USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 559 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 267 GLN : amide:sc= 0.222 X(o=0.21,f=-0.23) USER MOD Set 1.2: A 296 THR OG1 : rot 180:sc= -0.0125 USER MOD Set 2.1: A 250 THR OG1 : rot 180:sc= 1 USER MOD Set 2.2: A 310 THR OG1 : rot -113:sc= 0.698 USER MOD Set 3.1: A 248 THR OG1 : rot 180:sc= 0.402 USER MOD Set 3.2: A 312 THR OG1 : rot -118:sc= 0.545 USER MOD Single : A 227 THR OG1 : rot 180:sc= 0 USER MOD Single : A 229 THR OG1 : rot 180:sc= 0 USER MOD Single : A 231 LYS NZ :NH3+ -178:sc= -0.0365 (180deg=-0.0435) USER MOD Single : A 232 THR OG1 : rot -70:sc= 1.33 USER MOD Single : A 233 GLN :FLIP amide:sc= -0.0489 F(o=-2.1!,f=-0.049) USER MOD Single : A 235 THR OG1 : rot 180:sc= -0.42 USER MOD Single : A 237 THR OG1 : rot 180:sc= 0.00517 USER MOD Single : A 238 TYR OH : rot 30:sc= 0 USER MOD Single : A 239 ASN : amide:sc= -1.6 K(o=-1.6,f=-7.3!) USER MOD Single : A 242 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 244 SER OG : rot 180:sc= 0 USER MOD Single : A 245 TYR OH : rot 180:sc= 0 USER MOD Single : A 246 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 252 THR OG1 : rot 180:sc= -0.12 USER MOD Single : A 255 THR OG1 : rot 180:sc= 0.1 USER MOD Single : A 257 SER OG : rot 180:sc= 0 USER MOD Single : A 259 THR OG1 : rot 180:sc= 0 USER MOD Single : A 263 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 269 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0432) USER MOD Single : A 271 THR OG1 : rot -62:sc= -1.69! USER MOD Single : A 272 ASN : amide:sc= 0.274 K(o=0.27,f=-0.36) USER MOD Single : A 292 SER OG : rot 23:sc= 0.19 USER MOD Single : A 294 THR OG1 : rot -4:sc= 1.21 USER MOD Single : A 298 THR OG1 : rot -100:sc= 0.00103 USER MOD Single : A 302 ASN : amide:sc= -0.111 X(o=-0.11,f=-0.11) USER MOD Single : A 303 SER OG : rot -64:sc= 1.33 USER MOD Single : A 305 SER OG : rot 180:sc= 0 USER MOD Single : A 314 SER OG : rot 180:sc= 0 USER MOD Single : A 340 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 47 N GLY A 226 13.026 -4.143 -9.094 1.00 0.00 N ATOM 48 CA GLY A 226 12.913 -4.131 -7.651 1.00 0.00 C ATOM 49 C GLY A 226 11.660 -4.829 -7.174 1.00 0.00 C ATOM 50 O GLY A 226 10.544 -4.388 -7.457 1.00 0.00 O ATOM 0 HA2 GLY A 226 13.786 -4.616 -7.215 1.00 0.00 H new ATOM 0 HA3 GLY A 226 12.911 -3.100 -7.296 1.00 0.00 H new ATOM 54 N THR A 227 11.845 -5.923 -6.459 1.00 0.00 N ATOM 55 CA THR A 227 10.732 -6.709 -5.963 1.00 0.00 C ATOM 56 C THR A 227 10.768 -6.759 -4.446 1.00 0.00 C ATOM 57 O THR A 227 11.821 -6.980 -3.842 1.00 0.00 O ATOM 58 CB THR A 227 10.773 -8.136 -6.534 1.00 0.00 C ATOM 59 OG1 THR A 227 10.894 -8.075 -7.963 1.00 0.00 O ATOM 60 CG2 THR A 227 9.521 -8.920 -6.161 1.00 0.00 C ATOM 0 H THR A 227 12.763 -6.289 -6.208 1.00 0.00 H new ATOM 0 HA THR A 227 9.806 -6.234 -6.287 1.00 0.00 H new ATOM 0 HB THR A 227 11.634 -8.650 -6.107 1.00 0.00 H new ATOM 0 HG1 THR A 227 10.922 -8.984 -8.328 1.00 0.00 H new ATOM 0 HG21 THR A 227 9.582 -9.924 -6.580 1.00 0.00 H new ATOM 0 HG22 THR A 227 9.442 -8.984 -5.076 1.00 0.00 H new ATOM 0 HG23 THR A 227 8.642 -8.413 -6.560 1.00 0.00 H new ATOM 68 N LEU A 228 9.617 -6.544 -3.841 1.00 0.00 N ATOM 69 CA LEU A 228 9.517 -6.434 -2.406 1.00 0.00 C ATOM 70 C LEU A 228 8.262 -7.133 -1.910 1.00 0.00 C ATOM 71 O LEU A 228 7.415 -7.556 -2.697 1.00 0.00 O ATOM 72 CB LEU A 228 9.491 -4.957 -2.017 1.00 0.00 C ATOM 73 CG LEU A 228 10.825 -4.194 -2.224 1.00 0.00 C ATOM 74 CD1 LEU A 228 10.561 -2.728 -2.545 1.00 0.00 C ATOM 75 CD2 LEU A 228 11.723 -4.292 -1.001 1.00 0.00 C ATOM 0 H LEU A 228 8.729 -6.441 -4.332 1.00 0.00 H new ATOM 0 HA LEU A 228 10.380 -6.914 -1.945 1.00 0.00 H new ATOM 0 HB2 LEU A 228 8.713 -4.459 -2.596 1.00 0.00 H new ATOM 0 HB3 LEU A 228 9.206 -4.879 -0.968 1.00 0.00 H new ATOM 0 HG LEU A 228 11.337 -4.663 -3.064 1.00 0.00 H new ATOM 0 HD11 LEU A 228 11.510 -2.210 -2.687 1.00 0.00 H new ATOM 0 HD12 LEU A 228 9.969 -2.656 -3.457 1.00 0.00 H new ATOM 0 HD13 LEU A 228 10.016 -2.268 -1.721 1.00 0.00 H new ATOM 0 HD21 LEU A 228 12.648 -3.745 -1.184 1.00 0.00 H new ATOM 0 HD22 LEU A 228 11.212 -3.863 -0.139 1.00 0.00 H new ATOM 0 HD23 LEU A 228 11.954 -5.339 -0.802 1.00 0.00 H new ATOM 87 N THR A 229 8.154 -7.245 -0.608 1.00 0.00 N ATOM 88 CA THR A 229 7.050 -7.928 0.030 1.00 0.00 C ATOM 89 C THR A 229 6.576 -7.097 1.225 1.00 0.00 C ATOM 90 O THR A 229 7.260 -6.165 1.636 1.00 0.00 O ATOM 91 CB THR A 229 7.525 -9.323 0.483 1.00 0.00 C ATOM 92 OG1 THR A 229 8.047 -10.046 -0.642 1.00 0.00 O ATOM 93 CG2 THR A 229 6.419 -10.146 1.136 1.00 0.00 C ATOM 0 H THR A 229 8.836 -6.861 0.047 1.00 0.00 H new ATOM 0 HA THR A 229 6.217 -8.049 -0.663 1.00 0.00 H new ATOM 0 HB THR A 229 8.299 -9.163 1.234 1.00 0.00 H new ATOM 0 HG1 THR A 229 8.349 -10.931 -0.350 1.00 0.00 H new ATOM 0 HG21 THR A 229 6.815 -11.117 1.433 1.00 0.00 H new ATOM 0 HG22 THR A 229 6.046 -9.622 2.016 1.00 0.00 H new ATOM 0 HG23 THR A 229 5.604 -10.288 0.426 1.00 0.00 H new ATOM 101 N VAL A 230 5.409 -7.401 1.763 1.00 0.00 N ATOM 102 CA VAL A 230 4.910 -6.708 2.942 1.00 0.00 C ATOM 103 C VAL A 230 4.756 -7.683 4.102 1.00 0.00 C ATOM 104 O VAL A 230 4.204 -8.773 3.942 1.00 0.00 O ATOM 105 CB VAL A 230 3.570 -5.992 2.660 1.00 0.00 C ATOM 106 CG1 VAL A 230 2.963 -5.444 3.947 1.00 0.00 C ATOM 107 CG2 VAL A 230 3.785 -4.858 1.667 1.00 0.00 C ATOM 0 H VAL A 230 4.786 -8.124 1.403 1.00 0.00 H new ATOM 0 HA VAL A 230 5.641 -5.945 3.212 1.00 0.00 H new ATOM 0 HB VAL A 230 2.878 -6.719 2.235 1.00 0.00 H new ATOM 0 HG11 VAL A 230 2.021 -4.945 3.721 1.00 0.00 H new ATOM 0 HG12 VAL A 230 2.782 -6.264 4.642 1.00 0.00 H new ATOM 0 HG13 VAL A 230 3.652 -4.731 4.399 1.00 0.00 H new ATOM 0 HG21 VAL A 230 2.836 -4.359 1.474 1.00 0.00 H new ATOM 0 HG22 VAL A 230 4.494 -4.141 2.081 1.00 0.00 H new ATOM 0 HG23 VAL A 230 4.179 -5.261 0.734 1.00 0.00 H new ATOM 117 N LYS A 231 5.263 -7.291 5.263 1.00 0.00 N ATOM 118 CA LYS A 231 5.239 -8.151 6.437 1.00 0.00 C ATOM 119 C LYS A 231 4.467 -7.474 7.578 1.00 0.00 C ATOM 120 O LYS A 231 4.488 -7.922 8.722 1.00 0.00 O ATOM 121 CB LYS A 231 6.682 -8.488 6.848 1.00 0.00 C ATOM 122 CG LYS A 231 6.802 -9.550 7.931 1.00 0.00 C ATOM 123 CD LYS A 231 8.242 -10.014 8.108 1.00 0.00 C ATOM 124 CE LYS A 231 8.675 -10.952 6.989 1.00 0.00 C ATOM 125 NZ LYS A 231 10.112 -11.329 7.103 1.00 0.00 N1+ ATOM 0 H LYS A 231 5.697 -6.381 5.417 1.00 0.00 H new ATOM 0 HA LYS A 231 4.722 -9.082 6.203 1.00 0.00 H new ATOM 0 HB2 LYS A 231 7.228 -8.824 5.966 1.00 0.00 H new ATOM 0 HB3 LYS A 231 7.169 -7.577 7.196 1.00 0.00 H new ATOM 0 HG2 LYS A 231 6.430 -9.151 8.875 1.00 0.00 H new ATOM 0 HG3 LYS A 231 6.174 -10.403 7.675 1.00 0.00 H new ATOM 0 HD2 LYS A 231 8.903 -9.147 8.132 1.00 0.00 H new ATOM 0 HD3 LYS A 231 8.345 -10.521 9.068 1.00 0.00 H new ATOM 0 HE2 LYS A 231 8.061 -11.852 7.012 1.00 0.00 H new ATOM 0 HE3 LYS A 231 8.501 -10.472 6.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 231 10.375 -11.940 6.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 231 10.698 -10.470 7.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 231 10.267 -11.840 7.995 1.00 0.00 H new ATOM 139 N THR A 232 3.770 -6.394 7.245 1.00 0.00 N ATOM 140 CA THR A 232 2.968 -5.659 8.216 1.00 0.00 C ATOM 141 C THR A 232 1.644 -5.230 7.593 1.00 0.00 C ATOM 142 O THR A 232 1.304 -5.663 6.497 1.00 0.00 O ATOM 143 CB THR A 232 3.714 -4.417 8.731 1.00 0.00 C ATOM 144 OG1 THR A 232 4.345 -3.752 7.635 1.00 0.00 O ATOM 145 CG2 THR A 232 4.748 -4.789 9.783 1.00 0.00 C ATOM 0 H THR A 232 3.744 -6.005 6.302 1.00 0.00 H new ATOM 0 HA THR A 232 2.778 -6.325 9.058 1.00 0.00 H new ATOM 0 HB THR A 232 2.990 -3.749 9.198 1.00 0.00 H new ATOM 0 HG1 THR A 232 5.087 -4.300 7.304 1.00 0.00 H new ATOM 0 HG21 THR A 232 5.258 -3.889 10.126 1.00 0.00 H new ATOM 0 HG22 THR A 232 4.252 -5.270 10.626 1.00 0.00 H new ATOM 0 HG23 THR A 232 5.476 -5.476 9.351 1.00 0.00 H new ATOM 153 N GLN A 233 0.901 -4.390 8.296 1.00 0.00 N ATOM 154 CA GLN A 233 -0.409 -3.953 7.835 1.00 0.00 C ATOM 155 C GLN A 233 -0.385 -2.456 7.548 1.00 0.00 C ATOM 156 O GLN A 233 -0.260 -1.648 8.469 1.00 0.00 O ATOM 157 CB GLN A 233 -1.465 -4.276 8.889 1.00 0.00 C ATOM 158 CG GLN A 233 -1.387 -5.703 9.406 1.00 0.00 C ATOM 159 CD GLN A 233 -2.389 -5.987 10.504 1.00 0.00 C ATOM 160 OE1 GLN A 233 -3.591 -6.389 10.124 1.00 0.00 O flip ATOM 161 NE2 GLN A 233 -2.092 -5.827 11.688 1.00 0.00 N flip ATOM 0 H GLN A 233 1.184 -3.995 9.193 1.00 0.00 H new ATOM 0 HA GLN A 233 -0.660 -4.481 6.915 1.00 0.00 H new ATOM 0 HB2 GLN A 233 -1.354 -3.588 9.727 1.00 0.00 H new ATOM 0 HB3 GLN A 233 -2.455 -4.105 8.465 1.00 0.00 H new ATOM 0 HG2 GLN A 233 -1.556 -6.393 8.580 1.00 0.00 H new ATOM 0 HG3 GLN A 233 -0.381 -5.894 9.780 1.00 0.00 H new ATOM 0 HE21 GLN A 233 -1.154 -5.516 11.941 1.00 0.00 H new ATOM 0 HE22 GLN A 233 -2.784 -6.006 12.416 1.00 0.00 H new ATOM 170 N PRO A 234 -0.489 -2.066 6.274 1.00 0.00 N ATOM 171 CA PRO A 234 -0.402 -0.661 5.875 1.00 0.00 C ATOM 172 C PRO A 234 -1.632 0.151 6.274 1.00 0.00 C ATOM 173 O PRO A 234 -2.695 0.032 5.668 1.00 0.00 O ATOM 174 CB PRO A 234 -0.273 -0.733 4.352 1.00 0.00 C ATOM 175 CG PRO A 234 -0.905 -2.027 3.966 1.00 0.00 C ATOM 176 CD PRO A 234 -0.695 -2.966 5.122 1.00 0.00 C ATOM 0 HA PRO A 234 0.429 -0.155 6.366 1.00 0.00 H new ATOM 0 HB2 PRO A 234 -0.775 0.108 3.874 1.00 0.00 H new ATOM 0 HB3 PRO A 234 0.772 -0.698 4.043 1.00 0.00 H new ATOM 0 HG2 PRO A 234 -1.967 -1.894 3.762 1.00 0.00 H new ATOM 0 HG3 PRO A 234 -0.453 -2.424 3.057 1.00 0.00 H new ATOM 0 HD2 PRO A 234 -1.557 -3.616 5.271 1.00 0.00 H new ATOM 0 HD3 PRO A 234 0.167 -3.613 4.960 1.00 0.00 H new ATOM 184 N THR A 235 -1.478 0.981 7.300 1.00 0.00 N ATOM 185 CA THR A 235 -2.571 1.829 7.758 1.00 0.00 C ATOM 186 C THR A 235 -2.066 3.072 8.497 1.00 0.00 C ATOM 187 O THR A 235 -1.203 2.979 9.371 1.00 0.00 O ATOM 188 CB THR A 235 -3.544 1.041 8.666 1.00 0.00 C ATOM 189 OG1 THR A 235 -4.543 1.920 9.198 1.00 0.00 O ATOM 190 CG2 THR A 235 -2.804 0.352 9.813 1.00 0.00 C ATOM 0 H THR A 235 -0.611 1.084 7.828 1.00 0.00 H new ATOM 0 HA THR A 235 -3.103 2.160 6.866 1.00 0.00 H new ATOM 0 HB THR A 235 -4.019 0.273 8.056 1.00 0.00 H new ATOM 0 HG1 THR A 235 -5.155 1.411 9.770 1.00 0.00 H new ATOM 0 HG21 THR A 235 -3.518 -0.193 10.431 1.00 0.00 H new ATOM 0 HG22 THR A 235 -2.071 -0.344 9.407 1.00 0.00 H new ATOM 0 HG23 THR A 235 -2.296 1.101 10.420 1.00 0.00 H new ATOM 198 N VAL A 236 -2.589 4.231 8.105 1.00 0.00 N ATOM 199 CA VAL A 236 -2.360 5.493 8.806 1.00 0.00 C ATOM 200 C VAL A 236 -3.535 6.444 8.522 1.00 0.00 C ATOM 201 O VAL A 236 -4.399 6.104 7.724 1.00 0.00 O ATOM 202 CB VAL A 236 -0.956 6.109 8.454 1.00 0.00 C ATOM 203 CG1 VAL A 236 -0.972 7.615 8.232 1.00 0.00 C ATOM 204 CG2 VAL A 236 0.027 5.790 9.563 1.00 0.00 C ATOM 0 H VAL A 236 -3.189 4.322 7.285 1.00 0.00 H new ATOM 0 HA VAL A 236 -2.326 5.316 9.881 1.00 0.00 H new ATOM 0 HB VAL A 236 -0.659 5.657 7.508 1.00 0.00 H new ATOM 0 HG11 VAL A 236 0.035 7.958 7.994 1.00 0.00 H new ATOM 0 HG12 VAL A 236 -1.641 7.854 7.406 1.00 0.00 H new ATOM 0 HG13 VAL A 236 -1.321 8.112 9.137 1.00 0.00 H new ATOM 0 HG21 VAL A 236 1.000 6.216 9.320 1.00 0.00 H new ATOM 0 HG22 VAL A 236 -0.332 6.215 10.500 1.00 0.00 H new ATOM 0 HG23 VAL A 236 0.120 4.709 9.667 1.00 0.00 H new ATOM 214 N THR A 237 -3.566 7.580 9.222 1.00 0.00 N ATOM 215 CA THR A 237 -4.599 8.620 9.125 1.00 0.00 C ATOM 216 C THR A 237 -5.545 8.478 7.924 1.00 0.00 C ATOM 217 O THR A 237 -5.134 8.611 6.769 1.00 0.00 O ATOM 218 CB THR A 237 -3.912 9.997 9.056 1.00 0.00 C ATOM 219 OG1 THR A 237 -3.018 10.148 10.170 1.00 0.00 O ATOM 220 CG2 THR A 237 -4.931 11.127 9.063 1.00 0.00 C ATOM 0 H THR A 237 -2.842 7.813 9.902 1.00 0.00 H new ATOM 0 HA THR A 237 -5.221 8.511 10.013 1.00 0.00 H new ATOM 0 HB THR A 237 -3.353 10.049 8.122 1.00 0.00 H new ATOM 0 HG1 THR A 237 -2.581 11.024 10.123 1.00 0.00 H new ATOM 0 HG21 THR A 237 -4.413 12.085 9.013 1.00 0.00 H new ATOM 0 HG22 THR A 237 -5.591 11.027 8.202 1.00 0.00 H new ATOM 0 HG23 THR A 237 -5.520 11.080 9.979 1.00 0.00 H new ATOM 228 N TYR A 238 -6.814 8.198 8.218 1.00 0.00 N ATOM 229 CA TYR A 238 -7.858 8.163 7.204 1.00 0.00 C ATOM 230 C TYR A 238 -8.871 9.271 7.483 1.00 0.00 C ATOM 231 O TYR A 238 -9.903 9.040 8.117 1.00 0.00 O ATOM 232 CB TYR A 238 -8.590 6.797 7.193 1.00 0.00 C ATOM 233 CG TYR A 238 -7.753 5.631 6.732 1.00 0.00 C ATOM 234 CD1 TYR A 238 -7.633 5.342 5.385 1.00 0.00 C ATOM 235 CD2 TYR A 238 -7.109 4.807 7.641 1.00 0.00 C ATOM 236 CE1 TYR A 238 -6.895 4.267 4.947 1.00 0.00 C ATOM 237 CE2 TYR A 238 -6.360 3.728 7.214 1.00 0.00 C ATOM 238 CZ TYR A 238 -6.256 3.462 5.866 1.00 0.00 C ATOM 239 OH TYR A 238 -5.515 2.384 5.437 1.00 0.00 O ATOM 0 H TYR A 238 -7.142 7.991 9.161 1.00 0.00 H new ATOM 0 HA TYR A 238 -7.391 8.310 6.230 1.00 0.00 H new ATOM 0 HB2 TYR A 238 -8.954 6.589 8.199 1.00 0.00 H new ATOM 0 HB3 TYR A 238 -9.465 6.875 6.547 1.00 0.00 H new ATOM 0 HD1 TYR A 238 -8.129 5.973 4.662 1.00 0.00 H new ATOM 0 HD2 TYR A 238 -7.194 5.011 8.698 1.00 0.00 H new ATOM 0 HE1 TYR A 238 -6.817 4.055 3.891 1.00 0.00 H new ATOM 0 HE2 TYR A 238 -5.859 3.096 7.932 1.00 0.00 H new ATOM 0 HH TYR A 238 -5.145 2.574 4.550 1.00 0.00 H new ATOM 249 N ASN A 239 -8.571 10.471 7.020 1.00 0.00 N ATOM 250 CA ASN A 239 -9.445 11.619 7.222 1.00 0.00 C ATOM 251 C ASN A 239 -9.812 12.209 5.868 1.00 0.00 C ATOM 252 O ASN A 239 -8.952 12.416 5.027 1.00 0.00 O ATOM 253 CB ASN A 239 -8.744 12.662 8.100 1.00 0.00 C ATOM 254 CG ASN A 239 -9.651 13.806 8.530 1.00 0.00 C ATOM 255 OD1 ASN A 239 -10.579 14.198 7.819 1.00 0.00 O ATOM 256 ND2 ASN A 239 -9.377 14.360 9.698 1.00 0.00 N ATOM 0 H ASN A 239 -7.721 10.680 6.496 1.00 0.00 H new ATOM 0 HA ASN A 239 -10.357 11.306 7.731 1.00 0.00 H new ATOM 0 HB2 ASN A 239 -8.348 12.170 8.988 1.00 0.00 H new ATOM 0 HB3 ASN A 239 -7.892 13.070 7.555 1.00 0.00 H new ATOM 0 HD21 ASN A 239 -9.941 15.139 10.038 1.00 0.00 H new ATOM 0 HD22 ASN A 239 -8.601 14.009 10.259 1.00 0.00 H new ATOM 263 N ALA A 240 -11.081 12.489 5.664 1.00 0.00 N ATOM 264 CA ALA A 240 -11.567 12.861 4.341 1.00 0.00 C ATOM 265 C ALA A 240 -11.876 14.347 4.248 1.00 0.00 C ATOM 266 O ALA A 240 -11.695 14.960 3.197 1.00 0.00 O ATOM 267 CB ALA A 240 -12.784 12.038 3.977 1.00 0.00 C ATOM 0 H ALA A 240 -11.797 12.468 6.390 1.00 0.00 H new ATOM 0 HA ALA A 240 -10.772 12.651 3.626 1.00 0.00 H new ATOM 0 HB1 ALA A 240 -13.136 12.327 2.987 1.00 0.00 H new ATOM 0 HB2 ALA A 240 -12.520 10.980 3.974 1.00 0.00 H new ATOM 0 HB3 ALA A 240 -13.574 12.213 4.708 1.00 0.00 H new ATOM 273 N VAL A 241 -12.336 14.928 5.348 1.00 0.00 N ATOM 274 CA VAL A 241 -12.580 16.361 5.410 1.00 0.00 C ATOM 275 C VAL A 241 -11.264 17.109 5.240 1.00 0.00 C ATOM 276 O VAL A 241 -11.220 18.228 4.730 1.00 0.00 O ATOM 277 CB VAL A 241 -13.225 16.753 6.761 1.00 0.00 C ATOM 278 CG1 VAL A 241 -13.559 18.243 6.811 1.00 0.00 C ATOM 279 CG2 VAL A 241 -14.469 15.913 7.023 1.00 0.00 C ATOM 0 H VAL A 241 -12.548 14.427 6.211 1.00 0.00 H new ATOM 0 HA VAL A 241 -13.267 16.630 4.607 1.00 0.00 H new ATOM 0 HB VAL A 241 -12.497 16.552 7.547 1.00 0.00 H new ATOM 0 HG11 VAL A 241 -14.010 18.483 7.774 1.00 0.00 H new ATOM 0 HG12 VAL A 241 -12.646 18.825 6.683 1.00 0.00 H new ATOM 0 HG13 VAL A 241 -14.259 18.486 6.012 1.00 0.00 H new ATOM 0 HG21 VAL A 241 -14.909 16.202 7.977 1.00 0.00 H new ATOM 0 HG22 VAL A 241 -15.193 16.076 6.225 1.00 0.00 H new ATOM 0 HG23 VAL A 241 -14.196 14.858 7.055 1.00 0.00 H new ATOM 289 N LYS A 242 -10.191 16.460 5.660 1.00 0.00 N ATOM 290 CA LYS A 242 -8.855 17.032 5.580 1.00 0.00 C ATOM 291 C LYS A 242 -8.115 16.518 4.363 1.00 0.00 C ATOM 292 O LYS A 242 -7.032 16.993 4.021 1.00 0.00 O ATOM 293 CB LYS A 242 -8.086 16.669 6.835 1.00 0.00 C ATOM 294 CG LYS A 242 -8.773 17.132 8.100 1.00 0.00 C ATOM 295 CD LYS A 242 -8.319 18.519 8.504 1.00 0.00 C ATOM 296 CE LYS A 242 -8.868 19.608 7.595 1.00 0.00 C ATOM 297 NZ LYS A 242 -8.577 20.965 8.122 1.00 0.00 N1+ ATOM 0 H LYS A 242 -10.220 15.524 6.065 1.00 0.00 H new ATOM 0 HA LYS A 242 -8.942 18.115 5.492 1.00 0.00 H new ATOM 0 HB2 LYS A 242 -7.954 15.588 6.874 1.00 0.00 H new ATOM 0 HB3 LYS A 242 -7.091 17.110 6.786 1.00 0.00 H new ATOM 0 HG2 LYS A 242 -9.853 17.131 7.950 1.00 0.00 H new ATOM 0 HG3 LYS A 242 -8.563 16.430 8.907 1.00 0.00 H new ATOM 0 HD2 LYS A 242 -8.634 18.715 9.529 1.00 0.00 H new ATOM 0 HD3 LYS A 242 -7.230 18.557 8.492 1.00 0.00 H new ATOM 0 HE2 LYS A 242 -8.435 19.504 6.600 1.00 0.00 H new ATOM 0 HE3 LYS A 242 -9.946 19.483 7.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 242 -8.967 21.680 7.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 242 -9.012 21.074 9.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 242 -7.548 21.094 8.200 1.00 0.00 H new ATOM 311 N ASP A 243 -8.730 15.534 3.737 1.00 0.00 N ATOM 312 CA ASP A 243 -8.170 14.853 2.566 1.00 0.00 C ATOM 313 C ASP A 243 -6.860 14.181 2.927 1.00 0.00 C ATOM 314 O ASP A 243 -5.904 14.184 2.152 1.00 0.00 O ATOM 315 CB ASP A 243 -7.954 15.817 1.391 1.00 0.00 C ATOM 316 CG ASP A 243 -9.247 16.346 0.811 1.00 0.00 C ATOM 317 OD1 ASP A 243 -9.575 17.527 1.055 1.00 0.00 O ATOM 318 OD2 ASP A 243 -9.933 15.592 0.094 1.00 0.00 O1- ATOM 0 H ASP A 243 -9.641 15.175 4.022 1.00 0.00 H new ATOM 0 HA ASP A 243 -8.892 14.100 2.251 1.00 0.00 H new ATOM 0 HB2 ASP A 243 -7.343 16.656 1.725 1.00 0.00 H new ATOM 0 HB3 ASP A 243 -7.394 15.306 0.608 1.00 0.00 H new ATOM 323 N SER A 244 -6.833 13.586 4.103 1.00 0.00 N ATOM 324 CA SER A 244 -5.626 12.988 4.631 1.00 0.00 C ATOM 325 C SER A 244 -5.785 11.478 4.711 1.00 0.00 C ATOM 326 O SER A 244 -6.337 10.952 5.672 1.00 0.00 O ATOM 327 CB SER A 244 -5.328 13.553 6.021 1.00 0.00 C ATOM 328 OG SER A 244 -5.406 14.968 6.026 1.00 0.00 O ATOM 0 H SER A 244 -7.644 13.504 4.716 1.00 0.00 H new ATOM 0 HA SER A 244 -4.795 13.223 3.965 1.00 0.00 H new ATOM 0 HB2 SER A 244 -6.036 13.144 6.742 1.00 0.00 H new ATOM 0 HB3 SER A 244 -4.333 13.240 6.338 1.00 0.00 H new ATOM 0 HG SER A 244 -5.213 15.303 6.926 1.00 0.00 H new ATOM 334 N TYR A 245 -5.309 10.795 3.693 1.00 0.00 N ATOM 335 CA TYR A 245 -5.332 9.343 3.662 1.00 0.00 C ATOM 336 C TYR A 245 -3.932 8.847 3.377 1.00 0.00 C ATOM 337 O TYR A 245 -3.411 9.044 2.279 1.00 0.00 O ATOM 338 CB TYR A 245 -6.291 8.824 2.590 1.00 0.00 C ATOM 339 CG TYR A 245 -7.721 8.578 3.049 1.00 0.00 C ATOM 340 CD1 TYR A 245 -8.481 9.572 3.654 1.00 0.00 C ATOM 341 CD2 TYR A 245 -8.316 7.336 2.857 1.00 0.00 C ATOM 342 CE1 TYR A 245 -9.781 9.334 4.056 1.00 0.00 C ATOM 343 CE2 TYR A 245 -9.615 7.093 3.257 1.00 0.00 C ATOM 344 CZ TYR A 245 -10.342 8.095 3.856 1.00 0.00 C ATOM 345 OH TYR A 245 -11.636 7.855 4.263 1.00 0.00 O ATOM 0 H TYR A 245 -4.896 11.225 2.865 1.00 0.00 H new ATOM 0 HA TYR A 245 -5.681 8.974 4.626 1.00 0.00 H new ATOM 0 HB2 TYR A 245 -6.310 9.540 1.768 1.00 0.00 H new ATOM 0 HB3 TYR A 245 -5.891 7.892 2.191 1.00 0.00 H new ATOM 0 HD1 TYR A 245 -8.047 10.548 3.813 1.00 0.00 H new ATOM 0 HD2 TYR A 245 -7.751 6.546 2.386 1.00 0.00 H new ATOM 0 HE1 TYR A 245 -10.355 10.119 4.526 1.00 0.00 H new ATOM 0 HE2 TYR A 245 -10.058 6.121 3.100 1.00 0.00 H new ATOM 0 HH TYR A 245 -11.881 6.931 4.047 1.00 0.00 H new ATOM 355 N GLN A 246 -3.310 8.255 4.372 1.00 0.00 N ATOM 356 CA GLN A 246 -1.950 7.765 4.232 1.00 0.00 C ATOM 357 C GLN A 246 -1.836 6.394 4.872 1.00 0.00 C ATOM 358 O GLN A 246 -2.780 5.930 5.504 1.00 0.00 O ATOM 359 CB GLN A 246 -0.972 8.740 4.890 1.00 0.00 C ATOM 360 CG GLN A 246 -1.051 10.154 4.340 1.00 0.00 C ATOM 361 CD GLN A 246 -0.176 11.126 5.100 1.00 0.00 C ATOM 362 OE1 GLN A 246 0.874 10.757 5.629 1.00 0.00 O ATOM 363 NE2 GLN A 246 -0.602 12.376 5.159 1.00 0.00 N ATOM 0 H GLN A 246 -3.723 8.099 5.292 1.00 0.00 H new ATOM 0 HA GLN A 246 -1.702 7.686 3.174 1.00 0.00 H new ATOM 0 HB2 GLN A 246 -1.166 8.766 5.962 1.00 0.00 H new ATOM 0 HB3 GLN A 246 0.043 8.365 4.759 1.00 0.00 H new ATOM 0 HG2 GLN A 246 -0.755 10.148 3.291 1.00 0.00 H new ATOM 0 HG3 GLN A 246 -2.085 10.497 4.377 1.00 0.00 H new ATOM 0 HE21 GLN A 246 -1.478 12.638 4.706 1.00 0.00 H new ATOM 0 HE22 GLN A 246 -0.055 13.078 5.657 1.00 0.00 H new ATOM 372 N PHE A 247 -0.698 5.738 4.715 1.00 0.00 N ATOM 373 CA PHE A 247 -0.497 4.452 5.359 1.00 0.00 C ATOM 374 C PHE A 247 0.976 4.151 5.606 1.00 0.00 C ATOM 375 O PHE A 247 1.809 4.348 4.730 1.00 0.00 O ATOM 376 CB PHE A 247 -1.158 3.318 4.576 1.00 0.00 C ATOM 377 CG PHE A 247 -0.822 3.233 3.112 1.00 0.00 C ATOM 378 CD1 PHE A 247 -0.035 2.202 2.637 1.00 0.00 C ATOM 379 CD2 PHE A 247 -1.343 4.143 2.206 1.00 0.00 C ATOM 380 CE1 PHE A 247 0.221 2.073 1.291 1.00 0.00 C ATOM 381 CE2 PHE A 247 -1.077 4.028 0.859 1.00 0.00 C ATOM 382 CZ PHE A 247 -0.299 2.987 0.403 1.00 0.00 C ATOM 0 H PHE A 247 0.089 6.068 4.156 1.00 0.00 H new ATOM 0 HA PHE A 247 -0.983 4.518 6.333 1.00 0.00 H new ATOM 0 HB2 PHE A 247 -0.883 2.373 5.045 1.00 0.00 H new ATOM 0 HB3 PHE A 247 -2.239 3.420 4.673 1.00 0.00 H new ATOM 0 HD1 PHE A 247 0.385 1.488 3.330 1.00 0.00 H new ATOM 0 HD2 PHE A 247 -1.965 4.952 2.560 1.00 0.00 H new ATOM 0 HE1 PHE A 247 0.829 1.256 0.932 1.00 0.00 H new ATOM 0 HE2 PHE A 247 -1.477 4.751 0.164 1.00 0.00 H new ATOM 0 HZ PHE A 247 -0.097 2.888 -0.653 1.00 0.00 H new ATOM 392 N THR A 248 1.296 3.670 6.803 1.00 0.00 N ATOM 393 CA THR A 248 2.664 3.320 7.143 1.00 0.00 C ATOM 394 C THR A 248 2.849 1.824 7.004 1.00 0.00 C ATOM 395 O THR A 248 1.963 1.048 7.376 1.00 0.00 O ATOM 396 CB THR A 248 3.006 3.747 8.590 1.00 0.00 C ATOM 397 OG1 THR A 248 2.944 5.172 8.704 1.00 0.00 O ATOM 398 CG2 THR A 248 4.388 3.261 9.009 1.00 0.00 C ATOM 0 H THR A 248 0.622 3.515 7.553 1.00 0.00 H new ATOM 0 HA THR A 248 3.333 3.846 6.462 1.00 0.00 H new ATOM 0 HB THR A 248 2.272 3.289 9.253 1.00 0.00 H new ATOM 0 HG1 THR A 248 3.160 5.436 9.623 1.00 0.00 H new ATOM 0 HG21 THR A 248 4.592 3.581 10.031 1.00 0.00 H new ATOM 0 HG22 THR A 248 4.423 2.173 8.955 1.00 0.00 H new ATOM 0 HG23 THR A 248 5.140 3.681 8.341 1.00 0.00 H new ATOM 406 N VAL A 249 3.979 1.411 6.464 1.00 0.00 N ATOM 407 CA VAL A 249 4.194 -0.010 6.234 1.00 0.00 C ATOM 408 C VAL A 249 5.644 -0.433 6.492 1.00 0.00 C ATOM 409 O VAL A 249 6.585 0.304 6.204 1.00 0.00 O ATOM 410 CB VAL A 249 3.804 -0.393 4.787 1.00 0.00 C ATOM 411 CG1 VAL A 249 4.854 0.064 3.793 1.00 0.00 C ATOM 412 CG2 VAL A 249 3.546 -1.889 4.671 1.00 0.00 C ATOM 0 H VAL A 249 4.747 2.019 6.181 1.00 0.00 H new ATOM 0 HA VAL A 249 3.557 -0.538 6.944 1.00 0.00 H new ATOM 0 HB VAL A 249 2.877 0.126 4.543 1.00 0.00 H new ATOM 0 HG11 VAL A 249 4.550 -0.221 2.786 1.00 0.00 H new ATOM 0 HG12 VAL A 249 4.960 1.147 3.848 1.00 0.00 H new ATOM 0 HG13 VAL A 249 5.808 -0.406 4.030 1.00 0.00 H new ATOM 0 HG21 VAL A 249 3.274 -2.133 3.644 1.00 0.00 H new ATOM 0 HG22 VAL A 249 4.447 -2.436 4.947 1.00 0.00 H new ATOM 0 HG23 VAL A 249 2.732 -2.171 5.339 1.00 0.00 H new ATOM 422 N THR A 250 5.816 -1.614 7.057 1.00 0.00 N ATOM 423 CA THR A 250 7.110 -2.258 7.095 1.00 0.00 C ATOM 424 C THR A 250 7.173 -3.292 5.980 1.00 0.00 C ATOM 425 O THR A 250 6.563 -4.366 6.071 1.00 0.00 O ATOM 426 CB THR A 250 7.380 -2.930 8.458 1.00 0.00 C ATOM 427 OG1 THR A 250 7.504 -1.926 9.474 1.00 0.00 O ATOM 428 CG2 THR A 250 8.649 -3.777 8.422 1.00 0.00 C ATOM 0 H THR A 250 5.067 -2.148 7.498 1.00 0.00 H new ATOM 0 HA THR A 250 7.880 -1.499 6.954 1.00 0.00 H new ATOM 0 HB THR A 250 6.539 -3.587 8.682 1.00 0.00 H new ATOM 0 HG1 THR A 250 7.674 -2.355 10.339 1.00 0.00 H new ATOM 0 HG21 THR A 250 8.808 -4.235 9.398 1.00 0.00 H new ATOM 0 HG22 THR A 250 8.545 -4.557 7.668 1.00 0.00 H new ATOM 0 HG23 THR A 250 9.502 -3.145 8.174 1.00 0.00 H new ATOM 436 N LEU A 251 7.882 -2.956 4.918 1.00 0.00 N ATOM 437 CA LEU A 251 8.001 -3.841 3.783 1.00 0.00 C ATOM 438 C LEU A 251 9.164 -4.779 4.029 1.00 0.00 C ATOM 439 O LEU A 251 9.924 -4.613 4.983 1.00 0.00 O ATOM 440 CB LEU A 251 8.252 -3.061 2.474 1.00 0.00 C ATOM 441 CG LEU A 251 7.459 -1.768 2.275 1.00 0.00 C ATOM 442 CD1 LEU A 251 8.365 -0.693 1.704 1.00 0.00 C ATOM 443 CD2 LEU A 251 6.273 -1.973 1.345 1.00 0.00 C ATOM 0 H LEU A 251 8.384 -2.073 4.821 1.00 0.00 H new ATOM 0 HA LEU A 251 7.066 -4.390 3.672 1.00 0.00 H new ATOM 0 HB2 LEU A 251 9.314 -2.819 2.422 1.00 0.00 H new ATOM 0 HB3 LEU A 251 8.035 -3.724 1.637 1.00 0.00 H new ATOM 0 HG LEU A 251 7.078 -1.460 3.249 1.00 0.00 H new ATOM 0 HD11 LEU A 251 7.796 0.226 1.564 1.00 0.00 H new ATOM 0 HD12 LEU A 251 9.189 -0.508 2.393 1.00 0.00 H new ATOM 0 HD13 LEU A 251 8.762 -1.024 0.744 1.00 0.00 H new ATOM 0 HD21 LEU A 251 5.735 -1.032 1.229 1.00 0.00 H new ATOM 0 HD22 LEU A 251 6.628 -2.311 0.371 1.00 0.00 H new ATOM 0 HD23 LEU A 251 5.605 -2.723 1.768 1.00 0.00 H new ATOM 455 N THR A 252 9.296 -5.762 3.182 1.00 0.00 N ATOM 456 CA THR A 252 10.400 -6.670 3.251 1.00 0.00 C ATOM 457 C THR A 252 11.066 -6.768 1.884 1.00 0.00 C ATOM 458 O THR A 252 10.387 -6.753 0.858 1.00 0.00 O ATOM 459 CB THR A 252 9.931 -8.046 3.723 1.00 0.00 C ATOM 460 OG1 THR A 252 8.525 -8.186 3.473 1.00 0.00 O ATOM 461 CG2 THR A 252 10.213 -8.238 5.210 1.00 0.00 C ATOM 0 H THR A 252 8.639 -5.954 2.425 1.00 0.00 H new ATOM 0 HA THR A 252 11.127 -6.296 3.972 1.00 0.00 H new ATOM 0 HB THR A 252 10.480 -8.808 3.170 1.00 0.00 H new ATOM 0 HG1 THR A 252 8.226 -9.069 3.774 1.00 0.00 H new ATOM 0 HG21 THR A 252 9.870 -9.225 5.521 1.00 0.00 H new ATOM 0 HG22 THR A 252 11.284 -8.153 5.391 1.00 0.00 H new ATOM 0 HG23 THR A 252 9.686 -7.474 5.782 1.00 0.00 H new ATOM 469 N GLY A 253 12.382 -6.850 1.871 1.00 0.00 N ATOM 470 CA GLY A 253 13.115 -6.819 0.632 1.00 0.00 C ATOM 471 C GLY A 253 14.359 -7.666 0.679 1.00 0.00 C ATOM 472 O GLY A 253 14.365 -8.746 1.276 1.00 0.00 O ATOM 0 H GLY A 253 12.960 -6.938 2.707 1.00 0.00 H new ATOM 0 HA2 GLY A 253 12.472 -7.168 -0.176 1.00 0.00 H new ATOM 0 HA3 GLY A 253 13.388 -5.790 0.400 1.00 0.00 H new ATOM 476 N ALA A 254 15.412 -7.182 0.047 1.00 0.00 N ATOM 477 CA ALA A 254 16.647 -7.936 -0.048 1.00 0.00 C ATOM 478 C ALA A 254 17.738 -7.381 0.859 1.00 0.00 C ATOM 479 O ALA A 254 17.500 -6.470 1.652 1.00 0.00 O ATOM 480 CB ALA A 254 17.116 -8.000 -1.491 1.00 0.00 C ATOM 0 H ALA A 254 15.436 -6.270 -0.408 1.00 0.00 H new ATOM 0 HA ALA A 254 16.439 -8.948 0.300 1.00 0.00 H new ATOM 0 HB1 ALA A 254 18.044 -8.569 -1.547 1.00 0.00 H new ATOM 0 HB2 ALA A 254 16.354 -8.487 -2.100 1.00 0.00 H new ATOM 0 HB3 ALA A 254 17.287 -6.990 -1.863 1.00 0.00 H new ATOM 486 N THR A 255 18.929 -7.947 0.718 1.00 0.00 N ATOM 487 CA THR A 255 20.035 -7.738 1.643 1.00 0.00 C ATOM 488 C THR A 255 20.588 -6.300 1.621 1.00 0.00 C ATOM 489 O THR A 255 20.104 -5.431 0.884 1.00 0.00 O ATOM 490 CB THR A 255 21.162 -8.737 1.298 1.00 0.00 C ATOM 491 OG1 THR A 255 20.584 -9.876 0.640 1.00 0.00 O ATOM 492 CG2 THR A 255 21.916 -9.218 2.547 1.00 0.00 C ATOM 0 H THR A 255 19.157 -8.574 -0.054 1.00 0.00 H new ATOM 0 HA THR A 255 19.655 -7.903 2.651 1.00 0.00 H new ATOM 0 HB THR A 255 21.876 -8.225 0.653 1.00 0.00 H new ATOM 0 HG1 THR A 255 21.290 -10.517 0.414 1.00 0.00 H new ATOM 0 HG21 THR A 255 22.698 -9.918 2.253 1.00 0.00 H new ATOM 0 HG22 THR A 255 22.366 -8.363 3.052 1.00 0.00 H new ATOM 0 HG23 THR A 255 21.220 -9.714 3.223 1.00 0.00 H new ATOM 500 N ALA A 256 21.611 -6.081 2.447 1.00 0.00 N ATOM 501 CA ALA A 256 22.266 -4.786 2.606 1.00 0.00 C ATOM 502 C ALA A 256 22.997 -4.343 1.335 1.00 0.00 C ATOM 503 O ALA A 256 22.896 -4.992 0.289 1.00 0.00 O ATOM 504 CB ALA A 256 23.225 -4.846 3.791 1.00 0.00 C ATOM 0 H ALA A 256 22.013 -6.812 3.034 1.00 0.00 H new ATOM 0 HA ALA A 256 21.495 -4.039 2.796 1.00 0.00 H new ATOM 0 HB1 ALA A 256 23.715 -3.880 3.912 1.00 0.00 H new ATOM 0 HB2 ALA A 256 22.669 -5.086 4.697 1.00 0.00 H new ATOM 0 HB3 ALA A 256 23.977 -5.615 3.612 1.00 0.00 H new ATOM 510 N SER A 257 23.702 -3.209 1.441 1.00 0.00 N ATOM 511 CA SER A 257 24.444 -2.601 0.333 1.00 0.00 C ATOM 512 C SER A 257 23.517 -1.809 -0.590 1.00 0.00 C ATOM 513 O SER A 257 23.872 -1.495 -1.727 1.00 0.00 O ATOM 514 CB SER A 257 25.242 -3.656 -0.457 1.00 0.00 C ATOM 515 OG SER A 257 26.173 -4.321 0.383 1.00 0.00 O ATOM 0 H SER A 257 23.773 -2.682 2.312 1.00 0.00 H new ATOM 0 HA SER A 257 25.159 -1.902 0.766 1.00 0.00 H new ATOM 0 HB2 SER A 257 24.558 -4.383 -0.895 1.00 0.00 H new ATOM 0 HB3 SER A 257 25.769 -3.177 -1.282 1.00 0.00 H new ATOM 0 HG SER A 257 26.667 -4.987 -0.139 1.00 0.00 H new ATOM 521 N VAL A 258 22.326 -1.491 -0.092 1.00 0.00 N ATOM 522 CA VAL A 258 21.422 -0.579 -0.772 1.00 0.00 C ATOM 523 C VAL A 258 20.884 0.426 0.241 1.00 0.00 C ATOM 524 O VAL A 258 19.872 0.181 0.918 1.00 0.00 O ATOM 525 CB VAL A 258 20.242 -1.309 -1.461 1.00 0.00 C ATOM 526 CG1 VAL A 258 19.359 -0.319 -2.209 1.00 0.00 C ATOM 527 CG2 VAL A 258 20.749 -2.387 -2.409 1.00 0.00 C ATOM 0 H VAL A 258 21.965 -1.857 0.789 1.00 0.00 H new ATOM 0 HA VAL A 258 21.985 -0.076 -1.558 1.00 0.00 H new ATOM 0 HB VAL A 258 19.645 -1.788 -0.685 1.00 0.00 H new ATOM 0 HG11 VAL A 258 18.537 -0.853 -2.685 1.00 0.00 H new ATOM 0 HG12 VAL A 258 18.959 0.413 -1.508 1.00 0.00 H new ATOM 0 HG13 VAL A 258 19.949 0.192 -2.970 1.00 0.00 H new ATOM 0 HG21 VAL A 258 19.902 -2.885 -2.880 1.00 0.00 H new ATOM 0 HG22 VAL A 258 21.375 -1.932 -3.176 1.00 0.00 H new ATOM 0 HG23 VAL A 258 21.334 -3.117 -1.850 1.00 0.00 H new ATOM 537 N THR A 259 21.590 1.542 0.368 1.00 0.00 N ATOM 538 CA THR A 259 21.216 2.583 1.304 1.00 0.00 C ATOM 539 C THR A 259 19.920 3.251 0.868 1.00 0.00 C ATOM 540 O THR A 259 19.912 4.086 -0.038 1.00 0.00 O ATOM 541 CB THR A 259 22.324 3.645 1.433 1.00 0.00 C ATOM 542 OG1 THR A 259 23.571 3.009 1.741 1.00 0.00 O ATOM 543 CG2 THR A 259 21.984 4.652 2.523 1.00 0.00 C ATOM 0 H THR A 259 22.431 1.746 -0.172 1.00 0.00 H new ATOM 0 HA THR A 259 21.072 2.113 2.277 1.00 0.00 H new ATOM 0 HB THR A 259 22.406 4.174 0.483 1.00 0.00 H new ATOM 0 HG1 THR A 259 24.273 3.688 1.821 1.00 0.00 H new ATOM 0 HG21 THR A 259 22.781 5.392 2.596 1.00 0.00 H new ATOM 0 HG22 THR A 259 21.046 5.151 2.278 1.00 0.00 H new ATOM 0 HG23 THR A 259 21.881 4.135 3.477 1.00 0.00 H new ATOM 551 N GLY A 260 18.828 2.857 1.503 1.00 0.00 N ATOM 552 CA GLY A 260 17.537 3.419 1.187 1.00 0.00 C ATOM 553 C GLY A 260 17.017 2.979 -0.165 1.00 0.00 C ATOM 554 O GLY A 260 17.339 3.589 -1.185 1.00 0.00 O ATOM 0 H GLY A 260 18.816 2.151 2.239 1.00 0.00 H new ATOM 0 HA2 GLY A 260 16.822 3.129 1.957 1.00 0.00 H new ATOM 0 HA3 GLY A 260 17.605 4.507 1.208 1.00 0.00 H new ATOM 558 N PHE A 261 16.242 1.896 -0.170 1.00 0.00 N ATOM 559 CA PHE A 261 15.485 1.495 -1.359 1.00 0.00 C ATOM 560 C PHE A 261 14.840 2.700 -2.055 1.00 0.00 C ATOM 561 O PHE A 261 15.135 2.977 -3.215 1.00 0.00 O ATOM 562 CB PHE A 261 14.348 0.517 -0.991 1.00 0.00 C ATOM 563 CG PHE A 261 14.689 -0.937 -1.145 1.00 0.00 C ATOM 564 CD1 PHE A 261 15.000 -1.454 -2.391 1.00 0.00 C ATOM 565 CD2 PHE A 261 14.663 -1.792 -0.057 1.00 0.00 C ATOM 566 CE1 PHE A 261 15.284 -2.795 -2.549 1.00 0.00 C ATOM 567 CE2 PHE A 261 14.951 -3.136 -0.206 1.00 0.00 C ATOM 568 CZ PHE A 261 15.260 -3.638 -1.456 1.00 0.00 C ATOM 0 H PHE A 261 16.120 1.280 0.634 1.00 0.00 H new ATOM 0 HA PHE A 261 16.202 1.018 -2.027 1.00 0.00 H new ATOM 0 HB2 PHE A 261 14.053 0.698 0.043 1.00 0.00 H new ATOM 0 HB3 PHE A 261 13.481 0.740 -1.614 1.00 0.00 H new ATOM 0 HD1 PHE A 261 15.021 -0.800 -3.250 1.00 0.00 H new ATOM 0 HD2 PHE A 261 14.415 -1.405 0.920 1.00 0.00 H new ATOM 0 HE1 PHE A 261 15.525 -3.185 -3.527 1.00 0.00 H new ATOM 0 HE2 PHE A 261 14.935 -3.792 0.652 1.00 0.00 H new ATOM 0 HZ PHE A 261 15.482 -4.688 -1.578 1.00 0.00 H new ATOM 578 N LEU A 262 13.978 3.420 -1.337 1.00 0.00 N ATOM 579 CA LEU A 262 13.209 4.519 -1.926 1.00 0.00 C ATOM 580 C LEU A 262 12.975 5.633 -0.909 1.00 0.00 C ATOM 581 O LEU A 262 13.143 5.431 0.293 1.00 0.00 O ATOM 582 CB LEU A 262 11.856 4.007 -2.432 1.00 0.00 C ATOM 583 CG LEU A 262 11.915 2.951 -3.537 1.00 0.00 C ATOM 584 CD1 LEU A 262 10.525 2.416 -3.825 1.00 0.00 C ATOM 585 CD2 LEU A 262 12.534 3.525 -4.804 1.00 0.00 C ATOM 0 H LEU A 262 13.794 3.263 -0.346 1.00 0.00 H new ATOM 0 HA LEU A 262 13.786 4.919 -2.759 1.00 0.00 H new ATOM 0 HB2 LEU A 262 11.307 3.591 -1.587 1.00 0.00 H new ATOM 0 HB3 LEU A 262 11.281 4.857 -2.798 1.00 0.00 H new ATOM 0 HG LEU A 262 12.545 2.130 -3.193 1.00 0.00 H new ATOM 0 HD11 LEU A 262 10.580 1.665 -4.613 1.00 0.00 H new ATOM 0 HD12 LEU A 262 10.115 1.964 -2.922 1.00 0.00 H new ATOM 0 HD13 LEU A 262 9.880 3.233 -4.147 1.00 0.00 H new ATOM 0 HD21 LEU A 262 12.565 2.755 -5.575 1.00 0.00 H new ATOM 0 HD22 LEU A 262 11.934 4.365 -5.154 1.00 0.00 H new ATOM 0 HD23 LEU A 262 13.547 3.867 -4.592 1.00 0.00 H new ATOM 597 N LYS A 263 12.603 6.809 -1.407 1.00 0.00 N ATOM 598 CA LYS A 263 12.296 7.953 -0.570 1.00 0.00 C ATOM 599 C LYS A 263 11.018 8.654 -1.022 1.00 0.00 C ATOM 600 O LYS A 263 10.267 8.128 -1.846 1.00 0.00 O ATOM 601 CB LYS A 263 13.460 8.925 -0.610 1.00 0.00 C ATOM 602 CG LYS A 263 14.679 8.384 0.089 1.00 0.00 C ATOM 603 CD LYS A 263 15.906 9.255 -0.146 1.00 0.00 C ATOM 604 CE LYS A 263 16.310 9.245 -1.615 1.00 0.00 C ATOM 605 NZ LYS A 263 17.533 10.050 -1.873 1.00 0.00 N1+ ATOM 0 H LYS A 263 12.507 6.991 -2.406 1.00 0.00 H new ATOM 0 HA LYS A 263 12.136 7.600 0.449 1.00 0.00 H new ATOM 0 HB2 LYS A 263 13.708 9.149 -1.647 1.00 0.00 H new ATOM 0 HB3 LYS A 263 13.163 9.864 -0.143 1.00 0.00 H new ATOM 0 HG2 LYS A 263 14.483 8.316 1.159 1.00 0.00 H new ATOM 0 HG3 LYS A 263 14.880 7.372 -0.264 1.00 0.00 H new ATOM 0 HD2 LYS A 263 15.697 10.277 0.170 1.00 0.00 H new ATOM 0 HD3 LYS A 263 16.734 8.895 0.465 1.00 0.00 H new ATOM 0 HE2 LYS A 263 16.481 8.217 -1.935 1.00 0.00 H new ATOM 0 HE3 LYS A 263 15.489 9.634 -2.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 263 17.767 10.012 -2.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 263 17.364 11.037 -1.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 263 18.325 9.665 -1.320 1.00 0.00 H new ATOM 619 N ALA A 264 10.787 9.847 -0.484 1.00 0.00 N ATOM 620 CA ALA A 264 9.601 10.618 -0.800 1.00 0.00 C ATOM 621 C ALA A 264 9.572 11.006 -2.269 1.00 0.00 C ATOM 622 O ALA A 264 10.487 11.659 -2.779 1.00 0.00 O ATOM 623 CB ALA A 264 9.522 11.858 0.078 1.00 0.00 C ATOM 0 H ALA A 264 11.416 10.300 0.179 1.00 0.00 H new ATOM 0 HA ALA A 264 8.732 9.992 -0.600 1.00 0.00 H new ATOM 0 HB1 ALA A 264 8.625 12.425 -0.173 1.00 0.00 H new ATOM 0 HB2 ALA A 264 9.482 11.560 1.126 1.00 0.00 H new ATOM 0 HB3 ALA A 264 10.402 12.479 -0.089 1.00 0.00 H new ATOM 629 N GLY A 265 8.527 10.572 -2.941 1.00 0.00 N ATOM 630 CA GLY A 265 8.340 10.910 -4.337 1.00 0.00 C ATOM 631 C GLY A 265 8.611 9.736 -5.249 1.00 0.00 C ATOM 632 O GLY A 265 8.441 9.829 -6.468 1.00 0.00 O ATOM 0 H GLY A 265 7.794 9.985 -2.544 1.00 0.00 H new ATOM 0 HA2 GLY A 265 7.319 11.260 -4.491 1.00 0.00 H new ATOM 0 HA3 GLY A 265 9.002 11.734 -4.602 1.00 0.00 H new ATOM 636 N ASP A 266 9.046 8.631 -4.665 1.00 0.00 N ATOM 637 CA ASP A 266 9.321 7.424 -5.430 1.00 0.00 C ATOM 638 C ASP A 266 8.093 6.534 -5.458 1.00 0.00 C ATOM 639 O ASP A 266 7.443 6.328 -4.433 1.00 0.00 O ATOM 640 CB ASP A 266 10.512 6.665 -4.847 1.00 0.00 C ATOM 641 CG ASP A 266 11.816 7.410 -5.036 1.00 0.00 C ATOM 642 OD1 ASP A 266 12.572 7.575 -4.052 1.00 0.00 O ATOM 643 OD2 ASP A 266 12.093 7.846 -6.175 1.00 0.00 O1- ATOM 0 H ASP A 266 9.217 8.544 -3.663 1.00 0.00 H new ATOM 0 HA ASP A 266 9.572 7.716 -6.450 1.00 0.00 H new ATOM 0 HB2 ASP A 266 10.345 6.493 -3.784 1.00 0.00 H new ATOM 0 HB3 ASP A 266 10.583 5.686 -5.321 1.00 0.00 H new ATOM 648 N GLN A 267 7.768 6.010 -6.631 1.00 0.00 N ATOM 649 CA GLN A 267 6.551 5.236 -6.791 1.00 0.00 C ATOM 650 C GLN A 267 6.832 3.743 -6.841 1.00 0.00 C ATOM 651 O GLN A 267 7.906 3.301 -7.261 1.00 0.00 O ATOM 652 CB GLN A 267 5.794 5.668 -8.044 1.00 0.00 C ATOM 653 CG GLN A 267 5.380 7.129 -8.021 1.00 0.00 C ATOM 654 CD GLN A 267 4.260 7.429 -8.990 1.00 0.00 C ATOM 655 OE1 GLN A 267 4.492 7.780 -10.144 1.00 0.00 O ATOM 656 NE2 GLN A 267 3.033 7.299 -8.521 1.00 0.00 N ATOM 0 H GLN A 267 8.327 6.107 -7.479 1.00 0.00 H new ATOM 0 HA GLN A 267 5.930 5.431 -5.916 1.00 0.00 H new ATOM 0 HB2 GLN A 267 6.420 5.488 -8.918 1.00 0.00 H new ATOM 0 HB3 GLN A 267 4.905 5.047 -8.155 1.00 0.00 H new ATOM 0 HG2 GLN A 267 5.065 7.398 -7.013 1.00 0.00 H new ATOM 0 HG3 GLN A 267 6.242 7.751 -8.263 1.00 0.00 H new ATOM 0 HE21 GLN A 267 2.884 7.005 -7.556 1.00 0.00 H new ATOM 0 HE22 GLN A 267 2.233 7.493 -9.124 1.00 0.00 H new ATOM 665 N VAL A 268 5.843 2.976 -6.418 1.00 0.00 N ATOM 666 CA VAL A 268 5.945 1.531 -6.362 1.00 0.00 C ATOM 667 C VAL A 268 4.737 0.880 -7.017 1.00 0.00 C ATOM 668 O VAL A 268 3.655 1.465 -7.070 1.00 0.00 O ATOM 669 CB VAL A 268 6.010 1.012 -4.901 1.00 0.00 C ATOM 670 CG1 VAL A 268 7.442 0.979 -4.396 1.00 0.00 C ATOM 671 CG2 VAL A 268 5.153 1.872 -3.975 1.00 0.00 C ATOM 0 H VAL A 268 4.944 3.340 -6.103 1.00 0.00 H new ATOM 0 HA VAL A 268 6.863 1.270 -6.889 1.00 0.00 H new ATOM 0 HB VAL A 268 5.616 -0.004 -4.898 1.00 0.00 H new ATOM 0 HG11 VAL A 268 7.458 0.611 -3.370 1.00 0.00 H new ATOM 0 HG12 VAL A 268 8.035 0.318 -5.027 1.00 0.00 H new ATOM 0 HG13 VAL A 268 7.862 1.984 -4.428 1.00 0.00 H new ATOM 0 HG21 VAL A 268 5.217 1.486 -2.958 1.00 0.00 H new ATOM 0 HG22 VAL A 268 5.514 2.900 -3.996 1.00 0.00 H new ATOM 0 HG23 VAL A 268 4.116 1.844 -4.309 1.00 0.00 H new ATOM 681 N LYS A 269 4.933 -0.327 -7.509 1.00 0.00 N ATOM 682 CA LYS A 269 3.833 -1.181 -7.900 1.00 0.00 C ATOM 683 C LYS A 269 3.374 -1.938 -6.658 1.00 0.00 C ATOM 684 O LYS A 269 3.935 -2.973 -6.307 1.00 0.00 O ATOM 685 CB LYS A 269 4.262 -2.148 -9.007 1.00 0.00 C ATOM 686 CG LYS A 269 3.744 -1.764 -10.381 1.00 0.00 C ATOM 687 CD LYS A 269 4.198 -0.372 -10.779 1.00 0.00 C ATOM 688 CE LYS A 269 3.518 0.092 -12.060 1.00 0.00 C ATOM 689 NZ LYS A 269 3.856 -0.777 -13.218 1.00 0.00 N1+ ATOM 0 H LYS A 269 5.855 -0.740 -7.648 1.00 0.00 H new ATOM 0 HA LYS A 269 3.013 -0.585 -8.301 1.00 0.00 H new ATOM 0 HB2 LYS A 269 5.351 -2.193 -9.037 1.00 0.00 H new ATOM 0 HB3 LYS A 269 3.908 -3.149 -8.761 1.00 0.00 H new ATOM 0 HG2 LYS A 269 4.095 -2.487 -11.118 1.00 0.00 H new ATOM 0 HG3 LYS A 269 2.655 -1.807 -10.385 1.00 0.00 H new ATOM 0 HD2 LYS A 269 3.976 0.328 -9.974 1.00 0.00 H new ATOM 0 HD3 LYS A 269 5.279 -0.366 -10.917 1.00 0.00 H new ATOM 0 HE2 LYS A 269 2.438 0.098 -11.915 1.00 0.00 H new ATOM 0 HE3 LYS A 269 3.816 1.118 -12.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 269 3.442 -0.378 -14.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 269 4.889 -0.831 -13.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 269 3.474 -1.731 -13.059 1.00 0.00 H new ATOM 703 N PHE A 270 2.364 -1.405 -5.990 1.00 0.00 N ATOM 704 CA PHE A 270 2.022 -1.835 -4.641 1.00 0.00 C ATOM 705 C PHE A 270 0.650 -2.487 -4.620 1.00 0.00 C ATOM 706 O PHE A 270 -0.373 -1.812 -4.755 1.00 0.00 O ATOM 707 CB PHE A 270 2.059 -0.620 -3.710 1.00 0.00 C ATOM 708 CG PHE A 270 1.780 -0.911 -2.262 1.00 0.00 C ATOM 709 CD1 PHE A 270 0.503 -0.763 -1.745 1.00 0.00 C ATOM 710 CD2 PHE A 270 2.802 -1.305 -1.412 1.00 0.00 C ATOM 711 CE1 PHE A 270 0.249 -1.004 -0.408 1.00 0.00 C ATOM 712 CE2 PHE A 270 2.552 -1.550 -0.075 1.00 0.00 C ATOM 713 CZ PHE A 270 1.274 -1.398 0.426 1.00 0.00 C ATOM 0 H PHE A 270 1.763 -0.670 -6.361 1.00 0.00 H new ATOM 0 HA PHE A 270 2.745 -2.576 -4.299 1.00 0.00 H new ATOM 0 HB2 PHE A 270 3.041 -0.154 -3.787 1.00 0.00 H new ATOM 0 HB3 PHE A 270 1.331 0.110 -4.064 1.00 0.00 H new ATOM 0 HD1 PHE A 270 -0.303 -0.456 -2.394 1.00 0.00 H new ATOM 0 HD2 PHE A 270 3.804 -1.422 -1.799 1.00 0.00 H new ATOM 0 HE1 PHE A 270 -0.751 -0.884 -0.017 1.00 0.00 H new ATOM 0 HE2 PHE A 270 3.355 -1.860 0.577 1.00 0.00 H new ATOM 0 HZ PHE A 270 1.077 -1.588 1.471 1.00 0.00 H new ATOM 723 N THR A 271 0.636 -3.797 -4.473 1.00 0.00 N ATOM 724 CA THR A 271 -0.603 -4.546 -4.477 1.00 0.00 C ATOM 725 C THR A 271 -1.190 -4.632 -3.077 1.00 0.00 C ATOM 726 O THR A 271 -0.828 -5.514 -2.299 1.00 0.00 O ATOM 727 CB THR A 271 -0.375 -5.975 -5.021 1.00 0.00 C ATOM 728 OG1 THR A 271 0.077 -5.907 -6.378 1.00 0.00 O ATOM 729 CG2 THR A 271 -1.644 -6.836 -4.950 1.00 0.00 C ATOM 0 H THR A 271 1.473 -4.366 -4.349 1.00 0.00 H new ATOM 0 HA THR A 271 -1.303 -4.020 -5.126 1.00 0.00 H new ATOM 0 HB THR A 271 0.380 -6.446 -4.391 1.00 0.00 H new ATOM 0 HG1 THR A 271 -0.615 -5.491 -6.933 1.00 0.00 H new ATOM 0 HG21 THR A 271 -1.432 -7.830 -5.344 1.00 0.00 H new ATOM 0 HG22 THR A 271 -1.970 -6.918 -3.913 1.00 0.00 H new ATOM 0 HG23 THR A 271 -2.432 -6.372 -5.543 1.00 0.00 H new ATOM 737 N ASN A 272 -2.098 -3.718 -2.771 1.00 0.00 N ATOM 738 CA ASN A 272 -2.753 -3.697 -1.464 1.00 0.00 C ATOM 739 C ASN A 272 -4.017 -4.543 -1.515 1.00 0.00 C ATOM 740 O ASN A 272 -5.113 -4.046 -1.780 1.00 0.00 O ATOM 741 CB ASN A 272 -3.090 -2.258 -1.060 1.00 0.00 C ATOM 742 CG ASN A 272 -3.698 -2.144 0.330 1.00 0.00 C ATOM 743 OD1 ASN A 272 -4.528 -1.268 0.580 1.00 0.00 O ATOM 744 ND2 ASN A 272 -3.279 -3.003 1.249 1.00 0.00 N ATOM 0 H ASN A 272 -2.401 -2.980 -3.407 1.00 0.00 H new ATOM 0 HA ASN A 272 -2.076 -4.112 -0.718 1.00 0.00 H new ATOM 0 HB2 ASN A 272 -2.183 -1.656 -1.101 1.00 0.00 H new ATOM 0 HB3 ASN A 272 -3.785 -1.838 -1.787 1.00 0.00 H new ATOM 0 HD21 ASN A 272 -3.645 -2.952 2.200 1.00 0.00 H new ATOM 0 HD22 ASN A 272 -2.591 -3.715 1.005 1.00 0.00 H new ATOM 1061 N SER A 292 -4.281 -5.069 -8.581 1.00 0.00 N ATOM 1062 CA SER A 292 -3.949 -3.669 -8.356 1.00 0.00 C ATOM 1063 C SER A 292 -2.545 -3.560 -7.776 1.00 0.00 C ATOM 1064 O SER A 292 -2.172 -4.373 -6.937 1.00 0.00 O ATOM 1065 CB SER A 292 -4.965 -3.039 -7.401 1.00 0.00 C ATOM 1066 OG SER A 292 -6.291 -3.287 -7.838 1.00 0.00 O ATOM 0 HA SER A 292 -3.982 -3.135 -9.306 1.00 0.00 H new ATOM 0 HB2 SER A 292 -4.827 -3.443 -6.398 1.00 0.00 H new ATOM 0 HB3 SER A 292 -4.793 -1.964 -7.338 1.00 0.00 H new ATOM 0 HG SER A 292 -6.302 -4.078 -8.416 1.00 0.00 H new ATOM 1072 N PHE A 293 -1.754 -2.587 -8.237 1.00 0.00 N ATOM 1073 CA PHE A 293 -0.399 -2.411 -7.724 1.00 0.00 C ATOM 1074 C PHE A 293 0.169 -1.028 -8.051 1.00 0.00 C ATOM 1075 O PHE A 293 0.913 -0.866 -9.007 1.00 0.00 O ATOM 1076 CB PHE A 293 0.532 -3.499 -8.291 1.00 0.00 C ATOM 1077 CG PHE A 293 0.147 -4.001 -9.662 1.00 0.00 C ATOM 1078 CD1 PHE A 293 -0.412 -5.261 -9.814 1.00 0.00 C ATOM 1079 CD2 PHE A 293 0.340 -3.220 -10.790 1.00 0.00 C ATOM 1080 CE1 PHE A 293 -0.770 -5.729 -11.062 1.00 0.00 C ATOM 1081 CE2 PHE A 293 -0.016 -3.684 -12.041 1.00 0.00 C ATOM 1082 CZ PHE A 293 -0.573 -4.941 -12.176 1.00 0.00 C ATOM 0 H PHE A 293 -2.027 -1.918 -8.956 1.00 0.00 H new ATOM 0 HA PHE A 293 -0.454 -2.500 -6.639 1.00 0.00 H new ATOM 0 HB2 PHE A 293 1.547 -3.104 -8.334 1.00 0.00 H new ATOM 0 HB3 PHE A 293 0.547 -4.342 -7.600 1.00 0.00 H new ATOM 0 HD1 PHE A 293 -0.569 -5.883 -8.945 1.00 0.00 H new ATOM 0 HD2 PHE A 293 0.774 -2.236 -10.690 1.00 0.00 H new ATOM 0 HE1 PHE A 293 -1.204 -6.712 -11.166 1.00 0.00 H new ATOM 0 HE2 PHE A 293 0.141 -3.065 -12.912 1.00 0.00 H new ATOM 0 HZ PHE A 293 -0.854 -5.306 -13.153 1.00 0.00 H new ATOM 1092 N THR A 294 -0.114 -0.048 -7.208 1.00 0.00 N ATOM 1093 CA THR A 294 0.454 1.288 -7.376 1.00 0.00 C ATOM 1094 C THR A 294 0.377 2.084 -6.073 1.00 0.00 C ATOM 1095 O THR A 294 -0.700 2.227 -5.493 1.00 0.00 O ATOM 1096 CB THR A 294 -0.253 2.078 -8.510 1.00 0.00 C ATOM 1097 OG1 THR A 294 0.070 1.505 -9.786 1.00 0.00 O ATOM 1098 CG2 THR A 294 0.141 3.558 -8.505 1.00 0.00 C ATOM 0 H THR A 294 -0.731 -0.148 -6.402 1.00 0.00 H new ATOM 0 HA THR A 294 1.500 1.153 -7.653 1.00 0.00 H new ATOM 0 HB THR A 294 -1.326 2.011 -8.332 1.00 0.00 H new ATOM 0 HG1 THR A 294 0.724 0.786 -9.665 1.00 0.00 H new ATOM 0 HG21 THR A 294 -0.376 4.075 -9.314 1.00 0.00 H new ATOM 0 HG22 THR A 294 -0.139 4.006 -7.551 1.00 0.00 H new ATOM 0 HG23 THR A 294 1.218 3.648 -8.646 1.00 0.00 H new ATOM 1106 N ALA A 295 1.520 2.573 -5.606 1.00 0.00 N ATOM 1107 CA ALA A 295 1.555 3.461 -4.452 1.00 0.00 C ATOM 1108 C ALA A 295 2.773 4.371 -4.522 1.00 0.00 C ATOM 1109 O ALA A 295 3.558 4.284 -5.468 1.00 0.00 O ATOM 1110 CB ALA A 295 1.571 2.654 -3.173 1.00 0.00 C ATOM 0 H ALA A 295 2.434 2.369 -6.009 1.00 0.00 H new ATOM 0 HA ALA A 295 0.659 4.082 -4.460 1.00 0.00 H new ATOM 0 HB1 ALA A 295 1.597 3.329 -2.317 1.00 0.00 H new ATOM 0 HB2 ALA A 295 0.674 2.037 -3.121 1.00 0.00 H new ATOM 0 HB3 ALA A 295 2.453 2.014 -3.158 1.00 0.00 H new ATOM 1116 N THR A 296 2.938 5.243 -3.532 1.00 0.00 N ATOM 1117 CA THR A 296 4.068 6.156 -3.526 1.00 0.00 C ATOM 1118 C THR A 296 4.659 6.335 -2.134 1.00 0.00 C ATOM 1119 O THR A 296 3.944 6.567 -1.151 1.00 0.00 O ATOM 1120 CB THR A 296 3.671 7.533 -4.120 1.00 0.00 C ATOM 1121 OG1 THR A 296 3.211 7.359 -5.467 1.00 0.00 O ATOM 1122 CG2 THR A 296 4.831 8.540 -4.098 1.00 0.00 C ATOM 0 H THR A 296 2.310 5.334 -2.734 1.00 0.00 H new ATOM 0 HA THR A 296 4.837 5.707 -4.154 1.00 0.00 H new ATOM 0 HB THR A 296 2.876 7.940 -3.495 1.00 0.00 H new ATOM 0 HG1 THR A 296 2.959 8.229 -5.842 1.00 0.00 H new ATOM 0 HG21 THR A 296 4.499 9.487 -4.525 1.00 0.00 H new ATOM 0 HG22 THR A 296 5.155 8.699 -3.070 1.00 0.00 H new ATOM 0 HG23 THR A 296 5.663 8.149 -4.684 1.00 0.00 H new ATOM 1130 N VAL A 297 5.981 6.229 -2.083 1.00 0.00 N ATOM 1131 CA VAL A 297 6.740 6.338 -0.852 1.00 0.00 C ATOM 1132 C VAL A 297 6.916 7.802 -0.466 1.00 0.00 C ATOM 1133 O VAL A 297 7.193 8.650 -1.315 1.00 0.00 O ATOM 1134 CB VAL A 297 8.123 5.662 -1.003 1.00 0.00 C ATOM 1135 CG1 VAL A 297 8.919 5.749 0.284 1.00 0.00 C ATOM 1136 CG2 VAL A 297 7.965 4.210 -1.433 1.00 0.00 C ATOM 0 H VAL A 297 6.559 6.063 -2.907 1.00 0.00 H new ATOM 0 HA VAL A 297 6.187 5.828 -0.063 1.00 0.00 H new ATOM 0 HB VAL A 297 8.674 6.197 -1.777 1.00 0.00 H new ATOM 0 HG11 VAL A 297 9.886 5.265 0.147 1.00 0.00 H new ATOM 0 HG12 VAL A 297 9.071 6.796 0.548 1.00 0.00 H new ATOM 0 HG13 VAL A 297 8.373 5.249 1.084 1.00 0.00 H new ATOM 0 HG21 VAL A 297 8.949 3.751 -1.534 1.00 0.00 H new ATOM 0 HG22 VAL A 297 7.388 3.669 -0.683 1.00 0.00 H new ATOM 0 HG23 VAL A 297 7.445 4.169 -2.390 1.00 0.00 H new ATOM 1146 N THR A 298 6.734 8.098 0.812 1.00 0.00 N ATOM 1147 CA THR A 298 6.805 9.465 1.297 1.00 0.00 C ATOM 1148 C THR A 298 7.828 9.595 2.436 1.00 0.00 C ATOM 1149 O THR A 298 7.734 10.492 3.279 1.00 0.00 O ATOM 1150 CB THR A 298 5.409 9.934 1.765 1.00 0.00 C ATOM 1151 OG1 THR A 298 4.424 9.495 0.820 1.00 0.00 O ATOM 1152 CG2 THR A 298 5.339 11.451 1.881 1.00 0.00 C ATOM 0 H THR A 298 6.535 7.405 1.534 1.00 0.00 H new ATOM 0 HA THR A 298 7.136 10.103 0.478 1.00 0.00 H new ATOM 0 HB THR A 298 5.220 9.505 2.749 1.00 0.00 H new ATOM 0 HG1 THR A 298 4.186 10.238 0.226 1.00 0.00 H new ATOM 0 HG21 THR A 298 4.343 11.745 2.212 1.00 0.00 H new ATOM 0 HG22 THR A 298 6.078 11.795 2.604 1.00 0.00 H new ATOM 0 HG23 THR A 298 5.545 11.900 0.910 1.00 0.00 H new ATOM 1160 N ALA A 299 8.807 8.691 2.463 1.00 0.00 N ATOM 1161 CA ALA A 299 9.861 8.742 3.473 1.00 0.00 C ATOM 1162 C ALA A 299 11.024 7.835 3.126 1.00 0.00 C ATOM 1163 O ALA A 299 11.004 7.149 2.109 1.00 0.00 O ATOM 1164 CB ALA A 299 9.310 8.392 4.852 1.00 0.00 C ATOM 0 H ALA A 299 8.891 7.920 1.801 1.00 0.00 H new ATOM 0 HA ALA A 299 10.235 9.766 3.493 1.00 0.00 H new ATOM 0 HB1 ALA A 299 10.114 8.437 5.587 1.00 0.00 H new ATOM 0 HB2 ALA A 299 8.530 9.103 5.123 1.00 0.00 H new ATOM 0 HB3 ALA A 299 8.892 7.385 4.832 1.00 0.00 H new ATOM 1170 N ASP A 300 12.038 7.857 3.983 1.00 0.00 N ATOM 1171 CA ASP A 300 13.232 7.063 3.797 1.00 0.00 C ATOM 1172 C ASP A 300 12.917 5.594 3.928 1.00 0.00 C ATOM 1173 O ASP A 300 11.864 5.200 4.437 1.00 0.00 O ATOM 1174 CB ASP A 300 14.308 7.435 4.819 1.00 0.00 C ATOM 1175 CG ASP A 300 14.829 8.846 4.653 1.00 0.00 C ATOM 1176 OD1 ASP A 300 14.560 9.688 5.542 1.00 0.00 O ATOM 1177 OD2 ASP A 300 15.508 9.124 3.642 1.00 0.00 O1- ATOM 0 H ASP A 300 12.049 8.430 4.827 1.00 0.00 H new ATOM 0 HA ASP A 300 13.608 7.269 2.795 1.00 0.00 H new ATOM 0 HB2 ASP A 300 13.900 7.322 5.823 1.00 0.00 H new ATOM 0 HB3 ASP A 300 15.139 6.736 4.732 1.00 0.00 H new ATOM 1182 N ALA A 301 13.856 4.796 3.495 1.00 0.00 N ATOM 1183 CA ALA A 301 13.699 3.356 3.489 1.00 0.00 C ATOM 1184 C ALA A 301 15.034 2.690 3.791 1.00 0.00 C ATOM 1185 O ALA A 301 16.065 3.360 3.842 1.00 0.00 O ATOM 1186 CB ALA A 301 13.136 2.898 2.150 1.00 0.00 C ATOM 0 H ALA A 301 14.754 5.120 3.135 1.00 0.00 H new ATOM 0 HA ALA A 301 12.992 3.062 4.265 1.00 0.00 H new ATOM 0 HB1 ALA A 301 13.022 1.814 2.155 1.00 0.00 H new ATOM 0 HB2 ALA A 301 12.165 3.365 1.985 1.00 0.00 H new ATOM 0 HB3 ALA A 301 13.818 3.187 1.350 1.00 0.00 H new ATOM 1192 N ASN A 302 15.020 1.380 3.997 1.00 0.00 N ATOM 1193 CA ASN A 302 16.218 0.662 4.422 1.00 0.00 C ATOM 1194 C ASN A 302 16.301 -0.703 3.753 1.00 0.00 C ATOM 1195 O ASN A 302 15.352 -1.467 3.819 1.00 0.00 O ATOM 1196 CB ASN A 302 16.192 0.443 5.941 1.00 0.00 C ATOM 1197 CG ASN A 302 16.130 1.732 6.739 1.00 0.00 C ATOM 1198 OD1 ASN A 302 15.047 2.239 7.042 1.00 0.00 O ATOM 1199 ND2 ASN A 302 17.286 2.270 7.089 1.00 0.00 N ATOM 0 H ASN A 302 14.195 0.792 3.878 1.00 0.00 H new ATOM 0 HA ASN A 302 17.080 1.265 4.137 1.00 0.00 H new ATOM 0 HB2 ASN A 302 15.331 -0.174 6.196 1.00 0.00 H new ATOM 0 HB3 ASN A 302 17.082 -0.114 6.235 1.00 0.00 H new ATOM 0 HD21 ASN A 302 17.303 3.135 7.629 1.00 0.00 H new ATOM 0 HD22 ASN A 302 18.161 1.820 6.819 1.00 0.00 H new ATOM 1206 N SER A 303 17.409 -1.015 3.093 1.00 0.00 N ATOM 1207 CA SER A 303 17.644 -2.381 2.658 1.00 0.00 C ATOM 1208 C SER A 303 18.744 -3.001 3.518 1.00 0.00 C ATOM 1209 O SER A 303 19.931 -2.776 3.270 1.00 0.00 O ATOM 1210 CB SER A 303 18.065 -2.387 1.192 1.00 0.00 C ATOM 1211 OG SER A 303 17.573 -1.236 0.522 1.00 0.00 O ATOM 0 H SER A 303 18.146 -0.352 2.852 1.00 0.00 H new ATOM 0 HA SER A 303 16.729 -2.963 2.766 1.00 0.00 H new ATOM 0 HB2 SER A 303 19.152 -2.418 1.121 1.00 0.00 H new ATOM 0 HB3 SER A 303 17.688 -3.286 0.704 1.00 0.00 H new ATOM 0 HG SER A 303 16.593 -1.253 0.519 1.00 0.00 H new ATOM 1217 N ASP A 304 18.363 -3.748 4.545 1.00 0.00 N ATOM 1218 CA ASP A 304 19.344 -4.308 5.468 1.00 0.00 C ATOM 1219 C ASP A 304 19.587 -5.786 5.178 1.00 0.00 C ATOM 1220 O ASP A 304 18.961 -6.353 4.286 1.00 0.00 O ATOM 1221 CB ASP A 304 18.895 -4.126 6.924 1.00 0.00 C ATOM 1222 CG ASP A 304 17.987 -5.242 7.398 1.00 0.00 C ATOM 1223 OD1 ASP A 304 16.877 -5.382 6.860 1.00 0.00 O ATOM 1224 OD2 ASP A 304 18.393 -5.994 8.314 1.00 0.00 O1- ATOM 0 H ASP A 304 17.393 -3.979 4.760 1.00 0.00 H new ATOM 0 HA ASP A 304 20.279 -3.767 5.322 1.00 0.00 H new ATOM 0 HB2 ASP A 304 19.773 -4.079 7.568 1.00 0.00 H new ATOM 0 HB3 ASP A 304 18.375 -3.173 7.024 1.00 0.00 H new ATOM 1229 N SER A 305 20.480 -6.407 5.933 1.00 0.00 N ATOM 1230 CA SER A 305 20.831 -7.804 5.716 1.00 0.00 C ATOM 1231 C SER A 305 19.618 -8.710 5.908 1.00 0.00 C ATOM 1232 O SER A 305 19.465 -9.722 5.218 1.00 0.00 O ATOM 1233 CB SER A 305 21.930 -8.206 6.692 1.00 0.00 C ATOM 1234 OG SER A 305 22.496 -9.460 6.354 1.00 0.00 O ATOM 0 H SER A 305 20.978 -5.964 6.705 1.00 0.00 H new ATOM 0 HA SER A 305 21.183 -7.918 4.691 1.00 0.00 H new ATOM 0 HB2 SER A 305 22.709 -7.444 6.697 1.00 0.00 H new ATOM 0 HB3 SER A 305 21.522 -8.251 7.702 1.00 0.00 H new ATOM 0 HG SER A 305 23.198 -9.687 6.999 1.00 0.00 H new ATOM 1240 N GLY A 306 18.740 -8.319 6.821 1.00 0.00 N ATOM 1241 CA GLY A 306 17.561 -9.106 7.101 1.00 0.00 C ATOM 1242 C GLY A 306 16.462 -8.848 6.101 1.00 0.00 C ATOM 1243 O GLY A 306 15.373 -9.418 6.200 1.00 0.00 O ATOM 0 H GLY A 306 18.826 -7.466 7.374 1.00 0.00 H new ATOM 0 HA2 GLY A 306 17.820 -10.165 7.090 1.00 0.00 H new ATOM 0 HA3 GLY A 306 17.201 -8.876 8.104 1.00 0.00 H new ATOM 1247 N GLY A 307 16.757 -7.994 5.132 1.00 0.00 N ATOM 1248 CA GLY A 307 15.800 -7.682 4.100 1.00 0.00 C ATOM 1249 C GLY A 307 14.524 -7.042 4.623 1.00 0.00 C ATOM 1250 O GLY A 307 13.436 -7.413 4.195 1.00 0.00 O ATOM 0 H GLY A 307 17.651 -7.510 5.045 1.00 0.00 H new ATOM 0 HA2 GLY A 307 16.264 -7.010 3.378 1.00 0.00 H new ATOM 0 HA3 GLY A 307 15.544 -8.597 3.565 1.00 0.00 H new ATOM 1254 N ASP A 308 14.632 -6.114 5.566 1.00 0.00 N ATOM 1255 CA ASP A 308 13.451 -5.396 6.032 1.00 0.00 C ATOM 1256 C ASP A 308 13.539 -3.920 5.651 1.00 0.00 C ATOM 1257 O ASP A 308 14.575 -3.279 5.820 1.00 0.00 O ATOM 1258 CB ASP A 308 13.232 -5.581 7.546 1.00 0.00 C ATOM 1259 CG ASP A 308 13.571 -4.362 8.392 1.00 0.00 C ATOM 1260 OD1 ASP A 308 12.720 -3.458 8.508 1.00 0.00 O ATOM 1261 OD2 ASP A 308 14.671 -4.324 8.985 1.00 0.00 O1- ATOM 0 H ASP A 308 15.507 -5.844 6.016 1.00 0.00 H new ATOM 0 HA ASP A 308 12.579 -5.822 5.535 1.00 0.00 H new ATOM 0 HB2 ASP A 308 12.189 -5.847 7.718 1.00 0.00 H new ATOM 0 HB3 ASP A 308 13.836 -6.422 7.887 1.00 0.00 H new ATOM 1266 N VAL A 309 12.450 -3.408 5.100 1.00 0.00 N ATOM 1267 CA VAL A 309 12.394 -2.022 4.626 1.00 0.00 C ATOM 1268 C VAL A 309 11.066 -1.349 4.990 1.00 0.00 C ATOM 1269 O VAL A 309 10.031 -1.669 4.436 1.00 0.00 O ATOM 1270 CB VAL A 309 12.638 -1.945 3.084 1.00 0.00 C ATOM 1271 CG1 VAL A 309 12.214 -3.228 2.378 1.00 0.00 C ATOM 1272 CG2 VAL A 309 11.932 -0.756 2.439 1.00 0.00 C ATOM 0 H VAL A 309 11.584 -3.930 4.967 1.00 0.00 H new ATOM 0 HA VAL A 309 13.192 -1.479 5.132 1.00 0.00 H new ATOM 0 HB VAL A 309 13.713 -1.811 2.963 1.00 0.00 H new ATOM 0 HG11 VAL A 309 12.400 -3.133 1.308 1.00 0.00 H new ATOM 0 HG12 VAL A 309 12.787 -4.067 2.773 1.00 0.00 H new ATOM 0 HG13 VAL A 309 11.151 -3.402 2.547 1.00 0.00 H new ATOM 0 HG21 VAL A 309 12.135 -0.750 1.368 1.00 0.00 H new ATOM 0 HG22 VAL A 309 10.858 -0.837 2.605 1.00 0.00 H new ATOM 0 HG23 VAL A 309 12.299 0.169 2.883 1.00 0.00 H new ATOM 1282 N THR A 310 11.101 -0.408 5.919 1.00 0.00 N ATOM 1283 CA THR A 310 9.882 0.280 6.343 1.00 0.00 C ATOM 1284 C THR A 310 9.763 1.669 5.704 1.00 0.00 C ATOM 1285 O THR A 310 10.739 2.422 5.663 1.00 0.00 O ATOM 1286 CB THR A 310 9.859 0.434 7.887 1.00 0.00 C ATOM 1287 OG1 THR A 310 9.780 -0.851 8.509 1.00 0.00 O ATOM 1288 CG2 THR A 310 8.703 1.318 8.388 1.00 0.00 C ATOM 0 H THR A 310 11.950 -0.101 6.394 1.00 0.00 H new ATOM 0 HA THR A 310 9.039 -0.328 6.015 1.00 0.00 H new ATOM 0 HB THR A 310 10.789 0.932 8.162 1.00 0.00 H new ATOM 0 HG1 THR A 310 8.915 -0.943 8.961 1.00 0.00 H new ATOM 0 HG21 THR A 310 8.742 1.386 9.475 1.00 0.00 H new ATOM 0 HG22 THR A 310 8.795 2.315 7.958 1.00 0.00 H new ATOM 0 HG23 THR A 310 7.752 0.879 8.086 1.00 0.00 H new ATOM 1296 N VAL A 311 8.564 1.996 5.210 1.00 0.00 N ATOM 1297 CA VAL A 311 8.265 3.342 4.695 1.00 0.00 C ATOM 1298 C VAL A 311 6.818 3.695 4.996 1.00 0.00 C ATOM 1299 O VAL A 311 6.017 2.835 5.347 1.00 0.00 O ATOM 1300 CB VAL A 311 8.460 3.469 3.161 1.00 0.00 C ATOM 1301 CG1 VAL A 311 9.914 3.246 2.755 1.00 0.00 C ATOM 1302 CG2 VAL A 311 7.545 2.489 2.423 1.00 0.00 C ATOM 0 H VAL A 311 7.780 1.346 5.155 1.00 0.00 H new ATOM 0 HA VAL A 311 8.965 4.016 5.190 1.00 0.00 H new ATOM 0 HB VAL A 311 8.191 4.487 2.879 1.00 0.00 H new ATOM 0 HG11 VAL A 311 10.009 3.343 1.674 1.00 0.00 H new ATOM 0 HG12 VAL A 311 10.546 3.988 3.243 1.00 0.00 H new ATOM 0 HG13 VAL A 311 10.227 2.247 3.058 1.00 0.00 H new ATOM 0 HG21 VAL A 311 7.694 2.591 1.348 1.00 0.00 H new ATOM 0 HG22 VAL A 311 7.783 1.470 2.727 1.00 0.00 H new ATOM 0 HG23 VAL A 311 6.505 2.707 2.667 1.00 0.00 H new ATOM 1312 N THR A 312 6.488 4.959 4.868 1.00 0.00 N ATOM 1313 CA THR A 312 5.112 5.382 4.958 1.00 0.00 C ATOM 1314 C THR A 312 4.685 5.986 3.625 1.00 0.00 C ATOM 1315 O THR A 312 5.453 6.707 2.982 1.00 0.00 O ATOM 1316 CB THR A 312 4.930 6.399 6.109 1.00 0.00 C ATOM 1317 OG1 THR A 312 5.166 5.754 7.363 1.00 0.00 O ATOM 1318 CG2 THR A 312 3.540 7.070 6.112 1.00 0.00 C ATOM 0 H THR A 312 7.155 5.712 4.701 1.00 0.00 H new ATOM 0 HA THR A 312 4.482 4.520 5.176 1.00 0.00 H new ATOM 0 HB THR A 312 5.659 7.194 5.950 1.00 0.00 H new ATOM 0 HG1 THR A 312 4.350 5.785 7.905 1.00 0.00 H new ATOM 0 HG21 THR A 312 3.477 7.772 6.944 1.00 0.00 H new ATOM 0 HG22 THR A 312 3.392 7.605 5.174 1.00 0.00 H new ATOM 0 HG23 THR A 312 2.768 6.308 6.221 1.00 0.00 H new ATOM 1326 N LEU A 313 3.475 5.664 3.210 1.00 0.00 N ATOM 1327 CA LEU A 313 2.978 6.045 1.907 1.00 0.00 C ATOM 1328 C LEU A 313 1.858 7.057 2.035 1.00 0.00 C ATOM 1329 O LEU A 313 1.034 6.971 2.945 1.00 0.00 O ATOM 1330 CB LEU A 313 2.484 4.808 1.155 1.00 0.00 C ATOM 1331 CG LEU A 313 3.535 3.707 0.968 1.00 0.00 C ATOM 1332 CD1 LEU A 313 3.598 2.795 2.181 1.00 0.00 C ATOM 1333 CD2 LEU A 313 3.269 2.904 -0.289 1.00 0.00 C ATOM 0 H LEU A 313 2.810 5.130 3.769 1.00 0.00 H new ATOM 0 HA LEU A 313 3.793 6.503 1.347 1.00 0.00 H new ATOM 0 HB2 LEU A 313 1.632 4.390 1.691 1.00 0.00 H new ATOM 0 HB3 LEU A 313 2.123 5.117 0.174 1.00 0.00 H new ATOM 0 HG LEU A 313 4.504 4.195 0.861 1.00 0.00 H new ATOM 0 HD11 LEU A 313 4.352 2.025 2.018 1.00 0.00 H new ATOM 0 HD12 LEU A 313 3.861 3.380 3.063 1.00 0.00 H new ATOM 0 HD13 LEU A 313 2.626 2.325 2.334 1.00 0.00 H new ATOM 0 HD21 LEU A 313 4.030 2.131 -0.395 1.00 0.00 H new ATOM 0 HD22 LEU A 313 2.286 2.438 -0.222 1.00 0.00 H new ATOM 0 HD23 LEU A 313 3.299 3.564 -1.156 1.00 0.00 H new ATOM 1345 N SER A 314 1.837 8.021 1.132 1.00 0.00 N ATOM 1346 CA SER A 314 0.794 9.026 1.132 1.00 0.00 C ATOM 1347 C SER A 314 -0.105 8.838 -0.082 1.00 0.00 C ATOM 1348 O SER A 314 0.367 8.700 -1.216 1.00 0.00 O ATOM 1349 CB SER A 314 1.395 10.432 1.157 1.00 0.00 C ATOM 1350 OG SER A 314 0.390 11.423 1.315 1.00 0.00 O ATOM 0 H SER A 314 2.530 8.128 0.391 1.00 0.00 H new ATOM 0 HA SER A 314 0.191 8.908 2.033 1.00 0.00 H new ATOM 0 HB2 SER A 314 2.114 10.507 1.973 1.00 0.00 H new ATOM 0 HB3 SER A 314 1.943 10.612 0.232 1.00 0.00 H new ATOM 0 HG SER A 314 0.805 12.311 1.329 1.00 0.00 H new ATOM 1632 N VAL A 333 -6.891 -4.377 6.205 1.00 0.00 N ATOM 1633 CA VAL A 333 -5.693 -4.829 5.514 1.00 0.00 C ATOM 1634 C VAL A 333 -4.734 -5.548 6.460 1.00 0.00 C ATOM 1635 O VAL A 333 -4.450 -5.078 7.566 1.00 0.00 O ATOM 1636 CB VAL A 333 -4.962 -3.659 4.820 1.00 0.00 C ATOM 1637 CG1 VAL A 333 -5.813 -3.095 3.691 1.00 0.00 C ATOM 1638 CG2 VAL A 333 -4.613 -2.562 5.818 1.00 0.00 C ATOM 0 HA VAL A 333 -6.022 -5.535 4.751 1.00 0.00 H new ATOM 0 HB VAL A 333 -4.033 -4.044 4.400 1.00 0.00 H new ATOM 0 HG11 VAL A 333 -5.283 -2.271 3.213 1.00 0.00 H new ATOM 0 HG12 VAL A 333 -6.008 -3.877 2.957 1.00 0.00 H new ATOM 0 HG13 VAL A 333 -6.759 -2.733 4.094 1.00 0.00 H new ATOM 0 HG21 VAL A 333 -4.099 -1.751 5.302 1.00 0.00 H new ATOM 0 HG22 VAL A 333 -5.527 -2.181 6.274 1.00 0.00 H new ATOM 0 HG23 VAL A 333 -3.963 -2.968 6.593 1.00 0.00 H new ATOM 1648 N GLU A 334 -4.266 -6.705 6.030 1.00 0.00 N ATOM 1649 CA GLU A 334 -3.288 -7.469 6.778 1.00 0.00 C ATOM 1650 C GLU A 334 -1.974 -7.495 6.015 1.00 0.00 C ATOM 1651 O GLU A 334 -1.787 -6.722 5.082 1.00 0.00 O ATOM 1652 CB GLU A 334 -3.782 -8.900 7.051 1.00 0.00 C ATOM 1653 CG GLU A 334 -4.158 -9.695 5.805 1.00 0.00 C ATOM 1654 CD GLU A 334 -5.507 -9.302 5.239 1.00 0.00 C ATOM 1655 OE1 GLU A 334 -6.528 -9.847 5.703 1.00 0.00 O ATOM 1656 OE2 GLU A 334 -5.550 -8.441 4.342 1.00 0.00 O1- ATOM 0 H GLU A 334 -4.553 -7.140 5.153 1.00 0.00 H new ATOM 0 HA GLU A 334 -3.137 -6.987 7.744 1.00 0.00 H new ATOM 0 HB2 GLU A 334 -3.004 -9.441 7.589 1.00 0.00 H new ATOM 0 HB3 GLU A 334 -4.650 -8.851 7.709 1.00 0.00 H new ATOM 0 HG2 GLU A 334 -3.393 -9.548 5.042 1.00 0.00 H new ATOM 0 HG3 GLU A 334 -4.167 -10.758 6.047 1.00 0.00 H new ATOM 1663 N ALA A 335 -1.064 -8.363 6.419 1.00 0.00 N ATOM 1664 CA ALA A 335 0.191 -8.507 5.706 1.00 0.00 C ATOM 1665 C ALA A 335 0.000 -9.406 4.487 1.00 0.00 C ATOM 1666 O ALA A 335 -0.905 -10.244 4.467 1.00 0.00 O ATOM 1667 CB ALA A 335 1.258 -9.078 6.627 1.00 0.00 C ATOM 0 H ALA A 335 -1.169 -8.973 7.229 1.00 0.00 H new ATOM 0 HA ALA A 335 0.519 -7.524 5.367 1.00 0.00 H new ATOM 0 HB1 ALA A 335 2.195 -9.181 6.079 1.00 0.00 H new ATOM 0 HB2 ALA A 335 1.405 -8.407 7.474 1.00 0.00 H new ATOM 0 HB3 ALA A 335 0.941 -10.056 6.989 1.00 0.00 H new ATOM 1673 N GLY A 336 0.848 -9.248 3.479 1.00 0.00 N ATOM 1674 CA GLY A 336 0.760 -10.107 2.315 1.00 0.00 C ATOM 1675 C GLY A 336 0.733 -9.345 1.003 1.00 0.00 C ATOM 1676 O GLY A 336 0.799 -9.956 -0.068 1.00 0.00 O ATOM 0 H GLY A 336 1.588 -8.547 3.446 1.00 0.00 H new ATOM 0 HA2 GLY A 336 1.609 -10.790 2.312 1.00 0.00 H new ATOM 0 HA3 GLY A 336 -0.140 -10.717 2.391 1.00 0.00 H new ATOM 1680 N ASP A 337 0.619 -8.021 1.076 1.00 0.00 N ATOM 1681 CA ASP A 337 0.710 -7.173 -0.107 1.00 0.00 C ATOM 1682 C ASP A 337 1.979 -7.480 -0.897 1.00 0.00 C ATOM 1683 O ASP A 337 3.043 -7.724 -0.318 1.00 0.00 O ATOM 1684 CB ASP A 337 0.720 -5.699 0.297 1.00 0.00 C ATOM 1685 CG ASP A 337 -0.374 -5.353 1.282 1.00 0.00 C ATOM 1686 OD1 ASP A 337 -1.434 -4.859 0.850 1.00 0.00 O ATOM 1687 OD2 ASP A 337 -0.167 -5.578 2.491 1.00 0.00 O1- ATOM 0 H ASP A 337 0.463 -7.512 1.946 1.00 0.00 H new ATOM 0 HA ASP A 337 -0.159 -7.377 -0.732 1.00 0.00 H new ATOM 0 HB2 ASP A 337 1.688 -5.454 0.735 1.00 0.00 H new ATOM 0 HB3 ASP A 337 0.608 -5.082 -0.595 1.00 0.00 H new ATOM 1692 N ALA A 338 1.866 -7.475 -2.215 1.00 0.00 N ATOM 1693 CA ALA A 338 3.017 -7.725 -3.074 1.00 0.00 C ATOM 1694 C ALA A 338 3.553 -6.405 -3.606 1.00 0.00 C ATOM 1695 O ALA A 338 2.784 -5.559 -4.070 1.00 0.00 O ATOM 1696 CB ALA A 338 2.655 -8.673 -4.211 1.00 0.00 C ATOM 0 H ALA A 338 0.994 -7.302 -2.714 1.00 0.00 H new ATOM 0 HA ALA A 338 3.798 -8.208 -2.487 1.00 0.00 H new ATOM 0 HB1 ALA A 338 3.531 -8.842 -4.836 1.00 0.00 H new ATOM 0 HB2 ALA A 338 2.315 -9.623 -3.798 1.00 0.00 H new ATOM 0 HB3 ALA A 338 1.860 -8.233 -4.812 1.00 0.00 H new ATOM 1702 N VAL A 339 4.863 -6.218 -3.527 1.00 0.00 N ATOM 1703 CA VAL A 339 5.457 -4.928 -3.824 1.00 0.00 C ATOM 1704 C VAL A 339 6.464 -5.011 -4.970 1.00 0.00 C ATOM 1705 O VAL A 339 7.215 -5.978 -5.097 1.00 0.00 O ATOM 1706 CB VAL A 339 6.155 -4.356 -2.562 1.00 0.00 C ATOM 1707 CG1 VAL A 339 6.852 -3.036 -2.869 1.00 0.00 C ATOM 1708 CG2 VAL A 339 5.137 -4.154 -1.453 1.00 0.00 C ATOM 0 H VAL A 339 5.530 -6.942 -3.261 1.00 0.00 H new ATOM 0 HA VAL A 339 4.649 -4.265 -4.133 1.00 0.00 H new ATOM 0 HB VAL A 339 6.909 -5.073 -2.238 1.00 0.00 H new ATOM 0 HG11 VAL A 339 7.332 -2.659 -1.966 1.00 0.00 H new ATOM 0 HG12 VAL A 339 7.605 -3.193 -3.642 1.00 0.00 H new ATOM 0 HG13 VAL A 339 6.118 -2.310 -3.220 1.00 0.00 H new ATOM 0 HG21 VAL A 339 5.635 -3.752 -0.571 1.00 0.00 H new ATOM 0 HG22 VAL A 339 4.370 -3.455 -1.786 1.00 0.00 H new ATOM 0 HG23 VAL A 339 4.675 -5.109 -1.205 1.00 0.00 H new ATOM 1718 N SER A 340 6.438 -4.000 -5.820 1.00 0.00 N ATOM 1719 CA SER A 340 7.440 -3.816 -6.853 1.00 0.00 C ATOM 1720 C SER A 340 7.750 -2.325 -6.971 1.00 0.00 C ATOM 1721 O SER A 340 7.033 -1.505 -6.412 1.00 0.00 O ATOM 1722 CB SER A 340 6.938 -4.380 -8.183 1.00 0.00 C ATOM 1723 OG SER A 340 6.550 -5.739 -8.043 1.00 0.00 O ATOM 0 H SER A 340 5.716 -3.279 -5.812 1.00 0.00 H new ATOM 0 HA SER A 340 8.352 -4.353 -6.591 1.00 0.00 H new ATOM 0 HB2 SER A 340 6.092 -3.791 -8.536 1.00 0.00 H new ATOM 0 HB3 SER A 340 7.721 -4.297 -8.937 1.00 0.00 H new ATOM 0 HG SER A 340 6.231 -6.079 -8.905 1.00 0.00 H new ATOM 1729 N VAL A 341 8.812 -1.971 -7.676 1.00 0.00 N ATOM 1730 CA VAL A 341 9.234 -0.575 -7.760 1.00 0.00 C ATOM 1731 C VAL A 341 9.136 -0.056 -9.192 1.00 0.00 C ATOM 1732 O VAL A 341 9.431 -0.778 -10.143 1.00 0.00 O ATOM 1733 CB VAL A 341 10.687 -0.412 -7.258 1.00 0.00 C ATOM 1734 CG1 VAL A 341 11.115 1.047 -7.272 1.00 0.00 C ATOM 1735 CG2 VAL A 341 10.851 -1.001 -5.866 1.00 0.00 C ATOM 0 H VAL A 341 9.397 -2.624 -8.197 1.00 0.00 H new ATOM 0 HA VAL A 341 8.565 0.007 -7.126 1.00 0.00 H new ATOM 0 HB VAL A 341 11.334 -0.961 -7.942 1.00 0.00 H new ATOM 0 HG11 VAL A 341 12.141 1.129 -6.914 1.00 0.00 H new ATOM 0 HG12 VAL A 341 11.054 1.434 -8.289 1.00 0.00 H new ATOM 0 HG13 VAL A 341 10.457 1.625 -6.623 1.00 0.00 H new ATOM 0 HG21 VAL A 341 11.882 -0.873 -5.536 1.00 0.00 H new ATOM 0 HG22 VAL A 341 10.182 -0.490 -5.173 1.00 0.00 H new ATOM 0 HG23 VAL A 341 10.606 -2.063 -5.889 1.00 0.00 H new ATOM 1745 N VAL A 342 8.693 1.195 -9.332 1.00 0.00 N ATOM 1746 CA VAL A 342 8.633 1.854 -10.633 1.00 0.00 C ATOM 1747 C VAL A 342 10.007 2.400 -11.013 1.00 0.00 C ATOM 1748 O VAL A 342 10.404 2.364 -12.177 1.00 0.00 O ATOM 1749 CB VAL A 342 7.605 3.014 -10.640 1.00 0.00 C ATOM 1750 CG1 VAL A 342 7.679 3.804 -11.942 1.00 0.00 C ATOM 1751 CG2 VAL A 342 6.194 2.481 -10.439 1.00 0.00 C ATOM 0 H VAL A 342 8.370 1.772 -8.555 1.00 0.00 H new ATOM 0 HA VAL A 342 8.316 1.107 -11.361 1.00 0.00 H new ATOM 0 HB VAL A 342 7.853 3.682 -9.815 1.00 0.00 H new ATOM 0 HG11 VAL A 342 6.947 4.611 -11.920 1.00 0.00 H new ATOM 0 HG12 VAL A 342 8.679 4.223 -12.057 1.00 0.00 H new ATOM 0 HG13 VAL A 342 7.464 3.143 -12.781 1.00 0.00 H new ATOM 0 HG21 VAL A 342 5.487 3.311 -10.447 1.00 0.00 H new ATOM 0 HG22 VAL A 342 5.949 1.788 -11.244 1.00 0.00 H new ATOM 0 HG23 VAL A 342 6.134 1.962 -9.482 1.00 0.00 H new