USER MOD reduce.3.24.130724 H: found=0, std=0, add=908, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 903 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 29 ASN : amide:sc= 0.836 K(o=-2.1,f=-13!) USER MOD Set 1.2: A 91 ASN : amide:sc= -2.96 K(o=-2.1,f=-4.6!) USER MOD Set 2.1: A 76 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 77 ASN : amide:sc= -0.0144 K(o=-0.014,f=-1.7) USER MOD Set 3.1: A 59 HIS : no HD1:sc= -3.86! C(o=-3!,f=-11!) USER MOD Set 3.2: A 67 SER OG : rot 35:sc= 0.669 USER MOD Set 3.3: A 112 TYR OH : rot 180:sc= 0.154 USER MOD Set 4.1: A 32 CYS SG : rot 177:sc= -2.61 USER MOD Set 4.2: A 35 CYS SG : rot -41:sc= 1.32 USER MOD Set 4.3: A 52 CYS SG : rot -132:sc= 1.3 USER MOD Set 4.4: A 55 CYS SG : rot 84:sc= -0.89 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ -115:sc= 0 (180deg=-1.59!) USER MOD Single : A 14 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -147:sc= 0.683 (180deg=-0.0204) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 SER OG : rot 180:sc= 0.0987 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot -130:sc= -0.929 USER MOD Single : A 47 TYR OH : rot 30:sc= -1.19 USER MOD Single : A 56 SER OG : rot -5:sc= -0.807 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 65 HIS : no HD1:sc= -0.948 K(o=-0.95,f=-1.9!) USER MOD Single : A 71 SER OG : rot -150:sc= 0 USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 82 GLN : amide:sc= -3.87! C(o=-3.9!,f=-4.2!) USER MOD Single : A 85 CYS SG : rot 63:sc= -0.0458 USER MOD Single : A 86 MET CE :methyl -166:sc= -0.977 (180deg=-1.24) USER MOD Single : A 87 GLN : amide:sc= -0.388 K(o=-0.39,f=-1.3) USER MOD Single : A 93 SER OG : rot 147:sc= 1.14 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 99 HIS : no HD1:sc= -0.208 X(o=-0.21,f=0) USER MOD Single : A 100 GLN : amide:sc= -0.0819 K(o=-0.082,f=-1.2!) USER MOD Single : A 108 THR OG1 : rot 27:sc= 0.068 USER MOD Single : A 109 ASN : amide:sc= -0.614 X(o=-0.61,f=-1) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 ASN : amide:sc= -3.06! K(o=-3.1!,f=-1.4) USER MOD Single : A 114 SER OG : rot -88:sc= 0.699 USER MOD Single : A 118 GLN : amide:sc= -1.4 K(o=-1.4,f=-0.71) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 150:sc= -0.323 (180deg=-1.37) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 130 GLN : amide:sc= -0.0253 X(o=-0.025,f=0) USER MOD Single : A 132 THR OG1 : rot -120:sc= -0.576 USER MOD ----------------------------------------------------------------- ATOM 90 N ASP A 10 4.981 16.482 -4.073 1.00 0.00 N ATOM 91 CA ASP A 10 5.012 15.098 -3.612 1.00 0.00 C ATOM 92 C ASP A 10 5.220 15.033 -2.102 1.00 0.00 C ATOM 93 O ASP A 10 5.799 15.931 -1.491 1.00 0.00 O ATOM 94 CB ASP A 10 6.123 14.326 -4.326 1.00 0.00 C ATOM 95 CG ASP A 10 6.391 14.856 -5.721 1.00 0.00 C ATOM 96 OD1 ASP A 10 5.429 14.970 -6.508 1.00 0.00 O ATOM 97 OD2 ASP A 10 7.565 15.156 -6.025 1.00 0.00 O ATOM 0 HA ASP A 10 4.052 14.640 -3.848 1.00 0.00 H new ATOM 0 HB2 ASP A 10 7.038 14.383 -3.737 1.00 0.00 H new ATOM 0 HB3 ASP A 10 5.849 13.273 -4.387 1.00 0.00 H new ATOM 102 N PRO A 11 4.737 13.944 -1.485 1.00 0.00 N ATOM 103 CA PRO A 11 4.857 13.735 -0.039 1.00 0.00 C ATOM 104 C PRO A 11 6.295 13.461 0.389 1.00 0.00 C ATOM 105 O PRO A 11 6.976 12.617 -0.194 1.00 0.00 O ATOM 106 CB PRO A 11 3.979 12.507 0.216 1.00 0.00 C ATOM 107 CG PRO A 11 3.962 11.778 -1.083 1.00 0.00 C ATOM 108 CD PRO A 11 4.037 12.833 -2.151 1.00 0.00 C ATOM 0 HA PRO A 11 4.555 14.616 0.527 1.00 0.00 H new ATOM 0 HB2 PRO A 11 4.388 11.886 1.013 1.00 0.00 H new ATOM 0 HB3 PRO A 11 2.973 12.796 0.521 1.00 0.00 H new ATOM 0 HG2 PRO A 11 4.804 11.089 -1.155 1.00 0.00 H new ATOM 0 HG3 PRO A 11 3.054 11.183 -1.185 1.00 0.00 H new ATOM 0 HD2 PRO A 11 4.583 12.481 -3.026 1.00 0.00 H new ATOM 0 HD3 PRO A 11 3.045 13.130 -2.493 1.00 0.00 H new ATOM 116 N SER A 12 6.749 14.176 1.413 1.00 0.00 N ATOM 117 CA SER A 12 8.107 14.011 1.917 1.00 0.00 C ATOM 118 C SER A 12 8.263 12.673 2.632 1.00 0.00 C ATOM 119 O SER A 12 7.283 11.970 2.880 1.00 0.00 O ATOM 120 CB SER A 12 8.463 15.155 2.870 1.00 0.00 C ATOM 121 OG SER A 12 8.572 16.384 2.172 1.00 0.00 O ATOM 0 H SER A 12 6.197 14.875 1.910 1.00 0.00 H new ATOM 0 HA SER A 12 8.788 14.030 1.066 1.00 0.00 H new ATOM 0 HB2 SER A 12 7.700 15.239 3.644 1.00 0.00 H new ATOM 0 HB3 SER A 12 9.404 14.934 3.373 1.00 0.00 H new ATOM 0 HG SER A 12 8.798 17.099 2.802 1.00 0.00 H new ATOM 127 N LYS A 13 9.503 12.325 2.960 1.00 0.00 N ATOM 128 CA LYS A 13 9.790 11.072 3.648 1.00 0.00 C ATOM 129 C LYS A 13 8.962 10.949 4.923 1.00 0.00 C ATOM 130 O LYS A 13 8.181 10.011 5.079 1.00 0.00 O ATOM 131 CB LYS A 13 11.279 10.980 3.983 1.00 0.00 C ATOM 132 CG LYS A 13 11.677 9.666 4.633 1.00 0.00 C ATOM 133 CD LYS A 13 13.187 9.505 4.688 1.00 0.00 C ATOM 134 CE LYS A 13 13.583 8.095 5.104 1.00 0.00 C ATOM 135 NZ LYS A 13 13.713 7.969 6.582 1.00 0.00 N ATOM 0 H LYS A 13 10.326 12.894 2.760 1.00 0.00 H new ATOM 0 HA LYS A 13 9.523 10.251 2.982 1.00 0.00 H new ATOM 0 HB2 LYS A 13 11.857 11.113 3.069 1.00 0.00 H new ATOM 0 HB3 LYS A 13 11.544 11.800 4.650 1.00 0.00 H new ATOM 0 HG2 LYS A 13 11.268 9.620 5.642 1.00 0.00 H new ATOM 0 HG3 LYS A 13 11.242 8.837 4.075 1.00 0.00 H new ATOM 0 HD2 LYS A 13 13.614 9.731 3.711 1.00 0.00 H new ATOM 0 HD3 LYS A 13 13.605 10.224 5.392 1.00 0.00 H new ATOM 0 HE2 LYS A 13 12.837 7.387 4.743 1.00 0.00 H new ATOM 0 HE3 LYS A 13 14.529 7.829 4.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 14.703 7.765 6.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 13.421 8.859 7.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 13.106 7.195 6.919 1.00 0.00 H new ATOM 149 N GLN A 14 9.139 11.902 5.832 1.00 0.00 N ATOM 150 CA GLN A 14 8.407 11.900 7.093 1.00 0.00 C ATOM 151 C GLN A 14 6.952 11.500 6.878 1.00 0.00 C ATOM 152 O GLN A 14 6.472 10.527 7.460 1.00 0.00 O ATOM 153 CB GLN A 14 8.477 13.280 7.750 1.00 0.00 C ATOM 154 CG GLN A 14 8.111 13.270 9.226 1.00 0.00 C ATOM 155 CD GLN A 14 8.681 14.457 9.977 1.00 0.00 C ATOM 156 OE1 GLN A 14 8.007 15.471 10.163 1.00 0.00 O ATOM 157 NE2 GLN A 14 9.929 14.338 10.414 1.00 0.00 N ATOM 0 H GLN A 14 9.783 12.685 5.719 1.00 0.00 H new ATOM 0 HA GLN A 14 8.872 11.167 7.752 1.00 0.00 H new ATOM 0 HB2 GLN A 14 9.486 13.676 7.637 1.00 0.00 H new ATOM 0 HB3 GLN A 14 7.807 13.959 7.223 1.00 0.00 H new ATOM 0 HG2 GLN A 14 7.026 13.268 9.327 1.00 0.00 H new ATOM 0 HG3 GLN A 14 8.475 12.349 9.680 1.00 0.00 H new ATOM 0 HE21 GLN A 14 10.451 13.480 10.238 1.00 0.00 H new ATOM 0 HE22 GLN A 14 10.365 15.105 10.926 1.00 0.00 H new ATOM 166 N ASP A 15 6.253 12.257 6.039 1.00 0.00 N ATOM 167 CA ASP A 15 4.852 11.981 5.746 1.00 0.00 C ATOM 168 C ASP A 15 4.651 10.512 5.385 1.00 0.00 C ATOM 169 O ASP A 15 3.820 9.826 5.979 1.00 0.00 O ATOM 170 CB ASP A 15 4.363 12.872 4.601 1.00 0.00 C ATOM 171 CG ASP A 15 4.692 14.335 4.825 1.00 0.00 C ATOM 172 OD1 ASP A 15 4.204 14.906 5.822 1.00 0.00 O ATOM 173 OD2 ASP A 15 5.436 14.908 4.003 1.00 0.00 O ATOM 0 H ASP A 15 6.634 13.067 5.550 1.00 0.00 H new ATOM 0 HA ASP A 15 4.269 12.200 6.641 1.00 0.00 H new ATOM 0 HB2 ASP A 15 4.816 12.540 3.667 1.00 0.00 H new ATOM 0 HB3 ASP A 15 3.285 12.758 4.491 1.00 0.00 H new ATOM 178 N ILE A 16 5.417 10.038 4.408 1.00 0.00 N ATOM 179 CA ILE A 16 5.322 8.652 3.968 1.00 0.00 C ATOM 180 C ILE A 16 5.486 7.691 5.142 1.00 0.00 C ATOM 181 O ILE A 16 4.856 6.633 5.184 1.00 0.00 O ATOM 182 CB ILE A 16 6.385 8.326 2.901 1.00 0.00 C ATOM 183 CG1 ILE A 16 6.221 9.247 1.690 1.00 0.00 C ATOM 184 CG2 ILE A 16 6.283 6.867 2.482 1.00 0.00 C ATOM 185 CD1 ILE A 16 7.444 9.300 0.802 1.00 0.00 C ATOM 0 H ILE A 16 6.110 10.593 3.906 1.00 0.00 H new ATOM 0 HA ILE A 16 4.331 8.526 3.533 1.00 0.00 H new ATOM 0 HB ILE A 16 7.373 8.493 3.329 1.00 0.00 H new ATOM 0 HG12 ILE A 16 5.368 8.910 1.101 1.00 0.00 H new ATOM 0 HG13 ILE A 16 5.991 10.254 2.038 1.00 0.00 H new ATOM 0 HG21 ILE A 16 7.040 6.651 1.728 1.00 0.00 H new ATOM 0 HG22 ILE A 16 6.443 6.227 3.350 1.00 0.00 H new ATOM 0 HG23 ILE A 16 5.293 6.676 2.068 1.00 0.00 H new ATOM 0 HD11 ILE A 16 7.256 9.972 -0.036 1.00 0.00 H new ATOM 0 HD12 ILE A 16 8.295 9.665 1.376 1.00 0.00 H new ATOM 0 HD13 ILE A 16 7.663 8.301 0.424 1.00 0.00 H new ATOM 197 N LEU A 17 6.333 8.067 6.093 1.00 0.00 N ATOM 198 CA LEU A 17 6.579 7.240 7.269 1.00 0.00 C ATOM 199 C LEU A 17 5.361 7.223 8.187 1.00 0.00 C ATOM 200 O LEU A 17 5.102 6.237 8.877 1.00 0.00 O ATOM 201 CB LEU A 17 7.800 7.755 8.033 1.00 0.00 C ATOM 202 CG LEU A 17 9.146 7.612 7.322 1.00 0.00 C ATOM 203 CD1 LEU A 17 10.258 8.234 8.152 1.00 0.00 C ATOM 204 CD2 LEU A 17 9.446 6.148 7.036 1.00 0.00 C ATOM 0 H LEU A 17 6.861 8.939 6.073 1.00 0.00 H new ATOM 0 HA LEU A 17 6.772 6.221 6.932 1.00 0.00 H new ATOM 0 HB2 LEU A 17 7.643 8.809 8.261 1.00 0.00 H new ATOM 0 HB3 LEU A 17 7.857 7.228 8.985 1.00 0.00 H new ATOM 0 HG LEU A 17 9.090 8.143 6.372 1.00 0.00 H new ATOM 0 HD11 LEU A 17 11.208 8.122 7.629 1.00 0.00 H new ATOM 0 HD12 LEU A 17 10.050 9.293 8.304 1.00 0.00 H new ATOM 0 HD13 LEU A 17 10.314 7.733 9.118 1.00 0.00 H new ATOM 0 HD21 LEU A 17 10.408 6.066 6.530 1.00 0.00 H new ATOM 0 HD22 LEU A 17 9.481 5.594 7.974 1.00 0.00 H new ATOM 0 HD23 LEU A 17 8.664 5.734 6.399 1.00 0.00 H new ATOM 216 N THR A 18 4.612 8.322 8.189 1.00 0.00 N ATOM 217 CA THR A 18 3.420 8.434 9.020 1.00 0.00 C ATOM 218 C THR A 18 2.322 7.496 8.535 1.00 0.00 C ATOM 219 O THR A 18 1.737 6.751 9.323 1.00 0.00 O ATOM 220 CB THR A 18 2.879 9.877 9.035 1.00 0.00 C ATOM 221 OG1 THR A 18 3.724 10.709 9.836 1.00 0.00 O ATOM 222 CG2 THR A 18 1.459 9.915 9.577 1.00 0.00 C ATOM 0 H THR A 18 4.811 9.147 7.624 1.00 0.00 H new ATOM 0 HA THR A 18 3.712 8.153 10.032 1.00 0.00 H new ATOM 0 HB THR A 18 2.870 10.250 8.011 1.00 0.00 H new ATOM 0 HG1 THR A 18 3.374 11.624 9.839 1.00 0.00 H new ATOM 0 HG21 THR A 18 1.098 10.943 9.578 1.00 0.00 H new ATOM 0 HG22 THR A 18 0.813 9.304 8.947 1.00 0.00 H new ATOM 0 HG23 THR A 18 1.447 9.525 10.595 1.00 0.00 H new ATOM 230 N ILE A 19 2.046 7.536 7.236 1.00 0.00 N ATOM 231 CA ILE A 19 1.018 6.688 6.646 1.00 0.00 C ATOM 232 C ILE A 19 1.349 5.211 6.836 1.00 0.00 C ATOM 233 O ILE A 19 0.455 4.367 6.909 1.00 0.00 O ATOM 234 CB ILE A 19 0.846 6.974 5.143 1.00 0.00 C ATOM 235 CG1 ILE A 19 0.214 8.351 4.933 1.00 0.00 C ATOM 236 CG2 ILE A 19 -0.003 5.891 4.492 1.00 0.00 C ATOM 237 CD1 ILE A 19 0.231 8.812 3.493 1.00 0.00 C ATOM 0 H ILE A 19 2.521 8.147 6.572 1.00 0.00 H new ATOM 0 HA ILE A 19 0.085 6.919 7.160 1.00 0.00 H new ATOM 0 HB ILE A 19 1.829 6.970 4.672 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -0.817 8.326 5.285 1.00 0.00 H new ATOM 0 HG13 ILE A 19 0.742 9.081 5.546 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -0.116 6.107 3.430 1.00 0.00 H new ATOM 0 HG22 ILE A 19 0.484 4.924 4.616 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -0.985 5.866 4.964 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -0.233 9.795 3.420 1.00 0.00 H new ATOM 0 HD12 ILE A 19 1.261 8.870 3.142 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -0.323 8.103 2.877 1.00 0.00 H new ATOM 249 N PHE A 20 2.639 4.905 6.919 1.00 0.00 N ATOM 250 CA PHE A 20 3.090 3.530 7.101 1.00 0.00 C ATOM 251 C PHE A 20 3.052 3.137 8.576 1.00 0.00 C ATOM 252 O PHE A 20 2.520 2.087 8.937 1.00 0.00 O ATOM 253 CB PHE A 20 4.506 3.357 6.552 1.00 0.00 C ATOM 254 CG PHE A 20 4.551 3.129 5.068 1.00 0.00 C ATOM 255 CD1 PHE A 20 3.748 2.165 4.478 1.00 0.00 C ATOM 256 CD2 PHE A 20 5.393 3.879 4.263 1.00 0.00 C ATOM 257 CE1 PHE A 20 3.788 1.953 3.113 1.00 0.00 C ATOM 258 CE2 PHE A 20 5.436 3.671 2.897 1.00 0.00 C ATOM 259 CZ PHE A 20 4.631 2.708 2.321 1.00 0.00 C ATOM 0 H PHE A 20 3.392 5.591 6.863 1.00 0.00 H new ATOM 0 HA PHE A 20 2.413 2.876 6.550 1.00 0.00 H new ATOM 0 HB2 PHE A 20 5.091 4.244 6.793 1.00 0.00 H new ATOM 0 HB3 PHE A 20 4.982 2.515 7.055 1.00 0.00 H new ATOM 0 HD1 PHE A 20 3.084 1.574 5.091 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.023 4.635 4.708 1.00 0.00 H new ATOM 0 HE1 PHE A 20 3.160 1.197 2.665 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.098 4.261 2.281 1.00 0.00 H new ATOM 0 HZ PHE A 20 4.661 2.546 1.254 1.00 0.00 H new ATOM 269 N LYS A 21 3.622 3.987 9.423 1.00 0.00 N ATOM 270 CA LYS A 21 3.654 3.732 10.858 1.00 0.00 C ATOM 271 C LYS A 21 2.271 3.344 11.373 1.00 0.00 C ATOM 272 O LYS A 21 2.142 2.480 12.240 1.00 0.00 O ATOM 273 CB LYS A 21 4.161 4.967 11.606 1.00 0.00 C ATOM 274 CG LYS A 21 3.049 5.861 12.128 1.00 0.00 C ATOM 275 CD LYS A 21 3.594 6.974 13.007 1.00 0.00 C ATOM 276 CE LYS A 21 2.474 7.798 13.622 1.00 0.00 C ATOM 277 NZ LYS A 21 1.928 7.162 14.853 1.00 0.00 N ATOM 0 H LYS A 21 4.069 4.859 9.140 1.00 0.00 H new ATOM 0 HA LYS A 21 4.336 2.901 11.038 1.00 0.00 H new ATOM 0 HB2 LYS A 21 4.781 4.645 12.443 1.00 0.00 H new ATOM 0 HB3 LYS A 21 4.800 5.547 10.941 1.00 0.00 H new ATOM 0 HG2 LYS A 21 2.504 6.293 11.289 1.00 0.00 H new ATOM 0 HG3 LYS A 21 2.337 5.263 12.697 1.00 0.00 H new ATOM 0 HD2 LYS A 21 4.209 6.546 13.799 1.00 0.00 H new ATOM 0 HD3 LYS A 21 4.241 7.622 12.416 1.00 0.00 H new ATOM 0 HE2 LYS A 21 2.846 8.794 13.862 1.00 0.00 H new ATOM 0 HE3 LYS A 21 1.674 7.924 12.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 1.167 7.755 15.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 1.550 6.222 14.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 2.686 7.065 15.559 1.00 0.00 H new ATOM 291 N ARG A 22 1.242 3.988 10.832 1.00 0.00 N ATOM 292 CA ARG A 22 -0.131 3.709 11.238 1.00 0.00 C ATOM 293 C ARG A 22 -0.503 2.261 10.937 1.00 0.00 C ATOM 294 O ARG A 22 -1.247 1.630 11.689 1.00 0.00 O ATOM 295 CB ARG A 22 -1.097 4.656 10.523 1.00 0.00 C ATOM 296 CG ARG A 22 -2.552 4.447 10.911 1.00 0.00 C ATOM 297 CD ARG A 22 -2.934 5.292 12.115 1.00 0.00 C ATOM 298 NE ARG A 22 -4.379 5.321 12.328 1.00 0.00 N ATOM 299 CZ ARG A 22 -5.057 4.333 12.903 1.00 0.00 C ATOM 300 NH1 ARG A 22 -4.423 3.246 13.320 1.00 0.00 N ATOM 301 NH2 ARG A 22 -6.371 4.433 13.061 1.00 0.00 N ATOM 0 H ARG A 22 1.332 4.705 10.113 1.00 0.00 H new ATOM 0 HA ARG A 22 -0.206 3.868 12.314 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -0.815 5.685 10.745 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -0.994 4.522 9.446 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -3.195 4.701 10.068 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -2.722 3.394 11.135 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -2.444 4.897 13.005 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -2.568 6.309 11.975 1.00 0.00 H new ATOM 0 HE ARG A 22 -4.896 6.144 12.019 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -3.413 3.167 13.200 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -4.945 2.489 13.761 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -6.861 5.268 12.741 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -6.891 3.674 13.502 1.00 0.00 H new ATOM 315 N LEU A 23 0.016 1.739 9.830 1.00 0.00 N ATOM 316 CA LEU A 23 -0.262 0.365 9.429 1.00 0.00 C ATOM 317 C LEU A 23 0.732 -0.600 10.065 1.00 0.00 C ATOM 318 O LEU A 23 0.349 -1.494 10.820 1.00 0.00 O ATOM 319 CB LEU A 23 -0.211 0.238 7.905 1.00 0.00 C ATOM 320 CG LEU A 23 -1.253 1.043 7.128 1.00 0.00 C ATOM 321 CD1 LEU A 23 -0.933 1.040 5.643 1.00 0.00 C ATOM 322 CD2 LEU A 23 -2.648 0.489 7.376 1.00 0.00 C ATOM 0 H LEU A 23 0.631 2.247 9.195 1.00 0.00 H new ATOM 0 HA LEU A 23 -1.262 0.107 9.776 1.00 0.00 H new ATOM 0 HB2 LEU A 23 0.780 0.543 7.568 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.326 -0.814 7.644 1.00 0.00 H new ATOM 0 HG LEU A 23 -1.224 2.074 7.482 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -1.686 1.618 5.107 1.00 0.00 H new ATOM 0 HD12 LEU A 23 0.049 1.485 5.481 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -0.932 0.015 5.273 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -3.377 1.074 6.815 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -2.690 -0.551 7.051 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -2.878 0.546 8.440 1.00 0.00 H new ATOM 334 N ARG A 24 2.012 -0.413 9.755 1.00 0.00 N ATOM 335 CA ARG A 24 3.062 -1.267 10.298 1.00 0.00 C ATOM 336 C ARG A 24 2.735 -1.689 11.727 1.00 0.00 C ATOM 337 O ARG A 24 2.846 -2.864 12.078 1.00 0.00 O ATOM 338 CB ARG A 24 4.408 -0.540 10.264 1.00 0.00 C ATOM 339 CG ARG A 24 4.892 -0.219 8.860 1.00 0.00 C ATOM 340 CD ARG A 24 6.286 0.388 8.876 1.00 0.00 C ATOM 341 NE ARG A 24 7.260 -0.495 9.514 1.00 0.00 N ATOM 342 CZ ARG A 24 8.509 -0.640 9.087 1.00 0.00 C ATOM 343 NH1 ARG A 24 8.935 0.035 8.028 1.00 0.00 N ATOM 344 NH2 ARG A 24 9.336 -1.462 9.720 1.00 0.00 N ATOM 0 H ARG A 24 2.346 0.322 9.131 1.00 0.00 H new ATOM 0 HA ARG A 24 3.124 -2.162 9.679 1.00 0.00 H new ATOM 0 HB2 ARG A 24 4.325 0.387 10.831 1.00 0.00 H new ATOM 0 HB3 ARG A 24 5.156 -1.154 10.765 1.00 0.00 H new ATOM 0 HG2 ARG A 24 4.897 -1.128 8.259 1.00 0.00 H new ATOM 0 HG3 ARG A 24 4.198 0.474 8.384 1.00 0.00 H new ATOM 0 HD2 ARG A 24 6.602 0.598 7.854 1.00 0.00 H new ATOM 0 HD3 ARG A 24 6.260 1.341 9.404 1.00 0.00 H new ATOM 0 HE ARG A 24 6.965 -1.029 10.331 1.00 0.00 H new ATOM 0 HH11 ARG A 24 8.303 0.668 7.539 1.00 0.00 H new ATOM 0 HH12 ARG A 24 9.895 -0.079 7.703 1.00 0.00 H new ATOM 0 HH21 ARG A 24 9.012 -1.983 10.535 1.00 0.00 H new ATOM 0 HH22 ARG A 24 10.295 -1.573 9.392 1.00 0.00 H new ATOM 358 N SER A 25 2.333 -0.724 12.546 1.00 0.00 N ATOM 359 CA SER A 25 1.994 -0.994 13.939 1.00 0.00 C ATOM 360 C SER A 25 1.199 -2.291 14.062 1.00 0.00 C ATOM 361 O SER A 25 1.501 -3.140 14.900 1.00 0.00 O ATOM 362 CB SER A 25 1.191 0.167 14.526 1.00 0.00 C ATOM 363 OG SER A 25 1.231 0.151 15.943 1.00 0.00 O ATOM 0 H SER A 25 2.234 0.253 12.270 1.00 0.00 H new ATOM 0 HA SER A 25 2.923 -1.102 14.499 1.00 0.00 H new ATOM 0 HB2 SER A 25 1.591 1.112 14.159 1.00 0.00 H new ATOM 0 HB3 SER A 25 0.157 0.105 14.188 1.00 0.00 H new ATOM 0 HG SER A 25 0.711 0.904 16.293 1.00 0.00 H new ATOM 369 N VAL A 26 0.180 -2.436 13.220 1.00 0.00 N ATOM 370 CA VAL A 26 -0.658 -3.628 13.233 1.00 0.00 C ATOM 371 C VAL A 26 0.182 -4.893 13.109 1.00 0.00 C ATOM 372 O VAL A 26 1.055 -5.007 12.247 1.00 0.00 O ATOM 373 CB VAL A 26 -1.693 -3.598 12.092 1.00 0.00 C ATOM 374 CG1 VAL A 26 -2.715 -4.710 12.269 1.00 0.00 C ATOM 375 CG2 VAL A 26 -2.376 -2.240 12.027 1.00 0.00 C ATOM 0 H VAL A 26 -0.084 -1.742 12.521 1.00 0.00 H new ATOM 0 HA VAL A 26 -1.181 -3.636 14.189 1.00 0.00 H new ATOM 0 HB VAL A 26 -1.172 -3.762 11.149 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -3.438 -4.673 11.454 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -2.208 -5.675 12.261 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -3.233 -4.580 13.219 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -3.104 -2.237 11.215 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -2.884 -2.043 12.971 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -1.630 -1.466 11.848 1.00 0.00 H new ATOM 385 N PRO A 27 -0.084 -5.870 13.989 1.00 0.00 N ATOM 386 CA PRO A 27 0.637 -7.145 13.998 1.00 0.00 C ATOM 387 C PRO A 27 0.300 -8.010 12.789 1.00 0.00 C ATOM 388 O PRO A 27 0.711 -9.168 12.706 1.00 0.00 O ATOM 389 CB PRO A 27 0.155 -7.817 15.287 1.00 0.00 C ATOM 390 CG PRO A 27 -1.183 -7.217 15.548 1.00 0.00 C ATOM 391 CD PRO A 27 -1.110 -5.803 15.044 1.00 0.00 C ATOM 0 HA PRO A 27 1.717 -7.002 13.953 1.00 0.00 H new ATOM 0 HB2 PRO A 27 0.088 -8.898 15.169 1.00 0.00 H new ATOM 0 HB3 PRO A 27 0.841 -7.629 16.112 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -1.967 -7.774 15.035 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.420 -7.240 16.612 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -2.069 -5.466 14.651 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -0.828 -5.108 15.835 1.00 0.00 H new ATOM 399 N THR A 28 -0.450 -7.441 11.851 1.00 0.00 N ATOM 400 CA THR A 28 -0.844 -8.160 10.645 1.00 0.00 C ATOM 401 C THR A 28 -0.272 -7.497 9.398 1.00 0.00 C ATOM 402 O THR A 28 -0.304 -8.069 8.309 1.00 0.00 O ATOM 403 CB THR A 28 -2.376 -8.241 10.513 1.00 0.00 C ATOM 404 OG1 THR A 28 -2.899 -6.973 10.102 1.00 0.00 O ATOM 405 CG2 THR A 28 -3.011 -8.652 11.833 1.00 0.00 C ATOM 0 H THR A 28 -0.797 -6.483 11.903 1.00 0.00 H new ATOM 0 HA THR A 28 -0.441 -9.169 10.734 1.00 0.00 H new ATOM 0 HB THR A 28 -2.615 -8.994 9.762 1.00 0.00 H new ATOM 0 HG1 THR A 28 -3.874 -7.033 10.018 1.00 0.00 H new ATOM 0 HG21 THR A 28 -4.094 -8.703 11.716 1.00 0.00 H new ATOM 0 HG22 THR A 28 -2.632 -9.630 12.130 1.00 0.00 H new ATOM 0 HG23 THR A 28 -2.763 -7.918 12.600 1.00 0.00 H new ATOM 413 N ASN A 29 0.252 -6.286 9.564 1.00 0.00 N ATOM 414 CA ASN A 29 0.831 -5.545 8.450 1.00 0.00 C ATOM 415 C ASN A 29 2.355 -5.547 8.529 1.00 0.00 C ATOM 416 O ASN A 29 3.040 -5.367 7.522 1.00 0.00 O ATOM 417 CB ASN A 29 0.311 -4.106 8.443 1.00 0.00 C ATOM 418 CG ASN A 29 -1.043 -3.984 7.772 1.00 0.00 C ATOM 419 OD1 ASN A 29 -1.389 -4.778 6.897 1.00 0.00 O ATOM 420 ND2 ASN A 29 -1.817 -2.985 8.180 1.00 0.00 N ATOM 0 H ASN A 29 0.287 -5.798 10.459 1.00 0.00 H new ATOM 0 HA ASN A 29 0.532 -6.037 7.524 1.00 0.00 H new ATOM 0 HB2 ASN A 29 0.239 -3.744 9.468 1.00 0.00 H new ATOM 0 HB3 ASN A 29 1.028 -3.466 7.928 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -2.739 -2.852 7.765 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -1.489 -2.351 8.908 1.00 0.00 H new ATOM 427 N LYS A 30 2.879 -5.752 9.733 1.00 0.00 N ATOM 428 CA LYS A 30 4.322 -5.780 9.945 1.00 0.00 C ATOM 429 C LYS A 30 4.904 -7.133 9.549 1.00 0.00 C ATOM 430 O LYS A 30 6.074 -7.416 9.809 1.00 0.00 O ATOM 431 CB LYS A 30 4.648 -5.481 11.410 1.00 0.00 C ATOM 432 CG LYS A 30 4.081 -6.503 12.381 1.00 0.00 C ATOM 433 CD LYS A 30 4.408 -6.146 13.821 1.00 0.00 C ATOM 434 CE LYS A 30 3.846 -4.784 14.199 1.00 0.00 C ATOM 435 NZ LYS A 30 3.741 -4.617 15.674 1.00 0.00 N ATOM 0 H LYS A 30 2.326 -5.901 10.577 1.00 0.00 H new ATOM 0 HA LYS A 30 4.772 -5.013 9.315 1.00 0.00 H new ATOM 0 HB2 LYS A 30 5.730 -5.439 11.531 1.00 0.00 H new ATOM 0 HB3 LYS A 30 4.260 -4.495 11.666 1.00 0.00 H new ATOM 0 HG2 LYS A 30 3.000 -6.563 12.257 1.00 0.00 H new ATOM 0 HG3 LYS A 30 4.484 -7.489 12.149 1.00 0.00 H new ATOM 0 HD2 LYS A 30 4.000 -6.907 14.487 1.00 0.00 H new ATOM 0 HD3 LYS A 30 5.489 -6.146 13.961 1.00 0.00 H new ATOM 0 HE2 LYS A 30 4.485 -4.001 13.790 1.00 0.00 H new ATOM 0 HE3 LYS A 30 2.861 -4.660 13.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 2.918 -4.022 15.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 3.627 -5.549 16.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 4.604 -4.163 16.034 1.00 0.00 H new ATOM 449 N VAL A 31 4.080 -7.965 8.920 1.00 0.00 N ATOM 450 CA VAL A 31 4.515 -9.288 8.486 1.00 0.00 C ATOM 451 C VAL A 31 4.048 -9.581 7.065 1.00 0.00 C ATOM 452 O VAL A 31 2.847 -9.616 6.788 1.00 0.00 O ATOM 453 CB VAL A 31 3.987 -10.388 9.425 1.00 0.00 C ATOM 454 CG1 VAL A 31 4.670 -10.305 10.782 1.00 0.00 C ATOM 455 CG2 VAL A 31 2.477 -10.283 9.572 1.00 0.00 C ATOM 0 H VAL A 31 3.108 -7.747 8.700 1.00 0.00 H new ATOM 0 HA VAL A 31 5.605 -9.288 8.515 1.00 0.00 H new ATOM 0 HB VAL A 31 4.220 -11.358 8.987 1.00 0.00 H new ATOM 0 HG11 VAL A 31 4.284 -11.090 11.432 1.00 0.00 H new ATOM 0 HG12 VAL A 31 5.745 -10.433 10.657 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.471 -9.332 11.231 1.00 0.00 H new ATOM 0 HG21 VAL A 31 2.121 -11.068 10.239 1.00 0.00 H new ATOM 0 HG22 VAL A 31 2.219 -9.309 9.988 1.00 0.00 H new ATOM 0 HG23 VAL A 31 2.008 -10.397 8.595 1.00 0.00 H new ATOM 465 N CYS A 32 5.002 -9.791 6.165 1.00 0.00 N ATOM 466 CA CYS A 32 4.690 -10.081 4.771 1.00 0.00 C ATOM 467 C CYS A 32 3.410 -10.907 4.661 1.00 0.00 C ATOM 468 O CYS A 32 3.394 -12.093 4.989 1.00 0.00 O ATOM 469 CB CYS A 32 5.850 -10.830 4.112 1.00 0.00 C ATOM 470 SG CYS A 32 5.465 -11.488 2.457 1.00 0.00 S ATOM 0 H CYS A 32 5.999 -9.766 6.377 1.00 0.00 H new ATOM 0 HA CYS A 32 4.537 -9.134 4.254 1.00 0.00 H new ATOM 0 HB2 CYS A 32 6.705 -10.158 4.034 1.00 0.00 H new ATOM 0 HB3 CYS A 32 6.150 -11.655 4.758 1.00 0.00 H new ATOM 0 HG CYS A 32 6.526 -12.047 1.955 1.00 0.00 H new ATOM 475 N PHE A 33 2.340 -10.270 4.196 1.00 0.00 N ATOM 476 CA PHE A 33 1.057 -10.944 4.043 1.00 0.00 C ATOM 477 C PHE A 33 1.229 -12.291 3.347 1.00 0.00 C ATOM 478 O PHE A 33 0.427 -13.206 3.535 1.00 0.00 O ATOM 479 CB PHE A 33 0.088 -10.066 3.248 1.00 0.00 C ATOM 480 CG PHE A 33 -0.909 -10.851 2.443 1.00 0.00 C ATOM 481 CD1 PHE A 33 -0.514 -11.541 1.308 1.00 0.00 C ATOM 482 CD2 PHE A 33 -2.241 -10.898 2.821 1.00 0.00 C ATOM 483 CE1 PHE A 33 -1.428 -12.263 0.566 1.00 0.00 C ATOM 484 CE2 PHE A 33 -3.160 -11.618 2.082 1.00 0.00 C ATOM 485 CZ PHE A 33 -2.753 -12.302 0.952 1.00 0.00 C ATOM 0 H PHE A 33 2.337 -9.288 3.919 1.00 0.00 H new ATOM 0 HA PHE A 33 0.646 -11.119 5.037 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -0.447 -9.413 3.937 1.00 0.00 H new ATOM 0 HB3 PHE A 33 0.659 -9.423 2.578 1.00 0.00 H new ATOM 0 HD1 PHE A 33 0.521 -11.514 1.000 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -2.565 -10.366 3.703 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -1.106 -12.797 -0.316 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -4.196 -11.646 2.387 1.00 0.00 H new ATOM 0 HZ PHE A 33 -3.469 -12.865 0.373 1.00 0.00 H new ATOM 495 N ASP A 34 2.279 -12.403 2.541 1.00 0.00 N ATOM 496 CA ASP A 34 2.557 -13.637 1.816 1.00 0.00 C ATOM 497 C ASP A 34 3.012 -14.738 2.771 1.00 0.00 C ATOM 498 O ASP A 34 2.282 -15.696 3.024 1.00 0.00 O ATOM 499 CB ASP A 34 3.627 -13.397 0.749 1.00 0.00 C ATOM 500 CG ASP A 34 3.459 -14.307 -0.452 1.00 0.00 C ATOM 501 OD1 ASP A 34 3.677 -15.528 -0.307 1.00 0.00 O ATOM 502 OD2 ASP A 34 3.112 -13.797 -1.538 1.00 0.00 O ATOM 0 H ASP A 34 2.951 -11.654 2.373 1.00 0.00 H new ATOM 0 HA ASP A 34 1.636 -13.959 1.330 1.00 0.00 H new ATOM 0 HB2 ASP A 34 3.585 -12.358 0.423 1.00 0.00 H new ATOM 0 HB3 ASP A 34 4.613 -13.554 1.185 1.00 0.00 H new ATOM 507 N CYS A 35 4.224 -14.593 3.298 1.00 0.00 N ATOM 508 CA CYS A 35 4.777 -15.574 4.223 1.00 0.00 C ATOM 509 C CYS A 35 4.604 -15.117 5.669 1.00 0.00 C ATOM 510 O CYS A 35 4.207 -15.896 6.533 1.00 0.00 O ATOM 511 CB CYS A 35 6.260 -15.808 3.924 1.00 0.00 C ATOM 512 SG CYS A 35 7.274 -14.294 3.964 1.00 0.00 S ATOM 0 H CYS A 35 4.841 -13.805 3.100 1.00 0.00 H new ATOM 0 HA CYS A 35 4.234 -16.509 4.089 1.00 0.00 H new ATOM 0 HB2 CYS A 35 6.658 -16.519 4.648 1.00 0.00 H new ATOM 0 HB3 CYS A 35 6.353 -16.269 2.941 1.00 0.00 H new ATOM 0 HG CYS A 35 6.621 -13.319 3.404 1.00 0.00 H new ATOM 517 N GLY A 36 4.906 -13.847 5.922 1.00 0.00 N ATOM 518 CA GLY A 36 4.777 -13.307 7.262 1.00 0.00 C ATOM 519 C GLY A 36 6.082 -12.745 7.790 1.00 0.00 C ATOM 520 O GLY A 36 6.203 -12.444 8.976 1.00 0.00 O ATOM 0 H GLY A 36 5.238 -13.183 5.222 1.00 0.00 H new ATOM 0 HA2 GLY A 36 4.021 -12.522 7.263 1.00 0.00 H new ATOM 0 HA3 GLY A 36 4.424 -14.090 7.933 1.00 0.00 H new ATOM 524 N ALA A 37 7.065 -12.606 6.905 1.00 0.00 N ATOM 525 CA ALA A 37 8.368 -12.077 7.287 1.00 0.00 C ATOM 526 C ALA A 37 8.227 -10.748 8.022 1.00 0.00 C ATOM 527 O ALA A 37 7.656 -9.793 7.494 1.00 0.00 O ATOM 528 CB ALA A 37 9.252 -11.913 6.060 1.00 0.00 C ATOM 0 H ALA A 37 6.983 -12.853 5.919 1.00 0.00 H new ATOM 0 HA ALA A 37 8.837 -12.790 7.966 1.00 0.00 H new ATOM 0 HB1 ALA A 37 10.222 -11.517 6.361 1.00 0.00 H new ATOM 0 HB2 ALA A 37 9.389 -12.881 5.578 1.00 0.00 H new ATOM 0 HB3 ALA A 37 8.779 -11.223 5.361 1.00 0.00 H new ATOM 534 N LYS A 38 8.749 -10.693 9.243 1.00 0.00 N ATOM 535 CA LYS A 38 8.683 -9.481 10.050 1.00 0.00 C ATOM 536 C LYS A 38 9.486 -8.354 9.407 1.00 0.00 C ATOM 537 O LYS A 38 10.557 -8.585 8.848 1.00 0.00 O ATOM 538 CB LYS A 38 9.206 -9.755 11.462 1.00 0.00 C ATOM 539 CG LYS A 38 8.309 -10.668 12.277 1.00 0.00 C ATOM 540 CD LYS A 38 8.549 -10.500 13.768 1.00 0.00 C ATOM 541 CE LYS A 38 7.782 -11.536 14.577 1.00 0.00 C ATOM 542 NZ LYS A 38 6.408 -11.071 14.914 1.00 0.00 N ATOM 0 H LYS A 38 9.223 -11.475 9.695 1.00 0.00 H new ATOM 0 HA LYS A 38 7.640 -9.170 10.110 1.00 0.00 H new ATOM 0 HB2 LYS A 38 10.198 -10.202 11.392 1.00 0.00 H new ATOM 0 HB3 LYS A 38 9.320 -8.807 11.988 1.00 0.00 H new ATOM 0 HG2 LYS A 38 7.265 -10.452 12.049 1.00 0.00 H new ATOM 0 HG3 LYS A 38 8.489 -11.705 11.993 1.00 0.00 H new ATOM 0 HD2 LYS A 38 9.615 -10.589 13.978 1.00 0.00 H new ATOM 0 HD3 LYS A 38 8.246 -9.499 14.076 1.00 0.00 H new ATOM 0 HE2 LYS A 38 7.722 -12.466 14.012 1.00 0.00 H new ATOM 0 HE3 LYS A 38 8.327 -11.755 15.495 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 5.919 -11.805 15.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 6.465 -10.197 15.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 5.879 -10.886 14.038 1.00 0.00 H new ATOM 556 N ASN A 39 8.961 -7.136 9.493 1.00 0.00 N ATOM 557 CA ASN A 39 9.631 -5.974 8.921 1.00 0.00 C ATOM 558 C ASN A 39 9.714 -6.087 7.402 1.00 0.00 C ATOM 559 O ASN A 39 10.768 -5.888 6.797 1.00 0.00 O ATOM 560 CB ASN A 39 11.034 -5.826 9.511 1.00 0.00 C ATOM 561 CG ASN A 39 11.032 -5.870 11.027 1.00 0.00 C ATOM 562 OD1 ASN A 39 10.371 -5.063 11.681 1.00 0.00 O ATOM 563 ND2 ASN A 39 11.774 -6.814 11.592 1.00 0.00 N ATOM 0 H ASN A 39 8.075 -6.928 9.953 1.00 0.00 H new ATOM 0 HA ASN A 39 9.045 -5.089 9.170 1.00 0.00 H new ATOM 0 HB2 ASN A 39 11.672 -6.623 9.128 1.00 0.00 H new ATOM 0 HB3 ASN A 39 11.467 -4.883 9.178 1.00 0.00 H new ATOM 0 HD21 ASN A 39 11.813 -6.892 12.608 1.00 0.00 H new ATOM 0 HD22 ASN A 39 12.306 -7.461 11.010 1.00 0.00 H new ATOM 570 N PRO A 40 8.577 -6.416 6.770 1.00 0.00 N ATOM 571 CA PRO A 40 8.495 -6.561 5.314 1.00 0.00 C ATOM 572 C PRO A 40 8.629 -5.227 4.588 1.00 0.00 C ATOM 573 O PRO A 40 7.633 -4.622 4.193 1.00 0.00 O ATOM 574 CB PRO A 40 7.101 -7.152 5.094 1.00 0.00 C ATOM 575 CG PRO A 40 6.314 -6.715 6.280 1.00 0.00 C ATOM 576 CD PRO A 40 7.285 -6.667 7.427 1.00 0.00 C ATOM 0 HA PRO A 40 9.302 -7.179 4.921 1.00 0.00 H new ATOM 0 HB2 PRO A 40 6.658 -6.786 4.168 1.00 0.00 H new ATOM 0 HB3 PRO A 40 7.138 -8.239 5.022 1.00 0.00 H new ATOM 0 HG2 PRO A 40 5.862 -5.738 6.110 1.00 0.00 H new ATOM 0 HG3 PRO A 40 5.501 -7.411 6.486 1.00 0.00 H new ATOM 0 HD2 PRO A 40 7.033 -5.876 8.134 1.00 0.00 H new ATOM 0 HD3 PRO A 40 7.293 -7.603 7.986 1.00 0.00 H new ATOM 584 N SER A 41 9.867 -4.774 4.415 1.00 0.00 N ATOM 585 CA SER A 41 10.131 -3.509 3.740 1.00 0.00 C ATOM 586 C SER A 41 9.265 -3.369 2.491 1.00 0.00 C ATOM 587 O SER A 41 8.369 -2.527 2.435 1.00 0.00 O ATOM 588 CB SER A 41 11.609 -3.406 3.363 1.00 0.00 C ATOM 589 OG SER A 41 12.054 -4.587 2.715 1.00 0.00 O ATOM 0 H SER A 41 10.703 -5.265 4.733 1.00 0.00 H new ATOM 0 HA SER A 41 9.882 -2.700 4.427 1.00 0.00 H new ATOM 0 HB2 SER A 41 11.761 -2.548 2.708 1.00 0.00 H new ATOM 0 HB3 SER A 41 12.205 -3.232 4.259 1.00 0.00 H new ATOM 0 HG SER A 41 13.002 -4.495 2.483 1.00 0.00 H new ATOM 595 N TRP A 42 9.540 -4.201 1.492 1.00 0.00 N ATOM 596 CA TRP A 42 8.786 -4.170 0.244 1.00 0.00 C ATOM 597 C TRP A 42 7.288 -4.089 0.514 1.00 0.00 C ATOM 598 O TRP A 42 6.792 -4.658 1.486 1.00 0.00 O ATOM 599 CB TRP A 42 9.100 -5.409 -0.596 1.00 0.00 C ATOM 600 CG TRP A 42 10.557 -5.558 -0.914 1.00 0.00 C ATOM 601 CD1 TRP A 42 11.518 -6.117 -0.121 1.00 0.00 C ATOM 602 CD2 TRP A 42 11.219 -5.138 -2.112 1.00 0.00 C ATOM 603 NE1 TRP A 42 12.736 -6.071 -0.754 1.00 0.00 N ATOM 604 CE2 TRP A 42 12.580 -5.475 -1.977 1.00 0.00 C ATOM 605 CE3 TRP A 42 10.794 -4.511 -3.287 1.00 0.00 C ATOM 606 CZ2 TRP A 42 13.515 -5.205 -2.972 1.00 0.00 C ATOM 607 CZ3 TRP A 42 11.725 -4.244 -4.273 1.00 0.00 C ATOM 608 CH2 TRP A 42 13.072 -4.591 -4.112 1.00 0.00 C ATOM 0 H TRP A 42 10.278 -4.904 1.522 1.00 0.00 H new ATOM 0 HA TRP A 42 9.084 -3.280 -0.309 1.00 0.00 H new ATOM 0 HB2 TRP A 42 8.759 -6.296 -0.063 1.00 0.00 H new ATOM 0 HB3 TRP A 42 8.535 -5.360 -1.527 1.00 0.00 H new ATOM 0 HD1 TRP A 42 11.346 -6.534 0.860 1.00 0.00 H new ATOM 0 HE1 TRP A 42 13.615 -6.424 -0.375 1.00 0.00 H new ATOM 0 HE3 TRP A 42 9.757 -4.240 -3.422 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 14.554 -5.471 -2.849 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 11.408 -3.759 -5.184 1.00 0.00 H new ATOM 0 HH2 TRP A 42 13.774 -4.370 -4.902 1.00 0.00 H new ATOM 619 N ALA A 43 6.572 -3.380 -0.352 1.00 0.00 N ATOM 620 CA ALA A 43 5.129 -3.227 -0.207 1.00 0.00 C ATOM 621 C ALA A 43 4.460 -3.028 -1.563 1.00 0.00 C ATOM 622 O ALA A 43 4.884 -2.190 -2.358 1.00 0.00 O ATOM 623 CB ALA A 43 4.812 -2.062 0.717 1.00 0.00 C ATOM 0 H ALA A 43 6.967 -2.902 -1.162 1.00 0.00 H new ATOM 0 HA ALA A 43 4.733 -4.142 0.233 1.00 0.00 H new ATOM 0 HB1 ALA A 43 3.731 -1.960 0.816 1.00 0.00 H new ATOM 0 HB2 ALA A 43 5.250 -2.246 1.698 1.00 0.00 H new ATOM 0 HB3 ALA A 43 5.227 -1.144 0.301 1.00 0.00 H new ATOM 629 N SER A 44 3.412 -3.804 -1.820 1.00 0.00 N ATOM 630 CA SER A 44 2.686 -3.715 -3.082 1.00 0.00 C ATOM 631 C SER A 44 1.520 -2.738 -2.970 1.00 0.00 C ATOM 632 O SER A 44 0.568 -2.973 -2.225 1.00 0.00 O ATOM 633 CB SER A 44 2.172 -5.095 -3.497 1.00 0.00 C ATOM 634 OG SER A 44 1.237 -4.993 -4.558 1.00 0.00 O ATOM 0 H SER A 44 3.047 -4.501 -1.171 1.00 0.00 H new ATOM 0 HA SER A 44 3.374 -3.347 -3.843 1.00 0.00 H new ATOM 0 HB2 SER A 44 3.009 -5.721 -3.805 1.00 0.00 H new ATOM 0 HB3 SER A 44 1.705 -5.585 -2.642 1.00 0.00 H new ATOM 0 HG SER A 44 0.925 -5.888 -4.806 1.00 0.00 H new ATOM 640 N ILE A 45 1.602 -1.641 -3.715 1.00 0.00 N ATOM 641 CA ILE A 45 0.553 -0.628 -3.701 1.00 0.00 C ATOM 642 C ILE A 45 -0.742 -1.170 -4.298 1.00 0.00 C ATOM 643 O ILE A 45 -1.821 -0.988 -3.734 1.00 0.00 O ATOM 644 CB ILE A 45 0.978 0.632 -4.480 1.00 0.00 C ATOM 645 CG1 ILE A 45 2.303 1.169 -3.939 1.00 0.00 C ATOM 646 CG2 ILE A 45 -0.107 1.695 -4.395 1.00 0.00 C ATOM 647 CD1 ILE A 45 3.114 1.925 -4.969 1.00 0.00 C ATOM 0 H ILE A 45 2.384 -1.431 -4.336 1.00 0.00 H new ATOM 0 HA ILE A 45 0.385 -0.361 -2.658 1.00 0.00 H new ATOM 0 HB ILE A 45 1.118 0.366 -5.528 1.00 0.00 H new ATOM 0 HG12 ILE A 45 2.101 1.826 -3.093 1.00 0.00 H new ATOM 0 HG13 ILE A 45 2.896 0.336 -3.561 1.00 0.00 H new ATOM 0 HG21 ILE A 45 0.206 2.580 -4.949 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -1.031 1.307 -4.823 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -0.274 1.961 -3.351 1.00 0.00 H new ATOM 0 HD11 ILE A 45 4.041 2.277 -4.516 1.00 0.00 H new ATOM 0 HD12 ILE A 45 3.347 1.265 -5.805 1.00 0.00 H new ATOM 0 HD13 ILE A 45 2.540 2.778 -5.330 1.00 0.00 H new ATOM 659 N THR A 46 -0.627 -1.838 -5.441 1.00 0.00 N ATOM 660 CA THR A 46 -1.787 -2.406 -6.115 1.00 0.00 C ATOM 661 C THR A 46 -2.734 -3.063 -5.117 1.00 0.00 C ATOM 662 O THR A 46 -3.889 -2.658 -4.984 1.00 0.00 O ATOM 663 CB THR A 46 -1.370 -3.447 -7.171 1.00 0.00 C ATOM 664 OG1 THR A 46 -0.518 -2.839 -8.148 1.00 0.00 O ATOM 665 CG2 THR A 46 -2.591 -4.043 -7.854 1.00 0.00 C ATOM 0 H THR A 46 0.259 -1.999 -5.920 1.00 0.00 H new ATOM 0 HA THR A 46 -2.299 -1.582 -6.611 1.00 0.00 H new ATOM 0 HB THR A 46 -0.829 -4.248 -6.667 1.00 0.00 H new ATOM 0 HG1 THR A 46 -0.846 -3.052 -9.046 1.00 0.00 H new ATOM 0 HG21 THR A 46 -2.272 -4.775 -8.596 1.00 0.00 H new ATOM 0 HG22 THR A 46 -3.222 -4.530 -7.111 1.00 0.00 H new ATOM 0 HG23 THR A 46 -3.156 -3.251 -8.346 1.00 0.00 H new ATOM 673 N TYR A 47 -2.238 -4.077 -4.416 1.00 0.00 N ATOM 674 CA TYR A 47 -3.041 -4.791 -3.432 1.00 0.00 C ATOM 675 C TYR A 47 -2.822 -4.221 -2.033 1.00 0.00 C ATOM 676 O TYR A 47 -3.173 -4.846 -1.034 1.00 0.00 O ATOM 677 CB TYR A 47 -2.699 -6.281 -3.446 1.00 0.00 C ATOM 678 CG TYR A 47 -3.094 -6.980 -4.727 1.00 0.00 C ATOM 679 CD1 TYR A 47 -2.348 -6.818 -5.889 1.00 0.00 C ATOM 680 CD2 TYR A 47 -4.213 -7.802 -4.777 1.00 0.00 C ATOM 681 CE1 TYR A 47 -2.705 -7.455 -7.062 1.00 0.00 C ATOM 682 CE2 TYR A 47 -4.577 -8.444 -5.946 1.00 0.00 C ATOM 683 CZ TYR A 47 -3.820 -8.267 -7.085 1.00 0.00 C ATOM 684 OH TYR A 47 -4.181 -8.903 -8.251 1.00 0.00 O ATOM 0 H TYR A 47 -1.283 -4.422 -4.512 1.00 0.00 H new ATOM 0 HA TYR A 47 -4.091 -4.664 -3.697 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -1.627 -6.401 -3.292 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -3.197 -6.768 -2.608 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -1.474 -6.183 -5.875 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -4.809 -7.942 -3.887 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -2.114 -7.318 -7.956 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -5.449 -9.081 -5.967 1.00 0.00 H new ATOM 0 HH TYR A 47 -3.380 -9.085 -8.786 1.00 0.00 H new ATOM 694 N GLY A 48 -2.238 -3.027 -1.972 1.00 0.00 N ATOM 695 CA GLY A 48 -1.982 -2.392 -0.694 1.00 0.00 C ATOM 696 C GLY A 48 -1.608 -3.390 0.385 1.00 0.00 C ATOM 697 O GLY A 48 -2.228 -3.427 1.449 1.00 0.00 O ATOM 0 H GLY A 48 -1.938 -2.489 -2.785 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -1.177 -1.666 -0.807 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -2.868 -1.840 -0.382 1.00 0.00 H new ATOM 701 N VAL A 49 -0.592 -4.201 0.112 1.00 0.00 N ATOM 702 CA VAL A 49 -0.137 -5.205 1.067 1.00 0.00 C ATOM 703 C VAL A 49 1.377 -5.148 1.243 1.00 0.00 C ATOM 704 O VAL A 49 2.084 -4.535 0.444 1.00 0.00 O ATOM 705 CB VAL A 49 -0.539 -6.624 0.624 1.00 0.00 C ATOM 706 CG1 VAL A 49 -2.026 -6.851 0.845 1.00 0.00 C ATOM 707 CG2 VAL A 49 -0.167 -6.853 -0.834 1.00 0.00 C ATOM 0 H VAL A 49 -0.068 -4.183 -0.763 1.00 0.00 H new ATOM 0 HA VAL A 49 -0.620 -4.980 2.018 1.00 0.00 H new ATOM 0 HB VAL A 49 0.008 -7.344 1.232 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -2.292 -7.859 0.526 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -2.259 -6.732 1.903 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -2.595 -6.125 0.264 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -0.458 -7.861 -1.130 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -0.685 -6.127 -1.460 1.00 0.00 H new ATOM 0 HG23 VAL A 49 0.910 -6.736 -0.958 1.00 0.00 H new ATOM 717 N PHE A 50 1.869 -5.793 2.296 1.00 0.00 N ATOM 718 CA PHE A 50 3.299 -5.817 2.579 1.00 0.00 C ATOM 719 C PHE A 50 3.929 -7.117 2.087 1.00 0.00 C ATOM 720 O PHE A 50 3.315 -8.182 2.154 1.00 0.00 O ATOM 721 CB PHE A 50 3.546 -5.653 4.079 1.00 0.00 C ATOM 722 CG PHE A 50 3.485 -4.225 4.544 1.00 0.00 C ATOM 723 CD1 PHE A 50 4.595 -3.403 4.446 1.00 0.00 C ATOM 724 CD2 PHE A 50 2.317 -3.708 5.081 1.00 0.00 C ATOM 725 CE1 PHE A 50 4.542 -2.089 4.873 1.00 0.00 C ATOM 726 CE2 PHE A 50 2.258 -2.395 5.509 1.00 0.00 C ATOM 727 CZ PHE A 50 3.372 -1.584 5.405 1.00 0.00 C ATOM 0 H PHE A 50 1.298 -6.306 2.967 1.00 0.00 H new ATOM 0 HA PHE A 50 3.763 -4.986 2.049 1.00 0.00 H new ATOM 0 HB2 PHE A 50 2.807 -6.237 4.627 1.00 0.00 H new ATOM 0 HB3 PHE A 50 4.524 -6.066 4.325 1.00 0.00 H new ATOM 0 HD1 PHE A 50 5.513 -3.793 4.031 1.00 0.00 H new ATOM 0 HD2 PHE A 50 1.444 -4.338 5.166 1.00 0.00 H new ATOM 0 HE1 PHE A 50 5.415 -1.458 4.791 1.00 0.00 H new ATOM 0 HE2 PHE A 50 1.341 -2.003 5.925 1.00 0.00 H new ATOM 0 HZ PHE A 50 3.328 -0.558 5.739 1.00 0.00 H new ATOM 737 N LEU A 51 5.158 -7.020 1.591 1.00 0.00 N ATOM 738 CA LEU A 51 5.872 -8.188 1.087 1.00 0.00 C ATOM 739 C LEU A 51 7.339 -8.151 1.505 1.00 0.00 C ATOM 740 O LEU A 51 7.830 -7.134 1.997 1.00 0.00 O ATOM 741 CB LEU A 51 5.767 -8.257 -0.437 1.00 0.00 C ATOM 742 CG LEU A 51 4.351 -8.225 -1.014 1.00 0.00 C ATOM 743 CD1 LEU A 51 4.389 -7.939 -2.507 1.00 0.00 C ATOM 744 CD2 LEU A 51 3.635 -9.540 -0.739 1.00 0.00 C ATOM 0 H LEU A 51 5.680 -6.146 1.527 1.00 0.00 H new ATOM 0 HA LEU A 51 5.412 -9.078 1.517 1.00 0.00 H new ATOM 0 HB2 LEU A 51 6.328 -7.423 -0.858 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.255 -9.172 -0.774 1.00 0.00 H new ATOM 0 HG LEU A 51 3.798 -7.423 -0.526 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.372 -7.920 -2.900 1.00 0.00 H new ATOM 0 HD12 LEU A 51 4.863 -6.973 -2.680 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.959 -8.719 -3.012 1.00 0.00 H new ATOM 0 HD21 LEU A 51 2.629 -9.501 -1.156 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.187 -10.358 -1.201 1.00 0.00 H new ATOM 0 HD23 LEU A 51 3.576 -9.704 0.337 1.00 0.00 H new ATOM 756 N CYS A 52 8.035 -9.266 1.304 1.00 0.00 N ATOM 757 CA CYS A 52 9.446 -9.361 1.658 1.00 0.00 C ATOM 758 C CYS A 52 10.309 -9.535 0.413 1.00 0.00 C ATOM 759 O CYS A 52 9.874 -10.123 -0.579 1.00 0.00 O ATOM 760 CB CYS A 52 9.673 -10.531 2.618 1.00 0.00 C ATOM 761 SG CYS A 52 9.371 -12.168 1.879 1.00 0.00 S ATOM 0 H CYS A 52 7.644 -10.116 0.898 1.00 0.00 H new ATOM 0 HA CYS A 52 9.735 -8.433 2.151 1.00 0.00 H new ATOM 0 HB2 CYS A 52 10.699 -10.493 2.984 1.00 0.00 H new ATOM 0 HB3 CYS A 52 9.021 -10.409 3.483 1.00 0.00 H new ATOM 0 HG CYS A 52 8.620 -12.871 2.674 1.00 0.00 H new ATOM 766 N ILE A 53 11.532 -9.023 0.471 1.00 0.00 N ATOM 767 CA ILE A 53 12.457 -9.123 -0.651 1.00 0.00 C ATOM 768 C ILE A 53 12.234 -10.412 -1.434 1.00 0.00 C ATOM 769 O ILE A 53 12.229 -10.411 -2.665 1.00 0.00 O ATOM 770 CB ILE A 53 13.923 -9.069 -0.181 1.00 0.00 C ATOM 771 CG1 ILE A 53 14.869 -9.144 -1.380 1.00 0.00 C ATOM 772 CG2 ILE A 53 14.206 -10.200 0.797 1.00 0.00 C ATOM 773 CD1 ILE A 53 14.974 -7.847 -2.151 1.00 0.00 C ATOM 0 H ILE A 53 11.907 -8.534 1.284 1.00 0.00 H new ATOM 0 HA ILE A 53 12.260 -8.268 -1.298 1.00 0.00 H new ATOM 0 HB ILE A 53 14.091 -8.121 0.331 1.00 0.00 H new ATOM 0 HG12 ILE A 53 15.861 -9.431 -1.032 1.00 0.00 H new ATOM 0 HG13 ILE A 53 14.527 -9.930 -2.053 1.00 0.00 H new ATOM 0 HG21 ILE A 53 15.246 -10.149 1.121 1.00 0.00 H new ATOM 0 HG22 ILE A 53 13.551 -10.104 1.663 1.00 0.00 H new ATOM 0 HG23 ILE A 53 14.024 -11.157 0.309 1.00 0.00 H new ATOM 0 HD11 ILE A 53 15.662 -7.975 -2.987 1.00 0.00 H new ATOM 0 HD12 ILE A 53 13.991 -7.568 -2.530 1.00 0.00 H new ATOM 0 HD13 ILE A 53 15.345 -7.061 -1.493 1.00 0.00 H new ATOM 785 N ASP A 54 12.046 -11.512 -0.712 1.00 0.00 N ATOM 786 CA ASP A 54 11.818 -12.808 -1.339 1.00 0.00 C ATOM 787 C ASP A 54 10.549 -12.789 -2.182 1.00 0.00 C ATOM 788 O ASP A 54 10.607 -12.817 -3.412 1.00 0.00 O ATOM 789 CB ASP A 54 11.722 -13.903 -0.274 1.00 0.00 C ATOM 790 CG ASP A 54 12.068 -15.274 -0.820 1.00 0.00 C ATOM 791 OD1 ASP A 54 13.077 -15.386 -1.548 1.00 0.00 O ATOM 792 OD2 ASP A 54 11.330 -16.235 -0.519 1.00 0.00 O ATOM 0 H ASP A 54 12.047 -11.531 0.308 1.00 0.00 H new ATOM 0 HA ASP A 54 12.663 -13.021 -1.994 1.00 0.00 H new ATOM 0 HB2 ASP A 54 12.393 -13.664 0.551 1.00 0.00 H new ATOM 0 HB3 ASP A 54 10.711 -13.922 0.133 1.00 0.00 H new ATOM 797 N CYS A 55 9.401 -12.742 -1.514 1.00 0.00 N ATOM 798 CA CYS A 55 8.116 -12.720 -2.202 1.00 0.00 C ATOM 799 C CYS A 55 8.046 -11.559 -3.190 1.00 0.00 C ATOM 800 O CYS A 55 7.808 -11.757 -4.380 1.00 0.00 O ATOM 801 CB CYS A 55 6.974 -12.611 -1.189 1.00 0.00 C ATOM 802 SG CYS A 55 6.890 -13.998 -0.011 1.00 0.00 S ATOM 0 H CYS A 55 9.335 -12.718 -0.496 1.00 0.00 H new ATOM 0 HA CYS A 55 8.014 -13.652 -2.757 1.00 0.00 H new ATOM 0 HB2 CYS A 55 7.085 -11.681 -0.631 1.00 0.00 H new ATOM 0 HB3 CYS A 55 6.029 -12.549 -1.728 1.00 0.00 H new ATOM 0 HG CYS A 55 7.710 -13.781 0.974 1.00 0.00 H new ATOM 807 N SER A 56 8.258 -10.347 -2.685 1.00 0.00 N ATOM 808 CA SER A 56 8.217 -9.153 -3.522 1.00 0.00 C ATOM 809 C SER A 56 8.731 -9.456 -4.926 1.00 0.00 C ATOM 810 O SER A 56 8.237 -8.910 -5.912 1.00 0.00 O ATOM 811 CB SER A 56 9.047 -8.034 -2.891 1.00 0.00 C ATOM 812 OG SER A 56 10.380 -8.456 -2.663 1.00 0.00 O ATOM 0 H SER A 56 8.460 -10.166 -1.702 1.00 0.00 H new ATOM 0 HA SER A 56 7.180 -8.827 -3.597 1.00 0.00 H new ATOM 0 HB2 SER A 56 9.045 -7.162 -3.545 1.00 0.00 H new ATOM 0 HB3 SER A 56 8.593 -7.727 -1.949 1.00 0.00 H new ATOM 0 HG SER A 56 10.463 -9.408 -2.880 1.00 0.00 H new ATOM 818 N GLY A 57 9.730 -10.329 -5.007 1.00 0.00 N ATOM 819 CA GLY A 57 10.297 -10.690 -6.294 1.00 0.00 C ATOM 820 C GLY A 57 9.262 -11.260 -7.245 1.00 0.00 C ATOM 821 O GLY A 57 9.181 -10.850 -8.402 1.00 0.00 O ATOM 0 H GLY A 57 10.157 -10.793 -4.205 1.00 0.00 H new ATOM 0 HA2 GLY A 57 10.755 -9.810 -6.745 1.00 0.00 H new ATOM 0 HA3 GLY A 57 11.091 -11.422 -6.145 1.00 0.00 H new ATOM 825 N SER A 58 8.470 -12.209 -6.756 1.00 0.00 N ATOM 826 CA SER A 58 7.439 -12.840 -7.571 1.00 0.00 C ATOM 827 C SER A 58 6.547 -11.789 -8.226 1.00 0.00 C ATOM 828 O SER A 58 6.231 -11.879 -9.413 1.00 0.00 O ATOM 829 CB SER A 58 6.592 -13.786 -6.718 1.00 0.00 C ATOM 830 OG SER A 58 7.183 -15.072 -6.644 1.00 0.00 O ATOM 0 H SER A 58 8.523 -12.558 -5.799 1.00 0.00 H new ATOM 0 HA SER A 58 7.931 -13.414 -8.356 1.00 0.00 H new ATOM 0 HB2 SER A 58 6.481 -13.375 -5.715 1.00 0.00 H new ATOM 0 HB3 SER A 58 5.591 -13.866 -7.142 1.00 0.00 H new ATOM 0 HG SER A 58 6.624 -15.658 -6.092 1.00 0.00 H new ATOM 836 N HIS A 59 6.141 -10.795 -7.443 1.00 0.00 N ATOM 837 CA HIS A 59 5.285 -9.727 -7.945 1.00 0.00 C ATOM 838 C HIS A 59 5.977 -8.957 -9.065 1.00 0.00 C ATOM 839 O HIS A 59 5.387 -8.706 -10.116 1.00 0.00 O ATOM 840 CB HIS A 59 4.906 -8.772 -6.812 1.00 0.00 C ATOM 841 CG HIS A 59 3.709 -9.216 -6.030 1.00 0.00 C ATOM 842 ND1 HIS A 59 2.474 -8.610 -6.137 1.00 0.00 N ATOM 843 CD2 HIS A 59 3.560 -10.212 -5.126 1.00 0.00 C ATOM 844 CE1 HIS A 59 1.619 -9.214 -5.332 1.00 0.00 C ATOM 845 NE2 HIS A 59 2.253 -10.191 -4.706 1.00 0.00 N ATOM 0 H HIS A 59 6.391 -10.707 -6.458 1.00 0.00 H new ATOM 0 HA HIS A 59 4.378 -10.180 -8.346 1.00 0.00 H new ATOM 0 HB2 HIS A 59 5.754 -8.669 -6.135 1.00 0.00 H new ATOM 0 HB3 HIS A 59 4.711 -7.785 -7.230 1.00 0.00 H new ATOM 0 HD2 HIS A 59 4.327 -10.897 -4.796 1.00 0.00 H new ATOM 0 HE1 HIS A 59 0.578 -8.954 -5.206 1.00 0.00 H new ATOM 0 HE2 HIS A 59 1.839 -10.825 -4.023 1.00 0.00 H new ATOM 853 N ARG A 60 7.231 -8.583 -8.832 1.00 0.00 N ATOM 854 CA ARG A 60 8.003 -7.839 -9.821 1.00 0.00 C ATOM 855 C ARG A 60 7.913 -8.502 -11.191 1.00 0.00 C ATOM 856 O ARG A 60 7.839 -7.824 -12.216 1.00 0.00 O ATOM 857 CB ARG A 60 9.466 -7.739 -9.386 1.00 0.00 C ATOM 858 CG ARG A 60 9.677 -6.881 -8.149 1.00 0.00 C ATOM 859 CD ARG A 60 11.094 -7.015 -7.614 1.00 0.00 C ATOM 860 NE ARG A 60 12.052 -6.242 -8.401 1.00 0.00 N ATOM 861 CZ ARG A 60 13.357 -6.485 -8.413 1.00 0.00 C ATOM 862 NH1 ARG A 60 13.859 -7.473 -7.686 1.00 0.00 N ATOM 863 NH2 ARG A 60 14.165 -5.737 -9.156 1.00 0.00 N ATOM 0 H ARG A 60 7.734 -8.783 -7.967 1.00 0.00 H new ATOM 0 HA ARG A 60 7.583 -6.836 -9.894 1.00 0.00 H new ATOM 0 HB2 ARG A 60 9.848 -8.741 -9.192 1.00 0.00 H new ATOM 0 HB3 ARG A 60 10.053 -7.328 -10.207 1.00 0.00 H new ATOM 0 HG2 ARG A 60 9.475 -5.837 -8.390 1.00 0.00 H new ATOM 0 HG3 ARG A 60 8.966 -7.173 -7.376 1.00 0.00 H new ATOM 0 HD2 ARG A 60 11.123 -6.680 -6.577 1.00 0.00 H new ATOM 0 HD3 ARG A 60 11.385 -8.065 -7.618 1.00 0.00 H new ATOM 0 HE ARG A 60 11.699 -5.474 -8.972 1.00 0.00 H new ATOM 0 HH11 ARG A 60 13.242 -8.050 -7.114 1.00 0.00 H new ATOM 0 HH12 ARG A 60 14.862 -7.656 -7.698 1.00 0.00 H new ATOM 0 HH21 ARG A 60 13.783 -4.976 -9.717 1.00 0.00 H new ATOM 0 HH22 ARG A 60 15.168 -5.924 -9.165 1.00 0.00 H new ATOM 877 N SER A 61 7.918 -9.831 -11.202 1.00 0.00 N ATOM 878 CA SER A 61 7.841 -10.586 -12.447 1.00 0.00 C ATOM 879 C SER A 61 6.503 -10.352 -13.143 1.00 0.00 C ATOM 880 O SER A 61 6.452 -10.088 -14.345 1.00 0.00 O ATOM 881 CB SER A 61 8.033 -12.079 -12.176 1.00 0.00 C ATOM 882 OG SER A 61 9.349 -12.351 -11.729 1.00 0.00 O ATOM 0 H SER A 61 7.975 -10.407 -10.362 1.00 0.00 H new ATOM 0 HA SER A 61 8.638 -10.238 -13.104 1.00 0.00 H new ATOM 0 HB2 SER A 61 7.315 -12.411 -11.426 1.00 0.00 H new ATOM 0 HB3 SER A 61 7.830 -12.646 -13.085 1.00 0.00 H new ATOM 0 HG SER A 61 9.445 -13.312 -11.561 1.00 0.00 H new ATOM 888 N LEU A 62 5.421 -10.450 -12.379 1.00 0.00 N ATOM 889 CA LEU A 62 4.081 -10.249 -12.919 1.00 0.00 C ATOM 890 C LEU A 62 4.037 -9.020 -13.821 1.00 0.00 C ATOM 891 O LEU A 62 3.505 -9.069 -14.929 1.00 0.00 O ATOM 892 CB LEU A 62 3.068 -10.099 -11.783 1.00 0.00 C ATOM 893 CG LEU A 62 3.022 -11.242 -10.769 1.00 0.00 C ATOM 894 CD1 LEU A 62 2.025 -10.934 -9.662 1.00 0.00 C ATOM 895 CD2 LEU A 62 2.668 -12.552 -11.459 1.00 0.00 C ATOM 0 H LEU A 62 5.445 -10.668 -11.383 1.00 0.00 H new ATOM 0 HA LEU A 62 3.821 -11.124 -13.515 1.00 0.00 H new ATOM 0 HB2 LEU A 62 3.286 -9.174 -11.248 1.00 0.00 H new ATOM 0 HB3 LEU A 62 2.076 -9.988 -12.220 1.00 0.00 H new ATOM 0 HG LEU A 62 4.010 -11.345 -10.321 1.00 0.00 H new ATOM 0 HD11 LEU A 62 2.006 -11.759 -8.950 1.00 0.00 H new ATOM 0 HD12 LEU A 62 2.321 -10.019 -9.150 1.00 0.00 H new ATOM 0 HD13 LEU A 62 1.032 -10.803 -10.092 1.00 0.00 H new ATOM 0 HD21 LEU A 62 2.640 -13.355 -10.723 1.00 0.00 H new ATOM 0 HD22 LEU A 62 1.691 -12.461 -11.934 1.00 0.00 H new ATOM 0 HD23 LEU A 62 3.419 -12.780 -12.215 1.00 0.00 H new ATOM 907 N GLY A 63 4.604 -7.918 -13.340 1.00 0.00 N ATOM 908 CA GLY A 63 4.620 -6.692 -14.116 1.00 0.00 C ATOM 909 C GLY A 63 4.112 -5.500 -13.330 1.00 0.00 C ATOM 910 O GLY A 63 3.078 -5.581 -12.665 1.00 0.00 O ATOM 0 H GLY A 63 5.053 -7.852 -12.426 1.00 0.00 H new ATOM 0 HA2 GLY A 63 5.637 -6.493 -14.454 1.00 0.00 H new ATOM 0 HA3 GLY A 63 4.007 -6.823 -15.008 1.00 0.00 H new ATOM 914 N VAL A 64 4.840 -4.390 -13.402 1.00 0.00 N ATOM 915 CA VAL A 64 4.457 -3.177 -12.691 1.00 0.00 C ATOM 916 C VAL A 64 2.975 -2.874 -12.878 1.00 0.00 C ATOM 917 O VAL A 64 2.356 -2.210 -12.046 1.00 0.00 O ATOM 918 CB VAL A 64 5.282 -1.965 -13.165 1.00 0.00 C ATOM 919 CG1 VAL A 64 6.768 -2.223 -12.975 1.00 0.00 C ATOM 920 CG2 VAL A 64 4.968 -1.644 -14.619 1.00 0.00 C ATOM 0 H VAL A 64 5.699 -4.306 -13.946 1.00 0.00 H new ATOM 0 HA VAL A 64 4.657 -3.353 -11.634 1.00 0.00 H new ATOM 0 HB VAL A 64 5.009 -1.101 -12.559 1.00 0.00 H new ATOM 0 HG11 VAL A 64 7.334 -1.356 -13.315 1.00 0.00 H new ATOM 0 HG12 VAL A 64 6.975 -2.400 -11.919 1.00 0.00 H new ATOM 0 HG13 VAL A 64 7.062 -3.099 -13.554 1.00 0.00 H new ATOM 0 HG21 VAL A 64 5.559 -0.786 -14.938 1.00 0.00 H new ATOM 0 HG22 VAL A 64 5.212 -2.504 -15.242 1.00 0.00 H new ATOM 0 HG23 VAL A 64 3.908 -1.412 -14.720 1.00 0.00 H new ATOM 930 N HIS A 65 2.410 -3.365 -13.977 1.00 0.00 N ATOM 931 CA HIS A 65 0.998 -3.149 -14.274 1.00 0.00 C ATOM 932 C HIS A 65 0.119 -4.064 -13.429 1.00 0.00 C ATOM 933 O HIS A 65 -0.976 -3.680 -13.013 1.00 0.00 O ATOM 934 CB HIS A 65 0.725 -3.388 -15.759 1.00 0.00 C ATOM 935 CG HIS A 65 1.217 -4.714 -16.252 1.00 0.00 C ATOM 936 ND1 HIS A 65 2.519 -4.932 -16.653 1.00 0.00 N ATOM 937 CD2 HIS A 65 0.576 -5.896 -16.405 1.00 0.00 C ATOM 938 CE1 HIS A 65 2.656 -6.189 -17.034 1.00 0.00 C ATOM 939 NE2 HIS A 65 1.491 -6.797 -16.893 1.00 0.00 N ATOM 0 H HIS A 65 2.908 -3.915 -14.677 1.00 0.00 H new ATOM 0 HA HIS A 65 0.755 -2.115 -14.030 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -0.348 -3.318 -15.939 1.00 0.00 H new ATOM 0 HB3 HIS A 65 1.198 -2.596 -16.339 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -0.462 -6.094 -16.184 1.00 0.00 H new ATOM 0 HE1 HIS A 65 3.565 -6.643 -17.399 1.00 0.00 H new ATOM 0 HE2 HIS A 65 1.302 -7.775 -17.111 1.00 0.00 H new ATOM 947 N LEU A 66 0.603 -5.275 -13.177 1.00 0.00 N ATOM 948 CA LEU A 66 -0.139 -6.245 -12.381 1.00 0.00 C ATOM 949 C LEU A 66 0.004 -5.953 -10.891 1.00 0.00 C ATOM 950 O LEU A 66 -0.953 -6.080 -10.127 1.00 0.00 O ATOM 951 CB LEU A 66 0.349 -7.663 -12.682 1.00 0.00 C ATOM 952 CG LEU A 66 -0.699 -8.771 -12.580 1.00 0.00 C ATOM 953 CD1 LEU A 66 -0.239 -10.012 -13.329 1.00 0.00 C ATOM 954 CD2 LEU A 66 -0.985 -9.102 -11.122 1.00 0.00 C ATOM 0 H LEU A 66 1.507 -5.608 -13.513 1.00 0.00 H new ATOM 0 HA LEU A 66 -1.193 -6.165 -12.649 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.765 -7.676 -13.689 1.00 0.00 H new ATOM 0 HB3 LEU A 66 1.164 -7.898 -11.998 1.00 0.00 H new ATOM 0 HG LEU A 66 -1.621 -8.415 -13.039 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -0.998 -10.790 -13.245 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.085 -9.767 -14.380 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.697 -10.370 -12.900 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -1.733 -9.893 -11.068 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -0.068 -9.437 -10.638 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.359 -8.213 -10.614 1.00 0.00 H new ATOM 966 N SER A 67 1.206 -5.557 -10.484 1.00 0.00 N ATOM 967 CA SER A 67 1.476 -5.246 -9.085 1.00 0.00 C ATOM 968 C SER A 67 2.751 -4.420 -8.948 1.00 0.00 C ATOM 969 O SER A 67 3.859 -4.939 -9.085 1.00 0.00 O ATOM 970 CB SER A 67 1.599 -6.534 -8.269 1.00 0.00 C ATOM 971 OG SER A 67 0.341 -6.935 -7.755 1.00 0.00 O ATOM 0 H SER A 67 2.008 -5.444 -11.103 1.00 0.00 H new ATOM 0 HA SER A 67 0.641 -4.659 -8.701 1.00 0.00 H new ATOM 0 HB2 SER A 67 2.009 -7.327 -8.895 1.00 0.00 H new ATOM 0 HB3 SER A 67 2.299 -6.382 -7.448 1.00 0.00 H new ATOM 0 HG SER A 67 -0.362 -6.714 -8.401 1.00 0.00 H new ATOM 977 N PHE A 68 2.586 -3.130 -8.677 1.00 0.00 N ATOM 978 CA PHE A 68 3.723 -2.229 -8.523 1.00 0.00 C ATOM 979 C PHE A 68 4.341 -2.367 -7.134 1.00 0.00 C ATOM 980 O PHE A 68 3.646 -2.280 -6.122 1.00 0.00 O ATOM 981 CB PHE A 68 3.290 -0.781 -8.758 1.00 0.00 C ATOM 982 CG PHE A 68 4.403 0.107 -9.235 1.00 0.00 C ATOM 983 CD1 PHE A 68 5.303 0.656 -8.336 1.00 0.00 C ATOM 984 CD2 PHE A 68 4.549 0.394 -10.583 1.00 0.00 C ATOM 985 CE1 PHE A 68 6.328 1.475 -8.772 1.00 0.00 C ATOM 986 CE2 PHE A 68 5.573 1.212 -11.025 1.00 0.00 C ATOM 987 CZ PHE A 68 6.464 1.752 -10.118 1.00 0.00 C ATOM 0 H PHE A 68 1.676 -2.684 -8.559 1.00 0.00 H new ATOM 0 HA PHE A 68 4.473 -2.501 -9.265 1.00 0.00 H new ATOM 0 HB2 PHE A 68 2.484 -0.766 -9.491 1.00 0.00 H new ATOM 0 HB3 PHE A 68 2.885 -0.376 -7.831 1.00 0.00 H new ATOM 0 HD1 PHE A 68 5.203 0.442 -7.282 1.00 0.00 H new ATOM 0 HD2 PHE A 68 3.855 -0.026 -11.296 1.00 0.00 H new ATOM 0 HE1 PHE A 68 7.022 1.898 -8.060 1.00 0.00 H new ATOM 0 HE2 PHE A 68 5.676 1.428 -12.078 1.00 0.00 H new ATOM 0 HZ PHE A 68 7.265 2.390 -10.461 1.00 0.00 H new ATOM 997 N ILE A 69 5.652 -2.584 -7.095 1.00 0.00 N ATOM 998 CA ILE A 69 6.363 -2.734 -5.833 1.00 0.00 C ATOM 999 C ILE A 69 7.154 -1.474 -5.494 1.00 0.00 C ATOM 1000 O ILE A 69 7.648 -0.782 -6.384 1.00 0.00 O ATOM 1001 CB ILE A 69 7.325 -3.936 -5.867 1.00 0.00 C ATOM 1002 CG1 ILE A 69 6.761 -5.042 -6.761 1.00 0.00 C ATOM 1003 CG2 ILE A 69 7.570 -4.459 -4.460 1.00 0.00 C ATOM 1004 CD1 ILE A 69 5.519 -5.698 -6.201 1.00 0.00 C ATOM 0 H ILE A 69 6.242 -2.660 -7.923 1.00 0.00 H new ATOM 0 HA ILE A 69 5.609 -2.905 -5.065 1.00 0.00 H new ATOM 0 HB ILE A 69 8.278 -3.608 -6.282 1.00 0.00 H new ATOM 0 HG12 ILE A 69 6.531 -4.624 -7.741 1.00 0.00 H new ATOM 0 HG13 ILE A 69 7.527 -5.802 -6.911 1.00 0.00 H new ATOM 0 HG21 ILE A 69 8.252 -5.308 -4.501 1.00 0.00 H new ATOM 0 HG22 ILE A 69 8.010 -3.670 -3.850 1.00 0.00 H new ATOM 0 HG23 ILE A 69 6.624 -4.774 -4.019 1.00 0.00 H new ATOM 0 HD11 ILE A 69 5.175 -6.472 -6.887 1.00 0.00 H new ATOM 0 HD12 ILE A 69 5.749 -6.146 -5.234 1.00 0.00 H new ATOM 0 HD13 ILE A 69 4.737 -4.949 -6.077 1.00 0.00 H new ATOM 1016 N ARG A 70 7.271 -1.185 -4.203 1.00 0.00 N ATOM 1017 CA ARG A 70 8.003 -0.009 -3.746 1.00 0.00 C ATOM 1018 C ARG A 70 8.345 -0.122 -2.264 1.00 0.00 C ATOM 1019 O ARG A 70 7.463 -0.303 -1.425 1.00 0.00 O ATOM 1020 CB ARG A 70 7.182 1.258 -3.996 1.00 0.00 C ATOM 1021 CG ARG A 70 7.324 1.809 -5.405 1.00 0.00 C ATOM 1022 CD ARG A 70 6.934 3.277 -5.471 1.00 0.00 C ATOM 1023 NE ARG A 70 6.931 3.782 -6.841 1.00 0.00 N ATOM 1024 CZ ARG A 70 8.025 4.186 -7.478 1.00 0.00 C ATOM 1025 NH1 ARG A 70 9.202 4.145 -6.870 1.00 0.00 N ATOM 1026 NH2 ARG A 70 7.941 4.633 -8.725 1.00 0.00 N ATOM 0 H ARG A 70 6.869 -1.749 -3.454 1.00 0.00 H new ATOM 0 HA ARG A 70 8.933 0.051 -4.311 1.00 0.00 H new ATOM 0 HB2 ARG A 70 6.131 1.043 -3.803 1.00 0.00 H new ATOM 0 HB3 ARG A 70 7.486 2.024 -3.283 1.00 0.00 H new ATOM 0 HG2 ARG A 70 8.354 1.690 -5.741 1.00 0.00 H new ATOM 0 HG3 ARG A 70 6.697 1.234 -6.087 1.00 0.00 H new ATOM 0 HD2 ARG A 70 5.944 3.409 -5.034 1.00 0.00 H new ATOM 0 HD3 ARG A 70 7.629 3.864 -4.870 1.00 0.00 H new ATOM 0 HE ARG A 70 6.040 3.827 -7.336 1.00 0.00 H new ATOM 0 HH11 ARG A 70 9.269 3.803 -5.911 1.00 0.00 H new ATOM 0 HH12 ARG A 70 10.041 4.456 -7.361 1.00 0.00 H new ATOM 0 HH21 ARG A 70 7.036 4.667 -9.195 1.00 0.00 H new ATOM 0 HH22 ARG A 70 8.781 4.943 -9.213 1.00 0.00 H new ATOM 1040 N SER A 71 9.632 -0.017 -1.950 1.00 0.00 N ATOM 1041 CA SER A 71 10.092 -0.112 -0.569 1.00 0.00 C ATOM 1042 C SER A 71 9.471 0.987 0.287 1.00 0.00 C ATOM 1043 O SER A 71 8.646 1.769 -0.186 1.00 0.00 O ATOM 1044 CB SER A 71 11.618 -0.020 -0.509 1.00 0.00 C ATOM 1045 OG SER A 71 12.220 -0.970 -1.373 1.00 0.00 O ATOM 0 H SER A 71 10.375 0.134 -2.633 1.00 0.00 H new ATOM 0 HA SER A 71 9.778 -1.078 -0.174 1.00 0.00 H new ATOM 0 HB2 SER A 71 11.936 0.984 -0.789 1.00 0.00 H new ATOM 0 HB3 SER A 71 11.956 -0.188 0.514 1.00 0.00 H new ATOM 0 HG SER A 71 13.089 -1.239 -1.009 1.00 0.00 H new ATOM 1051 N THR A 72 9.874 1.041 1.554 1.00 0.00 N ATOM 1052 CA THR A 72 9.358 2.042 2.478 1.00 0.00 C ATOM 1053 C THR A 72 10.475 2.941 2.996 1.00 0.00 C ATOM 1054 O THR A 72 10.258 4.122 3.266 1.00 0.00 O ATOM 1055 CB THR A 72 8.645 1.387 3.676 1.00 0.00 C ATOM 1056 OG1 THR A 72 9.531 0.474 4.333 1.00 0.00 O ATOM 1057 CG2 THR A 72 7.393 0.651 3.224 1.00 0.00 C ATOM 0 H THR A 72 10.556 0.402 1.962 1.00 0.00 H new ATOM 0 HA THR A 72 8.639 2.644 1.922 1.00 0.00 H new ATOM 0 HB THR A 72 8.353 2.173 4.372 1.00 0.00 H new ATOM 0 HG1 THR A 72 9.071 0.063 5.095 1.00 0.00 H new ATOM 0 HG21 THR A 72 6.906 0.197 4.087 1.00 0.00 H new ATOM 0 HG22 THR A 72 6.708 1.355 2.750 1.00 0.00 H new ATOM 0 HG23 THR A 72 7.666 -0.126 2.510 1.00 0.00 H new ATOM 1065 N GLU A 73 11.670 2.374 3.128 1.00 0.00 N ATOM 1066 CA GLU A 73 12.822 3.126 3.614 1.00 0.00 C ATOM 1067 C GLU A 73 13.532 3.835 2.465 1.00 0.00 C ATOM 1068 O GLU A 73 13.752 5.047 2.508 1.00 0.00 O ATOM 1069 CB GLU A 73 13.798 2.196 4.335 1.00 0.00 C ATOM 1070 CG GLU A 73 13.143 1.327 5.396 1.00 0.00 C ATOM 1071 CD GLU A 73 14.083 0.988 6.536 1.00 0.00 C ATOM 1072 OE1 GLU A 73 15.063 0.251 6.297 1.00 0.00 O ATOM 1073 OE2 GLU A 73 13.841 1.459 7.667 1.00 0.00 O ATOM 0 H GLU A 73 11.866 1.398 2.906 1.00 0.00 H new ATOM 0 HA GLU A 73 12.463 3.879 4.316 1.00 0.00 H new ATOM 0 HB2 GLU A 73 14.284 1.553 3.601 1.00 0.00 H new ATOM 0 HB3 GLU A 73 14.580 2.795 4.801 1.00 0.00 H new ATOM 0 HG2 GLU A 73 12.268 1.842 5.793 1.00 0.00 H new ATOM 0 HG3 GLU A 73 12.788 0.405 4.936 1.00 0.00 H new ATOM 1080 N LEU A 74 13.890 3.072 1.438 1.00 0.00 N ATOM 1081 CA LEU A 74 14.576 3.626 0.276 1.00 0.00 C ATOM 1082 C LEU A 74 13.636 4.505 -0.545 1.00 0.00 C ATOM 1083 O LEU A 74 13.868 5.703 -0.700 1.00 0.00 O ATOM 1084 CB LEU A 74 15.132 2.500 -0.598 1.00 0.00 C ATOM 1085 CG LEU A 74 16.001 1.464 0.116 1.00 0.00 C ATOM 1086 CD1 LEU A 74 16.048 0.168 -0.678 1.00 0.00 C ATOM 1087 CD2 LEU A 74 17.404 2.007 0.339 1.00 0.00 C ATOM 0 H LEU A 74 13.717 2.068 1.386 1.00 0.00 H new ATOM 0 HA LEU A 74 15.401 4.242 0.633 1.00 0.00 H new ATOM 0 HB2 LEU A 74 14.294 1.982 -1.065 1.00 0.00 H new ATOM 0 HB3 LEU A 74 15.719 2.946 -1.401 1.00 0.00 H new ATOM 0 HG LEU A 74 15.556 1.254 1.089 1.00 0.00 H new ATOM 0 HD11 LEU A 74 16.671 -0.557 -0.154 1.00 0.00 H new ATOM 0 HD12 LEU A 74 15.039 -0.230 -0.784 1.00 0.00 H new ATOM 0 HD13 LEU A 74 16.468 0.361 -1.665 1.00 0.00 H new ATOM 0 HD21 LEU A 74 18.008 1.256 0.848 1.00 0.00 H new ATOM 0 HD22 LEU A 74 17.858 2.247 -0.622 1.00 0.00 H new ATOM 0 HD23 LEU A 74 17.353 2.907 0.951 1.00 0.00 H new ATOM 1099 N ASP A 75 12.574 3.900 -1.066 1.00 0.00 N ATOM 1100 CA ASP A 75 11.597 4.626 -1.867 1.00 0.00 C ATOM 1101 C ASP A 75 10.947 5.741 -1.053 1.00 0.00 C ATOM 1102 O ASP A 75 10.283 5.483 -0.049 1.00 0.00 O ATOM 1103 CB ASP A 75 10.525 3.671 -2.394 1.00 0.00 C ATOM 1104 CG ASP A 75 10.998 2.875 -3.593 1.00 0.00 C ATOM 1105 OD1 ASP A 75 11.989 2.126 -3.457 1.00 0.00 O ATOM 1106 OD2 ASP A 75 10.377 2.999 -4.670 1.00 0.00 O ATOM 0 H ASP A 75 12.368 2.908 -0.947 1.00 0.00 H new ATOM 0 HA ASP A 75 12.119 5.074 -2.712 1.00 0.00 H new ATOM 0 HB2 ASP A 75 10.231 2.985 -1.599 1.00 0.00 H new ATOM 0 HB3 ASP A 75 9.637 4.241 -2.667 1.00 0.00 H new ATOM 1111 N SER A 76 11.143 6.980 -1.492 1.00 0.00 N ATOM 1112 CA SER A 76 10.580 8.134 -0.801 1.00 0.00 C ATOM 1113 C SER A 76 9.729 8.973 -1.750 1.00 0.00 C ATOM 1114 O SER A 76 8.887 9.758 -1.316 1.00 0.00 O ATOM 1115 CB SER A 76 11.697 8.993 -0.205 1.00 0.00 C ATOM 1116 OG SER A 76 12.117 9.990 -1.120 1.00 0.00 O ATOM 0 H SER A 76 11.687 7.211 -2.323 1.00 0.00 H new ATOM 0 HA SER A 76 9.943 7.769 0.005 1.00 0.00 H new ATOM 0 HB2 SER A 76 11.348 9.463 0.714 1.00 0.00 H new ATOM 0 HB3 SER A 76 12.543 8.360 0.062 1.00 0.00 H new ATOM 0 HG SER A 76 12.830 10.526 -0.715 1.00 0.00 H new ATOM 1122 N ASN A 77 9.957 8.801 -3.048 1.00 0.00 N ATOM 1123 CA ASN A 77 9.213 9.543 -4.059 1.00 0.00 C ATOM 1124 C ASN A 77 7.854 8.898 -4.316 1.00 0.00 C ATOM 1125 O ASN A 77 7.401 8.814 -5.458 1.00 0.00 O ATOM 1126 CB ASN A 77 10.011 9.610 -5.362 1.00 0.00 C ATOM 1127 CG ASN A 77 11.213 10.529 -5.257 1.00 0.00 C ATOM 1128 OD1 ASN A 77 11.642 10.884 -4.159 1.00 0.00 O ATOM 1129 ND2 ASN A 77 11.762 10.918 -6.402 1.00 0.00 N ATOM 0 H ASN A 77 10.651 8.155 -3.424 1.00 0.00 H new ATOM 0 HA ASN A 77 9.052 10.555 -3.686 1.00 0.00 H new ATOM 0 HB2 ASN A 77 10.345 8.608 -5.632 1.00 0.00 H new ATOM 0 HB3 ASN A 77 9.361 9.957 -6.166 1.00 0.00 H new ATOM 0 HD21 ASN A 77 12.573 11.536 -6.395 1.00 0.00 H new ATOM 0 HD22 ASN A 77 11.372 10.598 -7.289 1.00 0.00 H new ATOM 1136 N TRP A 78 7.208 8.446 -3.247 1.00 0.00 N ATOM 1137 CA TRP A 78 5.900 7.811 -3.356 1.00 0.00 C ATOM 1138 C TRP A 78 4.853 8.801 -3.851 1.00 0.00 C ATOM 1139 O TRP A 78 5.141 9.984 -4.034 1.00 0.00 O ATOM 1140 CB TRP A 78 5.476 7.235 -2.003 1.00 0.00 C ATOM 1141 CG TRP A 78 5.934 5.824 -1.788 1.00 0.00 C ATOM 1142 CD1 TRP A 78 7.224 5.382 -1.718 1.00 0.00 C ATOM 1143 CD2 TRP A 78 5.102 4.670 -1.618 1.00 0.00 C ATOM 1144 NE1 TRP A 78 7.245 4.023 -1.514 1.00 0.00 N ATOM 1145 CE2 TRP A 78 5.957 3.563 -1.448 1.00 0.00 C ATOM 1146 CE3 TRP A 78 3.720 4.465 -1.590 1.00 0.00 C ATOM 1147 CZ2 TRP A 78 5.472 2.272 -1.255 1.00 0.00 C ATOM 1148 CZ3 TRP A 78 3.240 3.183 -1.399 1.00 0.00 C ATOM 1149 CH2 TRP A 78 4.114 2.101 -1.233 1.00 0.00 C ATOM 0 H TRP A 78 7.569 8.508 -2.295 1.00 0.00 H new ATOM 0 HA TRP A 78 5.977 7.001 -4.081 1.00 0.00 H new ATOM 0 HB2 TRP A 78 5.875 7.864 -1.207 1.00 0.00 H new ATOM 0 HB3 TRP A 78 4.389 7.273 -1.925 1.00 0.00 H new ATOM 0 HD1 TRP A 78 8.099 6.008 -1.809 1.00 0.00 H new ATOM 0 HE1 TRP A 78 8.084 3.450 -1.426 1.00 0.00 H new ATOM 0 HE3 TRP A 78 3.039 5.294 -1.715 1.00 0.00 H new ATOM 0 HZ2 TRP A 78 6.143 1.436 -1.127 1.00 0.00 H new ATOM 0 HZ3 TRP A 78 2.174 3.013 -1.377 1.00 0.00 H new ATOM 0 HH2 TRP A 78 3.708 1.111 -1.085 1.00 0.00 H new ATOM 1160 N SER A 79 3.636 8.310 -4.067 1.00 0.00 N ATOM 1161 CA SER A 79 2.546 9.153 -4.545 1.00 0.00 C ATOM 1162 C SER A 79 1.408 9.196 -3.532 1.00 0.00 C ATOM 1163 O SER A 79 0.880 8.159 -3.130 1.00 0.00 O ATOM 1164 CB SER A 79 2.028 8.638 -5.890 1.00 0.00 C ATOM 1165 OG SER A 79 3.090 8.458 -6.811 1.00 0.00 O ATOM 0 H SER A 79 3.381 7.334 -3.919 1.00 0.00 H new ATOM 0 HA SER A 79 2.931 10.164 -4.675 1.00 0.00 H new ATOM 0 HB2 SER A 79 1.505 7.693 -5.744 1.00 0.00 H new ATOM 0 HB3 SER A 79 1.304 9.343 -6.298 1.00 0.00 H new ATOM 0 HG SER A 79 2.733 8.127 -7.661 1.00 0.00 H new ATOM 1171 N TRP A 80 1.034 10.403 -3.123 1.00 0.00 N ATOM 1172 CA TRP A 80 -0.042 10.583 -2.155 1.00 0.00 C ATOM 1173 C TRP A 80 -1.111 9.508 -2.323 1.00 0.00 C ATOM 1174 O TRP A 80 -1.474 8.825 -1.366 1.00 0.00 O ATOM 1175 CB TRP A 80 -0.668 11.970 -2.308 1.00 0.00 C ATOM 1176 CG TRP A 80 0.150 13.063 -1.690 1.00 0.00 C ATOM 1177 CD1 TRP A 80 0.828 14.051 -2.346 1.00 0.00 C ATOM 1178 CD2 TRP A 80 0.379 13.276 -0.292 1.00 0.00 C ATOM 1179 NE1 TRP A 80 1.464 14.866 -1.441 1.00 0.00 N ATOM 1180 CE2 TRP A 80 1.203 14.412 -0.174 1.00 0.00 C ATOM 1181 CE3 TRP A 80 -0.035 12.620 0.869 1.00 0.00 C ATOM 1182 CZ2 TRP A 80 1.622 14.903 1.060 1.00 0.00 C ATOM 1183 CZ3 TRP A 80 0.382 13.108 2.094 1.00 0.00 C ATOM 1184 CH2 TRP A 80 1.201 14.241 2.182 1.00 0.00 C ATOM 0 H TRP A 80 1.460 11.272 -3.447 1.00 0.00 H new ATOM 0 HA TRP A 80 0.384 10.493 -1.156 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -0.805 12.184 -3.368 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -1.658 11.966 -1.853 1.00 0.00 H new ATOM 0 HD1 TRP A 80 0.859 14.173 -3.419 1.00 0.00 H new ATOM 0 HE1 TRP A 80 2.037 15.677 -1.674 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -0.669 11.748 0.811 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 2.256 15.774 1.129 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 0.071 12.607 2.999 1.00 0.00 H new ATOM 0 HH2 TRP A 80 1.506 14.599 3.154 1.00 0.00 H new ATOM 1195 N PHE A 81 -1.610 9.364 -3.546 1.00 0.00 N ATOM 1196 CA PHE A 81 -2.638 8.372 -3.839 1.00 0.00 C ATOM 1197 C PHE A 81 -2.144 6.964 -3.518 1.00 0.00 C ATOM 1198 O PHE A 81 -2.823 6.198 -2.835 1.00 0.00 O ATOM 1199 CB PHE A 81 -3.053 8.455 -5.310 1.00 0.00 C ATOM 1200 CG PHE A 81 -4.182 7.531 -5.668 1.00 0.00 C ATOM 1201 CD1 PHE A 81 -5.488 7.849 -5.332 1.00 0.00 C ATOM 1202 CD2 PHE A 81 -3.936 6.345 -6.340 1.00 0.00 C ATOM 1203 CE1 PHE A 81 -6.528 6.999 -5.661 1.00 0.00 C ATOM 1204 CE2 PHE A 81 -4.973 5.491 -6.671 1.00 0.00 C ATOM 1205 CZ PHE A 81 -6.270 5.821 -6.331 1.00 0.00 C ATOM 0 H PHE A 81 -1.320 9.921 -4.350 1.00 0.00 H new ATOM 0 HA PHE A 81 -3.503 8.587 -3.211 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -3.346 9.480 -5.539 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -2.191 8.222 -5.936 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -5.696 8.770 -4.808 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -2.923 6.084 -6.609 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -7.542 7.257 -5.393 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -4.769 4.568 -7.194 1.00 0.00 H new ATOM 0 HZ PHE A 81 -7.082 5.157 -6.589 1.00 0.00 H new ATOM 1215 N GLN A 82 -0.957 6.632 -4.016 1.00 0.00 N ATOM 1216 CA GLN A 82 -0.372 5.317 -3.783 1.00 0.00 C ATOM 1217 C GLN A 82 -0.311 5.005 -2.291 1.00 0.00 C ATOM 1218 O GLN A 82 -0.659 3.905 -1.862 1.00 0.00 O ATOM 1219 CB GLN A 82 1.030 5.245 -4.389 1.00 0.00 C ATOM 1220 CG GLN A 82 1.034 4.955 -5.881 1.00 0.00 C ATOM 1221 CD GLN A 82 2.425 4.683 -6.420 1.00 0.00 C ATOM 1222 OE1 GLN A 82 3.418 5.179 -5.885 1.00 0.00 O ATOM 1223 NE2 GLN A 82 2.505 3.894 -7.483 1.00 0.00 N ATOM 0 H GLN A 82 -0.382 7.255 -4.583 1.00 0.00 H new ATOM 0 HA GLN A 82 -1.007 4.574 -4.265 1.00 0.00 H new ATOM 0 HB2 GLN A 82 1.543 6.190 -4.210 1.00 0.00 H new ATOM 0 HB3 GLN A 82 1.599 4.470 -3.875 1.00 0.00 H new ATOM 0 HG2 GLN A 82 0.396 4.094 -6.081 1.00 0.00 H new ATOM 0 HG3 GLN A 82 0.602 5.803 -6.413 1.00 0.00 H new ATOM 0 HE21 GLN A 82 1.657 3.505 -7.894 1.00 0.00 H new ATOM 0 HE22 GLN A 82 3.415 3.677 -7.889 1.00 0.00 H new ATOM 1232 N LEU A 83 0.134 5.980 -1.506 1.00 0.00 N ATOM 1233 CA LEU A 83 0.242 5.810 -0.061 1.00 0.00 C ATOM 1234 C LEU A 83 -1.085 5.344 0.532 1.00 0.00 C ATOM 1235 O LEU A 83 -1.161 4.279 1.147 1.00 0.00 O ATOM 1236 CB LEU A 83 0.674 7.121 0.596 1.00 0.00 C ATOM 1237 CG LEU A 83 2.166 7.452 0.517 1.00 0.00 C ATOM 1238 CD1 LEU A 83 2.377 8.958 0.500 1.00 0.00 C ATOM 1239 CD2 LEU A 83 2.914 6.818 1.679 1.00 0.00 C ATOM 0 H LEU A 83 0.426 6.896 -1.846 1.00 0.00 H new ATOM 0 HA LEU A 83 0.996 5.047 0.135 1.00 0.00 H new ATOM 0 HB2 LEU A 83 0.116 7.936 0.135 1.00 0.00 H new ATOM 0 HB3 LEU A 83 0.384 7.091 1.646 1.00 0.00 H new ATOM 0 HG LEU A 83 2.563 7.040 -0.411 1.00 0.00 H new ATOM 0 HD11 LEU A 83 3.444 9.175 0.444 1.00 0.00 H new ATOM 0 HD12 LEU A 83 1.873 9.386 -0.366 1.00 0.00 H new ATOM 0 HD13 LEU A 83 1.966 9.393 1.411 1.00 0.00 H new ATOM 0 HD21 LEU A 83 3.974 7.064 1.607 1.00 0.00 H new ATOM 0 HD22 LEU A 83 2.516 7.200 2.619 1.00 0.00 H new ATOM 0 HD23 LEU A 83 2.789 5.736 1.645 1.00 0.00 H new ATOM 1251 N ARG A 84 -2.126 6.146 0.343 1.00 0.00 N ATOM 1252 CA ARG A 84 -3.449 5.816 0.858 1.00 0.00 C ATOM 1253 C ARG A 84 -3.802 4.362 0.557 1.00 0.00 C ATOM 1254 O ARG A 84 -4.236 3.623 1.442 1.00 0.00 O ATOM 1255 CB ARG A 84 -4.503 6.744 0.251 1.00 0.00 C ATOM 1256 CG ARG A 84 -4.186 8.220 0.421 1.00 0.00 C ATOM 1257 CD ARG A 84 -3.740 8.535 1.841 1.00 0.00 C ATOM 1258 NE ARG A 84 -3.487 9.960 2.032 1.00 0.00 N ATOM 1259 CZ ARG A 84 -4.272 10.756 2.750 1.00 0.00 C ATOM 1260 NH1 ARG A 84 -5.354 10.268 3.341 1.00 0.00 N ATOM 1261 NH2 ARG A 84 -3.974 12.043 2.878 1.00 0.00 N ATOM 0 H ARG A 84 -2.079 7.030 -0.164 1.00 0.00 H new ATOM 0 HA ARG A 84 -3.435 5.953 1.939 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -4.601 6.522 -0.812 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -5.468 6.533 0.711 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -3.402 8.508 -0.280 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -5.067 8.813 0.175 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -4.506 8.206 2.543 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -2.835 7.972 2.070 1.00 0.00 H new ATOM 0 HE ARG A 84 -2.663 10.367 1.590 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -5.585 9.279 3.245 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -5.955 10.881 3.892 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -3.142 12.421 2.425 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -4.577 12.654 3.429 1.00 0.00 H new ATOM 1275 N CYS A 85 -3.614 3.960 -0.694 1.00 0.00 N ATOM 1276 CA CYS A 85 -3.914 2.595 -1.112 1.00 0.00 C ATOM 1277 C CYS A 85 -3.481 1.592 -0.047 1.00 0.00 C ATOM 1278 O CYS A 85 -4.101 0.543 0.121 1.00 0.00 O ATOM 1279 CB CYS A 85 -3.219 2.282 -2.438 1.00 0.00 C ATOM 1280 SG CYS A 85 -3.718 3.354 -3.805 1.00 0.00 S ATOM 0 H CYS A 85 -3.255 4.559 -1.437 1.00 0.00 H new ATOM 0 HA CYS A 85 -4.992 2.511 -1.246 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -2.141 2.366 -2.299 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -3.426 1.247 -2.708 1.00 0.00 H new ATOM 0 HG CYS A 85 -3.383 4.582 -3.538 1.00 0.00 H new ATOM 1286 N MET A 86 -2.411 1.924 0.670 1.00 0.00 N ATOM 1287 CA MET A 86 -1.895 1.052 1.718 1.00 0.00 C ATOM 1288 C MET A 86 -2.817 1.059 2.933 1.00 0.00 C ATOM 1289 O MET A 86 -3.091 0.013 3.521 1.00 0.00 O ATOM 1290 CB MET A 86 -0.487 1.491 2.128 1.00 0.00 C ATOM 1291 CG MET A 86 0.477 1.607 0.960 1.00 0.00 C ATOM 1292 SD MET A 86 0.530 0.112 -0.049 1.00 0.00 S ATOM 1293 CE MET A 86 1.333 -1.026 1.076 1.00 0.00 C ATOM 0 H MET A 86 -1.886 2.789 0.544 1.00 0.00 H new ATOM 0 HA MET A 86 -1.851 0.037 1.324 1.00 0.00 H new ATOM 0 HB2 MET A 86 -0.549 2.454 2.635 1.00 0.00 H new ATOM 0 HB3 MET A 86 -0.088 0.777 2.848 1.00 0.00 H new ATOM 0 HG2 MET A 86 0.185 2.452 0.336 1.00 0.00 H new ATOM 0 HG3 MET A 86 1.477 1.821 1.339 1.00 0.00 H new ATOM 0 HE1 MET A 86 1.662 -1.909 0.527 1.00 0.00 H new ATOM 0 HE2 MET A 86 2.195 -0.539 1.532 1.00 0.00 H new ATOM 0 HE3 MET A 86 0.631 -1.324 1.855 1.00 0.00 H new ATOM 1303 N GLN A 87 -3.290 2.245 3.305 1.00 0.00 N ATOM 1304 CA GLN A 87 -4.181 2.385 4.451 1.00 0.00 C ATOM 1305 C GLN A 87 -5.568 1.837 4.135 1.00 0.00 C ATOM 1306 O GLN A 87 -6.211 1.221 4.984 1.00 0.00 O ATOM 1307 CB GLN A 87 -4.282 3.854 4.866 1.00 0.00 C ATOM 1308 CG GLN A 87 -2.992 4.415 5.443 1.00 0.00 C ATOM 1309 CD GLN A 87 -3.235 5.504 6.470 1.00 0.00 C ATOM 1310 OE1 GLN A 87 -4.347 6.020 6.590 1.00 0.00 O ATOM 1311 NE2 GLN A 87 -2.196 5.858 7.215 1.00 0.00 N ATOM 0 H GLN A 87 -3.071 3.121 2.830 1.00 0.00 H new ATOM 0 HA GLN A 87 -3.764 1.808 5.276 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -4.571 4.448 3.999 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -5.077 3.960 5.605 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -2.423 3.607 5.904 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -2.380 4.814 4.634 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -1.293 5.403 7.080 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -2.300 6.585 7.922 1.00 0.00 H new ATOM 1320 N VAL A 88 -6.022 2.065 2.907 1.00 0.00 N ATOM 1321 CA VAL A 88 -7.333 1.593 2.477 1.00 0.00 C ATOM 1322 C VAL A 88 -7.273 0.137 2.030 1.00 0.00 C ATOM 1323 O VAL A 88 -8.110 -0.319 1.252 1.00 0.00 O ATOM 1324 CB VAL A 88 -7.888 2.450 1.325 1.00 0.00 C ATOM 1325 CG1 VAL A 88 -7.887 3.922 1.704 1.00 0.00 C ATOM 1326 CG2 VAL A 88 -7.084 2.218 0.054 1.00 0.00 C ATOM 0 H VAL A 88 -5.502 2.574 2.192 1.00 0.00 H new ATOM 0 HA VAL A 88 -7.998 1.679 3.336 1.00 0.00 H new ATOM 0 HB VAL A 88 -8.919 2.150 1.137 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -8.283 4.511 0.877 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -8.510 4.071 2.586 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -6.868 4.241 1.921 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -7.490 2.832 -0.750 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -6.043 2.490 0.228 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -7.143 1.166 -0.227 1.00 0.00 H new ATOM 1336 N GLY A 89 -6.278 -0.590 2.530 1.00 0.00 N ATOM 1337 CA GLY A 89 -6.128 -1.989 2.172 1.00 0.00 C ATOM 1338 C GLY A 89 -5.742 -2.852 3.356 1.00 0.00 C ATOM 1339 O GLY A 89 -6.603 -3.340 4.086 1.00 0.00 O ATOM 0 H GLY A 89 -5.573 -0.235 3.176 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -7.064 -2.355 1.749 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -5.369 -2.083 1.395 1.00 0.00 H new ATOM 1343 N GLY A 90 -4.439 -3.044 3.546 1.00 0.00 N ATOM 1344 CA GLY A 90 -3.964 -3.857 4.650 1.00 0.00 C ATOM 1345 C GLY A 90 -3.768 -5.308 4.260 1.00 0.00 C ATOM 1346 O GLY A 90 -4.264 -5.751 3.224 1.00 0.00 O ATOM 0 H GLY A 90 -3.706 -2.651 2.956 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -3.020 -3.452 5.016 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -4.676 -3.798 5.473 1.00 0.00 H new ATOM 1350 N ASN A 91 -3.042 -6.050 5.090 1.00 0.00 N ATOM 1351 CA ASN A 91 -2.780 -7.460 4.824 1.00 0.00 C ATOM 1352 C ASN A 91 -4.039 -8.296 5.037 1.00 0.00 C ATOM 1353 O ASN A 91 -4.568 -8.891 4.099 1.00 0.00 O ATOM 1354 CB ASN A 91 -1.656 -7.971 5.728 1.00 0.00 C ATOM 1355 CG ASN A 91 -0.326 -7.308 5.426 1.00 0.00 C ATOM 1356 OD1 ASN A 91 -0.275 -6.250 4.798 1.00 0.00 O ATOM 1357 ND2 ASN A 91 0.759 -7.930 5.871 1.00 0.00 N ATOM 0 H ASN A 91 -2.625 -5.699 5.952 1.00 0.00 H new ATOM 0 HA ASN A 91 -2.472 -7.557 3.783 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -1.921 -7.791 6.770 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -1.557 -9.050 5.606 1.00 0.00 H new ATOM 0 HD21 ASN A 91 1.682 -7.533 5.697 1.00 0.00 H new ATOM 0 HD22 ASN A 91 0.670 -8.805 6.387 1.00 0.00 H new ATOM 1364 N ALA A 92 -4.513 -8.336 6.279 1.00 0.00 N ATOM 1365 CA ALA A 92 -5.710 -9.097 6.616 1.00 0.00 C ATOM 1366 C ALA A 92 -6.806 -8.883 5.577 1.00 0.00 C ATOM 1367 O ALA A 92 -7.391 -9.841 5.073 1.00 0.00 O ATOM 1368 CB ALA A 92 -6.209 -8.710 8.000 1.00 0.00 C ATOM 0 H ALA A 92 -4.086 -7.850 7.068 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.450 -10.155 6.619 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -7.103 -9.286 8.239 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -5.435 -8.920 8.738 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -6.447 -7.646 8.017 1.00 0.00 H new ATOM 1374 N SER A 93 -7.079 -7.620 5.263 1.00 0.00 N ATOM 1375 CA SER A 93 -8.109 -7.280 4.289 1.00 0.00 C ATOM 1376 C SER A 93 -8.173 -8.326 3.179 1.00 0.00 C ATOM 1377 O SER A 93 -9.232 -8.889 2.902 1.00 0.00 O ATOM 1378 CB SER A 93 -7.837 -5.900 3.689 1.00 0.00 C ATOM 1379 OG SER A 93 -8.471 -4.882 4.444 1.00 0.00 O ATOM 0 H SER A 93 -6.601 -6.816 5.669 1.00 0.00 H new ATOM 0 HA SER A 93 -9.070 -7.262 4.804 1.00 0.00 H new ATOM 0 HB2 SER A 93 -6.763 -5.719 3.658 1.00 0.00 H new ATOM 0 HB3 SER A 93 -8.195 -5.870 2.660 1.00 0.00 H new ATOM 0 HG SER A 93 -7.928 -4.067 4.415 1.00 0.00 H new ATOM 1385 N ALA A 94 -7.031 -8.579 2.548 1.00 0.00 N ATOM 1386 CA ALA A 94 -6.956 -9.558 1.470 1.00 0.00 C ATOM 1387 C ALA A 94 -7.112 -10.978 2.005 1.00 0.00 C ATOM 1388 O ALA A 94 -7.928 -11.753 1.507 1.00 0.00 O ATOM 1389 CB ALA A 94 -5.639 -9.416 0.720 1.00 0.00 C ATOM 0 H ALA A 94 -6.146 -8.120 2.764 1.00 0.00 H new ATOM 0 HA ALA A 94 -7.778 -9.366 0.780 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -5.596 -10.153 -0.082 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -5.568 -8.414 0.297 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -4.809 -9.579 1.408 1.00 0.00 H new ATOM 1395 N SER A 95 -6.323 -11.312 3.022 1.00 0.00 N ATOM 1396 CA SER A 95 -6.370 -12.640 3.622 1.00 0.00 C ATOM 1397 C SER A 95 -7.798 -13.179 3.636 1.00 0.00 C ATOM 1398 O SER A 95 -8.025 -14.372 3.441 1.00 0.00 O ATOM 1399 CB SER A 95 -5.813 -12.599 5.046 1.00 0.00 C ATOM 1400 OG SER A 95 -5.415 -13.890 5.474 1.00 0.00 O ATOM 0 H SER A 95 -5.644 -10.681 3.447 1.00 0.00 H new ATOM 0 HA SER A 95 -5.755 -13.307 3.019 1.00 0.00 H new ATOM 0 HB2 SER A 95 -4.961 -11.920 5.088 1.00 0.00 H new ATOM 0 HB3 SER A 95 -6.569 -12.204 5.725 1.00 0.00 H new ATOM 0 HG SER A 95 -5.061 -13.838 6.386 1.00 0.00 H new ATOM 1406 N SER A 96 -8.757 -12.288 3.870 1.00 0.00 N ATOM 1407 CA SER A 96 -10.163 -12.674 3.915 1.00 0.00 C ATOM 1408 C SER A 96 -10.846 -12.391 2.581 1.00 0.00 C ATOM 1409 O SER A 96 -11.443 -13.282 1.975 1.00 0.00 O ATOM 1410 CB SER A 96 -10.883 -11.924 5.038 1.00 0.00 C ATOM 1411 OG SER A 96 -10.324 -12.240 6.301 1.00 0.00 O ATOM 0 H SER A 96 -8.586 -11.295 4.031 1.00 0.00 H new ATOM 0 HA SER A 96 -10.215 -13.745 4.111 1.00 0.00 H new ATOM 0 HB2 SER A 96 -10.815 -10.850 4.865 1.00 0.00 H new ATOM 0 HB3 SER A 96 -11.942 -12.181 5.031 1.00 0.00 H new ATOM 0 HG SER A 96 -10.800 -11.747 7.002 1.00 0.00 H new ATOM 1417 N PHE A 97 -10.754 -11.145 2.127 1.00 0.00 N ATOM 1418 CA PHE A 97 -11.364 -10.744 0.865 1.00 0.00 C ATOM 1419 C PHE A 97 -11.309 -11.880 -0.151 1.00 0.00 C ATOM 1420 O PHE A 97 -12.313 -12.218 -0.778 1.00 0.00 O ATOM 1421 CB PHE A 97 -10.658 -9.508 0.304 1.00 0.00 C ATOM 1422 CG PHE A 97 -11.309 -8.955 -0.932 1.00 0.00 C ATOM 1423 CD1 PHE A 97 -11.024 -9.490 -2.178 1.00 0.00 C ATOM 1424 CD2 PHE A 97 -12.206 -7.903 -0.848 1.00 0.00 C ATOM 1425 CE1 PHE A 97 -11.620 -8.984 -3.317 1.00 0.00 C ATOM 1426 CE2 PHE A 97 -12.806 -7.392 -1.984 1.00 0.00 C ATOM 1427 CZ PHE A 97 -12.513 -7.934 -3.219 1.00 0.00 C ATOM 0 H PHE A 97 -10.263 -10.396 2.615 1.00 0.00 H new ATOM 0 HA PHE A 97 -12.409 -10.502 1.056 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -10.635 -8.733 1.070 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -9.623 -9.762 0.077 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -10.328 -10.312 -2.260 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -12.440 -7.477 0.116 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -11.388 -9.408 -4.283 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -13.503 -6.570 -1.905 1.00 0.00 H new ATOM 0 HZ PHE A 97 -12.981 -7.538 -4.108 1.00 0.00 H new ATOM 1437 N PHE A 98 -10.126 -12.467 -0.310 1.00 0.00 N ATOM 1438 CA PHE A 98 -9.938 -13.564 -1.251 1.00 0.00 C ATOM 1439 C PHE A 98 -10.817 -14.755 -0.881 1.00 0.00 C ATOM 1440 O PHE A 98 -11.663 -15.184 -1.667 1.00 0.00 O ATOM 1441 CB PHE A 98 -8.468 -13.991 -1.282 1.00 0.00 C ATOM 1442 CG PHE A 98 -7.613 -13.132 -2.170 1.00 0.00 C ATOM 1443 CD1 PHE A 98 -7.218 -11.869 -1.761 1.00 0.00 C ATOM 1444 CD2 PHE A 98 -7.204 -13.589 -3.412 1.00 0.00 C ATOM 1445 CE1 PHE A 98 -6.432 -11.076 -2.576 1.00 0.00 C ATOM 1446 CE2 PHE A 98 -6.417 -12.801 -4.231 1.00 0.00 C ATOM 1447 CZ PHE A 98 -6.030 -11.544 -3.812 1.00 0.00 C ATOM 0 H PHE A 98 -9.284 -12.201 0.201 1.00 0.00 H new ATOM 0 HA PHE A 98 -10.229 -13.214 -2.241 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -8.068 -13.963 -0.268 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -8.405 -15.025 -1.621 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -7.528 -11.500 -0.795 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -7.503 -14.572 -3.744 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -6.133 -10.092 -2.247 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -6.105 -13.168 -5.198 1.00 0.00 H new ATOM 0 HZ PHE A 98 -5.414 -10.927 -4.450 1.00 0.00 H new ATOM 1457 N HIS A 99 -10.611 -15.286 0.319 1.00 0.00 N ATOM 1458 CA HIS A 99 -11.384 -16.428 0.794 1.00 0.00 C ATOM 1459 C HIS A 99 -12.880 -16.181 0.619 1.00 0.00 C ATOM 1460 O HIS A 99 -13.574 -16.961 -0.031 1.00 0.00 O ATOM 1461 CB HIS A 99 -11.070 -16.707 2.264 1.00 0.00 C ATOM 1462 CG HIS A 99 -11.430 -18.094 2.701 1.00 0.00 C ATOM 1463 ND1 HIS A 99 -10.785 -18.752 3.726 1.00 0.00 N ATOM 1464 CD2 HIS A 99 -12.377 -18.947 2.245 1.00 0.00 C ATOM 1465 CE1 HIS A 99 -11.317 -19.950 3.881 1.00 0.00 C ATOM 1466 NE2 HIS A 99 -12.287 -20.094 2.995 1.00 0.00 N ATOM 0 H HIS A 99 -9.915 -14.944 0.981 1.00 0.00 H new ATOM 0 HA HIS A 99 -11.105 -17.298 0.199 1.00 0.00 H new ATOM 0 HB2 HIS A 99 -10.006 -16.545 2.437 1.00 0.00 H new ATOM 0 HB3 HIS A 99 -11.606 -15.989 2.884 1.00 0.00 H new ATOM 0 HD2 HIS A 99 -13.074 -18.760 1.441 1.00 0.00 H new ATOM 0 HE1 HIS A 99 -11.011 -20.687 4.608 1.00 0.00 H new ATOM 0 HE2 HIS A 99 -12.873 -20.922 2.886 1.00 0.00 H new ATOM 1474 N GLN A 100 -13.367 -15.093 1.207 1.00 0.00 N ATOM 1475 CA GLN A 100 -14.781 -14.746 1.117 1.00 0.00 C ATOM 1476 C GLN A 100 -15.309 -14.975 -0.296 1.00 0.00 C ATOM 1477 O GLN A 100 -16.413 -15.490 -0.481 1.00 0.00 O ATOM 1478 CB GLN A 100 -14.996 -13.287 1.523 1.00 0.00 C ATOM 1479 CG GLN A 100 -15.071 -13.079 3.027 1.00 0.00 C ATOM 1480 CD GLN A 100 -16.466 -13.302 3.578 1.00 0.00 C ATOM 1481 OE1 GLN A 100 -17.462 -13.018 2.911 1.00 0.00 O ATOM 1482 NE2 GLN A 100 -16.545 -13.813 4.801 1.00 0.00 N ATOM 0 H GLN A 100 -12.805 -14.438 1.750 1.00 0.00 H new ATOM 0 HA GLN A 100 -15.332 -15.392 1.801 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -14.182 -12.683 1.121 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -15.917 -12.924 1.068 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -14.377 -13.760 3.519 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -14.747 -12.066 3.267 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -15.694 -14.033 5.318 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -17.457 -13.985 5.224 1.00 0.00 H new ATOM 1577 N THR A 108 1.342 -17.647 -6.673 1.00 0.00 N ATOM 1578 CA THR A 108 1.437 -16.202 -6.835 1.00 0.00 C ATOM 1579 C THR A 108 1.041 -15.779 -8.245 1.00 0.00 C ATOM 1580 O THR A 108 0.389 -14.753 -8.434 1.00 0.00 O ATOM 1581 CB THR A 108 2.862 -15.697 -6.541 1.00 0.00 C ATOM 1582 OG1 THR A 108 3.247 -16.060 -5.211 1.00 0.00 O ATOM 1583 CG2 THR A 108 2.945 -14.186 -6.704 1.00 0.00 C ATOM 0 HA THR A 108 0.746 -15.758 -6.118 1.00 0.00 H new ATOM 0 HB THR A 108 3.542 -16.162 -7.255 1.00 0.00 H new ATOM 0 HG1 THR A 108 2.758 -16.864 -4.937 1.00 0.00 H new ATOM 0 HG21 THR A 108 3.961 -13.852 -6.491 1.00 0.00 H new ATOM 0 HG22 THR A 108 2.681 -13.915 -7.726 1.00 0.00 H new ATOM 0 HG23 THR A 108 2.253 -13.707 -6.011 1.00 0.00 H new ATOM 1591 N ASN A 109 1.437 -16.578 -9.231 1.00 0.00 N ATOM 1592 CA ASN A 109 1.123 -16.285 -10.624 1.00 0.00 C ATOM 1593 C ASN A 109 -0.328 -16.635 -10.939 1.00 0.00 C ATOM 1594 O ASN A 109 -0.830 -16.333 -12.021 1.00 0.00 O ATOM 1595 CB ASN A 109 2.059 -17.060 -11.553 1.00 0.00 C ATOM 1596 CG ASN A 109 1.653 -16.947 -13.011 1.00 0.00 C ATOM 1597 OD1 ASN A 109 0.870 -17.754 -13.513 1.00 0.00 O ATOM 1598 ND2 ASN A 109 2.182 -15.940 -13.696 1.00 0.00 N ATOM 0 H ASN A 109 1.976 -17.433 -9.091 1.00 0.00 H new ATOM 0 HA ASN A 109 1.264 -15.216 -10.786 1.00 0.00 H new ATOM 0 HB2 ASN A 109 3.076 -16.687 -11.432 1.00 0.00 H new ATOM 0 HB3 ASN A 109 2.068 -18.110 -11.262 1.00 0.00 H new ATOM 0 HD21 ASN A 109 1.944 -15.811 -14.679 1.00 0.00 H new ATOM 0 HD22 ASN A 109 2.827 -15.295 -13.239 1.00 0.00 H new ATOM 1605 N ALA A 110 -0.997 -17.275 -9.986 1.00 0.00 N ATOM 1606 CA ALA A 110 -2.391 -17.664 -10.159 1.00 0.00 C ATOM 1607 C ALA A 110 -3.299 -16.897 -9.203 1.00 0.00 C ATOM 1608 O ALA A 110 -4.204 -16.180 -9.631 1.00 0.00 O ATOM 1609 CB ALA A 110 -2.551 -19.164 -9.953 1.00 0.00 C ATOM 0 H ALA A 110 -0.596 -17.535 -9.085 1.00 0.00 H new ATOM 0 HA ALA A 110 -2.687 -17.415 -11.178 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -3.597 -19.440 -10.085 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -1.940 -19.698 -10.680 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -2.231 -19.429 -8.945 1.00 0.00 H new ATOM 1615 N LYS A 111 -3.052 -17.054 -7.908 1.00 0.00 N ATOM 1616 CA LYS A 111 -3.846 -16.376 -6.890 1.00 0.00 C ATOM 1617 C LYS A 111 -4.055 -14.908 -7.250 1.00 0.00 C ATOM 1618 O LYS A 111 -5.139 -14.360 -7.055 1.00 0.00 O ATOM 1619 CB LYS A 111 -3.162 -16.484 -5.524 1.00 0.00 C ATOM 1620 CG LYS A 111 -3.905 -15.761 -4.414 1.00 0.00 C ATOM 1621 CD LYS A 111 -2.996 -15.474 -3.230 1.00 0.00 C ATOM 1622 CE LYS A 111 -3.712 -14.663 -2.162 1.00 0.00 C ATOM 1623 NZ LYS A 111 -4.661 -15.498 -1.375 1.00 0.00 N ATOM 0 H LYS A 111 -2.308 -17.645 -7.538 1.00 0.00 H new ATOM 0 HA LYS A 111 -4.820 -16.863 -6.842 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -3.063 -17.537 -5.258 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -2.153 -16.078 -5.599 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -4.312 -14.825 -4.797 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -4.751 -16.366 -4.087 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -2.647 -16.414 -2.802 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -2.114 -14.931 -3.570 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -2.978 -14.218 -1.491 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -4.254 -13.842 -2.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -5.129 -14.909 -0.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -5.377 -15.903 -2.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -4.140 -16.267 -0.906 1.00 0.00 H new ATOM 1637 N TYR A 112 -3.011 -14.279 -7.780 1.00 0.00 N ATOM 1638 CA TYR A 112 -3.081 -12.876 -8.167 1.00 0.00 C ATOM 1639 C TYR A 112 -3.686 -12.725 -9.560 1.00 0.00 C ATOM 1640 O TYR A 112 -4.293 -11.703 -9.877 1.00 0.00 O ATOM 1641 CB TYR A 112 -1.687 -12.246 -8.133 1.00 0.00 C ATOM 1642 CG TYR A 112 -1.216 -11.894 -6.741 1.00 0.00 C ATOM 1643 CD1 TYR A 112 -1.646 -10.730 -6.114 1.00 0.00 C ATOM 1644 CD2 TYR A 112 -0.341 -12.723 -6.051 1.00 0.00 C ATOM 1645 CE1 TYR A 112 -1.218 -10.404 -4.842 1.00 0.00 C ATOM 1646 CE2 TYR A 112 0.092 -12.406 -4.778 1.00 0.00 C ATOM 1647 CZ TYR A 112 -0.349 -11.245 -4.178 1.00 0.00 C ATOM 1648 OH TYR A 112 0.080 -10.924 -2.910 1.00 0.00 O ATOM 0 H TYR A 112 -2.107 -14.719 -7.951 1.00 0.00 H new ATOM 0 HA TYR A 112 -3.723 -12.360 -7.454 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -0.974 -12.936 -8.585 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -1.690 -11.344 -8.745 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -2.326 -10.069 -6.631 1.00 0.00 H new ATOM 0 HD2 TYR A 112 0.007 -13.632 -6.518 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -1.562 -9.496 -4.370 1.00 0.00 H new ATOM 0 HE2 TYR A 112 0.772 -13.063 -4.256 1.00 0.00 H new ATOM 0 HH TYR A 112 0.687 -11.621 -2.584 1.00 0.00 H new ATOM 1658 N ASN A 113 -3.514 -13.750 -10.387 1.00 0.00 N ATOM 1659 CA ASN A 113 -4.043 -13.733 -11.746 1.00 0.00 C ATOM 1660 C ASN A 113 -5.478 -14.249 -11.778 1.00 0.00 C ATOM 1661 O ASN A 113 -5.972 -14.676 -12.822 1.00 0.00 O ATOM 1662 CB ASN A 113 -3.164 -14.580 -12.668 1.00 0.00 C ATOM 1663 CG ASN A 113 -1.907 -13.848 -13.101 1.00 0.00 C ATOM 1664 OD1 ASN A 113 -1.861 -13.254 -14.177 1.00 0.00 O ATOM 1665 ND2 ASN A 113 -0.880 -13.891 -12.259 1.00 0.00 N ATOM 0 H ASN A 113 -3.012 -14.603 -10.140 1.00 0.00 H new ATOM 0 HA ASN A 113 -4.039 -12.701 -12.098 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -2.887 -15.501 -12.156 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -3.737 -14.866 -13.550 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -0.007 -13.419 -12.495 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -0.964 -14.396 -11.377 1.00 0.00 H new ATOM 1672 N SER A 114 -6.142 -14.207 -10.628 1.00 0.00 N ATOM 1673 CA SER A 114 -7.521 -14.673 -10.524 1.00 0.00 C ATOM 1674 C SER A 114 -8.483 -13.498 -10.388 1.00 0.00 C ATOM 1675 O SER A 114 -8.063 -12.344 -10.298 1.00 0.00 O ATOM 1676 CB SER A 114 -7.674 -15.612 -9.325 1.00 0.00 C ATOM 1677 OG SER A 114 -7.809 -14.882 -8.119 1.00 0.00 O ATOM 0 H SER A 114 -5.748 -13.855 -9.755 1.00 0.00 H new ATOM 0 HA SER A 114 -7.765 -15.216 -11.437 1.00 0.00 H new ATOM 0 HB2 SER A 114 -8.547 -16.249 -9.467 1.00 0.00 H new ATOM 0 HB3 SER A 114 -6.807 -16.269 -9.261 1.00 0.00 H new ATOM 0 HG SER A 114 -6.921 -14.699 -7.746 1.00 0.00 H new ATOM 1683 N ARG A 115 -9.778 -13.799 -10.375 1.00 0.00 N ATOM 1684 CA ARG A 115 -10.801 -12.768 -10.253 1.00 0.00 C ATOM 1685 C ARG A 115 -10.756 -12.118 -8.873 1.00 0.00 C ATOM 1686 O ARG A 115 -10.672 -10.897 -8.754 1.00 0.00 O ATOM 1687 CB ARG A 115 -12.188 -13.364 -10.503 1.00 0.00 C ATOM 1688 CG ARG A 115 -13.288 -12.322 -10.609 1.00 0.00 C ATOM 1689 CD ARG A 115 -13.140 -11.482 -11.868 1.00 0.00 C ATOM 1690 NE ARG A 115 -13.395 -12.259 -13.078 1.00 0.00 N ATOM 1691 CZ ARG A 115 -12.946 -11.915 -14.281 1.00 0.00 C ATOM 1692 NH1 ARG A 115 -12.222 -10.814 -14.431 1.00 0.00 N ATOM 1693 NH2 ARG A 115 -13.218 -12.674 -15.334 1.00 0.00 N ATOM 0 H ARG A 115 -10.143 -14.749 -10.447 1.00 0.00 H new ATOM 0 HA ARG A 115 -10.601 -12.003 -11.003 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -12.163 -13.948 -11.423 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -12.429 -14.054 -9.694 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -14.260 -12.816 -10.612 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -13.263 -11.674 -9.733 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -13.831 -10.640 -11.825 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -12.133 -11.066 -11.910 1.00 0.00 H new ATOM 0 HE ARG A 115 -13.948 -13.112 -12.996 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -12.009 -10.230 -13.623 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -11.878 -10.552 -15.355 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -13.772 -13.523 -15.221 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -12.873 -12.409 -16.257 1.00 0.00 H new ATOM 1707 N ALA A 116 -10.814 -12.944 -7.833 1.00 0.00 N ATOM 1708 CA ALA A 116 -10.778 -12.451 -6.462 1.00 0.00 C ATOM 1709 C ALA A 116 -9.671 -11.419 -6.279 1.00 0.00 C ATOM 1710 O ALA A 116 -9.871 -10.388 -5.638 1.00 0.00 O ATOM 1711 CB ALA A 116 -10.590 -13.606 -5.490 1.00 0.00 C ATOM 0 H ALA A 116 -10.886 -13.958 -7.914 1.00 0.00 H new ATOM 0 HA ALA A 116 -11.731 -11.965 -6.252 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -10.565 -13.223 -4.470 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -11.418 -14.307 -5.594 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -9.652 -14.117 -5.709 1.00 0.00 H new ATOM 1717 N ALA A 117 -8.503 -11.703 -6.847 1.00 0.00 N ATOM 1718 CA ALA A 117 -7.365 -10.798 -6.746 1.00 0.00 C ATOM 1719 C ALA A 117 -7.669 -9.458 -7.409 1.00 0.00 C ATOM 1720 O ALA A 117 -7.526 -8.404 -6.790 1.00 0.00 O ATOM 1721 CB ALA A 117 -6.131 -11.430 -7.374 1.00 0.00 C ATOM 0 H ALA A 117 -8.321 -12.552 -7.382 1.00 0.00 H new ATOM 0 HA ALA A 117 -7.170 -10.616 -5.689 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -5.289 -10.743 -7.292 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -5.894 -12.359 -6.855 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -6.325 -11.641 -8.426 1.00 0.00 H new ATOM 1727 N GLN A 118 -8.088 -9.507 -8.669 1.00 0.00 N ATOM 1728 CA GLN A 118 -8.411 -8.297 -9.414 1.00 0.00 C ATOM 1729 C GLN A 118 -9.353 -7.401 -8.616 1.00 0.00 C ATOM 1730 O GLN A 118 -9.000 -6.279 -8.253 1.00 0.00 O ATOM 1731 CB GLN A 118 -9.046 -8.654 -10.759 1.00 0.00 C ATOM 1732 CG GLN A 118 -8.100 -9.374 -11.706 1.00 0.00 C ATOM 1733 CD GLN A 118 -6.811 -8.609 -11.937 1.00 0.00 C ATOM 1734 OE1 GLN A 118 -6.683 -7.864 -12.909 1.00 0.00 O ATOM 1735 NE2 GLN A 118 -5.847 -8.790 -11.042 1.00 0.00 N ATOM 0 H GLN A 118 -8.212 -10.372 -9.195 1.00 0.00 H new ATOM 0 HA GLN A 118 -7.484 -7.752 -9.591 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -9.919 -9.282 -10.584 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -9.401 -7.741 -11.238 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -7.866 -10.359 -11.301 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -8.600 -9.533 -12.661 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -5.996 -9.417 -10.251 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -4.957 -8.302 -11.145 1.00 0.00 H new ATOM 1744 N LEU A 119 -10.552 -7.903 -8.346 1.00 0.00 N ATOM 1745 CA LEU A 119 -11.546 -7.149 -7.591 1.00 0.00 C ATOM 1746 C LEU A 119 -10.882 -6.310 -6.504 1.00 0.00 C ATOM 1747 O LEU A 119 -11.284 -5.174 -6.250 1.00 0.00 O ATOM 1748 CB LEU A 119 -12.569 -8.099 -6.965 1.00 0.00 C ATOM 1749 CG LEU A 119 -13.244 -9.082 -7.921 1.00 0.00 C ATOM 1750 CD1 LEU A 119 -14.083 -10.088 -7.147 1.00 0.00 C ATOM 1751 CD2 LEU A 119 -14.102 -8.338 -8.934 1.00 0.00 C ATOM 0 H LEU A 119 -10.860 -8.830 -8.639 1.00 0.00 H new ATOM 0 HA LEU A 119 -12.058 -6.478 -8.281 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -12.073 -8.669 -6.180 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -13.343 -7.501 -6.484 1.00 0.00 H new ATOM 0 HG LEU A 119 -12.468 -9.625 -8.461 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -14.556 -10.780 -7.844 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -13.444 -10.644 -6.461 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -14.851 -9.562 -6.580 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -14.575 -9.054 -9.606 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -14.871 -7.769 -8.411 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -13.476 -7.657 -9.511 1.00 0.00 H new ATOM 1763 N TYR A 120 -9.863 -6.876 -5.867 1.00 0.00 N ATOM 1764 CA TYR A 120 -9.142 -6.180 -4.807 1.00 0.00 C ATOM 1765 C TYR A 120 -8.480 -4.913 -5.338 1.00 0.00 C ATOM 1766 O TYR A 120 -8.805 -3.805 -4.913 1.00 0.00 O ATOM 1767 CB TYR A 120 -8.088 -7.101 -4.190 1.00 0.00 C ATOM 1768 CG TYR A 120 -7.510 -6.576 -2.895 1.00 0.00 C ATOM 1769 CD1 TYR A 120 -6.540 -5.582 -2.896 1.00 0.00 C ATOM 1770 CD2 TYR A 120 -7.935 -7.075 -1.670 1.00 0.00 C ATOM 1771 CE1 TYR A 120 -6.009 -5.101 -1.715 1.00 0.00 C ATOM 1772 CE2 TYR A 120 -7.411 -6.599 -0.484 1.00 0.00 C ATOM 1773 CZ TYR A 120 -6.448 -5.613 -0.512 1.00 0.00 C ATOM 1774 OH TYR A 120 -5.922 -5.134 0.668 1.00 0.00 O ATOM 0 H TYR A 120 -9.517 -7.815 -6.066 1.00 0.00 H new ATOM 0 HA TYR A 120 -9.861 -5.896 -4.039 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -8.533 -8.079 -4.009 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -7.280 -7.246 -4.907 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -6.195 -5.178 -3.836 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -8.688 -7.849 -1.645 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -5.254 -4.329 -1.734 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -7.754 -6.997 0.460 1.00 0.00 H new ATOM 0 HH TYR A 120 -6.338 -5.598 1.424 1.00 0.00 H new ATOM 1784 N ARG A 121 -7.551 -5.086 -6.273 1.00 0.00 N ATOM 1785 CA ARG A 121 -6.842 -3.958 -6.864 1.00 0.00 C ATOM 1786 C ARG A 121 -7.783 -2.775 -7.075 1.00 0.00 C ATOM 1787 O ARG A 121 -7.626 -1.726 -6.451 1.00 0.00 O ATOM 1788 CB ARG A 121 -6.212 -4.366 -8.197 1.00 0.00 C ATOM 1789 CG ARG A 121 -5.457 -5.684 -8.136 1.00 0.00 C ATOM 1790 CD ARG A 121 -4.719 -5.964 -9.436 1.00 0.00 C ATOM 1791 NE ARG A 121 -5.538 -5.660 -10.606 1.00 0.00 N ATOM 1792 CZ ARG A 121 -5.575 -4.466 -11.188 1.00 0.00 C ATOM 1793 NH1 ARG A 121 -4.842 -3.469 -10.709 1.00 0.00 N ATOM 1794 NH2 ARG A 121 -6.345 -4.266 -12.249 1.00 0.00 N ATOM 0 H ARG A 121 -7.272 -5.997 -6.637 1.00 0.00 H new ATOM 0 HA ARG A 121 -6.054 -3.655 -6.175 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -6.995 -4.440 -8.952 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -5.529 -3.581 -8.522 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -4.746 -5.659 -7.311 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -6.155 -6.495 -7.931 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -3.805 -5.371 -9.469 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -4.420 -7.012 -9.465 1.00 0.00 H new ATOM 0 HE ARG A 121 -6.113 -6.405 -10.998 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -4.249 -3.618 -9.893 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -4.872 -2.553 -11.157 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -6.910 -5.030 -12.620 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -6.372 -3.349 -12.694 1.00 0.00 H new ATOM 1808 N GLU A 122 -8.760 -2.952 -7.959 1.00 0.00 N ATOM 1809 CA GLU A 122 -9.724 -1.899 -8.253 1.00 0.00 C ATOM 1810 C GLU A 122 -10.269 -1.286 -6.965 1.00 0.00 C ATOM 1811 O GLU A 122 -10.222 -0.071 -6.774 1.00 0.00 O ATOM 1812 CB GLU A 122 -10.875 -2.451 -9.095 1.00 0.00 C ATOM 1813 CG GLU A 122 -10.429 -3.049 -10.419 1.00 0.00 C ATOM 1814 CD GLU A 122 -11.537 -3.068 -11.454 1.00 0.00 C ATOM 1815 OE1 GLU A 122 -12.719 -3.107 -11.055 1.00 0.00 O ATOM 1816 OE2 GLU A 122 -11.222 -3.044 -12.662 1.00 0.00 O ATOM 0 H GLU A 122 -8.904 -3.815 -8.484 1.00 0.00 H new ATOM 0 HA GLU A 122 -9.212 -1.120 -8.818 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -11.401 -3.213 -8.521 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -11.588 -1.650 -9.290 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -9.586 -2.477 -10.806 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -10.075 -4.066 -10.253 1.00 0.00 H new ATOM 1823 N LYS A 123 -10.787 -2.137 -6.086 1.00 0.00 N ATOM 1824 CA LYS A 123 -11.341 -1.682 -4.816 1.00 0.00 C ATOM 1825 C LYS A 123 -10.393 -0.707 -4.127 1.00 0.00 C ATOM 1826 O LYS A 123 -10.800 0.376 -3.704 1.00 0.00 O ATOM 1827 CB LYS A 123 -11.616 -2.877 -3.899 1.00 0.00 C ATOM 1828 CG LYS A 123 -12.200 -2.487 -2.552 1.00 0.00 C ATOM 1829 CD LYS A 123 -13.104 -3.578 -2.001 1.00 0.00 C ATOM 1830 CE LYS A 123 -14.519 -3.455 -2.542 1.00 0.00 C ATOM 1831 NZ LYS A 123 -14.688 -4.192 -3.825 1.00 0.00 N ATOM 0 H LYS A 123 -10.835 -3.146 -6.230 1.00 0.00 H new ATOM 0 HA LYS A 123 -12.279 -1.165 -5.021 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -12.303 -3.559 -4.400 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -10.686 -3.423 -3.738 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -11.392 -2.291 -1.847 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -12.766 -1.561 -2.654 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -12.697 -4.555 -2.262 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -13.123 -3.521 -0.913 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -15.224 -3.841 -1.806 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -14.760 -2.403 -2.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -15.670 -4.524 -3.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -14.468 -3.559 -4.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -14.044 -5.009 -3.844 1.00 0.00 H new ATOM 1845 N ILE A 124 -9.126 -1.095 -4.019 1.00 0.00 N ATOM 1846 CA ILE A 124 -8.120 -0.253 -3.384 1.00 0.00 C ATOM 1847 C ILE A 124 -8.053 1.118 -4.047 1.00 0.00 C ATOM 1848 O ILE A 124 -7.926 2.140 -3.374 1.00 0.00 O ATOM 1849 CB ILE A 124 -6.727 -0.905 -3.433 1.00 0.00 C ATOM 1850 CG1 ILE A 124 -6.750 -2.263 -2.728 1.00 0.00 C ATOM 1851 CG2 ILE A 124 -5.690 0.009 -2.799 1.00 0.00 C ATOM 1852 CD1 ILE A 124 -6.862 -2.160 -1.223 1.00 0.00 C ATOM 0 H ILE A 124 -8.772 -1.988 -4.363 1.00 0.00 H new ATOM 0 HA ILE A 124 -8.419 -0.135 -2.342 1.00 0.00 H new ATOM 0 HB ILE A 124 -6.454 -1.062 -4.476 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -7.589 -2.846 -3.108 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -5.841 -2.810 -2.980 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -4.710 -0.467 -2.842 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -5.658 0.954 -3.341 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -5.957 0.196 -1.759 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -6.873 -3.160 -0.790 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -6.010 -1.604 -0.832 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -7.784 -1.641 -0.961 1.00 0.00 H new ATOM 1864 N LYS A 125 -8.139 1.132 -5.373 1.00 0.00 N ATOM 1865 CA LYS A 125 -8.091 2.377 -6.131 1.00 0.00 C ATOM 1866 C LYS A 125 -9.189 3.333 -5.677 1.00 0.00 C ATOM 1867 O LYS A 125 -8.969 4.539 -5.567 1.00 0.00 O ATOM 1868 CB LYS A 125 -8.233 2.093 -7.627 1.00 0.00 C ATOM 1869 CG LYS A 125 -8.254 3.347 -8.485 1.00 0.00 C ATOM 1870 CD LYS A 125 -8.253 3.009 -9.966 1.00 0.00 C ATOM 1871 CE LYS A 125 -6.891 2.506 -10.422 1.00 0.00 C ATOM 1872 NZ LYS A 125 -6.640 2.809 -11.858 1.00 0.00 N ATOM 0 H LYS A 125 -8.242 0.294 -5.946 1.00 0.00 H new ATOM 0 HA LYS A 125 -7.125 2.848 -5.947 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -7.408 1.457 -7.948 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -9.152 1.532 -7.796 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -9.138 3.938 -8.246 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -7.386 3.964 -8.251 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -9.009 2.250 -10.168 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -8.527 3.893 -10.542 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -6.112 2.964 -9.813 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -6.829 1.430 -10.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -5.702 2.450 -12.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -7.368 2.351 -12.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -6.674 3.838 -12.007 1.00 0.00 H new ATOM 1886 N SER A 126 -10.373 2.786 -5.414 1.00 0.00 N ATOM 1887 CA SER A 126 -11.506 3.591 -4.974 1.00 0.00 C ATOM 1888 C SER A 126 -11.266 4.148 -3.575 1.00 0.00 C ATOM 1889 O SER A 126 -11.097 5.355 -3.394 1.00 0.00 O ATOM 1890 CB SER A 126 -12.788 2.756 -4.991 1.00 0.00 C ATOM 1891 OG SER A 126 -13.427 2.828 -6.253 1.00 0.00 O ATOM 0 H SER A 126 -10.571 1.789 -5.498 1.00 0.00 H new ATOM 0 HA SER A 126 -11.616 4.427 -5.664 1.00 0.00 H new ATOM 0 HB2 SER A 126 -12.552 1.718 -4.758 1.00 0.00 H new ATOM 0 HB3 SER A 126 -13.467 3.111 -4.215 1.00 0.00 H new ATOM 0 HG SER A 126 -14.242 2.285 -6.238 1.00 0.00 H new ATOM 1897 N LEU A 127 -11.253 3.260 -2.586 1.00 0.00 N ATOM 1898 CA LEU A 127 -11.034 3.662 -1.200 1.00 0.00 C ATOM 1899 C LEU A 127 -9.844 4.608 -1.089 1.00 0.00 C ATOM 1900 O LEU A 127 -9.885 5.590 -0.349 1.00 0.00 O ATOM 1901 CB LEU A 127 -10.806 2.431 -0.322 1.00 0.00 C ATOM 1902 CG LEU A 127 -11.870 1.336 -0.411 1.00 0.00 C ATOM 1903 CD1 LEU A 127 -11.272 -0.019 -0.065 1.00 0.00 C ATOM 1904 CD2 LEU A 127 -13.040 1.655 0.509 1.00 0.00 C ATOM 0 H LEU A 127 -11.391 2.258 -2.718 1.00 0.00 H new ATOM 0 HA LEU A 127 -11.925 4.187 -0.855 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -9.842 1.995 -0.585 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -10.735 2.758 0.716 1.00 0.00 H new ATOM 0 HG LEU A 127 -12.239 1.296 -1.436 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -12.044 -0.786 -0.134 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -10.467 -0.251 -0.763 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -10.876 0.007 0.950 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -13.788 0.866 0.433 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -12.686 1.722 1.538 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -13.485 2.606 0.216 1.00 0.00 H new ATOM 1916 N ALA A 128 -8.783 4.306 -1.831 1.00 0.00 N ATOM 1917 CA ALA A 128 -7.582 5.131 -1.819 1.00 0.00 C ATOM 1918 C ALA A 128 -7.895 6.562 -2.243 1.00 0.00 C ATOM 1919 O ALA A 128 -7.344 7.517 -1.695 1.00 0.00 O ATOM 1920 CB ALA A 128 -6.520 4.531 -2.728 1.00 0.00 C ATOM 0 H ALA A 128 -8.731 3.495 -2.448 1.00 0.00 H new ATOM 0 HA ALA A 128 -7.199 5.157 -0.799 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -5.628 5.158 -2.709 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -6.267 3.530 -2.380 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -6.903 4.475 -3.747 1.00 0.00 H new ATOM 1926 N SER A 129 -8.783 6.704 -3.222 1.00 0.00 N ATOM 1927 CA SER A 129 -9.166 8.019 -3.722 1.00 0.00 C ATOM 1928 C SER A 129 -9.858 8.834 -2.633 1.00 0.00 C ATOM 1929 O SER A 129 -9.729 10.057 -2.582 1.00 0.00 O ATOM 1930 CB SER A 129 -10.090 7.878 -4.933 1.00 0.00 C ATOM 1931 OG SER A 129 -10.760 9.096 -5.208 1.00 0.00 O ATOM 0 H SER A 129 -9.251 5.924 -3.685 1.00 0.00 H new ATOM 0 HA SER A 129 -8.260 8.544 -4.024 1.00 0.00 H new ATOM 0 HB2 SER A 129 -9.509 7.574 -5.804 1.00 0.00 H new ATOM 0 HB3 SER A 129 -10.821 7.091 -4.747 1.00 0.00 H new ATOM 0 HG SER A 129 -11.343 8.980 -5.987 1.00 0.00 H new ATOM 1937 N GLN A 130 -10.592 8.147 -1.764 1.00 0.00 N ATOM 1938 CA GLN A 130 -11.304 8.806 -0.677 1.00 0.00 C ATOM 1939 C GLN A 130 -10.335 9.541 0.243 1.00 0.00 C ATOM 1940 O GLN A 130 -10.425 10.756 0.413 1.00 0.00 O ATOM 1941 CB GLN A 130 -12.112 7.785 0.125 1.00 0.00 C ATOM 1942 CG GLN A 130 -13.318 7.240 -0.623 1.00 0.00 C ATOM 1943 CD GLN A 130 -14.399 6.726 0.306 1.00 0.00 C ATOM 1944 OE1 GLN A 130 -15.261 7.483 0.753 1.00 0.00 O ATOM 1945 NE2 GLN A 130 -14.359 5.432 0.604 1.00 0.00 N ATOM 0 H GLN A 130 -10.709 7.134 -1.792 1.00 0.00 H new ATOM 0 HA GLN A 130 -11.986 9.536 -1.114 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -11.461 6.955 0.401 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -12.449 8.248 1.052 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -13.732 8.024 -1.257 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -12.997 6.433 -1.282 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -13.627 4.841 0.211 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -15.061 5.030 1.226 1.00 0.00 H new ATOM 1954 N ALA A 131 -9.408 8.795 0.834 1.00 0.00 N ATOM 1955 CA ALA A 131 -8.420 9.375 1.735 1.00 0.00 C ATOM 1956 C ALA A 131 -7.726 10.571 1.092 1.00 0.00 C ATOM 1957 O ALA A 131 -7.681 11.659 1.667 1.00 0.00 O ATOM 1958 CB ALA A 131 -7.397 8.326 2.144 1.00 0.00 C ATOM 0 H ALA A 131 -9.320 7.787 0.705 1.00 0.00 H new ATOM 0 HA ALA A 131 -8.940 9.726 2.626 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -6.666 8.774 2.817 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -7.902 7.504 2.652 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -6.890 7.947 1.257 1.00 0.00 H new ATOM 1964 N THR A 132 -7.184 10.362 -0.103 1.00 0.00 N ATOM 1965 CA THR A 132 -6.490 11.422 -0.823 1.00 0.00 C ATOM 1966 C THR A 132 -7.429 12.584 -1.129 1.00 0.00 C ATOM 1967 O THR A 132 -7.190 13.715 -0.704 1.00 0.00 O ATOM 1968 CB THR A 132 -5.886 10.904 -2.142 1.00 0.00 C ATOM 1969 OG1 THR A 132 -4.727 10.109 -1.871 1.00 0.00 O ATOM 1970 CG2 THR A 132 -5.513 12.061 -3.058 1.00 0.00 C ATOM 0 H THR A 132 -7.212 9.468 -0.593 1.00 0.00 H new ATOM 0 HA THR A 132 -5.685 11.769 -0.175 1.00 0.00 H new ATOM 0 HB THR A 132 -6.636 10.292 -2.644 1.00 0.00 H new ATOM 0 HG1 THR A 132 -3.947 10.508 -2.310 1.00 0.00 H new ATOM 0 HG21 THR A 132 -5.089 11.671 -3.983 1.00 0.00 H new ATOM 0 HG22 THR A 132 -6.404 12.646 -3.286 1.00 0.00 H new ATOM 0 HG23 THR A 132 -4.779 12.696 -2.562 1.00 0.00 H new ATOM 1978 N ARG A 133 -8.497 12.298 -1.867 1.00 0.00 N ATOM 1979 CA ARG A 133 -9.470 13.321 -2.230 1.00 0.00 C ATOM 1980 C ARG A 133 -9.607 14.360 -1.121 1.00 0.00 C ATOM 1981 O ARG A 133 -9.354 15.546 -1.332 1.00 0.00 O ATOM 1982 CB ARG A 133 -10.830 12.681 -2.514 1.00 0.00 C ATOM 1983 CG ARG A 133 -11.863 13.658 -3.054 1.00 0.00 C ATOM 1984 CD ARG A 133 -11.842 13.706 -4.573 1.00 0.00 C ATOM 1985 NE ARG A 133 -13.154 14.033 -5.127 1.00 0.00 N ATOM 1986 CZ ARG A 133 -13.327 14.637 -6.298 1.00 0.00 C ATOM 1987 NH1 ARG A 133 -12.279 14.977 -7.033 1.00 0.00 N ATOM 1988 NH2 ARG A 133 -14.552 14.901 -6.735 1.00 0.00 N ATOM 0 H ARG A 133 -8.710 11.367 -2.225 1.00 0.00 H new ATOM 0 HA ARG A 133 -9.115 13.822 -3.131 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -10.698 11.871 -3.232 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -11.210 12.234 -1.596 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -12.856 13.366 -2.712 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -11.668 14.653 -2.655 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -11.114 14.447 -4.903 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -11.514 12.742 -4.962 1.00 0.00 H new ATOM 0 HE ARG A 133 -13.982 13.784 -4.586 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -11.336 14.775 -6.701 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -12.415 15.440 -7.931 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -15.362 14.640 -6.172 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -14.684 15.365 -7.634 1.00 0.00 H new