USER MOD reduce.3.24.130724 H: found=0, std=0, add=1091, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1089 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 100 TYR OH : rot 180:sc= -0.322 USER MOD Set 1.2: A 104 MET CE :methyl -174:sc= -1.87! (180deg=-1.82) USER MOD Single : A 1 GLY N :NH3+ -133:sc= 0.0085 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 HIS : no HD1:sc= -4.37! C(o=-4.4!,f=-4.4!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= -0.0143 K(o=-0.014,f=-1.5!) USER MOD Single : A 31 HIS : no HE2:sc= -4.64 X(o=-4.6,f=-4.2!) USER MOD Single : A 36 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0111) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 90:sc= -2.39 USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=-0.0056) USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=-0.025) USER MOD Single : A 56 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 58 ASN : amide:sc= 0.0213 K(o=0.021,f=-1.1) USER MOD Single : A 60 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.218) USER MOD Single : A 62 CYS SG : rot -78:sc= 0.962 USER MOD Single : A 69 ASN : amide:sc= -1.6 K(o=-1.6,f=-7.1!) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 GLN : amide:sc= -0.068 X(o=-0.068,f=-0.068) USER MOD Single : A 74 LYS NZ :NH3+ 158:sc= 0 (180deg=-0.462) USER MOD Single : A 76 CYS SG : rot 180:sc= -2.28 USER MOD Single : A 78 LYS NZ :NH3+ 150:sc= -0.215 (180deg=-1.38) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 87 MET CE :methyl 180:sc= -0.142 (180deg=-0.142) USER MOD Single : A 88 SER OG : rot 160:sc= 0 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 CYS SG : rot 20:sc= -2.36! USER MOD Single : A 95 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 107 CYS SG : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 MET CE :methyl -109:sc= -0.222 (180deg=-1.79) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 98:sc= 0.228 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 126 GLN : amide:sc= -0.141 K(o=-0.14,f=-2.1!) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 4.410 -18.507 2.705 1.00 0.00 N ATOM 2 CA GLY A 1 4.590 -18.831 4.108 1.00 0.00 C ATOM 3 C GLY A 1 5.001 -17.627 4.933 1.00 0.00 C ATOM 4 O GLY A 1 4.524 -16.516 4.702 1.00 0.00 O ATOM 0 H1 GLY A 1 3.515 -18.915 2.367 1.00 0.00 H new ATOM 0 H2 GLY A 1 4.386 -17.474 2.588 1.00 0.00 H new ATOM 0 H3 GLY A 1 5.200 -18.900 2.154 1.00 0.00 H new ATOM 0 HA2 GLY A 1 3.661 -19.240 4.505 1.00 0.00 H new ATOM 0 HA3 GLY A 1 5.347 -19.609 4.204 1.00 0.00 H new ATOM 8 N SER A 2 5.888 -17.848 5.898 1.00 0.00 N ATOM 9 CA SER A 2 6.359 -16.773 6.763 1.00 0.00 C ATOM 10 C SER A 2 7.495 -15.999 6.100 1.00 0.00 C ATOM 11 O SER A 2 8.366 -16.584 5.456 1.00 0.00 O ATOM 12 CB SER A 2 6.828 -17.339 8.105 1.00 0.00 C ATOM 13 OG SER A 2 5.775 -18.015 8.770 1.00 0.00 O ATOM 0 H SER A 2 6.295 -18.761 6.100 1.00 0.00 H new ATOM 0 HA SER A 2 5.529 -16.088 6.935 1.00 0.00 H new ATOM 0 HB2 SER A 2 7.660 -18.025 7.943 1.00 0.00 H new ATOM 0 HB3 SER A 2 7.200 -16.530 8.734 1.00 0.00 H new ATOM 0 HG SER A 2 6.101 -18.369 9.624 1.00 0.00 H new ATOM 19 N SER A 3 7.477 -14.680 6.261 1.00 0.00 N ATOM 20 CA SER A 3 8.502 -13.824 5.675 1.00 0.00 C ATOM 21 C SER A 3 9.314 -13.127 6.763 1.00 0.00 C ATOM 22 O SER A 3 8.926 -13.111 7.930 1.00 0.00 O ATOM 23 CB SER A 3 7.863 -12.784 4.754 1.00 0.00 C ATOM 24 OG SER A 3 6.892 -12.018 5.446 1.00 0.00 O ATOM 0 H SER A 3 6.764 -14.181 6.792 1.00 0.00 H new ATOM 0 HA SER A 3 9.174 -14.452 5.090 1.00 0.00 H new ATOM 0 HB2 SER A 3 8.634 -12.125 4.355 1.00 0.00 H new ATOM 0 HB3 SER A 3 7.399 -13.283 3.904 1.00 0.00 H new ATOM 0 HG SER A 3 6.499 -11.359 4.836 1.00 0.00 H new ATOM 30 N GLY A 4 10.446 -12.550 6.369 1.00 0.00 N ATOM 31 CA GLY A 4 11.296 -11.858 7.321 1.00 0.00 C ATOM 32 C GLY A 4 12.348 -11.003 6.643 1.00 0.00 C ATOM 33 O GLY A 4 12.589 -11.138 5.444 1.00 0.00 O ATOM 0 H GLY A 4 10.789 -12.550 5.408 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.680 -11.229 7.964 1.00 0.00 H new ATOM 0 HA3 GLY A 4 11.786 -12.589 7.965 1.00 0.00 H new ATOM 37 N SER A 5 12.976 -10.120 7.413 1.00 0.00 N ATOM 38 CA SER A 5 14.005 -9.235 6.879 1.00 0.00 C ATOM 39 C SER A 5 14.738 -8.513 8.005 1.00 0.00 C ATOM 40 O SER A 5 14.180 -7.634 8.661 1.00 0.00 O ATOM 41 CB SER A 5 13.384 -8.215 5.923 1.00 0.00 C ATOM 42 OG SER A 5 14.364 -7.660 5.062 1.00 0.00 O ATOM 0 H SER A 5 12.790 -9.998 8.409 1.00 0.00 H new ATOM 0 HA SER A 5 14.725 -9.844 6.332 1.00 0.00 H new ATOM 0 HB2 SER A 5 12.605 -8.695 5.331 1.00 0.00 H new ATOM 0 HB3 SER A 5 12.906 -7.420 6.495 1.00 0.00 H new ATOM 0 HG SER A 5 13.941 -7.013 4.460 1.00 0.00 H new ATOM 48 N SER A 6 15.994 -8.891 8.223 1.00 0.00 N ATOM 49 CA SER A 6 16.804 -8.283 9.272 1.00 0.00 C ATOM 50 C SER A 6 16.820 -6.764 9.134 1.00 0.00 C ATOM 51 O SER A 6 16.421 -6.218 8.106 1.00 0.00 O ATOM 52 CB SER A 6 18.233 -8.827 9.221 1.00 0.00 C ATOM 53 OG SER A 6 18.258 -10.221 9.471 1.00 0.00 O ATOM 0 H SER A 6 16.472 -9.615 7.687 1.00 0.00 H new ATOM 0 HA SER A 6 16.360 -8.538 10.234 1.00 0.00 H new ATOM 0 HB2 SER A 6 18.669 -8.622 8.243 1.00 0.00 H new ATOM 0 HB3 SER A 6 18.848 -8.311 9.958 1.00 0.00 H new ATOM 0 HG SER A 6 19.182 -10.544 9.431 1.00 0.00 H new ATOM 59 N GLY A 7 17.285 -6.086 10.179 1.00 0.00 N ATOM 60 CA GLY A 7 17.345 -4.636 10.155 1.00 0.00 C ATOM 61 C GLY A 7 16.020 -4.007 9.775 1.00 0.00 C ATOM 62 O GLY A 7 15.030 -4.709 9.564 1.00 0.00 O ATOM 0 H GLY A 7 17.621 -6.515 11.041 1.00 0.00 H new ATOM 0 HA2 GLY A 7 17.648 -4.272 11.137 1.00 0.00 H new ATOM 0 HA3 GLY A 7 18.111 -4.319 9.447 1.00 0.00 H new ATOM 66 N ILE A 8 15.999 -2.681 9.689 1.00 0.00 N ATOM 67 CA ILE A 8 14.784 -1.958 9.332 1.00 0.00 C ATOM 68 C ILE A 8 13.996 -2.703 8.260 1.00 0.00 C ATOM 69 O ILE A 8 14.340 -2.689 7.078 1.00 0.00 O ATOM 70 CB ILE A 8 15.102 -0.539 8.826 1.00 0.00 C ATOM 71 CG1 ILE A 8 15.758 0.286 9.935 1.00 0.00 C ATOM 72 CG2 ILE A 8 13.835 0.143 8.330 1.00 0.00 C ATOM 73 CD1 ILE A 8 14.789 0.744 11.002 1.00 0.00 C ATOM 0 H ILE A 8 16.809 -2.086 9.862 1.00 0.00 H new ATOM 0 HA ILE A 8 14.182 -1.886 10.238 1.00 0.00 H new ATOM 0 HB ILE A 8 15.801 -0.614 7.993 1.00 0.00 H new ATOM 0 HG12 ILE A 8 16.545 -0.307 10.401 1.00 0.00 H new ATOM 0 HG13 ILE A 8 16.237 1.159 9.492 1.00 0.00 H new ATOM 0 HG21 ILE A 8 14.076 1.145 7.976 1.00 0.00 H new ATOM 0 HG22 ILE A 8 13.405 -0.437 7.513 1.00 0.00 H new ATOM 0 HG23 ILE A 8 13.115 0.210 9.145 1.00 0.00 H new ATOM 0 HD11 ILE A 8 15.324 1.323 11.755 1.00 0.00 H new ATOM 0 HD12 ILE A 8 14.016 1.364 10.549 1.00 0.00 H new ATOM 0 HD13 ILE A 8 14.328 -0.125 11.472 1.00 0.00 H new ATOM 85 N PRO A 9 12.910 -3.370 8.680 1.00 0.00 N ATOM 86 CA PRO A 9 12.048 -4.132 7.771 1.00 0.00 C ATOM 87 C PRO A 9 11.253 -3.229 6.835 1.00 0.00 C ATOM 88 O PRO A 9 10.376 -2.484 7.273 1.00 0.00 O ATOM 89 CB PRO A 9 11.108 -4.881 8.719 1.00 0.00 C ATOM 90 CG PRO A 9 11.075 -4.050 9.955 1.00 0.00 C ATOM 91 CD PRO A 9 12.441 -3.431 10.074 1.00 0.00 C ATOM 0 HA PRO A 9 12.623 -4.786 7.115 1.00 0.00 H new ATOM 0 HB2 PRO A 9 10.113 -4.988 8.287 1.00 0.00 H new ATOM 0 HB3 PRO A 9 11.475 -5.886 8.927 1.00 0.00 H new ATOM 0 HG2 PRO A 9 10.303 -3.283 9.889 1.00 0.00 H new ATOM 0 HG3 PRO A 9 10.845 -4.659 10.829 1.00 0.00 H new ATOM 0 HD2 PRO A 9 12.395 -2.440 10.526 1.00 0.00 H new ATOM 0 HD3 PRO A 9 13.103 -4.035 10.695 1.00 0.00 H new ATOM 99 N GLU A 10 11.564 -3.302 5.544 1.00 0.00 N ATOM 100 CA GLU A 10 10.877 -2.490 4.547 1.00 0.00 C ATOM 101 C GLU A 10 10.490 -3.331 3.334 1.00 0.00 C ATOM 102 O GLU A 10 11.191 -4.276 2.970 1.00 0.00 O ATOM 103 CB GLU A 10 11.762 -1.321 4.110 1.00 0.00 C ATOM 104 CG GLU A 10 12.337 -0.526 5.270 1.00 0.00 C ATOM 105 CD GLU A 10 13.520 0.330 4.861 1.00 0.00 C ATOM 106 OE1 GLU A 10 13.305 1.347 4.169 1.00 0.00 O ATOM 107 OE2 GLU A 10 14.660 -0.017 5.233 1.00 0.00 O ATOM 0 H GLU A 10 12.286 -3.914 5.165 1.00 0.00 H new ATOM 0 HA GLU A 10 9.967 -2.097 5.000 1.00 0.00 H new ATOM 0 HB2 GLU A 10 12.581 -1.704 3.502 1.00 0.00 H new ATOM 0 HB3 GLU A 10 11.180 -0.653 3.476 1.00 0.00 H new ATOM 0 HG2 GLU A 10 11.559 0.112 5.689 1.00 0.00 H new ATOM 0 HG3 GLU A 10 12.645 -1.212 6.059 1.00 0.00 H new ATOM 114 N LEU A 11 9.369 -2.981 2.711 1.00 0.00 N ATOM 115 CA LEU A 11 8.888 -3.703 1.539 1.00 0.00 C ATOM 116 C LEU A 11 9.157 -2.911 0.263 1.00 0.00 C ATOM 117 O LEU A 11 8.940 -1.700 0.213 1.00 0.00 O ATOM 118 CB LEU A 11 7.390 -3.986 1.670 1.00 0.00 C ATOM 119 CG LEU A 11 7.013 -5.330 2.294 1.00 0.00 C ATOM 120 CD1 LEU A 11 5.684 -5.225 3.026 1.00 0.00 C ATOM 121 CD2 LEU A 11 6.953 -6.414 1.228 1.00 0.00 C ATOM 0 H LEU A 11 8.777 -2.202 2.998 1.00 0.00 H new ATOM 0 HA LEU A 11 9.427 -4.648 1.479 1.00 0.00 H new ATOM 0 HB2 LEU A 11 6.942 -3.192 2.267 1.00 0.00 H new ATOM 0 HB3 LEU A 11 6.942 -3.930 0.678 1.00 0.00 H new ATOM 0 HG LEU A 11 7.782 -5.602 3.017 1.00 0.00 H new ATOM 0 HD11 LEU A 11 5.432 -6.191 3.463 1.00 0.00 H new ATOM 0 HD12 LEU A 11 5.762 -4.478 3.816 1.00 0.00 H new ATOM 0 HD13 LEU A 11 4.904 -4.930 2.324 1.00 0.00 H new ATOM 0 HD21 LEU A 11 6.683 -7.364 1.690 1.00 0.00 H new ATOM 0 HD22 LEU A 11 6.205 -6.149 0.481 1.00 0.00 H new ATOM 0 HD23 LEU A 11 7.928 -6.507 0.749 1.00 0.00 H new ATOM 133 N LYS A 12 9.631 -3.604 -0.767 1.00 0.00 N ATOM 134 CA LYS A 12 9.928 -2.968 -2.045 1.00 0.00 C ATOM 135 C LYS A 12 9.113 -3.600 -3.170 1.00 0.00 C ATOM 136 O LYS A 12 9.366 -4.737 -3.568 1.00 0.00 O ATOM 137 CB LYS A 12 11.421 -3.078 -2.359 1.00 0.00 C ATOM 138 CG LYS A 12 12.317 -2.665 -1.204 1.00 0.00 C ATOM 139 CD LYS A 12 12.642 -1.182 -1.252 1.00 0.00 C ATOM 140 CE LYS A 12 13.862 -0.906 -2.118 1.00 0.00 C ATOM 141 NZ LYS A 12 13.954 0.529 -2.507 1.00 0.00 N ATOM 0 H LYS A 12 9.818 -4.606 -0.742 1.00 0.00 H new ATOM 0 HA LYS A 12 9.656 -1.915 -1.970 1.00 0.00 H new ATOM 0 HB2 LYS A 12 11.651 -4.107 -2.636 1.00 0.00 H new ATOM 0 HB3 LYS A 12 11.649 -2.456 -3.225 1.00 0.00 H new ATOM 0 HG2 LYS A 12 11.826 -2.900 -0.260 1.00 0.00 H new ATOM 0 HG3 LYS A 12 13.241 -3.242 -1.235 1.00 0.00 H new ATOM 0 HD2 LYS A 12 11.785 -0.633 -1.643 1.00 0.00 H new ATOM 0 HD3 LYS A 12 12.821 -0.815 -0.241 1.00 0.00 H new ATOM 0 HE2 LYS A 12 14.764 -1.194 -1.577 1.00 0.00 H new ATOM 0 HE3 LYS A 12 13.817 -1.523 -3.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 14.798 0.676 -3.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 13.106 0.798 -3.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 14.022 1.117 -1.652 1.00 0.00 H new ATOM 155 N ASP A 13 8.137 -2.856 -3.678 1.00 0.00 N ATOM 156 CA ASP A 13 7.288 -3.343 -4.758 1.00 0.00 C ATOM 157 C ASP A 13 6.356 -2.242 -5.255 1.00 0.00 C ATOM 158 O ASP A 13 5.857 -1.436 -4.470 1.00 0.00 O ATOM 159 CB ASP A 13 6.470 -4.548 -4.289 1.00 0.00 C ATOM 160 CG ASP A 13 7.233 -5.851 -4.420 1.00 0.00 C ATOM 161 OD1 ASP A 13 7.727 -6.141 -5.529 1.00 0.00 O ATOM 162 OD2 ASP A 13 7.336 -6.582 -3.412 1.00 0.00 O ATOM 0 H ASP A 13 7.914 -1.913 -3.359 1.00 0.00 H new ATOM 0 HA ASP A 13 7.931 -3.649 -5.583 1.00 0.00 H new ATOM 0 HB2 ASP A 13 6.179 -4.403 -3.248 1.00 0.00 H new ATOM 0 HB3 ASP A 13 5.551 -4.608 -4.871 1.00 0.00 H new ATOM 167 N HIS A 14 6.126 -2.215 -6.564 1.00 0.00 N ATOM 168 CA HIS A 14 5.254 -1.212 -7.166 1.00 0.00 C ATOM 169 C HIS A 14 3.862 -1.784 -7.417 1.00 0.00 C ATOM 170 O HIS A 14 3.687 -2.680 -8.244 1.00 0.00 O ATOM 171 CB HIS A 14 5.854 -0.705 -8.477 1.00 0.00 C ATOM 172 CG HIS A 14 4.853 -0.054 -9.382 1.00 0.00 C ATOM 173 ND1 HIS A 14 4.328 -0.676 -10.495 1.00 0.00 N ATOM 174 CD2 HIS A 14 4.280 1.171 -9.332 1.00 0.00 C ATOM 175 CE1 HIS A 14 3.477 0.139 -11.091 1.00 0.00 C ATOM 176 NE2 HIS A 14 3.429 1.266 -10.405 1.00 0.00 N ATOM 0 H HIS A 14 6.531 -2.875 -7.228 1.00 0.00 H new ATOM 0 HA HIS A 14 5.165 -0.378 -6.470 1.00 0.00 H new ATOM 0 HB2 HIS A 14 6.646 0.009 -8.252 1.00 0.00 H new ATOM 0 HB3 HIS A 14 6.317 -1.540 -9.002 1.00 0.00 H new ATOM 0 HD2 HIS A 14 4.459 1.932 -8.587 1.00 0.00 H new ATOM 0 HE1 HIS A 14 2.916 -0.079 -11.987 1.00 0.00 H new ATOM 0 HE2 HIS A 14 2.853 2.076 -10.635 1.00 0.00 H new ATOM 185 N LEU A 15 2.874 -1.261 -6.698 1.00 0.00 N ATOM 186 CA LEU A 15 1.497 -1.719 -6.843 1.00 0.00 C ATOM 187 C LEU A 15 0.771 -0.930 -7.927 1.00 0.00 C ATOM 188 O LEU A 15 1.372 -0.105 -8.616 1.00 0.00 O ATOM 189 CB LEU A 15 0.752 -1.585 -5.513 1.00 0.00 C ATOM 190 CG LEU A 15 1.452 -2.176 -4.289 1.00 0.00 C ATOM 191 CD1 LEU A 15 1.030 -1.440 -3.026 1.00 0.00 C ATOM 192 CD2 LEU A 15 1.151 -3.662 -4.168 1.00 0.00 C ATOM 0 H LEU A 15 3.001 -0.520 -6.009 1.00 0.00 H new ATOM 0 HA LEU A 15 1.518 -2.768 -7.137 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.570 -0.527 -5.327 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.222 -2.063 -5.615 1.00 0.00 H new ATOM 0 HG LEU A 15 2.528 -2.053 -4.415 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.538 -1.874 -2.165 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.297 -0.387 -3.112 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -0.048 -1.531 -2.895 1.00 0.00 H new ATOM 0 HD21 LEU A 15 1.658 -4.066 -3.291 1.00 0.00 H new ATOM 0 HD22 LEU A 15 0.076 -3.808 -4.065 1.00 0.00 H new ATOM 0 HD23 LEU A 15 1.504 -4.179 -5.061 1.00 0.00 H new ATOM 204 N ARG A 16 -0.524 -1.188 -8.073 1.00 0.00 N ATOM 205 CA ARG A 16 -1.332 -0.501 -9.073 1.00 0.00 C ATOM 206 C ARG A 16 -1.781 0.866 -8.565 1.00 0.00 C ATOM 207 O ARG A 16 -2.532 0.962 -7.594 1.00 0.00 O ATOM 208 CB ARG A 16 -2.554 -1.346 -9.441 1.00 0.00 C ATOM 209 CG ARG A 16 -2.267 -2.404 -10.494 1.00 0.00 C ATOM 210 CD ARG A 16 -2.272 -1.812 -11.895 1.00 0.00 C ATOM 211 NE ARG A 16 -0.955 -1.313 -12.283 1.00 0.00 N ATOM 212 CZ ARG A 16 0.079 -2.101 -12.554 1.00 0.00 C ATOM 213 NH1 ARG A 16 -0.051 -3.419 -12.481 1.00 0.00 N ATOM 214 NH2 ARG A 16 1.245 -1.572 -12.900 1.00 0.00 N ATOM 0 H ARG A 16 -1.036 -1.868 -7.511 1.00 0.00 H new ATOM 0 HA ARG A 16 -0.718 -0.355 -9.962 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -2.933 -1.833 -8.542 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -3.344 -0.689 -9.804 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -1.299 -2.863 -10.295 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -3.014 -3.195 -10.429 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -2.597 -2.570 -12.608 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -2.996 -0.999 -11.942 1.00 0.00 H new ATOM 0 HE ARG A 16 -0.822 -0.304 -12.349 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -0.947 -3.829 -12.216 1.00 0.00 H new ATOM 0 HH12 ARG A 16 0.745 -4.022 -12.690 1.00 0.00 H new ATOM 0 HH21 ARG A 16 1.348 -0.559 -12.958 1.00 0.00 H new ATOM 0 HH22 ARG A 16 2.038 -2.178 -13.108 1.00 0.00 H new ATOM 228 N ILE A 17 -1.315 1.920 -9.227 1.00 0.00 N ATOM 229 CA ILE A 17 -1.668 3.280 -8.842 1.00 0.00 C ATOM 230 C ILE A 17 -2.468 3.972 -9.940 1.00 0.00 C ATOM 231 O ILE A 17 -2.027 4.054 -11.087 1.00 0.00 O ATOM 232 CB ILE A 17 -0.416 4.120 -8.528 1.00 0.00 C ATOM 233 CG1 ILE A 17 0.178 3.705 -7.180 1.00 0.00 C ATOM 234 CG2 ILE A 17 -0.759 5.602 -8.529 1.00 0.00 C ATOM 235 CD1 ILE A 17 1.425 4.477 -6.807 1.00 0.00 C ATOM 0 H ILE A 17 -0.692 1.858 -10.032 1.00 0.00 H new ATOM 0 HA ILE A 17 -2.279 3.204 -7.943 1.00 0.00 H new ATOM 0 HB ILE A 17 0.329 3.939 -9.303 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -0.573 3.845 -6.402 1.00 0.00 H new ATOM 0 HG13 ILE A 17 0.413 2.641 -7.208 1.00 0.00 H new ATOM 0 HG21 ILE A 17 0.136 6.183 -8.306 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -1.141 5.886 -9.510 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -1.518 5.800 -7.773 1.00 0.00 H new ATOM 0 HD11 ILE A 17 1.792 4.131 -5.841 1.00 0.00 H new ATOM 0 HD12 ILE A 17 2.192 4.317 -7.565 1.00 0.00 H new ATOM 0 HD13 ILE A 17 1.191 5.540 -6.747 1.00 0.00 H new ATOM 247 N PHE A 18 -3.647 4.471 -9.582 1.00 0.00 N ATOM 248 CA PHE A 18 -4.509 5.157 -10.537 1.00 0.00 C ATOM 249 C PHE A 18 -4.939 6.519 -10.000 1.00 0.00 C ATOM 250 O PHE A 18 -5.374 6.638 -8.855 1.00 0.00 O ATOM 251 CB PHE A 18 -5.742 4.306 -10.847 1.00 0.00 C ATOM 252 CG PHE A 18 -6.834 5.064 -11.546 1.00 0.00 C ATOM 253 CD1 PHE A 18 -6.598 5.678 -12.765 1.00 0.00 C ATOM 254 CD2 PHE A 18 -8.097 5.163 -10.983 1.00 0.00 C ATOM 255 CE1 PHE A 18 -7.601 6.377 -13.411 1.00 0.00 C ATOM 256 CE2 PHE A 18 -9.103 5.859 -11.625 1.00 0.00 C ATOM 257 CZ PHE A 18 -8.855 6.468 -12.839 1.00 0.00 C ATOM 0 H PHE A 18 -4.027 4.413 -8.637 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.942 5.310 -11.455 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -5.443 3.461 -11.467 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -6.134 3.896 -9.916 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -5.619 5.610 -13.216 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -8.297 4.691 -10.032 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -7.404 6.851 -14.361 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -10.083 5.927 -11.177 1.00 0.00 H new ATOM 0 HZ PHE A 18 -9.640 7.015 -13.340 1.00 0.00 H new ATOM 267 N ARG A 19 -4.814 7.544 -10.837 1.00 0.00 N ATOM 268 CA ARG A 19 -5.188 8.898 -10.447 1.00 0.00 C ATOM 269 C ARG A 19 -6.148 9.511 -11.462 1.00 0.00 C ATOM 270 O ARG A 19 -5.740 10.086 -12.471 1.00 0.00 O ATOM 271 CB ARG A 19 -3.942 9.776 -10.314 1.00 0.00 C ATOM 272 CG ARG A 19 -3.120 9.482 -9.069 1.00 0.00 C ATOM 273 CD ARG A 19 -3.798 10.012 -7.816 1.00 0.00 C ATOM 274 NE ARG A 19 -3.667 11.462 -7.695 1.00 0.00 N ATOM 275 CZ ARG A 19 -4.349 12.190 -6.818 1.00 0.00 C ATOM 276 NH1 ARG A 19 -5.205 11.607 -5.990 1.00 0.00 N ATOM 277 NH2 ARG A 19 -4.175 13.505 -6.768 1.00 0.00 N ATOM 0 H ARG A 19 -4.457 7.462 -11.789 1.00 0.00 H new ATOM 0 HA ARG A 19 -5.692 8.845 -9.482 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -3.315 9.638 -11.194 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -4.245 10.823 -10.300 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -2.971 8.406 -8.976 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -2.133 9.933 -9.168 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -4.854 9.744 -7.834 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -3.363 9.534 -6.938 1.00 0.00 H new ATOM 0 HE ARG A 19 -3.017 11.941 -8.318 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -5.341 10.597 -6.025 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -5.727 12.169 -5.318 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -3.517 13.957 -7.403 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -4.699 14.064 -6.094 1.00 0.00 H new ATOM 291 N PRO A 20 -7.456 9.386 -11.190 1.00 0.00 N ATOM 292 CA PRO A 20 -8.501 9.921 -12.067 1.00 0.00 C ATOM 293 C PRO A 20 -8.545 11.445 -12.055 1.00 0.00 C ATOM 294 O PRO A 20 -9.261 12.061 -12.845 1.00 0.00 O ATOM 295 CB PRO A 20 -9.790 9.344 -11.476 1.00 0.00 C ATOM 296 CG PRO A 20 -9.469 9.092 -10.043 1.00 0.00 C ATOM 297 CD PRO A 20 -8.014 8.713 -10.005 1.00 0.00 C ATOM 0 HA PRO A 20 -8.335 9.650 -13.110 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -10.620 10.043 -11.579 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -10.082 8.425 -11.984 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -9.657 9.980 -9.439 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -10.091 8.294 -9.638 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -7.534 9.052 -9.087 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -7.879 7.633 -10.055 1.00 0.00 H new ATOM 305 N ARG A 21 -7.774 12.047 -11.156 1.00 0.00 N ATOM 306 CA ARG A 21 -7.725 13.500 -11.041 1.00 0.00 C ATOM 307 C ARG A 21 -6.368 14.035 -11.490 1.00 0.00 C ATOM 308 O ARG A 21 -5.487 14.291 -10.669 1.00 0.00 O ATOM 309 CB ARG A 21 -8.003 13.928 -9.599 1.00 0.00 C ATOM 310 CG ARG A 21 -8.633 15.307 -9.484 1.00 0.00 C ATOM 311 CD ARG A 21 -7.576 16.397 -9.407 1.00 0.00 C ATOM 312 NE ARG A 21 -8.157 17.702 -9.103 1.00 0.00 N ATOM 313 CZ ARG A 21 -8.692 18.013 -7.928 1.00 0.00 C ATOM 314 NH1 ARG A 21 -8.720 17.118 -6.951 1.00 0.00 N ATOM 315 NH2 ARG A 21 -9.202 19.222 -7.728 1.00 0.00 N ATOM 0 H ARG A 21 -7.174 11.551 -10.496 1.00 0.00 H new ATOM 0 HA ARG A 21 -8.494 13.918 -11.691 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -8.663 13.196 -9.132 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -7.068 13.917 -9.039 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -9.280 15.486 -10.343 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -9.264 15.347 -8.596 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -6.844 16.139 -8.642 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -7.041 16.450 -10.355 1.00 0.00 H new ATOM 0 HE ARG A 21 -8.152 18.414 -9.834 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -8.330 16.187 -7.100 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -9.132 17.360 -6.050 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -9.183 19.914 -8.477 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -9.613 19.459 -6.825 1.00 0.00 H new ATOM 329 N LYS A 22 -6.207 14.202 -12.798 1.00 0.00 N ATOM 330 CA LYS A 22 -4.959 14.707 -13.357 1.00 0.00 C ATOM 331 C LYS A 22 -5.186 15.305 -14.742 1.00 0.00 C ATOM 332 O LYS A 22 -6.054 14.853 -15.490 1.00 0.00 O ATOM 333 CB LYS A 22 -3.921 13.586 -13.438 1.00 0.00 C ATOM 334 CG LYS A 22 -2.488 14.074 -13.321 1.00 0.00 C ATOM 335 CD LYS A 22 -2.171 14.542 -11.911 1.00 0.00 C ATOM 336 CE LYS A 22 -1.722 13.388 -11.028 1.00 0.00 C ATOM 337 NZ LYS A 22 -1.330 13.851 -9.667 1.00 0.00 N ATOM 0 H LYS A 22 -6.926 13.995 -13.491 1.00 0.00 H new ATOM 0 HA LYS A 22 -4.586 15.491 -12.698 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -4.116 12.864 -12.645 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -4.040 13.060 -14.385 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -1.806 13.271 -13.601 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -2.323 14.892 -14.022 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -1.389 15.301 -11.946 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -3.053 15.013 -11.476 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -2.528 12.659 -10.945 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -0.879 12.880 -11.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -1.030 13.035 -9.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -0.544 14.528 -9.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -2.142 14.314 -9.210 1.00 0.00 H new ATOM 351 N LEU A 23 -4.401 16.322 -15.078 1.00 0.00 N ATOM 352 CA LEU A 23 -4.515 16.981 -16.375 1.00 0.00 C ATOM 353 C LEU A 23 -4.536 15.957 -17.506 1.00 0.00 C ATOM 354 O LEU A 23 -5.529 15.828 -18.223 1.00 0.00 O ATOM 355 CB LEU A 23 -3.355 17.957 -16.577 1.00 0.00 C ATOM 356 CG LEU A 23 -3.246 19.090 -15.557 1.00 0.00 C ATOM 357 CD1 LEU A 23 -1.795 19.515 -15.384 1.00 0.00 C ATOM 358 CD2 LEU A 23 -4.103 20.274 -15.981 1.00 0.00 C ATOM 0 H LEU A 23 -3.678 16.709 -14.471 1.00 0.00 H new ATOM 0 HA LEU A 23 -5.454 17.534 -16.393 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -2.424 17.391 -16.562 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -3.445 18.397 -17.570 1.00 0.00 H new ATOM 0 HG LEU A 23 -3.614 18.726 -14.598 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -1.737 20.323 -14.654 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -1.207 18.667 -15.034 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -1.401 19.861 -16.340 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -4.013 21.071 -15.243 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -3.766 20.638 -16.951 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -5.145 19.962 -16.053 1.00 0.00 H new ATOM 370 N THR A 24 -3.435 15.229 -17.659 1.00 0.00 N ATOM 371 CA THR A 24 -3.327 14.216 -18.701 1.00 0.00 C ATOM 372 C THR A 24 -2.657 12.952 -18.173 1.00 0.00 C ATOM 373 O THR A 24 -1.590 13.013 -17.560 1.00 0.00 O ATOM 374 CB THR A 24 -2.530 14.738 -19.912 1.00 0.00 C ATOM 375 OG1 THR A 24 -3.242 15.808 -20.542 1.00 0.00 O ATOM 376 CG2 THR A 24 -2.284 13.624 -20.918 1.00 0.00 C ATOM 0 H THR A 24 -2.605 15.322 -17.074 1.00 0.00 H new ATOM 0 HA THR A 24 -4.343 13.980 -19.018 1.00 0.00 H new ATOM 0 HB THR A 24 -1.567 15.103 -19.556 1.00 0.00 H new ATOM 0 HG1 THR A 24 -2.728 16.135 -21.310 1.00 0.00 H new ATOM 0 HG21 THR A 24 -1.720 14.016 -21.764 1.00 0.00 H new ATOM 0 HG22 THR A 24 -1.717 12.824 -20.443 1.00 0.00 H new ATOM 0 HG23 THR A 24 -3.239 13.233 -21.269 1.00 0.00 H new ATOM 384 N LEU A 25 -3.289 11.809 -18.414 1.00 0.00 N ATOM 385 CA LEU A 25 -2.753 10.529 -17.962 1.00 0.00 C ATOM 386 C LEU A 25 -3.397 9.372 -18.719 1.00 0.00 C ATOM 387 O LEU A 25 -4.527 9.480 -19.196 1.00 0.00 O ATOM 388 CB LEU A 25 -2.981 10.360 -16.459 1.00 0.00 C ATOM 389 CG LEU A 25 -4.374 9.889 -16.040 1.00 0.00 C ATOM 390 CD1 LEU A 25 -5.445 10.766 -16.669 1.00 0.00 C ATOM 391 CD2 LEU A 25 -4.582 8.432 -16.424 1.00 0.00 C ATOM 0 H LEU A 25 -4.172 11.742 -18.919 1.00 0.00 H new ATOM 0 HA LEU A 25 -1.682 10.520 -18.164 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -2.249 9.648 -16.079 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -2.780 11.314 -15.972 1.00 0.00 H new ATOM 0 HG LEU A 25 -4.455 9.973 -14.956 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -6.430 10.416 -16.360 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -5.308 11.797 -16.344 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -5.366 10.714 -17.755 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -5.579 8.114 -16.118 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -4.482 8.322 -17.504 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -3.835 7.814 -15.926 1.00 0.00 H new ATOM 403 N LYS A 26 -2.672 8.263 -18.823 1.00 0.00 N ATOM 404 CA LYS A 26 -3.173 7.084 -19.518 1.00 0.00 C ATOM 405 C LYS A 26 -3.239 5.885 -18.577 1.00 0.00 C ATOM 406 O LYS A 26 -2.238 5.208 -18.346 1.00 0.00 O ATOM 407 CB LYS A 26 -2.279 6.755 -20.717 1.00 0.00 C ATOM 408 CG LYS A 26 -2.915 5.791 -21.703 1.00 0.00 C ATOM 409 CD LYS A 26 -1.981 5.482 -22.861 1.00 0.00 C ATOM 410 CE LYS A 26 -0.922 4.464 -22.466 1.00 0.00 C ATOM 411 NZ LYS A 26 -1.443 3.070 -22.521 1.00 0.00 N ATOM 0 H LYS A 26 -1.735 8.157 -18.434 1.00 0.00 H new ATOM 0 HA LYS A 26 -4.180 7.303 -19.872 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -2.027 7.680 -21.237 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -1.344 6.328 -20.356 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -3.179 4.866 -21.190 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -3.842 6.219 -22.086 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -2.558 5.100 -23.703 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -1.498 6.400 -23.195 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -0.063 4.557 -23.131 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -0.569 4.680 -21.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -0.691 2.407 -22.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -2.246 2.974 -21.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -1.756 2.854 -23.489 1.00 0.00 H new ATOM 425 N GLY A 27 -4.427 5.628 -18.037 1.00 0.00 N ATOM 426 CA GLY A 27 -4.602 4.510 -17.128 1.00 0.00 C ATOM 427 C GLY A 27 -3.505 4.433 -16.085 1.00 0.00 C ATOM 428 O GLY A 27 -3.279 5.387 -15.341 1.00 0.00 O ATOM 0 H GLY A 27 -5.271 6.174 -18.213 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -5.567 4.599 -16.630 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -4.622 3.582 -17.699 1.00 0.00 H new ATOM 432 N TYR A 28 -2.822 3.295 -16.029 1.00 0.00 N ATOM 433 CA TYR A 28 -1.746 3.096 -15.067 1.00 0.00 C ATOM 434 C TYR A 28 -0.385 3.336 -15.714 1.00 0.00 C ATOM 435 O TYR A 28 -0.254 3.309 -16.938 1.00 0.00 O ATOM 436 CB TYR A 28 -1.805 1.681 -14.488 1.00 0.00 C ATOM 437 CG TYR A 28 -3.069 1.399 -13.707 1.00 0.00 C ATOM 438 CD1 TYR A 28 -4.208 0.917 -14.340 1.00 0.00 C ATOM 439 CD2 TYR A 28 -3.123 1.614 -12.335 1.00 0.00 C ATOM 440 CE1 TYR A 28 -5.364 0.658 -13.630 1.00 0.00 C ATOM 441 CE2 TYR A 28 -4.275 1.357 -11.617 1.00 0.00 C ATOM 442 CZ TYR A 28 -5.393 0.880 -12.269 1.00 0.00 C ATOM 443 OH TYR A 28 -6.543 0.623 -11.558 1.00 0.00 O ATOM 0 H TYR A 28 -2.995 2.496 -16.639 1.00 0.00 H new ATOM 0 HA TYR A 28 -1.877 3.817 -14.260 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -1.722 0.961 -15.302 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -0.944 1.527 -13.838 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -4.189 0.742 -15.406 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -2.250 1.988 -11.821 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -6.241 0.284 -14.138 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -4.300 1.529 -10.551 1.00 0.00 H new ATOM 0 HH TYR A 28 -6.396 0.831 -10.612 1.00 0.00 H new ATOM 453 N ARG A 29 0.625 3.569 -14.882 1.00 0.00 N ATOM 454 CA ARG A 29 1.976 3.815 -15.372 1.00 0.00 C ATOM 455 C ARG A 29 3.000 3.024 -14.562 1.00 0.00 C ATOM 456 O ARG A 29 2.703 2.546 -13.468 1.00 0.00 O ATOM 457 CB ARG A 29 2.302 5.308 -15.306 1.00 0.00 C ATOM 458 CG ARG A 29 1.909 6.073 -16.560 1.00 0.00 C ATOM 459 CD ARG A 29 2.163 7.564 -16.405 1.00 0.00 C ATOM 460 NE ARG A 29 1.197 8.193 -15.509 1.00 0.00 N ATOM 461 CZ ARG A 29 1.175 9.496 -15.250 1.00 0.00 C ATOM 462 NH1 ARG A 29 2.063 10.303 -15.815 1.00 0.00 N ATOM 463 NH2 ARG A 29 0.265 9.994 -14.423 1.00 0.00 N ATOM 0 H ARG A 29 0.533 3.593 -13.866 1.00 0.00 H new ATOM 0 HA ARG A 29 2.025 3.485 -16.410 1.00 0.00 H new ATOM 0 HB2 ARG A 29 1.791 5.745 -14.448 1.00 0.00 H new ATOM 0 HB3 ARG A 29 3.372 5.431 -15.136 1.00 0.00 H new ATOM 0 HG2 ARG A 29 2.474 5.693 -17.411 1.00 0.00 H new ATOM 0 HG3 ARG A 29 0.854 5.903 -16.776 1.00 0.00 H new ATOM 0 HD2 ARG A 29 3.171 7.722 -16.020 1.00 0.00 H new ATOM 0 HD3 ARG A 29 2.116 8.043 -17.383 1.00 0.00 H new ATOM 0 HE ARG A 29 0.501 7.600 -15.057 1.00 0.00 H new ATOM 0 HH11 ARG A 29 2.765 9.924 -16.450 1.00 0.00 H new ATOM 0 HH12 ARG A 29 2.044 11.303 -15.614 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -0.419 9.376 -13.985 1.00 0.00 H new ATOM 0 HH22 ARG A 29 0.249 10.994 -14.225 1.00 0.00 H new ATOM 477 N GLN A 30 4.204 2.890 -15.109 1.00 0.00 N ATOM 478 CA GLN A 30 5.270 2.156 -14.438 1.00 0.00 C ATOM 479 C GLN A 30 6.024 3.058 -13.467 1.00 0.00 C ATOM 480 O GLN A 30 6.909 3.816 -13.866 1.00 0.00 O ATOM 481 CB GLN A 30 6.240 1.570 -15.466 1.00 0.00 C ATOM 482 CG GLN A 30 7.308 0.678 -14.854 1.00 0.00 C ATOM 483 CD GLN A 30 8.003 -0.190 -15.885 1.00 0.00 C ATOM 484 OE1 GLN A 30 7.602 -0.235 -17.048 1.00 0.00 O ATOM 485 NE2 GLN A 30 9.053 -0.885 -15.462 1.00 0.00 N ATOM 0 H GLN A 30 4.465 3.280 -16.015 1.00 0.00 H new ATOM 0 HA GLN A 30 4.816 1.342 -13.872 1.00 0.00 H new ATOM 0 HB2 GLN A 30 5.675 0.995 -16.200 1.00 0.00 H new ATOM 0 HB3 GLN A 30 6.724 2.386 -16.003 1.00 0.00 H new ATOM 0 HG2 GLN A 30 8.048 1.298 -14.348 1.00 0.00 H new ATOM 0 HG3 GLN A 30 6.853 0.041 -14.095 1.00 0.00 H new ATOM 0 HE21 GLN A 30 9.351 -0.818 -14.489 1.00 0.00 H new ATOM 0 HE22 GLN A 30 9.562 -1.486 -16.110 1.00 0.00 H new ATOM 494 N HIS A 31 5.668 2.972 -12.189 1.00 0.00 N ATOM 495 CA HIS A 31 6.311 3.781 -11.160 1.00 0.00 C ATOM 496 C HIS A 31 6.914 2.897 -10.072 1.00 0.00 C ATOM 497 O HIS A 31 6.675 1.690 -10.036 1.00 0.00 O ATOM 498 CB HIS A 31 5.306 4.754 -10.543 1.00 0.00 C ATOM 499 CG HIS A 31 4.756 5.746 -11.521 1.00 0.00 C ATOM 500 ND1 HIS A 31 4.657 7.095 -11.250 1.00 0.00 N ATOM 501 CD2 HIS A 31 4.276 5.580 -12.776 1.00 0.00 C ATOM 502 CE1 HIS A 31 4.138 7.715 -12.295 1.00 0.00 C ATOM 503 NE2 HIS A 31 3.898 6.818 -13.234 1.00 0.00 N ATOM 0 H HIS A 31 4.938 2.350 -11.842 1.00 0.00 H new ATOM 0 HA HIS A 31 7.114 4.349 -11.629 1.00 0.00 H new ATOM 0 HB2 HIS A 31 4.482 4.187 -10.111 1.00 0.00 H new ATOM 0 HB3 HIS A 31 5.787 5.291 -9.725 1.00 0.00 H new ATOM 0 HD1 HIS A 31 4.940 7.544 -10.379 1.00 0.00 H new ATOM 0 HD2 HIS A 31 4.204 4.648 -13.316 1.00 0.00 H new ATOM 0 HE1 HIS A 31 3.943 8.775 -12.369 1.00 0.00 H new ATOM 512 N TRP A 32 7.697 3.506 -9.189 1.00 0.00 N ATOM 513 CA TRP A 32 8.335 2.773 -8.100 1.00 0.00 C ATOM 514 C TRP A 32 7.702 3.130 -6.760 1.00 0.00 C ATOM 515 O TRP A 32 7.375 4.290 -6.506 1.00 0.00 O ATOM 516 CB TRP A 32 9.834 3.073 -8.067 1.00 0.00 C ATOM 517 CG TRP A 32 10.554 2.377 -6.951 1.00 0.00 C ATOM 518 CD1 TRP A 32 11.387 2.947 -6.032 1.00 0.00 C ATOM 519 CD2 TRP A 32 10.505 0.980 -6.640 1.00 0.00 C ATOM 520 NE1 TRP A 32 11.860 1.989 -5.167 1.00 0.00 N ATOM 521 CE2 TRP A 32 11.333 0.775 -5.518 1.00 0.00 C ATOM 522 CE3 TRP A 32 9.842 -0.116 -7.197 1.00 0.00 C ATOM 523 CZ2 TRP A 32 11.513 -0.483 -4.948 1.00 0.00 C ATOM 524 CZ3 TRP A 32 10.023 -1.363 -6.630 1.00 0.00 C ATOM 525 CH2 TRP A 32 10.852 -1.538 -5.514 1.00 0.00 C ATOM 0 H TRP A 32 7.906 4.504 -9.205 1.00 0.00 H new ATOM 0 HA TRP A 32 8.189 1.707 -8.277 1.00 0.00 H new ATOM 0 HB2 TRP A 32 10.278 2.776 -9.017 1.00 0.00 H new ATOM 0 HB3 TRP A 32 9.980 4.149 -7.969 1.00 0.00 H new ATOM 0 HD1 TRP A 32 11.638 3.997 -5.991 1.00 0.00 H new ATOM 0 HE1 TRP A 32 12.500 2.155 -4.390 1.00 0.00 H new ATOM 0 HE3 TRP A 32 9.199 0.009 -8.056 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 12.153 -0.621 -4.089 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 9.517 -2.217 -7.054 1.00 0.00 H new ATOM 0 HH2 TRP A 32 10.971 -2.525 -5.093 1.00 0.00 H new ATOM 536 N VAL A 33 7.532 2.127 -5.904 1.00 0.00 N ATOM 537 CA VAL A 33 6.940 2.336 -4.589 1.00 0.00 C ATOM 538 C VAL A 33 7.756 1.645 -3.502 1.00 0.00 C ATOM 539 O VAL A 33 8.257 0.538 -3.697 1.00 0.00 O ATOM 540 CB VAL A 33 5.491 1.816 -4.536 1.00 0.00 C ATOM 541 CG1 VAL A 33 4.818 2.237 -3.239 1.00 0.00 C ATOM 542 CG2 VAL A 33 4.704 2.310 -5.740 1.00 0.00 C ATOM 0 H VAL A 33 7.796 1.161 -6.099 1.00 0.00 H new ATOM 0 HA VAL A 33 6.939 3.411 -4.410 1.00 0.00 H new ATOM 0 HB VAL A 33 5.513 0.727 -4.567 1.00 0.00 H new ATOM 0 HG11 VAL A 33 3.795 1.860 -3.221 1.00 0.00 H new ATOM 0 HG12 VAL A 33 5.371 1.828 -2.393 1.00 0.00 H new ATOM 0 HG13 VAL A 33 4.805 3.325 -3.172 1.00 0.00 H new ATOM 0 HG21 VAL A 33 3.683 1.933 -5.687 1.00 0.00 H new ATOM 0 HG22 VAL A 33 4.689 3.400 -5.743 1.00 0.00 H new ATOM 0 HG23 VAL A 33 5.176 1.951 -6.655 1.00 0.00 H new ATOM 552 N VAL A 34 7.886 2.307 -2.357 1.00 0.00 N ATOM 553 CA VAL A 34 8.641 1.756 -1.237 1.00 0.00 C ATOM 554 C VAL A 34 7.881 1.925 0.074 1.00 0.00 C ATOM 555 O VAL A 34 7.478 3.031 0.432 1.00 0.00 O ATOM 556 CB VAL A 34 10.021 2.426 -1.107 1.00 0.00 C ATOM 557 CG1 VAL A 34 10.766 1.885 0.104 1.00 0.00 C ATOM 558 CG2 VAL A 34 10.834 2.222 -2.378 1.00 0.00 C ATOM 0 H VAL A 34 7.479 3.225 -2.180 1.00 0.00 H new ATOM 0 HA VAL A 34 8.779 0.694 -1.440 1.00 0.00 H new ATOM 0 HB VAL A 34 9.874 3.497 -0.964 1.00 0.00 H new ATOM 0 HG11 VAL A 34 11.739 2.370 0.179 1.00 0.00 H new ATOM 0 HG12 VAL A 34 10.189 2.087 1.006 1.00 0.00 H new ATOM 0 HG13 VAL A 34 10.905 0.809 -0.005 1.00 0.00 H new ATOM 0 HG21 VAL A 34 11.807 2.702 -2.269 1.00 0.00 H new ATOM 0 HG22 VAL A 34 10.973 1.155 -2.553 1.00 0.00 H new ATOM 0 HG23 VAL A 34 10.305 2.662 -3.223 1.00 0.00 H new ATOM 568 N PHE A 35 7.688 0.819 0.786 1.00 0.00 N ATOM 569 CA PHE A 35 6.976 0.844 2.058 1.00 0.00 C ATOM 570 C PHE A 35 7.954 0.861 3.229 1.00 0.00 C ATOM 571 O PHE A 35 8.769 -0.049 3.386 1.00 0.00 O ATOM 572 CB PHE A 35 6.049 -0.367 2.171 1.00 0.00 C ATOM 573 CG PHE A 35 5.364 -0.476 3.504 1.00 0.00 C ATOM 574 CD1 PHE A 35 4.820 0.644 4.111 1.00 0.00 C ATOM 575 CD2 PHE A 35 5.265 -1.698 4.149 1.00 0.00 C ATOM 576 CE1 PHE A 35 4.189 0.547 5.338 1.00 0.00 C ATOM 577 CE2 PHE A 35 4.635 -1.801 5.375 1.00 0.00 C ATOM 578 CZ PHE A 35 4.098 -0.677 5.971 1.00 0.00 C ATOM 0 H PHE A 35 8.015 -0.105 0.503 1.00 0.00 H new ATOM 0 HA PHE A 35 6.379 1.755 2.094 1.00 0.00 H new ATOM 0 HB2 PHE A 35 5.294 -0.311 1.387 1.00 0.00 H new ATOM 0 HB3 PHE A 35 6.626 -1.274 1.993 1.00 0.00 H new ATOM 0 HD1 PHE A 35 4.889 1.604 3.621 1.00 0.00 H new ATOM 0 HD2 PHE A 35 5.685 -2.580 3.689 1.00 0.00 H new ATOM 0 HE1 PHE A 35 3.768 1.427 5.801 1.00 0.00 H new ATOM 0 HE2 PHE A 35 4.563 -2.760 5.867 1.00 0.00 H new ATOM 0 HZ PHE A 35 3.608 -0.755 6.930 1.00 0.00 H new ATOM 588 N LYS A 36 7.869 1.903 4.049 1.00 0.00 N ATOM 589 CA LYS A 36 8.744 2.041 5.207 1.00 0.00 C ATOM 590 C LYS A 36 7.978 1.792 6.501 1.00 0.00 C ATOM 591 O LYS A 36 6.755 1.921 6.543 1.00 0.00 O ATOM 592 CB LYS A 36 9.373 3.436 5.234 1.00 0.00 C ATOM 593 CG LYS A 36 10.348 3.642 6.379 1.00 0.00 C ATOM 594 CD LYS A 36 11.570 2.749 6.239 1.00 0.00 C ATOM 595 CE LYS A 36 12.804 3.393 6.853 1.00 0.00 C ATOM 596 NZ LYS A 36 13.365 4.461 5.980 1.00 0.00 N ATOM 0 H LYS A 36 7.202 2.666 3.933 1.00 0.00 H new ATOM 0 HA LYS A 36 9.534 1.295 5.124 1.00 0.00 H new ATOM 0 HB2 LYS A 36 9.891 3.610 4.291 1.00 0.00 H new ATOM 0 HB3 LYS A 36 8.581 4.181 5.304 1.00 0.00 H new ATOM 0 HG2 LYS A 36 10.661 4.686 6.408 1.00 0.00 H new ATOM 0 HG3 LYS A 36 9.849 3.432 7.325 1.00 0.00 H new ATOM 0 HD2 LYS A 36 11.379 1.791 6.723 1.00 0.00 H new ATOM 0 HD3 LYS A 36 11.752 2.543 5.184 1.00 0.00 H new ATOM 0 HE2 LYS A 36 12.548 3.815 7.825 1.00 0.00 H new ATOM 0 HE3 LYS A 36 13.563 2.630 7.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 14.277 4.781 6.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 13.507 4.086 5.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 12.704 5.263 5.944 1.00 0.00 H new ATOM 610 N GLU A 37 8.705 1.436 7.556 1.00 0.00 N ATOM 611 CA GLU A 37 8.092 1.170 8.852 1.00 0.00 C ATOM 612 C GLU A 37 6.859 2.046 9.060 1.00 0.00 C ATOM 613 O GLU A 37 5.725 1.574 8.967 1.00 0.00 O ATOM 614 CB GLU A 37 9.099 1.413 9.977 1.00 0.00 C ATOM 615 CG GLU A 37 10.334 0.533 9.889 1.00 0.00 C ATOM 616 CD GLU A 37 11.441 0.985 10.822 1.00 0.00 C ATOM 617 OE1 GLU A 37 11.887 2.144 10.694 1.00 0.00 O ATOM 618 OE2 GLU A 37 11.861 0.179 11.679 1.00 0.00 O ATOM 0 H GLU A 37 9.719 1.325 7.538 1.00 0.00 H new ATOM 0 HA GLU A 37 7.782 0.125 8.871 1.00 0.00 H new ATOM 0 HB2 GLU A 37 9.406 2.459 9.959 1.00 0.00 H new ATOM 0 HB3 GLU A 37 8.609 1.242 10.935 1.00 0.00 H new ATOM 0 HG2 GLU A 37 10.061 -0.495 10.127 1.00 0.00 H new ATOM 0 HG3 GLU A 37 10.705 0.535 8.864 1.00 0.00 H new ATOM 625 N THR A 38 7.089 3.324 9.343 1.00 0.00 N ATOM 626 CA THR A 38 5.999 4.266 9.566 1.00 0.00 C ATOM 627 C THR A 38 5.993 5.361 8.506 1.00 0.00 C ATOM 628 O THR A 38 5.482 6.458 8.734 1.00 0.00 O ATOM 629 CB THR A 38 6.096 4.916 10.959 1.00 0.00 C ATOM 630 OG1 THR A 38 7.467 5.015 11.360 1.00 0.00 O ATOM 631 CG2 THR A 38 5.319 4.109 11.988 1.00 0.00 C ATOM 0 H THR A 38 8.021 3.731 9.423 1.00 0.00 H new ATOM 0 HA THR A 38 5.071 3.698 9.502 1.00 0.00 H new ATOM 0 HB THR A 38 5.662 5.914 10.900 1.00 0.00 H new ATOM 0 HG1 THR A 38 7.520 5.431 12.246 1.00 0.00 H new ATOM 0 HG21 THR A 38 5.402 4.587 12.964 1.00 0.00 H new ATOM 0 HG22 THR A 38 4.270 4.061 11.696 1.00 0.00 H new ATOM 0 HG23 THR A 38 5.727 3.100 12.043 1.00 0.00 H new ATOM 639 N THR A 39 6.563 5.057 7.344 1.00 0.00 N ATOM 640 CA THR A 39 6.623 6.016 6.248 1.00 0.00 C ATOM 641 C THR A 39 6.363 5.336 4.909 1.00 0.00 C ATOM 642 O THR A 39 6.457 4.114 4.792 1.00 0.00 O ATOM 643 CB THR A 39 7.991 6.723 6.195 1.00 0.00 C ATOM 644 OG1 THR A 39 8.547 6.814 7.511 1.00 0.00 O ATOM 645 CG2 THR A 39 7.857 8.115 5.597 1.00 0.00 C ATOM 0 H THR A 39 6.990 4.154 7.138 1.00 0.00 H new ATOM 0 HA THR A 39 5.846 6.758 6.433 1.00 0.00 H new ATOM 0 HB THR A 39 8.655 6.135 5.561 1.00 0.00 H new ATOM 0 HG1 THR A 39 9.417 7.263 7.468 1.00 0.00 H new ATOM 0 HG21 THR A 39 8.835 8.595 5.570 1.00 0.00 H new ATOM 0 HG22 THR A 39 7.462 8.039 4.584 1.00 0.00 H new ATOM 0 HG23 THR A 39 7.178 8.710 6.208 1.00 0.00 H new ATOM 653 N LEU A 40 6.035 6.136 3.899 1.00 0.00 N ATOM 654 CA LEU A 40 5.761 5.611 2.566 1.00 0.00 C ATOM 655 C LEU A 40 6.031 6.668 1.499 1.00 0.00 C ATOM 656 O LEU A 40 5.687 7.837 1.668 1.00 0.00 O ATOM 657 CB LEU A 40 4.311 5.135 2.472 1.00 0.00 C ATOM 658 CG LEU A 40 4.006 4.126 1.364 1.00 0.00 C ATOM 659 CD1 LEU A 40 2.761 3.321 1.702 1.00 0.00 C ATOM 660 CD2 LEU A 40 3.837 4.836 0.028 1.00 0.00 C ATOM 0 H LEU A 40 5.953 7.150 3.978 1.00 0.00 H new ATOM 0 HA LEU A 40 6.426 4.766 2.391 1.00 0.00 H new ATOM 0 HB2 LEU A 40 4.033 4.690 3.427 1.00 0.00 H new ATOM 0 HB3 LEU A 40 3.672 6.006 2.328 1.00 0.00 H new ATOM 0 HG LEU A 40 4.848 3.438 1.284 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.560 2.609 0.902 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.919 2.782 2.636 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.911 3.994 1.810 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.621 4.103 -0.749 1.00 0.00 H new ATOM 0 HD22 LEU A 40 3.014 5.547 0.095 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.756 5.367 -0.220 1.00 0.00 H new ATOM 672 N SER A 41 6.648 6.247 0.400 1.00 0.00 N ATOM 673 CA SER A 41 6.966 7.157 -0.694 1.00 0.00 C ATOM 674 C SER A 41 6.953 6.424 -2.032 1.00 0.00 C ATOM 675 O SER A 41 7.086 5.201 -2.084 1.00 0.00 O ATOM 676 CB SER A 41 8.334 7.803 -0.467 1.00 0.00 C ATOM 677 OG SER A 41 8.476 8.982 -1.241 1.00 0.00 O ATOM 0 H SER A 41 6.938 5.282 0.243 1.00 0.00 H new ATOM 0 HA SER A 41 6.204 7.936 -0.719 1.00 0.00 H new ATOM 0 HB2 SER A 41 8.456 8.041 0.590 1.00 0.00 H new ATOM 0 HB3 SER A 41 9.121 7.096 -0.728 1.00 0.00 H new ATOM 0 HG SER A 41 8.157 9.752 -0.726 1.00 0.00 H new ATOM 683 N TYR A 42 6.791 7.180 -3.112 1.00 0.00 N ATOM 684 CA TYR A 42 6.758 6.603 -4.451 1.00 0.00 C ATOM 685 C TYR A 42 7.489 7.498 -5.448 1.00 0.00 C ATOM 686 O TYR A 42 7.436 8.724 -5.353 1.00 0.00 O ATOM 687 CB TYR A 42 5.312 6.392 -4.902 1.00 0.00 C ATOM 688 CG TYR A 42 4.552 7.681 -5.122 1.00 0.00 C ATOM 689 CD1 TYR A 42 4.345 8.574 -4.079 1.00 0.00 C ATOM 690 CD2 TYR A 42 4.042 8.004 -6.373 1.00 0.00 C ATOM 691 CE1 TYR A 42 3.650 9.752 -4.275 1.00 0.00 C ATOM 692 CE2 TYR A 42 3.348 9.181 -6.579 1.00 0.00 C ATOM 693 CZ TYR A 42 3.154 10.051 -5.527 1.00 0.00 C ATOM 694 OH TYR A 42 2.463 11.224 -5.726 1.00 0.00 O ATOM 0 H TYR A 42 6.680 8.194 -3.087 1.00 0.00 H new ATOM 0 HA TYR A 42 7.265 5.639 -4.417 1.00 0.00 H new ATOM 0 HB2 TYR A 42 5.309 5.816 -5.827 1.00 0.00 H new ATOM 0 HB3 TYR A 42 4.790 5.796 -4.154 1.00 0.00 H new ATOM 0 HD1 TYR A 42 4.734 8.344 -3.098 1.00 0.00 H new ATOM 0 HD2 TYR A 42 4.190 7.324 -7.199 1.00 0.00 H new ATOM 0 HE1 TYR A 42 3.496 10.435 -3.453 1.00 0.00 H new ATOM 0 HE2 TYR A 42 2.960 9.418 -7.558 1.00 0.00 H new ATOM 0 HH TYR A 42 2.183 11.283 -6.663 1.00 0.00 H new ATOM 704 N TYR A 43 8.169 6.875 -6.404 1.00 0.00 N ATOM 705 CA TYR A 43 8.912 7.613 -7.418 1.00 0.00 C ATOM 706 C TYR A 43 8.458 7.218 -8.821 1.00 0.00 C ATOM 707 O TYR A 43 7.673 6.286 -8.993 1.00 0.00 O ATOM 708 CB TYR A 43 10.412 7.360 -7.266 1.00 0.00 C ATOM 709 CG TYR A 43 10.919 7.552 -5.854 1.00 0.00 C ATOM 710 CD1 TYR A 43 10.515 6.705 -4.829 1.00 0.00 C ATOM 711 CD2 TYR A 43 11.799 8.582 -5.545 1.00 0.00 C ATOM 712 CE1 TYR A 43 10.975 6.877 -3.538 1.00 0.00 C ATOM 713 CE2 TYR A 43 12.265 8.760 -4.257 1.00 0.00 C ATOM 714 CZ TYR A 43 11.850 7.906 -3.257 1.00 0.00 C ATOM 715 OH TYR A 43 12.310 8.082 -1.972 1.00 0.00 O ATOM 0 H TYR A 43 8.221 5.861 -6.498 1.00 0.00 H new ATOM 0 HA TYR A 43 8.713 8.675 -7.276 1.00 0.00 H new ATOM 0 HB2 TYR A 43 10.635 6.343 -7.588 1.00 0.00 H new ATOM 0 HB3 TYR A 43 10.954 8.031 -7.932 1.00 0.00 H new ATOM 0 HD1 TYR A 43 9.830 5.899 -5.045 1.00 0.00 H new ATOM 0 HD2 TYR A 43 12.124 9.255 -6.325 1.00 0.00 H new ATOM 0 HE1 TYR A 43 10.652 6.210 -2.753 1.00 0.00 H new ATOM 0 HE2 TYR A 43 12.951 9.564 -4.034 1.00 0.00 H new ATOM 0 HH TYR A 43 12.918 8.850 -1.945 1.00 0.00 H new ATOM 725 N LYS A 44 8.958 7.936 -9.821 1.00 0.00 N ATOM 726 CA LYS A 44 8.608 7.663 -11.209 1.00 0.00 C ATOM 727 C LYS A 44 9.574 6.657 -11.826 1.00 0.00 C ATOM 728 O LYS A 44 9.174 5.801 -12.616 1.00 0.00 O ATOM 729 CB LYS A 44 8.615 8.958 -12.024 1.00 0.00 C ATOM 730 CG LYS A 44 7.981 8.818 -13.397 1.00 0.00 C ATOM 731 CD LYS A 44 7.790 10.169 -14.064 1.00 0.00 C ATOM 732 CE LYS A 44 9.121 10.784 -14.468 1.00 0.00 C ATOM 733 NZ LYS A 44 8.964 11.773 -15.570 1.00 0.00 N ATOM 0 H LYS A 44 9.608 8.712 -9.695 1.00 0.00 H new ATOM 0 HA LYS A 44 7.605 7.236 -11.226 1.00 0.00 H new ATOM 0 HB2 LYS A 44 8.086 9.731 -11.466 1.00 0.00 H new ATOM 0 HB3 LYS A 44 9.644 9.298 -12.142 1.00 0.00 H new ATOM 0 HG2 LYS A 44 8.609 8.186 -14.026 1.00 0.00 H new ATOM 0 HG3 LYS A 44 7.017 8.318 -13.304 1.00 0.00 H new ATOM 0 HD2 LYS A 44 7.158 10.055 -14.945 1.00 0.00 H new ATOM 0 HD3 LYS A 44 7.269 10.842 -13.383 1.00 0.00 H new ATOM 0 HE2 LYS A 44 9.573 11.272 -13.604 1.00 0.00 H new ATOM 0 HE3 LYS A 44 9.805 9.995 -14.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 9.894 12.169 -15.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 8.557 11.303 -16.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 8.332 12.539 -15.261 1.00 0.00 H new ATOM 747 N SER A 45 10.847 6.765 -11.460 1.00 0.00 N ATOM 748 CA SER A 45 11.871 5.866 -11.979 1.00 0.00 C ATOM 749 C SER A 45 12.896 5.529 -10.901 1.00 0.00 C ATOM 750 O SER A 45 13.430 6.418 -10.238 1.00 0.00 O ATOM 751 CB SER A 45 12.570 6.497 -13.185 1.00 0.00 C ATOM 752 OG SER A 45 13.387 5.552 -13.853 1.00 0.00 O ATOM 0 H SER A 45 11.194 7.466 -10.806 1.00 0.00 H new ATOM 0 HA SER A 45 11.384 4.943 -12.293 1.00 0.00 H new ATOM 0 HB2 SER A 45 11.825 6.891 -13.876 1.00 0.00 H new ATOM 0 HB3 SER A 45 13.178 7.340 -12.857 1.00 0.00 H new ATOM 0 HG SER A 45 13.821 5.980 -14.621 1.00 0.00 H new ATOM 758 N GLN A 46 13.166 4.239 -10.732 1.00 0.00 N ATOM 759 CA GLN A 46 14.127 3.784 -9.734 1.00 0.00 C ATOM 760 C GLN A 46 15.424 4.580 -9.824 1.00 0.00 C ATOM 761 O GLN A 46 16.174 4.675 -8.853 1.00 0.00 O ATOM 762 CB GLN A 46 14.416 2.293 -9.916 1.00 0.00 C ATOM 763 CG GLN A 46 14.835 1.593 -8.633 1.00 0.00 C ATOM 764 CD GLN A 46 15.549 0.281 -8.890 1.00 0.00 C ATOM 765 OE1 GLN A 46 16.651 0.258 -9.440 1.00 0.00 O ATOM 766 NE2 GLN A 46 14.925 -0.821 -8.493 1.00 0.00 N ATOM 0 H GLN A 46 12.733 3.490 -11.273 1.00 0.00 H new ATOM 0 HA GLN A 46 13.692 3.945 -8.748 1.00 0.00 H new ATOM 0 HB2 GLN A 46 13.526 1.805 -10.312 1.00 0.00 H new ATOM 0 HB3 GLN A 46 15.204 2.172 -10.660 1.00 0.00 H new ATOM 0 HG2 GLN A 46 15.488 2.252 -8.061 1.00 0.00 H new ATOM 0 HG3 GLN A 46 13.953 1.408 -8.020 1.00 0.00 H new ATOM 0 HE21 GLN A 46 14.013 -0.756 -8.041 1.00 0.00 H new ATOM 0 HE22 GLN A 46 15.358 -1.733 -8.640 1.00 0.00 H new ATOM 775 N ASP A 47 15.682 5.150 -10.996 1.00 0.00 N ATOM 776 CA ASP A 47 16.889 5.939 -11.214 1.00 0.00 C ATOM 777 C ASP A 47 16.834 7.244 -10.426 1.00 0.00 C ATOM 778 O ASP A 47 17.853 7.725 -9.932 1.00 0.00 O ATOM 779 CB ASP A 47 17.069 6.235 -12.703 1.00 0.00 C ATOM 780 CG ASP A 47 17.621 5.047 -13.467 1.00 0.00 C ATOM 781 OD1 ASP A 47 18.188 4.139 -12.823 1.00 0.00 O ATOM 782 OD2 ASP A 47 17.484 5.024 -14.708 1.00 0.00 O ATOM 0 H ASP A 47 15.071 5.080 -11.810 1.00 0.00 H new ATOM 0 HA ASP A 47 17.742 5.358 -10.862 1.00 0.00 H new ATOM 0 HB2 ASP A 47 16.110 6.525 -13.131 1.00 0.00 H new ATOM 0 HB3 ASP A 47 17.741 7.085 -12.823 1.00 0.00 H new ATOM 787 N GLU A 48 15.637 7.813 -10.315 1.00 0.00 N ATOM 788 CA GLU A 48 15.451 9.064 -9.590 1.00 0.00 C ATOM 789 C GLU A 48 15.600 8.848 -8.086 1.00 0.00 C ATOM 790 O GLU A 48 15.785 9.799 -7.328 1.00 0.00 O ATOM 791 CB GLU A 48 14.074 9.657 -9.897 1.00 0.00 C ATOM 792 CG GLU A 48 12.993 9.222 -8.922 1.00 0.00 C ATOM 793 CD GLU A 48 11.647 9.852 -9.224 1.00 0.00 C ATOM 794 OE1 GLU A 48 11.164 9.703 -10.366 1.00 0.00 O ATOM 795 OE2 GLU A 48 11.076 10.494 -8.317 1.00 0.00 O ATOM 0 H GLU A 48 14.783 7.427 -10.718 1.00 0.00 H new ATOM 0 HA GLU A 48 16.221 9.763 -9.918 1.00 0.00 H new ATOM 0 HB2 GLU A 48 14.145 10.745 -9.886 1.00 0.00 H new ATOM 0 HB3 GLU A 48 13.780 9.367 -10.906 1.00 0.00 H new ATOM 0 HG2 GLU A 48 12.897 8.137 -8.952 1.00 0.00 H new ATOM 0 HG3 GLU A 48 13.295 9.487 -7.909 1.00 0.00 H new ATOM 802 N ALA A 49 15.517 7.591 -7.664 1.00 0.00 N ATOM 803 CA ALA A 49 15.644 7.249 -6.253 1.00 0.00 C ATOM 804 C ALA A 49 17.057 6.776 -5.927 1.00 0.00 C ATOM 805 O ALA A 49 17.765 6.230 -6.774 1.00 0.00 O ATOM 806 CB ALA A 49 14.628 6.182 -5.874 1.00 0.00 C ATOM 0 H ALA A 49 15.362 6.792 -8.279 1.00 0.00 H new ATOM 0 HA ALA A 49 15.446 8.147 -5.669 1.00 0.00 H new ATOM 0 HB1 ALA A 49 14.735 5.937 -4.817 1.00 0.00 H new ATOM 0 HB2 ALA A 49 13.621 6.556 -6.060 1.00 0.00 H new ATOM 0 HB3 ALA A 49 14.799 5.288 -6.473 1.00 0.00 H new ATOM 812 N PRO A 50 17.479 6.990 -4.672 1.00 0.00 N ATOM 813 CA PRO A 50 16.645 7.639 -3.656 1.00 0.00 C ATOM 814 C PRO A 50 16.433 9.122 -3.942 1.00 0.00 C ATOM 815 O PRO A 50 15.306 9.613 -3.919 1.00 0.00 O ATOM 816 CB PRO A 50 17.448 7.452 -2.366 1.00 0.00 C ATOM 817 CG PRO A 50 18.861 7.310 -2.817 1.00 0.00 C ATOM 818 CD PRO A 50 18.803 6.614 -4.148 1.00 0.00 C ATOM 0 HA PRO A 50 15.643 7.211 -3.616 1.00 0.00 H new ATOM 0 HB2 PRO A 50 17.329 8.305 -1.698 1.00 0.00 H new ATOM 0 HB3 PRO A 50 17.117 6.570 -1.818 1.00 0.00 H new ATOM 0 HG2 PRO A 50 19.342 8.284 -2.907 1.00 0.00 H new ATOM 0 HG3 PRO A 50 19.443 6.732 -2.099 1.00 0.00 H new ATOM 0 HD2 PRO A 50 19.605 6.943 -4.809 1.00 0.00 H new ATOM 0 HD3 PRO A 50 18.901 5.534 -4.041 1.00 0.00 H new ATOM 826 N GLY A 51 17.526 9.831 -4.211 1.00 0.00 N ATOM 827 CA GLY A 51 17.437 11.250 -4.498 1.00 0.00 C ATOM 828 C GLY A 51 16.332 11.932 -3.715 1.00 0.00 C ATOM 829 O GLY A 51 16.450 12.130 -2.506 1.00 0.00 O ATOM 0 H GLY A 51 18.471 9.447 -4.235 1.00 0.00 H new ATOM 0 HA2 GLY A 51 18.390 11.725 -4.265 1.00 0.00 H new ATOM 0 HA3 GLY A 51 17.263 11.392 -5.565 1.00 0.00 H new ATOM 833 N ASP A 52 15.256 12.292 -4.406 1.00 0.00 N ATOM 834 CA ASP A 52 14.125 12.957 -3.768 1.00 0.00 C ATOM 835 C ASP A 52 12.804 12.419 -4.309 1.00 0.00 C ATOM 836 O ASP A 52 12.538 12.450 -5.510 1.00 0.00 O ATOM 837 CB ASP A 52 14.203 14.468 -3.989 1.00 0.00 C ATOM 838 CG ASP A 52 13.265 15.235 -3.078 1.00 0.00 C ATOM 839 OD1 ASP A 52 13.172 14.877 -1.886 1.00 0.00 O ATOM 840 OD2 ASP A 52 12.624 16.194 -3.558 1.00 0.00 O ATOM 0 H ASP A 52 15.143 12.135 -5.407 1.00 0.00 H new ATOM 0 HA ASP A 52 14.170 12.752 -2.698 1.00 0.00 H new ATOM 0 HB2 ASP A 52 15.226 14.805 -3.819 1.00 0.00 H new ATOM 0 HB3 ASP A 52 13.961 14.693 -5.028 1.00 0.00 H new ATOM 845 N PRO A 53 11.955 11.912 -3.402 1.00 0.00 N ATOM 846 CA PRO A 53 10.648 11.357 -3.764 1.00 0.00 C ATOM 847 C PRO A 53 9.669 12.432 -4.224 1.00 0.00 C ATOM 848 O PRO A 53 9.759 13.587 -3.805 1.00 0.00 O ATOM 849 CB PRO A 53 10.163 10.713 -2.463 1.00 0.00 C ATOM 850 CG PRO A 53 10.868 11.461 -1.384 1.00 0.00 C ATOM 851 CD PRO A 53 12.207 11.843 -1.953 1.00 0.00 C ATOM 0 HA PRO A 53 10.718 10.661 -4.600 1.00 0.00 H new ATOM 0 HB2 PRO A 53 9.081 10.795 -2.360 1.00 0.00 H new ATOM 0 HB3 PRO A 53 10.406 9.651 -2.432 1.00 0.00 H new ATOM 0 HG2 PRO A 53 10.303 12.345 -1.088 1.00 0.00 H new ATOM 0 HG3 PRO A 53 10.984 10.844 -0.493 1.00 0.00 H new ATOM 0 HD2 PRO A 53 12.553 12.799 -1.559 1.00 0.00 H new ATOM 0 HD3 PRO A 53 12.971 11.104 -1.713 1.00 0.00 H new ATOM 859 N ILE A 54 8.735 12.046 -5.086 1.00 0.00 N ATOM 860 CA ILE A 54 7.738 12.977 -5.600 1.00 0.00 C ATOM 861 C ILE A 54 6.961 13.633 -4.464 1.00 0.00 C ATOM 862 O ILE A 54 6.738 14.843 -4.470 1.00 0.00 O ATOM 863 CB ILE A 54 6.747 12.274 -6.547 1.00 0.00 C ATOM 864 CG1 ILE A 54 7.457 11.835 -7.829 1.00 0.00 C ATOM 865 CG2 ILE A 54 5.580 13.196 -6.870 1.00 0.00 C ATOM 866 CD1 ILE A 54 6.623 10.918 -8.697 1.00 0.00 C ATOM 0 H ILE A 54 8.648 11.095 -5.443 1.00 0.00 H new ATOM 0 HA ILE A 54 8.278 13.743 -6.156 1.00 0.00 H new ATOM 0 HB ILE A 54 6.357 11.387 -6.048 1.00 0.00 H new ATOM 0 HG12 ILE A 54 7.729 12.719 -8.405 1.00 0.00 H new ATOM 0 HG13 ILE A 54 8.385 11.328 -7.565 1.00 0.00 H new ATOM 0 HG21 ILE A 54 4.888 12.686 -7.540 1.00 0.00 H new ATOM 0 HG22 ILE A 54 5.062 13.464 -5.949 1.00 0.00 H new ATOM 0 HG23 ILE A 54 5.953 14.099 -7.353 1.00 0.00 H new ATOM 0 HD11 ILE A 54 7.189 10.647 -9.588 1.00 0.00 H new ATOM 0 HD12 ILE A 54 6.372 10.016 -8.138 1.00 0.00 H new ATOM 0 HD13 ILE A 54 5.706 11.429 -8.991 1.00 0.00 H new ATOM 878 N GLN A 55 6.553 12.826 -3.490 1.00 0.00 N ATOM 879 CA GLN A 55 5.801 13.329 -2.346 1.00 0.00 C ATOM 880 C GLN A 55 5.802 12.316 -1.206 1.00 0.00 C ATOM 881 O GLN A 55 5.110 11.300 -1.267 1.00 0.00 O ATOM 882 CB GLN A 55 4.364 13.653 -2.756 1.00 0.00 C ATOM 883 CG GLN A 55 3.740 14.781 -1.951 1.00 0.00 C ATOM 884 CD GLN A 55 2.228 14.693 -1.896 1.00 0.00 C ATOM 885 OE1 GLN A 55 1.572 14.444 -2.908 1.00 0.00 O ATOM 886 NE2 GLN A 55 1.665 14.897 -0.711 1.00 0.00 N ATOM 0 H GLN A 55 6.730 11.822 -3.470 1.00 0.00 H new ATOM 0 HA GLN A 55 6.285 14.241 -1.997 1.00 0.00 H new ATOM 0 HB2 GLN A 55 4.348 13.920 -3.813 1.00 0.00 H new ATOM 0 HB3 GLN A 55 3.753 12.757 -2.645 1.00 0.00 H new ATOM 0 HG2 GLN A 55 4.138 14.761 -0.937 1.00 0.00 H new ATOM 0 HG3 GLN A 55 4.029 15.737 -2.388 1.00 0.00 H new ATOM 0 HE21 GLN A 55 2.247 15.101 0.102 1.00 0.00 H new ATOM 0 HE22 GLN A 55 0.651 14.850 -0.613 1.00 0.00 H new ATOM 895 N GLN A 56 6.582 12.601 -0.169 1.00 0.00 N ATOM 896 CA GLN A 56 6.672 11.713 0.984 1.00 0.00 C ATOM 897 C GLN A 56 5.486 11.915 1.922 1.00 0.00 C ATOM 898 O GLN A 56 5.006 13.036 2.099 1.00 0.00 O ATOM 899 CB GLN A 56 7.981 11.954 1.739 1.00 0.00 C ATOM 900 CG GLN A 56 8.138 13.379 2.244 1.00 0.00 C ATOM 901 CD GLN A 56 9.544 13.676 2.726 1.00 0.00 C ATOM 902 OE1 GLN A 56 10.334 12.764 2.973 1.00 0.00 O ATOM 903 NE2 GLN A 56 9.866 14.957 2.861 1.00 0.00 N ATOM 0 H GLN A 56 7.160 13.439 -0.103 1.00 0.00 H new ATOM 0 HA GLN A 56 6.653 10.685 0.621 1.00 0.00 H new ATOM 0 HB2 GLN A 56 8.034 11.269 2.586 1.00 0.00 H new ATOM 0 HB3 GLN A 56 8.818 11.715 1.083 1.00 0.00 H new ATOM 0 HG2 GLN A 56 7.877 14.074 1.446 1.00 0.00 H new ATOM 0 HG3 GLN A 56 7.435 13.551 3.059 1.00 0.00 H new ATOM 0 HE21 GLN A 56 9.180 15.681 2.645 1.00 0.00 H new ATOM 0 HE22 GLN A 56 10.799 15.217 3.180 1.00 0.00 H new ATOM 912 N LEU A 57 5.018 10.825 2.520 1.00 0.00 N ATOM 913 CA LEU A 57 3.888 10.883 3.439 1.00 0.00 C ATOM 914 C LEU A 57 4.097 9.940 4.620 1.00 0.00 C ATOM 915 O LEU A 57 4.702 8.878 4.478 1.00 0.00 O ATOM 916 CB LEU A 57 2.592 10.524 2.709 1.00 0.00 C ATOM 917 CG LEU A 57 2.510 10.947 1.242 1.00 0.00 C ATOM 918 CD1 LEU A 57 3.135 9.889 0.346 1.00 0.00 C ATOM 919 CD2 LEU A 57 1.064 11.201 0.840 1.00 0.00 C ATOM 0 H LEU A 57 5.404 9.891 2.385 1.00 0.00 H new ATOM 0 HA LEU A 57 3.814 11.902 3.820 1.00 0.00 H new ATOM 0 HB2 LEU A 57 2.455 9.444 2.763 1.00 0.00 H new ATOM 0 HB3 LEU A 57 1.759 10.978 3.245 1.00 0.00 H new ATOM 0 HG LEU A 57 3.069 11.875 1.120 1.00 0.00 H new ATOM 0 HD11 LEU A 57 3.067 10.207 -0.694 1.00 0.00 H new ATOM 0 HD12 LEU A 57 4.182 9.755 0.617 1.00 0.00 H new ATOM 0 HD13 LEU A 57 2.604 8.946 0.472 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.025 11.501 -0.207 1.00 0.00 H new ATOM 0 HD22 LEU A 57 0.482 10.290 0.978 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.648 11.995 1.461 1.00 0.00 H new ATOM 931 N ASN A 58 3.591 10.335 5.783 1.00 0.00 N ATOM 932 CA ASN A 58 3.721 9.524 6.988 1.00 0.00 C ATOM 933 C ASN A 58 2.405 8.828 7.320 1.00 0.00 C ATOM 934 O ASN A 58 1.453 9.461 7.777 1.00 0.00 O ATOM 935 CB ASN A 58 4.164 10.392 8.168 1.00 0.00 C ATOM 936 CG ASN A 58 3.407 11.705 8.234 1.00 0.00 C ATOM 937 OD1 ASN A 58 3.685 12.633 7.475 1.00 0.00 O ATOM 938 ND2 ASN A 58 2.446 11.788 9.146 1.00 0.00 N ATOM 0 H ASN A 58 3.087 11.212 5.917 1.00 0.00 H new ATOM 0 HA ASN A 58 4.478 8.762 6.802 1.00 0.00 H new ATOM 0 HB2 ASN A 58 4.014 9.842 9.097 1.00 0.00 H new ATOM 0 HB3 ASN A 58 5.232 10.595 8.086 1.00 0.00 H new ATOM 0 HD21 ASN A 58 1.903 12.647 9.238 1.00 0.00 H new ATOM 0 HD22 ASN A 58 2.250 10.993 9.754 1.00 0.00 H new ATOM 945 N LEU A 59 2.359 7.520 7.089 1.00 0.00 N ATOM 946 CA LEU A 59 1.160 6.736 7.365 1.00 0.00 C ATOM 947 C LEU A 59 0.618 7.041 8.757 1.00 0.00 C ATOM 948 O LEU A 59 -0.572 6.870 9.024 1.00 0.00 O ATOM 949 CB LEU A 59 1.463 5.242 7.238 1.00 0.00 C ATOM 950 CG LEU A 59 1.579 4.699 5.814 1.00 0.00 C ATOM 951 CD1 LEU A 59 2.371 3.401 5.801 1.00 0.00 C ATOM 952 CD2 LEU A 59 0.199 4.490 5.208 1.00 0.00 C ATOM 0 H LEU A 59 3.138 6.980 6.711 1.00 0.00 H new ATOM 0 HA LEU A 59 0.401 7.009 6.633 1.00 0.00 H new ATOM 0 HB2 LEU A 59 2.397 5.035 7.761 1.00 0.00 H new ATOM 0 HB3 LEU A 59 0.679 4.688 7.754 1.00 0.00 H new ATOM 0 HG LEU A 59 2.112 5.432 5.209 1.00 0.00 H new ATOM 0 HD11 LEU A 59 2.443 3.029 4.779 1.00 0.00 H new ATOM 0 HD12 LEU A 59 3.372 3.582 6.193 1.00 0.00 H new ATOM 0 HD13 LEU A 59 1.866 2.661 6.422 1.00 0.00 H new ATOM 0 HD21 LEU A 59 0.302 4.103 4.194 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -0.360 3.777 5.814 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -0.334 5.440 5.181 1.00 0.00 H new ATOM 964 N LYS A 60 1.498 7.495 9.643 1.00 0.00 N ATOM 965 CA LYS A 60 1.109 7.828 11.008 1.00 0.00 C ATOM 966 C LYS A 60 0.171 9.031 11.029 1.00 0.00 C ATOM 967 O LYS A 60 0.603 10.170 10.858 1.00 0.00 O ATOM 968 CB LYS A 60 2.349 8.120 11.857 1.00 0.00 C ATOM 969 CG LYS A 60 2.945 6.883 12.506 1.00 0.00 C ATOM 970 CD LYS A 60 3.680 7.228 13.791 1.00 0.00 C ATOM 971 CE LYS A 60 5.122 7.626 13.520 1.00 0.00 C ATOM 972 NZ LYS A 60 5.240 9.065 13.154 1.00 0.00 N ATOM 0 H LYS A 60 2.487 7.641 9.440 1.00 0.00 H new ATOM 0 HA LYS A 60 0.582 6.971 11.428 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.106 8.592 11.230 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.086 8.838 12.634 1.00 0.00 H new ATOM 0 HG2 LYS A 60 2.153 6.166 12.720 1.00 0.00 H new ATOM 0 HG3 LYS A 60 3.632 6.401 11.811 1.00 0.00 H new ATOM 0 HD2 LYS A 60 3.165 8.045 14.297 1.00 0.00 H new ATOM 0 HD3 LYS A 60 3.659 6.371 14.465 1.00 0.00 H new ATOM 0 HE2 LYS A 60 5.727 7.425 14.404 1.00 0.00 H new ATOM 0 HE3 LYS A 60 5.523 7.012 12.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 6.226 9.374 13.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.954 9.196 12.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 4.622 9.632 13.770 1.00 0.00 H new ATOM 986 N GLY A 61 -1.115 8.769 11.240 1.00 0.00 N ATOM 987 CA GLY A 61 -2.093 9.841 11.281 1.00 0.00 C ATOM 988 C GLY A 61 -2.873 9.964 9.986 1.00 0.00 C ATOM 989 O GLY A 61 -3.391 11.034 9.665 1.00 0.00 O ATOM 0 H GLY A 61 -1.497 7.834 11.383 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -2.786 9.665 12.104 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -1.586 10.784 11.487 1.00 0.00 H new ATOM 993 N CYS A 62 -2.955 8.867 9.241 1.00 0.00 N ATOM 994 CA CYS A 62 -3.676 8.857 7.973 1.00 0.00 C ATOM 995 C CYS A 62 -4.925 7.987 8.065 1.00 0.00 C ATOM 996 O CYS A 62 -5.207 7.398 9.107 1.00 0.00 O ATOM 997 CB CYS A 62 -2.768 8.350 6.851 1.00 0.00 C ATOM 998 SG CYS A 62 -2.436 6.573 6.916 1.00 0.00 S ATOM 0 H CYS A 62 -2.532 7.974 9.493 1.00 0.00 H new ATOM 0 HA CYS A 62 -3.983 9.879 7.749 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -3.227 8.588 5.891 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -1.821 8.888 6.894 1.00 0.00 H new ATOM 0 HG CYS A 62 -1.542 6.332 7.828 1.00 0.00 H new ATOM 1004 N GLU A 63 -5.671 7.915 6.967 1.00 0.00 N ATOM 1005 CA GLU A 63 -6.893 7.119 6.925 1.00 0.00 C ATOM 1006 C GLU A 63 -6.698 5.868 6.074 1.00 0.00 C ATOM 1007 O GLU A 63 -5.869 5.844 5.164 1.00 0.00 O ATOM 1008 CB GLU A 63 -8.051 7.951 6.370 1.00 0.00 C ATOM 1009 CG GLU A 63 -9.421 7.375 6.687 1.00 0.00 C ATOM 1010 CD GLU A 63 -10.518 8.421 6.642 1.00 0.00 C ATOM 1011 OE1 GLU A 63 -10.288 9.543 7.140 1.00 0.00 O ATOM 1012 OE2 GLU A 63 -11.606 8.118 6.109 1.00 0.00 O ATOM 0 H GLU A 63 -5.451 8.397 6.096 1.00 0.00 H new ATOM 0 HA GLU A 63 -7.131 6.812 7.943 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -7.988 8.961 6.775 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -7.942 8.034 5.289 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -9.651 6.582 5.976 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -9.399 6.919 7.677 1.00 0.00 H new ATOM 1019 N VAL A 64 -7.468 4.827 6.377 1.00 0.00 N ATOM 1020 CA VAL A 64 -7.382 3.572 5.641 1.00 0.00 C ATOM 1021 C VAL A 64 -8.760 2.948 5.455 1.00 0.00 C ATOM 1022 O VAL A 64 -9.455 2.651 6.426 1.00 0.00 O ATOM 1023 CB VAL A 64 -6.466 2.562 6.358 1.00 0.00 C ATOM 1024 CG1 VAL A 64 -6.433 1.242 5.604 1.00 0.00 C ATOM 1025 CG2 VAL A 64 -5.064 3.132 6.513 1.00 0.00 C ATOM 0 H VAL A 64 -8.159 4.829 7.128 1.00 0.00 H new ATOM 0 HA VAL A 64 -6.958 3.807 4.665 1.00 0.00 H new ATOM 0 HB VAL A 64 -6.870 2.374 7.353 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -5.781 0.541 6.125 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -7.440 0.829 5.550 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -6.054 1.408 4.596 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -4.430 2.406 7.021 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -4.649 3.350 5.529 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -5.107 4.050 7.100 1.00 0.00 H new ATOM 1035 N VAL A 65 -9.150 2.751 4.199 1.00 0.00 N ATOM 1036 CA VAL A 65 -10.446 2.160 3.885 1.00 0.00 C ATOM 1037 C VAL A 65 -10.288 0.923 3.009 1.00 0.00 C ATOM 1038 O VAL A 65 -10.126 1.011 1.791 1.00 0.00 O ATOM 1039 CB VAL A 65 -11.364 3.169 3.169 1.00 0.00 C ATOM 1040 CG1 VAL A 65 -12.799 2.664 3.148 1.00 0.00 C ATOM 1041 CG2 VAL A 65 -11.279 4.533 3.837 1.00 0.00 C ATOM 0 H VAL A 65 -8.587 2.992 3.383 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.902 1.874 4.833 1.00 0.00 H new ATOM 0 HB VAL A 65 -11.026 3.273 2.138 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -13.433 3.390 2.638 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -12.842 1.711 2.620 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -13.152 2.529 4.170 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -11.934 5.233 3.318 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -11.590 4.448 4.878 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -10.252 4.896 3.794 1.00 0.00 H new ATOM 1051 N PRO A 66 -10.335 -0.259 3.640 1.00 0.00 N ATOM 1052 CA PRO A 66 -10.199 -1.538 2.937 1.00 0.00 C ATOM 1053 C PRO A 66 -11.408 -1.848 2.060 1.00 0.00 C ATOM 1054 O PRO A 66 -12.498 -2.121 2.562 1.00 0.00 O ATOM 1055 CB PRO A 66 -10.088 -2.558 4.073 1.00 0.00 C ATOM 1056 CG PRO A 66 -10.776 -1.915 5.228 1.00 0.00 C ATOM 1057 CD PRO A 66 -10.524 -0.439 5.089 1.00 0.00 C ATOM 0 HA PRO A 66 -9.346 -1.541 2.258 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -10.562 -3.502 3.805 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -9.046 -2.779 4.306 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -11.844 -2.132 5.216 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -10.385 -2.291 6.174 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -11.364 0.149 5.461 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -9.643 -0.127 5.651 1.00 0.00 H new ATOM 1065 N ASP A 67 -11.207 -1.805 0.747 1.00 0.00 N ATOM 1066 CA ASP A 67 -12.280 -2.082 -0.200 1.00 0.00 C ATOM 1067 C ASP A 67 -12.210 -3.525 -0.693 1.00 0.00 C ATOM 1068 O ASP A 67 -12.513 -3.812 -1.851 1.00 0.00 O ATOM 1069 CB ASP A 67 -12.202 -1.121 -1.387 1.00 0.00 C ATOM 1070 CG ASP A 67 -12.958 0.170 -1.137 1.00 0.00 C ATOM 1071 OD1 ASP A 67 -13.059 0.579 0.038 1.00 0.00 O ATOM 1072 OD2 ASP A 67 -13.447 0.770 -2.117 1.00 0.00 O ATOM 0 H ASP A 67 -10.311 -1.581 0.315 1.00 0.00 H new ATOM 0 HA ASP A 67 -13.231 -1.937 0.313 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -11.157 -0.892 -1.597 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -12.606 -1.610 -2.274 1.00 0.00 H new ATOM 1077 N VAL A 68 -11.809 -4.429 0.195 1.00 0.00 N ATOM 1078 CA VAL A 68 -11.700 -5.842 -0.148 1.00 0.00 C ATOM 1079 C VAL A 68 -13.065 -6.434 -0.479 1.00 0.00 C ATOM 1080 O VAL A 68 -13.991 -6.374 0.329 1.00 0.00 O ATOM 1081 CB VAL A 68 -11.065 -6.651 0.998 1.00 0.00 C ATOM 1082 CG1 VAL A 68 -11.066 -8.136 0.668 1.00 0.00 C ATOM 1083 CG2 VAL A 68 -9.653 -6.159 1.278 1.00 0.00 C ATOM 0 H VAL A 68 -11.554 -4.208 1.158 1.00 0.00 H new ATOM 0 HA VAL A 68 -11.057 -5.906 -1.026 1.00 0.00 H new ATOM 0 HB VAL A 68 -11.662 -6.503 1.898 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -10.613 -8.692 1.489 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -12.091 -8.476 0.522 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -10.494 -8.306 -0.244 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -9.219 -6.742 2.091 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -9.043 -6.275 0.382 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -9.684 -5.107 1.562 1.00 0.00 H new ATOM 1093 N ASN A 69 -13.182 -7.008 -1.672 1.00 0.00 N ATOM 1094 CA ASN A 69 -14.435 -7.612 -2.110 1.00 0.00 C ATOM 1095 C ASN A 69 -14.214 -9.048 -2.574 1.00 0.00 C ATOM 1096 O ASN A 69 -13.978 -9.302 -3.755 1.00 0.00 O ATOM 1097 CB ASN A 69 -15.054 -6.789 -3.241 1.00 0.00 C ATOM 1098 CG ASN A 69 -16.501 -7.163 -3.504 1.00 0.00 C ATOM 1099 OD1 ASN A 69 -16.822 -8.331 -3.722 1.00 0.00 O ATOM 1100 ND2 ASN A 69 -17.381 -6.169 -3.484 1.00 0.00 N ATOM 0 H ASN A 69 -12.425 -7.068 -2.352 1.00 0.00 H new ATOM 0 HA ASN A 69 -15.119 -7.624 -1.262 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -14.995 -5.730 -2.990 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -14.473 -6.934 -4.152 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -18.369 -6.359 -3.654 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -17.069 -5.216 -3.299 1.00 0.00 H new ATOM 1107 N VAL A 70 -14.291 -9.986 -1.635 1.00 0.00 N ATOM 1108 CA VAL A 70 -14.101 -11.398 -1.946 1.00 0.00 C ATOM 1109 C VAL A 70 -14.995 -11.830 -3.103 1.00 0.00 C ATOM 1110 O VAL A 70 -14.575 -12.593 -3.973 1.00 0.00 O ATOM 1111 CB VAL A 70 -14.395 -12.287 -0.724 1.00 0.00 C ATOM 1112 CG1 VAL A 70 -14.265 -13.758 -1.089 1.00 0.00 C ATOM 1113 CG2 VAL A 70 -13.468 -11.932 0.429 1.00 0.00 C ATOM 0 H VAL A 70 -14.484 -9.793 -0.652 1.00 0.00 H new ATOM 0 HA VAL A 70 -13.056 -11.522 -2.232 1.00 0.00 H new ATOM 0 HB VAL A 70 -15.421 -12.106 -0.404 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -14.476 -14.370 -0.212 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -14.974 -14.000 -1.881 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -13.251 -13.959 -1.436 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -13.690 -12.570 1.284 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -12.433 -12.082 0.123 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -13.616 -10.889 0.707 1.00 0.00 H new ATOM 1123 N SER A 71 -16.229 -11.338 -3.106 1.00 0.00 N ATOM 1124 CA SER A 71 -17.185 -11.676 -4.154 1.00 0.00 C ATOM 1125 C SER A 71 -16.516 -11.657 -5.525 1.00 0.00 C ATOM 1126 O SER A 71 -16.828 -12.473 -6.392 1.00 0.00 O ATOM 1127 CB SER A 71 -18.362 -10.700 -4.134 1.00 0.00 C ATOM 1128 OG SER A 71 -19.543 -11.315 -4.618 1.00 0.00 O ATOM 0 H SER A 71 -16.591 -10.703 -2.394 1.00 0.00 H new ATOM 0 HA SER A 71 -17.555 -12.683 -3.964 1.00 0.00 H new ATOM 0 HB2 SER A 71 -18.525 -10.343 -3.117 1.00 0.00 H new ATOM 0 HB3 SER A 71 -18.126 -9.828 -4.744 1.00 0.00 H new ATOM 0 HG SER A 71 -20.281 -10.671 -4.593 1.00 0.00 H new ATOM 1134 N GLY A 72 -15.593 -10.719 -5.714 1.00 0.00 N ATOM 1135 CA GLY A 72 -14.895 -10.609 -6.981 1.00 0.00 C ATOM 1136 C GLY A 72 -13.389 -10.681 -6.821 1.00 0.00 C ATOM 1137 O GLY A 72 -12.652 -9.979 -7.512 1.00 0.00 O ATOM 0 H GLY A 72 -15.316 -10.033 -5.012 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -15.225 -11.408 -7.645 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -15.162 -9.666 -7.459 1.00 0.00 H new ATOM 1141 N GLN A 73 -12.932 -11.530 -5.906 1.00 0.00 N ATOM 1142 CA GLN A 73 -11.505 -11.688 -5.656 1.00 0.00 C ATOM 1143 C GLN A 73 -10.774 -10.359 -5.817 1.00 0.00 C ATOM 1144 O GLN A 73 -9.662 -10.309 -6.343 1.00 0.00 O ATOM 1145 CB GLN A 73 -10.911 -12.728 -6.607 1.00 0.00 C ATOM 1146 CG GLN A 73 -11.578 -14.091 -6.512 1.00 0.00 C ATOM 1147 CD GLN A 73 -11.403 -14.732 -5.150 1.00 0.00 C ATOM 1148 OE1 GLN A 73 -10.283 -15.010 -4.721 1.00 0.00 O ATOM 1149 NE2 GLN A 73 -12.513 -14.971 -4.460 1.00 0.00 N ATOM 0 H GLN A 73 -13.530 -12.119 -5.326 1.00 0.00 H new ATOM 0 HA GLN A 73 -11.378 -12.030 -4.629 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -10.995 -12.362 -7.630 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -9.848 -12.838 -6.394 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -12.642 -13.987 -6.726 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -11.162 -14.749 -7.275 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -13.421 -14.724 -4.854 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -12.457 -15.401 -3.537 1.00 0.00 H new ATOM 1158 N LYS A 74 -11.406 -9.283 -5.361 1.00 0.00 N ATOM 1159 CA LYS A 74 -10.816 -7.952 -5.453 1.00 0.00 C ATOM 1160 C LYS A 74 -10.077 -7.595 -4.167 1.00 0.00 C ATOM 1161 O LYS A 74 -10.530 -7.917 -3.069 1.00 0.00 O ATOM 1162 CB LYS A 74 -11.900 -6.910 -5.738 1.00 0.00 C ATOM 1163 CG LYS A 74 -11.373 -5.488 -5.808 1.00 0.00 C ATOM 1164 CD LYS A 74 -12.493 -4.470 -5.670 1.00 0.00 C ATOM 1165 CE LYS A 74 -13.083 -4.104 -7.024 1.00 0.00 C ATOM 1166 NZ LYS A 74 -14.119 -5.080 -7.460 1.00 0.00 N ATOM 0 H LYS A 74 -12.327 -9.306 -4.924 1.00 0.00 H new ATOM 0 HA LYS A 74 -10.099 -7.955 -6.274 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -12.388 -7.154 -6.681 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -12.662 -6.968 -4.961 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -10.639 -5.332 -5.018 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -10.857 -5.337 -6.756 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -13.276 -4.873 -5.028 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -12.112 -3.572 -5.183 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -13.522 -3.108 -6.971 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -12.287 -4.063 -7.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -14.745 -4.632 -8.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -13.658 -5.908 -7.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -14.679 -5.382 -6.638 1.00 0.00 H new ATOM 1180 N PHE A 75 -8.939 -6.925 -4.311 1.00 0.00 N ATOM 1181 CA PHE A 75 -8.137 -6.523 -3.161 1.00 0.00 C ATOM 1182 C PHE A 75 -7.477 -5.169 -3.405 1.00 0.00 C ATOM 1183 O PHE A 75 -6.556 -5.053 -4.215 1.00 0.00 O ATOM 1184 CB PHE A 75 -7.070 -7.578 -2.863 1.00 0.00 C ATOM 1185 CG PHE A 75 -7.624 -8.965 -2.712 1.00 0.00 C ATOM 1186 CD1 PHE A 75 -8.339 -9.321 -1.580 1.00 0.00 C ATOM 1187 CD2 PHE A 75 -7.429 -9.914 -3.703 1.00 0.00 C ATOM 1188 CE1 PHE A 75 -8.851 -10.598 -1.439 1.00 0.00 C ATOM 1189 CE2 PHE A 75 -7.939 -11.192 -3.567 1.00 0.00 C ATOM 1190 CZ PHE A 75 -8.650 -11.534 -2.433 1.00 0.00 C ATOM 0 H PHE A 75 -8.551 -6.649 -5.213 1.00 0.00 H new ATOM 0 HA PHE A 75 -8.800 -6.434 -2.300 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -6.333 -7.575 -3.666 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -6.545 -7.304 -1.948 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -8.498 -8.593 -0.799 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -6.873 -9.653 -4.591 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -9.408 -10.862 -0.552 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -7.782 -11.922 -4.347 1.00 0.00 H new ATOM 0 HZ PHE A 75 -9.048 -12.532 -2.325 1.00 0.00 H new ATOM 1200 N CYS A 76 -7.954 -4.149 -2.700 1.00 0.00 N ATOM 1201 CA CYS A 76 -7.411 -2.803 -2.840 1.00 0.00 C ATOM 1202 C CYS A 76 -7.239 -2.141 -1.477 1.00 0.00 C ATOM 1203 O CYS A 76 -7.934 -2.481 -0.519 1.00 0.00 O ATOM 1204 CB CYS A 76 -8.326 -1.951 -3.722 1.00 0.00 C ATOM 1205 SG CYS A 76 -7.925 -2.018 -5.484 1.00 0.00 S ATOM 0 H CYS A 76 -8.715 -4.229 -2.026 1.00 0.00 H new ATOM 0 HA CYS A 76 -6.432 -2.880 -3.312 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -9.356 -2.279 -3.582 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -8.273 -0.915 -3.388 1.00 0.00 H new ATOM 0 HG CYS A 76 -8.755 -1.268 -6.147 1.00 0.00 H new ATOM 1211 N ILE A 77 -6.308 -1.197 -1.397 1.00 0.00 N ATOM 1212 CA ILE A 77 -6.044 -0.489 -0.150 1.00 0.00 C ATOM 1213 C ILE A 77 -6.187 1.018 -0.333 1.00 0.00 C ATOM 1214 O ILE A 77 -5.223 1.709 -0.664 1.00 0.00 O ATOM 1215 CB ILE A 77 -4.633 -0.798 0.385 1.00 0.00 C ATOM 1216 CG1 ILE A 77 -4.427 -2.310 0.498 1.00 0.00 C ATOM 1217 CG2 ILE A 77 -4.420 -0.127 1.734 1.00 0.00 C ATOM 1218 CD1 ILE A 77 -2.999 -2.704 0.803 1.00 0.00 C ATOM 0 H ILE A 77 -5.724 -0.904 -2.180 1.00 0.00 H new ATOM 0 HA ILE A 77 -6.782 -0.837 0.573 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.899 -0.401 -0.317 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -5.078 -2.700 1.281 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.734 -2.781 -0.436 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -3.419 -0.354 2.099 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -4.530 0.952 1.625 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -5.158 -0.497 2.445 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -2.927 -3.790 0.869 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -2.345 -2.345 0.009 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -2.694 -2.262 1.752 1.00 0.00 H new ATOM 1230 N LYS A 78 -7.396 1.523 -0.115 1.00 0.00 N ATOM 1231 CA LYS A 78 -7.667 2.949 -0.253 1.00 0.00 C ATOM 1232 C LYS A 78 -6.871 3.755 0.769 1.00 0.00 C ATOM 1233 O LYS A 78 -7.188 3.752 1.960 1.00 0.00 O ATOM 1234 CB LYS A 78 -9.163 3.224 -0.082 1.00 0.00 C ATOM 1235 CG LYS A 78 -9.578 4.618 -0.518 1.00 0.00 C ATOM 1236 CD LYS A 78 -10.826 5.083 0.214 1.00 0.00 C ATOM 1237 CE LYS A 78 -11.618 6.084 -0.614 1.00 0.00 C ATOM 1238 NZ LYS A 78 -12.591 6.845 0.218 1.00 0.00 N ATOM 0 H LYS A 78 -8.205 0.965 0.158 1.00 0.00 H new ATOM 0 HA LYS A 78 -7.359 3.257 -1.252 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -9.727 2.490 -0.657 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -9.432 3.084 0.965 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -8.763 5.317 -0.330 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -9.762 4.625 -1.592 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -11.454 4.223 0.446 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -10.544 5.537 1.164 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -10.932 6.779 -1.097 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -12.151 5.559 -1.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -12.731 7.792 -0.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -13.500 6.340 0.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -12.223 6.936 1.186 1.00 0.00 H new ATOM 1252 N LEU A 79 -5.838 4.445 0.298 1.00 0.00 N ATOM 1253 CA LEU A 79 -4.998 5.257 1.171 1.00 0.00 C ATOM 1254 C LEU A 79 -5.398 6.727 1.098 1.00 0.00 C ATOM 1255 O LEU A 79 -5.357 7.341 0.031 1.00 0.00 O ATOM 1256 CB LEU A 79 -3.526 5.098 0.786 1.00 0.00 C ATOM 1257 CG LEU A 79 -2.515 5.249 1.924 1.00 0.00 C ATOM 1258 CD1 LEU A 79 -2.837 4.285 3.055 1.00 0.00 C ATOM 1259 CD2 LEU A 79 -1.100 5.021 1.413 1.00 0.00 C ATOM 0 H LEU A 79 -5.562 4.458 -0.684 1.00 0.00 H new ATOM 0 HA LEU A 79 -5.139 4.911 2.195 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.393 4.114 0.337 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.291 5.834 0.017 1.00 0.00 H new ATOM 0 HG LEU A 79 -2.581 6.266 2.311 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -2.107 4.407 3.856 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -3.835 4.495 3.439 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.799 3.261 2.682 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.394 5.132 2.236 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.020 4.016 1.000 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -0.871 5.752 0.637 1.00 0.00 H new ATOM 1271 N LEU A 80 -5.784 7.286 2.240 1.00 0.00 N ATOM 1272 CA LEU A 80 -6.190 8.686 2.307 1.00 0.00 C ATOM 1273 C LEU A 80 -5.442 9.417 3.418 1.00 0.00 C ATOM 1274 O LEU A 80 -5.820 9.344 4.587 1.00 0.00 O ATOM 1275 CB LEU A 80 -7.698 8.790 2.538 1.00 0.00 C ATOM 1276 CG LEU A 80 -8.571 8.793 1.283 1.00 0.00 C ATOM 1277 CD1 LEU A 80 -9.997 8.387 1.623 1.00 0.00 C ATOM 1278 CD2 LEU A 80 -8.548 10.164 0.621 1.00 0.00 C ATOM 0 H LEU A 80 -5.824 6.792 3.131 1.00 0.00 H new ATOM 0 HA LEU A 80 -5.941 9.157 1.356 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -8.007 7.957 3.169 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -7.897 9.704 3.097 1.00 0.00 H new ATOM 0 HG LEU A 80 -8.166 8.065 0.580 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -10.603 8.395 0.717 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -9.998 7.385 2.051 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -10.413 9.090 2.344 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -9.175 10.148 -0.271 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -8.928 10.911 1.318 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -7.525 10.416 0.341 1.00 0.00 H new ATOM 1290 N VAL A 81 -4.380 10.124 3.043 1.00 0.00 N ATOM 1291 CA VAL A 81 -3.581 10.872 4.007 1.00 0.00 C ATOM 1292 C VAL A 81 -3.942 12.353 3.989 1.00 0.00 C ATOM 1293 O VAL A 81 -4.066 12.974 2.933 1.00 0.00 O ATOM 1294 CB VAL A 81 -2.075 10.718 3.726 1.00 0.00 C ATOM 1295 CG1 VAL A 81 -1.260 11.514 4.734 1.00 0.00 C ATOM 1296 CG2 VAL A 81 -1.676 9.250 3.746 1.00 0.00 C ATOM 0 H VAL A 81 -4.053 10.194 2.079 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.804 10.459 4.991 1.00 0.00 H new ATOM 0 HB VAL A 81 -1.866 11.114 2.732 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -0.198 11.393 4.520 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.526 12.569 4.666 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -1.471 11.151 5.740 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -0.608 9.160 3.545 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -1.898 8.826 4.725 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -2.235 8.711 2.982 1.00 0.00 H new ATOM 1306 N PRO A 82 -4.115 12.934 5.185 1.00 0.00 N ATOM 1307 CA PRO A 82 -4.464 14.350 5.334 1.00 0.00 C ATOM 1308 C PRO A 82 -3.316 15.274 4.941 1.00 0.00 C ATOM 1309 O PRO A 82 -2.151 14.980 5.209 1.00 0.00 O ATOM 1310 CB PRO A 82 -4.771 14.485 6.827 1.00 0.00 C ATOM 1311 CG PRO A 82 -4.000 13.387 7.474 1.00 0.00 C ATOM 1312 CD PRO A 82 -3.983 12.254 6.485 1.00 0.00 C ATOM 0 HA PRO A 82 -5.293 14.635 4.687 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -4.466 15.460 7.207 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -5.839 14.387 7.022 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -2.987 13.710 7.714 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -4.467 13.081 8.410 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -3.058 11.681 6.547 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -4.802 11.557 6.659 1.00 0.00 H new ATOM 1320 N SER A 83 -3.652 16.392 4.306 1.00 0.00 N ATOM 1321 CA SER A 83 -2.649 17.357 3.873 1.00 0.00 C ATOM 1322 C SER A 83 -3.075 18.779 4.226 1.00 0.00 C ATOM 1323 O SER A 83 -4.245 19.147 4.123 1.00 0.00 O ATOM 1324 CB SER A 83 -2.416 17.242 2.366 1.00 0.00 C ATOM 1325 OG SER A 83 -1.614 16.114 2.058 1.00 0.00 O ATOM 0 H SER A 83 -4.612 16.652 4.080 1.00 0.00 H new ATOM 0 HA SER A 83 -1.718 17.135 4.395 1.00 0.00 H new ATOM 0 HB2 SER A 83 -3.374 17.162 1.852 1.00 0.00 H new ATOM 0 HB3 SER A 83 -1.932 18.147 2.000 1.00 0.00 H new ATOM 0 HG SER A 83 -1.481 16.062 1.088 1.00 0.00 H new ATOM 1331 N PRO A 84 -2.103 19.598 4.653 1.00 0.00 N ATOM 1332 CA PRO A 84 -2.352 20.993 5.030 1.00 0.00 C ATOM 1333 C PRO A 84 -2.694 21.866 3.827 1.00 0.00 C ATOM 1334 O PRO A 84 -3.034 23.039 3.978 1.00 0.00 O ATOM 1335 CB PRO A 84 -1.024 21.435 5.650 1.00 0.00 C ATOM 1336 CG PRO A 84 -0.002 20.546 5.031 1.00 0.00 C ATOM 1337 CD PRO A 84 -0.685 19.227 4.800 1.00 0.00 C ATOM 0 HA PRO A 84 -3.205 21.088 5.702 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -0.817 22.484 5.437 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -1.038 21.327 6.735 1.00 0.00 H new ATOM 0 HG2 PRO A 84 0.364 20.965 4.094 1.00 0.00 H new ATOM 0 HG3 PRO A 84 0.861 20.429 5.686 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -0.305 18.729 3.908 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -0.533 18.544 5.636 1.00 0.00 H new ATOM 1345 N GLU A 85 -2.604 21.285 2.635 1.00 0.00 N ATOM 1346 CA GLU A 85 -2.905 22.012 1.407 1.00 0.00 C ATOM 1347 C GLU A 85 -4.039 21.339 0.641 1.00 0.00 C ATOM 1348 O GLU A 85 -4.635 21.933 -0.257 1.00 0.00 O ATOM 1349 CB GLU A 85 -1.659 22.101 0.523 1.00 0.00 C ATOM 1350 CG GLU A 85 -0.486 22.798 1.192 1.00 0.00 C ATOM 1351 CD GLU A 85 0.834 22.507 0.505 1.00 0.00 C ATOM 1352 OE1 GLU A 85 1.491 21.513 0.879 1.00 0.00 O ATOM 1353 OE2 GLU A 85 1.211 23.273 -0.407 1.00 0.00 O ATOM 0 H GLU A 85 -2.325 20.314 2.493 1.00 0.00 H new ATOM 0 HA GLU A 85 -3.221 23.019 1.679 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -1.356 21.095 0.234 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -1.912 22.633 -0.394 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -0.661 23.874 1.194 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -0.427 22.482 2.234 1.00 0.00 H new ATOM 1360 N GLY A 86 -4.332 20.093 1.001 1.00 0.00 N ATOM 1361 CA GLY A 86 -5.394 19.359 0.338 1.00 0.00 C ATOM 1362 C GLY A 86 -5.502 17.928 0.827 1.00 0.00 C ATOM 1363 O GLY A 86 -5.579 17.681 2.030 1.00 0.00 O ATOM 0 H GLY A 86 -3.853 19.579 1.740 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -6.343 19.869 0.504 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -5.216 19.360 -0.737 1.00 0.00 H new ATOM 1367 N MET A 87 -5.510 16.984 -0.108 1.00 0.00 N ATOM 1368 CA MET A 87 -5.611 15.570 0.235 1.00 0.00 C ATOM 1369 C MET A 87 -4.916 14.706 -0.813 1.00 0.00 C ATOM 1370 O MET A 87 -4.848 15.071 -1.986 1.00 0.00 O ATOM 1371 CB MET A 87 -7.078 15.157 0.361 1.00 0.00 C ATOM 1372 CG MET A 87 -7.283 13.652 0.427 1.00 0.00 C ATOM 1373 SD MET A 87 -8.751 13.191 1.367 1.00 0.00 S ATOM 1374 CE MET A 87 -8.023 12.776 2.950 1.00 0.00 C ATOM 0 H MET A 87 -5.448 17.172 -1.109 1.00 0.00 H new ATOM 0 HA MET A 87 -5.115 15.418 1.194 1.00 0.00 H new ATOM 0 HB2 MET A 87 -7.499 15.612 1.257 1.00 0.00 H new ATOM 0 HB3 MET A 87 -7.633 15.554 -0.489 1.00 0.00 H new ATOM 0 HG2 MET A 87 -7.365 13.256 -0.585 1.00 0.00 H new ATOM 0 HG3 MET A 87 -6.406 13.189 0.880 1.00 0.00 H new ATOM 0 HE1 MET A 87 -8.807 12.470 3.642 1.00 0.00 H new ATOM 0 HE2 MET A 87 -7.314 11.959 2.821 1.00 0.00 H new ATOM 0 HE3 MET A 87 -7.504 13.647 3.351 1.00 0.00 H new ATOM 1384 N SER A 88 -4.401 13.559 -0.380 1.00 0.00 N ATOM 1385 CA SER A 88 -3.707 12.645 -1.280 1.00 0.00 C ATOM 1386 C SER A 88 -4.406 11.289 -1.321 1.00 0.00 C ATOM 1387 O SER A 88 -4.102 10.398 -0.529 1.00 0.00 O ATOM 1388 CB SER A 88 -2.253 12.469 -0.841 1.00 0.00 C ATOM 1389 OG SER A 88 -1.486 11.843 -1.855 1.00 0.00 O ATOM 0 H SER A 88 -4.451 13.241 0.588 1.00 0.00 H new ATOM 0 HA SER A 88 -3.726 13.075 -2.281 1.00 0.00 H new ATOM 0 HB2 SER A 88 -1.822 13.441 -0.602 1.00 0.00 H new ATOM 0 HB3 SER A 88 -2.215 11.871 0.070 1.00 0.00 H new ATOM 0 HG SER A 88 -0.535 12.024 -1.704 1.00 0.00 H new ATOM 1395 N GLU A 89 -5.344 11.142 -2.252 1.00 0.00 N ATOM 1396 CA GLU A 89 -6.087 9.896 -2.396 1.00 0.00 C ATOM 1397 C GLU A 89 -5.433 8.990 -3.436 1.00 0.00 C ATOM 1398 O GLU A 89 -5.414 9.308 -4.626 1.00 0.00 O ATOM 1399 CB GLU A 89 -7.537 10.183 -2.793 1.00 0.00 C ATOM 1400 CG GLU A 89 -8.454 8.979 -2.659 1.00 0.00 C ATOM 1401 CD GLU A 89 -9.913 9.370 -2.521 1.00 0.00 C ATOM 1402 OE1 GLU A 89 -10.472 9.931 -3.486 1.00 0.00 O ATOM 1403 OE2 GLU A 89 -10.495 9.113 -1.446 1.00 0.00 O ATOM 0 H GLU A 89 -5.607 11.870 -2.917 1.00 0.00 H new ATOM 0 HA GLU A 89 -6.076 9.383 -1.434 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -7.921 10.993 -2.173 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -7.560 10.534 -3.825 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -8.335 8.337 -3.532 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -8.155 8.394 -1.790 1.00 0.00 H new ATOM 1410 N ILE A 90 -4.900 7.863 -2.979 1.00 0.00 N ATOM 1411 CA ILE A 90 -4.246 6.911 -3.869 1.00 0.00 C ATOM 1412 C ILE A 90 -4.918 5.544 -3.801 1.00 0.00 C ATOM 1413 O ILE A 90 -5.361 5.110 -2.738 1.00 0.00 O ATOM 1414 CB ILE A 90 -2.753 6.754 -3.527 1.00 0.00 C ATOM 1415 CG1 ILE A 90 -2.025 8.089 -3.699 1.00 0.00 C ATOM 1416 CG2 ILE A 90 -2.119 5.683 -4.401 1.00 0.00 C ATOM 1417 CD1 ILE A 90 -0.696 8.150 -2.979 1.00 0.00 C ATOM 0 H ILE A 90 -4.908 7.586 -1.997 1.00 0.00 H new ATOM 0 HA ILE A 90 -4.339 7.309 -4.879 1.00 0.00 H new ATOM 0 HB ILE A 90 -2.665 6.445 -2.486 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -1.862 8.270 -4.761 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -2.665 8.892 -3.333 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -1.064 5.584 -4.147 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -2.623 4.731 -4.234 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -2.215 5.965 -5.449 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -0.237 9.124 -3.145 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -0.854 8.000 -1.911 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -0.039 7.369 -3.362 1.00 0.00 H new ATOM 1429 N TYR A 91 -4.989 4.869 -4.943 1.00 0.00 N ATOM 1430 CA TYR A 91 -5.608 3.550 -5.014 1.00 0.00 C ATOM 1431 C TYR A 91 -4.567 2.476 -5.314 1.00 0.00 C ATOM 1432 O TYR A 91 -3.877 2.530 -6.333 1.00 0.00 O ATOM 1433 CB TYR A 91 -6.698 3.533 -6.086 1.00 0.00 C ATOM 1434 CG TYR A 91 -7.866 4.442 -5.777 1.00 0.00 C ATOM 1435 CD1 TYR A 91 -8.677 4.212 -4.672 1.00 0.00 C ATOM 1436 CD2 TYR A 91 -8.160 5.530 -6.590 1.00 0.00 C ATOM 1437 CE1 TYR A 91 -9.746 5.040 -4.386 1.00 0.00 C ATOM 1438 CE2 TYR A 91 -9.225 6.363 -6.311 1.00 0.00 C ATOM 1439 CZ TYR A 91 -10.015 6.114 -5.208 1.00 0.00 C ATOM 1440 OH TYR A 91 -11.079 6.941 -4.927 1.00 0.00 O ATOM 0 H TYR A 91 -4.626 5.213 -5.832 1.00 0.00 H new ATOM 0 HA TYR A 91 -6.058 3.334 -4.045 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -6.262 3.828 -7.040 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -7.064 2.513 -6.204 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -8.468 3.372 -4.026 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -7.545 5.727 -7.455 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -10.367 4.847 -3.524 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -9.438 7.205 -6.953 1.00 0.00 H new ATOM 0 HH TYR A 91 -11.130 7.649 -5.602 1.00 0.00 H new ATOM 1450 N LEU A 92 -4.459 1.500 -4.419 1.00 0.00 N ATOM 1451 CA LEU A 92 -3.503 0.411 -4.586 1.00 0.00 C ATOM 1452 C LEU A 92 -4.223 -0.914 -4.820 1.00 0.00 C ATOM 1453 O LEU A 92 -4.916 -1.420 -3.937 1.00 0.00 O ATOM 1454 CB LEU A 92 -2.602 0.304 -3.355 1.00 0.00 C ATOM 1455 CG LEU A 92 -1.969 1.609 -2.871 1.00 0.00 C ATOM 1456 CD1 LEU A 92 -1.329 1.418 -1.505 1.00 0.00 C ATOM 1457 CD2 LEU A 92 -0.942 2.109 -3.877 1.00 0.00 C ATOM 0 H LEU A 92 -5.022 1.441 -3.570 1.00 0.00 H new ATOM 0 HA LEU A 92 -2.889 0.630 -5.460 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -3.186 -0.118 -2.537 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.803 -0.404 -3.575 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.755 2.359 -2.780 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -0.884 2.357 -1.177 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -2.088 1.107 -0.788 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -0.555 0.653 -1.569 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -0.502 3.039 -3.516 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.159 1.361 -4.000 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -1.429 2.286 -4.836 1.00 0.00 H new ATOM 1469 N ARG A 93 -4.052 -1.471 -6.014 1.00 0.00 N ATOM 1470 CA ARG A 93 -4.684 -2.738 -6.364 1.00 0.00 C ATOM 1471 C ARG A 93 -3.639 -3.836 -6.541 1.00 0.00 C ATOM 1472 O ARG A 93 -2.904 -3.853 -7.530 1.00 0.00 O ATOM 1473 CB ARG A 93 -5.503 -2.586 -7.647 1.00 0.00 C ATOM 1474 CG ARG A 93 -6.358 -3.800 -7.970 1.00 0.00 C ATOM 1475 CD ARG A 93 -6.884 -3.748 -9.396 1.00 0.00 C ATOM 1476 NE ARG A 93 -5.924 -4.289 -10.354 1.00 0.00 N ATOM 1477 CZ ARG A 93 -6.181 -4.436 -11.649 1.00 0.00 C ATOM 1478 NH1 ARG A 93 -7.362 -4.084 -12.138 1.00 0.00 N ATOM 1479 NH2 ARG A 93 -5.255 -4.936 -12.457 1.00 0.00 N ATOM 0 H ARG A 93 -3.481 -1.065 -6.756 1.00 0.00 H new ATOM 0 HA ARG A 93 -5.349 -3.022 -5.548 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -6.148 -1.712 -7.555 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -4.826 -2.397 -8.480 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -5.771 -4.707 -7.831 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -7.195 -3.852 -7.274 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -7.815 -4.311 -9.459 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -7.116 -2.716 -9.659 1.00 0.00 H new ATOM 0 HE ARG A 93 -5.006 -4.569 -10.010 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -8.076 -3.699 -11.519 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -7.557 -4.198 -13.133 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -4.345 -5.208 -12.084 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -5.453 -5.049 -13.451 1.00 0.00 H new ATOM 1493 N CYS A 94 -3.579 -4.749 -5.579 1.00 0.00 N ATOM 1494 CA CYS A 94 -2.623 -5.850 -5.628 1.00 0.00 C ATOM 1495 C CYS A 94 -3.110 -6.951 -6.565 1.00 0.00 C ATOM 1496 O CYS A 94 -4.160 -6.823 -7.194 1.00 0.00 O ATOM 1497 CB CYS A 94 -2.397 -6.419 -4.227 1.00 0.00 C ATOM 1498 SG CYS A 94 -1.646 -5.251 -3.068 1.00 0.00 S ATOM 0 H CYS A 94 -4.181 -4.749 -4.755 1.00 0.00 H new ATOM 0 HA CYS A 94 -1.679 -5.463 -6.011 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -3.353 -6.751 -3.823 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -1.760 -7.300 -4.303 1.00 0.00 H new ATOM 0 HG CYS A 94 -1.818 -4.038 -3.502 1.00 0.00 H new ATOM 1504 N GLN A 95 -2.339 -8.030 -6.652 1.00 0.00 N ATOM 1505 CA GLN A 95 -2.691 -9.152 -7.514 1.00 0.00 C ATOM 1506 C GLN A 95 -3.561 -10.159 -6.769 1.00 0.00 C ATOM 1507 O GLN A 95 -4.657 -10.498 -7.216 1.00 0.00 O ATOM 1508 CB GLN A 95 -1.427 -9.839 -8.035 1.00 0.00 C ATOM 1509 CG GLN A 95 -1.659 -10.671 -9.286 1.00 0.00 C ATOM 1510 CD GLN A 95 -0.372 -11.224 -9.865 1.00 0.00 C ATOM 1511 OE1 GLN A 95 0.721 -10.908 -9.393 1.00 0.00 O ATOM 1512 NE2 GLN A 95 -0.494 -12.054 -10.894 1.00 0.00 N ATOM 0 H GLN A 95 -1.467 -8.151 -6.137 1.00 0.00 H new ATOM 0 HA GLN A 95 -3.259 -8.764 -8.359 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -0.673 -9.081 -8.247 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -1.023 -10.480 -7.252 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -2.331 -11.496 -9.050 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -2.158 -10.059 -10.038 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -1.419 -12.289 -11.253 1.00 0.00 H new ATOM 0 HE22 GLN A 95 0.338 -12.457 -11.325 1.00 0.00 H new ATOM 1521 N ASP A 96 -3.065 -10.634 -5.632 1.00 0.00 N ATOM 1522 CA ASP A 96 -3.797 -11.603 -4.824 1.00 0.00 C ATOM 1523 C ASP A 96 -3.784 -11.203 -3.352 1.00 0.00 C ATOM 1524 O ASP A 96 -3.057 -10.294 -2.953 1.00 0.00 O ATOM 1525 CB ASP A 96 -3.194 -12.998 -4.992 1.00 0.00 C ATOM 1526 CG ASP A 96 -4.220 -14.099 -4.802 1.00 0.00 C ATOM 1527 OD1 ASP A 96 -5.007 -14.344 -5.741 1.00 0.00 O ATOM 1528 OD2 ASP A 96 -4.235 -14.715 -3.716 1.00 0.00 O ATOM 0 H ASP A 96 -2.159 -10.364 -5.249 1.00 0.00 H new ATOM 0 HA ASP A 96 -4.831 -11.619 -5.168 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -2.754 -13.083 -5.985 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -2.386 -13.130 -4.273 1.00 0.00 H new ATOM 1533 N GLU A 97 -4.593 -11.888 -2.550 1.00 0.00 N ATOM 1534 CA GLU A 97 -4.675 -11.602 -1.123 1.00 0.00 C ATOM 1535 C GLU A 97 -3.313 -11.769 -0.455 1.00 0.00 C ATOM 1536 O GLU A 97 -2.997 -11.079 0.513 1.00 0.00 O ATOM 1537 CB GLU A 97 -5.700 -12.521 -0.454 1.00 0.00 C ATOM 1538 CG GLU A 97 -5.424 -13.999 -0.670 1.00 0.00 C ATOM 1539 CD GLU A 97 -6.417 -14.890 0.051 1.00 0.00 C ATOM 1540 OE1 GLU A 97 -7.577 -14.462 0.227 1.00 0.00 O ATOM 1541 OE2 GLU A 97 -6.035 -16.014 0.438 1.00 0.00 O ATOM 0 H GLU A 97 -5.201 -12.645 -2.864 1.00 0.00 H new ATOM 0 HA GLU A 97 -4.994 -10.567 -1.004 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -5.716 -12.316 0.616 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -6.692 -12.285 -0.838 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -5.454 -14.218 -1.737 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -4.416 -14.231 -0.325 1.00 0.00 H new ATOM 1548 N GLN A 98 -2.513 -12.692 -0.980 1.00 0.00 N ATOM 1549 CA GLN A 98 -1.186 -12.951 -0.435 1.00 0.00 C ATOM 1550 C GLN A 98 -0.414 -11.650 -0.240 1.00 0.00 C ATOM 1551 O GLN A 98 0.033 -11.343 0.864 1.00 0.00 O ATOM 1552 CB GLN A 98 -0.406 -13.888 -1.358 1.00 0.00 C ATOM 1553 CG GLN A 98 -0.903 -15.324 -1.329 1.00 0.00 C ATOM 1554 CD GLN A 98 0.199 -16.329 -1.605 1.00 0.00 C ATOM 1555 OE1 GLN A 98 0.857 -16.276 -2.644 1.00 0.00 O ATOM 1556 NE2 GLN A 98 0.406 -17.252 -0.673 1.00 0.00 N ATOM 0 H GLN A 98 -2.761 -13.272 -1.781 1.00 0.00 H new ATOM 0 HA GLN A 98 -1.307 -13.429 0.537 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -0.467 -13.512 -2.379 1.00 0.00 H new ATOM 0 HB3 GLN A 98 0.646 -13.871 -1.074 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -1.344 -15.532 -0.354 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -1.694 -15.446 -2.069 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -0.163 -17.259 0.173 1.00 0.00 H new ATOM 0 HE22 GLN A 98 1.134 -17.954 -0.804 1.00 0.00 H new ATOM 1565 N GLN A 99 -0.261 -10.891 -1.321 1.00 0.00 N ATOM 1566 CA GLN A 99 0.458 -9.624 -1.268 1.00 0.00 C ATOM 1567 C GLN A 99 -0.320 -8.589 -0.461 1.00 0.00 C ATOM 1568 O GLN A 99 0.267 -7.777 0.254 1.00 0.00 O ATOM 1569 CB GLN A 99 0.713 -9.099 -2.682 1.00 0.00 C ATOM 1570 CG GLN A 99 1.609 -7.872 -2.723 1.00 0.00 C ATOM 1571 CD GLN A 99 2.030 -7.503 -4.132 1.00 0.00 C ATOM 1572 OE1 GLN A 99 1.374 -7.875 -5.105 1.00 0.00 O ATOM 1573 NE2 GLN A 99 3.130 -6.768 -4.248 1.00 0.00 N ATOM 0 H GLN A 99 -0.625 -11.132 -2.243 1.00 0.00 H new ATOM 0 HA GLN A 99 1.414 -9.798 -0.774 1.00 0.00 H new ATOM 0 HB2 GLN A 99 1.167 -9.890 -3.278 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -0.242 -8.857 -3.148 1.00 0.00 H new ATOM 0 HG2 GLN A 99 1.085 -7.029 -2.272 1.00 0.00 H new ATOM 0 HG3 GLN A 99 2.497 -8.055 -2.119 1.00 0.00 H new ATOM 0 HE21 GLN A 99 3.643 -6.482 -3.414 1.00 0.00 H new ATOM 0 HE22 GLN A 99 3.462 -6.489 -5.171 1.00 0.00 H new ATOM 1582 N TYR A 100 -1.642 -8.625 -0.581 1.00 0.00 N ATOM 1583 CA TYR A 100 -2.500 -7.689 0.135 1.00 0.00 C ATOM 1584 C TYR A 100 -2.235 -7.745 1.636 1.00 0.00 C ATOM 1585 O TYR A 100 -1.942 -6.728 2.264 1.00 0.00 O ATOM 1586 CB TYR A 100 -3.972 -7.997 -0.146 1.00 0.00 C ATOM 1587 CG TYR A 100 -4.929 -7.249 0.754 1.00 0.00 C ATOM 1588 CD1 TYR A 100 -5.308 -5.943 0.466 1.00 0.00 C ATOM 1589 CD2 TYR A 100 -5.456 -7.848 1.892 1.00 0.00 C ATOM 1590 CE1 TYR A 100 -6.182 -5.256 1.286 1.00 0.00 C ATOM 1591 CE2 TYR A 100 -6.331 -7.168 2.717 1.00 0.00 C ATOM 1592 CZ TYR A 100 -6.691 -5.873 2.410 1.00 0.00 C ATOM 1593 OH TYR A 100 -7.563 -5.192 3.228 1.00 0.00 O ATOM 0 H TYR A 100 -2.143 -9.292 -1.167 1.00 0.00 H new ATOM 0 HA TYR A 100 -2.272 -6.683 -0.218 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -4.194 -7.750 -1.184 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -4.139 -9.068 -0.030 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -4.912 -5.457 -0.414 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -5.177 -8.862 2.136 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -6.465 -4.241 1.048 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -6.731 -7.648 3.598 1.00 0.00 H new ATOM 0 HH TYR A 100 -7.829 -5.768 3.975 1.00 0.00 H new ATOM 1603 N ALA A 101 -2.339 -8.942 2.204 1.00 0.00 N ATOM 1604 CA ALA A 101 -2.107 -9.133 3.631 1.00 0.00 C ATOM 1605 C ALA A 101 -0.820 -8.447 4.075 1.00 0.00 C ATOM 1606 O ALA A 101 -0.833 -7.604 4.973 1.00 0.00 O ATOM 1607 CB ALA A 101 -2.059 -10.617 3.963 1.00 0.00 C ATOM 0 H ALA A 101 -2.582 -9.794 1.698 1.00 0.00 H new ATOM 0 HA ALA A 101 -2.935 -8.677 4.173 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -1.885 -10.745 5.031 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -3.007 -11.082 3.691 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -1.250 -11.089 3.405 1.00 0.00 H new ATOM 1613 N ARG A 102 0.289 -8.813 3.441 1.00 0.00 N ATOM 1614 CA ARG A 102 1.585 -8.233 3.773 1.00 0.00 C ATOM 1615 C ARG A 102 1.502 -6.710 3.826 1.00 0.00 C ATOM 1616 O ARG A 102 1.637 -6.108 4.891 1.00 0.00 O ATOM 1617 CB ARG A 102 2.637 -8.662 2.748 1.00 0.00 C ATOM 1618 CG ARG A 102 2.924 -10.155 2.758 1.00 0.00 C ATOM 1619 CD ARG A 102 3.499 -10.620 1.430 1.00 0.00 C ATOM 1620 NE ARG A 102 4.023 -11.981 1.507 1.00 0.00 N ATOM 1621 CZ ARG A 102 4.948 -12.460 0.683 1.00 0.00 C ATOM 1622 NH1 ARG A 102 5.448 -11.693 -0.276 1.00 0.00 N ATOM 1623 NH2 ARG A 102 5.375 -13.710 0.817 1.00 0.00 N ATOM 0 H ARG A 102 0.316 -9.508 2.695 1.00 0.00 H new ATOM 0 HA ARG A 102 1.877 -8.598 4.758 1.00 0.00 H new ATOM 0 HB2 ARG A 102 2.301 -8.372 1.752 1.00 0.00 H new ATOM 0 HB3 ARG A 102 3.563 -8.121 2.942 1.00 0.00 H new ATOM 0 HG2 ARG A 102 3.625 -10.387 3.560 1.00 0.00 H new ATOM 0 HG3 ARG A 102 2.005 -10.702 2.969 1.00 0.00 H new ATOM 0 HD2 ARG A 102 2.726 -10.572 0.663 1.00 0.00 H new ATOM 0 HD3 ARG A 102 4.295 -9.942 1.122 1.00 0.00 H new ATOM 0 HE ARG A 102 3.659 -12.597 2.233 1.00 0.00 H new ATOM 0 HH11 ARG A 102 5.122 -10.732 -0.382 1.00 0.00 H new ATOM 0 HH12 ARG A 102 6.158 -12.064 -0.907 1.00 0.00 H new ATOM 0 HH21 ARG A 102 4.993 -14.303 1.553 1.00 0.00 H new ATOM 0 HH22 ARG A 102 6.085 -14.077 0.184 1.00 0.00 H new ATOM 1637 N TRP A 103 1.281 -6.095 2.670 1.00 0.00 N ATOM 1638 CA TRP A 103 1.181 -4.642 2.585 1.00 0.00 C ATOM 1639 C TRP A 103 0.126 -4.112 3.549 1.00 0.00 C ATOM 1640 O TRP A 103 0.444 -3.401 4.502 1.00 0.00 O ATOM 1641 CB TRP A 103 0.843 -4.217 1.155 1.00 0.00 C ATOM 1642 CG TRP A 103 2.038 -4.165 0.252 1.00 0.00 C ATOM 1643 CD1 TRP A 103 2.604 -5.211 -0.419 1.00 0.00 C ATOM 1644 CD2 TRP A 103 2.814 -3.008 -0.076 1.00 0.00 C ATOM 1645 NE1 TRP A 103 3.686 -4.773 -1.144 1.00 0.00 N ATOM 1646 CE2 TRP A 103 3.835 -3.425 -0.952 1.00 0.00 C ATOM 1647 CE3 TRP A 103 2.745 -1.659 0.283 1.00 0.00 C ATOM 1648 CZ2 TRP A 103 4.778 -2.542 -1.470 1.00 0.00 C ATOM 1649 CZ3 TRP A 103 3.682 -0.783 -0.232 1.00 0.00 C ATOM 1650 CH2 TRP A 103 4.687 -1.227 -1.102 1.00 0.00 C ATOM 0 H TRP A 103 1.168 -6.579 1.779 1.00 0.00 H new ATOM 0 HA TRP A 103 2.146 -4.219 2.864 1.00 0.00 H new ATOM 0 HB2 TRP A 103 0.113 -4.912 0.740 1.00 0.00 H new ATOM 0 HB3 TRP A 103 0.371 -3.235 1.178 1.00 0.00 H new ATOM 0 HD1 TRP A 103 2.253 -6.232 -0.385 1.00 0.00 H new ATOM 0 HE1 TRP A 103 4.282 -5.357 -1.730 1.00 0.00 H new ATOM 0 HE3 TRP A 103 1.973 -1.307 0.951 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 5.554 -2.883 -2.139 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 3.639 0.261 0.041 1.00 0.00 H new ATOM 0 HH2 TRP A 103 5.403 -0.518 -1.489 1.00 0.00 H new ATOM 1661 N MET A 104 -1.131 -4.462 3.296 1.00 0.00 N ATOM 1662 CA MET A 104 -2.233 -4.021 4.144 1.00 0.00 C ATOM 1663 C MET A 104 -1.812 -3.990 5.609 1.00 0.00 C ATOM 1664 O MET A 104 -1.669 -2.921 6.201 1.00 0.00 O ATOM 1665 CB MET A 104 -3.441 -4.943 3.967 1.00 0.00 C ATOM 1666 CG MET A 104 -4.619 -4.578 4.856 1.00 0.00 C ATOM 1667 SD MET A 104 -4.835 -2.796 5.025 1.00 0.00 S ATOM 1668 CE MET A 104 -6.326 -2.543 4.065 1.00 0.00 C ATOM 0 H MET A 104 -1.412 -5.049 2.511 1.00 0.00 H new ATOM 0 HA MET A 104 -2.509 -3.011 3.843 1.00 0.00 H new ATOM 0 HB2 MET A 104 -3.760 -4.915 2.925 1.00 0.00 H new ATOM 0 HB3 MET A 104 -3.139 -5.969 4.180 1.00 0.00 H new ATOM 0 HG2 MET A 104 -5.529 -5.013 4.443 1.00 0.00 H new ATOM 0 HG3 MET A 104 -4.475 -5.018 5.843 1.00 0.00 H new ATOM 0 HE1 MET A 104 -6.530 -1.475 3.985 1.00 0.00 H new ATOM 0 HE2 MET A 104 -6.192 -2.963 3.068 1.00 0.00 H new ATOM 0 HE3 MET A 104 -7.164 -3.037 4.557 1.00 0.00 H new ATOM 1678 N ALA A 105 -1.614 -5.170 6.189 1.00 0.00 N ATOM 1679 CA ALA A 105 -1.208 -5.277 7.585 1.00 0.00 C ATOM 1680 C ALA A 105 -0.210 -4.184 7.951 1.00 0.00 C ATOM 1681 O ALA A 105 -0.199 -3.694 9.080 1.00 0.00 O ATOM 1682 CB ALA A 105 -0.613 -6.651 7.857 1.00 0.00 C ATOM 0 H ALA A 105 -1.728 -6.065 5.713 1.00 0.00 H new ATOM 0 HA ALA A 105 -2.094 -5.147 8.207 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -0.314 -6.717 8.903 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -1.357 -7.418 7.643 1.00 0.00 H new ATOM 0 HB3 ALA A 105 0.259 -6.803 7.220 1.00 0.00 H new ATOM 1688 N GLY A 106 0.627 -3.806 6.990 1.00 0.00 N ATOM 1689 CA GLY A 106 1.617 -2.774 7.232 1.00 0.00 C ATOM 1690 C GLY A 106 0.999 -1.396 7.362 1.00 0.00 C ATOM 1691 O GLY A 106 1.238 -0.691 8.343 1.00 0.00 O ATOM 0 H GLY A 106 0.637 -4.197 6.048 1.00 0.00 H new ATOM 0 HA2 GLY A 106 2.167 -3.009 8.143 1.00 0.00 H new ATOM 0 HA3 GLY A 106 2.339 -2.769 6.416 1.00 0.00 H new ATOM 1695 N CYS A 107 0.204 -1.010 6.371 1.00 0.00 N ATOM 1696 CA CYS A 107 -0.449 0.294 6.377 1.00 0.00 C ATOM 1697 C CYS A 107 -1.275 0.482 7.645 1.00 0.00 C ATOM 1698 O CYS A 107 -1.328 1.576 8.207 1.00 0.00 O ATOM 1699 CB CYS A 107 -1.341 0.447 5.145 1.00 0.00 C ATOM 1700 SG CYS A 107 -0.441 0.446 3.577 1.00 0.00 S ATOM 0 H CYS A 107 -0.004 -1.582 5.552 1.00 0.00 H new ATOM 0 HA CYS A 107 0.325 1.061 6.352 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -2.069 -0.364 5.134 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -1.902 1.378 5.229 1.00 0.00 H new ATOM 0 HG CYS A 107 -1.282 0.578 2.594 1.00 0.00 H new ATOM 1706 N ARG A 108 -1.921 -0.591 8.089 1.00 0.00 N ATOM 1707 CA ARG A 108 -2.748 -0.544 9.289 1.00 0.00 C ATOM 1708 C ARG A 108 -1.891 -0.311 10.530 1.00 0.00 C ATOM 1709 O ARG A 108 -2.189 0.561 11.348 1.00 0.00 O ATOM 1710 CB ARG A 108 -3.541 -1.843 9.440 1.00 0.00 C ATOM 1711 CG ARG A 108 -4.681 -1.980 8.444 1.00 0.00 C ATOM 1712 CD ARG A 108 -5.040 -3.438 8.205 1.00 0.00 C ATOM 1713 NE ARG A 108 -5.456 -4.108 9.435 1.00 0.00 N ATOM 1714 CZ ARG A 108 -6.609 -3.866 10.049 1.00 0.00 C ATOM 1715 NH1 ARG A 108 -7.456 -2.977 9.550 1.00 0.00 N ATOM 1716 NH2 ARG A 108 -6.916 -4.516 11.165 1.00 0.00 N ATOM 0 H ARG A 108 -1.888 -1.504 7.636 1.00 0.00 H new ATOM 0 HA ARG A 108 -3.445 0.288 9.187 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -2.863 -2.688 9.322 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -3.945 -1.897 10.451 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -5.555 -1.445 8.814 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -4.399 -1.514 7.500 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -5.843 -3.498 7.470 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -4.181 -3.958 7.782 1.00 0.00 H new ATOM 0 HE ARG A 108 -4.827 -4.799 9.844 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -7.223 -2.476 8.692 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -8.340 -2.793 10.024 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -6.267 -5.201 11.551 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -7.801 -4.330 11.636 1.00 0.00 H new ATOM 1730 N LEU A 109 -0.828 -1.096 10.665 1.00 0.00 N ATOM 1731 CA LEU A 109 0.072 -0.976 11.806 1.00 0.00 C ATOM 1732 C LEU A 109 0.636 0.437 11.909 1.00 0.00 C ATOM 1733 O LEU A 109 0.713 1.008 12.997 1.00 0.00 O ATOM 1734 CB LEU A 109 1.215 -1.986 11.688 1.00 0.00 C ATOM 1735 CG LEU A 109 0.819 -3.461 11.775 1.00 0.00 C ATOM 1736 CD1 LEU A 109 1.789 -4.322 10.981 1.00 0.00 C ATOM 1737 CD2 LEU A 109 0.766 -3.914 13.227 1.00 0.00 C ATOM 0 H LEU A 109 -0.568 -1.823 9.998 1.00 0.00 H new ATOM 0 HA LEU A 109 -0.499 -1.186 12.711 1.00 0.00 H new ATOM 0 HB2 LEU A 109 1.721 -1.822 10.737 1.00 0.00 H new ATOM 0 HB3 LEU A 109 1.940 -1.778 12.475 1.00 0.00 H new ATOM 0 HG LEU A 109 -0.175 -3.577 11.343 1.00 0.00 H new ATOM 0 HD11 LEU A 109 1.491 -5.368 11.055 1.00 0.00 H new ATOM 0 HD12 LEU A 109 1.777 -4.014 9.935 1.00 0.00 H new ATOM 0 HD13 LEU A 109 2.795 -4.202 11.383 1.00 0.00 H new ATOM 0 HD21 LEU A 109 0.483 -4.966 13.270 1.00 0.00 H new ATOM 0 HD22 LEU A 109 1.746 -3.783 13.685 1.00 0.00 H new ATOM 0 HD23 LEU A 109 0.031 -3.318 13.768 1.00 0.00 H new ATOM 1749 N ALA A 110 1.027 0.997 10.769 1.00 0.00 N ATOM 1750 CA ALA A 110 1.580 2.345 10.731 1.00 0.00 C ATOM 1751 C ALA A 110 0.499 3.389 10.990 1.00 0.00 C ATOM 1752 O ALA A 110 0.778 4.468 11.515 1.00 0.00 O ATOM 1753 CB ALA A 110 2.253 2.602 9.390 1.00 0.00 C ATOM 0 H ALA A 110 0.971 0.538 9.860 1.00 0.00 H new ATOM 0 HA ALA A 110 2.326 2.427 11.522 1.00 0.00 H new ATOM 0 HB1 ALA A 110 2.661 3.612 9.376 1.00 0.00 H new ATOM 0 HB2 ALA A 110 3.059 1.883 9.244 1.00 0.00 H new ATOM 0 HB3 ALA A 110 1.521 2.495 8.589 1.00 0.00 H new ATOM 1759 N SER A 111 -0.735 3.063 10.619 1.00 0.00 N ATOM 1760 CA SER A 111 -1.857 3.974 10.808 1.00 0.00 C ATOM 1761 C SER A 111 -1.878 4.522 12.232 1.00 0.00 C ATOM 1762 O SER A 111 -2.048 5.722 12.446 1.00 0.00 O ATOM 1763 CB SER A 111 -3.176 3.263 10.503 1.00 0.00 C ATOM 1764 OG SER A 111 -4.273 4.154 10.609 1.00 0.00 O ATOM 0 H SER A 111 -0.983 2.174 10.185 1.00 0.00 H new ATOM 0 HA SER A 111 -1.735 4.809 10.118 1.00 0.00 H new ATOM 0 HB2 SER A 111 -3.142 2.842 9.498 1.00 0.00 H new ATOM 0 HB3 SER A 111 -3.312 2.430 11.193 1.00 0.00 H new ATOM 0 HG SER A 111 -5.104 3.675 10.408 1.00 0.00 H new ATOM 1770 N LYS A 112 -1.705 3.632 13.203 1.00 0.00 N ATOM 1771 CA LYS A 112 -1.703 4.023 14.608 1.00 0.00 C ATOM 1772 C LYS A 112 -0.291 4.365 15.075 1.00 0.00 C ATOM 1773 O LYS A 112 -0.108 5.153 16.002 1.00 0.00 O ATOM 1774 CB LYS A 112 -2.279 2.900 15.472 1.00 0.00 C ATOM 1775 CG LYS A 112 -3.707 2.527 15.112 1.00 0.00 C ATOM 1776 CD LYS A 112 -4.686 3.617 15.514 1.00 0.00 C ATOM 1777 CE LYS A 112 -4.933 4.592 14.373 1.00 0.00 C ATOM 1778 NZ LYS A 112 -6.313 5.151 14.410 1.00 0.00 N ATOM 0 H LYS A 112 -1.564 2.635 13.043 1.00 0.00 H new ATOM 0 HA LYS A 112 -2.327 4.910 14.713 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -1.646 2.018 15.375 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -2.244 3.204 16.518 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -3.778 2.350 14.039 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -3.976 1.594 15.607 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -5.630 3.165 15.819 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -4.297 4.157 16.378 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -4.210 5.406 14.428 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -4.772 4.086 13.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -6.442 5.811 13.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -7.003 4.377 14.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -6.459 5.656 15.307 1.00 0.00 H new ATOM 1792 N GLY A 113 0.703 3.767 14.426 1.00 0.00 N ATOM 1793 CA GLY A 113 2.085 4.023 14.789 1.00 0.00 C ATOM 1794 C GLY A 113 2.939 2.771 14.738 1.00 0.00 C ATOM 1795 O GLY A 113 4.132 2.837 14.441 1.00 0.00 O ATOM 0 H GLY A 113 0.576 3.110 13.656 1.00 0.00 H new ATOM 0 HA2 GLY A 113 2.502 4.771 14.115 1.00 0.00 H new ATOM 0 HA3 GLY A 113 2.122 4.444 15.794 1.00 0.00 H new ATOM 1799 N ARG A 114 2.328 1.628 15.031 1.00 0.00 N ATOM 1800 CA ARG A 114 3.041 0.356 15.020 1.00 0.00 C ATOM 1801 C ARG A 114 3.655 0.089 13.648 1.00 0.00 C ATOM 1802 O ARG A 114 3.189 0.610 12.635 1.00 0.00 O ATOM 1803 CB ARG A 114 2.096 -0.786 15.399 1.00 0.00 C ATOM 1804 CG ARG A 114 1.675 -0.768 16.859 1.00 0.00 C ATOM 1805 CD ARG A 114 0.486 -1.683 17.107 1.00 0.00 C ATOM 1806 NE ARG A 114 -0.017 -1.569 18.473 1.00 0.00 N ATOM 1807 CZ ARG A 114 -1.076 -2.232 18.924 1.00 0.00 C ATOM 1808 NH1 ARG A 114 -1.739 -3.053 18.122 1.00 0.00 N ATOM 1809 NH2 ARG A 114 -1.473 -2.076 20.181 1.00 0.00 N ATOM 0 H ARG A 114 1.341 1.556 15.279 1.00 0.00 H new ATOM 0 HA ARG A 114 3.845 0.412 15.754 1.00 0.00 H new ATOM 0 HB2 ARG A 114 1.206 -0.733 14.772 1.00 0.00 H new ATOM 0 HB3 ARG A 114 2.583 -1.737 15.182 1.00 0.00 H new ATOM 0 HG2 ARG A 114 2.512 -1.080 17.484 1.00 0.00 H new ATOM 0 HG3 ARG A 114 1.420 0.250 17.153 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -0.312 -1.439 16.405 1.00 0.00 H new ATOM 0 HD3 ARG A 114 0.776 -2.715 16.913 1.00 0.00 H new ATOM 0 HE ARG A 114 0.472 -0.946 19.116 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -1.436 -3.177 17.156 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -2.552 -3.561 18.471 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -0.965 -1.446 20.802 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -2.286 -2.586 20.526 1.00 0.00 H new ATOM 1823 N THR A 115 4.704 -0.727 13.624 1.00 0.00 N ATOM 1824 CA THR A 115 5.383 -1.062 12.379 1.00 0.00 C ATOM 1825 C THR A 115 5.653 -2.560 12.286 1.00 0.00 C ATOM 1826 O THR A 115 5.454 -3.297 13.251 1.00 0.00 O ATOM 1827 CB THR A 115 6.716 -0.302 12.243 1.00 0.00 C ATOM 1828 OG1 THR A 115 7.691 -0.862 13.129 1.00 0.00 O ATOM 1829 CG2 THR A 115 6.530 1.175 12.554 1.00 0.00 C ATOM 0 H THR A 115 5.102 -1.168 14.453 1.00 0.00 H new ATOM 0 HA THR A 115 4.719 -0.764 11.567 1.00 0.00 H new ATOM 0 HB THR A 115 7.062 -0.400 11.214 1.00 0.00 H new ATOM 0 HG1 THR A 115 8.536 -0.375 13.036 1.00 0.00 H new ATOM 0 HG21 THR A 115 7.484 1.691 12.452 1.00 0.00 H new ATOM 0 HG22 THR A 115 5.808 1.605 11.859 1.00 0.00 H new ATOM 0 HG23 THR A 115 6.164 1.289 13.574 1.00 0.00 H new ATOM 1837 N MET A 116 6.109 -3.003 11.119 1.00 0.00 N ATOM 1838 CA MET A 116 6.409 -4.413 10.902 1.00 0.00 C ATOM 1839 C MET A 116 7.296 -4.958 12.016 1.00 0.00 C ATOM 1840 O MET A 116 7.193 -6.127 12.389 1.00 0.00 O ATOM 1841 CB MET A 116 7.093 -4.609 9.547 1.00 0.00 C ATOM 1842 CG MET A 116 6.146 -4.487 8.365 1.00 0.00 C ATOM 1843 SD MET A 116 6.791 -5.271 6.875 1.00 0.00 S ATOM 1844 CE MET A 116 7.925 -4.012 6.294 1.00 0.00 C ATOM 0 H MET A 116 6.279 -2.406 10.310 1.00 0.00 H new ATOM 0 HA MET A 116 5.468 -4.964 10.909 1.00 0.00 H new ATOM 0 HB2 MET A 116 7.889 -3.872 9.441 1.00 0.00 H new ATOM 0 HB3 MET A 116 7.563 -5.592 9.525 1.00 0.00 H new ATOM 0 HG2 MET A 116 5.188 -4.939 8.623 1.00 0.00 H new ATOM 0 HG3 MET A 116 5.957 -3.433 8.163 1.00 0.00 H new ATOM 0 HE1 MET A 116 7.522 -3.547 5.394 1.00 0.00 H new ATOM 0 HE2 MET A 116 8.055 -3.255 7.067 1.00 0.00 H new ATOM 0 HE3 MET A 116 8.889 -4.467 6.067 1.00 0.00 H new ATOM 1854 N ALA A 117 8.167 -4.105 12.544 1.00 0.00 N ATOM 1855 CA ALA A 117 9.071 -4.501 13.617 1.00 0.00 C ATOM 1856 C ALA A 117 8.338 -5.309 14.682 1.00 0.00 C ATOM 1857 O ALA A 117 8.893 -6.248 15.254 1.00 0.00 O ATOM 1858 CB ALA A 117 9.723 -3.275 14.238 1.00 0.00 C ATOM 0 H ALA A 117 8.266 -3.135 12.246 1.00 0.00 H new ATOM 0 HA ALA A 117 9.848 -5.134 13.188 1.00 0.00 H new ATOM 0 HB1 ALA A 117 10.395 -3.586 15.038 1.00 0.00 H new ATOM 0 HB2 ALA A 117 10.289 -2.739 13.476 1.00 0.00 H new ATOM 0 HB3 ALA A 117 8.953 -2.620 14.646 1.00 0.00 H new ATOM 1864 N ASP A 118 7.090 -4.939 14.944 1.00 0.00 N ATOM 1865 CA ASP A 118 6.280 -5.630 15.941 1.00 0.00 C ATOM 1866 C ASP A 118 5.919 -7.035 15.469 1.00 0.00 C ATOM 1867 O ASP A 118 5.592 -7.243 14.300 1.00 0.00 O ATOM 1868 CB ASP A 118 5.007 -4.835 16.235 1.00 0.00 C ATOM 1869 CG ASP A 118 4.460 -5.110 17.622 1.00 0.00 C ATOM 1870 OD1 ASP A 118 4.962 -4.500 18.590 1.00 0.00 O ATOM 1871 OD2 ASP A 118 3.530 -5.935 17.740 1.00 0.00 O ATOM 0 H ASP A 118 6.616 -4.164 14.480 1.00 0.00 H new ATOM 0 HA ASP A 118 6.867 -5.713 16.856 1.00 0.00 H new ATOM 0 HB2 ASP A 118 5.216 -3.770 16.135 1.00 0.00 H new ATOM 0 HB3 ASP A 118 4.248 -5.082 15.493 1.00 0.00 H new ATOM 1876 N SER A 119 5.982 -7.996 16.385 1.00 0.00 N ATOM 1877 CA SER A 119 5.667 -9.382 16.061 1.00 0.00 C ATOM 1878 C SER A 119 4.195 -9.532 15.689 1.00 0.00 C ATOM 1879 O SER A 119 3.803 -10.503 15.042 1.00 0.00 O ATOM 1880 CB SER A 119 6.001 -10.293 17.244 1.00 0.00 C ATOM 1881 OG SER A 119 7.346 -10.735 17.184 1.00 0.00 O ATOM 0 H SER A 119 6.248 -7.840 17.357 1.00 0.00 H new ATOM 0 HA SER A 119 6.272 -9.675 15.203 1.00 0.00 H new ATOM 0 HB2 SER A 119 5.832 -9.757 18.178 1.00 0.00 H new ATOM 0 HB3 SER A 119 5.332 -11.153 17.245 1.00 0.00 H new ATOM 0 HG SER A 119 7.535 -11.314 17.952 1.00 0.00 H new ATOM 1887 N SER A 120 3.385 -8.563 16.101 1.00 0.00 N ATOM 1888 CA SER A 120 1.956 -8.587 15.815 1.00 0.00 C ATOM 1889 C SER A 120 1.699 -8.439 14.319 1.00 0.00 C ATOM 1890 O SER A 120 0.627 -8.788 13.824 1.00 0.00 O ATOM 1891 CB SER A 120 1.242 -7.471 16.580 1.00 0.00 C ATOM 1892 OG SER A 120 1.235 -7.731 17.973 1.00 0.00 O ATOM 0 H SER A 120 3.694 -7.751 16.635 1.00 0.00 H new ATOM 0 HA SER A 120 1.562 -9.550 16.140 1.00 0.00 H new ATOM 0 HB2 SER A 120 1.737 -6.519 16.387 1.00 0.00 H new ATOM 0 HB3 SER A 120 0.218 -7.376 16.219 1.00 0.00 H new ATOM 0 HG SER A 120 1.963 -7.235 18.402 1.00 0.00 H new ATOM 1898 N TYR A 121 2.690 -7.919 13.604 1.00 0.00 N ATOM 1899 CA TYR A 121 2.571 -7.721 12.164 1.00 0.00 C ATOM 1900 C TYR A 121 2.141 -9.011 11.471 1.00 0.00 C ATOM 1901 O TYR A 121 1.113 -9.053 10.794 1.00 0.00 O ATOM 1902 CB TYR A 121 3.901 -7.237 11.583 1.00 0.00 C ATOM 1903 CG TYR A 121 4.069 -7.548 10.113 1.00 0.00 C ATOM 1904 CD1 TYR A 121 3.437 -6.780 9.143 1.00 0.00 C ATOM 1905 CD2 TYR A 121 4.862 -8.609 9.694 1.00 0.00 C ATOM 1906 CE1 TYR A 121 3.587 -7.061 7.799 1.00 0.00 C ATOM 1907 CE2 TYR A 121 5.020 -8.897 8.352 1.00 0.00 C ATOM 1908 CZ TYR A 121 4.380 -8.120 7.409 1.00 0.00 C ATOM 1909 OH TYR A 121 4.534 -8.403 6.071 1.00 0.00 O ATOM 0 H TYR A 121 3.585 -7.627 13.998 1.00 0.00 H new ATOM 0 HA TYR A 121 1.808 -6.963 11.989 1.00 0.00 H new ATOM 0 HB2 TYR A 121 3.981 -6.160 11.729 1.00 0.00 H new ATOM 0 HB3 TYR A 121 4.719 -7.696 12.139 1.00 0.00 H new ATOM 0 HD1 TYR A 121 2.817 -5.949 9.445 1.00 0.00 H new ATOM 0 HD2 TYR A 121 5.364 -9.219 10.430 1.00 0.00 H new ATOM 0 HE1 TYR A 121 3.086 -6.455 7.058 1.00 0.00 H new ATOM 0 HE2 TYR A 121 5.641 -9.725 8.043 1.00 0.00 H new ATOM 0 HH TYR A 121 5.124 -9.178 5.966 1.00 0.00 H new ATOM 1919 N THR A 122 2.936 -10.062 11.645 1.00 0.00 N ATOM 1920 CA THR A 122 2.639 -11.353 11.037 1.00 0.00 C ATOM 1921 C THR A 122 1.292 -11.888 11.510 1.00 0.00 C ATOM 1922 O THR A 122 0.631 -12.647 10.802 1.00 0.00 O ATOM 1923 CB THR A 122 3.732 -12.390 11.359 1.00 0.00 C ATOM 1924 OG1 THR A 122 3.735 -13.422 10.367 1.00 0.00 O ATOM 1925 CG2 THR A 122 3.509 -13.002 12.734 1.00 0.00 C ATOM 0 H THR A 122 3.790 -10.044 12.202 1.00 0.00 H new ATOM 0 HA THR A 122 2.605 -11.194 9.959 1.00 0.00 H new ATOM 0 HB THR A 122 4.696 -11.882 11.357 1.00 0.00 H new ATOM 0 HG1 THR A 122 4.433 -14.076 10.578 1.00 0.00 H new ATOM 0 HG21 THR A 122 4.293 -13.731 12.939 1.00 0.00 H new ATOM 0 HG22 THR A 122 3.536 -12.217 13.490 1.00 0.00 H new ATOM 0 HG23 THR A 122 2.538 -13.497 12.759 1.00 0.00 H new ATOM 1933 N SER A 123 0.891 -11.486 12.712 1.00 0.00 N ATOM 1934 CA SER A 123 -0.377 -11.927 13.282 1.00 0.00 C ATOM 1935 C SER A 123 -1.548 -11.478 12.413 1.00 0.00 C ATOM 1936 O SER A 123 -2.576 -12.151 12.344 1.00 0.00 O ATOM 1937 CB SER A 123 -0.541 -11.380 14.701 1.00 0.00 C ATOM 1938 OG SER A 123 -1.363 -12.229 15.483 1.00 0.00 O ATOM 0 H SER A 123 1.426 -10.856 13.310 1.00 0.00 H new ATOM 0 HA SER A 123 -0.371 -13.016 13.319 1.00 0.00 H new ATOM 0 HB2 SER A 123 0.437 -11.282 15.172 1.00 0.00 H new ATOM 0 HB3 SER A 123 -0.977 -10.382 14.661 1.00 0.00 H new ATOM 0 HG SER A 123 -1.451 -11.858 16.386 1.00 0.00 H new ATOM 1944 N GLU A 124 -1.384 -10.336 11.752 1.00 0.00 N ATOM 1945 CA GLU A 124 -2.428 -9.797 10.889 1.00 0.00 C ATOM 1946 C GLU A 124 -2.407 -10.475 9.522 1.00 0.00 C ATOM 1947 O GLU A 124 -3.453 -10.812 8.968 1.00 0.00 O ATOM 1948 CB GLU A 124 -2.253 -8.286 10.723 1.00 0.00 C ATOM 1949 CG GLU A 124 -2.840 -7.477 11.868 1.00 0.00 C ATOM 1950 CD GLU A 124 -2.401 -7.986 13.227 1.00 0.00 C ATOM 1951 OE1 GLU A 124 -2.964 -8.999 13.692 1.00 0.00 O ATOM 1952 OE2 GLU A 124 -1.495 -7.370 13.826 1.00 0.00 O ATOM 0 H GLU A 124 -0.539 -9.767 11.798 1.00 0.00 H new ATOM 0 HA GLU A 124 -3.391 -9.995 11.359 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -1.190 -8.059 10.636 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -2.723 -7.974 9.790 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -2.542 -6.434 11.761 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -3.928 -7.505 11.808 1.00 0.00 H new ATOM 1959 N VAL A 125 -1.208 -10.671 8.983 1.00 0.00 N ATOM 1960 CA VAL A 125 -1.049 -11.309 7.681 1.00 0.00 C ATOM 1961 C VAL A 125 -1.721 -12.677 7.654 1.00 0.00 C ATOM 1962 O VAL A 125 -2.375 -13.038 6.676 1.00 0.00 O ATOM 1963 CB VAL A 125 0.437 -11.472 7.313 1.00 0.00 C ATOM 1964 CG1 VAL A 125 0.582 -12.181 5.976 1.00 0.00 C ATOM 1965 CG2 VAL A 125 1.131 -10.118 7.286 1.00 0.00 C ATOM 0 H VAL A 125 -0.332 -10.397 9.428 1.00 0.00 H new ATOM 0 HA VAL A 125 -1.527 -10.658 6.949 1.00 0.00 H new ATOM 0 HB VAL A 125 0.917 -12.085 8.076 1.00 0.00 H new ATOM 0 HG11 VAL A 125 1.639 -12.287 5.733 1.00 0.00 H new ATOM 0 HG12 VAL A 125 0.123 -13.168 6.036 1.00 0.00 H new ATOM 0 HG13 VAL A 125 0.088 -11.597 5.199 1.00 0.00 H new ATOM 0 HG21 VAL A 125 2.181 -10.252 7.024 1.00 0.00 H new ATOM 0 HG22 VAL A 125 0.651 -9.478 6.546 1.00 0.00 H new ATOM 0 HG23 VAL A 125 1.059 -9.653 8.269 1.00 0.00 H new ATOM 1975 N GLN A 126 -1.557 -13.432 8.735 1.00 0.00 N ATOM 1976 CA GLN A 126 -2.148 -14.762 8.835 1.00 0.00 C ATOM 1977 C GLN A 126 -3.659 -14.673 9.018 1.00 0.00 C ATOM 1978 O GLN A 126 -4.424 -15.221 8.225 1.00 0.00 O ATOM 1979 CB GLN A 126 -1.525 -15.534 9.999 1.00 0.00 C ATOM 1980 CG GLN A 126 -0.009 -15.439 10.051 1.00 0.00 C ATOM 1981 CD GLN A 126 0.672 -16.540 9.263 1.00 0.00 C ATOM 1982 OE1 GLN A 126 0.097 -17.606 9.039 1.00 0.00 O ATOM 1983 NE2 GLN A 126 1.904 -16.289 8.837 1.00 0.00 N ATOM 0 H GLN A 126 -1.020 -13.146 9.554 1.00 0.00 H new ATOM 0 HA GLN A 126 -1.944 -15.294 7.906 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -1.936 -15.157 10.935 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -1.812 -16.583 9.924 1.00 0.00 H new ATOM 0 HG2 GLN A 126 0.304 -14.471 9.660 1.00 0.00 H new ATOM 0 HG3 GLN A 126 0.319 -15.485 11.090 1.00 0.00 H new ATOM 0 HE21 GLN A 126 2.343 -15.392 9.045 1.00 0.00 H new ATOM 0 HE22 GLN A 126 2.412 -16.993 8.302 1.00 0.00 H new ATOM 1992 N ALA A 127 -4.083 -13.979 10.070 1.00 0.00 N ATOM 1993 CA ALA A 127 -5.503 -13.817 10.356 1.00 0.00 C ATOM 1994 C ALA A 127 -6.281 -13.463 9.094 1.00 0.00 C ATOM 1995 O ALA A 127 -7.392 -13.949 8.881 1.00 0.00 O ATOM 1996 CB ALA A 127 -5.708 -12.750 11.422 1.00 0.00 C ATOM 0 H ALA A 127 -3.463 -13.520 10.738 1.00 0.00 H new ATOM 0 HA ALA A 127 -5.883 -14.767 10.730 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -6.773 -12.639 11.626 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -5.192 -13.045 12.336 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -5.306 -11.801 11.069 1.00 0.00 H new ATOM 2002 N ILE A 128 -5.691 -12.613 8.260 1.00 0.00 N ATOM 2003 CA ILE A 128 -6.330 -12.194 7.018 1.00 0.00 C ATOM 2004 C ILE A 128 -6.472 -13.365 6.051 1.00 0.00 C ATOM 2005 O ILE A 128 -7.584 -13.784 5.726 1.00 0.00 O ATOM 2006 CB ILE A 128 -5.537 -11.068 6.329 1.00 0.00 C ATOM 2007 CG1 ILE A 128 -5.539 -9.808 7.198 1.00 0.00 C ATOM 2008 CG2 ILE A 128 -6.122 -10.772 4.956 1.00 0.00 C ATOM 2009 CD1 ILE A 128 -4.420 -8.845 6.868 1.00 0.00 C ATOM 0 H ILE A 128 -4.772 -12.201 8.422 1.00 0.00 H new ATOM 0 HA ILE A 128 -7.320 -11.821 7.282 1.00 0.00 H new ATOM 0 HB ILE A 128 -4.506 -11.396 6.200 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -6.494 -9.297 7.080 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -5.460 -10.099 8.246 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -5.551 -9.974 4.481 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -6.074 -11.669 4.339 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -7.161 -10.460 5.063 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -4.483 -7.976 7.522 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -3.460 -9.340 7.013 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -4.510 -8.525 5.830 1.00 0.00 H new ATOM 2021 N LEU A 129 -5.340 -13.891 5.597 1.00 0.00 N ATOM 2022 CA LEU A 129 -5.337 -15.016 4.669 1.00 0.00 C ATOM 2023 C LEU A 129 -6.484 -15.975 4.972 1.00 0.00 C ATOM 2024 O LEU A 129 -7.216 -16.387 4.072 1.00 0.00 O ATOM 2025 CB LEU A 129 -4.003 -15.760 4.742 1.00 0.00 C ATOM 2026 CG LEU A 129 -2.831 -15.111 4.004 1.00 0.00 C ATOM 2027 CD1 LEU A 129 -1.531 -15.829 4.330 1.00 0.00 C ATOM 2028 CD2 LEU A 129 -3.081 -15.112 2.503 1.00 0.00 C ATOM 0 H LEU A 129 -4.412 -13.556 5.857 1.00 0.00 H new ATOM 0 HA LEU A 129 -5.472 -14.623 3.661 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -3.729 -15.871 5.791 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -4.147 -16.764 4.342 1.00 0.00 H new ATOM 0 HG LEU A 129 -2.744 -14.077 4.338 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -0.709 -15.353 3.796 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -1.345 -15.776 5.403 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -1.606 -16.873 4.025 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -2.237 -14.647 1.993 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -3.195 -16.138 2.154 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -3.990 -14.552 2.285 1.00 0.00 H new ATOM 2040 N ALA A 130 -6.636 -16.324 6.245 1.00 0.00 N ATOM 2041 CA ALA A 130 -7.697 -17.230 6.667 1.00 0.00 C ATOM 2042 C ALA A 130 -9.058 -16.545 6.616 1.00 0.00 C ATOM 2043 O ALA A 130 -9.969 -17.002 5.925 1.00 0.00 O ATOM 2044 CB ALA A 130 -7.419 -17.751 8.070 1.00 0.00 C ATOM 0 H ALA A 130 -6.038 -15.993 7.002 1.00 0.00 H new ATOM 0 HA ALA A 130 -7.718 -18.072 5.975 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -8.219 -18.426 8.373 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -6.470 -18.287 8.078 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -7.369 -16.913 8.766 1.00 0.00 H new ATOM 2050 N PHE A 131 -9.190 -15.446 7.351 1.00 0.00 N ATOM 2051 CA PHE A 131 -10.441 -14.698 7.391 1.00 0.00 C ATOM 2052 C PHE A 131 -11.073 -14.622 6.004 1.00 0.00 C ATOM 2053 O PHE A 131 -12.255 -14.923 5.831 1.00 0.00 O ATOM 2054 CB PHE A 131 -10.200 -13.287 7.931 1.00 0.00 C ATOM 2055 CG PHE A 131 -11.433 -12.430 7.941 1.00 0.00 C ATOM 2056 CD1 PHE A 131 -12.432 -12.641 8.878 1.00 0.00 C ATOM 2057 CD2 PHE A 131 -11.594 -11.413 7.014 1.00 0.00 C ATOM 2058 CE1 PHE A 131 -13.569 -11.854 8.890 1.00 0.00 C ATOM 2059 CE2 PHE A 131 -12.727 -10.622 7.021 1.00 0.00 C ATOM 2060 CZ PHE A 131 -13.717 -10.844 7.960 1.00 0.00 C ATOM 0 H PHE A 131 -8.446 -15.053 7.927 1.00 0.00 H new ATOM 0 HA PHE A 131 -11.127 -15.222 8.057 1.00 0.00 H new ATOM 0 HB2 PHE A 131 -9.808 -13.357 8.946 1.00 0.00 H new ATOM 0 HB3 PHE A 131 -9.434 -12.801 7.326 1.00 0.00 H new ATOM 0 HD1 PHE A 131 -12.321 -13.430 9.608 1.00 0.00 H new ATOM 0 HD2 PHE A 131 -10.825 -11.236 6.277 1.00 0.00 H new ATOM 0 HE1 PHE A 131 -14.340 -12.029 9.626 1.00 0.00 H new ATOM 0 HE2 PHE A 131 -12.839 -9.831 6.294 1.00 0.00 H new ATOM 0 HZ PHE A 131 -14.605 -10.229 7.966 1.00 0.00 H new ATOM 2070 N LEU A 132 -10.278 -14.218 5.019 1.00 0.00 N ATOM 2071 CA LEU A 132 -10.759 -14.102 3.647 1.00 0.00 C ATOM 2072 C LEU A 132 -11.435 -15.392 3.196 1.00 0.00 C ATOM 2073 O LEU A 132 -12.524 -15.366 2.621 1.00 0.00 O ATOM 2074 CB LEU A 132 -9.600 -13.764 2.707 1.00 0.00 C ATOM 2075 CG LEU A 132 -8.903 -12.426 2.955 1.00 0.00 C ATOM 2076 CD1 LEU A 132 -7.626 -12.330 2.135 1.00 0.00 C ATOM 2077 CD2 LEU A 132 -9.837 -11.270 2.627 1.00 0.00 C ATOM 0 H LEU A 132 -9.298 -13.965 5.145 1.00 0.00 H new ATOM 0 HA LEU A 132 -11.494 -13.298 3.612 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -8.856 -14.557 2.780 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -9.975 -13.771 1.683 1.00 0.00 H new ATOM 0 HG LEU A 132 -8.638 -12.366 4.011 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -7.143 -11.371 2.324 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -6.951 -13.138 2.417 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -7.867 -12.412 1.075 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -9.325 -10.325 2.809 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -10.132 -11.327 1.579 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -10.724 -11.329 3.257 1.00 0.00 H new ATOM 2089 N SER A 133 -10.784 -16.520 3.462 1.00 0.00 N ATOM 2090 CA SER A 133 -11.322 -17.821 3.081 1.00 0.00 C ATOM 2091 C SER A 133 -12.716 -18.024 3.666 1.00 0.00 C ATOM 2092 O SER A 133 -13.637 -18.457 2.970 1.00 0.00 O ATOM 2093 CB SER A 133 -10.391 -18.939 3.554 1.00 0.00 C ATOM 2094 OG SER A 133 -10.487 -20.074 2.710 1.00 0.00 O ATOM 0 H SER A 133 -9.884 -16.559 3.940 1.00 0.00 H new ATOM 0 HA SER A 133 -11.394 -17.853 1.994 1.00 0.00 H new ATOM 0 HB2 SER A 133 -9.362 -18.578 3.568 1.00 0.00 H new ATOM 0 HB3 SER A 133 -10.645 -19.220 4.576 1.00 0.00 H new ATOM 0 HG SER A 133 -9.881 -20.774 3.032 1.00 0.00 H new ATOM 2100 N LEU A 134 -12.865 -17.710 4.948 1.00 0.00 N ATOM 2101 CA LEU A 134 -14.148 -17.857 5.627 1.00 0.00 C ATOM 2102 C LEU A 134 -15.251 -17.122 4.874 1.00 0.00 C ATOM 2103 O LEU A 134 -16.367 -17.624 4.744 1.00 0.00 O ATOM 2104 CB LEU A 134 -14.052 -17.327 7.059 1.00 0.00 C ATOM 2105 CG LEU A 134 -12.897 -17.872 7.901 1.00 0.00 C ATOM 2106 CD1 LEU A 134 -12.843 -17.172 9.250 1.00 0.00 C ATOM 2107 CD2 LEU A 134 -13.034 -19.377 8.083 1.00 0.00 C ATOM 0 H LEU A 134 -12.114 -17.352 5.538 1.00 0.00 H new ATOM 0 HA LEU A 134 -14.397 -18.918 5.654 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -13.965 -16.241 7.018 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -14.987 -17.552 7.572 1.00 0.00 H new ATOM 0 HG LEU A 134 -11.963 -17.673 7.375 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -12.015 -17.573 9.835 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -12.696 -16.102 9.099 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -13.779 -17.338 9.784 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -12.204 -19.748 8.684 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -13.975 -19.598 8.587 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -13.022 -19.864 7.108 1.00 0.00 H new ATOM 2119 N GLN A 135 -14.930 -15.931 4.379 1.00 0.00 N ATOM 2120 CA GLN A 135 -15.895 -15.127 3.637 1.00 0.00 C ATOM 2121 C GLN A 135 -16.613 -15.970 2.587 1.00 0.00 C ATOM 2122 O GLN A 135 -17.827 -15.861 2.414 1.00 0.00 O ATOM 2123 CB GLN A 135 -15.196 -13.943 2.966 1.00 0.00 C ATOM 2124 CG GLN A 135 -14.505 -13.010 3.947 1.00 0.00 C ATOM 2125 CD GLN A 135 -15.415 -11.899 4.435 1.00 0.00 C ATOM 2126 OE1 GLN A 135 -16.496 -12.155 4.967 1.00 0.00 O ATOM 2127 NE2 GLN A 135 -14.982 -10.657 4.256 1.00 0.00 N ATOM 0 H GLN A 135 -14.010 -15.501 4.478 1.00 0.00 H new ATOM 0 HA GLN A 135 -16.635 -14.750 4.343 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -14.460 -14.321 2.256 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -15.929 -13.376 2.393 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -14.150 -13.586 4.802 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -13.627 -12.573 3.471 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -14.080 -10.491 3.811 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -15.552 -9.869 4.564 1.00 0.00 H new ATOM 2136 N ARG A 136 -15.854 -16.809 1.890 1.00 0.00 N ATOM 2137 CA ARG A 136 -16.418 -17.669 0.856 1.00 0.00 C ATOM 2138 C ARG A 136 -16.582 -19.098 1.368 1.00 0.00 C ATOM 2139 O ARG A 136 -15.776 -19.581 2.163 1.00 0.00 O ATOM 2140 CB ARG A 136 -15.526 -17.661 -0.387 1.00 0.00 C ATOM 2141 CG ARG A 136 -14.158 -18.284 -0.159 1.00 0.00 C ATOM 2142 CD ARG A 136 -13.334 -18.299 -1.436 1.00 0.00 C ATOM 2143 NE ARG A 136 -13.555 -19.514 -2.217 1.00 0.00 N ATOM 2144 CZ ARG A 136 -13.224 -20.729 -1.795 1.00 0.00 C ATOM 2145 NH1 ARG A 136 -12.660 -20.891 -0.606 1.00 0.00 N ATOM 2146 NH2 ARG A 136 -13.458 -21.786 -2.563 1.00 0.00 N ATOM 0 H ARG A 136 -14.848 -16.912 2.022 1.00 0.00 H new ATOM 0 HA ARG A 136 -17.401 -17.280 0.592 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -16.031 -18.198 -1.190 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -15.396 -16.633 -0.724 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -13.627 -17.726 0.612 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -14.278 -19.303 0.210 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -13.587 -17.428 -2.041 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -12.276 -18.216 -1.186 1.00 0.00 H new ATOM 0 HE ARG A 136 -13.987 -19.424 -3.137 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -12.479 -20.081 -0.013 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -12.407 -21.825 -0.285 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -13.892 -21.665 -3.478 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -13.203 -22.719 -2.238 1.00 0.00 H new ATOM 2160 N THR A 137 -17.633 -19.768 0.907 1.00 0.00 N ATOM 2161 CA THR A 137 -17.905 -21.140 1.318 1.00 0.00 C ATOM 2162 C THR A 137 -16.843 -22.095 0.785 1.00 0.00 C ATOM 2163 O THR A 137 -16.030 -22.621 1.545 1.00 0.00 O ATOM 2164 CB THR A 137 -19.290 -21.608 0.832 1.00 0.00 C ATOM 2165 OG1 THR A 137 -19.238 -21.928 -0.562 1.00 0.00 O ATOM 2166 CG2 THR A 137 -20.339 -20.533 1.072 1.00 0.00 C ATOM 0 H THR A 137 -18.310 -19.383 0.249 1.00 0.00 H new ATOM 0 HA THR A 137 -17.887 -21.153 2.408 1.00 0.00 H new ATOM 0 HB THR A 137 -19.568 -22.497 1.398 1.00 0.00 H new ATOM 0 HG1 THR A 137 -20.122 -22.226 -0.862 1.00 0.00 H new ATOM 0 HG21 THR A 137 -21.309 -20.886 0.721 1.00 0.00 H new ATOM 0 HG22 THR A 137 -20.397 -20.313 2.138 1.00 0.00 H new ATOM 0 HG23 THR A 137 -20.064 -19.629 0.529 1.00 0.00 H new TER 2174 THR A 137