USER MOD reduce.3.24.130724 H: found=0, std=0, add=949, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 947 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 113 SER OG : rot -114:sc= -3.82! USER MOD Set 1.2: A 116 HIS : no HE2:sc= -15.7! C(o=-19!,f=-26!) USER MOD Set 2.1: A 31 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 108 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 88 TYR OH : rot 180:sc= -0.0203 USER MOD Set 3.2: A 90 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 72 SER OG : rot 80:sc= -0.0773 USER MOD Set 4.2: A 75 THR OG1 : rot -89:sc= -2.01! USER MOD Set 5.1: A 55 HIS : no HD1:sc= -10.9! C(o=-14!,f=-15!) USER MOD Set 5.2: A 57 GLN : amide:sc= -3.38! C(o=-14!,f=-20!) USER MOD Single : A 26 LYS NZ :NH3+ -159:sc= -3.38! (180deg=-4.84!) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 CYS SG : rot 46:sc= 1.04 USER MOD Single : A 35 HIS : no HE2:sc= -6.56! C(o=-6.6!,f=-11!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot -7:sc= -4.46! USER MOD Single : A 52 SER OG : rot -62:sc= 1.16 USER MOD Single : A 54 GLN :FLIP amide:sc= -0.228! C(o=-4.9!,f=-0.23!) USER MOD Single : A 59 GLN : amide:sc= -3.13 X(o=-3.1,f=-3.2!) USER MOD Single : A 61 SER OG : rot -64:sc= 1.06 USER MOD Single : A 64 SER OG : rot 81:sc= 1.13 USER MOD Single : A 69 TYR OH : rot -35:sc= 0.364 USER MOD Single : A 71 LYS NZ :NH3+ -151:sc= -2.87! (180deg=-3.82!) USER MOD Single : A 73 THR OG1 : rot -173:sc= -2.42! USER MOD Single : A 77 GLN : amide:sc= -0.229 K(o=-0.23,f=-2.7!) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 MET CE :methyl -110:sc= -2.9 (180deg=-6.45!) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0.14 USER MOD Single : A 91 GLN : amide:sc= -0.731 X(o=-0.73,f=-1) USER MOD Single : A 92 THR OG1 : rot 41:sc= 0.952 USER MOD Single : A 94 ASN :FLIP amide:sc= -0.572 F(o=-4.1!,f=-0.57) USER MOD Single : A 97 CYS SG : rot -49:sc= -2.01 USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 HIS : no HE2:sc= -4.67! C(o=-4.7!,f=-4.3!) USER MOD Single : A 109 ASN : amide:sc= -3.64! C(o=-3.6!,f=-5.5!) USER MOD Single : A 110 THR OG1 : rot 36:sc= -0.703 USER MOD Single : A 111 TYR OH : rot 15:sc= -4.4! USER MOD Single : A 114 LYS NZ :NH3+ -155:sc= -0.115 (180deg=-0.999) USER MOD Single : A 115 LYS NZ :NH3+ 153:sc= -0.0586 (180deg=-0.405) USER MOD Single : A 119 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0298) USER MOD Single : A 120 ASN :FLIP amide:sc= -0.0974 F(o=-0.79,f=-0.097) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 ASN : amide:sc= -0.014 X(o=-0.014,f=0) USER MOD Single : A 130 SER OG : rot 65:sc= 0.765 USER MOD Single : A 131 CYS SG : rot 150:sc= -5.18! USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot -155:sc= 1.16 USER MOD Single : A 138 HIS : no HD1:sc= -8.82! C(o=-8.8!,f=-11!) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 37 N LYS A 26 -8.463 -6.023 8.818 1.00 0.00 N ATOM 38 CA LYS A 26 -7.558 -6.334 7.724 1.00 0.00 C ATOM 39 C LYS A 26 -6.171 -5.772 8.041 1.00 0.00 C ATOM 40 O LYS A 26 -6.049 -4.656 8.544 1.00 0.00 O ATOM 41 CB LYS A 26 -8.133 -5.839 6.395 1.00 0.00 C ATOM 42 CG LYS A 26 -7.046 -5.763 5.322 1.00 0.00 C ATOM 43 CD LYS A 26 -6.441 -7.143 5.055 1.00 0.00 C ATOM 44 CE LYS A 26 -4.949 -7.036 4.736 1.00 0.00 C ATOM 45 NZ LYS A 26 -4.722 -7.141 3.277 1.00 0.00 N ATOM 0 HA LYS A 26 -7.449 -7.413 7.615 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -8.927 -6.509 6.066 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -8.582 -4.856 6.533 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -7.468 -5.362 4.400 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -6.263 -5.074 5.640 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -6.585 -7.782 5.926 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -6.961 -7.617 4.223 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -4.560 -6.086 5.103 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -4.403 -7.825 5.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -3.737 -7.422 3.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -5.363 -7.855 2.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -4.906 -6.220 2.830 1.00 0.00 H new ATOM 59 N LEU A 27 -5.160 -6.572 7.734 1.00 0.00 N ATOM 60 CA LEU A 27 -3.786 -6.169 7.979 1.00 0.00 C ATOM 61 C LEU A 27 -2.885 -6.750 6.888 1.00 0.00 C ATOM 62 O LEU A 27 -2.792 -7.968 6.738 1.00 0.00 O ATOM 63 CB LEU A 27 -3.360 -6.553 9.398 1.00 0.00 C ATOM 64 CG LEU A 27 -2.523 -7.828 9.524 1.00 0.00 C ATOM 65 CD1 LEU A 27 -1.076 -7.580 9.094 1.00 0.00 C ATOM 66 CD2 LEU A 27 -2.610 -8.403 10.940 1.00 0.00 C ATOM 0 H LEU A 27 -5.265 -7.497 7.318 1.00 0.00 H new ATOM 0 HA LEU A 27 -3.692 -5.084 7.925 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -2.792 -5.725 9.822 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -4.257 -6.669 10.007 1.00 0.00 H new ATOM 0 HG LEU A 27 -2.936 -8.575 8.846 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.504 -8.502 9.194 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -1.056 -7.251 8.055 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -0.635 -6.810 9.727 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -2.006 -9.308 11.003 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -2.238 -7.669 11.654 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -3.648 -8.642 11.173 1.00 0.00 H new ATOM 78 N LEU A 28 -2.245 -5.853 6.153 1.00 0.00 N ATOM 79 CA LEU A 28 -1.355 -6.262 5.080 1.00 0.00 C ATOM 80 C LEU A 28 0.002 -6.652 5.669 1.00 0.00 C ATOM 81 O LEU A 28 0.299 -6.331 6.818 1.00 0.00 O ATOM 82 CB LEU A 28 -1.271 -5.172 4.009 1.00 0.00 C ATOM 83 CG LEU A 28 -1.627 -5.602 2.585 1.00 0.00 C ATOM 84 CD1 LEU A 28 -1.448 -4.443 1.602 1.00 0.00 C ATOM 85 CD2 LEU A 28 -0.825 -6.836 2.168 1.00 0.00 C ATOM 0 H LEU A 28 -2.325 -4.844 6.279 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.748 -7.144 4.574 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.933 -4.356 4.297 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -0.257 -4.773 4.004 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.680 -5.881 2.566 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.708 -4.775 0.597 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -2.098 -3.617 1.891 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -0.410 -4.110 1.617 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -1.097 -7.121 1.152 1.00 0.00 H new ATOM 0 HD22 LEU A 28 0.240 -6.608 2.208 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -1.046 -7.660 2.847 1.00 0.00 H new ATOM 97 N TYR A 29 0.790 -7.338 4.854 1.00 0.00 N ATOM 98 CA TYR A 29 2.108 -7.775 5.280 1.00 0.00 C ATOM 99 C TYR A 29 3.135 -7.591 4.160 1.00 0.00 C ATOM 100 O TYR A 29 2.847 -7.869 2.997 1.00 0.00 O ATOM 101 CB TYR A 29 1.977 -9.266 5.595 1.00 0.00 C ATOM 102 CG TYR A 29 3.308 -9.958 5.898 1.00 0.00 C ATOM 103 CD1 TYR A 29 4.167 -9.421 6.834 1.00 0.00 C ATOM 104 CD2 TYR A 29 3.648 -11.120 5.235 1.00 0.00 C ATOM 105 CE1 TYR A 29 5.419 -10.072 7.120 1.00 0.00 C ATOM 106 CE2 TYR A 29 4.901 -11.770 5.520 1.00 0.00 C ATOM 107 CZ TYR A 29 5.724 -11.214 6.448 1.00 0.00 C ATOM 108 OH TYR A 29 6.907 -11.829 6.718 1.00 0.00 O ATOM 0 H TYR A 29 0.541 -7.602 3.901 1.00 0.00 H new ATOM 0 HA TYR A 29 2.446 -7.195 6.139 1.00 0.00 H new ATOM 0 HB2 TYR A 29 1.312 -9.389 6.450 1.00 0.00 H new ATOM 0 HB3 TYR A 29 1.504 -9.765 4.749 1.00 0.00 H new ATOM 0 HD1 TYR A 29 3.900 -8.512 7.353 1.00 0.00 H new ATOM 0 HD2 TYR A 29 2.975 -11.541 4.503 1.00 0.00 H new ATOM 0 HE1 TYR A 29 6.100 -9.663 7.851 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.181 -12.679 5.008 1.00 0.00 H new ATOM 0 HH TYR A 29 6.991 -12.634 6.165 1.00 0.00 H new ATOM 118 N CYS A 30 4.312 -7.124 4.551 1.00 0.00 N ATOM 119 CA CYS A 30 5.383 -6.900 3.595 1.00 0.00 C ATOM 120 C CYS A 30 6.222 -8.176 3.506 1.00 0.00 C ATOM 121 O CYS A 30 6.536 -8.790 4.524 1.00 0.00 O ATOM 122 CB CYS A 30 6.232 -5.684 3.972 1.00 0.00 C ATOM 123 SG CYS A 30 6.576 -4.675 2.484 1.00 0.00 S ATOM 0 H CYS A 30 4.547 -6.895 5.517 1.00 0.00 H new ATOM 0 HA CYS A 30 4.959 -6.676 2.616 1.00 0.00 H new ATOM 0 HB2 CYS A 30 5.710 -5.083 4.717 1.00 0.00 H new ATOM 0 HB3 CYS A 30 7.168 -6.010 4.425 1.00 0.00 H new ATOM 0 HG CYS A 30 5.480 -4.519 1.803 1.00 0.00 H new ATOM 129 N SER A 31 6.561 -8.538 2.277 1.00 0.00 N ATOM 130 CA SER A 31 7.358 -9.730 2.041 1.00 0.00 C ATOM 131 C SER A 31 8.760 -9.547 2.626 1.00 0.00 C ATOM 132 O SER A 31 9.086 -10.128 3.659 1.00 0.00 O ATOM 133 CB SER A 31 7.443 -10.048 0.547 1.00 0.00 C ATOM 134 OG SER A 31 8.175 -11.245 0.297 1.00 0.00 O ATOM 0 H SER A 31 6.298 -8.027 1.434 1.00 0.00 H new ATOM 0 HA SER A 31 6.872 -10.570 2.537 1.00 0.00 H new ATOM 0 HB2 SER A 31 6.437 -10.146 0.139 1.00 0.00 H new ATOM 0 HB3 SER A 31 7.918 -9.217 0.026 1.00 0.00 H new ATOM 0 HG SER A 31 8.205 -11.414 -0.668 1.00 0.00 H new ATOM 168 N HIS A 35 8.110 -6.016 7.051 1.00 0.00 N ATOM 169 CA HIS A 35 7.426 -4.789 7.423 1.00 0.00 C ATOM 170 C HIS A 35 5.915 -4.976 7.268 1.00 0.00 C ATOM 171 O HIS A 35 5.465 -5.965 6.692 1.00 0.00 O ATOM 172 CB HIS A 35 7.962 -3.603 6.619 1.00 0.00 C ATOM 173 CG HIS A 35 9.337 -3.145 7.043 1.00 0.00 C ATOM 174 ND1 HIS A 35 10.453 -3.961 6.975 1.00 0.00 N ATOM 175 CD2 HIS A 35 9.764 -1.949 7.539 1.00 0.00 C ATOM 176 CE1 HIS A 35 11.499 -3.276 7.414 1.00 0.00 C ATOM 177 NE2 HIS A 35 11.070 -2.030 7.764 1.00 0.00 N ATOM 0 HA HIS A 35 7.623 -4.562 8.471 1.00 0.00 H new ATOM 0 HB2 HIS A 35 7.990 -3.875 5.564 1.00 0.00 H new ATOM 0 HB3 HIS A 35 7.267 -2.769 6.714 1.00 0.00 H new ATOM 0 HD1 HIS A 35 10.468 -4.925 6.643 1.00 0.00 H new ATOM 0 HD2 HIS A 35 9.145 -1.083 7.718 1.00 0.00 H new ATOM 0 HE1 HIS A 35 12.513 -3.641 7.483 1.00 0.00 H new ATOM 185 N PHE A 36 5.175 -4.011 7.792 1.00 0.00 N ATOM 186 CA PHE A 36 3.724 -4.056 7.719 1.00 0.00 C ATOM 187 C PHE A 36 3.145 -2.666 7.451 1.00 0.00 C ATOM 188 O PHE A 36 3.109 -1.822 8.345 1.00 0.00 O ATOM 189 CB PHE A 36 3.224 -4.552 9.077 1.00 0.00 C ATOM 190 CG PHE A 36 3.412 -6.054 9.300 1.00 0.00 C ATOM 191 CD1 PHE A 36 4.631 -6.541 9.655 1.00 0.00 C ATOM 192 CD2 PHE A 36 2.361 -6.902 9.142 1.00 0.00 C ATOM 193 CE1 PHE A 36 4.806 -7.934 9.862 1.00 0.00 C ATOM 194 CE2 PHE A 36 2.536 -8.296 9.349 1.00 0.00 C ATOM 195 CZ PHE A 36 3.754 -8.783 9.705 1.00 0.00 C ATOM 0 H PHE A 36 5.553 -3.192 8.269 1.00 0.00 H new ATOM 0 HA PHE A 36 3.412 -4.712 6.906 1.00 0.00 H new ATOM 0 HB2 PHE A 36 3.747 -4.010 9.865 1.00 0.00 H new ATOM 0 HB3 PHE A 36 2.165 -4.311 9.173 1.00 0.00 H new ATOM 0 HD1 PHE A 36 5.466 -5.868 9.779 1.00 0.00 H new ATOM 0 HD2 PHE A 36 1.393 -6.515 8.859 1.00 0.00 H new ATOM 0 HE1 PHE A 36 5.774 -8.320 10.144 1.00 0.00 H new ATOM 0 HE2 PHE A 36 1.701 -8.969 9.224 1.00 0.00 H new ATOM 0 HZ PHE A 36 3.887 -9.843 9.863 1.00 0.00 H new ATOM 205 N LEU A 37 2.706 -2.471 6.216 1.00 0.00 N ATOM 206 CA LEU A 37 2.130 -1.197 5.819 1.00 0.00 C ATOM 207 C LEU A 37 1.357 -0.602 6.998 1.00 0.00 C ATOM 208 O LEU A 37 0.714 -1.330 7.754 1.00 0.00 O ATOM 209 CB LEU A 37 1.288 -1.361 4.552 1.00 0.00 C ATOM 210 CG LEU A 37 1.725 -0.531 3.344 1.00 0.00 C ATOM 211 CD1 LEU A 37 0.827 -0.805 2.136 1.00 0.00 C ATOM 212 CD2 LEU A 37 1.778 0.958 3.692 1.00 0.00 C ATOM 0 H LEU A 37 2.738 -3.174 5.477 1.00 0.00 H new ATOM 0 HA LEU A 37 2.916 -0.487 5.562 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.297 -2.413 4.267 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.256 -1.104 4.790 1.00 0.00 H new ATOM 0 HG LEU A 37 2.735 -0.834 3.069 1.00 0.00 H new ATOM 0 HD11 LEU A 37 1.160 -0.202 1.291 1.00 0.00 H new ATOM 0 HD12 LEU A 37 0.884 -1.861 1.873 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.203 -0.547 2.382 1.00 0.00 H new ATOM 0 HD21 LEU A 37 2.091 1.526 2.816 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.790 1.293 4.007 1.00 0.00 H new ATOM 0 HD23 LEU A 37 2.490 1.117 4.501 1.00 0.00 H new ATOM 224 N ARG A 38 1.445 0.714 7.119 1.00 0.00 N ATOM 225 CA ARG A 38 0.762 1.415 8.193 1.00 0.00 C ATOM 226 C ARG A 38 0.271 2.780 7.708 1.00 0.00 C ATOM 227 O ARG A 38 0.771 3.307 6.716 1.00 0.00 O ATOM 228 CB ARG A 38 1.686 1.611 9.397 1.00 0.00 C ATOM 229 CG ARG A 38 2.857 2.530 9.045 1.00 0.00 C ATOM 230 CD ARG A 38 3.463 3.153 10.305 1.00 0.00 C ATOM 231 NE ARG A 38 3.577 2.132 11.370 1.00 0.00 N ATOM 232 CZ ARG A 38 4.112 2.362 12.576 1.00 0.00 C ATOM 233 NH1 ARG A 38 4.586 3.578 12.879 1.00 0.00 N ATOM 234 NH2 ARG A 38 4.174 1.375 13.481 1.00 0.00 N ATOM 0 H ARG A 38 1.979 1.314 6.491 1.00 0.00 H new ATOM 0 HA ARG A 38 -0.089 0.806 8.498 1.00 0.00 H new ATOM 0 HB2 ARG A 38 1.122 2.036 10.227 1.00 0.00 H new ATOM 0 HB3 ARG A 38 2.065 0.645 9.730 1.00 0.00 H new ATOM 0 HG2 ARG A 38 3.621 1.964 8.511 1.00 0.00 H new ATOM 0 HG3 ARG A 38 2.516 3.318 8.373 1.00 0.00 H new ATOM 0 HD2 ARG A 38 4.446 3.566 10.079 1.00 0.00 H new ATOM 0 HD3 ARG A 38 2.840 3.980 10.647 1.00 0.00 H new ATOM 0 HE ARG A 38 3.226 1.195 11.173 1.00 0.00 H new ATOM 0 HH11 ARG A 38 4.540 4.329 12.191 1.00 0.00 H new ATOM 0 HH12 ARG A 38 4.993 3.752 13.798 1.00 0.00 H new ATOM 0 HH21 ARG A 38 3.814 0.449 13.251 1.00 0.00 H new ATOM 0 HH22 ARG A 38 4.581 1.550 14.400 1.00 0.00 H new ATOM 248 N ILE A 39 -0.704 3.313 8.430 1.00 0.00 N ATOM 249 CA ILE A 39 -1.268 4.607 8.086 1.00 0.00 C ATOM 250 C ILE A 39 -1.703 5.326 9.365 1.00 0.00 C ATOM 251 O ILE A 39 -2.043 4.683 10.357 1.00 0.00 O ATOM 252 CB ILE A 39 -2.391 4.445 7.059 1.00 0.00 C ATOM 253 CG1 ILE A 39 -2.357 5.574 6.027 1.00 0.00 C ATOM 254 CG2 ILE A 39 -3.753 4.340 7.749 1.00 0.00 C ATOM 255 CD1 ILE A 39 -2.546 5.027 4.610 1.00 0.00 C ATOM 0 H ILE A 39 -1.118 2.872 9.252 1.00 0.00 H new ATOM 0 HA ILE A 39 -0.517 5.235 7.607 1.00 0.00 H new ATOM 0 HB ILE A 39 -2.230 3.511 6.520 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -3.141 6.298 6.249 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -1.406 6.103 6.093 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -4.534 4.226 6.997 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -3.759 3.475 8.413 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -3.938 5.244 8.329 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -2.518 5.850 3.896 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -1.747 4.322 4.383 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -3.508 4.520 4.541 1.00 0.00 H new ATOM 267 N LEU A 40 -1.678 6.649 9.300 1.00 0.00 N ATOM 268 CA LEU A 40 -2.065 7.461 10.440 1.00 0.00 C ATOM 269 C LEU A 40 -3.402 8.144 10.144 1.00 0.00 C ATOM 270 O LEU A 40 -3.659 8.549 9.011 1.00 0.00 O ATOM 271 CB LEU A 40 -0.945 8.436 10.808 1.00 0.00 C ATOM 272 CG LEU A 40 0.437 7.818 11.029 1.00 0.00 C ATOM 273 CD1 LEU A 40 0.319 6.406 11.606 1.00 0.00 C ATOM 274 CD2 LEU A 40 1.261 7.844 9.741 1.00 0.00 C ATOM 0 H LEU A 40 -1.396 7.179 8.475 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.214 6.835 11.320 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.865 9.182 10.017 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.234 8.964 11.716 1.00 0.00 H new ATOM 0 HG LEU A 40 0.969 8.423 11.763 1.00 0.00 H new ATOM 0 HD11 LEU A 40 1.315 5.989 11.754 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -0.203 6.446 12.562 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.239 5.776 10.914 1.00 0.00 H new ATOM 0 HD21 LEU A 40 2.239 7.399 9.926 1.00 0.00 H new ATOM 0 HD22 LEU A 40 0.744 7.277 8.967 1.00 0.00 H new ATOM 0 HD23 LEU A 40 1.388 8.875 9.411 1.00 0.00 H new ATOM 286 N PRO A 41 -4.240 8.253 11.209 1.00 0.00 N ATOM 287 CA PRO A 41 -5.545 8.880 11.075 1.00 0.00 C ATOM 288 C PRO A 41 -5.414 10.401 10.977 1.00 0.00 C ATOM 289 O PRO A 41 -6.417 11.112 10.933 1.00 0.00 O ATOM 290 CB PRO A 41 -6.326 8.428 12.297 1.00 0.00 C ATOM 291 CG PRO A 41 -5.290 7.948 13.301 1.00 0.00 C ATOM 292 CD PRO A 41 -3.970 7.785 12.566 1.00 0.00 C ATOM 0 HA PRO A 41 -6.060 8.588 10.160 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -6.917 9.247 12.707 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -7.022 7.629 12.042 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -5.187 8.665 14.116 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -5.599 7.002 13.746 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -3.180 8.370 13.037 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -3.641 6.746 12.568 1.00 0.00 H new ATOM 300 N ASP A 42 -4.170 10.856 10.947 1.00 0.00 N ATOM 301 CA ASP A 42 -3.896 12.280 10.855 1.00 0.00 C ATOM 302 C ASP A 42 -3.824 12.688 9.382 1.00 0.00 C ATOM 303 O ASP A 42 -4.449 13.665 8.974 1.00 0.00 O ATOM 304 CB ASP A 42 -2.556 12.626 11.507 1.00 0.00 C ATOM 305 CG ASP A 42 -2.518 13.971 12.235 1.00 0.00 C ATOM 306 OD1 ASP A 42 -2.278 14.984 11.544 1.00 0.00 O ATOM 307 OD2 ASP A 42 -2.731 13.956 13.467 1.00 0.00 O ATOM 0 H ASP A 42 -3.341 10.264 10.985 1.00 0.00 H new ATOM 0 HA ASP A 42 -4.696 12.811 11.371 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -2.301 11.839 12.216 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -1.784 12.625 10.738 1.00 0.00 H new ATOM 312 N GLY A 43 -3.057 11.917 8.625 1.00 0.00 N ATOM 313 CA GLY A 43 -2.896 12.186 7.206 1.00 0.00 C ATOM 314 C GLY A 43 -1.488 11.816 6.734 1.00 0.00 C ATOM 315 O GLY A 43 -0.852 12.579 6.008 1.00 0.00 O ATOM 0 H GLY A 43 -2.541 11.107 8.967 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -3.634 11.619 6.639 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -3.084 13.241 7.009 1.00 0.00 H new ATOM 319 N THR A 44 -1.042 10.646 7.167 1.00 0.00 N ATOM 320 CA THR A 44 0.279 10.165 6.798 1.00 0.00 C ATOM 321 C THR A 44 0.254 8.651 6.582 1.00 0.00 C ATOM 322 O THR A 44 -0.704 7.981 6.965 1.00 0.00 O ATOM 323 CB THR A 44 1.263 10.609 7.882 1.00 0.00 C ATOM 324 OG1 THR A 44 1.584 11.952 7.531 1.00 0.00 O ATOM 325 CG2 THR A 44 2.600 9.871 7.796 1.00 0.00 C ATOM 0 H THR A 44 -1.572 10.017 7.770 1.00 0.00 H new ATOM 0 HA THR A 44 0.605 10.591 5.849 1.00 0.00 H new ATOM 0 HB THR A 44 0.820 10.444 8.864 1.00 0.00 H new ATOM 0 HG1 THR A 44 2.217 12.318 8.184 1.00 0.00 H new ATOM 0 HG21 THR A 44 3.262 10.223 8.587 1.00 0.00 H new ATOM 0 HG22 THR A 44 2.433 8.800 7.913 1.00 0.00 H new ATOM 0 HG23 THR A 44 3.060 10.063 6.826 1.00 0.00 H new ATOM 333 N VAL A 45 1.320 8.156 5.969 1.00 0.00 N ATOM 334 CA VAL A 45 1.433 6.733 5.698 1.00 0.00 C ATOM 335 C VAL A 45 2.890 6.300 5.867 1.00 0.00 C ATOM 336 O VAL A 45 3.791 7.137 5.893 1.00 0.00 O ATOM 337 CB VAL A 45 0.873 6.419 4.309 1.00 0.00 C ATOM 338 CG1 VAL A 45 0.287 5.006 4.260 1.00 0.00 C ATOM 339 CG2 VAL A 45 -0.168 7.459 3.889 1.00 0.00 C ATOM 0 H VAL A 45 2.112 8.715 5.653 1.00 0.00 H new ATOM 0 HA VAL A 45 0.839 6.160 6.410 1.00 0.00 H new ATOM 0 HB VAL A 45 1.698 6.464 3.598 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -0.104 4.809 3.262 1.00 0.00 H new ATOM 0 HG12 VAL A 45 1.066 4.281 4.494 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -0.519 4.921 4.989 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -0.550 7.212 2.898 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -0.990 7.461 4.605 1.00 0.00 H new ATOM 0 HG23 VAL A 45 0.293 8.446 3.864 1.00 0.00 H new ATOM 349 N ASP A 46 3.077 4.993 5.977 1.00 0.00 N ATOM 350 CA ASP A 46 4.410 4.438 6.143 1.00 0.00 C ATOM 351 C ASP A 46 4.302 2.940 6.434 1.00 0.00 C ATOM 352 O ASP A 46 3.220 2.363 6.341 1.00 0.00 O ATOM 353 CB ASP A 46 5.138 5.097 7.317 1.00 0.00 C ATOM 354 CG ASP A 46 4.251 5.933 8.241 1.00 0.00 C ATOM 355 OD1 ASP A 46 3.142 5.448 8.555 1.00 0.00 O ATOM 356 OD2 ASP A 46 4.702 7.038 8.614 1.00 0.00 O ATOM 0 H ASP A 46 2.327 4.302 5.954 1.00 0.00 H new ATOM 0 HA ASP A 46 4.968 4.620 5.224 1.00 0.00 H new ATOM 0 HB2 ASP A 46 5.621 4.319 7.908 1.00 0.00 H new ATOM 0 HB3 ASP A 46 5.929 5.735 6.923 1.00 0.00 H new ATOM 361 N GLY A 47 5.439 2.354 6.781 1.00 0.00 N ATOM 362 CA GLY A 47 5.486 0.934 7.087 1.00 0.00 C ATOM 363 C GLY A 47 6.141 0.688 8.447 1.00 0.00 C ATOM 364 O GLY A 47 6.594 1.626 9.101 1.00 0.00 O ATOM 0 H GLY A 47 6.334 2.837 6.857 1.00 0.00 H new ATOM 0 HA2 GLY A 47 4.476 0.525 7.086 1.00 0.00 H new ATOM 0 HA3 GLY A 47 6.043 0.409 6.311 1.00 0.00 H new ATOM 368 N THR A 48 6.170 -0.580 8.833 1.00 0.00 N ATOM 369 CA THR A 48 6.762 -0.961 10.104 1.00 0.00 C ATOM 370 C THR A 48 7.249 -2.411 10.051 1.00 0.00 C ATOM 371 O THR A 48 6.471 -3.321 9.768 1.00 0.00 O ATOM 372 CB THR A 48 5.728 -0.707 11.202 1.00 0.00 C ATOM 373 OG1 THR A 48 5.604 0.712 11.241 1.00 0.00 O ATOM 374 CG2 THR A 48 6.250 -1.074 12.593 1.00 0.00 C ATOM 0 H THR A 48 5.793 -1.356 8.288 1.00 0.00 H new ATOM 0 HA THR A 48 7.645 -0.362 10.325 1.00 0.00 H new ATOM 0 HB THR A 48 4.825 -1.280 10.990 1.00 0.00 H new ATOM 0 HG1 THR A 48 6.283 1.116 10.661 1.00 0.00 H new ATOM 0 HG21 THR A 48 5.478 -0.875 13.336 1.00 0.00 H new ATOM 0 HG22 THR A 48 6.511 -2.132 12.616 1.00 0.00 H new ATOM 0 HG23 THR A 48 7.133 -0.477 12.819 1.00 0.00 H new ATOM 382 N ARG A 49 8.534 -2.581 10.328 1.00 0.00 N ATOM 383 CA ARG A 49 9.133 -3.904 10.315 1.00 0.00 C ATOM 384 C ARG A 49 8.130 -4.946 10.813 1.00 0.00 C ATOM 385 O ARG A 49 8.051 -6.047 10.269 1.00 0.00 O ATOM 386 CB ARG A 49 10.384 -3.950 11.195 1.00 0.00 C ATOM 387 CG ARG A 49 11.407 -4.945 10.643 1.00 0.00 C ATOM 388 CD ARG A 49 11.212 -6.331 11.262 1.00 0.00 C ATOM 389 NE ARG A 49 12.527 -6.943 11.556 1.00 0.00 N ATOM 390 CZ ARG A 49 12.734 -8.262 11.669 1.00 0.00 C ATOM 391 NH1 ARG A 49 11.712 -9.116 11.514 1.00 0.00 N ATOM 392 NH2 ARG A 49 13.961 -8.728 11.938 1.00 0.00 N ATOM 0 H ARG A 49 9.176 -1.824 10.563 1.00 0.00 H new ATOM 0 HA ARG A 49 9.416 -4.130 9.287 1.00 0.00 H new ATOM 0 HB2 ARG A 49 10.830 -2.957 11.251 1.00 0.00 H new ATOM 0 HB3 ARG A 49 10.108 -4.233 12.211 1.00 0.00 H new ATOM 0 HG2 ARG A 49 11.309 -5.010 9.559 1.00 0.00 H new ATOM 0 HG3 ARG A 49 12.416 -4.588 10.851 1.00 0.00 H new ATOM 0 HD2 ARG A 49 10.626 -6.250 12.178 1.00 0.00 H new ATOM 0 HD3 ARG A 49 10.650 -6.968 10.579 1.00 0.00 H new ATOM 0 HE ARG A 49 13.326 -6.322 11.680 1.00 0.00 H new ATOM 0 HH11 ARG A 49 10.778 -8.761 11.310 1.00 0.00 H new ATOM 0 HH12 ARG A 49 11.869 -10.120 11.600 1.00 0.00 H new ATOM 0 HH21 ARG A 49 14.738 -8.079 12.057 1.00 0.00 H new ATOM 0 HH22 ARG A 49 14.118 -9.732 12.024 1.00 0.00 H new ATOM 406 N ASP A 50 7.388 -4.563 11.842 1.00 0.00 N ATOM 407 CA ASP A 50 6.393 -5.451 12.419 1.00 0.00 C ATOM 408 C ASP A 50 5.175 -4.632 12.851 1.00 0.00 C ATOM 409 O ASP A 50 5.303 -3.681 13.621 1.00 0.00 O ATOM 410 CB ASP A 50 6.944 -6.166 13.654 1.00 0.00 C ATOM 411 CG ASP A 50 7.284 -7.644 13.447 1.00 0.00 C ATOM 412 OD1 ASP A 50 6.692 -8.238 12.521 1.00 0.00 O ATOM 413 OD2 ASP A 50 8.129 -8.145 14.220 1.00 0.00 O ATOM 0 H ASP A 50 7.456 -3.650 12.291 1.00 0.00 H new ATOM 0 HA ASP A 50 6.122 -6.190 11.665 1.00 0.00 H new ATOM 0 HB2 ASP A 50 7.842 -5.645 13.987 1.00 0.00 H new ATOM 0 HB3 ASP A 50 6.213 -6.086 14.458 1.00 0.00 H new ATOM 418 N ARG A 51 4.021 -5.031 12.336 1.00 0.00 N ATOM 419 CA ARG A 51 2.781 -4.346 12.659 1.00 0.00 C ATOM 420 C ARG A 51 2.676 -4.122 14.169 1.00 0.00 C ATOM 421 O ARG A 51 2.669 -5.077 14.943 1.00 0.00 O ATOM 422 CB ARG A 51 1.568 -5.149 12.184 1.00 0.00 C ATOM 423 CG ARG A 51 1.426 -6.448 12.979 1.00 0.00 C ATOM 424 CD ARG A 51 1.022 -7.608 12.066 1.00 0.00 C ATOM 425 NE ARG A 51 0.096 -8.515 12.780 1.00 0.00 N ATOM 426 CZ ARG A 51 -0.075 -9.808 12.472 1.00 0.00 C ATOM 427 NH1 ARG A 51 0.615 -10.353 11.462 1.00 0.00 N ATOM 428 NH2 ARG A 51 -0.937 -10.555 13.175 1.00 0.00 N ATOM 0 H ARG A 51 3.919 -5.820 11.697 1.00 0.00 H new ATOM 0 HA ARG A 51 2.790 -3.385 12.145 1.00 0.00 H new ATOM 0 HB2 ARG A 51 0.664 -4.550 12.295 1.00 0.00 H new ATOM 0 HB3 ARG A 51 1.671 -5.377 11.123 1.00 0.00 H new ATOM 0 HG2 ARG A 51 2.369 -6.681 13.473 1.00 0.00 H new ATOM 0 HG3 ARG A 51 0.679 -6.320 13.762 1.00 0.00 H new ATOM 0 HD2 ARG A 51 0.545 -7.223 11.165 1.00 0.00 H new ATOM 0 HD3 ARG A 51 1.908 -8.157 11.748 1.00 0.00 H new ATOM 0 HE ARG A 51 -0.446 -8.132 13.555 1.00 0.00 H new ATOM 0 HH11 ARG A 51 1.271 -9.784 10.927 1.00 0.00 H new ATOM 0 HH12 ARG A 51 0.485 -11.337 11.228 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -1.463 -10.139 13.944 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -1.068 -11.539 12.941 1.00 0.00 H new ATOM 442 N SER A 52 2.597 -2.853 14.542 1.00 0.00 N ATOM 443 CA SER A 52 2.492 -2.491 15.946 1.00 0.00 C ATOM 444 C SER A 52 2.417 -0.970 16.090 1.00 0.00 C ATOM 445 O SER A 52 3.351 -0.343 16.586 1.00 0.00 O ATOM 446 CB SER A 52 3.674 -3.042 16.746 1.00 0.00 C ATOM 447 OG SER A 52 3.956 -2.249 17.896 1.00 0.00 O ATOM 0 H SER A 52 2.604 -2.063 13.897 1.00 0.00 H new ATOM 0 HA SER A 52 1.579 -2.933 16.346 1.00 0.00 H new ATOM 0 HB2 SER A 52 3.457 -4.065 17.055 1.00 0.00 H new ATOM 0 HB3 SER A 52 4.557 -3.082 16.108 1.00 0.00 H new ATOM 0 HG SER A 52 4.204 -1.343 17.616 1.00 0.00 H new ATOM 453 N ASP A 53 1.296 -0.420 15.646 1.00 0.00 N ATOM 454 CA ASP A 53 1.086 1.016 15.720 1.00 0.00 C ATOM 455 C ASP A 53 -0.371 1.296 16.092 1.00 0.00 C ATOM 456 O ASP A 53 -1.137 0.370 16.355 1.00 0.00 O ATOM 457 CB ASP A 53 1.366 1.683 14.372 1.00 0.00 C ATOM 458 CG ASP A 53 2.134 3.004 14.451 1.00 0.00 C ATOM 459 OD1 ASP A 53 3.144 3.030 15.187 1.00 0.00 O ATOM 460 OD2 ASP A 53 1.694 3.958 13.774 1.00 0.00 O ATOM 0 H ASP A 53 0.524 -0.943 15.234 1.00 0.00 H new ATOM 0 HA ASP A 53 1.767 1.418 16.470 1.00 0.00 H new ATOM 0 HB2 ASP A 53 1.931 0.988 13.750 1.00 0.00 H new ATOM 0 HB3 ASP A 53 0.416 1.862 13.868 1.00 0.00 H new ATOM 465 N GLN A 54 -0.711 2.576 16.102 1.00 0.00 N ATOM 466 CA GLN A 54 -2.062 2.990 16.438 1.00 0.00 C ATOM 467 C GLN A 54 -3.078 2.224 15.588 1.00 0.00 C ATOM 468 O GLN A 54 -4.066 1.708 16.110 1.00 0.00 O ATOM 469 CB GLN A 54 -2.232 4.501 16.266 1.00 0.00 C ATOM 470 CG GLN A 54 -1.601 5.260 17.435 1.00 0.00 C ATOM 471 CD GLN A 54 -0.121 4.900 17.587 1.00 0.00 C ATOM 472 OE1 GLN A 54 0.562 4.926 16.446 1.00 0.00 O flip ATOM 473 NE2 GLN A 54 0.367 4.617 18.668 1.00 0.00 N flip ATOM 0 H GLN A 54 -0.073 3.341 15.882 1.00 0.00 H new ATOM 0 HA GLN A 54 -2.243 2.755 17.487 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -1.771 4.818 15.331 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -3.292 4.746 16.198 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -1.703 6.333 17.274 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -2.133 5.024 18.356 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -0.215 4.616 19.506 1.00 0.00 H new ATOM 0 HE22 GLN A 54 1.357 4.381 18.735 1.00 0.00 H new ATOM 482 N HIS A 55 -2.801 2.173 14.294 1.00 0.00 N ATOM 483 CA HIS A 55 -3.678 1.479 13.367 1.00 0.00 C ATOM 484 C HIS A 55 -2.991 1.354 12.006 1.00 0.00 C ATOM 485 O HIS A 55 -2.921 2.322 11.250 1.00 0.00 O ATOM 486 CB HIS A 55 -5.038 2.173 13.282 1.00 0.00 C ATOM 487 CG HIS A 55 -6.129 1.486 14.069 1.00 0.00 C ATOM 488 ND1 HIS A 55 -6.540 0.191 13.806 1.00 0.00 N ATOM 489 CD2 HIS A 55 -6.887 1.926 15.114 1.00 0.00 C ATOM 490 CE1 HIS A 55 -7.503 -0.124 14.660 1.00 0.00 C ATOM 491 NE2 HIS A 55 -7.717 0.953 15.469 1.00 0.00 N ATOM 0 H HIS A 55 -1.981 2.601 13.865 1.00 0.00 H new ATOM 0 HA HIS A 55 -3.872 0.470 13.732 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -4.935 3.197 13.641 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -5.340 2.231 12.236 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -6.823 2.901 15.575 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -8.026 -1.068 14.707 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -8.402 1.003 16.223 1.00 0.00 H new ATOM 499 N ILE A 56 -2.500 0.153 11.734 1.00 0.00 N ATOM 500 CA ILE A 56 -1.820 -0.111 10.477 1.00 0.00 C ATOM 501 C ILE A 56 -2.725 -0.961 9.583 1.00 0.00 C ATOM 502 O ILE A 56 -2.271 -1.514 8.582 1.00 0.00 O ATOM 503 CB ILE A 56 -0.446 -0.733 10.732 1.00 0.00 C ATOM 504 CG1 ILE A 56 -0.578 -2.191 11.179 1.00 0.00 C ATOM 505 CG2 ILE A 56 0.358 0.102 11.730 1.00 0.00 C ATOM 506 CD1 ILE A 56 -0.816 -3.112 9.981 1.00 0.00 C ATOM 0 H ILE A 56 -2.560 -0.648 12.363 1.00 0.00 H new ATOM 0 HA ILE A 56 -1.628 0.820 9.944 1.00 0.00 H new ATOM 0 HB ILE A 56 0.108 -0.733 9.793 1.00 0.00 H new ATOM 0 HG12 ILE A 56 0.327 -2.498 11.704 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -1.403 -2.286 11.885 1.00 0.00 H new ATOM 0 HG21 ILE A 56 1.330 -0.363 11.893 1.00 0.00 H new ATOM 0 HG22 ILE A 56 0.498 1.108 11.333 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -0.181 0.157 12.676 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -0.906 -4.142 10.326 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -1.734 -2.818 9.473 1.00 0.00 H new ATOM 0 HD13 ILE A 56 0.023 -3.033 9.289 1.00 0.00 H new ATOM 518 N GLN A 57 -3.987 -1.040 9.976 1.00 0.00 N ATOM 519 CA GLN A 57 -4.959 -1.813 9.222 1.00 0.00 C ATOM 520 C GLN A 57 -5.170 -1.197 7.838 1.00 0.00 C ATOM 521 O GLN A 57 -5.055 0.016 7.671 1.00 0.00 O ATOM 522 CB GLN A 57 -6.283 -1.921 9.982 1.00 0.00 C ATOM 523 CG GLN A 57 -6.195 -2.971 11.091 1.00 0.00 C ATOM 524 CD GLN A 57 -4.844 -2.902 11.806 1.00 0.00 C ATOM 525 OE1 GLN A 57 -3.799 -3.187 11.243 1.00 0.00 O ATOM 526 NE2 GLN A 57 -4.923 -2.509 13.074 1.00 0.00 N ATOM 0 H GLN A 57 -4.359 -0.581 10.807 1.00 0.00 H new ATOM 0 HA GLN A 57 -4.569 -2.823 9.093 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -6.539 -0.953 10.412 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -7.083 -2.184 9.290 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -6.999 -2.814 11.810 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -6.336 -3.965 10.667 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -5.830 -2.286 13.483 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -4.076 -2.431 13.637 1.00 0.00 H new ATOM 535 N LEU A 58 -5.476 -2.061 6.881 1.00 0.00 N ATOM 536 CA LEU A 58 -5.704 -1.616 5.516 1.00 0.00 C ATOM 537 C LEU A 58 -6.825 -2.451 4.893 1.00 0.00 C ATOM 538 O LEU A 58 -7.464 -3.247 5.578 1.00 0.00 O ATOM 539 CB LEU A 58 -4.399 -1.646 4.718 1.00 0.00 C ATOM 540 CG LEU A 58 -3.532 -0.388 4.803 1.00 0.00 C ATOM 541 CD1 LEU A 58 -2.065 -0.748 5.045 1.00 0.00 C ATOM 542 CD2 LEU A 58 -3.710 0.485 3.559 1.00 0.00 C ATOM 0 H LEU A 58 -5.571 -3.066 7.024 1.00 0.00 H new ATOM 0 HA LEU A 58 -6.035 -0.577 5.504 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -3.807 -2.495 5.059 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -4.641 -1.827 3.671 1.00 0.00 H new ATOM 0 HG LEU A 58 -3.865 0.199 5.659 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.471 0.164 5.101 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -1.975 -1.298 5.982 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -1.702 -1.367 4.225 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -3.083 1.373 3.645 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -3.420 -0.080 2.673 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -4.754 0.785 3.472 1.00 0.00 H new ATOM 554 N GLN A 59 -7.028 -2.239 3.601 1.00 0.00 N ATOM 555 CA GLN A 59 -8.061 -2.962 2.878 1.00 0.00 C ATOM 556 C GLN A 59 -8.038 -2.580 1.397 1.00 0.00 C ATOM 557 O GLN A 59 -7.952 -1.401 1.058 1.00 0.00 O ATOM 558 CB GLN A 59 -9.440 -2.705 3.489 1.00 0.00 C ATOM 559 CG GLN A 59 -10.447 -3.763 3.035 1.00 0.00 C ATOM 560 CD GLN A 59 -10.446 -4.963 3.985 1.00 0.00 C ATOM 561 OE1 GLN A 59 -11.193 -5.026 4.948 1.00 0.00 O ATOM 562 NE2 GLN A 59 -9.569 -5.909 3.661 1.00 0.00 N ATOM 0 H GLN A 59 -6.495 -1.577 3.036 1.00 0.00 H new ATOM 0 HA GLN A 59 -7.856 -4.029 2.961 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -9.367 -2.711 4.577 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -9.792 -1.715 3.199 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -11.445 -3.327 2.995 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -10.203 -4.093 2.025 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -8.973 -5.793 2.841 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -9.492 -6.750 4.232 1.00 0.00 H new ATOM 571 N LEU A 60 -8.116 -3.599 0.555 1.00 0.00 N ATOM 572 CA LEU A 60 -8.105 -3.386 -0.882 1.00 0.00 C ATOM 573 C LEU A 60 -9.542 -3.393 -1.406 1.00 0.00 C ATOM 574 O LEU A 60 -10.447 -3.893 -0.739 1.00 0.00 O ATOM 575 CB LEU A 60 -7.195 -4.406 -1.569 1.00 0.00 C ATOM 576 CG LEU A 60 -5.963 -4.847 -0.776 1.00 0.00 C ATOM 577 CD1 LEU A 60 -6.285 -6.048 0.114 1.00 0.00 C ATOM 578 CD2 LEU A 60 -4.781 -5.124 -1.708 1.00 0.00 C ATOM 0 H LEU A 60 -8.187 -4.576 0.841 1.00 0.00 H new ATOM 0 HA LEU A 60 -7.684 -2.409 -1.118 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -7.787 -5.291 -1.804 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.861 -3.985 -2.517 1.00 0.00 H new ATOM 0 HG LEU A 60 -5.669 -4.029 -0.118 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -5.392 -6.341 0.667 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -7.074 -5.779 0.816 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -6.618 -6.881 -0.505 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -3.918 -5.436 -1.119 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -5.047 -5.916 -2.408 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -4.534 -4.218 -2.262 1.00 0.00 H new ATOM 590 N SER A 61 -9.708 -2.834 -2.595 1.00 0.00 N ATOM 591 CA SER A 61 -11.021 -2.770 -3.216 1.00 0.00 C ATOM 592 C SER A 61 -10.892 -2.942 -4.731 1.00 0.00 C ATOM 593 O SER A 61 -11.413 -2.134 -5.497 1.00 0.00 O ATOM 594 CB SER A 61 -11.721 -1.449 -2.889 1.00 0.00 C ATOM 595 OG SER A 61 -12.792 -1.177 -3.789 1.00 0.00 O ATOM 0 H SER A 61 -8.955 -2.421 -3.146 1.00 0.00 H new ATOM 0 HA SER A 61 -11.629 -3.581 -2.815 1.00 0.00 H new ATOM 0 HB2 SER A 61 -12.104 -1.484 -1.869 1.00 0.00 H new ATOM 0 HB3 SER A 61 -10.997 -0.635 -2.930 1.00 0.00 H new ATOM 0 HG SER A 61 -12.436 -1.056 -4.694 1.00 0.00 H new ATOM 601 N ALA A 62 -10.196 -4.001 -5.117 1.00 0.00 N ATOM 602 CA ALA A 62 -9.992 -4.290 -6.526 1.00 0.00 C ATOM 603 C ALA A 62 -11.284 -4.000 -7.293 1.00 0.00 C ATOM 604 O ALA A 62 -12.345 -4.518 -6.947 1.00 0.00 O ATOM 605 CB ALA A 62 -9.530 -5.739 -6.689 1.00 0.00 C ATOM 0 H ALA A 62 -9.766 -4.670 -4.478 1.00 0.00 H new ATOM 0 HA ALA A 62 -9.212 -3.651 -6.940 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -9.377 -5.955 -7.746 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -8.594 -5.885 -6.150 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -10.289 -6.410 -6.287 1.00 0.00 H new ATOM 611 N GLU A 63 -11.152 -3.174 -8.321 1.00 0.00 N ATOM 612 CA GLU A 63 -12.295 -2.810 -9.140 1.00 0.00 C ATOM 613 C GLU A 63 -12.109 -3.322 -10.569 1.00 0.00 C ATOM 614 O GLU A 63 -12.989 -3.155 -11.412 1.00 0.00 O ATOM 615 CB GLU A 63 -12.520 -1.297 -9.124 1.00 0.00 C ATOM 616 CG GLU A 63 -11.459 -0.576 -9.957 1.00 0.00 C ATOM 617 CD GLU A 63 -12.097 0.176 -11.127 1.00 0.00 C ATOM 618 OE1 GLU A 63 -12.546 1.318 -10.890 1.00 0.00 O ATOM 619 OE2 GLU A 63 -12.122 -0.408 -12.232 1.00 0.00 O ATOM 0 H GLU A 63 -10.270 -2.747 -8.605 1.00 0.00 H new ATOM 0 HA GLU A 63 -13.184 -3.281 -8.720 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -13.511 -1.069 -9.515 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.491 -0.932 -8.097 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -10.910 0.124 -9.327 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -10.736 -1.299 -10.336 1.00 0.00 H new ATOM 626 N SER A 64 -10.957 -3.935 -10.799 1.00 0.00 N ATOM 627 CA SER A 64 -10.644 -4.473 -12.112 1.00 0.00 C ATOM 628 C SER A 64 -9.131 -4.651 -12.258 1.00 0.00 C ATOM 629 O SER A 64 -8.362 -3.746 -11.937 1.00 0.00 O ATOM 630 CB SER A 64 -11.180 -3.565 -13.221 1.00 0.00 C ATOM 631 OG SER A 64 -12.454 -3.996 -13.694 1.00 0.00 O ATOM 0 H SER A 64 -10.229 -4.071 -10.098 1.00 0.00 H new ATOM 0 HA SER A 64 -11.129 -5.444 -12.208 1.00 0.00 H new ATOM 0 HB2 SER A 64 -11.258 -2.544 -12.848 1.00 0.00 H new ATOM 0 HB3 SER A 64 -10.472 -3.548 -14.050 1.00 0.00 H new ATOM 0 HG SER A 64 -13.153 -3.682 -13.083 1.00 0.00 H new ATOM 637 N VAL A 65 -8.750 -5.824 -12.741 1.00 0.00 N ATOM 638 CA VAL A 65 -7.343 -6.132 -12.933 1.00 0.00 C ATOM 639 C VAL A 65 -6.630 -4.906 -13.506 1.00 0.00 C ATOM 640 O VAL A 65 -7.155 -4.237 -14.395 1.00 0.00 O ATOM 641 CB VAL A 65 -7.195 -7.375 -13.813 1.00 0.00 C ATOM 642 CG1 VAL A 65 -7.195 -8.650 -12.966 1.00 0.00 C ATOM 643 CG2 VAL A 65 -8.290 -7.425 -14.880 1.00 0.00 C ATOM 0 H VAL A 65 -9.391 -6.572 -13.005 1.00 0.00 H new ATOM 0 HA VAL A 65 -6.870 -6.367 -11.979 1.00 0.00 H new ATOM 0 HB VAL A 65 -6.234 -7.312 -14.323 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -7.089 -9.519 -13.616 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -6.363 -8.619 -12.262 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -8.133 -8.721 -12.416 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.162 -8.318 -15.492 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -9.267 -7.453 -14.398 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -8.223 -6.540 -15.512 1.00 0.00 H new ATOM 653 N GLY A 66 -5.444 -4.648 -12.973 1.00 0.00 N ATOM 654 CA GLY A 66 -4.654 -3.513 -13.420 1.00 0.00 C ATOM 655 C GLY A 66 -5.137 -2.217 -12.767 1.00 0.00 C ATOM 656 O GLY A 66 -4.510 -1.170 -12.920 1.00 0.00 O ATOM 0 H GLY A 66 -5.012 -5.205 -12.236 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -3.604 -3.678 -13.177 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.720 -3.424 -14.504 1.00 0.00 H new ATOM 660 N GLU A 67 -6.248 -2.329 -12.054 1.00 0.00 N ATOM 661 CA GLU A 67 -6.823 -1.179 -11.378 1.00 0.00 C ATOM 662 C GLU A 67 -7.589 -1.625 -10.131 1.00 0.00 C ATOM 663 O GLU A 67 -8.691 -2.161 -10.233 1.00 0.00 O ATOM 664 CB GLU A 67 -7.727 -0.383 -12.321 1.00 0.00 C ATOM 665 CG GLU A 67 -7.416 1.113 -12.247 1.00 0.00 C ATOM 666 CD GLU A 67 -8.180 1.886 -13.324 1.00 0.00 C ATOM 667 OE1 GLU A 67 -8.548 1.243 -14.330 1.00 0.00 O ATOM 668 OE2 GLU A 67 -8.377 3.103 -13.116 1.00 0.00 O ATOM 0 H GLU A 67 -6.765 -3.199 -11.930 1.00 0.00 H new ATOM 0 HA GLU A 67 -6.011 -0.522 -11.067 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.592 -0.736 -13.343 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -8.771 -0.554 -12.060 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -7.683 1.495 -11.262 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -6.345 1.272 -12.371 1.00 0.00 H new ATOM 675 N VAL A 68 -6.975 -1.386 -8.981 1.00 0.00 N ATOM 676 CA VAL A 68 -7.585 -1.756 -7.716 1.00 0.00 C ATOM 677 C VAL A 68 -7.576 -0.548 -6.777 1.00 0.00 C ATOM 678 O VAL A 68 -6.887 0.438 -7.035 1.00 0.00 O ATOM 679 CB VAL A 68 -6.872 -2.976 -7.127 1.00 0.00 C ATOM 680 CG1 VAL A 68 -6.955 -4.171 -8.079 1.00 0.00 C ATOM 681 CG2 VAL A 68 -5.417 -2.647 -6.785 1.00 0.00 C ATOM 0 H VAL A 68 -6.061 -0.940 -8.900 1.00 0.00 H new ATOM 0 HA VAL A 68 -8.626 -2.045 -7.865 1.00 0.00 H new ATOM 0 HB VAL A 68 -7.380 -3.249 -6.202 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -6.441 -5.025 -7.637 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -8.000 -4.427 -8.252 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -6.483 -3.914 -9.027 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.933 -3.530 -6.368 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -4.892 -2.337 -7.689 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -5.389 -1.839 -6.054 1.00 0.00 H new ATOM 691 N TYR A 69 -8.349 -0.664 -5.707 1.00 0.00 N ATOM 692 CA TYR A 69 -8.438 0.406 -4.729 1.00 0.00 C ATOM 693 C TYR A 69 -7.993 -0.076 -3.346 1.00 0.00 C ATOM 694 O TYR A 69 -7.847 -1.276 -3.121 1.00 0.00 O ATOM 695 CB TYR A 69 -9.915 0.799 -4.668 1.00 0.00 C ATOM 696 CG TYR A 69 -10.331 1.822 -5.727 1.00 0.00 C ATOM 697 CD1 TYR A 69 -10.030 3.158 -5.552 1.00 0.00 C ATOM 698 CD2 TYR A 69 -11.008 1.410 -6.856 1.00 0.00 C ATOM 699 CE1 TYR A 69 -10.422 4.121 -6.549 1.00 0.00 C ATOM 700 CE2 TYR A 69 -11.399 2.372 -7.853 1.00 0.00 C ATOM 701 CZ TYR A 69 -11.087 3.680 -7.650 1.00 0.00 C ATOM 702 OH TYR A 69 -11.456 4.590 -8.592 1.00 0.00 O ATOM 0 H TYR A 69 -8.919 -1.483 -5.496 1.00 0.00 H new ATOM 0 HA TYR A 69 -7.795 1.239 -5.012 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -10.524 -0.097 -4.785 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -10.132 1.205 -3.680 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -9.501 3.481 -4.668 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -11.245 0.365 -6.992 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -10.193 5.169 -6.425 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -11.928 2.062 -8.742 1.00 0.00 H new ATOM 0 HH TYR A 69 -11.698 5.433 -8.155 1.00 0.00 H new ATOM 712 N ILE A 70 -7.791 0.885 -2.457 1.00 0.00 N ATOM 713 CA ILE A 70 -7.366 0.574 -1.102 1.00 0.00 C ATOM 714 C ILE A 70 -8.041 1.539 -0.126 1.00 0.00 C ATOM 715 O ILE A 70 -7.942 2.756 -0.282 1.00 0.00 O ATOM 716 CB ILE A 70 -5.839 0.571 -1.008 1.00 0.00 C ATOM 717 CG1 ILE A 70 -5.240 -0.559 -1.847 1.00 0.00 C ATOM 718 CG2 ILE A 70 -5.381 0.508 0.451 1.00 0.00 C ATOM 719 CD1 ILE A 70 -3.717 -0.436 -1.925 1.00 0.00 C ATOM 0 H ILE A 70 -7.914 1.879 -2.648 1.00 0.00 H new ATOM 0 HA ILE A 70 -7.682 -0.432 -0.825 1.00 0.00 H new ATOM 0 HB ILE A 70 -5.469 1.509 -1.422 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -5.509 -1.522 -1.412 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -5.662 -0.534 -2.852 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -4.292 0.507 0.491 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.763 1.375 0.990 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -5.762 -0.403 0.913 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -3.316 -1.252 -2.527 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.452 0.517 -2.383 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -3.296 -0.486 -0.921 1.00 0.00 H new ATOM 731 N LYS A 71 -8.713 0.961 0.859 1.00 0.00 N ATOM 732 CA LYS A 71 -9.404 1.755 1.860 1.00 0.00 C ATOM 733 C LYS A 71 -8.912 1.353 3.252 1.00 0.00 C ATOM 734 O LYS A 71 -9.266 0.288 3.756 1.00 0.00 O ATOM 735 CB LYS A 71 -10.919 1.637 1.686 1.00 0.00 C ATOM 736 CG LYS A 71 -11.616 2.952 2.040 1.00 0.00 C ATOM 737 CD LYS A 71 -12.201 2.899 3.453 1.00 0.00 C ATOM 738 CE LYS A 71 -11.105 2.649 4.491 1.00 0.00 C ATOM 739 NZ LYS A 71 -11.511 3.181 5.811 1.00 0.00 N ATOM 0 H LYS A 71 -8.793 -0.048 0.985 1.00 0.00 H new ATOM 0 HA LYS A 71 -9.173 2.813 1.733 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -11.150 1.365 0.656 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -11.300 0.837 2.321 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -10.906 3.775 1.967 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -12.410 3.152 1.321 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -12.710 3.837 3.675 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -12.949 2.109 3.511 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -10.906 1.580 4.569 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -10.177 3.123 4.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -10.665 3.460 6.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -12.125 4.010 5.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -12.029 2.448 6.337 1.00 0.00 H new ATOM 753 N SER A 72 -8.104 2.226 3.835 1.00 0.00 N ATOM 754 CA SER A 72 -7.560 1.976 5.159 1.00 0.00 C ATOM 755 C SER A 72 -8.697 1.726 6.153 1.00 0.00 C ATOM 756 O SER A 72 -9.159 2.652 6.817 1.00 0.00 O ATOM 757 CB SER A 72 -6.692 3.145 5.628 1.00 0.00 C ATOM 758 OG SER A 72 -6.463 3.108 7.034 1.00 0.00 O ATOM 0 H SER A 72 -7.813 3.108 3.414 1.00 0.00 H new ATOM 0 HA SER A 72 -6.929 1.089 5.108 1.00 0.00 H new ATOM 0 HB2 SER A 72 -5.736 3.120 5.104 1.00 0.00 H new ATOM 0 HB3 SER A 72 -7.176 4.085 5.364 1.00 0.00 H new ATOM 0 HG SER A 72 -5.751 2.464 7.233 1.00 0.00 H new ATOM 764 N THR A 73 -9.113 0.470 6.222 1.00 0.00 N ATOM 765 CA THR A 73 -10.187 0.087 7.124 1.00 0.00 C ATOM 766 C THR A 73 -9.844 0.485 8.561 1.00 0.00 C ATOM 767 O THR A 73 -9.347 -0.333 9.334 1.00 0.00 O ATOM 768 CB THR A 73 -10.436 -1.412 6.952 1.00 0.00 C ATOM 769 OG1 THR A 73 -9.154 -1.943 6.629 1.00 0.00 O ATOM 770 CG2 THR A 73 -11.290 -1.727 5.722 1.00 0.00 C ATOM 0 H THR A 73 -8.727 -0.295 5.669 1.00 0.00 H new ATOM 0 HA THR A 73 -11.111 0.614 6.886 1.00 0.00 H new ATOM 0 HB THR A 73 -10.926 -1.802 7.844 1.00 0.00 H new ATOM 0 HG1 THR A 73 -9.243 -2.888 6.385 1.00 0.00 H new ATOM 0 HG21 THR A 73 -11.436 -2.805 5.647 1.00 0.00 H new ATOM 0 HG22 THR A 73 -12.258 -1.235 5.816 1.00 0.00 H new ATOM 0 HG23 THR A 73 -10.785 -1.366 4.826 1.00 0.00 H new ATOM 778 N GLU A 74 -10.123 1.742 8.876 1.00 0.00 N ATOM 779 CA GLU A 74 -9.850 2.258 10.206 1.00 0.00 C ATOM 780 C GLU A 74 -9.781 3.786 10.178 1.00 0.00 C ATOM 781 O GLU A 74 -10.398 4.454 11.006 1.00 0.00 O ATOM 782 CB GLU A 74 -8.560 1.661 10.772 1.00 0.00 C ATOM 783 CG GLU A 74 -8.866 0.606 11.838 1.00 0.00 C ATOM 784 CD GLU A 74 -9.316 1.262 13.145 1.00 0.00 C ATOM 785 OE1 GLU A 74 -8.792 2.358 13.440 1.00 0.00 O ATOM 786 OE2 GLU A 74 -10.173 0.653 13.820 1.00 0.00 O ATOM 0 H GLU A 74 -10.535 2.418 8.233 1.00 0.00 H new ATOM 0 HA GLU A 74 -10.667 1.962 10.864 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -7.979 1.212 9.967 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -7.947 2.453 11.204 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -9.645 -0.066 11.477 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -7.979 -0.002 12.018 1.00 0.00 H new ATOM 793 N THR A 75 -9.024 4.295 9.217 1.00 0.00 N ATOM 794 CA THR A 75 -8.866 5.732 9.071 1.00 0.00 C ATOM 795 C THR A 75 -10.065 6.328 8.331 1.00 0.00 C ATOM 796 O THR A 75 -10.233 7.546 8.293 1.00 0.00 O ATOM 797 CB THR A 75 -7.530 5.992 8.372 1.00 0.00 C ATOM 798 OG1 THR A 75 -7.599 5.202 7.188 1.00 0.00 O ATOM 799 CG2 THR A 75 -6.343 5.409 9.141 1.00 0.00 C ATOM 0 H THR A 75 -8.513 3.738 8.532 1.00 0.00 H new ATOM 0 HA THR A 75 -8.844 6.228 10.041 1.00 0.00 H new ATOM 0 HB THR A 75 -7.389 7.066 8.247 1.00 0.00 H new ATOM 0 HG1 THR A 75 -7.256 4.303 7.374 1.00 0.00 H new ATOM 0 HG21 THR A 75 -5.420 5.622 8.601 1.00 0.00 H new ATOM 0 HG22 THR A 75 -6.296 5.859 10.133 1.00 0.00 H new ATOM 0 HG23 THR A 75 -6.466 4.330 9.238 1.00 0.00 H new ATOM 807 N GLY A 76 -10.868 5.441 7.761 1.00 0.00 N ATOM 808 CA GLY A 76 -12.047 5.864 7.025 1.00 0.00 C ATOM 809 C GLY A 76 -11.657 6.596 5.739 1.00 0.00 C ATOM 810 O GLY A 76 -12.519 7.106 5.025 1.00 0.00 O ATOM 0 H GLY A 76 -10.725 4.432 7.794 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.659 4.996 6.782 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -12.655 6.518 7.650 1.00 0.00 H new ATOM 814 N GLN A 77 -10.357 6.624 5.483 1.00 0.00 N ATOM 815 CA GLN A 77 -9.843 7.285 4.296 1.00 0.00 C ATOM 816 C GLN A 77 -9.493 6.252 3.223 1.00 0.00 C ATOM 817 O GLN A 77 -9.906 5.096 3.311 1.00 0.00 O ATOM 818 CB GLN A 77 -8.630 8.155 4.634 1.00 0.00 C ATOM 819 CG GLN A 77 -8.947 9.638 4.434 1.00 0.00 C ATOM 820 CD GLN A 77 -9.379 10.289 5.750 1.00 0.00 C ATOM 821 OE1 GLN A 77 -9.204 9.745 6.828 1.00 0.00 O ATOM 822 NE2 GLN A 77 -9.951 11.480 5.602 1.00 0.00 N ATOM 0 H GLN A 77 -9.645 6.200 6.077 1.00 0.00 H new ATOM 0 HA GLN A 77 -10.621 7.940 3.904 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -8.329 7.980 5.667 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -7.787 7.871 4.004 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -8.069 10.151 4.041 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -9.739 9.748 3.693 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -10.067 11.878 4.670 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -10.274 11.996 6.420 1.00 0.00 H new ATOM 831 N TYR A 78 -8.736 6.705 2.234 1.00 0.00 N ATOM 832 CA TYR A 78 -8.326 5.834 1.146 1.00 0.00 C ATOM 833 C TYR A 78 -6.823 5.953 0.884 1.00 0.00 C ATOM 834 O TYR A 78 -6.200 6.943 1.265 1.00 0.00 O ATOM 835 CB TYR A 78 -9.087 6.318 -0.090 1.00 0.00 C ATOM 836 CG TYR A 78 -10.556 5.891 -0.124 1.00 0.00 C ATOM 837 CD1 TYR A 78 -10.914 4.696 -0.715 1.00 0.00 C ATOM 838 CD2 TYR A 78 -11.523 6.700 0.437 1.00 0.00 C ATOM 839 CE1 TYR A 78 -12.296 4.294 -0.747 1.00 0.00 C ATOM 840 CE2 TYR A 78 -12.905 6.298 0.406 1.00 0.00 C ATOM 841 CZ TYR A 78 -13.224 5.115 -0.185 1.00 0.00 C ATOM 842 OH TYR A 78 -14.529 4.735 -0.214 1.00 0.00 O ATOM 0 H TYR A 78 -8.396 7.664 2.164 1.00 0.00 H new ATOM 0 HA TYR A 78 -8.538 4.792 1.387 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -9.035 7.406 -0.133 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -8.589 5.939 -0.982 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -10.157 4.062 -1.153 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -11.243 7.635 0.899 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -12.589 3.362 -1.207 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -13.671 6.922 0.842 1.00 0.00 H new ATOM 0 HH TYR A 78 -15.078 5.418 0.225 1.00 0.00 H new ATOM 852 N LEU A 79 -6.285 4.931 0.235 1.00 0.00 N ATOM 853 CA LEU A 79 -4.868 4.909 -0.082 1.00 0.00 C ATOM 854 C LEU A 79 -4.644 5.564 -1.447 1.00 0.00 C ATOM 855 O LEU A 79 -5.545 5.586 -2.284 1.00 0.00 O ATOM 856 CB LEU A 79 -4.320 3.484 0.013 1.00 0.00 C ATOM 857 CG LEU A 79 -2.954 3.334 0.686 1.00 0.00 C ATOM 858 CD1 LEU A 79 -1.864 4.042 -0.121 1.00 0.00 C ATOM 859 CD2 LEU A 79 -3.001 3.820 2.136 1.00 0.00 C ATOM 0 H LEU A 79 -6.805 4.112 -0.080 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.306 5.492 0.648 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -5.040 2.875 0.558 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -4.253 3.074 -0.995 1.00 0.00 H new ATOM 0 HG LEU A 79 -2.700 2.274 0.710 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -0.903 3.920 0.379 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.811 3.608 -1.120 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.100 5.103 -0.199 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -2.018 3.702 2.591 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -3.288 4.871 2.158 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -3.731 3.233 2.693 1.00 0.00 H new ATOM 871 N ALA A 80 -3.438 6.082 -1.629 1.00 0.00 N ATOM 872 CA ALA A 80 -3.085 6.736 -2.877 1.00 0.00 C ATOM 873 C ALA A 80 -1.596 7.088 -2.860 1.00 0.00 C ATOM 874 O ALA A 80 -0.923 6.907 -1.847 1.00 0.00 O ATOM 875 CB ALA A 80 -3.973 7.966 -3.078 1.00 0.00 C ATOM 0 H ALA A 80 -2.693 6.062 -0.933 1.00 0.00 H new ATOM 0 HA ALA A 80 -3.256 6.069 -3.722 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.708 8.457 -4.014 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -5.018 7.659 -3.112 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -3.826 8.660 -2.250 1.00 0.00 H new ATOM 881 N MET A 81 -1.126 7.584 -3.995 1.00 0.00 N ATOM 882 CA MET A 81 0.271 7.963 -4.123 1.00 0.00 C ATOM 883 C MET A 81 0.411 9.308 -4.840 1.00 0.00 C ATOM 884 O MET A 81 0.398 9.365 -6.068 1.00 0.00 O ATOM 885 CB MET A 81 1.023 6.886 -4.908 1.00 0.00 C ATOM 886 CG MET A 81 2.440 6.699 -4.362 1.00 0.00 C ATOM 887 SD MET A 81 2.845 4.962 -4.297 1.00 0.00 S ATOM 888 CE MET A 81 4.572 5.029 -4.744 1.00 0.00 C ATOM 0 H MET A 81 -1.687 7.732 -4.834 1.00 0.00 H new ATOM 0 HA MET A 81 0.695 8.059 -3.123 1.00 0.00 H new ATOM 0 HB2 MET A 81 0.480 5.943 -4.850 1.00 0.00 H new ATOM 0 HB3 MET A 81 1.069 7.164 -5.961 1.00 0.00 H new ATOM 0 HG2 MET A 81 3.155 7.224 -4.996 1.00 0.00 H new ATOM 0 HG3 MET A 81 2.516 7.136 -3.366 1.00 0.00 H new ATOM 0 HE1 MET A 81 4.707 4.603 -5.738 1.00 0.00 H new ATOM 0 HE2 MET A 81 4.908 6.066 -4.745 1.00 0.00 H new ATOM 0 HE3 MET A 81 5.157 4.459 -4.022 1.00 0.00 H new ATOM 898 N ASP A 82 0.541 10.357 -4.041 1.00 0.00 N ATOM 899 CA ASP A 82 0.683 11.697 -4.584 1.00 0.00 C ATOM 900 C ASP A 82 1.768 11.694 -5.663 1.00 0.00 C ATOM 901 O ASP A 82 2.497 10.714 -5.812 1.00 0.00 O ATOM 902 CB ASP A 82 1.100 12.690 -3.497 1.00 0.00 C ATOM 903 CG ASP A 82 0.158 12.766 -2.294 1.00 0.00 C ATOM 904 OD1 ASP A 82 -1.046 13.005 -2.531 1.00 0.00 O ATOM 905 OD2 ASP A 82 0.663 12.583 -1.166 1.00 0.00 O ATOM 0 H ASP A 82 0.551 10.306 -3.022 1.00 0.00 H new ATOM 0 HA ASP A 82 -0.280 11.997 -4.997 1.00 0.00 H new ATOM 0 HB2 ASP A 82 2.095 12.421 -3.143 1.00 0.00 H new ATOM 0 HB3 ASP A 82 1.177 13.682 -3.942 1.00 0.00 H new ATOM 910 N THR A 83 1.842 12.801 -6.387 1.00 0.00 N ATOM 911 CA THR A 83 2.826 12.938 -7.447 1.00 0.00 C ATOM 912 C THR A 83 4.241 12.814 -6.881 1.00 0.00 C ATOM 913 O THR A 83 5.201 12.645 -7.630 1.00 0.00 O ATOM 914 CB THR A 83 2.570 14.268 -8.160 1.00 0.00 C ATOM 915 OG1 THR A 83 2.164 15.149 -7.117 1.00 0.00 O ATOM 916 CG2 THR A 83 1.358 14.209 -9.092 1.00 0.00 C ATOM 0 H THR A 83 1.236 13.612 -6.260 1.00 0.00 H new ATOM 0 HA THR A 83 2.733 12.136 -8.180 1.00 0.00 H new ATOM 0 HB THR A 83 3.454 14.549 -8.732 1.00 0.00 H new ATOM 0 HG1 THR A 83 1.979 16.036 -7.491 1.00 0.00 H new ATOM 0 HG21 THR A 83 1.221 15.178 -9.572 1.00 0.00 H new ATOM 0 HG22 THR A 83 1.521 13.446 -9.853 1.00 0.00 H new ATOM 0 HG23 THR A 83 0.467 13.961 -8.515 1.00 0.00 H new ATOM 924 N ASP A 84 4.326 12.904 -5.561 1.00 0.00 N ATOM 925 CA ASP A 84 5.609 12.805 -4.885 1.00 0.00 C ATOM 926 C ASP A 84 5.889 11.339 -4.547 1.00 0.00 C ATOM 927 O ASP A 84 6.691 11.045 -3.661 1.00 0.00 O ATOM 928 CB ASP A 84 5.605 13.600 -3.578 1.00 0.00 C ATOM 929 CG ASP A 84 6.405 14.904 -3.612 1.00 0.00 C ATOM 930 OD1 ASP A 84 7.649 14.805 -3.686 1.00 0.00 O ATOM 931 OD2 ASP A 84 5.754 15.970 -3.564 1.00 0.00 O ATOM 0 H ASP A 84 3.527 13.044 -4.942 1.00 0.00 H new ATOM 0 HA ASP A 84 6.374 13.208 -5.549 1.00 0.00 H new ATOM 0 HB2 ASP A 84 4.573 13.831 -3.314 1.00 0.00 H new ATOM 0 HB3 ASP A 84 6.003 12.968 -2.784 1.00 0.00 H new ATOM 936 N GLY A 85 5.213 10.458 -5.269 1.00 0.00 N ATOM 937 CA GLY A 85 5.380 9.030 -5.057 1.00 0.00 C ATOM 938 C GLY A 85 5.371 8.694 -3.564 1.00 0.00 C ATOM 939 O GLY A 85 5.933 7.681 -3.150 1.00 0.00 O ATOM 0 H GLY A 85 4.548 10.705 -6.002 1.00 0.00 H new ATOM 0 HA2 GLY A 85 4.580 8.488 -5.561 1.00 0.00 H new ATOM 0 HA3 GLY A 85 6.318 8.700 -5.502 1.00 0.00 H new ATOM 943 N LEU A 86 4.728 9.562 -2.798 1.00 0.00 N ATOM 944 CA LEU A 86 4.639 9.370 -1.360 1.00 0.00 C ATOM 945 C LEU A 86 3.236 8.879 -1.002 1.00 0.00 C ATOM 946 O LEU A 86 2.272 9.641 -1.064 1.00 0.00 O ATOM 947 CB LEU A 86 5.052 10.645 -0.623 1.00 0.00 C ATOM 948 CG LEU A 86 5.570 10.457 0.804 1.00 0.00 C ATOM 949 CD1 LEU A 86 6.189 11.750 1.338 1.00 0.00 C ATOM 950 CD2 LEU A 86 4.467 9.928 1.723 1.00 0.00 C ATOM 0 H LEU A 86 4.263 10.401 -3.146 1.00 0.00 H new ATOM 0 HA LEU A 86 5.339 8.601 -1.034 1.00 0.00 H new ATOM 0 HB2 LEU A 86 5.826 11.144 -1.206 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.194 11.317 -0.591 1.00 0.00 H new ATOM 0 HG LEU A 86 6.360 9.706 0.784 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.549 11.588 2.354 1.00 0.00 H new ATOM 0 HD12 LEU A 86 7.022 12.045 0.700 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.437 12.539 1.341 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.862 9.803 2.731 1.00 0.00 H new ATOM 0 HD22 LEU A 86 3.639 10.637 1.743 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.113 8.967 1.351 1.00 0.00 H new ATOM 962 N LEU A 87 3.164 7.608 -0.634 1.00 0.00 N ATOM 963 CA LEU A 87 1.894 7.006 -0.265 1.00 0.00 C ATOM 964 C LEU A 87 1.078 8.008 0.555 1.00 0.00 C ATOM 965 O LEU A 87 1.531 8.475 1.598 1.00 0.00 O ATOM 966 CB LEU A 87 2.121 5.670 0.445 1.00 0.00 C ATOM 967 CG LEU A 87 2.234 4.440 -0.459 1.00 0.00 C ATOM 968 CD1 LEU A 87 3.574 4.424 -1.196 1.00 0.00 C ATOM 969 CD2 LEU A 87 2.000 3.153 0.335 1.00 0.00 C ATOM 0 H LEU A 87 3.965 6.978 -0.584 1.00 0.00 H new ATOM 0 HA LEU A 87 1.310 6.772 -1.155 1.00 0.00 H new ATOM 0 HB2 LEU A 87 3.033 5.746 1.037 1.00 0.00 H new ATOM 0 HB3 LEU A 87 1.300 5.509 1.144 1.00 0.00 H new ATOM 0 HG LEU A 87 1.451 4.498 -1.215 1.00 0.00 H new ATOM 0 HD11 LEU A 87 3.629 3.540 -1.831 1.00 0.00 H new ATOM 0 HD12 LEU A 87 3.662 5.319 -1.811 1.00 0.00 H new ATOM 0 HD13 LEU A 87 4.388 4.401 -0.471 1.00 0.00 H new ATOM 0 HD21 LEU A 87 2.086 2.294 -0.331 1.00 0.00 H new ATOM 0 HD22 LEU A 87 2.744 3.074 1.127 1.00 0.00 H new ATOM 0 HD23 LEU A 87 1.003 3.173 0.775 1.00 0.00 H new ATOM 981 N TYR A 88 -0.110 8.307 0.051 1.00 0.00 N ATOM 982 CA TYR A 88 -0.993 9.245 0.724 1.00 0.00 C ATOM 983 C TYR A 88 -2.460 8.915 0.443 1.00 0.00 C ATOM 984 O TYR A 88 -2.767 8.193 -0.505 1.00 0.00 O ATOM 985 CB TYR A 88 -0.671 10.621 0.138 1.00 0.00 C ATOM 986 CG TYR A 88 -1.704 11.124 -0.873 1.00 0.00 C ATOM 987 CD1 TYR A 88 -1.811 10.519 -2.109 1.00 0.00 C ATOM 988 CD2 TYR A 88 -2.528 12.182 -0.549 1.00 0.00 C ATOM 989 CE1 TYR A 88 -2.783 10.992 -3.060 1.00 0.00 C ATOM 990 CE2 TYR A 88 -3.500 12.655 -1.501 1.00 0.00 C ATOM 991 CZ TYR A 88 -3.579 12.037 -2.709 1.00 0.00 C ATOM 992 OH TYR A 88 -4.497 12.483 -3.608 1.00 0.00 O ATOM 0 H TYR A 88 -0.482 7.917 -0.815 1.00 0.00 H new ATOM 0 HA TYR A 88 -0.845 9.205 1.803 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -0.593 11.342 0.952 1.00 0.00 H new ATOM 0 HB3 TYR A 88 0.305 10.579 -0.345 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -1.166 9.691 -2.363 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -2.444 12.655 0.418 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -2.878 10.527 -4.030 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -4.151 13.482 -1.260 1.00 0.00 H new ATOM 0 HH TYR A 88 -4.996 13.233 -3.222 1.00 0.00 H new ATOM 1002 N GLY A 89 -3.327 9.458 1.285 1.00 0.00 N ATOM 1003 CA GLY A 89 -4.755 9.230 1.139 1.00 0.00 C ATOM 1004 C GLY A 89 -5.484 10.527 0.784 1.00 0.00 C ATOM 1005 O GLY A 89 -4.973 11.619 1.030 1.00 0.00 O ATOM 0 H GLY A 89 -3.068 10.055 2.071 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -4.930 8.486 0.362 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -5.159 8.824 2.066 1.00 0.00 H new ATOM 1009 N SER A 90 -6.667 10.365 0.209 1.00 0.00 N ATOM 1010 CA SER A 90 -7.471 11.510 -0.183 1.00 0.00 C ATOM 1011 C SER A 90 -8.944 11.107 -0.278 1.00 0.00 C ATOM 1012 O SER A 90 -9.261 9.923 -0.383 1.00 0.00 O ATOM 1013 CB SER A 90 -6.992 12.090 -1.515 1.00 0.00 C ATOM 1014 OG SER A 90 -7.041 13.514 -1.527 1.00 0.00 O ATOM 0 H SER A 90 -7.088 9.458 0.005 1.00 0.00 H new ATOM 0 HA SER A 90 -7.361 12.282 0.578 1.00 0.00 H new ATOM 0 HB2 SER A 90 -5.971 11.761 -1.707 1.00 0.00 H new ATOM 0 HB3 SER A 90 -7.610 11.699 -2.323 1.00 0.00 H new ATOM 0 HG SER A 90 -6.726 13.845 -2.394 1.00 0.00 H new ATOM 1020 N GLN A 91 -9.804 12.114 -0.238 1.00 0.00 N ATOM 1021 CA GLN A 91 -11.236 11.878 -0.319 1.00 0.00 C ATOM 1022 C GLN A 91 -11.689 11.858 -1.780 1.00 0.00 C ATOM 1023 O GLN A 91 -12.755 12.374 -2.110 1.00 0.00 O ATOM 1024 CB GLN A 91 -12.010 12.929 0.481 1.00 0.00 C ATOM 1025 CG GLN A 91 -13.513 12.647 0.445 1.00 0.00 C ATOM 1026 CD GLN A 91 -14.276 13.818 -0.178 1.00 0.00 C ATOM 1027 OE1 GLN A 91 -14.807 13.734 -1.273 1.00 0.00 O ATOM 1028 NE2 GLN A 91 -14.299 14.912 0.578 1.00 0.00 N ATOM 0 H GLN A 91 -9.537 13.095 -0.151 1.00 0.00 H new ATOM 0 HA GLN A 91 -11.450 10.904 0.120 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -11.662 12.934 1.514 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -11.812 13.920 0.073 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -13.703 11.739 -0.128 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -13.877 12.468 1.457 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -13.834 14.915 1.486 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -14.782 15.748 0.250 1.00 0.00 H new ATOM 1037 N THR A 92 -10.856 11.256 -2.616 1.00 0.00 N ATOM 1038 CA THR A 92 -11.157 11.161 -4.034 1.00 0.00 C ATOM 1039 C THR A 92 -10.638 9.839 -4.603 1.00 0.00 C ATOM 1040 O THR A 92 -9.488 9.752 -5.029 1.00 0.00 O ATOM 1041 CB THR A 92 -10.569 12.393 -4.726 1.00 0.00 C ATOM 1042 OG1 THR A 92 -9.177 12.327 -4.428 1.00 0.00 O ATOM 1043 CG2 THR A 92 -11.027 13.702 -4.079 1.00 0.00 C ATOM 0 H THR A 92 -9.972 10.829 -2.338 1.00 0.00 H new ATOM 0 HA THR A 92 -12.233 11.154 -4.210 1.00 0.00 H new ATOM 0 HB THR A 92 -10.854 12.389 -5.778 1.00 0.00 H new ATOM 0 HG1 THR A 92 -8.871 11.399 -4.499 1.00 0.00 H new ATOM 0 HG21 THR A 92 -10.581 14.545 -4.608 1.00 0.00 H new ATOM 0 HG22 THR A 92 -12.113 13.774 -4.132 1.00 0.00 H new ATOM 0 HG23 THR A 92 -10.713 13.721 -3.035 1.00 0.00 H new ATOM 1051 N PRO A 93 -11.535 8.817 -4.590 1.00 0.00 N ATOM 1052 CA PRO A 93 -11.179 7.503 -5.100 1.00 0.00 C ATOM 1053 C PRO A 93 -11.143 7.499 -6.629 1.00 0.00 C ATOM 1054 O PRO A 93 -12.133 7.158 -7.276 1.00 0.00 O ATOM 1055 CB PRO A 93 -12.227 6.563 -4.528 1.00 0.00 C ATOM 1056 CG PRO A 93 -13.391 7.443 -4.104 1.00 0.00 C ATOM 1057 CD PRO A 93 -12.906 8.884 -4.093 1.00 0.00 C ATOM 0 HA PRO A 93 -10.178 7.192 -4.801 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -12.542 5.831 -5.271 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -11.830 6.005 -3.680 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -14.228 7.327 -4.793 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -13.749 7.153 -3.116 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -13.527 9.516 -4.728 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -12.943 9.307 -3.089 1.00 0.00 H new ATOM 1065 N ASN A 94 -9.993 7.883 -7.164 1.00 0.00 N ATOM 1066 CA ASN A 94 -9.815 7.928 -8.605 1.00 0.00 C ATOM 1067 C ASN A 94 -8.536 7.178 -8.981 1.00 0.00 C ATOM 1068 O ASN A 94 -7.888 6.579 -8.123 1.00 0.00 O ATOM 1069 CB ASN A 94 -9.681 9.370 -9.099 1.00 0.00 C ATOM 1070 CG ASN A 94 -10.997 10.132 -8.931 1.00 0.00 C ATOM 1071 OD1 ASN A 94 -11.413 10.223 -7.671 1.00 0.00 O flip ATOM 1072 ND2 ASN A 94 -11.596 10.605 -9.883 1.00 0.00 N flip ATOM 0 H ASN A 94 -9.175 8.166 -6.625 1.00 0.00 H new ATOM 0 HA ASN A 94 -10.689 7.469 -9.067 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -8.890 9.876 -8.545 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -9.387 9.373 -10.148 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -11.221 10.499 -10.825 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -12.472 11.107 -9.736 1.00 0.00 H new ATOM 1079 N GLU A 95 -8.209 7.236 -10.263 1.00 0.00 N ATOM 1080 CA GLU A 95 -7.018 6.569 -10.763 1.00 0.00 C ATOM 1081 C GLU A 95 -5.875 6.701 -9.755 1.00 0.00 C ATOM 1082 O GLU A 95 -5.062 5.789 -9.611 1.00 0.00 O ATOM 1083 CB GLU A 95 -6.612 7.125 -12.129 1.00 0.00 C ATOM 1084 CG GLU A 95 -7.400 6.449 -13.253 1.00 0.00 C ATOM 1085 CD GLU A 95 -8.287 7.457 -13.985 1.00 0.00 C ATOM 1086 OE1 GLU A 95 -9.105 8.101 -13.292 1.00 0.00 O ATOM 1087 OE2 GLU A 95 -8.128 7.562 -15.220 1.00 0.00 O ATOM 0 H GLU A 95 -8.748 7.735 -10.971 1.00 0.00 H new ATOM 0 HA GLU A 95 -7.243 5.510 -10.891 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -6.786 8.201 -12.154 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -5.544 6.971 -12.285 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -6.710 5.987 -13.959 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -8.016 5.650 -12.840 1.00 0.00 H new ATOM 1094 N GLU A 96 -5.848 7.842 -9.084 1.00 0.00 N ATOM 1095 CA GLU A 96 -4.817 8.105 -8.094 1.00 0.00 C ATOM 1096 C GLU A 96 -4.946 7.129 -6.922 1.00 0.00 C ATOM 1097 O GLU A 96 -4.064 6.300 -6.700 1.00 0.00 O ATOM 1098 CB GLU A 96 -4.879 9.554 -7.609 1.00 0.00 C ATOM 1099 CG GLU A 96 -3.675 9.889 -6.727 1.00 0.00 C ATOM 1100 CD GLU A 96 -3.640 11.381 -6.389 1.00 0.00 C ATOM 1101 OE1 GLU A 96 -4.726 11.997 -6.429 1.00 0.00 O ATOM 1102 OE2 GLU A 96 -2.527 11.871 -6.099 1.00 0.00 O ATOM 0 H GLU A 96 -6.524 8.596 -9.206 1.00 0.00 H new ATOM 0 HA GLU A 96 -3.844 7.955 -8.562 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -4.905 10.227 -8.466 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -5.800 9.715 -7.049 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -3.720 9.305 -5.808 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -2.755 9.607 -7.239 1.00 0.00 H new ATOM 1109 N CYS A 97 -6.052 7.259 -6.204 1.00 0.00 N ATOM 1110 CA CYS A 97 -6.307 6.399 -5.061 1.00 0.00 C ATOM 1111 C CYS A 97 -6.101 4.947 -5.497 1.00 0.00 C ATOM 1112 O CYS A 97 -5.736 4.098 -4.685 1.00 0.00 O ATOM 1113 CB CYS A 97 -7.705 6.628 -4.482 1.00 0.00 C ATOM 1114 SG CYS A 97 -7.580 7.441 -2.847 1.00 0.00 S ATOM 0 H CYS A 97 -6.781 7.947 -6.392 1.00 0.00 H new ATOM 0 HA CYS A 97 -5.609 6.639 -4.259 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -8.292 7.247 -5.161 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -8.228 5.676 -4.385 1.00 0.00 H new ATOM 0 HG CYS A 97 -6.717 6.805 -2.111 1.00 0.00 H new ATOM 1120 N LEU A 98 -6.343 4.707 -6.777 1.00 0.00 N ATOM 1121 CA LEU A 98 -6.188 3.372 -7.330 1.00 0.00 C ATOM 1122 C LEU A 98 -4.717 2.960 -7.254 1.00 0.00 C ATOM 1123 O LEU A 98 -3.850 3.790 -6.981 1.00 0.00 O ATOM 1124 CB LEU A 98 -6.772 3.306 -8.743 1.00 0.00 C ATOM 1125 CG LEU A 98 -8.246 2.908 -8.841 1.00 0.00 C ATOM 1126 CD1 LEU A 98 -8.940 3.651 -9.984 1.00 0.00 C ATOM 1127 CD2 LEU A 98 -8.396 1.390 -8.969 1.00 0.00 C ATOM 0 H LEU A 98 -6.645 5.414 -7.447 1.00 0.00 H new ATOM 0 HA LEU A 98 -6.753 2.649 -6.742 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -6.648 4.282 -9.212 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.185 2.595 -9.325 1.00 0.00 H new ATOM 0 HG LEU A 98 -8.742 3.204 -7.917 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -9.986 3.350 -10.031 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -8.879 4.725 -9.810 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.449 3.408 -10.927 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -9.453 1.133 -9.037 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.881 1.048 -9.867 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -7.961 0.906 -8.095 1.00 0.00 H new ATOM 1139 N PHE A 99 -4.480 1.680 -7.499 1.00 0.00 N ATOM 1140 CA PHE A 99 -3.128 1.149 -7.461 1.00 0.00 C ATOM 1141 C PHE A 99 -2.941 0.051 -8.510 1.00 0.00 C ATOM 1142 O PHE A 99 -3.350 -1.090 -8.299 1.00 0.00 O ATOM 1143 CB PHE A 99 -2.922 0.548 -6.069 1.00 0.00 C ATOM 1144 CG PHE A 99 -1.855 1.261 -5.236 1.00 0.00 C ATOM 1145 CD1 PHE A 99 -0.667 1.605 -5.802 1.00 0.00 C ATOM 1146 CD2 PHE A 99 -2.094 1.550 -3.928 1.00 0.00 C ATOM 1147 CE1 PHE A 99 0.323 2.267 -5.029 1.00 0.00 C ATOM 1148 CE2 PHE A 99 -1.103 2.211 -3.155 1.00 0.00 C ATOM 1149 CZ PHE A 99 0.084 2.556 -3.721 1.00 0.00 C ATOM 0 H PHE A 99 -5.201 0.995 -7.725 1.00 0.00 H new ATOM 0 HA PHE A 99 -2.411 1.942 -7.672 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -3.868 0.575 -5.529 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -2.645 -0.501 -6.175 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -0.477 1.374 -6.840 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.037 1.277 -3.478 1.00 0.00 H new ATOM 0 HE1 PHE A 99 1.266 2.541 -5.479 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -1.292 2.440 -2.117 1.00 0.00 H new ATOM 0 HZ PHE A 99 0.837 3.059 -3.133 1.00 0.00 H new ATOM 1159 N LEU A 100 -2.322 0.433 -9.617 1.00 0.00 N ATOM 1160 CA LEU A 100 -2.077 -0.505 -10.700 1.00 0.00 C ATOM 1161 C LEU A 100 -1.591 -1.833 -10.117 1.00 0.00 C ATOM 1162 O LEU A 100 -0.426 -1.963 -9.745 1.00 0.00 O ATOM 1163 CB LEU A 100 -1.119 0.102 -11.728 1.00 0.00 C ATOM 1164 CG LEU A 100 -1.686 0.305 -13.134 1.00 0.00 C ATOM 1165 CD1 LEU A 100 -0.927 1.405 -13.878 1.00 0.00 C ATOM 1166 CD2 LEU A 100 -1.699 -1.011 -13.915 1.00 0.00 C ATOM 0 H LEU A 100 -1.982 1.380 -9.788 1.00 0.00 H new ATOM 0 HA LEU A 100 -3.000 -0.712 -11.241 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.778 1.067 -11.352 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -0.241 -0.540 -11.801 1.00 0.00 H new ATOM 0 HG LEU A 100 -2.721 0.635 -13.041 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -1.350 1.529 -14.875 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -1.013 2.342 -13.328 1.00 0.00 H new ATOM 0 HD13 LEU A 100 0.124 1.129 -13.962 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -2.107 -0.839 -14.911 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.682 -1.394 -14.000 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.318 -1.739 -13.391 1.00 0.00 H new ATOM 1178 N GLU A 101 -2.509 -2.787 -10.055 1.00 0.00 N ATOM 1179 CA GLU A 101 -2.189 -4.100 -9.523 1.00 0.00 C ATOM 1180 C GLU A 101 -2.188 -5.141 -10.645 1.00 0.00 C ATOM 1181 O GLU A 101 -2.973 -5.044 -11.587 1.00 0.00 O ATOM 1182 CB GLU A 101 -3.163 -4.494 -8.411 1.00 0.00 C ATOM 1183 CG GLU A 101 -2.666 -5.730 -7.659 1.00 0.00 C ATOM 1184 CD GLU A 101 -3.655 -6.890 -7.796 1.00 0.00 C ATOM 1185 OE1 GLU A 101 -4.565 -6.963 -6.943 1.00 0.00 O ATOM 1186 OE2 GLU A 101 -3.477 -7.677 -8.750 1.00 0.00 O ATOM 0 H GLU A 101 -3.475 -2.676 -10.365 1.00 0.00 H new ATOM 0 HA GLU A 101 -1.190 -4.061 -9.088 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -3.281 -3.664 -7.715 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -4.146 -4.694 -8.838 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -1.693 -6.029 -8.048 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -2.528 -5.488 -6.605 1.00 0.00 H new ATOM 1193 N ARG A 102 -1.298 -6.113 -10.507 1.00 0.00 N ATOM 1194 CA ARG A 102 -1.184 -7.170 -11.497 1.00 0.00 C ATOM 1195 C ARG A 102 -0.900 -8.509 -10.813 1.00 0.00 C ATOM 1196 O ARG A 102 -1.824 -9.199 -10.383 1.00 0.00 O ATOM 1197 CB ARG A 102 -0.067 -6.869 -12.498 1.00 0.00 C ATOM 1198 CG ARG A 102 0.974 -5.927 -11.891 1.00 0.00 C ATOM 1199 CD ARG A 102 2.255 -5.914 -12.727 1.00 0.00 C ATOM 1200 NE ARG A 102 2.957 -4.622 -12.558 1.00 0.00 N ATOM 1201 CZ ARG A 102 4.221 -4.398 -12.942 1.00 0.00 C ATOM 1202 NH1 ARG A 102 4.930 -5.378 -13.518 1.00 0.00 N ATOM 1203 NH2 ARG A 102 4.776 -3.194 -12.748 1.00 0.00 N ATOM 0 H ARG A 102 -0.649 -6.190 -9.724 1.00 0.00 H new ATOM 0 HA ARG A 102 -2.131 -7.226 -12.033 1.00 0.00 H new ATOM 0 HB2 ARG A 102 0.413 -7.799 -12.803 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -0.490 -6.419 -13.396 1.00 0.00 H new ATOM 0 HG2 ARG A 102 0.565 -4.918 -11.830 1.00 0.00 H new ATOM 0 HG3 ARG A 102 1.203 -6.240 -10.873 1.00 0.00 H new ATOM 0 HD2 ARG A 102 2.906 -6.733 -12.423 1.00 0.00 H new ATOM 0 HD3 ARG A 102 2.014 -6.072 -13.778 1.00 0.00 H new ATOM 0 HE ARG A 102 2.447 -3.854 -12.122 1.00 0.00 H new ATOM 0 HH11 ARG A 102 4.508 -6.295 -13.664 1.00 0.00 H new ATOM 0 HH12 ARG A 102 5.892 -5.207 -13.810 1.00 0.00 H new ATOM 0 HH21 ARG A 102 4.236 -2.449 -12.308 1.00 0.00 H new ATOM 0 HH22 ARG A 102 5.738 -3.023 -13.040 1.00 0.00 H new ATOM 1217 N LEU A 103 0.381 -8.837 -10.734 1.00 0.00 N ATOM 1218 CA LEU A 103 0.798 -10.081 -10.110 1.00 0.00 C ATOM 1219 C LEU A 103 2.321 -10.202 -10.193 1.00 0.00 C ATOM 1220 O LEU A 103 2.891 -10.182 -11.283 1.00 0.00 O ATOM 1221 CB LEU A 103 0.052 -11.266 -10.726 1.00 0.00 C ATOM 1222 CG LEU A 103 -0.504 -12.295 -9.740 1.00 0.00 C ATOM 1223 CD1 LEU A 103 -0.803 -13.621 -10.441 1.00 0.00 C ATOM 1224 CD2 LEU A 103 0.438 -12.476 -8.548 1.00 0.00 C ATOM 0 H LEU A 103 1.144 -8.263 -11.092 1.00 0.00 H new ATOM 0 HA LEU A 103 0.535 -10.084 -9.052 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.775 -10.879 -11.321 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.727 -11.778 -11.412 1.00 0.00 H new ATOM 0 HG LEU A 103 -1.449 -11.918 -9.349 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -1.197 -14.334 -9.717 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.539 -13.459 -11.228 1.00 0.00 H new ATOM 0 HD13 LEU A 103 0.114 -14.016 -10.878 1.00 0.00 H new ATOM 0 HD21 LEU A 103 0.020 -13.213 -7.862 1.00 0.00 H new ATOM 0 HD22 LEU A 103 1.410 -12.820 -8.901 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.556 -11.524 -8.030 1.00 0.00 H new ATOM 1236 N GLU A 104 2.937 -10.326 -9.026 1.00 0.00 N ATOM 1237 CA GLU A 104 4.383 -10.451 -8.953 1.00 0.00 C ATOM 1238 C GLU A 104 4.785 -11.924 -8.867 1.00 0.00 C ATOM 1239 O GLU A 104 5.700 -12.364 -9.562 1.00 0.00 O ATOM 1240 CB GLU A 104 4.943 -9.660 -7.769 1.00 0.00 C ATOM 1241 CG GLU A 104 6.417 -9.995 -7.533 1.00 0.00 C ATOM 1242 CD GLU A 104 6.562 -11.186 -6.584 1.00 0.00 C ATOM 1243 OE1 GLU A 104 5.508 -11.691 -6.140 1.00 0.00 O ATOM 1244 OE2 GLU A 104 7.725 -11.565 -6.323 1.00 0.00 O ATOM 0 H GLU A 104 2.461 -10.343 -8.124 1.00 0.00 H new ATOM 0 HA GLU A 104 4.810 -10.031 -9.863 1.00 0.00 H new ATOM 0 HB2 GLU A 104 4.835 -8.592 -7.957 1.00 0.00 H new ATOM 0 HB3 GLU A 104 4.367 -9.886 -6.872 1.00 0.00 H new ATOM 0 HG2 GLU A 104 6.899 -10.222 -8.484 1.00 0.00 H new ATOM 0 HG3 GLU A 104 6.929 -9.128 -7.115 1.00 0.00 H new ATOM 1251 N GLU A 105 4.082 -12.647 -8.008 1.00 0.00 N ATOM 1252 CA GLU A 105 4.354 -14.063 -7.822 1.00 0.00 C ATOM 1253 C GLU A 105 3.058 -14.870 -7.922 1.00 0.00 C ATOM 1254 O GLU A 105 2.544 -15.093 -9.018 1.00 0.00 O ATOM 1255 CB GLU A 105 5.055 -14.315 -6.486 1.00 0.00 C ATOM 1256 CG GLU A 105 6.557 -14.045 -6.596 1.00 0.00 C ATOM 1257 CD GLU A 105 7.341 -15.352 -6.726 1.00 0.00 C ATOM 1258 OE1 GLU A 105 6.890 -16.209 -7.517 1.00 0.00 O ATOM 1259 OE2 GLU A 105 8.374 -15.466 -6.031 1.00 0.00 O ATOM 0 H GLU A 105 3.324 -12.279 -7.433 1.00 0.00 H new ATOM 0 HA GLU A 105 5.026 -14.392 -8.615 1.00 0.00 H new ATOM 0 HB2 GLU A 105 4.622 -13.675 -5.717 1.00 0.00 H new ATOM 0 HB3 GLU A 105 4.889 -15.346 -6.173 1.00 0.00 H new ATOM 0 HG2 GLU A 105 6.754 -13.411 -7.461 1.00 0.00 H new ATOM 0 HG3 GLU A 105 6.897 -13.499 -5.716 1.00 0.00 H new ATOM 1266 N ASN A 106 2.566 -15.286 -6.764 1.00 0.00 N ATOM 1267 CA ASN A 106 1.340 -16.063 -6.708 1.00 0.00 C ATOM 1268 C ASN A 106 0.775 -16.014 -5.287 1.00 0.00 C ATOM 1269 O ASN A 106 0.324 -17.029 -4.759 1.00 0.00 O ATOM 1270 CB ASN A 106 1.600 -17.529 -7.062 1.00 0.00 C ATOM 1271 CG ASN A 106 0.455 -18.102 -7.900 1.00 0.00 C ATOM 1272 OD1 ASN A 106 0.302 -17.806 -9.074 1.00 0.00 O ATOM 1273 ND2 ASN A 106 -0.337 -18.936 -7.233 1.00 0.00 N ATOM 0 H ASN A 106 2.995 -15.099 -5.857 1.00 0.00 H new ATOM 0 HA ASN A 106 0.638 -15.637 -7.425 1.00 0.00 H new ATOM 0 HB2 ASN A 106 2.536 -17.613 -7.613 1.00 0.00 H new ATOM 0 HB3 ASN A 106 1.714 -18.113 -6.149 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -1.130 -19.372 -7.703 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -0.151 -19.140 -6.251 1.00 0.00 H new ATOM 1280 N HIS A 107 0.818 -14.823 -4.708 1.00 0.00 N ATOM 1281 CA HIS A 107 0.316 -14.628 -3.359 1.00 0.00 C ATOM 1282 C HIS A 107 0.094 -13.135 -3.104 1.00 0.00 C ATOM 1283 O HIS A 107 -0.981 -12.730 -2.666 1.00 0.00 O ATOM 1284 CB HIS A 107 1.251 -15.271 -2.333 1.00 0.00 C ATOM 1285 CG HIS A 107 2.215 -16.273 -2.923 1.00 0.00 C ATOM 1286 ND1 HIS A 107 3.413 -15.904 -3.510 1.00 0.00 N ATOM 1287 CD2 HIS A 107 2.146 -17.632 -3.011 1.00 0.00 C ATOM 1288 CE1 HIS A 107 4.029 -17.000 -3.929 1.00 0.00 C ATOM 1289 NE2 HIS A 107 3.241 -18.070 -3.619 1.00 0.00 N ATOM 0 H HIS A 107 1.193 -13.983 -5.149 1.00 0.00 H new ATOM 0 HA HIS A 107 -0.647 -15.127 -3.250 1.00 0.00 H new ATOM 0 HB2 HIS A 107 1.819 -14.487 -1.833 1.00 0.00 H new ATOM 0 HB3 HIS A 107 0.651 -15.766 -1.570 1.00 0.00 H new ATOM 0 HD1 HIS A 107 3.762 -14.950 -3.604 1.00 0.00 H new ATOM 0 HD2 HIS A 107 1.337 -18.248 -2.647 1.00 0.00 H new ATOM 0 HE1 HIS A 107 4.986 -17.039 -4.428 1.00 0.00 H new ATOM 1297 N TYR A 108 1.129 -12.359 -3.391 1.00 0.00 N ATOM 1298 CA TYR A 108 1.060 -10.920 -3.199 1.00 0.00 C ATOM 1299 C TYR A 108 0.357 -10.243 -4.376 1.00 0.00 C ATOM 1300 O TYR A 108 -0.198 -10.916 -5.244 1.00 0.00 O ATOM 1301 CB TYR A 108 2.510 -10.434 -3.137 1.00 0.00 C ATOM 1302 CG TYR A 108 3.464 -11.407 -2.443 1.00 0.00 C ATOM 1303 CD1 TYR A 108 3.414 -11.563 -1.072 1.00 0.00 C ATOM 1304 CD2 TYR A 108 4.375 -12.129 -3.186 1.00 0.00 C ATOM 1305 CE1 TYR A 108 4.312 -12.479 -0.418 1.00 0.00 C ATOM 1306 CE2 TYR A 108 5.273 -13.045 -2.532 1.00 0.00 C ATOM 1307 CZ TYR A 108 5.197 -13.175 -1.181 1.00 0.00 C ATOM 1308 OH TYR A 108 6.046 -14.040 -0.563 1.00 0.00 O ATOM 0 H TYR A 108 2.019 -12.699 -3.755 1.00 0.00 H new ATOM 0 HA TYR A 108 0.499 -10.679 -2.296 1.00 0.00 H new ATOM 0 HB2 TYR A 108 2.866 -10.254 -4.152 1.00 0.00 H new ATOM 0 HB3 TYR A 108 2.540 -9.478 -2.615 1.00 0.00 H new ATOM 0 HD1 TYR A 108 2.701 -10.998 -0.490 1.00 0.00 H new ATOM 0 HD2 TYR A 108 4.415 -12.007 -4.258 1.00 0.00 H new ATOM 0 HE1 TYR A 108 4.283 -12.610 0.654 1.00 0.00 H new ATOM 0 HE2 TYR A 108 5.991 -13.616 -3.102 1.00 0.00 H new ATOM 0 HH TYR A 108 6.621 -14.468 -1.232 1.00 0.00 H new ATOM 1318 N ASN A 109 0.402 -8.918 -4.369 1.00 0.00 N ATOM 1319 CA ASN A 109 -0.224 -8.142 -5.426 1.00 0.00 C ATOM 1320 C ASN A 109 0.514 -6.811 -5.581 1.00 0.00 C ATOM 1321 O ASN A 109 -0.049 -5.750 -5.315 1.00 0.00 O ATOM 1322 CB ASN A 109 -1.686 -7.836 -5.092 1.00 0.00 C ATOM 1323 CG ASN A 109 -2.454 -9.119 -4.767 1.00 0.00 C ATOM 1324 OD1 ASN A 109 -2.170 -9.817 -3.808 1.00 0.00 O ATOM 1325 ND2 ASN A 109 -3.440 -9.389 -5.617 1.00 0.00 N ATOM 0 H ASN A 109 0.862 -8.363 -3.648 1.00 0.00 H new ATOM 0 HA ASN A 109 -0.178 -8.726 -6.345 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -1.734 -7.154 -4.243 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -2.157 -7.329 -5.934 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -4.012 -10.223 -5.486 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -3.624 -8.762 -6.400 1.00 0.00 H new ATOM 1332 N THR A 110 1.764 -6.911 -6.010 1.00 0.00 N ATOM 1333 CA THR A 110 2.585 -5.728 -6.204 1.00 0.00 C ATOM 1334 C THR A 110 1.821 -4.674 -7.009 1.00 0.00 C ATOM 1335 O THR A 110 1.401 -4.933 -8.136 1.00 0.00 O ATOM 1336 CB THR A 110 3.895 -6.164 -6.863 1.00 0.00 C ATOM 1337 OG1 THR A 110 3.478 -6.878 -8.024 1.00 0.00 O ATOM 1338 CG2 THR A 110 4.648 -7.207 -6.035 1.00 0.00 C ATOM 0 H THR A 110 2.228 -7.793 -6.229 1.00 0.00 H new ATOM 0 HA THR A 110 2.825 -5.254 -5.253 1.00 0.00 H new ATOM 0 HB THR A 110 4.532 -5.293 -7.016 1.00 0.00 H new ATOM 0 HG1 THR A 110 2.678 -6.454 -8.399 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.570 -7.482 -6.547 1.00 0.00 H new ATOM 0 HG22 THR A 110 4.887 -6.791 -5.056 1.00 0.00 H new ATOM 0 HG23 THR A 110 4.024 -8.092 -5.911 1.00 0.00 H new ATOM 1346 N TYR A 111 1.664 -3.509 -6.399 1.00 0.00 N ATOM 1347 CA TYR A 111 0.958 -2.415 -7.045 1.00 0.00 C ATOM 1348 C TYR A 111 1.933 -1.332 -7.511 1.00 0.00 C ATOM 1349 O TYR A 111 3.119 -1.379 -7.188 1.00 0.00 O ATOM 1350 CB TYR A 111 0.030 -1.825 -5.981 1.00 0.00 C ATOM 1351 CG TYR A 111 -0.651 -2.874 -5.099 1.00 0.00 C ATOM 1352 CD1 TYR A 111 0.041 -3.453 -4.055 1.00 0.00 C ATOM 1353 CD2 TYR A 111 -1.958 -3.240 -5.347 1.00 0.00 C ATOM 1354 CE1 TYR A 111 -0.600 -4.440 -3.225 1.00 0.00 C ATOM 1355 CE2 TYR A 111 -2.600 -4.227 -4.517 1.00 0.00 C ATOM 1356 CZ TYR A 111 -1.889 -4.778 -3.497 1.00 0.00 C ATOM 1357 OH TYR A 111 -2.494 -5.710 -2.713 1.00 0.00 O ATOM 0 H TYR A 111 2.013 -3.298 -5.464 1.00 0.00 H new ATOM 0 HA TYR A 111 0.416 -2.772 -7.921 1.00 0.00 H new ATOM 0 HB2 TYR A 111 0.604 -1.149 -5.347 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -0.736 -1.226 -6.473 1.00 0.00 H new ATOM 0 HD1 TYR A 111 1.064 -3.166 -3.860 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -2.500 -2.786 -6.164 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -0.069 -4.901 -2.405 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -3.622 -4.523 -4.701 1.00 0.00 H new ATOM 0 HH TYR A 111 -1.968 -5.841 -1.896 1.00 0.00 H new ATOM 1367 N ILE A 112 1.397 -0.382 -8.263 1.00 0.00 N ATOM 1368 CA ILE A 112 2.205 0.711 -8.776 1.00 0.00 C ATOM 1369 C ILE A 112 1.329 1.954 -8.940 1.00 0.00 C ATOM 1370 O ILE A 112 0.351 1.935 -9.686 1.00 0.00 O ATOM 1371 CB ILE A 112 2.922 0.290 -10.061 1.00 0.00 C ATOM 1372 CG1 ILE A 112 4.370 -0.112 -9.775 1.00 0.00 C ATOM 1373 CG2 ILE A 112 2.830 1.386 -11.124 1.00 0.00 C ATOM 1374 CD1 ILE A 112 5.045 -0.663 -11.032 1.00 0.00 C ATOM 0 H ILE A 112 0.413 -0.347 -8.529 1.00 0.00 H new ATOM 0 HA ILE A 112 2.993 0.967 -8.068 1.00 0.00 H new ATOM 0 HB ILE A 112 2.418 -0.590 -10.461 1.00 0.00 H new ATOM 0 HG12 ILE A 112 4.925 0.752 -9.409 1.00 0.00 H new ATOM 0 HG13 ILE A 112 4.393 -0.864 -8.986 1.00 0.00 H new ATOM 0 HG21 ILE A 112 3.347 1.062 -12.027 1.00 0.00 H new ATOM 0 HG22 ILE A 112 1.783 1.581 -11.356 1.00 0.00 H new ATOM 0 HG23 ILE A 112 3.294 2.298 -10.748 1.00 0.00 H new ATOM 0 HD11 ILE A 112 6.073 -0.941 -10.801 1.00 0.00 H new ATOM 0 HD12 ILE A 112 4.502 -1.541 -11.382 1.00 0.00 H new ATOM 0 HD13 ILE A 112 5.042 0.100 -11.811 1.00 0.00 H new ATOM 1386 N SER A 113 1.711 3.006 -8.230 1.00 0.00 N ATOM 1387 CA SER A 113 0.972 4.256 -8.288 1.00 0.00 C ATOM 1388 C SER A 113 0.479 4.507 -9.714 1.00 0.00 C ATOM 1389 O SER A 113 1.252 4.919 -10.578 1.00 0.00 O ATOM 1390 CB SER A 113 1.833 5.427 -7.810 1.00 0.00 C ATOM 1391 OG SER A 113 1.226 6.685 -8.090 1.00 0.00 O ATOM 0 H SER A 113 2.522 3.018 -7.612 1.00 0.00 H new ATOM 0 HA SER A 113 0.113 4.176 -7.622 1.00 0.00 H new ATOM 0 HB2 SER A 113 2.003 5.337 -6.737 1.00 0.00 H new ATOM 0 HB3 SER A 113 2.809 5.380 -8.293 1.00 0.00 H new ATOM 0 HG SER A 113 1.771 7.174 -8.741 1.00 0.00 H new ATOM 1397 N LYS A 114 -0.805 4.249 -9.917 1.00 0.00 N ATOM 1398 CA LYS A 114 -1.410 4.442 -11.224 1.00 0.00 C ATOM 1399 C LYS A 114 -1.264 5.908 -11.637 1.00 0.00 C ATOM 1400 O LYS A 114 -1.225 6.221 -12.826 1.00 0.00 O ATOM 1401 CB LYS A 114 -2.856 3.944 -11.223 1.00 0.00 C ATOM 1402 CG LYS A 114 -3.376 3.769 -12.651 1.00 0.00 C ATOM 1403 CD LYS A 114 -4.697 2.996 -12.663 1.00 0.00 C ATOM 1404 CE LYS A 114 -4.880 2.245 -13.983 1.00 0.00 C ATOM 1405 NZ LYS A 114 -4.304 3.019 -15.105 1.00 0.00 N ATOM 0 H LYS A 114 -1.443 3.908 -9.198 1.00 0.00 H new ATOM 0 HA LYS A 114 -0.893 3.846 -11.976 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -2.917 2.995 -10.691 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.488 4.652 -10.686 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -3.518 4.746 -13.112 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -2.635 3.239 -13.249 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -4.717 2.290 -11.833 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -5.528 3.686 -12.515 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -4.399 1.269 -13.922 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -5.940 2.067 -14.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -4.776 2.749 -15.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -4.444 4.035 -14.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -3.287 2.817 -15.180 1.00 0.00 H new ATOM 1419 N LYS A 115 -1.188 6.768 -10.631 1.00 0.00 N ATOM 1420 CA LYS A 115 -1.048 8.193 -10.875 1.00 0.00 C ATOM 1421 C LYS A 115 0.298 8.461 -11.553 1.00 0.00 C ATOM 1422 O LYS A 115 0.451 9.449 -12.268 1.00 0.00 O ATOM 1423 CB LYS A 115 -1.252 8.981 -9.580 1.00 0.00 C ATOM 1424 CG LYS A 115 -2.172 10.182 -9.807 1.00 0.00 C ATOM 1425 CD LYS A 115 -1.607 11.439 -9.143 1.00 0.00 C ATOM 1426 CE LYS A 115 -1.411 12.559 -10.167 1.00 0.00 C ATOM 1427 NZ LYS A 115 -2.702 12.916 -10.798 1.00 0.00 N ATOM 0 H LYS A 115 -1.221 6.505 -9.646 1.00 0.00 H new ATOM 0 HA LYS A 115 -1.824 8.540 -11.558 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -1.680 8.330 -8.818 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -0.288 9.323 -9.203 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -2.293 10.355 -10.876 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -3.162 9.967 -9.404 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -2.283 11.775 -8.357 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -0.655 11.206 -8.667 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -0.983 13.435 -9.679 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -0.702 12.241 -10.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -2.672 13.907 -11.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -2.871 12.297 -11.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -3.471 12.795 -10.108 1.00 0.00 H new ATOM 1441 N HIS A 116 1.238 7.562 -11.303 1.00 0.00 N ATOM 1442 CA HIS A 116 2.566 7.688 -11.879 1.00 0.00 C ATOM 1443 C HIS A 116 3.226 6.310 -11.955 1.00 0.00 C ATOM 1444 O HIS A 116 4.232 6.063 -11.292 1.00 0.00 O ATOM 1445 CB HIS A 116 3.403 8.705 -11.100 1.00 0.00 C ATOM 1446 CG HIS A 116 2.825 9.072 -9.754 1.00 0.00 C ATOM 1447 ND1 HIS A 116 3.019 8.303 -8.619 1.00 0.00 N ATOM 1448 CD2 HIS A 116 2.058 10.134 -9.373 1.00 0.00 C ATOM 1449 CE1 HIS A 116 2.391 8.885 -7.608 1.00 0.00 C ATOM 1450 NE2 HIS A 116 1.796 10.019 -8.077 1.00 0.00 N ATOM 0 H HIS A 116 1.107 6.743 -10.709 1.00 0.00 H new ATOM 0 HA HIS A 116 2.489 8.072 -12.896 1.00 0.00 H new ATOM 0 HB2 HIS A 116 4.405 8.301 -10.956 1.00 0.00 H new ATOM 0 HB3 HIS A 116 3.507 9.610 -11.699 1.00 0.00 H new ATOM 0 HD1 HIS A 116 3.554 7.436 -8.570 1.00 0.00 H new ATOM 0 HD2 HIS A 116 1.721 10.933 -10.017 1.00 0.00 H new ATOM 0 HE1 HIS A 116 2.356 8.525 -6.591 1.00 0.00 H new ATOM 1458 N ALA A 117 2.633 5.449 -12.768 1.00 0.00 N ATOM 1459 CA ALA A 117 3.151 4.102 -12.939 1.00 0.00 C ATOM 1460 C ALA A 117 4.174 4.094 -14.076 1.00 0.00 C ATOM 1461 O ALA A 117 4.872 3.102 -14.281 1.00 0.00 O ATOM 1462 CB ALA A 117 1.991 3.137 -13.191 1.00 0.00 C ATOM 0 H ALA A 117 1.798 5.658 -13.316 1.00 0.00 H new ATOM 0 HA ALA A 117 3.661 3.769 -12.035 1.00 0.00 H new ATOM 0 HB1 ALA A 117 2.379 2.127 -13.319 1.00 0.00 H new ATOM 0 HB2 ALA A 117 1.309 3.158 -12.341 1.00 0.00 H new ATOM 0 HB3 ALA A 117 1.457 3.438 -14.092 1.00 0.00 H new ATOM 1468 N GLU A 118 4.230 5.211 -14.787 1.00 0.00 N ATOM 1469 CA GLU A 118 5.156 5.345 -15.898 1.00 0.00 C ATOM 1470 C GLU A 118 6.593 5.442 -15.383 1.00 0.00 C ATOM 1471 O GLU A 118 7.541 5.420 -16.168 1.00 0.00 O ATOM 1472 CB GLU A 118 4.801 6.555 -16.765 1.00 0.00 C ATOM 1473 CG GLU A 118 5.817 6.738 -17.894 1.00 0.00 C ATOM 1474 CD GLU A 118 5.128 7.182 -19.185 1.00 0.00 C ATOM 1475 OE1 GLU A 118 4.427 6.332 -19.776 1.00 0.00 O ATOM 1476 OE2 GLU A 118 5.317 8.362 -19.553 1.00 0.00 O ATOM 0 H GLU A 118 3.649 6.031 -14.615 1.00 0.00 H new ATOM 0 HA GLU A 118 5.074 4.455 -16.523 1.00 0.00 H new ATOM 0 HB2 GLU A 118 3.804 6.425 -17.186 1.00 0.00 H new ATOM 0 HB3 GLU A 118 4.772 7.453 -16.148 1.00 0.00 H new ATOM 0 HG2 GLU A 118 6.561 7.479 -17.602 1.00 0.00 H new ATOM 0 HG3 GLU A 118 6.349 5.802 -18.065 1.00 0.00 H new ATOM 1483 N LYS A 119 6.711 5.546 -14.068 1.00 0.00 N ATOM 1484 CA LYS A 119 8.017 5.646 -13.439 1.00 0.00 C ATOM 1485 C LYS A 119 8.292 4.372 -12.638 1.00 0.00 C ATOM 1486 O LYS A 119 9.360 4.224 -12.047 1.00 0.00 O ATOM 1487 CB LYS A 119 8.115 6.927 -12.609 1.00 0.00 C ATOM 1488 CG LYS A 119 9.328 7.761 -13.027 1.00 0.00 C ATOM 1489 CD LYS A 119 9.341 9.111 -12.308 1.00 0.00 C ATOM 1490 CE LYS A 119 9.577 10.256 -13.294 1.00 0.00 C ATOM 1491 NZ LYS A 119 8.379 10.470 -14.137 1.00 0.00 N ATOM 0 H LYS A 119 5.923 5.563 -13.420 1.00 0.00 H new ATOM 0 HA LYS A 119 8.799 5.722 -14.195 1.00 0.00 H new ATOM 0 HB2 LYS A 119 7.205 7.515 -12.732 1.00 0.00 H new ATOM 0 HB3 LYS A 119 8.190 6.674 -11.551 1.00 0.00 H new ATOM 0 HG2 LYS A 119 10.244 7.216 -12.800 1.00 0.00 H new ATOM 0 HG3 LYS A 119 9.310 7.920 -14.105 1.00 0.00 H new ATOM 0 HD2 LYS A 119 8.393 9.261 -11.792 1.00 0.00 H new ATOM 0 HD3 LYS A 119 10.122 9.114 -11.548 1.00 0.00 H new ATOM 0 HE2 LYS A 119 9.813 11.170 -12.749 1.00 0.00 H new ATOM 0 HE3 LYS A 119 10.437 10.029 -13.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 8.474 11.368 -14.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 8.288 9.688 -14.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 7.532 10.506 -13.534 1.00 0.00 H new ATOM 1505 N ASN A 120 7.308 3.484 -12.643 1.00 0.00 N ATOM 1506 CA ASN A 120 7.430 2.227 -11.924 1.00 0.00 C ATOM 1507 C ASN A 120 7.565 2.512 -10.427 1.00 0.00 C ATOM 1508 O ASN A 120 8.373 1.887 -9.743 1.00 0.00 O ATOM 1509 CB ASN A 120 8.672 1.455 -12.372 1.00 0.00 C ATOM 1510 CG ASN A 120 8.289 0.258 -13.244 1.00 0.00 C ATOM 1511 OD1 ASN A 120 7.264 0.488 -14.059 1.00 0.00 O flip ATOM 1512 ND2 ASN A 120 8.885 -0.805 -13.180 1.00 0.00 N flip ATOM 0 H ASN A 120 6.423 3.610 -13.134 1.00 0.00 H new ATOM 0 HA ASN A 120 6.541 1.632 -12.132 1.00 0.00 H new ATOM 0 HB2 ASN A 120 9.335 2.117 -12.928 1.00 0.00 H new ATOM 0 HB3 ASN A 120 9.225 1.111 -11.498 1.00 0.00 H new ATOM 0 HD21 ASN A 120 9.665 -0.914 -12.531 1.00 0.00 H new ATOM 0 HD22 ASN A 120 8.604 -1.584 -13.775 1.00 0.00 H new ATOM 1519 N TRP A 121 6.760 3.457 -9.962 1.00 0.00 N ATOM 1520 CA TRP A 121 6.779 3.832 -8.559 1.00 0.00 C ATOM 1521 C TRP A 121 5.885 2.854 -7.795 1.00 0.00 C ATOM 1522 O TRP A 121 4.754 3.185 -7.443 1.00 0.00 O ATOM 1523 CB TRP A 121 6.360 5.292 -8.376 1.00 0.00 C ATOM 1524 CG TRP A 121 7.412 6.304 -8.836 1.00 0.00 C ATOM 1525 CD1 TRP A 121 8.643 6.059 -9.305 1.00 0.00 C ATOM 1526 CD2 TRP A 121 7.274 7.741 -8.851 1.00 0.00 C ATOM 1527 NE1 TRP A 121 9.306 7.227 -9.621 1.00 0.00 N ATOM 1528 CE2 TRP A 121 8.447 8.282 -9.336 1.00 0.00 C ATOM 1529 CE3 TRP A 121 6.194 8.555 -8.468 1.00 0.00 C ATOM 1530 CZ2 TRP A 121 8.652 9.660 -9.483 1.00 0.00 C ATOM 1531 CZ3 TRP A 121 6.415 9.929 -8.621 1.00 0.00 C ATOM 1532 CH2 TRP A 121 7.589 10.491 -9.107 1.00 0.00 C ATOM 0 H TRP A 121 6.091 3.974 -10.533 1.00 0.00 H new ATOM 0 HA TRP A 121 7.790 3.766 -8.157 1.00 0.00 H new ATOM 0 HB2 TRP A 121 5.437 5.466 -8.929 1.00 0.00 H new ATOM 0 HB3 TRP A 121 6.139 5.467 -7.323 1.00 0.00 H new ATOM 0 HD1 TRP A 121 9.064 5.071 -9.421 1.00 0.00 H new ATOM 0 HE1 TRP A 121 10.252 7.302 -9.995 1.00 0.00 H new ATOM 0 HE3 TRP A 121 5.267 8.153 -8.086 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 9.579 10.060 -9.866 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 5.616 10.600 -8.341 1.00 0.00 H new ATOM 0 HH2 TRP A 121 7.682 11.563 -9.194 1.00 0.00 H new ATOM 1543 N PHE A 122 6.426 1.667 -7.561 1.00 0.00 N ATOM 1544 CA PHE A 122 5.691 0.637 -6.846 1.00 0.00 C ATOM 1545 C PHE A 122 5.195 1.156 -5.494 1.00 0.00 C ATOM 1546 O PHE A 122 5.365 2.333 -5.177 1.00 0.00 O ATOM 1547 CB PHE A 122 6.660 -0.522 -6.609 1.00 0.00 C ATOM 1548 CG PHE A 122 6.774 -1.489 -7.789 1.00 0.00 C ATOM 1549 CD1 PHE A 122 7.366 -1.085 -8.945 1.00 0.00 C ATOM 1550 CD2 PHE A 122 6.282 -2.753 -7.682 1.00 0.00 C ATOM 1551 CE1 PHE A 122 7.471 -1.983 -10.040 1.00 0.00 C ATOM 1552 CE2 PHE A 122 6.387 -3.651 -8.777 1.00 0.00 C ATOM 1553 CZ PHE A 122 6.979 -3.247 -9.933 1.00 0.00 C ATOM 0 H PHE A 122 7.365 1.396 -7.854 1.00 0.00 H new ATOM 0 HA PHE A 122 4.823 0.328 -7.428 1.00 0.00 H new ATOM 0 HB2 PHE A 122 7.647 -0.117 -6.388 1.00 0.00 H new ATOM 0 HB3 PHE A 122 6.338 -1.077 -5.728 1.00 0.00 H new ATOM 0 HD1 PHE A 122 7.756 -0.082 -9.030 1.00 0.00 H new ATOM 0 HD2 PHE A 122 5.812 -3.073 -6.764 1.00 0.00 H new ATOM 0 HE1 PHE A 122 7.941 -1.663 -10.958 1.00 0.00 H new ATOM 0 HE2 PHE A 122 5.997 -4.654 -8.692 1.00 0.00 H new ATOM 0 HZ PHE A 122 7.059 -3.930 -10.766 1.00 0.00 H new ATOM 1563 N VAL A 123 4.593 0.253 -4.735 1.00 0.00 N ATOM 1564 CA VAL A 123 4.072 0.605 -3.425 1.00 0.00 C ATOM 1565 C VAL A 123 4.813 -0.197 -2.353 1.00 0.00 C ATOM 1566 O VAL A 123 4.305 -0.381 -1.248 1.00 0.00 O ATOM 1567 CB VAL A 123 2.557 0.392 -3.390 1.00 0.00 C ATOM 1568 CG1 VAL A 123 2.205 -1.079 -3.616 1.00 0.00 C ATOM 1569 CG2 VAL A 123 1.962 0.903 -2.076 1.00 0.00 C ATOM 0 H VAL A 123 4.454 -0.722 -5.002 1.00 0.00 H new ATOM 0 HA VAL A 123 4.244 1.661 -3.217 1.00 0.00 H new ATOM 0 HB VAL A 123 2.118 0.970 -4.203 1.00 0.00 H new ATOM 0 HG11 VAL A 123 1.122 -1.203 -3.586 1.00 0.00 H new ATOM 0 HG12 VAL A 123 2.580 -1.398 -4.589 1.00 0.00 H new ATOM 0 HG13 VAL A 123 2.661 -1.687 -2.834 1.00 0.00 H new ATOM 0 HG21 VAL A 123 0.884 0.740 -2.077 1.00 0.00 H new ATOM 0 HG22 VAL A 123 2.410 0.365 -1.240 1.00 0.00 H new ATOM 0 HG23 VAL A 123 2.167 1.969 -1.974 1.00 0.00 H new ATOM 1579 N GLY A 124 6.003 -0.653 -2.718 1.00 0.00 N ATOM 1580 CA GLY A 124 6.819 -1.431 -1.802 1.00 0.00 C ATOM 1581 C GLY A 124 7.703 -0.521 -0.947 1.00 0.00 C ATOM 1582 O GLY A 124 8.705 0.006 -1.427 1.00 0.00 O ATOM 0 H GLY A 124 6.421 -0.498 -3.635 1.00 0.00 H new ATOM 0 HA2 GLY A 124 6.177 -2.031 -1.157 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.443 -2.125 -2.365 1.00 0.00 H new ATOM 1586 N LEU A 125 7.299 -0.365 0.305 1.00 0.00 N ATOM 1587 CA LEU A 125 8.042 0.473 1.232 1.00 0.00 C ATOM 1588 C LEU A 125 9.464 -0.073 1.378 1.00 0.00 C ATOM 1589 O LEU A 125 9.652 -1.243 1.709 1.00 0.00 O ATOM 1590 CB LEU A 125 7.292 0.599 2.559 1.00 0.00 C ATOM 1591 CG LEU A 125 5.789 0.866 2.457 1.00 0.00 C ATOM 1592 CD1 LEU A 125 5.002 -0.081 3.365 1.00 0.00 C ATOM 1593 CD2 LEU A 125 5.472 2.334 2.748 1.00 0.00 C ATOM 0 H LEU A 125 6.467 -0.804 0.699 1.00 0.00 H new ATOM 0 HA LEU A 125 8.128 1.488 0.844 1.00 0.00 H new ATOM 0 HB2 LEU A 125 7.440 -0.320 3.126 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.746 1.405 3.135 1.00 0.00 H new ATOM 0 HG LEU A 125 5.475 0.666 1.433 1.00 0.00 H new ATOM 0 HD11 LEU A 125 3.936 0.129 3.274 1.00 0.00 H new ATOM 0 HD12 LEU A 125 5.195 -1.112 3.069 1.00 0.00 H new ATOM 0 HD13 LEU A 125 5.313 0.064 4.399 1.00 0.00 H new ATOM 0 HD21 LEU A 125 4.397 2.497 2.669 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.804 2.585 3.755 1.00 0.00 H new ATOM 0 HD23 LEU A 125 5.989 2.968 2.027 1.00 0.00 H new ATOM 1605 N LYS A 126 10.428 0.800 1.126 1.00 0.00 N ATOM 1606 CA LYS A 126 11.827 0.419 1.225 1.00 0.00 C ATOM 1607 C LYS A 126 11.982 -0.662 2.297 1.00 0.00 C ATOM 1608 O LYS A 126 11.594 -0.462 3.447 1.00 0.00 O ATOM 1609 CB LYS A 126 12.701 1.652 1.465 1.00 0.00 C ATOM 1610 CG LYS A 126 13.989 1.579 0.642 1.00 0.00 C ATOM 1611 CD LYS A 126 15.211 1.897 1.506 1.00 0.00 C ATOM 1612 CE LYS A 126 16.301 2.584 0.681 1.00 0.00 C ATOM 1613 NZ LYS A 126 17.643 2.174 1.153 1.00 0.00 N ATOM 0 H LYS A 126 10.268 1.770 0.853 1.00 0.00 H new ATOM 0 HA LYS A 126 12.173 -0.011 0.285 1.00 0.00 H new ATOM 0 HB2 LYS A 126 12.147 2.552 1.200 1.00 0.00 H new ATOM 0 HB3 LYS A 126 12.946 1.728 2.524 1.00 0.00 H new ATOM 0 HG2 LYS A 126 14.093 0.583 0.211 1.00 0.00 H new ATOM 0 HG3 LYS A 126 13.934 2.282 -0.189 1.00 0.00 H new ATOM 0 HD2 LYS A 126 14.917 2.541 2.335 1.00 0.00 H new ATOM 0 HD3 LYS A 126 15.603 0.977 1.940 1.00 0.00 H new ATOM 0 HE2 LYS A 126 16.185 2.327 -0.372 1.00 0.00 H new ATOM 0 HE3 LYS A 126 16.196 3.666 0.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 18.372 2.649 0.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 17.756 2.441 2.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 17.745 1.144 1.056 1.00 0.00 H new ATOM 1627 N LYS A 127 12.549 -1.785 1.881 1.00 0.00 N ATOM 1628 CA LYS A 127 12.760 -2.898 2.790 1.00 0.00 C ATOM 1629 C LYS A 127 13.799 -2.502 3.842 1.00 0.00 C ATOM 1630 O LYS A 127 14.835 -3.153 3.971 1.00 0.00 O ATOM 1631 CB LYS A 127 13.124 -4.164 2.012 1.00 0.00 C ATOM 1632 CG LYS A 127 13.773 -3.816 0.671 1.00 0.00 C ATOM 1633 CD LYS A 127 14.933 -2.837 0.860 1.00 0.00 C ATOM 1634 CE LYS A 127 16.219 -3.385 0.238 1.00 0.00 C ATOM 1635 NZ LYS A 127 17.193 -2.293 0.015 1.00 0.00 N ATOM 0 H LYS A 127 12.869 -1.948 0.926 1.00 0.00 H new ATOM 0 HA LYS A 127 11.839 -3.134 3.324 1.00 0.00 H new ATOM 0 HB2 LYS A 127 13.807 -4.775 2.603 1.00 0.00 H new ATOM 0 HB3 LYS A 127 12.228 -4.761 1.842 1.00 0.00 H new ATOM 0 HG2 LYS A 127 14.135 -4.725 0.191 1.00 0.00 H new ATOM 0 HG3 LYS A 127 13.029 -3.379 0.005 1.00 0.00 H new ATOM 0 HD2 LYS A 127 14.683 -1.879 0.404 1.00 0.00 H new ATOM 0 HD3 LYS A 127 15.089 -2.653 1.923 1.00 0.00 H new ATOM 0 HE2 LYS A 127 16.654 -4.140 0.893 1.00 0.00 H new ATOM 0 HE3 LYS A 127 15.992 -3.876 -0.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 18.060 -2.682 -0.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 16.781 -1.587 -0.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 17.423 -1.842 0.923 1.00 0.00 H new ATOM 1649 N ASN A 128 13.486 -1.438 4.565 1.00 0.00 N ATOM 1650 CA ASN A 128 14.380 -0.948 5.601 1.00 0.00 C ATOM 1651 C ASN A 128 13.554 -0.478 6.800 1.00 0.00 C ATOM 1652 O ASN A 128 13.897 -0.767 7.946 1.00 0.00 O ATOM 1653 CB ASN A 128 15.204 0.240 5.100 1.00 0.00 C ATOM 1654 CG ASN A 128 16.645 0.161 5.610 1.00 0.00 C ATOM 1655 OD1 ASN A 128 16.918 0.256 6.795 1.00 0.00 O ATOM 1656 ND2 ASN A 128 17.549 -0.018 4.651 1.00 0.00 N ATOM 0 H ASN A 128 12.626 -0.901 4.455 1.00 0.00 H new ATOM 0 HA ASN A 128 15.051 -1.760 5.880 1.00 0.00 H new ATOM 0 HB2 ASN A 128 15.200 0.256 4.010 1.00 0.00 H new ATOM 0 HB3 ASN A 128 14.747 1.171 5.434 1.00 0.00 H new ATOM 0 HD21 ASN A 128 18.539 -0.084 4.889 1.00 0.00 H new ATOM 0 HD22 ASN A 128 17.253 -0.090 3.678 1.00 0.00 H new ATOM 1663 N GLY A 129 12.482 0.238 6.496 1.00 0.00 N ATOM 1664 CA GLY A 129 11.605 0.751 7.535 1.00 0.00 C ATOM 1665 C GLY A 129 11.394 2.258 7.380 1.00 0.00 C ATOM 1666 O GLY A 129 11.843 3.041 8.217 1.00 0.00 O ATOM 0 H GLY A 129 12.200 0.475 5.545 1.00 0.00 H new ATOM 0 HA2 GLY A 129 10.644 0.239 7.490 1.00 0.00 H new ATOM 0 HA3 GLY A 129 12.033 0.539 8.515 1.00 0.00 H new ATOM 1670 N SER A 130 10.711 2.621 6.304 1.00 0.00 N ATOM 1671 CA SER A 130 10.436 4.021 6.029 1.00 0.00 C ATOM 1672 C SER A 130 9.862 4.174 4.619 1.00 0.00 C ATOM 1673 O SER A 130 10.399 3.616 3.663 1.00 0.00 O ATOM 1674 CB SER A 130 11.698 4.871 6.184 1.00 0.00 C ATOM 1675 OG SER A 130 11.716 5.579 7.421 1.00 0.00 O ATOM 0 H SER A 130 10.340 1.970 5.612 1.00 0.00 H new ATOM 0 HA SER A 130 9.702 4.374 6.753 1.00 0.00 H new ATOM 0 HB2 SER A 130 12.577 4.230 6.120 1.00 0.00 H new ATOM 0 HB3 SER A 130 11.761 5.581 5.359 1.00 0.00 H new ATOM 0 HG SER A 130 11.766 4.940 8.163 1.00 0.00 H new ATOM 1681 N CYS A 131 8.780 4.933 4.534 1.00 0.00 N ATOM 1682 CA CYS A 131 8.128 5.166 3.257 1.00 0.00 C ATOM 1683 C CYS A 131 9.091 5.948 2.362 1.00 0.00 C ATOM 1684 O CYS A 131 10.021 6.586 2.853 1.00 0.00 O ATOM 1685 CB CYS A 131 6.792 5.892 3.428 1.00 0.00 C ATOM 1686 SG CYS A 131 5.583 5.274 2.200 1.00 0.00 S ATOM 0 H CYS A 131 8.338 5.395 5.329 1.00 0.00 H new ATOM 0 HA CYS A 131 7.891 4.211 2.788 1.00 0.00 H new ATOM 0 HB2 CYS A 131 6.410 5.736 4.437 1.00 0.00 H new ATOM 0 HB3 CYS A 131 6.933 6.966 3.303 1.00 0.00 H new ATOM 0 HG CYS A 131 4.382 5.361 2.691 1.00 0.00 H new ATOM 1692 N LYS A 132 8.836 5.874 1.064 1.00 0.00 N ATOM 1693 CA LYS A 132 9.668 6.566 0.096 1.00 0.00 C ATOM 1694 C LYS A 132 8.832 7.626 -0.625 1.00 0.00 C ATOM 1695 O LYS A 132 7.647 7.787 -0.337 1.00 0.00 O ATOM 1696 CB LYS A 132 10.339 5.566 -0.848 1.00 0.00 C ATOM 1697 CG LYS A 132 11.849 5.512 -0.606 1.00 0.00 C ATOM 1698 CD LYS A 132 12.159 5.249 0.869 1.00 0.00 C ATOM 1699 CE LYS A 132 12.788 6.480 1.524 1.00 0.00 C ATOM 1700 NZ LYS A 132 13.882 6.079 2.436 1.00 0.00 N ATOM 0 H LYS A 132 8.064 5.344 0.660 1.00 0.00 H new ATOM 0 HA LYS A 132 10.481 7.089 0.599 1.00 0.00 H new ATOM 0 HB2 LYS A 132 9.908 4.576 -0.701 1.00 0.00 H new ATOM 0 HB3 LYS A 132 10.143 5.849 -1.882 1.00 0.00 H new ATOM 0 HG2 LYS A 132 12.291 4.727 -1.220 1.00 0.00 H new ATOM 0 HG3 LYS A 132 12.304 6.453 -0.915 1.00 0.00 H new ATOM 0 HD2 LYS A 132 11.243 4.981 1.395 1.00 0.00 H new ATOM 0 HD3 LYS A 132 12.837 4.400 0.956 1.00 0.00 H new ATOM 0 HE2 LYS A 132 13.174 7.151 0.756 1.00 0.00 H new ATOM 0 HE3 LYS A 132 12.029 7.033 2.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 14.298 6.926 2.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 13.504 5.457 3.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 14.614 5.572 1.899 1.00 0.00 H new ATOM 1714 N ARG A 133 9.482 8.320 -1.547 1.00 0.00 N ATOM 1715 CA ARG A 133 8.813 9.359 -2.311 1.00 0.00 C ATOM 1716 C ARG A 133 9.459 9.504 -3.691 1.00 0.00 C ATOM 1717 O ARG A 133 10.680 9.426 -3.819 1.00 0.00 O ATOM 1718 CB ARG A 133 8.874 10.704 -1.584 1.00 0.00 C ATOM 1719 CG ARG A 133 10.319 11.085 -1.256 1.00 0.00 C ATOM 1720 CD ARG A 133 10.889 12.032 -2.314 1.00 0.00 C ATOM 1721 NE ARG A 133 11.517 13.202 -1.660 1.00 0.00 N ATOM 1722 CZ ARG A 133 10.831 14.198 -1.083 1.00 0.00 C ATOM 1723 NH1 ARG A 133 9.491 14.172 -1.076 1.00 0.00 N ATOM 1724 NH2 ARG A 133 11.484 15.219 -0.513 1.00 0.00 N ATOM 0 H ARG A 133 10.465 8.183 -1.782 1.00 0.00 H new ATOM 0 HA ARG A 133 7.769 9.066 -2.423 1.00 0.00 H new ATOM 0 HB2 ARG A 133 8.422 11.478 -2.205 1.00 0.00 H new ATOM 0 HB3 ARG A 133 8.290 10.651 -0.665 1.00 0.00 H new ATOM 0 HG2 ARG A 133 10.360 11.561 -0.276 1.00 0.00 H new ATOM 0 HG3 ARG A 133 10.932 10.186 -1.199 1.00 0.00 H new ATOM 0 HD2 ARG A 133 11.624 11.508 -2.925 1.00 0.00 H new ATOM 0 HD3 ARG A 133 10.095 12.362 -2.984 1.00 0.00 H new ATOM 0 HE ARG A 133 12.536 13.253 -1.648 1.00 0.00 H new ATOM 0 HH11 ARG A 133 8.994 13.394 -1.510 1.00 0.00 H new ATOM 0 HH12 ARG A 133 8.968 14.930 -0.637 1.00 0.00 H new ATOM 0 HH21 ARG A 133 12.504 15.239 -0.518 1.00 0.00 H new ATOM 0 HH22 ARG A 133 10.962 15.977 -0.074 1.00 0.00 H new ATOM 1738 N GLY A 134 8.611 9.711 -4.687 1.00 0.00 N ATOM 1739 CA GLY A 134 9.084 9.867 -6.052 1.00 0.00 C ATOM 1740 C GLY A 134 9.793 8.600 -6.535 1.00 0.00 C ATOM 1741 O GLY A 134 9.356 7.489 -6.239 1.00 0.00 O ATOM 0 H GLY A 134 7.599 9.774 -4.576 1.00 0.00 H new ATOM 0 HA2 GLY A 134 8.243 10.090 -6.709 1.00 0.00 H new ATOM 0 HA3 GLY A 134 9.767 10.715 -6.109 1.00 0.00 H new ATOM 1745 N PRO A 135 10.904 8.814 -7.290 1.00 0.00 N ATOM 1746 CA PRO A 135 11.677 7.703 -7.817 1.00 0.00 C ATOM 1747 C PRO A 135 12.511 7.044 -6.715 1.00 0.00 C ATOM 1748 O PRO A 135 13.718 7.263 -6.631 1.00 0.00 O ATOM 1749 CB PRO A 135 12.526 8.304 -8.925 1.00 0.00 C ATOM 1750 CG PRO A 135 12.542 9.803 -8.671 1.00 0.00 C ATOM 1751 CD PRO A 135 11.450 10.116 -7.661 1.00 0.00 C ATOM 0 HA PRO A 135 11.049 6.901 -8.205 1.00 0.00 H new ATOM 0 HB2 PRO A 135 13.536 7.894 -8.909 1.00 0.00 H new ATOM 0 HB3 PRO A 135 12.106 8.078 -9.905 1.00 0.00 H new ATOM 0 HG2 PRO A 135 13.515 10.115 -8.291 1.00 0.00 H new ATOM 0 HG3 PRO A 135 12.372 10.349 -9.599 1.00 0.00 H new ATOM 0 HD2 PRO A 135 11.852 10.639 -6.793 1.00 0.00 H new ATOM 0 HD3 PRO A 135 10.683 10.758 -8.093 1.00 0.00 H new ATOM 1759 N ARG A 136 11.833 6.251 -5.899 1.00 0.00 N ATOM 1760 CA ARG A 136 12.496 5.559 -4.807 1.00 0.00 C ATOM 1761 C ARG A 136 11.653 4.370 -4.342 1.00 0.00 C ATOM 1762 O ARG A 136 11.740 3.956 -3.187 1.00 0.00 O ATOM 1763 CB ARG A 136 12.735 6.499 -3.624 1.00 0.00 C ATOM 1764 CG ARG A 136 13.899 7.451 -3.906 1.00 0.00 C ATOM 1765 CD ARG A 136 13.394 8.790 -4.448 1.00 0.00 C ATOM 1766 NE ARG A 136 14.369 9.345 -5.413 1.00 0.00 N ATOM 1767 CZ ARG A 136 14.417 10.635 -5.775 1.00 0.00 C ATOM 1768 NH1 ARG A 136 13.546 11.509 -5.253 1.00 0.00 N ATOM 1769 NH2 ARG A 136 15.336 11.049 -6.657 1.00 0.00 N ATOM 0 H ARG A 136 10.831 6.072 -5.972 1.00 0.00 H new ATOM 0 HA ARG A 136 13.459 5.204 -5.175 1.00 0.00 H new ATOM 0 HB2 ARG A 136 11.831 7.074 -3.423 1.00 0.00 H new ATOM 0 HB3 ARG A 136 12.947 5.915 -2.728 1.00 0.00 H new ATOM 0 HG2 ARG A 136 14.468 7.616 -2.991 1.00 0.00 H new ATOM 0 HG3 ARG A 136 14.579 6.996 -4.626 1.00 0.00 H new ATOM 0 HD2 ARG A 136 12.427 8.654 -4.933 1.00 0.00 H new ATOM 0 HD3 ARG A 136 13.243 9.491 -3.627 1.00 0.00 H new ATOM 0 HE ARG A 136 15.047 8.706 -5.829 1.00 0.00 H new ATOM 0 HH11 ARG A 136 12.847 11.193 -4.581 1.00 0.00 H new ATOM 0 HH12 ARG A 136 13.582 12.491 -5.528 1.00 0.00 H new ATOM 0 HH21 ARG A 136 15.999 10.383 -7.053 1.00 0.00 H new ATOM 0 HH22 ARG A 136 15.373 12.030 -6.933 1.00 0.00 H new ATOM 1783 N THR A 137 10.855 3.854 -5.265 1.00 0.00 N ATOM 1784 CA THR A 137 9.996 2.721 -4.965 1.00 0.00 C ATOM 1785 C THR A 137 9.724 1.908 -6.231 1.00 0.00 C ATOM 1786 O THR A 137 8.785 2.199 -6.971 1.00 0.00 O ATOM 1787 CB THR A 137 8.726 3.254 -4.300 1.00 0.00 C ATOM 1788 OG1 THR A 137 7.805 2.170 -4.393 1.00 0.00 O ATOM 1789 CG2 THR A 137 8.067 4.373 -5.108 1.00 0.00 C ATOM 0 H THR A 137 10.785 4.200 -6.222 1.00 0.00 H new ATOM 0 HA THR A 137 10.478 2.032 -4.272 1.00 0.00 H new ATOM 0 HB THR A 137 8.965 3.620 -3.302 1.00 0.00 H new ATOM 0 HG1 THR A 137 6.889 2.516 -4.370 1.00 0.00 H new ATOM 0 HG21 THR A 137 7.170 4.715 -4.592 1.00 0.00 H new ATOM 0 HG22 THR A 137 8.764 5.204 -5.214 1.00 0.00 H new ATOM 0 HG23 THR A 137 7.796 3.998 -6.095 1.00 0.00 H new ATOM 1797 N HIS A 138 10.562 0.903 -6.443 1.00 0.00 N ATOM 1798 CA HIS A 138 10.423 0.046 -7.608 1.00 0.00 C ATOM 1799 C HIS A 138 10.719 -1.404 -7.216 1.00 0.00 C ATOM 1800 O HIS A 138 10.846 -1.717 -6.033 1.00 0.00 O ATOM 1801 CB HIS A 138 11.305 0.541 -8.755 1.00 0.00 C ATOM 1802 CG HIS A 138 11.275 2.038 -8.952 1.00 0.00 C ATOM 1803 ND1 HIS A 138 11.554 2.933 -7.934 1.00 0.00 N ATOM 1804 CD2 HIS A 138 10.996 2.786 -10.057 1.00 0.00 C ATOM 1805 CE1 HIS A 138 11.445 4.162 -8.416 1.00 0.00 C ATOM 1806 NE2 HIS A 138 11.098 4.069 -9.732 1.00 0.00 N ATOM 0 H HIS A 138 11.339 0.663 -5.828 1.00 0.00 H new ATOM 0 HA HIS A 138 9.397 0.086 -7.973 1.00 0.00 H new ATOM 0 HB2 HIS A 138 12.333 0.230 -8.569 1.00 0.00 H new ATOM 0 HB3 HIS A 138 10.987 0.057 -9.679 1.00 0.00 H new ATOM 0 HD2 HIS A 138 10.736 2.400 -11.032 1.00 0.00 H new ATOM 0 HE1 HIS A 138 11.603 5.077 -7.864 1.00 0.00 H new ATOM 0 HE2 HIS A 138 10.943 4.856 -10.362 1.00 0.00 H new ATOM 1814 N TYR A 139 10.819 -2.249 -8.231 1.00 0.00 N ATOM 1815 CA TYR A 139 11.097 -3.657 -8.008 1.00 0.00 C ATOM 1816 C TYR A 139 12.383 -3.841 -7.199 1.00 0.00 C ATOM 1817 O TYR A 139 12.840 -2.913 -6.535 1.00 0.00 O ATOM 1818 CB TYR A 139 11.288 -4.275 -9.394 1.00 0.00 C ATOM 1819 CG TYR A 139 10.366 -5.462 -9.679 1.00 0.00 C ATOM 1820 CD1 TYR A 139 9.086 -5.481 -9.166 1.00 0.00 C ATOM 1821 CD2 TYR A 139 10.816 -6.515 -10.450 1.00 0.00 C ATOM 1822 CE1 TYR A 139 8.218 -6.599 -9.434 1.00 0.00 C ATOM 1823 CE2 TYR A 139 9.949 -7.633 -10.718 1.00 0.00 C ATOM 1824 CZ TYR A 139 8.693 -7.620 -10.197 1.00 0.00 C ATOM 1825 OH TYR A 139 7.874 -8.675 -10.450 1.00 0.00 O ATOM 0 H TYR A 139 10.712 -1.985 -9.211 1.00 0.00 H new ATOM 0 HA TYR A 139 10.285 -4.124 -7.451 1.00 0.00 H new ATOM 0 HB2 TYR A 139 11.119 -3.507 -10.149 1.00 0.00 H new ATOM 0 HB3 TYR A 139 12.323 -4.600 -9.496 1.00 0.00 H new ATOM 0 HD1 TYR A 139 8.734 -4.657 -8.563 1.00 0.00 H new ATOM 0 HD2 TYR A 139 11.818 -6.500 -10.852 1.00 0.00 H new ATOM 0 HE1 TYR A 139 7.213 -6.626 -9.038 1.00 0.00 H new ATOM 0 HE2 TYR A 139 10.289 -8.463 -11.319 1.00 0.00 H new ATOM 0 HH TYR A 139 8.345 -9.328 -11.008 1.00 0.00 H new ATOM 1891 N ILE A 144 7.399 -4.873 -2.154 1.00 0.00 N ATOM 1892 CA ILE A 144 6.225 -4.710 -2.995 1.00 0.00 C ATOM 1893 C ILE A 144 5.319 -5.933 -2.842 1.00 0.00 C ATOM 1894 O ILE A 144 4.101 -5.828 -2.974 1.00 0.00 O ATOM 1895 CB ILE A 144 6.637 -4.427 -4.441 1.00 0.00 C ATOM 1896 CG1 ILE A 144 7.424 -5.601 -5.027 1.00 0.00 C ATOM 1897 CG2 ILE A 144 7.410 -3.110 -4.543 1.00 0.00 C ATOM 1898 CD1 ILE A 144 8.140 -5.192 -6.316 1.00 0.00 C ATOM 0 HA ILE A 144 5.646 -3.843 -2.677 1.00 0.00 H new ATOM 0 HB ILE A 144 5.732 -4.316 -5.039 1.00 0.00 H new ATOM 0 HG12 ILE A 144 8.153 -5.955 -4.298 1.00 0.00 H new ATOM 0 HG13 ILE A 144 6.748 -6.432 -5.230 1.00 0.00 H new ATOM 0 HG21 ILE A 144 7.691 -2.933 -5.581 1.00 0.00 H new ATOM 0 HG22 ILE A 144 6.782 -2.291 -4.192 1.00 0.00 H new ATOM 0 HG23 ILE A 144 8.308 -3.167 -3.929 1.00 0.00 H new ATOM 0 HD11 ILE A 144 8.692 -6.045 -6.712 1.00 0.00 H new ATOM 0 HD12 ILE A 144 7.406 -4.862 -7.051 1.00 0.00 H new ATOM 0 HD13 ILE A 144 8.833 -4.378 -6.105 1.00 0.00 H new ATOM 1910 N LEU A 145 5.949 -7.065 -2.565 1.00 0.00 N ATOM 1911 CA LEU A 145 5.215 -8.307 -2.392 1.00 0.00 C ATOM 1912 C LEU A 145 4.390 -8.232 -1.106 1.00 0.00 C ATOM 1913 O LEU A 145 4.835 -8.683 -0.051 1.00 0.00 O ATOM 1914 CB LEU A 145 6.167 -9.504 -2.443 1.00 0.00 C ATOM 1915 CG LEU A 145 6.569 -9.982 -3.840 1.00 0.00 C ATOM 1916 CD1 LEU A 145 7.419 -8.930 -4.555 1.00 0.00 C ATOM 1917 CD2 LEU A 145 7.273 -11.339 -3.774 1.00 0.00 C ATOM 0 H LEU A 145 6.960 -7.148 -2.456 1.00 0.00 H new ATOM 0 HA LEU A 145 4.513 -8.452 -3.213 1.00 0.00 H new ATOM 0 HB2 LEU A 145 7.073 -9.246 -1.894 1.00 0.00 H new ATOM 0 HB3 LEU A 145 5.701 -10.336 -1.916 1.00 0.00 H new ATOM 0 HG LEU A 145 5.662 -10.118 -4.429 1.00 0.00 H new ATOM 0 HD11 LEU A 145 7.691 -9.294 -5.546 1.00 0.00 H new ATOM 0 HD12 LEU A 145 6.849 -8.006 -4.652 1.00 0.00 H new ATOM 0 HD13 LEU A 145 8.323 -8.739 -3.977 1.00 0.00 H new ATOM 0 HD21 LEU A 145 7.548 -11.656 -4.780 1.00 0.00 H new ATOM 0 HD22 LEU A 145 8.171 -11.254 -3.162 1.00 0.00 H new ATOM 0 HD23 LEU A 145 6.602 -12.076 -3.332 1.00 0.00 H new ATOM 1929 N PHE A 146 3.202 -7.660 -1.235 1.00 0.00 N ATOM 1930 CA PHE A 146 2.310 -7.521 -0.096 1.00 0.00 C ATOM 1931 C PHE A 146 1.372 -8.724 0.016 1.00 0.00 C ATOM 1932 O PHE A 146 0.590 -8.993 -0.894 1.00 0.00 O ATOM 1933 CB PHE A 146 1.477 -6.259 -0.332 1.00 0.00 C ATOM 1934 CG PHE A 146 2.184 -4.963 0.069 1.00 0.00 C ATOM 1935 CD1 PHE A 146 2.927 -4.917 1.208 1.00 0.00 C ATOM 1936 CD2 PHE A 146 2.070 -3.856 -0.713 1.00 0.00 C ATOM 1937 CE1 PHE A 146 3.582 -3.714 1.580 1.00 0.00 C ATOM 1938 CE2 PHE A 146 2.725 -2.653 -0.341 1.00 0.00 C ATOM 1939 CZ PHE A 146 3.468 -2.607 0.798 1.00 0.00 C ATOM 0 H PHE A 146 2.836 -7.287 -2.111 1.00 0.00 H new ATOM 0 HA PHE A 146 2.889 -7.460 0.825 1.00 0.00 H new ATOM 0 HB2 PHE A 146 1.211 -6.204 -1.388 1.00 0.00 H new ATOM 0 HB3 PHE A 146 0.545 -6.341 0.228 1.00 0.00 H new ATOM 0 HD1 PHE A 146 3.018 -5.796 1.829 1.00 0.00 H new ATOM 0 HD2 PHE A 146 1.481 -3.892 -1.617 1.00 0.00 H new ATOM 0 HE1 PHE A 146 4.171 -3.678 2.484 1.00 0.00 H new ATOM 0 HE2 PHE A 146 2.634 -1.774 -0.962 1.00 0.00 H new ATOM 0 HZ PHE A 146 3.967 -1.692 1.081 1.00 0.00 H new ATOM 1949 N LEU A 147 1.480 -9.415 1.141 1.00 0.00 N ATOM 1950 CA LEU A 147 0.651 -10.583 1.385 1.00 0.00 C ATOM 1951 C LEU A 147 -0.496 -10.203 2.323 1.00 0.00 C ATOM 1952 O LEU A 147 -0.281 -9.976 3.512 1.00 0.00 O ATOM 1953 CB LEU A 147 1.502 -11.748 1.895 1.00 0.00 C ATOM 1954 CG LEU A 147 0.995 -13.150 1.552 1.00 0.00 C ATOM 1955 CD1 LEU A 147 -0.120 -13.579 2.508 1.00 0.00 C ATOM 1956 CD2 LEU A 147 0.558 -13.232 0.088 1.00 0.00 C ATOM 0 H LEU A 147 2.129 -9.188 1.894 1.00 0.00 H new ATOM 0 HA LEU A 147 0.201 -10.931 0.455 1.00 0.00 H new ATOM 0 HB2 LEU A 147 2.509 -11.639 1.493 1.00 0.00 H new ATOM 0 HB3 LEU A 147 1.581 -11.667 2.979 1.00 0.00 H new ATOM 0 HG LEU A 147 1.818 -13.852 1.682 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -0.462 -14.579 2.242 1.00 0.00 H new ATOM 0 HD12 LEU A 147 0.259 -13.585 3.530 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -0.952 -12.879 2.434 1.00 0.00 H new ATOM 0 HD21 LEU A 147 0.202 -14.239 -0.130 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -0.244 -12.517 -0.093 1.00 0.00 H new ATOM 0 HD23 LEU A 147 1.404 -12.999 -0.558 1.00 0.00 H new ATOM 1968 N PRO A 148 -1.722 -10.142 1.736 1.00 0.00 N ATOM 1969 CA PRO A 148 -2.903 -9.793 2.507 1.00 0.00 C ATOM 1970 C PRO A 148 -3.346 -10.960 3.392 1.00 0.00 C ATOM 1971 O PRO A 148 -3.508 -12.081 2.912 1.00 0.00 O ATOM 1972 CB PRO A 148 -3.946 -9.404 1.472 1.00 0.00 C ATOM 1973 CG PRO A 148 -3.467 -9.991 0.155 1.00 0.00 C ATOM 1974 CD PRO A 148 -2.014 -10.404 0.330 1.00 0.00 C ATOM 0 HA PRO A 148 -2.724 -8.973 3.202 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -4.927 -9.796 1.740 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -4.043 -8.320 1.404 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -4.077 -10.850 -0.124 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -3.562 -9.258 -0.646 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -1.869 -11.456 0.085 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -1.358 -9.831 -0.324 1.00 0.00 H new ATOM 1982 N LEU A 149 -3.528 -10.656 4.669 1.00 0.00 N ATOM 1983 CA LEU A 149 -3.949 -11.666 5.625 1.00 0.00 C ATOM 1984 C LEU A 149 -5.094 -11.112 6.475 1.00 0.00 C ATOM 1985 O LEU A 149 -4.940 -10.917 7.679 1.00 0.00 O ATOM 1986 CB LEU A 149 -2.755 -12.156 6.447 1.00 0.00 C ATOM 1987 CG LEU A 149 -2.019 -11.090 7.261 1.00 0.00 C ATOM 1988 CD1 LEU A 149 -2.361 -11.202 8.748 1.00 0.00 C ATOM 1989 CD2 LEU A 149 -0.510 -11.156 7.013 1.00 0.00 C ATOM 0 H LEU A 149 -3.392 -9.725 5.063 1.00 0.00 H new ATOM 0 HA LEU A 149 -4.332 -12.545 5.106 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -3.103 -12.931 7.130 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -2.041 -12.625 5.770 1.00 0.00 H new ATOM 0 HG LEU A 149 -2.358 -10.110 6.926 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -1.825 -10.433 9.304 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -3.434 -11.068 8.886 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -2.069 -12.186 9.116 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -0.010 -10.388 7.603 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -0.136 -12.138 7.304 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -0.308 -10.989 5.955 1.00 0.00 H new ATOM 2001 N PRO A 150 -6.247 -10.868 5.796 1.00 0.00 N ATOM 2002 CA PRO A 150 -7.418 -10.341 6.475 1.00 0.00 C ATOM 2003 C PRO A 150 -8.100 -11.424 7.314 1.00 0.00 C ATOM 2004 O PRO A 150 -7.795 -12.607 7.173 1.00 0.00 O ATOM 2005 CB PRO A 150 -8.307 -9.801 5.367 1.00 0.00 C ATOM 2006 CG PRO A 150 -7.821 -10.459 4.086 1.00 0.00 C ATOM 2007 CD PRO A 150 -6.466 -11.088 4.369 1.00 0.00 C ATOM 0 HA PRO A 150 -7.171 -9.554 7.188 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -9.354 -10.039 5.555 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -8.233 -8.715 5.301 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -8.531 -11.216 3.753 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -7.741 -9.723 3.286 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -6.464 -12.151 4.127 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -5.681 -10.624 3.772 1.00 0.00 H new ATOM 2015 N VAL A 151 -9.011 -10.980 8.169 1.00 0.00 N ATOM 2016 CA VAL A 151 -9.738 -11.897 9.030 1.00 0.00 C ATOM 2017 C VAL A 151 -10.846 -11.134 9.759 1.00 0.00 C ATOM 2018 O VAL A 151 -11.003 -11.268 10.971 1.00 0.00 O ATOM 2019 CB VAL A 151 -8.769 -12.599 9.983 1.00 0.00 C ATOM 2020 CG1 VAL A 151 -8.255 -13.907 9.377 1.00 0.00 C ATOM 2021 CG2 VAL A 151 -7.609 -11.678 10.363 1.00 0.00 C ATOM 0 H VAL A 151 -9.262 -9.998 8.283 1.00 0.00 H new ATOM 0 HA VAL A 151 -10.215 -12.679 8.439 1.00 0.00 H new ATOM 0 HB VAL A 151 -9.314 -12.843 10.895 1.00 0.00 H new ATOM 0 HG11 VAL A 151 -7.568 -14.386 10.075 1.00 0.00 H new ATOM 0 HG12 VAL A 151 -9.096 -14.572 9.181 1.00 0.00 H new ATOM 0 HG13 VAL A 151 -7.734 -13.695 8.443 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -6.935 -12.202 11.041 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -7.065 -11.388 9.464 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -7.998 -10.787 10.855 1.00 0.00 H new