USER MOD reduce.3.24.130724 H: found=0, std=0, add=386, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 394 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 212 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 213 ASN : amide:sc= -1.08 K(o=-1.1,f=-0.003) USER MOD Set 2.1: A 195 ASN : amide:sc= -3.55! K(o=-13!,f=-6.2) USER MOD Set 2.2: A 202 THR OG1 : rot 180:sc= -2.72! USER MOD Set 2.3: A 203 ASN : amide:sc= -7.08! C(o=-13!,f=-4.4!) USER MOD Single : A 188 SER OG : rot 180:sc= -0.0287 USER MOD Single : A 191 SER OG : rot 180:sc= 0 USER MOD Single : A 194 ASN : amide:sc=-0.00528 K(o=-0.0053,f=-1.5!) USER MOD Single : A 198 ASN : amide:sc= -1.76 K(o=-1.8,f=-0.58) USER MOD Single : A 204 SER OG : rot 180:sc= 0 USER MOD Single : A 216 SER OG : rot 180:sc= 0 USER MOD Single : A 218 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 219 THR OG1 : rot -26:sc= 1.11 USER MOD Single : A 220 SER OG : rot 180:sc= 0 USER MOD Single : A 224 LYS NZ :NH3+ 165:sc=-0.00617 (180deg=-0.179) USER MOD Single : A 225 HIS : no HD1:sc= -5.19! C(o=-5.2!,f=-13!) USER MOD Single : A 229 LYS NZ :NH3+ 152:sc= -0.157 (180deg=-0.619) USER MOD Single : A 230 THR OG1 : rot 180:sc= 0 USER MOD Single : A 231 LYS NZ :NH3+ -177:sc= -4.22! (180deg=-4.5!) USER MOD Single : A 233 GLN : amide:sc= -2.33! K(o=-2.3!,f=-1) USER MOD Single : A 235 THR OG1 : rot 38:sc= 0.935 USER MOD Single : A 241 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 243 HIS : no HD1:sc= -0.0163 X(o=-0.016,f=-0.28) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 187 12.115 -23.762 1.562 1.00 0.00 N ATOM 2 CA GLY A 187 11.683 -22.448 1.006 1.00 0.00 C ATOM 3 C GLY A 187 10.570 -21.866 1.880 1.00 0.00 C ATOM 4 O GLY A 187 9.522 -21.488 1.397 1.00 0.00 O ATOM 0 HA2 GLY A 187 12.528 -21.761 0.969 1.00 0.00 H new ATOM 0 HA3 GLY A 187 11.329 -22.573 -0.017 1.00 0.00 H new ATOM 7 N SER A 188 10.790 -21.794 3.164 1.00 0.00 N ATOM 8 CA SER A 188 9.745 -21.242 4.071 1.00 0.00 C ATOM 9 C SER A 188 9.466 -19.783 3.707 1.00 0.00 C ATOM 10 O SER A 188 8.533 -19.480 2.991 1.00 0.00 O ATOM 11 CB SER A 188 10.234 -21.321 5.517 1.00 0.00 C ATOM 12 OG SER A 188 9.424 -20.485 6.334 1.00 0.00 O ATOM 0 H SER A 188 11.649 -22.094 3.624 1.00 0.00 H new ATOM 0 HA SER A 188 8.829 -21.823 3.963 1.00 0.00 H new ATOM 0 HB2 SER A 188 10.189 -22.350 5.873 1.00 0.00 H new ATOM 0 HB3 SER A 188 11.276 -21.008 5.578 1.00 0.00 H new ATOM 0 HG SER A 188 9.734 -20.535 7.262 1.00 0.00 H new ATOM 18 N CYS A 189 10.266 -18.875 4.196 1.00 0.00 N ATOM 19 CA CYS A 189 10.043 -17.437 3.878 1.00 0.00 C ATOM 20 C CYS A 189 11.267 -16.876 3.152 1.00 0.00 C ATOM 21 O CYS A 189 12.350 -17.423 3.219 1.00 0.00 O ATOM 22 CB CYS A 189 9.815 -16.656 5.174 1.00 0.00 C ATOM 23 SG CYS A 189 8.331 -17.277 6.006 1.00 0.00 S ATOM 0 H CYS A 189 11.064 -19.067 4.802 1.00 0.00 H new ATOM 0 HA CYS A 189 9.167 -17.340 3.237 1.00 0.00 H new ATOM 0 HB2 CYS A 189 10.681 -16.758 5.829 1.00 0.00 H new ATOM 0 HB3 CYS A 189 9.704 -15.594 4.955 1.00 0.00 H new ATOM 28 N ALA A 190 11.100 -15.784 2.461 1.00 0.00 N ATOM 29 CA ALA A 190 12.246 -15.174 1.728 1.00 0.00 C ATOM 30 C ALA A 190 11.846 -13.777 1.258 1.00 0.00 C ATOM 31 O ALA A 190 12.163 -12.785 1.884 1.00 0.00 O ATOM 32 CB ALA A 190 12.600 -16.038 0.517 1.00 0.00 C ATOM 0 H ALA A 190 10.215 -15.285 2.371 1.00 0.00 H new ATOM 0 HA ALA A 190 13.112 -15.110 2.387 1.00 0.00 H new ATOM 0 HB1 ALA A 190 13.438 -15.590 -0.017 1.00 0.00 H new ATOM 0 HB2 ALA A 190 12.876 -17.038 0.852 1.00 0.00 H new ATOM 0 HB3 ALA A 190 11.739 -16.103 -0.148 1.00 0.00 H new ATOM 38 N SER A 191 11.138 -13.693 0.166 1.00 0.00 N ATOM 39 CA SER A 191 10.702 -12.362 -0.340 1.00 0.00 C ATOM 40 C SER A 191 9.413 -11.957 0.377 1.00 0.00 C ATOM 41 O SER A 191 8.870 -10.893 0.151 1.00 0.00 O ATOM 42 CB SER A 191 10.446 -12.444 -1.846 1.00 0.00 C ATOM 43 OG SER A 191 9.214 -13.115 -2.077 1.00 0.00 O ATOM 0 H SER A 191 10.842 -14.490 -0.398 1.00 0.00 H new ATOM 0 HA SER A 191 11.479 -11.622 -0.149 1.00 0.00 H new ATOM 0 HB2 SER A 191 10.414 -11.443 -2.276 1.00 0.00 H new ATOM 0 HB3 SER A 191 11.261 -12.976 -2.337 1.00 0.00 H new ATOM 0 HG SER A 191 9.046 -13.168 -3.041 1.00 0.00 H new ATOM 49 N CYS A 192 8.919 -12.805 1.241 1.00 0.00 N ATOM 50 CA CYS A 192 7.664 -12.488 1.981 1.00 0.00 C ATOM 51 C CYS A 192 7.936 -12.552 3.487 1.00 0.00 C ATOM 52 O CYS A 192 7.459 -13.435 4.172 1.00 0.00 O ATOM 53 CB CYS A 192 6.593 -13.519 1.618 1.00 0.00 C ATOM 54 SG CYS A 192 5.618 -12.919 0.215 1.00 0.00 S ATOM 0 H CYS A 192 9.335 -13.709 1.466 1.00 0.00 H new ATOM 0 HA CYS A 192 7.320 -11.489 1.712 1.00 0.00 H new ATOM 0 HB2 CYS A 192 7.061 -14.471 1.367 1.00 0.00 H new ATOM 0 HB3 CYS A 192 5.943 -13.699 2.474 1.00 0.00 H new ATOM 59 N PRO A 193 8.706 -11.627 3.995 1.00 0.00 N ATOM 60 CA PRO A 193 9.060 -11.578 5.444 1.00 0.00 C ATOM 61 C PRO A 193 7.859 -11.248 6.338 1.00 0.00 C ATOM 62 O PRO A 193 7.767 -11.703 7.461 1.00 0.00 O ATOM 63 CB PRO A 193 10.113 -10.471 5.536 1.00 0.00 C ATOM 64 CG PRO A 193 9.917 -9.622 4.323 1.00 0.00 C ATOM 65 CD PRO A 193 9.323 -10.524 3.241 1.00 0.00 C ATOM 0 HA PRO A 193 9.416 -12.547 5.795 1.00 0.00 H new ATOM 0 HB2 PRO A 193 9.987 -9.886 6.447 1.00 0.00 H new ATOM 0 HB3 PRO A 193 11.119 -10.889 5.562 1.00 0.00 H new ATOM 0 HG2 PRO A 193 9.250 -8.788 4.539 1.00 0.00 H new ATOM 0 HG3 PRO A 193 10.864 -9.195 3.993 1.00 0.00 H new ATOM 0 HD2 PRO A 193 8.587 -9.992 2.638 1.00 0.00 H new ATOM 0 HD3 PRO A 193 10.091 -10.888 2.559 1.00 0.00 H new ATOM 73 N ASN A 194 6.943 -10.453 5.855 1.00 0.00 N ATOM 74 CA ASN A 194 5.758 -10.090 6.686 1.00 0.00 C ATOM 75 C ASN A 194 4.588 -11.027 6.374 1.00 0.00 C ATOM 76 O ASN A 194 3.483 -10.821 6.834 1.00 0.00 O ATOM 77 CB ASN A 194 5.345 -8.647 6.385 1.00 0.00 C ATOM 78 CG ASN A 194 6.475 -7.697 6.790 1.00 0.00 C ATOM 79 OD1 ASN A 194 7.368 -8.075 7.522 1.00 0.00 O ATOM 80 ND2 ASN A 194 6.471 -6.469 6.346 1.00 0.00 N ATOM 0 H ASN A 194 6.963 -10.040 4.923 1.00 0.00 H new ATOM 0 HA ASN A 194 6.022 -10.186 7.739 1.00 0.00 H new ATOM 0 HB2 ASN A 194 5.124 -8.535 5.324 1.00 0.00 H new ATOM 0 HB3 ASN A 194 4.434 -8.398 6.928 1.00 0.00 H new ATOM 0 HD21 ASN A 194 7.217 -5.827 6.614 1.00 0.00 H new ATOM 0 HD22 ASN A 194 5.721 -6.151 5.731 1.00 0.00 H new ATOM 87 N ASN A 195 4.812 -12.048 5.590 1.00 0.00 N ATOM 88 CA ASN A 195 3.695 -12.977 5.254 1.00 0.00 C ATOM 89 C ASN A 195 4.184 -14.427 5.315 1.00 0.00 C ATOM 90 O ASN A 195 4.582 -14.913 6.356 1.00 0.00 O ATOM 91 CB ASN A 195 3.190 -12.666 3.844 1.00 0.00 C ATOM 92 CG ASN A 195 2.785 -11.194 3.765 1.00 0.00 C ATOM 93 OD1 ASN A 195 2.068 -10.702 4.614 1.00 0.00 O ATOM 94 ND2 ASN A 195 3.224 -10.460 2.779 1.00 0.00 N ATOM 0 H ASN A 195 5.713 -12.277 5.171 1.00 0.00 H new ATOM 0 HA ASN A 195 2.887 -12.845 5.973 1.00 0.00 H new ATOM 0 HB2 ASN A 195 3.968 -12.881 3.111 1.00 0.00 H new ATOM 0 HB3 ASN A 195 2.339 -13.303 3.602 1.00 0.00 H new ATOM 0 HD21 ASN A 195 2.965 -9.475 2.722 1.00 0.00 H new ATOM 0 HD22 ASN A 195 3.826 -10.871 2.066 1.00 0.00 H new ATOM 101 N CYS A 196 4.150 -15.121 4.208 1.00 0.00 N ATOM 102 CA CYS A 196 4.604 -16.541 4.194 1.00 0.00 C ATOM 103 C CYS A 196 4.186 -17.226 5.496 1.00 0.00 C ATOM 104 O CYS A 196 5.012 -17.652 6.279 1.00 0.00 O ATOM 105 CB CYS A 196 6.128 -16.590 4.052 1.00 0.00 C ATOM 106 SG CYS A 196 6.900 -15.925 5.546 1.00 0.00 S ATOM 0 H CYS A 196 3.826 -14.763 3.310 1.00 0.00 H new ATOM 0 HA CYS A 196 4.146 -17.059 3.352 1.00 0.00 H new ATOM 0 HB2 CYS A 196 6.455 -17.617 3.888 1.00 0.00 H new ATOM 0 HB3 CYS A 196 6.441 -16.013 3.182 1.00 0.00 H new ATOM 111 N GLU A 197 2.906 -17.337 5.736 1.00 0.00 N ATOM 112 CA GLU A 197 2.438 -17.996 6.988 1.00 0.00 C ATOM 113 C GLU A 197 2.859 -19.466 6.972 1.00 0.00 C ATOM 114 O GLU A 197 3.276 -20.016 7.971 1.00 0.00 O ATOM 115 CB GLU A 197 0.912 -17.904 7.071 1.00 0.00 C ATOM 116 CG GLU A 197 0.494 -16.439 7.198 1.00 0.00 C ATOM 117 CD GLU A 197 -1.028 -16.354 7.333 1.00 0.00 C ATOM 118 OE1 GLU A 197 -1.520 -15.269 7.594 1.00 0.00 O ATOM 119 OE2 GLU A 197 -1.675 -17.376 7.171 1.00 0.00 O ATOM 0 H GLU A 197 2.166 -17.000 5.120 1.00 0.00 H new ATOM 0 HA GLU A 197 2.880 -17.498 7.851 1.00 0.00 H new ATOM 0 HB2 GLU A 197 0.462 -18.346 6.182 1.00 0.00 H new ATOM 0 HB3 GLU A 197 0.549 -18.472 7.928 1.00 0.00 H new ATOM 0 HG2 GLU A 197 0.973 -15.987 8.067 1.00 0.00 H new ATOM 0 HG3 GLU A 197 0.824 -15.878 6.324 1.00 0.00 H new ATOM 127 N ASN A 198 2.760 -20.099 5.837 1.00 0.00 N ATOM 128 CA ASN A 198 3.161 -21.529 5.733 1.00 0.00 C ATOM 129 C ASN A 198 3.930 -21.725 4.427 1.00 0.00 C ATOM 130 O ASN A 198 3.867 -22.767 3.806 1.00 0.00 O ATOM 131 CB ASN A 198 1.913 -22.415 5.730 1.00 0.00 C ATOM 132 CG ASN A 198 1.101 -22.159 7.001 1.00 0.00 C ATOM 133 OD1 ASN A 198 -0.106 -22.025 6.948 1.00 0.00 O ATOM 134 ND2 ASN A 198 1.715 -22.086 8.150 1.00 0.00 N ATOM 0 H ASN A 198 2.416 -19.684 4.971 1.00 0.00 H new ATOM 0 HA ASN A 198 3.788 -21.802 6.582 1.00 0.00 H new ATOM 0 HB2 ASN A 198 1.306 -22.203 4.850 1.00 0.00 H new ATOM 0 HB3 ASN A 198 2.200 -23.465 5.675 1.00 0.00 H new ATOM 0 HD21 ASN A 198 1.182 -21.917 9.003 1.00 0.00 H new ATOM 0 HD22 ASN A 198 2.728 -22.198 8.195 1.00 0.00 H new ATOM 141 N GLY A 199 4.642 -20.719 4.000 1.00 0.00 N ATOM 142 CA GLY A 199 5.403 -20.828 2.726 1.00 0.00 C ATOM 143 C GLY A 199 4.574 -20.205 1.602 1.00 0.00 C ATOM 144 O GLY A 199 4.947 -20.237 0.446 1.00 0.00 O ATOM 0 H GLY A 199 4.729 -19.824 4.481 1.00 0.00 H new ATOM 0 HA2 GLY A 199 6.362 -20.318 2.815 1.00 0.00 H new ATOM 0 HA3 GLY A 199 5.617 -21.873 2.502 1.00 0.00 H new ATOM 148 N LEU A 200 3.446 -19.638 1.941 1.00 0.00 N ATOM 149 CA LEU A 200 2.575 -19.008 0.908 1.00 0.00 C ATOM 150 C LEU A 200 2.510 -17.499 1.149 1.00 0.00 C ATOM 151 O LEU A 200 2.213 -17.051 2.238 1.00 0.00 O ATOM 152 CB LEU A 200 1.166 -19.594 1.018 1.00 0.00 C ATOM 153 CG LEU A 200 0.321 -19.126 -0.168 1.00 0.00 C ATOM 154 CD1 LEU A 200 0.709 -19.922 -1.416 1.00 0.00 C ATOM 155 CD2 LEU A 200 -1.161 -19.350 0.143 1.00 0.00 C ATOM 0 H LEU A 200 3.090 -19.585 2.895 1.00 0.00 H new ATOM 0 HA LEU A 200 2.983 -19.203 -0.084 1.00 0.00 H new ATOM 0 HB2 LEU A 200 1.215 -20.683 1.036 1.00 0.00 H new ATOM 0 HB3 LEU A 200 0.703 -19.280 1.954 1.00 0.00 H new ATOM 0 HG LEU A 200 0.498 -18.065 -0.346 1.00 0.00 H new ATOM 0 HD11 LEU A 200 0.107 -19.589 -2.262 1.00 0.00 H new ATOM 0 HD12 LEU A 200 1.764 -19.762 -1.636 1.00 0.00 H new ATOM 0 HD13 LEU A 200 0.532 -20.983 -1.240 1.00 0.00 H new ATOM 0 HD21 LEU A 200 -1.764 -19.017 -0.701 1.00 0.00 H new ATOM 0 HD22 LEU A 200 -1.339 -20.411 0.320 1.00 0.00 H new ATOM 0 HD23 LEU A 200 -1.436 -18.782 1.032 1.00 0.00 H new ATOM 167 N CYS A 201 2.772 -16.710 0.144 1.00 0.00 N ATOM 168 CA CYS A 201 2.712 -15.236 0.332 1.00 0.00 C ATOM 169 C CYS A 201 1.252 -14.809 0.497 1.00 0.00 C ATOM 170 O CYS A 201 0.467 -14.874 -0.429 1.00 0.00 O ATOM 171 CB CYS A 201 3.312 -14.538 -0.890 1.00 0.00 C ATOM 172 SG CYS A 201 5.117 -14.597 -0.794 1.00 0.00 S ATOM 0 H CYS A 201 3.024 -17.021 -0.794 1.00 0.00 H new ATOM 0 HA CYS A 201 3.279 -14.958 1.220 1.00 0.00 H new ATOM 0 HB2 CYS A 201 2.970 -15.024 -1.804 1.00 0.00 H new ATOM 0 HB3 CYS A 201 2.973 -13.503 -0.933 1.00 0.00 H new ATOM 177 N THR A 202 0.880 -14.375 1.670 1.00 0.00 N ATOM 178 CA THR A 202 -0.528 -13.949 1.890 1.00 0.00 C ATOM 179 C THR A 202 -0.720 -12.537 1.335 1.00 0.00 C ATOM 180 O THR A 202 -1.813 -12.005 1.323 1.00 0.00 O ATOM 181 CB THR A 202 -0.837 -13.960 3.391 1.00 0.00 C ATOM 182 OG1 THR A 202 -0.016 -13.005 4.049 1.00 0.00 O ATOM 183 CG2 THR A 202 -0.564 -15.354 3.962 1.00 0.00 C ATOM 0 H THR A 202 1.490 -14.298 2.484 1.00 0.00 H new ATOM 0 HA THR A 202 -1.203 -14.635 1.379 1.00 0.00 H new ATOM 0 HB THR A 202 -1.886 -13.707 3.548 1.00 0.00 H new ATOM 0 HG1 THR A 202 -0.214 -13.010 5.009 1.00 0.00 H new ATOM 0 HG21 THR A 202 -0.784 -15.359 5.029 1.00 0.00 H new ATOM 0 HG22 THR A 202 -1.196 -16.084 3.457 1.00 0.00 H new ATOM 0 HG23 THR A 202 0.484 -15.612 3.806 1.00 0.00 H new ATOM 191 N ASN A 203 0.336 -11.927 0.872 1.00 0.00 N ATOM 192 CA ASN A 203 0.223 -10.552 0.313 1.00 0.00 C ATOM 193 C ASN A 203 1.358 -10.322 -0.686 1.00 0.00 C ATOM 194 O ASN A 203 2.495 -10.115 -0.310 1.00 0.00 O ATOM 195 CB ASN A 203 0.324 -9.531 1.446 1.00 0.00 C ATOM 196 CG ASN A 203 -0.668 -9.895 2.553 1.00 0.00 C ATOM 197 OD1 ASN A 203 -1.825 -9.528 2.493 1.00 0.00 O ATOM 198 ND2 ASN A 203 -0.262 -10.613 3.564 1.00 0.00 N ATOM 0 H ASN A 203 1.275 -12.324 0.857 1.00 0.00 H new ATOM 0 HA ASN A 203 -0.737 -10.438 -0.190 1.00 0.00 H new ATOM 0 HB2 ASN A 203 1.339 -9.513 1.844 1.00 0.00 H new ATOM 0 HB3 ASN A 203 0.112 -8.531 1.068 1.00 0.00 H new ATOM 0 HD21 ASN A 203 -0.916 -10.867 4.305 1.00 0.00 H new ATOM 0 HD22 ASN A 203 0.709 -10.921 3.614 1.00 0.00 H new ATOM 205 N SER A 204 1.061 -10.351 -1.956 1.00 0.00 N ATOM 206 CA SER A 204 2.126 -10.131 -2.972 1.00 0.00 C ATOM 207 C SER A 204 2.373 -8.630 -3.120 1.00 0.00 C ATOM 208 O SER A 204 3.260 -8.204 -3.832 1.00 0.00 O ATOM 209 CB SER A 204 1.681 -10.713 -4.315 1.00 0.00 C ATOM 210 OG SER A 204 0.631 -9.915 -4.848 1.00 0.00 O ATOM 0 H SER A 204 0.128 -10.517 -2.333 1.00 0.00 H new ATOM 0 HA SER A 204 3.045 -10.624 -2.654 1.00 0.00 H new ATOM 0 HB2 SER A 204 2.521 -10.740 -5.009 1.00 0.00 H new ATOM 0 HB3 SER A 204 1.342 -11.741 -4.185 1.00 0.00 H new ATOM 0 HG SER A 204 0.345 -10.284 -5.709 1.00 0.00 H new ATOM 216 N CYS A 205 1.590 -7.835 -2.437 1.00 0.00 N ATOM 217 CA CYS A 205 1.745 -6.351 -2.505 1.00 0.00 C ATOM 218 C CYS A 205 2.807 -5.963 -3.535 1.00 0.00 C ATOM 219 O CYS A 205 3.966 -5.796 -3.213 1.00 0.00 O ATOM 220 CB CYS A 205 2.162 -5.828 -1.131 1.00 0.00 C ATOM 221 SG CYS A 205 1.981 -4.027 -1.092 1.00 0.00 S ATOM 0 H CYS A 205 0.839 -8.156 -1.826 1.00 0.00 H new ATOM 0 HA CYS A 205 0.793 -5.913 -2.804 1.00 0.00 H new ATOM 0 HB2 CYS A 205 1.547 -6.283 -0.355 1.00 0.00 H new ATOM 0 HB3 CYS A 205 3.195 -6.105 -0.923 1.00 0.00 H new ATOM 226 N ASP A 206 2.416 -5.809 -4.771 1.00 0.00 N ATOM 227 CA ASP A 206 3.399 -5.420 -5.822 1.00 0.00 C ATOM 228 C ASP A 206 3.116 -3.983 -6.269 1.00 0.00 C ATOM 229 O ASP A 206 3.609 -3.533 -7.285 1.00 0.00 O ATOM 230 CB ASP A 206 3.269 -6.364 -7.021 1.00 0.00 C ATOM 231 CG ASP A 206 4.418 -6.111 -7.998 1.00 0.00 C ATOM 232 OD1 ASP A 206 4.374 -6.655 -9.089 1.00 0.00 O ATOM 233 OD2 ASP A 206 5.325 -5.377 -7.639 1.00 0.00 O ATOM 0 H ASP A 206 1.458 -5.936 -5.098 1.00 0.00 H new ATOM 0 HA ASP A 206 4.410 -5.486 -5.420 1.00 0.00 H new ATOM 0 HB2 ASP A 206 3.286 -7.401 -6.684 1.00 0.00 H new ATOM 0 HB3 ASP A 206 2.313 -6.206 -7.519 1.00 0.00 H new ATOM 239 N PHE A 207 2.319 -3.262 -5.523 1.00 0.00 N ATOM 240 CA PHE A 207 2.001 -1.858 -5.917 1.00 0.00 C ATOM 241 C PHE A 207 2.510 -0.887 -4.852 1.00 0.00 C ATOM 242 O PHE A 207 2.646 -1.230 -3.693 1.00 0.00 O ATOM 243 CB PHE A 207 0.486 -1.691 -6.047 1.00 0.00 C ATOM 244 CG PHE A 207 -0.180 -3.042 -5.972 1.00 0.00 C ATOM 245 CD1 PHE A 207 0.193 -4.059 -6.858 1.00 0.00 C ATOM 246 CD2 PHE A 207 -1.169 -3.279 -5.011 1.00 0.00 C ATOM 247 CE1 PHE A 207 -0.423 -5.313 -6.781 1.00 0.00 C ATOM 248 CE2 PHE A 207 -1.784 -4.531 -4.932 1.00 0.00 C ATOM 249 CZ PHE A 207 -1.412 -5.549 -5.818 1.00 0.00 C ATOM 0 H PHE A 207 1.877 -3.583 -4.662 1.00 0.00 H new ATOM 0 HA PHE A 207 2.485 -1.644 -6.870 1.00 0.00 H new ATOM 0 HB2 PHE A 207 0.112 -1.045 -5.253 1.00 0.00 H new ATOM 0 HB3 PHE A 207 0.243 -1.207 -6.993 1.00 0.00 H new ATOM 0 HD1 PHE A 207 0.956 -3.876 -7.601 1.00 0.00 H new ATOM 0 HD2 PHE A 207 -1.457 -2.493 -4.329 1.00 0.00 H new ATOM 0 HE1 PHE A 207 -0.136 -6.099 -7.464 1.00 0.00 H new ATOM 0 HE2 PHE A 207 -2.546 -4.713 -4.188 1.00 0.00 H new ATOM 0 HZ PHE A 207 -1.888 -6.517 -5.759 1.00 0.00 H new ATOM 259 N GLU A 208 2.772 0.331 -5.238 1.00 0.00 N ATOM 260 CA GLU A 208 3.252 1.346 -4.261 1.00 0.00 C ATOM 261 C GLU A 208 2.392 2.604 -4.411 1.00 0.00 C ATOM 262 O GLU A 208 1.989 2.957 -5.501 1.00 0.00 O ATOM 263 CB GLU A 208 4.716 1.688 -4.549 1.00 0.00 C ATOM 264 CG GLU A 208 5.279 2.526 -3.402 1.00 0.00 C ATOM 265 CD GLU A 208 5.401 1.657 -2.149 1.00 0.00 C ATOM 266 OE1 GLU A 208 5.390 2.213 -1.064 1.00 0.00 O ATOM 267 OE2 GLU A 208 5.501 0.450 -2.298 1.00 0.00 O ATOM 0 H GLU A 208 2.673 0.668 -6.196 1.00 0.00 H new ATOM 0 HA GLU A 208 3.174 0.955 -3.246 1.00 0.00 H new ATOM 0 HB2 GLU A 208 5.298 0.774 -4.665 1.00 0.00 H new ATOM 0 HB3 GLU A 208 4.794 2.237 -5.487 1.00 0.00 H new ATOM 0 HG2 GLU A 208 6.255 2.928 -3.676 1.00 0.00 H new ATOM 0 HG3 GLU A 208 4.627 3.377 -3.205 1.00 0.00 H new ATOM 275 N ASP A 209 2.095 3.283 -3.337 1.00 0.00 N ATOM 276 CA ASP A 209 1.254 4.506 -3.457 1.00 0.00 C ATOM 277 C ASP A 209 2.045 5.598 -4.171 1.00 0.00 C ATOM 278 O ASP A 209 2.997 6.138 -3.646 1.00 0.00 O ATOM 279 CB ASP A 209 0.849 5.001 -2.066 1.00 0.00 C ATOM 280 CG ASP A 209 -0.124 4.006 -1.431 1.00 0.00 C ATOM 281 OD1 ASP A 209 -0.723 3.241 -2.169 1.00 0.00 O ATOM 282 OD2 ASP A 209 -0.255 4.028 -0.219 1.00 0.00 O ATOM 0 H ASP A 209 2.395 3.047 -2.391 1.00 0.00 H new ATOM 0 HA ASP A 209 0.357 4.267 -4.028 1.00 0.00 H new ATOM 0 HB2 ASP A 209 1.732 5.113 -1.437 1.00 0.00 H new ATOM 0 HB3 ASP A 209 0.383 5.984 -2.140 1.00 0.00 H new ATOM 288 N LEU A 210 1.646 5.932 -5.362 1.00 0.00 N ATOM 289 CA LEU A 210 2.355 6.996 -6.118 1.00 0.00 C ATOM 290 C LEU A 210 2.221 8.320 -5.362 1.00 0.00 C ATOM 291 O LEU A 210 3.069 9.187 -5.451 1.00 0.00 O ATOM 292 CB LEU A 210 1.740 7.115 -7.513 1.00 0.00 C ATOM 293 CG LEU A 210 2.294 6.007 -8.411 1.00 0.00 C ATOM 294 CD1 LEU A 210 2.004 4.642 -7.784 1.00 0.00 C ATOM 295 CD2 LEU A 210 1.628 6.086 -9.787 1.00 0.00 C ATOM 0 H LEU A 210 0.854 5.511 -5.848 1.00 0.00 H new ATOM 0 HA LEU A 210 3.412 6.748 -6.217 1.00 0.00 H new ATOM 0 HB2 LEU A 210 0.654 7.039 -7.451 1.00 0.00 H new ATOM 0 HB3 LEU A 210 1.967 8.092 -7.940 1.00 0.00 H new ATOM 0 HG LEU A 210 3.371 6.134 -8.518 1.00 0.00 H new ATOM 0 HD11 LEU A 210 2.400 3.855 -8.426 1.00 0.00 H new ATOM 0 HD12 LEU A 210 2.478 4.584 -6.804 1.00 0.00 H new ATOM 0 HD13 LEU A 210 0.927 4.513 -7.674 1.00 0.00 H new ATOM 0 HD21 LEU A 210 2.022 5.297 -10.428 1.00 0.00 H new ATOM 0 HD22 LEU A 210 0.551 5.961 -9.678 1.00 0.00 H new ATOM 0 HD23 LEU A 210 1.836 7.057 -10.237 1.00 0.00 H new ATOM 307 N LEU A 211 1.162 8.479 -4.614 1.00 0.00 N ATOM 308 CA LEU A 211 0.969 9.743 -3.843 1.00 0.00 C ATOM 309 C LEU A 211 1.100 9.451 -2.348 1.00 0.00 C ATOM 310 O LEU A 211 0.652 8.431 -1.865 1.00 0.00 O ATOM 311 CB LEU A 211 -0.424 10.311 -4.126 1.00 0.00 C ATOM 312 CG LEU A 211 -0.613 10.486 -5.633 1.00 0.00 C ATOM 313 CD1 LEU A 211 -1.947 11.187 -5.903 1.00 0.00 C ATOM 314 CD2 LEU A 211 0.531 11.331 -6.198 1.00 0.00 C ATOM 0 H LEU A 211 0.421 7.787 -4.503 1.00 0.00 H new ATOM 0 HA LEU A 211 1.725 10.468 -4.144 1.00 0.00 H new ATOM 0 HB2 LEU A 211 -1.188 9.642 -3.729 1.00 0.00 H new ATOM 0 HB3 LEU A 211 -0.546 11.269 -3.621 1.00 0.00 H new ATOM 0 HG LEU A 211 -0.613 9.508 -6.114 1.00 0.00 H new ATOM 0 HD11 LEU A 211 -2.082 11.312 -6.977 1.00 0.00 H new ATOM 0 HD12 LEU A 211 -2.762 10.584 -5.503 1.00 0.00 H new ATOM 0 HD13 LEU A 211 -1.948 12.165 -5.421 1.00 0.00 H new ATOM 0 HD21 LEU A 211 0.395 11.455 -7.272 1.00 0.00 H new ATOM 0 HD22 LEU A 211 0.533 12.309 -5.717 1.00 0.00 H new ATOM 0 HD23 LEU A 211 1.481 10.831 -6.008 1.00 0.00 H new ATOM 326 N SER A 212 1.703 10.342 -1.607 1.00 0.00 N ATOM 327 CA SER A 212 1.850 10.111 -0.143 1.00 0.00 C ATOM 328 C SER A 212 0.556 10.515 0.561 1.00 0.00 C ATOM 329 O SER A 212 0.408 10.345 1.755 1.00 0.00 O ATOM 330 CB SER A 212 3.009 10.952 0.396 1.00 0.00 C ATOM 331 OG SER A 212 2.617 12.317 0.440 1.00 0.00 O ATOM 0 H SER A 212 2.099 11.217 -1.952 1.00 0.00 H new ATOM 0 HA SER A 212 2.055 9.056 0.042 1.00 0.00 H new ATOM 0 HB2 SER A 212 3.289 10.610 1.392 1.00 0.00 H new ATOM 0 HB3 SER A 212 3.886 10.834 -0.240 1.00 0.00 H new ATOM 0 HG SER A 212 3.357 12.859 0.786 1.00 0.00 H new ATOM 337 N ASN A 213 -0.384 11.044 -0.172 1.00 0.00 N ATOM 338 CA ASN A 213 -1.671 11.453 0.451 1.00 0.00 C ATOM 339 C ASN A 213 -2.750 10.429 0.094 1.00 0.00 C ATOM 340 O ASN A 213 -3.931 10.681 0.226 1.00 0.00 O ATOM 341 CB ASN A 213 -2.076 12.833 -0.069 1.00 0.00 C ATOM 342 CG ASN A 213 -1.022 13.860 0.341 1.00 0.00 C ATOM 343 OD1 ASN A 213 -0.798 14.830 -0.356 1.00 0.00 O ATOM 344 ND2 ASN A 213 -0.360 13.686 1.450 1.00 0.00 N ATOM 0 H ASN A 213 -0.315 11.210 -1.176 1.00 0.00 H new ATOM 0 HA ASN A 213 -1.557 11.499 1.534 1.00 0.00 H new ATOM 0 HB2 ASN A 213 -2.174 12.810 -1.154 1.00 0.00 H new ATOM 0 HB3 ASN A 213 -3.049 13.114 0.333 1.00 0.00 H new ATOM 0 HD21 ASN A 213 0.347 14.364 1.734 1.00 0.00 H new ATOM 0 HD22 ASN A 213 -0.549 12.872 2.034 1.00 0.00 H new ATOM 351 N CYS A 214 -2.348 9.275 -0.366 1.00 0.00 N ATOM 352 CA CYS A 214 -3.342 8.232 -0.744 1.00 0.00 C ATOM 353 C CYS A 214 -4.297 7.970 0.420 1.00 0.00 C ATOM 354 O CYS A 214 -5.495 7.877 0.237 1.00 0.00 O ATOM 355 CB CYS A 214 -2.607 6.943 -1.102 1.00 0.00 C ATOM 356 SG CYS A 214 -1.935 7.091 -2.773 1.00 0.00 S ATOM 0 H CYS A 214 -1.372 9.010 -0.496 1.00 0.00 H new ATOM 0 HA CYS A 214 -3.918 8.579 -1.602 1.00 0.00 H new ATOM 0 HB2 CYS A 214 -1.804 6.757 -0.389 1.00 0.00 H new ATOM 0 HB3 CYS A 214 -3.287 6.093 -1.044 1.00 0.00 H new ATOM 361 N GLU A 215 -3.790 7.862 1.615 1.00 0.00 N ATOM 362 CA GLU A 215 -4.696 7.619 2.767 1.00 0.00 C ATOM 363 C GLU A 215 -5.680 8.783 2.855 1.00 0.00 C ATOM 364 O GLU A 215 -6.848 8.609 3.141 1.00 0.00 O ATOM 365 CB GLU A 215 -3.878 7.535 4.056 1.00 0.00 C ATOM 366 CG GLU A 215 -4.785 7.098 5.207 1.00 0.00 C ATOM 367 CD GLU A 215 -3.994 7.115 6.516 1.00 0.00 C ATOM 368 OE1 GLU A 215 -4.561 6.751 7.533 1.00 0.00 O ATOM 369 OE2 GLU A 215 -2.835 7.495 6.480 1.00 0.00 O ATOM 0 H GLU A 215 -2.798 7.931 1.842 1.00 0.00 H new ATOM 0 HA GLU A 215 -5.235 6.681 2.632 1.00 0.00 H new ATOM 0 HB2 GLU A 215 -3.059 6.826 3.934 1.00 0.00 H new ATOM 0 HB3 GLU A 215 -3.430 8.503 4.279 1.00 0.00 H new ATOM 0 HG2 GLU A 215 -5.644 7.765 5.280 1.00 0.00 H new ATOM 0 HG3 GLU A 215 -5.174 6.097 5.018 1.00 0.00 H new ATOM 377 N SER A 216 -5.208 9.973 2.597 1.00 0.00 N ATOM 378 CA SER A 216 -6.101 11.161 2.646 1.00 0.00 C ATOM 379 C SER A 216 -7.150 11.054 1.536 1.00 0.00 C ATOM 380 O SER A 216 -8.317 11.324 1.739 1.00 0.00 O ATOM 381 CB SER A 216 -5.265 12.424 2.434 1.00 0.00 C ATOM 382 OG SER A 216 -6.066 13.571 2.686 1.00 0.00 O ATOM 0 H SER A 216 -4.238 10.172 2.354 1.00 0.00 H new ATOM 0 HA SER A 216 -6.600 11.207 3.614 1.00 0.00 H new ATOM 0 HB2 SER A 216 -4.401 12.417 3.099 1.00 0.00 H new ATOM 0 HB3 SER A 216 -4.882 12.452 1.414 1.00 0.00 H new ATOM 0 HG SER A 216 -5.530 14.380 2.552 1.00 0.00 H new ATOM 388 N LEU A 217 -6.739 10.661 0.358 1.00 0.00 N ATOM 389 CA LEU A 217 -7.708 10.539 -0.769 1.00 0.00 C ATOM 390 C LEU A 217 -8.709 9.422 -0.476 1.00 0.00 C ATOM 391 O LEU A 217 -9.872 9.518 -0.809 1.00 0.00 O ATOM 392 CB LEU A 217 -6.953 10.216 -2.059 1.00 0.00 C ATOM 393 CG LEU A 217 -5.936 11.321 -2.351 1.00 0.00 C ATOM 394 CD1 LEU A 217 -5.201 11.004 -3.654 1.00 0.00 C ATOM 395 CD2 LEU A 217 -6.664 12.659 -2.496 1.00 0.00 C ATOM 0 H LEU A 217 -5.775 10.420 0.129 1.00 0.00 H new ATOM 0 HA LEU A 217 -8.243 11.482 -0.883 1.00 0.00 H new ATOM 0 HB2 LEU A 217 -6.445 9.256 -1.964 1.00 0.00 H new ATOM 0 HB3 LEU A 217 -7.654 10.125 -2.889 1.00 0.00 H new ATOM 0 HG LEU A 217 -5.220 11.381 -1.531 1.00 0.00 H new ATOM 0 HD11 LEU A 217 -4.476 11.791 -3.863 1.00 0.00 H new ATOM 0 HD12 LEU A 217 -4.683 10.050 -3.557 1.00 0.00 H new ATOM 0 HD13 LEU A 217 -5.919 10.945 -4.472 1.00 0.00 H new ATOM 0 HD21 LEU A 217 -5.940 13.447 -2.704 1.00 0.00 H new ATOM 0 HD22 LEU A 217 -7.379 12.597 -3.317 1.00 0.00 H new ATOM 0 HD23 LEU A 217 -7.193 12.888 -1.571 1.00 0.00 H new ATOM 407 N LYS A 218 -8.268 8.358 0.136 1.00 0.00 N ATOM 408 CA LYS A 218 -9.199 7.237 0.436 1.00 0.00 C ATOM 409 C LYS A 218 -10.342 7.744 1.318 1.00 0.00 C ATOM 410 O LYS A 218 -11.488 7.388 1.131 1.00 0.00 O ATOM 411 CB LYS A 218 -8.451 6.132 1.175 1.00 0.00 C ATOM 412 CG LYS A 218 -9.159 4.793 0.937 1.00 0.00 C ATOM 413 CD LYS A 218 -9.512 4.160 2.279 1.00 0.00 C ATOM 414 CE LYS A 218 -8.258 4.076 3.145 1.00 0.00 C ATOM 415 NZ LYS A 218 -8.144 2.709 3.729 1.00 0.00 N ATOM 0 H LYS A 218 -7.305 8.217 0.440 1.00 0.00 H new ATOM 0 HA LYS A 218 -9.601 6.845 -0.498 1.00 0.00 H new ATOM 0 HB2 LYS A 218 -7.420 6.078 0.825 1.00 0.00 H new ATOM 0 HB3 LYS A 218 -8.415 6.353 2.242 1.00 0.00 H new ATOM 0 HG2 LYS A 218 -10.062 4.947 0.346 1.00 0.00 H new ATOM 0 HG3 LYS A 218 -8.514 4.125 0.366 1.00 0.00 H new ATOM 0 HD2 LYS A 218 -10.276 4.752 2.783 1.00 0.00 H new ATOM 0 HD3 LYS A 218 -9.929 3.165 2.126 1.00 0.00 H new ATOM 0 HE2 LYS A 218 -7.375 4.302 2.547 1.00 0.00 H new ATOM 0 HE3 LYS A 218 -8.303 4.820 3.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 218 -7.289 2.654 4.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 218 -8.981 2.510 4.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 218 -8.082 2.008 2.963 1.00 0.00 H new ATOM 429 N THR A 219 -10.037 8.569 2.283 1.00 0.00 N ATOM 430 CA THR A 219 -11.100 9.095 3.180 1.00 0.00 C ATOM 431 C THR A 219 -11.976 10.094 2.421 1.00 0.00 C ATOM 432 O THR A 219 -13.142 10.257 2.718 1.00 0.00 O ATOM 433 CB THR A 219 -10.444 9.791 4.372 1.00 0.00 C ATOM 434 OG1 THR A 219 -9.687 10.902 3.913 1.00 0.00 O ATOM 435 CG2 THR A 219 -9.524 8.808 5.098 1.00 0.00 C ATOM 0 H THR A 219 -9.094 8.901 2.487 1.00 0.00 H new ATOM 0 HA THR A 219 -11.724 8.272 3.528 1.00 0.00 H new ATOM 0 HB THR A 219 -11.216 10.137 5.060 1.00 0.00 H new ATOM 0 HG1 THR A 219 -9.411 10.749 2.985 1.00 0.00 H new ATOM 0 HG21 THR A 219 -9.057 9.306 5.948 1.00 0.00 H new ATOM 0 HG22 THR A 219 -10.107 7.957 5.451 1.00 0.00 H new ATOM 0 HG23 THR A 219 -8.751 8.459 4.413 1.00 0.00 H new ATOM 443 N SER A 220 -11.427 10.765 1.446 1.00 0.00 N ATOM 444 CA SER A 220 -12.237 11.753 0.677 1.00 0.00 C ATOM 445 C SER A 220 -12.798 11.093 -0.585 1.00 0.00 C ATOM 446 O SER A 220 -13.798 11.521 -1.125 1.00 0.00 O ATOM 447 CB SER A 220 -11.356 12.938 0.281 1.00 0.00 C ATOM 448 OG SER A 220 -11.594 14.018 1.175 1.00 0.00 O ATOM 0 H SER A 220 -10.456 10.673 1.149 1.00 0.00 H new ATOM 0 HA SER A 220 -13.062 12.102 1.299 1.00 0.00 H new ATOM 0 HB2 SER A 220 -10.305 12.651 0.311 1.00 0.00 H new ATOM 0 HB3 SER A 220 -11.574 13.243 -0.742 1.00 0.00 H new ATOM 0 HG SER A 220 -11.030 14.779 0.926 1.00 0.00 H new ATOM 454 N ALA A 221 -12.161 10.057 -1.060 1.00 0.00 N ATOM 455 CA ALA A 221 -12.662 9.374 -2.288 1.00 0.00 C ATOM 456 C ALA A 221 -13.006 7.923 -1.955 1.00 0.00 C ATOM 457 O ALA A 221 -14.140 7.593 -1.669 1.00 0.00 O ATOM 458 CB ALA A 221 -11.581 9.409 -3.372 1.00 0.00 C ATOM 0 H ALA A 221 -11.317 9.654 -0.652 1.00 0.00 H new ATOM 0 HA ALA A 221 -13.553 9.886 -2.652 1.00 0.00 H new ATOM 0 HB1 ALA A 221 -11.948 8.910 -4.269 1.00 0.00 H new ATOM 0 HB2 ALA A 221 -11.336 10.445 -3.608 1.00 0.00 H new ATOM 0 HB3 ALA A 221 -10.688 8.898 -3.012 1.00 0.00 H new ATOM 464 N GLY A 222 -12.036 7.051 -1.989 1.00 0.00 N ATOM 465 CA GLY A 222 -12.308 5.621 -1.672 1.00 0.00 C ATOM 466 C GLY A 222 -11.274 4.737 -2.370 1.00 0.00 C ATOM 467 O GLY A 222 -10.979 4.909 -3.535 1.00 0.00 O ATOM 0 H GLY A 222 -11.067 7.267 -2.223 1.00 0.00 H new ATOM 0 HA2 GLY A 222 -12.269 5.463 -0.594 1.00 0.00 H new ATOM 0 HA3 GLY A 222 -13.312 5.350 -1.998 1.00 0.00 H new ATOM 471 N CYS A 223 -10.723 3.787 -1.664 1.00 0.00 N ATOM 472 CA CYS A 223 -9.712 2.887 -2.285 1.00 0.00 C ATOM 473 C CYS A 223 -10.340 2.187 -3.492 1.00 0.00 C ATOM 474 O CYS A 223 -9.689 1.933 -4.486 1.00 0.00 O ATOM 475 CB CYS A 223 -9.256 1.859 -1.245 1.00 0.00 C ATOM 476 SG CYS A 223 -9.597 0.178 -1.828 1.00 0.00 S ATOM 0 H CYS A 223 -10.930 3.596 -0.684 1.00 0.00 H new ATOM 0 HA CYS A 223 -8.847 3.460 -2.620 1.00 0.00 H new ATOM 0 HB2 CYS A 223 -8.189 1.975 -1.053 1.00 0.00 H new ATOM 0 HB3 CYS A 223 -9.771 2.035 -0.300 1.00 0.00 H new ATOM 481 N LYS A 224 -11.608 1.890 -3.416 1.00 0.00 N ATOM 482 CA LYS A 224 -12.291 1.223 -4.561 1.00 0.00 C ATOM 483 C LYS A 224 -12.862 2.290 -5.501 1.00 0.00 C ATOM 484 O LYS A 224 -13.575 1.988 -6.437 1.00 0.00 O ATOM 485 CB LYS A 224 -13.430 0.348 -4.034 1.00 0.00 C ATOM 486 CG LYS A 224 -12.854 -0.774 -3.171 1.00 0.00 C ATOM 487 CD LYS A 224 -13.985 -1.701 -2.721 1.00 0.00 C ATOM 488 CE LYS A 224 -13.425 -2.784 -1.797 1.00 0.00 C ATOM 489 NZ LYS A 224 -13.095 -2.188 -0.472 1.00 0.00 N ATOM 0 H LYS A 224 -12.202 2.081 -2.609 1.00 0.00 H new ATOM 0 HA LYS A 224 -11.576 0.603 -5.102 1.00 0.00 H new ATOM 0 HB2 LYS A 224 -14.125 0.951 -3.449 1.00 0.00 H new ATOM 0 HB3 LYS A 224 -13.995 -0.072 -4.866 1.00 0.00 H new ATOM 0 HG2 LYS A 224 -12.111 -1.337 -3.736 1.00 0.00 H new ATOM 0 HG3 LYS A 224 -12.345 -0.355 -2.303 1.00 0.00 H new ATOM 0 HD2 LYS A 224 -14.754 -1.128 -2.202 1.00 0.00 H new ATOM 0 HD3 LYS A 224 -14.460 -2.159 -3.588 1.00 0.00 H new ATOM 0 HE2 LYS A 224 -14.154 -3.585 -1.675 1.00 0.00 H new ATOM 0 HE3 LYS A 224 -12.534 -3.229 -2.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 224 -12.959 -2.947 0.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 224 -12.221 -1.630 -0.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 224 -13.874 -1.571 -0.165 1.00 0.00 H new ATOM 503 N HIS A 225 -12.562 3.535 -5.249 1.00 0.00 N ATOM 504 CA HIS A 225 -13.094 4.628 -6.116 1.00 0.00 C ATOM 505 C HIS A 225 -12.717 4.388 -7.578 1.00 0.00 C ATOM 506 O HIS A 225 -13.556 4.434 -8.452 1.00 0.00 O ATOM 507 CB HIS A 225 -12.490 5.961 -5.671 1.00 0.00 C ATOM 508 CG HIS A 225 -12.765 7.004 -6.719 1.00 0.00 C ATOM 509 ND1 HIS A 225 -12.261 6.900 -8.008 1.00 0.00 N ATOM 510 CD2 HIS A 225 -13.488 8.171 -6.691 1.00 0.00 C ATOM 511 CE1 HIS A 225 -12.683 7.976 -8.696 1.00 0.00 C ATOM 512 NE2 HIS A 225 -13.432 8.780 -7.939 1.00 0.00 N ATOM 0 H HIS A 225 -11.970 3.844 -4.478 1.00 0.00 H new ATOM 0 HA HIS A 225 -14.180 4.647 -6.024 1.00 0.00 H new ATOM 0 HB2 HIS A 225 -12.917 6.267 -4.716 1.00 0.00 H new ATOM 0 HB3 HIS A 225 -11.416 5.855 -5.520 1.00 0.00 H new ATOM 0 HD2 HIS A 225 -14.018 8.556 -5.832 1.00 0.00 H new ATOM 0 HE1 HIS A 225 -12.445 8.166 -9.732 1.00 0.00 H new ATOM 0 HE2 HIS A 225 -13.871 9.657 -8.218 1.00 0.00 H new ATOM 521 N GLU A 226 -11.456 4.150 -7.836 1.00 0.00 N ATOM 522 CA GLU A 226 -10.967 3.921 -9.233 1.00 0.00 C ATOM 523 C GLU A 226 -9.659 4.691 -9.415 1.00 0.00 C ATOM 524 O GLU A 226 -8.634 4.127 -9.744 1.00 0.00 O ATOM 525 CB GLU A 226 -11.996 4.409 -10.263 1.00 0.00 C ATOM 526 CG GLU A 226 -11.439 4.220 -11.677 1.00 0.00 C ATOM 527 CD GLU A 226 -12.434 4.776 -12.697 1.00 0.00 C ATOM 528 OE1 GLU A 226 -12.147 4.696 -13.881 1.00 0.00 O ATOM 529 OE2 GLU A 226 -13.467 5.274 -12.279 1.00 0.00 O ATOM 0 H GLU A 226 -10.728 4.104 -7.123 1.00 0.00 H new ATOM 0 HA GLU A 226 -10.813 2.853 -9.390 1.00 0.00 H new ATOM 0 HB2 GLU A 226 -12.928 3.855 -10.151 1.00 0.00 H new ATOM 0 HB3 GLU A 226 -12.228 5.460 -10.090 1.00 0.00 H new ATOM 0 HG2 GLU A 226 -10.481 4.730 -11.773 1.00 0.00 H new ATOM 0 HG3 GLU A 226 -11.258 3.163 -11.869 1.00 0.00 H new ATOM 537 N LEU A 227 -9.684 5.978 -9.187 1.00 0.00 N ATOM 538 CA LEU A 227 -8.439 6.781 -9.330 1.00 0.00 C ATOM 539 C LEU A 227 -7.369 6.200 -8.407 1.00 0.00 C ATOM 540 O LEU A 227 -6.215 6.086 -8.771 1.00 0.00 O ATOM 541 CB LEU A 227 -8.723 8.236 -8.948 1.00 0.00 C ATOM 542 CG LEU A 227 -8.875 9.079 -10.216 1.00 0.00 C ATOM 543 CD1 LEU A 227 -10.097 8.609 -11.007 1.00 0.00 C ATOM 544 CD2 LEU A 227 -9.055 10.548 -9.828 1.00 0.00 C ATOM 0 H LEU A 227 -10.512 6.505 -8.909 1.00 0.00 H new ATOM 0 HA LEU A 227 -8.089 6.748 -10.362 1.00 0.00 H new ATOM 0 HB2 LEU A 227 -9.632 8.295 -8.349 1.00 0.00 H new ATOM 0 HB3 LEU A 227 -7.911 8.627 -8.335 1.00 0.00 H new ATOM 0 HG LEU A 227 -7.983 8.968 -10.833 1.00 0.00 H new ATOM 0 HD11 LEU A 227 -10.201 9.212 -11.909 1.00 0.00 H new ATOM 0 HD12 LEU A 227 -9.971 7.562 -11.283 1.00 0.00 H new ATOM 0 HD13 LEU A 227 -10.991 8.717 -10.393 1.00 0.00 H new ATOM 0 HD21 LEU A 227 -9.164 11.152 -10.729 1.00 0.00 H new ATOM 0 HD22 LEU A 227 -9.947 10.655 -9.210 1.00 0.00 H new ATOM 0 HD23 LEU A 227 -8.183 10.886 -9.268 1.00 0.00 H new ATOM 556 N LEU A 228 -7.749 5.804 -7.223 1.00 0.00 N ATOM 557 CA LEU A 228 -6.763 5.200 -6.289 1.00 0.00 C ATOM 558 C LEU A 228 -6.243 3.906 -6.909 1.00 0.00 C ATOM 559 O LEU A 228 -5.187 3.409 -6.567 1.00 0.00 O ATOM 560 CB LEU A 228 -7.437 4.902 -4.943 1.00 0.00 C ATOM 561 CG LEU A 228 -7.500 6.187 -4.105 1.00 0.00 C ATOM 562 CD1 LEU A 228 -8.686 7.041 -4.557 1.00 0.00 C ATOM 563 CD2 LEU A 228 -7.667 5.836 -2.624 1.00 0.00 C ATOM 0 H LEU A 228 -8.701 5.874 -6.864 1.00 0.00 H new ATOM 0 HA LEU A 228 -5.936 5.890 -6.118 1.00 0.00 H new ATOM 0 HB2 LEU A 228 -8.442 4.512 -5.106 1.00 0.00 H new ATOM 0 HB3 LEU A 228 -6.880 4.133 -4.408 1.00 0.00 H new ATOM 0 HG LEU A 228 -6.574 6.745 -4.243 1.00 0.00 H new ATOM 0 HD11 LEU A 228 -8.727 7.952 -3.960 1.00 0.00 H new ATOM 0 HD12 LEU A 228 -8.567 7.302 -5.609 1.00 0.00 H new ATOM 0 HD13 LEU A 228 -9.610 6.479 -4.425 1.00 0.00 H new ATOM 0 HD21 LEU A 228 -7.711 6.752 -2.036 1.00 0.00 H new ATOM 0 HD22 LEU A 228 -8.589 5.271 -2.486 1.00 0.00 H new ATOM 0 HD23 LEU A 228 -6.820 5.234 -2.295 1.00 0.00 H new ATOM 575 N LYS A 229 -7.001 3.353 -7.811 1.00 0.00 N ATOM 576 CA LYS A 229 -6.605 2.080 -8.465 1.00 0.00 C ATOM 577 C LYS A 229 -5.418 2.297 -9.414 1.00 0.00 C ATOM 578 O LYS A 229 -4.907 1.355 -9.986 1.00 0.00 O ATOM 579 CB LYS A 229 -7.795 1.539 -9.258 1.00 0.00 C ATOM 580 CG LYS A 229 -7.702 0.016 -9.346 1.00 0.00 C ATOM 581 CD LYS A 229 -7.932 -0.587 -7.956 1.00 0.00 C ATOM 582 CE LYS A 229 -8.919 -1.752 -8.061 1.00 0.00 C ATOM 583 NZ LYS A 229 -8.400 -2.761 -9.026 1.00 0.00 N ATOM 0 H LYS A 229 -7.892 3.736 -8.127 1.00 0.00 H new ATOM 0 HA LYS A 229 -6.305 1.368 -7.696 1.00 0.00 H new ATOM 0 HB2 LYS A 229 -8.728 1.829 -8.776 1.00 0.00 H new ATOM 0 HB3 LYS A 229 -7.805 1.971 -10.259 1.00 0.00 H new ATOM 0 HG2 LYS A 229 -8.444 -0.365 -10.048 1.00 0.00 H new ATOM 0 HG3 LYS A 229 -6.724 -0.279 -9.725 1.00 0.00 H new ATOM 0 HD2 LYS A 229 -6.987 -0.934 -7.538 1.00 0.00 H new ATOM 0 HD3 LYS A 229 -8.321 0.173 -7.278 1.00 0.00 H new ATOM 0 HE2 LYS A 229 -9.062 -2.210 -7.082 1.00 0.00 H new ATOM 0 HE3 LYS A 229 -9.893 -1.388 -8.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 229 -8.761 -3.703 -8.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 229 -8.716 -2.517 -9.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 229 -7.360 -2.769 -8.995 1.00 0.00 H new ATOM 597 N THR A 230 -4.983 3.517 -9.617 1.00 0.00 N ATOM 598 CA THR A 230 -3.840 3.725 -10.558 1.00 0.00 C ATOM 599 C THR A 230 -2.635 4.371 -9.848 1.00 0.00 C ATOM 600 O THR A 230 -1.505 4.146 -10.231 1.00 0.00 O ATOM 601 CB THR A 230 -4.302 4.579 -11.747 1.00 0.00 C ATOM 602 OG1 THR A 230 -3.524 4.254 -12.890 1.00 0.00 O ATOM 603 CG2 THR A 230 -4.148 6.065 -11.437 1.00 0.00 C ATOM 0 H THR A 230 -5.360 4.360 -9.183 1.00 0.00 H new ATOM 0 HA THR A 230 -3.511 2.753 -10.925 1.00 0.00 H new ATOM 0 HB THR A 230 -5.354 4.370 -11.939 1.00 0.00 H new ATOM 0 HG1 THR A 230 -3.818 4.797 -13.651 1.00 0.00 H new ATOM 0 HG21 THR A 230 -4.481 6.652 -12.293 1.00 0.00 H new ATOM 0 HG22 THR A 230 -4.752 6.319 -10.566 1.00 0.00 H new ATOM 0 HG23 THR A 230 -3.101 6.287 -11.230 1.00 0.00 H new ATOM 611 N LYS A 231 -2.847 5.146 -8.813 1.00 0.00 N ATOM 612 CA LYS A 231 -1.678 5.758 -8.097 1.00 0.00 C ATOM 613 C LYS A 231 -1.696 5.313 -6.632 1.00 0.00 C ATOM 614 O LYS A 231 -0.680 5.289 -5.968 1.00 0.00 O ATOM 615 CB LYS A 231 -1.726 7.293 -8.157 1.00 0.00 C ATOM 616 CG LYS A 231 -3.133 7.775 -8.487 1.00 0.00 C ATOM 617 CD LYS A 231 -4.072 7.409 -7.346 1.00 0.00 C ATOM 618 CE LYS A 231 -5.299 8.321 -7.394 1.00 0.00 C ATOM 619 NZ LYS A 231 -5.676 8.563 -8.813 1.00 0.00 N ATOM 0 H LYS A 231 -3.765 5.381 -8.435 1.00 0.00 H new ATOM 0 HA LYS A 231 -0.764 5.424 -8.587 1.00 0.00 H new ATOM 0 HB2 LYS A 231 -1.408 7.709 -7.201 1.00 0.00 H new ATOM 0 HB3 LYS A 231 -1.026 7.655 -8.910 1.00 0.00 H new ATOM 0 HG2 LYS A 231 -3.133 8.854 -8.641 1.00 0.00 H new ATOM 0 HG3 LYS A 231 -3.477 7.320 -9.416 1.00 0.00 H new ATOM 0 HD2 LYS A 231 -4.376 6.366 -7.429 1.00 0.00 H new ATOM 0 HD3 LYS A 231 -3.561 7.517 -6.389 1.00 0.00 H new ATOM 0 HE2 LYS A 231 -6.129 7.861 -6.858 1.00 0.00 H new ATOM 0 HE3 LYS A 231 -5.083 9.267 -6.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 231 -6.479 9.223 -8.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 231 -4.867 8.972 -9.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 231 -5.947 7.663 -9.259 1.00 0.00 H new ATOM 633 N CYS A 232 -2.847 4.961 -6.125 1.00 0.00 N ATOM 634 CA CYS A 232 -2.930 4.517 -4.702 1.00 0.00 C ATOM 635 C CYS A 232 -3.240 3.021 -4.649 1.00 0.00 C ATOM 636 O CYS A 232 -3.848 2.531 -3.719 1.00 0.00 O ATOM 637 CB CYS A 232 -4.031 5.300 -3.991 1.00 0.00 C ATOM 638 SG CYS A 232 -3.581 7.051 -3.940 1.00 0.00 S ATOM 0 H CYS A 232 -3.732 4.961 -6.633 1.00 0.00 H new ATOM 0 HA CYS A 232 -1.977 4.702 -4.205 1.00 0.00 H new ATOM 0 HB2 CYS A 232 -4.979 5.171 -4.513 1.00 0.00 H new ATOM 0 HB3 CYS A 232 -4.169 4.919 -2.979 1.00 0.00 H new ATOM 643 N GLN A 233 -2.823 2.296 -5.647 1.00 0.00 N ATOM 644 CA GLN A 233 -3.084 0.826 -5.672 1.00 0.00 C ATOM 645 C GLN A 233 -2.558 0.183 -4.389 1.00 0.00 C ATOM 646 O GLN A 233 -3.153 -0.731 -3.856 1.00 0.00 O ATOM 647 CB GLN A 233 -2.364 0.217 -6.875 1.00 0.00 C ATOM 648 CG GLN A 233 -2.947 0.810 -8.155 1.00 0.00 C ATOM 649 CD GLN A 233 -2.271 0.178 -9.372 1.00 0.00 C ATOM 650 OE1 GLN A 233 -2.030 -1.012 -9.400 1.00 0.00 O ATOM 651 NE2 GLN A 233 -1.951 0.935 -10.386 1.00 0.00 N ATOM 0 H GLN A 233 -2.310 2.657 -6.451 1.00 0.00 H new ATOM 0 HA GLN A 233 -4.157 0.647 -5.747 1.00 0.00 H new ATOM 0 HB2 GLN A 233 -1.295 0.422 -6.818 1.00 0.00 H new ATOM 0 HB3 GLN A 233 -2.481 -0.867 -6.875 1.00 0.00 H new ATOM 0 HG2 GLN A 233 -4.022 0.634 -8.192 1.00 0.00 H new ATOM 0 HG3 GLN A 233 -2.801 1.890 -8.166 1.00 0.00 H new ATOM 0 HE21 GLN A 233 -2.154 1.934 -10.361 1.00 0.00 H new ATOM 0 HE22 GLN A 233 -1.498 0.527 -11.204 1.00 0.00 H new ATOM 660 N ALA A 234 -1.453 0.649 -3.882 1.00 0.00 N ATOM 661 CA ALA A 234 -0.909 0.054 -2.636 1.00 0.00 C ATOM 662 C ALA A 234 -1.826 0.408 -1.468 1.00 0.00 C ATOM 663 O ALA A 234 -2.106 -0.408 -0.619 1.00 0.00 O ATOM 664 CB ALA A 234 0.494 0.599 -2.381 1.00 0.00 C ATOM 0 H ALA A 234 -0.906 1.414 -4.276 1.00 0.00 H new ATOM 0 HA ALA A 234 -0.856 -1.030 -2.737 1.00 0.00 H new ATOM 0 HB1 ALA A 234 0.893 0.162 -1.466 1.00 0.00 H new ATOM 0 HB2 ALA A 234 1.142 0.342 -3.219 1.00 0.00 H new ATOM 0 HB3 ALA A 234 0.450 1.683 -2.276 1.00 0.00 H new ATOM 670 N THR A 235 -2.308 1.615 -1.422 1.00 0.00 N ATOM 671 CA THR A 235 -3.212 2.001 -0.307 1.00 0.00 C ATOM 672 C THR A 235 -4.543 1.260 -0.453 1.00 0.00 C ATOM 673 O THR A 235 -5.234 1.008 0.514 1.00 0.00 O ATOM 674 CB THR A 235 -3.451 3.513 -0.347 1.00 0.00 C ATOM 675 OG1 THR A 235 -2.525 4.160 0.516 1.00 0.00 O ATOM 676 CG2 THR A 235 -4.880 3.825 0.099 1.00 0.00 C ATOM 0 H THR A 235 -2.117 2.348 -2.105 1.00 0.00 H new ATOM 0 HA THR A 235 -2.755 1.735 0.646 1.00 0.00 H new ATOM 0 HB THR A 235 -3.311 3.875 -1.366 1.00 0.00 H new ATOM 0 HG1 THR A 235 -1.654 3.714 0.455 1.00 0.00 H new ATOM 0 HG21 THR A 235 -5.044 4.902 0.068 1.00 0.00 H new ATOM 0 HG22 THR A 235 -5.586 3.332 -0.569 1.00 0.00 H new ATOM 0 HG23 THR A 235 -5.031 3.464 1.116 1.00 0.00 H new ATOM 684 N CYS A 236 -4.914 0.925 -1.659 1.00 0.00 N ATOM 685 CA CYS A 236 -6.208 0.217 -1.876 1.00 0.00 C ATOM 686 C CYS A 236 -5.979 -1.276 -2.123 1.00 0.00 C ATOM 687 O CYS A 236 -6.403 -2.118 -1.357 1.00 0.00 O ATOM 688 CB CYS A 236 -6.898 0.823 -3.101 1.00 0.00 C ATOM 689 SG CYS A 236 -8.428 -0.078 -3.460 1.00 0.00 S ATOM 0 H CYS A 236 -4.376 1.112 -2.505 1.00 0.00 H new ATOM 0 HA CYS A 236 -6.826 0.331 -0.986 1.00 0.00 H new ATOM 0 HB2 CYS A 236 -7.120 1.875 -2.920 1.00 0.00 H new ATOM 0 HB3 CYS A 236 -6.231 0.781 -3.962 1.00 0.00 H new ATOM 694 N LEU A 237 -5.343 -1.607 -3.211 1.00 0.00 N ATOM 695 CA LEU A 237 -5.117 -3.040 -3.548 1.00 0.00 C ATOM 696 C LEU A 237 -4.233 -3.737 -2.503 1.00 0.00 C ATOM 697 O LEU A 237 -4.400 -4.913 -2.243 1.00 0.00 O ATOM 698 CB LEU A 237 -4.468 -3.125 -4.929 1.00 0.00 C ATOM 699 CG LEU A 237 -5.375 -2.442 -5.951 1.00 0.00 C ATOM 700 CD1 LEU A 237 -4.697 -2.450 -7.322 1.00 0.00 C ATOM 701 CD2 LEU A 237 -6.695 -3.207 -6.037 1.00 0.00 C ATOM 0 H LEU A 237 -4.967 -0.942 -3.886 1.00 0.00 H new ATOM 0 HA LEU A 237 -6.079 -3.553 -3.551 1.00 0.00 H new ATOM 0 HB2 LEU A 237 -3.489 -2.645 -4.915 1.00 0.00 H new ATOM 0 HB3 LEU A 237 -4.308 -4.167 -5.206 1.00 0.00 H new ATOM 0 HG LEU A 237 -5.562 -1.413 -5.645 1.00 0.00 H new ATOM 0 HD11 LEU A 237 -5.344 -1.963 -8.051 1.00 0.00 H new ATOM 0 HD12 LEU A 237 -3.750 -1.914 -7.263 1.00 0.00 H new ATOM 0 HD13 LEU A 237 -4.513 -3.479 -7.631 1.00 0.00 H new ATOM 0 HD21 LEU A 237 -7.348 -2.725 -6.765 1.00 0.00 H new ATOM 0 HD22 LEU A 237 -6.501 -4.234 -6.347 1.00 0.00 H new ATOM 0 HD23 LEU A 237 -7.179 -3.208 -5.060 1.00 0.00 H new ATOM 713 N CYS A 238 -3.292 -3.051 -1.909 1.00 0.00 N ATOM 714 CA CYS A 238 -2.422 -3.735 -0.901 1.00 0.00 C ATOM 715 C CYS A 238 -2.312 -2.910 0.384 1.00 0.00 C ATOM 716 O CYS A 238 -1.554 -1.966 0.467 1.00 0.00 O ATOM 717 CB CYS A 238 -1.023 -3.930 -1.484 1.00 0.00 C ATOM 718 SG CYS A 238 0.209 -3.735 -0.171 1.00 0.00 S ATOM 0 H CYS A 238 -3.088 -2.065 -2.072 1.00 0.00 H new ATOM 0 HA CYS A 238 -2.873 -4.698 -0.662 1.00 0.00 H new ATOM 0 HB2 CYS A 238 -0.939 -4.920 -1.933 1.00 0.00 H new ATOM 0 HB3 CYS A 238 -0.843 -3.204 -2.277 1.00 0.00 H new ATOM 723 N GLU A 239 -3.040 -3.280 1.401 1.00 0.00 N ATOM 724 CA GLU A 239 -2.956 -2.539 2.687 1.00 0.00 C ATOM 725 C GLU A 239 -2.560 -3.521 3.787 1.00 0.00 C ATOM 726 O GLU A 239 -3.029 -4.641 3.828 1.00 0.00 O ATOM 727 CB GLU A 239 -4.314 -1.916 3.020 1.00 0.00 C ATOM 728 CG GLU A 239 -4.173 -1.024 4.256 1.00 0.00 C ATOM 729 CD GLU A 239 -5.547 -0.498 4.671 1.00 0.00 C ATOM 730 OE1 GLU A 239 -5.609 0.238 5.641 1.00 0.00 O ATOM 731 OE2 GLU A 239 -6.516 -0.840 4.011 1.00 0.00 O ATOM 0 H GLU A 239 -3.690 -4.066 1.395 1.00 0.00 H new ATOM 0 HA GLU A 239 -2.215 -1.744 2.608 1.00 0.00 H new ATOM 0 HB2 GLU A 239 -4.675 -1.331 2.174 1.00 0.00 H new ATOM 0 HB3 GLU A 239 -5.050 -2.698 3.204 1.00 0.00 H new ATOM 0 HG2 GLU A 239 -3.726 -1.588 5.075 1.00 0.00 H new ATOM 0 HG3 GLU A 239 -3.504 -0.191 4.041 1.00 0.00 H new ATOM 739 N ASP A 240 -1.703 -3.118 4.679 1.00 0.00 N ATOM 740 CA ASP A 240 -1.287 -4.041 5.769 1.00 0.00 C ATOM 741 C ASP A 240 -2.536 -4.541 6.494 1.00 0.00 C ATOM 742 O ASP A 240 -2.481 -5.455 7.291 1.00 0.00 O ATOM 743 CB ASP A 240 -0.378 -3.301 6.754 1.00 0.00 C ATOM 744 CG ASP A 240 0.935 -2.936 6.060 1.00 0.00 C ATOM 745 OD1 ASP A 240 1.693 -2.171 6.633 1.00 0.00 O ATOM 746 OD2 ASP A 240 1.159 -3.425 4.966 1.00 0.00 O ATOM 0 H ASP A 240 -1.273 -2.193 4.702 1.00 0.00 H new ATOM 0 HA ASP A 240 -0.740 -4.886 5.350 1.00 0.00 H new ATOM 0 HB2 ASP A 240 -0.873 -2.400 7.116 1.00 0.00 H new ATOM 0 HB3 ASP A 240 -0.180 -3.927 7.624 1.00 0.00 H new ATOM 752 N LYS A 241 -3.659 -3.934 6.223 1.00 0.00 N ATOM 753 CA LYS A 241 -4.927 -4.347 6.886 1.00 0.00 C ATOM 754 C LYS A 241 -4.873 -3.922 8.351 1.00 0.00 C ATOM 755 O LYS A 241 -4.717 -4.733 9.241 1.00 0.00 O ATOM 756 CB LYS A 241 -5.105 -5.865 6.794 1.00 0.00 C ATOM 757 CG LYS A 241 -6.556 -6.222 7.127 1.00 0.00 C ATOM 758 CD LYS A 241 -6.735 -7.739 7.078 1.00 0.00 C ATOM 759 CE LYS A 241 -8.217 -8.087 7.241 1.00 0.00 C ATOM 760 NZ LYS A 241 -8.440 -8.690 8.585 1.00 0.00 N ATOM 0 H LYS A 241 -3.752 -3.162 5.563 1.00 0.00 H new ATOM 0 HA LYS A 241 -5.771 -3.870 6.388 1.00 0.00 H new ATOM 0 HB2 LYS A 241 -4.853 -6.213 5.792 1.00 0.00 H new ATOM 0 HB3 LYS A 241 -4.427 -6.365 7.485 1.00 0.00 H new ATOM 0 HG2 LYS A 241 -6.815 -5.847 8.117 1.00 0.00 H new ATOM 0 HG3 LYS A 241 -7.231 -5.743 6.418 1.00 0.00 H new ATOM 0 HD2 LYS A 241 -6.362 -8.129 6.131 1.00 0.00 H new ATOM 0 HD3 LYS A 241 -6.151 -8.210 7.869 1.00 0.00 H new ATOM 0 HE2 LYS A 241 -8.827 -7.191 7.127 1.00 0.00 H new ATOM 0 HE3 LYS A 241 -8.526 -8.784 6.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 241 -9.447 -8.927 8.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 241 -7.869 -9.554 8.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 241 -8.161 -8.011 9.321 1.00 0.00 H new ATOM 774 N ILE A 242 -4.990 -2.646 8.606 1.00 0.00 N ATOM 775 CA ILE A 242 -4.934 -2.159 10.009 1.00 0.00 C ATOM 776 C ILE A 242 -6.175 -2.634 10.765 1.00 0.00 C ATOM 777 O ILE A 242 -7.278 -2.595 10.256 1.00 0.00 O ATOM 778 CB ILE A 242 -4.891 -0.628 10.013 1.00 0.00 C ATOM 779 CG1 ILE A 242 -3.682 -0.148 9.205 1.00 0.00 C ATOM 780 CG2 ILE A 242 -4.774 -0.123 11.454 1.00 0.00 C ATOM 781 CD1 ILE A 242 -3.725 1.376 9.076 1.00 0.00 C ATOM 0 H ILE A 242 -5.122 -1.921 7.900 1.00 0.00 H new ATOM 0 HA ILE A 242 -4.041 -2.552 10.495 1.00 0.00 H new ATOM 0 HB ILE A 242 -5.805 -0.239 9.565 1.00 0.00 H new ATOM 0 HG12 ILE A 242 -2.758 -0.456 9.695 1.00 0.00 H new ATOM 0 HG13 ILE A 242 -3.687 -0.607 8.216 1.00 0.00 H new ATOM 0 HG21 ILE A 242 -4.743 0.967 11.456 1.00 0.00 H new ATOM 0 HG22 ILE A 242 -5.635 -0.463 12.030 1.00 0.00 H new ATOM 0 HG23 ILE A 242 -3.860 -0.513 11.903 1.00 0.00 H new ATOM 0 HD11 ILE A 242 -2.864 1.717 8.501 1.00 0.00 H new ATOM 0 HD12 ILE A 242 -4.642 1.672 8.567 1.00 0.00 H new ATOM 0 HD13 ILE A 242 -3.699 1.826 10.068 1.00 0.00 H new ATOM 793 N HIS A 243 -6.004 -3.086 11.976 1.00 0.00 N ATOM 794 CA HIS A 243 -7.171 -3.567 12.767 1.00 0.00 C ATOM 795 C HIS A 243 -7.611 -2.476 13.745 1.00 0.00 C ATOM 796 O HIS A 243 -7.027 -1.395 13.780 1.00 0.00 O ATOM 797 CB HIS A 243 -6.776 -4.823 13.544 1.00 0.00 C ATOM 798 CG HIS A 243 -7.954 -5.315 14.336 1.00 0.00 C ATOM 799 ND1 HIS A 243 -8.150 -4.970 15.668 1.00 0.00 N ATOM 800 CD2 HIS A 243 -9.009 -6.127 14.000 1.00 0.00 C ATOM 801 CE1 HIS A 243 -9.283 -5.569 16.079 1.00 0.00 C ATOM 802 NE2 HIS A 243 -9.842 -6.284 15.100 1.00 0.00 N ATOM 0 H HIS A 243 -5.104 -3.143 12.453 1.00 0.00 H new ATOM 0 HA HIS A 243 -7.995 -3.801 12.093 1.00 0.00 H new ATOM 0 HB2 HIS A 243 -6.438 -5.598 12.856 1.00 0.00 H new ATOM 0 HB3 HIS A 243 -5.942 -4.603 14.211 1.00 0.00 H new ATOM 0 HD2 HIS A 243 -9.167 -6.575 13.030 1.00 0.00 H new ATOM 0 HE1 HIS A 243 -9.689 -5.482 17.076 1.00 0.00 H new ATOM 0 HE2 HIS A 243 -10.701 -6.831 15.150 1.00 0.00 H new TER 811 HIS A 243