USER MOD reduce.3.24.130724 H: found=0, std=0, add=1093, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1094 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 137 ASN : amide:sc= -1.91 K(o=-2.3,f=-8.4!) USER MOD Set 1.2: A 144 THR OG1 : rot -170:sc= -0.413 USER MOD Set 2.1: A 45 SER OG : rot 105:sc= -0.785! USER MOD Set 2.2: A 143 THR OG1 : rot 180:sc= 0.928 USER MOD Set 3.1: A 81 LYS NZ :NH3+ -169:sc= -0.056 (180deg=-0.0183) USER MOD Set 3.2: A 135 GLN : amide:sc= -1.38 X(o=-1.4,f=-1.8) USER MOD Set 4.1: A 54 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 131 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 27 SER OG : rot 170:sc= 0.924 USER MOD Set 5.2: A 30 HIS : no HD1:sc= -0.269 K(o=0.65,f=-0.57) USER MOD Set 6.1: A 13 MET CE :methyl -124:sc= -2.31 (180deg=-4.42!) USER MOD Set 6.2: A 150 THR OG1 : rot 121:sc= 0.496 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 MET CE :methyl -157:sc= -2.34 (180deg=-3.2) USER MOD Single : A 17 ASN : amide:sc=-0.00288 K(o=-0.0029,f=-1.3) USER MOD Single : A 18 LYS NZ :NH3+ -151:sc= -0.908 (180deg=-1.75!) USER MOD Single : A 21 CYS SG : rot 62:sc= 0.418 USER MOD Single : A 23 CYS SG : rot 180:sc= -0.193 USER MOD Single : A 25 ASN : amide:sc= -0.351 X(o=-0.35,f=0) USER MOD Single : A 34 ASN : amide:sc= -1.28 X(o=-1.3,f=-0.95) USER MOD Single : A 35 CYS SG : rot -52:sc= 0.707 USER MOD Single : A 47 CYS SG : rot 180:sc= 0 USER MOD Single : A 50 GLN : amide:sc= -0.0803 X(o=-0.08,f=0) USER MOD Single : A 58 ASN : amide:sc= -0.171 X(o=-0.17,f=0) USER MOD Single : A 59 GLN : amide:sc= -4.41! C(o=-4.4!,f=-6.4!) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot 30:sc= -0.983 USER MOD Single : A 65 SER OG : rot 180:sc= -0.355 USER MOD Single : A 66 MET CE :methyl -156:sc=-0.00601 (180deg=-0.289) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= -0.431 K(o=-0.43,f=-2.5) USER MOD Single : A 73 ASN : amide:sc= -0.394 X(o=-0.39,f=-0.26) USER MOD Single : A 75 GLN :FLIP amide:sc= -1.86! C(o=-3.2!,f=-1.9!) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 ASN :FLIP amide:sc= -0.0131 F(o=-1.3,f=-0.013) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 MET CE :methyl -170:sc= -3.75 (180deg=-4.25) USER MOD Single : A 98 SER OG : rot 91:sc= 0.00449 USER MOD Single : A 101 THR OG1 : rot -120:sc= -0.0695 USER MOD Single : A 102 GLN : amide:sc= -4.84 K(o=-4.8,f=-13!) USER MOD Single : A 107 THR OG1 : rot 180:sc= -0.114 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 GLN : amide:sc= 0.165 X(o=0.16,f=-0.013) USER MOD Single : A 126 ASN : amide:sc= -3.69 X(o=-3.7,f=-4.2!) USER MOD Single : A 128 ASN : amide:sc= -1.42 X(o=-1.4,f=-1.6) USER MOD Single : A 129 SER OG : rot 27:sc= 0.185 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 138 GLN : amide:sc= -1.54 K(o=-1.5,f=-6.5!) USER MOD Single : A 147 SER OG : rot 170:sc= -0.192 USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD Single : A 154 THR OG1 : rot 180:sc= -0.869 USER MOD Single : A 157 GLN : amide:sc=-0.00378 K(o=-0.0038,f=-0.84) USER MOD ----------------------------------------------------------------- ATOM 73 N TYR A 9 12.670 9.369 0.885 1.00 0.00 N ATOM 74 CA TYR A 9 11.752 8.696 1.795 1.00 0.00 C ATOM 75 C TYR A 9 12.102 7.217 1.927 1.00 0.00 C ATOM 76 O TYR A 9 13.102 6.753 1.380 1.00 0.00 O ATOM 77 CB TYR A 9 10.311 8.848 1.305 1.00 0.00 C ATOM 78 CG TYR A 9 9.927 10.276 0.988 1.00 0.00 C ATOM 79 CD1 TYR A 9 9.482 11.134 1.986 1.00 0.00 C ATOM 80 CD2 TYR A 9 10.011 10.767 -0.309 1.00 0.00 C ATOM 81 CE1 TYR A 9 9.130 12.439 1.701 1.00 0.00 C ATOM 82 CE2 TYR A 9 9.663 12.071 -0.603 1.00 0.00 C ATOM 83 CZ TYR A 9 9.222 12.903 0.405 1.00 0.00 C ATOM 84 OH TYR A 9 8.873 14.203 0.117 1.00 0.00 O ATOM 0 HA TYR A 9 11.847 9.162 2.776 1.00 0.00 H new ATOM 0 HB2 TYR A 9 10.173 8.237 0.413 1.00 0.00 H new ATOM 0 HB3 TYR A 9 9.634 8.459 2.066 1.00 0.00 H new ATOM 0 HD1 TYR A 9 9.410 10.775 3.002 1.00 0.00 H new ATOM 0 HD2 TYR A 9 10.354 10.118 -1.101 1.00 0.00 H new ATOM 0 HE1 TYR A 9 8.785 13.093 2.488 1.00 0.00 H new ATOM 0 HE2 TYR A 9 9.736 12.437 -1.616 1.00 0.00 H new ATOM 0 HH TYR A 9 8.996 14.370 -0.841 1.00 0.00 H new ATOM 94 N MET A 10 11.269 6.481 2.657 1.00 0.00 N ATOM 95 CA MET A 10 11.489 5.054 2.860 1.00 0.00 C ATOM 96 C MET A 10 10.204 4.267 2.622 1.00 0.00 C ATOM 97 O MET A 10 9.106 4.761 2.877 1.00 0.00 O ATOM 98 CB MET A 10 12.005 4.792 4.276 1.00 0.00 C ATOM 99 CG MET A 10 12.688 5.995 4.906 1.00 0.00 C ATOM 100 SD MET A 10 13.687 5.555 6.342 1.00 0.00 S ATOM 101 CE MET A 10 12.533 4.533 7.256 1.00 0.00 C ATOM 0 H MET A 10 10.437 6.849 3.117 1.00 0.00 H new ATOM 0 HA MET A 10 12.237 4.721 2.141 1.00 0.00 H new ATOM 0 HB2 MET A 10 11.171 4.486 4.907 1.00 0.00 H new ATOM 0 HB3 MET A 10 12.707 3.958 4.250 1.00 0.00 H new ATOM 0 HG2 MET A 10 13.321 6.479 4.162 1.00 0.00 H new ATOM 0 HG3 MET A 10 11.932 6.722 5.203 1.00 0.00 H new ATOM 0 HE1 MET A 10 12.814 4.519 8.309 1.00 0.00 H new ATOM 0 HE2 MET A 10 11.527 4.940 7.154 1.00 0.00 H new ATOM 0 HE3 MET A 10 12.555 3.517 6.861 1.00 0.00 H new ATOM 111 N ASP A 11 10.349 3.041 2.130 1.00 0.00 N ATOM 112 CA ASP A 11 9.200 2.186 1.857 1.00 0.00 C ATOM 113 C ASP A 11 8.556 1.711 3.156 1.00 0.00 C ATOM 114 O ASP A 11 7.466 1.138 3.148 1.00 0.00 O ATOM 115 CB ASP A 11 9.623 0.982 1.013 1.00 0.00 C ATOM 116 CG ASP A 11 10.688 1.335 -0.006 1.00 0.00 C ATOM 117 OD1 ASP A 11 10.356 2.012 -1.002 1.00 0.00 O ATOM 118 OD2 ASP A 11 11.854 0.935 0.192 1.00 0.00 O ATOM 0 H ASP A 11 11.251 2.617 1.912 1.00 0.00 H new ATOM 0 HA ASP A 11 8.467 2.770 1.301 1.00 0.00 H new ATOM 0 HB2 ASP A 11 9.998 0.196 1.669 1.00 0.00 H new ATOM 0 HB3 ASP A 11 8.751 0.579 0.498 1.00 0.00 H new ATOM 123 N LEU A 12 9.238 1.951 4.271 1.00 0.00 N ATOM 124 CA LEU A 12 8.733 1.548 5.579 1.00 0.00 C ATOM 125 C LEU A 12 8.488 0.043 5.627 1.00 0.00 C ATOM 126 O LEU A 12 7.727 -0.446 6.461 1.00 0.00 O ATOM 127 CB LEU A 12 7.438 2.297 5.901 1.00 0.00 C ATOM 128 CG LEU A 12 7.412 3.781 5.534 1.00 0.00 C ATOM 129 CD1 LEU A 12 5.989 4.315 5.570 1.00 0.00 C ATOM 130 CD2 LEU A 12 8.307 4.578 6.471 1.00 0.00 C ATOM 0 H LEU A 12 10.142 2.423 4.295 1.00 0.00 H new ATOM 0 HA LEU A 12 9.486 1.800 6.325 1.00 0.00 H new ATOM 0 HB2 LEU A 12 6.617 1.801 5.384 1.00 0.00 H new ATOM 0 HB3 LEU A 12 7.244 2.204 6.970 1.00 0.00 H new ATOM 0 HG LEU A 12 7.794 3.891 4.519 1.00 0.00 H new ATOM 0 HD11 LEU A 12 5.990 5.373 5.306 1.00 0.00 H new ATOM 0 HD12 LEU A 12 5.375 3.764 4.857 1.00 0.00 H new ATOM 0 HD13 LEU A 12 5.579 4.192 6.573 1.00 0.00 H new ATOM 0 HD21 LEU A 12 8.276 5.632 6.195 1.00 0.00 H new ATOM 0 HD22 LEU A 12 7.956 4.461 7.496 1.00 0.00 H new ATOM 0 HD23 LEU A 12 9.331 4.213 6.394 1.00 0.00 H new ATOM 142 N MET A 13 9.142 -0.687 4.728 1.00 0.00 N ATOM 143 CA MET A 13 8.998 -2.137 4.671 1.00 0.00 C ATOM 144 C MET A 13 9.344 -2.771 6.015 1.00 0.00 C ATOM 145 O MET A 13 8.565 -3.531 6.589 1.00 0.00 O ATOM 146 CB MET A 13 9.893 -2.717 3.574 1.00 0.00 C ATOM 147 CG MET A 13 9.212 -3.788 2.738 1.00 0.00 C ATOM 148 SD MET A 13 8.359 -3.110 1.301 1.00 0.00 S ATOM 149 CE MET A 13 6.680 -3.643 1.622 1.00 0.00 C ATOM 0 H MET A 13 9.776 -0.298 4.030 1.00 0.00 H new ATOM 0 HA MET A 13 7.958 -2.365 4.439 1.00 0.00 H new ATOM 0 HB2 MET A 13 10.220 -1.910 2.919 1.00 0.00 H new ATOM 0 HB3 MET A 13 10.788 -3.139 4.032 1.00 0.00 H new ATOM 0 HG2 MET A 13 9.956 -4.512 2.406 1.00 0.00 H new ATOM 0 HG3 MET A 13 8.497 -4.328 3.359 1.00 0.00 H new ATOM 0 HE1 MET A 13 6.313 -4.220 0.773 1.00 0.00 H new ATOM 0 HE2 MET A 13 6.660 -4.263 2.518 1.00 0.00 H new ATOM 0 HE3 MET A 13 6.043 -2.771 1.770 1.00 0.00 H new ATOM 159 N PRO A 14 10.542 -2.453 6.529 1.00 0.00 N ATOM 160 CA PRO A 14 11.018 -2.981 7.810 1.00 0.00 C ATOM 161 C PRO A 14 10.248 -2.408 8.996 1.00 0.00 C ATOM 162 O PRO A 14 10.455 -2.816 10.139 1.00 0.00 O ATOM 163 CB PRO A 14 12.481 -2.533 7.857 1.00 0.00 C ATOM 164 CG PRO A 14 12.536 -1.326 6.986 1.00 0.00 C ATOM 165 CD PRO A 14 11.523 -1.553 5.898 1.00 0.00 C ATOM 0 HA PRO A 14 10.886 -4.061 7.880 1.00 0.00 H new ATOM 0 HB2 PRO A 14 12.791 -2.300 8.876 1.00 0.00 H new ATOM 0 HB3 PRO A 14 13.146 -3.315 7.492 1.00 0.00 H new ATOM 0 HG2 PRO A 14 12.304 -0.425 7.553 1.00 0.00 H new ATOM 0 HG3 PRO A 14 13.534 -1.192 6.568 1.00 0.00 H new ATOM 0 HD2 PRO A 14 11.063 -0.619 5.576 1.00 0.00 H new ATOM 0 HD3 PRO A 14 11.975 -2.006 5.016 1.00 0.00 H new ATOM 173 N PHE A 15 9.359 -1.461 8.716 1.00 0.00 N ATOM 174 CA PHE A 15 8.558 -0.832 9.759 1.00 0.00 C ATOM 175 C PHE A 15 7.162 -1.444 9.817 1.00 0.00 C ATOM 176 O PHE A 15 6.367 -1.121 10.699 1.00 0.00 O ATOM 177 CB PHE A 15 8.457 0.675 9.515 1.00 0.00 C ATOM 178 CG PHE A 15 9.756 1.403 9.713 1.00 0.00 C ATOM 179 CD1 PHE A 15 10.788 1.268 8.798 1.00 0.00 C ATOM 180 CD2 PHE A 15 9.945 2.224 10.813 1.00 0.00 C ATOM 181 CE1 PHE A 15 11.984 1.936 8.978 1.00 0.00 C ATOM 182 CE2 PHE A 15 11.139 2.895 10.999 1.00 0.00 C ATOM 183 CZ PHE A 15 12.160 2.751 10.079 1.00 0.00 C ATOM 0 H PHE A 15 9.175 -1.112 7.775 1.00 0.00 H new ATOM 0 HA PHE A 15 9.051 -1.006 10.715 1.00 0.00 H new ATOM 0 HB2 PHE A 15 8.104 0.847 8.498 1.00 0.00 H new ATOM 0 HB3 PHE A 15 7.709 1.094 10.187 1.00 0.00 H new ATOM 0 HD1 PHE A 15 10.656 0.633 7.934 1.00 0.00 H new ATOM 0 HD2 PHE A 15 9.150 2.341 11.534 1.00 0.00 H new ATOM 0 HE1 PHE A 15 12.781 1.821 8.258 1.00 0.00 H new ATOM 0 HE2 PHE A 15 11.274 3.531 11.862 1.00 0.00 H new ATOM 0 HZ PHE A 15 13.094 3.275 10.221 1.00 0.00 H new ATOM 193 N ILE A 16 6.871 -2.329 8.869 1.00 0.00 N ATOM 194 CA ILE A 16 5.572 -2.987 8.812 1.00 0.00 C ATOM 195 C ILE A 16 5.570 -4.272 9.631 1.00 0.00 C ATOM 196 O ILE A 16 6.556 -5.008 9.654 1.00 0.00 O ATOM 197 CB ILE A 16 5.171 -3.315 7.361 1.00 0.00 C ATOM 198 CG1 ILE A 16 5.027 -2.029 6.545 1.00 0.00 C ATOM 199 CG2 ILE A 16 3.875 -4.112 7.338 1.00 0.00 C ATOM 200 CD1 ILE A 16 5.427 -2.186 5.095 1.00 0.00 C ATOM 0 H ILE A 16 7.517 -2.606 8.130 1.00 0.00 H new ATOM 0 HA ILE A 16 4.847 -2.291 9.233 1.00 0.00 H new ATOM 0 HB ILE A 16 5.956 -3.922 6.910 1.00 0.00 H new ATOM 0 HG12 ILE A 16 3.992 -1.692 6.593 1.00 0.00 H new ATOM 0 HG13 ILE A 16 5.638 -1.249 7.000 1.00 0.00 H new ATOM 0 HG21 ILE A 16 3.604 -4.336 6.306 1.00 0.00 H new ATOM 0 HG22 ILE A 16 4.011 -5.043 7.888 1.00 0.00 H new ATOM 0 HG23 ILE A 16 3.081 -3.528 7.803 1.00 0.00 H new ATOM 0 HD11 ILE A 16 5.299 -1.235 4.577 1.00 0.00 H new ATOM 0 HD12 ILE A 16 6.471 -2.494 5.037 1.00 0.00 H new ATOM 0 HD13 ILE A 16 4.799 -2.943 4.624 1.00 0.00 H new ATOM 212 N ASN A 17 4.454 -4.537 10.303 1.00 0.00 N ATOM 213 CA ASN A 17 4.323 -5.736 11.124 1.00 0.00 C ATOM 214 C ASN A 17 3.510 -6.805 10.401 1.00 0.00 C ATOM 215 O ASN A 17 2.279 -6.770 10.400 1.00 0.00 O ATOM 216 CB ASN A 17 3.661 -5.393 12.461 1.00 0.00 C ATOM 217 CG ASN A 17 3.750 -6.532 13.459 1.00 0.00 C ATOM 218 OD1 ASN A 17 4.688 -7.329 13.425 1.00 0.00 O ATOM 219 ND2 ASN A 17 2.773 -6.612 14.353 1.00 0.00 N ATOM 0 H ASN A 17 3.628 -3.938 10.295 1.00 0.00 H new ATOM 0 HA ASN A 17 5.322 -6.130 11.310 1.00 0.00 H new ATOM 0 HB2 ASN A 17 4.136 -4.507 12.882 1.00 0.00 H new ATOM 0 HB3 ASN A 17 2.614 -5.143 12.291 1.00 0.00 H new ATOM 0 HD21 ASN A 17 2.779 -7.357 15.050 1.00 0.00 H new ATOM 0 HD22 ASN A 17 2.016 -5.929 14.343 1.00 0.00 H new ATOM 226 N LYS A 18 4.206 -7.754 9.785 1.00 0.00 N ATOM 227 CA LYS A 18 3.551 -8.835 9.059 1.00 0.00 C ATOM 228 C LYS A 18 2.798 -9.755 10.014 1.00 0.00 C ATOM 229 O LYS A 18 1.841 -10.422 9.623 1.00 0.00 O ATOM 230 CB LYS A 18 4.581 -9.641 8.265 1.00 0.00 C ATOM 231 CG LYS A 18 5.236 -8.854 7.142 1.00 0.00 C ATOM 232 CD LYS A 18 4.873 -9.420 5.780 1.00 0.00 C ATOM 233 CE LYS A 18 6.040 -9.326 4.809 1.00 0.00 C ATOM 234 NZ LYS A 18 6.595 -7.946 4.740 1.00 0.00 N ATOM 0 H LYS A 18 5.225 -7.796 9.774 1.00 0.00 H new ATOM 0 HA LYS A 18 2.834 -8.392 8.368 1.00 0.00 H new ATOM 0 HB2 LYS A 18 5.354 -9.998 8.946 1.00 0.00 H new ATOM 0 HB3 LYS A 18 4.095 -10.522 7.845 1.00 0.00 H new ATOM 0 HG2 LYS A 18 4.925 -7.811 7.198 1.00 0.00 H new ATOM 0 HG3 LYS A 18 6.319 -8.871 7.268 1.00 0.00 H new ATOM 0 HD2 LYS A 18 4.570 -10.462 5.887 1.00 0.00 H new ATOM 0 HD3 LYS A 18 4.017 -8.879 5.376 1.00 0.00 H new ATOM 0 HE2 LYS A 18 6.824 -10.018 5.116 1.00 0.00 H new ATOM 0 HE3 LYS A 18 5.712 -9.636 3.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 7.003 -7.783 3.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 5.835 -7.257 4.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 7.335 -7.833 5.462 1.00 0.00 H new ATOM 248 N ALA A 19 3.235 -9.783 11.269 1.00 0.00 N ATOM 249 CA ALA A 19 2.599 -10.618 12.281 1.00 0.00 C ATOM 250 C ALA A 19 1.232 -10.065 12.669 1.00 0.00 C ATOM 251 O ALA A 19 0.387 -10.787 13.196 1.00 0.00 O ATOM 252 CB ALA A 19 3.492 -10.732 13.508 1.00 0.00 C ATOM 0 H ALA A 19 4.027 -9.237 11.609 1.00 0.00 H new ATOM 0 HA ALA A 19 2.453 -11.612 11.858 1.00 0.00 H new ATOM 0 HB1 ALA A 19 3.005 -11.358 14.256 1.00 0.00 H new ATOM 0 HB2 ALA A 19 4.444 -11.180 13.224 1.00 0.00 H new ATOM 0 HB3 ALA A 19 3.667 -9.740 13.924 1.00 0.00 H new ATOM 258 N GLY A 20 1.023 -8.779 12.406 1.00 0.00 N ATOM 259 CA GLY A 20 -0.244 -8.151 12.735 1.00 0.00 C ATOM 260 C GLY A 20 -1.057 -7.804 11.504 1.00 0.00 C ATOM 261 O GLY A 20 -2.179 -7.310 11.612 1.00 0.00 O ATOM 0 H GLY A 20 1.708 -8.161 11.971 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -0.823 -8.820 13.372 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -0.058 -7.244 13.311 1.00 0.00 H new ATOM 265 N CYS A 21 -0.489 -8.062 10.331 1.00 0.00 N ATOM 266 CA CYS A 21 -1.168 -7.771 9.073 1.00 0.00 C ATOM 267 C CYS A 21 -2.379 -8.680 8.886 1.00 0.00 C ATOM 268 O CYS A 21 -2.442 -9.769 9.455 1.00 0.00 O ATOM 269 CB CYS A 21 -0.203 -7.938 7.898 1.00 0.00 C ATOM 270 SG CYS A 21 0.896 -6.525 7.640 1.00 0.00 S ATOM 0 H CYS A 21 0.439 -8.472 10.225 1.00 0.00 H new ATOM 0 HA CYS A 21 -1.514 -6.738 9.105 1.00 0.00 H new ATOM 0 HB2 CYS A 21 0.402 -8.830 8.062 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -0.780 -8.107 6.989 1.00 0.00 H new ATOM 0 HG CYS A 21 1.646 -6.361 8.689 1.00 0.00 H new ATOM 276 N GLU A 22 -3.337 -8.224 8.085 1.00 0.00 N ATOM 277 CA GLU A 22 -4.546 -8.996 7.825 1.00 0.00 C ATOM 278 C GLU A 22 -4.976 -8.860 6.368 1.00 0.00 C ATOM 279 O GLU A 22 -4.981 -7.761 5.811 1.00 0.00 O ATOM 280 CB GLU A 22 -5.678 -8.538 8.748 1.00 0.00 C ATOM 281 CG GLU A 22 -7.048 -9.043 8.326 1.00 0.00 C ATOM 282 CD GLU A 22 -7.859 -9.573 9.493 1.00 0.00 C ATOM 283 OE1 GLU A 22 -8.349 -8.753 10.297 1.00 0.00 O ATOM 284 OE2 GLU A 22 -8.003 -10.809 9.601 1.00 0.00 O ATOM 0 H GLU A 22 -3.299 -7.325 7.605 1.00 0.00 H new ATOM 0 HA GLU A 22 -4.326 -10.045 8.024 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -5.470 -8.880 9.762 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -5.694 -7.448 8.776 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -7.597 -8.234 7.845 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -6.928 -9.832 7.584 1.00 0.00 H new ATOM 291 N CYS A 23 -5.336 -9.982 5.756 1.00 0.00 N ATOM 292 CA CYS A 23 -5.767 -9.990 4.362 1.00 0.00 C ATOM 293 C CYS A 23 -7.178 -10.553 4.232 1.00 0.00 C ATOM 294 O CYS A 23 -7.563 -11.469 4.961 1.00 0.00 O ATOM 295 CB CYS A 23 -4.797 -10.810 3.511 1.00 0.00 C ATOM 296 SG CYS A 23 -4.376 -12.421 4.217 1.00 0.00 S ATOM 0 H CYS A 23 -5.338 -10.899 6.203 1.00 0.00 H new ATOM 0 HA CYS A 23 -5.772 -8.961 4.003 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -5.234 -10.961 2.524 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -3.881 -10.237 3.369 1.00 0.00 H new ATOM 0 HG CYS A 23 -3.553 -13.040 3.424 1.00 0.00 H new ATOM 302 N LEU A 24 -7.947 -9.999 3.301 1.00 0.00 N ATOM 303 CA LEU A 24 -9.318 -10.445 3.076 1.00 0.00 C ATOM 304 C LEU A 24 -9.461 -11.094 1.703 1.00 0.00 C ATOM 305 O LEU A 24 -9.034 -10.535 0.694 1.00 0.00 O ATOM 306 CB LEU A 24 -10.285 -9.266 3.199 1.00 0.00 C ATOM 307 CG LEU A 24 -10.131 -8.398 4.449 1.00 0.00 C ATOM 308 CD1 LEU A 24 -11.295 -7.428 4.572 1.00 0.00 C ATOM 309 CD2 LEU A 24 -10.024 -9.269 5.692 1.00 0.00 C ATOM 0 H LEU A 24 -7.645 -9.240 2.690 1.00 0.00 H new ATOM 0 HA LEU A 24 -9.562 -11.188 3.836 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -10.164 -8.630 2.322 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -11.304 -9.653 3.173 1.00 0.00 H new ATOM 0 HG LEU A 24 -9.212 -7.819 4.356 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -11.168 -6.819 5.467 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -11.324 -6.782 3.695 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -12.228 -7.987 4.643 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -9.915 -8.635 6.572 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -10.925 -9.875 5.790 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -9.155 -9.922 5.605 1.00 0.00 H new ATOM 321 N ASN A 25 -10.067 -12.276 1.674 1.00 0.00 N ATOM 322 CA ASN A 25 -10.268 -13.001 0.424 1.00 0.00 C ATOM 323 C ASN A 25 -8.932 -13.382 -0.205 1.00 0.00 C ATOM 324 O ASN A 25 -8.797 -13.414 -1.428 1.00 0.00 O ATOM 325 CB ASN A 25 -11.083 -12.153 -0.556 1.00 0.00 C ATOM 326 CG ASN A 25 -11.871 -13.000 -1.536 1.00 0.00 C ATOM 327 OD1 ASN A 25 -12.809 -13.700 -1.155 1.00 0.00 O ATOM 328 ND2 ASN A 25 -11.491 -12.941 -2.807 1.00 0.00 N ATOM 0 H ASN A 25 -10.427 -12.752 2.501 1.00 0.00 H new ATOM 0 HA ASN A 25 -10.818 -13.915 0.648 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -11.769 -11.516 0.002 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -10.412 -11.494 -1.107 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -11.983 -13.490 -3.512 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -10.708 -12.347 -3.078 1.00 0.00 H new ATOM 335 N GLU A 26 -7.947 -13.671 0.640 1.00 0.00 N ATOM 336 CA GLU A 26 -6.621 -14.050 0.166 1.00 0.00 C ATOM 337 C GLU A 26 -6.653 -15.422 -0.501 1.00 0.00 C ATOM 338 O GLU A 26 -7.209 -16.376 0.044 1.00 0.00 O ATOM 339 CB GLU A 26 -5.623 -14.057 1.326 1.00 0.00 C ATOM 340 CG GLU A 26 -4.249 -14.582 0.944 1.00 0.00 C ATOM 341 CD GLU A 26 -3.842 -15.796 1.756 1.00 0.00 C ATOM 342 OE1 GLU A 26 -4.234 -15.878 2.938 1.00 0.00 O ATOM 343 OE2 GLU A 26 -3.130 -16.664 1.208 1.00 0.00 O ATOM 0 H GLU A 26 -8.042 -13.650 1.655 1.00 0.00 H new ATOM 0 HA GLU A 26 -6.303 -13.314 -0.572 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -5.521 -13.043 1.712 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -6.024 -14.667 2.135 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -4.244 -14.840 -0.115 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -3.511 -13.792 1.083 1.00 0.00 H new ATOM 350 N SER A 27 -6.054 -15.513 -1.683 1.00 0.00 N ATOM 351 CA SER A 27 -6.017 -16.767 -2.427 1.00 0.00 C ATOM 352 C SER A 27 -5.441 -17.890 -1.570 1.00 0.00 C ATOM 353 O SER A 27 -4.706 -17.642 -0.614 1.00 0.00 O ATOM 354 CB SER A 27 -5.185 -16.604 -3.701 1.00 0.00 C ATOM 355 OG SER A 27 -4.520 -17.810 -4.033 1.00 0.00 O ATOM 0 H SER A 27 -5.587 -14.734 -2.147 1.00 0.00 H new ATOM 0 HA SER A 27 -7.039 -17.030 -2.700 1.00 0.00 H new ATOM 0 HB2 SER A 27 -5.831 -16.303 -4.525 1.00 0.00 H new ATOM 0 HB3 SER A 27 -4.453 -15.808 -3.562 1.00 0.00 H new ATOM 0 HG SER A 27 -4.128 -17.732 -4.928 1.00 0.00 H new ATOM 361 N ASP A 28 -5.780 -19.126 -1.920 1.00 0.00 N ATOM 362 CA ASP A 28 -5.297 -20.289 -1.185 1.00 0.00 C ATOM 363 C ASP A 28 -3.916 -20.708 -1.678 1.00 0.00 C ATOM 364 O ASP A 28 -3.056 -21.095 -0.888 1.00 0.00 O ATOM 365 CB ASP A 28 -6.278 -21.453 -1.329 1.00 0.00 C ATOM 366 CG ASP A 28 -7.582 -21.205 -0.597 1.00 0.00 C ATOM 367 OD1 ASP A 28 -7.829 -20.046 -0.202 1.00 0.00 O ATOM 368 OD2 ASP A 28 -8.356 -22.169 -0.418 1.00 0.00 O ATOM 0 H ASP A 28 -6.388 -19.348 -2.708 1.00 0.00 H new ATOM 0 HA ASP A 28 -5.220 -20.017 -0.132 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -6.484 -21.622 -2.386 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -5.817 -22.363 -0.945 1.00 0.00 H new ATOM 373 N GLU A 29 -3.711 -20.628 -2.989 1.00 0.00 N ATOM 374 CA GLU A 29 -2.435 -21.001 -3.587 1.00 0.00 C ATOM 375 C GLU A 29 -1.438 -19.848 -3.507 1.00 0.00 C ATOM 376 O GLU A 29 -0.225 -20.060 -3.496 1.00 0.00 O ATOM 377 CB GLU A 29 -2.632 -21.419 -5.046 1.00 0.00 C ATOM 378 CG GLU A 29 -3.770 -22.404 -5.249 1.00 0.00 C ATOM 379 CD GLU A 29 -3.782 -23.504 -4.205 1.00 0.00 C ATOM 380 OE1 GLU A 29 -2.765 -24.219 -4.086 1.00 0.00 O ATOM 381 OE2 GLU A 29 -4.808 -23.651 -3.509 1.00 0.00 O ATOM 0 H GLU A 29 -4.412 -20.308 -3.657 1.00 0.00 H new ATOM 0 HA GLU A 29 -2.034 -21.845 -3.026 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -2.821 -20.530 -5.647 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -1.708 -21.863 -5.416 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -4.719 -21.869 -5.218 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -3.687 -22.850 -6.240 1.00 0.00 H new ATOM 388 N HIS A 30 -1.960 -18.627 -3.451 1.00 0.00 N ATOM 389 CA HIS A 30 -1.117 -17.439 -3.371 1.00 0.00 C ATOM 390 C HIS A 30 -1.400 -16.656 -2.093 1.00 0.00 C ATOM 391 O HIS A 30 -2.531 -16.623 -1.611 1.00 0.00 O ATOM 392 CB HIS A 30 -1.343 -16.545 -4.591 1.00 0.00 C ATOM 393 CG HIS A 30 -1.387 -17.297 -5.885 1.00 0.00 C ATOM 394 ND1 HIS A 30 -2.463 -17.251 -6.746 1.00 0.00 N ATOM 395 CD2 HIS A 30 -0.478 -18.116 -6.465 1.00 0.00 C ATOM 396 CE1 HIS A 30 -2.216 -18.011 -7.798 1.00 0.00 C ATOM 397 NE2 HIS A 30 -1.017 -18.547 -7.652 1.00 0.00 N ATOM 0 H HIS A 30 -2.962 -18.434 -3.460 1.00 0.00 H new ATOM 0 HA HIS A 30 -0.076 -17.763 -3.354 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -2.279 -16.001 -4.464 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -0.547 -15.802 -4.639 1.00 0.00 H new ATOM 0 HD2 HIS A 30 0.491 -18.381 -6.068 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -2.881 -18.168 -8.635 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -0.565 -19.178 -8.314 1.00 0.00 H new ATOM 405 N GLY A 31 -0.363 -16.028 -1.547 1.00 0.00 N ATOM 406 CA GLY A 31 -0.521 -15.255 -0.329 1.00 0.00 C ATOM 407 C GLY A 31 -0.458 -13.761 -0.578 1.00 0.00 C ATOM 408 O GLY A 31 0.074 -13.316 -1.594 1.00 0.00 O ATOM 0 H GLY A 31 0.584 -16.041 -1.927 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -1.476 -15.503 0.134 1.00 0.00 H new ATOM 0 HA3 GLY A 31 0.259 -15.535 0.379 1.00 0.00 H new ATOM 412 N PHE A 32 -1.005 -12.985 0.352 1.00 0.00 N ATOM 413 CA PHE A 32 -1.012 -11.532 0.227 1.00 0.00 C ATOM 414 C PHE A 32 0.302 -10.937 0.724 1.00 0.00 C ATOM 415 O PHE A 32 0.478 -9.719 0.741 1.00 0.00 O ATOM 416 CB PHE A 32 -2.183 -10.937 1.012 1.00 0.00 C ATOM 417 CG PHE A 32 -3.176 -10.212 0.149 1.00 0.00 C ATOM 418 CD1 PHE A 32 -2.791 -9.109 -0.596 1.00 0.00 C ATOM 419 CD2 PHE A 32 -4.495 -10.633 0.085 1.00 0.00 C ATOM 420 CE1 PHE A 32 -3.702 -8.440 -1.391 1.00 0.00 C ATOM 421 CE2 PHE A 32 -5.410 -9.968 -0.709 1.00 0.00 C ATOM 422 CZ PHE A 32 -5.014 -8.869 -1.447 1.00 0.00 C ATOM 0 H PHE A 32 -1.449 -13.338 1.200 1.00 0.00 H new ATOM 0 HA PHE A 32 -1.127 -11.284 -0.828 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -2.695 -11.737 1.548 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -1.795 -10.248 1.762 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -1.767 -8.768 -0.555 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -4.811 -11.490 0.662 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -3.389 -7.583 -1.968 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -6.434 -10.307 -0.753 1.00 0.00 H new ATOM 0 HZ PHE A 32 -5.728 -8.347 -2.066 1.00 0.00 H new ATOM 432 N ASP A 33 1.222 -11.806 1.129 1.00 0.00 N ATOM 433 CA ASP A 33 2.521 -11.369 1.627 1.00 0.00 C ATOM 434 C ASP A 33 3.571 -11.421 0.522 1.00 0.00 C ATOM 435 O ASP A 33 4.604 -10.756 0.601 1.00 0.00 O ATOM 436 CB ASP A 33 2.959 -12.239 2.805 1.00 0.00 C ATOM 437 CG ASP A 33 2.128 -11.990 4.049 1.00 0.00 C ATOM 438 OD1 ASP A 33 0.894 -12.168 3.982 1.00 0.00 O ATOM 439 OD2 ASP A 33 2.712 -11.618 5.088 1.00 0.00 O ATOM 0 H ASP A 33 1.092 -12.818 1.122 1.00 0.00 H new ATOM 0 HA ASP A 33 2.425 -10.337 1.965 1.00 0.00 H new ATOM 0 HB2 ASP A 33 2.883 -13.290 2.525 1.00 0.00 H new ATOM 0 HB3 ASP A 33 4.008 -12.043 3.027 1.00 0.00 H new ATOM 444 N ASN A 34 3.301 -12.216 -0.508 1.00 0.00 N ATOM 445 CA ASN A 34 4.224 -12.356 -1.629 1.00 0.00 C ATOM 446 C ASN A 34 4.177 -11.125 -2.529 1.00 0.00 C ATOM 447 O ASN A 34 5.008 -10.966 -3.424 1.00 0.00 O ATOM 448 CB ASN A 34 3.887 -13.609 -2.440 1.00 0.00 C ATOM 449 CG ASN A 34 3.538 -14.792 -1.559 1.00 0.00 C ATOM 450 OD1 ASN A 34 3.983 -14.881 -0.415 1.00 0.00 O ATOM 451 ND2 ASN A 34 2.736 -15.709 -2.089 1.00 0.00 N ATOM 0 H ASN A 34 2.451 -12.773 -0.590 1.00 0.00 H new ATOM 0 HA ASN A 34 5.233 -12.452 -1.228 1.00 0.00 H new ATOM 0 HB2 ASN A 34 3.049 -13.394 -3.104 1.00 0.00 H new ATOM 0 HB3 ASN A 34 4.736 -13.868 -3.072 1.00 0.00 H new ATOM 0 HD21 ASN A 34 2.466 -16.527 -1.543 1.00 0.00 H new ATOM 0 HD22 ASN A 34 2.390 -15.595 -3.042 1.00 0.00 H new ATOM 458 N CYS A 35 3.200 -10.258 -2.286 1.00 0.00 N ATOM 459 CA CYS A 35 3.045 -9.041 -3.075 1.00 0.00 C ATOM 460 C CYS A 35 3.624 -7.838 -2.338 1.00 0.00 C ATOM 461 O CYS A 35 3.307 -6.690 -2.655 1.00 0.00 O ATOM 462 CB CYS A 35 1.568 -8.798 -3.390 1.00 0.00 C ATOM 463 SG CYS A 35 0.590 -8.255 -1.969 1.00 0.00 S ATOM 0 H CYS A 35 2.504 -10.375 -1.550 1.00 0.00 H new ATOM 0 HA CYS A 35 3.592 -9.170 -4.009 1.00 0.00 H new ATOM 0 HB2 CYS A 35 1.494 -8.047 -4.177 1.00 0.00 H new ATOM 0 HB3 CYS A 35 1.136 -9.717 -3.785 1.00 0.00 H new ATOM 0 HG CYS A 35 0.774 -9.075 -0.977 1.00 0.00 H new ATOM 469 N LEU A 36 4.474 -8.107 -1.353 1.00 0.00 N ATOM 470 CA LEU A 36 5.098 -7.046 -0.570 1.00 0.00 C ATOM 471 C LEU A 36 6.509 -6.756 -1.072 1.00 0.00 C ATOM 472 O LEU A 36 7.002 -5.634 -0.952 1.00 0.00 O ATOM 473 CB LEU A 36 5.141 -7.436 0.909 1.00 0.00 C ATOM 474 CG LEU A 36 3.859 -7.191 1.705 1.00 0.00 C ATOM 475 CD1 LEU A 36 3.758 -8.165 2.868 1.00 0.00 C ATOM 476 CD2 LEU A 36 3.807 -5.754 2.204 1.00 0.00 C ATOM 0 H LEU A 36 4.747 -9.050 -1.078 1.00 0.00 H new ATOM 0 HA LEU A 36 4.499 -6.143 -0.685 1.00 0.00 H new ATOM 0 HB2 LEU A 36 5.391 -8.495 0.978 1.00 0.00 H new ATOM 0 HB3 LEU A 36 5.952 -6.885 1.386 1.00 0.00 H new ATOM 0 HG LEU A 36 3.008 -7.356 1.045 1.00 0.00 H new ATOM 0 HD11 LEU A 36 2.839 -7.975 3.423 1.00 0.00 H new ATOM 0 HD12 LEU A 36 3.748 -9.186 2.487 1.00 0.00 H new ATOM 0 HD13 LEU A 36 4.615 -8.033 3.529 1.00 0.00 H new ATOM 0 HD21 LEU A 36 2.888 -5.598 2.768 1.00 0.00 H new ATOM 0 HD22 LEU A 36 4.665 -5.561 2.848 1.00 0.00 H new ATOM 0 HD23 LEU A 36 3.831 -5.072 1.354 1.00 0.00 H new ATOM 594 N LEU A 43 0.082 -12.031 -5.876 1.00 0.00 N ATOM 595 CA LEU A 43 -1.182 -12.320 -5.207 1.00 0.00 C ATOM 596 C LEU A 43 -2.348 -12.234 -6.186 1.00 0.00 C ATOM 597 O LEU A 43 -2.749 -11.145 -6.594 1.00 0.00 O ATOM 598 CB LEU A 43 -1.402 -11.347 -4.047 1.00 0.00 C ATOM 599 CG LEU A 43 -2.670 -11.564 -3.220 1.00 0.00 C ATOM 600 CD1 LEU A 43 -3.868 -10.922 -3.901 1.00 0.00 C ATOM 601 CD2 LEU A 43 -2.914 -13.050 -2.998 1.00 0.00 C ATOM 0 HA LEU A 43 -1.134 -13.336 -4.816 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -0.542 -11.408 -3.380 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -1.423 -10.334 -4.448 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.533 -11.089 -2.249 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -4.761 -11.087 -3.298 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.695 -9.851 -4.008 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.008 -11.367 -4.886 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.820 -13.186 -2.408 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.030 -13.547 -3.961 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.066 -13.482 -2.466 1.00 0.00 H new ATOM 613 N GLU A 44 -2.889 -13.391 -6.557 1.00 0.00 N ATOM 614 CA GLU A 44 -4.011 -13.445 -7.487 1.00 0.00 C ATOM 615 C GLU A 44 -5.326 -13.652 -6.742 1.00 0.00 C ATOM 616 O GLU A 44 -5.427 -14.512 -5.867 1.00 0.00 O ATOM 617 CB GLU A 44 -3.805 -14.570 -8.503 1.00 0.00 C ATOM 618 CG GLU A 44 -4.810 -14.552 -9.643 1.00 0.00 C ATOM 619 CD GLU A 44 -4.423 -15.482 -10.777 1.00 0.00 C ATOM 620 OE1 GLU A 44 -3.405 -15.209 -11.446 1.00 0.00 O ATOM 621 OE2 GLU A 44 -5.138 -16.482 -10.994 1.00 0.00 O ATOM 0 H GLU A 44 -2.569 -14.302 -6.228 1.00 0.00 H new ATOM 0 HA GLU A 44 -4.059 -12.492 -8.015 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -2.799 -14.496 -8.916 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -3.869 -15.529 -7.989 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -5.791 -14.838 -9.262 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -4.901 -13.536 -10.026 1.00 0.00 H new ATOM 628 N SER A 45 -6.331 -12.858 -7.095 1.00 0.00 N ATOM 629 CA SER A 45 -7.640 -12.950 -6.457 1.00 0.00 C ATOM 630 C SER A 45 -8.402 -14.173 -6.957 1.00 0.00 C ATOM 631 O SER A 45 -8.452 -14.439 -8.158 1.00 0.00 O ATOM 632 CB SER A 45 -8.453 -11.683 -6.727 1.00 0.00 C ATOM 633 OG SER A 45 -7.629 -10.646 -7.232 1.00 0.00 O ATOM 0 H SER A 45 -6.265 -12.143 -7.820 1.00 0.00 H new ATOM 0 HA SER A 45 -7.487 -13.052 -5.383 1.00 0.00 H new ATOM 0 HB2 SER A 45 -9.247 -11.902 -7.442 1.00 0.00 H new ATOM 0 HB3 SER A 45 -8.935 -11.353 -5.807 1.00 0.00 H new ATOM 0 HG SER A 45 -7.785 -10.544 -8.194 1.00 0.00 H new ATOM 639 N ASP A 46 -8.995 -14.914 -6.027 1.00 0.00 N ATOM 640 CA ASP A 46 -9.757 -16.109 -6.372 1.00 0.00 C ATOM 641 C ASP A 46 -11.242 -15.786 -6.507 1.00 0.00 C ATOM 642 O ASP A 46 -12.091 -16.672 -6.406 1.00 0.00 O ATOM 643 CB ASP A 46 -9.552 -17.193 -5.313 1.00 0.00 C ATOM 644 CG ASP A 46 -10.458 -17.007 -4.111 1.00 0.00 C ATOM 645 OD1 ASP A 46 -10.156 -16.136 -3.270 1.00 0.00 O ATOM 646 OD2 ASP A 46 -11.469 -17.734 -4.012 1.00 0.00 O ATOM 0 H ASP A 46 -8.963 -14.708 -5.028 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.395 -16.477 -7.332 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -9.739 -18.171 -5.757 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -8.512 -17.185 -4.985 1.00 0.00 H new ATOM 651 N CYS A 47 -11.547 -14.514 -6.736 1.00 0.00 N ATOM 652 CA CYS A 47 -12.930 -14.074 -6.883 1.00 0.00 C ATOM 653 C CYS A 47 -13.019 -12.860 -7.802 1.00 0.00 C ATOM 654 O CYS A 47 -13.657 -12.910 -8.854 1.00 0.00 O ATOM 655 CB CYS A 47 -13.529 -13.739 -5.516 1.00 0.00 C ATOM 656 SG CYS A 47 -15.307 -13.414 -5.550 1.00 0.00 S ATOM 0 H CYS A 47 -10.856 -13.769 -6.824 1.00 0.00 H new ATOM 0 HA CYS A 47 -13.499 -14.889 -7.331 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -13.335 -14.566 -4.833 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -13.018 -12.865 -5.112 1.00 0.00 H new ATOM 0 HG CYS A 47 -15.722 -13.143 -4.348 1.00 0.00 H new ATOM 662 N ASP A 48 -12.377 -11.770 -7.397 1.00 0.00 N ATOM 663 CA ASP A 48 -12.384 -10.542 -8.184 1.00 0.00 C ATOM 664 C ASP A 48 -11.559 -9.455 -7.502 1.00 0.00 C ATOM 665 O ASP A 48 -10.857 -9.716 -6.526 1.00 0.00 O ATOM 666 CB ASP A 48 -13.818 -10.054 -8.395 1.00 0.00 C ATOM 667 CG ASP A 48 -14.218 -10.047 -9.857 1.00 0.00 C ATOM 668 OD1 ASP A 48 -14.008 -9.013 -10.525 1.00 0.00 O ATOM 669 OD2 ASP A 48 -14.743 -11.075 -10.334 1.00 0.00 O ATOM 0 H ASP A 48 -11.845 -11.711 -6.529 1.00 0.00 H new ATOM 0 HA ASP A 48 -11.936 -10.759 -9.154 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -14.502 -10.694 -7.837 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -13.920 -9.048 -7.989 1.00 0.00 H new ATOM 674 N GLU A 49 -11.648 -8.236 -8.025 1.00 0.00 N ATOM 675 CA GLU A 49 -10.907 -7.110 -7.467 1.00 0.00 C ATOM 676 C GLU A 49 -11.613 -6.552 -6.234 1.00 0.00 C ATOM 677 O GLU A 49 -11.949 -5.370 -6.182 1.00 0.00 O ATOM 678 CB GLU A 49 -10.743 -6.009 -8.516 1.00 0.00 C ATOM 679 CG GLU A 49 -12.040 -5.632 -9.212 1.00 0.00 C ATOM 680 CD GLU A 49 -12.245 -6.385 -10.512 1.00 0.00 C ATOM 681 OE1 GLU A 49 -11.502 -7.358 -10.757 1.00 0.00 O ATOM 682 OE2 GLU A 49 -13.148 -6.001 -11.285 1.00 0.00 O ATOM 0 H GLU A 49 -12.225 -8.003 -8.833 1.00 0.00 H new ATOM 0 HA GLU A 49 -9.921 -7.468 -7.169 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -10.326 -5.123 -8.038 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -10.021 -6.337 -9.264 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -12.878 -5.833 -8.544 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -12.042 -4.561 -9.413 1.00 0.00 H new ATOM 689 N GLN A 50 -11.834 -7.413 -5.246 1.00 0.00 N ATOM 690 CA GLN A 50 -12.501 -7.007 -4.015 1.00 0.00 C ATOM 691 C GLN A 50 -11.735 -7.503 -2.792 1.00 0.00 C ATOM 692 O GLN A 50 -12.334 -7.908 -1.795 1.00 0.00 O ATOM 693 CB GLN A 50 -13.934 -7.541 -3.985 1.00 0.00 C ATOM 694 CG GLN A 50 -14.857 -6.862 -4.985 1.00 0.00 C ATOM 695 CD GLN A 50 -15.830 -5.906 -4.324 1.00 0.00 C ATOM 696 OE1 GLN A 50 -16.772 -6.326 -3.653 1.00 0.00 O ATOM 697 NE2 GLN A 50 -15.606 -4.610 -4.511 1.00 0.00 N ATOM 0 H GLN A 50 -11.561 -8.395 -5.274 1.00 0.00 H new ATOM 0 HA GLN A 50 -12.527 -5.918 -3.988 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -13.918 -8.612 -4.187 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -14.340 -7.412 -2.982 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -14.258 -6.318 -5.715 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -15.415 -7.621 -5.533 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -14.812 -4.306 -5.075 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -16.228 -3.919 -4.090 1.00 0.00 H new ATOM 706 N LEU A 51 -10.410 -7.469 -2.876 1.00 0.00 N ATOM 707 CA LEU A 51 -9.562 -7.916 -1.777 1.00 0.00 C ATOM 708 C LEU A 51 -9.086 -6.732 -0.940 1.00 0.00 C ATOM 709 O LEU A 51 -8.907 -5.627 -1.454 1.00 0.00 O ATOM 710 CB LEU A 51 -8.358 -8.690 -2.317 1.00 0.00 C ATOM 711 CG LEU A 51 -8.642 -9.653 -3.470 1.00 0.00 C ATOM 712 CD1 LEU A 51 -7.886 -9.227 -4.719 1.00 0.00 C ATOM 713 CD2 LEU A 51 -8.272 -11.076 -3.080 1.00 0.00 C ATOM 0 H LEU A 51 -9.899 -7.136 -3.694 1.00 0.00 H new ATOM 0 HA LEU A 51 -10.153 -8.574 -1.140 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -7.608 -7.971 -2.647 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -7.918 -9.257 -1.497 1.00 0.00 H new ATOM 0 HG LEU A 51 -9.710 -9.624 -3.688 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -8.100 -9.924 -5.529 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -8.200 -8.225 -5.010 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -6.815 -9.227 -4.514 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -8.481 -11.748 -3.913 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -7.211 -11.122 -2.834 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -8.859 -11.380 -2.213 1.00 0.00 H new ATOM 725 N LEU A 52 -8.881 -6.971 0.350 1.00 0.00 N ATOM 726 CA LEU A 52 -8.424 -5.925 1.258 1.00 0.00 C ATOM 727 C LEU A 52 -7.034 -6.245 1.801 1.00 0.00 C ATOM 728 O LEU A 52 -6.648 -7.410 1.896 1.00 0.00 O ATOM 729 CB LEU A 52 -9.410 -5.759 2.416 1.00 0.00 C ATOM 730 CG LEU A 52 -10.347 -4.554 2.331 1.00 0.00 C ATOM 731 CD1 LEU A 52 -11.795 -4.992 2.486 1.00 0.00 C ATOM 732 CD2 LEU A 52 -9.985 -3.521 3.388 1.00 0.00 C ATOM 0 H LEU A 52 -9.024 -7.880 0.791 1.00 0.00 H new ATOM 0 HA LEU A 52 -8.370 -4.991 0.699 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -10.017 -6.662 2.483 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -8.842 -5.688 3.343 1.00 0.00 H new ATOM 0 HG LEU A 52 -10.230 -4.096 1.349 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -12.447 -4.121 2.423 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -12.050 -5.694 1.692 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -11.927 -5.475 3.454 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -10.662 -2.670 3.312 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -10.073 -3.968 4.378 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -8.960 -3.184 3.231 1.00 0.00 H new ATOM 744 N ILE A 53 -6.290 -5.204 2.158 1.00 0.00 N ATOM 745 CA ILE A 53 -4.946 -5.374 2.695 1.00 0.00 C ATOM 746 C ILE A 53 -4.735 -4.512 3.935 1.00 0.00 C ATOM 747 O ILE A 53 -4.743 -3.283 3.859 1.00 0.00 O ATOM 748 CB ILE A 53 -3.873 -5.020 1.648 1.00 0.00 C ATOM 749 CG1 ILE A 53 -4.091 -5.829 0.368 1.00 0.00 C ATOM 750 CG2 ILE A 53 -2.481 -5.272 2.210 1.00 0.00 C ATOM 751 CD1 ILE A 53 -4.684 -5.020 -0.764 1.00 0.00 C ATOM 0 H ILE A 53 -6.595 -4.234 2.085 1.00 0.00 H new ATOM 0 HA ILE A 53 -4.845 -6.425 2.966 1.00 0.00 H new ATOM 0 HB ILE A 53 -3.959 -3.961 1.405 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -3.137 -6.247 0.045 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -4.749 -6.670 0.587 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -1.734 -5.017 1.459 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -2.329 -4.656 3.096 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -2.382 -6.324 2.478 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -4.811 -5.657 -1.639 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -5.653 -4.624 -0.460 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -4.016 -4.195 -1.010 1.00 0.00 H new ATOM 763 N THR A 54 -4.545 -5.164 5.077 1.00 0.00 N ATOM 764 CA THR A 54 -4.332 -4.458 6.334 1.00 0.00 C ATOM 765 C THR A 54 -2.849 -4.399 6.686 1.00 0.00 C ATOM 766 O THR A 54 -2.100 -5.338 6.421 1.00 0.00 O ATOM 767 CB THR A 54 -5.096 -5.127 7.492 1.00 0.00 C ATOM 768 OG1 THR A 54 -6.503 -5.111 7.224 1.00 0.00 O ATOM 769 CG2 THR A 54 -4.817 -4.416 8.807 1.00 0.00 C ATOM 0 H THR A 54 -4.534 -6.181 5.157 1.00 0.00 H new ATOM 0 HA THR A 54 -4.712 -3.446 6.196 1.00 0.00 H new ATOM 0 HB THR A 54 -4.754 -6.159 7.576 1.00 0.00 H new ATOM 0 HG1 THR A 54 -6.982 -5.540 7.964 1.00 0.00 H new ATOM 0 HG21 THR A 54 -5.368 -4.907 9.610 1.00 0.00 H new ATOM 0 HG22 THR A 54 -3.749 -4.455 9.022 1.00 0.00 H new ATOM 0 HG23 THR A 54 -5.134 -3.376 8.733 1.00 0.00 H new ATOM 777 N VAL A 55 -2.433 -3.288 7.287 1.00 0.00 N ATOM 778 CA VAL A 55 -1.040 -3.107 7.677 1.00 0.00 C ATOM 779 C VAL A 55 -0.934 -2.528 9.083 1.00 0.00 C ATOM 780 O VAL A 55 -1.522 -1.490 9.384 1.00 0.00 O ATOM 781 CB VAL A 55 -0.297 -2.181 6.695 1.00 0.00 C ATOM 782 CG1 VAL A 55 1.208 -2.353 6.833 1.00 0.00 C ATOM 783 CG2 VAL A 55 -0.745 -2.452 5.267 1.00 0.00 C ATOM 0 H VAL A 55 -3.041 -2.501 7.514 1.00 0.00 H new ATOM 0 HA VAL A 55 -0.575 -4.093 7.657 1.00 0.00 H new ATOM 0 HB VAL A 55 -0.543 -1.148 6.939 1.00 0.00 H new ATOM 0 HG11 VAL A 55 1.716 -1.691 6.132 1.00 0.00 H new ATOM 0 HG12 VAL A 55 1.511 -2.105 7.850 1.00 0.00 H new ATOM 0 HG13 VAL A 55 1.477 -3.387 6.616 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -0.211 -1.790 4.586 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -0.529 -3.489 5.009 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -1.817 -2.272 5.182 1.00 0.00 H new ATOM 793 N ALA A 56 -0.180 -3.207 9.942 1.00 0.00 N ATOM 794 CA ALA A 56 0.006 -2.759 11.316 1.00 0.00 C ATOM 795 C ALA A 56 1.417 -2.224 11.534 1.00 0.00 C ATOM 796 O ALA A 56 2.391 -2.975 11.482 1.00 0.00 O ATOM 797 CB ALA A 56 -0.286 -3.894 12.286 1.00 0.00 C ATOM 0 H ALA A 56 0.312 -4.070 9.710 1.00 0.00 H new ATOM 0 HA ALA A 56 -0.695 -1.946 11.504 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -0.143 -3.545 13.309 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -1.316 -4.227 12.157 1.00 0.00 H new ATOM 0 HB3 ALA A 56 0.391 -4.725 12.088 1.00 0.00 H new ATOM 803 N PHE A 57 1.520 -0.921 11.777 1.00 0.00 N ATOM 804 CA PHE A 57 2.814 -0.285 12.001 1.00 0.00 C ATOM 805 C PHE A 57 3.118 -0.181 13.492 1.00 0.00 C ATOM 806 O PHE A 57 2.388 0.467 14.241 1.00 0.00 O ATOM 807 CB PHE A 57 2.838 1.106 11.365 1.00 0.00 C ATOM 808 CG PHE A 57 3.083 1.084 9.883 1.00 0.00 C ATOM 809 CD1 PHE A 57 4.360 0.887 9.382 1.00 0.00 C ATOM 810 CD2 PHE A 57 2.037 1.262 8.992 1.00 0.00 C ATOM 811 CE1 PHE A 57 4.589 0.866 8.019 1.00 0.00 C ATOM 812 CE2 PHE A 57 2.260 1.241 7.628 1.00 0.00 C ATOM 813 CZ PHE A 57 3.538 1.044 7.141 1.00 0.00 C ATOM 0 H PHE A 57 0.724 -0.285 11.824 1.00 0.00 H new ATOM 0 HA PHE A 57 3.581 -0.903 11.535 1.00 0.00 H new ATOM 0 HB2 PHE A 57 1.888 1.603 11.561 1.00 0.00 H new ATOM 0 HB3 PHE A 57 3.614 1.703 11.845 1.00 0.00 H new ATOM 0 HD1 PHE A 57 5.186 0.748 10.064 1.00 0.00 H new ATOM 0 HD2 PHE A 57 1.037 1.419 9.367 1.00 0.00 H new ATOM 0 HE1 PHE A 57 5.589 0.711 7.641 1.00 0.00 H new ATOM 0 HE2 PHE A 57 1.436 1.378 6.943 1.00 0.00 H new ATOM 0 HZ PHE A 57 3.715 1.029 6.076 1.00 0.00 H new ATOM 823 N ASN A 58 4.200 -0.825 13.916 1.00 0.00 N ATOM 824 CA ASN A 58 4.601 -0.806 15.318 1.00 0.00 C ATOM 825 C ASN A 58 4.873 0.620 15.787 1.00 0.00 C ATOM 826 O ASN A 58 4.832 0.908 16.982 1.00 0.00 O ATOM 827 CB ASN A 58 5.848 -1.669 15.525 1.00 0.00 C ATOM 828 CG ASN A 58 5.558 -3.150 15.370 1.00 0.00 C ATOM 829 OD1 ASN A 58 4.823 -3.736 16.166 1.00 0.00 O ATOM 830 ND2 ASN A 58 6.136 -3.762 14.343 1.00 0.00 N ATOM 0 H ASN A 58 4.815 -1.367 13.309 1.00 0.00 H new ATOM 0 HA ASN A 58 3.782 -1.214 15.910 1.00 0.00 H new ATOM 0 HB2 ASN A 58 6.614 -1.374 14.807 1.00 0.00 H new ATOM 0 HB3 ASN A 58 6.254 -1.483 16.519 1.00 0.00 H new ATOM 0 HD21 ASN A 58 5.978 -4.758 14.188 1.00 0.00 H new ATOM 0 HD22 ASN A 58 6.737 -3.236 13.709 1.00 0.00 H new ATOM 837 N GLN A 59 5.150 1.507 14.836 1.00 0.00 N ATOM 838 CA GLN A 59 5.428 2.903 15.153 1.00 0.00 C ATOM 839 C GLN A 59 4.668 3.835 14.215 1.00 0.00 C ATOM 840 O GLN A 59 4.495 3.556 13.029 1.00 0.00 O ATOM 841 CB GLN A 59 6.929 3.179 15.060 1.00 0.00 C ATOM 842 CG GLN A 59 7.480 3.078 13.647 1.00 0.00 C ATOM 843 CD GLN A 59 8.184 4.346 13.203 1.00 0.00 C ATOM 844 OE1 GLN A 59 9.342 4.312 12.785 1.00 0.00 O ATOM 845 NE2 GLN A 59 7.488 5.472 13.292 1.00 0.00 N ATOM 0 H GLN A 59 5.188 1.284 13.841 1.00 0.00 H new ATOM 0 HA GLN A 59 5.094 3.092 16.173 1.00 0.00 H new ATOM 0 HB2 GLN A 59 7.131 4.177 15.449 1.00 0.00 H new ATOM 0 HB3 GLN A 59 7.460 2.474 15.699 1.00 0.00 H new ATOM 0 HG2 GLN A 59 8.177 2.242 13.592 1.00 0.00 H new ATOM 0 HG3 GLN A 59 6.664 2.859 12.958 1.00 0.00 H new ATOM 0 HE21 GLN A 59 6.531 5.453 13.644 1.00 0.00 H new ATOM 0 HE22 GLN A 59 7.910 6.356 13.008 1.00 0.00 H new ATOM 854 N PRO A 60 4.202 4.970 14.758 1.00 0.00 N ATOM 855 CA PRO A 60 3.453 5.967 13.987 1.00 0.00 C ATOM 856 C PRO A 60 4.331 6.696 12.975 1.00 0.00 C ATOM 857 O PRO A 60 5.207 7.476 13.347 1.00 0.00 O ATOM 858 CB PRO A 60 2.951 6.939 15.058 1.00 0.00 C ATOM 859 CG PRO A 60 3.922 6.802 16.179 1.00 0.00 C ATOM 860 CD PRO A 60 4.371 5.367 16.166 1.00 0.00 C ATOM 0 HA PRO A 60 2.657 5.513 13.397 1.00 0.00 H new ATOM 0 HB2 PRO A 60 2.922 7.962 14.682 1.00 0.00 H new ATOM 0 HB3 PRO A 60 1.940 6.688 15.377 1.00 0.00 H new ATOM 0 HG2 PRO A 60 4.768 7.477 16.047 1.00 0.00 H new ATOM 0 HG3 PRO A 60 3.457 7.057 17.131 1.00 0.00 H new ATOM 0 HD2 PRO A 60 5.407 5.267 16.490 1.00 0.00 H new ATOM 0 HD3 PRO A 60 3.767 4.751 16.833 1.00 0.00 H new ATOM 868 N VAL A 61 4.089 6.437 11.694 1.00 0.00 N ATOM 869 CA VAL A 61 4.856 7.070 10.628 1.00 0.00 C ATOM 870 C VAL A 61 3.978 7.997 9.795 1.00 0.00 C ATOM 871 O VAL A 61 2.825 8.255 10.141 1.00 0.00 O ATOM 872 CB VAL A 61 5.501 6.022 9.702 1.00 0.00 C ATOM 873 CG1 VAL A 61 6.338 5.040 10.508 1.00 0.00 C ATOM 874 CG2 VAL A 61 4.434 5.292 8.900 1.00 0.00 C ATOM 0 H VAL A 61 3.368 5.793 11.369 1.00 0.00 H new ATOM 0 HA VAL A 61 5.642 7.653 11.107 1.00 0.00 H new ATOM 0 HB VAL A 61 6.161 6.537 9.003 1.00 0.00 H new ATOM 0 HG11 VAL A 61 6.786 4.307 9.837 1.00 0.00 H new ATOM 0 HG12 VAL A 61 7.126 5.579 11.034 1.00 0.00 H new ATOM 0 HG13 VAL A 61 5.703 4.529 11.232 1.00 0.00 H new ATOM 0 HG21 VAL A 61 4.907 4.555 8.251 1.00 0.00 H new ATOM 0 HG22 VAL A 61 3.748 4.788 9.581 1.00 0.00 H new ATOM 0 HG23 VAL A 61 3.881 6.009 8.293 1.00 0.00 H new ATOM 884 N LYS A 62 4.531 8.494 8.694 1.00 0.00 N ATOM 885 CA LYS A 62 3.799 9.391 7.808 1.00 0.00 C ATOM 886 C LYS A 62 3.738 8.828 6.392 1.00 0.00 C ATOM 887 O LYS A 62 4.770 8.588 5.763 1.00 0.00 O ATOM 888 CB LYS A 62 4.456 10.773 7.791 1.00 0.00 C ATOM 889 CG LYS A 62 4.484 11.450 9.150 1.00 0.00 C ATOM 890 CD LYS A 62 4.154 12.930 9.043 1.00 0.00 C ATOM 891 CE LYS A 62 5.413 13.783 9.049 1.00 0.00 C ATOM 892 NZ LYS A 62 5.738 14.282 10.414 1.00 0.00 N ATOM 0 H LYS A 62 5.484 8.291 8.394 1.00 0.00 H new ATOM 0 HA LYS A 62 2.781 9.484 8.187 1.00 0.00 H new ATOM 0 HB2 LYS A 62 5.477 10.676 7.422 1.00 0.00 H new ATOM 0 HB3 LYS A 62 3.922 11.411 7.087 1.00 0.00 H new ATOM 0 HG2 LYS A 62 3.769 10.964 9.814 1.00 0.00 H new ATOM 0 HG3 LYS A 62 5.470 11.328 9.598 1.00 0.00 H new ATOM 0 HD2 LYS A 62 3.593 13.114 8.127 1.00 0.00 H new ATOM 0 HD3 LYS A 62 3.512 13.222 9.874 1.00 0.00 H new ATOM 0 HE2 LYS A 62 6.250 13.198 8.667 1.00 0.00 H new ATOM 0 HE3 LYS A 62 5.282 14.629 8.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 6.602 14.859 10.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 4.950 14.861 10.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 5.889 13.475 11.052 1.00 0.00 H new ATOM 906 N LEU A 63 2.524 8.620 5.894 1.00 0.00 N ATOM 907 CA LEU A 63 2.329 8.087 4.550 1.00 0.00 C ATOM 908 C LEU A 63 2.353 9.204 3.512 1.00 0.00 C ATOM 909 O LEU A 63 1.317 9.779 3.180 1.00 0.00 O ATOM 910 CB LEU A 63 1.003 7.328 4.469 1.00 0.00 C ATOM 911 CG LEU A 63 0.801 6.217 5.501 1.00 0.00 C ATOM 912 CD1 LEU A 63 -0.478 5.446 5.211 1.00 0.00 C ATOM 913 CD2 LEU A 63 1.999 5.279 5.516 1.00 0.00 C ATOM 0 H LEU A 63 1.660 8.812 6.401 1.00 0.00 H new ATOM 0 HA LEU A 63 3.148 7.400 4.336 1.00 0.00 H new ATOM 0 HB2 LEU A 63 0.190 8.046 4.574 1.00 0.00 H new ATOM 0 HB3 LEU A 63 0.917 6.892 3.474 1.00 0.00 H new ATOM 0 HG LEU A 63 0.710 6.674 6.486 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -0.605 4.660 5.955 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -1.329 6.125 5.251 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.417 5.000 4.218 1.00 0.00 H new ATOM 0 HD21 LEU A 63 1.838 4.495 6.256 1.00 0.00 H new ATOM 0 HD22 LEU A 63 2.121 4.829 4.531 1.00 0.00 H new ATOM 0 HD23 LEU A 63 2.898 5.840 5.772 1.00 0.00 H new ATOM 925 N TYR A 64 3.542 9.503 3.000 1.00 0.00 N ATOM 926 CA TYR A 64 3.701 10.551 1.999 1.00 0.00 C ATOM 927 C TYR A 64 3.328 10.040 0.611 1.00 0.00 C ATOM 928 O TYR A 64 2.844 10.796 -0.231 1.00 0.00 O ATOM 929 CB TYR A 64 5.142 11.066 1.995 1.00 0.00 C ATOM 930 CG TYR A 64 5.467 11.966 3.165 1.00 0.00 C ATOM 931 CD1 TYR A 64 5.269 13.339 3.086 1.00 0.00 C ATOM 932 CD2 TYR A 64 5.972 11.444 4.349 1.00 0.00 C ATOM 933 CE1 TYR A 64 5.566 14.166 4.152 1.00 0.00 C ATOM 934 CE2 TYR A 64 6.269 12.263 5.421 1.00 0.00 C ATOM 935 CZ TYR A 64 6.065 13.623 5.318 1.00 0.00 C ATOM 936 OH TYR A 64 6.361 14.443 6.383 1.00 0.00 O ATOM 0 H TYR A 64 4.409 9.034 3.262 1.00 0.00 H new ATOM 0 HA TYR A 64 3.030 11.370 2.257 1.00 0.00 H new ATOM 0 HB2 TYR A 64 5.823 10.215 2.002 1.00 0.00 H new ATOM 0 HB3 TYR A 64 5.322 11.610 1.068 1.00 0.00 H new ATOM 0 HD1 TYR A 64 4.876 13.767 2.176 1.00 0.00 H new ATOM 0 HD2 TYR A 64 6.135 10.380 4.433 1.00 0.00 H new ATOM 0 HE1 TYR A 64 5.408 15.232 4.073 1.00 0.00 H new ATOM 0 HE2 TYR A 64 6.659 11.840 6.335 1.00 0.00 H new ATOM 0 HH TYR A 64 5.767 15.222 6.371 1.00 0.00 H new ATOM 946 N SER A 65 3.555 8.751 0.381 1.00 0.00 N ATOM 947 CA SER A 65 3.246 8.137 -0.905 1.00 0.00 C ATOM 948 C SER A 65 3.048 6.632 -0.755 1.00 0.00 C ATOM 949 O SER A 65 3.328 6.060 0.298 1.00 0.00 O ATOM 950 CB SER A 65 4.364 8.419 -1.910 1.00 0.00 C ATOM 951 OG SER A 65 5.460 9.065 -1.286 1.00 0.00 O ATOM 0 H SER A 65 3.952 8.111 1.069 1.00 0.00 H new ATOM 0 HA SER A 65 2.317 8.572 -1.274 1.00 0.00 H new ATOM 0 HB2 SER A 65 4.697 7.484 -2.360 1.00 0.00 H new ATOM 0 HB3 SER A 65 3.982 9.043 -2.718 1.00 0.00 H new ATOM 0 HG SER A 65 6.162 9.233 -1.949 1.00 0.00 H new ATOM 957 N MET A 66 2.563 5.997 -1.817 1.00 0.00 N ATOM 958 CA MET A 66 2.328 4.558 -1.805 1.00 0.00 C ATOM 959 C MET A 66 2.666 3.940 -3.158 1.00 0.00 C ATOM 960 O MET A 66 2.308 4.480 -4.205 1.00 0.00 O ATOM 961 CB MET A 66 0.871 4.260 -1.445 1.00 0.00 C ATOM 962 CG MET A 66 0.403 2.885 -1.894 1.00 0.00 C ATOM 963 SD MET A 66 -1.274 2.510 -1.349 1.00 0.00 S ATOM 964 CE MET A 66 -2.223 3.075 -2.758 1.00 0.00 C ATOM 0 H MET A 66 2.325 6.456 -2.696 1.00 0.00 H new ATOM 0 HA MET A 66 2.979 4.116 -1.051 1.00 0.00 H new ATOM 0 HB2 MET A 66 0.748 4.342 -0.365 1.00 0.00 H new ATOM 0 HB3 MET A 66 0.231 5.018 -1.897 1.00 0.00 H new ATOM 0 HG2 MET A 66 0.449 2.827 -2.981 1.00 0.00 H new ATOM 0 HG3 MET A 66 1.085 2.129 -1.505 1.00 0.00 H new ATOM 0 HE1 MET A 66 -3.238 3.314 -2.441 1.00 0.00 H new ATOM 0 HE2 MET A 66 -1.755 3.965 -3.178 1.00 0.00 H new ATOM 0 HE3 MET A 66 -2.254 2.290 -3.514 1.00 0.00 H new ATOM 974 N LYS A 67 3.358 2.806 -3.130 1.00 0.00 N ATOM 975 CA LYS A 67 3.744 2.114 -4.354 1.00 0.00 C ATOM 976 C LYS A 67 2.869 0.886 -4.584 1.00 0.00 C ATOM 977 O LYS A 67 3.151 -0.195 -4.068 1.00 0.00 O ATOM 978 CB LYS A 67 5.216 1.699 -4.286 1.00 0.00 C ATOM 979 CG LYS A 67 6.182 2.863 -4.415 1.00 0.00 C ATOM 980 CD LYS A 67 7.561 2.398 -4.854 1.00 0.00 C ATOM 981 CE LYS A 67 8.329 3.511 -5.550 1.00 0.00 C ATOM 982 NZ LYS A 67 9.336 2.975 -6.507 1.00 0.00 N ATOM 0 H LYS A 67 3.663 2.346 -2.272 1.00 0.00 H new ATOM 0 HA LYS A 67 3.604 2.800 -5.190 1.00 0.00 H new ATOM 0 HB2 LYS A 67 5.398 1.190 -3.340 1.00 0.00 H new ATOM 0 HB3 LYS A 67 5.419 0.980 -5.079 1.00 0.00 H new ATOM 0 HG2 LYS A 67 5.793 3.582 -5.136 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.259 3.381 -3.459 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.124 2.054 -3.986 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.462 1.547 -5.527 1.00 0.00 H new ATOM 0 HE2 LYS A 67 7.630 4.157 -6.082 1.00 0.00 H new ATOM 0 HE3 LYS A 67 8.829 4.128 -4.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.838 3.765 -6.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 10.018 2.379 -5.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 8.856 2.407 -7.234 1.00 0.00 H new ATOM 996 N PHE A 68 1.806 1.061 -5.362 1.00 0.00 N ATOM 997 CA PHE A 68 0.890 -0.034 -5.661 1.00 0.00 C ATOM 998 C PHE A 68 0.935 -0.392 -7.144 1.00 0.00 C ATOM 999 O PHE A 68 0.686 0.452 -8.004 1.00 0.00 O ATOM 1000 CB PHE A 68 -0.538 0.344 -5.260 1.00 0.00 C ATOM 1001 CG PHE A 68 -1.280 -0.764 -4.569 1.00 0.00 C ATOM 1002 CD1 PHE A 68 -0.704 -1.445 -3.509 1.00 0.00 C ATOM 1003 CD2 PHE A 68 -2.553 -1.125 -4.981 1.00 0.00 C ATOM 1004 CE1 PHE A 68 -1.384 -2.465 -2.871 1.00 0.00 C ATOM 1005 CE2 PHE A 68 -3.238 -2.144 -4.346 1.00 0.00 C ATOM 1006 CZ PHE A 68 -2.652 -2.815 -3.291 1.00 0.00 C ATOM 0 H PHE A 68 1.558 1.950 -5.797 1.00 0.00 H new ATOM 0 HA PHE A 68 1.204 -0.905 -5.085 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -0.504 1.213 -4.603 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -1.091 0.640 -6.152 1.00 0.00 H new ATOM 0 HD1 PHE A 68 0.288 -1.176 -3.177 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -3.015 -0.605 -5.807 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -0.924 -2.988 -2.045 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -4.230 -2.415 -4.675 1.00 0.00 H new ATOM 0 HZ PHE A 68 -3.185 -3.613 -2.795 1.00 0.00 H new ATOM 1016 N GLN A 69 1.257 -1.648 -7.433 1.00 0.00 N ATOM 1017 CA GLN A 69 1.337 -2.118 -8.811 1.00 0.00 C ATOM 1018 C GLN A 69 1.025 -3.608 -8.898 1.00 0.00 C ATOM 1019 O GLN A 69 0.606 -4.223 -7.918 1.00 0.00 O ATOM 1020 CB GLN A 69 2.727 -1.842 -9.387 1.00 0.00 C ATOM 1021 CG GLN A 69 3.650 -1.112 -8.424 1.00 0.00 C ATOM 1022 CD GLN A 69 5.064 -0.985 -8.955 1.00 0.00 C ATOM 1023 OE1 GLN A 69 5.445 -1.665 -9.908 1.00 0.00 O ATOM 1024 NE2 GLN A 69 5.851 -0.110 -8.339 1.00 0.00 N ATOM 0 H GLN A 69 1.467 -2.359 -6.732 1.00 0.00 H new ATOM 0 HA GLN A 69 0.594 -1.575 -9.396 1.00 0.00 H new ATOM 0 HB2 GLN A 69 3.188 -2.788 -9.672 1.00 0.00 H new ATOM 0 HB3 GLN A 69 2.623 -1.251 -10.297 1.00 0.00 H new ATOM 0 HG2 GLN A 69 3.250 -0.118 -8.226 1.00 0.00 H new ATOM 0 HG3 GLN A 69 3.670 -1.643 -7.472 1.00 0.00 H new ATOM 0 HE21 GLN A 69 5.493 0.433 -7.553 1.00 0.00 H new ATOM 0 HE22 GLN A 69 6.813 0.019 -8.652 1.00 0.00 H new ATOM 1033 N GLY A 70 1.231 -4.184 -10.078 1.00 0.00 N ATOM 1034 CA GLY A 70 0.966 -5.598 -10.271 1.00 0.00 C ATOM 1035 C GLY A 70 2.039 -6.282 -11.094 1.00 0.00 C ATOM 1036 O GLY A 70 3.137 -5.758 -11.281 1.00 0.00 O ATOM 0 H GLY A 70 1.577 -3.697 -10.905 1.00 0.00 H new ATOM 0 HA2 GLY A 70 0.891 -6.086 -9.299 1.00 0.00 H new ATOM 0 HA3 GLY A 70 0.002 -5.720 -10.764 1.00 0.00 H new ATOM 1040 N PRO A 71 1.725 -7.483 -11.602 1.00 0.00 N ATOM 1041 CA PRO A 71 2.658 -8.267 -12.417 1.00 0.00 C ATOM 1042 C PRO A 71 2.896 -7.641 -13.788 1.00 0.00 C ATOM 1043 O PRO A 71 2.473 -6.515 -14.048 1.00 0.00 O ATOM 1044 CB PRO A 71 1.954 -9.618 -12.562 1.00 0.00 C ATOM 1045 CG PRO A 71 0.506 -9.311 -12.395 1.00 0.00 C ATOM 1046 CD PRO A 71 0.435 -8.169 -11.419 1.00 0.00 C ATOM 0 HA PRO A 71 3.645 -8.332 -11.958 1.00 0.00 H new ATOM 0 HB2 PRO A 71 2.154 -10.066 -13.535 1.00 0.00 H new ATOM 0 HB3 PRO A 71 2.298 -10.326 -11.808 1.00 0.00 H new ATOM 0 HG2 PRO A 71 0.052 -9.039 -13.348 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -0.036 -10.179 -12.020 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -0.405 -7.509 -11.634 1.00 0.00 H new ATOM 0 HD3 PRO A 71 0.309 -8.522 -10.396 1.00 0.00 H new ATOM 1054 N ASP A 72 3.576 -8.378 -14.659 1.00 0.00 N ATOM 1055 CA ASP A 72 3.869 -7.896 -16.004 1.00 0.00 C ATOM 1056 C ASP A 72 2.926 -8.525 -17.024 1.00 0.00 C ATOM 1057 O ASP A 72 3.299 -8.745 -18.176 1.00 0.00 O ATOM 1058 CB ASP A 72 5.320 -8.206 -16.374 1.00 0.00 C ATOM 1059 CG ASP A 72 6.027 -7.015 -16.992 1.00 0.00 C ATOM 1060 OD1 ASP A 72 6.577 -6.192 -16.231 1.00 0.00 O ATOM 1061 OD2 ASP A 72 6.029 -6.905 -18.236 1.00 0.00 O ATOM 0 H ASP A 72 3.935 -9.311 -14.458 1.00 0.00 H new ATOM 0 HA ASP A 72 3.721 -6.816 -16.017 1.00 0.00 H new ATOM 0 HB2 ASP A 72 5.860 -8.522 -15.482 1.00 0.00 H new ATOM 0 HB3 ASP A 72 5.343 -9.042 -17.073 1.00 0.00 H new ATOM 1066 N ASN A 73 1.702 -8.812 -16.593 1.00 0.00 N ATOM 1067 CA ASN A 73 0.705 -9.417 -17.469 1.00 0.00 C ATOM 1068 C ASN A 73 -0.290 -8.372 -17.965 1.00 0.00 C ATOM 1069 O ASN A 73 -0.803 -8.467 -19.079 1.00 0.00 O ATOM 1070 CB ASN A 73 -0.037 -10.536 -16.736 1.00 0.00 C ATOM 1071 CG ASN A 73 -1.281 -10.987 -17.476 1.00 0.00 C ATOM 1072 OD1 ASN A 73 -1.251 -11.207 -18.687 1.00 0.00 O ATOM 1073 ND2 ASN A 73 -2.383 -11.128 -16.749 1.00 0.00 N ATOM 0 H ASN A 73 1.377 -8.635 -15.643 1.00 0.00 H new ATOM 0 HA ASN A 73 1.223 -9.837 -18.331 1.00 0.00 H new ATOM 0 HB2 ASN A 73 0.632 -11.386 -16.604 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -0.315 -10.192 -15.740 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -3.251 -11.430 -17.192 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -2.362 -10.935 -15.748 1.00 0.00 H new ATOM 1080 N GLY A 74 -0.558 -7.374 -17.128 1.00 0.00 N ATOM 1081 CA GLY A 74 -1.490 -6.325 -17.499 1.00 0.00 C ATOM 1082 C GLY A 74 -2.664 -6.229 -16.545 1.00 0.00 C ATOM 1083 O GLY A 74 -3.724 -5.718 -16.906 1.00 0.00 O ATOM 0 H GLY A 74 -0.147 -7.273 -16.200 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -0.966 -5.369 -17.523 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -1.859 -6.511 -18.507 1.00 0.00 H new ATOM 1087 N GLN A 75 -2.476 -6.724 -15.326 1.00 0.00 N ATOM 1088 CA GLN A 75 -3.530 -6.694 -14.319 1.00 0.00 C ATOM 1089 C GLN A 75 -3.071 -5.945 -13.072 1.00 0.00 C ATOM 1090 O GLN A 75 -2.376 -6.502 -12.223 1.00 0.00 O ATOM 1091 CB GLN A 75 -3.951 -8.117 -13.948 1.00 0.00 C ATOM 1092 CG GLN A 75 -4.612 -8.873 -15.089 1.00 0.00 C ATOM 1093 CD GLN A 75 -5.656 -9.861 -14.608 1.00 0.00 C ATOM 1094 OE1 GLN A 75 -5.322 -10.616 -13.567 1.00 0.00 O flip ATOM 1095 NE2 GLN A 75 -6.751 -9.946 -15.165 1.00 0.00 N flip ATOM 0 H GLN A 75 -1.604 -7.150 -15.012 1.00 0.00 H new ATOM 0 HA GLN A 75 -4.386 -6.168 -14.741 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -3.073 -8.672 -13.616 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -4.640 -8.075 -13.104 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -5.078 -8.161 -15.770 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -3.849 -9.405 -15.657 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -6.966 -9.346 -15.962 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -7.443 -10.616 -14.830 1.00 0.00 H new ATOM 1104 N GLY A 76 -3.463 -4.679 -12.969 1.00 0.00 N ATOM 1105 CA GLY A 76 -3.081 -3.875 -11.823 1.00 0.00 C ATOM 1106 C GLY A 76 -4.252 -3.112 -11.235 1.00 0.00 C ATOM 1107 O GLY A 76 -5.220 -2.790 -11.924 1.00 0.00 O ATOM 0 H GLY A 76 -4.038 -4.196 -13.659 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -2.650 -4.520 -11.057 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -2.304 -3.170 -12.120 1.00 0.00 H new ATOM 1111 N PRO A 77 -4.172 -2.813 -9.929 1.00 0.00 N ATOM 1112 CA PRO A 77 -5.225 -2.081 -9.219 1.00 0.00 C ATOM 1113 C PRO A 77 -5.306 -0.620 -9.650 1.00 0.00 C ATOM 1114 O PRO A 77 -4.287 0.019 -9.910 1.00 0.00 O ATOM 1115 CB PRO A 77 -4.801 -2.183 -7.752 1.00 0.00 C ATOM 1116 CG PRO A 77 -3.324 -2.376 -7.797 1.00 0.00 C ATOM 1117 CD PRO A 77 -3.047 -3.166 -9.047 1.00 0.00 C ATOM 0 HA PRO A 77 -6.214 -2.492 -9.420 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -5.066 -1.281 -7.200 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -5.294 -3.018 -7.254 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -2.806 -1.417 -7.818 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -2.973 -2.908 -6.913 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -2.089 -2.895 -9.490 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -3.014 -4.237 -8.847 1.00 0.00 H new ATOM 1125 N LYS A 78 -6.525 -0.096 -9.722 1.00 0.00 N ATOM 1126 CA LYS A 78 -6.741 1.290 -10.119 1.00 0.00 C ATOM 1127 C LYS A 78 -7.382 2.087 -8.987 1.00 0.00 C ATOM 1128 O LYS A 78 -6.711 2.861 -8.303 1.00 0.00 O ATOM 1129 CB LYS A 78 -7.625 1.353 -11.366 1.00 0.00 C ATOM 1130 CG LYS A 78 -8.143 2.748 -11.675 1.00 0.00 C ATOM 1131 CD LYS A 78 -8.417 2.925 -13.159 1.00 0.00 C ATOM 1132 CE LYS A 78 -7.215 3.516 -13.880 1.00 0.00 C ATOM 1133 NZ LYS A 78 -7.554 3.940 -15.267 1.00 0.00 N ATOM 0 H LYS A 78 -7.379 -0.611 -9.510 1.00 0.00 H new ATOM 0 HA LYS A 78 -5.771 1.732 -10.346 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -7.058 0.987 -12.222 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -8.473 0.681 -11.234 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -9.058 2.931 -11.111 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -7.413 3.489 -11.348 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -8.670 1.961 -13.601 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -9.281 3.575 -13.296 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -6.840 4.373 -13.320 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -6.412 2.780 -13.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -6.709 4.337 -15.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -7.888 3.118 -15.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -8.303 4.661 -15.236 1.00 0.00 H new ATOM 1147 N TYR A 79 -8.681 1.891 -8.795 1.00 0.00 N ATOM 1148 CA TYR A 79 -9.412 2.592 -7.746 1.00 0.00 C ATOM 1149 C TYR A 79 -9.308 1.849 -6.418 1.00 0.00 C ATOM 1150 O TYR A 79 -10.028 0.880 -6.177 1.00 0.00 O ATOM 1151 CB TYR A 79 -10.882 2.752 -8.139 1.00 0.00 C ATOM 1152 CG TYR A 79 -11.599 3.840 -7.372 1.00 0.00 C ATOM 1153 CD1 TYR A 79 -11.489 5.172 -7.748 1.00 0.00 C ATOM 1154 CD2 TYR A 79 -12.389 3.533 -6.270 1.00 0.00 C ATOM 1155 CE1 TYR A 79 -12.142 6.169 -7.049 1.00 0.00 C ATOM 1156 CE2 TYR A 79 -13.047 4.523 -5.565 1.00 0.00 C ATOM 1157 CZ TYR A 79 -12.920 5.839 -5.958 1.00 0.00 C ATOM 1158 OH TYR A 79 -13.573 6.828 -5.260 1.00 0.00 O ATOM 0 H TYR A 79 -9.250 1.253 -9.352 1.00 0.00 H new ATOM 0 HA TYR A 79 -8.965 3.579 -7.625 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -10.943 2.970 -9.205 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -11.398 1.805 -7.978 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -10.882 5.434 -8.602 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -12.490 2.504 -5.960 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -12.044 7.200 -7.355 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -13.657 4.268 -4.711 1.00 0.00 H new ATOM 0 HH TYR A 79 -14.078 6.428 -4.522 1.00 0.00 H new ATOM 1168 N VAL A 80 -8.405 2.310 -5.559 1.00 0.00 N ATOM 1169 CA VAL A 80 -8.205 1.691 -4.254 1.00 0.00 C ATOM 1170 C VAL A 80 -8.544 2.661 -3.127 1.00 0.00 C ATOM 1171 O VAL A 80 -8.152 3.828 -3.159 1.00 0.00 O ATOM 1172 CB VAL A 80 -6.754 1.204 -4.079 1.00 0.00 C ATOM 1173 CG1 VAL A 80 -6.724 -0.286 -3.774 1.00 0.00 C ATOM 1174 CG2 VAL A 80 -5.934 1.520 -5.320 1.00 0.00 C ATOM 0 H VAL A 80 -7.800 3.110 -5.743 1.00 0.00 H new ATOM 0 HA VAL A 80 -8.876 0.833 -4.205 1.00 0.00 H new ATOM 0 HB VAL A 80 -6.311 1.732 -3.235 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -5.691 -0.612 -3.654 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -7.275 -0.480 -2.854 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -7.184 -0.835 -4.596 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -4.912 1.169 -5.180 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -6.374 1.021 -6.183 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -5.928 2.597 -5.488 1.00 0.00 H new ATOM 1184 N LYS A 81 -9.274 2.171 -2.131 1.00 0.00 N ATOM 1185 CA LYS A 81 -9.665 2.993 -0.992 1.00 0.00 C ATOM 1186 C LYS A 81 -8.682 2.827 0.162 1.00 0.00 C ATOM 1187 O LYS A 81 -8.497 1.724 0.677 1.00 0.00 O ATOM 1188 CB LYS A 81 -11.076 2.624 -0.531 1.00 0.00 C ATOM 1189 CG LYS A 81 -12.121 2.724 -1.630 1.00 0.00 C ATOM 1190 CD LYS A 81 -13.527 2.557 -1.079 1.00 0.00 C ATOM 1191 CE LYS A 81 -14.311 3.859 -1.148 1.00 0.00 C ATOM 1192 NZ LYS A 81 -15.270 3.869 -2.287 1.00 0.00 N ATOM 0 H LYS A 81 -9.607 1.208 -2.090 1.00 0.00 H new ATOM 0 HA LYS A 81 -9.654 4.036 -1.308 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -11.067 1.606 -0.141 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -11.363 3.278 0.292 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.036 3.690 -2.127 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -11.932 1.960 -2.384 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -14.051 1.785 -1.643 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -13.476 2.216 -0.045 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -14.854 4.006 -0.215 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -13.619 4.695 -1.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -15.647 4.830 -2.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -14.781 3.571 -3.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -16.052 3.213 -2.088 1.00 0.00 H new ATOM 1206 N ILE A 82 -8.055 3.927 0.564 1.00 0.00 N ATOM 1207 CA ILE A 82 -7.094 3.902 1.659 1.00 0.00 C ATOM 1208 C ILE A 82 -7.757 4.271 2.981 1.00 0.00 C ATOM 1209 O ILE A 82 -8.555 5.206 3.049 1.00 0.00 O ATOM 1210 CB ILE A 82 -5.920 4.866 1.400 1.00 0.00 C ATOM 1211 CG1 ILE A 82 -5.202 4.492 0.102 1.00 0.00 C ATOM 1212 CG2 ILE A 82 -4.951 4.847 2.572 1.00 0.00 C ATOM 1213 CD1 ILE A 82 -4.382 5.621 -0.482 1.00 0.00 C ATOM 0 H ILE A 82 -8.196 4.847 0.147 1.00 0.00 H new ATOM 0 HA ILE A 82 -6.711 2.883 1.719 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.315 5.877 1.297 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -4.549 3.639 0.290 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -5.941 4.172 -0.633 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -4.127 5.533 2.374 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -5.471 5.156 3.479 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -4.560 3.838 2.704 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -3.901 5.284 -1.401 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -5.033 6.467 -0.702 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -3.620 5.926 0.235 1.00 0.00 H new ATOM 1225 N PHE A 83 -7.420 3.530 4.032 1.00 0.00 N ATOM 1226 CA PHE A 83 -7.982 3.779 5.355 1.00 0.00 C ATOM 1227 C PHE A 83 -6.885 3.814 6.414 1.00 0.00 C ATOM 1228 O PHE A 83 -5.892 3.092 6.319 1.00 0.00 O ATOM 1229 CB PHE A 83 -9.012 2.703 5.705 1.00 0.00 C ATOM 1230 CG PHE A 83 -10.234 2.735 4.833 1.00 0.00 C ATOM 1231 CD1 PHE A 83 -10.240 2.097 3.603 1.00 0.00 C ATOM 1232 CD2 PHE A 83 -11.377 3.402 5.243 1.00 0.00 C ATOM 1233 CE1 PHE A 83 -11.363 2.126 2.798 1.00 0.00 C ATOM 1234 CE2 PHE A 83 -12.503 3.434 4.442 1.00 0.00 C ATOM 1235 CZ PHE A 83 -12.496 2.794 3.219 1.00 0.00 C ATOM 0 H PHE A 83 -6.761 2.753 3.993 1.00 0.00 H new ATOM 0 HA PHE A 83 -8.475 4.751 5.336 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -8.543 1.722 5.623 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -9.315 2.826 6.745 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -9.357 1.571 3.270 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -11.388 3.903 6.200 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -11.355 1.627 1.840 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -13.387 3.959 4.773 1.00 0.00 H new ATOM 0 HZ PHE A 83 -13.375 2.816 2.592 1.00 0.00 H new ATOM 1245 N ILE A 84 -7.072 4.659 7.423 1.00 0.00 N ATOM 1246 CA ILE A 84 -6.099 4.788 8.501 1.00 0.00 C ATOM 1247 C ILE A 84 -6.786 5.087 9.829 1.00 0.00 C ATOM 1248 O ILE A 84 -7.960 5.455 9.863 1.00 0.00 O ATOM 1249 CB ILE A 84 -5.075 5.899 8.204 1.00 0.00 C ATOM 1250 CG1 ILE A 84 -5.784 7.242 8.024 1.00 0.00 C ATOM 1251 CG2 ILE A 84 -4.262 5.552 6.965 1.00 0.00 C ATOM 1252 CD1 ILE A 84 -5.012 8.414 8.589 1.00 0.00 C ATOM 0 H ILE A 84 -7.888 5.264 7.516 1.00 0.00 H new ATOM 0 HA ILE A 84 -5.578 3.833 8.572 1.00 0.00 H new ATOM 0 HB ILE A 84 -4.394 5.981 9.051 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -5.960 7.411 6.962 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -6.761 7.195 8.505 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -3.542 6.347 6.768 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -3.731 4.614 7.129 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -4.929 5.446 6.110 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -5.575 9.333 8.426 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -4.859 8.267 9.658 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -4.045 8.487 8.091 1.00 0.00 H new ATOM 1264 N ASN A 85 -6.046 4.929 10.921 1.00 0.00 N ATOM 1265 CA ASN A 85 -6.583 5.184 12.252 1.00 0.00 C ATOM 1266 C ASN A 85 -7.871 4.398 12.479 1.00 0.00 C ATOM 1267 O ASN A 85 -8.817 4.897 13.090 1.00 0.00 O ATOM 1268 CB ASN A 85 -6.845 6.680 12.442 1.00 0.00 C ATOM 1269 CG ASN A 85 -5.582 7.450 12.773 1.00 0.00 C ATOM 1270 OD1 ASN A 85 -4.546 7.264 11.963 1.00 0.00 O flip ATOM 1271 ND2 ASN A 85 -5.539 8.204 13.745 1.00 0.00 N flip ATOM 0 H ASN A 85 -5.072 4.625 10.910 1.00 0.00 H new ATOM 0 HA ASN A 85 -5.844 4.856 12.983 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -7.288 7.087 11.533 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -7.573 6.820 13.241 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -6.360 8.316 14.340 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -4.683 8.717 13.955 1.00 0.00 H new ATOM 1278 N LEU A 86 -7.901 3.166 11.982 1.00 0.00 N ATOM 1279 CA LEU A 86 -9.072 2.310 12.131 1.00 0.00 C ATOM 1280 C LEU A 86 -9.177 1.773 13.554 1.00 0.00 C ATOM 1281 O LEU A 86 -8.189 1.672 14.281 1.00 0.00 O ATOM 1282 CB LEU A 86 -9.007 1.147 11.138 1.00 0.00 C ATOM 1283 CG LEU A 86 -9.204 1.510 9.666 1.00 0.00 C ATOM 1284 CD1 LEU A 86 -8.888 0.318 8.776 1.00 0.00 C ATOM 1285 CD2 LEU A 86 -10.624 1.998 9.422 1.00 0.00 C ATOM 0 H LEU A 86 -7.128 2.738 11.473 1.00 0.00 H new ATOM 0 HA LEU A 86 -9.958 2.909 11.923 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -8.039 0.658 11.245 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -9.766 0.415 11.416 1.00 0.00 H new ATOM 0 HG LEU A 86 -8.516 2.317 9.416 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -9.034 0.595 7.732 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -7.853 0.014 8.930 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -9.551 -0.510 9.028 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -10.746 2.252 8.369 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -11.330 1.212 9.690 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -10.815 2.881 10.032 1.00 0.00 H new ATOM 1297 N PRO A 87 -10.404 1.417 13.964 1.00 0.00 N ATOM 1298 CA PRO A 87 -10.668 0.881 15.303 1.00 0.00 C ATOM 1299 C PRO A 87 -10.093 -0.518 15.491 1.00 0.00 C ATOM 1300 O PRO A 87 -9.847 -0.953 16.616 1.00 0.00 O ATOM 1301 CB PRO A 87 -12.196 0.846 15.376 1.00 0.00 C ATOM 1302 CG PRO A 87 -12.641 0.745 13.958 1.00 0.00 C ATOM 1303 CD PRO A 87 -11.629 1.510 13.151 1.00 0.00 C ATOM 0 HA PRO A 87 -10.204 1.485 16.083 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -12.545 -0.004 15.962 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -12.590 1.744 15.852 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -12.690 -0.296 13.637 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -13.639 1.165 13.831 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -11.489 1.073 12.162 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -11.934 2.546 13.001 1.00 0.00 H new ATOM 1311 N ARG A 88 -9.880 -1.219 14.382 1.00 0.00 N ATOM 1312 CA ARG A 88 -9.334 -2.571 14.425 1.00 0.00 C ATOM 1313 C ARG A 88 -8.990 -3.063 13.022 1.00 0.00 C ATOM 1314 O ARG A 88 -7.818 -3.157 12.657 1.00 0.00 O ATOM 1315 CB ARG A 88 -10.332 -3.526 15.082 1.00 0.00 C ATOM 1316 CG ARG A 88 -11.776 -3.063 14.979 1.00 0.00 C ATOM 1317 CD ARG A 88 -12.741 -4.239 14.995 1.00 0.00 C ATOM 1318 NE ARG A 88 -13.019 -4.700 16.353 1.00 0.00 N ATOM 1319 CZ ARG A 88 -13.658 -5.831 16.628 1.00 0.00 C ATOM 1320 NH1 ARG A 88 -14.081 -6.614 15.645 1.00 0.00 N ATOM 1321 NH2 ARG A 88 -13.873 -6.183 17.889 1.00 0.00 N ATOM 0 H ARG A 88 -10.077 -0.873 13.443 1.00 0.00 H new ATOM 0 HA ARG A 88 -8.419 -2.548 15.018 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -10.240 -4.509 14.619 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -10.071 -3.644 16.134 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -12.004 -2.392 15.808 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -11.912 -2.492 14.060 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -13.674 -3.949 14.512 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -12.322 -5.059 14.412 1.00 0.00 H new ATOM 0 HE ARG A 88 -12.705 -4.122 17.132 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -13.916 -6.348 14.674 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -14.572 -7.482 15.860 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -13.547 -5.585 18.648 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -14.364 -7.052 18.099 1.00 0.00 H new ATOM 1335 N SER A 89 -10.019 -3.377 12.242 1.00 0.00 N ATOM 1336 CA SER A 89 -9.825 -3.864 10.881 1.00 0.00 C ATOM 1337 C SER A 89 -10.911 -3.328 9.953 1.00 0.00 C ATOM 1338 O SER A 89 -11.849 -2.666 10.395 1.00 0.00 O ATOM 1339 CB SER A 89 -9.829 -5.394 10.859 1.00 0.00 C ATOM 1340 OG SER A 89 -11.092 -5.906 11.249 1.00 0.00 O ATOM 0 H SER A 89 -10.995 -3.303 12.529 1.00 0.00 H new ATOM 0 HA SER A 89 -8.859 -3.505 10.527 1.00 0.00 H new ATOM 0 HB2 SER A 89 -9.583 -5.747 9.857 1.00 0.00 H new ATOM 0 HB3 SER A 89 -9.057 -5.773 11.529 1.00 0.00 H new ATOM 0 HG SER A 89 -11.069 -6.885 11.225 1.00 0.00 H new ATOM 1346 N MET A 90 -10.775 -3.619 8.663 1.00 0.00 N ATOM 1347 CA MET A 90 -11.744 -3.168 7.672 1.00 0.00 C ATOM 1348 C MET A 90 -12.347 -4.352 6.922 1.00 0.00 C ATOM 1349 O MET A 90 -11.625 -5.209 6.413 1.00 0.00 O ATOM 1350 CB MET A 90 -11.083 -2.206 6.682 1.00 0.00 C ATOM 1351 CG MET A 90 -12.071 -1.507 5.762 1.00 0.00 C ATOM 1352 SD MET A 90 -12.396 0.196 6.258 1.00 0.00 S ATOM 1353 CE MET A 90 -12.707 -0.015 8.010 1.00 0.00 C ATOM 0 H MET A 90 -10.003 -4.165 8.280 1.00 0.00 H new ATOM 0 HA MET A 90 -12.545 -2.646 8.196 1.00 0.00 H new ATOM 0 HB2 MET A 90 -10.522 -1.454 7.238 1.00 0.00 H new ATOM 0 HB3 MET A 90 -10.364 -2.758 6.077 1.00 0.00 H new ATOM 0 HG2 MET A 90 -11.683 -1.517 4.743 1.00 0.00 H new ATOM 0 HG3 MET A 90 -13.008 -2.064 5.751 1.00 0.00 H new ATOM 0 HE1 MET A 90 -13.096 0.915 8.425 1.00 0.00 H new ATOM 0 HE2 MET A 90 -13.437 -0.811 8.157 1.00 0.00 H new ATOM 0 HE3 MET A 90 -11.778 -0.277 8.516 1.00 0.00 H new ATOM 1363 N ASP A 91 -13.673 -4.393 6.859 1.00 0.00 N ATOM 1364 CA ASP A 91 -14.373 -5.472 6.172 1.00 0.00 C ATOM 1365 C ASP A 91 -14.899 -5.002 4.819 1.00 0.00 C ATOM 1366 O ASP A 91 -14.556 -3.917 4.350 1.00 0.00 O ATOM 1367 CB ASP A 91 -15.528 -5.989 7.031 1.00 0.00 C ATOM 1368 CG ASP A 91 -15.181 -6.025 8.506 1.00 0.00 C ATOM 1369 OD1 ASP A 91 -15.297 -4.973 9.170 1.00 0.00 O ATOM 1370 OD2 ASP A 91 -14.793 -7.105 8.998 1.00 0.00 O ATOM 0 H ASP A 91 -14.285 -3.691 7.275 1.00 0.00 H new ATOM 0 HA ASP A 91 -13.665 -6.283 6.005 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -16.401 -5.354 6.881 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -15.803 -6.991 6.701 1.00 0.00 H new ATOM 1375 N PHE A 92 -15.734 -5.828 4.196 1.00 0.00 N ATOM 1376 CA PHE A 92 -16.307 -5.498 2.896 1.00 0.00 C ATOM 1377 C PHE A 92 -17.418 -4.462 3.038 1.00 0.00 C ATOM 1378 O PHE A 92 -17.578 -3.589 2.186 1.00 0.00 O ATOM 1379 CB PHE A 92 -16.852 -6.758 2.221 1.00 0.00 C ATOM 1380 CG PHE A 92 -15.787 -7.754 1.859 1.00 0.00 C ATOM 1381 CD1 PHE A 92 -15.175 -8.520 2.838 1.00 0.00 C ATOM 1382 CD2 PHE A 92 -15.398 -7.923 0.541 1.00 0.00 C ATOM 1383 CE1 PHE A 92 -14.195 -9.436 2.509 1.00 0.00 C ATOM 1384 CE2 PHE A 92 -14.418 -8.838 0.204 1.00 0.00 C ATOM 1385 CZ PHE A 92 -13.816 -9.596 1.190 1.00 0.00 C ATOM 0 H PHE A 92 -16.029 -6.730 4.570 1.00 0.00 H new ATOM 0 HA PHE A 92 -15.517 -5.074 2.276 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -17.572 -7.234 2.886 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -17.392 -6.472 1.319 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -15.468 -8.399 3.871 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -15.866 -7.333 -0.233 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -13.726 -10.026 3.282 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -14.124 -8.960 -0.828 1.00 0.00 H new ATOM 0 HZ PHE A 92 -13.051 -10.312 0.930 1.00 0.00 H new ATOM 1395 N GLU A 93 -18.182 -4.567 4.120 1.00 0.00 N ATOM 1396 CA GLU A 93 -19.279 -3.640 4.373 1.00 0.00 C ATOM 1397 C GLU A 93 -18.765 -2.345 4.996 1.00 0.00 C ATOM 1398 O GLU A 93 -19.266 -1.261 4.701 1.00 0.00 O ATOM 1399 CB GLU A 93 -20.319 -4.284 5.293 1.00 0.00 C ATOM 1400 CG GLU A 93 -21.362 -5.103 4.552 1.00 0.00 C ATOM 1401 CD GLU A 93 -22.745 -4.973 5.160 1.00 0.00 C ATOM 1402 OE1 GLU A 93 -22.924 -5.392 6.323 1.00 0.00 O ATOM 1403 OE2 GLU A 93 -23.649 -4.452 4.473 1.00 0.00 O ATOM 0 H GLU A 93 -18.062 -5.284 4.835 1.00 0.00 H new ATOM 0 HA GLU A 93 -19.747 -3.402 3.418 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -19.809 -4.925 6.012 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -20.821 -3.502 5.863 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -21.396 -4.784 3.510 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -21.065 -6.152 4.555 1.00 0.00 H new ATOM 1410 N GLU A 94 -17.763 -2.469 5.861 1.00 0.00 N ATOM 1411 CA GLU A 94 -17.182 -1.309 6.527 1.00 0.00 C ATOM 1412 C GLU A 94 -16.351 -0.481 5.551 1.00 0.00 C ATOM 1413 O GLU A 94 -16.142 0.714 5.756 1.00 0.00 O ATOM 1414 CB GLU A 94 -16.312 -1.753 7.706 1.00 0.00 C ATOM 1415 CG GLU A 94 -17.065 -1.823 9.024 1.00 0.00 C ATOM 1416 CD GLU A 94 -16.413 -0.993 10.113 1.00 0.00 C ATOM 1417 OE1 GLU A 94 -15.982 0.141 9.816 1.00 0.00 O ATOM 1418 OE2 GLU A 94 -16.333 -1.477 11.261 1.00 0.00 O ATOM 0 H GLU A 94 -17.337 -3.360 6.117 1.00 0.00 H new ATOM 0 HA GLU A 94 -17.998 -0.689 6.899 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -15.889 -2.733 7.486 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -15.476 -1.061 7.811 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -18.088 -1.478 8.873 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -17.124 -2.861 9.350 1.00 0.00 H new ATOM 1425 N ALA A 95 -15.879 -1.126 4.489 1.00 0.00 N ATOM 1426 CA ALA A 95 -15.072 -0.450 3.481 1.00 0.00 C ATOM 1427 C ALA A 95 -15.952 0.287 2.478 1.00 0.00 C ATOM 1428 O ALA A 95 -15.462 1.078 1.673 1.00 0.00 O ATOM 1429 CB ALA A 95 -14.176 -1.450 2.765 1.00 0.00 C ATOM 0 H ALA A 95 -16.042 -2.116 4.305 1.00 0.00 H new ATOM 0 HA ALA A 95 -14.446 0.286 3.985 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -13.579 -0.932 2.015 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -13.515 -1.929 3.488 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -14.791 -2.207 2.279 1.00 0.00 H new ATOM 1435 N GLU A 96 -17.254 0.022 2.532 1.00 0.00 N ATOM 1436 CA GLU A 96 -18.201 0.661 1.625 1.00 0.00 C ATOM 1437 C GLU A 96 -18.947 1.792 2.327 1.00 0.00 C ATOM 1438 O GLU A 96 -19.052 2.900 1.802 1.00 0.00 O ATOM 1439 CB GLU A 96 -19.199 -0.367 1.088 1.00 0.00 C ATOM 1440 CG GLU A 96 -19.133 -0.550 -0.419 1.00 0.00 C ATOM 1441 CD GLU A 96 -20.466 -0.299 -1.096 1.00 0.00 C ATOM 1442 OE1 GLU A 96 -20.933 0.858 -1.077 1.00 0.00 O ATOM 1443 OE2 GLU A 96 -21.042 -1.262 -1.646 1.00 0.00 O ATOM 0 H GLU A 96 -17.676 -0.630 3.193 1.00 0.00 H new ATOM 0 HA GLU A 96 -17.640 1.082 0.791 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -19.014 -1.327 1.570 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -20.208 -0.060 1.364 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -18.387 0.129 -0.831 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -18.801 -1.563 -0.644 1.00 0.00 H new ATOM 1450 N ARG A 97 -19.465 1.503 3.517 1.00 0.00 N ATOM 1451 CA ARG A 97 -20.203 2.494 4.290 1.00 0.00 C ATOM 1452 C ARG A 97 -19.289 3.636 4.723 1.00 0.00 C ATOM 1453 O ARG A 97 -19.653 4.808 4.622 1.00 0.00 O ATOM 1454 CB ARG A 97 -20.840 1.842 5.519 1.00 0.00 C ATOM 1455 CG ARG A 97 -19.844 1.119 6.410 1.00 0.00 C ATOM 1456 CD ARG A 97 -20.493 -0.048 7.138 1.00 0.00 C ATOM 1457 NE ARG A 97 -20.436 0.113 8.589 1.00 0.00 N ATOM 1458 CZ ARG A 97 -21.269 0.887 9.275 1.00 0.00 C ATOM 1459 NH1 ARG A 97 -22.218 1.567 8.647 1.00 0.00 N ATOM 1460 NH2 ARG A 97 -21.154 0.982 10.594 1.00 0.00 N ATOM 0 H ARG A 97 -19.387 0.591 3.966 1.00 0.00 H new ATOM 0 HA ARG A 97 -20.989 2.902 3.655 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -21.348 2.609 6.104 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -21.601 1.134 5.191 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -19.012 0.756 5.807 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -19.430 1.818 7.137 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -21.533 -0.138 6.824 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -19.993 -0.975 6.856 1.00 0.00 H new ATOM 0 HE ARG A 97 -19.717 -0.397 9.103 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -22.310 1.497 7.634 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -22.856 2.160 9.177 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -20.425 0.460 11.081 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -21.794 1.577 11.120 1.00 0.00 H new ATOM 1474 N SER A 98 -18.101 3.286 5.206 1.00 0.00 N ATOM 1475 CA SER A 98 -17.137 4.282 5.659 1.00 0.00 C ATOM 1476 C SER A 98 -16.207 4.693 4.522 1.00 0.00 C ATOM 1477 O SER A 98 -15.562 3.851 3.898 1.00 0.00 O ATOM 1478 CB SER A 98 -16.318 3.734 6.830 1.00 0.00 C ATOM 1479 OG SER A 98 -17.133 2.986 7.715 1.00 0.00 O ATOM 0 H SER A 98 -17.783 2.321 5.294 1.00 0.00 H new ATOM 0 HA SER A 98 -17.689 5.162 5.991 1.00 0.00 H new ATOM 0 HB2 SER A 98 -15.513 3.104 6.452 1.00 0.00 H new ATOM 0 HB3 SER A 98 -15.851 4.558 7.369 1.00 0.00 H new ATOM 0 HG SER A 98 -17.129 2.044 7.446 1.00 0.00 H new ATOM 1485 N GLU A 99 -16.144 5.995 4.258 1.00 0.00 N ATOM 1486 CA GLU A 99 -15.293 6.519 3.196 1.00 0.00 C ATOM 1487 C GLU A 99 -13.825 6.491 3.611 1.00 0.00 C ATOM 1488 O GLU A 99 -13.484 6.624 4.786 1.00 0.00 O ATOM 1489 CB GLU A 99 -15.707 7.948 2.839 1.00 0.00 C ATOM 1490 CG GLU A 99 -15.325 8.973 3.893 1.00 0.00 C ATOM 1491 CD GLU A 99 -16.289 10.143 3.944 1.00 0.00 C ATOM 1492 OE1 GLU A 99 -17.514 9.905 3.909 1.00 0.00 O ATOM 1493 OE2 GLU A 99 -15.817 11.297 4.020 1.00 0.00 O ATOM 0 H GLU A 99 -16.672 6.706 4.765 1.00 0.00 H new ATOM 0 HA GLU A 99 -15.416 5.883 2.319 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -15.246 8.225 1.891 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -16.786 7.978 2.689 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -15.293 8.490 4.870 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -14.321 9.343 3.688 1.00 0.00 H new ATOM 1500 N PRO A 100 -12.935 6.314 2.624 1.00 0.00 N ATOM 1501 CA PRO A 100 -11.489 6.265 2.861 1.00 0.00 C ATOM 1502 C PRO A 100 -10.921 7.621 3.262 1.00 0.00 C ATOM 1503 O PRO A 100 -11.612 8.639 3.201 1.00 0.00 O ATOM 1504 CB PRO A 100 -10.923 5.827 1.508 1.00 0.00 C ATOM 1505 CG PRO A 100 -11.939 6.266 0.511 1.00 0.00 C ATOM 1506 CD PRO A 100 -13.271 6.149 1.199 1.00 0.00 C ATOM 0 HA PRO A 100 -11.233 5.596 3.683 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -9.955 6.289 1.316 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -10.774 4.748 1.472 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -11.754 7.291 0.191 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -11.905 5.642 -0.382 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -13.968 6.915 0.859 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -13.740 5.184 1.006 1.00 0.00 H new ATOM 1514 N THR A 101 -9.656 7.630 3.673 1.00 0.00 N ATOM 1515 CA THR A 101 -8.995 8.862 4.085 1.00 0.00 C ATOM 1516 C THR A 101 -8.493 9.647 2.878 1.00 0.00 C ATOM 1517 O THR A 101 -8.284 10.857 2.958 1.00 0.00 O ATOM 1518 CB THR A 101 -7.810 8.576 5.026 1.00 0.00 C ATOM 1519 OG1 THR A 101 -8.271 7.903 6.203 1.00 0.00 O ATOM 1520 CG2 THR A 101 -7.106 9.866 5.417 1.00 0.00 C ATOM 0 H THR A 101 -9.069 6.798 3.729 1.00 0.00 H new ATOM 0 HA THR A 101 -9.737 9.456 4.618 1.00 0.00 H new ATOM 0 HB THR A 101 -7.100 7.939 4.498 1.00 0.00 H new ATOM 0 HG1 THR A 101 -8.057 8.442 6.993 1.00 0.00 H new ATOM 0 HG21 THR A 101 -6.273 9.639 6.082 1.00 0.00 H new ATOM 0 HG22 THR A 101 -6.731 10.362 4.522 1.00 0.00 H new ATOM 0 HG23 THR A 101 -7.809 10.524 5.928 1.00 0.00 H new ATOM 1528 N GLN A 102 -8.302 8.950 1.763 1.00 0.00 N ATOM 1529 CA GLN A 102 -7.824 9.583 0.540 1.00 0.00 C ATOM 1530 C GLN A 102 -8.491 8.970 -0.687 1.00 0.00 C ATOM 1531 O GLN A 102 -9.371 9.578 -1.296 1.00 0.00 O ATOM 1532 CB GLN A 102 -6.304 9.447 0.430 1.00 0.00 C ATOM 1533 CG GLN A 102 -5.753 9.857 -0.926 1.00 0.00 C ATOM 1534 CD GLN A 102 -4.394 10.522 -0.827 1.00 0.00 C ATOM 1535 OE1 GLN A 102 -3.497 10.028 -0.144 1.00 0.00 O ATOM 1536 NE2 GLN A 102 -4.236 11.650 -1.510 1.00 0.00 N ATOM 0 H GLN A 102 -8.471 7.947 1.681 1.00 0.00 H new ATOM 0 HA GLN A 102 -8.085 10.640 0.583 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -5.836 10.057 1.203 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -6.025 8.412 0.629 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -5.677 8.977 -1.564 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -6.453 10.540 -1.407 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -5.007 12.023 -2.063 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -3.343 12.143 -1.481 1.00 0.00 H new ATOM 1545 N ALA A 103 -8.066 7.763 -1.045 1.00 0.00 N ATOM 1546 CA ALA A 103 -8.624 7.067 -2.198 1.00 0.00 C ATOM 1547 C ALA A 103 -8.293 7.800 -3.494 1.00 0.00 C ATOM 1548 O ALA A 103 -8.682 8.953 -3.684 1.00 0.00 O ATOM 1549 CB ALA A 103 -10.130 6.915 -2.045 1.00 0.00 C ATOM 0 H ALA A 103 -7.337 7.247 -0.553 1.00 0.00 H new ATOM 0 HA ALA A 103 -8.173 6.076 -2.246 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -10.533 6.394 -2.913 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -10.348 6.342 -1.144 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -10.589 7.901 -1.968 1.00 0.00 H new ATOM 1555 N LEU A 104 -7.571 7.124 -4.382 1.00 0.00 N ATOM 1556 CA LEU A 104 -7.187 7.712 -5.661 1.00 0.00 C ATOM 1557 C LEU A 104 -7.308 6.690 -6.787 1.00 0.00 C ATOM 1558 O LEU A 104 -7.319 5.484 -6.545 1.00 0.00 O ATOM 1559 CB LEU A 104 -5.754 8.243 -5.590 1.00 0.00 C ATOM 1560 CG LEU A 104 -5.279 8.712 -4.215 1.00 0.00 C ATOM 1561 CD1 LEU A 104 -4.627 7.568 -3.456 1.00 0.00 C ATOM 1562 CD2 LEU A 104 -4.314 9.881 -4.354 1.00 0.00 C ATOM 0 H LEU A 104 -7.240 6.170 -4.240 1.00 0.00 H new ATOM 0 HA LEU A 104 -7.864 8.540 -5.872 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.080 7.460 -5.937 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -5.661 9.075 -6.288 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.147 9.048 -3.648 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -4.295 7.921 -2.480 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -5.348 6.761 -3.324 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -3.769 7.200 -4.019 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -3.986 10.202 -3.365 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -3.449 9.571 -4.940 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -4.815 10.709 -4.856 1.00 0.00 H new ATOM 1574 N GLU A 105 -7.397 7.183 -8.019 1.00 0.00 N ATOM 1575 CA GLU A 105 -7.516 6.312 -9.182 1.00 0.00 C ATOM 1576 C GLU A 105 -6.154 6.081 -9.830 1.00 0.00 C ATOM 1577 O GLU A 105 -5.750 6.817 -10.732 1.00 0.00 O ATOM 1578 CB GLU A 105 -8.483 6.917 -10.203 1.00 0.00 C ATOM 1579 CG GLU A 105 -8.570 6.129 -11.499 1.00 0.00 C ATOM 1580 CD GLU A 105 -9.398 6.835 -12.556 1.00 0.00 C ATOM 1581 OE1 GLU A 105 -9.612 8.058 -12.423 1.00 0.00 O ATOM 1582 OE2 GLU A 105 -9.831 6.163 -13.515 1.00 0.00 O ATOM 0 H GLU A 105 -7.389 8.179 -8.237 1.00 0.00 H new ATOM 0 HA GLU A 105 -7.907 5.352 -8.846 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -9.476 6.979 -9.758 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -8.170 7.937 -10.428 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.565 5.958 -11.884 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -9.004 5.150 -11.296 1.00 0.00 H new ATOM 1589 N LEU A 106 -5.450 5.055 -9.364 1.00 0.00 N ATOM 1590 CA LEU A 106 -4.133 4.726 -9.897 1.00 0.00 C ATOM 1591 C LEU A 106 -4.190 4.532 -11.409 1.00 0.00 C ATOM 1592 O LEU A 106 -5.107 3.896 -11.930 1.00 0.00 O ATOM 1593 CB LEU A 106 -3.592 3.461 -9.229 1.00 0.00 C ATOM 1594 CG LEU A 106 -3.645 3.434 -7.701 1.00 0.00 C ATOM 1595 CD1 LEU A 106 -2.960 2.187 -7.165 1.00 0.00 C ATOM 1596 CD2 LEU A 106 -3.004 4.687 -7.123 1.00 0.00 C ATOM 0 H LEU A 106 -5.769 4.437 -8.618 1.00 0.00 H new ATOM 0 HA LEU A 106 -3.463 5.558 -9.681 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.153 2.606 -9.607 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.556 3.325 -9.539 1.00 0.00 H new ATOM 0 HG LEU A 106 -4.690 3.410 -7.393 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -3.008 2.185 -6.076 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.463 1.301 -7.552 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -1.917 2.180 -7.482 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -3.051 4.651 -6.035 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -1.963 4.742 -7.440 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -3.539 5.567 -7.480 1.00 0.00 H new ATOM 1608 N THR A 107 -3.203 5.082 -12.109 1.00 0.00 N ATOM 1609 CA THR A 107 -3.140 4.968 -13.561 1.00 0.00 C ATOM 1610 C THR A 107 -2.019 4.028 -13.991 1.00 0.00 C ATOM 1611 O THR A 107 -1.267 3.523 -13.158 1.00 0.00 O ATOM 1612 CB THR A 107 -2.925 6.342 -14.223 1.00 0.00 C ATOM 1613 OG1 THR A 107 -3.097 6.235 -15.641 1.00 0.00 O ATOM 1614 CG2 THR A 107 -1.535 6.879 -13.916 1.00 0.00 C ATOM 0 H THR A 107 -2.436 5.611 -11.694 1.00 0.00 H new ATOM 0 HA THR A 107 -4.097 4.561 -13.888 1.00 0.00 H new ATOM 0 HB THR A 107 -3.663 7.035 -13.819 1.00 0.00 H new ATOM 0 HG1 THR A 107 -2.960 7.113 -16.054 1.00 0.00 H new ATOM 0 HG21 THR A 107 -1.406 7.850 -14.394 1.00 0.00 H new ATOM 0 HG22 THR A 107 -1.416 6.987 -12.838 1.00 0.00 H new ATOM 0 HG23 THR A 107 -0.785 6.185 -14.296 1.00 0.00 H new ATOM 1622 N GLU A 108 -1.913 3.799 -15.296 1.00 0.00 N ATOM 1623 CA GLU A 108 -0.883 2.919 -15.835 1.00 0.00 C ATOM 1624 C GLU A 108 0.508 3.399 -15.432 1.00 0.00 C ATOM 1625 O GLU A 108 1.441 2.604 -15.315 1.00 0.00 O ATOM 1626 CB GLU A 108 -0.988 2.848 -17.360 1.00 0.00 C ATOM 1627 CG GLU A 108 -0.933 4.207 -18.037 1.00 0.00 C ATOM 1628 CD GLU A 108 -0.627 4.108 -19.519 1.00 0.00 C ATOM 1629 OE1 GLU A 108 0.490 3.672 -19.867 1.00 0.00 O ATOM 1630 OE2 GLU A 108 -1.506 4.466 -20.331 1.00 0.00 O ATOM 0 H GLU A 108 -2.527 4.210 -15.999 1.00 0.00 H new ATOM 0 HA GLU A 108 -1.039 1.923 -15.421 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -0.178 2.227 -17.743 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -1.922 2.355 -17.629 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -1.887 4.716 -17.900 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -0.172 4.820 -17.553 1.00 0.00 H new ATOM 1637 N ASP A 109 0.639 4.704 -15.221 1.00 0.00 N ATOM 1638 CA ASP A 109 1.915 5.291 -14.831 1.00 0.00 C ATOM 1639 C ASP A 109 2.143 5.147 -13.329 1.00 0.00 C ATOM 1640 O ASP A 109 3.259 5.323 -12.841 1.00 0.00 O ATOM 1641 CB ASP A 109 1.964 6.767 -15.227 1.00 0.00 C ATOM 1642 CG ASP A 109 2.944 7.032 -16.354 1.00 0.00 C ATOM 1643 OD1 ASP A 109 2.827 6.375 -17.408 1.00 0.00 O ATOM 1644 OD2 ASP A 109 3.829 7.896 -16.180 1.00 0.00 O ATOM 0 H ASP A 109 -0.123 5.375 -15.314 1.00 0.00 H new ATOM 0 HA ASP A 109 2.708 4.756 -15.354 1.00 0.00 H new ATOM 0 HB2 ASP A 109 0.969 7.092 -15.531 1.00 0.00 H new ATOM 0 HB3 ASP A 109 2.243 7.364 -14.359 1.00 0.00 H new ATOM 1649 N ASP A 110 1.078 4.829 -12.602 1.00 0.00 N ATOM 1650 CA ASP A 110 1.161 4.661 -11.156 1.00 0.00 C ATOM 1651 C ASP A 110 1.325 3.190 -10.788 1.00 0.00 C ATOM 1652 O ASP A 110 1.686 2.859 -9.658 1.00 0.00 O ATOM 1653 CB ASP A 110 -0.088 5.232 -10.483 1.00 0.00 C ATOM 1654 CG ASP A 110 -0.363 6.665 -10.893 1.00 0.00 C ATOM 1655 OD1 ASP A 110 0.609 7.408 -11.142 1.00 0.00 O ATOM 1656 OD2 ASP A 110 -1.551 7.045 -10.964 1.00 0.00 O ATOM 0 H ASP A 110 0.146 4.682 -12.991 1.00 0.00 H new ATOM 0 HA ASP A 110 2.036 5.205 -10.801 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -0.949 4.613 -10.737 1.00 0.00 H new ATOM 0 HB3 ASP A 110 0.032 5.183 -9.401 1.00 0.00 H new ATOM 1661 N ILE A 111 1.056 2.311 -11.748 1.00 0.00 N ATOM 1662 CA ILE A 111 1.174 0.876 -11.524 1.00 0.00 C ATOM 1663 C ILE A 111 2.193 0.254 -12.472 1.00 0.00 C ATOM 1664 O ILE A 111 2.137 -0.941 -12.765 1.00 0.00 O ATOM 1665 CB ILE A 111 -0.180 0.165 -11.705 1.00 0.00 C ATOM 1666 CG1 ILE A 111 -0.645 0.270 -13.159 1.00 0.00 C ATOM 1667 CG2 ILE A 111 -1.220 0.758 -10.766 1.00 0.00 C ATOM 1668 CD1 ILE A 111 -0.791 -1.070 -13.845 1.00 0.00 C ATOM 0 H ILE A 111 0.755 2.568 -12.688 1.00 0.00 H new ATOM 0 HA ILE A 111 1.510 0.743 -10.496 1.00 0.00 H new ATOM 0 HB ILE A 111 -0.056 -0.889 -11.458 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -1.602 0.791 -13.189 1.00 0.00 H new ATOM 0 HG13 ILE A 111 0.067 0.879 -13.717 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -2.171 0.245 -10.906 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -0.890 0.636 -9.734 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -1.344 1.819 -10.984 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -1.124 -0.919 -14.872 1.00 0.00 H new ATOM 0 HD12 ILE A 111 0.170 -1.584 -13.847 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -1.525 -1.674 -13.311 1.00 0.00 H new ATOM 1680 N LYS A 112 3.126 1.071 -12.949 1.00 0.00 N ATOM 1681 CA LYS A 112 4.162 0.602 -13.862 1.00 0.00 C ATOM 1682 C LYS A 112 5.392 0.132 -13.093 1.00 0.00 C ATOM 1683 O LYS A 112 5.368 0.032 -11.867 1.00 0.00 O ATOM 1684 CB LYS A 112 4.551 1.714 -14.838 1.00 0.00 C ATOM 1685 CG LYS A 112 5.172 2.926 -14.164 1.00 0.00 C ATOM 1686 CD LYS A 112 6.092 3.680 -15.109 1.00 0.00 C ATOM 1687 CE LYS A 112 5.778 5.168 -15.125 1.00 0.00 C ATOM 1688 NZ LYS A 112 6.661 5.911 -16.065 1.00 0.00 N ATOM 0 H LYS A 112 3.186 2.063 -12.718 1.00 0.00 H new ATOM 0 HA LYS A 112 3.762 -0.242 -14.424 1.00 0.00 H new ATOM 0 HB2 LYS A 112 5.255 1.315 -15.569 1.00 0.00 H new ATOM 0 HB3 LYS A 112 3.665 2.029 -15.388 1.00 0.00 H new ATOM 0 HG2 LYS A 112 4.384 3.592 -13.814 1.00 0.00 H new ATOM 0 HG3 LYS A 112 5.733 2.607 -13.286 1.00 0.00 H new ATOM 0 HD2 LYS A 112 7.128 3.529 -14.807 1.00 0.00 H new ATOM 0 HD3 LYS A 112 5.992 3.275 -16.116 1.00 0.00 H new ATOM 0 HE2 LYS A 112 4.737 5.316 -15.411 1.00 0.00 H new ATOM 0 HE3 LYS A 112 5.894 5.574 -14.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 6.415 6.921 -16.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 7.653 5.791 -15.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 6.532 5.541 -17.028 1.00 0.00 H new ATOM 1702 N GLU A 113 6.466 -0.155 -13.823 1.00 0.00 N ATOM 1703 CA GLU A 113 7.706 -0.614 -13.208 1.00 0.00 C ATOM 1704 C GLU A 113 8.130 0.318 -12.076 1.00 0.00 C ATOM 1705 O GLU A 113 8.612 -0.131 -11.036 1.00 0.00 O ATOM 1706 CB GLU A 113 8.819 -0.702 -14.255 1.00 0.00 C ATOM 1707 CG GLU A 113 9.123 0.623 -14.932 1.00 0.00 C ATOM 1708 CD GLU A 113 10.007 0.465 -16.154 1.00 0.00 C ATOM 1709 OE1 GLU A 113 9.526 -0.083 -17.168 1.00 0.00 O ATOM 1710 OE2 GLU A 113 11.181 0.888 -16.095 1.00 0.00 O ATOM 0 H GLU A 113 6.502 -0.078 -14.839 1.00 0.00 H new ATOM 0 HA GLU A 113 7.529 -1.606 -12.792 1.00 0.00 H new ATOM 0 HB2 GLU A 113 9.726 -1.073 -13.778 1.00 0.00 H new ATOM 0 HB3 GLU A 113 8.536 -1.432 -15.014 1.00 0.00 H new ATOM 0 HG2 GLU A 113 8.188 1.100 -15.224 1.00 0.00 H new ATOM 0 HG3 GLU A 113 9.611 1.288 -14.219 1.00 0.00 H new ATOM 1717 N ASP A 114 7.948 1.617 -12.288 1.00 0.00 N ATOM 1718 CA ASP A 114 8.311 2.613 -11.287 1.00 0.00 C ATOM 1719 C ASP A 114 7.106 3.470 -10.912 1.00 0.00 C ATOM 1720 O ASP A 114 7.238 4.667 -10.660 1.00 0.00 O ATOM 1721 CB ASP A 114 9.443 3.500 -11.806 1.00 0.00 C ATOM 1722 CG ASP A 114 10.329 4.020 -10.691 1.00 0.00 C ATOM 1723 OD1 ASP A 114 9.913 4.971 -9.996 1.00 0.00 O ATOM 1724 OD2 ASP A 114 11.439 3.476 -10.513 1.00 0.00 O ATOM 0 H ASP A 114 7.551 2.005 -13.144 1.00 0.00 H new ATOM 0 HA ASP A 114 8.652 2.088 -10.395 1.00 0.00 H new ATOM 0 HB2 ASP A 114 10.049 2.934 -12.513 1.00 0.00 H new ATOM 0 HB3 ASP A 114 9.019 4.343 -12.352 1.00 0.00 H new ATOM 1729 N GLY A 115 5.931 2.849 -10.879 1.00 0.00 N ATOM 1730 CA GLY A 115 4.720 3.571 -10.536 1.00 0.00 C ATOM 1731 C GLY A 115 4.745 4.105 -9.117 1.00 0.00 C ATOM 1732 O GLY A 115 5.207 3.426 -8.200 1.00 0.00 O ATOM 0 H GLY A 115 5.796 1.859 -11.084 1.00 0.00 H new ATOM 0 HA2 GLY A 115 4.586 4.400 -11.231 1.00 0.00 H new ATOM 0 HA3 GLY A 115 3.861 2.911 -10.658 1.00 0.00 H new ATOM 1736 N ILE A 116 4.249 5.325 -8.937 1.00 0.00 N ATOM 1737 CA ILE A 116 4.218 5.949 -7.620 1.00 0.00 C ATOM 1738 C ILE A 116 2.885 6.646 -7.374 1.00 0.00 C ATOM 1739 O ILE A 116 2.361 7.336 -8.249 1.00 0.00 O ATOM 1740 CB ILE A 116 5.358 6.972 -7.455 1.00 0.00 C ATOM 1741 CG1 ILE A 116 5.278 7.639 -6.080 1.00 0.00 C ATOM 1742 CG2 ILE A 116 5.297 8.016 -8.560 1.00 0.00 C ATOM 1743 CD1 ILE A 116 5.350 6.660 -4.929 1.00 0.00 C ATOM 0 H ILE A 116 3.864 5.900 -9.686 1.00 0.00 H new ATOM 0 HA ILE A 116 4.348 5.151 -6.889 1.00 0.00 H new ATOM 0 HB ILE A 116 6.311 6.448 -7.530 1.00 0.00 H new ATOM 0 HG12 ILE A 116 6.092 8.358 -5.986 1.00 0.00 H new ATOM 0 HG13 ILE A 116 4.346 8.201 -6.011 1.00 0.00 H new ATOM 0 HG21 ILE A 116 6.109 8.732 -8.430 1.00 0.00 H new ATOM 0 HG22 ILE A 116 5.397 7.527 -9.529 1.00 0.00 H new ATOM 0 HG23 ILE A 116 4.342 8.539 -8.514 1.00 0.00 H new ATOM 0 HD11 ILE A 116 5.287 7.202 -3.986 1.00 0.00 H new ATOM 0 HD12 ILE A 116 4.521 5.955 -4.998 1.00 0.00 H new ATOM 0 HD13 ILE A 116 6.293 6.116 -4.973 1.00 0.00 H new ATOM 1755 N VAL A 117 2.340 6.463 -6.175 1.00 0.00 N ATOM 1756 CA VAL A 117 1.068 7.077 -5.812 1.00 0.00 C ATOM 1757 C VAL A 117 1.259 8.141 -4.737 1.00 0.00 C ATOM 1758 O VAL A 117 1.409 7.842 -3.552 1.00 0.00 O ATOM 1759 CB VAL A 117 0.062 6.026 -5.306 1.00 0.00 C ATOM 1760 CG1 VAL A 117 -1.332 6.626 -5.204 1.00 0.00 C ATOM 1761 CG2 VAL A 117 0.061 4.808 -6.217 1.00 0.00 C ATOM 0 H VAL A 117 2.759 5.895 -5.439 1.00 0.00 H new ATOM 0 HA VAL A 117 0.672 7.543 -6.714 1.00 0.00 H new ATOM 0 HB VAL A 117 0.368 5.706 -4.310 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -2.029 5.869 -4.845 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -1.317 7.465 -4.508 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -1.650 6.975 -6.186 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -0.655 4.076 -5.845 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -0.219 5.109 -7.226 1.00 0.00 H new ATOM 0 HG23 VAL A 117 1.057 4.365 -6.234 1.00 0.00 H new ATOM 1771 N PRO A 118 1.252 9.415 -5.157 1.00 0.00 N ATOM 1772 CA PRO A 118 1.422 10.550 -4.245 1.00 0.00 C ATOM 1773 C PRO A 118 0.218 10.743 -3.330 1.00 0.00 C ATOM 1774 O PRO A 118 -0.858 11.141 -3.778 1.00 0.00 O ATOM 1775 CB PRO A 118 1.572 11.744 -5.191 1.00 0.00 C ATOM 1776 CG PRO A 118 0.873 11.330 -6.439 1.00 0.00 C ATOM 1777 CD PRO A 118 1.078 9.844 -6.555 1.00 0.00 C ATOM 0 HA PRO A 118 2.269 10.411 -3.574 1.00 0.00 H new ATOM 0 HB2 PRO A 118 1.125 12.643 -4.767 1.00 0.00 H new ATOM 0 HB3 PRO A 118 2.621 11.969 -5.381 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -0.188 11.575 -6.392 1.00 0.00 H new ATOM 0 HG3 PRO A 118 1.282 11.849 -7.306 1.00 0.00 H new ATOM 0 HD2 PRO A 118 0.223 9.355 -7.022 1.00 0.00 H new ATOM 0 HD3 PRO A 118 1.952 9.605 -7.161 1.00 0.00 H new ATOM 1785 N LEU A 119 0.406 10.459 -2.046 1.00 0.00 N ATOM 1786 CA LEU A 119 -0.665 10.603 -1.066 1.00 0.00 C ATOM 1787 C LEU A 119 -0.617 11.976 -0.404 1.00 0.00 C ATOM 1788 O LEU A 119 0.157 12.844 -0.807 1.00 0.00 O ATOM 1789 CB LEU A 119 -0.560 9.508 -0.003 1.00 0.00 C ATOM 1790 CG LEU A 119 -0.544 8.069 -0.520 1.00 0.00 C ATOM 1791 CD1 LEU A 119 0.019 7.129 0.535 1.00 0.00 C ATOM 1792 CD2 LEU A 119 -1.942 7.635 -0.934 1.00 0.00 C ATOM 0 H LEU A 119 1.290 10.128 -1.659 1.00 0.00 H new ATOM 0 HA LEU A 119 -1.617 10.505 -1.588 1.00 0.00 H new ATOM 0 HB2 LEU A 119 0.350 9.676 0.574 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -1.398 9.616 0.685 1.00 0.00 H new ATOM 0 HG LEU A 119 0.102 8.025 -1.397 1.00 0.00 H new ATOM 0 HD11 LEU A 119 0.023 6.110 0.149 1.00 0.00 H new ATOM 0 HD12 LEU A 119 1.038 7.427 0.782 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -0.600 7.176 1.431 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -1.911 6.608 -1.299 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -2.611 7.695 -0.075 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -2.307 8.291 -1.725 1.00 0.00 H new ATOM 1804 N ARG A 120 -1.449 12.166 0.615 1.00 0.00 N ATOM 1805 CA ARG A 120 -1.501 13.433 1.334 1.00 0.00 C ATOM 1806 C ARG A 120 -1.086 13.249 2.791 1.00 0.00 C ATOM 1807 O ARG A 120 -1.900 12.874 3.636 1.00 0.00 O ATOM 1808 CB ARG A 120 -2.910 14.026 1.264 1.00 0.00 C ATOM 1809 CG ARG A 120 -4.008 13.025 1.584 1.00 0.00 C ATOM 1810 CD ARG A 120 -5.383 13.583 1.252 1.00 0.00 C ATOM 1811 NE ARG A 120 -5.494 13.966 -0.153 1.00 0.00 N ATOM 1812 CZ ARG A 120 -6.550 14.588 -0.665 1.00 0.00 C ATOM 1813 NH1 ARG A 120 -7.581 14.896 0.110 1.00 0.00 N ATOM 1814 NH2 ARG A 120 -6.576 14.903 -1.953 1.00 0.00 N ATOM 0 H ARG A 120 -2.097 11.458 0.961 1.00 0.00 H new ATOM 0 HA ARG A 120 -0.801 14.121 0.859 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -2.978 14.862 1.960 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -3.077 14.428 0.265 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -3.841 12.107 1.021 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -3.966 12.762 2.641 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -6.143 12.837 1.485 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -5.584 14.450 1.881 1.00 0.00 H new ATOM 0 HE ARG A 120 -4.717 13.743 -0.776 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -7.564 14.655 1.101 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -8.391 15.374 -0.285 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -5.784 14.668 -2.552 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -7.388 15.381 -2.345 1.00 0.00 H new ATOM 1828 N TYR A 121 0.183 13.516 3.077 1.00 0.00 N ATOM 1829 CA TYR A 121 0.706 13.377 4.431 1.00 0.00 C ATOM 1830 C TYR A 121 -0.098 14.221 5.415 1.00 0.00 C ATOM 1831 O TYR A 121 -0.121 13.944 6.615 1.00 0.00 O ATOM 1832 CB TYR A 121 2.179 13.788 4.475 1.00 0.00 C ATOM 1833 CG TYR A 121 2.390 15.284 4.509 1.00 0.00 C ATOM 1834 CD1 TYR A 121 1.846 16.104 3.527 1.00 0.00 C ATOM 1835 CD2 TYR A 121 3.133 15.879 5.521 1.00 0.00 C ATOM 1836 CE1 TYR A 121 2.036 17.472 3.553 1.00 0.00 C ATOM 1837 CE2 TYR A 121 3.328 17.246 5.555 1.00 0.00 C ATOM 1838 CZ TYR A 121 2.778 18.039 4.570 1.00 0.00 C ATOM 1839 OH TYR A 121 2.970 19.401 4.600 1.00 0.00 O ATOM 0 H TYR A 121 0.868 13.830 2.390 1.00 0.00 H new ATOM 0 HA TYR A 121 0.618 12.330 4.722 1.00 0.00 H new ATOM 0 HB2 TYR A 121 2.645 13.344 5.355 1.00 0.00 H new ATOM 0 HB3 TYR A 121 2.688 13.378 3.603 1.00 0.00 H new ATOM 0 HD1 TYR A 121 1.265 15.664 2.730 1.00 0.00 H new ATOM 0 HD2 TYR A 121 3.566 15.262 6.295 1.00 0.00 H new ATOM 0 HE1 TYR A 121 1.607 18.095 2.782 1.00 0.00 H new ATOM 0 HE2 TYR A 121 3.908 17.692 6.349 1.00 0.00 H new ATOM 0 HH TYR A 121 3.513 19.638 5.381 1.00 0.00 H new ATOM 1849 N VAL A 122 -0.758 15.252 4.899 1.00 0.00 N ATOM 1850 CA VAL A 122 -1.566 16.137 5.730 1.00 0.00 C ATOM 1851 C VAL A 122 -2.625 15.354 6.498 1.00 0.00 C ATOM 1852 O VAL A 122 -3.124 15.808 7.528 1.00 0.00 O ATOM 1853 CB VAL A 122 -2.259 17.223 4.886 1.00 0.00 C ATOM 1854 CG1 VAL A 122 -3.182 16.591 3.855 1.00 0.00 C ATOM 1855 CG2 VAL A 122 -3.024 18.185 5.781 1.00 0.00 C ATOM 0 H VAL A 122 -0.749 15.496 3.909 1.00 0.00 H new ATOM 0 HA VAL A 122 -0.887 16.615 6.436 1.00 0.00 H new ATOM 0 HB VAL A 122 -1.494 17.789 4.354 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -3.663 17.374 3.268 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -2.602 15.947 3.194 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -3.943 15.999 4.363 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -3.507 18.946 5.168 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -3.780 17.636 6.342 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -2.333 18.663 6.475 1.00 0.00 H new ATOM 1865 N LYS A 123 -2.963 14.173 5.991 1.00 0.00 N ATOM 1866 CA LYS A 123 -3.962 13.324 6.629 1.00 0.00 C ATOM 1867 C LYS A 123 -3.297 12.191 7.404 1.00 0.00 C ATOM 1868 O LYS A 123 -3.813 11.738 8.426 1.00 0.00 O ATOM 1869 CB LYS A 123 -4.917 12.748 5.581 1.00 0.00 C ATOM 1870 CG LYS A 123 -5.640 13.808 4.769 1.00 0.00 C ATOM 1871 CD LYS A 123 -6.947 14.219 5.426 1.00 0.00 C ATOM 1872 CE LYS A 123 -6.782 15.486 6.251 1.00 0.00 C ATOM 1873 NZ LYS A 123 -8.060 16.241 6.370 1.00 0.00 N ATOM 0 H LYS A 123 -2.559 13.782 5.140 1.00 0.00 H new ATOM 0 HA LYS A 123 -4.529 13.937 7.330 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -4.355 12.105 4.904 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -5.654 12.119 6.080 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -4.998 14.682 4.656 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -5.839 13.427 3.767 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -7.706 14.379 4.660 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -7.304 13.411 6.065 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -6.419 15.227 7.246 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -6.026 16.122 5.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -7.905 17.097 6.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -8.393 16.511 5.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -8.775 15.643 6.831 1.00 0.00 H new ATOM 1887 N PHE A 124 -2.149 11.738 6.912 1.00 0.00 N ATOM 1888 CA PHE A 124 -1.413 10.657 7.559 1.00 0.00 C ATOM 1889 C PHE A 124 -0.255 11.208 8.386 1.00 0.00 C ATOM 1890 O PHE A 124 0.816 10.604 8.451 1.00 0.00 O ATOM 1891 CB PHE A 124 -0.885 9.673 6.513 1.00 0.00 C ATOM 1892 CG PHE A 124 -1.881 9.352 5.436 1.00 0.00 C ATOM 1893 CD1 PHE A 124 -2.913 8.458 5.672 1.00 0.00 C ATOM 1894 CD2 PHE A 124 -1.787 9.946 4.187 1.00 0.00 C ATOM 1895 CE1 PHE A 124 -3.830 8.160 4.682 1.00 0.00 C ATOM 1896 CE2 PHE A 124 -2.702 9.652 3.194 1.00 0.00 C ATOM 1897 CZ PHE A 124 -3.725 8.759 3.442 1.00 0.00 C ATOM 0 H PHE A 124 -1.708 12.102 6.068 1.00 0.00 H new ATOM 0 HA PHE A 124 -2.097 10.133 8.227 1.00 0.00 H new ATOM 0 HB2 PHE A 124 0.012 10.089 6.055 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -0.590 8.749 7.011 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -3.002 7.989 6.641 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -0.990 10.647 3.988 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -4.628 7.459 4.878 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -2.617 10.121 2.225 1.00 0.00 H new ATOM 0 HZ PHE A 124 -4.442 8.529 2.668 1.00 0.00 H new ATOM 1907 N GLN A 125 -0.479 12.356 9.016 1.00 0.00 N ATOM 1908 CA GLN A 125 0.547 12.989 9.838 1.00 0.00 C ATOM 1909 C GLN A 125 1.051 12.030 10.912 1.00 0.00 C ATOM 1910 O GLN A 125 2.177 12.157 11.391 1.00 0.00 O ATOM 1911 CB GLN A 125 -0.003 14.259 10.489 1.00 0.00 C ATOM 1912 CG GLN A 125 -0.494 15.292 9.488 1.00 0.00 C ATOM 1913 CD GLN A 125 0.602 16.240 9.043 1.00 0.00 C ATOM 1914 OE1 GLN A 125 0.679 17.379 9.505 1.00 0.00 O ATOM 1915 NE2 GLN A 125 1.457 15.775 8.140 1.00 0.00 N ATOM 0 H GLN A 125 -1.361 12.867 8.974 1.00 0.00 H new ATOM 0 HA GLN A 125 1.383 13.254 9.191 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -0.824 13.990 11.154 1.00 0.00 H new ATOM 0 HB3 GLN A 125 0.775 14.706 11.108 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -0.904 14.782 8.616 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -1.307 15.866 9.933 1.00 0.00 H new ATOM 0 HE21 GLN A 125 1.356 14.824 7.784 1.00 0.00 H new ATOM 0 HE22 GLN A 125 2.215 16.368 7.802 1.00 0.00 H new ATOM 1924 N ASN A 126 0.209 11.072 11.286 1.00 0.00 N ATOM 1925 CA ASN A 126 0.569 10.092 12.304 1.00 0.00 C ATOM 1926 C ASN A 126 -0.405 8.919 12.299 1.00 0.00 C ATOM 1927 O ASN A 126 -1.452 8.964 12.946 1.00 0.00 O ATOM 1928 CB ASN A 126 0.590 10.747 13.687 1.00 0.00 C ATOM 1929 CG ASN A 126 1.220 9.856 14.739 1.00 0.00 C ATOM 1930 OD1 ASN A 126 2.340 10.101 15.187 1.00 0.00 O ATOM 1931 ND2 ASN A 126 0.500 8.814 15.140 1.00 0.00 N ATOM 0 H ASN A 126 -0.727 10.954 10.899 1.00 0.00 H new ATOM 0 HA ASN A 126 1.565 9.714 12.073 1.00 0.00 H new ATOM 0 HB2 ASN A 126 1.141 11.686 13.633 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -0.429 10.992 13.985 1.00 0.00 H new ATOM 0 HD21 ASN A 126 0.871 8.179 15.847 1.00 0.00 H new ATOM 0 HD22 ASN A 126 -0.424 8.649 14.741 1.00 0.00 H new ATOM 1938 N VAL A 127 -0.054 7.868 11.565 1.00 0.00 N ATOM 1939 CA VAL A 127 -0.896 6.681 11.477 1.00 0.00 C ATOM 1940 C VAL A 127 -0.173 5.452 12.016 1.00 0.00 C ATOM 1941 O VAL A 127 1.034 5.299 11.831 1.00 0.00 O ATOM 1942 CB VAL A 127 -1.334 6.410 10.026 1.00 0.00 C ATOM 1943 CG1 VAL A 127 -1.833 7.689 9.371 1.00 0.00 C ATOM 1944 CG2 VAL A 127 -0.189 5.804 9.228 1.00 0.00 C ATOM 0 H VAL A 127 0.808 7.814 11.022 1.00 0.00 H new ATOM 0 HA VAL A 127 -1.779 6.875 12.085 1.00 0.00 H new ATOM 0 HB VAL A 127 -2.155 5.693 10.041 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -2.138 7.478 8.346 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -2.684 8.076 9.931 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -1.034 8.431 9.366 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -0.516 5.619 8.205 1.00 0.00 H new ATOM 0 HG22 VAL A 127 0.654 6.495 9.220 1.00 0.00 H new ATOM 0 HG23 VAL A 127 0.117 4.864 9.687 1.00 0.00 H new ATOM 1954 N ASN A 128 -0.919 4.578 12.684 1.00 0.00 N ATOM 1955 CA ASN A 128 -0.348 3.362 13.251 1.00 0.00 C ATOM 1956 C ASN A 128 -0.897 2.124 12.548 1.00 0.00 C ATOM 1957 O ASN A 128 -0.340 1.033 12.664 1.00 0.00 O ATOM 1958 CB ASN A 128 -0.645 3.284 14.750 1.00 0.00 C ATOM 1959 CG ASN A 128 -0.316 1.924 15.335 1.00 0.00 C ATOM 1960 OD1 ASN A 128 0.778 1.709 15.857 1.00 0.00 O ATOM 1961 ND2 ASN A 128 -1.264 0.999 15.250 1.00 0.00 N ATOM 0 H ASN A 128 -1.920 4.689 12.846 1.00 0.00 H new ATOM 0 HA ASN A 128 0.731 3.394 13.103 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -0.070 4.049 15.272 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -1.699 3.505 14.921 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -1.100 0.065 15.626 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -2.156 1.222 14.809 1.00 0.00 H new ATOM 1968 N SER A 129 -1.993 2.303 11.817 1.00 0.00 N ATOM 1969 CA SER A 129 -2.620 1.201 11.097 1.00 0.00 C ATOM 1970 C SER A 129 -3.276 1.695 9.811 1.00 0.00 C ATOM 1971 O SER A 129 -4.146 2.566 9.839 1.00 0.00 O ATOM 1972 CB SER A 129 -3.661 0.512 11.982 1.00 0.00 C ATOM 1973 OG SER A 129 -4.610 1.444 12.472 1.00 0.00 O ATOM 0 H SER A 129 -2.465 3.201 11.708 1.00 0.00 H new ATOM 0 HA SER A 129 -1.843 0.482 10.835 1.00 0.00 H new ATOM 0 HB2 SER A 129 -4.170 -0.265 11.412 1.00 0.00 H new ATOM 0 HB3 SER A 129 -3.164 0.020 12.818 1.00 0.00 H new ATOM 0 HG SER A 129 -4.676 2.200 11.852 1.00 0.00 H new ATOM 1979 N VAL A 130 -2.852 1.133 8.684 1.00 0.00 N ATOM 1980 CA VAL A 130 -3.397 1.514 7.387 1.00 0.00 C ATOM 1981 C VAL A 130 -3.952 0.303 6.646 1.00 0.00 C ATOM 1982 O VAL A 130 -3.394 -0.793 6.719 1.00 0.00 O ATOM 1983 CB VAL A 130 -2.331 2.196 6.508 1.00 0.00 C ATOM 1984 CG1 VAL A 130 -1.088 1.325 6.405 1.00 0.00 C ATOM 1985 CG2 VAL A 130 -2.895 2.501 5.128 1.00 0.00 C ATOM 0 H VAL A 130 -2.132 0.412 8.643 1.00 0.00 H new ATOM 0 HA VAL A 130 -4.205 2.220 7.579 1.00 0.00 H new ATOM 0 HB VAL A 130 -2.047 3.139 6.976 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -0.346 1.822 5.781 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -0.674 1.162 7.400 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -1.352 0.365 5.960 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -2.129 2.983 4.520 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -3.208 1.573 4.649 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -3.753 3.166 5.224 1.00 0.00 H new ATOM 1995 N THR A 131 -5.055 0.506 5.932 1.00 0.00 N ATOM 1996 CA THR A 131 -5.686 -0.569 5.178 1.00 0.00 C ATOM 1997 C THR A 131 -6.036 -0.118 3.765 1.00 0.00 C ATOM 1998 O THR A 131 -6.400 1.038 3.544 1.00 0.00 O ATOM 1999 CB THR A 131 -6.965 -1.069 5.876 1.00 0.00 C ATOM 2000 OG1 THR A 131 -6.648 -1.571 7.179 1.00 0.00 O ATOM 2001 CG2 THR A 131 -7.638 -2.160 5.057 1.00 0.00 C ATOM 0 H THR A 131 -5.530 1.406 5.860 1.00 0.00 H new ATOM 0 HA THR A 131 -4.965 -1.385 5.128 1.00 0.00 H new ATOM 0 HB THR A 131 -7.654 -0.229 5.968 1.00 0.00 H new ATOM 0 HG1 THR A 131 -7.467 -1.885 7.617 1.00 0.00 H new ATOM 0 HG21 THR A 131 -8.539 -2.497 5.570 1.00 0.00 H new ATOM 0 HG22 THR A 131 -7.905 -1.766 4.076 1.00 0.00 H new ATOM 0 HG23 THR A 131 -6.953 -3.000 4.937 1.00 0.00 H new ATOM 2009 N ILE A 132 -5.924 -1.036 2.811 1.00 0.00 N ATOM 2010 CA ILE A 132 -6.230 -0.732 1.418 1.00 0.00 C ATOM 2011 C ILE A 132 -7.217 -1.740 0.840 1.00 0.00 C ATOM 2012 O ILE A 132 -6.956 -2.943 0.827 1.00 0.00 O ATOM 2013 CB ILE A 132 -4.957 -0.720 0.551 1.00 0.00 C ATOM 2014 CG1 ILE A 132 -3.998 0.371 1.029 1.00 0.00 C ATOM 2015 CG2 ILE A 132 -5.316 -0.514 -0.913 1.00 0.00 C ATOM 2016 CD1 ILE A 132 -2.560 -0.089 1.128 1.00 0.00 C ATOM 0 H ILE A 132 -5.624 -1.997 2.977 1.00 0.00 H new ATOM 0 HA ILE A 132 -6.678 0.261 1.403 1.00 0.00 H new ATOM 0 HB ILE A 132 -4.458 -1.684 0.650 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -4.054 1.218 0.345 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -4.325 0.728 2.006 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -4.406 -0.508 -1.513 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -5.965 -1.324 -1.246 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -5.834 0.438 -1.030 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -1.937 0.736 1.473 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -2.490 -0.916 1.835 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -2.215 -0.419 0.148 1.00 0.00 H new ATOM 2028 N PHE A 133 -8.352 -1.240 0.360 1.00 0.00 N ATOM 2029 CA PHE A 133 -9.378 -2.097 -0.221 1.00 0.00 C ATOM 2030 C PHE A 133 -9.410 -1.954 -1.740 1.00 0.00 C ATOM 2031 O PHE A 133 -9.572 -0.854 -2.268 1.00 0.00 O ATOM 2032 CB PHE A 133 -10.750 -1.754 0.364 1.00 0.00 C ATOM 2033 CG PHE A 133 -11.892 -2.399 -0.368 1.00 0.00 C ATOM 2034 CD1 PHE A 133 -11.830 -3.732 -0.738 1.00 0.00 C ATOM 2035 CD2 PHE A 133 -13.028 -1.671 -0.686 1.00 0.00 C ATOM 2036 CE1 PHE A 133 -12.880 -4.328 -1.412 1.00 0.00 C ATOM 2037 CE2 PHE A 133 -14.081 -2.261 -1.360 1.00 0.00 C ATOM 2038 CZ PHE A 133 -14.007 -3.592 -1.722 1.00 0.00 C ATOM 0 H PHE A 133 -8.583 -0.247 0.362 1.00 0.00 H new ATOM 0 HA PHE A 133 -9.134 -3.131 0.024 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -10.778 -2.063 1.409 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -10.883 -0.672 0.348 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -10.952 -4.313 -0.497 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -13.091 -0.630 -0.404 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -12.819 -5.368 -1.696 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -14.960 -1.682 -1.603 1.00 0.00 H new ATOM 0 HZ PHE A 133 -14.829 -4.056 -2.247 1.00 0.00 H new ATOM 2048 N VAL A 134 -9.254 -3.075 -2.437 1.00 0.00 N ATOM 2049 CA VAL A 134 -9.265 -3.076 -3.895 1.00 0.00 C ATOM 2050 C VAL A 134 -10.691 -3.047 -4.434 1.00 0.00 C ATOM 2051 O VAL A 134 -11.515 -3.891 -4.081 1.00 0.00 O ATOM 2052 CB VAL A 134 -8.540 -4.312 -4.461 1.00 0.00 C ATOM 2053 CG1 VAL A 134 -8.595 -4.314 -5.981 1.00 0.00 C ATOM 2054 CG2 VAL A 134 -7.100 -4.353 -3.972 1.00 0.00 C ATOM 0 H VAL A 134 -9.119 -3.994 -2.016 1.00 0.00 H new ATOM 0 HA VAL A 134 -8.740 -2.177 -4.216 1.00 0.00 H new ATOM 0 HB VAL A 134 -9.048 -5.207 -4.102 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -8.078 -5.194 -6.363 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -9.635 -4.334 -6.307 1.00 0.00 H new ATOM 0 HG13 VAL A 134 -8.112 -3.415 -6.364 1.00 0.00 H new ATOM 0 HG21 VAL A 134 -6.602 -5.232 -4.381 1.00 0.00 H new ATOM 0 HG22 VAL A 134 -6.578 -3.454 -4.301 1.00 0.00 H new ATOM 0 HG23 VAL A 134 -7.087 -4.402 -2.883 1.00 0.00 H new ATOM 2064 N GLN A 135 -10.975 -2.072 -5.290 1.00 0.00 N ATOM 2065 CA GLN A 135 -12.302 -1.933 -5.878 1.00 0.00 C ATOM 2066 C GLN A 135 -12.278 -2.277 -7.363 1.00 0.00 C ATOM 2067 O GLN A 135 -12.901 -3.246 -7.796 1.00 0.00 O ATOM 2068 CB GLN A 135 -12.824 -0.509 -5.680 1.00 0.00 C ATOM 2069 CG GLN A 135 -14.325 -0.438 -5.448 1.00 0.00 C ATOM 2070 CD GLN A 135 -14.746 0.835 -4.740 1.00 0.00 C ATOM 2071 OE1 GLN A 135 -14.631 1.931 -5.289 1.00 0.00 O ATOM 2072 NE2 GLN A 135 -15.238 0.696 -3.515 1.00 0.00 N ATOM 0 H GLN A 135 -10.304 -1.366 -5.592 1.00 0.00 H new ATOM 0 HA GLN A 135 -12.970 -2.631 -5.373 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -12.312 -0.058 -4.830 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -12.572 0.087 -6.557 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -14.841 -0.504 -6.406 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -14.639 -1.299 -4.857 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -15.315 -0.232 -3.099 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -15.539 1.517 -2.990 1.00 0.00 H new ATOM 2081 N SER A 136 -11.556 -1.476 -8.140 1.00 0.00 N ATOM 2082 CA SER A 136 -11.454 -1.693 -9.578 1.00 0.00 C ATOM 2083 C SER A 136 -9.994 -1.738 -10.019 1.00 0.00 C ATOM 2084 O SER A 136 -9.093 -1.388 -9.258 1.00 0.00 O ATOM 2085 CB SER A 136 -12.193 -0.588 -10.336 1.00 0.00 C ATOM 2086 OG SER A 136 -12.884 -1.112 -11.456 1.00 0.00 O ATOM 0 H SER A 136 -11.033 -0.670 -7.797 1.00 0.00 H new ATOM 0 HA SER A 136 -11.915 -2.653 -9.809 1.00 0.00 H new ATOM 0 HB2 SER A 136 -12.899 -0.094 -9.668 1.00 0.00 H new ATOM 0 HB3 SER A 136 -11.482 0.170 -10.665 1.00 0.00 H new ATOM 0 HG SER A 136 -13.349 -0.386 -11.922 1.00 0.00 H new ATOM 2092 N ASN A 137 -9.769 -2.174 -11.254 1.00 0.00 N ATOM 2093 CA ASN A 137 -8.419 -2.267 -11.798 1.00 0.00 C ATOM 2094 C ASN A 137 -8.209 -1.244 -12.910 1.00 0.00 C ATOM 2095 O ASN A 137 -9.065 -0.394 -13.154 1.00 0.00 O ATOM 2096 CB ASN A 137 -8.157 -3.677 -12.331 1.00 0.00 C ATOM 2097 CG ASN A 137 -9.360 -4.587 -12.174 1.00 0.00 C ATOM 2098 OD1 ASN A 137 -10.427 -4.324 -12.730 1.00 0.00 O ATOM 2099 ND2 ASN A 137 -9.193 -5.663 -11.415 1.00 0.00 N ATOM 0 H ASN A 137 -10.504 -2.468 -11.897 1.00 0.00 H new ATOM 0 HA ASN A 137 -7.715 -2.053 -10.994 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -7.884 -3.619 -13.385 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -7.306 -4.109 -11.804 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -9.967 -6.312 -11.273 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -8.291 -5.841 -10.974 1.00 0.00 H new ATOM 2106 N GLN A 138 -7.064 -1.333 -13.580 1.00 0.00 N ATOM 2107 CA GLN A 138 -6.742 -0.415 -14.666 1.00 0.00 C ATOM 2108 C GLN A 138 -7.720 -0.578 -15.825 1.00 0.00 C ATOM 2109 O GLN A 138 -8.447 0.352 -16.172 1.00 0.00 O ATOM 2110 CB GLN A 138 -5.311 -0.651 -15.154 1.00 0.00 C ATOM 2111 CG GLN A 138 -4.259 -0.434 -14.079 1.00 0.00 C ATOM 2112 CD GLN A 138 -4.174 1.010 -13.627 1.00 0.00 C ATOM 2113 OE1 GLN A 138 -3.848 1.901 -14.413 1.00 0.00 O ATOM 2114 NE2 GLN A 138 -4.470 1.251 -12.355 1.00 0.00 N ATOM 0 H GLN A 138 -6.345 -2.031 -13.390 1.00 0.00 H new ATOM 0 HA GLN A 138 -6.826 0.603 -14.284 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -5.228 -1.670 -15.532 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -5.107 0.017 -15.991 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -4.487 -1.066 -13.221 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -3.287 -0.749 -14.459 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -4.735 0.483 -11.739 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -4.432 2.204 -11.994 1.00 0.00 H new ATOM 2123 N GLY A 139 -7.732 -1.766 -16.421 1.00 0.00 N ATOM 2124 CA GLY A 139 -8.624 -2.029 -17.535 1.00 0.00 C ATOM 2125 C GLY A 139 -9.877 -2.771 -17.112 1.00 0.00 C ATOM 2126 O GLY A 139 -10.509 -3.446 -17.923 1.00 0.00 O ATOM 0 H GLY A 139 -7.140 -2.552 -16.152 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -8.905 -1.085 -18.002 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -8.096 -2.613 -18.289 1.00 0.00 H new ATOM 2130 N GLU A 140 -10.234 -2.647 -15.837 1.00 0.00 N ATOM 2131 CA GLU A 140 -11.418 -3.315 -15.308 1.00 0.00 C ATOM 2132 C GLU A 140 -11.268 -4.831 -15.387 1.00 0.00 C ATOM 2133 O GLU A 140 -12.249 -5.553 -15.566 1.00 0.00 O ATOM 2134 CB GLU A 140 -12.665 -2.874 -16.077 1.00 0.00 C ATOM 2135 CG GLU A 140 -12.748 -1.372 -16.293 1.00 0.00 C ATOM 2136 CD GLU A 140 -14.164 -0.897 -16.555 1.00 0.00 C ATOM 2137 OE1 GLU A 140 -14.966 -1.691 -17.089 1.00 0.00 O ATOM 2138 OE2 GLU A 140 -14.470 0.268 -16.225 1.00 0.00 O ATOM 0 H GLU A 140 -9.721 -2.091 -15.152 1.00 0.00 H new ATOM 0 HA GLU A 140 -11.526 -3.032 -14.261 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -12.679 -3.373 -17.046 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -13.551 -3.204 -15.535 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -12.354 -0.860 -15.415 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -12.114 -1.094 -17.135 1.00 0.00 H new ATOM 2145 N GLU A 141 -10.034 -5.306 -15.253 1.00 0.00 N ATOM 2146 CA GLU A 141 -9.756 -6.736 -15.311 1.00 0.00 C ATOM 2147 C GLU A 141 -10.659 -7.505 -14.351 1.00 0.00 C ATOM 2148 O GLU A 141 -11.157 -6.950 -13.372 1.00 0.00 O ATOM 2149 CB GLU A 141 -8.288 -7.007 -14.974 1.00 0.00 C ATOM 2150 CG GLU A 141 -7.315 -6.145 -15.761 1.00 0.00 C ATOM 2151 CD GLU A 141 -6.631 -5.103 -14.898 1.00 0.00 C ATOM 2152 OE1 GLU A 141 -6.307 -5.415 -13.733 1.00 0.00 O ATOM 2153 OE2 GLU A 141 -6.419 -3.974 -15.389 1.00 0.00 O ATOM 0 H GLU A 141 -9.211 -4.722 -15.104 1.00 0.00 H new ATOM 0 HA GLU A 141 -9.958 -7.078 -16.326 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -8.131 -6.838 -13.909 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -8.068 -8.057 -15.166 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -6.560 -6.783 -16.221 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -7.849 -5.648 -16.571 1.00 0.00 H new ATOM 2160 N GLU A 142 -10.866 -8.786 -14.640 1.00 0.00 N ATOM 2161 CA GLU A 142 -11.711 -9.630 -13.803 1.00 0.00 C ATOM 2162 C GLU A 142 -11.113 -9.785 -12.407 1.00 0.00 C ATOM 2163 O GLU A 142 -11.826 -10.055 -11.440 1.00 0.00 O ATOM 2164 CB GLU A 142 -11.892 -11.007 -14.447 1.00 0.00 C ATOM 2165 CG GLU A 142 -10.587 -11.651 -14.883 1.00 0.00 C ATOM 2166 CD GLU A 142 -10.654 -13.166 -14.878 1.00 0.00 C ATOM 2167 OE1 GLU A 142 -11.063 -13.739 -13.847 1.00 0.00 O ATOM 2168 OE2 GLU A 142 -10.298 -13.778 -15.907 1.00 0.00 O ATOM 0 H GLU A 142 -10.461 -9.262 -15.446 1.00 0.00 H new ATOM 0 HA GLU A 142 -12.684 -9.148 -13.712 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -12.394 -11.667 -13.739 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -12.547 -10.911 -15.313 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -10.333 -11.306 -15.885 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -9.786 -11.324 -14.220 1.00 0.00 H new ATOM 2175 N THR A 143 -9.799 -9.611 -12.310 1.00 0.00 N ATOM 2176 CA THR A 143 -9.104 -9.732 -11.035 1.00 0.00 C ATOM 2177 C THR A 143 -7.847 -8.871 -11.010 1.00 0.00 C ATOM 2178 O THR A 143 -7.266 -8.569 -12.053 1.00 0.00 O ATOM 2179 CB THR A 143 -8.716 -11.194 -10.743 1.00 0.00 C ATOM 2180 OG1 THR A 143 -7.684 -11.239 -9.752 1.00 0.00 O ATOM 2181 CG2 THR A 143 -8.242 -11.891 -12.009 1.00 0.00 C ATOM 0 H THR A 143 -9.194 -9.386 -13.100 1.00 0.00 H new ATOM 0 HA THR A 143 -9.794 -9.386 -10.265 1.00 0.00 H new ATOM 0 HB THR A 143 -9.599 -11.713 -10.370 1.00 0.00 H new ATOM 0 HG1 THR A 143 -7.445 -12.172 -9.571 1.00 0.00 H new ATOM 0 HG21 THR A 143 -7.974 -12.922 -11.778 1.00 0.00 H new ATOM 0 HG22 THR A 143 -9.041 -11.881 -12.750 1.00 0.00 H new ATOM 0 HG23 THR A 143 -7.371 -11.370 -12.407 1.00 0.00 H new ATOM 2189 N THR A 144 -7.429 -8.476 -9.811 1.00 0.00 N ATOM 2190 CA THR A 144 -6.240 -7.649 -9.650 1.00 0.00 C ATOM 2191 C THR A 144 -5.086 -8.452 -9.060 1.00 0.00 C ATOM 2192 O THR A 144 -5.217 -9.050 -7.992 1.00 0.00 O ATOM 2193 CB THR A 144 -6.520 -6.433 -8.745 1.00 0.00 C ATOM 2194 OG1 THR A 144 -7.803 -5.878 -9.054 1.00 0.00 O ATOM 2195 CG2 THR A 144 -5.446 -5.370 -8.920 1.00 0.00 C ATOM 0 H THR A 144 -7.897 -8.716 -8.937 1.00 0.00 H new ATOM 0 HA THR A 144 -5.963 -7.298 -10.644 1.00 0.00 H new ATOM 0 HB THR A 144 -6.510 -6.769 -7.708 1.00 0.00 H new ATOM 0 HG1 THR A 144 -7.908 -5.020 -8.592 1.00 0.00 H new ATOM 0 HG21 THR A 144 -5.665 -4.522 -8.272 1.00 0.00 H new ATOM 0 HG22 THR A 144 -4.474 -5.788 -8.656 1.00 0.00 H new ATOM 0 HG23 THR A 144 -5.428 -5.038 -9.958 1.00 0.00 H new ATOM 2203 N ARG A 145 -3.958 -8.460 -9.762 1.00 0.00 N ATOM 2204 CA ARG A 145 -2.781 -9.191 -9.307 1.00 0.00 C ATOM 2205 C ARG A 145 -1.790 -8.253 -8.624 1.00 0.00 C ATOM 2206 O ARG A 145 -1.281 -7.316 -9.240 1.00 0.00 O ATOM 2207 CB ARG A 145 -2.105 -9.895 -10.485 1.00 0.00 C ATOM 2208 CG ARG A 145 -2.799 -11.180 -10.906 1.00 0.00 C ATOM 2209 CD ARG A 145 -2.205 -11.739 -12.189 1.00 0.00 C ATOM 2210 NE ARG A 145 -3.152 -12.587 -12.907 1.00 0.00 N ATOM 2211 CZ ARG A 145 -2.821 -13.340 -13.950 1.00 0.00 C ATOM 2212 NH1 ARG A 145 -1.572 -13.350 -14.395 1.00 0.00 N ATOM 2213 NH2 ARG A 145 -3.740 -14.085 -14.551 1.00 0.00 N ATOM 0 H ARG A 145 -3.834 -7.969 -10.647 1.00 0.00 H new ATOM 0 HA ARG A 145 -3.105 -9.939 -8.583 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -2.074 -9.214 -11.335 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -1.072 -10.120 -10.219 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -2.711 -11.920 -10.110 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -3.863 -10.990 -11.049 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -1.895 -10.916 -12.833 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -1.310 -12.314 -11.953 1.00 0.00 H new ATOM 0 HE ARG A 145 -4.121 -12.602 -12.590 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -0.863 -12.779 -13.936 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -1.321 -13.929 -15.196 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -4.702 -14.080 -14.212 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -3.484 -14.663 -15.352 1.00 0.00 H new ATOM 2227 N ILE A 146 -1.520 -8.513 -7.349 1.00 0.00 N ATOM 2228 CA ILE A 146 -0.590 -7.693 -6.583 1.00 0.00 C ATOM 2229 C ILE A 146 0.810 -8.298 -6.590 1.00 0.00 C ATOM 2230 O ILE A 146 0.997 -9.459 -6.228 1.00 0.00 O ATOM 2231 CB ILE A 146 -1.057 -7.524 -5.125 1.00 0.00 C ATOM 2232 CG1 ILE A 146 -2.584 -7.460 -5.060 1.00 0.00 C ATOM 2233 CG2 ILE A 146 -0.443 -6.273 -4.514 1.00 0.00 C ATOM 2234 CD1 ILE A 146 -3.180 -6.363 -5.913 1.00 0.00 C ATOM 0 H ILE A 146 -1.932 -9.285 -6.825 1.00 0.00 H new ATOM 0 HA ILE A 146 -0.563 -6.715 -7.063 1.00 0.00 H new ATOM 0 HB ILE A 146 -0.723 -8.388 -4.550 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -2.993 -8.419 -5.378 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -2.889 -7.310 -4.024 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -0.782 -6.167 -3.484 1.00 0.00 H new ATOM 0 HG22 ILE A 146 0.644 -6.355 -4.531 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -0.750 -5.399 -5.089 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -4.266 -6.377 -5.818 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -2.799 -5.397 -5.581 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -2.905 -6.523 -6.956 1.00 0.00 H new ATOM 2246 N SER A 147 1.791 -7.501 -7.002 1.00 0.00 N ATOM 2247 CA SER A 147 3.174 -7.959 -7.058 1.00 0.00 C ATOM 2248 C SER A 147 4.042 -7.187 -6.069 1.00 0.00 C ATOM 2249 O SER A 147 4.830 -7.774 -5.327 1.00 0.00 O ATOM 2250 CB SER A 147 3.730 -7.798 -8.475 1.00 0.00 C ATOM 2251 OG SER A 147 4.003 -6.438 -8.764 1.00 0.00 O ATOM 0 H SER A 147 1.654 -6.536 -7.302 1.00 0.00 H new ATOM 0 HA SER A 147 3.193 -9.014 -6.785 1.00 0.00 H new ATOM 0 HB2 SER A 147 4.642 -8.386 -8.580 1.00 0.00 H new ATOM 0 HB3 SER A 147 3.013 -8.190 -9.197 1.00 0.00 H new ATOM 0 HG SER A 147 4.503 -6.376 -9.605 1.00 0.00 H new ATOM 2257 N TYR A 148 3.891 -5.867 -6.064 1.00 0.00 N ATOM 2258 CA TYR A 148 4.662 -5.013 -5.168 1.00 0.00 C ATOM 2259 C TYR A 148 3.747 -4.065 -4.399 1.00 0.00 C ATOM 2260 O TYR A 148 2.916 -3.372 -4.986 1.00 0.00 O ATOM 2261 CB TYR A 148 5.697 -4.211 -5.959 1.00 0.00 C ATOM 2262 CG TYR A 148 6.763 -3.578 -5.094 1.00 0.00 C ATOM 2263 CD1 TYR A 148 7.499 -4.341 -4.196 1.00 0.00 C ATOM 2264 CD2 TYR A 148 7.033 -2.217 -5.173 1.00 0.00 C ATOM 2265 CE1 TYR A 148 8.474 -3.767 -3.403 1.00 0.00 C ATOM 2266 CE2 TYR A 148 8.006 -1.635 -4.385 1.00 0.00 C ATOM 2267 CZ TYR A 148 8.724 -2.414 -3.501 1.00 0.00 C ATOM 2268 OH TYR A 148 9.694 -1.838 -2.713 1.00 0.00 O ATOM 0 H TYR A 148 3.242 -5.365 -6.670 1.00 0.00 H new ATOM 0 HA TYR A 148 5.178 -5.652 -4.452 1.00 0.00 H new ATOM 0 HB2 TYR A 148 6.174 -4.867 -6.687 1.00 0.00 H new ATOM 0 HB3 TYR A 148 5.186 -3.430 -6.521 1.00 0.00 H new ATOM 0 HD1 TYR A 148 7.306 -5.401 -4.116 1.00 0.00 H new ATOM 0 HD2 TYR A 148 6.472 -1.604 -5.863 1.00 0.00 H new ATOM 0 HE1 TYR A 148 9.037 -4.374 -2.710 1.00 0.00 H new ATOM 0 HE2 TYR A 148 8.204 -0.576 -4.460 1.00 0.00 H new ATOM 0 HH TYR A 148 9.745 -0.878 -2.906 1.00 0.00 H new ATOM 2278 N PHE A 149 3.908 -4.039 -3.080 1.00 0.00 N ATOM 2279 CA PHE A 149 3.097 -3.177 -2.227 1.00 0.00 C ATOM 2280 C PHE A 149 3.910 -2.666 -1.041 1.00 0.00 C ATOM 2281 O PHE A 149 4.572 -3.438 -0.348 1.00 0.00 O ATOM 2282 CB PHE A 149 1.864 -3.932 -1.728 1.00 0.00 C ATOM 2283 CG PHE A 149 1.231 -3.311 -0.515 1.00 0.00 C ATOM 2284 CD1 PHE A 149 0.898 -1.966 -0.504 1.00 0.00 C ATOM 2285 CD2 PHE A 149 0.970 -4.072 0.613 1.00 0.00 C ATOM 2286 CE1 PHE A 149 0.315 -1.391 0.610 1.00 0.00 C ATOM 2287 CE2 PHE A 149 0.387 -3.502 1.729 1.00 0.00 C ATOM 2288 CZ PHE A 149 0.061 -2.160 1.728 1.00 0.00 C ATOM 0 H PHE A 149 4.593 -4.605 -2.578 1.00 0.00 H new ATOM 0 HA PHE A 149 2.774 -2.321 -2.819 1.00 0.00 H new ATOM 0 HB2 PHE A 149 1.127 -3.978 -2.530 1.00 0.00 H new ATOM 0 HB3 PHE A 149 2.146 -4.959 -1.495 1.00 0.00 H new ATOM 0 HD1 PHE A 149 1.096 -1.360 -1.376 1.00 0.00 H new ATOM 0 HD2 PHE A 149 1.225 -5.121 0.620 1.00 0.00 H new ATOM 0 HE1 PHE A 149 0.059 -0.342 0.606 1.00 0.00 H new ATOM 0 HE2 PHE A 149 0.186 -4.106 2.602 1.00 0.00 H new ATOM 0 HZ PHE A 149 -0.392 -1.713 2.601 1.00 0.00 H new ATOM 2298 N THR A 150 3.854 -1.357 -0.814 1.00 0.00 N ATOM 2299 CA THR A 150 4.585 -0.741 0.286 1.00 0.00 C ATOM 2300 C THR A 150 4.049 0.653 0.591 1.00 0.00 C ATOM 2301 O THR A 150 3.021 1.064 0.053 1.00 0.00 O ATOM 2302 CB THR A 150 6.091 -0.643 -0.025 1.00 0.00 C ATOM 2303 OG1 THR A 150 6.828 -0.427 1.184 1.00 0.00 O ATOM 2304 CG2 THR A 150 6.369 0.488 -1.003 1.00 0.00 C ATOM 0 H THR A 150 3.310 -0.704 -1.377 1.00 0.00 H new ATOM 0 HA THR A 150 4.442 -1.380 1.157 1.00 0.00 H new ATOM 0 HB THR A 150 6.407 -1.582 -0.480 1.00 0.00 H new ATOM 0 HG1 THR A 150 7.476 -1.152 1.306 1.00 0.00 H new ATOM 0 HG21 THR A 150 7.439 0.538 -1.207 1.00 0.00 H new ATOM 0 HG22 THR A 150 5.830 0.306 -1.933 1.00 0.00 H new ATOM 0 HG23 THR A 150 6.038 1.432 -0.571 1.00 0.00 H new ATOM 2312 N PHE A 151 4.752 1.377 1.456 1.00 0.00 N ATOM 2313 CA PHE A 151 4.346 2.726 1.831 1.00 0.00 C ATOM 2314 C PHE A 151 5.551 3.660 1.890 1.00 0.00 C ATOM 2315 O PHE A 151 6.443 3.489 2.722 1.00 0.00 O ATOM 2316 CB PHE A 151 3.634 2.708 3.186 1.00 0.00 C ATOM 2317 CG PHE A 151 2.143 2.851 3.081 1.00 0.00 C ATOM 2318 CD1 PHE A 151 1.581 3.976 2.500 1.00 0.00 C ATOM 2319 CD2 PHE A 151 1.303 1.860 3.562 1.00 0.00 C ATOM 2320 CE1 PHE A 151 0.208 4.110 2.403 1.00 0.00 C ATOM 2321 CE2 PHE A 151 -0.070 1.988 3.467 1.00 0.00 C ATOM 2322 CZ PHE A 151 -0.618 3.114 2.886 1.00 0.00 C ATOM 0 H PHE A 151 5.605 1.052 1.910 1.00 0.00 H new ATOM 0 HA PHE A 151 3.658 3.097 1.071 1.00 0.00 H new ATOM 0 HB2 PHE A 151 3.866 1.774 3.697 1.00 0.00 H new ATOM 0 HB3 PHE A 151 4.026 3.516 3.804 1.00 0.00 H new ATOM 0 HD1 PHE A 151 2.222 4.757 2.119 1.00 0.00 H new ATOM 0 HD2 PHE A 151 1.726 0.977 4.017 1.00 0.00 H new ATOM 0 HE1 PHE A 151 -0.218 4.993 1.950 1.00 0.00 H new ATOM 0 HE2 PHE A 151 -0.713 1.208 3.847 1.00 0.00 H new ATOM 0 HZ PHE A 151 -1.690 3.216 2.809 1.00 0.00 H new ATOM 2332 N ILE A 152 5.571 4.647 1.000 1.00 0.00 N ATOM 2333 CA ILE A 152 6.665 5.608 0.950 1.00 0.00 C ATOM 2334 C ILE A 152 6.434 6.755 1.928 1.00 0.00 C ATOM 2335 O ILE A 152 5.358 7.350 1.960 1.00 0.00 O ATOM 2336 CB ILE A 152 6.844 6.185 -0.467 1.00 0.00 C ATOM 2337 CG1 ILE A 152 6.823 5.060 -1.505 1.00 0.00 C ATOM 2338 CG2 ILE A 152 8.142 6.973 -0.558 1.00 0.00 C ATOM 2339 CD1 ILE A 152 7.878 4.002 -1.271 1.00 0.00 C ATOM 0 H ILE A 152 4.842 4.802 0.304 1.00 0.00 H new ATOM 0 HA ILE A 152 7.570 5.070 1.231 1.00 0.00 H new ATOM 0 HB ILE A 152 6.016 6.862 -0.675 1.00 0.00 H new ATOM 0 HG12 ILE A 152 5.840 4.589 -1.498 1.00 0.00 H new ATOM 0 HG13 ILE A 152 6.964 5.489 -2.497 1.00 0.00 H new ATOM 0 HG21 ILE A 152 8.254 7.374 -1.565 1.00 0.00 H new ATOM 0 HG22 ILE A 152 8.121 7.793 0.159 1.00 0.00 H new ATOM 0 HG23 ILE A 152 8.983 6.317 -0.333 1.00 0.00 H new ATOM 0 HD11 ILE A 152 7.804 3.237 -2.044 1.00 0.00 H new ATOM 0 HD12 ILE A 152 8.867 4.460 -1.307 1.00 0.00 H new ATOM 0 HD13 ILE A 152 7.725 3.546 -0.293 1.00 0.00 H new ATOM 2351 N GLY A 153 7.454 7.062 2.724 1.00 0.00 N ATOM 2352 CA GLY A 153 7.343 8.139 3.691 1.00 0.00 C ATOM 2353 C GLY A 153 8.469 8.125 4.706 1.00 0.00 C ATOM 2354 O GLY A 153 9.612 7.811 4.373 1.00 0.00 O ATOM 0 H GLY A 153 8.355 6.584 2.716 1.00 0.00 H new ATOM 0 HA2 GLY A 153 7.342 9.095 3.167 1.00 0.00 H new ATOM 0 HA3 GLY A 153 6.388 8.059 4.211 1.00 0.00 H new ATOM 2358 N THR A 154 8.147 8.468 5.949 1.00 0.00 N ATOM 2359 CA THR A 154 9.140 8.496 7.016 1.00 0.00 C ATOM 2360 C THR A 154 8.474 8.536 8.386 1.00 0.00 C ATOM 2361 O THR A 154 7.322 8.946 8.532 1.00 0.00 O ATOM 2362 CB THR A 154 10.077 9.711 6.878 1.00 0.00 C ATOM 2363 OG1 THR A 154 10.329 10.284 8.166 1.00 0.00 O ATOM 2364 CG2 THR A 154 9.471 10.761 5.959 1.00 0.00 C ATOM 0 H THR A 154 7.206 8.730 6.242 1.00 0.00 H new ATOM 0 HA THR A 154 9.726 7.581 6.927 1.00 0.00 H new ATOM 0 HB THR A 154 11.016 9.370 6.443 1.00 0.00 H new ATOM 0 HG1 THR A 154 10.926 11.055 8.070 1.00 0.00 H new ATOM 0 HG21 THR A 154 10.151 11.609 5.877 1.00 0.00 H new ATOM 0 HG22 THR A 154 9.308 10.330 4.971 1.00 0.00 H new ATOM 0 HG23 THR A 154 8.519 11.098 6.369 1.00 0.00 H new ATOM 2372 N PRO A 155 9.213 8.100 9.417 1.00 0.00 N ATOM 2373 CA PRO A 155 8.714 8.078 10.795 1.00 0.00 C ATOM 2374 C PRO A 155 8.551 9.478 11.376 1.00 0.00 C ATOM 2375 O PRO A 155 9.405 10.344 11.182 1.00 0.00 O ATOM 2376 CB PRO A 155 9.798 7.307 11.552 1.00 0.00 C ATOM 2377 CG PRO A 155 11.037 7.511 10.751 1.00 0.00 C ATOM 2378 CD PRO A 155 10.593 7.597 9.317 1.00 0.00 C ATOM 0 HA PRO A 155 7.724 7.627 10.863 1.00 0.00 H new ATOM 0 HB2 PRO A 155 9.916 7.685 12.568 1.00 0.00 H new ATOM 0 HB3 PRO A 155 9.548 6.249 11.633 1.00 0.00 H new ATOM 0 HG2 PRO A 155 11.553 8.422 11.055 1.00 0.00 H new ATOM 0 HG3 PRO A 155 11.735 6.686 10.895 1.00 0.00 H new ATOM 0 HD2 PRO A 155 11.226 8.272 8.740 1.00 0.00 H new ATOM 0 HD3 PRO A 155 10.632 6.625 8.825 1.00 0.00 H new ATOM 2386 N VAL A 156 7.451 9.694 12.090 1.00 0.00 N ATOM 2387 CA VAL A 156 7.178 10.989 12.701 1.00 0.00 C ATOM 2388 C VAL A 156 8.373 11.478 13.511 1.00 0.00 C ATOM 2389 O VAL A 156 8.633 12.679 13.588 1.00 0.00 O ATOM 2390 CB VAL A 156 5.941 10.928 13.617 1.00 0.00 C ATOM 2391 CG1 VAL A 156 4.694 10.599 12.810 1.00 0.00 C ATOM 2392 CG2 VAL A 156 6.151 9.910 14.727 1.00 0.00 C ATOM 0 H VAL A 156 6.734 8.988 12.260 1.00 0.00 H new ATOM 0 HA VAL A 156 6.984 11.688 11.887 1.00 0.00 H new ATOM 0 HB VAL A 156 5.800 11.907 14.074 1.00 0.00 H new ATOM 0 HG11 VAL A 156 3.831 10.560 13.474 1.00 0.00 H new ATOM 0 HG12 VAL A 156 4.536 11.368 12.054 1.00 0.00 H new ATOM 0 HG13 VAL A 156 4.821 9.632 12.323 1.00 0.00 H new ATOM 0 HG21 VAL A 156 5.268 9.880 15.365 1.00 0.00 H new ATOM 0 HG22 VAL A 156 6.317 8.925 14.291 1.00 0.00 H new ATOM 0 HG23 VAL A 156 7.019 10.194 15.322 1.00 0.00 H new ATOM 2402 N GLN A 157 9.097 10.540 14.112 1.00 0.00 N ATOM 2403 CA GLN A 157 10.266 10.876 14.916 1.00 0.00 C ATOM 2404 C GLN A 157 11.201 9.678 15.045 1.00 0.00 C ATOM 2405 O GLN A 157 10.890 8.707 15.735 1.00 0.00 O ATOM 2406 CB GLN A 157 9.835 11.353 16.304 1.00 0.00 C ATOM 2407 CG GLN A 157 8.916 10.380 17.024 1.00 0.00 C ATOM 2408 CD GLN A 157 8.154 11.030 18.163 1.00 0.00 C ATOM 2409 OE1 GLN A 157 8.455 12.155 18.563 1.00 0.00 O ATOM 2410 NE2 GLN A 157 7.162 10.324 18.691 1.00 0.00 N ATOM 0 H GLN A 157 8.895 9.542 14.058 1.00 0.00 H new ATOM 0 HA GLN A 157 10.803 11.680 14.413 1.00 0.00 H new ATOM 0 HB2 GLN A 157 10.723 11.520 16.914 1.00 0.00 H new ATOM 0 HB3 GLN A 157 9.329 12.314 16.208 1.00 0.00 H new ATOM 0 HG2 GLN A 157 8.207 9.960 16.310 1.00 0.00 H new ATOM 0 HG3 GLN A 157 9.505 9.550 17.413 1.00 0.00 H new ATOM 0 HE21 GLN A 157 6.947 9.395 18.328 1.00 0.00 H new ATOM 0 HE22 GLN A 157 6.614 10.710 19.460 1.00 0.00 H new