USER MOD reduce.3.24.130724 H: found=0, std=0, add=347, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 276 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 265 ASN : amide:sc=-0.00146 X(o=-1.7,f=-2) USER MOD Set 1.2: A 269 ASN : amide:sc= -1.7! C(o=-1.7!,f=-0.26!) USER MOD Single : A 250 HIS : no HD1:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 251 LYS NZ :NH3+ -135:sc= 0.071 (180deg=0) USER MOD Single : A 252 GLN : amide:sc= -0.0937 X(o=-0.094,f=0) USER MOD Single : A 253 LYS NZ :NH3+ -155:sc= -0.578 (180deg=-1.23) USER MOD Single : A 255 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.279) USER MOD Single : A 256 SER OG : rot 180:sc= -0.293 USER MOD Single : A 259 GLN : amide:sc= -1.27 X(o=-1.3,f=-0.83) USER MOD Single : A 270 HIS : no HD1:sc= -11.4! C(o=-11!,f=-7.3!) USER MOD Single : A 271 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 272 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.0963) USER MOD Single : A 275 THR OG1 : rot 180:sc= 0 USER MOD Single : A 276 GLN : amide:sc= -0.345 X(o=-0.34,f=-0.0068) USER MOD Single : A 279 SER OG : rot 40:sc= 0.62 USER MOD Single : A 280 TYR OH : rot 180:sc= 0 USER MOD Single : A 281 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 282 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 285 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 286 TYR OH : rot 149:sc= -3.16! USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 248 -14.686 -13.044 10.710 1.00 0.00 N ATOM 2 CA GLY A 248 -15.220 -12.334 9.512 1.00 0.00 C ATOM 3 C GLY A 248 -14.138 -11.430 8.932 1.00 0.00 C ATOM 4 O GLY A 248 -13.457 -11.797 7.974 1.00 0.00 O ATOM 0 HA2 GLY A 248 -15.545 -13.056 8.763 1.00 0.00 H new ATOM 0 HA3 GLY A 248 -16.094 -11.743 9.786 1.00 0.00 H new ATOM 10 N ILE A 249 -13.983 -10.250 9.520 1.00 0.00 N ATOM 11 CA ILE A 249 -12.977 -9.300 9.057 1.00 0.00 C ATOM 12 C ILE A 249 -11.581 -9.903 9.171 1.00 0.00 C ATOM 13 O ILE A 249 -10.699 -9.610 8.366 1.00 0.00 O ATOM 14 CB ILE A 249 -13.051 -8.019 9.889 1.00 0.00 C ATOM 15 CG1 ILE A 249 -11.958 -7.049 9.431 1.00 0.00 C ATOM 16 CG2 ILE A 249 -12.841 -8.357 11.365 1.00 0.00 C ATOM 17 CD1 ILE A 249 -12.236 -5.658 10.007 1.00 0.00 C ATOM 0 H ILE A 249 -14.537 -9.929 10.314 1.00 0.00 H new ATOM 0 HA ILE A 249 -13.175 -9.067 8.011 1.00 0.00 H new ATOM 0 HB ILE A 249 -14.029 -7.556 9.756 1.00 0.00 H new ATOM 0 HG12 ILE A 249 -10.981 -7.403 9.761 1.00 0.00 H new ATOM 0 HG13 ILE A 249 -11.929 -7.004 8.342 1.00 0.00 H new ATOM 0 HG21 ILE A 249 -12.894 -7.444 11.958 1.00 0.00 H new ATOM 0 HG22 ILE A 249 -13.617 -9.049 11.694 1.00 0.00 H new ATOM 0 HG23 ILE A 249 -11.863 -8.819 11.497 1.00 0.00 H new ATOM 0 HD11 ILE A 249 -11.458 -4.967 9.681 1.00 0.00 H new ATOM 0 HD12 ILE A 249 -13.205 -5.305 9.655 1.00 0.00 H new ATOM 0 HD13 ILE A 249 -12.243 -5.710 11.096 1.00 0.00 H new ATOM 23 N HIS A 250 -11.391 -10.747 10.180 1.00 0.00 N ATOM 24 CA HIS A 250 -10.099 -11.389 10.397 1.00 0.00 C ATOM 25 C HIS A 250 -9.580 -12.009 9.103 1.00 0.00 C ATOM 26 O HIS A 250 -8.382 -11.970 8.823 1.00 0.00 O ATOM 27 CB HIS A 250 -10.233 -12.475 11.465 1.00 0.00 C ATOM 28 CG HIS A 250 -9.900 -11.895 12.812 1.00 0.00 C ATOM 29 ND1 HIS A 250 -10.413 -10.681 13.238 1.00 0.00 N ATOM 30 CD2 HIS A 250 -9.109 -12.350 13.837 1.00 0.00 C ATOM 31 CE1 HIS A 250 -9.928 -10.447 14.471 1.00 0.00 C ATOM 32 NE2 HIS A 250 -9.128 -11.433 14.883 1.00 0.00 N ATOM 0 H HIS A 250 -12.110 -11.001 10.857 1.00 0.00 H new ATOM 0 HA HIS A 250 -9.390 -10.631 10.731 1.00 0.00 H new ATOM 0 HB2 HIS A 250 -11.248 -12.873 11.469 1.00 0.00 H new ATOM 0 HB3 HIS A 250 -9.565 -13.306 11.240 1.00 0.00 H new ATOM 0 HD2 HIS A 250 -8.556 -13.278 13.832 1.00 0.00 H new ATOM 0 HE1 HIS A 250 -10.158 -9.569 15.056 1.00 0.00 H new ATOM 0 HE2 HIS A 250 -8.636 -11.500 15.774 1.00 0.00 H new ATOM 40 N LYS A 251 -10.488 -12.586 8.323 1.00 0.00 N ATOM 41 CA LYS A 251 -10.108 -13.218 7.064 1.00 0.00 C ATOM 42 C LYS A 251 -9.717 -12.171 6.027 1.00 0.00 C ATOM 43 O LYS A 251 -8.538 -11.998 5.721 1.00 0.00 O ATOM 44 CB LYS A 251 -11.271 -14.058 6.528 1.00 0.00 C ATOM 45 CG LYS A 251 -11.408 -15.342 7.352 1.00 0.00 C ATOM 46 CD LYS A 251 -12.495 -15.153 8.414 1.00 0.00 C ATOM 47 CE LYS A 251 -12.725 -16.477 9.144 1.00 0.00 C ATOM 48 NZ LYS A 251 -13.874 -16.334 10.082 1.00 0.00 N ATOM 0 H LYS A 251 -11.484 -12.629 8.537 1.00 0.00 H new ATOM 0 HA LYS A 251 -9.249 -13.861 7.252 1.00 0.00 H new ATOM 0 HB2 LYS A 251 -12.197 -13.485 6.574 1.00 0.00 H new ATOM 0 HB3 LYS A 251 -11.101 -14.304 5.480 1.00 0.00 H new ATOM 0 HG2 LYS A 251 -11.662 -16.179 6.701 1.00 0.00 H new ATOM 0 HG3 LYS A 251 -10.458 -15.585 7.828 1.00 0.00 H new ATOM 0 HD2 LYS A 251 -12.196 -14.381 9.123 1.00 0.00 H new ATOM 0 HD3 LYS A 251 -13.421 -14.816 7.947 1.00 0.00 H new ATOM 0 HE2 LYS A 251 -12.926 -17.271 8.425 1.00 0.00 H new ATOM 0 HE3 LYS A 251 -11.827 -16.763 9.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 251 -13.629 -16.760 10.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 251 -14.090 -15.325 10.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 251 -14.706 -16.817 9.688 1.00 0.00 H new ATOM 62 N GLN A 252 -10.713 -11.479 5.483 1.00 0.00 N ATOM 63 CA GLN A 252 -10.459 -10.456 4.474 1.00 0.00 C ATOM 64 C GLN A 252 -10.051 -9.138 5.124 1.00 0.00 C ATOM 65 O GLN A 252 -10.539 -8.786 6.199 1.00 0.00 O ATOM 66 CB GLN A 252 -11.712 -10.244 3.622 1.00 0.00 C ATOM 67 CG GLN A 252 -11.570 -8.953 2.813 1.00 0.00 C ATOM 68 CD GLN A 252 -12.579 -8.943 1.669 1.00 0.00 C ATOM 69 OE1 GLN A 252 -13.419 -8.047 1.588 1.00 0.00 O ATOM 70 NE2 GLN A 252 -12.546 -9.893 0.774 1.00 0.00 N ATOM 0 H GLN A 252 -11.697 -11.606 5.721 1.00 0.00 H new ATOM 0 HA GLN A 252 -9.640 -10.797 3.841 1.00 0.00 H new ATOM 0 HB2 GLN A 252 -11.856 -11.091 2.952 1.00 0.00 H new ATOM 0 HB3 GLN A 252 -12.594 -10.190 4.261 1.00 0.00 H new ATOM 0 HG2 GLN A 252 -11.731 -8.090 3.459 1.00 0.00 H new ATOM 0 HG3 GLN A 252 -10.558 -8.871 2.417 1.00 0.00 H new ATOM 0 HE21 GLN A 252 -11.849 -10.635 0.843 1.00 0.00 H new ATOM 0 HE22 GLN A 252 -13.217 -9.894 0.006 1.00 0.00 H new ATOM 79 N LYS A 253 -9.155 -8.414 4.461 1.00 0.00 N ATOM 80 CA LYS A 253 -8.685 -7.133 4.975 1.00 0.00 C ATOM 81 C LYS A 253 -8.463 -6.151 3.829 1.00 0.00 C ATOM 82 O LYS A 253 -8.194 -6.554 2.697 1.00 0.00 O ATOM 83 CB LYS A 253 -7.376 -7.330 5.745 1.00 0.00 C ATOM 84 CG LYS A 253 -7.541 -6.823 7.181 1.00 0.00 C ATOM 85 CD LYS A 253 -6.166 -6.710 7.843 1.00 0.00 C ATOM 86 CE LYS A 253 -5.469 -8.072 7.816 1.00 0.00 C ATOM 87 NZ LYS A 253 -6.434 -9.134 8.217 1.00 0.00 N ATOM 0 H LYS A 253 -8.742 -8.691 3.571 1.00 0.00 H new ATOM 0 HA LYS A 253 -9.442 -6.727 5.646 1.00 0.00 H new ATOM 0 HB2 LYS A 253 -7.101 -8.385 5.751 1.00 0.00 H new ATOM 0 HB3 LYS A 253 -6.567 -6.793 5.250 1.00 0.00 H new ATOM 0 HG2 LYS A 253 -8.037 -5.852 7.181 1.00 0.00 H new ATOM 0 HG3 LYS A 253 -8.175 -7.505 7.748 1.00 0.00 H new ATOM 0 HD2 LYS A 253 -5.560 -5.970 7.321 1.00 0.00 H new ATOM 0 HD3 LYS A 253 -6.274 -6.366 8.872 1.00 0.00 H new ATOM 0 HE2 LYS A 253 -5.083 -8.275 6.817 1.00 0.00 H new ATOM 0 HE3 LYS A 253 -4.615 -8.068 8.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 253 -5.914 -9.947 8.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 253 -7.081 -8.760 8.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 253 -6.981 -9.438 7.386 1.00 0.00 H new ATOM 101 N GLU A 254 -8.577 -4.860 4.127 1.00 0.00 N ATOM 102 CA GLU A 254 -8.387 -3.832 3.111 1.00 0.00 C ATOM 103 C GLU A 254 -7.983 -2.507 3.752 1.00 0.00 C ATOM 104 O GLU A 254 -8.744 -1.921 4.523 1.00 0.00 O ATOM 105 CB GLU A 254 -9.682 -3.647 2.316 1.00 0.00 C ATOM 106 CG GLU A 254 -9.481 -2.565 1.255 1.00 0.00 C ATOM 107 CD GLU A 254 -10.278 -2.912 0.002 1.00 0.00 C ATOM 108 OE1 GLU A 254 -9.870 -3.818 -0.704 1.00 0.00 O ATOM 109 OE2 GLU A 254 -11.286 -2.265 -0.232 1.00 0.00 O ATOM 0 H GLU A 254 -8.798 -4.503 5.057 1.00 0.00 H new ATOM 0 HA GLU A 254 -7.589 -4.150 2.441 1.00 0.00 H new ATOM 0 HB2 GLU A 254 -9.968 -4.586 1.843 1.00 0.00 H new ATOM 0 HB3 GLU A 254 -10.495 -3.367 2.986 1.00 0.00 H new ATOM 0 HG2 GLU A 254 -9.801 -1.598 1.644 1.00 0.00 H new ATOM 0 HG3 GLU A 254 -8.423 -2.476 1.010 1.00 0.00 H new ATOM 116 N LYS A 255 -6.780 -2.040 3.426 1.00 0.00 N ATOM 117 CA LYS A 255 -6.281 -0.783 3.973 1.00 0.00 C ATOM 118 C LYS A 255 -6.241 -0.833 5.497 1.00 0.00 C ATOM 119 O LYS A 255 -5.649 -1.737 6.086 1.00 0.00 O ATOM 120 CB LYS A 255 -7.177 0.375 3.529 1.00 0.00 C ATOM 121 CG LYS A 255 -7.077 0.549 2.013 1.00 0.00 C ATOM 122 CD LYS A 255 -7.472 1.979 1.638 1.00 0.00 C ATOM 123 CE LYS A 255 -7.913 2.021 0.174 1.00 0.00 C ATOM 124 NZ LYS A 255 -6.816 1.503 -0.691 1.00 0.00 N ATOM 0 H LYS A 255 -6.137 -2.511 2.790 1.00 0.00 H new ATOM 0 HA LYS A 255 -5.269 -0.629 3.598 1.00 0.00 H new ATOM 0 HB2 LYS A 255 -8.210 0.179 3.815 1.00 0.00 H new ATOM 0 HB3 LYS A 255 -6.876 1.294 4.031 1.00 0.00 H new ATOM 0 HG2 LYS A 255 -6.061 0.341 1.678 1.00 0.00 H new ATOM 0 HG3 LYS A 255 -7.730 -0.164 1.510 1.00 0.00 H new ATOM 0 HD2 LYS A 255 -8.280 2.325 2.282 1.00 0.00 H new ATOM 0 HD3 LYS A 255 -6.630 2.653 1.794 1.00 0.00 H new ATOM 0 HE2 LYS A 255 -8.813 1.421 0.037 1.00 0.00 H new ATOM 0 HE3 LYS A 255 -8.164 3.042 -0.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 255 -7.003 1.761 -1.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 255 -5.911 1.918 -0.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 255 -6.767 0.468 -0.607 1.00 0.00 H new ATOM 138 N SER A 256 -6.878 0.149 6.126 1.00 0.00 N ATOM 139 CA SER A 256 -6.917 0.221 7.581 1.00 0.00 C ATOM 140 C SER A 256 -7.834 1.353 8.029 1.00 0.00 C ATOM 141 O SER A 256 -7.727 2.480 7.542 1.00 0.00 O ATOM 142 CB SER A 256 -5.510 0.451 8.132 1.00 0.00 C ATOM 143 OG SER A 256 -4.651 0.859 7.074 1.00 0.00 O ATOM 0 H SER A 256 -7.373 0.904 5.652 1.00 0.00 H new ATOM 0 HA SER A 256 -7.304 -0.723 7.966 1.00 0.00 H new ATOM 0 HB2 SER A 256 -5.532 1.212 8.912 1.00 0.00 H new ATOM 0 HB3 SER A 256 -5.133 -0.463 8.590 1.00 0.00 H new ATOM 0 HG SER A 256 -3.748 1.009 7.425 1.00 0.00 H new ATOM 149 N ARG A 257 -8.740 1.050 8.952 1.00 0.00 N ATOM 150 CA ARG A 257 -9.674 2.054 9.448 1.00 0.00 C ATOM 151 C ARG A 257 -9.008 2.954 10.482 1.00 0.00 C ATOM 152 O ARG A 257 -8.316 2.478 11.383 1.00 0.00 O ATOM 153 CB ARG A 257 -10.896 1.374 10.071 1.00 0.00 C ATOM 154 CG ARG A 257 -10.483 0.643 11.351 1.00 0.00 C ATOM 155 CD ARG A 257 -11.480 -0.481 11.639 1.00 0.00 C ATOM 156 NE ARG A 257 -11.025 -1.283 12.770 1.00 0.00 N ATOM 157 CZ ARG A 257 -11.650 -2.403 13.113 1.00 0.00 C ATOM 158 NH1 ARG A 257 -12.692 -2.802 12.435 1.00 0.00 N ATOM 159 NH2 ARG A 257 -11.224 -3.105 14.127 1.00 0.00 N ATOM 0 H ARG A 257 -8.847 0.125 9.369 1.00 0.00 H new ATOM 0 HA ARG A 257 -9.990 2.668 8.604 1.00 0.00 H new ATOM 0 HB2 ARG A 257 -11.662 2.116 10.296 1.00 0.00 H new ATOM 0 HB3 ARG A 257 -11.333 0.669 9.363 1.00 0.00 H new ATOM 0 HG2 ARG A 257 -9.479 0.234 11.241 1.00 0.00 H new ATOM 0 HG3 ARG A 257 -10.453 1.341 12.188 1.00 0.00 H new ATOM 0 HD2 ARG A 257 -12.462 -0.059 11.855 1.00 0.00 H new ATOM 0 HD3 ARG A 257 -11.591 -1.113 10.758 1.00 0.00 H new ATOM 0 HE ARG A 257 -10.213 -0.978 13.306 1.00 0.00 H new ATOM 0 HH11 ARG A 257 -13.025 -2.253 11.642 1.00 0.00 H new ATOM 0 HH12 ARG A 257 -13.173 -3.662 12.698 1.00 0.00 H new ATOM 0 HH21 ARG A 257 -10.410 -2.793 14.657 1.00 0.00 H new ATOM 0 HH22 ARG A 257 -11.705 -3.965 14.390 1.00 0.00 H new ATOM 173 N LEU A 258 -9.227 4.257 10.345 1.00 0.00 N ATOM 174 CA LEU A 258 -8.650 5.225 11.268 1.00 0.00 C ATOM 175 C LEU A 258 -9.172 6.624 10.960 1.00 0.00 C ATOM 176 O LEU A 258 -9.510 6.932 9.817 1.00 0.00 O ATOM 177 CB LEU A 258 -7.126 5.212 11.161 1.00 0.00 C ATOM 178 CG LEU A 258 -6.544 6.220 12.151 1.00 0.00 C ATOM 179 CD1 LEU A 258 -5.282 5.638 12.792 1.00 0.00 C ATOM 180 CD2 LEU A 258 -6.192 7.515 11.415 1.00 0.00 C ATOM 0 H LEU A 258 -9.798 4.666 9.606 1.00 0.00 H new ATOM 0 HA LEU A 258 -8.940 4.951 12.282 1.00 0.00 H new ATOM 0 HB2 LEU A 258 -6.743 4.214 11.373 1.00 0.00 H new ATOM 0 HB3 LEU A 258 -6.819 5.462 10.146 1.00 0.00 H new ATOM 0 HG LEU A 258 -7.280 6.432 12.927 1.00 0.00 H new ATOM 0 HD11 LEU A 258 -4.867 6.358 13.498 1.00 0.00 H new ATOM 0 HD12 LEU A 258 -5.533 4.717 13.318 1.00 0.00 H new ATOM 0 HD13 LEU A 258 -4.546 5.424 12.017 1.00 0.00 H new ATOM 0 HD21 LEU A 258 -5.777 8.234 12.122 1.00 0.00 H new ATOM 0 HD22 LEU A 258 -5.457 7.304 10.638 1.00 0.00 H new ATOM 0 HD23 LEU A 258 -7.091 7.931 10.960 1.00 0.00 H new ATOM 186 N GLN A 259 -9.238 7.469 11.983 1.00 0.00 N ATOM 187 CA GLN A 259 -9.724 8.831 11.801 1.00 0.00 C ATOM 188 C GLN A 259 -8.826 9.827 12.526 1.00 0.00 C ATOM 189 O GLN A 259 -8.644 9.746 13.740 1.00 0.00 O ATOM 190 CB GLN A 259 -11.154 8.952 12.328 1.00 0.00 C ATOM 191 CG GLN A 259 -11.329 8.047 13.548 1.00 0.00 C ATOM 192 CD GLN A 259 -11.814 6.670 13.110 1.00 0.00 C ATOM 193 OE1 GLN A 259 -11.276 5.652 13.547 1.00 0.00 O ATOM 194 NE2 GLN A 259 -12.804 6.578 12.266 1.00 0.00 N ATOM 0 H GLN A 259 -8.964 7.238 12.938 1.00 0.00 H new ATOM 0 HA GLN A 259 -9.709 9.059 10.735 1.00 0.00 H new ATOM 0 HB2 GLN A 259 -11.367 9.987 12.597 1.00 0.00 H new ATOM 0 HB3 GLN A 259 -11.864 8.672 11.550 1.00 0.00 H new ATOM 0 HG2 GLN A 259 -10.383 7.956 14.082 1.00 0.00 H new ATOM 0 HG3 GLN A 259 -12.045 8.490 14.240 1.00 0.00 H new ATOM 0 HE21 GLN A 259 -13.247 7.423 11.906 1.00 0.00 H new ATOM 0 HE22 GLN A 259 -13.135 5.661 11.966 1.00 0.00 H new ATOM 203 N GLY A 260 -8.271 10.768 11.770 1.00 0.00 N ATOM 204 CA GLY A 260 -7.395 11.781 12.344 1.00 0.00 C ATOM 205 C GLY A 260 -7.238 12.956 11.386 1.00 0.00 C ATOM 206 O GLY A 260 -7.211 12.775 10.169 1.00 0.00 O ATOM 0 H GLY A 260 -8.412 10.850 10.763 1.00 0.00 H new ATOM 0 HA2 GLY A 260 -7.805 12.129 13.292 1.00 0.00 H new ATOM 0 HA3 GLY A 260 -6.419 11.346 12.559 1.00 0.00 H new ATOM 210 N GLY A 261 -7.134 14.158 11.940 1.00 0.00 N ATOM 211 CA GLY A 261 -6.979 15.350 11.120 1.00 0.00 C ATOM 212 C GLY A 261 -5.572 15.427 10.546 1.00 0.00 C ATOM 213 O GLY A 261 -4.592 15.136 11.231 1.00 0.00 O ATOM 0 H GLY A 261 -7.154 14.331 12.945 1.00 0.00 H new ATOM 0 HA2 GLY A 261 -7.708 15.338 10.310 1.00 0.00 H new ATOM 0 HA3 GLY A 261 -7.183 16.238 11.718 1.00 0.00 H new ATOM 217 N VAL A 262 -5.482 15.820 9.283 1.00 0.00 N ATOM 218 CA VAL A 262 -4.189 15.931 8.618 1.00 0.00 C ATOM 219 C VAL A 262 -3.225 16.772 9.450 1.00 0.00 C ATOM 220 O VAL A 262 -2.011 16.577 9.393 1.00 0.00 O ATOM 221 CB VAL A 262 -4.360 16.562 7.235 1.00 0.00 C ATOM 222 CG1 VAL A 262 -4.992 15.542 6.284 1.00 0.00 C ATOM 223 CG2 VAL A 262 -5.269 17.788 7.345 1.00 0.00 C ATOM 0 H VAL A 262 -6.282 16.066 8.701 1.00 0.00 H new ATOM 0 HA VAL A 262 -3.775 14.929 8.508 1.00 0.00 H new ATOM 0 HB VAL A 262 -3.386 16.864 6.849 1.00 0.00 H new ATOM 0 HG11 VAL A 262 -5.114 15.991 5.298 1.00 0.00 H new ATOM 0 HG12 VAL A 262 -4.346 14.667 6.207 1.00 0.00 H new ATOM 0 HG13 VAL A 262 -5.966 15.241 6.669 1.00 0.00 H new ATOM 0 HG21 VAL A 262 -5.392 18.239 6.360 1.00 0.00 H new ATOM 0 HG22 VAL A 262 -6.243 17.486 7.730 1.00 0.00 H new ATOM 0 HG23 VAL A 262 -4.820 18.514 8.023 1.00 0.00 H new ATOM 227 N LEU A 263 -3.769 17.705 10.225 1.00 0.00 N ATOM 228 CA LEU A 263 -2.934 18.558 11.062 1.00 0.00 C ATOM 229 C LEU A 263 -1.987 17.703 11.895 1.00 0.00 C ATOM 230 O LEU A 263 -0.767 17.850 11.812 1.00 0.00 O ATOM 231 CB LEU A 263 -3.805 19.412 11.985 1.00 0.00 C ATOM 232 CG LEU A 263 -3.245 20.835 12.038 1.00 0.00 C ATOM 233 CD1 LEU A 263 -3.957 21.623 13.140 1.00 0.00 C ATOM 234 CD2 LEU A 263 -1.743 20.782 12.338 1.00 0.00 C ATOM 0 H LEU A 263 -4.770 17.888 10.291 1.00 0.00 H new ATOM 0 HA LEU A 263 -2.351 19.216 10.417 1.00 0.00 H new ATOM 0 HB2 LEU A 263 -4.833 19.427 11.622 1.00 0.00 H new ATOM 0 HB3 LEU A 263 -3.826 18.980 12.986 1.00 0.00 H new ATOM 0 HG LEU A 263 -3.407 21.325 11.078 1.00 0.00 H new ATOM 0 HD11 LEU A 263 -3.558 22.637 13.178 1.00 0.00 H new ATOM 0 HD12 LEU A 263 -5.025 21.661 12.928 1.00 0.00 H new ATOM 0 HD13 LEU A 263 -3.795 21.133 14.100 1.00 0.00 H new ATOM 0 HD21 LEU A 263 -1.344 21.795 12.376 1.00 0.00 H new ATOM 0 HD22 LEU A 263 -1.581 20.292 13.298 1.00 0.00 H new ATOM 0 HD23 LEU A 263 -1.235 20.221 11.554 1.00 0.00 H new ATOM 240 N VAL A 264 -2.556 16.802 12.691 1.00 0.00 N ATOM 241 CA VAL A 264 -1.747 15.923 13.525 1.00 0.00 C ATOM 242 C VAL A 264 -0.642 15.292 12.689 1.00 0.00 C ATOM 243 O VAL A 264 0.510 15.217 13.116 1.00 0.00 O ATOM 244 CB VAL A 264 -2.624 14.831 14.141 1.00 0.00 C ATOM 245 CG1 VAL A 264 -2.681 13.623 13.203 1.00 0.00 C ATOM 246 CG2 VAL A 264 -2.034 14.406 15.487 1.00 0.00 C ATOM 0 H VAL A 264 -3.563 16.663 12.775 1.00 0.00 H new ATOM 0 HA VAL A 264 -1.298 16.509 14.327 1.00 0.00 H new ATOM 0 HB VAL A 264 -3.632 15.218 14.289 1.00 0.00 H new ATOM 0 HG11 VAL A 264 -3.307 12.848 13.646 1.00 0.00 H new ATOM 0 HG12 VAL A 264 -3.102 13.926 12.245 1.00 0.00 H new ATOM 0 HG13 VAL A 264 -1.675 13.233 13.050 1.00 0.00 H new ATOM 0 HG21 VAL A 264 -2.657 13.628 15.928 1.00 0.00 H new ATOM 0 HG22 VAL A 264 -1.025 14.021 15.337 1.00 0.00 H new ATOM 0 HG23 VAL A 264 -1.999 15.265 16.156 1.00 0.00 H new ATOM 250 N ASN A 265 -1.004 14.851 11.488 1.00 0.00 N ATOM 251 CA ASN A 265 -0.036 14.242 10.588 1.00 0.00 C ATOM 252 C ASN A 265 1.035 15.261 10.222 1.00 0.00 C ATOM 253 O ASN A 265 2.197 14.911 10.020 1.00 0.00 O ATOM 254 CB ASN A 265 -0.735 13.745 9.322 1.00 0.00 C ATOM 255 CG ASN A 265 0.298 13.293 8.295 1.00 0.00 C ATOM 256 OD1 ASN A 265 1.222 12.551 8.626 1.00 0.00 O ATOM 257 ND2 ASN A 265 0.194 13.698 7.058 1.00 0.00 N ATOM 0 H ASN A 265 -1.954 14.904 11.119 1.00 0.00 H new ATOM 0 HA ASN A 265 0.430 13.393 11.089 1.00 0.00 H new ATOM 0 HB2 ASN A 265 -1.402 12.918 9.566 1.00 0.00 H new ATOM 0 HB3 ASN A 265 -1.352 14.539 8.903 1.00 0.00 H new ATOM 0 HD21 ASN A 265 0.879 13.399 6.364 1.00 0.00 H new ATOM 0 HD22 ASN A 265 -0.573 14.313 6.785 1.00 0.00 H new ATOM 264 N GLU A 266 0.632 16.528 10.151 1.00 0.00 N ATOM 265 CA GLU A 266 1.565 17.598 9.822 1.00 0.00 C ATOM 266 C GLU A 266 2.414 17.950 11.038 1.00 0.00 C ATOM 267 O GLU A 266 3.631 18.111 10.936 1.00 0.00 O ATOM 268 CB GLU A 266 0.810 18.843 9.357 1.00 0.00 C ATOM 269 CG GLU A 266 1.784 20.020 9.274 1.00 0.00 C ATOM 270 CD GLU A 266 1.076 21.246 8.706 1.00 0.00 C ATOM 271 OE1 GLU A 266 0.346 21.090 7.742 1.00 0.00 O ATOM 272 OE2 GLU A 266 1.274 22.323 9.243 1.00 0.00 O ATOM 0 H GLU A 266 -0.327 16.835 10.316 1.00 0.00 H new ATOM 0 HA GLU A 266 2.211 17.249 9.016 1.00 0.00 H new ATOM 0 HB2 GLU A 266 0.354 18.664 8.384 1.00 0.00 H new ATOM 0 HB3 GLU A 266 0.001 19.073 10.051 1.00 0.00 H new ATOM 0 HG2 GLU A 266 2.180 20.245 10.264 1.00 0.00 H new ATOM 0 HG3 GLU A 266 2.633 19.756 8.644 1.00 0.00 H new ATOM 279 N ILE A 267 1.762 18.069 12.191 1.00 0.00 N ATOM 280 CA ILE A 267 2.461 18.399 13.418 1.00 0.00 C ATOM 281 C ILE A 267 3.287 17.209 13.885 1.00 0.00 C ATOM 282 O ILE A 267 4.444 17.356 14.236 1.00 0.00 O ATOM 283 CB ILE A 267 1.456 18.819 14.502 1.00 0.00 C ATOM 284 CG1 ILE A 267 2.031 20.001 15.288 1.00 0.00 C ATOM 285 CG2 ILE A 267 1.184 17.656 15.463 1.00 0.00 C ATOM 286 CD1 ILE A 267 1.078 20.372 16.425 1.00 0.00 C ATOM 0 H ILE A 267 0.755 17.942 12.296 1.00 0.00 H new ATOM 0 HA ILE A 267 3.135 19.235 13.229 1.00 0.00 H new ATOM 0 HB ILE A 267 0.519 19.105 14.024 1.00 0.00 H new ATOM 0 HG12 ILE A 267 3.010 19.741 15.691 1.00 0.00 H new ATOM 0 HG13 ILE A 267 2.175 20.855 14.627 1.00 0.00 H new ATOM 0 HG21 ILE A 267 0.470 17.972 16.224 1.00 0.00 H new ATOM 0 HG22 ILE A 267 0.773 16.813 14.907 1.00 0.00 H new ATOM 0 HG23 ILE A 267 2.115 17.355 15.942 1.00 0.00 H new ATOM 0 HD11 ILE A 267 1.488 21.213 16.984 1.00 0.00 H new ATOM 0 HD12 ILE A 267 0.108 20.649 16.011 1.00 0.00 H new ATOM 0 HD13 ILE A 267 0.957 19.518 17.092 1.00 0.00 H new ATOM 292 N LEU A 268 2.693 16.027 13.887 1.00 0.00 N ATOM 293 CA LEU A 268 3.422 14.843 14.312 1.00 0.00 C ATOM 294 C LEU A 268 4.332 14.333 13.198 1.00 0.00 C ATOM 295 O LEU A 268 5.341 13.681 13.457 1.00 0.00 O ATOM 296 CB LEU A 268 2.458 13.745 14.749 1.00 0.00 C ATOM 297 CG LEU A 268 3.059 13.018 15.949 1.00 0.00 C ATOM 298 CD1 LEU A 268 4.438 12.483 15.567 1.00 0.00 C ATOM 299 CD2 LEU A 268 3.200 14.001 17.117 1.00 0.00 C ATOM 0 H LEU A 268 1.727 15.862 13.605 1.00 0.00 H new ATOM 0 HA LEU A 268 4.044 15.120 15.163 1.00 0.00 H new ATOM 0 HB2 LEU A 268 1.491 14.173 15.012 1.00 0.00 H new ATOM 0 HB3 LEU A 268 2.285 13.046 13.931 1.00 0.00 H new ATOM 0 HG LEU A 268 2.412 12.192 16.244 1.00 0.00 H new ATOM 0 HD11 LEU A 268 4.875 11.962 16.419 1.00 0.00 H new ATOM 0 HD12 LEU A 268 4.341 11.792 14.730 1.00 0.00 H new ATOM 0 HD13 LEU A 268 5.083 13.313 15.279 1.00 0.00 H new ATOM 0 HD21 LEU A 268 3.629 13.486 17.976 1.00 0.00 H new ATOM 0 HD22 LEU A 268 3.853 14.823 16.824 1.00 0.00 H new ATOM 0 HD23 LEU A 268 2.219 14.394 17.382 1.00 0.00 H new ATOM 305 N ASN A 269 3.955 14.636 11.962 1.00 0.00 N ATOM 306 CA ASN A 269 4.722 14.223 10.787 1.00 0.00 C ATOM 307 C ASN A 269 6.155 13.817 11.141 1.00 0.00 C ATOM 308 O ASN A 269 6.707 12.879 10.567 1.00 0.00 O ATOM 309 CB ASN A 269 4.772 15.386 9.795 1.00 0.00 C ATOM 310 CG ASN A 269 4.489 14.883 8.383 1.00 0.00 C ATOM 311 OD1 ASN A 269 3.500 14.185 8.159 1.00 0.00 O ATOM 312 ND2 ASN A 269 5.303 15.198 7.413 1.00 0.00 N ATOM 0 H ASN A 269 3.115 15.171 11.743 1.00 0.00 H new ATOM 0 HA ASN A 269 4.225 13.354 10.356 1.00 0.00 H new ATOM 0 HB2 ASN A 269 4.039 16.143 10.073 1.00 0.00 H new ATOM 0 HB3 ASN A 269 5.752 15.862 9.830 1.00 0.00 H new ATOM 0 HD21 ASN A 269 5.121 14.866 6.466 1.00 0.00 H new ATOM 0 HD22 ASN A 269 6.122 15.777 7.602 1.00 0.00 H new ATOM 319 N HIS A 270 6.754 14.551 12.067 1.00 0.00 N ATOM 320 CA HIS A 270 8.130 14.300 12.482 1.00 0.00 C ATOM 321 C HIS A 270 8.347 12.843 12.886 1.00 0.00 C ATOM 322 O HIS A 270 9.405 12.274 12.622 1.00 0.00 O ATOM 323 CB HIS A 270 8.487 15.224 13.648 1.00 0.00 C ATOM 324 CG HIS A 270 7.628 16.461 13.587 1.00 0.00 C ATOM 325 ND1 HIS A 270 7.387 17.249 14.699 1.00 0.00 N ATOM 326 CD2 HIS A 270 6.934 17.049 12.556 1.00 0.00 C ATOM 327 CE1 HIS A 270 6.578 18.254 14.313 1.00 0.00 C ATOM 328 NE2 HIS A 270 6.278 18.180 13.018 1.00 0.00 N ATOM 0 H HIS A 270 6.307 15.331 12.549 1.00 0.00 H new ATOM 0 HA HIS A 270 8.781 14.504 11.632 1.00 0.00 H new ATOM 0 HB2 HIS A 270 8.334 14.708 14.596 1.00 0.00 H new ATOM 0 HB3 HIS A 270 9.541 15.497 13.601 1.00 0.00 H new ATOM 0 HD2 HIS A 270 6.904 16.685 11.540 1.00 0.00 H new ATOM 0 HE1 HIS A 270 6.216 19.027 14.975 1.00 0.00 H new ATOM 0 HE2 HIS A 270 5.691 18.818 12.481 1.00 0.00 H new ATOM 336 N MET A 271 7.351 12.242 13.528 1.00 0.00 N ATOM 337 CA MET A 271 7.474 10.851 13.957 1.00 0.00 C ATOM 338 C MET A 271 6.382 9.991 13.330 1.00 0.00 C ATOM 339 O MET A 271 5.219 10.391 13.268 1.00 0.00 O ATOM 340 CB MET A 271 7.389 10.767 15.483 1.00 0.00 C ATOM 341 CG MET A 271 8.802 10.731 16.072 1.00 0.00 C ATOM 342 SD MET A 271 8.777 11.431 17.740 1.00 0.00 S ATOM 343 CE MET A 271 10.073 10.383 18.445 1.00 0.00 C ATOM 0 H MET A 271 6.463 12.686 13.761 1.00 0.00 H new ATOM 0 HA MET A 271 8.442 10.474 13.627 1.00 0.00 H new ATOM 0 HB2 MET A 271 6.842 11.624 15.875 1.00 0.00 H new ATOM 0 HB3 MET A 271 6.837 9.875 15.779 1.00 0.00 H new ATOM 0 HG2 MET A 271 9.169 9.705 16.102 1.00 0.00 H new ATOM 0 HG3 MET A 271 9.486 11.296 15.439 1.00 0.00 H new ATOM 0 HE1 MET A 271 10.226 10.648 19.491 1.00 0.00 H new ATOM 0 HE2 MET A 271 9.773 9.337 18.376 1.00 0.00 H new ATOM 0 HE3 MET A 271 11.001 10.531 17.893 1.00 0.00 H new ATOM 350 N LYS A 272 6.767 8.806 12.864 1.00 0.00 N ATOM 351 CA LYS A 272 5.818 7.892 12.239 1.00 0.00 C ATOM 352 C LYS A 272 5.640 6.640 13.093 1.00 0.00 C ATOM 353 O LYS A 272 6.285 6.489 14.131 1.00 0.00 O ATOM 354 CB LYS A 272 6.319 7.495 10.848 1.00 0.00 C ATOM 355 CG LYS A 272 6.847 8.734 10.120 1.00 0.00 C ATOM 356 CD LYS A 272 7.297 8.346 8.709 1.00 0.00 C ATOM 357 CE LYS A 272 7.327 9.589 7.819 1.00 0.00 C ATOM 358 NZ LYS A 272 5.939 9.936 7.401 1.00 0.00 N ATOM 0 H LYS A 272 7.725 8.458 12.907 1.00 0.00 H new ATOM 0 HA LYS A 272 4.857 8.398 12.150 1.00 0.00 H new ATOM 0 HB2 LYS A 272 7.108 6.748 10.934 1.00 0.00 H new ATOM 0 HB3 LYS A 272 5.511 7.041 10.275 1.00 0.00 H new ATOM 0 HG2 LYS A 272 6.070 9.497 10.068 1.00 0.00 H new ATOM 0 HG3 LYS A 272 7.681 9.166 10.673 1.00 0.00 H new ATOM 0 HD2 LYS A 272 8.286 7.888 8.745 1.00 0.00 H new ATOM 0 HD3 LYS A 272 6.617 7.604 8.291 1.00 0.00 H new ATOM 0 HE2 LYS A 272 7.775 10.424 8.358 1.00 0.00 H new ATOM 0 HE3 LYS A 272 7.947 9.406 6.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 272 5.973 10.595 6.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 272 5.435 9.071 7.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 272 5.439 10.385 8.195 1.00 0.00 H new ATOM 372 N ARG A 273 4.760 5.745 12.652 1.00 0.00 N ATOM 373 CA ARG A 273 4.507 4.511 13.387 1.00 0.00 C ATOM 374 C ARG A 273 5.436 3.401 12.906 1.00 0.00 C ATOM 375 O ARG A 273 5.915 3.429 11.773 1.00 0.00 O ATOM 376 CB ARG A 273 3.051 4.080 13.199 1.00 0.00 C ATOM 377 CG ARG A 273 2.124 5.103 13.862 1.00 0.00 C ATOM 378 CD ARG A 273 2.174 4.935 15.382 1.00 0.00 C ATOM 379 NE ARG A 273 2.151 3.520 15.735 1.00 0.00 N ATOM 380 CZ ARG A 273 2.906 3.036 16.718 1.00 0.00 C ATOM 381 NH1 ARG A 273 3.679 3.833 17.406 1.00 0.00 N ATOM 382 NH2 ARG A 273 2.870 1.763 16.998 1.00 0.00 N ATOM 0 H ARG A 273 4.215 5.850 11.796 1.00 0.00 H new ATOM 0 HA ARG A 273 4.697 4.694 14.445 1.00 0.00 H new ATOM 0 HB2 ARG A 273 2.819 3.999 12.137 1.00 0.00 H new ATOM 0 HB3 ARG A 273 2.893 3.094 13.636 1.00 0.00 H new ATOM 0 HG2 ARG A 273 2.427 6.114 13.588 1.00 0.00 H new ATOM 0 HG3 ARG A 273 1.103 4.968 13.505 1.00 0.00 H new ATOM 0 HD2 ARG A 273 3.077 5.401 15.777 1.00 0.00 H new ATOM 0 HD3 ARG A 273 1.326 5.445 15.839 1.00 0.00 H new ATOM 0 HE ARG A 273 1.542 2.887 15.216 1.00 0.00 H new ATOM 0 HH11 ARG A 273 3.705 4.830 17.190 1.00 0.00 H new ATOM 0 HH12 ARG A 273 4.256 3.459 18.159 1.00 0.00 H new ATOM 0 HH21 ARG A 273 2.264 1.140 16.464 1.00 0.00 H new ATOM 0 HH22 ARG A 273 3.448 1.390 17.751 1.00 0.00 H new ATOM 396 N ALA A 274 5.687 2.427 13.774 1.00 0.00 N ATOM 397 CA ALA A 274 6.564 1.315 13.425 1.00 0.00 C ATOM 398 C ALA A 274 5.796 0.244 12.657 1.00 0.00 C ATOM 399 O ALA A 274 5.078 -0.563 13.248 1.00 0.00 O ATOM 400 CB ALA A 274 7.164 0.703 14.691 1.00 0.00 C ATOM 0 H ALA A 274 5.299 2.384 14.717 1.00 0.00 H new ATOM 0 HA ALA A 274 7.364 1.697 12.791 1.00 0.00 H new ATOM 0 HB1 ALA A 274 7.817 -0.126 14.420 1.00 0.00 H new ATOM 0 HB2 ALA A 274 7.740 1.460 15.223 1.00 0.00 H new ATOM 0 HB3 ALA A 274 6.363 0.339 15.334 1.00 0.00 H new ATOM 403 N THR A 275 5.956 0.240 11.338 1.00 0.00 N ATOM 404 CA THR A 275 5.275 -0.740 10.500 1.00 0.00 C ATOM 405 C THR A 275 5.993 -2.085 10.564 1.00 0.00 C ATOM 406 O THR A 275 5.480 -3.097 10.088 1.00 0.00 O ATOM 407 CB THR A 275 5.233 -0.249 9.051 1.00 0.00 C ATOM 408 OG1 THR A 275 6.532 -0.340 8.484 1.00 0.00 O ATOM 409 CG2 THR A 275 4.759 1.205 9.015 1.00 0.00 C ATOM 0 H THR A 275 6.546 0.898 10.829 1.00 0.00 H new ATOM 0 HA THR A 275 4.257 -0.865 10.869 1.00 0.00 H new ATOM 0 HB THR A 275 4.542 -0.867 8.478 1.00 0.00 H new ATOM 0 HG1 THR A 275 6.506 -0.028 7.556 1.00 0.00 H new ATOM 0 HG21 THR A 275 4.730 1.553 7.982 1.00 0.00 H new ATOM 0 HG22 THR A 275 3.762 1.273 9.449 1.00 0.00 H new ATOM 0 HG23 THR A 275 5.447 1.826 9.588 1.00 0.00 H new ATOM 414 N GLN A 276 7.183 -2.087 11.155 1.00 0.00 N ATOM 415 CA GLN A 276 7.966 -3.313 11.274 1.00 0.00 C ATOM 416 C GLN A 276 7.550 -4.104 12.513 1.00 0.00 C ATOM 417 O GLN A 276 8.225 -5.055 12.908 1.00 0.00 O ATOM 418 CB GLN A 276 9.455 -2.971 11.363 1.00 0.00 C ATOM 419 CG GLN A 276 10.258 -3.951 10.504 1.00 0.00 C ATOM 420 CD GLN A 276 11.740 -3.845 10.845 1.00 0.00 C ATOM 421 OE1 GLN A 276 12.575 -3.701 9.953 1.00 0.00 O ATOM 422 NE2 GLN A 276 12.117 -3.907 12.093 1.00 0.00 N ATOM 0 H GLN A 276 7.625 -1.260 11.557 1.00 0.00 H new ATOM 0 HA GLN A 276 7.782 -3.925 10.391 1.00 0.00 H new ATOM 0 HB2 GLN A 276 9.625 -1.949 11.023 1.00 0.00 H new ATOM 0 HB3 GLN A 276 9.789 -3.022 12.399 1.00 0.00 H new ATOM 0 HG2 GLN A 276 9.908 -4.969 10.675 1.00 0.00 H new ATOM 0 HG3 GLN A 276 10.103 -3.734 9.447 1.00 0.00 H new ATOM 0 HE21 GLN A 276 11.422 -4.026 12.830 1.00 0.00 H new ATOM 0 HE22 GLN A 276 13.106 -3.836 12.331 1.00 0.00 H new ATOM 431 N ILE A 277 6.435 -3.705 13.118 1.00 0.00 N ATOM 432 CA ILE A 277 5.934 -4.383 14.310 1.00 0.00 C ATOM 433 C ILE A 277 6.407 -5.841 14.351 1.00 0.00 C ATOM 434 O ILE A 277 5.852 -6.699 13.666 1.00 0.00 O ATOM 435 CB ILE A 277 4.400 -4.332 14.330 1.00 0.00 C ATOM 436 CG1 ILE A 277 3.936 -3.059 15.044 1.00 0.00 C ATOM 437 CG2 ILE A 277 3.865 -5.535 15.091 1.00 0.00 C ATOM 438 CD1 ILE A 277 4.380 -3.087 16.512 1.00 0.00 C ATOM 0 H ILE A 277 5.864 -2.920 12.805 1.00 0.00 H new ATOM 0 HA ILE A 277 6.327 -3.871 15.188 1.00 0.00 H new ATOM 0 HB ILE A 277 4.030 -4.339 13.305 1.00 0.00 H new ATOM 0 HG12 ILE A 277 4.351 -2.182 14.547 1.00 0.00 H new ATOM 0 HG13 ILE A 277 2.851 -2.975 14.986 1.00 0.00 H new ATOM 0 HG21 ILE A 277 2.776 -5.501 15.106 1.00 0.00 H new ATOM 0 HG22 ILE A 277 4.192 -6.451 14.600 1.00 0.00 H new ATOM 0 HG23 ILE A 277 4.243 -5.516 16.113 1.00 0.00 H new ATOM 0 HD11 ILE A 277 4.045 -2.177 17.011 1.00 0.00 H new ATOM 0 HD12 ILE A 277 3.944 -3.954 17.008 1.00 0.00 H new ATOM 0 HD13 ILE A 277 5.467 -3.149 16.562 1.00 0.00 H new ATOM 444 N PRO A 278 7.408 -6.135 15.147 1.00 0.00 N ATOM 445 CA PRO A 278 7.945 -7.518 15.289 1.00 0.00 C ATOM 446 C PRO A 278 7.091 -8.338 16.250 1.00 0.00 C ATOM 447 O PRO A 278 6.012 -8.807 15.888 1.00 0.00 O ATOM 448 CB PRO A 278 9.348 -7.296 15.852 1.00 0.00 C ATOM 449 CG PRO A 278 9.273 -6.010 16.614 1.00 0.00 C ATOM 450 CD PRO A 278 8.139 -5.182 15.997 1.00 0.00 C ATOM 0 HA PRO A 278 7.947 -8.074 14.351 1.00 0.00 H new ATOM 0 HB2 PRO A 278 9.646 -8.120 16.501 1.00 0.00 H new ATOM 0 HB3 PRO A 278 10.087 -7.236 15.053 1.00 0.00 H new ATOM 0 HG2 PRO A 278 9.080 -6.199 17.670 1.00 0.00 H new ATOM 0 HG3 PRO A 278 10.219 -5.472 16.554 1.00 0.00 H new ATOM 0 HD2 PRO A 278 7.493 -4.759 16.766 1.00 0.00 H new ATOM 0 HD3 PRO A 278 8.529 -4.348 15.414 1.00 0.00 H new ATOM 458 N SER A 279 7.560 -8.474 17.488 1.00 0.00 N ATOM 459 CA SER A 279 6.807 -9.196 18.497 1.00 0.00 C ATOM 460 C SER A 279 6.660 -8.319 19.724 1.00 0.00 C ATOM 461 O SER A 279 7.600 -8.101 20.490 1.00 0.00 O ATOM 462 CB SER A 279 7.480 -10.506 18.854 1.00 0.00 C ATOM 463 OG SER A 279 8.808 -10.257 19.298 1.00 0.00 O ATOM 0 H SER A 279 8.451 -8.095 17.810 1.00 0.00 H new ATOM 0 HA SER A 279 5.821 -9.437 18.099 1.00 0.00 H new ATOM 0 HB2 SER A 279 6.915 -11.016 19.634 1.00 0.00 H new ATOM 0 HB3 SER A 279 7.494 -11.167 17.987 1.00 0.00 H new ATOM 0 HG SER A 279 8.820 -9.452 19.857 1.00 0.00 H new ATOM 469 N TYR A 280 5.467 -7.795 19.854 1.00 0.00 N ATOM 470 CA TYR A 280 5.102 -6.890 20.923 1.00 0.00 C ATOM 471 C TYR A 280 4.758 -7.636 22.210 1.00 0.00 C ATOM 472 O TYR A 280 5.275 -7.321 23.282 1.00 0.00 O ATOM 473 CB TYR A 280 3.907 -6.060 20.443 1.00 0.00 C ATOM 474 CG TYR A 280 3.289 -6.744 19.235 1.00 0.00 C ATOM 475 CD1 TYR A 280 4.040 -6.951 18.061 1.00 0.00 C ATOM 476 CD2 TYR A 280 1.974 -7.205 19.300 1.00 0.00 C ATOM 477 CE1 TYR A 280 3.469 -7.619 16.972 1.00 0.00 C ATOM 478 CE2 TYR A 280 1.403 -7.863 18.207 1.00 0.00 C ATOM 479 CZ TYR A 280 2.151 -8.072 17.044 1.00 0.00 C ATOM 480 OH TYR A 280 1.588 -8.731 15.970 1.00 0.00 O ATOM 0 H TYR A 280 4.703 -7.988 19.206 1.00 0.00 H new ATOM 0 HA TYR A 280 5.950 -6.246 21.158 1.00 0.00 H new ATOM 0 HB2 TYR A 280 3.170 -5.964 21.240 1.00 0.00 H new ATOM 0 HB3 TYR A 280 4.228 -5.052 20.182 1.00 0.00 H new ATOM 0 HD1 TYR A 280 5.057 -6.594 18.002 1.00 0.00 H new ATOM 0 HD2 TYR A 280 1.395 -7.053 20.199 1.00 0.00 H new ATOM 0 HE1 TYR A 280 4.048 -7.784 16.076 1.00 0.00 H new ATOM 0 HE2 TYR A 280 0.382 -8.211 18.261 1.00 0.00 H new ATOM 0 HH TYR A 280 0.665 -8.980 16.186 1.00 0.00 H new ATOM 490 N LYS A 281 3.856 -8.606 22.098 1.00 0.00 N ATOM 491 CA LYS A 281 3.415 -9.374 23.261 1.00 0.00 C ATOM 492 C LYS A 281 4.422 -10.444 23.672 1.00 0.00 C ATOM 493 O LYS A 281 4.679 -10.627 24.861 1.00 0.00 O ATOM 494 CB LYS A 281 2.070 -10.038 22.972 1.00 0.00 C ATOM 495 CG LYS A 281 2.106 -10.693 21.589 1.00 0.00 C ATOM 496 CD LYS A 281 1.731 -12.172 21.713 1.00 0.00 C ATOM 497 CE LYS A 281 0.225 -12.303 21.949 1.00 0.00 C ATOM 498 NZ LYS A 281 -0.144 -13.746 21.999 1.00 0.00 N ATOM 0 H LYS A 281 3.417 -8.879 21.219 1.00 0.00 H new ATOM 0 HA LYS A 281 3.321 -8.669 24.087 1.00 0.00 H new ATOM 0 HB2 LYS A 281 1.851 -10.786 23.734 1.00 0.00 H new ATOM 0 HB3 LYS A 281 1.271 -9.298 23.014 1.00 0.00 H new ATOM 0 HG2 LYS A 281 1.413 -10.187 20.917 1.00 0.00 H new ATOM 0 HG3 LYS A 281 3.101 -10.595 21.154 1.00 0.00 H new ATOM 0 HD2 LYS A 281 2.015 -12.707 20.806 1.00 0.00 H new ATOM 0 HD3 LYS A 281 2.279 -12.628 22.537 1.00 0.00 H new ATOM 0 HE2 LYS A 281 -0.052 -11.813 22.882 1.00 0.00 H new ATOM 0 HE3 LYS A 281 -0.324 -11.803 21.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 281 -1.168 -13.837 22.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 281 0.107 -14.200 21.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 281 0.371 -14.209 22.775 1.00 0.00 H new ATOM 512 N LYS A 282 4.966 -11.166 22.695 1.00 0.00 N ATOM 513 CA LYS A 282 5.924 -12.234 22.987 1.00 0.00 C ATOM 514 C LYS A 282 6.592 -12.014 24.340 1.00 0.00 C ATOM 515 O LYS A 282 6.803 -12.959 25.100 1.00 0.00 O ATOM 516 CB LYS A 282 6.989 -12.305 21.895 1.00 0.00 C ATOM 517 CG LYS A 282 8.090 -13.276 22.324 1.00 0.00 C ATOM 518 CD LYS A 282 7.473 -14.641 22.639 1.00 0.00 C ATOM 519 CE LYS A 282 8.575 -15.703 22.687 1.00 0.00 C ATOM 520 NZ LYS A 282 8.603 -16.447 21.397 1.00 0.00 N ATOM 0 H LYS A 282 4.764 -11.035 21.704 1.00 0.00 H new ATOM 0 HA LYS A 282 5.376 -13.176 23.018 1.00 0.00 H new ATOM 0 HB2 LYS A 282 6.543 -12.635 20.957 1.00 0.00 H new ATOM 0 HB3 LYS A 282 7.410 -11.316 21.717 1.00 0.00 H new ATOM 0 HG2 LYS A 282 8.832 -13.375 21.531 1.00 0.00 H new ATOM 0 HG3 LYS A 282 8.610 -12.889 23.201 1.00 0.00 H new ATOM 0 HD2 LYS A 282 6.949 -14.603 23.594 1.00 0.00 H new ATOM 0 HD3 LYS A 282 6.735 -14.902 21.880 1.00 0.00 H new ATOM 0 HE2 LYS A 282 9.541 -15.232 22.869 1.00 0.00 H new ATOM 0 HE3 LYS A 282 8.396 -16.392 23.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 282 9.351 -17.169 21.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 282 7.684 -16.908 21.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 282 8.794 -15.785 20.618 1.00 0.00 H new ATOM 534 N LEU A 283 6.916 -10.761 24.638 1.00 0.00 N ATOM 535 CA LEU A 283 7.550 -10.428 25.907 1.00 0.00 C ATOM 536 C LEU A 283 6.547 -10.535 27.049 1.00 0.00 C ATOM 537 O LEU A 283 6.827 -11.167 28.066 1.00 0.00 O ATOM 538 CB LEU A 283 8.113 -9.008 25.852 1.00 0.00 C ATOM 539 CG LEU A 283 8.712 -8.630 27.210 1.00 0.00 C ATOM 540 CD1 LEU A 283 10.129 -9.195 27.327 1.00 0.00 C ATOM 541 CD2 LEU A 283 8.753 -7.111 27.323 1.00 0.00 C ATOM 0 H LEU A 283 6.751 -9.964 24.023 1.00 0.00 H new ATOM 0 HA LEU A 283 8.362 -11.134 26.083 1.00 0.00 H new ATOM 0 HB2 LEU A 283 8.876 -8.940 25.077 1.00 0.00 H new ATOM 0 HB3 LEU A 283 7.324 -8.305 25.585 1.00 0.00 H new ATOM 0 HG LEU A 283 8.100 -9.045 28.011 1.00 0.00 H new ATOM 0 HD11 LEU A 283 10.550 -8.923 28.295 1.00 0.00 H new ATOM 0 HD12 LEU A 283 10.096 -10.281 27.238 1.00 0.00 H new ATOM 0 HD13 LEU A 283 10.751 -8.784 26.532 1.00 0.00 H new ATOM 0 HD21 LEU A 283 9.178 -6.829 28.286 1.00 0.00 H new ATOM 0 HD22 LEU A 283 9.369 -6.703 26.522 1.00 0.00 H new ATOM 0 HD23 LEU A 283 7.742 -6.713 27.242 1.00 0.00 H new ATOM 547 N ILE A 284 5.387 -9.900 26.872 1.00 0.00 N ATOM 548 CA ILE A 284 4.339 -9.912 27.890 1.00 0.00 C ATOM 549 C ILE A 284 4.576 -11.024 28.907 1.00 0.00 C ATOM 550 O ILE A 284 4.499 -10.797 30.115 1.00 0.00 O ATOM 551 CB ILE A 284 2.975 -10.097 27.226 1.00 0.00 C ATOM 552 CG1 ILE A 284 1.901 -9.437 28.090 1.00 0.00 C ATOM 553 CG2 ILE A 284 2.667 -11.588 27.082 1.00 0.00 C ATOM 554 CD1 ILE A 284 0.549 -9.523 27.380 1.00 0.00 C ATOM 0 H ILE A 284 5.151 -9.371 26.032 1.00 0.00 H new ATOM 0 HA ILE A 284 4.362 -8.958 28.417 1.00 0.00 H new ATOM 0 HB ILE A 284 2.988 -9.637 26.238 1.00 0.00 H new ATOM 0 HG12 ILE A 284 1.846 -9.931 29.060 1.00 0.00 H new ATOM 0 HG13 ILE A 284 2.160 -8.395 28.277 1.00 0.00 H new ATOM 0 HG21 ILE A 284 1.694 -11.714 26.608 1.00 0.00 H new ATOM 0 HG22 ILE A 284 3.434 -12.060 26.468 1.00 0.00 H new ATOM 0 HG23 ILE A 284 2.654 -12.054 28.067 1.00 0.00 H new ATOM 0 HD11 ILE A 284 -0.216 -9.052 27.997 1.00 0.00 H new ATOM 0 HD12 ILE A 284 0.609 -9.009 26.420 1.00 0.00 H new ATOM 0 HD13 ILE A 284 0.290 -10.569 27.216 1.00 0.00 H new ATOM 560 N MET A 285 4.882 -12.218 28.414 1.00 0.00 N ATOM 561 CA MET A 285 5.150 -13.346 29.293 1.00 0.00 C ATOM 562 C MET A 285 6.651 -13.578 29.402 1.00 0.00 C ATOM 563 O MET A 285 7.304 -13.960 28.430 1.00 0.00 O ATOM 564 CB MET A 285 4.474 -14.606 28.755 1.00 0.00 C ATOM 565 CG MET A 285 3.953 -15.443 29.924 1.00 0.00 C ATOM 566 SD MET A 285 3.651 -17.138 29.366 1.00 0.00 S ATOM 567 CE MET A 285 3.900 -17.949 30.964 1.00 0.00 C ATOM 0 H MET A 285 4.950 -12.428 27.418 1.00 0.00 H new ATOM 0 HA MET A 285 4.749 -13.121 30.281 1.00 0.00 H new ATOM 0 HB2 MET A 285 3.652 -14.336 28.092 1.00 0.00 H new ATOM 0 HB3 MET A 285 5.182 -15.188 28.164 1.00 0.00 H new ATOM 0 HG2 MET A 285 4.678 -15.441 30.738 1.00 0.00 H new ATOM 0 HG3 MET A 285 3.033 -15.008 30.315 1.00 0.00 H new ATOM 0 HE1 MET A 285 3.760 -19.024 30.852 1.00 0.00 H new ATOM 0 HE2 MET A 285 4.911 -17.750 31.319 1.00 0.00 H new ATOM 0 HE3 MET A 285 3.180 -17.562 31.685 1.00 0.00 H new ATOM 574 N TYR A 286 7.192 -13.335 30.587 1.00 0.00 N ATOM 575 CA TYR A 286 8.622 -13.510 30.815 1.00 0.00 C ATOM 576 C TYR A 286 8.918 -14.917 31.326 1.00 0.00 C ATOM 577 O TYR A 286 9.974 -15.104 31.908 1.00 0.00 O ATOM 578 CB TYR A 286 9.119 -12.476 31.831 1.00 0.00 C ATOM 579 CG TYR A 286 8.841 -11.090 31.322 1.00 0.00 C ATOM 580 CD1 TYR A 286 7.522 -10.650 31.179 1.00 0.00 C ATOM 581 CD2 TYR A 286 9.903 -10.241 31.001 1.00 0.00 C ATOM 582 CE1 TYR A 286 7.264 -9.360 30.717 1.00 0.00 C ATOM 583 CE2 TYR A 286 9.648 -8.950 30.537 1.00 0.00 C ATOM 584 CZ TYR A 286 8.327 -8.506 30.394 1.00 0.00 C ATOM 585 OH TYR A 286 8.072 -7.230 29.936 1.00 0.00 O ATOM 586 OXT TYR A 286 8.087 -15.786 31.124 1.00 0.00 O ATOM 0 H TYR A 286 6.667 -13.018 31.402 1.00 0.00 H new ATOM 0 HA TYR A 286 9.142 -13.367 29.868 1.00 0.00 H new ATOM 0 HB2 TYR A 286 8.624 -12.627 32.790 1.00 0.00 H new ATOM 0 HB3 TYR A 286 10.188 -12.604 32.001 1.00 0.00 H new ATOM 0 HD1 TYR A 286 6.703 -11.309 31.426 1.00 0.00 H new ATOM 0 HD2 TYR A 286 10.921 -10.584 31.112 1.00 0.00 H new ATOM 0 HE1 TYR A 286 6.245 -9.019 30.608 1.00 0.00 H new ATOM 0 HE2 TYR A 286 10.469 -8.293 30.288 1.00 0.00 H new ATOM 0 HH TYR A 286 8.795 -6.631 30.217 1.00 0.00 H new TER 596 TYR A 286