USER MOD reduce.3.24.130724 H: found=0, std=0, add=544, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 545 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 309 HIS : no HE2:sc= -19.9! C(o=-20!,f=-22!) USER MOD Set 1.2: A 312 CYS SG : rot 180:sc= -0.253 USER MOD Single : A 249 MET CE :methyl -165:sc= -0.0854 (180deg=-0.506) USER MOD Single : A 251 GLN : amide:sc= -0.356 K(o=-0.36,f=-1.5) USER MOD Single : A 252 CYS SG : rot -150:sc= -4.42! USER MOD Single : A 254 SER OG : rot 58:sc= 1.33! USER MOD Single : A 260 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 263 THR OG1 : rot 180:sc= 0 USER MOD Single : A 267 GLN : amide:sc= -0.516 K(o=-0.52,f=-2.8!) USER MOD Single : A 275 SER OG : rot 72:sc= -1.42! USER MOD Single : A 276 LYS NZ :NH3+ -150:sc= -0.0786 (180deg=-0.576) USER MOD Single : A 278 THR OG1 : rot 29:sc= 0.171 USER MOD Single : A 279 THR OG1 : rot 180:sc= 0.148 USER MOD Single : A 280 ASN : amide:sc= -0.661 K(o=-0.66,f=-3.5!) USER MOD Single : A 281 ASN :FLIP amide:sc= -0.0508 F(o=-1.2,f=-0.051) USER MOD Single : A 284 ASN : amide:sc= -0.217 K(o=-0.22,f=-2) USER MOD Single : A 292 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 294 LYS NZ :NH3+ 157:sc= -1.24 (180deg=-2.2!) USER MOD Single : A 296 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 299 SER OG : rot 180:sc= 0 USER MOD Single : A 300 THR OG1 : rot 82:sc= 0.852 USER MOD Single : A 302 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 305 LYS NZ :NH3+ -161:sc= -0.249 (180deg=-0.727) USER MOD Single : A 306 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 310 THR OG1 : rot 180:sc= 0 USER MOD Single : A 311 ASN : amide:sc= -2.52 X(o=-2.5,f=-2.2) USER MOD ----------------------------------------------------------------- ATOM 75 N ARG A 247 -5.231 -15.497 3.249 1.00 0.00 N ATOM 76 CA ARG A 247 -4.642 -14.672 2.187 1.00 0.00 C ATOM 77 C ARG A 247 -5.138 -13.246 2.223 1.00 0.00 C ATOM 78 O ARG A 247 -5.980 -12.873 3.039 1.00 0.00 O ATOM 79 CB ARG A 247 -4.864 -15.299 0.804 1.00 0.00 C ATOM 80 CG ARG A 247 -6.257 -15.094 0.226 1.00 0.00 C ATOM 81 CD ARG A 247 -6.747 -16.341 -0.494 1.00 0.00 C ATOM 82 NE ARG A 247 -8.165 -16.258 -0.838 1.00 0.00 N ATOM 83 CZ ARG A 247 -9.152 -16.504 0.019 1.00 0.00 C ATOM 84 NH1 ARG A 247 -8.881 -16.840 1.275 1.00 0.00 N ATOM 85 NH2 ARG A 247 -10.413 -16.412 -0.378 1.00 0.00 N ATOM 0 HA ARG A 247 -3.569 -14.640 2.376 1.00 0.00 H new ATOM 0 HB2 ARG A 247 -4.133 -14.883 0.110 1.00 0.00 H new ATOM 0 HB3 ARG A 247 -4.667 -16.369 0.870 1.00 0.00 H new ATOM 0 HG2 ARG A 247 -6.951 -14.838 1.027 1.00 0.00 H new ATOM 0 HG3 ARG A 247 -6.245 -14.253 -0.467 1.00 0.00 H new ATOM 0 HD2 ARG A 247 -6.162 -16.487 -1.402 1.00 0.00 H new ATOM 0 HD3 ARG A 247 -6.578 -17.213 0.138 1.00 0.00 H new ATOM 0 HE ARG A 247 -8.412 -15.996 -1.792 1.00 0.00 H new ATOM 0 HH11 ARG A 247 -7.912 -16.910 1.586 1.00 0.00 H new ATOM 0 HH12 ARG A 247 -9.642 -17.028 1.928 1.00 0.00 H new ATOM 0 HH21 ARG A 247 -10.627 -16.153 -1.341 1.00 0.00 H new ATOM 0 HH22 ARG A 247 -11.170 -16.601 0.279 1.00 0.00 H new ATOM 99 N TRP A 248 -4.542 -12.431 1.373 1.00 0.00 N ATOM 100 CA TRP A 248 -4.860 -11.022 1.349 1.00 0.00 C ATOM 101 C TRP A 248 -4.792 -10.385 -0.031 1.00 0.00 C ATOM 102 O TRP A 248 -4.413 -11.002 -1.023 1.00 0.00 O ATOM 103 CB TRP A 248 -3.875 -10.312 2.252 1.00 0.00 C ATOM 104 CG TRP A 248 -4.293 -10.225 3.672 1.00 0.00 C ATOM 105 CD1 TRP A 248 -3.794 -10.942 4.714 1.00 0.00 C ATOM 106 CD2 TRP A 248 -5.293 -9.365 4.204 1.00 0.00 C ATOM 107 NE1 TRP A 248 -4.385 -10.531 5.887 1.00 0.00 N ATOM 108 CE2 TRP A 248 -5.322 -9.562 5.592 1.00 0.00 C ATOM 109 CE3 TRP A 248 -6.156 -8.434 3.634 1.00 0.00 C ATOM 110 CZ2 TRP A 248 -6.188 -8.841 6.417 1.00 0.00 C ATOM 111 CZ3 TRP A 248 -7.017 -7.736 4.448 1.00 0.00 C ATOM 112 CH2 TRP A 248 -7.024 -7.937 5.827 1.00 0.00 C ATOM 0 H TRP A 248 -3.838 -12.722 0.694 1.00 0.00 H new ATOM 0 HA TRP A 248 -5.894 -10.923 1.680 1.00 0.00 H new ATOM 0 HB2 TRP A 248 -2.917 -10.828 2.200 1.00 0.00 H new ATOM 0 HB3 TRP A 248 -3.715 -9.303 1.871 1.00 0.00 H new ATOM 0 HD1 TRP A 248 -3.046 -11.717 4.633 1.00 0.00 H new ATOM 0 HE1 TRP A 248 -4.167 -10.884 6.819 1.00 0.00 H new ATOM 0 HE3 TRP A 248 -6.150 -8.262 2.568 1.00 0.00 H new ATOM 0 HZ2 TRP A 248 -6.196 -8.993 7.486 1.00 0.00 H new ATOM 0 HZ3 TRP A 248 -7.699 -7.021 4.012 1.00 0.00 H new ATOM 0 HH2 TRP A 248 -7.704 -7.366 6.441 1.00 0.00 H new ATOM 123 N MET A 249 -5.145 -9.107 -0.020 1.00 0.00 N ATOM 124 CA MET A 249 -5.142 -8.224 -1.183 1.00 0.00 C ATOM 125 C MET A 249 -5.246 -6.801 -0.654 1.00 0.00 C ATOM 126 O MET A 249 -6.309 -6.182 -0.673 1.00 0.00 O ATOM 127 CB MET A 249 -6.308 -8.501 -2.110 1.00 0.00 C ATOM 128 CG MET A 249 -6.398 -9.941 -2.589 1.00 0.00 C ATOM 129 SD MET A 249 -7.470 -10.132 -4.027 1.00 0.00 S ATOM 130 CE MET A 249 -8.836 -9.062 -3.582 1.00 0.00 C ATOM 0 H MET A 249 -5.454 -8.637 0.831 1.00 0.00 H new ATOM 0 HA MET A 249 -4.231 -8.384 -1.760 1.00 0.00 H new ATOM 0 HB2 MET A 249 -7.234 -8.243 -1.597 1.00 0.00 H new ATOM 0 HB3 MET A 249 -6.231 -7.846 -2.978 1.00 0.00 H new ATOM 0 HG2 MET A 249 -5.399 -10.300 -2.836 1.00 0.00 H new ATOM 0 HG3 MET A 249 -6.771 -10.567 -1.778 1.00 0.00 H new ATOM 0 HE1 MET A 249 -9.688 -9.272 -4.228 1.00 0.00 H new ATOM 0 HE2 MET A 249 -9.115 -9.241 -2.544 1.00 0.00 H new ATOM 0 HE3 MET A 249 -8.537 -8.021 -3.703 1.00 0.00 H new ATOM 140 N VAL A 250 -4.144 -6.333 -0.119 1.00 0.00 N ATOM 141 CA VAL A 250 -4.069 -5.024 0.517 1.00 0.00 C ATOM 142 C VAL A 250 -4.636 -3.898 -0.326 1.00 0.00 C ATOM 143 O VAL A 250 -4.609 -3.940 -1.555 1.00 0.00 O ATOM 144 CB VAL A 250 -2.627 -4.666 0.894 1.00 0.00 C ATOM 145 CG1 VAL A 250 -2.603 -3.365 1.680 1.00 0.00 C ATOM 146 CG2 VAL A 250 -1.980 -5.795 1.682 1.00 0.00 C ATOM 0 H VAL A 250 -3.263 -6.848 -0.109 1.00 0.00 H new ATOM 0 HA VAL A 250 -4.686 -5.117 1.411 1.00 0.00 H new ATOM 0 HB VAL A 250 -2.049 -4.527 -0.019 1.00 0.00 H new ATOM 0 HG11 VAL A 250 -1.575 -3.118 1.944 1.00 0.00 H new ATOM 0 HG12 VAL A 250 -3.024 -2.564 1.071 1.00 0.00 H new ATOM 0 HG13 VAL A 250 -3.194 -3.478 2.589 1.00 0.00 H new ATOM 0 HG21 VAL A 250 -0.957 -5.520 1.939 1.00 0.00 H new ATOM 0 HG22 VAL A 250 -2.548 -5.974 2.595 1.00 0.00 H new ATOM 0 HG23 VAL A 250 -1.970 -6.702 1.077 1.00 0.00 H new ATOM 156 N GLN A 251 -5.120 -2.867 0.368 1.00 0.00 N ATOM 157 CA GLN A 251 -5.658 -1.699 -0.279 1.00 0.00 C ATOM 158 C GLN A 251 -5.357 -0.496 0.578 1.00 0.00 C ATOM 159 O GLN A 251 -6.242 0.247 0.999 1.00 0.00 O ATOM 160 CB GLN A 251 -7.152 -1.862 -0.489 1.00 0.00 C ATOM 161 CG GLN A 251 -7.739 -0.910 -1.519 1.00 0.00 C ATOM 162 CD GLN A 251 -8.801 0.000 -0.934 1.00 0.00 C ATOM 163 OE1 GLN A 251 -9.968 -0.377 -0.825 1.00 0.00 O ATOM 164 NE2 GLN A 251 -8.401 1.208 -0.554 1.00 0.00 N ATOM 0 H GLN A 251 -5.144 -2.830 1.387 1.00 0.00 H new ATOM 0 HA GLN A 251 -5.200 -1.565 -1.259 1.00 0.00 H new ATOM 0 HB2 GLN A 251 -7.355 -2.887 -0.799 1.00 0.00 H new ATOM 0 HB3 GLN A 251 -7.661 -1.710 0.463 1.00 0.00 H new ATOM 0 HG2 GLN A 251 -6.940 -0.303 -1.944 1.00 0.00 H new ATOM 0 HG3 GLN A 251 -8.171 -1.487 -2.337 1.00 0.00 H new ATOM 0 HE21 GLN A 251 -7.424 1.479 -0.662 1.00 0.00 H new ATOM 0 HE22 GLN A 251 -9.071 1.865 -0.154 1.00 0.00 H new ATOM 173 N CYS A 252 -4.075 -0.335 0.829 1.00 0.00 N ATOM 174 CA CYS A 252 -3.573 0.753 1.642 1.00 0.00 C ATOM 175 C CYS A 252 -3.066 1.863 0.749 1.00 0.00 C ATOM 176 O CYS A 252 -1.883 2.202 0.760 1.00 0.00 O ATOM 177 CB CYS A 252 -2.458 0.248 2.559 1.00 0.00 C ATOM 178 SG CYS A 252 -2.990 -1.022 3.733 1.00 0.00 S ATOM 0 H CYS A 252 -3.349 -0.957 0.474 1.00 0.00 H new ATOM 0 HA CYS A 252 -4.379 1.143 2.263 1.00 0.00 H new ATOM 0 HB2 CYS A 252 -1.651 -0.154 1.946 1.00 0.00 H new ATOM 0 HB3 CYS A 252 -2.047 1.092 3.113 1.00 0.00 H new ATOM 0 HG CYS A 252 -2.269 -0.945 4.812 1.00 0.00 H new ATOM 184 N GLY A 253 -3.969 2.411 -0.044 1.00 0.00 N ATOM 185 CA GLY A 253 -3.593 3.459 -0.952 1.00 0.00 C ATOM 186 C GLY A 253 -4.612 4.563 -1.057 1.00 0.00 C ATOM 187 O GLY A 253 -5.546 4.645 -0.259 1.00 0.00 O ATOM 0 H GLY A 253 -4.954 2.147 -0.072 1.00 0.00 H new ATOM 0 HA2 GLY A 253 -2.642 3.883 -0.629 1.00 0.00 H new ATOM 0 HA3 GLY A 253 -3.431 3.030 -1.941 1.00 0.00 H new ATOM 191 N SER A 254 -4.424 5.404 -2.064 1.00 0.00 N ATOM 192 CA SER A 254 -5.314 6.522 -2.333 1.00 0.00 C ATOM 193 C SER A 254 -4.941 7.727 -1.480 1.00 0.00 C ATOM 194 O SER A 254 -5.669 8.122 -0.570 1.00 0.00 O ATOM 195 CB SER A 254 -6.783 6.105 -2.130 1.00 0.00 C ATOM 196 OG SER A 254 -7.355 6.706 -0.980 1.00 0.00 O ATOM 0 H SER A 254 -3.646 5.329 -2.720 1.00 0.00 H new ATOM 0 HA SER A 254 -5.199 6.817 -3.376 1.00 0.00 H new ATOM 0 HB2 SER A 254 -7.363 6.383 -3.010 1.00 0.00 H new ATOM 0 HB3 SER A 254 -6.842 5.020 -2.039 1.00 0.00 H new ATOM 0 HG SER A 254 -7.296 7.681 -1.057 1.00 0.00 H new ATOM 202 N PHE A 255 -3.791 8.313 -1.792 1.00 0.00 N ATOM 203 CA PHE A 255 -3.316 9.481 -1.061 1.00 0.00 C ATOM 204 C PHE A 255 -3.220 10.702 -1.960 1.00 0.00 C ATOM 205 O PHE A 255 -2.575 10.663 -3.008 1.00 0.00 O ATOM 206 CB PHE A 255 -1.941 9.238 -0.409 1.00 0.00 C ATOM 207 CG PHE A 255 -1.458 7.812 -0.436 1.00 0.00 C ATOM 208 CD1 PHE A 255 -2.075 6.850 0.344 1.00 0.00 C ATOM 209 CD2 PHE A 255 -0.379 7.436 -1.230 1.00 0.00 C ATOM 210 CE1 PHE A 255 -1.634 5.545 0.336 1.00 0.00 C ATOM 211 CE2 PHE A 255 0.065 6.129 -1.241 1.00 0.00 C ATOM 212 CZ PHE A 255 -0.562 5.182 -0.457 1.00 0.00 C ATOM 0 H PHE A 255 -3.174 8.001 -2.542 1.00 0.00 H new ATOM 0 HA PHE A 255 -4.052 9.663 -0.278 1.00 0.00 H new ATOM 0 HB2 PHE A 255 -1.203 9.863 -0.912 1.00 0.00 H new ATOM 0 HB3 PHE A 255 -1.986 9.569 0.628 1.00 0.00 H new ATOM 0 HD1 PHE A 255 -2.913 7.126 0.967 1.00 0.00 H new ATOM 0 HD2 PHE A 255 0.116 8.174 -1.844 1.00 0.00 H new ATOM 0 HE1 PHE A 255 -2.126 4.805 0.950 1.00 0.00 H new ATOM 0 HE2 PHE A 255 0.902 5.848 -1.863 1.00 0.00 H new ATOM 0 HZ PHE A 255 -0.216 4.159 -0.463 1.00 0.00 H new ATOM 222 N ARG A 256 -3.830 11.806 -1.525 1.00 0.00 N ATOM 223 CA ARG A 256 -3.769 13.052 -2.282 1.00 0.00 C ATOM 224 C ARG A 256 -2.320 13.365 -2.637 1.00 0.00 C ATOM 225 O ARG A 256 -2.038 14.062 -3.612 1.00 0.00 O ATOM 226 CB ARG A 256 -4.375 14.203 -1.475 1.00 0.00 C ATOM 227 CG ARG A 256 -4.699 15.430 -2.312 1.00 0.00 C ATOM 228 CD ARG A 256 -6.037 15.286 -3.020 1.00 0.00 C ATOM 229 NE ARG A 256 -6.805 16.528 -2.994 1.00 0.00 N ATOM 230 CZ ARG A 256 -7.837 16.780 -3.797 1.00 0.00 C ATOM 231 NH1 ARG A 256 -8.227 15.878 -4.691 1.00 0.00 N ATOM 232 NH2 ARG A 256 -8.481 17.935 -3.707 1.00 0.00 N ATOM 0 H ARG A 256 -4.367 11.861 -0.660 1.00 0.00 H new ATOM 0 HA ARG A 256 -4.347 12.935 -3.199 1.00 0.00 H new ATOM 0 HB2 ARG A 256 -5.286 13.854 -0.989 1.00 0.00 H new ATOM 0 HB3 ARG A 256 -3.680 14.486 -0.684 1.00 0.00 H new ATOM 0 HG2 ARG A 256 -4.718 16.313 -1.673 1.00 0.00 H new ATOM 0 HG3 ARG A 256 -3.911 15.587 -3.049 1.00 0.00 H new ATOM 0 HD2 ARG A 256 -5.870 14.985 -4.054 1.00 0.00 H new ATOM 0 HD3 ARG A 256 -6.615 14.492 -2.546 1.00 0.00 H new ATOM 0 HE ARG A 256 -6.535 17.245 -2.321 1.00 0.00 H new ATOM 0 HH11 ARG A 256 -7.735 14.987 -4.765 1.00 0.00 H new ATOM 0 HH12 ARG A 256 -9.018 16.076 -5.304 1.00 0.00 H new ATOM 0 HH21 ARG A 256 -8.186 18.631 -3.022 1.00 0.00 H new ATOM 0 HH22 ARG A 256 -9.271 18.128 -4.322 1.00 0.00 H new ATOM 246 N GLY A 257 -1.408 12.815 -1.840 1.00 0.00 N ATOM 247 CA GLY A 257 0.003 12.999 -2.065 1.00 0.00 C ATOM 248 C GLY A 257 0.480 12.239 -3.286 1.00 0.00 C ATOM 249 O GLY A 257 1.373 11.407 -3.188 1.00 0.00 O ATOM 0 H GLY A 257 -1.634 12.237 -1.031 1.00 0.00 H new ATOM 0 HA2 GLY A 257 0.216 14.061 -2.191 1.00 0.00 H new ATOM 0 HA3 GLY A 257 0.558 12.664 -1.188 1.00 0.00 H new ATOM 253 N ALA A 258 -0.129 12.522 -4.437 1.00 0.00 N ATOM 254 CA ALA A 258 0.221 11.859 -5.694 1.00 0.00 C ATOM 255 C ALA A 258 1.724 11.642 -5.802 1.00 0.00 C ATOM 256 O ALA A 258 2.182 10.592 -6.256 1.00 0.00 O ATOM 257 CB ALA A 258 -0.281 12.673 -6.876 1.00 0.00 C ATOM 0 H ALA A 258 -0.874 13.213 -4.525 1.00 0.00 H new ATOM 0 HA ALA A 258 -0.262 10.882 -5.706 1.00 0.00 H new ATOM 0 HB1 ALA A 258 -0.014 12.169 -7.805 1.00 0.00 H new ATOM 0 HB2 ALA A 258 -1.365 12.772 -6.815 1.00 0.00 H new ATOM 0 HB3 ALA A 258 0.175 13.663 -6.856 1.00 0.00 H new ATOM 263 N GLU A 259 2.487 12.635 -5.363 1.00 0.00 N ATOM 264 CA GLU A 259 3.941 12.541 -5.390 1.00 0.00 C ATOM 265 C GLU A 259 4.400 11.513 -4.367 1.00 0.00 C ATOM 266 O GLU A 259 5.229 10.652 -4.659 1.00 0.00 O ATOM 267 CB GLU A 259 4.577 13.902 -5.101 1.00 0.00 C ATOM 268 CG GLU A 259 4.354 14.924 -6.205 1.00 0.00 C ATOM 269 CD GLU A 259 5.608 15.712 -6.530 1.00 0.00 C ATOM 270 OE1 GLU A 259 6.412 15.957 -5.607 1.00 0.00 O ATOM 271 OE2 GLU A 259 5.785 16.085 -7.709 1.00 0.00 O ATOM 0 H GLU A 259 2.125 13.511 -4.986 1.00 0.00 H new ATOM 0 HA GLU A 259 4.258 12.226 -6.384 1.00 0.00 H new ATOM 0 HB2 GLU A 259 4.171 14.293 -4.168 1.00 0.00 H new ATOM 0 HB3 GLU A 259 5.648 13.769 -4.951 1.00 0.00 H new ATOM 0 HG2 GLU A 259 4.007 14.413 -7.103 1.00 0.00 H new ATOM 0 HG3 GLU A 259 3.564 15.612 -5.904 1.00 0.00 H new ATOM 278 N GLN A 260 3.825 11.594 -3.173 1.00 0.00 N ATOM 279 CA GLN A 260 4.141 10.654 -2.111 1.00 0.00 C ATOM 280 C GLN A 260 3.664 9.265 -2.510 1.00 0.00 C ATOM 281 O GLN A 260 4.317 8.268 -2.229 1.00 0.00 O ATOM 282 CB GLN A 260 3.473 11.076 -0.801 1.00 0.00 C ATOM 283 CG GLN A 260 3.618 12.558 -0.490 1.00 0.00 C ATOM 284 CD GLN A 260 3.029 12.931 0.856 1.00 0.00 C ATOM 285 OE1 GLN A 260 2.793 12.069 1.704 1.00 0.00 O ATOM 286 NE2 GLN A 260 2.787 14.220 1.059 1.00 0.00 N ATOM 0 H GLN A 260 3.137 12.303 -2.918 1.00 0.00 H new ATOM 0 HA GLN A 260 5.220 10.643 -1.958 1.00 0.00 H new ATOM 0 HB2 GLN A 260 2.413 10.825 -0.847 1.00 0.00 H new ATOM 0 HB3 GLN A 260 3.902 10.498 0.018 1.00 0.00 H new ATOM 0 HG2 GLN A 260 4.674 12.828 -0.508 1.00 0.00 H new ATOM 0 HG3 GLN A 260 3.127 13.139 -1.271 1.00 0.00 H new ATOM 0 HE21 GLN A 260 2.998 14.900 0.328 1.00 0.00 H new ATOM 0 HE22 GLN A 260 2.390 14.531 1.946 1.00 0.00 H new ATOM 295 N ALA A 261 2.519 9.222 -3.186 1.00 0.00 N ATOM 296 CA ALA A 261 1.938 7.973 -3.654 1.00 0.00 C ATOM 297 C ALA A 261 2.920 7.223 -4.545 1.00 0.00 C ATOM 298 O ALA A 261 3.129 6.021 -4.382 1.00 0.00 O ATOM 299 CB ALA A 261 0.646 8.255 -4.390 1.00 0.00 C ATOM 0 H ALA A 261 1.972 10.050 -3.423 1.00 0.00 H new ATOM 0 HA ALA A 261 1.720 7.339 -2.794 1.00 0.00 H new ATOM 0 HB1 ALA A 261 0.214 7.317 -4.739 1.00 0.00 H new ATOM 0 HB2 ALA A 261 -0.055 8.750 -3.718 1.00 0.00 H new ATOM 0 HB3 ALA A 261 0.847 8.902 -5.244 1.00 0.00 H new ATOM 305 N GLU A 262 3.536 7.945 -5.478 1.00 0.00 N ATOM 306 CA GLU A 262 4.514 7.347 -6.378 1.00 0.00 C ATOM 307 C GLU A 262 5.694 6.821 -5.575 1.00 0.00 C ATOM 308 O GLU A 262 6.033 5.640 -5.649 1.00 0.00 O ATOM 309 CB GLU A 262 4.987 8.371 -7.414 1.00 0.00 C ATOM 310 CG GLU A 262 4.409 8.146 -8.801 1.00 0.00 C ATOM 311 CD GLU A 262 4.115 9.445 -9.526 1.00 0.00 C ATOM 312 OE1 GLU A 262 3.416 10.303 -8.947 1.00 0.00 O ATOM 313 OE2 GLU A 262 4.583 9.604 -10.674 1.00 0.00 O ATOM 0 H GLU A 262 3.375 8.941 -5.629 1.00 0.00 H new ATOM 0 HA GLU A 262 4.046 6.518 -6.909 1.00 0.00 H new ATOM 0 HB2 GLU A 262 4.716 9.371 -7.074 1.00 0.00 H new ATOM 0 HB3 GLU A 262 6.075 8.339 -7.473 1.00 0.00 H new ATOM 0 HG2 GLU A 262 5.109 7.555 -9.391 1.00 0.00 H new ATOM 0 HG3 GLU A 262 3.491 7.564 -8.718 1.00 0.00 H new ATOM 320 N THR A 263 6.298 7.700 -4.783 1.00 0.00 N ATOM 321 CA THR A 263 7.416 7.312 -3.938 1.00 0.00 C ATOM 322 C THR A 263 6.951 6.271 -2.927 1.00 0.00 C ATOM 323 O THR A 263 7.729 5.432 -2.474 1.00 0.00 O ATOM 324 CB THR A 263 7.989 8.530 -3.214 1.00 0.00 C ATOM 325 OG1 THR A 263 8.388 9.523 -4.142 1.00 0.00 O ATOM 326 CG2 THR A 263 9.185 8.205 -2.347 1.00 0.00 C ATOM 0 H THR A 263 6.032 8.682 -4.710 1.00 0.00 H new ATOM 0 HA THR A 263 8.201 6.885 -4.562 1.00 0.00 H new ATOM 0 HB THR A 263 7.184 8.889 -2.573 1.00 0.00 H new ATOM 0 HG1 THR A 263 8.750 10.295 -3.659 1.00 0.00 H new ATOM 0 HG21 THR A 263 9.541 9.114 -1.863 1.00 0.00 H new ATOM 0 HG22 THR A 263 8.897 7.478 -1.587 1.00 0.00 H new ATOM 0 HG23 THR A 263 9.980 7.788 -2.965 1.00 0.00 H new ATOM 334 N VAL A 264 5.663 6.330 -2.592 1.00 0.00 N ATOM 335 CA VAL A 264 5.071 5.392 -1.653 1.00 0.00 C ATOM 336 C VAL A 264 5.128 3.980 -2.231 1.00 0.00 C ATOM 337 O VAL A 264 5.248 3.002 -1.494 1.00 0.00 O ATOM 338 CB VAL A 264 3.606 5.783 -1.300 1.00 0.00 C ATOM 339 CG1 VAL A 264 2.773 4.556 -0.955 1.00 0.00 C ATOM 340 CG2 VAL A 264 3.591 6.768 -0.140 1.00 0.00 C ATOM 0 H VAL A 264 5.011 7.022 -2.961 1.00 0.00 H new ATOM 0 HA VAL A 264 5.646 5.425 -0.728 1.00 0.00 H new ATOM 0 HB VAL A 264 3.164 6.255 -2.177 1.00 0.00 H new ATOM 0 HG11 VAL A 264 1.755 4.863 -0.713 1.00 0.00 H new ATOM 0 HG12 VAL A 264 2.754 3.877 -1.808 1.00 0.00 H new ATOM 0 HG13 VAL A 264 3.212 4.048 -0.097 1.00 0.00 H new ATOM 0 HG21 VAL A 264 2.561 7.034 0.098 1.00 0.00 H new ATOM 0 HG22 VAL A 264 4.058 6.310 0.732 1.00 0.00 H new ATOM 0 HG23 VAL A 264 4.143 7.666 -0.418 1.00 0.00 H new ATOM 350 N ARG A 265 5.061 3.887 -3.557 1.00 0.00 N ATOM 351 CA ARG A 265 5.126 2.598 -4.234 1.00 0.00 C ATOM 352 C ARG A 265 6.502 1.976 -4.042 1.00 0.00 C ATOM 353 O ARG A 265 6.631 0.883 -3.490 1.00 0.00 O ATOM 354 CB ARG A 265 4.831 2.754 -5.729 1.00 0.00 C ATOM 355 CG ARG A 265 4.052 1.583 -6.315 1.00 0.00 C ATOM 356 CD ARG A 265 4.858 0.823 -7.358 1.00 0.00 C ATOM 357 NE ARG A 265 6.165 0.409 -6.852 1.00 0.00 N ATOM 358 CZ ARG A 265 6.737 -0.763 -7.128 1.00 0.00 C ATOM 359 NH1 ARG A 265 6.133 -1.640 -7.922 1.00 0.00 N ATOM 360 NH2 ARG A 265 7.922 -1.056 -6.611 1.00 0.00 N ATOM 0 H ARG A 265 4.962 4.688 -4.181 1.00 0.00 H new ATOM 0 HA ARG A 265 4.371 1.944 -3.798 1.00 0.00 H new ATOM 0 HB2 ARG A 265 4.266 3.673 -5.887 1.00 0.00 H new ATOM 0 HB3 ARG A 265 5.772 2.862 -6.269 1.00 0.00 H new ATOM 0 HG2 ARG A 265 3.764 0.903 -5.514 1.00 0.00 H new ATOM 0 HG3 ARG A 265 3.131 1.951 -6.767 1.00 0.00 H new ATOM 0 HD2 ARG A 265 4.299 -0.056 -7.677 1.00 0.00 H new ATOM 0 HD3 ARG A 265 4.994 1.451 -8.238 1.00 0.00 H new ATOM 0 HE ARG A 265 6.672 1.058 -6.250 1.00 0.00 H new ATOM 0 HH11 ARG A 265 5.223 -1.419 -8.327 1.00 0.00 H new ATOM 0 HH12 ARG A 265 6.579 -2.534 -8.127 1.00 0.00 H new ATOM 0 HH21 ARG A 265 8.393 -0.385 -6.004 1.00 0.00 H new ATOM 0 HH22 ARG A 265 8.362 -1.952 -6.820 1.00 0.00 H new ATOM 374 N ALA A 266 7.530 2.686 -4.499 1.00 0.00 N ATOM 375 CA ALA A 266 8.901 2.211 -4.373 1.00 0.00 C ATOM 376 C ALA A 266 9.252 1.959 -2.913 1.00 0.00 C ATOM 377 O ALA A 266 9.985 1.025 -2.593 1.00 0.00 O ATOM 378 CB ALA A 266 9.866 3.214 -4.987 1.00 0.00 C ATOM 0 H ALA A 266 7.438 3.592 -4.959 1.00 0.00 H new ATOM 0 HA ALA A 266 8.989 1.268 -4.912 1.00 0.00 H new ATOM 0 HB1 ALA A 266 10.887 2.846 -4.886 1.00 0.00 H new ATOM 0 HB2 ALA A 266 9.631 3.345 -6.043 1.00 0.00 H new ATOM 0 HB3 ALA A 266 9.773 4.171 -4.473 1.00 0.00 H new ATOM 384 N GLN A 267 8.713 2.794 -2.030 1.00 0.00 N ATOM 385 CA GLN A 267 8.963 2.654 -0.603 1.00 0.00 C ATOM 386 C GLN A 267 8.444 1.310 -0.103 1.00 0.00 C ATOM 387 O GLN A 267 9.159 0.571 0.569 1.00 0.00 O ATOM 388 CB GLN A 267 8.299 3.794 0.172 1.00 0.00 C ATOM 389 CG GLN A 267 9.246 4.935 0.504 1.00 0.00 C ATOM 390 CD GLN A 267 10.123 4.635 1.703 1.00 0.00 C ATOM 391 OE1 GLN A 267 9.700 3.964 2.644 1.00 0.00 O ATOM 392 NE2 GLN A 267 11.355 5.132 1.676 1.00 0.00 N ATOM 0 H GLN A 267 8.102 3.572 -2.278 1.00 0.00 H new ATOM 0 HA GLN A 267 10.039 2.700 -0.437 1.00 0.00 H new ATOM 0 HB2 GLN A 267 7.466 4.183 -0.413 1.00 0.00 H new ATOM 0 HB3 GLN A 267 7.881 3.398 1.098 1.00 0.00 H new ATOM 0 HG2 GLN A 267 9.877 5.142 -0.360 1.00 0.00 H new ATOM 0 HG3 GLN A 267 8.667 5.838 0.699 1.00 0.00 H new ATOM 0 HE21 GLN A 267 11.665 5.683 0.876 1.00 0.00 H new ATOM 0 HE22 GLN A 267 11.991 4.962 2.456 1.00 0.00 H new ATOM 401 N LEU A 268 7.199 0.997 -0.446 1.00 0.00 N ATOM 402 CA LEU A 268 6.586 -0.265 -0.040 1.00 0.00 C ATOM 403 C LEU A 268 7.441 -1.439 -0.494 1.00 0.00 C ATOM 404 O LEU A 268 7.711 -2.353 0.279 1.00 0.00 O ATOM 405 CB LEU A 268 5.159 -0.376 -0.617 1.00 0.00 C ATOM 406 CG LEU A 268 4.021 0.094 0.307 1.00 0.00 C ATOM 407 CD1 LEU A 268 3.452 1.415 -0.175 1.00 0.00 C ATOM 408 CD2 LEU A 268 2.909 -0.953 0.394 1.00 0.00 C ATOM 0 H LEU A 268 6.594 1.599 -1.004 1.00 0.00 H new ATOM 0 HA LEU A 268 6.521 -0.289 1.048 1.00 0.00 H new ATOM 0 HB2 LEU A 268 5.115 0.204 -1.539 1.00 0.00 H new ATOM 0 HB3 LEU A 268 4.977 -1.417 -0.885 1.00 0.00 H new ATOM 0 HG LEU A 268 4.441 0.232 1.303 1.00 0.00 H new ATOM 0 HD11 LEU A 268 2.649 1.730 0.491 1.00 0.00 H new ATOM 0 HD12 LEU A 268 4.238 2.170 -0.178 1.00 0.00 H new ATOM 0 HD13 LEU A 268 3.060 1.295 -1.185 1.00 0.00 H new ATOM 0 HD21 LEU A 268 2.120 -0.592 1.054 1.00 0.00 H new ATOM 0 HD22 LEU A 268 2.498 -1.131 -0.600 1.00 0.00 H new ATOM 0 HD23 LEU A 268 3.316 -1.884 0.790 1.00 0.00 H new ATOM 420 N ALA A 269 7.877 -1.405 -1.743 1.00 0.00 N ATOM 421 CA ALA A 269 8.711 -2.473 -2.282 1.00 0.00 C ATOM 422 C ALA A 269 10.136 -2.385 -1.747 1.00 0.00 C ATOM 423 O ALA A 269 10.834 -3.394 -1.649 1.00 0.00 O ATOM 424 CB ALA A 269 8.712 -2.428 -3.802 1.00 0.00 C ATOM 0 H ALA A 269 7.670 -0.654 -2.402 1.00 0.00 H new ATOM 0 HA ALA A 269 8.289 -3.424 -1.958 1.00 0.00 H new ATOM 0 HB1 ALA A 269 9.339 -3.231 -4.189 1.00 0.00 H new ATOM 0 HB2 ALA A 269 7.694 -2.553 -4.170 1.00 0.00 H new ATOM 0 HB3 ALA A 269 9.104 -1.468 -4.137 1.00 0.00 H new ATOM 430 N PHE A 270 10.565 -1.176 -1.403 1.00 0.00 N ATOM 431 CA PHE A 270 11.909 -0.966 -0.879 1.00 0.00 C ATOM 432 C PHE A 270 11.979 -1.326 0.600 1.00 0.00 C ATOM 433 O PHE A 270 13.020 -1.762 1.093 1.00 0.00 O ATOM 434 CB PHE A 270 12.342 0.487 -1.082 1.00 0.00 C ATOM 435 CG PHE A 270 13.806 0.713 -0.838 1.00 0.00 C ATOM 436 CD1 PHE A 270 14.334 0.612 0.439 1.00 0.00 C ATOM 437 CD2 PHE A 270 14.656 1.026 -1.887 1.00 0.00 C ATOM 438 CE1 PHE A 270 15.681 0.820 0.666 1.00 0.00 C ATOM 439 CE2 PHE A 270 16.004 1.233 -1.668 1.00 0.00 C ATOM 440 CZ PHE A 270 16.518 1.130 -0.389 1.00 0.00 C ATOM 0 H PHE A 270 10.003 -0.328 -1.477 1.00 0.00 H new ATOM 0 HA PHE A 270 12.588 -1.619 -1.427 1.00 0.00 H new ATOM 0 HB2 PHE A 270 12.100 0.792 -2.100 1.00 0.00 H new ATOM 0 HB3 PHE A 270 11.767 1.127 -0.413 1.00 0.00 H new ATOM 0 HD1 PHE A 270 13.685 0.368 1.267 1.00 0.00 H new ATOM 0 HD2 PHE A 270 14.259 1.109 -2.888 1.00 0.00 H new ATOM 0 HE1 PHE A 270 16.079 0.740 1.667 1.00 0.00 H new ATOM 0 HE2 PHE A 270 16.655 1.475 -2.495 1.00 0.00 H new ATOM 0 HZ PHE A 270 17.572 1.291 -0.215 1.00 0.00 H new ATOM 450 N GLU A 271 10.868 -1.143 1.307 1.00 0.00 N ATOM 451 CA GLU A 271 10.814 -1.452 2.731 1.00 0.00 C ATOM 452 C GLU A 271 10.669 -2.952 2.960 1.00 0.00 C ATOM 453 O GLU A 271 10.932 -3.449 4.055 1.00 0.00 O ATOM 454 CB GLU A 271 9.652 -0.709 3.389 1.00 0.00 C ATOM 455 CG GLU A 271 10.087 0.244 4.488 1.00 0.00 C ATOM 456 CD GLU A 271 10.818 -0.461 5.614 1.00 0.00 C ATOM 457 OE1 GLU A 271 10.181 -1.267 6.324 1.00 0.00 O ATOM 458 OE2 GLU A 271 12.029 -0.206 5.786 1.00 0.00 O ATOM 0 H GLU A 271 9.996 -0.784 0.918 1.00 0.00 H new ATOM 0 HA GLU A 271 11.750 -1.125 3.184 1.00 0.00 H new ATOM 0 HB2 GLU A 271 9.111 -0.149 2.626 1.00 0.00 H new ATOM 0 HB3 GLU A 271 8.955 -1.436 3.805 1.00 0.00 H new ATOM 0 HG2 GLU A 271 10.734 1.011 4.064 1.00 0.00 H new ATOM 0 HG3 GLU A 271 9.211 0.753 4.891 1.00 0.00 H new ATOM 465 N GLY A 272 10.246 -3.670 1.924 1.00 0.00 N ATOM 466 CA GLY A 272 10.072 -5.104 2.043 1.00 0.00 C ATOM 467 C GLY A 272 8.641 -5.541 1.792 1.00 0.00 C ATOM 468 O GLY A 272 8.266 -6.667 2.120 1.00 0.00 O ATOM 0 H GLY A 272 10.021 -3.284 1.007 1.00 0.00 H new ATOM 0 HA2 GLY A 272 10.731 -5.606 1.335 1.00 0.00 H new ATOM 0 HA3 GLY A 272 10.375 -5.422 3.041 1.00 0.00 H new ATOM 472 N PHE A 273 7.841 -4.658 1.199 1.00 0.00 N ATOM 473 CA PHE A 273 6.454 -4.973 0.899 1.00 0.00 C ATOM 474 C PHE A 273 6.005 -4.291 -0.386 1.00 0.00 C ATOM 475 O PHE A 273 5.340 -3.259 -0.359 1.00 0.00 O ATOM 476 CB PHE A 273 5.536 -4.620 2.079 1.00 0.00 C ATOM 477 CG PHE A 273 5.445 -3.156 2.472 1.00 0.00 C ATOM 478 CD1 PHE A 273 6.571 -2.369 2.726 1.00 0.00 C ATOM 479 CD2 PHE A 273 4.197 -2.591 2.660 1.00 0.00 C ATOM 480 CE1 PHE A 273 6.433 -1.051 3.156 1.00 0.00 C ATOM 481 CE2 PHE A 273 4.064 -1.283 3.077 1.00 0.00 C ATOM 482 CZ PHE A 273 5.179 -0.517 3.327 1.00 0.00 C ATOM 0 H PHE A 273 8.132 -3.722 0.919 1.00 0.00 H new ATOM 0 HA PHE A 273 6.380 -6.049 0.742 1.00 0.00 H new ATOM 0 HB2 PHE A 273 4.531 -4.969 1.842 1.00 0.00 H new ATOM 0 HB3 PHE A 273 5.872 -5.183 2.949 1.00 0.00 H new ATOM 0 HD1 PHE A 273 7.558 -2.786 2.588 1.00 0.00 H new ATOM 0 HD2 PHE A 273 3.312 -3.183 2.477 1.00 0.00 H new ATOM 0 HE1 PHE A 273 7.309 -0.451 3.354 1.00 0.00 H new ATOM 0 HE2 PHE A 273 3.080 -0.858 3.208 1.00 0.00 H new ATOM 0 HZ PHE A 273 5.068 0.505 3.658 1.00 0.00 H new ATOM 492 N ASP A 274 6.404 -4.880 -1.511 1.00 0.00 N ATOM 493 CA ASP A 274 6.088 -4.348 -2.835 1.00 0.00 C ATOM 494 C ASP A 274 4.588 -4.308 -3.118 1.00 0.00 C ATOM 495 O ASP A 274 3.968 -5.331 -3.401 1.00 0.00 O ATOM 496 CB ASP A 274 6.790 -5.176 -3.913 1.00 0.00 C ATOM 497 CG ASP A 274 8.259 -5.397 -3.607 1.00 0.00 C ATOM 498 OD1 ASP A 274 8.568 -5.902 -2.507 1.00 0.00 O ATOM 499 OD2 ASP A 274 9.100 -5.066 -4.469 1.00 0.00 O ATOM 0 H ASP A 274 6.955 -5.738 -1.531 1.00 0.00 H new ATOM 0 HA ASP A 274 6.448 -3.319 -2.854 1.00 0.00 H new ATOM 0 HB2 ASP A 274 6.292 -6.141 -4.008 1.00 0.00 H new ATOM 0 HB3 ASP A 274 6.694 -4.672 -4.875 1.00 0.00 H new ATOM 504 N SER A 275 4.034 -3.102 -3.077 1.00 0.00 N ATOM 505 CA SER A 275 2.619 -2.865 -3.362 1.00 0.00 C ATOM 506 C SER A 275 2.457 -2.435 -4.814 1.00 0.00 C ATOM 507 O SER A 275 3.438 -2.212 -5.522 1.00 0.00 O ATOM 508 CB SER A 275 2.094 -1.756 -2.461 1.00 0.00 C ATOM 509 OG SER A 275 2.904 -0.596 -2.552 1.00 0.00 O ATOM 0 H SER A 275 4.554 -2.256 -2.844 1.00 0.00 H new ATOM 0 HA SER A 275 2.061 -3.784 -3.182 1.00 0.00 H new ATOM 0 HB2 SER A 275 1.070 -1.510 -2.741 1.00 0.00 H new ATOM 0 HB3 SER A 275 2.067 -2.104 -1.429 1.00 0.00 H new ATOM 0 HG SER A 275 2.761 -0.164 -3.420 1.00 0.00 H new ATOM 515 N LYS A 276 1.216 -2.305 -5.238 1.00 0.00 N ATOM 516 CA LYS A 276 0.907 -1.879 -6.606 1.00 0.00 C ATOM 517 C LYS A 276 -0.058 -0.691 -6.601 1.00 0.00 C ATOM 518 O LYS A 276 -1.196 -0.812 -6.150 1.00 0.00 O ATOM 519 CB LYS A 276 0.305 -3.038 -7.401 1.00 0.00 C ATOM 520 CG LYS A 276 1.340 -3.868 -8.145 1.00 0.00 C ATOM 521 CD LYS A 276 0.743 -4.537 -9.374 1.00 0.00 C ATOM 522 CE LYS A 276 0.632 -6.041 -9.192 1.00 0.00 C ATOM 523 NZ LYS A 276 1.964 -6.674 -8.981 1.00 0.00 N ATOM 0 H LYS A 276 0.396 -2.487 -4.659 1.00 0.00 H new ATOM 0 HA LYS A 276 1.837 -1.568 -7.082 1.00 0.00 H new ATOM 0 HB2 LYS A 276 -0.248 -3.686 -6.721 1.00 0.00 H new ATOM 0 HB3 LYS A 276 -0.414 -2.641 -8.118 1.00 0.00 H new ATOM 0 HG2 LYS A 276 2.171 -3.230 -8.445 1.00 0.00 H new ATOM 0 HG3 LYS A 276 1.746 -4.628 -7.477 1.00 0.00 H new ATOM 0 HD2 LYS A 276 -0.244 -4.120 -9.573 1.00 0.00 H new ATOM 0 HD3 LYS A 276 1.362 -4.320 -10.244 1.00 0.00 H new ATOM 0 HE2 LYS A 276 -0.012 -6.257 -8.340 1.00 0.00 H new ATOM 0 HE3 LYS A 276 0.157 -6.479 -10.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 276 1.950 -7.645 -9.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 276 2.693 -6.122 -9.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 276 2.180 -6.698 -7.964 1.00 0.00 H new ATOM 537 N ILE A 277 0.404 0.461 -7.094 1.00 0.00 N ATOM 538 CA ILE A 277 -0.416 1.662 -7.128 1.00 0.00 C ATOM 539 C ILE A 277 -1.306 1.727 -8.362 1.00 0.00 C ATOM 540 O ILE A 277 -1.117 0.993 -9.330 1.00 0.00 O ATOM 541 CB ILE A 277 0.444 2.935 -7.080 1.00 0.00 C ATOM 542 CG1 ILE A 277 1.373 3.012 -8.292 1.00 0.00 C ATOM 543 CG2 ILE A 277 1.236 3.006 -5.784 1.00 0.00 C ATOM 544 CD1 ILE A 277 2.180 4.291 -8.344 1.00 0.00 C ATOM 0 H ILE A 277 1.343 0.581 -7.474 1.00 0.00 H new ATOM 0 HA ILE A 277 -1.048 1.609 -6.242 1.00 0.00 H new ATOM 0 HB ILE A 277 -0.225 3.795 -7.113 1.00 0.00 H new ATOM 0 HG12 ILE A 277 2.054 2.161 -8.275 1.00 0.00 H new ATOM 0 HG13 ILE A 277 0.780 2.927 -9.202 1.00 0.00 H new ATOM 0 HG21 ILE A 277 1.837 3.916 -5.774 1.00 0.00 H new ATOM 0 HG22 ILE A 277 0.549 3.015 -4.938 1.00 0.00 H new ATOM 0 HG23 ILE A 277 1.891 2.138 -5.710 1.00 0.00 H new ATOM 0 HD11 ILE A 277 2.818 4.283 -9.227 1.00 0.00 H new ATOM 0 HD12 ILE A 277 1.505 5.145 -8.392 1.00 0.00 H new ATOM 0 HD13 ILE A 277 2.799 4.367 -7.450 1.00 0.00 H new ATOM 556 N THR A 278 -2.276 2.631 -8.301 1.00 0.00 N ATOM 557 CA THR A 278 -3.220 2.843 -9.391 1.00 0.00 C ATOM 558 C THR A 278 -4.022 4.120 -9.151 1.00 0.00 C ATOM 559 O THR A 278 -4.591 4.310 -8.079 1.00 0.00 O ATOM 560 CB THR A 278 -4.164 1.647 -9.520 1.00 0.00 C ATOM 561 OG1 THR A 278 -4.344 1.012 -8.265 1.00 0.00 O ATOM 562 CG2 THR A 278 -3.674 0.599 -10.496 1.00 0.00 C ATOM 0 H THR A 278 -2.430 3.237 -7.495 1.00 0.00 H new ATOM 0 HA THR A 278 -2.660 2.946 -10.320 1.00 0.00 H new ATOM 0 HB THR A 278 -5.101 2.059 -9.894 1.00 0.00 H new ATOM 0 HG1 THR A 278 -4.247 1.672 -7.547 1.00 0.00 H new ATOM 0 HG21 THR A 278 -4.391 -0.221 -10.539 1.00 0.00 H new ATOM 0 HG22 THR A 278 -3.571 1.044 -11.486 1.00 0.00 H new ATOM 0 HG23 THR A 278 -2.707 0.219 -10.167 1.00 0.00 H new ATOM 570 N THR A 279 -4.059 4.998 -10.146 1.00 0.00 N ATOM 571 CA THR A 279 -4.787 6.257 -10.020 1.00 0.00 C ATOM 572 C THR A 279 -6.295 6.016 -9.981 1.00 0.00 C ATOM 573 O THR A 279 -6.840 5.296 -10.816 1.00 0.00 O ATOM 574 CB THR A 279 -4.434 7.199 -11.174 1.00 0.00 C ATOM 575 OG1 THR A 279 -3.471 6.609 -12.030 1.00 0.00 O ATOM 576 CG2 THR A 279 -3.879 8.527 -10.707 1.00 0.00 C ATOM 0 H THR A 279 -3.596 4.864 -11.045 1.00 0.00 H new ATOM 0 HA THR A 279 -4.490 6.724 -9.081 1.00 0.00 H new ATOM 0 HB THR A 279 -5.372 7.376 -11.701 1.00 0.00 H new ATOM 0 HG1 THR A 279 -3.261 7.227 -12.761 1.00 0.00 H new ATOM 0 HG21 THR A 279 -3.649 9.149 -11.572 1.00 0.00 H new ATOM 0 HG22 THR A 279 -4.618 9.031 -10.084 1.00 0.00 H new ATOM 0 HG23 THR A 279 -2.970 8.359 -10.129 1.00 0.00 H new ATOM 584 N ASN A 280 -6.963 6.628 -9.004 1.00 0.00 N ATOM 585 CA ASN A 280 -8.407 6.483 -8.855 1.00 0.00 C ATOM 586 C ASN A 280 -8.897 7.268 -7.644 1.00 0.00 C ATOM 587 O ASN A 280 -8.161 7.450 -6.675 1.00 0.00 O ATOM 588 CB ASN A 280 -8.791 5.009 -8.713 1.00 0.00 C ATOM 589 CG ASN A 280 -10.086 4.681 -9.428 1.00 0.00 C ATOM 590 OD1 ASN A 280 -10.932 5.550 -9.637 1.00 0.00 O ATOM 591 ND2 ASN A 280 -10.249 3.419 -9.809 1.00 0.00 N ATOM 0 H ASN A 280 -6.526 7.228 -8.305 1.00 0.00 H new ATOM 0 HA ASN A 280 -8.883 6.881 -9.751 1.00 0.00 H new ATOM 0 HB2 ASN A 280 -7.990 4.387 -9.113 1.00 0.00 H new ATOM 0 HB3 ASN A 280 -8.889 4.762 -7.656 1.00 0.00 H new ATOM 0 HD21 ASN A 280 -11.101 3.139 -10.295 1.00 0.00 H new ATOM 0 HD22 ASN A 280 -9.522 2.730 -9.616 1.00 0.00 H new ATOM 598 N ASN A 281 -10.137 7.741 -7.709 1.00 0.00 N ATOM 599 CA ASN A 281 -10.718 8.518 -6.618 1.00 0.00 C ATOM 600 C ASN A 281 -10.035 9.879 -6.489 1.00 0.00 C ATOM 601 O ASN A 281 -10.278 10.617 -5.535 1.00 0.00 O ATOM 602 CB ASN A 281 -10.599 7.758 -5.296 1.00 0.00 C ATOM 603 CG ASN A 281 -11.171 6.356 -5.381 1.00 0.00 C ATOM 604 OD1 ASN A 281 -10.316 5.385 -5.681 1.00 0.00 O flip ATOM 605 ND2 ASN A 281 -12.368 6.149 -5.181 1.00 0.00 N flip ATOM 0 H ASN A 281 -10.759 7.601 -8.505 1.00 0.00 H new ATOM 0 HA ASN A 281 -11.772 8.676 -6.848 1.00 0.00 H new ATOM 0 HB2 ASN A 281 -9.550 7.702 -5.005 1.00 0.00 H new ATOM 0 HB3 ASN A 281 -11.118 8.312 -4.514 1.00 0.00 H new ATOM 0 HD21 ASN A 281 -12.989 6.926 -4.953 1.00 0.00 H new ATOM 0 HD22 ASN A 281 -12.739 5.201 -5.243 1.00 0.00 H new ATOM 612 N GLY A 282 -9.179 10.205 -7.454 1.00 0.00 N ATOM 613 CA GLY A 282 -8.477 11.472 -7.425 1.00 0.00 C ATOM 614 C GLY A 282 -7.019 11.320 -7.039 1.00 0.00 C ATOM 615 O GLY A 282 -6.183 12.139 -7.421 1.00 0.00 O ATOM 0 H GLY A 282 -8.960 9.612 -8.255 1.00 0.00 H new ATOM 0 HA2 GLY A 282 -8.542 11.942 -8.406 1.00 0.00 H new ATOM 0 HA3 GLY A 282 -8.969 12.140 -6.718 1.00 0.00 H new ATOM 619 N TRP A 283 -6.711 10.279 -6.269 1.00 0.00 N ATOM 620 CA TRP A 283 -5.354 10.040 -5.825 1.00 0.00 C ATOM 621 C TRP A 283 -4.920 8.598 -6.066 1.00 0.00 C ATOM 622 O TRP A 283 -5.740 7.711 -6.300 1.00 0.00 O ATOM 623 CB TRP A 283 -5.231 10.390 -4.348 1.00 0.00 C ATOM 624 CG TRP A 283 -6.368 9.909 -3.497 1.00 0.00 C ATOM 625 CD1 TRP A 283 -6.979 8.695 -3.557 1.00 0.00 C ATOM 626 CD2 TRP A 283 -7.020 10.634 -2.449 1.00 0.00 C ATOM 627 NE1 TRP A 283 -7.978 8.620 -2.617 1.00 0.00 N ATOM 628 CE2 TRP A 283 -8.022 9.798 -1.923 1.00 0.00 C ATOM 629 CE3 TRP A 283 -6.856 11.909 -1.904 1.00 0.00 C ATOM 630 CZ2 TRP A 283 -8.852 10.195 -0.878 1.00 0.00 C ATOM 631 CZ3 TRP A 283 -7.679 12.302 -0.868 1.00 0.00 C ATOM 632 CH2 TRP A 283 -8.668 11.448 -0.363 1.00 0.00 C ATOM 0 H TRP A 283 -7.389 9.590 -5.943 1.00 0.00 H new ATOM 0 HA TRP A 283 -4.691 10.678 -6.410 1.00 0.00 H new ATOM 0 HB2 TRP A 283 -4.303 9.968 -3.964 1.00 0.00 H new ATOM 0 HB3 TRP A 283 -5.153 11.473 -4.250 1.00 0.00 H new ATOM 0 HD1 TRP A 283 -6.717 7.904 -4.244 1.00 0.00 H new ATOM 0 HE1 TRP A 283 -8.587 7.817 -2.462 1.00 0.00 H new ATOM 0 HE3 TRP A 283 -6.098 12.576 -2.287 1.00 0.00 H new ATOM 0 HZ2 TRP A 283 -9.614 9.537 -0.488 1.00 0.00 H new ATOM 0 HZ3 TRP A 283 -7.558 13.286 -0.439 1.00 0.00 H new ATOM 0 HH2 TRP A 283 -9.296 11.786 0.448 1.00 0.00 H new ATOM 643 N ASN A 284 -3.610 8.389 -6.014 1.00 0.00 N ATOM 644 CA ASN A 284 -3.013 7.073 -6.229 1.00 0.00 C ATOM 645 C ASN A 284 -3.534 6.048 -5.220 1.00 0.00 C ATOM 646 O ASN A 284 -3.116 6.045 -4.064 1.00 0.00 O ATOM 647 CB ASN A 284 -1.489 7.189 -6.127 1.00 0.00 C ATOM 648 CG ASN A 284 -0.808 7.073 -7.476 1.00 0.00 C ATOM 649 OD1 ASN A 284 -0.775 5.999 -8.078 1.00 0.00 O ATOM 650 ND2 ASN A 284 -0.260 8.183 -7.959 1.00 0.00 N ATOM 0 H ASN A 284 -2.931 9.125 -5.822 1.00 0.00 H new ATOM 0 HA ASN A 284 -3.293 6.724 -7.223 1.00 0.00 H new ATOM 0 HB2 ASN A 284 -1.230 8.146 -5.674 1.00 0.00 H new ATOM 0 HB3 ASN A 284 -1.112 6.410 -5.465 1.00 0.00 H new ATOM 0 HD21 ASN A 284 0.212 8.167 -8.863 1.00 0.00 H new ATOM 0 HD22 ASN A 284 -0.311 9.051 -7.426 1.00 0.00 H new ATOM 657 N ARG A 285 -4.444 5.179 -5.666 1.00 0.00 N ATOM 658 CA ARG A 285 -5.015 4.150 -4.795 1.00 0.00 C ATOM 659 C ARG A 285 -4.203 2.856 -4.855 1.00 0.00 C ATOM 660 O ARG A 285 -4.539 1.929 -5.593 1.00 0.00 O ATOM 661 CB ARG A 285 -6.481 3.882 -5.162 1.00 0.00 C ATOM 662 CG ARG A 285 -6.681 3.245 -6.530 1.00 0.00 C ATOM 663 CD ARG A 285 -7.564 2.010 -6.443 1.00 0.00 C ATOM 664 NE ARG A 285 -8.091 1.616 -7.747 1.00 0.00 N ATOM 665 CZ ARG A 285 -9.126 0.797 -7.912 1.00 0.00 C ATOM 666 NH1 ARG A 285 -9.753 0.286 -6.859 1.00 0.00 N ATOM 667 NH2 ARG A 285 -9.539 0.486 -9.133 1.00 0.00 N ATOM 0 H ARG A 285 -4.800 5.167 -6.622 1.00 0.00 H new ATOM 0 HA ARG A 285 -4.975 4.523 -3.772 1.00 0.00 H new ATOM 0 HB2 ARG A 285 -6.919 3.232 -4.405 1.00 0.00 H new ATOM 0 HB3 ARG A 285 -7.029 4.824 -5.130 1.00 0.00 H new ATOM 0 HG2 ARG A 285 -7.132 3.970 -7.208 1.00 0.00 H new ATOM 0 HG3 ARG A 285 -5.713 2.973 -6.952 1.00 0.00 H new ATOM 0 HD2 ARG A 285 -6.991 1.185 -6.020 1.00 0.00 H new ATOM 0 HD3 ARG A 285 -8.392 2.205 -5.762 1.00 0.00 H new ATOM 0 HE ARG A 285 -7.638 1.991 -8.581 1.00 0.00 H new ATOM 0 HH11 ARG A 285 -9.442 0.521 -5.917 1.00 0.00 H new ATOM 0 HH12 ARG A 285 -10.546 -0.341 -6.993 1.00 0.00 H new ATOM 0 HH21 ARG A 285 -9.063 0.875 -9.947 1.00 0.00 H new ATOM 0 HH22 ARG A 285 -10.333 -0.142 -9.258 1.00 0.00 H new ATOM 681 N VAL A 286 -3.122 2.799 -4.082 1.00 0.00 N ATOM 682 CA VAL A 286 -2.263 1.620 -4.067 1.00 0.00 C ATOM 683 C VAL A 286 -2.917 0.415 -3.411 1.00 0.00 C ATOM 684 O VAL A 286 -3.768 0.529 -2.530 1.00 0.00 O ATOM 685 CB VAL A 286 -0.904 1.878 -3.380 1.00 0.00 C ATOM 686 CG1 VAL A 286 -1.086 2.380 -1.959 1.00 0.00 C ATOM 687 CG2 VAL A 286 -0.037 0.627 -3.385 1.00 0.00 C ATOM 0 H VAL A 286 -2.822 3.551 -3.462 1.00 0.00 H new ATOM 0 HA VAL A 286 -2.094 1.398 -5.121 1.00 0.00 H new ATOM 0 HB VAL A 286 -0.397 2.653 -3.955 1.00 0.00 H new ATOM 0 HG11 VAL A 286 -0.110 2.551 -1.506 1.00 0.00 H new ATOM 0 HG12 VAL A 286 -1.649 3.314 -1.972 1.00 0.00 H new ATOM 0 HG13 VAL A 286 -1.631 1.636 -1.377 1.00 0.00 H new ATOM 0 HG21 VAL A 286 0.913 0.841 -2.895 1.00 0.00 H new ATOM 0 HG22 VAL A 286 -0.550 -0.173 -2.851 1.00 0.00 H new ATOM 0 HG23 VAL A 286 0.148 0.316 -4.413 1.00 0.00 H new ATOM 697 N VAL A 287 -2.453 -0.735 -3.863 1.00 0.00 N ATOM 698 CA VAL A 287 -2.886 -2.042 -3.383 1.00 0.00 C ATOM 699 C VAL A 287 -1.750 -3.023 -3.626 1.00 0.00 C ATOM 700 O VAL A 287 -1.071 -2.923 -4.645 1.00 0.00 O ATOM 701 CB VAL A 287 -4.137 -2.557 -4.121 1.00 0.00 C ATOM 702 CG1 VAL A 287 -5.393 -1.842 -3.646 1.00 0.00 C ATOM 703 CG2 VAL A 287 -3.967 -2.409 -5.625 1.00 0.00 C ATOM 0 H VAL A 287 -1.745 -0.792 -4.595 1.00 0.00 H new ATOM 0 HA VAL A 287 -3.140 -1.951 -2.327 1.00 0.00 H new ATOM 0 HB VAL A 287 -4.252 -3.616 -3.889 1.00 0.00 H new ATOM 0 HG11 VAL A 287 -6.258 -2.228 -4.186 1.00 0.00 H new ATOM 0 HG12 VAL A 287 -5.527 -2.012 -2.578 1.00 0.00 H new ATOM 0 HG13 VAL A 287 -5.296 -0.773 -3.834 1.00 0.00 H new ATOM 0 HG21 VAL A 287 -4.860 -2.778 -6.130 1.00 0.00 H new ATOM 0 HG22 VAL A 287 -3.818 -1.358 -5.873 1.00 0.00 H new ATOM 0 HG23 VAL A 287 -3.101 -2.985 -5.952 1.00 0.00 H new ATOM 713 N ILE A 288 -1.526 -3.963 -2.721 1.00 0.00 N ATOM 714 CA ILE A 288 -0.438 -4.915 -2.915 1.00 0.00 C ATOM 715 C ILE A 288 -0.961 -6.222 -3.481 1.00 0.00 C ATOM 716 O ILE A 288 -2.045 -6.675 -3.112 1.00 0.00 O ATOM 717 CB ILE A 288 0.330 -5.213 -1.610 1.00 0.00 C ATOM 718 CG1 ILE A 288 0.299 -4.022 -0.655 1.00 0.00 C ATOM 719 CG2 ILE A 288 1.763 -5.621 -1.902 1.00 0.00 C ATOM 720 CD1 ILE A 288 0.855 -4.345 0.709 1.00 0.00 C ATOM 0 H ILE A 288 -2.066 -4.088 -1.865 1.00 0.00 H new ATOM 0 HA ILE A 288 0.251 -4.448 -3.619 1.00 0.00 H new ATOM 0 HB ILE A 288 -0.174 -6.047 -1.122 1.00 0.00 H new ATOM 0 HG12 ILE A 288 0.870 -3.201 -1.089 1.00 0.00 H new ATOM 0 HG13 ILE A 288 -0.729 -3.675 -0.549 1.00 0.00 H new ATOM 0 HG21 ILE A 288 2.281 -5.825 -0.965 1.00 0.00 H new ATOM 0 HG22 ILE A 288 1.767 -6.518 -2.522 1.00 0.00 H new ATOM 0 HG23 ILE A 288 2.271 -4.813 -2.429 1.00 0.00 H new ATOM 0 HD11 ILE A 288 0.805 -3.459 1.341 1.00 0.00 H new ATOM 0 HD12 ILE A 288 0.269 -5.146 1.160 1.00 0.00 H new ATOM 0 HD13 ILE A 288 1.893 -4.664 0.613 1.00 0.00 H new ATOM 732 N GLY A 289 -0.182 -6.835 -4.370 1.00 0.00 N ATOM 733 CA GLY A 289 -0.590 -8.098 -4.956 1.00 0.00 C ATOM 734 C GLY A 289 -1.126 -9.044 -3.903 1.00 0.00 C ATOM 735 O GLY A 289 -0.688 -8.994 -2.754 1.00 0.00 O ATOM 0 H GLY A 289 0.719 -6.481 -4.692 1.00 0.00 H new ATOM 0 HA2 GLY A 289 -1.355 -7.921 -5.712 1.00 0.00 H new ATOM 0 HA3 GLY A 289 0.259 -8.557 -5.463 1.00 0.00 H new ATOM 739 N PRO A 290 -2.087 -9.911 -4.250 1.00 0.00 N ATOM 740 CA PRO A 290 -2.673 -10.847 -3.295 1.00 0.00 C ATOM 741 C PRO A 290 -1.627 -11.451 -2.359 1.00 0.00 C ATOM 742 O PRO A 290 -0.915 -12.386 -2.724 1.00 0.00 O ATOM 743 CB PRO A 290 -3.283 -11.915 -4.197 1.00 0.00 C ATOM 744 CG PRO A 290 -3.672 -11.179 -5.437 1.00 0.00 C ATOM 745 CD PRO A 290 -2.690 -10.041 -5.591 1.00 0.00 C ATOM 0 HA PRO A 290 -3.393 -10.370 -2.630 1.00 0.00 H new ATOM 0 HB2 PRO A 290 -2.567 -12.708 -4.414 1.00 0.00 H new ATOM 0 HB3 PRO A 290 -4.147 -12.385 -3.727 1.00 0.00 H new ATOM 0 HG2 PRO A 290 -3.640 -11.838 -6.305 1.00 0.00 H new ATOM 0 HG3 PRO A 290 -4.692 -10.803 -5.360 1.00 0.00 H new ATOM 0 HD2 PRO A 290 -1.938 -10.262 -6.348 1.00 0.00 H new ATOM 0 HD3 PRO A 290 -3.189 -9.121 -5.896 1.00 0.00 H new ATOM 753 N VAL A 291 -1.541 -10.901 -1.152 1.00 0.00 N ATOM 754 CA VAL A 291 -0.582 -11.374 -0.156 1.00 0.00 C ATOM 755 C VAL A 291 -1.160 -12.546 0.628 1.00 0.00 C ATOM 756 O VAL A 291 -2.270 -12.997 0.351 1.00 0.00 O ATOM 757 CB VAL A 291 -0.157 -10.253 0.828 1.00 0.00 C ATOM 758 CG1 VAL A 291 1.013 -9.457 0.269 1.00 0.00 C ATOM 759 CG2 VAL A 291 -1.321 -9.324 1.153 1.00 0.00 C ATOM 0 H VAL A 291 -2.125 -10.126 -0.838 1.00 0.00 H new ATOM 0 HA VAL A 291 0.305 -11.697 -0.700 1.00 0.00 H new ATOM 0 HB VAL A 291 0.158 -10.734 1.754 1.00 0.00 H new ATOM 0 HG11 VAL A 291 1.293 -8.677 0.977 1.00 0.00 H new ATOM 0 HG12 VAL A 291 1.861 -10.122 0.107 1.00 0.00 H new ATOM 0 HG13 VAL A 291 0.724 -9.001 -0.678 1.00 0.00 H new ATOM 0 HG21 VAL A 291 -0.987 -8.551 1.845 1.00 0.00 H new ATOM 0 HG22 VAL A 291 -1.682 -8.859 0.236 1.00 0.00 H new ATOM 0 HG23 VAL A 291 -2.127 -9.897 1.611 1.00 0.00 H new ATOM 769 N LYS A 292 -0.406 -13.045 1.603 1.00 0.00 N ATOM 770 CA LYS A 292 -0.863 -14.170 2.409 1.00 0.00 C ATOM 771 C LYS A 292 0.058 -14.413 3.598 1.00 0.00 C ATOM 772 O LYS A 292 1.281 -14.348 3.474 1.00 0.00 O ATOM 773 CB LYS A 292 -0.951 -15.435 1.552 1.00 0.00 C ATOM 774 CG LYS A 292 0.391 -15.890 1.000 1.00 0.00 C ATOM 775 CD LYS A 292 0.821 -17.221 1.599 1.00 0.00 C ATOM 776 CE LYS A 292 0.465 -18.388 0.688 1.00 0.00 C ATOM 777 NZ LYS A 292 1.673 -19.134 0.243 1.00 0.00 N ATOM 0 H LYS A 292 0.517 -12.691 1.852 1.00 0.00 H new ATOM 0 HA LYS A 292 -1.853 -13.924 2.792 1.00 0.00 H new ATOM 0 HB2 LYS A 292 -1.381 -16.239 2.149 1.00 0.00 H new ATOM 0 HB3 LYS A 292 -1.634 -15.255 0.722 1.00 0.00 H new ATOM 0 HG2 LYS A 292 0.327 -15.982 -0.084 1.00 0.00 H new ATOM 0 HG3 LYS A 292 1.147 -15.134 1.211 1.00 0.00 H new ATOM 0 HD2 LYS A 292 1.897 -17.211 1.774 1.00 0.00 H new ATOM 0 HD3 LYS A 292 0.341 -17.356 2.568 1.00 0.00 H new ATOM 0 HE2 LYS A 292 -0.207 -19.066 1.213 1.00 0.00 H new ATOM 0 HE3 LYS A 292 -0.074 -18.017 -0.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 292 1.387 -19.920 -0.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 292 2.303 -18.493 -0.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 292 2.174 -19.511 1.073 1.00 0.00 H new ATOM 791 N GLY A 293 -0.541 -14.699 4.750 1.00 0.00 N ATOM 792 CA GLY A 293 0.239 -14.956 5.946 1.00 0.00 C ATOM 793 C GLY A 293 -0.395 -14.389 7.202 1.00 0.00 C ATOM 794 O GLY A 293 -0.086 -14.829 8.308 1.00 0.00 O ATOM 0 H GLY A 293 -1.552 -14.757 4.876 1.00 0.00 H new ATOM 0 HA2 GLY A 293 0.368 -16.032 6.065 1.00 0.00 H new ATOM 0 HA3 GLY A 293 1.234 -14.528 5.823 1.00 0.00 H new ATOM 798 N LYS A 294 -1.279 -13.403 7.037 1.00 0.00 N ATOM 799 CA LYS A 294 -1.946 -12.776 8.175 1.00 0.00 C ATOM 800 C LYS A 294 -0.946 -12.046 9.074 1.00 0.00 C ATOM 801 O LYS A 294 -1.295 -11.601 10.168 1.00 0.00 O ATOM 802 CB LYS A 294 -2.704 -13.825 8.990 1.00 0.00 C ATOM 803 CG LYS A 294 -4.152 -13.998 8.562 1.00 0.00 C ATOM 804 CD LYS A 294 -5.095 -13.207 9.454 1.00 0.00 C ATOM 805 CE LYS A 294 -5.409 -13.957 10.738 1.00 0.00 C ATOM 806 NZ LYS A 294 -4.285 -13.886 11.712 1.00 0.00 N ATOM 0 H LYS A 294 -1.548 -13.024 6.129 1.00 0.00 H new ATOM 0 HA LYS A 294 -2.652 -12.043 7.783 1.00 0.00 H new ATOM 0 HB2 LYS A 294 -2.191 -14.782 8.901 1.00 0.00 H new ATOM 0 HB3 LYS A 294 -2.676 -13.545 10.043 1.00 0.00 H new ATOM 0 HG2 LYS A 294 -4.268 -13.672 7.528 1.00 0.00 H new ATOM 0 HG3 LYS A 294 -4.419 -15.054 8.595 1.00 0.00 H new ATOM 0 HD2 LYS A 294 -4.646 -12.243 9.695 1.00 0.00 H new ATOM 0 HD3 LYS A 294 -6.020 -13.002 8.916 1.00 0.00 H new ATOM 0 HE2 LYS A 294 -6.309 -13.540 11.191 1.00 0.00 H new ATOM 0 HE3 LYS A 294 -5.623 -15.000 10.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 294 -4.648 -14.048 12.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 294 -3.579 -14.614 11.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 294 -3.842 -12.946 11.663 1.00 0.00 H new ATOM 820 N GLU A 295 0.294 -11.924 8.607 1.00 0.00 N ATOM 821 CA GLU A 295 1.334 -11.246 9.368 1.00 0.00 C ATOM 822 C GLU A 295 2.018 -10.188 8.512 1.00 0.00 C ATOM 823 O GLU A 295 2.114 -9.025 8.906 1.00 0.00 O ATOM 824 CB GLU A 295 2.367 -12.254 9.878 1.00 0.00 C ATOM 825 CG GLU A 295 1.796 -13.272 10.853 1.00 0.00 C ATOM 826 CD GLU A 295 2.249 -13.033 12.280 1.00 0.00 C ATOM 827 OE1 GLU A 295 1.609 -12.218 12.977 1.00 0.00 O ATOM 828 OE2 GLU A 295 3.245 -13.658 12.699 1.00 0.00 O ATOM 0 H GLU A 295 0.601 -12.287 7.704 1.00 0.00 H new ATOM 0 HA GLU A 295 0.868 -10.757 10.223 1.00 0.00 H new ATOM 0 HB2 GLU A 295 2.799 -12.781 9.027 1.00 0.00 H new ATOM 0 HB3 GLU A 295 3.180 -11.714 10.364 1.00 0.00 H new ATOM 0 HG2 GLU A 295 0.707 -13.238 10.811 1.00 0.00 H new ATOM 0 HG3 GLU A 295 2.096 -14.273 10.544 1.00 0.00 H new ATOM 835 N ASN A 296 2.486 -10.593 7.335 1.00 0.00 N ATOM 836 CA ASN A 296 3.152 -9.671 6.423 1.00 0.00 C ATOM 837 C ASN A 296 2.219 -8.525 6.059 1.00 0.00 C ATOM 838 O ASN A 296 2.565 -7.357 6.226 1.00 0.00 O ATOM 839 CB ASN A 296 3.613 -10.400 5.160 1.00 0.00 C ATOM 840 CG ASN A 296 4.894 -9.820 4.592 1.00 0.00 C ATOM 841 OD1 ASN A 296 4.864 -8.911 3.763 1.00 0.00 O ATOM 842 ND2 ASN A 296 6.029 -10.346 5.037 1.00 0.00 N ATOM 0 H ASN A 296 2.416 -11.551 6.992 1.00 0.00 H new ATOM 0 HA ASN A 296 4.030 -9.264 6.925 1.00 0.00 H new ATOM 0 HB2 ASN A 296 3.765 -11.455 5.388 1.00 0.00 H new ATOM 0 HB3 ASN A 296 2.828 -10.347 4.406 1.00 0.00 H new ATOM 0 HD21 ASN A 296 6.923 -9.997 4.691 1.00 0.00 H new ATOM 0 HD22 ASN A 296 6.007 -11.099 5.725 1.00 0.00 H new ATOM 849 N ALA A 297 1.023 -8.864 5.586 1.00 0.00 N ATOM 850 CA ALA A 297 0.035 -7.855 5.233 1.00 0.00 C ATOM 851 C ALA A 297 -0.219 -6.944 6.435 1.00 0.00 C ATOM 852 O ALA A 297 -0.386 -5.734 6.295 1.00 0.00 O ATOM 853 CB ALA A 297 -1.257 -8.520 4.782 1.00 0.00 C ATOM 0 H ALA A 297 0.717 -9.826 5.440 1.00 0.00 H new ATOM 0 HA ALA A 297 0.414 -7.252 4.408 1.00 0.00 H new ATOM 0 HB1 ALA A 297 -1.988 -7.755 4.521 1.00 0.00 H new ATOM 0 HB2 ALA A 297 -1.060 -9.146 3.912 1.00 0.00 H new ATOM 0 HB3 ALA A 297 -1.650 -9.137 5.590 1.00 0.00 H new ATOM 859 N ASP A 298 -0.224 -7.544 7.628 1.00 0.00 N ATOM 860 CA ASP A 298 -0.432 -6.800 8.867 1.00 0.00 C ATOM 861 C ASP A 298 0.714 -5.824 9.094 1.00 0.00 C ATOM 862 O ASP A 298 0.506 -4.610 9.133 1.00 0.00 O ATOM 863 CB ASP A 298 -0.554 -7.759 10.053 1.00 0.00 C ATOM 864 CG ASP A 298 -1.820 -7.532 10.855 1.00 0.00 C ATOM 865 OD1 ASP A 298 -2.041 -6.388 11.305 1.00 0.00 O ATOM 866 OD2 ASP A 298 -2.592 -8.497 11.031 1.00 0.00 O ATOM 0 H ASP A 298 -0.086 -8.546 7.759 1.00 0.00 H new ATOM 0 HA ASP A 298 -1.361 -6.236 8.781 1.00 0.00 H new ATOM 0 HB2 ASP A 298 -0.538 -8.786 9.689 1.00 0.00 H new ATOM 0 HB3 ASP A 298 0.312 -7.638 10.704 1.00 0.00 H new ATOM 871 N SER A 299 1.930 -6.351 9.217 1.00 0.00 N ATOM 872 CA SER A 299 3.099 -5.503 9.406 1.00 0.00 C ATOM 873 C SER A 299 3.216 -4.544 8.232 1.00 0.00 C ATOM 874 O SER A 299 3.697 -3.420 8.372 1.00 0.00 O ATOM 875 CB SER A 299 4.366 -6.350 9.530 1.00 0.00 C ATOM 876 OG SER A 299 4.276 -7.247 10.625 1.00 0.00 O ATOM 0 H SER A 299 2.128 -7.351 9.189 1.00 0.00 H new ATOM 0 HA SER A 299 2.983 -4.935 10.329 1.00 0.00 H new ATOM 0 HB2 SER A 299 4.524 -6.911 8.609 1.00 0.00 H new ATOM 0 HB3 SER A 299 5.231 -5.699 9.659 1.00 0.00 H new ATOM 0 HG SER A 299 5.098 -7.778 10.681 1.00 0.00 H new ATOM 882 N THR A 300 2.738 -4.999 7.075 1.00 0.00 N ATOM 883 CA THR A 300 2.747 -4.196 5.866 1.00 0.00 C ATOM 884 C THR A 300 1.931 -2.928 6.093 1.00 0.00 C ATOM 885 O THR A 300 2.277 -1.855 5.600 1.00 0.00 O ATOM 886 CB THR A 300 2.182 -5.023 4.706 1.00 0.00 C ATOM 887 OG1 THR A 300 3.197 -5.821 4.126 1.00 0.00 O ATOM 888 CG2 THR A 300 1.566 -4.203 3.597 1.00 0.00 C ATOM 0 H THR A 300 2.337 -5.929 6.955 1.00 0.00 H new ATOM 0 HA THR A 300 3.766 -3.903 5.614 1.00 0.00 H new ATOM 0 HB THR A 300 1.394 -5.626 5.156 1.00 0.00 H new ATOM 0 HG1 THR A 300 3.313 -6.638 4.655 1.00 0.00 H new ATOM 0 HG21 THR A 300 1.192 -4.867 2.818 1.00 0.00 H new ATOM 0 HG22 THR A 300 0.742 -3.612 3.996 1.00 0.00 H new ATOM 0 HG23 THR A 300 2.319 -3.537 3.175 1.00 0.00 H new ATOM 896 N LEU A 301 0.858 -3.063 6.866 1.00 0.00 N ATOM 897 CA LEU A 301 -0.001 -1.932 7.192 1.00 0.00 C ATOM 898 C LEU A 301 0.827 -0.843 7.859 1.00 0.00 C ATOM 899 O LEU A 301 0.912 0.283 7.367 1.00 0.00 O ATOM 900 CB LEU A 301 -1.125 -2.380 8.126 1.00 0.00 C ATOM 901 CG LEU A 301 -2.472 -1.692 7.908 1.00 0.00 C ATOM 902 CD1 LEU A 301 -3.472 -2.152 8.959 1.00 0.00 C ATOM 903 CD2 LEU A 301 -2.310 -0.178 7.940 1.00 0.00 C ATOM 0 H LEU A 301 0.563 -3.948 7.279 1.00 0.00 H new ATOM 0 HA LEU A 301 -0.443 -1.540 6.276 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -1.263 -3.455 8.011 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -0.810 -2.207 9.155 1.00 0.00 H new ATOM 0 HG LEU A 301 -2.853 -1.970 6.925 1.00 0.00 H new ATOM 0 HD11 LEU A 301 -4.428 -1.655 8.794 1.00 0.00 H new ATOM 0 HD12 LEU A 301 -3.606 -3.231 8.886 1.00 0.00 H new ATOM 0 HD13 LEU A 301 -3.099 -1.900 9.951 1.00 0.00 H new ATOM 0 HD21 LEU A 301 -3.279 0.295 7.783 1.00 0.00 H new ATOM 0 HD22 LEU A 301 -1.911 0.125 8.908 1.00 0.00 H new ATOM 0 HD23 LEU A 301 -1.624 0.131 7.152 1.00 0.00 H new ATOM 915 N ASN A 302 1.462 -1.205 8.968 1.00 0.00 N ATOM 916 CA ASN A 302 2.317 -0.283 9.696 1.00 0.00 C ATOM 917 C ASN A 302 3.509 0.101 8.830 1.00 0.00 C ATOM 918 O ASN A 302 4.062 1.193 8.959 1.00 0.00 O ATOM 919 CB ASN A 302 2.797 -0.926 10.999 1.00 0.00 C ATOM 920 CG ASN A 302 1.905 -0.584 12.177 1.00 0.00 C ATOM 921 OD1 ASN A 302 0.775 -1.062 12.273 1.00 0.00 O ATOM 922 ND2 ASN A 302 2.410 0.247 13.080 1.00 0.00 N ATOM 0 H ASN A 302 1.398 -2.135 9.382 1.00 0.00 H new ATOM 0 HA ASN A 302 1.749 0.615 9.940 1.00 0.00 H new ATOM 0 HB2 ASN A 302 2.831 -2.008 10.875 1.00 0.00 H new ATOM 0 HB3 ASN A 302 3.814 -0.597 11.210 1.00 0.00 H new ATOM 0 HD21 ASN A 302 1.856 0.513 13.894 1.00 0.00 H new ATOM 0 HD22 ASN A 302 3.352 0.619 12.960 1.00 0.00 H new ATOM 929 N ARG A 303 3.887 -0.808 7.936 1.00 0.00 N ATOM 930 CA ARG A 303 4.999 -0.574 7.031 1.00 0.00 C ATOM 931 C ARG A 303 4.641 0.522 6.027 1.00 0.00 C ATOM 932 O ARG A 303 5.481 1.349 5.680 1.00 0.00 O ATOM 933 CB ARG A 303 5.376 -1.873 6.317 1.00 0.00 C ATOM 934 CG ARG A 303 6.765 -2.381 6.672 1.00 0.00 C ATOM 935 CD ARG A 303 6.730 -3.833 7.123 1.00 0.00 C ATOM 936 NE ARG A 303 7.994 -4.253 7.721 1.00 0.00 N ATOM 937 CZ ARG A 303 9.065 -4.614 7.016 1.00 0.00 C ATOM 938 NH1 ARG A 303 9.030 -4.598 5.689 1.00 0.00 N ATOM 939 NH2 ARG A 303 10.173 -4.990 7.640 1.00 0.00 N ATOM 0 H ARG A 303 3.435 -1.715 7.822 1.00 0.00 H new ATOM 0 HA ARG A 303 5.862 -0.238 7.605 1.00 0.00 H new ATOM 0 HB2 ARG A 303 4.643 -2.640 6.565 1.00 0.00 H new ATOM 0 HB3 ARG A 303 5.320 -1.715 5.240 1.00 0.00 H new ATOM 0 HG2 ARG A 303 7.421 -2.283 5.807 1.00 0.00 H new ATOM 0 HG3 ARG A 303 7.188 -1.763 7.464 1.00 0.00 H new ATOM 0 HD2 ARG A 303 5.925 -3.968 7.845 1.00 0.00 H new ATOM 0 HD3 ARG A 303 6.503 -4.472 6.269 1.00 0.00 H new ATOM 0 HE ARG A 303 8.061 -4.271 8.739 1.00 0.00 H new ATOM 0 HH11 ARG A 303 8.180 -4.308 5.205 1.00 0.00 H new ATOM 0 HH12 ARG A 303 9.853 -4.875 5.154 1.00 0.00 H new ATOM 0 HH21 ARG A 303 10.205 -5.003 8.659 1.00 0.00 H new ATOM 0 HH22 ARG A 303 10.993 -5.267 7.101 1.00 0.00 H new ATOM 953 N LEU A 304 3.380 0.543 5.586 1.00 0.00 N ATOM 954 CA LEU A 304 2.911 1.567 4.651 1.00 0.00 C ATOM 955 C LEU A 304 3.161 2.951 5.232 1.00 0.00 C ATOM 956 O LEU A 304 3.355 3.918 4.496 1.00 0.00 O ATOM 957 CB LEU A 304 1.436 1.355 4.330 1.00 0.00 C ATOM 958 CG LEU A 304 1.180 0.705 2.964 1.00 0.00 C ATOM 959 CD1 LEU A 304 0.449 -0.616 3.128 1.00 0.00 C ATOM 960 CD2 LEU A 304 0.404 1.642 2.044 1.00 0.00 C ATOM 0 H LEU A 304 2.669 -0.135 5.861 1.00 0.00 H new ATOM 0 HA LEU A 304 3.468 1.485 3.717 1.00 0.00 H new ATOM 0 HB2 LEU A 304 0.992 0.731 5.106 1.00 0.00 H new ATOM 0 HB3 LEU A 304 0.926 2.318 4.364 1.00 0.00 H new ATOM 0 HG LEU A 304 2.146 0.508 2.500 1.00 0.00 H new ATOM 0 HD11 LEU A 304 0.277 -1.061 2.148 1.00 0.00 H new ATOM 0 HD12 LEU A 304 1.052 -1.293 3.733 1.00 0.00 H new ATOM 0 HD13 LEU A 304 -0.508 -0.444 3.621 1.00 0.00 H new ATOM 0 HD21 LEU A 304 0.238 1.154 1.084 1.00 0.00 H new ATOM 0 HD22 LEU A 304 -0.556 1.885 2.499 1.00 0.00 H new ATOM 0 HD23 LEU A 304 0.975 2.558 1.891 1.00 0.00 H new ATOM 972 N LYS A 305 3.207 3.029 6.559 1.00 0.00 N ATOM 973 CA LYS A 305 3.495 4.286 7.229 1.00 0.00 C ATOM 974 C LYS A 305 4.953 4.664 6.968 1.00 0.00 C ATOM 975 O LYS A 305 5.334 5.833 7.043 1.00 0.00 O ATOM 976 CB LYS A 305 3.232 4.162 8.734 1.00 0.00 C ATOM 977 CG LYS A 305 2.129 5.081 9.237 1.00 0.00 C ATOM 978 CD LYS A 305 2.607 6.520 9.345 1.00 0.00 C ATOM 979 CE LYS A 305 1.455 7.471 9.628 1.00 0.00 C ATOM 980 NZ LYS A 305 0.337 7.296 8.659 1.00 0.00 N ATOM 0 H LYS A 305 3.049 2.240 7.185 1.00 0.00 H new ATOM 0 HA LYS A 305 2.842 5.067 6.838 1.00 0.00 H new ATOM 0 HB2 LYS A 305 2.967 3.130 8.964 1.00 0.00 H new ATOM 0 HB3 LYS A 305 4.152 4.383 9.275 1.00 0.00 H new ATOM 0 HG2 LYS A 305 1.275 5.030 8.561 1.00 0.00 H new ATOM 0 HG3 LYS A 305 1.784 4.737 10.212 1.00 0.00 H new ATOM 0 HD2 LYS A 305 3.349 6.599 10.140 1.00 0.00 H new ATOM 0 HD3 LYS A 305 3.101 6.811 8.418 1.00 0.00 H new ATOM 0 HE2 LYS A 305 1.087 7.304 10.640 1.00 0.00 H new ATOM 0 HE3 LYS A 305 1.815 8.499 9.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 305 -0.268 8.142 8.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 305 0.724 7.160 7.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 305 -0.227 6.464 8.926 1.00 0.00 H new ATOM 994 N MET A 306 5.756 3.649 6.640 1.00 0.00 N ATOM 995 CA MET A 306 7.171 3.829 6.338 1.00 0.00 C ATOM 996 C MET A 306 7.344 4.507 4.986 1.00 0.00 C ATOM 997 O MET A 306 8.296 5.256 4.769 1.00 0.00 O ATOM 998 CB MET A 306 7.884 2.467 6.328 1.00 0.00 C ATOM 999 CG MET A 306 9.388 2.566 6.537 1.00 0.00 C ATOM 1000 SD MET A 306 9.826 3.404 8.074 1.00 0.00 S ATOM 1001 CE MET A 306 11.149 2.350 8.666 1.00 0.00 C ATOM 0 H MET A 306 5.440 2.681 6.577 1.00 0.00 H new ATOM 0 HA MET A 306 7.612 4.461 7.109 1.00 0.00 H new ATOM 0 HB2 MET A 306 7.458 1.837 7.109 1.00 0.00 H new ATOM 0 HB3 MET A 306 7.689 1.971 5.377 1.00 0.00 H new ATOM 0 HG2 MET A 306 9.817 1.564 6.540 1.00 0.00 H new ATOM 0 HG3 MET A 306 9.833 3.100 5.698 1.00 0.00 H new ATOM 0 HE1 MET A 306 11.527 2.737 9.612 1.00 0.00 H new ATOM 0 HE2 MET A 306 10.770 1.339 8.813 1.00 0.00 H new ATOM 0 HE3 MET A 306 11.956 2.332 7.933 1.00 0.00 H new ATOM 1011 N ALA A 307 6.416 4.228 4.079 1.00 0.00 N ATOM 1012 CA ALA A 307 6.452 4.795 2.739 1.00 0.00 C ATOM 1013 C ALA A 307 5.989 6.251 2.732 1.00 0.00 C ATOM 1014 O ALA A 307 6.261 6.989 1.785 1.00 0.00 O ATOM 1015 CB ALA A 307 5.600 3.955 1.799 1.00 0.00 C ATOM 0 H ALA A 307 5.624 3.608 4.250 1.00 0.00 H new ATOM 0 HA ALA A 307 7.485 4.782 2.392 1.00 0.00 H new ATOM 0 HB1 ALA A 307 5.631 4.385 0.798 1.00 0.00 H new ATOM 0 HB2 ALA A 307 5.987 2.937 1.769 1.00 0.00 H new ATOM 0 HB3 ALA A 307 4.570 3.941 2.156 1.00 0.00 H new ATOM 1021 N GLY A 308 5.285 6.661 3.785 1.00 0.00 N ATOM 1022 CA GLY A 308 4.801 8.026 3.862 1.00 0.00 C ATOM 1023 C GLY A 308 3.572 8.242 3.006 1.00 0.00 C ATOM 1024 O GLY A 308 3.649 8.840 1.933 1.00 0.00 O ATOM 0 H GLY A 308 5.043 6.073 4.583 1.00 0.00 H new ATOM 0 HA2 GLY A 308 4.568 8.270 4.899 1.00 0.00 H new ATOM 0 HA3 GLY A 308 5.589 8.708 3.543 1.00 0.00 H new ATOM 1028 N HIS A 309 2.436 7.740 3.476 1.00 0.00 N ATOM 1029 CA HIS A 309 1.182 7.866 2.742 1.00 0.00 C ATOM 1030 C HIS A 309 0.010 8.143 3.686 1.00 0.00 C ATOM 1031 O HIS A 309 0.087 7.862 4.882 1.00 0.00 O ATOM 1032 CB HIS A 309 0.917 6.580 1.950 1.00 0.00 C ATOM 1033 CG HIS A 309 0.178 5.541 2.742 1.00 0.00 C ATOM 1034 ND1 HIS A 309 -1.141 5.702 3.111 1.00 0.00 N ATOM 1035 CD2 HIS A 309 0.570 4.348 3.268 1.00 0.00 C ATOM 1036 CE1 HIS A 309 -1.527 4.670 3.828 1.00 0.00 C ATOM 1037 NE2 HIS A 309 -0.517 3.834 3.939 1.00 0.00 N ATOM 0 H HIS A 309 2.357 7.242 4.362 1.00 0.00 H new ATOM 0 HA HIS A 309 1.272 8.710 2.058 1.00 0.00 H new ATOM 0 HB2 HIS A 309 0.343 6.823 1.056 1.00 0.00 H new ATOM 0 HB3 HIS A 309 1.867 6.165 1.615 1.00 0.00 H new ATOM 0 HD1 HIS A 309 -1.727 6.500 2.865 1.00 0.00 H new ATOM 0 HD2 HIS A 309 1.545 3.893 3.177 1.00 0.00 H new ATOM 0 HE1 HIS A 309 -2.509 4.531 4.255 1.00 0.00 H new ATOM 1046 N THR A 310 -1.080 8.680 3.138 1.00 0.00 N ATOM 1047 CA THR A 310 -2.270 8.972 3.940 1.00 0.00 C ATOM 1048 C THR A 310 -3.482 8.157 3.468 1.00 0.00 C ATOM 1049 O THR A 310 -3.943 8.328 2.342 1.00 0.00 O ATOM 1050 CB THR A 310 -2.594 10.465 3.877 1.00 0.00 C ATOM 1051 OG1 THR A 310 -1.449 11.240 4.182 1.00 0.00 O ATOM 1052 CG2 THR A 310 -3.696 10.879 4.830 1.00 0.00 C ATOM 0 H THR A 310 -1.165 8.920 2.150 1.00 0.00 H new ATOM 0 HA THR A 310 -2.053 8.689 4.970 1.00 0.00 H new ATOM 0 HB THR A 310 -2.932 10.644 2.856 1.00 0.00 H new ATOM 0 HG1 THR A 310 -1.676 12.192 4.135 1.00 0.00 H new ATOM 0 HG21 THR A 310 -3.876 11.950 4.735 1.00 0.00 H new ATOM 0 HG22 THR A 310 -4.609 10.335 4.589 1.00 0.00 H new ATOM 0 HG23 THR A 310 -3.397 10.651 5.853 1.00 0.00 H new ATOM 1060 N ASN A 311 -3.993 7.279 4.352 1.00 0.00 N ATOM 1061 CA ASN A 311 -5.163 6.423 4.069 1.00 0.00 C ATOM 1062 C ASN A 311 -4.742 5.016 3.647 1.00 0.00 C ATOM 1063 O ASN A 311 -4.142 4.827 2.588 1.00 0.00 O ATOM 1064 CB ASN A 311 -6.079 7.034 3.000 1.00 0.00 C ATOM 1065 CG ASN A 311 -6.454 8.471 3.307 1.00 0.00 C ATOM 1066 OD1 ASN A 311 -6.845 8.798 4.428 1.00 0.00 O ATOM 1067 ND2 ASN A 311 -6.335 9.338 2.308 1.00 0.00 N ATOM 0 H ASN A 311 -3.605 7.142 5.286 1.00 0.00 H new ATOM 0 HA ASN A 311 -5.725 6.355 5.001 1.00 0.00 H new ATOM 0 HB2 ASN A 311 -5.580 6.991 2.032 1.00 0.00 H new ATOM 0 HB3 ASN A 311 -6.986 6.435 2.918 1.00 0.00 H new ATOM 0 HD21 ASN A 311 -6.572 10.319 2.454 1.00 0.00 H new ATOM 0 HD22 ASN A 311 -6.007 9.022 1.395 1.00 0.00 H new ATOM 1074 N CYS A 312 -5.058 4.029 4.491 1.00 0.00 N ATOM 1075 CA CYS A 312 -4.709 2.630 4.217 1.00 0.00 C ATOM 1076 C CYS A 312 -5.777 1.669 4.744 1.00 0.00 C ATOM 1077 O CYS A 312 -6.479 1.982 5.705 1.00 0.00 O ATOM 1078 CB CYS A 312 -3.361 2.283 4.857 1.00 0.00 C ATOM 1079 SG CYS A 312 -3.045 3.110 6.436 1.00 0.00 S ATOM 0 H CYS A 312 -5.555 4.172 5.370 1.00 0.00 H new ATOM 0 HA CYS A 312 -4.645 2.517 3.135 1.00 0.00 H new ATOM 0 HB2 CYS A 312 -3.312 1.205 5.010 1.00 0.00 H new ATOM 0 HB3 CYS A 312 -2.564 2.542 4.160 1.00 0.00 H new ATOM 0 HG CYS A 312 -1.883 2.747 6.891 1.00 0.00 H new ATOM 1085 N ILE A 313 -5.883 0.487 4.120 1.00 0.00 N ATOM 1086 CA ILE A 313 -6.846 -0.522 4.540 1.00 0.00 C ATOM 1087 C ILE A 313 -6.597 -1.817 3.787 1.00 0.00 C ATOM 1088 O ILE A 313 -6.740 -1.872 2.567 1.00 0.00 O ATOM 1089 CB ILE A 313 -8.304 -0.083 4.302 1.00 0.00 C ATOM 1090 CG1 ILE A 313 -8.425 0.717 3.002 1.00 0.00 C ATOM 1091 CG2 ILE A 313 -8.820 0.728 5.483 1.00 0.00 C ATOM 1092 CD1 ILE A 313 -9.829 1.206 2.719 1.00 0.00 C ATOM 0 H ILE A 313 -5.309 0.213 3.322 1.00 0.00 H new ATOM 0 HA ILE A 313 -6.708 -0.664 5.612 1.00 0.00 H new ATOM 0 HB ILE A 313 -8.918 -0.979 4.208 1.00 0.00 H new ATOM 0 HG12 ILE A 313 -7.753 1.574 3.049 1.00 0.00 H new ATOM 0 HG13 ILE A 313 -8.091 0.096 2.171 1.00 0.00 H new ATOM 0 HG21 ILE A 313 -9.851 1.028 5.295 1.00 0.00 H new ATOM 0 HG22 ILE A 313 -8.778 0.121 6.387 1.00 0.00 H new ATOM 0 HG23 ILE A 313 -8.201 1.616 5.613 1.00 0.00 H new ATOM 0 HD11 ILE A 313 -9.838 1.764 1.783 1.00 0.00 H new ATOM 0 HD12 ILE A 313 -10.502 0.353 2.639 1.00 0.00 H new ATOM 0 HD13 ILE A 313 -10.159 1.854 3.531 1.00 0.00 H new ATOM 1104 N ARG A 314 -6.209 -2.854 4.514 1.00 0.00 N ATOM 1105 CA ARG A 314 -5.929 -4.137 3.892 1.00 0.00 C ATOM 1106 C ARG A 314 -7.209 -4.820 3.446 1.00 0.00 C ATOM 1107 O ARG A 314 -8.142 -4.995 4.232 1.00 0.00 O ATOM 1108 CB ARG A 314 -5.128 -5.048 4.835 1.00 0.00 C ATOM 1109 CG ARG A 314 -3.839 -5.554 4.197 1.00 0.00 C ATOM 1110 CD ARG A 314 -2.594 -4.983 4.871 1.00 0.00 C ATOM 1111 NE ARG A 314 -2.787 -4.801 6.311 1.00 0.00 N ATOM 1112 CZ ARG A 314 -3.157 -5.776 7.143 1.00 0.00 C ATOM 1113 NH1 ARG A 314 -3.267 -7.027 6.715 1.00 0.00 N ATOM 1114 NH2 ARG A 314 -3.399 -5.504 8.418 1.00 0.00 N ATOM 0 H ARG A 314 -6.082 -2.832 5.526 1.00 0.00 H new ATOM 0 HA ARG A 314 -5.320 -3.948 3.008 1.00 0.00 H new ATOM 0 HB2 ARG A 314 -4.889 -4.502 5.747 1.00 0.00 H new ATOM 0 HB3 ARG A 314 -5.745 -5.898 5.125 1.00 0.00 H new ATOM 0 HG2 ARG A 314 -3.812 -6.642 4.252 1.00 0.00 H new ATOM 0 HG3 ARG A 314 -3.831 -5.288 3.140 1.00 0.00 H new ATOM 0 HD2 ARG A 314 -1.750 -5.651 4.700 1.00 0.00 H new ATOM 0 HD3 ARG A 314 -2.341 -4.026 4.415 1.00 0.00 H new ATOM 0 HE ARG A 314 -2.629 -3.872 6.702 1.00 0.00 H new ATOM 0 HH11 ARG A 314 -3.068 -7.252 5.740 1.00 0.00 H new ATOM 0 HH12 ARG A 314 -3.551 -7.764 7.361 1.00 0.00 H new ATOM 0 HH21 ARG A 314 -3.302 -4.549 8.763 1.00 0.00 H new ATOM 0 HH22 ARG A 314 -3.682 -6.250 9.054 1.00 0.00 H new ATOM 1128 N LEU A 315 -7.241 -5.212 2.176 1.00 0.00 N ATOM 1129 CA LEU A 315 -8.395 -5.893 1.616 1.00 0.00 C ATOM 1130 C LEU A 315 -8.120 -7.387 1.531 1.00 0.00 C ATOM 1131 O LEU A 315 -7.254 -7.827 0.779 1.00 0.00 O ATOM 1132 CB LEU A 315 -8.731 -5.353 0.229 1.00 0.00 C ATOM 1133 CG LEU A 315 -10.058 -4.600 0.127 1.00 0.00 C ATOM 1134 CD1 LEU A 315 -9.858 -3.123 0.430 1.00 0.00 C ATOM 1135 CD2 LEU A 315 -10.667 -4.789 -1.255 1.00 0.00 C ATOM 0 H LEU A 315 -6.477 -5.067 1.516 1.00 0.00 H new ATOM 0 HA LEU A 315 -9.248 -5.713 2.270 1.00 0.00 H new ATOM 0 HB2 LEU A 315 -7.929 -4.687 -0.088 1.00 0.00 H new ATOM 0 HB3 LEU A 315 -8.750 -6.187 -0.473 1.00 0.00 H new ATOM 0 HG LEU A 315 -10.748 -5.008 0.866 1.00 0.00 H new ATOM 0 HD11 LEU A 315 -10.813 -2.603 0.353 1.00 0.00 H new ATOM 0 HD12 LEU A 315 -9.463 -3.009 1.440 1.00 0.00 H new ATOM 0 HD13 LEU A 315 -9.154 -2.697 -0.285 1.00 0.00 H new ATOM 0 HD21 LEU A 315 -11.611 -4.248 -1.314 1.00 0.00 H new ATOM 0 HD22 LEU A 315 -9.981 -4.405 -2.010 1.00 0.00 H new ATOM 0 HD23 LEU A 315 -10.845 -5.850 -1.432 1.00 0.00 H new ATOM 1147 N ALA A 316 -8.842 -8.162 2.315 1.00 0.00 N ATOM 1148 CA ALA A 316 -8.645 -9.605 2.334 1.00 0.00 C ATOM 1149 C ALA A 316 -9.508 -10.311 1.298 1.00 0.00 C ATOM 1150 O ALA A 316 -10.675 -9.970 1.102 1.00 0.00 O ATOM 1151 CB ALA A 316 -8.913 -10.151 3.725 1.00 0.00 C ATOM 0 H ALA A 316 -9.568 -7.823 2.946 1.00 0.00 H new ATOM 0 HA ALA A 316 -7.606 -9.803 2.071 1.00 0.00 H new ATOM 0 HB1 ALA A 316 -8.763 -11.231 3.727 1.00 0.00 H new ATOM 0 HB2 ALA A 316 -8.229 -9.688 4.436 1.00 0.00 H new ATOM 0 HB3 ALA A 316 -9.940 -9.927 4.012 1.00 0.00 H new ATOM 1157 N ALA A 317 -8.917 -11.301 0.636 1.00 0.00 N ATOM 1158 CA ALA A 317 -9.613 -12.070 -0.387 1.00 0.00 C ATOM 1159 C ALA A 317 -10.883 -12.706 0.169 1.00 0.00 C ATOM 1160 O ALA A 317 -11.003 -12.926 1.374 1.00 0.00 O ATOM 1161 CB ALA A 317 -8.686 -13.138 -0.954 1.00 0.00 C ATOM 0 H ALA A 317 -7.951 -11.590 0.792 1.00 0.00 H new ATOM 0 HA ALA A 317 -9.905 -11.390 -1.187 1.00 0.00 H new ATOM 0 HB1 ALA A 317 -9.213 -13.709 -1.718 1.00 0.00 H new ATOM 0 HB2 ALA A 317 -7.810 -12.662 -1.396 1.00 0.00 H new ATOM 0 HB3 ALA A 317 -8.370 -13.808 -0.154 1.00 0.00 H new