USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=29 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 250 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 310 THR OG1 : rot 180:sc= -1.68! USER MOD Set 2.1: A 248 THR OG1 : rot 180:sc= -0.602! USER MOD Set 2.2: A 312 THR OG1 : rot -125:sc= 0.568 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+ -170:sc= 0 (180deg=-0.0605) USER MOD Single : A 232 THR OG1 : rot 153:sc= 1.09 USER MOD Single : A 233 GLN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 235 THR OG1 : rot 180:sc= 0 USER MOD Single : A 237 THR OG1 : rot 180:sc= 0 USER MOD Single : A 238 TYR OH : rot 180:sc= 0 USER MOD Single : A 239 ASN : amide:sc= -0.827 K(o=-0.83,f=-2.7) USER MOD Single : A 242 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 244 SER OG : rot 180:sc=-0.00304 USER MOD Single : A 245 TYR OH : rot 180:sc= -1.23 USER MOD Single : A 246 GLN : amide:sc= -2.43 X(o=-2.4,f=-2.1) USER MOD Single : A 252 THR OG1 : rot 180:sc= 0 USER MOD Single : A 255 THR OG1 : rot 116:sc= 0.801 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+ 170:sc= 1.27 (180deg=1.16) USER MOD Single : A 267 GLN :FLIP amide:sc=-0.000598 F(o=-1.8,f=-0.0006) USER MOD Single : A 269 LYS NZ :NH3+ -157:sc= -0.105 (180deg=-0.521) USER MOD Single : A 271 THR OG1 : rot 41:sc= 0.385 USER MOD Single : A 272 ASN : amide:sc= -0.182 K(o=-0.18,f=-3.8!) USER MOD Single : A 292 SER OG : rot 40:sc= -0.435 USER MOD Single : A 294 THR OG1 : rot 180:sc= 0 USER MOD Single : A 296 THR OG1 : rot 180:sc= 0 USER MOD Single : A 298 THR OG1 : rot -42:sc= 0.796 USER MOD Single : A 302 ASN : amide:sc= -0.151 K(o=-0.15,f=-1.9) USER MOD Single : A 303 SER OG : rot 63:sc= 0.943 USER MOD Single : A 305 SER OG : rot 180:sc= 0.17 USER MOD Single : A 314 SER OG : rot 180:sc= -0.289 USER MOD Single : A 340 SER OG : rot 180:sc= -0.0133 USER MOD ----------------------------------------------------------------- ATOM 47 N GLY A 226 12.642 -4.331 -8.668 1.00 0.00 N ATOM 48 CA GLY A 226 12.674 -5.639 -8.047 1.00 0.00 C ATOM 49 C GLY A 226 11.477 -5.893 -7.158 1.00 0.00 C ATOM 50 O GLY A 226 10.811 -4.956 -6.715 1.00 0.00 O ATOM 0 HA2 GLY A 226 12.714 -6.404 -8.823 1.00 0.00 H new ATOM 0 HA3 GLY A 226 13.586 -5.735 -7.458 1.00 0.00 H new ATOM 54 N THR A 227 11.208 -7.162 -6.904 1.00 0.00 N ATOM 55 CA THR A 227 10.096 -7.565 -6.060 1.00 0.00 C ATOM 56 C THR A 227 10.459 -7.407 -4.587 1.00 0.00 C ATOM 57 O THR A 227 11.584 -7.698 -4.180 1.00 0.00 O ATOM 58 CB THR A 227 9.733 -9.034 -6.323 1.00 0.00 C ATOM 59 OG1 THR A 227 9.680 -9.274 -7.737 1.00 0.00 O ATOM 60 CG2 THR A 227 8.393 -9.400 -5.695 1.00 0.00 C ATOM 0 H THR A 227 11.752 -7.940 -7.276 1.00 0.00 H new ATOM 0 HA THR A 227 9.245 -6.926 -6.297 1.00 0.00 H new ATOM 0 HB THR A 227 10.503 -9.656 -5.867 1.00 0.00 H new ATOM 0 HG1 THR A 227 9.450 -10.212 -7.901 1.00 0.00 H new ATOM 0 HG21 THR A 227 8.168 -10.446 -5.901 1.00 0.00 H new ATOM 0 HG22 THR A 227 8.442 -9.245 -4.617 1.00 0.00 H new ATOM 0 HG23 THR A 227 7.609 -8.771 -6.117 1.00 0.00 H new ATOM 68 N LEU A 228 9.510 -6.938 -3.798 1.00 0.00 N ATOM 69 CA LEU A 228 9.697 -6.799 -2.366 1.00 0.00 C ATOM 70 C LEU A 228 8.485 -7.384 -1.645 1.00 0.00 C ATOM 71 O LEU A 228 7.539 -7.836 -2.288 1.00 0.00 O ATOM 72 CB LEU A 228 9.899 -5.324 -2.000 1.00 0.00 C ATOM 73 CG LEU A 228 11.097 -4.634 -2.711 1.00 0.00 C ATOM 74 CD1 LEU A 228 10.593 -3.615 -3.722 1.00 0.00 C ATOM 75 CD2 LEU A 228 12.036 -3.945 -1.729 1.00 0.00 C ATOM 0 H LEU A 228 8.592 -6.644 -4.130 1.00 0.00 H new ATOM 0 HA LEU A 228 10.588 -7.344 -2.055 1.00 0.00 H new ATOM 0 HB2 LEU A 228 8.988 -4.776 -2.240 1.00 0.00 H new ATOM 0 HB3 LEU A 228 10.042 -5.248 -0.922 1.00 0.00 H new ATOM 0 HG LEU A 228 11.659 -5.419 -3.217 1.00 0.00 H new ATOM 0 HD11 LEU A 228 11.442 -3.139 -4.213 1.00 0.00 H new ATOM 0 HD12 LEU A 228 9.977 -4.117 -4.468 1.00 0.00 H new ATOM 0 HD13 LEU A 228 9.999 -2.858 -3.210 1.00 0.00 H new ATOM 0 HD21 LEU A 228 12.856 -3.479 -2.276 1.00 0.00 H new ATOM 0 HD22 LEU A 228 11.488 -3.182 -1.176 1.00 0.00 H new ATOM 0 HD23 LEU A 228 12.437 -4.681 -1.032 1.00 0.00 H new ATOM 87 N THR A 229 8.510 -7.389 -0.325 1.00 0.00 N ATOM 88 CA THR A 229 7.458 -8.019 0.454 1.00 0.00 C ATOM 89 C THR A 229 6.916 -7.057 1.518 1.00 0.00 C ATOM 90 O THR A 229 7.574 -6.079 1.873 1.00 0.00 O ATOM 91 CB THR A 229 8.023 -9.291 1.115 1.00 0.00 C ATOM 92 OG1 THR A 229 8.542 -10.162 0.101 1.00 0.00 O ATOM 93 CG2 THR A 229 6.987 -10.045 1.943 1.00 0.00 C ATOM 0 H THR A 229 9.250 -6.962 0.233 1.00 0.00 H new ATOM 0 HA THR A 229 6.630 -8.283 -0.204 1.00 0.00 H new ATOM 0 HB THR A 229 8.810 -8.973 1.798 1.00 0.00 H new ATOM 0 HG1 THR A 229 8.904 -10.971 0.519 1.00 0.00 H new ATOM 0 HG21 THR A 229 7.447 -10.931 2.382 1.00 0.00 H new ATOM 0 HG22 THR A 229 6.615 -9.398 2.737 1.00 0.00 H new ATOM 0 HG23 THR A 229 6.158 -10.346 1.302 1.00 0.00 H new ATOM 101 N VAL A 230 5.717 -7.335 2.007 1.00 0.00 N ATOM 102 CA VAL A 230 5.074 -6.524 3.035 1.00 0.00 C ATOM 103 C VAL A 230 5.030 -7.310 4.339 1.00 0.00 C ATOM 104 O VAL A 230 4.755 -8.509 4.325 1.00 0.00 O ATOM 105 CB VAL A 230 3.628 -6.144 2.639 1.00 0.00 C ATOM 106 CG1 VAL A 230 3.013 -5.211 3.670 1.00 0.00 C ATOM 107 CG2 VAL A 230 3.590 -5.497 1.264 1.00 0.00 C ATOM 0 H VAL A 230 5.159 -8.132 1.702 1.00 0.00 H new ATOM 0 HA VAL A 230 5.654 -5.608 3.151 1.00 0.00 H new ATOM 0 HB VAL A 230 3.043 -7.063 2.605 1.00 0.00 H new ATOM 0 HG11 VAL A 230 1.996 -4.957 3.370 1.00 0.00 H new ATOM 0 HG12 VAL A 230 2.993 -5.705 4.641 1.00 0.00 H new ATOM 0 HG13 VAL A 230 3.609 -4.301 3.738 1.00 0.00 H new ATOM 0 HG21 VAL A 230 2.561 -5.240 1.011 1.00 0.00 H new ATOM 0 HG22 VAL A 230 4.199 -4.593 1.270 1.00 0.00 H new ATOM 0 HG23 VAL A 230 3.983 -6.193 0.523 1.00 0.00 H new ATOM 117 N LYS A 231 5.305 -6.655 5.458 1.00 0.00 N ATOM 118 CA LYS A 231 5.312 -7.351 6.735 1.00 0.00 C ATOM 119 C LYS A 231 4.150 -6.902 7.621 1.00 0.00 C ATOM 120 O LYS A 231 3.583 -7.705 8.359 1.00 0.00 O ATOM 121 CB LYS A 231 6.641 -7.140 7.457 1.00 0.00 C ATOM 122 CG LYS A 231 6.952 -8.237 8.457 1.00 0.00 C ATOM 123 CD LYS A 231 8.281 -8.011 9.152 1.00 0.00 C ATOM 124 CE LYS A 231 8.733 -9.262 9.887 1.00 0.00 C ATOM 125 NZ LYS A 231 7.719 -9.732 10.869 1.00 0.00 N1+ ATOM 0 H LYS A 231 5.523 -5.660 5.508 1.00 0.00 H new ATOM 0 HA LYS A 231 5.189 -8.415 6.531 1.00 0.00 H new ATOM 0 HB2 LYS A 231 7.444 -7.088 6.721 1.00 0.00 H new ATOM 0 HB3 LYS A 231 6.619 -6.180 7.973 1.00 0.00 H new ATOM 0 HG2 LYS A 231 6.157 -8.285 9.201 1.00 0.00 H new ATOM 0 HG3 LYS A 231 6.969 -9.200 7.946 1.00 0.00 H new ATOM 0 HD2 LYS A 231 9.034 -7.724 8.418 1.00 0.00 H new ATOM 0 HD3 LYS A 231 8.191 -7.184 9.856 1.00 0.00 H new ATOM 0 HE2 LYS A 231 8.932 -10.054 9.165 1.00 0.00 H new ATOM 0 HE3 LYS A 231 9.671 -9.059 10.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 231 8.132 -10.479 11.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 231 7.422 -8.936 11.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 231 6.894 -10.110 10.362 1.00 0.00 H new ATOM 139 N THR A 232 3.782 -5.629 7.536 1.00 0.00 N ATOM 140 CA THR A 232 2.691 -5.106 8.350 1.00 0.00 C ATOM 141 C THR A 232 1.573 -4.563 7.462 1.00 0.00 C ATOM 142 O THR A 232 1.579 -4.775 6.254 1.00 0.00 O ATOM 143 CB THR A 232 3.176 -4.017 9.328 1.00 0.00 C ATOM 144 OG1 THR A 232 3.779 -2.931 8.620 1.00 0.00 O ATOM 145 CG2 THR A 232 4.171 -4.592 10.327 1.00 0.00 C ATOM 0 H THR A 232 4.218 -4.945 6.918 1.00 0.00 H new ATOM 0 HA THR A 232 2.302 -5.933 8.944 1.00 0.00 H new ATOM 0 HB THR A 232 2.306 -3.646 9.870 1.00 0.00 H new ATOM 0 HG1 THR A 232 3.688 -2.108 9.144 1.00 0.00 H new ATOM 0 HG21 THR A 232 4.500 -3.806 11.007 1.00 0.00 H new ATOM 0 HG22 THR A 232 3.694 -5.389 10.897 1.00 0.00 H new ATOM 0 HG23 THR A 232 5.032 -4.993 9.793 1.00 0.00 H new ATOM 153 N GLN A 233 0.620 -3.866 8.059 1.00 0.00 N ATOM 154 CA GLN A 233 -0.620 -3.532 7.369 1.00 0.00 C ATOM 155 C GLN A 233 -0.723 -2.035 7.114 1.00 0.00 C ATOM 156 O GLN A 233 -0.677 -1.237 8.050 1.00 0.00 O ATOM 157 CB GLN A 233 -1.833 -3.995 8.189 1.00 0.00 C ATOM 158 CG GLN A 233 -1.836 -5.479 8.536 1.00 0.00 C ATOM 159 CD GLN A 233 -3.021 -5.880 9.393 1.00 0.00 C ATOM 160 OE1 GLN A 233 -3.542 -5.084 10.178 1.00 0.00 O ATOM 161 NE2 GLN A 233 -3.458 -7.121 9.253 1.00 0.00 N ATOM 0 H GLN A 233 0.679 -3.520 9.017 1.00 0.00 H new ATOM 0 HA GLN A 233 -0.612 -4.049 6.410 1.00 0.00 H new ATOM 0 HB2 GLN A 233 -1.871 -3.419 9.114 1.00 0.00 H new ATOM 0 HB3 GLN A 233 -2.741 -3.764 7.632 1.00 0.00 H new ATOM 0 HG2 GLN A 233 -1.845 -6.063 7.615 1.00 0.00 H new ATOM 0 HG3 GLN A 233 -0.913 -5.726 9.061 1.00 0.00 H new ATOM 0 HE21 GLN A 233 -3.002 -7.751 8.593 1.00 0.00 H new ATOM 0 HE22 GLN A 233 -4.251 -7.448 9.805 1.00 0.00 H new ATOM 170 N PRO A 234 -0.836 -1.645 5.835 1.00 0.00 N ATOM 171 CA PRO A 234 -1.049 -0.248 5.437 1.00 0.00 C ATOM 172 C PRO A 234 -2.214 0.420 6.171 1.00 0.00 C ATOM 173 O PRO A 234 -3.377 0.196 5.838 1.00 0.00 O ATOM 174 CB PRO A 234 -1.396 -0.374 3.950 1.00 0.00 C ATOM 175 CG PRO A 234 -0.693 -1.603 3.498 1.00 0.00 C ATOM 176 CD PRO A 234 -0.714 -2.543 4.668 1.00 0.00 C ATOM 0 HA PRO A 234 -0.179 0.369 5.664 1.00 0.00 H new ATOM 0 HB2 PRO A 234 -2.473 -0.457 3.801 1.00 0.00 H new ATOM 0 HB3 PRO A 234 -1.063 0.500 3.391 1.00 0.00 H new ATOM 0 HG2 PRO A 234 -1.192 -2.043 2.634 1.00 0.00 H new ATOM 0 HG3 PRO A 234 0.330 -1.379 3.195 1.00 0.00 H new ATOM 0 HD2 PRO A 234 -1.551 -3.238 4.608 1.00 0.00 H new ATOM 0 HD3 PRO A 234 0.195 -3.142 4.717 1.00 0.00 H new ATOM 184 N THR A 235 -1.899 1.251 7.162 1.00 0.00 N ATOM 185 CA THR A 235 -2.927 2.020 7.849 1.00 0.00 C ATOM 186 C THR A 235 -2.356 3.262 8.553 1.00 0.00 C ATOM 187 O THR A 235 -1.548 3.140 9.472 1.00 0.00 O ATOM 188 CB THR A 235 -3.693 1.122 8.852 1.00 0.00 C ATOM 189 OG1 THR A 235 -4.743 1.860 9.487 1.00 0.00 O ATOM 190 CG2 THR A 235 -2.767 0.527 9.914 1.00 0.00 C ATOM 0 H THR A 235 -0.950 1.406 7.503 1.00 0.00 H new ATOM 0 HA THR A 235 -3.624 2.379 7.092 1.00 0.00 H new ATOM 0 HB THR A 235 -4.121 0.298 8.280 1.00 0.00 H new ATOM 0 HG1 THR A 235 -5.218 1.278 10.116 1.00 0.00 H new ATOM 0 HG21 THR A 235 -3.347 -0.095 10.595 1.00 0.00 H new ATOM 0 HG22 THR A 235 -2.002 -0.080 9.431 1.00 0.00 H new ATOM 0 HG23 THR A 235 -2.291 1.332 10.474 1.00 0.00 H new ATOM 198 N VAL A 236 -2.742 4.454 8.080 1.00 0.00 N ATOM 199 CA VAL A 236 -2.463 5.713 8.786 1.00 0.00 C ATOM 200 C VAL A 236 -3.496 6.781 8.425 1.00 0.00 C ATOM 201 O VAL A 236 -3.699 7.089 7.262 1.00 0.00 O ATOM 202 CB VAL A 236 -1.041 6.280 8.517 1.00 0.00 C ATOM 203 CG1 VAL A 236 -0.973 7.768 8.838 1.00 0.00 C ATOM 204 CG2 VAL A 236 -0.007 5.556 9.356 1.00 0.00 C ATOM 0 H VAL A 236 -3.252 4.574 7.205 1.00 0.00 H new ATOM 0 HA VAL A 236 -2.522 5.466 9.846 1.00 0.00 H new ATOM 0 HB VAL A 236 -0.829 6.129 7.459 1.00 0.00 H new ATOM 0 HG11 VAL A 236 0.033 8.137 8.640 1.00 0.00 H new ATOM 0 HG12 VAL A 236 -1.686 8.308 8.215 1.00 0.00 H new ATOM 0 HG13 VAL A 236 -1.217 7.925 9.889 1.00 0.00 H new ATOM 0 HG21 VAL A 236 0.981 5.969 9.152 1.00 0.00 H new ATOM 0 HG22 VAL A 236 -0.242 5.683 10.413 1.00 0.00 H new ATOM 0 HG23 VAL A 236 -0.015 4.495 9.108 1.00 0.00 H new ATOM 214 N THR A 237 -4.127 7.332 9.447 1.00 0.00 N ATOM 215 CA THR A 237 -5.104 8.407 9.314 1.00 0.00 C ATOM 216 C THR A 237 -6.138 8.106 8.233 1.00 0.00 C ATOM 217 O THR A 237 -5.965 8.461 7.065 1.00 0.00 O ATOM 218 CB THR A 237 -4.409 9.751 9.015 1.00 0.00 C ATOM 219 OG1 THR A 237 -3.373 9.987 9.981 1.00 0.00 O ATOM 220 CG2 THR A 237 -5.404 10.903 9.050 1.00 0.00 C ATOM 0 H THR A 237 -3.974 7.042 10.413 1.00 0.00 H new ATOM 0 HA THR A 237 -5.625 8.481 10.269 1.00 0.00 H new ATOM 0 HB THR A 237 -3.979 9.695 8.015 1.00 0.00 H new ATOM 0 HG1 THR A 237 -2.933 10.841 9.787 1.00 0.00 H new ATOM 0 HG21 THR A 237 -4.886 11.838 8.836 1.00 0.00 H new ATOM 0 HG22 THR A 237 -6.179 10.738 8.301 1.00 0.00 H new ATOM 0 HG23 THR A 237 -5.861 10.959 10.038 1.00 0.00 H new ATOM 228 N TYR A 238 -7.215 7.456 8.630 1.00 0.00 N ATOM 229 CA TYR A 238 -8.283 7.143 7.703 1.00 0.00 C ATOM 230 C TYR A 238 -9.410 8.151 7.837 1.00 0.00 C ATOM 231 O TYR A 238 -10.340 7.957 8.624 1.00 0.00 O ATOM 232 CB TYR A 238 -8.825 5.723 7.947 1.00 0.00 C ATOM 233 CG TYR A 238 -8.366 4.690 6.951 1.00 0.00 C ATOM 234 CD1 TYR A 238 -9.294 3.968 6.218 1.00 0.00 C ATOM 235 CD2 TYR A 238 -7.019 4.419 6.756 1.00 0.00 C ATOM 236 CE1 TYR A 238 -8.898 3.002 5.323 1.00 0.00 C ATOM 237 CE2 TYR A 238 -6.612 3.456 5.855 1.00 0.00 C ATOM 238 CZ TYR A 238 -7.556 2.746 5.141 1.00 0.00 C ATOM 239 OH TYR A 238 -7.155 1.770 4.252 1.00 0.00 O ATOM 0 H TYR A 238 -7.373 7.136 9.585 1.00 0.00 H new ATOM 0 HA TYR A 238 -7.876 7.191 6.693 1.00 0.00 H new ATOM 0 HB2 TYR A 238 -8.527 5.402 8.945 1.00 0.00 H new ATOM 0 HB3 TYR A 238 -9.914 5.759 7.936 1.00 0.00 H new ATOM 0 HD1 TYR A 238 -10.347 4.167 6.352 1.00 0.00 H new ATOM 0 HD2 TYR A 238 -6.279 4.970 7.317 1.00 0.00 H new ATOM 0 HE1 TYR A 238 -9.636 2.446 4.764 1.00 0.00 H new ATOM 0 HE2 TYR A 238 -5.560 3.259 5.709 1.00 0.00 H new ATOM 0 HH TYR A 238 -6.176 1.718 4.243 1.00 0.00 H new ATOM 249 N ASN A 239 -9.326 9.232 7.083 1.00 0.00 N ATOM 250 CA ASN A 239 -10.390 10.213 7.065 1.00 0.00 C ATOM 251 C ASN A 239 -11.068 10.164 5.707 1.00 0.00 C ATOM 252 O ASN A 239 -10.461 10.468 4.689 1.00 0.00 O ATOM 253 CB ASN A 239 -9.857 11.615 7.357 1.00 0.00 C ATOM 254 CG ASN A 239 -10.896 12.472 8.049 1.00 0.00 C ATOM 255 OD1 ASN A 239 -12.096 12.273 7.864 1.00 0.00 O ATOM 256 ND2 ASN A 239 -10.448 13.421 8.855 1.00 0.00 N ATOM 0 H ASN A 239 -8.534 9.450 6.478 1.00 0.00 H new ATOM 0 HA ASN A 239 -11.112 9.978 7.847 1.00 0.00 H new ATOM 0 HB2 ASN A 239 -8.967 11.544 7.983 1.00 0.00 H new ATOM 0 HB3 ASN A 239 -9.554 12.091 6.425 1.00 0.00 H new ATOM 0 HD21 ASN A 239 -11.106 14.021 9.351 1.00 0.00 H new ATOM 0 HD22 ASN A 239 -9.444 13.552 8.980 1.00 0.00 H new ATOM 263 N ALA A 240 -12.320 9.771 5.699 1.00 0.00 N ATOM 264 CA ALA A 240 -13.004 9.440 4.459 1.00 0.00 C ATOM 265 C ALA A 240 -13.788 10.614 3.904 1.00 0.00 C ATOM 266 O ALA A 240 -13.646 10.963 2.732 1.00 0.00 O ATOM 267 CB ALA A 240 -13.914 8.252 4.677 1.00 0.00 C ATOM 0 H ALA A 240 -12.892 9.671 6.537 1.00 0.00 H new ATOM 0 HA ALA A 240 -12.244 9.187 3.720 1.00 0.00 H new ATOM 0 HB1 ALA A 240 -14.424 8.008 3.745 1.00 0.00 H new ATOM 0 HB2 ALA A 240 -13.323 7.396 5.002 1.00 0.00 H new ATOM 0 HB3 ALA A 240 -14.652 8.494 5.442 1.00 0.00 H new ATOM 273 N VAL A 241 -14.603 11.233 4.744 1.00 0.00 N ATOM 274 CA VAL A 241 -15.421 12.362 4.318 1.00 0.00 C ATOM 275 C VAL A 241 -14.529 13.546 3.942 1.00 0.00 C ATOM 276 O VAL A 241 -14.917 14.418 3.161 1.00 0.00 O ATOM 277 CB VAL A 241 -16.424 12.778 5.422 1.00 0.00 C ATOM 278 CG1 VAL A 241 -17.325 13.919 4.957 1.00 0.00 C ATOM 279 CG2 VAL A 241 -17.265 11.586 5.854 1.00 0.00 C ATOM 0 H VAL A 241 -14.717 10.974 5.724 1.00 0.00 H new ATOM 0 HA VAL A 241 -15.993 12.053 3.443 1.00 0.00 H new ATOM 0 HB VAL A 241 -15.847 13.133 6.276 1.00 0.00 H new ATOM 0 HG11 VAL A 241 -18.016 14.186 5.756 1.00 0.00 H new ATOM 0 HG12 VAL A 241 -16.714 14.785 4.702 1.00 0.00 H new ATOM 0 HG13 VAL A 241 -17.889 13.603 4.080 1.00 0.00 H new ATOM 0 HG21 VAL A 241 -17.964 11.896 6.630 1.00 0.00 H new ATOM 0 HG22 VAL A 241 -17.820 11.203 4.998 1.00 0.00 H new ATOM 0 HG23 VAL A 241 -16.614 10.804 6.244 1.00 0.00 H new ATOM 289 N LYS A 242 -13.321 13.552 4.489 1.00 0.00 N ATOM 290 CA LYS A 242 -12.353 14.602 4.202 1.00 0.00 C ATOM 291 C LYS A 242 -11.406 14.157 3.097 1.00 0.00 C ATOM 292 O LYS A 242 -10.610 14.942 2.581 1.00 0.00 O ATOM 293 CB LYS A 242 -11.565 14.942 5.465 1.00 0.00 C ATOM 294 CG LYS A 242 -12.449 15.060 6.689 1.00 0.00 C ATOM 295 CD LYS A 242 -13.382 16.250 6.603 1.00 0.00 C ATOM 296 CE LYS A 242 -14.559 16.080 7.544 1.00 0.00 C ATOM 297 NZ LYS A 242 -15.427 17.286 7.582 1.00 0.00 N1+ ATOM 0 H LYS A 242 -12.987 12.838 5.137 1.00 0.00 H new ATOM 0 HA LYS A 242 -12.886 15.492 3.867 1.00 0.00 H new ATOM 0 HB2 LYS A 242 -10.813 14.172 5.638 1.00 0.00 H new ATOM 0 HB3 LYS A 242 -11.032 15.881 5.315 1.00 0.00 H new ATOM 0 HG2 LYS A 242 -13.035 14.148 6.802 1.00 0.00 H new ATOM 0 HG3 LYS A 242 -11.826 15.151 7.579 1.00 0.00 H new ATOM 0 HD2 LYS A 242 -12.840 17.162 6.853 1.00 0.00 H new ATOM 0 HD3 LYS A 242 -13.742 16.363 5.580 1.00 0.00 H new ATOM 0 HE2 LYS A 242 -15.150 15.219 7.232 1.00 0.00 H new ATOM 0 HE3 LYS A 242 -14.191 15.867 8.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 242 -16.218 17.124 8.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 242 -14.871 18.104 7.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 242 -15.800 17.475 6.630 1.00 0.00 H new ATOM 311 N ASP A 243 -11.528 12.877 2.750 1.00 0.00 N ATOM 312 CA ASP A 243 -10.688 12.229 1.736 1.00 0.00 C ATOM 313 C ASP A 243 -9.210 12.385 2.072 1.00 0.00 C ATOM 314 O ASP A 243 -8.474 13.120 1.416 1.00 0.00 O ATOM 315 CB ASP A 243 -10.980 12.775 0.334 1.00 0.00 C ATOM 316 CG ASP A 243 -10.386 11.905 -0.758 1.00 0.00 C ATOM 317 OD1 ASP A 243 -9.323 12.262 -1.308 1.00 0.00 O ATOM 318 OD2 ASP A 243 -10.986 10.854 -1.076 1.00 0.00 O1- ATOM 0 H ASP A 243 -12.218 12.252 3.167 1.00 0.00 H new ATOM 0 HA ASP A 243 -10.932 11.167 1.740 1.00 0.00 H new ATOM 0 HB2 ASP A 243 -12.058 12.847 0.192 1.00 0.00 H new ATOM 0 HB3 ASP A 243 -10.579 13.785 0.249 1.00 0.00 H new ATOM 323 N SER A 244 -8.790 11.704 3.121 1.00 0.00 N ATOM 324 CA SER A 244 -7.406 11.744 3.561 1.00 0.00 C ATOM 325 C SER A 244 -7.001 10.385 4.115 1.00 0.00 C ATOM 326 O SER A 244 -7.406 10.008 5.214 1.00 0.00 O ATOM 327 CB SER A 244 -7.222 12.829 4.627 1.00 0.00 C ATOM 328 OG SER A 244 -7.716 14.078 4.170 1.00 0.00 O ATOM 0 H SER A 244 -9.393 11.110 3.690 1.00 0.00 H new ATOM 0 HA SER A 244 -6.769 11.983 2.710 1.00 0.00 H new ATOM 0 HB2 SER A 244 -7.743 12.540 5.540 1.00 0.00 H new ATOM 0 HB3 SER A 244 -6.165 12.922 4.879 1.00 0.00 H new ATOM 0 HG SER A 244 -7.589 14.755 4.867 1.00 0.00 H new ATOM 334 N TYR A 245 -6.220 9.647 3.342 1.00 0.00 N ATOM 335 CA TYR A 245 -5.813 8.300 3.727 1.00 0.00 C ATOM 336 C TYR A 245 -4.301 8.156 3.587 1.00 0.00 C ATOM 337 O TYR A 245 -3.755 8.382 2.506 1.00 0.00 O ATOM 338 CB TYR A 245 -6.489 7.233 2.848 1.00 0.00 C ATOM 339 CG TYR A 245 -7.994 7.365 2.685 1.00 0.00 C ATOM 340 CD1 TYR A 245 -8.865 6.983 3.701 1.00 0.00 C ATOM 341 CD2 TYR A 245 -8.548 7.843 1.499 1.00 0.00 C ATOM 342 CE1 TYR A 245 -10.230 7.073 3.544 1.00 0.00 C ATOM 343 CE2 TYR A 245 -9.915 7.941 1.339 1.00 0.00 C ATOM 344 CZ TYR A 245 -10.750 7.557 2.361 1.00 0.00 C ATOM 345 OH TYR A 245 -12.109 7.646 2.193 1.00 0.00 O ATOM 0 H TYR A 245 -5.853 9.957 2.442 1.00 0.00 H new ATOM 0 HA TYR A 245 -6.118 8.149 4.762 1.00 0.00 H new ATOM 0 HB2 TYR A 245 -6.032 7.262 1.859 1.00 0.00 H new ATOM 0 HB3 TYR A 245 -6.273 6.252 3.271 1.00 0.00 H new ATOM 0 HD1 TYR A 245 -8.462 6.609 4.631 1.00 0.00 H new ATOM 0 HD2 TYR A 245 -7.896 8.142 0.691 1.00 0.00 H new ATOM 0 HE1 TYR A 245 -10.890 6.767 4.342 1.00 0.00 H new ATOM 0 HE2 TYR A 245 -10.327 8.318 0.415 1.00 0.00 H new ATOM 0 HH TYR A 245 -12.306 8.008 1.304 1.00 0.00 H new ATOM 355 N GLN A 246 -3.614 7.804 4.664 1.00 0.00 N ATOM 356 CA GLN A 246 -2.194 7.499 4.569 1.00 0.00 C ATOM 357 C GLN A 246 -1.981 6.068 5.047 1.00 0.00 C ATOM 358 O GLN A 246 -2.955 5.372 5.343 1.00 0.00 O ATOM 359 CB GLN A 246 -1.351 8.468 5.406 1.00 0.00 C ATOM 360 CG GLN A 246 -1.584 9.947 5.122 1.00 0.00 C ATOM 361 CD GLN A 246 -2.620 10.569 6.040 1.00 0.00 C ATOM 362 OE1 GLN A 246 -2.296 11.023 7.138 1.00 0.00 O ATOM 363 NE2 GLN A 246 -3.862 10.630 5.590 1.00 0.00 N ATOM 0 H GLN A 246 -4.009 7.723 5.601 1.00 0.00 H new ATOM 0 HA GLN A 246 -1.874 7.608 3.533 1.00 0.00 H new ATOM 0 HB2 GLN A 246 -1.553 8.281 6.461 1.00 0.00 H new ATOM 0 HB3 GLN A 246 -0.297 8.245 5.239 1.00 0.00 H new ATOM 0 HG2 GLN A 246 -0.642 10.485 5.228 1.00 0.00 H new ATOM 0 HG3 GLN A 246 -1.904 10.067 4.087 1.00 0.00 H new ATOM 0 HE21 GLN A 246 -4.092 10.243 4.675 1.00 0.00 H new ATOM 0 HE22 GLN A 246 -4.589 11.064 6.158 1.00 0.00 H new ATOM 372 N PHE A 247 -0.737 5.603 5.102 1.00 0.00 N ATOM 373 CA PHE A 247 -0.478 4.288 5.662 1.00 0.00 C ATOM 374 C PHE A 247 1.003 4.049 5.951 1.00 0.00 C ATOM 375 O PHE A 247 1.840 4.204 5.077 1.00 0.00 O ATOM 376 CB PHE A 247 -1.036 3.183 4.761 1.00 0.00 C ATOM 377 CG PHE A 247 -0.675 3.268 3.298 1.00 0.00 C ATOM 378 CD1 PHE A 247 0.114 2.294 2.711 1.00 0.00 C ATOM 379 CD2 PHE A 247 -1.158 4.295 2.503 1.00 0.00 C ATOM 380 CE1 PHE A 247 0.413 2.343 1.365 1.00 0.00 C ATOM 381 CE2 PHE A 247 -0.853 4.356 1.162 1.00 0.00 C ATOM 382 CZ PHE A 247 -0.070 3.378 0.590 1.00 0.00 C ATOM 0 H PHE A 247 0.088 6.105 4.773 1.00 0.00 H new ATOM 0 HA PHE A 247 -0.998 4.255 6.619 1.00 0.00 H new ATOM 0 HB2 PHE A 247 -0.691 2.223 5.143 1.00 0.00 H new ATOM 0 HB3 PHE A 247 -2.123 3.188 4.846 1.00 0.00 H new ATOM 0 HD1 PHE A 247 0.500 1.486 3.314 1.00 0.00 H new ATOM 0 HD2 PHE A 247 -1.783 5.059 2.942 1.00 0.00 H new ATOM 0 HE1 PHE A 247 1.024 1.573 0.918 1.00 0.00 H new ATOM 0 HE2 PHE A 247 -1.227 5.170 0.559 1.00 0.00 H new ATOM 0 HZ PHE A 247 0.166 3.421 -0.463 1.00 0.00 H new ATOM 392 N THR A 248 1.323 3.653 7.183 1.00 0.00 N ATOM 393 CA THR A 248 2.702 3.364 7.557 1.00 0.00 C ATOM 394 C THR A 248 2.919 1.868 7.522 1.00 0.00 C ATOM 395 O THR A 248 2.108 1.113 8.067 1.00 0.00 O ATOM 396 CB THR A 248 3.030 3.890 8.975 1.00 0.00 C ATOM 397 OG1 THR A 248 3.005 5.322 8.988 1.00 0.00 O ATOM 398 CG2 THR A 248 4.390 3.398 9.456 1.00 0.00 C ATOM 0 H THR A 248 0.646 3.526 7.935 1.00 0.00 H new ATOM 0 HA THR A 248 3.360 3.867 6.848 1.00 0.00 H new ATOM 0 HB THR A 248 2.270 3.503 9.654 1.00 0.00 H new ATOM 0 HG1 THR A 248 3.213 5.645 9.890 1.00 0.00 H new ATOM 0 HG21 THR A 248 4.585 3.788 10.455 1.00 0.00 H new ATOM 0 HG22 THR A 248 4.393 2.308 9.484 1.00 0.00 H new ATOM 0 HG23 THR A 248 5.165 3.746 8.773 1.00 0.00 H new ATOM 406 N VAL A 249 3.985 1.424 6.876 1.00 0.00 N ATOM 407 CA VAL A 249 4.187 -0.010 6.721 1.00 0.00 C ATOM 408 C VAL A 249 5.646 -0.411 6.930 1.00 0.00 C ATOM 409 O VAL A 249 6.566 0.309 6.544 1.00 0.00 O ATOM 410 CB VAL A 249 3.732 -0.511 5.328 1.00 0.00 C ATOM 411 CG1 VAL A 249 3.741 -2.028 5.258 1.00 0.00 C ATOM 412 CG2 VAL A 249 2.357 0.023 4.965 1.00 0.00 C ATOM 0 H VAL A 249 4.706 2.015 6.461 1.00 0.00 H new ATOM 0 HA VAL A 249 3.574 -0.478 7.491 1.00 0.00 H new ATOM 0 HB VAL A 249 4.448 -0.128 4.601 1.00 0.00 H new ATOM 0 HG11 VAL A 249 3.417 -2.348 4.268 1.00 0.00 H new ATOM 0 HG12 VAL A 249 4.750 -2.395 5.446 1.00 0.00 H new ATOM 0 HG13 VAL A 249 3.063 -2.431 6.010 1.00 0.00 H new ATOM 0 HG21 VAL A 249 2.070 -0.349 3.981 1.00 0.00 H new ATOM 0 HG22 VAL A 249 1.630 -0.311 5.705 1.00 0.00 H new ATOM 0 HG23 VAL A 249 2.383 1.113 4.947 1.00 0.00 H new ATOM 422 N THR A 250 5.842 -1.552 7.565 1.00 0.00 N ATOM 423 CA THR A 250 7.127 -2.202 7.598 1.00 0.00 C ATOM 424 C THR A 250 7.174 -3.218 6.465 1.00 0.00 C ATOM 425 O THR A 250 6.382 -4.165 6.434 1.00 0.00 O ATOM 426 CB THR A 250 7.357 -2.908 8.950 1.00 0.00 C ATOM 427 OG1 THR A 250 7.328 -1.942 10.011 1.00 0.00 O ATOM 428 CG2 THR A 250 8.685 -3.652 8.970 1.00 0.00 C ATOM 0 H THR A 250 5.110 -2.050 8.071 1.00 0.00 H new ATOM 0 HA THR A 250 7.914 -1.458 7.477 1.00 0.00 H new ATOM 0 HB THR A 250 6.559 -3.637 9.091 1.00 0.00 H new ATOM 0 HG1 THR A 250 7.473 -2.394 10.869 1.00 0.00 H new ATOM 0 HG21 THR A 250 8.815 -4.138 9.937 1.00 0.00 H new ATOM 0 HG22 THR A 250 8.692 -4.405 8.182 1.00 0.00 H new ATOM 0 HG23 THR A 250 9.500 -2.947 8.806 1.00 0.00 H new ATOM 436 N LEU A 251 8.061 -3.003 5.513 1.00 0.00 N ATOM 437 CA LEU A 251 8.155 -3.874 4.366 1.00 0.00 C ATOM 438 C LEU A 251 9.376 -4.764 4.540 1.00 0.00 C ATOM 439 O LEU A 251 10.215 -4.518 5.409 1.00 0.00 O ATOM 440 CB LEU A 251 8.237 -3.064 3.050 1.00 0.00 C ATOM 441 CG LEU A 251 7.037 -2.162 2.716 1.00 0.00 C ATOM 442 CD1 LEU A 251 7.057 -0.870 3.526 1.00 0.00 C ATOM 443 CD2 LEU A 251 7.031 -1.838 1.233 1.00 0.00 C ATOM 0 H LEU A 251 8.727 -2.230 5.515 1.00 0.00 H new ATOM 0 HA LEU A 251 7.258 -4.489 4.299 1.00 0.00 H new ATOM 0 HB2 LEU A 251 9.130 -2.440 3.090 1.00 0.00 H new ATOM 0 HB3 LEU A 251 8.374 -3.765 2.227 1.00 0.00 H new ATOM 0 HG LEU A 251 6.130 -2.707 2.979 1.00 0.00 H new ATOM 0 HD11 LEU A 251 6.193 -0.261 3.261 1.00 0.00 H new ATOM 0 HD12 LEU A 251 7.021 -1.107 4.589 1.00 0.00 H new ATOM 0 HD13 LEU A 251 7.971 -0.318 3.308 1.00 0.00 H new ATOM 0 HD21 LEU A 251 6.178 -1.199 1.004 1.00 0.00 H new ATOM 0 HD22 LEU A 251 7.954 -1.321 0.970 1.00 0.00 H new ATOM 0 HD23 LEU A 251 6.957 -2.762 0.659 1.00 0.00 H new ATOM 455 N THR A 252 9.472 -5.801 3.745 1.00 0.00 N ATOM 456 CA THR A 252 10.548 -6.753 3.881 1.00 0.00 C ATOM 457 C THR A 252 11.157 -7.107 2.516 1.00 0.00 C ATOM 458 O THR A 252 10.600 -7.909 1.766 1.00 0.00 O ATOM 459 CB THR A 252 10.022 -8.018 4.579 1.00 0.00 C ATOM 460 OG1 THR A 252 8.626 -8.196 4.283 1.00 0.00 O ATOM 461 CG2 THR A 252 10.214 -7.930 6.093 1.00 0.00 C ATOM 0 H THR A 252 8.815 -6.008 2.993 1.00 0.00 H new ATOM 0 HA THR A 252 11.337 -6.304 4.485 1.00 0.00 H new ATOM 0 HB THR A 252 10.589 -8.871 4.206 1.00 0.00 H new ATOM 0 HG1 THR A 252 8.297 -9.004 4.729 1.00 0.00 H new ATOM 0 HG21 THR A 252 9.833 -8.838 6.561 1.00 0.00 H new ATOM 0 HG22 THR A 252 11.275 -7.822 6.320 1.00 0.00 H new ATOM 0 HG23 THR A 252 9.671 -7.067 6.479 1.00 0.00 H new ATOM 469 N GLY A 253 12.289 -6.492 2.185 1.00 0.00 N ATOM 470 CA GLY A 253 12.943 -6.758 0.920 1.00 0.00 C ATOM 471 C GLY A 253 14.440 -6.882 1.091 1.00 0.00 C ATOM 472 O GLY A 253 15.041 -6.131 1.859 1.00 0.00 O ATOM 0 H GLY A 253 12.766 -5.811 2.776 1.00 0.00 H new ATOM 0 HA2 GLY A 253 12.547 -7.678 0.490 1.00 0.00 H new ATOM 0 HA3 GLY A 253 12.720 -5.955 0.217 1.00 0.00 H new ATOM 476 N ALA A 254 15.048 -7.822 0.386 1.00 0.00 N ATOM 477 CA ALA A 254 16.450 -8.131 0.606 1.00 0.00 C ATOM 478 C ALA A 254 17.320 -7.709 -0.569 1.00 0.00 C ATOM 479 O ALA A 254 17.498 -8.459 -1.531 1.00 0.00 O ATOM 480 CB ALA A 254 16.615 -9.619 0.873 1.00 0.00 C ATOM 0 H ALA A 254 14.596 -8.380 -0.338 1.00 0.00 H new ATOM 0 HA ALA A 254 16.781 -7.563 1.476 1.00 0.00 H new ATOM 0 HB1 ALA A 254 17.669 -9.845 1.037 1.00 0.00 H new ATOM 0 HB2 ALA A 254 16.042 -9.895 1.758 1.00 0.00 H new ATOM 0 HB3 ALA A 254 16.252 -10.185 0.015 1.00 0.00 H new ATOM 486 N THR A 255 17.851 -6.503 -0.486 1.00 0.00 N ATOM 487 CA THR A 255 18.849 -6.035 -1.430 1.00 0.00 C ATOM 488 C THR A 255 20.080 -5.554 -0.665 1.00 0.00 C ATOM 489 O THR A 255 20.046 -4.511 -0.016 1.00 0.00 O ATOM 490 CB THR A 255 18.298 -4.908 -2.326 1.00 0.00 C ATOM 491 OG1 THR A 255 17.088 -5.352 -2.959 1.00 0.00 O ATOM 492 CG2 THR A 255 19.315 -4.518 -3.405 1.00 0.00 C ATOM 0 H THR A 255 17.604 -5.823 0.234 1.00 0.00 H new ATOM 0 HA THR A 255 19.123 -6.864 -2.083 1.00 0.00 H new ATOM 0 HB THR A 255 18.101 -4.037 -1.701 1.00 0.00 H new ATOM 0 HG1 THR A 255 16.338 -4.800 -2.654 1.00 0.00 H new ATOM 0 HG21 THR A 255 18.902 -3.721 -4.023 1.00 0.00 H new ATOM 0 HG22 THR A 255 20.233 -4.171 -2.931 1.00 0.00 H new ATOM 0 HG23 THR A 255 19.534 -5.385 -4.029 1.00 0.00 H new ATOM 500 N ALA A 256 21.146 -6.340 -0.722 1.00 0.00 N ATOM 501 CA ALA A 256 22.358 -6.063 0.039 1.00 0.00 C ATOM 502 C ALA A 256 23.024 -4.753 -0.371 1.00 0.00 C ATOM 503 O ALA A 256 23.053 -4.399 -1.554 1.00 0.00 O ATOM 504 CB ALA A 256 23.343 -7.208 -0.122 1.00 0.00 C ATOM 0 H ALA A 256 21.196 -7.183 -1.293 1.00 0.00 H new ATOM 0 HA ALA A 256 22.063 -5.964 1.084 1.00 0.00 H new ATOM 0 HB1 ALA A 256 24.246 -6.994 0.449 1.00 0.00 H new ATOM 0 HB2 ALA A 256 22.892 -8.130 0.244 1.00 0.00 H new ATOM 0 HB3 ALA A 256 23.599 -7.323 -1.175 1.00 0.00 H new ATOM 510 N SER A 257 23.543 -4.042 0.627 1.00 0.00 N ATOM 511 CA SER A 257 24.380 -2.865 0.415 1.00 0.00 C ATOM 512 C SER A 257 23.627 -1.753 -0.322 1.00 0.00 C ATOM 513 O SER A 257 24.084 -1.252 -1.354 1.00 0.00 O ATOM 514 CB SER A 257 25.645 -3.267 -0.354 1.00 0.00 C ATOM 515 OG SER A 257 26.666 -2.290 -0.234 1.00 0.00 O ATOM 0 H SER A 257 23.394 -4.268 1.610 1.00 0.00 H new ATOM 0 HA SER A 257 24.660 -2.466 1.390 1.00 0.00 H new ATOM 0 HB2 SER A 257 26.010 -4.223 0.021 1.00 0.00 H new ATOM 0 HB3 SER A 257 25.401 -3.410 -1.407 1.00 0.00 H new ATOM 0 HG SER A 257 27.457 -2.580 -0.735 1.00 0.00 H new ATOM 521 N VAL A 258 22.467 -1.376 0.201 1.00 0.00 N ATOM 522 CA VAL A 258 21.715 -0.252 -0.341 1.00 0.00 C ATOM 523 C VAL A 258 21.163 0.604 0.796 1.00 0.00 C ATOM 524 O VAL A 258 20.191 0.232 1.463 1.00 0.00 O ATOM 525 CB VAL A 258 20.549 -0.699 -1.256 1.00 0.00 C ATOM 526 CG1 VAL A 258 19.835 0.511 -1.846 1.00 0.00 C ATOM 527 CG2 VAL A 258 21.043 -1.610 -2.368 1.00 0.00 C ATOM 0 H VAL A 258 22.027 -1.832 1.000 1.00 0.00 H new ATOM 0 HA VAL A 258 22.409 0.327 -0.950 1.00 0.00 H new ATOM 0 HB VAL A 258 19.842 -1.260 -0.644 1.00 0.00 H new ATOM 0 HG11 VAL A 258 19.019 0.176 -2.486 1.00 0.00 H new ATOM 0 HG12 VAL A 258 19.435 1.126 -1.040 1.00 0.00 H new ATOM 0 HG13 VAL A 258 20.540 1.098 -2.435 1.00 0.00 H new ATOM 0 HG21 VAL A 258 20.202 -1.908 -2.995 1.00 0.00 H new ATOM 0 HG22 VAL A 258 21.777 -1.079 -2.974 1.00 0.00 H new ATOM 0 HG23 VAL A 258 21.504 -2.497 -1.934 1.00 0.00 H new ATOM 537 N THR A 259 21.796 1.742 1.026 1.00 0.00 N ATOM 538 CA THR A 259 21.363 2.657 2.063 1.00 0.00 C ATOM 539 C THR A 259 20.167 3.475 1.582 1.00 0.00 C ATOM 540 O THR A 259 20.316 4.560 1.024 1.00 0.00 O ATOM 541 CB THR A 259 22.510 3.592 2.487 1.00 0.00 C ATOM 542 OG1 THR A 259 23.657 2.810 2.854 1.00 0.00 O ATOM 543 CG2 THR A 259 22.097 4.469 3.662 1.00 0.00 C ATOM 0 H THR A 259 22.615 2.053 0.504 1.00 0.00 H new ATOM 0 HA THR A 259 21.064 2.069 2.931 1.00 0.00 H new ATOM 0 HB THR A 259 22.754 4.238 1.644 1.00 0.00 H new ATOM 0 HG1 THR A 259 24.387 3.406 3.122 1.00 0.00 H new ATOM 0 HG21 THR A 259 22.927 5.119 3.940 1.00 0.00 H new ATOM 0 HG22 THR A 259 21.239 5.078 3.378 1.00 0.00 H new ATOM 0 HG23 THR A 259 21.830 3.839 4.510 1.00 0.00 H new ATOM 551 N GLY A 260 18.983 2.923 1.788 1.00 0.00 N ATOM 552 CA GLY A 260 17.767 3.578 1.368 1.00 0.00 C ATOM 553 C GLY A 260 17.307 3.118 0.002 1.00 0.00 C ATOM 554 O GLY A 260 17.768 3.643 -1.011 1.00 0.00 O ATOM 0 H GLY A 260 18.843 2.022 2.245 1.00 0.00 H new ATOM 0 HA2 GLY A 260 16.981 3.383 2.098 1.00 0.00 H new ATOM 0 HA3 GLY A 260 17.925 4.656 1.351 1.00 0.00 H new ATOM 558 N PHE A 261 16.436 2.110 -0.024 1.00 0.00 N ATOM 559 CA PHE A 261 15.792 1.671 -1.267 1.00 0.00 C ATOM 560 C PHE A 261 15.289 2.854 -2.085 1.00 0.00 C ATOM 561 O PHE A 261 15.691 3.057 -3.231 1.00 0.00 O ATOM 562 CB PHE A 261 14.561 0.786 -0.980 1.00 0.00 C ATOM 563 CG PHE A 261 14.815 -0.690 -1.008 1.00 0.00 C ATOM 564 CD1 PHE A 261 14.521 -1.472 0.091 1.00 0.00 C ATOM 565 CD2 PHE A 261 15.324 -1.297 -2.144 1.00 0.00 C ATOM 566 CE1 PHE A 261 14.727 -2.837 0.065 1.00 0.00 C ATOM 567 CE2 PHE A 261 15.537 -2.660 -2.177 1.00 0.00 C ATOM 568 CZ PHE A 261 15.239 -3.434 -1.071 1.00 0.00 C ATOM 0 H PHE A 261 16.158 1.580 0.802 1.00 0.00 H new ATOM 0 HA PHE A 261 16.553 1.116 -1.815 1.00 0.00 H new ATOM 0 HB2 PHE A 261 14.163 1.051 -0.000 1.00 0.00 H new ATOM 0 HB3 PHE A 261 13.788 1.019 -1.712 1.00 0.00 H new ATOM 0 HD1 PHE A 261 14.125 -1.010 0.983 1.00 0.00 H new ATOM 0 HD2 PHE A 261 15.556 -0.698 -3.012 1.00 0.00 H new ATOM 0 HE1 PHE A 261 14.488 -3.437 0.931 1.00 0.00 H new ATOM 0 HE2 PHE A 261 15.937 -3.122 -3.067 1.00 0.00 H new ATOM 0 HZ PHE A 261 15.406 -4.501 -1.095 1.00 0.00 H new ATOM 578 N LEU A 262 14.406 3.627 -1.472 1.00 0.00 N ATOM 579 CA LEU A 262 13.621 4.614 -2.184 1.00 0.00 C ATOM 580 C LEU A 262 12.960 5.543 -1.164 1.00 0.00 C ATOM 581 O LEU A 262 12.540 5.085 -0.103 1.00 0.00 O ATOM 582 CB LEU A 262 12.585 3.849 -3.032 1.00 0.00 C ATOM 583 CG LEU A 262 11.859 4.622 -4.135 1.00 0.00 C ATOM 584 CD1 LEU A 262 10.742 5.462 -3.554 1.00 0.00 C ATOM 585 CD2 LEU A 262 12.836 5.485 -4.918 1.00 0.00 C ATOM 0 H LEU A 262 14.216 3.586 -0.471 1.00 0.00 H new ATOM 0 HA LEU A 262 14.230 5.232 -2.843 1.00 0.00 H new ATOM 0 HB2 LEU A 262 13.090 3.001 -3.494 1.00 0.00 H new ATOM 0 HB3 LEU A 262 11.833 3.443 -2.356 1.00 0.00 H new ATOM 0 HG LEU A 262 11.417 3.902 -4.823 1.00 0.00 H new ATOM 0 HD11 LEU A 262 10.239 6.003 -4.355 1.00 0.00 H new ATOM 0 HD12 LEU A 262 10.026 4.815 -3.048 1.00 0.00 H new ATOM 0 HD13 LEU A 262 11.156 6.174 -2.840 1.00 0.00 H new ATOM 0 HD21 LEU A 262 12.300 6.026 -5.697 1.00 0.00 H new ATOM 0 HD22 LEU A 262 13.313 6.197 -4.245 1.00 0.00 H new ATOM 0 HD23 LEU A 262 13.597 4.851 -5.374 1.00 0.00 H new ATOM 597 N LYS A 263 12.901 6.840 -1.456 1.00 0.00 N ATOM 598 CA LYS A 263 12.308 7.800 -0.530 1.00 0.00 C ATOM 599 C LYS A 263 11.212 8.643 -1.178 1.00 0.00 C ATOM 600 O LYS A 263 10.802 8.386 -2.313 1.00 0.00 O ATOM 601 CB LYS A 263 13.376 8.721 0.050 1.00 0.00 C ATOM 602 CG LYS A 263 14.249 8.052 1.091 1.00 0.00 C ATOM 603 CD LYS A 263 15.118 9.062 1.826 1.00 0.00 C ATOM 604 CE LYS A 263 14.281 10.160 2.470 1.00 0.00 C ATOM 605 NZ LYS A 263 15.103 11.070 3.306 1.00 0.00 N1+ ATOM 0 H LYS A 263 13.254 7.248 -2.321 1.00 0.00 H new ATOM 0 HA LYS A 263 11.851 7.214 0.267 1.00 0.00 H new ATOM 0 HB2 LYS A 263 14.006 9.089 -0.760 1.00 0.00 H new ATOM 0 HB3 LYS A 263 12.892 9.590 0.497 1.00 0.00 H new ATOM 0 HG2 LYS A 263 13.621 7.522 1.807 1.00 0.00 H new ATOM 0 HG3 LYS A 263 14.883 7.307 0.611 1.00 0.00 H new ATOM 0 HD2 LYS A 263 15.701 8.551 2.593 1.00 0.00 H new ATOM 0 HD3 LYS A 263 15.828 9.507 1.129 1.00 0.00 H new ATOM 0 HE2 LYS A 263 13.780 10.736 1.692 1.00 0.00 H new ATOM 0 HE3 LYS A 263 13.502 9.708 3.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 263 14.533 11.894 3.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 263 15.423 10.565 4.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 263 15.929 11.390 2.762 1.00 0.00 H new ATOM 619 N ALA A 264 10.762 9.657 -0.439 1.00 0.00 N ATOM 620 CA ALA A 264 9.696 10.546 -0.867 1.00 0.00 C ATOM 621 C ALA A 264 9.955 11.125 -2.245 1.00 0.00 C ATOM 622 O ALA A 264 11.045 11.616 -2.543 1.00 0.00 O ATOM 623 CB ALA A 264 9.508 11.667 0.143 1.00 0.00 C ATOM 0 H ALA A 264 11.135 9.882 0.483 1.00 0.00 H new ATOM 0 HA ALA A 264 8.783 9.953 -0.926 1.00 0.00 H new ATOM 0 HB1 ALA A 264 8.706 12.326 -0.190 1.00 0.00 H new ATOM 0 HB2 ALA A 264 9.250 11.243 1.113 1.00 0.00 H new ATOM 0 HB3 ALA A 264 10.433 12.237 0.231 1.00 0.00 H new ATOM 629 N GLY A 265 8.940 11.042 -3.073 1.00 0.00 N ATOM 630 CA GLY A 265 9.016 11.572 -4.413 1.00 0.00 C ATOM 631 C GLY A 265 8.745 10.508 -5.444 1.00 0.00 C ATOM 632 O GLY A 265 8.179 10.779 -6.504 1.00 0.00 O ATOM 0 H GLY A 265 8.046 10.609 -2.839 1.00 0.00 H new ATOM 0 HA2 GLY A 265 8.295 12.382 -4.526 1.00 0.00 H new ATOM 0 HA3 GLY A 265 10.005 11.999 -4.581 1.00 0.00 H new ATOM 636 N ASP A 266 9.133 9.286 -5.122 1.00 0.00 N ATOM 637 CA ASP A 266 8.985 8.174 -6.049 1.00 0.00 C ATOM 638 C ASP A 266 7.880 7.238 -5.584 1.00 0.00 C ATOM 639 O ASP A 266 7.569 7.164 -4.391 1.00 0.00 O ATOM 640 CB ASP A 266 10.304 7.417 -6.202 1.00 0.00 C ATOM 641 CG ASP A 266 11.325 8.160 -7.039 1.00 0.00 C ATOM 642 OD1 ASP A 266 11.256 8.078 -8.284 1.00 0.00 O ATOM 643 OD2 ASP A 266 12.218 8.815 -6.458 1.00 0.00 O1- ATOM 0 H ASP A 266 9.553 9.037 -4.226 1.00 0.00 H new ATOM 0 HA ASP A 266 8.709 8.575 -7.024 1.00 0.00 H new ATOM 0 HB2 ASP A 266 10.723 7.227 -5.214 1.00 0.00 H new ATOM 0 HB3 ASP A 266 10.108 6.446 -6.657 1.00 0.00 H new ATOM 648 N GLN A 267 7.288 6.520 -6.524 1.00 0.00 N ATOM 649 CA GLN A 267 6.129 5.695 -6.229 1.00 0.00 C ATOM 650 C GLN A 267 6.436 4.213 -6.421 1.00 0.00 C ATOM 651 O GLN A 267 7.402 3.838 -7.088 1.00 0.00 O ATOM 652 CB GLN A 267 4.959 6.102 -7.126 1.00 0.00 C ATOM 653 CG GLN A 267 4.761 7.608 -7.206 1.00 0.00 C ATOM 654 CD GLN A 267 3.550 8.010 -8.026 1.00 0.00 C ATOM 655 OE1 GLN A 267 2.493 7.219 -7.961 1.00 0.00 O flip ATOM 656 NE2 GLN A 267 3.557 9.045 -8.691 1.00 0.00 N flip ATOM 0 H GLN A 267 7.591 6.492 -7.498 1.00 0.00 H new ATOM 0 HA GLN A 267 5.862 5.852 -5.184 1.00 0.00 H new ATOM 0 HB2 GLN A 267 5.125 5.710 -8.129 1.00 0.00 H new ATOM 0 HB3 GLN A 267 4.045 5.641 -6.751 1.00 0.00 H new ATOM 0 HG2 GLN A 267 4.658 8.008 -6.197 1.00 0.00 H new ATOM 0 HG3 GLN A 267 5.652 8.062 -7.639 1.00 0.00 H new ATOM 0 HE21 GLN A 267 4.393 9.629 -8.716 1.00 0.00 H new ATOM 0 HE22 GLN A 267 2.727 9.319 -9.217 1.00 0.00 H new ATOM 665 N VAL A 268 5.596 3.379 -5.837 1.00 0.00 N ATOM 666 CA VAL A 268 5.725 1.937 -5.952 1.00 0.00 C ATOM 667 C VAL A 268 4.428 1.334 -6.446 1.00 0.00 C ATOM 668 O VAL A 268 3.483 2.044 -6.758 1.00 0.00 O ATOM 669 CB VAL A 268 6.092 1.259 -4.604 1.00 0.00 C ATOM 670 CG1 VAL A 268 7.599 1.264 -4.388 1.00 0.00 C ATOM 671 CG2 VAL A 268 5.400 1.963 -3.439 1.00 0.00 C ATOM 0 H VAL A 268 4.805 3.682 -5.269 1.00 0.00 H new ATOM 0 HA VAL A 268 6.534 1.757 -6.660 1.00 0.00 H new ATOM 0 HB VAL A 268 5.748 0.226 -4.646 1.00 0.00 H new ATOM 0 HG11 VAL A 268 7.832 0.784 -3.438 1.00 0.00 H new ATOM 0 HG12 VAL A 268 8.084 0.720 -5.198 1.00 0.00 H new ATOM 0 HG13 VAL A 268 7.961 2.292 -4.374 1.00 0.00 H new ATOM 0 HG21 VAL A 268 5.671 1.472 -2.504 1.00 0.00 H new ATOM 0 HG22 VAL A 268 5.715 3.006 -3.405 1.00 0.00 H new ATOM 0 HG23 VAL A 268 4.320 1.914 -3.574 1.00 0.00 H new ATOM 681 N LYS A 269 4.389 0.027 -6.503 1.00 0.00 N ATOM 682 CA LYS A 269 3.213 -0.698 -6.940 1.00 0.00 C ATOM 683 C LYS A 269 3.167 -2.029 -6.200 1.00 0.00 C ATOM 684 O LYS A 269 4.189 -2.689 -6.093 1.00 0.00 O ATOM 685 CB LYS A 269 3.295 -0.905 -8.465 1.00 0.00 C ATOM 686 CG LYS A 269 2.341 -1.952 -9.024 1.00 0.00 C ATOM 687 CD LYS A 269 2.919 -3.356 -8.932 1.00 0.00 C ATOM 688 CE LYS A 269 3.856 -3.656 -10.090 1.00 0.00 C ATOM 689 NZ LYS A 269 3.143 -3.662 -11.395 1.00 0.00 N1+ ATOM 0 H LYS A 269 5.174 -0.572 -6.247 1.00 0.00 H new ATOM 0 HA LYS A 269 2.301 -0.143 -6.719 1.00 0.00 H new ATOM 0 HB2 LYS A 269 3.095 0.047 -8.957 1.00 0.00 H new ATOM 0 HB3 LYS A 269 4.315 -1.189 -8.724 1.00 0.00 H new ATOM 0 HG2 LYS A 269 1.398 -1.912 -8.478 1.00 0.00 H new ATOM 0 HG3 LYS A 269 2.117 -1.720 -10.065 1.00 0.00 H new ATOM 0 HD2 LYS A 269 3.457 -3.467 -7.991 1.00 0.00 H new ATOM 0 HD3 LYS A 269 2.107 -4.084 -8.923 1.00 0.00 H new ATOM 0 HE2 LYS A 269 4.652 -2.912 -10.115 1.00 0.00 H new ATOM 0 HE3 LYS A 269 4.330 -4.624 -9.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 269 3.681 -4.229 -12.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 269 2.196 -4.075 -11.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 269 3.053 -2.687 -11.746 1.00 0.00 H new ATOM 703 N PHE A 270 2.019 -2.436 -5.675 1.00 0.00 N ATOM 704 CA PHE A 270 1.967 -3.740 -5.028 1.00 0.00 C ATOM 705 C PHE A 270 0.618 -4.415 -5.202 1.00 0.00 C ATOM 706 O PHE A 270 -0.419 -3.759 -5.315 1.00 0.00 O ATOM 707 CB PHE A 270 2.375 -3.659 -3.544 1.00 0.00 C ATOM 708 CG PHE A 270 1.408 -2.971 -2.621 1.00 0.00 C ATOM 709 CD1 PHE A 270 1.461 -1.601 -2.433 1.00 0.00 C ATOM 710 CD2 PHE A 270 0.476 -3.707 -1.907 1.00 0.00 C ATOM 711 CE1 PHE A 270 0.599 -0.977 -1.549 1.00 0.00 C ATOM 712 CE2 PHE A 270 -0.391 -3.088 -1.029 1.00 0.00 C ATOM 713 CZ PHE A 270 -0.328 -1.722 -0.848 1.00 0.00 C ATOM 0 H PHE A 270 1.146 -1.909 -5.681 1.00 0.00 H new ATOM 0 HA PHE A 270 2.701 -4.368 -5.533 1.00 0.00 H new ATOM 0 HB2 PHE A 270 2.534 -4.673 -3.178 1.00 0.00 H new ATOM 0 HB3 PHE A 270 3.333 -3.143 -3.481 1.00 0.00 H new ATOM 0 HD1 PHE A 270 2.182 -1.013 -2.982 1.00 0.00 H new ATOM 0 HD2 PHE A 270 0.427 -4.778 -2.039 1.00 0.00 H new ATOM 0 HE1 PHE A 270 0.651 0.092 -1.407 1.00 0.00 H new ATOM 0 HE2 PHE A 270 -1.118 -3.673 -0.484 1.00 0.00 H new ATOM 0 HZ PHE A 270 -1.003 -1.236 -0.159 1.00 0.00 H new ATOM 723 N THR A 271 0.664 -5.740 -5.263 1.00 0.00 N ATOM 724 CA THR A 271 -0.524 -6.558 -5.432 1.00 0.00 C ATOM 725 C THR A 271 -1.012 -7.036 -4.071 1.00 0.00 C ATOM 726 O THR A 271 -0.347 -7.842 -3.414 1.00 0.00 O ATOM 727 CB THR A 271 -0.223 -7.792 -6.334 1.00 0.00 C ATOM 728 OG1 THR A 271 0.784 -8.605 -5.714 1.00 0.00 O ATOM 729 CG2 THR A 271 0.279 -7.394 -7.732 1.00 0.00 C ATOM 0 H THR A 271 1.529 -6.276 -5.196 1.00 0.00 H new ATOM 0 HA THR A 271 -1.293 -5.953 -5.912 1.00 0.00 H new ATOM 0 HB THR A 271 -1.161 -8.336 -6.448 1.00 0.00 H new ATOM 0 HG1 THR A 271 0.612 -8.660 -4.751 1.00 0.00 H new ATOM 0 HG21 THR A 271 0.473 -8.292 -8.318 1.00 0.00 H new ATOM 0 HG22 THR A 271 -0.478 -6.791 -8.232 1.00 0.00 H new ATOM 0 HG23 THR A 271 1.199 -6.817 -7.638 1.00 0.00 H new ATOM 737 N ASN A 272 -2.159 -6.532 -3.647 1.00 0.00 N ATOM 738 CA ASN A 272 -2.687 -6.862 -2.328 1.00 0.00 C ATOM 739 C ASN A 272 -3.832 -7.857 -2.436 1.00 0.00 C ATOM 740 O ASN A 272 -4.510 -7.938 -3.465 1.00 0.00 O ATOM 741 CB ASN A 272 -3.159 -5.603 -1.589 1.00 0.00 C ATOM 742 CG ASN A 272 -4.404 -4.981 -2.191 1.00 0.00 C ATOM 743 OD1 ASN A 272 -4.607 -5.000 -3.404 1.00 0.00 O ATOM 744 ND2 ASN A 272 -5.251 -4.430 -1.336 1.00 0.00 N ATOM 0 H ASN A 272 -2.742 -5.896 -4.191 1.00 0.00 H new ATOM 0 HA ASN A 272 -1.878 -7.317 -1.756 1.00 0.00 H new ATOM 0 HB2 ASN A 272 -3.356 -5.855 -0.547 1.00 0.00 H new ATOM 0 HB3 ASN A 272 -2.356 -4.866 -1.593 1.00 0.00 H new ATOM 0 HD21 ASN A 272 -6.111 -3.999 -1.676 1.00 0.00 H new ATOM 0 HD22 ASN A 272 -5.044 -4.436 -0.337 1.00 0.00 H new ATOM 1061 N SER A 292 -4.482 -4.643 -7.732 1.00 0.00 N ATOM 1062 CA SER A 292 -3.175 -4.041 -7.889 1.00 0.00 C ATOM 1063 C SER A 292 -3.302 -2.524 -7.962 1.00 0.00 C ATOM 1064 O SER A 292 -4.263 -2.012 -8.541 1.00 0.00 O ATOM 1065 CB SER A 292 -2.521 -4.573 -9.166 1.00 0.00 C ATOM 1066 OG SER A 292 -2.452 -5.990 -9.148 1.00 0.00 O ATOM 0 HA SER A 292 -2.555 -4.298 -7.030 1.00 0.00 H new ATOM 0 HB2 SER A 292 -3.091 -4.244 -10.035 1.00 0.00 H new ATOM 0 HB3 SER A 292 -1.518 -4.157 -9.266 1.00 0.00 H new ATOM 0 HG SER A 292 -3.277 -6.353 -8.764 1.00 0.00 H new ATOM 1072 N PHE A 293 -2.354 -1.804 -7.373 1.00 0.00 N ATOM 1073 CA PHE A 293 -2.374 -0.354 -7.428 1.00 0.00 C ATOM 1074 C PHE A 293 -1.010 0.232 -7.113 1.00 0.00 C ATOM 1075 O PHE A 293 -0.136 -0.435 -6.551 1.00 0.00 O ATOM 1076 CB PHE A 293 -3.428 0.227 -6.480 1.00 0.00 C ATOM 1077 CG PHE A 293 -3.351 -0.260 -5.061 1.00 0.00 C ATOM 1078 CD1 PHE A 293 -4.111 -1.342 -4.647 1.00 0.00 C ATOM 1079 CD2 PHE A 293 -2.541 0.378 -4.138 1.00 0.00 C ATOM 1080 CE1 PHE A 293 -4.062 -1.777 -3.339 1.00 0.00 C ATOM 1081 CE2 PHE A 293 -2.486 -0.056 -2.830 1.00 0.00 C ATOM 1082 CZ PHE A 293 -3.248 -1.136 -2.430 1.00 0.00 C ATOM 0 H PHE A 293 -1.569 -2.200 -6.856 1.00 0.00 H new ATOM 0 HA PHE A 293 -2.639 -0.078 -8.449 1.00 0.00 H new ATOM 0 HB2 PHE A 293 -3.334 1.313 -6.480 1.00 0.00 H new ATOM 0 HB3 PHE A 293 -4.417 -0.007 -6.874 1.00 0.00 H new ATOM 0 HD1 PHE A 293 -4.748 -1.850 -5.356 1.00 0.00 H new ATOM 0 HD2 PHE A 293 -1.945 1.225 -4.445 1.00 0.00 H new ATOM 0 HE1 PHE A 293 -4.661 -2.620 -3.027 1.00 0.00 H new ATOM 0 HE2 PHE A 293 -1.848 0.448 -2.119 1.00 0.00 H new ATOM 0 HZ PHE A 293 -3.206 -1.478 -1.406 1.00 0.00 H new ATOM 1092 N THR A 294 -0.843 1.487 -7.491 1.00 0.00 N ATOM 1093 CA THR A 294 0.396 2.205 -7.275 1.00 0.00 C ATOM 1094 C THR A 294 0.387 2.897 -5.908 1.00 0.00 C ATOM 1095 O THR A 294 -0.546 3.633 -5.577 1.00 0.00 O ATOM 1096 CB THR A 294 0.595 3.256 -8.393 1.00 0.00 C ATOM 1097 OG1 THR A 294 0.668 2.605 -9.670 1.00 0.00 O ATOM 1098 CG2 THR A 294 1.851 4.101 -8.181 1.00 0.00 C ATOM 0 H THR A 294 -1.565 2.036 -7.957 1.00 0.00 H new ATOM 0 HA THR A 294 1.220 1.491 -7.298 1.00 0.00 H new ATOM 0 HB THR A 294 -0.264 3.926 -8.360 1.00 0.00 H new ATOM 0 HG1 THR A 294 0.792 3.277 -10.373 1.00 0.00 H new ATOM 0 HG21 THR A 294 1.945 4.823 -8.992 1.00 0.00 H new ATOM 0 HG22 THR A 294 1.777 4.630 -7.231 1.00 0.00 H new ATOM 0 HG23 THR A 294 2.728 3.453 -8.168 1.00 0.00 H new ATOM 1106 N ALA A 295 1.419 2.650 -5.113 1.00 0.00 N ATOM 1107 CA ALA A 295 1.550 3.277 -3.809 1.00 0.00 C ATOM 1108 C ALA A 295 2.671 4.307 -3.856 1.00 0.00 C ATOM 1109 O ALA A 295 3.340 4.435 -4.877 1.00 0.00 O ATOM 1110 CB ALA A 295 1.821 2.220 -2.756 1.00 0.00 C ATOM 0 H ALA A 295 2.181 2.016 -5.352 1.00 0.00 H new ATOM 0 HA ALA A 295 0.623 3.786 -3.546 1.00 0.00 H new ATOM 0 HB1 ALA A 295 1.918 2.695 -1.780 1.00 0.00 H new ATOM 0 HB2 ALA A 295 0.995 1.509 -2.733 1.00 0.00 H new ATOM 0 HB3 ALA A 295 2.745 1.694 -2.997 1.00 0.00 H new ATOM 1116 N THR A 296 2.887 5.045 -2.777 1.00 0.00 N ATOM 1117 CA THR A 296 3.930 6.064 -2.783 1.00 0.00 C ATOM 1118 C THR A 296 4.777 6.049 -1.520 1.00 0.00 C ATOM 1119 O THR A 296 4.267 6.176 -0.408 1.00 0.00 O ATOM 1120 CB THR A 296 3.337 7.479 -3.010 1.00 0.00 C ATOM 1121 OG1 THR A 296 2.788 7.569 -4.333 1.00 0.00 O ATOM 1122 CG2 THR A 296 4.382 8.588 -2.815 1.00 0.00 C ATOM 0 H THR A 296 2.367 4.962 -1.903 1.00 0.00 H new ATOM 0 HA THR A 296 4.586 5.817 -3.618 1.00 0.00 H new ATOM 0 HB THR A 296 2.555 7.626 -2.265 1.00 0.00 H new ATOM 0 HG1 THR A 296 2.413 8.464 -4.471 1.00 0.00 H new ATOM 0 HG21 THR A 296 3.918 9.559 -2.985 1.00 0.00 H new ATOM 0 HG22 THR A 296 4.772 8.545 -1.798 1.00 0.00 H new ATOM 0 HG23 THR A 296 5.198 8.447 -3.523 1.00 0.00 H new ATOM 1130 N VAL A 297 6.081 5.897 -1.727 1.00 0.00 N ATOM 1131 CA VAL A 297 7.063 5.957 -0.661 1.00 0.00 C ATOM 1132 C VAL A 297 7.303 7.415 -0.294 1.00 0.00 C ATOM 1133 O VAL A 297 7.618 8.229 -1.161 1.00 0.00 O ATOM 1134 CB VAL A 297 8.384 5.306 -1.113 1.00 0.00 C ATOM 1135 CG1 VAL A 297 9.438 5.381 -0.029 1.00 0.00 C ATOM 1136 CG2 VAL A 297 8.151 3.859 -1.525 1.00 0.00 C ATOM 0 H VAL A 297 6.485 5.728 -2.648 1.00 0.00 H new ATOM 0 HA VAL A 297 6.690 5.413 0.207 1.00 0.00 H new ATOM 0 HB VAL A 297 8.751 5.864 -1.975 1.00 0.00 H new ATOM 0 HG11 VAL A 297 10.357 4.912 -0.382 1.00 0.00 H new ATOM 0 HG12 VAL A 297 9.634 6.425 0.216 1.00 0.00 H new ATOM 0 HG13 VAL A 297 9.083 4.860 0.860 1.00 0.00 H new ATOM 0 HG21 VAL A 297 9.095 3.414 -1.841 1.00 0.00 H new ATOM 0 HG22 VAL A 297 7.752 3.300 -0.679 1.00 0.00 H new ATOM 0 HG23 VAL A 297 7.439 3.826 -2.350 1.00 0.00 H new ATOM 1146 N THR A 298 7.139 7.760 0.972 1.00 0.00 N ATOM 1147 CA THR A 298 7.146 9.168 1.342 1.00 0.00 C ATOM 1148 C THR A 298 8.036 9.445 2.553 1.00 0.00 C ATOM 1149 O THR A 298 7.927 10.497 3.188 1.00 0.00 O ATOM 1150 CB THR A 298 5.707 9.682 1.603 1.00 0.00 C ATOM 1151 OG1 THR A 298 5.707 11.106 1.777 1.00 0.00 O ATOM 1152 CG2 THR A 298 5.099 9.026 2.833 1.00 0.00 C ATOM 0 H THR A 298 7.003 7.106 1.743 1.00 0.00 H new ATOM 0 HA THR A 298 7.566 9.712 0.496 1.00 0.00 H new ATOM 0 HB THR A 298 5.104 9.420 0.734 1.00 0.00 H new ATOM 0 HG1 THR A 298 6.467 11.367 2.338 1.00 0.00 H new ATOM 0 HG21 THR A 298 4.090 9.408 2.988 1.00 0.00 H new ATOM 0 HG22 THR A 298 5.060 7.946 2.688 1.00 0.00 H new ATOM 0 HG23 THR A 298 5.711 9.253 3.706 1.00 0.00 H new ATOM 1160 N ALA A 299 8.930 8.522 2.864 1.00 0.00 N ATOM 1161 CA ALA A 299 9.799 8.682 4.017 1.00 0.00 C ATOM 1162 C ALA A 299 11.106 7.933 3.826 1.00 0.00 C ATOM 1163 O ALA A 299 11.371 7.406 2.744 1.00 0.00 O ATOM 1164 CB ALA A 299 9.090 8.218 5.282 1.00 0.00 C ATOM 0 H ALA A 299 9.073 7.660 2.338 1.00 0.00 H new ATOM 0 HA ALA A 299 10.036 9.741 4.120 1.00 0.00 H new ATOM 0 HB1 ALA A 299 9.753 8.344 6.138 1.00 0.00 H new ATOM 0 HB2 ALA A 299 8.188 8.811 5.432 1.00 0.00 H new ATOM 0 HB3 ALA A 299 8.821 7.166 5.183 1.00 0.00 H new ATOM 1170 N ASP A 300 11.920 7.895 4.871 1.00 0.00 N ATOM 1171 CA ASP A 300 13.179 7.187 4.832 1.00 0.00 C ATOM 1172 C ASP A 300 12.926 5.698 4.816 1.00 0.00 C ATOM 1173 O ASP A 300 12.044 5.195 5.508 1.00 0.00 O ATOM 1174 CB ASP A 300 14.060 7.552 6.031 1.00 0.00 C ATOM 1175 CG ASP A 300 14.516 8.995 6.006 1.00 0.00 C ATOM 1176 OD1 ASP A 300 15.517 9.299 5.324 1.00 0.00 O ATOM 1177 OD2 ASP A 300 13.879 9.837 6.670 1.00 0.00 O1- ATOM 0 H ASP A 300 11.723 8.352 5.761 1.00 0.00 H new ATOM 0 HA ASP A 300 13.706 7.480 3.924 1.00 0.00 H new ATOM 0 HB2 ASP A 300 13.507 7.366 6.952 1.00 0.00 H new ATOM 0 HB3 ASP A 300 14.933 6.900 6.046 1.00 0.00 H new ATOM 1182 N ALA A 301 13.706 5.009 4.021 1.00 0.00 N ATOM 1183 CA ALA A 301 13.577 3.567 3.869 1.00 0.00 C ATOM 1184 C ALA A 301 14.955 2.923 3.888 1.00 0.00 C ATOM 1185 O ALA A 301 15.964 3.620 3.796 1.00 0.00 O ATOM 1186 CB ALA A 301 12.830 3.231 2.580 1.00 0.00 C ATOM 0 H ALA A 301 14.449 5.424 3.459 1.00 0.00 H new ATOM 0 HA ALA A 301 12.998 3.169 4.702 1.00 0.00 H new ATOM 0 HB1 ALA A 301 12.742 2.149 2.482 1.00 0.00 H new ATOM 0 HB2 ALA A 301 11.835 3.675 2.610 1.00 0.00 H new ATOM 0 HB3 ALA A 301 13.379 3.629 1.727 1.00 0.00 H new ATOM 1192 N ASN A 302 15.010 1.604 4.014 1.00 0.00 N ATOM 1193 CA ASN A 302 16.290 0.912 4.101 1.00 0.00 C ATOM 1194 C ASN A 302 16.264 -0.387 3.313 1.00 0.00 C ATOM 1195 O ASN A 302 15.200 -0.930 3.051 1.00 0.00 O ATOM 1196 CB ASN A 302 16.630 0.600 5.558 1.00 0.00 C ATOM 1197 CG ASN A 302 18.087 0.216 5.731 1.00 0.00 C ATOM 1198 OD1 ASN A 302 18.953 0.675 4.985 1.00 0.00 O ATOM 1199 ND2 ASN A 302 18.368 -0.636 6.703 1.00 0.00 N ATOM 0 H ASN A 302 14.192 0.996 4.058 1.00 0.00 H new ATOM 0 HA ASN A 302 17.049 1.571 3.678 1.00 0.00 H new ATOM 0 HB2 ASN A 302 16.408 1.470 6.176 1.00 0.00 H new ATOM 0 HB3 ASN A 302 15.996 -0.213 5.912 1.00 0.00 H new ATOM 0 HD21 ASN A 302 19.331 -0.936 6.856 1.00 0.00 H new ATOM 0 HD22 ASN A 302 17.622 -0.993 7.300 1.00 0.00 H new ATOM 1206 N SER A 303 17.438 -0.866 2.930 1.00 0.00 N ATOM 1207 CA SER A 303 17.569 -2.149 2.276 1.00 0.00 C ATOM 1208 C SER A 303 18.786 -2.891 2.803 1.00 0.00 C ATOM 1209 O SER A 303 19.913 -2.647 2.367 1.00 0.00 O ATOM 1210 CB SER A 303 17.701 -1.947 0.771 1.00 0.00 C ATOM 1211 OG SER A 303 17.857 -0.573 0.460 1.00 0.00 O ATOM 0 H SER A 303 18.321 -0.374 3.066 1.00 0.00 H new ATOM 0 HA SER A 303 16.679 -2.742 2.486 1.00 0.00 H new ATOM 0 HB2 SER A 303 18.557 -2.509 0.398 1.00 0.00 H new ATOM 0 HB3 SER A 303 16.818 -2.341 0.268 1.00 0.00 H new ATOM 0 HG SER A 303 18.687 -0.239 0.861 1.00 0.00 H new ATOM 1217 N ASP A 304 18.566 -3.764 3.765 1.00 0.00 N ATOM 1218 CA ASP A 304 19.617 -4.650 4.223 1.00 0.00 C ATOM 1219 C ASP A 304 19.295 -6.057 3.752 1.00 0.00 C ATOM 1220 O ASP A 304 18.130 -6.396 3.526 1.00 0.00 O ATOM 1221 CB ASP A 304 19.766 -4.604 5.750 1.00 0.00 C ATOM 1222 CG ASP A 304 18.696 -5.383 6.484 1.00 0.00 C ATOM 1223 OD1 ASP A 304 18.931 -6.568 6.795 1.00 0.00 O ATOM 1224 OD2 ASP A 304 17.625 -4.813 6.765 1.00 0.00 O1- ATOM 0 H ASP A 304 17.672 -3.879 4.243 1.00 0.00 H new ATOM 0 HA ASP A 304 20.570 -4.326 3.805 1.00 0.00 H new ATOM 0 HB2 ASP A 304 20.744 -4.999 6.024 1.00 0.00 H new ATOM 0 HB3 ASP A 304 19.738 -3.565 6.079 1.00 0.00 H new ATOM 1229 N SER A 305 20.327 -6.867 3.590 1.00 0.00 N ATOM 1230 CA SER A 305 20.188 -8.178 2.973 1.00 0.00 C ATOM 1231 C SER A 305 19.400 -9.151 3.840 1.00 0.00 C ATOM 1232 O SER A 305 19.068 -10.250 3.396 1.00 0.00 O ATOM 1233 CB SER A 305 21.570 -8.744 2.676 1.00 0.00 C ATOM 1234 OG SER A 305 22.557 -8.107 3.476 1.00 0.00 O ATOM 0 H SER A 305 21.278 -6.639 3.879 1.00 0.00 H new ATOM 0 HA SER A 305 19.625 -8.051 2.048 1.00 0.00 H new ATOM 0 HB2 SER A 305 21.577 -9.817 2.867 1.00 0.00 H new ATOM 0 HB3 SER A 305 21.806 -8.606 1.621 1.00 0.00 H new ATOM 0 HG SER A 305 23.438 -8.485 3.272 1.00 0.00 H new ATOM 1240 N GLY A 306 19.094 -8.745 5.064 1.00 0.00 N ATOM 1241 CA GLY A 306 18.261 -9.554 5.924 1.00 0.00 C ATOM 1242 C GLY A 306 16.811 -9.480 5.507 1.00 0.00 C ATOM 1243 O GLY A 306 15.957 -10.172 6.062 1.00 0.00 O ATOM 0 H GLY A 306 19.410 -7.867 5.476 1.00 0.00 H new ATOM 0 HA2 GLY A 306 18.599 -10.590 5.892 1.00 0.00 H new ATOM 0 HA3 GLY A 306 18.363 -9.217 6.956 1.00 0.00 H new ATOM 1247 N GLY A 307 16.539 -8.638 4.520 1.00 0.00 N ATOM 1248 CA GLY A 307 15.202 -8.551 3.975 1.00 0.00 C ATOM 1249 C GLY A 307 14.294 -7.592 4.722 1.00 0.00 C ATOM 1250 O GLY A 307 13.140 -7.920 4.972 1.00 0.00 O ATOM 0 H GLY A 307 17.221 -8.014 4.088 1.00 0.00 H new ATOM 0 HA2 GLY A 307 15.265 -8.239 2.933 1.00 0.00 H new ATOM 0 HA3 GLY A 307 14.752 -9.544 3.984 1.00 0.00 H new ATOM 1254 N ASP A 308 14.802 -6.421 5.090 1.00 0.00 N ATOM 1255 CA ASP A 308 13.989 -5.433 5.804 1.00 0.00 C ATOM 1256 C ASP A 308 13.980 -4.076 5.098 1.00 0.00 C ATOM 1257 O ASP A 308 15.016 -3.599 4.631 1.00 0.00 O ATOM 1258 CB ASP A 308 14.492 -5.250 7.234 1.00 0.00 C ATOM 1259 CG ASP A 308 13.966 -6.292 8.198 1.00 0.00 C ATOM 1260 OD1 ASP A 308 14.706 -7.251 8.507 1.00 0.00 O ATOM 1261 OD2 ASP A 308 12.817 -6.147 8.671 1.00 0.00 O1- ATOM 0 H ASP A 308 15.763 -6.131 4.910 1.00 0.00 H new ATOM 0 HA ASP A 308 12.970 -5.819 5.818 1.00 0.00 H new ATOM 0 HB2 ASP A 308 15.581 -5.283 7.234 1.00 0.00 H new ATOM 0 HB3 ASP A 308 14.203 -4.260 7.588 1.00 0.00 H new ATOM 1266 N VAL A 309 12.796 -3.467 5.026 1.00 0.00 N ATOM 1267 CA VAL A 309 12.621 -2.114 4.485 1.00 0.00 C ATOM 1268 C VAL A 309 11.364 -1.443 5.063 1.00 0.00 C ATOM 1269 O VAL A 309 10.254 -1.780 4.697 1.00 0.00 O ATOM 1270 CB VAL A 309 12.526 -2.134 2.930 1.00 0.00 C ATOM 1271 CG1 VAL A 309 11.695 -3.306 2.434 1.00 0.00 C ATOM 1272 CG2 VAL A 309 11.970 -0.826 2.369 1.00 0.00 C ATOM 0 H VAL A 309 11.927 -3.898 5.342 1.00 0.00 H new ATOM 0 HA VAL A 309 13.499 -1.538 4.778 1.00 0.00 H new ATOM 0 HB VAL A 309 13.546 -2.251 2.564 1.00 0.00 H new ATOM 0 HG11 VAL A 309 11.652 -3.286 1.345 1.00 0.00 H new ATOM 0 HG12 VAL A 309 12.151 -4.240 2.762 1.00 0.00 H new ATOM 0 HG13 VAL A 309 10.686 -3.233 2.839 1.00 0.00 H new ATOM 0 HG21 VAL A 309 11.922 -0.887 1.282 1.00 0.00 H new ATOM 0 HG22 VAL A 309 10.970 -0.656 2.767 1.00 0.00 H new ATOM 0 HG23 VAL A 309 12.621 -0.001 2.658 1.00 0.00 H new ATOM 1282 N THR A 310 11.527 -0.488 5.961 1.00 0.00 N ATOM 1283 CA THR A 310 10.370 0.173 6.562 1.00 0.00 C ATOM 1284 C THR A 310 10.190 1.590 6.016 1.00 0.00 C ATOM 1285 O THR A 310 11.142 2.368 5.980 1.00 0.00 O ATOM 1286 CB THR A 310 10.516 0.238 8.108 1.00 0.00 C ATOM 1287 OG1 THR A 310 10.516 -1.087 8.660 1.00 0.00 O ATOM 1288 CG2 THR A 310 9.407 1.072 8.774 1.00 0.00 C ATOM 0 H THR A 310 12.432 -0.153 6.290 1.00 0.00 H new ATOM 0 HA THR A 310 9.491 -0.418 6.303 1.00 0.00 H new ATOM 0 HB THR A 310 11.466 0.731 8.315 1.00 0.00 H new ATOM 0 HG1 THR A 310 10.610 -1.036 9.634 1.00 0.00 H new ATOM 0 HG21 THR A 310 9.559 1.083 9.853 1.00 0.00 H new ATOM 0 HG22 THR A 310 9.440 2.092 8.392 1.00 0.00 H new ATOM 0 HG23 THR A 310 8.436 0.632 8.549 1.00 0.00 H new ATOM 1296 N VAL A 311 8.970 1.913 5.587 1.00 0.00 N ATOM 1297 CA VAL A 311 8.644 3.278 5.159 1.00 0.00 C ATOM 1298 C VAL A 311 7.134 3.508 5.204 1.00 0.00 C ATOM 1299 O VAL A 311 6.345 2.588 5.002 1.00 0.00 O ATOM 1300 CB VAL A 311 9.162 3.584 3.725 1.00 0.00 C ATOM 1301 CG1 VAL A 311 8.565 2.597 2.710 1.00 0.00 C ATOM 1302 CG2 VAL A 311 8.831 5.025 3.321 1.00 0.00 C ATOM 0 H VAL A 311 8.194 1.254 5.526 1.00 0.00 H new ATOM 0 HA VAL A 311 9.145 3.952 5.854 1.00 0.00 H new ATOM 0 HB VAL A 311 10.246 3.467 3.727 1.00 0.00 H new ATOM 0 HG11 VAL A 311 8.940 2.829 1.713 1.00 0.00 H new ATOM 0 HG12 VAL A 311 8.852 1.580 2.979 1.00 0.00 H new ATOM 0 HG13 VAL A 311 7.478 2.681 2.717 1.00 0.00 H new ATOM 0 HG21 VAL A 311 9.203 5.215 2.314 1.00 0.00 H new ATOM 0 HG22 VAL A 311 7.751 5.170 3.342 1.00 0.00 H new ATOM 0 HG23 VAL A 311 9.303 5.716 4.019 1.00 0.00 H new ATOM 1312 N THR A 312 6.741 4.734 5.503 1.00 0.00 N ATOM 1313 CA THR A 312 5.349 5.117 5.465 1.00 0.00 C ATOM 1314 C THR A 312 4.963 5.551 4.051 1.00 0.00 C ATOM 1315 O THR A 312 5.796 6.052 3.292 1.00 0.00 O ATOM 1316 CB THR A 312 5.093 6.275 6.465 1.00 0.00 C ATOM 1317 OG1 THR A 312 5.329 5.818 7.799 1.00 0.00 O ATOM 1318 CG2 THR A 312 3.675 6.878 6.358 1.00 0.00 C ATOM 0 H THR A 312 7.376 5.484 5.777 1.00 0.00 H new ATOM 0 HA THR A 312 4.738 4.261 5.749 1.00 0.00 H new ATOM 0 HB THR A 312 5.788 7.074 6.206 1.00 0.00 H new ATOM 0 HG1 THR A 312 4.533 5.983 8.347 1.00 0.00 H new ATOM 0 HG21 THR A 312 3.566 7.682 7.086 1.00 0.00 H new ATOM 0 HG22 THR A 312 3.523 7.274 5.354 1.00 0.00 H new ATOM 0 HG23 THR A 312 2.934 6.104 6.559 1.00 0.00 H new ATOM 1326 N LEU A 313 3.707 5.341 3.707 1.00 0.00 N ATOM 1327 CA LEU A 313 3.198 5.651 2.389 1.00 0.00 C ATOM 1328 C LEU A 313 1.974 6.555 2.494 1.00 0.00 C ATOM 1329 O LEU A 313 1.385 6.699 3.567 1.00 0.00 O ATOM 1330 CB LEU A 313 2.829 4.361 1.656 1.00 0.00 C ATOM 1331 CG LEU A 313 3.985 3.382 1.434 1.00 0.00 C ATOM 1332 CD1 LEU A 313 4.179 2.472 2.637 1.00 0.00 C ATOM 1333 CD2 LEU A 313 3.772 2.559 0.176 1.00 0.00 C ATOM 0 H LEU A 313 3.009 4.948 4.339 1.00 0.00 H new ATOM 0 HA LEU A 313 3.973 6.173 1.828 1.00 0.00 H new ATOM 0 HB2 LEU A 313 2.047 3.853 2.220 1.00 0.00 H new ATOM 0 HB3 LEU A 313 2.404 4.622 0.687 1.00 0.00 H new ATOM 0 HG LEU A 313 4.892 3.974 1.307 1.00 0.00 H new ATOM 0 HD11 LEU A 313 5.007 1.789 2.447 1.00 0.00 H new ATOM 0 HD12 LEU A 313 4.401 3.075 3.517 1.00 0.00 H new ATOM 0 HD13 LEU A 313 3.268 1.898 2.810 1.00 0.00 H new ATOM 0 HD21 LEU A 313 4.609 1.873 0.044 1.00 0.00 H new ATOM 0 HD22 LEU A 313 2.847 1.990 0.266 1.00 0.00 H new ATOM 0 HD23 LEU A 313 3.708 3.223 -0.686 1.00 0.00 H new ATOM 1345 N SER A 314 1.594 7.165 1.383 1.00 0.00 N ATOM 1346 CA SER A 314 0.437 8.043 1.359 1.00 0.00 C ATOM 1347 C SER A 314 -0.485 7.692 0.192 1.00 0.00 C ATOM 1348 O SER A 314 -0.020 7.465 -0.927 1.00 0.00 O ATOM 1349 CB SER A 314 0.891 9.501 1.247 1.00 0.00 C ATOM 1350 OG SER A 314 1.854 9.817 2.243 1.00 0.00 O ATOM 0 H SER A 314 2.070 7.068 0.486 1.00 0.00 H new ATOM 0 HA SER A 314 -0.117 7.909 2.288 1.00 0.00 H new ATOM 0 HB2 SER A 314 1.315 9.678 0.258 1.00 0.00 H new ATOM 0 HB3 SER A 314 0.030 10.162 1.347 1.00 0.00 H new ATOM 0 HG SER A 314 2.128 10.753 2.148 1.00 0.00 H new ATOM 1632 N VAL A 333 -7.427 -3.979 6.445 1.00 0.00 N ATOM 1633 CA VAL A 333 -6.191 -4.037 5.677 1.00 0.00 C ATOM 1634 C VAL A 333 -5.401 -5.306 6.016 1.00 0.00 C ATOM 1635 O VAL A 333 -5.396 -5.753 7.164 1.00 0.00 O ATOM 1636 CB VAL A 333 -5.325 -2.776 5.909 1.00 0.00 C ATOM 1637 CG1 VAL A 333 -5.038 -2.573 7.390 1.00 0.00 C ATOM 1638 CG2 VAL A 333 -4.036 -2.858 5.111 1.00 0.00 C ATOM 0 HA VAL A 333 -6.457 -4.069 4.620 1.00 0.00 H new ATOM 0 HB VAL A 333 -5.887 -1.910 5.559 1.00 0.00 H new ATOM 0 HG11 VAL A 333 -4.428 -1.680 7.523 1.00 0.00 H new ATOM 0 HG12 VAL A 333 -5.978 -2.454 7.930 1.00 0.00 H new ATOM 0 HG13 VAL A 333 -4.503 -3.439 7.779 1.00 0.00 H new ATOM 0 HG21 VAL A 333 -3.441 -1.962 5.288 1.00 0.00 H new ATOM 0 HG22 VAL A 333 -3.471 -3.736 5.422 1.00 0.00 H new ATOM 0 HG23 VAL A 333 -4.270 -2.935 4.049 1.00 0.00 H new ATOM 1648 N GLU A 334 -4.749 -5.880 5.011 1.00 0.00 N ATOM 1649 CA GLU A 334 -4.060 -7.154 5.162 1.00 0.00 C ATOM 1650 C GLU A 334 -2.560 -6.993 4.895 1.00 0.00 C ATOM 1651 O GLU A 334 -2.158 -6.175 4.074 1.00 0.00 O ATOM 1652 CB GLU A 334 -4.672 -8.171 4.195 1.00 0.00 C ATOM 1653 CG GLU A 334 -4.187 -9.594 4.397 1.00 0.00 C ATOM 1654 CD GLU A 334 -4.822 -10.562 3.424 1.00 0.00 C ATOM 1655 OE1 GLU A 334 -4.180 -10.884 2.402 1.00 0.00 O ATOM 1656 OE2 GLU A 334 -5.962 -11.012 3.683 1.00 0.00 O1- ATOM 0 H GLU A 334 -4.684 -5.478 4.076 1.00 0.00 H new ATOM 0 HA GLU A 334 -4.179 -7.509 6.186 1.00 0.00 H new ATOM 0 HB2 GLU A 334 -5.756 -8.150 4.303 1.00 0.00 H new ATOM 0 HB3 GLU A 334 -4.447 -7.864 3.173 1.00 0.00 H new ATOM 0 HG2 GLU A 334 -3.104 -9.626 4.282 1.00 0.00 H new ATOM 0 HG3 GLU A 334 -4.409 -9.910 5.416 1.00 0.00 H new ATOM 1663 N ALA A 335 -1.745 -7.739 5.635 1.00 0.00 N ATOM 1664 CA ALA A 335 -0.295 -7.720 5.459 1.00 0.00 C ATOM 1665 C ALA A 335 0.185 -8.926 4.648 1.00 0.00 C ATOM 1666 O ALA A 335 -0.433 -9.991 4.695 1.00 0.00 O ATOM 1667 CB ALA A 335 0.390 -7.711 6.816 1.00 0.00 C ATOM 0 H ALA A 335 -2.067 -8.370 6.369 1.00 0.00 H new ATOM 0 HA ALA A 335 -0.035 -6.815 4.909 1.00 0.00 H new ATOM 0 HB1 ALA A 335 1.471 -7.697 6.678 1.00 0.00 H new ATOM 0 HB2 ALA A 335 0.084 -6.825 7.372 1.00 0.00 H new ATOM 0 HB3 ALA A 335 0.107 -8.605 7.372 1.00 0.00 H new ATOM 1673 N GLY A 336 1.302 -8.776 3.937 1.00 0.00 N ATOM 1674 CA GLY A 336 1.902 -9.916 3.262 1.00 0.00 C ATOM 1675 C GLY A 336 1.837 -9.823 1.751 1.00 0.00 C ATOM 1676 O GLY A 336 2.107 -10.803 1.050 1.00 0.00 O ATOM 0 H GLY A 336 1.798 -7.893 3.817 1.00 0.00 H new ATOM 0 HA2 GLY A 336 2.944 -10.003 3.569 1.00 0.00 H new ATOM 0 HA3 GLY A 336 1.397 -10.827 3.585 1.00 0.00 H new ATOM 1680 N ASP A 337 1.488 -8.649 1.249 1.00 0.00 N ATOM 1681 CA ASP A 337 1.323 -8.435 -0.187 1.00 0.00 C ATOM 1682 C ASP A 337 2.670 -8.434 -0.911 1.00 0.00 C ATOM 1683 O ASP A 337 3.732 -8.404 -0.281 1.00 0.00 O ATOM 1684 CB ASP A 337 0.603 -7.111 -0.428 1.00 0.00 C ATOM 1685 CG ASP A 337 -0.604 -6.948 0.470 1.00 0.00 C ATOM 1686 OD1 ASP A 337 -1.601 -7.683 0.280 1.00 0.00 O ATOM 1687 OD2 ASP A 337 -0.546 -6.101 1.380 1.00 0.00 O1- ATOM 0 H ASP A 337 1.311 -7.821 1.817 1.00 0.00 H new ATOM 0 HA ASP A 337 0.729 -9.257 -0.587 1.00 0.00 H new ATOM 0 HB2 ASP A 337 1.295 -6.286 -0.258 1.00 0.00 H new ATOM 0 HB3 ASP A 337 0.289 -7.054 -1.470 1.00 0.00 H new ATOM 1692 N ALA A 338 2.621 -8.476 -2.237 1.00 0.00 N ATOM 1693 CA ALA A 338 3.831 -8.492 -3.053 1.00 0.00 C ATOM 1694 C ALA A 338 4.139 -7.094 -3.581 1.00 0.00 C ATOM 1695 O ALA A 338 3.319 -6.492 -4.273 1.00 0.00 O ATOM 1696 CB ALA A 338 3.679 -9.477 -4.205 1.00 0.00 C ATOM 0 H ALA A 338 1.753 -8.500 -2.773 1.00 0.00 H new ATOM 0 HA ALA A 338 4.665 -8.814 -2.430 1.00 0.00 H new ATOM 0 HB1 ALA A 338 4.589 -9.478 -4.805 1.00 0.00 H new ATOM 0 HB2 ALA A 338 3.505 -10.477 -3.808 1.00 0.00 H new ATOM 0 HB3 ALA A 338 2.834 -9.181 -4.827 1.00 0.00 H new ATOM 1702 N VAL A 339 5.328 -6.595 -3.264 1.00 0.00 N ATOM 1703 CA VAL A 339 5.696 -5.215 -3.556 1.00 0.00 C ATOM 1704 C VAL A 339 6.577 -5.114 -4.805 1.00 0.00 C ATOM 1705 O VAL A 339 7.374 -6.002 -5.096 1.00 0.00 O ATOM 1706 CB VAL A 339 6.426 -4.587 -2.332 1.00 0.00 C ATOM 1707 CG1 VAL A 339 7.073 -3.253 -2.686 1.00 0.00 C ATOM 1708 CG2 VAL A 339 5.450 -4.387 -1.191 1.00 0.00 C ATOM 0 H VAL A 339 6.060 -7.132 -2.800 1.00 0.00 H new ATOM 0 HA VAL A 339 4.778 -4.661 -3.754 1.00 0.00 H new ATOM 0 HB VAL A 339 7.213 -5.277 -2.029 1.00 0.00 H new ATOM 0 HG11 VAL A 339 7.572 -2.846 -1.807 1.00 0.00 H new ATOM 0 HG12 VAL A 339 7.803 -3.402 -3.481 1.00 0.00 H new ATOM 0 HG13 VAL A 339 6.307 -2.555 -3.023 1.00 0.00 H new ATOM 0 HG21 VAL A 339 5.970 -3.947 -0.340 1.00 0.00 H new ATOM 0 HG22 VAL A 339 4.649 -3.721 -1.510 1.00 0.00 H new ATOM 0 HG23 VAL A 339 5.028 -5.349 -0.901 1.00 0.00 H new ATOM 1718 N SER A 340 6.391 -4.033 -5.548 1.00 0.00 N ATOM 1719 CA SER A 340 7.179 -3.733 -6.733 1.00 0.00 C ATOM 1720 C SER A 340 7.245 -2.211 -6.923 1.00 0.00 C ATOM 1721 O SER A 340 6.672 -1.461 -6.133 1.00 0.00 O ATOM 1722 CB SER A 340 6.557 -4.414 -7.955 1.00 0.00 C ATOM 1723 OG SER A 340 6.518 -5.822 -7.785 1.00 0.00 O ATOM 0 H SER A 340 5.680 -3.331 -5.342 1.00 0.00 H new ATOM 0 HA SER A 340 8.193 -4.114 -6.613 1.00 0.00 H new ATOM 0 HB2 SER A 340 5.547 -4.035 -8.113 1.00 0.00 H new ATOM 0 HB3 SER A 340 7.133 -4.167 -8.847 1.00 0.00 H new ATOM 0 HG SER A 340 6.115 -6.236 -8.577 1.00 0.00 H new ATOM 1729 N VAL A 341 7.945 -1.756 -7.953 1.00 0.00 N ATOM 1730 CA VAL A 341 8.148 -0.327 -8.180 1.00 0.00 C ATOM 1731 C VAL A 341 7.397 0.104 -9.436 1.00 0.00 C ATOM 1732 O VAL A 341 7.317 -0.653 -10.400 1.00 0.00 O ATOM 1733 CB VAL A 341 9.656 -0.005 -8.340 1.00 0.00 C ATOM 1734 CG1 VAL A 341 9.900 1.496 -8.425 1.00 0.00 C ATOM 1735 CG2 VAL A 341 10.456 -0.607 -7.194 1.00 0.00 C ATOM 0 H VAL A 341 8.385 -2.357 -8.649 1.00 0.00 H new ATOM 0 HA VAL A 341 7.766 0.219 -7.317 1.00 0.00 H new ATOM 0 HB VAL A 341 9.991 -0.452 -9.276 1.00 0.00 H new ATOM 0 HG11 VAL A 341 10.968 1.685 -8.537 1.00 0.00 H new ATOM 0 HG12 VAL A 341 9.367 1.903 -9.284 1.00 0.00 H new ATOM 0 HG13 VAL A 341 9.540 1.975 -7.515 1.00 0.00 H new ATOM 0 HG21 VAL A 341 11.512 -0.370 -7.324 1.00 0.00 H new ATOM 0 HG22 VAL A 341 10.105 -0.193 -6.249 1.00 0.00 H new ATOM 0 HG23 VAL A 341 10.325 -1.689 -7.188 1.00 0.00 H new ATOM 1745 N VAL A 342 6.841 1.320 -9.414 1.00 0.00 N ATOM 1746 CA VAL A 342 6.013 1.809 -10.518 1.00 0.00 C ATOM 1747 C VAL A 342 6.862 2.069 -11.762 1.00 0.00 C ATOM 1748 O VAL A 342 6.363 2.044 -12.885 1.00 0.00 O ATOM 1749 CB VAL A 342 5.249 3.105 -10.138 1.00 0.00 C ATOM 1750 CG1 VAL A 342 6.200 4.290 -10.036 1.00 0.00 C ATOM 1751 CG2 VAL A 342 4.133 3.403 -11.139 1.00 0.00 C ATOM 0 H VAL A 342 6.950 1.981 -8.645 1.00 0.00 H new ATOM 0 HA VAL A 342 5.283 1.029 -10.733 1.00 0.00 H new ATOM 0 HB VAL A 342 4.795 2.943 -9.160 1.00 0.00 H new ATOM 0 HG11 VAL A 342 5.639 5.185 -9.769 1.00 0.00 H new ATOM 0 HG12 VAL A 342 6.950 4.090 -9.271 1.00 0.00 H new ATOM 0 HG13 VAL A 342 6.693 4.444 -10.996 1.00 0.00 H new ATOM 0 HG21 VAL A 342 3.616 4.317 -10.846 1.00 0.00 H new ATOM 0 HG22 VAL A 342 4.561 3.531 -12.133 1.00 0.00 H new ATOM 0 HG23 VAL A 342 3.425 2.574 -11.152 1.00 0.00 H new