USER MOD reduce.3.24.130724 H: found=0, std=0, add=720, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 722 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 236 HIS : no HD1:sc= 0.981 K(o=0.73,f=-11!) USER MOD Set 1.2: A 311 ASN : amide:sc= -1.61 K(o=0.73,f=-0.74!) USER MOD Set 1.3: A 316 SER OG : rot -22:sc= 1.35 USER MOD Set 2.1: A 275 SER OG : rot 180:sc=-0.00538 USER MOD Set 2.2: A 288 GLN : amide:sc= 0.499 K(o=0.49,f=-7.3!) USER MOD Set 3.1: A 231 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 258 SER OG : rot 180:sc= 0 USER MOD Single : A 227 SER OG : rot 26:sc= 0.038 USER MOD Single : A 229 THR OG1 : rot 180:sc= -1.71! USER MOD Single : A 233 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 237 LYS NZ :NH3+ -168:sc=-0.00791 (180deg=-0.185) USER MOD Single : A 252 GLN :FLIP amide:sc= -0.922 F(o=-5.5!,f=-0.92) USER MOD Single : A 254 THR OG1 : rot 31:sc= 0.607 USER MOD Single : A 256 THR OG1 : rot 180:sc= 0 USER MOD Single : A 260 SER OG : rot 180:sc= 0 USER MOD Single : A 263 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 269 THR OG1 : rot 180:sc= -0.0375 USER MOD Single : A 274 ASN : amide:sc= -2.85! C(o=-2.8!,f=-2.5!) USER MOD Single : A 277 HIS : no HE2:sc= 0.148 K(o=0.15,f=-4.4!) USER MOD Single : A 278 GLN : amide:sc= -0.915 K(o=-0.92,f=-4!) USER MOD Single : A 280 THR OG1 : rot 180:sc= 0 USER MOD Single : A 281 LYS NZ :NH3+ -169:sc= -0.0297 (180deg=-0.182) USER MOD Single : A 283 THR OG1 : rot 33:sc= 0.225 USER MOD Single : A 284 THR OG1 : rot 180:sc= 0 USER MOD Single : A 286 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 296 SER OG : rot -1:sc= 0.409 USER MOD Single : A 298 THR OG1 : rot 12:sc= 1 USER MOD Single : A 299 THR OG1 : rot 180:sc= 0 USER MOD Single : A 301 THR OG1 : rot 180:sc= -0.115 USER MOD Single : A 303 SER OG : rot 180:sc= -1.63! USER MOD Single : A 305 LYS NZ :NH3+ -138:sc= -1.57 (180deg=-3.88!) USER MOD Single : A 312 THR OG1 : rot 180:sc= 0 USER MOD Single : A 319 TYR OH : rot 180:sc= 0 USER MOD Single : A 321 ASN :FLIP amide:sc= -2.16! C(o=-4.4!,f=-2.2!) USER MOD Single : A 325 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 329 SER OG : rot 59:sc= 0.635 USER MOD Single : A 333 THR OG1 : rot 180:sc= 0 USER MOD Single : A 336 ASN : amide:sc= -0.219 X(o=-0.22,f=-0.22) USER MOD Single : A 337 LYS NZ :NH3+ 164:sc= -0.075 (180deg=-0.38) USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 227 17.069 -6.355 6.247 1.00 0.00 N ATOM 49 CA SER A 227 17.663 -5.447 5.271 1.00 0.00 C ATOM 50 C SER A 227 17.209 -4.008 5.503 1.00 0.00 C ATOM 51 O SER A 227 17.771 -3.300 6.338 1.00 0.00 O ATOM 52 CB SER A 227 17.360 -5.892 3.836 1.00 0.00 C ATOM 53 OG SER A 227 17.867 -7.195 3.585 1.00 0.00 O ATOM 0 HA SER A 227 18.744 -5.483 5.409 1.00 0.00 H new ATOM 0 HB2 SER A 227 16.283 -5.879 3.668 1.00 0.00 H new ATOM 0 HB3 SER A 227 17.801 -5.186 3.133 1.00 0.00 H new ATOM 0 HG SER A 227 17.921 -7.693 4.427 1.00 0.00 H new ATOM 59 N LEU A 228 16.219 -3.573 4.746 1.00 0.00 N ATOM 60 CA LEU A 228 15.722 -2.208 4.844 1.00 0.00 C ATOM 61 C LEU A 228 14.423 -2.176 5.627 1.00 0.00 C ATOM 62 O LEU A 228 13.578 -3.058 5.464 1.00 0.00 O ATOM 63 CB LEU A 228 15.504 -1.646 3.441 1.00 0.00 C ATOM 64 CG LEU A 228 16.748 -1.645 2.557 1.00 0.00 C ATOM 65 CD1 LEU A 228 16.408 -1.168 1.154 1.00 0.00 C ATOM 66 CD2 LEU A 228 17.833 -0.769 3.161 1.00 0.00 C ATOM 0 H LEU A 228 15.739 -4.146 4.052 1.00 0.00 H new ATOM 0 HA LEU A 228 16.456 -1.596 5.368 1.00 0.00 H new ATOM 0 HB2 LEU A 228 14.724 -2.227 2.948 1.00 0.00 H new ATOM 0 HB3 LEU A 228 15.134 -0.624 3.526 1.00 0.00 H new ATOM 0 HG LEU A 228 17.121 -2.667 2.495 1.00 0.00 H new ATOM 0 HD11 LEU A 228 17.308 -1.175 0.539 1.00 0.00 H new ATOM 0 HD12 LEU A 228 15.664 -1.832 0.714 1.00 0.00 H new ATOM 0 HD13 LEU A 228 16.008 -0.155 1.201 1.00 0.00 H new ATOM 0 HD21 LEU A 228 18.712 -0.781 2.516 1.00 0.00 H new ATOM 0 HD22 LEU A 228 17.466 0.253 3.254 1.00 0.00 H new ATOM 0 HD23 LEU A 228 18.101 -1.149 4.147 1.00 0.00 H new ATOM 78 N THR A 229 14.224 -1.143 6.433 1.00 0.00 N ATOM 79 CA THR A 229 12.974 -1.027 7.166 1.00 0.00 C ATOM 80 C THR A 229 12.263 0.261 6.806 1.00 0.00 C ATOM 81 O THR A 229 12.818 1.102 6.104 1.00 0.00 O ATOM 82 CB THR A 229 13.210 -1.124 8.679 1.00 0.00 C ATOM 83 OG1 THR A 229 14.199 -0.212 9.109 1.00 0.00 O ATOM 84 CG2 THR A 229 13.633 -2.496 9.137 1.00 0.00 C ATOM 0 H THR A 229 14.894 -0.391 6.593 1.00 0.00 H new ATOM 0 HA THR A 229 12.333 -1.860 6.878 1.00 0.00 H new ATOM 0 HB THR A 229 12.242 -0.888 9.121 1.00 0.00 H new ATOM 0 HG1 THR A 229 14.324 -0.298 10.077 1.00 0.00 H new ATOM 0 HG21 THR A 229 13.782 -2.489 10.217 1.00 0.00 H new ATOM 0 HG22 THR A 229 12.859 -3.220 8.882 1.00 0.00 H new ATOM 0 HG23 THR A 229 14.565 -2.773 8.644 1.00 0.00 H new ATOM 92 N VAL A 230 11.031 0.410 7.267 1.00 0.00 N ATOM 93 CA VAL A 230 10.248 1.600 6.979 1.00 0.00 C ATOM 94 C VAL A 230 9.336 1.933 8.155 1.00 0.00 C ATOM 95 O VAL A 230 8.588 1.077 8.641 1.00 0.00 O ATOM 96 CB VAL A 230 9.396 1.441 5.695 1.00 0.00 C ATOM 97 CG1 VAL A 230 8.579 2.694 5.431 1.00 0.00 C ATOM 98 CG2 VAL A 230 10.261 1.136 4.489 1.00 0.00 C ATOM 0 H VAL A 230 10.551 -0.281 7.844 1.00 0.00 H new ATOM 0 HA VAL A 230 10.954 2.415 6.816 1.00 0.00 H new ATOM 0 HB VAL A 230 8.721 0.601 5.858 1.00 0.00 H new ATOM 0 HG11 VAL A 230 7.989 2.559 4.525 1.00 0.00 H new ATOM 0 HG12 VAL A 230 7.913 2.878 6.274 1.00 0.00 H new ATOM 0 HG13 VAL A 230 9.248 3.545 5.305 1.00 0.00 H new ATOM 0 HG21 VAL A 230 9.630 1.031 3.606 1.00 0.00 H new ATOM 0 HG22 VAL A 230 10.969 1.950 4.334 1.00 0.00 H new ATOM 0 HG23 VAL A 230 10.806 0.208 4.658 1.00 0.00 H new ATOM 108 N SER A 231 9.370 3.189 8.571 1.00 0.00 N ATOM 109 CA SER A 231 8.518 3.664 9.644 1.00 0.00 C ATOM 110 C SER A 231 7.269 4.312 9.063 1.00 0.00 C ATOM 111 O SER A 231 7.218 4.624 7.874 1.00 0.00 O ATOM 112 CB SER A 231 9.275 4.672 10.505 1.00 0.00 C ATOM 113 OG SER A 231 10.473 4.111 11.017 1.00 0.00 O ATOM 0 H SER A 231 9.985 3.901 8.177 1.00 0.00 H new ATOM 0 HA SER A 231 8.225 2.818 10.266 1.00 0.00 H new ATOM 0 HB2 SER A 231 9.509 5.557 9.913 1.00 0.00 H new ATOM 0 HB3 SER A 231 8.641 4.998 11.330 1.00 0.00 H new ATOM 0 HG SER A 231 10.939 4.778 11.563 1.00 0.00 H new ATOM 119 N GLY A 232 6.259 4.505 9.890 1.00 0.00 N ATOM 120 CA GLY A 232 5.031 5.101 9.412 1.00 0.00 C ATOM 121 C GLY A 232 3.957 4.068 9.176 1.00 0.00 C ATOM 122 O GLY A 232 4.250 2.944 8.769 1.00 0.00 O ATOM 0 H GLY A 232 6.265 4.261 10.880 1.00 0.00 H new ATOM 0 HA2 GLY A 232 4.677 5.833 10.138 1.00 0.00 H new ATOM 0 HA3 GLY A 232 5.226 5.640 8.485 1.00 0.00 H new ATOM 126 N GLN A 233 2.724 4.420 9.498 1.00 0.00 N ATOM 127 CA GLN A 233 1.611 3.486 9.389 1.00 0.00 C ATOM 128 C GLN A 233 0.814 3.731 8.112 1.00 0.00 C ATOM 129 O GLN A 233 0.047 4.693 8.039 1.00 0.00 O ATOM 130 CB GLN A 233 0.688 3.641 10.601 1.00 0.00 C ATOM 131 CG GLN A 233 1.393 3.459 11.937 1.00 0.00 C ATOM 132 CD GLN A 233 0.472 3.709 13.114 1.00 0.00 C ATOM 133 OE1 GLN A 233 -0.539 3.027 13.285 1.00 0.00 O ATOM 134 NE2 GLN A 233 0.810 4.699 13.925 1.00 0.00 N ATOM 0 H GLN A 233 2.466 5.346 9.838 1.00 0.00 H new ATOM 0 HA GLN A 233 2.016 2.475 9.357 1.00 0.00 H new ATOM 0 HB2 GLN A 233 0.231 4.630 10.574 1.00 0.00 H new ATOM 0 HB3 GLN A 233 -0.121 2.914 10.525 1.00 0.00 H new ATOM 0 HG2 GLN A 233 1.792 2.446 12.000 1.00 0.00 H new ATOM 0 HG3 GLN A 233 2.242 4.140 11.992 1.00 0.00 H new ATOM 0 HE21 GLN A 233 1.657 5.239 13.746 1.00 0.00 H new ATOM 0 HE22 GLN A 233 0.224 4.922 14.729 1.00 0.00 H new ATOM 143 N PRO A 234 0.924 2.832 7.114 1.00 0.00 N ATOM 144 CA PRO A 234 0.137 2.934 5.881 1.00 0.00 C ATOM 145 C PRO A 234 -1.353 2.846 6.184 1.00 0.00 C ATOM 146 O PRO A 234 -1.782 2.007 6.980 1.00 0.00 O ATOM 147 CB PRO A 234 0.596 1.730 5.050 1.00 0.00 C ATOM 148 CG PRO A 234 1.186 0.778 6.034 1.00 0.00 C ATOM 149 CD PRO A 234 1.758 1.620 7.140 1.00 0.00 C ATOM 0 HA PRO A 234 0.285 3.882 5.364 1.00 0.00 H new ATOM 0 HB2 PRO A 234 -0.240 1.278 4.517 1.00 0.00 H new ATOM 0 HB3 PRO A 234 1.329 2.026 4.300 1.00 0.00 H new ATOM 0 HG2 PRO A 234 0.428 0.095 6.417 1.00 0.00 H new ATOM 0 HG3 PRO A 234 1.960 0.168 5.569 1.00 0.00 H new ATOM 0 HD2 PRO A 234 1.699 1.112 8.103 1.00 0.00 H new ATOM 0 HD3 PRO A 234 2.809 1.852 6.966 1.00 0.00 H new ATOM 157 N GLU A 235 -2.110 3.812 5.697 1.00 0.00 N ATOM 158 CA GLU A 235 -3.502 3.928 6.088 1.00 0.00 C ATOM 159 C GLU A 235 -4.478 3.744 4.924 1.00 0.00 C ATOM 160 O GLU A 235 -4.088 3.384 3.814 1.00 0.00 O ATOM 161 CB GLU A 235 -3.722 5.252 6.831 1.00 0.00 C ATOM 162 CG GLU A 235 -3.026 6.462 6.214 1.00 0.00 C ATOM 163 CD GLU A 235 -3.491 6.780 4.817 1.00 0.00 C ATOM 164 OE1 GLU A 235 -4.698 7.024 4.639 1.00 0.00 O ATOM 165 OE2 GLU A 235 -2.643 6.812 3.906 1.00 0.00 O1- ATOM 0 H GLU A 235 -1.789 4.520 5.037 1.00 0.00 H new ATOM 0 HA GLU A 235 -3.724 3.104 6.766 1.00 0.00 H new ATOM 0 HB2 GLU A 235 -4.793 5.452 6.877 1.00 0.00 H new ATOM 0 HB3 GLU A 235 -3.375 5.137 7.858 1.00 0.00 H new ATOM 0 HG2 GLU A 235 -3.195 7.331 6.850 1.00 0.00 H new ATOM 0 HG3 GLU A 235 -1.951 6.283 6.198 1.00 0.00 H new ATOM 172 N HIS A 236 -5.760 3.880 5.249 1.00 0.00 N ATOM 173 CA HIS A 236 -6.855 3.617 4.324 1.00 0.00 C ATOM 174 C HIS A 236 -8.169 4.147 4.874 1.00 0.00 C ATOM 175 O HIS A 236 -8.541 3.859 6.016 1.00 0.00 O ATOM 176 CB HIS A 236 -6.994 2.116 4.059 1.00 0.00 C ATOM 177 CG HIS A 236 -8.239 1.743 3.310 1.00 0.00 C ATOM 178 ND1 HIS A 236 -8.519 2.191 2.040 1.00 0.00 N ATOM 179 CD2 HIS A 236 -9.298 0.987 3.680 1.00 0.00 C ATOM 180 CE1 HIS A 236 -9.699 1.730 1.665 1.00 0.00 C ATOM 181 NE2 HIS A 236 -10.190 0.996 2.641 1.00 0.00 N ATOM 0 H HIS A 236 -6.070 4.180 6.173 1.00 0.00 H new ATOM 0 HA HIS A 236 -6.624 4.129 3.390 1.00 0.00 H new ATOM 0 HB2 HIS A 236 -6.126 1.775 3.494 1.00 0.00 H new ATOM 0 HB3 HIS A 236 -6.983 1.586 5.012 1.00 0.00 H new ATOM 0 HD2 HIS A 236 -9.418 0.471 4.621 1.00 0.00 H new ATOM 0 HE1 HIS A 236 -10.180 1.923 0.717 1.00 0.00 H new ATOM 0 HE2 HIS A 236 -11.088 0.513 2.626 1.00 0.00 H new ATOM 190 N LYS A 237 -8.918 4.799 4.000 1.00 0.00 N ATOM 191 CA LYS A 237 -10.276 5.252 4.302 1.00 0.00 C ATOM 192 C LYS A 237 -11.009 5.709 3.051 1.00 0.00 C ATOM 193 O LYS A 237 -10.536 6.576 2.309 1.00 0.00 O ATOM 194 CB LYS A 237 -10.304 6.355 5.377 1.00 0.00 C ATOM 195 CG LYS A 237 -9.023 7.166 5.493 1.00 0.00 C ATOM 196 CD LYS A 237 -8.634 7.866 4.206 1.00 0.00 C ATOM 197 CE LYS A 237 -7.278 8.528 4.350 1.00 0.00 C ATOM 198 NZ LYS A 237 -7.285 9.580 5.403 1.00 0.00 N1+ ATOM 0 H LYS A 237 -8.605 5.032 3.057 1.00 0.00 H new ATOM 0 HA LYS A 237 -10.800 4.386 4.708 1.00 0.00 H new ATOM 0 HB2 LYS A 237 -11.129 7.034 5.159 1.00 0.00 H new ATOM 0 HB3 LYS A 237 -10.515 5.896 6.343 1.00 0.00 H new ATOM 0 HG2 LYS A 237 -9.143 7.910 6.280 1.00 0.00 H new ATOM 0 HG3 LYS A 237 -8.211 6.506 5.799 1.00 0.00 H new ATOM 0 HD2 LYS A 237 -8.609 7.147 3.387 1.00 0.00 H new ATOM 0 HD3 LYS A 237 -9.385 8.614 3.951 1.00 0.00 H new ATOM 0 HE2 LYS A 237 -6.530 7.774 4.595 1.00 0.00 H new ATOM 0 HE3 LYS A 237 -6.986 8.970 3.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 237 -6.414 10.144 5.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 237 -8.110 10.199 5.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 237 -7.336 9.133 6.340 1.00 0.00 H new ATOM 416 N GLN A 252 -3.021 8.030 -1.280 1.00 0.00 N ATOM 417 CA GLN A 252 -1.848 7.177 -1.224 1.00 0.00 C ATOM 418 C GLN A 252 -1.168 7.311 0.129 1.00 0.00 C ATOM 419 O GLN A 252 -1.346 8.312 0.825 1.00 0.00 O ATOM 420 CB GLN A 252 -0.871 7.539 -2.345 1.00 0.00 C ATOM 421 CG GLN A 252 -1.498 7.509 -3.733 1.00 0.00 C ATOM 422 CD GLN A 252 -1.993 6.136 -4.159 1.00 0.00 C ATOM 423 OE1 GLN A 252 -1.733 5.120 -3.350 1.00 0.00 O flip ATOM 424 NE2 GLN A 252 -2.590 5.988 -5.222 1.00 0.00 N flip ATOM 0 HA GLN A 252 -2.163 6.142 -1.359 1.00 0.00 H new ATOM 0 HB2 GLN A 252 -0.469 8.535 -2.158 1.00 0.00 H new ATOM 0 HB3 GLN A 252 -0.030 6.846 -2.320 1.00 0.00 H new ATOM 0 HG2 GLN A 252 -2.333 8.209 -3.758 1.00 0.00 H new ATOM 0 HG3 GLN A 252 -0.765 7.861 -4.459 1.00 0.00 H new ATOM 0 HE21 GLN A 252 -2.773 6.793 -5.821 1.00 0.00 H new ATOM 0 HE22 GLN A 252 -2.903 5.060 -5.506 1.00 0.00 H new ATOM 433 N GLY A 253 -0.403 6.297 0.502 1.00 0.00 N ATOM 434 CA GLY A 253 0.272 6.323 1.782 1.00 0.00 C ATOM 435 C GLY A 253 1.596 7.046 1.718 1.00 0.00 C ATOM 436 O GLY A 253 2.374 6.842 0.787 1.00 0.00 O ATOM 0 H GLY A 253 -0.238 5.459 -0.056 1.00 0.00 H new ATOM 0 HA2 GLY A 253 -0.369 6.808 2.518 1.00 0.00 H new ATOM 0 HA3 GLY A 253 0.435 5.301 2.125 1.00 0.00 H new ATOM 440 N THR A 254 1.883 7.846 2.731 1.00 0.00 N ATOM 441 CA THR A 254 3.158 8.538 2.811 1.00 0.00 C ATOM 442 C THR A 254 3.866 8.157 4.102 1.00 0.00 C ATOM 443 O THR A 254 3.344 8.387 5.195 1.00 0.00 O ATOM 444 CB THR A 254 2.950 10.055 2.749 1.00 0.00 C ATOM 445 OG1 THR A 254 2.127 10.493 3.819 1.00 0.00 O ATOM 446 CG2 THR A 254 2.310 10.526 1.461 1.00 0.00 C ATOM 0 H THR A 254 1.250 8.032 3.509 1.00 0.00 H new ATOM 0 HA THR A 254 3.775 8.242 1.963 1.00 0.00 H new ATOM 0 HB THR A 254 3.951 10.482 2.814 1.00 0.00 H new ATOM 0 HG1 THR A 254 2.268 9.915 4.598 1.00 0.00 H new ATOM 0 HG21 THR A 254 2.194 11.609 1.488 1.00 0.00 H new ATOM 0 HG22 THR A 254 2.943 10.250 0.618 1.00 0.00 H new ATOM 0 HG23 THR A 254 1.332 10.059 1.349 1.00 0.00 H new ATOM 454 N ILE A 255 5.015 7.515 3.978 1.00 0.00 N ATOM 455 CA ILE A 255 5.742 7.035 5.143 1.00 0.00 C ATOM 456 C ILE A 255 7.201 7.467 5.104 1.00 0.00 C ATOM 457 O ILE A 255 7.752 7.752 4.037 1.00 0.00 O ATOM 458 CB ILE A 255 5.669 5.490 5.295 1.00 0.00 C ATOM 459 CG1 ILE A 255 6.269 4.751 4.084 1.00 0.00 C ATOM 460 CG2 ILE A 255 4.232 5.043 5.515 1.00 0.00 C ATOM 461 CD1 ILE A 255 5.462 4.859 2.807 1.00 0.00 C ATOM 0 H ILE A 255 5.465 7.314 3.085 1.00 0.00 H new ATOM 0 HA ILE A 255 5.254 7.486 6.007 1.00 0.00 H new ATOM 0 HB ILE A 255 6.269 5.230 6.167 1.00 0.00 H new ATOM 0 HG12 ILE A 255 7.270 5.141 3.898 1.00 0.00 H new ATOM 0 HG13 ILE A 255 6.380 3.697 4.338 1.00 0.00 H new ATOM 0 HG21 ILE A 255 4.200 3.958 5.619 1.00 0.00 H new ATOM 0 HG22 ILE A 255 3.842 5.506 6.421 1.00 0.00 H new ATOM 0 HG23 ILE A 255 3.623 5.344 4.662 1.00 0.00 H new ATOM 0 HD11 ILE A 255 5.964 4.307 2.012 1.00 0.00 H new ATOM 0 HD12 ILE A 255 4.468 4.441 2.968 1.00 0.00 H new ATOM 0 HD13 ILE A 255 5.372 5.907 2.521 1.00 0.00 H new ATOM 473 N THR A 256 7.834 7.472 6.268 1.00 0.00 N ATOM 474 CA THR A 256 9.242 7.814 6.375 1.00 0.00 C ATOM 475 C THR A 256 10.059 6.530 6.397 1.00 0.00 C ATOM 476 O THR A 256 9.814 5.657 7.227 1.00 0.00 O ATOM 477 CB THR A 256 9.484 8.614 7.655 1.00 0.00 C ATOM 478 OG1 THR A 256 8.546 9.672 7.760 1.00 0.00 O ATOM 479 CG2 THR A 256 10.867 9.228 7.729 1.00 0.00 C ATOM 0 H THR A 256 7.390 7.241 7.157 1.00 0.00 H new ATOM 0 HA THR A 256 9.542 8.423 5.522 1.00 0.00 H new ATOM 0 HB THR A 256 9.378 7.898 8.470 1.00 0.00 H new ATOM 0 HG1 THR A 256 8.711 10.175 8.585 1.00 0.00 H new ATOM 0 HG21 THR A 256 10.970 9.781 8.663 1.00 0.00 H new ATOM 0 HG22 THR A 256 11.618 8.439 7.690 1.00 0.00 H new ATOM 0 HG23 THR A 256 11.009 9.906 6.888 1.00 0.00 H new ATOM 487 N VAL A 257 10.899 6.331 5.397 1.00 0.00 N ATOM 488 CA VAL A 257 11.555 5.052 5.257 1.00 0.00 C ATOM 489 C VAL A 257 12.868 4.987 6.027 1.00 0.00 C ATOM 490 O VAL A 257 13.674 5.918 6.011 1.00 0.00 O ATOM 491 CB VAL A 257 11.809 4.701 3.772 1.00 0.00 C ATOM 492 CG1 VAL A 257 10.497 4.644 3.006 1.00 0.00 C ATOM 493 CG2 VAL A 257 12.755 5.701 3.125 1.00 0.00 C ATOM 0 H VAL A 257 11.137 7.024 4.687 1.00 0.00 H new ATOM 0 HA VAL A 257 10.873 4.317 5.684 1.00 0.00 H new ATOM 0 HB VAL A 257 12.279 3.718 3.736 1.00 0.00 H new ATOM 0 HG11 VAL A 257 10.695 4.396 1.963 1.00 0.00 H new ATOM 0 HG12 VAL A 257 9.853 3.882 3.444 1.00 0.00 H new ATOM 0 HG13 VAL A 257 10.001 5.613 3.060 1.00 0.00 H new ATOM 0 HG21 VAL A 257 12.915 5.428 2.082 1.00 0.00 H new ATOM 0 HG22 VAL A 257 12.320 6.699 3.177 1.00 0.00 H new ATOM 0 HG23 VAL A 257 13.709 5.693 3.652 1.00 0.00 H new ATOM 503 N SER A 258 13.118 3.813 6.579 1.00 0.00 N ATOM 504 CA SER A 258 14.377 3.494 7.224 1.00 0.00 C ATOM 505 C SER A 258 15.313 2.840 6.210 1.00 0.00 C ATOM 506 O SER A 258 16.361 2.294 6.558 1.00 0.00 O ATOM 507 CB SER A 258 14.152 2.596 8.431 1.00 0.00 C ATOM 508 OG SER A 258 13.232 3.187 9.339 1.00 0.00 O ATOM 0 H SER A 258 12.445 3.047 6.592 1.00 0.00 H new ATOM 0 HA SER A 258 14.840 4.412 7.586 1.00 0.00 H new ATOM 0 HB2 SER A 258 13.774 1.628 8.103 1.00 0.00 H new ATOM 0 HB3 SER A 258 15.101 2.414 8.936 1.00 0.00 H new ATOM 0 HG SER A 258 13.101 2.591 10.106 1.00 0.00 H new ATOM 514 N ALA A 259 14.898 2.871 4.948 1.00 0.00 N ATOM 515 CA ALA A 259 15.679 2.298 3.866 1.00 0.00 C ATOM 516 C ALA A 259 16.729 3.309 3.425 1.00 0.00 C ATOM 517 O ALA A 259 16.830 4.391 4.004 1.00 0.00 O ATOM 518 CB ALA A 259 14.778 1.912 2.702 1.00 0.00 C ATOM 0 H ALA A 259 14.017 3.291 4.651 1.00 0.00 H new ATOM 0 HA ALA A 259 16.175 1.392 4.214 1.00 0.00 H new ATOM 0 HB1 ALA A 259 15.381 1.485 1.901 1.00 0.00 H new ATOM 0 HB2 ALA A 259 14.046 1.177 3.037 1.00 0.00 H new ATOM 0 HB3 ALA A 259 14.260 2.798 2.333 1.00 0.00 H new ATOM 524 N SER A 260 17.540 2.959 2.444 1.00 0.00 N ATOM 525 CA SER A 260 18.598 3.857 2.014 1.00 0.00 C ATOM 526 C SER A 260 18.762 3.836 0.498 1.00 0.00 C ATOM 527 O SER A 260 18.978 2.778 -0.100 1.00 0.00 O ATOM 528 CB SER A 260 19.912 3.472 2.700 1.00 0.00 C ATOM 529 OG SER A 260 20.937 4.412 2.422 1.00 0.00 O ATOM 0 H SER A 260 17.490 2.075 1.937 1.00 0.00 H new ATOM 0 HA SER A 260 18.325 4.872 2.302 1.00 0.00 H new ATOM 0 HB2 SER A 260 19.757 3.409 3.777 1.00 0.00 H new ATOM 0 HB3 SER A 260 20.223 2.483 2.364 1.00 0.00 H new ATOM 0 HG SER A 260 21.762 4.140 2.875 1.00 0.00 H new ATOM 535 N GLY A 261 18.730 5.018 -0.108 1.00 0.00 N ATOM 536 CA GLY A 261 18.957 5.129 -1.537 1.00 0.00 C ATOM 537 C GLY A 261 17.746 4.756 -2.366 1.00 0.00 C ATOM 538 O GLY A 261 17.858 3.970 -3.305 1.00 0.00 O ATOM 0 H GLY A 261 18.550 5.903 0.366 1.00 0.00 H new ATOM 0 HA2 GLY A 261 19.249 6.152 -1.773 1.00 0.00 H new ATOM 0 HA3 GLY A 261 19.792 4.486 -1.816 1.00 0.00 H new ATOM 542 N LEU A 262 16.595 5.337 -2.052 1.00 0.00 N ATOM 543 CA LEU A 262 15.387 5.067 -2.825 1.00 0.00 C ATOM 544 C LEU A 262 15.190 6.129 -3.897 1.00 0.00 C ATOM 545 O LEU A 262 15.757 7.224 -3.812 1.00 0.00 O ATOM 546 CB LEU A 262 14.155 5.000 -1.922 1.00 0.00 C ATOM 547 CG LEU A 262 14.236 3.973 -0.792 1.00 0.00 C ATOM 548 CD1 LEU A 262 12.930 3.927 -0.019 1.00 0.00 C ATOM 549 CD2 LEU A 262 14.584 2.599 -1.339 1.00 0.00 C ATOM 0 H LEU A 262 16.471 5.990 -1.278 1.00 0.00 H new ATOM 0 HA LEU A 262 15.511 4.097 -3.306 1.00 0.00 H new ATOM 0 HB2 LEU A 262 13.989 5.985 -1.486 1.00 0.00 H new ATOM 0 HB3 LEU A 262 13.284 4.773 -2.537 1.00 0.00 H new ATOM 0 HG LEU A 262 15.029 4.278 -0.109 1.00 0.00 H new ATOM 0 HD11 LEU A 262 13.006 3.191 0.781 1.00 0.00 H new ATOM 0 HD12 LEU A 262 12.726 4.908 0.409 1.00 0.00 H new ATOM 0 HD13 LEU A 262 12.119 3.649 -0.692 1.00 0.00 H new ATOM 0 HD21 LEU A 262 14.637 1.883 -0.519 1.00 0.00 H new ATOM 0 HD22 LEU A 262 13.817 2.284 -2.047 1.00 0.00 H new ATOM 0 HD23 LEU A 262 15.548 2.642 -1.845 1.00 0.00 H new ATOM 561 N GLN A 263 14.396 5.802 -4.906 1.00 0.00 N ATOM 562 CA GLN A 263 14.128 6.714 -6.011 1.00 0.00 C ATOM 563 C GLN A 263 12.679 6.572 -6.453 1.00 0.00 C ATOM 564 O GLN A 263 12.030 5.571 -6.157 1.00 0.00 O ATOM 565 CB GLN A 263 15.054 6.414 -7.200 1.00 0.00 C ATOM 566 CG GLN A 263 16.540 6.476 -6.874 1.00 0.00 C ATOM 567 CD GLN A 263 17.411 6.212 -8.086 1.00 0.00 C ATOM 568 OE1 GLN A 263 17.363 6.952 -9.069 1.00 0.00 O ATOM 569 NE2 GLN A 263 18.207 5.155 -8.030 1.00 0.00 N ATOM 0 H GLN A 263 13.921 4.903 -4.983 1.00 0.00 H new ATOM 0 HA GLN A 263 14.313 7.733 -5.670 1.00 0.00 H new ATOM 0 HB2 GLN A 263 14.820 5.421 -7.585 1.00 0.00 H new ATOM 0 HB3 GLN A 263 14.840 7.124 -7.999 1.00 0.00 H new ATOM 0 HG2 GLN A 263 16.779 7.458 -6.466 1.00 0.00 H new ATOM 0 HG3 GLN A 263 16.770 5.745 -6.099 1.00 0.00 H new ATOM 0 HE21 GLN A 263 18.217 4.567 -7.196 1.00 0.00 H new ATOM 0 HE22 GLN A 263 18.811 4.929 -8.821 1.00 0.00 H new ATOM 578 N VAL A 264 12.194 7.524 -7.230 1.00 0.00 N ATOM 579 CA VAL A 264 10.854 7.416 -7.774 1.00 0.00 C ATOM 580 C VAL A 264 10.863 6.485 -8.982 1.00 0.00 C ATOM 581 O VAL A 264 11.615 6.700 -9.934 1.00 0.00 O ATOM 582 CB VAL A 264 10.281 8.785 -8.188 1.00 0.00 C ATOM 583 CG1 VAL A 264 8.825 8.646 -8.602 1.00 0.00 C ATOM 584 CG2 VAL A 264 10.426 9.799 -7.064 1.00 0.00 C ATOM 0 H VAL A 264 12.700 8.369 -7.495 1.00 0.00 H new ATOM 0 HA VAL A 264 10.215 7.012 -6.989 1.00 0.00 H new ATOM 0 HB VAL A 264 10.851 9.149 -9.043 1.00 0.00 H new ATOM 0 HG11 VAL A 264 8.434 9.622 -8.892 1.00 0.00 H new ATOM 0 HG12 VAL A 264 8.751 7.960 -9.446 1.00 0.00 H new ATOM 0 HG13 VAL A 264 8.245 8.257 -7.766 1.00 0.00 H new ATOM 0 HG21 VAL A 264 10.014 10.757 -7.382 1.00 0.00 H new ATOM 0 HG22 VAL A 264 9.887 9.447 -6.184 1.00 0.00 H new ATOM 0 HG23 VAL A 264 11.481 9.922 -6.819 1.00 0.00 H new ATOM 594 N GLY A 265 10.039 5.452 -8.945 1.00 0.00 N ATOM 595 CA GLY A 265 9.988 4.517 -10.051 1.00 0.00 C ATOM 596 C GLY A 265 10.430 3.125 -9.663 1.00 0.00 C ATOM 597 O GLY A 265 10.639 2.273 -10.526 1.00 0.00 O ATOM 0 H GLY A 265 9.406 5.243 -8.173 1.00 0.00 H new ATOM 0 HA2 GLY A 265 8.970 4.475 -10.438 1.00 0.00 H new ATOM 0 HA3 GLY A 265 10.622 4.882 -10.859 1.00 0.00 H new ATOM 601 N ASP A 266 10.512 2.866 -8.365 1.00 0.00 N ATOM 602 CA ASP A 266 10.851 1.536 -7.886 1.00 0.00 C ATOM 603 C ASP A 266 9.602 0.697 -7.676 1.00 0.00 C ATOM 604 O ASP A 266 8.491 1.222 -7.564 1.00 0.00 O ATOM 605 CB ASP A 266 11.683 1.588 -6.599 1.00 0.00 C ATOM 606 CG ASP A 266 13.067 2.140 -6.836 1.00 0.00 C ATOM 607 OD1 ASP A 266 13.793 1.576 -7.677 1.00 0.00 O ATOM 608 OD2 ASP A 266 13.441 3.128 -6.180 1.00 0.00 O1- ATOM 0 H ASP A 266 10.349 3.555 -7.631 1.00 0.00 H new ATOM 0 HA ASP A 266 11.461 1.064 -8.657 1.00 0.00 H new ATOM 0 HB2 ASP A 266 11.169 2.204 -5.861 1.00 0.00 H new ATOM 0 HB3 ASP A 266 11.761 0.586 -6.178 1.00 0.00 H new ATOM 613 N ALA A 267 9.813 -0.597 -7.527 1.00 0.00 N ATOM 614 CA ALA A 267 8.750 -1.534 -7.214 1.00 0.00 C ATOM 615 C ALA A 267 9.204 -2.388 -6.050 1.00 0.00 C ATOM 616 O ALA A 267 10.400 -2.620 -5.900 1.00 0.00 O ATOM 617 CB ALA A 267 8.430 -2.407 -8.418 1.00 0.00 C ATOM 0 H ALA A 267 10.732 -1.030 -7.620 1.00 0.00 H new ATOM 0 HA ALA A 267 7.843 -0.990 -6.951 1.00 0.00 H new ATOM 0 HB1 ALA A 267 7.631 -3.102 -8.161 1.00 0.00 H new ATOM 0 HB2 ALA A 267 8.111 -1.778 -9.249 1.00 0.00 H new ATOM 0 HB3 ALA A 267 9.319 -2.967 -8.708 1.00 0.00 H new ATOM 623 N PHE A 268 8.305 -2.755 -5.152 1.00 0.00 N ATOM 624 CA PHE A 268 8.747 -3.451 -3.961 1.00 0.00 C ATOM 625 C PHE A 268 7.633 -4.226 -3.292 1.00 0.00 C ATOM 626 O PHE A 268 6.453 -4.015 -3.574 1.00 0.00 O ATOM 627 CB PHE A 268 9.372 -2.448 -2.990 1.00 0.00 C ATOM 628 CG PHE A 268 8.463 -1.341 -2.544 1.00 0.00 C ATOM 629 CD1 PHE A 268 7.383 -1.595 -1.718 1.00 0.00 C ATOM 630 CD2 PHE A 268 8.701 -0.040 -2.948 1.00 0.00 C ATOM 631 CE1 PHE A 268 6.564 -0.573 -1.301 1.00 0.00 C ATOM 632 CE2 PHE A 268 7.880 0.985 -2.535 1.00 0.00 C ATOM 633 CZ PHE A 268 6.813 0.715 -1.709 1.00 0.00 C ATOM 0 H PHE A 268 7.301 -2.590 -5.221 1.00 0.00 H new ATOM 0 HA PHE A 268 9.493 -4.187 -4.261 1.00 0.00 H new ATOM 0 HB2 PHE A 268 9.721 -2.988 -2.109 1.00 0.00 H new ATOM 0 HB3 PHE A 268 10.250 -2.008 -3.462 1.00 0.00 H new ATOM 0 HD1 PHE A 268 7.181 -2.606 -1.398 1.00 0.00 H new ATOM 0 HD2 PHE A 268 9.540 0.174 -3.594 1.00 0.00 H new ATOM 0 HE1 PHE A 268 5.726 -0.782 -0.653 1.00 0.00 H new ATOM 0 HE2 PHE A 268 8.073 1.997 -2.858 1.00 0.00 H new ATOM 0 HZ PHE A 268 6.170 1.518 -1.381 1.00 0.00 H new ATOM 643 N THR A 269 8.022 -5.060 -2.346 1.00 0.00 N ATOM 644 CA THR A 269 7.077 -5.809 -1.545 1.00 0.00 C ATOM 645 C THR A 269 7.198 -5.392 -0.083 1.00 0.00 C ATOM 646 O THR A 269 8.291 -5.077 0.393 1.00 0.00 O ATOM 647 CB THR A 269 7.328 -7.309 -1.709 1.00 0.00 C ATOM 648 OG1 THR A 269 8.676 -7.629 -1.406 1.00 0.00 O ATOM 649 CG2 THR A 269 7.035 -7.819 -3.106 1.00 0.00 C ATOM 0 H THR A 269 8.999 -5.236 -2.113 1.00 0.00 H new ATOM 0 HA THR A 269 6.063 -5.594 -1.882 1.00 0.00 H new ATOM 0 HB THR A 269 6.642 -7.793 -1.014 1.00 0.00 H new ATOM 0 HG1 THR A 269 8.816 -8.593 -1.515 1.00 0.00 H new ATOM 0 HG21 THR A 269 7.234 -8.890 -3.152 1.00 0.00 H new ATOM 0 HG22 THR A 269 5.989 -7.634 -3.349 1.00 0.00 H new ATOM 0 HG23 THR A 269 7.671 -7.301 -3.823 1.00 0.00 H new ATOM 657 N ILE A 270 6.076 -5.357 0.617 1.00 0.00 N ATOM 658 CA ILE A 270 6.065 -4.948 2.012 1.00 0.00 C ATOM 659 C ILE A 270 5.723 -6.131 2.912 1.00 0.00 C ATOM 660 O ILE A 270 4.725 -6.819 2.691 1.00 0.00 O ATOM 661 CB ILE A 270 5.058 -3.801 2.252 1.00 0.00 C ATOM 662 CG1 ILE A 270 5.445 -2.562 1.448 1.00 0.00 C ATOM 663 CG2 ILE A 270 4.961 -3.459 3.728 1.00 0.00 C ATOM 664 CD1 ILE A 270 4.521 -1.384 1.671 1.00 0.00 C ATOM 0 H ILE A 270 5.161 -5.607 0.242 1.00 0.00 H new ATOM 0 HA ILE A 270 7.063 -4.586 2.258 1.00 0.00 H new ATOM 0 HB ILE A 270 4.080 -4.143 1.914 1.00 0.00 H new ATOM 0 HG12 ILE A 270 6.462 -2.271 1.711 1.00 0.00 H new ATOM 0 HG13 ILE A 270 5.450 -2.814 0.388 1.00 0.00 H new ATOM 0 HG21 ILE A 270 4.245 -2.649 3.867 1.00 0.00 H new ATOM 0 HG22 ILE A 270 4.629 -4.336 4.284 1.00 0.00 H new ATOM 0 HG23 ILE A 270 5.939 -3.146 4.094 1.00 0.00 H new ATOM 0 HD11 ILE A 270 4.856 -0.540 1.069 1.00 0.00 H new ATOM 0 HD12 ILE A 270 3.507 -1.657 1.380 1.00 0.00 H new ATOM 0 HD13 ILE A 270 4.534 -1.106 2.725 1.00 0.00 H new ATOM 676 N ALA A 271 6.561 -6.367 3.918 1.00 0.00 N ATOM 677 CA ALA A 271 6.355 -7.474 4.845 1.00 0.00 C ATOM 678 C ALA A 271 5.084 -7.280 5.662 1.00 0.00 C ATOM 679 O ALA A 271 4.945 -6.305 6.397 1.00 0.00 O ATOM 680 CB ALA A 271 7.552 -7.623 5.771 1.00 0.00 C ATOM 0 H ALA A 271 7.390 -5.805 4.111 1.00 0.00 H new ATOM 0 HA ALA A 271 6.246 -8.385 4.256 1.00 0.00 H new ATOM 0 HB1 ALA A 271 7.381 -8.454 6.456 1.00 0.00 H new ATOM 0 HB2 ALA A 271 8.447 -7.818 5.180 1.00 0.00 H new ATOM 0 HB3 ALA A 271 7.687 -6.704 6.342 1.00 0.00 H new ATOM 686 N GLY A 272 4.165 -8.224 5.534 1.00 0.00 N ATOM 687 CA GLY A 272 2.917 -8.160 6.273 1.00 0.00 C ATOM 688 C GLY A 272 1.761 -7.703 5.410 1.00 0.00 C ATOM 689 O GLY A 272 0.615 -8.076 5.651 1.00 0.00 O ATOM 0 H GLY A 272 4.260 -9.039 4.928 1.00 0.00 H new ATOM 0 HA2 GLY A 272 2.692 -9.143 6.687 1.00 0.00 H new ATOM 0 HA3 GLY A 272 3.031 -7.478 7.115 1.00 0.00 H new ATOM 693 N VAL A 273 2.071 -6.985 4.341 1.00 0.00 N ATOM 694 CA VAL A 273 1.057 -6.590 3.376 1.00 0.00 C ATOM 695 C VAL A 273 1.044 -7.574 2.213 1.00 0.00 C ATOM 696 O VAL A 273 1.897 -7.518 1.327 1.00 0.00 O ATOM 697 CB VAL A 273 1.298 -5.168 2.824 1.00 0.00 C ATOM 698 CG1 VAL A 273 0.151 -4.739 1.918 1.00 0.00 C ATOM 699 CG2 VAL A 273 1.488 -4.169 3.950 1.00 0.00 C ATOM 0 H VAL A 273 3.014 -6.665 4.120 1.00 0.00 H new ATOM 0 HA VAL A 273 0.098 -6.594 3.895 1.00 0.00 H new ATOM 0 HB VAL A 273 2.214 -5.191 2.234 1.00 0.00 H new ATOM 0 HG11 VAL A 273 0.342 -3.734 1.540 1.00 0.00 H new ATOM 0 HG12 VAL A 273 0.070 -5.432 1.081 1.00 0.00 H new ATOM 0 HG13 VAL A 273 -0.781 -4.743 2.484 1.00 0.00 H new ATOM 0 HG21 VAL A 273 1.656 -3.177 3.532 1.00 0.00 H new ATOM 0 HG22 VAL A 273 0.596 -4.153 4.576 1.00 0.00 H new ATOM 0 HG23 VAL A 273 2.349 -4.459 4.552 1.00 0.00 H new ATOM 709 N ASN A 274 0.070 -8.465 2.212 1.00 0.00 N ATOM 710 CA ASN A 274 -0.056 -9.447 1.145 1.00 0.00 C ATOM 711 C ASN A 274 -0.966 -8.909 0.057 1.00 0.00 C ATOM 712 O ASN A 274 -1.624 -7.894 0.252 1.00 0.00 O ATOM 713 CB ASN A 274 -0.613 -10.768 1.686 1.00 0.00 C ATOM 714 CG ASN A 274 0.292 -11.431 2.711 1.00 0.00 C ATOM 715 OD1 ASN A 274 -0.065 -12.457 3.286 1.00 0.00 O ATOM 716 ND2 ASN A 274 1.472 -10.867 2.931 1.00 0.00 N ATOM 0 H ASN A 274 -0.646 -8.531 2.936 1.00 0.00 H new ATOM 0 HA ASN A 274 0.934 -9.636 0.729 1.00 0.00 H new ATOM 0 HB2 ASN A 274 -1.588 -10.585 2.138 1.00 0.00 H new ATOM 0 HB3 ASN A 274 -0.771 -11.455 0.854 1.00 0.00 H new ATOM 0 HD21 ASN A 274 2.121 -11.285 3.598 1.00 0.00 H new ATOM 0 HD22 ASN A 274 1.731 -10.015 2.433 1.00 0.00 H new ATOM 723 N SER A 275 -1.017 -9.588 -1.077 1.00 0.00 N ATOM 724 CA SER A 275 -1.878 -9.161 -2.168 1.00 0.00 C ATOM 725 C SER A 275 -3.023 -10.128 -2.323 1.00 0.00 C ATOM 726 O SER A 275 -2.876 -11.320 -2.050 1.00 0.00 O ATOM 727 CB SER A 275 -1.133 -9.151 -3.493 1.00 0.00 C ATOM 728 OG SER A 275 -1.849 -8.431 -4.482 1.00 0.00 O ATOM 0 H SER A 275 -0.476 -10.432 -1.266 1.00 0.00 H new ATOM 0 HA SER A 275 -2.226 -8.157 -1.926 1.00 0.00 H new ATOM 0 HB2 SER A 275 -0.149 -8.703 -3.356 1.00 0.00 H new ATOM 0 HB3 SER A 275 -0.973 -10.175 -3.830 1.00 0.00 H new ATOM 0 HG SER A 275 -1.345 -8.440 -5.322 1.00 0.00 H new ATOM 734 N VAL A 276 -4.045 -9.679 -3.012 1.00 0.00 N ATOM 735 CA VAL A 276 -5.062 -10.582 -3.478 1.00 0.00 C ATOM 736 C VAL A 276 -5.177 -10.475 -4.992 1.00 0.00 C ATOM 737 O VAL A 276 -4.482 -9.671 -5.614 1.00 0.00 O ATOM 738 CB VAL A 276 -6.426 -10.304 -2.830 1.00 0.00 C ATOM 739 CG1 VAL A 276 -6.317 -10.283 -1.313 1.00 0.00 C ATOM 740 CG2 VAL A 276 -7.042 -9.014 -3.346 1.00 0.00 C ATOM 0 H VAL A 276 -4.191 -8.700 -3.259 1.00 0.00 H new ATOM 0 HA VAL A 276 -4.767 -11.592 -3.193 1.00 0.00 H new ATOM 0 HB VAL A 276 -7.091 -11.121 -3.112 1.00 0.00 H new ATOM 0 HG11 VAL A 276 -7.298 -10.084 -0.880 1.00 0.00 H new ATOM 0 HG12 VAL A 276 -5.954 -11.249 -0.961 1.00 0.00 H new ATOM 0 HG13 VAL A 276 -5.621 -9.501 -1.009 1.00 0.00 H new ATOM 0 HG21 VAL A 276 -8.006 -8.853 -2.864 1.00 0.00 H new ATOM 0 HG22 VAL A 276 -6.379 -8.179 -3.121 1.00 0.00 H new ATOM 0 HG23 VAL A 276 -7.183 -9.084 -4.425 1.00 0.00 H new ATOM 750 N HIS A 277 -6.059 -11.265 -5.580 1.00 0.00 N ATOM 751 CA HIS A 277 -6.263 -11.224 -7.020 1.00 0.00 C ATOM 752 C HIS A 277 -7.510 -10.413 -7.349 1.00 0.00 C ATOM 753 O HIS A 277 -8.551 -10.594 -6.719 1.00 0.00 O ATOM 754 CB HIS A 277 -6.388 -12.645 -7.588 1.00 0.00 C ATOM 755 CG HIS A 277 -5.176 -13.501 -7.359 1.00 0.00 C ATOM 756 ND1 HIS A 277 -4.715 -13.847 -6.104 1.00 0.00 N ATOM 757 CD2 HIS A 277 -4.316 -14.068 -8.238 1.00 0.00 C ATOM 758 CE1 HIS A 277 -3.628 -14.584 -6.225 1.00 0.00 C ATOM 759 NE2 HIS A 277 -3.363 -14.735 -7.507 1.00 0.00 N ATOM 0 H HIS A 277 -6.643 -11.940 -5.086 1.00 0.00 H new ATOM 0 HA HIS A 277 -5.399 -10.745 -7.479 1.00 0.00 H new ATOM 0 HB2 HIS A 277 -7.254 -13.131 -7.138 1.00 0.00 H new ATOM 0 HB3 HIS A 277 -6.579 -12.582 -8.659 1.00 0.00 H new ATOM 0 HD1 HIS A 277 -5.148 -13.575 -5.221 1.00 0.00 H new ATOM 0 HD2 HIS A 277 -4.369 -14.007 -9.315 1.00 0.00 H new ATOM 0 HE1 HIS A 277 -3.051 -14.995 -5.410 1.00 0.00 H new ATOM 768 N GLN A 278 -7.403 -9.507 -8.319 1.00 0.00 N ATOM 769 CA GLN A 278 -8.533 -8.659 -8.698 1.00 0.00 C ATOM 770 C GLN A 278 -9.599 -9.454 -9.450 1.00 0.00 C ATOM 771 O GLN A 278 -10.689 -8.950 -9.717 1.00 0.00 O ATOM 772 CB GLN A 278 -8.100 -7.459 -9.559 1.00 0.00 C ATOM 773 CG GLN A 278 -7.295 -6.370 -8.841 1.00 0.00 C ATOM 774 CD GLN A 278 -5.865 -6.745 -8.495 1.00 0.00 C ATOM 775 OE1 GLN A 278 -5.606 -7.663 -7.720 1.00 0.00 O ATOM 776 NE2 GLN A 278 -4.918 -6.023 -9.075 1.00 0.00 N ATOM 0 H GLN A 278 -6.551 -9.341 -8.855 1.00 0.00 H new ATOM 0 HA GLN A 278 -8.952 -8.282 -7.765 1.00 0.00 H new ATOM 0 HB2 GLN A 278 -7.505 -7.832 -10.393 1.00 0.00 H new ATOM 0 HB3 GLN A 278 -8.993 -7.001 -9.984 1.00 0.00 H new ATOM 0 HG2 GLN A 278 -7.278 -5.479 -9.469 1.00 0.00 H new ATOM 0 HG3 GLN A 278 -7.816 -6.102 -7.922 1.00 0.00 H new ATOM 0 HE21 GLN A 278 -5.171 -5.268 -9.713 1.00 0.00 H new ATOM 0 HE22 GLN A 278 -3.936 -6.222 -8.884 1.00 0.00 H new ATOM 785 N ILE A 279 -9.270 -10.682 -9.825 1.00 0.00 N ATOM 786 CA ILE A 279 -10.194 -11.519 -10.580 1.00 0.00 C ATOM 787 C ILE A 279 -10.851 -12.562 -9.675 1.00 0.00 C ATOM 788 O ILE A 279 -12.075 -12.687 -9.645 1.00 0.00 O ATOM 789 CB ILE A 279 -9.503 -12.232 -11.781 1.00 0.00 C ATOM 790 CG1 ILE A 279 -9.018 -11.234 -12.844 1.00 0.00 C ATOM 791 CG2 ILE A 279 -10.448 -13.233 -12.426 1.00 0.00 C ATOM 792 CD1 ILE A 279 -7.892 -10.325 -12.400 1.00 0.00 C ATOM 0 H ILE A 279 -8.372 -11.121 -9.620 1.00 0.00 H new ATOM 0 HA ILE A 279 -10.958 -10.852 -10.980 1.00 0.00 H new ATOM 0 HB ILE A 279 -8.633 -12.753 -11.380 1.00 0.00 H new ATOM 0 HG12 ILE A 279 -8.691 -11.791 -13.722 1.00 0.00 H new ATOM 0 HG13 ILE A 279 -9.862 -10.618 -13.154 1.00 0.00 H new ATOM 0 HG21 ILE A 279 -9.947 -13.720 -13.262 1.00 0.00 H new ATOM 0 HG22 ILE A 279 -10.740 -13.983 -11.691 1.00 0.00 H new ATOM 0 HG23 ILE A 279 -11.336 -12.714 -12.788 1.00 0.00 H new ATOM 0 HD11 ILE A 279 -7.619 -9.658 -13.218 1.00 0.00 H new ATOM 0 HD12 ILE A 279 -8.217 -9.735 -11.543 1.00 0.00 H new ATOM 0 HD13 ILE A 279 -7.028 -10.927 -12.119 1.00 0.00 H new ATOM 804 N THR A 280 -10.033 -13.382 -9.024 1.00 0.00 N ATOM 805 CA THR A 280 -10.549 -14.492 -8.233 1.00 0.00 C ATOM 806 C THR A 280 -10.565 -14.190 -6.734 1.00 0.00 C ATOM 807 O THR A 280 -11.054 -15.002 -5.947 1.00 0.00 O ATOM 808 CB THR A 280 -9.718 -15.744 -8.512 1.00 0.00 C ATOM 809 OG1 THR A 280 -8.345 -15.504 -8.243 1.00 0.00 O ATOM 810 CG2 THR A 280 -9.827 -16.223 -9.942 1.00 0.00 C ATOM 0 H THR A 280 -9.016 -13.300 -9.028 1.00 0.00 H new ATOM 0 HA THR A 280 -11.585 -14.655 -8.531 1.00 0.00 H new ATOM 0 HB THR A 280 -10.121 -16.514 -7.854 1.00 0.00 H new ATOM 0 HG1 THR A 280 -7.829 -16.317 -8.426 1.00 0.00 H new ATOM 0 HG21 THR A 280 -9.214 -17.114 -10.075 1.00 0.00 H new ATOM 0 HG22 THR A 280 -10.867 -16.460 -10.168 1.00 0.00 H new ATOM 0 HG23 THR A 280 -9.479 -15.440 -10.616 1.00 0.00 H new ATOM 818 N LYS A 281 -10.002 -13.041 -6.341 1.00 0.00 N ATOM 819 CA LYS A 281 -9.925 -12.652 -4.925 1.00 0.00 C ATOM 820 C LYS A 281 -9.189 -13.701 -4.093 1.00 0.00 C ATOM 821 O LYS A 281 -9.505 -13.904 -2.919 1.00 0.00 O ATOM 822 CB LYS A 281 -11.328 -12.430 -4.346 1.00 0.00 C ATOM 823 CG LYS A 281 -12.078 -11.251 -4.951 1.00 0.00 C ATOM 824 CD LYS A 281 -11.400 -9.924 -4.629 1.00 0.00 C ATOM 825 CE LYS A 281 -11.328 -9.683 -3.123 1.00 0.00 C ATOM 826 NZ LYS A 281 -12.675 -9.718 -2.487 1.00 0.00 N1+ ATOM 0 H LYS A 281 -9.592 -12.363 -6.983 1.00 0.00 H new ATOM 0 HA LYS A 281 -9.363 -11.719 -4.878 1.00 0.00 H new ATOM 0 HB2 LYS A 281 -11.917 -13.335 -4.495 1.00 0.00 H new ATOM 0 HB3 LYS A 281 -11.244 -12.278 -3.270 1.00 0.00 H new ATOM 0 HG2 LYS A 281 -12.139 -11.375 -6.032 1.00 0.00 H new ATOM 0 HG3 LYS A 281 -13.100 -11.238 -4.573 1.00 0.00 H new ATOM 0 HD2 LYS A 281 -10.394 -9.917 -5.048 1.00 0.00 H new ATOM 0 HD3 LYS A 281 -11.948 -9.110 -5.103 1.00 0.00 H new ATOM 0 HE2 LYS A 281 -10.691 -10.440 -2.665 1.00 0.00 H new ATOM 0 HE3 LYS A 281 -10.862 -8.716 -2.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 281 -12.607 -9.369 -1.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 281 -13.329 -9.114 -3.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 281 -13.031 -10.695 -2.482 1.00 0.00 H new ATOM 840 N ASP A 282 -8.260 -14.411 -4.723 1.00 0.00 N ATOM 841 CA ASP A 282 -7.546 -15.490 -4.054 1.00 0.00 C ATOM 842 C ASP A 282 -6.466 -14.921 -3.138 1.00 0.00 C ATOM 843 O ASP A 282 -5.778 -13.961 -3.495 1.00 0.00 O ATOM 844 CB ASP A 282 -6.947 -16.449 -5.093 1.00 0.00 C ATOM 845 CG ASP A 282 -6.374 -17.710 -4.481 1.00 0.00 C ATOM 846 OD1 ASP A 282 -5.400 -17.623 -3.718 1.00 0.00 O ATOM 847 OD2 ASP A 282 -6.911 -18.798 -4.765 1.00 0.00 O1- ATOM 0 H ASP A 282 -7.985 -14.259 -5.693 1.00 0.00 H new ATOM 0 HA ASP A 282 -8.246 -16.053 -3.437 1.00 0.00 H new ATOM 0 HB2 ASP A 282 -7.718 -16.721 -5.814 1.00 0.00 H new ATOM 0 HB3 ASP A 282 -6.162 -15.932 -5.645 1.00 0.00 H new ATOM 852 N THR A 283 -6.327 -15.522 -1.966 1.00 0.00 N ATOM 853 CA THR A 283 -5.335 -15.105 -0.987 1.00 0.00 C ATOM 854 C THR A 283 -4.222 -16.137 -0.910 1.00 0.00 C ATOM 855 O THR A 283 -4.484 -17.322 -0.699 1.00 0.00 O ATOM 856 CB THR A 283 -5.989 -14.913 0.383 1.00 0.00 C ATOM 857 OG1 THR A 283 -6.628 -16.107 0.811 1.00 0.00 O ATOM 858 CG2 THR A 283 -7.024 -13.811 0.399 1.00 0.00 C ATOM 0 H THR A 283 -6.899 -16.312 -1.667 1.00 0.00 H new ATOM 0 HA THR A 283 -4.907 -14.152 -1.297 1.00 0.00 H new ATOM 0 HB THR A 283 -5.175 -14.640 1.055 1.00 0.00 H new ATOM 0 HG1 THR A 283 -6.133 -16.882 0.473 1.00 0.00 H new ATOM 0 HG21 THR A 283 -7.450 -13.726 1.399 1.00 0.00 H new ATOM 0 HG22 THR A 283 -6.554 -12.867 0.123 1.00 0.00 H new ATOM 0 HG23 THR A 283 -7.815 -14.044 -0.314 1.00 0.00 H new ATOM 866 N THR A 284 -3.012 -15.726 -1.222 1.00 0.00 N ATOM 867 CA THR A 284 -1.919 -16.668 -1.337 1.00 0.00 C ATOM 868 C THR A 284 -0.850 -16.427 -0.277 1.00 0.00 C ATOM 869 O THR A 284 0.010 -17.279 -0.045 1.00 0.00 O ATOM 870 CB THR A 284 -1.337 -16.559 -2.737 1.00 0.00 C ATOM 871 OG1 THR A 284 -0.818 -15.257 -2.960 1.00 0.00 O ATOM 872 CG2 THR A 284 -2.371 -16.833 -3.807 1.00 0.00 C ATOM 0 H THR A 284 -2.761 -14.753 -1.399 1.00 0.00 H new ATOM 0 HA THR A 284 -2.296 -17.677 -1.169 1.00 0.00 H new ATOM 0 HB THR A 284 -0.548 -17.308 -2.801 1.00 0.00 H new ATOM 0 HG1 THR A 284 -0.446 -15.204 -3.865 1.00 0.00 H new ATOM 0 HG21 THR A 284 -1.909 -16.744 -4.790 1.00 0.00 H new ATOM 0 HG22 THR A 284 -2.766 -17.841 -3.682 1.00 0.00 H new ATOM 0 HG23 THR A 284 -3.184 -16.112 -3.721 1.00 0.00 H new ATOM 880 N GLY A 285 -0.909 -15.273 0.368 1.00 0.00 N ATOM 881 CA GLY A 285 0.060 -14.955 1.398 1.00 0.00 C ATOM 882 C GLY A 285 1.297 -14.288 0.839 1.00 0.00 C ATOM 883 O GLY A 285 2.248 -14.019 1.572 1.00 0.00 O ATOM 0 H GLY A 285 -1.609 -14.551 0.198 1.00 0.00 H new ATOM 0 HA2 GLY A 285 -0.401 -14.299 2.137 1.00 0.00 H new ATOM 0 HA3 GLY A 285 0.347 -15.869 1.918 1.00 0.00 H new ATOM 887 N GLN A 286 1.278 -13.998 -0.456 1.00 0.00 N ATOM 888 CA GLN A 286 2.399 -13.329 -1.104 1.00 0.00 C ATOM 889 C GLN A 286 2.190 -11.822 -1.093 1.00 0.00 C ATOM 890 O GLN A 286 1.077 -11.348 -1.310 1.00 0.00 O ATOM 891 CB GLN A 286 2.559 -13.821 -2.544 1.00 0.00 C ATOM 892 CG GLN A 286 2.800 -15.316 -2.656 1.00 0.00 C ATOM 893 CD GLN A 286 2.977 -15.761 -4.091 1.00 0.00 C ATOM 894 OE1 GLN A 286 3.895 -15.314 -4.780 1.00 0.00 O ATOM 895 NE2 GLN A 286 2.098 -16.635 -4.554 1.00 0.00 N ATOM 0 H GLN A 286 0.499 -14.215 -1.078 1.00 0.00 H new ATOM 0 HA GLN A 286 3.307 -13.567 -0.550 1.00 0.00 H new ATOM 0 HB2 GLN A 286 1.663 -13.563 -3.108 1.00 0.00 H new ATOM 0 HB3 GLN A 286 3.391 -13.292 -3.009 1.00 0.00 H new ATOM 0 HG2 GLN A 286 3.688 -15.583 -2.083 1.00 0.00 H new ATOM 0 HG3 GLN A 286 1.961 -15.852 -2.212 1.00 0.00 H new ATOM 0 HE21 GLN A 286 1.353 -16.979 -3.948 1.00 0.00 H new ATOM 0 HE22 GLN A 286 2.165 -16.965 -5.517 1.00 0.00 H new ATOM 904 N PRO A 287 3.251 -11.046 -0.821 1.00 0.00 N ATOM 905 CA PRO A 287 3.166 -9.583 -0.762 1.00 0.00 C ATOM 906 C PRO A 287 2.836 -8.963 -2.118 1.00 0.00 C ATOM 907 O PRO A 287 3.184 -9.509 -3.167 1.00 0.00 O ATOM 908 CB PRO A 287 4.564 -9.146 -0.310 1.00 0.00 C ATOM 909 CG PRO A 287 5.213 -10.377 0.226 1.00 0.00 C ATOM 910 CD PRO A 287 4.609 -11.526 -0.528 1.00 0.00 C ATOM 0 HA PRO A 287 2.369 -9.259 -0.093 1.00 0.00 H new ATOM 0 HB2 PRO A 287 5.134 -8.733 -1.142 1.00 0.00 H new ATOM 0 HB3 PRO A 287 4.505 -8.370 0.453 1.00 0.00 H new ATOM 0 HG2 PRO A 287 6.293 -10.342 0.084 1.00 0.00 H new ATOM 0 HG3 PRO A 287 5.036 -10.477 1.297 1.00 0.00 H new ATOM 0 HD2 PRO A 287 5.165 -11.749 -1.439 1.00 0.00 H new ATOM 0 HD3 PRO A 287 4.596 -12.438 0.068 1.00 0.00 H new ATOM 918 N GLN A 288 2.206 -7.799 -2.083 1.00 0.00 N ATOM 919 CA GLN A 288 1.872 -7.065 -3.298 1.00 0.00 C ATOM 920 C GLN A 288 3.081 -6.276 -3.797 1.00 0.00 C ATOM 921 O GLN A 288 3.900 -5.813 -3.003 1.00 0.00 O ATOM 922 CB GLN A 288 0.684 -6.125 -3.023 1.00 0.00 C ATOM 923 CG GLN A 288 0.297 -5.205 -4.182 1.00 0.00 C ATOM 924 CD GLN A 288 -0.164 -5.941 -5.428 1.00 0.00 C ATOM 925 OE1 GLN A 288 0.588 -6.707 -6.034 1.00 0.00 O ATOM 926 NE2 GLN A 288 -1.407 -5.706 -5.822 1.00 0.00 N ATOM 0 H GLN A 288 1.913 -7.338 -1.221 1.00 0.00 H new ATOM 0 HA GLN A 288 1.589 -7.774 -4.076 1.00 0.00 H new ATOM 0 HB2 GLN A 288 -0.183 -6.730 -2.756 1.00 0.00 H new ATOM 0 HB3 GLN A 288 0.922 -5.509 -2.156 1.00 0.00 H new ATOM 0 HG2 GLN A 288 -0.499 -4.537 -3.852 1.00 0.00 H new ATOM 0 HG3 GLN A 288 1.153 -4.580 -4.437 1.00 0.00 H new ATOM 0 HE21 GLN A 288 -1.997 -5.065 -5.292 1.00 0.00 H new ATOM 0 HE22 GLN A 288 -1.774 -6.166 -6.655 1.00 0.00 H new ATOM 935 N VAL A 289 3.146 -6.074 -5.107 1.00 0.00 N ATOM 936 CA VAL A 289 4.200 -5.276 -5.705 1.00 0.00 C ATOM 937 C VAL A 289 3.717 -3.841 -5.886 1.00 0.00 C ATOM 938 O VAL A 289 2.630 -3.604 -6.413 1.00 0.00 O ATOM 939 CB VAL A 289 4.645 -5.854 -7.066 1.00 0.00 C ATOM 940 CG1 VAL A 289 5.774 -5.031 -7.665 1.00 0.00 C ATOM 941 CG2 VAL A 289 5.068 -7.306 -6.914 1.00 0.00 C ATOM 0 H VAL A 289 2.476 -6.455 -5.775 1.00 0.00 H new ATOM 0 HA VAL A 289 5.060 -5.295 -5.035 1.00 0.00 H new ATOM 0 HB VAL A 289 3.795 -5.808 -7.747 1.00 0.00 H new ATOM 0 HG11 VAL A 289 6.068 -5.460 -8.623 1.00 0.00 H new ATOM 0 HG12 VAL A 289 5.437 -4.005 -7.815 1.00 0.00 H new ATOM 0 HG13 VAL A 289 6.628 -5.037 -6.987 1.00 0.00 H new ATOM 0 HG21 VAL A 289 5.379 -7.698 -7.883 1.00 0.00 H new ATOM 0 HG22 VAL A 289 5.900 -7.371 -6.213 1.00 0.00 H new ATOM 0 HG23 VAL A 289 4.229 -7.892 -6.538 1.00 0.00 H new ATOM 951 N PHE A 290 4.469 -2.903 -5.339 1.00 0.00 N ATOM 952 CA PHE A 290 4.058 -1.506 -5.327 1.00 0.00 C ATOM 953 C PHE A 290 4.869 -0.689 -6.319 1.00 0.00 C ATOM 954 O PHE A 290 5.873 -1.159 -6.848 1.00 0.00 O ATOM 955 CB PHE A 290 4.220 -0.947 -3.917 1.00 0.00 C ATOM 956 CG PHE A 290 3.414 -1.704 -2.907 1.00 0.00 C ATOM 957 CD1 PHE A 290 2.033 -1.636 -2.910 1.00 0.00 C ATOM 958 CD2 PHE A 290 4.039 -2.513 -1.979 1.00 0.00 C ATOM 959 CE1 PHE A 290 1.290 -2.362 -2.002 1.00 0.00 C ATOM 960 CE2 PHE A 290 3.305 -3.237 -1.067 1.00 0.00 C ATOM 961 CZ PHE A 290 1.931 -3.161 -1.077 1.00 0.00 C ATOM 0 H PHE A 290 5.370 -3.081 -4.896 1.00 0.00 H new ATOM 0 HA PHE A 290 3.012 -1.443 -5.626 1.00 0.00 H new ATOM 0 HB2 PHE A 290 5.273 -0.978 -3.635 1.00 0.00 H new ATOM 0 HB3 PHE A 290 3.918 0.100 -3.907 1.00 0.00 H new ATOM 0 HD1 PHE A 290 1.531 -1.008 -3.631 1.00 0.00 H new ATOM 0 HD2 PHE A 290 5.117 -2.579 -1.969 1.00 0.00 H new ATOM 0 HE1 PHE A 290 0.212 -2.305 -2.015 1.00 0.00 H new ATOM 0 HE2 PHE A 290 3.807 -3.864 -0.345 1.00 0.00 H new ATOM 0 HZ PHE A 290 1.354 -3.727 -0.361 1.00 0.00 H new ATOM 971 N ARG A 291 4.428 0.535 -6.567 1.00 0.00 N ATOM 972 CA ARG A 291 5.104 1.425 -7.488 1.00 0.00 C ATOM 973 C ARG A 291 5.261 2.801 -6.847 1.00 0.00 C ATOM 974 O ARG A 291 4.285 3.424 -6.424 1.00 0.00 O ATOM 975 CB ARG A 291 4.305 1.542 -8.790 1.00 0.00 C ATOM 976 CG ARG A 291 5.042 2.267 -9.903 1.00 0.00 C ATOM 977 CD ARG A 291 6.264 1.483 -10.359 1.00 0.00 C ATOM 978 NE ARG A 291 6.981 2.161 -11.436 1.00 0.00 N ATOM 979 CZ ARG A 291 8.067 1.662 -12.022 1.00 0.00 C ATOM 980 NH1 ARG A 291 8.512 0.460 -11.683 1.00 0.00 N1+ ATOM 981 NH2 ARG A 291 8.700 2.361 -12.955 1.00 0.00 N ATOM 0 H ARG A 291 3.595 0.935 -6.136 1.00 0.00 H new ATOM 0 HA ARG A 291 6.090 1.020 -7.718 1.00 0.00 H new ATOM 0 HB2 ARG A 291 4.041 0.542 -9.134 1.00 0.00 H new ATOM 0 HB3 ARG A 291 3.371 2.065 -8.586 1.00 0.00 H new ATOM 0 HG2 ARG A 291 4.370 2.421 -10.747 1.00 0.00 H new ATOM 0 HG3 ARG A 291 5.349 3.254 -9.556 1.00 0.00 H new ATOM 0 HD2 ARG A 291 6.936 1.335 -9.513 1.00 0.00 H new ATOM 0 HD3 ARG A 291 5.954 0.494 -10.697 1.00 0.00 H new ATOM 0 HE ARG A 291 6.631 3.064 -11.756 1.00 0.00 H new ATOM 0 HH11 ARG A 291 8.022 -0.084 -10.972 1.00 0.00 H new ATOM 0 HH12 ARG A 291 9.344 0.079 -12.133 1.00 0.00 H new ATOM 0 HH21 ARG A 291 8.355 3.282 -13.224 1.00 0.00 H new ATOM 0 HH22 ARG A 291 9.532 1.977 -13.403 1.00 0.00 H new ATOM 995 N VAL A 292 6.500 3.233 -6.724 1.00 0.00 N ATOM 996 CA VAL A 292 6.826 4.502 -6.074 1.00 0.00 C ATOM 997 C VAL A 292 6.293 5.700 -6.861 1.00 0.00 C ATOM 998 O VAL A 292 6.497 5.805 -8.071 1.00 0.00 O ATOM 999 CB VAL A 292 8.350 4.648 -5.887 1.00 0.00 C ATOM 1000 CG1 VAL A 292 8.691 5.960 -5.202 1.00 0.00 C ATOM 1001 CG2 VAL A 292 8.906 3.479 -5.093 1.00 0.00 C ATOM 0 H VAL A 292 7.312 2.721 -7.068 1.00 0.00 H new ATOM 0 HA VAL A 292 6.341 4.490 -5.098 1.00 0.00 H new ATOM 0 HB VAL A 292 8.811 4.649 -6.875 1.00 0.00 H new ATOM 0 HG11 VAL A 292 9.772 6.038 -5.082 1.00 0.00 H new ATOM 0 HG12 VAL A 292 8.332 6.791 -5.809 1.00 0.00 H new ATOM 0 HG13 VAL A 292 8.214 5.994 -4.222 1.00 0.00 H new ATOM 0 HG21 VAL A 292 9.982 3.601 -4.972 1.00 0.00 H new ATOM 0 HG22 VAL A 292 8.432 3.447 -4.112 1.00 0.00 H new ATOM 0 HG23 VAL A 292 8.703 2.549 -5.624 1.00 0.00 H new ATOM 1011 N LEU A 293 5.640 6.618 -6.149 1.00 0.00 N ATOM 1012 CA LEU A 293 5.107 7.832 -6.759 1.00 0.00 C ATOM 1013 C LEU A 293 6.004 9.033 -6.487 1.00 0.00 C ATOM 1014 O LEU A 293 6.209 9.866 -7.366 1.00 0.00 O ATOM 1015 CB LEU A 293 3.707 8.138 -6.229 1.00 0.00 C ATOM 1016 CG LEU A 293 2.648 7.075 -6.505 1.00 0.00 C ATOM 1017 CD1 LEU A 293 1.314 7.509 -5.925 1.00 0.00 C ATOM 1018 CD2 LEU A 293 2.517 6.819 -7.996 1.00 0.00 C ATOM 0 H LEU A 293 5.468 6.542 -5.146 1.00 0.00 H new ATOM 0 HA LEU A 293 5.064 7.653 -7.833 1.00 0.00 H new ATOM 0 HB2 LEU A 293 3.771 8.289 -5.151 1.00 0.00 H new ATOM 0 HB3 LEU A 293 3.372 9.080 -6.663 1.00 0.00 H new ATOM 0 HG LEU A 293 2.957 6.146 -6.027 1.00 0.00 H new ATOM 0 HD11 LEU A 293 0.564 6.745 -6.127 1.00 0.00 H new ATOM 0 HD12 LEU A 293 1.413 7.646 -4.848 1.00 0.00 H new ATOM 0 HD13 LEU A 293 1.006 8.449 -6.383 1.00 0.00 H new ATOM 0 HD21 LEU A 293 1.756 6.058 -8.169 1.00 0.00 H new ATOM 0 HD22 LEU A 293 2.228 7.742 -8.500 1.00 0.00 H new ATOM 0 HD23 LEU A 293 3.472 6.474 -8.391 1.00 0.00 H new ATOM 1030 N ALA A 294 6.456 9.172 -5.245 1.00 0.00 N ATOM 1031 CA ALA A 294 7.234 10.341 -4.852 1.00 0.00 C ATOM 1032 C ALA A 294 8.216 10.004 -3.743 1.00 0.00 C ATOM 1033 O ALA A 294 7.868 9.313 -2.788 1.00 0.00 O ATOM 1034 CB ALA A 294 6.307 11.461 -4.402 1.00 0.00 C ATOM 0 H ALA A 294 6.299 8.495 -4.498 1.00 0.00 H new ATOM 0 HA ALA A 294 7.804 10.671 -5.720 1.00 0.00 H new ATOM 0 HB1 ALA A 294 6.899 12.329 -4.111 1.00 0.00 H new ATOM 0 HB2 ALA A 294 5.642 11.734 -5.221 1.00 0.00 H new ATOM 0 HB3 ALA A 294 5.715 11.124 -3.551 1.00 0.00 H new ATOM 1040 N VAL A 295 9.424 10.547 -3.844 1.00 0.00 N ATOM 1041 CA VAL A 295 10.441 10.360 -2.817 1.00 0.00 C ATOM 1042 C VAL A 295 11.105 11.693 -2.487 1.00 0.00 C ATOM 1043 O VAL A 295 11.729 12.315 -3.346 1.00 0.00 O ATOM 1044 CB VAL A 295 11.525 9.347 -3.255 1.00 0.00 C ATOM 1045 CG1 VAL A 295 12.557 9.139 -2.155 1.00 0.00 C ATOM 1046 CG2 VAL A 295 10.896 8.020 -3.639 1.00 0.00 C ATOM 0 H VAL A 295 9.723 11.123 -4.631 1.00 0.00 H new ATOM 0 HA VAL A 295 9.940 9.963 -1.934 1.00 0.00 H new ATOM 0 HB VAL A 295 12.032 9.760 -4.127 1.00 0.00 H new ATOM 0 HG11 VAL A 295 13.307 8.422 -2.490 1.00 0.00 H new ATOM 0 HG12 VAL A 295 13.040 10.089 -1.925 1.00 0.00 H new ATOM 0 HG13 VAL A 295 12.064 8.757 -1.261 1.00 0.00 H new ATOM 0 HG21 VAL A 295 11.676 7.322 -3.944 1.00 0.00 H new ATOM 0 HG22 VAL A 295 10.358 7.611 -2.784 1.00 0.00 H new ATOM 0 HG23 VAL A 295 10.202 8.172 -4.466 1.00 0.00 H new ATOM 1056 N SER A 296 10.963 12.127 -1.245 1.00 0.00 N ATOM 1057 CA SER A 296 11.548 13.391 -0.793 1.00 0.00 C ATOM 1058 C SER A 296 11.733 13.382 0.722 1.00 0.00 C ATOM 1059 O SER A 296 10.771 13.194 1.465 1.00 0.00 O ATOM 1060 CB SER A 296 10.664 14.577 -1.200 1.00 0.00 C ATOM 1061 OG SER A 296 10.523 14.668 -2.613 1.00 0.00 O ATOM 0 H SER A 296 10.446 11.624 -0.524 1.00 0.00 H new ATOM 0 HA SER A 296 12.522 13.500 -1.270 1.00 0.00 H new ATOM 0 HB2 SER A 296 9.680 14.472 -0.742 1.00 0.00 H new ATOM 0 HB3 SER A 296 11.096 15.501 -0.817 1.00 0.00 H new ATOM 0 HG SER A 296 11.041 13.954 -3.040 1.00 0.00 H new ATOM 1067 N GLY A 297 12.977 13.536 1.171 1.00 0.00 N ATOM 1068 CA GLY A 297 13.269 13.489 2.596 1.00 0.00 C ATOM 1069 C GLY A 297 12.931 12.143 3.200 1.00 0.00 C ATOM 1070 O GLY A 297 12.317 12.074 4.267 1.00 0.00 O ATOM 0 H GLY A 297 13.789 13.693 0.574 1.00 0.00 H new ATOM 0 HA2 GLY A 297 14.326 13.703 2.757 1.00 0.00 H new ATOM 0 HA3 GLY A 297 12.704 14.268 3.108 1.00 0.00 H new ATOM 1074 N THR A 298 13.244 11.081 2.450 1.00 0.00 N ATOM 1075 CA THR A 298 12.899 9.697 2.803 1.00 0.00 C ATOM 1076 C THR A 298 11.402 9.527 3.094 1.00 0.00 C ATOM 1077 O THR A 298 10.982 8.523 3.665 1.00 0.00 O ATOM 1078 CB THR A 298 13.755 9.172 3.971 1.00 0.00 C ATOM 1079 OG1 THR A 298 13.580 9.934 5.155 1.00 0.00 O ATOM 1080 CG2 THR A 298 15.237 9.158 3.660 1.00 0.00 C ATOM 0 H THR A 298 13.751 11.158 1.568 1.00 0.00 H new ATOM 0 HA THR A 298 13.128 9.090 1.927 1.00 0.00 H new ATOM 0 HB THR A 298 13.403 8.152 4.123 1.00 0.00 H new ATOM 0 HG1 THR A 298 12.810 10.531 5.049 1.00 0.00 H new ATOM 0 HG21 THR A 298 15.786 8.778 4.522 1.00 0.00 H new ATOM 0 HG22 THR A 298 15.422 8.515 2.800 1.00 0.00 H new ATOM 0 HG23 THR A 298 15.571 10.171 3.435 1.00 0.00 H new ATOM 1088 N THR A 299 10.595 10.457 2.596 1.00 0.00 N ATOM 1089 CA THR A 299 9.150 10.346 2.701 1.00 0.00 C ATOM 1090 C THR A 299 8.591 9.908 1.356 1.00 0.00 C ATOM 1091 O THR A 299 8.676 10.642 0.367 1.00 0.00 O ATOM 1092 CB THR A 299 8.540 11.683 3.131 1.00 0.00 C ATOM 1093 OG1 THR A 299 9.119 12.121 4.346 1.00 0.00 O ATOM 1094 CG2 THR A 299 7.041 11.627 3.337 1.00 0.00 C ATOM 0 H THR A 299 10.920 11.296 2.116 1.00 0.00 H new ATOM 0 HA THR A 299 8.894 9.605 3.458 1.00 0.00 H new ATOM 0 HB THR A 299 8.749 12.372 2.313 1.00 0.00 H new ATOM 0 HG1 THR A 299 8.721 12.977 4.608 1.00 0.00 H new ATOM 0 HG21 THR A 299 6.678 12.609 3.640 1.00 0.00 H new ATOM 0 HG22 THR A 299 6.557 11.333 2.406 1.00 0.00 H new ATOM 0 HG23 THR A 299 6.807 10.898 4.113 1.00 0.00 H new ATOM 1102 N VAL A 300 8.150 8.666 1.289 1.00 0.00 N ATOM 1103 CA VAL A 300 7.730 8.089 0.028 1.00 0.00 C ATOM 1104 C VAL A 300 6.211 8.015 -0.070 1.00 0.00 C ATOM 1105 O VAL A 300 5.556 7.383 0.759 1.00 0.00 O ATOM 1106 CB VAL A 300 8.332 6.677 -0.161 1.00 0.00 C ATOM 1107 CG1 VAL A 300 7.959 6.095 -1.515 1.00 0.00 C ATOM 1108 CG2 VAL A 300 9.844 6.714 0.003 1.00 0.00 C ATOM 0 H VAL A 300 8.074 8.040 2.091 1.00 0.00 H new ATOM 0 HA VAL A 300 8.098 8.741 -0.764 1.00 0.00 H new ATOM 0 HB VAL A 300 7.913 6.030 0.610 1.00 0.00 H new ATOM 0 HG11 VAL A 300 8.397 5.102 -1.617 1.00 0.00 H new ATOM 0 HG12 VAL A 300 6.874 6.023 -1.594 1.00 0.00 H new ATOM 0 HG13 VAL A 300 8.338 6.742 -2.306 1.00 0.00 H new ATOM 0 HG21 VAL A 300 10.249 5.711 -0.133 1.00 0.00 H new ATOM 0 HG22 VAL A 300 10.274 7.384 -0.741 1.00 0.00 H new ATOM 0 HG23 VAL A 300 10.093 7.073 1.002 1.00 0.00 H new ATOM 1118 N THR A 301 5.680 8.543 -1.161 1.00 0.00 N ATOM 1119 CA THR A 301 4.268 8.403 -1.462 1.00 0.00 C ATOM 1120 C THR A 301 4.087 7.143 -2.295 1.00 0.00 C ATOM 1121 O THR A 301 4.766 6.973 -3.314 1.00 0.00 O ATOM 1122 CB THR A 301 3.761 9.632 -2.221 1.00 0.00 C ATOM 1123 OG1 THR A 301 4.056 10.816 -1.500 1.00 0.00 O ATOM 1124 CG2 THR A 301 2.268 9.612 -2.470 1.00 0.00 C ATOM 0 H THR A 301 6.209 9.074 -1.853 1.00 0.00 H new ATOM 0 HA THR A 301 3.691 8.325 -0.541 1.00 0.00 H new ATOM 0 HB THR A 301 4.273 9.610 -3.183 1.00 0.00 H new ATOM 0 HG1 THR A 301 3.727 11.593 -1.999 1.00 0.00 H new ATOM 0 HG21 THR A 301 1.977 10.512 -3.012 1.00 0.00 H new ATOM 0 HG22 THR A 301 2.009 8.733 -3.061 1.00 0.00 H new ATOM 0 HG23 THR A 301 1.741 9.576 -1.517 1.00 0.00 H new ATOM 1132 N ILE A 302 3.350 6.180 -1.766 1.00 0.00 N ATOM 1133 CA ILE A 302 3.315 4.865 -2.379 1.00 0.00 C ATOM 1134 C ILE A 302 1.970 4.546 -3.016 1.00 0.00 C ATOM 1135 O ILE A 302 0.910 4.766 -2.427 1.00 0.00 O ATOM 1136 CB ILE A 302 3.675 3.759 -1.363 1.00 0.00 C ATOM 1137 CG1 ILE A 302 2.694 3.748 -0.187 1.00 0.00 C ATOM 1138 CG2 ILE A 302 5.094 3.958 -0.856 1.00 0.00 C ATOM 1139 CD1 ILE A 302 2.993 2.680 0.843 1.00 0.00 C ATOM 0 H ILE A 302 2.778 6.282 -0.928 1.00 0.00 H new ATOM 0 HA ILE A 302 4.064 4.888 -3.170 1.00 0.00 H new ATOM 0 HB ILE A 302 3.606 2.797 -1.871 1.00 0.00 H new ATOM 0 HG12 ILE A 302 2.711 4.724 0.298 1.00 0.00 H new ATOM 0 HG13 ILE A 302 1.684 3.600 -0.569 1.00 0.00 H new ATOM 0 HG21 ILE A 302 5.338 3.173 -0.140 1.00 0.00 H new ATOM 0 HG22 ILE A 302 5.789 3.914 -1.694 1.00 0.00 H new ATOM 0 HG23 ILE A 302 5.174 4.930 -0.369 1.00 0.00 H new ATOM 0 HD11 ILE A 302 2.258 2.733 1.646 1.00 0.00 H new ATOM 0 HD12 ILE A 302 2.947 1.698 0.373 1.00 0.00 H new ATOM 0 HD13 ILE A 302 3.990 2.839 1.253 1.00 0.00 H new ATOM 1151 N SER A 303 2.057 3.897 -4.166 1.00 0.00 N ATOM 1152 CA SER A 303 0.905 3.361 -4.865 1.00 0.00 C ATOM 1153 C SER A 303 1.223 1.916 -5.214 1.00 0.00 C ATOM 1154 O SER A 303 2.388 1.583 -5.372 1.00 0.00 O ATOM 1155 CB SER A 303 0.631 4.171 -6.138 1.00 0.00 C ATOM 1156 OG SER A 303 -0.487 3.671 -6.856 1.00 0.00 O ATOM 0 H SER A 303 2.942 3.727 -4.644 1.00 0.00 H new ATOM 0 HA SER A 303 0.013 3.418 -4.241 1.00 0.00 H new ATOM 0 HB2 SER A 303 0.455 5.214 -5.873 1.00 0.00 H new ATOM 0 HB3 SER A 303 1.513 4.149 -6.779 1.00 0.00 H new ATOM 0 HG SER A 303 -0.630 4.215 -7.659 1.00 0.00 H new ATOM 1162 N PRO A 304 0.236 1.018 -5.326 1.00 0.00 N ATOM 1163 CA PRO A 304 -1.196 1.316 -5.150 1.00 0.00 C ATOM 1164 C PRO A 304 -1.540 1.788 -3.741 1.00 0.00 C ATOM 1165 O PRO A 304 -0.686 1.832 -2.855 1.00 0.00 O ATOM 1166 CB PRO A 304 -1.876 -0.028 -5.434 1.00 0.00 C ATOM 1167 CG PRO A 304 -0.871 -0.806 -6.210 1.00 0.00 C ATOM 1168 CD PRO A 304 0.462 -0.390 -5.665 1.00 0.00 C ATOM 0 HA PRO A 304 -1.516 2.128 -5.803 1.00 0.00 H new ATOM 0 HB2 PRO A 304 -2.144 -0.539 -4.509 1.00 0.00 H new ATOM 0 HB3 PRO A 304 -2.797 0.107 -6.002 1.00 0.00 H new ATOM 0 HG2 PRO A 304 -1.027 -1.878 -6.091 1.00 0.00 H new ATOM 0 HG3 PRO A 304 -0.944 -0.590 -7.276 1.00 0.00 H new ATOM 0 HD2 PRO A 304 0.746 -0.978 -4.792 1.00 0.00 H new ATOM 0 HD3 PRO A 304 1.257 -0.508 -6.401 1.00 0.00 H new ATOM 1176 N LYS A 305 -2.809 2.089 -3.523 1.00 0.00 N ATOM 1177 CA LYS A 305 -3.264 2.501 -2.206 1.00 0.00 C ATOM 1178 C LYS A 305 -3.650 1.303 -1.358 1.00 0.00 C ATOM 1179 O LYS A 305 -4.023 0.252 -1.884 1.00 0.00 O ATOM 1180 CB LYS A 305 -4.410 3.539 -2.255 1.00 0.00 C ATOM 1181 CG LYS A 305 -5.558 3.263 -3.229 1.00 0.00 C ATOM 1182 CD LYS A 305 -5.197 3.631 -4.666 1.00 0.00 C ATOM 1183 CE LYS A 305 -6.404 3.564 -5.592 1.00 0.00 C ATOM 1184 NZ LYS A 305 -7.045 2.223 -5.592 1.00 0.00 N1+ ATOM 0 H LYS A 305 -3.538 2.056 -4.236 1.00 0.00 H new ATOM 0 HA LYS A 305 -2.417 3.000 -1.735 1.00 0.00 H new ATOM 0 HB2 LYS A 305 -4.830 3.627 -1.253 1.00 0.00 H new ATOM 0 HB3 LYS A 305 -3.979 4.508 -2.506 1.00 0.00 H new ATOM 0 HG2 LYS A 305 -5.826 2.207 -3.183 1.00 0.00 H new ATOM 0 HG3 LYS A 305 -6.437 3.829 -2.921 1.00 0.00 H new ATOM 0 HD2 LYS A 305 -4.778 4.637 -4.688 1.00 0.00 H new ATOM 0 HD3 LYS A 305 -4.423 2.955 -5.030 1.00 0.00 H new ATOM 0 HE2 LYS A 305 -7.135 4.313 -5.287 1.00 0.00 H new ATOM 0 HE3 LYS A 305 -6.095 3.816 -6.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 305 -7.300 1.960 -6.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 305 -6.381 1.521 -5.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 305 -7.902 2.248 -5.004 1.00 0.00 H new ATOM 1198 N ILE A 306 -3.454 1.443 -0.049 1.00 0.00 N ATOM 1199 CA ILE A 306 -3.674 0.350 0.889 1.00 0.00 C ATOM 1200 C ILE A 306 -5.147 -0.028 0.937 1.00 0.00 C ATOM 1201 O ILE A 306 -5.937 0.627 1.608 1.00 0.00 O ATOM 1202 CB ILE A 306 -3.197 0.730 2.315 1.00 0.00 C ATOM 1203 CG1 ILE A 306 -1.737 1.195 2.284 1.00 0.00 C ATOM 1204 CG2 ILE A 306 -3.335 -0.460 3.254 1.00 0.00 C ATOM 1205 CD1 ILE A 306 -0.771 0.138 1.793 1.00 0.00 C ATOM 0 H ILE A 306 -3.141 2.311 0.387 1.00 0.00 H new ATOM 0 HA ILE A 306 -3.092 -0.502 0.538 1.00 0.00 H new ATOM 0 HB ILE A 306 -3.822 1.546 2.679 1.00 0.00 H new ATOM 0 HG12 ILE A 306 -1.658 2.073 1.642 1.00 0.00 H new ATOM 0 HG13 ILE A 306 -1.443 1.506 3.286 1.00 0.00 H new ATOM 0 HG21 ILE A 306 -2.996 -0.178 4.251 1.00 0.00 H new ATOM 0 HG22 ILE A 306 -4.379 -0.769 3.299 1.00 0.00 H new ATOM 0 HG23 ILE A 306 -2.728 -1.287 2.885 1.00 0.00 H new ATOM 0 HD11 ILE A 306 0.242 0.540 1.799 1.00 0.00 H new ATOM 0 HD12 ILE A 306 -0.820 -0.732 2.448 1.00 0.00 H new ATOM 0 HD13 ILE A 306 -1.039 -0.156 0.778 1.00 0.00 H new ATOM 1217 N LEU A 307 -5.519 -1.075 0.216 1.00 0.00 N ATOM 1218 CA LEU A 307 -6.907 -1.507 0.189 1.00 0.00 C ATOM 1219 C LEU A 307 -7.019 -2.927 0.719 1.00 0.00 C ATOM 1220 O LEU A 307 -6.782 -3.889 -0.010 1.00 0.00 O ATOM 1221 CB LEU A 307 -7.434 -1.441 -1.244 1.00 0.00 C ATOM 1222 CG LEU A 307 -7.288 -0.078 -1.919 1.00 0.00 C ATOM 1223 CD1 LEU A 307 -7.773 -0.130 -3.354 1.00 0.00 C ATOM 1224 CD2 LEU A 307 -8.052 0.983 -1.152 1.00 0.00 C ATOM 0 H LEU A 307 -4.885 -1.636 -0.353 1.00 0.00 H new ATOM 0 HA LEU A 307 -7.502 -0.848 0.822 1.00 0.00 H new ATOM 0 HB2 LEU A 307 -6.910 -2.185 -1.843 1.00 0.00 H new ATOM 0 HB3 LEU A 307 -8.488 -1.718 -1.242 1.00 0.00 H new ATOM 0 HG LEU A 307 -6.230 0.183 -1.920 1.00 0.00 H new ATOM 0 HD11 LEU A 307 -7.659 0.852 -3.813 1.00 0.00 H new ATOM 0 HD12 LEU A 307 -7.186 -0.861 -3.910 1.00 0.00 H new ATOM 0 HD13 LEU A 307 -8.824 -0.419 -3.373 1.00 0.00 H new ATOM 0 HD21 LEU A 307 -7.935 1.946 -1.649 1.00 0.00 H new ATOM 0 HD22 LEU A 307 -9.109 0.718 -1.118 1.00 0.00 H new ATOM 0 HD23 LEU A 307 -7.662 1.049 -0.136 1.00 0.00 H new ATOM 1236 N PRO A 308 -7.331 -3.073 2.013 1.00 0.00 N ATOM 1237 CA PRO A 308 -7.406 -4.375 2.675 1.00 0.00 C ATOM 1238 C PRO A 308 -8.691 -5.123 2.352 1.00 0.00 C ATOM 1239 O PRO A 308 -9.631 -4.556 1.807 1.00 0.00 O ATOM 1240 CB PRO A 308 -7.357 -4.030 4.174 1.00 0.00 C ATOM 1241 CG PRO A 308 -7.067 -2.564 4.247 1.00 0.00 C ATOM 1242 CD PRO A 308 -7.558 -1.979 2.958 1.00 0.00 C ATOM 0 HA PRO A 308 -6.601 -5.033 2.348 1.00 0.00 H new ATOM 0 HB2 PRO A 308 -8.304 -4.266 4.660 1.00 0.00 H new ATOM 0 HB3 PRO A 308 -6.585 -4.607 4.683 1.00 0.00 H new ATOM 0 HG2 PRO A 308 -7.572 -2.109 5.099 1.00 0.00 H new ATOM 0 HG3 PRO A 308 -6.000 -2.384 4.375 1.00 0.00 H new ATOM 0 HD2 PRO A 308 -8.610 -1.700 3.013 1.00 0.00 H new ATOM 0 HD3 PRO A 308 -7.005 -1.081 2.682 1.00 0.00 H new ATOM 1250 N VAL A 309 -8.739 -6.386 2.736 1.00 0.00 N ATOM 1251 CA VAL A 309 -9.932 -7.194 2.538 1.00 0.00 C ATOM 1252 C VAL A 309 -10.805 -7.140 3.793 1.00 0.00 C ATOM 1253 O VAL A 309 -12.021 -7.334 3.735 1.00 0.00 O ATOM 1254 CB VAL A 309 -9.556 -8.663 2.232 1.00 0.00 C ATOM 1255 CG1 VAL A 309 -10.787 -9.491 1.898 1.00 0.00 C ATOM 1256 CG2 VAL A 309 -8.543 -8.735 1.101 1.00 0.00 C ATOM 0 H VAL A 309 -7.966 -6.876 3.187 1.00 0.00 H new ATOM 0 HA VAL A 309 -10.484 -6.792 1.688 1.00 0.00 H new ATOM 0 HB VAL A 309 -9.103 -9.083 3.130 1.00 0.00 H new ATOM 0 HG11 VAL A 309 -10.489 -10.518 1.688 1.00 0.00 H new ATOM 0 HG12 VAL A 309 -11.474 -9.479 2.744 1.00 0.00 H new ATOM 0 HG13 VAL A 309 -11.282 -9.071 1.022 1.00 0.00 H new ATOM 0 HG21 VAL A 309 -8.293 -9.777 0.902 1.00 0.00 H new ATOM 0 HG22 VAL A 309 -8.968 -8.286 0.203 1.00 0.00 H new ATOM 0 HG23 VAL A 309 -7.641 -8.193 1.385 1.00 0.00 H new ATOM 1266 N GLU A 310 -10.144 -6.987 4.933 1.00 0.00 N ATOM 1267 CA GLU A 310 -10.788 -7.044 6.239 1.00 0.00 C ATOM 1268 C GLU A 310 -11.349 -5.685 6.669 1.00 0.00 C ATOM 1269 O GLU A 310 -11.291 -5.336 7.851 1.00 0.00 O ATOM 1270 CB GLU A 310 -9.794 -7.534 7.307 1.00 0.00 C ATOM 1271 CG GLU A 310 -9.135 -8.881 7.011 1.00 0.00 C ATOM 1272 CD GLU A 310 -8.053 -8.827 5.945 1.00 0.00 C ATOM 1273 OE1 GLU A 310 -7.529 -9.903 5.586 1.00 0.00 O ATOM 1274 OE2 GLU A 310 -7.704 -7.718 5.492 1.00 0.00 O1- ATOM 0 H GLU A 310 -9.139 -6.819 4.978 1.00 0.00 H new ATOM 0 HA GLU A 310 -11.619 -7.744 6.149 1.00 0.00 H new ATOM 0 HB2 GLU A 310 -9.013 -6.783 7.425 1.00 0.00 H new ATOM 0 HB3 GLU A 310 -10.316 -7.604 8.261 1.00 0.00 H new ATOM 0 HG2 GLU A 310 -8.702 -9.271 7.932 1.00 0.00 H new ATOM 0 HG3 GLU A 310 -9.904 -9.587 6.697 1.00 0.00 H new ATOM 1281 N ASN A 311 -11.859 -4.904 5.721 1.00 0.00 N ATOM 1282 CA ASN A 311 -12.388 -3.579 6.044 1.00 0.00 C ATOM 1283 C ASN A 311 -13.731 -3.663 6.749 1.00 0.00 C ATOM 1284 O ASN A 311 -14.447 -4.661 6.646 1.00 0.00 O ATOM 1285 CB ASN A 311 -12.533 -2.701 4.802 1.00 0.00 C ATOM 1286 CG ASN A 311 -11.204 -2.366 4.172 1.00 0.00 C ATOM 1287 OD1 ASN A 311 -10.307 -1.843 4.833 1.00 0.00 O ATOM 1288 ND2 ASN A 311 -11.081 -2.630 2.886 1.00 0.00 N ATOM 0 H ASN A 311 -11.918 -5.159 4.735 1.00 0.00 H new ATOM 0 HA ASN A 311 -11.660 -3.123 6.716 1.00 0.00 H new ATOM 0 HB2 ASN A 311 -13.159 -3.212 4.071 1.00 0.00 H new ATOM 0 HB3 ASN A 311 -13.046 -1.778 5.072 1.00 0.00 H new ATOM 0 HD21 ASN A 311 -10.215 -2.400 2.399 1.00 0.00 H new ATOM 0 HD22 ASN A 311 -11.852 -3.065 2.379 1.00 0.00 H new ATOM 1295 N THR A 312 -14.065 -2.593 7.450 1.00 0.00 N ATOM 1296 CA THR A 312 -15.321 -2.501 8.172 1.00 0.00 C ATOM 1297 C THR A 312 -16.402 -1.892 7.277 1.00 0.00 C ATOM 1298 O THR A 312 -17.569 -2.291 7.328 1.00 0.00 O ATOM 1299 CB THR A 312 -15.117 -1.645 9.425 1.00 0.00 C ATOM 1300 OG1 THR A 312 -14.020 -2.131 10.182 1.00 0.00 O ATOM 1301 CG2 THR A 312 -16.316 -1.618 10.343 1.00 0.00 C ATOM 0 H THR A 312 -13.474 -1.766 7.534 1.00 0.00 H new ATOM 0 HA THR A 312 -15.647 -3.499 8.467 1.00 0.00 H new ATOM 0 HB THR A 312 -14.941 -0.635 9.056 1.00 0.00 H new ATOM 0 HG1 THR A 312 -13.900 -1.574 10.979 1.00 0.00 H new ATOM 0 HG21 THR A 312 -16.098 -0.992 11.208 1.00 0.00 H new ATOM 0 HG22 THR A 312 -17.174 -1.211 9.808 1.00 0.00 H new ATOM 0 HG23 THR A 312 -16.542 -2.631 10.676 1.00 0.00 H new ATOM 1309 N ASP A 313 -16.001 -0.932 6.448 1.00 0.00 N ATOM 1310 CA ASP A 313 -16.922 -0.271 5.528 1.00 0.00 C ATOM 1311 C ASP A 313 -17.387 -1.245 4.455 1.00 0.00 C ATOM 1312 O ASP A 313 -16.577 -1.985 3.893 1.00 0.00 O ATOM 1313 CB ASP A 313 -16.256 0.940 4.867 1.00 0.00 C ATOM 1314 CG ASP A 313 -15.796 1.979 5.864 1.00 0.00 C ATOM 1315 OD1 ASP A 313 -14.950 1.656 6.716 1.00 0.00 O ATOM 1316 OD2 ASP A 313 -16.275 3.126 5.790 1.00 0.00 O1- ATOM 0 H ASP A 313 -15.040 -0.593 6.395 1.00 0.00 H new ATOM 0 HA ASP A 313 -17.783 0.071 6.102 1.00 0.00 H new ATOM 0 HB2 ASP A 313 -15.401 0.603 4.282 1.00 0.00 H new ATOM 0 HB3 ASP A 313 -16.958 1.399 4.171 1.00 0.00 H new ATOM 1321 N VAL A 314 -18.691 -1.267 4.205 1.00 0.00 N ATOM 1322 CA VAL A 314 -19.278 -2.187 3.235 1.00 0.00 C ATOM 1323 C VAL A 314 -18.706 -1.955 1.839 1.00 0.00 C ATOM 1324 O VAL A 314 -18.261 -2.894 1.176 1.00 0.00 O ATOM 1325 CB VAL A 314 -20.814 -2.036 3.178 1.00 0.00 C ATOM 1326 CG1 VAL A 314 -21.429 -3.080 2.262 1.00 0.00 C ATOM 1327 CG2 VAL A 314 -21.421 -2.122 4.568 1.00 0.00 C ATOM 0 H VAL A 314 -19.366 -0.655 4.663 1.00 0.00 H new ATOM 0 HA VAL A 314 -19.028 -3.196 3.564 1.00 0.00 H new ATOM 0 HB VAL A 314 -21.037 -1.050 2.769 1.00 0.00 H new ATOM 0 HG11 VAL A 314 -22.511 -2.952 2.239 1.00 0.00 H new ATOM 0 HG12 VAL A 314 -21.028 -2.962 1.255 1.00 0.00 H new ATOM 0 HG13 VAL A 314 -21.189 -4.076 2.633 1.00 0.00 H new ATOM 0 HG21 VAL A 314 -22.503 -2.013 4.500 1.00 0.00 H new ATOM 0 HG22 VAL A 314 -21.181 -3.089 5.011 1.00 0.00 H new ATOM 0 HG23 VAL A 314 -21.015 -1.326 5.192 1.00 0.00 H new ATOM 1337 N ALA A 315 -18.751 -0.706 1.390 1.00 0.00 N ATOM 1338 CA ALA A 315 -18.275 -0.344 0.058 1.00 0.00 C ATOM 1339 C ALA A 315 -16.761 -0.480 -0.060 1.00 0.00 C ATOM 1340 O ALA A 315 -16.220 -0.511 -1.160 1.00 0.00 O ATOM 1341 CB ALA A 315 -18.696 1.078 -0.287 1.00 0.00 C ATOM 0 H ALA A 315 -19.114 0.078 1.932 1.00 0.00 H new ATOM 0 HA ALA A 315 -18.729 -1.038 -0.649 1.00 0.00 H new ATOM 0 HB1 ALA A 315 -18.334 1.333 -1.283 1.00 0.00 H new ATOM 0 HB2 ALA A 315 -19.783 1.151 -0.267 1.00 0.00 H new ATOM 0 HB3 ALA A 315 -18.273 1.770 0.441 1.00 0.00 H new ATOM 1347 N SER A 316 -16.074 -0.531 1.070 1.00 0.00 N ATOM 1348 CA SER A 316 -14.622 -0.625 1.060 1.00 0.00 C ATOM 1349 C SER A 316 -14.159 -2.073 0.901 1.00 0.00 C ATOM 1350 O SER A 316 -12.975 -2.328 0.685 1.00 0.00 O ATOM 1351 CB SER A 316 -14.040 -0.024 2.341 1.00 0.00 C ATOM 1352 OG SER A 316 -12.624 -0.072 2.331 1.00 0.00 O ATOM 0 H SER A 316 -16.494 -0.509 1.999 1.00 0.00 H new ATOM 0 HA SER A 316 -14.258 -0.058 0.203 1.00 0.00 H new ATOM 0 HB2 SER A 316 -14.371 1.009 2.444 1.00 0.00 H new ATOM 0 HB3 SER A 316 -14.419 -0.568 3.206 1.00 0.00 H new ATOM 0 HG SER A 316 -12.325 -0.770 1.711 1.00 0.00 H new ATOM 1358 N ARG A 317 -15.086 -3.016 1.025 1.00 0.00 N ATOM 1359 CA ARG A 317 -14.754 -4.436 0.912 1.00 0.00 C ATOM 1360 C ARG A 317 -14.470 -4.860 -0.537 1.00 0.00 C ATOM 1361 O ARG A 317 -13.489 -5.560 -0.782 1.00 0.00 O ATOM 1362 CB ARG A 317 -15.870 -5.304 1.496 1.00 0.00 C ATOM 1363 CG ARG A 317 -16.168 -5.014 2.956 1.00 0.00 C ATOM 1364 CD ARG A 317 -17.267 -5.921 3.474 1.00 0.00 C ATOM 1365 NE ARG A 317 -18.486 -5.804 2.680 1.00 0.00 N ATOM 1366 CZ ARG A 317 -19.578 -6.529 2.902 1.00 0.00 C ATOM 1367 NH1 ARG A 317 -19.605 -7.394 3.909 1.00 0.00 N1+ ATOM 1368 NH2 ARG A 317 -20.634 -6.389 2.115 1.00 0.00 N ATOM 0 H ARG A 317 -16.072 -2.826 1.203 1.00 0.00 H new ATOM 0 HA ARG A 317 -13.840 -4.587 1.486 1.00 0.00 H new ATOM 0 HB2 ARG A 317 -16.778 -5.154 0.912 1.00 0.00 H new ATOM 0 HB3 ARG A 317 -15.594 -6.353 1.392 1.00 0.00 H new ATOM 0 HG2 ARG A 317 -15.265 -5.154 3.550 1.00 0.00 H new ATOM 0 HG3 ARG A 317 -16.467 -3.972 3.070 1.00 0.00 H new ATOM 0 HD2 ARG A 317 -16.922 -6.955 3.460 1.00 0.00 H new ATOM 0 HD3 ARG A 317 -17.484 -5.672 4.513 1.00 0.00 H new ATOM 0 HE ARG A 317 -18.501 -5.130 1.914 1.00 0.00 H new ATOM 0 HH11 ARG A 317 -18.789 -7.502 4.511 1.00 0.00 H new ATOM 0 HH12 ARG A 317 -20.442 -7.951 4.081 1.00 0.00 H new ATOM 0 HH21 ARG A 317 -20.608 -5.726 1.340 1.00 0.00 H new ATOM 0 HH22 ARG A 317 -21.473 -6.944 2.284 1.00 0.00 H new ATOM 1382 N PRO A 318 -15.345 -4.514 -1.520 1.00 0.00 N ATOM 1383 CA PRO A 318 -15.165 -4.945 -2.919 1.00 0.00 C ATOM 1384 C PRO A 318 -13.868 -4.437 -3.543 1.00 0.00 C ATOM 1385 O PRO A 318 -13.356 -5.026 -4.494 1.00 0.00 O ATOM 1386 CB PRO A 318 -16.363 -4.328 -3.646 1.00 0.00 C ATOM 1387 CG PRO A 318 -17.378 -4.091 -2.587 1.00 0.00 C ATOM 1388 CD PRO A 318 -16.598 -3.749 -1.353 1.00 0.00 C ATOM 0 HA PRO A 318 -15.107 -6.031 -2.988 1.00 0.00 H new ATOM 0 HB2 PRO A 318 -16.087 -3.398 -4.142 1.00 0.00 H new ATOM 0 HB3 PRO A 318 -16.745 -4.999 -4.416 1.00 0.00 H new ATOM 0 HG2 PRO A 318 -18.051 -3.279 -2.863 1.00 0.00 H new ATOM 0 HG3 PRO A 318 -17.994 -4.976 -2.429 1.00 0.00 H new ATOM 0 HD2 PRO A 318 -16.409 -2.678 -1.281 1.00 0.00 H new ATOM 0 HD3 PRO A 318 -17.130 -4.041 -0.447 1.00 0.00 H new ATOM 1396 N TYR A 319 -13.363 -3.321 -3.032 1.00 0.00 N ATOM 1397 CA TYR A 319 -12.152 -2.711 -3.571 1.00 0.00 C ATOM 1398 C TYR A 319 -10.906 -3.222 -2.852 1.00 0.00 C ATOM 1399 O TYR A 319 -9.892 -2.531 -2.785 1.00 0.00 O ATOM 1400 CB TYR A 319 -12.240 -1.188 -3.463 1.00 0.00 C ATOM 1401 CG TYR A 319 -13.411 -0.598 -4.216 1.00 0.00 C ATOM 1402 CD1 TYR A 319 -13.547 -0.787 -5.584 1.00 0.00 C ATOM 1403 CD2 TYR A 319 -14.384 0.141 -3.559 1.00 0.00 C ATOM 1404 CE1 TYR A 319 -14.616 -0.255 -6.275 1.00 0.00 C ATOM 1405 CE2 TYR A 319 -15.456 0.677 -4.242 1.00 0.00 C ATOM 1406 CZ TYR A 319 -15.567 0.475 -5.600 1.00 0.00 C ATOM 1407 OH TYR A 319 -16.635 1.005 -6.284 1.00 0.00 O ATOM 0 H TYR A 319 -13.773 -2.819 -2.244 1.00 0.00 H new ATOM 0 HA TYR A 319 -12.070 -2.991 -4.621 1.00 0.00 H new ATOM 0 HB2 TYR A 319 -12.316 -0.910 -2.412 1.00 0.00 H new ATOM 0 HB3 TYR A 319 -11.316 -0.751 -3.842 1.00 0.00 H new ATOM 0 HD1 TYR A 319 -12.803 -1.361 -6.117 1.00 0.00 H new ATOM 0 HD2 TYR A 319 -14.301 0.299 -2.494 1.00 0.00 H new ATOM 0 HE1 TYR A 319 -14.706 -0.411 -7.340 1.00 0.00 H new ATOM 0 HE2 TYR A 319 -16.204 1.251 -3.715 1.00 0.00 H new ATOM 0 HH TYR A 319 -17.214 1.491 -5.660 1.00 0.00 H new ATOM 1417 N ALA A 320 -10.984 -4.440 -2.330 1.00 0.00 N ATOM 1418 CA ALA A 320 -9.862 -5.055 -1.630 1.00 0.00 C ATOM 1419 C ALA A 320 -8.825 -5.580 -2.613 1.00 0.00 C ATOM 1420 O ALA A 320 -9.157 -6.346 -3.520 1.00 0.00 O ATOM 1421 CB ALA A 320 -10.354 -6.185 -0.746 1.00 0.00 C ATOM 0 H ALA A 320 -11.818 -5.025 -2.379 1.00 0.00 H new ATOM 0 HA ALA A 320 -9.391 -4.292 -1.010 1.00 0.00 H new ATOM 0 HB1 ALA A 320 -9.508 -6.637 -0.228 1.00 0.00 H new ATOM 0 HB2 ALA A 320 -11.060 -5.793 -0.014 1.00 0.00 H new ATOM 0 HB3 ALA A 320 -10.848 -6.938 -1.360 1.00 0.00 H new ATOM 1427 N ASN A 321 -7.571 -5.185 -2.423 1.00 0.00 N ATOM 1428 CA ASN A 321 -6.491 -5.640 -3.295 1.00 0.00 C ATOM 1429 C ASN A 321 -5.301 -6.167 -2.498 1.00 0.00 C ATOM 1430 O ASN A 321 -4.397 -6.778 -3.066 1.00 0.00 O ATOM 1431 CB ASN A 321 -6.035 -4.519 -4.233 1.00 0.00 C ATOM 1432 CG ASN A 321 -7.126 -4.079 -5.189 1.00 0.00 C ATOM 1433 OD1 ASN A 321 -7.514 -2.818 -5.105 1.00 0.00 O flip ATOM 1434 ND2 ASN A 321 -7.621 -4.870 -5.995 1.00 0.00 N flip ATOM 0 H ASN A 321 -7.277 -4.554 -1.677 1.00 0.00 H new ATOM 0 HA ASN A 321 -6.889 -6.461 -3.891 1.00 0.00 H new ATOM 0 HB2 ASN A 321 -5.710 -3.664 -3.640 1.00 0.00 H new ATOM 0 HB3 ASN A 321 -5.171 -4.858 -4.805 1.00 0.00 H new ATOM 0 HD21 ASN A 321 -7.294 -5.836 -6.029 1.00 0.00 H new ATOM 0 HD22 ASN A 321 -8.358 -4.559 -6.628 1.00 0.00 H new ATOM 1441 N VAL A 322 -5.317 -5.972 -1.181 1.00 0.00 N ATOM 1442 CA VAL A 322 -4.250 -6.482 -0.325 1.00 0.00 C ATOM 1443 C VAL A 322 -4.816 -7.072 0.968 1.00 0.00 C ATOM 1444 O VAL A 322 -5.922 -6.728 1.391 1.00 0.00 O ATOM 1445 CB VAL A 322 -3.197 -5.396 0.025 1.00 0.00 C ATOM 1446 CG1 VAL A 322 -2.534 -4.845 -1.229 1.00 0.00 C ATOM 1447 CG2 VAL A 322 -3.808 -4.268 0.839 1.00 0.00 C ATOM 0 H VAL A 322 -6.053 -5.468 -0.686 1.00 0.00 H new ATOM 0 HA VAL A 322 -3.751 -7.265 -0.897 1.00 0.00 H new ATOM 0 HB VAL A 322 -2.432 -5.877 0.635 1.00 0.00 H new ATOM 0 HG11 VAL A 322 -1.802 -4.087 -0.950 1.00 0.00 H new ATOM 0 HG12 VAL A 322 -2.034 -5.654 -1.762 1.00 0.00 H new ATOM 0 HG13 VAL A 322 -3.291 -4.399 -1.875 1.00 0.00 H new ATOM 0 HG21 VAL A 322 -3.042 -3.526 1.066 1.00 0.00 H new ATOM 0 HG22 VAL A 322 -4.609 -3.799 0.267 1.00 0.00 H new ATOM 0 HG23 VAL A 322 -4.212 -4.668 1.769 1.00 0.00 H new ATOM 1457 N ASP A 323 -4.050 -7.963 1.587 1.00 0.00 N ATOM 1458 CA ASP A 323 -4.462 -8.605 2.825 1.00 0.00 C ATOM 1459 C ASP A 323 -4.082 -7.771 4.035 1.00 0.00 C ATOM 1460 O ASP A 323 -3.086 -8.060 4.702 1.00 0.00 O ATOM 1461 CB ASP A 323 -3.850 -10.003 2.976 1.00 0.00 C ATOM 1462 CG ASP A 323 -4.283 -10.963 1.896 1.00 0.00 C ATOM 1463 OD1 ASP A 323 -3.937 -10.739 0.727 1.00 0.00 O ATOM 1464 OD2 ASP A 323 -4.975 -11.945 2.224 1.00 0.00 O1- ATOM 0 H ASP A 323 -3.134 -8.257 1.247 1.00 0.00 H new ATOM 0 HA ASP A 323 -5.547 -8.697 2.774 1.00 0.00 H new ATOM 0 HB2 ASP A 323 -2.763 -9.920 2.964 1.00 0.00 H new ATOM 0 HB3 ASP A 323 -4.128 -10.411 3.948 1.00 0.00 H new ATOM 1469 N ALA A 324 -4.977 -6.853 4.378 1.00 0.00 N ATOM 1470 CA ALA A 324 -4.906 -6.057 5.615 1.00 0.00 C ATOM 1471 C ALA A 324 -3.891 -4.925 5.559 1.00 0.00 C ATOM 1472 O ALA A 324 -2.793 -5.074 5.023 1.00 0.00 O ATOM 1473 CB ALA A 324 -4.600 -6.938 6.821 1.00 0.00 C ATOM 0 H ALA A 324 -5.788 -6.631 3.801 1.00 0.00 H new ATOM 0 HA ALA A 324 -5.893 -5.606 5.718 1.00 0.00 H new ATOM 0 HB1 ALA A 324 -4.554 -6.322 7.719 1.00 0.00 H new ATOM 0 HB2 ALA A 324 -5.385 -7.686 6.934 1.00 0.00 H new ATOM 0 HB3 ALA A 324 -3.642 -7.437 6.674 1.00 0.00 H new ATOM 1479 N LYS A 325 -4.193 -3.878 6.319 1.00 0.00 N ATOM 1480 CA LYS A 325 -3.235 -2.818 6.583 1.00 0.00 C ATOM 1481 C LYS A 325 -2.588 -3.050 7.953 1.00 0.00 C ATOM 1482 O LYS A 325 -3.256 -2.980 8.988 1.00 0.00 O ATOM 1483 CB LYS A 325 -3.926 -1.446 6.513 1.00 0.00 C ATOM 1484 CG LYS A 325 -5.163 -1.324 7.394 1.00 0.00 C ATOM 1485 CD LYS A 325 -5.848 0.022 7.223 1.00 0.00 C ATOM 1486 CE LYS A 325 -7.097 0.124 8.087 1.00 0.00 C ATOM 1487 NZ LYS A 325 -7.810 1.415 7.897 1.00 0.00 N1+ ATOM 0 H LYS A 325 -5.101 -3.743 6.764 1.00 0.00 H new ATOM 0 HA LYS A 325 -2.453 -2.831 5.824 1.00 0.00 H new ATOM 0 HB2 LYS A 325 -3.210 -0.676 6.802 1.00 0.00 H new ATOM 0 HB3 LYS A 325 -4.209 -1.246 5.479 1.00 0.00 H new ATOM 0 HG2 LYS A 325 -5.864 -2.122 7.149 1.00 0.00 H new ATOM 0 HG3 LYS A 325 -4.880 -1.458 8.438 1.00 0.00 H new ATOM 0 HD2 LYS A 325 -5.155 0.821 7.487 1.00 0.00 H new ATOM 0 HD3 LYS A 325 -6.115 0.165 6.176 1.00 0.00 H new ATOM 0 HE2 LYS A 325 -7.770 -0.699 7.847 1.00 0.00 H new ATOM 0 HE3 LYS A 325 -6.821 0.015 9.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 325 -8.653 1.439 8.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 325 -7.178 2.201 8.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 325 -8.098 1.509 6.902 1.00 0.00 H new ATOM 1501 N PRO A 326 -1.323 -3.495 7.957 1.00 0.00 N ATOM 1502 CA PRO A 326 -0.623 -3.929 9.168 1.00 0.00 C ATOM 1503 C PRO A 326 0.042 -2.783 9.920 1.00 0.00 C ATOM 1504 O PRO A 326 0.168 -1.670 9.399 1.00 0.00 O ATOM 1505 CB PRO A 326 0.446 -4.904 8.648 1.00 0.00 C ATOM 1506 CG PRO A 326 0.220 -5.017 7.174 1.00 0.00 C ATOM 1507 CD PRO A 326 -0.524 -3.781 6.766 1.00 0.00 C ATOM 0 HA PRO A 326 -1.318 -4.370 9.882 1.00 0.00 H new ATOM 0 HB2 PRO A 326 1.449 -4.534 8.862 1.00 0.00 H new ATOM 0 HB3 PRO A 326 0.356 -5.876 9.132 1.00 0.00 H new ATOM 0 HG2 PRO A 326 1.167 -5.095 6.640 1.00 0.00 H new ATOM 0 HG3 PRO A 326 -0.354 -5.913 6.936 1.00 0.00 H new ATOM 0 HD2 PRO A 326 0.151 -2.961 6.522 1.00 0.00 H new ATOM 0 HD3 PRO A 326 -1.148 -3.952 5.889 1.00 0.00 H new ATOM 1515 N ALA A 327 0.498 -3.086 11.136 1.00 0.00 N ATOM 1516 CA ALA A 327 1.204 -2.119 11.966 1.00 0.00 C ATOM 1517 C ALA A 327 2.461 -1.624 11.262 1.00 0.00 C ATOM 1518 O ALA A 327 3.250 -2.433 10.766 1.00 0.00 O ATOM 1519 CB ALA A 327 1.564 -2.737 13.310 1.00 0.00 C ATOM 0 H ALA A 327 0.388 -4.003 11.568 1.00 0.00 H new ATOM 0 HA ALA A 327 0.545 -1.268 12.136 1.00 0.00 H new ATOM 0 HB1 ALA A 327 2.091 -2.002 13.919 1.00 0.00 H new ATOM 0 HB2 ALA A 327 0.654 -3.048 13.823 1.00 0.00 H new ATOM 0 HB3 ALA A 327 2.205 -3.604 13.152 1.00 0.00 H new ATOM 1525 N GLU A 328 2.585 -0.294 11.172 1.00 0.00 N ATOM 1526 CA GLU A 328 3.684 0.383 10.464 1.00 0.00 C ATOM 1527 C GLU A 328 3.970 -0.256 9.103 1.00 0.00 C ATOM 1528 O GLU A 328 3.075 -0.826 8.476 1.00 0.00 O ATOM 1529 CB GLU A 328 4.958 0.467 11.328 1.00 0.00 C ATOM 1530 CG GLU A 328 5.543 -0.871 11.746 1.00 0.00 C ATOM 1531 CD GLU A 328 6.766 -0.719 12.613 1.00 0.00 C ATOM 1532 OE1 GLU A 328 7.328 -1.748 13.025 1.00 0.00 O ATOM 1533 OE2 GLU A 328 7.160 0.429 12.891 1.00 0.00 O1- ATOM 0 H GLU A 328 1.918 0.352 11.593 1.00 0.00 H new ATOM 0 HA GLU A 328 3.353 1.404 10.275 1.00 0.00 H new ATOM 0 HB2 GLU A 328 5.717 1.021 10.776 1.00 0.00 H new ATOM 0 HB3 GLU A 328 4.732 1.043 12.225 1.00 0.00 H new ATOM 0 HG2 GLU A 328 4.787 -1.442 12.286 1.00 0.00 H new ATOM 0 HG3 GLU A 328 5.801 -1.445 10.856 1.00 0.00 H new ATOM 1540 N SER A 329 5.170 -0.052 8.584 1.00 0.00 N ATOM 1541 CA SER A 329 5.480 -0.504 7.239 1.00 0.00 C ATOM 1542 C SER A 329 6.319 -1.778 7.238 1.00 0.00 C ATOM 1543 O SER A 329 6.176 -2.596 6.334 1.00 0.00 O ATOM 1544 CB SER A 329 6.184 0.598 6.461 1.00 0.00 C ATOM 1545 OG SER A 329 5.362 1.751 6.362 1.00 0.00 O ATOM 0 H SER A 329 5.936 0.418 9.067 1.00 0.00 H new ATOM 0 HA SER A 329 4.535 -0.741 6.750 1.00 0.00 H new ATOM 0 HB2 SER A 329 7.121 0.856 6.954 1.00 0.00 H new ATOM 0 HB3 SER A 329 6.437 0.240 5.463 1.00 0.00 H new ATOM 0 HG SER A 329 5.136 2.070 7.261 1.00 0.00 H new ATOM 1551 N ALA A 330 7.163 -1.954 8.261 1.00 0.00 N ATOM 1552 CA ALA A 330 7.998 -3.158 8.389 1.00 0.00 C ATOM 1553 C ALA A 330 9.123 -3.170 7.362 1.00 0.00 C ATOM 1554 O ALA A 330 9.606 -2.121 6.938 1.00 0.00 O ATOM 1555 CB ALA A 330 7.147 -4.422 8.267 1.00 0.00 C ATOM 0 H ALA A 330 7.287 -1.278 9.014 1.00 0.00 H new ATOM 0 HA ALA A 330 8.453 -3.139 9.380 1.00 0.00 H new ATOM 0 HB1 ALA A 330 7.785 -5.301 8.365 1.00 0.00 H new ATOM 0 HB2 ALA A 330 6.394 -4.431 9.055 1.00 0.00 H new ATOM 0 HB3 ALA A 330 6.655 -4.437 7.294 1.00 0.00 H new ATOM 1561 N ALA A 331 9.554 -4.366 6.996 1.00 0.00 N ATOM 1562 CA ALA A 331 10.642 -4.533 6.040 1.00 0.00 C ATOM 1563 C ALA A 331 10.129 -4.497 4.610 1.00 0.00 C ATOM 1564 O ALA A 331 9.403 -5.392 4.172 1.00 0.00 O ATOM 1565 CB ALA A 331 11.382 -5.836 6.289 1.00 0.00 C ATOM 0 H ALA A 331 9.166 -5.241 7.347 1.00 0.00 H new ATOM 0 HA ALA A 331 11.332 -3.701 6.180 1.00 0.00 H new ATOM 0 HB1 ALA A 331 12.190 -5.940 5.564 1.00 0.00 H new ATOM 0 HB2 ALA A 331 11.797 -5.832 7.297 1.00 0.00 H new ATOM 0 HB3 ALA A 331 10.691 -6.673 6.185 1.00 0.00 H new ATOM 1571 N ILE A 332 10.567 -3.498 3.867 1.00 0.00 N ATOM 1572 CA ILE A 332 10.223 -3.382 2.460 1.00 0.00 C ATOM 1573 C ILE A 332 11.400 -3.846 1.607 1.00 0.00 C ATOM 1574 O ILE A 332 12.558 -3.621 1.960 1.00 0.00 O ATOM 1575 CB ILE A 332 9.803 -1.932 2.082 1.00 0.00 C ATOM 1576 CG1 ILE A 332 8.423 -1.570 2.652 1.00 0.00 C ATOM 1577 CG2 ILE A 332 9.774 -1.747 0.580 1.00 0.00 C ATOM 1578 CD1 ILE A 332 8.318 -1.586 4.156 1.00 0.00 C ATOM 0 H ILE A 332 11.166 -2.750 4.216 1.00 0.00 H new ATOM 0 HA ILE A 332 9.362 -4.021 2.266 1.00 0.00 H new ATOM 0 HB ILE A 332 10.550 -1.270 2.519 1.00 0.00 H new ATOM 0 HG12 ILE A 332 8.152 -0.576 2.297 1.00 0.00 H new ATOM 0 HG13 ILE A 332 7.688 -2.265 2.246 1.00 0.00 H new ATOM 0 HG21 ILE A 332 9.477 -0.725 0.345 1.00 0.00 H new ATOM 0 HG22 ILE A 332 10.765 -1.940 0.170 1.00 0.00 H new ATOM 0 HG23 ILE A 332 9.058 -2.442 0.142 1.00 0.00 H new ATOM 0 HD11 ILE A 332 7.304 -1.316 4.453 1.00 0.00 H new ATOM 0 HD12 ILE A 332 8.551 -2.584 4.526 1.00 0.00 H new ATOM 0 HD13 ILE A 332 9.022 -0.869 4.578 1.00 0.00 H new ATOM 1590 N THR A 333 11.105 -4.548 0.521 1.00 0.00 N ATOM 1591 CA THR A 333 12.150 -5.107 -0.332 1.00 0.00 C ATOM 1592 C THR A 333 12.190 -4.372 -1.665 1.00 0.00 C ATOM 1593 O THR A 333 11.293 -4.526 -2.488 1.00 0.00 O ATOM 1594 CB THR A 333 11.908 -6.603 -0.552 1.00 0.00 C ATOM 1595 OG1 THR A 333 11.844 -7.286 0.690 1.00 0.00 O ATOM 1596 CG2 THR A 333 12.986 -7.272 -1.377 1.00 0.00 C ATOM 0 H THR A 333 10.154 -4.745 0.209 1.00 0.00 H new ATOM 0 HA THR A 333 13.113 -4.980 0.162 1.00 0.00 H new ATOM 0 HB THR A 333 10.964 -6.664 -1.094 1.00 0.00 H new ATOM 0 HG1 THR A 333 11.687 -8.240 0.531 1.00 0.00 H new ATOM 0 HG21 THR A 333 12.751 -8.330 -1.493 1.00 0.00 H new ATOM 0 HG22 THR A 333 13.037 -6.801 -2.359 1.00 0.00 H new ATOM 0 HG23 THR A 333 13.947 -7.167 -0.874 1.00 0.00 H new ATOM 1604 N ILE A 334 13.174 -3.496 -1.820 1.00 0.00 N ATOM 1605 CA ILE A 334 13.260 -2.633 -2.993 1.00 0.00 C ATOM 1606 C ILE A 334 13.974 -3.303 -4.162 1.00 0.00 C ATOM 1607 O ILE A 334 15.155 -3.642 -4.072 1.00 0.00 O ATOM 1608 CB ILE A 334 13.984 -1.315 -2.648 1.00 0.00 C ATOM 1609 CG1 ILE A 334 13.188 -0.543 -1.603 1.00 0.00 C ATOM 1610 CG2 ILE A 334 14.178 -0.458 -3.894 1.00 0.00 C ATOM 1611 CD1 ILE A 334 11.862 -0.042 -2.123 1.00 0.00 C ATOM 0 H ILE A 334 13.927 -3.363 -1.145 1.00 0.00 H new ATOM 0 HA ILE A 334 12.234 -2.427 -3.298 1.00 0.00 H new ATOM 0 HB ILE A 334 14.967 -1.559 -2.244 1.00 0.00 H new ATOM 0 HG12 ILE A 334 13.014 -1.185 -0.739 1.00 0.00 H new ATOM 0 HG13 ILE A 334 13.780 0.304 -1.256 1.00 0.00 H new ATOM 0 HG21 ILE A 334 14.690 0.465 -3.624 1.00 0.00 H new ATOM 0 HG22 ILE A 334 14.776 -1.005 -4.623 1.00 0.00 H new ATOM 0 HG23 ILE A 334 13.206 -0.220 -4.327 1.00 0.00 H new ATOM 0 HD11 ILE A 334 11.342 0.500 -1.333 1.00 0.00 H new ATOM 0 HD12 ILE A 334 12.031 0.624 -2.969 1.00 0.00 H new ATOM 0 HD13 ILE A 334 11.254 -0.888 -2.444 1.00 0.00 H new ATOM 1623 N LEU A 335 13.299 -3.322 -5.302 1.00 0.00 N ATOM 1624 CA LEU A 335 13.910 -3.753 -6.548 1.00 0.00 C ATOM 1625 C LEU A 335 13.456 -2.846 -7.687 1.00 0.00 C ATOM 1626 O LEU A 335 12.565 -2.015 -7.513 1.00 0.00 O ATOM 1627 CB LEU A 335 13.634 -5.252 -6.860 1.00 0.00 C ATOM 1628 CG LEU A 335 12.167 -5.757 -6.914 1.00 0.00 C ATOM 1629 CD1 LEU A 335 11.461 -5.613 -5.576 1.00 0.00 C ATOM 1630 CD2 LEU A 335 11.366 -5.071 -8.009 1.00 0.00 C ATOM 0 H LEU A 335 12.322 -3.042 -5.388 1.00 0.00 H new ATOM 0 HA LEU A 335 14.991 -3.666 -6.439 1.00 0.00 H new ATOM 0 HB2 LEU A 335 14.094 -5.477 -7.822 1.00 0.00 H new ATOM 0 HB3 LEU A 335 14.158 -5.845 -6.110 1.00 0.00 H new ATOM 0 HG LEU A 335 12.224 -6.819 -7.152 1.00 0.00 H new ATOM 0 HD11 LEU A 335 10.438 -5.979 -5.663 1.00 0.00 H new ATOM 0 HD12 LEU A 335 11.991 -6.193 -4.821 1.00 0.00 H new ATOM 0 HD13 LEU A 335 11.447 -4.563 -5.283 1.00 0.00 H new ATOM 0 HD21 LEU A 335 10.346 -5.456 -8.009 1.00 0.00 H new ATOM 0 HD22 LEU A 335 11.348 -3.996 -7.828 1.00 0.00 H new ATOM 0 HD23 LEU A 335 11.828 -5.268 -8.976 1.00 0.00 H new ATOM 1642 N ASN A 336 14.048 -3.018 -8.855 1.00 0.00 N ATOM 1643 CA ASN A 336 13.672 -2.230 -10.018 1.00 0.00 C ATOM 1644 C ASN A 336 13.586 -3.136 -11.236 1.00 0.00 C ATOM 1645 O ASN A 336 14.336 -2.984 -12.198 1.00 0.00 O ATOM 1646 CB ASN A 336 14.677 -1.096 -10.251 1.00 0.00 C ATOM 1647 CG ASN A 336 14.292 -0.202 -11.414 1.00 0.00 C ATOM 1648 OD1 ASN A 336 13.213 0.392 -11.426 1.00 0.00 O ATOM 1649 ND2 ASN A 336 15.175 -0.099 -12.397 1.00 0.00 N ATOM 0 H ASN A 336 14.791 -3.696 -9.025 1.00 0.00 H new ATOM 0 HA ASN A 336 12.696 -1.777 -9.843 1.00 0.00 H new ATOM 0 HB2 ASN A 336 14.755 -0.494 -9.346 1.00 0.00 H new ATOM 0 HB3 ASN A 336 15.663 -1.522 -10.437 1.00 0.00 H new ATOM 0 HD21 ASN A 336 14.973 0.490 -13.205 1.00 0.00 H new ATOM 0 HD22 ASN A 336 16.057 -0.609 -12.346 1.00 0.00 H new ATOM 1656 N LYS A 337 12.721 -4.136 -11.152 1.00 0.00 N ATOM 1657 CA LYS A 337 12.602 -5.124 -12.214 1.00 0.00 C ATOM 1658 C LYS A 337 11.142 -5.309 -12.608 1.00 0.00 C ATOM 1659 O LYS A 337 10.274 -5.166 -11.729 1.00 0.00 O ATOM 1660 CB LYS A 337 13.208 -6.459 -11.767 1.00 0.00 C ATOM 1661 CG LYS A 337 13.235 -7.520 -12.856 1.00 0.00 C ATOM 1662 CD LYS A 337 13.879 -8.809 -12.367 1.00 0.00 C ATOM 1663 CE LYS A 337 13.961 -9.844 -13.479 1.00 0.00 C ATOM 1664 NZ LYS A 337 14.736 -9.342 -14.646 1.00 0.00 N1+ ATOM 0 H LYS A 337 12.093 -4.285 -10.362 1.00 0.00 H new ATOM 0 HA LYS A 337 13.151 -4.766 -13.085 1.00 0.00 H new ATOM 0 HB2 LYS A 337 14.226 -6.286 -11.417 1.00 0.00 H new ATOM 0 HB3 LYS A 337 12.639 -6.838 -10.918 1.00 0.00 H new ATOM 0 HG2 LYS A 337 12.218 -7.725 -13.190 1.00 0.00 H new ATOM 0 HG3 LYS A 337 13.784 -7.143 -13.719 1.00 0.00 H new ATOM 0 HD2 LYS A 337 14.880 -8.598 -11.990 1.00 0.00 H new ATOM 0 HD3 LYS A 337 13.303 -9.212 -11.534 1.00 0.00 H new ATOM 0 HE2 LYS A 337 14.427 -10.752 -13.097 1.00 0.00 H new ATOM 0 HE3 LYS A 337 12.955 -10.113 -13.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 337 15.002 -10.141 -15.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 337 14.153 -8.672 -15.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 337 15.595 -8.861 -14.311 1.00 0.00 H new