ASN A 136 1.928 -24.367 11.682 1.00 0.00 O ATOM 2137 ND2 ASN A 136 1.080 -22.320 11.411 1.00 0.00 N ATOM 0 H ASN A 136 4.173 -21.810 13.242 1.00 0.00 H new ATOM 0 HA ASN A 136 4.449 -24.324 11.771 1.00 0.00 H new ATOM 0 HB2 ASN A 136 3.420 -21.558 11.073 1.00 0.00 H new ATOM 0 HB3 ASN A 136 3.567 -22.856 9.905 1.00 0.00 H new ATOM 0 HD21 ASN A 136 0.147 -22.628 11.684 1.00 0.00 H new ATOM 0 HD22 ASN A 136 1.241 -21.345 11.158 1.00 0.00 H new ATOM 2144 N LYS A 137 6.161 -23.522 9.984 1.00 0.00 N ATOM 2145 CA LYS A 137 7.409 -23.308 9.260 1.00 0.00 C ATOM 2146 C LYS A 137 7.643 -21.845 8.914 1.00 0.00 C ATOM 2147 O LYS A 137 6.795 -21.186 8.310 1.00 0.00 O ATOM 2148 CB LYS A 137 7.431 -24.126 7.971 1.00 0.00 C ATOM 2149 CG LYS A 137 8.736 -24.006 7.195 1.00 0.00 C ATOM 2150 CD LYS A 137 8.731 -24.880 5.952 1.00 0.00 C ATOM 2151 CE LYS A 137 10.037 -24.747 5.182 1.00 0.00 C ATOM 2152 NZ LYS A 137 10.046 -25.595 3.959 1.00 0.00 N ATOM 0 H LYS A 137 5.523 -24.177 9.531 1.00 0.00 H new ATOM 0 HA LYS A 137 8.207 -23.632 9.928 1.00 0.00 H new ATOM 0 HB2 LYS A 137 7.257 -25.174 8.213 1.00 0.00 H new ATOM 0 HB3 LYS A 137 6.608 -23.805 7.333 1.00 0.00 H new ATOM 0 HG2 LYS A 137 8.895 -22.966 6.909 1.00 0.00 H new ATOM 0 HG3 LYS A 137 9.569 -24.291 7.837 1.00 0.00 H new ATOM 0 HD2 LYS A 137 8.578 -25.921 6.237 1.00 0.00 H new ATOM 0 HD3 LYS A 137 7.896 -24.599 5.310 1.00 0.00 H new ATOM 0 HE2 LYS A 137 10.190 -23.705 4.903 1.00 0.00 H new ATOM 0 HE3 LYS A 137 10.869 -25.030 5.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 10.952 -25.477 3.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 9.925 -26.593 4.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 9.267 -25.309 3.332 1.00 0.00 H new ATOM 2166 N ASN A 138 8.815 -21.357 9.297 1.00 0.00 N ATOM 2167 CA ASN A 138 9.198 -19.977 9.052 1.00 0.00 C ATOM 2168 C ASN A 138 9.717 -19.800 7.626 1.00 0.00 C ATOM 2169 O ASN A 138 10.293 -20.736 7.070 1.00 0.00 O ATOM 2170 CB ASN A 138 10.246 -19.552 10.064 1.00 0.00 C ATOM 2171 CG ASN A 138 9.688 -19.467 11.454 1.00 0.00 C ATOM 2172 OD1 ASN A 138 8.566 -18.989 11.658 1.00 0.00 O ATOM 2173 ND2 ASN A 138 10.449 -19.925 12.416 1.00 0.00 N ATOM 0 H ASN A 138 9.523 -21.906 9.784 1.00 0.00 H new ATOM 0 HA ASN A 138 8.319 -19.342 9.164 1.00 0.00 H new ATOM 0 HB2 ASN A 138 11.073 -20.262 10.049 1.00 0.00 H new ATOM 0 HB3 ASN A 138 10.653 -18.582 9.778 1.00 0.00 H new ATOM 0 HD21 ASN A 138 10.123 -19.896 13.382 1.00 0.00 H new ATOM 0 HD22 ASN A 138 11.368 -20.311 12.199 1.00 0.00 H new ATOM 2180 N PRO A 139 9.521 -18.626 7.016 1.00 0.00 N ATOM 2181 CA PRO A 139 9.979 -18.307 5.684 1.00 0.00 C ATOM 2182 C PRO A 139 11.486 -18.103 5.630 1.00 0.00 C ATOM 2183 O PRO A 139 12.117 -17.788 6.640 1.00 0.00 O ATOM 2184 CB PRO A 139 9.204 -17.014 5.405 1.00 0.00 C ATOM 2185 CG PRO A 139 8.961 -16.414 6.763 1.00 0.00 C ATOM 2186 CD PRO A 139 8.741 -17.585 7.697 1.00 0.00 C ATOM 0 HA PRO A 139 9.805 -19.094 4.951 1.00 0.00 H new ATOM 0 HB2 PRO A 139 9.777 -16.338 4.770 1.00 0.00 H new ATOM 0 HB3 PRO A 139 8.266 -17.218 4.889 1.00 0.00 H new ATOM 0 HG2 PRO A 139 9.812 -15.813 7.083 1.00 0.00 H new ATOM 0 HG3 PRO A 139 8.093 -15.755 6.750 1.00 0.00 H new ATOM 0 HD2 PRO A 139 9.107 -17.386 8.704 1.00 0.00 H new ATOM 0 HD3 PRO A 139 7.688 -17.850 7.788 1.00 0.00 H new ATOM 2194 N LYS A 140 12.055 -18.282 4.444 1.00 0.00 N ATOM 2195 CA LYS A 140 13.489 -18.118 4.257 1.00 0.00 C ATOM 2196 C LYS A 140 13.956 -16.694 4.510 1.00 0.00 C ATOM 2197 O LYS A 140 13.446 -15.742 3.918 1.00 0.00 O ATOM 2198 CB LYS A 140 13.897 -18.520 2.842 1.00 0.00 C ATOM 2199 CG LYS A 140 15.397 -18.441 2.596 1.00 0.00 C ATOM 2200 CD LYS A 140 15.754 -18.905 1.193 1.00 0.00 C ATOM 2201 CE LYS A 140 17.253 -18.815 0.948 1.00 0.00 C ATOM 2202 NZ LYS A 140 17.614 -19.264 -0.425 1.00 0.00 N ATOM 0 H LYS A 140 11.545 -18.540 3.599 1.00 0.00 H new ATOM 0 HA LYS A 140 13.966 -18.769 4.990 1.00 0.00 H new ATOM 0 HB2 LYS A 140 13.559 -19.538 2.651 1.00 0.00 H new ATOM 0 HB3 LYS A 140 13.385 -17.875 2.128 1.00 0.00 H new ATOM 0 HG2 LYS A 140 15.737 -17.415 2.739 1.00 0.00 H new ATOM 0 HG3 LYS A 140 15.920 -19.056 3.328 1.00 0.00 H new ATOM 0 HD2 LYS A 140 15.421 -19.933 1.051 1.00 0.00 H new ATOM 0 HD3 LYS A 140 15.226 -18.295 0.460 1.00 0.00 H new ATOM 0 HE2 LYS A 140 17.585 -17.787 1.094 1.00 0.00 H new ATOM 0 HE3 LYS A 140 17.779 -19.427 1.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 18.643 -19.189 -0.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 17.320 -20.253 -0.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 17.132 -18.664 -1.124 1.00 0.00 H new ATOM 2216 N LYS A 141 14.934 -16.563 5.397 1.00 0.00 N ATOM 2217 CA LYS A 141 15.516 -15.269 5.716 1.00 0.00 C ATOM 2218 C LYS A 141 16.588 -14.903 4.704 1.00 0.00 C ATOM 2219 O LYS A 141 17.497 -15.693 4.446 1.00 0.00 O ATOM 2220 CB LYS A 141 16.115 -15.270 7.120 1.00 0.00 C ATOM 2221 CG LYS A 141 16.678 -13.922 7.551 1.00 0.00 C ATOM 2222 CD LYS A 141 17.209 -13.974 8.975 1.00 0.00 C ATOM 2223 CE LYS A 141 17.792 -12.633 9.396 1.00 0.00 C ATOM 2224 NZ LYS A 141 18.316 -12.673 10.789 1.00 0.00 N ATOM 0 H LYS A 141 15.342 -17.344 5.911 1.00 0.00 H new ATOM 0 HA LYS A 141 14.719 -14.527 5.677 1.00 0.00 H new ATOM 0 HB2 LYS A 141 15.348 -15.577 7.831 1.00 0.00 H new ATOM 0 HB3 LYS A 141 16.909 -16.016 7.165 1.00 0.00 H new ATOM 0 HG2 LYS A 141 17.478 -13.626 6.873 1.00 0.00 H new ATOM 0 HG3 LYS A 141 15.901 -13.161 7.478 1.00 0.00 H new ATOM 0 HD2 LYS A 141 16.405 -14.253 9.656 1.00 0.00 H new ATOM 0 HD3 LYS A 141 17.974 -14.746 9.052 1.00 0.00 H new ATOM 0 HE2 LYS A 141 18.595 -12.355 8.713 1.00 0.00 H new ATOM 0 HE3 LYS A 141 17.025 -11.862 9.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 18.705 -11.742 11.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 17.544 -12.914 11.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 19.065 -13.391 10.858 1.00 0.00 H new ATOM 2238 N THR A 142 16.459 -13.715 4.120 1.00 0.00 N ATOM 2239 CA THR A 142 17.442 -13.231 3.161 1.00 0.00 C ATOM 2240 C THR A 142 18.779 -12.957 3.815 1.00 0.00 C ATOM 2241 O THR A 142 18.856 -12.551 4.975 1.00 0.00 O ATOM 2242 CB THR A 142 17.011 -11.931 2.465 1.00 0.00 C ATOM 2243 OG1 THR A 142 17.959 -11.622 1.433 1.00 0.00 O ATOM 2244 CG2 THR A 142 16.987 -10.781 3.461 1.00 0.00 C ATOM 0 H THR A 142 15.686 -13.073 4.294 1.00 0.00 H new ATOM 0 HA THR A 142 17.525 -14.032 2.426 1.00 0.00 H new ATOM 0 HB THR A 142 16.014 -12.066 2.046 1.00 0.00 H new ATOM 0 HG1 THR A 142 17.692 -10.794 0.981 1.00 0.00 H new ATOM 0 HG21 THR A 142 16.680 -9.867 2.954 1.00 0.00 H new ATOM 0 HG22 THR A 142 16.281 -11.007 4.261 1.00 0.00 H new ATOM 0 HG23 THR A 142 17.983 -10.645 3.883 1.00 0.00 H new ATOM 2252 N LYS A 143 19.834 -13.163 3.042 1.00 0.00 N ATOM 2253 CA LYS A 143 21.182 -12.901 3.516 1.00 0.00 C ATOM 2254 C LYS A 143 21.625 -11.486 3.146 1.00 0.00 C ATOM 2255 O LYS A 143 22.718 -11.063 3.522 1.00 0.00 O ATOM 2256 CB LYS A 143 22.155 -13.929 2.942 1.00 0.00 C ATOM 2257 CG LYS A 143 21.910 -15.352 3.424 1.00 0.00 C ATOM 2258 CD LYS A 143 22.921 -16.319 2.829 1.00 0.00 C ATOM 2259 CE LYS A 143 22.683 -17.741 3.316 1.00 0.00 C ATOM 2260 NZ LYS A 143 23.646 -18.701 2.712 1.00 0.00 N ATOM 0 H LYS A 143 19.782 -13.511 2.084 1.00 0.00 H new ATOM 0 HA LYS A 143 21.183 -12.985 4.603 1.00 0.00 H new ATOM 0 HB2 LYS A 143 22.089 -13.909 1.854 1.00 0.00 H new ATOM 0 HB3 LYS A 143 23.172 -13.638 3.205 1.00 0.00 H new ATOM 0 HG2 LYS A 143 21.969 -15.385 4.512 1.00 0.00 H new ATOM 0 HG3 LYS A 143 20.902 -15.662 3.150 1.00 0.00 H new ATOM 0 HD2 LYS A 143 22.858 -16.290 1.741 1.00 0.00 H new ATOM 0 HD3 LYS A 143 23.929 -16.005 3.098 1.00 0.00 H new ATOM 0 HE2 LYS A 143 22.771 -17.773 4.402 1.00 0.00 H new ATOM 0 HE3 LYS A 143 21.665 -18.044 3.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 23.451 -19.658 3.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 23.545 -18.690 1.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 24.616 -18.427 2.968 1.00 0.00 H new ATOM 2274 N TRP A 144 20.790 -10.762 2.397 1.00 0.00 N ATOM 2275 CA TRP A 144 21.127 -9.400 2.015 1.00 0.00 C ATOM 2276 C TRP A 144 21.169 -8.447 3.197 1.00 0.00 C ATOM 2277 O TRP A 144 20.204 -8.324 3.952 1.00 0.00 O ATOM 2278 CB TRP A 144 20.128 -8.853 1.001 1.00 0.00 C ATOM 2279 CG TRP A 144 20.473 -7.465 0.550 1.00 0.00 C ATOM 2280 CD1 TRP A 144 21.537 -7.102 -0.220 1.00 0.00 C ATOM 2281 CD2 TRP A 144 19.751 -6.242 0.835 1.00 0.00 C ATOM 2282 NE1 TRP A 144 21.529 -5.746 -0.432 1.00 0.00 N ATOM 2283 CE2 TRP A 144 20.441 -5.203 0.205 1.00 0.00 C ATOM 2284 CE3 TRP A 144 18.589 -5.950 1.560 1.00 0.00 C ATOM 2285 CZ2 TRP A 144 20.014 -3.885 0.276 1.00 0.00 C ATOM 2286 CZ3 TRP A 144 18.158 -4.631 1.626 1.00 0.00 C ATOM 2287 CH2 TRP A 144 18.852 -3.625 0.999 1.00 0.00 C ATOM 0 H TRP A 144 19.890 -11.095 2.050 1.00 0.00 H new ATOM 0 HA TRP A 144 22.124 -9.457 1.579 1.00 0.00 H new ATOM 0 HB2 TRP A 144 20.093 -9.515 0.136 1.00 0.00 H new ATOM 0 HB3 TRP A 144 19.131 -8.852 1.442 1.00 0.00 H new ATOM 0 HD1 TRP A 144 22.280 -7.783 -0.608 1.00 0.00 H new ATOM 0 HE1 TRP A 144 22.219 -5.226 -0.974 1.00 0.00 H new ATOM 0 HE3 TRP A 144 18.039 -6.735 2.058 1.00 0.00 H new ATOM 0 HZ2 TRP A 144 20.561 -3.091 -0.210 1.00 0.00 H new ATOM 0 HZ3 TRP A 144 17.262 -4.392 2.180 1.00 0.00 H new ATOM 0 HH2 TRP A 144 18.489 -2.610 1.068 1.00 0.00 H new ATOM 2298 N TRP A 145 22.299 -7.770 3.342 1.00 0.00 N ATOM 2299 CA TRP A 145 22.462 -6.780 4.390 1.00 0.00 C ATOM 2300 C TRP A 145 21.925 -5.433 3.941 1.00 0.00 C ATOM 2301 O TRP A 145 22.297 -4.938 2.876 1.00 0.00 O ATOM 2302 CB TRP A 145 23.925 -6.641 4.801 1.00 0.00 C ATOM 2303 CG TRP A 145 24.104 -5.597 5.861 1.00 0.00 C ATOM 2304 CD1 TRP A 145 24.681 -4.371 5.714 1.00 0.00 C ATOM 2305 CD2 TRP A 145 23.672 -5.674 7.240 1.00 0.00 C ATOM 2306 NE1 TRP A 145 24.642 -3.686 6.903 1.00 0.00 N ATOM 2307 CE2 TRP A 145 24.026 -4.466 7.846 1.00 0.00 C ATOM 2308 CE3 TRP A 145 23.017 -6.654 7.995 1.00 0.00 C ATOM 2309 CZ2 TRP A 145 23.751 -4.205 9.178 1.00 0.00 C ATOM 2310 CZ3 TRP A 145 22.742 -6.393 9.332 1.00 0.00 C ATOM 2311 CH2 TRP A 145 23.101 -5.201 9.908 1.00 0.00 C ATOM 0 H TRP A 145 23.117 -7.891 2.744 1.00 0.00 H new ATOM 0 HA TRP A 145 21.893 -7.122 5.255 1.00 0.00 H new ATOM 0 HB2 TRP A 145 24.293 -7.599 5.168 1.00 0.00 H new ATOM 0 HB3 TRP A 145 24.525 -6.381 3.929 1.00 0.00 H new ATOM 0 HD1 TRP A 145 25.107 -3.994 4.796 1.00 0.00 H new ATOM 0 HE1 TRP A 145 25.012 -2.748 7.059 1.00 0.00 H new ATOM 0 HE3 TRP A 145 22.731 -7.594 7.547 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 24.029 -3.266 9.634 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 22.238 -7.140 9.927 1.00 0.00 H new ATOM 0 HH2 TRP A 145 22.875 -5.029 10.950 1.00 0.00 H new ATOM 2322 N TYR A 146 21.061 -4.844 4.759 1.00 0.00 N ATOM 2323 CA TYR A 146 20.494 -3.545 4.435 1.00 0.00 C ATOM 2324 C TYR A 146 21.571 -2.479 4.349 1.00 0.00 C ATOM 2325 O TYR A 146 22.394 -2.338 5.252 1.00 0.00 O ATOM 2326 CB TYR A 146 19.438 -3.119 5.451 1.00 0.00 C ATOM 2327 CG TYR A 146 18.885 -1.754 5.101 1.00 0.00 C ATOM 2328 CD1 TYR A 146 18.025 -1.607 4.024 1.00 0.00 C ATOM 2329 CD2 TYR A 146 19.251 -0.645 5.848 1.00 0.00 C ATOM 2330 CE1 TYR A 146 17.542 -0.360 3.686 1.00 0.00 C ATOM 2331 CE2 TYR A 146 18.765 0.605 5.513 1.00 0.00 C ATOM 2332 CZ TYR A 146 17.919 0.749 4.434 1.00 0.00 C ATOM 2333 OH TYR A 146 17.443 1.996 4.095 1.00 0.00 O ATOM 0 H TYR A 146 20.742 -5.242 5.642 1.00 0.00 H new ATOM 0 HA TYR A 146 20.017 -3.648 3.461 1.00 0.00 H new ATOM 0 HB2 TYR A 146 18.630 -3.850 5.473 1.00 0.00 H new ATOM 0 HB3 TYR A 146 19.874 -3.096 6.450 1.00 0.00 H new ATOM 0 HD1 TYR A 146 17.732 -2.472 3.447 1.00 0.00 H new ATOM 0 HD2 TYR A 146 19.916 -0.758 6.692 1.00 0.00 H new ATOM 0 HE1 TYR A 146 16.874 -0.246 2.845 1.00 0.00 H new ATOM 0 HE2 TYR A 146 19.048 1.469 6.096 1.00 0.00 H new ATOM 0 HH TYR A 146 17.800 2.663 4.718 1.00 0.00 H new ATOM 2343 N HIS A 147 21.531 -1.714 3.263 1.00 0.00 N ATOM 2344 CA HIS A 147 22.512 -0.672 2.995 1.00 0.00 C ATOM 2345 C HIS A 147 22.673 0.340 4.117 1.00 0.00 C ATOM 2346 O HIS A 147 21.724 1.015 4.516 1.00 0.00 O ATOM 2347 CB HIS A 147 22.138 0.079 1.719 1.00 0.00 C ATOM 2348 CG HIS A 147 23.156 1.109 1.344 1.00 0.00 C ATOM 2349 ND1 HIS A 147 24.426 0.784 0.920 1.00 0.00 N ATOM 2350 CD2 HIS A 147 23.087 2.461 1.330 1.00 0.00 C ATOM 2351 CE1 HIS A 147 25.097 1.894 0.665 1.00 0.00 C ATOM 2352 NE2 HIS A 147 24.307 2.924 0.905 1.00 0.00 N ATOM 0 H HIS A 147 20.814 -1.801 2.542 1.00 0.00 H new ATOM 0 HA HIS A 147 23.465 -1.191 2.893 1.00 0.00 H new ATOM 0 HB2 HIS A 147 22.027 -0.633 0.901 1.00 0.00 H new ATOM 0 HB3 HIS A 147 21.170 0.561 1.855 1.00 0.00 H new ATOM 0 HD2 HIS A 147 22.232 3.062 1.602 1.00 0.00 H new ATOM 0 HE1 HIS A 147 26.119 1.949 0.319 1.00 0.00 H new ATOM 0 HE2 HIS A 147 24.562 3.905 0.793 1.00 0.00 H new ATOM 2360 N ASP A 148 23.908 0.443 4.596 1.00 0.00 N ATOM 2361 CA ASP A 148 24.278 1.327 5.690 1.00 0.00 C ATOM 2362 C ASP A 148 24.082 2.799 5.352 1.00 0.00 C ATOM 2363 O ASP A 148 24.303 3.228 4.219 1.00 0.00 O ATOM 2364 CB ASP A 148 25.741 1.097 6.072 1.00 0.00 C ATOM 2365 CG ASP A 148 25.994 -0.252 6.736 1.00 0.00 C ATOM 2366 OD1 ASP A 148 25.053 -0.919 7.096 1.00 0.00 O ATOM 2367 OD2 ASP A 148 27.140 -0.604 6.878 1.00 0.00 O ATOM 0 H ASP A 148 24.692 -0.096 4.227 1.00 0.00 H new ATOM 0 HA ASP A 148 23.618 1.087 6.524 1.00 0.00 H new ATOM 0 HB2 ASP A 148 26.358 1.173 5.177 1.00 0.00 H new ATOM 0 HB3 ASP A 148 26.060 1.891 6.747 1.00 0.00 H new ATOM 2372 N ASP A 149 23.684 3.568 6.360 1.00 0.00 N ATOM 2373 CA ASP A 149 23.451 4.995 6.203 1.00 0.00 C ATOM 2374 C ASP A 149 24.735 5.743 5.877 1.00 0.00 C ATOM 2375 O ASP A 149 25.796 5.455 6.432 1.00 0.00 O ATOM 2376 CB ASP A 149 22.828 5.568 7.475 1.00 0.00 C ATOM 2377 CG ASP A 149 21.389 5.116 7.677 1.00 0.00 C ATOM 2378 OD1 ASP A 149 20.812 4.605 6.747 1.00 0.00 O ATOM 2379 OD2 ASP A 149 20.881 5.284 8.759 1.00 0.00 O ATOM 0 H ASP A 149 23.515 3.220 7.304 1.00 0.00 H new ATOM 0 HA ASP A 149 22.764 5.127 5.367 1.00 0.00 H new ATOM 0 HB2 ASP A 149 23.424 5.265 8.336 1.00 0.00 H new ATOM 0 HB3 ASP A 149 22.860 6.657 7.432 1.00 0.00 H new ATOM 2384 N THR A 150 24.616 6.719 4.983 1.00 0.00 N ATOM 2385 CA THR A 150 25.748 7.530 4.557 1.00 0.00 C ATOM 2386 C THR A 150 25.739 8.919 5.192 1.00 0.00 C ATOM 2387 O THR A 150 26.768 9.595 5.219 1.00 0.00 O ATOM 2388 CB THR A 150 25.751 7.679 3.026 1.00 0.00 C ATOM 2389 OG1 THR A 150 24.557 8.355 2.610 1.00 0.00 O ATOM 2390 CG2 THR A 150 25.802 6.305 2.372 1.00 0.00 C ATOM 0 H THR A 150 23.734 6.969 4.535 1.00 0.00 H new ATOM 0 HA THR A 150 26.648 7.012 4.888 1.00 0.00 H new ATOM 0 HB THR A 150 26.626 8.255 2.725 1.00 0.00 H new ATOM 0 HG1 THR A 150 24.559 8.452 1.635 1.00 0.00 H new ATOM 0 HG21 THR A 150 25.804 6.418 1.288 1.00 0.00 H new ATOM 0 HG22 THR A 150 26.709 5.787 2.684 1.00 0.00 H new ATOM 0 HG23 THR A 150 24.930 5.725 2.675 1.00 0.00 H new ATOM 2398 N CYS A 151 24.578 9.345 5.688 1.00 0.00 N ATOM 2399 CA CYS A 151 24.433 10.650 6.326 1.00 0.00 C ATOM 2400 C CYS A 151 23.981 10.528 7.778 1.00 0.00 C ATOM 2401 O CYS A 151 24.802 10.612 8.692 1.00 0.00 O ATOM 2402 CB CYS A 151 23.426 11.507 5.558 1.00 0.00 C ATOM 2403 SG CYS A 151 23.905 11.856 3.849 1.00 0.00 S ATOM 2404 OXT CYS A 151 22.784 10.654 8.032 1.00 0.00 O ATOM 0 H CYS A 151 23.717 8.798 5.659 1.00 0.00 H new ATOM 0 HA CYS A 151 25.414 11.124 6.312 1.00 0.00 H new ATOM 0 HB2 CYS A 151 22.461 11.001 5.557 1.00 0.00 H new ATOM 0 HB3 CYS A 151 23.291 12.451 6.086 1.00 0.00 H new ATOM 0 HG CYS A 151 22.990 12.584 3.282 1.00 0.00 H new TER 2410 CYS A 151