USER MOD reduce.3.24.130724 H: found=0, std=0, add=507, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 508 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 254 THR OG1 : rot 4:sc= 1.11 USER MOD Set 1.2: A 274 GLN :FLIP amide:sc= -0.146 F(o=-0.53,f=1.4) USER MOD Set 1.3: A 285 HIS : no HD1:sc= 0.46 K(o=1.4,f=-4.9) USER MOD Set 2.1: A 239 TYR OH : rot 180:sc= 0.661 USER MOD Set 2.2: A 265 LYS NZ :NH3+ 166:sc= 1.97 (180deg=-0.232) USER MOD Single : A 244 GLN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 245 LYS NZ :NH3+ -149:sc= -0.0441 (180deg=-1.59) USER MOD Single : A 249 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 251 TYR OH : rot 180:sc= 0 USER MOD Single : A 253 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 267 THR OG1 : rot -32:sc= 0.941 USER MOD Single : A 268 LYS NZ :NH3+ -139:sc= -0.147 (180deg=-0.661) USER MOD Single : A 270 ASN : amide:sc= -1.54 K(o=-1.5,f=-3!) USER MOD Single : A 272 SER OG : rot 180:sc= 0.00052 USER MOD Single : A 279 CYS SG : rot 88:sc= 1.13 USER MOD Single : A 280 ASN :FLIP amide:sc= 0 F(o=-1.4,f=0) USER MOD Single : A 282 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 289 THR OG1 : rot 176:sc= -0.986 USER MOD Single : A 290 HIS : no HE2:sc= -0.752 X(o=-0.75,f=-0.91) USER MOD Single : A 296 GLN : amide:sc= -0.596 X(o=-0.6,f=-0.62) USER MOD Single : A 297 GLN :FLIP amide:sc= -0.169 F(o=-2.1!,f=-0.17) USER MOD Single : A 298 ASN : amide:sc= 0.314 X(o=0.31,f=-0.18) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 236 12.011 -7.245 2.887 1.00 0.00 N ATOM 2 CA GLY A 236 12.354 -6.606 1.628 1.00 0.00 C ATOM 3 C GLY A 236 11.277 -5.632 1.192 1.00 0.00 C ATOM 4 O GLY A 236 11.495 -4.424 1.195 1.00 0.00 O ATOM 0 HA2 GLY A 236 13.303 -6.080 1.732 1.00 0.00 H new ATOM 0 HA3 GLY A 236 12.493 -7.365 0.859 1.00 0.00 H new ATOM 8 N PRO A 237 10.105 -6.152 0.787 1.00 0.00 N ATOM 9 CA PRO A 237 8.896 -5.363 0.548 1.00 0.00 C ATOM 10 C PRO A 237 8.690 -4.295 1.622 1.00 0.00 C ATOM 11 O PRO A 237 8.779 -4.585 2.822 1.00 0.00 O ATOM 12 CB PRO A 237 7.770 -6.415 0.613 1.00 0.00 C ATOM 13 CG PRO A 237 8.438 -7.734 0.857 1.00 0.00 C ATOM 14 CD PRO A 237 9.876 -7.555 0.477 1.00 0.00 C ATOM 0 HA PRO A 237 8.936 -4.820 -0.396 1.00 0.00 H new ATOM 0 HB2 PRO A 237 7.066 -6.182 1.412 1.00 0.00 H new ATOM 0 HB3 PRO A 237 7.201 -6.434 -0.317 1.00 0.00 H new ATOM 0 HG2 PRO A 237 8.346 -8.029 1.902 1.00 0.00 H new ATOM 0 HG3 PRO A 237 7.974 -8.521 0.262 1.00 0.00 H new ATOM 0 HD2 PRO A 237 10.533 -8.211 1.049 1.00 0.00 H new ATOM 0 HD3 PRO A 237 10.048 -7.772 -0.577 1.00 0.00 H new ATOM 22 N ILE A 238 8.361 -3.081 1.188 1.00 0.00 N ATOM 23 CA ILE A 238 8.404 -1.917 2.075 1.00 0.00 C ATOM 24 C ILE A 238 7.180 -1.874 2.979 1.00 0.00 C ATOM 25 O ILE A 238 6.162 -2.511 2.694 1.00 0.00 O ATOM 26 CB ILE A 238 8.490 -0.596 1.302 1.00 0.00 C ATOM 27 CG1 ILE A 238 7.114 -0.024 1.001 1.00 0.00 C ATOM 28 CG2 ILE A 238 9.260 -0.787 0.010 1.00 0.00 C ATOM 29 CD1 ILE A 238 7.220 1.218 0.181 1.00 0.00 C ATOM 0 H ILE A 238 8.063 -2.876 0.234 1.00 0.00 H new ATOM 0 HA ILE A 238 9.307 -2.027 2.675 1.00 0.00 H new ATOM 0 HB ILE A 238 9.018 0.116 1.937 1.00 0.00 H new ATOM 0 HG12 ILE A 238 6.516 -0.765 0.470 1.00 0.00 H new ATOM 0 HG13 ILE A 238 6.595 0.195 1.934 1.00 0.00 H new ATOM 0 HG21 ILE A 238 9.312 0.161 -0.526 1.00 0.00 H new ATOM 0 HG22 ILE A 238 10.269 -1.132 0.235 1.00 0.00 H new ATOM 0 HG23 ILE A 238 8.754 -1.527 -0.609 1.00 0.00 H new ATOM 0 HD11 ILE A 238 6.222 1.607 -0.021 1.00 0.00 H new ATOM 0 HD12 ILE A 238 7.798 1.965 0.725 1.00 0.00 H new ATOM 0 HD13 ILE A 238 7.718 0.990 -0.762 1.00 0.00 H new ATOM 41 N TYR A 239 7.279 -1.129 4.064 1.00 0.00 N ATOM 42 CA TYR A 239 6.144 -0.913 4.933 1.00 0.00 C ATOM 43 C TYR A 239 5.670 0.512 4.780 1.00 0.00 C ATOM 44 O TYR A 239 6.398 1.441 5.083 1.00 0.00 O ATOM 45 CB TYR A 239 6.520 -1.193 6.384 1.00 0.00 C ATOM 46 CG TYR A 239 6.824 -2.642 6.633 1.00 0.00 C ATOM 47 CD1 TYR A 239 5.795 -3.558 6.733 1.00 0.00 C ATOM 48 CD2 TYR A 239 8.130 -3.095 6.753 1.00 0.00 C ATOM 49 CE1 TYR A 239 6.050 -4.893 6.942 1.00 0.00 C ATOM 50 CE2 TYR A 239 8.397 -4.430 6.967 1.00 0.00 C ATOM 51 CZ TYR A 239 7.355 -5.326 7.059 1.00 0.00 C ATOM 52 OH TYR A 239 7.620 -6.662 7.249 1.00 0.00 O ATOM 0 H TYR A 239 8.136 -0.664 4.362 1.00 0.00 H new ATOM 0 HA TYR A 239 5.342 -1.596 4.654 1.00 0.00 H new ATOM 0 HB2 TYR A 239 7.389 -0.592 6.653 1.00 0.00 H new ATOM 0 HB3 TYR A 239 5.703 -0.880 7.034 1.00 0.00 H new ATOM 0 HD1 TYR A 239 4.773 -3.220 6.646 1.00 0.00 H new ATOM 0 HD2 TYR A 239 8.947 -2.393 6.678 1.00 0.00 H new ATOM 0 HE1 TYR A 239 5.235 -5.598 7.014 1.00 0.00 H new ATOM 0 HE2 TYR A 239 9.417 -4.772 7.062 1.00 0.00 H new ATOM 0 HH TYR A 239 8.589 -6.798 7.310 1.00 0.00 H new ATOM 62 N ALA A 240 4.445 0.692 4.344 1.00 0.00 N ATOM 63 CA ALA A 240 3.957 2.018 4.050 1.00 0.00 C ATOM 64 C ALA A 240 2.853 2.415 5.007 1.00 0.00 C ATOM 65 O ALA A 240 1.810 1.770 5.077 1.00 0.00 O ATOM 66 CB ALA A 240 3.469 2.078 2.614 1.00 0.00 C ATOM 0 H ALA A 240 3.772 -0.058 4.186 1.00 0.00 H new ATOM 0 HA ALA A 240 4.775 2.727 4.177 1.00 0.00 H new ATOM 0 HB1 ALA A 240 3.101 3.081 2.396 1.00 0.00 H new ATOM 0 HB2 ALA A 240 4.291 1.839 1.940 1.00 0.00 H new ATOM 0 HB3 ALA A 240 2.663 1.358 2.473 1.00 0.00 H new ATOM 72 N ARG A 241 3.100 3.471 5.757 1.00 0.00 N ATOM 73 CA ARG A 241 2.107 4.013 6.657 1.00 0.00 C ATOM 74 C ARG A 241 1.163 4.893 5.861 1.00 0.00 C ATOM 75 O ARG A 241 1.507 6.012 5.476 1.00 0.00 O ATOM 76 CB ARG A 241 2.778 4.820 7.772 1.00 0.00 C ATOM 77 CG ARG A 241 1.789 5.404 8.782 1.00 0.00 C ATOM 78 CD ARG A 241 1.019 4.321 9.525 1.00 0.00 C ATOM 79 NE ARG A 241 1.904 3.550 10.401 1.00 0.00 N ATOM 80 CZ ARG A 241 1.499 2.798 11.422 1.00 0.00 C ATOM 81 NH1 ARG A 241 0.210 2.700 11.720 1.00 0.00 N ATOM 82 NH2 ARG A 241 2.399 2.147 12.144 1.00 0.00 N ATOM 0 H ARG A 241 3.988 3.973 5.759 1.00 0.00 H new ATOM 0 HA ARG A 241 1.549 3.200 7.122 1.00 0.00 H new ATOM 0 HB2 ARG A 241 3.486 4.179 8.298 1.00 0.00 H new ATOM 0 HB3 ARG A 241 3.353 5.632 7.327 1.00 0.00 H new ATOM 0 HG2 ARG A 241 2.328 6.022 9.500 1.00 0.00 H new ATOM 0 HG3 ARG A 241 1.086 6.057 8.264 1.00 0.00 H new ATOM 0 HD2 ARG A 241 0.224 4.776 10.116 1.00 0.00 H new ATOM 0 HD3 ARG A 241 0.541 3.654 8.808 1.00 0.00 H new ATOM 0 HE ARG A 241 2.906 3.592 10.215 1.00 0.00 H new ATOM 0 HH11 ARG A 241 -0.482 3.204 11.165 1.00 0.00 H new ATOM 0 HH12 ARG A 241 -0.089 2.121 12.504 1.00 0.00 H new ATOM 0 HH21 ARG A 241 3.390 2.225 11.915 1.00 0.00 H new ATOM 0 HH22 ARG A 241 2.101 1.568 12.929 1.00 0.00 H new ATOM 96 N VAL A 242 -0.017 4.386 5.588 1.00 0.00 N ATOM 97 CA VAL A 242 -0.947 5.111 4.754 1.00 0.00 C ATOM 98 C VAL A 242 -1.768 6.088 5.577 1.00 0.00 C ATOM 99 O VAL A 242 -2.339 5.727 6.613 1.00 0.00 O ATOM 100 CB VAL A 242 -1.873 4.187 3.945 1.00 0.00 C ATOM 101 CG1 VAL A 242 -2.612 3.204 4.839 1.00 0.00 C ATOM 102 CG2 VAL A 242 -2.852 5.027 3.149 1.00 0.00 C ATOM 0 H VAL A 242 -0.353 3.485 5.927 1.00 0.00 H new ATOM 0 HA VAL A 242 -0.344 5.667 4.036 1.00 0.00 H new ATOM 0 HB VAL A 242 -1.259 3.598 3.263 1.00 0.00 H new ATOM 0 HG11 VAL A 242 -3.255 2.570 4.229 1.00 0.00 H new ATOM 0 HG12 VAL A 242 -1.891 2.584 5.372 1.00 0.00 H new ATOM 0 HG13 VAL A 242 -3.220 3.753 5.558 1.00 0.00 H new ATOM 0 HG21 VAL A 242 -3.509 4.374 2.575 1.00 0.00 H new ATOM 0 HG22 VAL A 242 -3.448 5.634 3.830 1.00 0.00 H new ATOM 0 HG23 VAL A 242 -2.303 5.678 2.469 1.00 0.00 H new ATOM 112 N ILE A 243 -1.823 7.325 5.094 1.00 0.00 N ATOM 113 CA ILE A 243 -2.460 8.413 5.812 1.00 0.00 C ATOM 114 C ILE A 243 -3.793 8.804 5.178 1.00 0.00 C ATOM 115 O ILE A 243 -4.397 9.802 5.562 1.00 0.00 O ATOM 116 CB ILE A 243 -1.520 9.646 5.882 1.00 0.00 C ATOM 117 CG1 ILE A 243 -1.078 10.125 4.480 1.00 0.00 C ATOM 118 CG2 ILE A 243 -0.297 9.322 6.726 1.00 0.00 C ATOM 119 CD1 ILE A 243 -2.098 10.984 3.763 1.00 0.00 C ATOM 0 H ILE A 243 -1.426 7.597 4.194 1.00 0.00 H new ATOM 0 HA ILE A 243 -2.661 8.061 6.824 1.00 0.00 H new ATOM 0 HB ILE A 243 -2.083 10.457 6.344 1.00 0.00 H new ATOM 0 HG12 ILE A 243 -0.150 10.689 4.578 1.00 0.00 H new ATOM 0 HG13 ILE A 243 -0.858 9.253 3.864 1.00 0.00 H new ATOM 0 HG21 ILE A 243 0.357 10.193 6.769 1.00 0.00 H new ATOM 0 HG22 ILE A 243 -0.612 9.054 7.735 1.00 0.00 H new ATOM 0 HG23 ILE A 243 0.242 8.486 6.280 1.00 0.00 H new ATOM 0 HD11 ILE A 243 -1.707 11.276 2.788 1.00 0.00 H new ATOM 0 HD12 ILE A 243 -3.020 10.419 3.630 1.00 0.00 H new ATOM 0 HD13 ILE A 243 -2.302 11.877 4.354 1.00 0.00 H new ATOM 131 N GLN A 244 -4.249 8.008 4.219 1.00 0.00 N ATOM 132 CA GLN A 244 -5.436 8.347 3.442 1.00 0.00 C ATOM 133 C GLN A 244 -5.752 7.231 2.457 1.00 0.00 C ATOM 134 O GLN A 244 -5.195 7.181 1.365 1.00 0.00 O ATOM 135 CB GLN A 244 -5.214 9.664 2.687 1.00 0.00 C ATOM 136 CG GLN A 244 -6.442 10.183 1.956 1.00 0.00 C ATOM 137 CD GLN A 244 -6.169 11.475 1.209 1.00 0.00 C ATOM 138 OE1 GLN A 244 -5.054 11.718 0.743 1.00 0.00 O ATOM 139 NE2 GLN A 244 -7.182 12.318 1.099 1.00 0.00 N ATOM 0 H GLN A 244 -3.815 7.122 3.960 1.00 0.00 H new ATOM 0 HA GLN A 244 -6.279 8.468 4.123 1.00 0.00 H new ATOM 0 HB2 GLN A 244 -4.880 10.423 3.395 1.00 0.00 H new ATOM 0 HB3 GLN A 244 -4.409 9.524 1.966 1.00 0.00 H new ATOM 0 HG2 GLN A 244 -6.789 9.426 1.252 1.00 0.00 H new ATOM 0 HG3 GLN A 244 -7.247 10.344 2.673 1.00 0.00 H new ATOM 0 HE21 GLN A 244 -8.090 12.080 1.499 1.00 0.00 H new ATOM 0 HE22 GLN A 244 -7.056 13.207 0.614 1.00 0.00 H new ATOM 148 N LYS A 245 -6.615 6.321 2.850 1.00 0.00 N ATOM 149 CA LYS A 245 -7.050 5.266 1.957 1.00 0.00 C ATOM 150 C LYS A 245 -8.507 4.920 2.234 1.00 0.00 C ATOM 151 O LYS A 245 -9.047 5.253 3.291 1.00 0.00 O ATOM 152 CB LYS A 245 -6.135 4.041 2.078 1.00 0.00 C ATOM 153 CG LYS A 245 -5.286 3.767 0.828 1.00 0.00 C ATOM 154 CD LYS A 245 -4.069 2.910 1.176 1.00 0.00 C ATOM 155 CE LYS A 245 -3.246 2.509 -0.039 1.00 0.00 C ATOM 156 NZ LYS A 245 -2.470 1.260 0.201 1.00 0.00 N ATOM 0 H LYS A 245 -7.030 6.289 3.781 1.00 0.00 H new ATOM 0 HA LYS A 245 -6.980 5.616 0.927 1.00 0.00 H new ATOM 0 HB2 LYS A 245 -5.471 4.179 2.932 1.00 0.00 H new ATOM 0 HB3 LYS A 245 -6.746 3.163 2.288 1.00 0.00 H new ATOM 0 HG2 LYS A 245 -5.891 3.260 0.076 1.00 0.00 H new ATOM 0 HG3 LYS A 245 -4.959 4.710 0.391 1.00 0.00 H new ATOM 0 HD2 LYS A 245 -3.434 3.459 1.871 1.00 0.00 H new ATOM 0 HD3 LYS A 245 -4.403 2.010 1.693 1.00 0.00 H new ATOM 0 HE2 LYS A 245 -3.907 2.367 -0.894 1.00 0.00 H new ATOM 0 HE3 LYS A 245 -2.562 3.317 -0.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 245 -1.588 1.288 -0.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 245 -2.244 1.180 1.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 245 -3.035 0.438 -0.093 1.00 0.00 H new ATOM 170 N ARG A 246 -9.123 4.263 1.272 1.00 0.00 N ATOM 171 CA ARG A 246 -10.554 3.977 1.287 1.00 0.00 C ATOM 172 C ARG A 246 -10.783 2.498 1.560 1.00 0.00 C ATOM 173 O ARG A 246 -9.832 1.761 1.812 1.00 0.00 O ATOM 174 CB ARG A 246 -11.180 4.365 -0.058 1.00 0.00 C ATOM 175 CG ARG A 246 -10.638 3.571 -1.236 1.00 0.00 C ATOM 176 CD ARG A 246 -11.469 3.797 -2.489 1.00 0.00 C ATOM 177 NE ARG A 246 -10.812 3.283 -3.693 1.00 0.00 N ATOM 178 CZ ARG A 246 -11.370 2.432 -4.558 1.00 0.00 C ATOM 179 NH1 ARG A 246 -12.568 1.905 -4.321 1.00 0.00 N ATOM 180 NH2 ARG A 246 -10.712 2.099 -5.658 1.00 0.00 N ATOM 0 H ARG A 246 -8.643 3.906 0.446 1.00 0.00 H new ATOM 0 HA ARG A 246 -11.025 4.561 2.078 1.00 0.00 H new ATOM 0 HB2 ARG A 246 -12.259 4.223 -0.001 1.00 0.00 H new ATOM 0 HB3 ARG A 246 -11.007 5.426 -0.236 1.00 0.00 H new ATOM 0 HG2 ARG A 246 -9.604 3.860 -1.426 1.00 0.00 H new ATOM 0 HG3 ARG A 246 -10.632 2.509 -0.989 1.00 0.00 H new ATOM 0 HD2 ARG A 246 -12.438 3.312 -2.372 1.00 0.00 H new ATOM 0 HD3 ARG A 246 -11.659 4.864 -2.609 1.00 0.00 H new ATOM 0 HE ARG A 246 -9.861 3.597 -3.884 1.00 0.00 H new ATOM 0 HH11 ARG A 246 -13.073 2.149 -3.469 1.00 0.00 H new ATOM 0 HH12 ARG A 246 -12.981 1.256 -4.991 1.00 0.00 H new ATOM 0 HH21 ARG A 246 -9.788 2.492 -5.838 1.00 0.00 H new ATOM 0 HH22 ARG A 246 -11.129 1.450 -6.325 1.00 0.00 H new ATOM 194 N VAL A 247 -12.041 2.064 1.530 1.00 0.00 N ATOM 195 CA VAL A 247 -12.352 0.644 1.686 1.00 0.00 C ATOM 196 C VAL A 247 -12.723 -0.008 0.333 1.00 0.00 C ATOM 197 O VAL A 247 -13.896 -0.194 0.001 1.00 0.00 O ATOM 198 CB VAL A 247 -13.458 0.414 2.754 1.00 0.00 C ATOM 199 CG1 VAL A 247 -14.723 1.199 2.438 1.00 0.00 C ATOM 200 CG2 VAL A 247 -13.766 -1.071 2.914 1.00 0.00 C ATOM 0 H VAL A 247 -12.854 2.667 1.401 1.00 0.00 H new ATOM 0 HA VAL A 247 -11.448 0.152 2.046 1.00 0.00 H new ATOM 0 HB VAL A 247 -13.072 0.786 3.703 1.00 0.00 H new ATOM 0 HG11 VAL A 247 -15.470 1.010 3.209 1.00 0.00 H new ATOM 0 HG12 VAL A 247 -14.493 2.264 2.409 1.00 0.00 H new ATOM 0 HG13 VAL A 247 -15.113 0.886 1.470 1.00 0.00 H new ATOM 0 HG21 VAL A 247 -14.543 -1.202 3.667 1.00 0.00 H new ATOM 0 HG22 VAL A 247 -14.111 -1.476 1.962 1.00 0.00 H new ATOM 0 HG23 VAL A 247 -12.865 -1.598 3.227 1.00 0.00 H new ATOM 210 N PRO A 248 -11.701 -0.325 -0.481 1.00 0.00 N ATOM 211 CA PRO A 248 -11.821 -1.047 -1.743 1.00 0.00 C ATOM 212 C PRO A 248 -11.723 -2.548 -1.514 1.00 0.00 C ATOM 213 O PRO A 248 -11.557 -2.997 -0.386 1.00 0.00 O ATOM 214 CB PRO A 248 -10.603 -0.556 -2.550 1.00 0.00 C ATOM 215 CG PRO A 248 -9.867 0.371 -1.634 1.00 0.00 C ATOM 216 CD PRO A 248 -10.312 0.006 -0.260 1.00 0.00 C ATOM 0 HA PRO A 248 -12.773 -0.871 -2.243 1.00 0.00 H new ATOM 0 HB2 PRO A 248 -9.971 -1.390 -2.855 1.00 0.00 H new ATOM 0 HB3 PRO A 248 -10.915 -0.043 -3.460 1.00 0.00 H new ATOM 0 HG2 PRO A 248 -8.789 0.255 -1.741 1.00 0.00 H new ATOM 0 HG3 PRO A 248 -10.100 1.412 -1.859 1.00 0.00 H new ATOM 0 HD2 PRO A 248 -9.749 -0.836 0.142 1.00 0.00 H new ATOM 0 HD3 PRO A 248 -10.194 0.832 0.441 1.00 0.00 H new ATOM 224 N ASN A 249 -11.857 -3.327 -2.566 1.00 0.00 N ATOM 225 CA ASN A 249 -11.726 -4.769 -2.448 1.00 0.00 C ATOM 226 C ASN A 249 -10.769 -5.289 -3.504 1.00 0.00 C ATOM 227 O ASN A 249 -10.381 -4.564 -4.423 1.00 0.00 O ATOM 228 CB ASN A 249 -13.094 -5.444 -2.617 1.00 0.00 C ATOM 229 CG ASN A 249 -14.122 -4.976 -1.603 1.00 0.00 C ATOM 230 OD1 ASN A 249 -14.275 -5.566 -0.535 1.00 0.00 O ATOM 231 ND2 ASN A 249 -14.839 -3.911 -1.932 1.00 0.00 N ATOM 0 H ASN A 249 -12.055 -2.992 -3.509 1.00 0.00 H new ATOM 0 HA ASN A 249 -11.335 -5.003 -1.458 1.00 0.00 H new ATOM 0 HB2 ASN A 249 -13.468 -5.246 -3.622 1.00 0.00 H new ATOM 0 HB3 ASN A 249 -12.972 -6.524 -2.529 1.00 0.00 H new ATOM 0 HD21 ASN A 249 -15.547 -3.554 -1.290 1.00 0.00 H new ATOM 0 HD22 ASN A 249 -14.683 -3.448 -2.827 1.00 0.00 H new ATOM 238 N ALA A 250 -10.409 -6.559 -3.390 1.00 0.00 N ATOM 239 CA ALA A 250 -9.527 -7.202 -4.354 1.00 0.00 C ATOM 240 C ALA A 250 -10.284 -7.531 -5.635 1.00 0.00 C ATOM 241 O ALA A 250 -9.837 -8.324 -6.461 1.00 0.00 O ATOM 242 CB ALA A 250 -8.932 -8.458 -3.755 1.00 0.00 C ATOM 0 H ALA A 250 -10.717 -7.169 -2.633 1.00 0.00 H new ATOM 0 HA ALA A 250 -8.719 -6.514 -4.601 1.00 0.00 H new ATOM 0 HB1 ALA A 250 -8.274 -8.932 -4.483 1.00 0.00 H new ATOM 0 HB2 ALA A 250 -8.361 -8.200 -2.863 1.00 0.00 H new ATOM 0 HB3 ALA A 250 -9.732 -9.148 -3.487 1.00 0.00 H new ATOM 248 N TYR A 251 -11.449 -6.928 -5.770 1.00 0.00 N ATOM 249 CA TYR A 251 -12.257 -7.043 -6.959 1.00 0.00 C ATOM 250 C TYR A 251 -12.270 -5.703 -7.675 1.00 0.00 C ATOM 251 O TYR A 251 -12.898 -5.534 -8.720 1.00 0.00 O ATOM 252 CB TYR A 251 -13.662 -7.468 -6.567 1.00 0.00 C ATOM 253 CG TYR A 251 -13.668 -8.663 -5.643 1.00 0.00 C ATOM 254 CD1 TYR A 251 -13.217 -9.896 -6.084 1.00 0.00 C ATOM 255 CD2 TYR A 251 -14.096 -8.550 -4.325 1.00 0.00 C ATOM 256 CE1 TYR A 251 -13.190 -10.987 -5.239 1.00 0.00 C ATOM 257 CE2 TYR A 251 -14.077 -9.640 -3.475 1.00 0.00 C ATOM 258 CZ TYR A 251 -13.620 -10.856 -3.938 1.00 0.00 C ATOM 259 OH TYR A 251 -13.579 -11.943 -3.090 1.00 0.00 O ATOM 0 H TYR A 251 -11.862 -6.339 -5.047 1.00 0.00 H new ATOM 0 HA TYR A 251 -11.846 -7.795 -7.633 1.00 0.00 H new ATOM 0 HB2 TYR A 251 -14.168 -6.634 -6.081 1.00 0.00 H new ATOM 0 HB3 TYR A 251 -14.231 -7.705 -7.466 1.00 0.00 H new ATOM 0 HD1 TYR A 251 -12.881 -10.005 -7.105 1.00 0.00 H new ATOM 0 HD2 TYR A 251 -14.448 -7.597 -3.960 1.00 0.00 H new ATOM 0 HE1 TYR A 251 -12.832 -11.941 -5.598 1.00 0.00 H new ATOM 0 HE2 TYR A 251 -14.418 -9.540 -2.455 1.00 0.00 H new ATOM 0 HH TYR A 251 -13.916 -11.682 -2.208 1.00 0.00 H new ATOM 269 N ASP A 252 -11.532 -4.759 -7.101 1.00 0.00 N ATOM 270 CA ASP A 252 -11.417 -3.413 -7.647 1.00 0.00 C ATOM 271 C ASP A 252 -10.168 -3.339 -8.497 1.00 0.00 C ATOM 272 O ASP A 252 -9.353 -2.426 -8.349 1.00 0.00 O ATOM 273 CB ASP A 252 -11.326 -2.381 -6.519 1.00 0.00 C ATOM 274 CG ASP A 252 -12.662 -2.056 -5.888 1.00 0.00 C ATOM 275 OD1 ASP A 252 -13.082 -2.779 -4.962 1.00 0.00 O ATOM 276 OD2 ASP A 252 -13.289 -1.058 -6.298 1.00 0.00 O ATOM 0 H ASP A 252 -10.997 -4.906 -6.245 1.00 0.00 H new ATOM 0 HA ASP A 252 -12.299 -3.193 -8.248 1.00 0.00 H new ATOM 0 HB2 ASP A 252 -10.651 -2.755 -5.749 1.00 0.00 H new ATOM 0 HB3 ASP A 252 -10.886 -1.464 -6.911 1.00 0.00 H new ATOM 281 N LYS A 253 -10.028 -4.320 -9.383 1.00 0.00 N ATOM 282 CA LYS A 253 -8.769 -4.573 -10.070 1.00 0.00 C ATOM 283 C LYS A 253 -7.717 -4.893 -9.016 1.00 0.00 C ATOM 284 O LYS A 253 -6.544 -4.540 -9.144 1.00 0.00 O ATOM 285 CB LYS A 253 -8.347 -3.380 -10.938 1.00 0.00 C ATOM 286 CG LYS A 253 -9.445 -2.893 -11.877 1.00 0.00 C ATOM 287 CD LYS A 253 -9.987 -4.018 -12.744 1.00 0.00 C ATOM 288 CE LYS A 253 -11.211 -3.572 -13.525 1.00 0.00 C ATOM 289 NZ LYS A 253 -11.774 -4.669 -14.356 1.00 0.00 N ATOM 0 H LYS A 253 -10.780 -4.958 -9.643 1.00 0.00 H new ATOM 0 HA LYS A 253 -8.884 -5.416 -10.751 1.00 0.00 H new ATOM 0 HB2 LYS A 253 -8.044 -2.558 -10.289 1.00 0.00 H new ATOM 0 HB3 LYS A 253 -7.474 -3.660 -11.527 1.00 0.00 H new ATOM 0 HG2 LYS A 253 -10.257 -2.461 -11.293 1.00 0.00 H new ATOM 0 HG3 LYS A 253 -9.053 -2.100 -12.514 1.00 0.00 H new ATOM 0 HD2 LYS A 253 -9.214 -4.352 -13.436 1.00 0.00 H new ATOM 0 HD3 LYS A 253 -10.244 -4.872 -12.117 1.00 0.00 H new ATOM 0 HE2 LYS A 253 -11.973 -3.215 -12.832 1.00 0.00 H new ATOM 0 HE3 LYS A 253 -10.945 -2.732 -14.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 253 -12.607 -4.321 -14.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 253 -11.057 -4.993 -15.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 253 -12.052 -5.461 -13.743 1.00 0.00 H new ATOM 303 N THR A 254 -8.198 -5.553 -7.960 1.00 0.00 N ATOM 304 CA THR A 254 -7.420 -5.949 -6.795 1.00 0.00 C ATOM 305 C THR A 254 -6.800 -4.746 -6.090 1.00 0.00 C ATOM 306 O THR A 254 -5.614 -4.449 -6.239 1.00 0.00 O ATOM 307 CB THR A 254 -6.344 -7.014 -7.107 1.00 0.00 C ATOM 308 OG1 THR A 254 -5.344 -6.517 -8.013 1.00 0.00 O ATOM 309 CG2 THR A 254 -6.976 -8.262 -7.696 1.00 0.00 C ATOM 0 H THR A 254 -9.176 -5.834 -7.895 1.00 0.00 H new ATOM 0 HA THR A 254 -8.134 -6.416 -6.116 1.00 0.00 H new ATOM 0 HB THR A 254 -5.861 -7.260 -6.161 1.00 0.00 H new ATOM 0 HG1 THR A 254 -5.514 -5.570 -8.201 1.00 0.00 H new ATOM 0 HG21 THR A 254 -6.200 -8.998 -7.908 1.00 0.00 H new ATOM 0 HG22 THR A 254 -7.688 -8.680 -6.984 1.00 0.00 H new ATOM 0 HG23 THR A 254 -7.495 -8.006 -8.620 1.00 0.00 H new ATOM 317 N ALA A 255 -7.624 -4.043 -5.332 1.00 0.00 N ATOM 318 CA ALA A 255 -7.157 -2.915 -4.539 1.00 0.00 C ATOM 319 C ALA A 255 -7.251 -3.228 -3.046 1.00 0.00 C ATOM 320 O ALA A 255 -8.047 -4.065 -2.626 1.00 0.00 O ATOM 321 CB ALA A 255 -7.944 -1.668 -4.881 1.00 0.00 C ATOM 0 H ALA A 255 -8.623 -4.233 -5.248 1.00 0.00 H new ATOM 0 HA ALA A 255 -6.109 -2.734 -4.779 1.00 0.00 H new ATOM 0 HB1 ALA A 255 -7.583 -0.834 -4.280 1.00 0.00 H new ATOM 0 HB2 ALA A 255 -7.816 -1.436 -5.938 1.00 0.00 H new ATOM 0 HB3 ALA A 255 -9.000 -1.836 -4.672 1.00 0.00 H new ATOM 327 N LEU A 256 -6.420 -2.558 -2.258 1.00 0.00 N ATOM 328 CA LEU A 256 -6.311 -2.835 -0.826 1.00 0.00 C ATOM 329 C LEU A 256 -7.392 -2.100 -0.036 1.00 0.00 C ATOM 330 O LEU A 256 -7.591 -0.910 -0.232 1.00 0.00 O ATOM 331 CB LEU A 256 -4.940 -2.378 -0.304 1.00 0.00 C ATOM 332 CG LEU A 256 -4.290 -3.262 0.768 1.00 0.00 C ATOM 333 CD1 LEU A 256 -5.294 -3.672 1.812 1.00 0.00 C ATOM 334 CD2 LEU A 256 -3.728 -4.490 0.150 1.00 0.00 C ATOM 0 H LEU A 256 -5.806 -1.813 -2.587 1.00 0.00 H new ATOM 0 HA LEU A 256 -6.433 -3.910 -0.690 1.00 0.00 H new ATOM 0 HB2 LEU A 256 -4.257 -2.310 -1.151 1.00 0.00 H new ATOM 0 HB3 LEU A 256 -5.047 -1.372 0.101 1.00 0.00 H new ATOM 0 HG LEU A 256 -3.497 -2.680 1.237 1.00 0.00 H new ATOM 0 HD11 LEU A 256 -4.807 -4.298 2.560 1.00 0.00 H new ATOM 0 HD12 LEU A 256 -5.702 -2.783 2.293 1.00 0.00 H new ATOM 0 HD13 LEU A 256 -6.101 -4.232 1.340 1.00 0.00 H new ATOM 0 HD21 LEU A 256 -3.270 -5.109 0.922 1.00 0.00 H new ATOM 0 HD22 LEU A 256 -4.526 -5.050 -0.337 1.00 0.00 H new ATOM 0 HD23 LEU A 256 -2.975 -4.214 -0.588 1.00 0.00 H new ATOM 346 N ALA A 257 -8.047 -2.807 0.877 1.00 0.00 N ATOM 347 CA ALA A 257 -8.972 -2.196 1.822 1.00 0.00 C ATOM 348 C ALA A 257 -8.226 -1.808 3.086 1.00 0.00 C ATOM 349 O ALA A 257 -7.916 -2.650 3.932 1.00 0.00 O ATOM 350 CB ALA A 257 -10.117 -3.136 2.151 1.00 0.00 C ATOM 0 H ALA A 257 -7.952 -3.817 0.983 1.00 0.00 H new ATOM 0 HA ALA A 257 -9.396 -1.302 1.365 1.00 0.00 H new ATOM 0 HB1 ALA A 257 -10.792 -2.654 2.858 1.00 0.00 H new ATOM 0 HB2 ALA A 257 -10.661 -3.380 1.239 1.00 0.00 H new ATOM 0 HB3 ALA A 257 -9.721 -4.051 2.593 1.00 0.00 H new ATOM 356 N LEU A 258 -7.923 -0.530 3.181 1.00 0.00 N ATOM 357 CA LEU A 258 -7.112 0.013 4.271 1.00 0.00 C ATOM 358 C LEU A 258 -7.382 1.514 4.419 1.00 0.00 C ATOM 359 O LEU A 258 -8.009 2.109 3.558 1.00 0.00 O ATOM 360 CB LEU A 258 -5.613 -0.284 4.044 1.00 0.00 C ATOM 361 CG LEU A 258 -5.179 -0.604 2.625 1.00 0.00 C ATOM 362 CD1 LEU A 258 -5.710 0.403 1.629 1.00 0.00 C ATOM 363 CD2 LEU A 258 -3.670 -0.647 2.569 1.00 0.00 C ATOM 0 H LEU A 258 -8.229 0.171 2.506 1.00 0.00 H new ATOM 0 HA LEU A 258 -7.393 -0.475 5.204 1.00 0.00 H new ATOM 0 HB2 LEU A 258 -5.042 0.579 4.386 1.00 0.00 H new ATOM 0 HB3 LEU A 258 -5.334 -1.124 4.681 1.00 0.00 H new ATOM 0 HG LEU A 258 -5.593 -1.574 2.351 1.00 0.00 H new ATOM 0 HD11 LEU A 258 -5.375 0.135 0.627 1.00 0.00 H new ATOM 0 HD12 LEU A 258 -6.800 0.405 1.659 1.00 0.00 H new ATOM 0 HD13 LEU A 258 -5.339 1.396 1.882 1.00 0.00 H new ATOM 0 HD21 LEU A 258 -3.350 -0.876 1.553 1.00 0.00 H new ATOM 0 HD22 LEU A 258 -3.267 0.321 2.866 1.00 0.00 H new ATOM 0 HD23 LEU A 258 -3.303 -1.417 3.248 1.00 0.00 H new ATOM 375 N GLU A 259 -6.899 2.132 5.486 1.00 0.00 N ATOM 376 CA GLU A 259 -7.445 3.404 5.925 1.00 0.00 C ATOM 377 C GLU A 259 -6.353 4.351 6.448 1.00 0.00 C ATOM 378 O GLU A 259 -5.189 3.970 6.564 1.00 0.00 O ATOM 379 CB GLU A 259 -8.491 3.088 7.007 1.00 0.00 C ATOM 380 CG GLU A 259 -8.980 4.271 7.815 1.00 0.00 C ATOM 381 CD GLU A 259 -9.997 3.867 8.856 1.00 0.00 C ATOM 382 OE1 GLU A 259 -9.588 3.366 9.925 1.00 0.00 O ATOM 383 OE2 GLU A 259 -11.209 4.031 8.605 1.00 0.00 O ATOM 0 H GLU A 259 -6.135 1.775 6.060 1.00 0.00 H new ATOM 0 HA GLU A 259 -7.904 3.930 5.087 1.00 0.00 H new ATOM 0 HB2 GLU A 259 -9.351 2.618 6.529 1.00 0.00 H new ATOM 0 HB3 GLU A 259 -8.067 2.354 7.692 1.00 0.00 H new ATOM 0 HG2 GLU A 259 -8.132 4.751 8.304 1.00 0.00 H new ATOM 0 HG3 GLU A 259 -9.421 5.009 7.145 1.00 0.00 H new ATOM 390 N VAL A 260 -6.748 5.591 6.740 1.00 0.00 N ATOM 391 CA VAL A 260 -5.871 6.593 7.337 1.00 0.00 C ATOM 392 C VAL A 260 -5.245 6.088 8.636 1.00 0.00 C ATOM 393 O VAL A 260 -5.952 5.769 9.592 1.00 0.00 O ATOM 394 CB VAL A 260 -6.661 7.880 7.657 1.00 0.00 C ATOM 395 CG1 VAL A 260 -5.745 8.951 8.232 1.00 0.00 C ATOM 396 CG2 VAL A 260 -7.390 8.384 6.421 1.00 0.00 C ATOM 0 H VAL A 260 -7.695 5.929 6.566 1.00 0.00 H new ATOM 0 HA VAL A 260 -5.084 6.798 6.611 1.00 0.00 H new ATOM 0 HB VAL A 260 -7.409 7.643 8.414 1.00 0.00 H new ATOM 0 HG11 VAL A 260 -6.325 9.848 8.449 1.00 0.00 H new ATOM 0 HG12 VAL A 260 -5.287 8.584 9.151 1.00 0.00 H new ATOM 0 HG13 VAL A 260 -4.965 9.190 7.509 1.00 0.00 H new ATOM 0 HG21 VAL A 260 -7.941 9.292 6.668 1.00 0.00 H new ATOM 0 HG22 VAL A 260 -6.667 8.601 5.635 1.00 0.00 H new ATOM 0 HG23 VAL A 260 -8.086 7.621 6.073 1.00 0.00 H new ATOM 406 N GLY A 261 -3.924 5.998 8.652 1.00 0.00 N ATOM 407 CA GLY A 261 -3.206 5.687 9.867 1.00 0.00 C ATOM 408 C GLY A 261 -2.751 4.254 9.891 1.00 0.00 C ATOM 409 O GLY A 261 -2.088 3.818 10.832 1.00 0.00 O ATOM 0 H GLY A 261 -3.331 6.137 7.833 1.00 0.00 H new ATOM 0 HA2 GLY A 261 -2.342 6.345 9.958 1.00 0.00 H new ATOM 0 HA3 GLY A 261 -3.846 5.880 10.728 1.00 0.00 H new ATOM 413 N GLU A 262 -3.097 3.515 8.849 1.00 0.00 N ATOM 414 CA GLU A 262 -2.835 2.085 8.830 1.00 0.00 C ATOM 415 C GLU A 262 -1.539 1.787 8.102 1.00 0.00 C ATOM 416 O GLU A 262 -0.918 2.681 7.529 1.00 0.00 O ATOM 417 CB GLU A 262 -3.990 1.331 8.183 1.00 0.00 C ATOM 418 CG GLU A 262 -5.315 1.581 8.870 1.00 0.00 C ATOM 419 CD GLU A 262 -6.286 0.434 8.689 1.00 0.00 C ATOM 420 OE1 GLU A 262 -6.910 0.335 7.618 1.00 0.00 O ATOM 421 OE2 GLU A 262 -6.418 -0.384 9.625 1.00 0.00 O ATOM 0 H GLU A 262 -3.556 3.877 8.013 1.00 0.00 H new ATOM 0 HA GLU A 262 -2.738 1.747 9.862 1.00 0.00 H new ATOM 0 HB2 GLU A 262 -4.068 1.625 7.136 1.00 0.00 H new ATOM 0 HB3 GLU A 262 -3.774 0.263 8.199 1.00 0.00 H new ATOM 0 HG2 GLU A 262 -5.144 1.744 9.934 1.00 0.00 H new ATOM 0 HG3 GLU A 262 -5.759 2.495 8.475 1.00 0.00 H new ATOM 428 N LEU A 263 -1.124 0.536 8.139 1.00 0.00 N ATOM 429 CA LEU A 263 0.105 0.133 7.492 1.00 0.00 C ATOM 430 C LEU A 263 -0.165 -0.874 6.385 1.00 0.00 C ATOM 431 O LEU A 263 -1.193 -1.554 6.374 1.00 0.00 O ATOM 432 CB LEU A 263 1.076 -0.445 8.517 1.00 0.00 C ATOM 433 CG LEU A 263 2.389 -0.969 7.936 1.00 0.00 C ATOM 434 CD1 LEU A 263 3.255 0.178 7.459 1.00 0.00 C ATOM 435 CD2 LEU A 263 3.139 -1.810 8.940 1.00 0.00 C ATOM 0 H LEU A 263 -1.622 -0.218 8.611 1.00 0.00 H new ATOM 0 HA LEU A 263 0.557 1.015 7.039 1.00 0.00 H new ATOM 0 HB2 LEU A 263 1.304 0.325 9.255 1.00 0.00 H new ATOM 0 HB3 LEU A 263 0.580 -1.258 9.047 1.00 0.00 H new ATOM 0 HG LEU A 263 2.144 -1.603 7.084 1.00 0.00 H new ATOM 0 HD11 LEU A 263 4.185 -0.215 7.049 1.00 0.00 H new ATOM 0 HD12 LEU A 263 2.726 0.737 6.688 1.00 0.00 H new ATOM 0 HD13 LEU A 263 3.478 0.838 8.297 1.00 0.00 H new ATOM 0 HD21 LEU A 263 4.068 -2.167 8.494 1.00 0.00 H new ATOM 0 HD22 LEU A 263 3.366 -1.209 9.821 1.00 0.00 H new ATOM 0 HD23 LEU A 263 2.525 -2.663 9.231 1.00 0.00 H new ATOM 447 N VAL A 264 0.771 -0.953 5.459 1.00 0.00 N ATOM 448 CA VAL A 264 0.647 -1.823 4.310 1.00 0.00 C ATOM 449 C VAL A 264 2.025 -2.238 3.816 1.00 0.00 C ATOM 450 O VAL A 264 2.849 -1.399 3.450 1.00 0.00 O ATOM 451 CB VAL A 264 -0.165 -1.164 3.165 1.00 0.00 C ATOM 452 CG1 VAL A 264 0.334 0.240 2.857 1.00 0.00 C ATOM 453 CG2 VAL A 264 -0.119 -2.024 1.915 1.00 0.00 C ATOM 0 H VAL A 264 1.638 -0.415 5.484 1.00 0.00 H new ATOM 0 HA VAL A 264 0.097 -2.709 4.626 1.00 0.00 H new ATOM 0 HB VAL A 264 -1.198 -1.083 3.502 1.00 0.00 H new ATOM 0 HG11 VAL A 264 -0.260 0.668 2.050 1.00 0.00 H new ATOM 0 HG12 VAL A 264 0.240 0.863 3.747 1.00 0.00 H new ATOM 0 HG13 VAL A 264 1.380 0.196 2.554 1.00 0.00 H new ATOM 0 HG21 VAL A 264 -0.694 -1.545 1.123 1.00 0.00 H new ATOM 0 HG22 VAL A 264 0.915 -2.142 1.592 1.00 0.00 H new ATOM 0 HG23 VAL A 264 -0.545 -3.004 2.131 1.00 0.00 H new ATOM 463 N LYS A 265 2.277 -3.528 3.835 1.00 0.00 N ATOM 464 CA LYS A 265 3.528 -4.071 3.350 1.00 0.00 C ATOM 465 C LYS A 265 3.429 -4.320 1.853 1.00 0.00 C ATOM 466 O LYS A 265 2.895 -5.339 1.421 1.00 0.00 O ATOM 467 CB LYS A 265 3.841 -5.376 4.076 1.00 0.00 C ATOM 468 CG LYS A 265 5.115 -6.048 3.604 1.00 0.00 C ATOM 469 CD LYS A 265 5.327 -7.363 4.316 1.00 0.00 C ATOM 470 CE LYS A 265 6.686 -7.945 3.996 1.00 0.00 C ATOM 471 NZ LYS A 265 7.791 -7.071 4.472 1.00 0.00 N ATOM 0 H LYS A 265 1.624 -4.229 4.186 1.00 0.00 H new ATOM 0 HA LYS A 265 4.330 -3.358 3.542 1.00 0.00 H new ATOM 0 HB2 LYS A 265 3.921 -5.176 5.145 1.00 0.00 H new ATOM 0 HB3 LYS A 265 3.007 -6.065 3.942 1.00 0.00 H new ATOM 0 HG2 LYS A 265 5.065 -6.216 2.528 1.00 0.00 H new ATOM 0 HG3 LYS A 265 5.966 -5.391 3.785 1.00 0.00 H new ATOM 0 HD2 LYS A 265 5.236 -7.216 5.392 1.00 0.00 H new ATOM 0 HD3 LYS A 265 4.549 -8.068 4.023 1.00 0.00 H new ATOM 0 HE2 LYS A 265 6.777 -8.929 4.457 1.00 0.00 H new ATOM 0 HE3 LYS A 265 6.775 -8.088 2.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 265 8.686 -7.601 4.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 265 7.867 -6.239 3.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 265 7.594 -6.761 5.445 1.00 0.00 H new ATOM 485 N VAL A 266 3.920 -3.390 1.055 1.00 0.00 N ATOM 486 CA VAL A 266 3.848 -3.551 -0.382 1.00 0.00 C ATOM 487 C VAL A 266 4.917 -4.534 -0.851 1.00 0.00 C ATOM 488 O VAL A 266 6.129 -4.300 -0.714 1.00 0.00 O ATOM 489 CB VAL A 266 3.941 -2.203 -1.135 1.00 0.00 C ATOM 490 CG1 VAL A 266 2.951 -1.211 -0.562 1.00 0.00 C ATOM 491 CG2 VAL A 266 5.333 -1.626 -1.106 1.00 0.00 C ATOM 0 H VAL A 266 4.366 -2.529 1.372 1.00 0.00 H new ATOM 0 HA VAL A 266 2.867 -3.961 -0.622 1.00 0.00 H new ATOM 0 HB VAL A 266 3.694 -2.399 -2.178 1.00 0.00 H new ATOM 0 HG11 VAL A 266 3.028 -0.267 -1.102 1.00 0.00 H new ATOM 0 HG12 VAL A 266 1.940 -1.606 -0.664 1.00 0.00 H new ATOM 0 HG13 VAL A 266 3.171 -1.045 0.493 1.00 0.00 H new ATOM 0 HG21 VAL A 266 5.346 -0.680 -1.648 1.00 0.00 H new ATOM 0 HG22 VAL A 266 5.635 -1.456 -0.073 1.00 0.00 H new ATOM 0 HG23 VAL A 266 6.026 -2.323 -1.577 1.00 0.00 H new ATOM 501 N THR A 267 4.442 -5.661 -1.362 1.00 0.00 N ATOM 502 CA THR A 267 5.306 -6.756 -1.753 1.00 0.00 C ATOM 503 C THR A 267 5.596 -6.716 -3.234 1.00 0.00 C ATOM 504 O THR A 267 6.266 -7.598 -3.774 1.00 0.00 O ATOM 505 CB THR A 267 4.696 -8.119 -1.350 1.00 0.00 C ATOM 506 OG1 THR A 267 5.562 -9.196 -1.730 1.00 0.00 O ATOM 507 CG2 THR A 267 3.324 -8.321 -1.983 1.00 0.00 C ATOM 0 H THR A 267 3.449 -5.838 -1.515 1.00 0.00 H new ATOM 0 HA THR A 267 6.250 -6.639 -1.221 1.00 0.00 H new ATOM 0 HB THR A 267 4.582 -8.116 -0.266 1.00 0.00 H new ATOM 0 HG1 THR A 267 6.038 -8.958 -2.553 1.00 0.00 H new ATOM 0 HG21 THR A 267 2.922 -9.288 -1.680 1.00 0.00 H new ATOM 0 HG22 THR A 267 2.651 -7.529 -1.653 1.00 0.00 H new ATOM 0 HG23 THR A 267 3.416 -8.290 -3.069 1.00 0.00 H new ATOM 515 N LYS A 268 5.116 -5.686 -3.891 1.00 0.00 N ATOM 516 CA LYS A 268 5.525 -5.452 -5.248 1.00 0.00 C ATOM 517 C LYS A 268 5.896 -4.001 -5.383 1.00 0.00 C ATOM 518 O LYS A 268 5.042 -3.128 -5.382 1.00 0.00 O ATOM 519 CB LYS A 268 4.444 -5.847 -6.243 1.00 0.00 C ATOM 520 CG LYS A 268 5.016 -6.401 -7.534 1.00 0.00 C ATOM 521 CD LYS A 268 6.017 -5.448 -8.150 1.00 0.00 C ATOM 522 CE LYS A 268 5.336 -4.234 -8.772 1.00 0.00 C ATOM 523 NZ LYS A 268 4.339 -4.618 -9.806 1.00 0.00 N ATOM 0 H LYS A 268 4.453 -5.009 -3.513 1.00 0.00 H new ATOM 0 HA LYS A 268 6.388 -6.077 -5.479 1.00 0.00 H new ATOM 0 HB2 LYS A 268 3.792 -6.593 -5.789 1.00 0.00 H new ATOM 0 HB3 LYS A 268 3.826 -4.978 -6.467 1.00 0.00 H new ATOM 0 HG2 LYS A 268 5.497 -7.359 -7.339 1.00 0.00 H new ATOM 0 HG3 LYS A 268 4.208 -6.588 -8.241 1.00 0.00 H new ATOM 0 HD2 LYS A 268 6.722 -5.118 -7.387 1.00 0.00 H new ATOM 0 HD3 LYS A 268 6.595 -5.971 -8.912 1.00 0.00 H new ATOM 0 HE2 LYS A 268 4.842 -3.656 -7.991 1.00 0.00 H new ATOM 0 HE3 LYS A 268 6.090 -3.586 -9.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 268 4.410 -3.968 -10.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 268 4.527 -5.590 -10.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 268 3.382 -4.566 -9.402 1.00 0.00 H new ATOM 537 N ILE A 269 7.180 -3.767 -5.498 1.00 0.00 N ATOM 538 CA ILE A 269 7.720 -2.423 -5.428 1.00 0.00 C ATOM 539 C ILE A 269 8.270 -1.925 -6.754 1.00 0.00 C ATOM 540 O ILE A 269 8.607 -2.698 -7.650 1.00 0.00 O ATOM 541 CB ILE A 269 8.793 -2.287 -4.324 1.00 0.00 C ATOM 542 CG1 ILE A 269 9.567 -3.595 -4.135 1.00 0.00 C ATOM 543 CG2 ILE A 269 8.140 -1.860 -3.026 1.00 0.00 C ATOM 544 CD1 ILE A 269 10.146 -4.115 -5.420 1.00 0.00 C ATOM 0 H ILE A 269 7.880 -4.495 -5.642 1.00 0.00 H new ATOM 0 HA ILE A 269 6.871 -1.789 -5.172 1.00 0.00 H new ATOM 0 HB ILE A 269 9.509 -1.525 -4.631 1.00 0.00 H new ATOM 0 HG12 ILE A 269 10.371 -3.436 -3.417 1.00 0.00 H new ATOM 0 HG13 ILE A 269 8.903 -4.347 -3.709 1.00 0.00 H new ATOM 0 HG21 ILE A 269 8.900 -1.765 -2.250 1.00 0.00 H new ATOM 0 HG22 ILE A 269 7.644 -0.900 -3.167 1.00 0.00 H new ATOM 0 HG23 ILE A 269 7.406 -2.607 -2.725 1.00 0.00 H new ATOM 0 HD11 ILE A 269 10.684 -5.043 -5.227 1.00 0.00 H new ATOM 0 HD12 ILE A 269 9.342 -4.302 -6.132 1.00 0.00 H new ATOM 0 HD13 ILE A 269 10.833 -3.377 -5.834 1.00 0.00 H new ATOM 556 N ASN A 270 8.305 -0.612 -6.859 1.00 0.00 N ATOM 557 CA ASN A 270 8.826 0.081 -8.028 1.00 0.00 C ATOM 558 C ASN A 270 9.495 1.379 -7.585 1.00 0.00 C ATOM 559 O ASN A 270 9.817 1.526 -6.410 1.00 0.00 O ATOM 560 CB ASN A 270 7.713 0.364 -9.042 1.00 0.00 C ATOM 561 CG ASN A 270 6.332 0.394 -8.422 1.00 0.00 C ATOM 562 OD1 ASN A 270 5.574 -0.571 -8.524 1.00 0.00 O ATOM 563 ND2 ASN A 270 6.012 1.476 -7.734 1.00 0.00 N ATOM 0 H ASN A 270 7.969 0.015 -6.128 1.00 0.00 H new ATOM 0 HA ASN A 270 9.562 -0.556 -8.519 1.00 0.00 H new ATOM 0 HB2 ASN A 270 7.907 1.321 -9.527 1.00 0.00 H new ATOM 0 HB3 ASN A 270 7.738 -0.398 -9.821 1.00 0.00 H new ATOM 0 HD21 ASN A 270 5.109 1.533 -7.263 1.00 0.00 H new ATOM 0 HD22 ASN A 270 6.668 2.255 -7.674 1.00 0.00 H new ATOM 570 N VAL A 271 9.690 2.325 -8.497 1.00 0.00 N ATOM 571 CA VAL A 271 10.270 3.609 -8.113 1.00 0.00 C ATOM 572 C VAL A 271 9.245 4.743 -8.187 1.00 0.00 C ATOM 573 O VAL A 271 9.394 5.755 -7.505 1.00 0.00 O ATOM 574 CB VAL A 271 11.508 3.975 -8.966 1.00 0.00 C ATOM 575 CG1 VAL A 271 12.613 2.947 -8.782 1.00 0.00 C ATOM 576 CG2 VAL A 271 11.146 4.114 -10.438 1.00 0.00 C ATOM 0 H VAL A 271 9.461 2.233 -9.487 1.00 0.00 H new ATOM 0 HA VAL A 271 10.590 3.491 -7.078 1.00 0.00 H new ATOM 0 HB VAL A 271 11.874 4.941 -8.619 1.00 0.00 H new ATOM 0 HG11 VAL A 271 13.473 3.225 -9.391 1.00 0.00 H new ATOM 0 HG12 VAL A 271 12.907 2.913 -7.733 1.00 0.00 H new ATOM 0 HG13 VAL A 271 12.252 1.966 -9.090 1.00 0.00 H new ATOM 0 HG21 VAL A 271 12.038 4.372 -11.009 1.00 0.00 H new ATOM 0 HG22 VAL A 271 10.741 3.171 -10.804 1.00 0.00 H new ATOM 0 HG23 VAL A 271 10.400 4.900 -10.557 1.00 0.00 H new ATOM 586 N SER A 272 8.198 4.565 -8.993 1.00 0.00 N ATOM 587 CA SER A 272 7.205 5.621 -9.204 1.00 0.00 C ATOM 588 C SER A 272 6.422 5.937 -7.931 1.00 0.00 C ATOM 589 O SER A 272 6.208 7.098 -7.596 1.00 0.00 O ATOM 590 CB SER A 272 6.222 5.208 -10.294 1.00 0.00 C ATOM 591 OG SER A 272 6.898 4.588 -11.378 1.00 0.00 O ATOM 0 H SER A 272 8.015 3.704 -9.509 1.00 0.00 H new ATOM 0 HA SER A 272 7.751 6.516 -9.503 1.00 0.00 H new ATOM 0 HB2 SER A 272 5.482 4.522 -9.881 1.00 0.00 H new ATOM 0 HB3 SER A 272 5.680 6.084 -10.651 1.00 0.00 H new ATOM 0 HG SER A 272 6.248 4.330 -12.064 1.00 0.00 H new ATOM 597 N GLY A 273 5.993 4.900 -7.226 1.00 0.00 N ATOM 598 CA GLY A 273 5.200 5.104 -6.032 1.00 0.00 C ATOM 599 C GLY A 273 3.877 4.376 -6.096 1.00 0.00 C ATOM 600 O GLY A 273 3.254 4.112 -5.073 1.00 0.00 O ATOM 0 H GLY A 273 6.179 3.925 -7.459 1.00 0.00 H new ATOM 0 HA2 GLY A 273 5.760 4.761 -5.162 1.00 0.00 H new ATOM 0 HA3 GLY A 273 5.020 6.170 -5.895 1.00 0.00 H new ATOM 604 N GLN A 274 3.439 4.068 -7.303 1.00 0.00 N ATOM 605 CA GLN A 274 2.259 3.240 -7.492 1.00 0.00 C ATOM 606 C GLN A 274 2.708 1.794 -7.546 1.00 0.00 C ATOM 607 O GLN A 274 3.248 1.344 -8.554 1.00 0.00 O ATOM 608 CB GLN A 274 1.519 3.616 -8.784 1.00 0.00 C ATOM 609 CG GLN A 274 0.018 3.310 -8.774 1.00 0.00 C ATOM 610 CD GLN A 274 -0.336 1.827 -8.739 1.00 0.00 C ATOM 611 OE1 GLN A 274 0.518 0.986 -9.295 1.00 0.00 O flip ATOM 612 NE2 GLN A 274 -1.376 1.441 -8.201 1.00 0.00 N flip ATOM 0 H GLN A 274 3.882 4.378 -8.168 1.00 0.00 H new ATOM 0 HA GLN A 274 1.566 3.395 -6.665 1.00 0.00 H new ATOM 0 HB2 GLN A 274 1.658 4.681 -8.969 1.00 0.00 H new ATOM 0 HB3 GLN A 274 1.979 3.085 -9.618 1.00 0.00 H new ATOM 0 HG2 GLN A 274 -0.431 3.796 -7.908 1.00 0.00 H new ATOM 0 HG3 GLN A 274 -0.435 3.756 -9.660 1.00 0.00 H new ATOM 0 HE21 GLN A 274 -2.014 2.117 -7.781 1.00 0.00 H new ATOM 0 HE22 GLN A 274 -1.598 0.446 -8.176 1.00 0.00 H new ATOM 621 N TRP A 275 2.505 1.089 -6.458 1.00 0.00 N ATOM 622 CA TRP A 275 2.939 -0.291 -6.340 1.00 0.00 C ATOM 623 C TRP A 275 1.832 -1.135 -5.738 1.00 0.00 C ATOM 624 O TRP A 275 0.786 -0.614 -5.341 1.00 0.00 O ATOM 625 CB TRP A 275 4.208 -0.398 -5.488 1.00 0.00 C ATOM 626 CG TRP A 275 4.384 0.685 -4.477 1.00 0.00 C ATOM 627 CD1 TRP A 275 3.436 1.248 -3.677 1.00 0.00 C ATOM 628 CD2 TRP A 275 5.614 1.321 -4.156 1.00 0.00 C ATOM 629 NE1 TRP A 275 4.005 2.229 -2.902 1.00 0.00 N ATOM 630 CE2 TRP A 275 5.347 2.281 -3.173 1.00 0.00 C ATOM 631 CE3 TRP A 275 6.919 1.170 -4.617 1.00 0.00 C ATOM 632 CZ2 TRP A 275 6.344 3.090 -2.643 1.00 0.00 C ATOM 633 CZ3 TRP A 275 7.907 1.966 -4.090 1.00 0.00 C ATOM 634 CH2 TRP A 275 7.618 2.917 -3.111 1.00 0.00 C ATOM 0 H TRP A 275 2.035 1.452 -5.628 1.00 0.00 H new ATOM 0 HA TRP A 275 3.169 -0.663 -7.339 1.00 0.00 H new ATOM 0 HB2 TRP A 275 4.201 -1.358 -4.972 1.00 0.00 H new ATOM 0 HB3 TRP A 275 5.073 -0.399 -6.151 1.00 0.00 H new ATOM 0 HD1 TRP A 275 2.394 0.966 -3.655 1.00 0.00 H new ATOM 0 HE1 TRP A 275 3.510 2.821 -2.235 1.00 0.00 H new ATOM 0 HE3 TRP A 275 7.151 0.439 -5.377 1.00 0.00 H new ATOM 0 HZ2 TRP A 275 6.121 3.830 -1.888 1.00 0.00 H new ATOM 0 HZ3 TRP A 275 8.923 1.854 -4.439 1.00 0.00 H new ATOM 0 HH2 TRP A 275 8.415 3.528 -2.715 1.00 0.00 H new ATOM 645 N GLU A 276 2.059 -2.436 -5.671 1.00 0.00 N ATOM 646 CA GLU A 276 1.070 -3.333 -5.115 1.00 0.00 C ATOM 647 C GLU A 276 1.316 -3.503 -3.629 1.00 0.00 C ATOM 648 O GLU A 276 2.411 -3.899 -3.203 1.00 0.00 O ATOM 649 CB GLU A 276 1.106 -4.687 -5.817 1.00 0.00 C ATOM 650 CG GLU A 276 0.042 -5.655 -5.332 1.00 0.00 C ATOM 651 CD GLU A 276 0.054 -6.959 -6.096 1.00 0.00 C ATOM 652 OE1 GLU A 276 0.954 -7.789 -5.858 1.00 0.00 O ATOM 653 OE2 GLU A 276 -0.830 -7.153 -6.956 1.00 0.00 O ATOM 0 H GLU A 276 2.914 -2.889 -5.993 1.00 0.00 H new ATOM 0 HA GLU A 276 0.081 -2.901 -5.269 1.00 0.00 H new ATOM 0 HB2 GLU A 276 0.983 -4.534 -6.889 1.00 0.00 H new ATOM 0 HB3 GLU A 276 2.088 -5.137 -5.670 1.00 0.00 H new ATOM 0 HG2 GLU A 276 0.196 -5.857 -4.272 1.00 0.00 H new ATOM 0 HG3 GLU A 276 -0.939 -5.190 -5.429 1.00 0.00 H new ATOM 660 N GLY A 277 0.279 -3.237 -2.859 1.00 0.00 N ATOM 661 CA GLY A 277 0.378 -3.264 -1.426 1.00 0.00 C ATOM 662 C GLY A 277 -0.275 -4.500 -0.847 1.00 0.00 C ATOM 663 O GLY A 277 -1.137 -5.104 -1.483 1.00 0.00 O ATOM 0 H GLY A 277 -0.647 -2.998 -3.213 1.00 0.00 H new ATOM 0 HA2 GLY A 277 1.427 -3.234 -1.132 1.00 0.00 H new ATOM 0 HA3 GLY A 277 -0.094 -2.374 -1.011 1.00 0.00 H new ATOM 667 N GLU A 278 0.152 -4.894 0.336 1.00 0.00 N ATOM 668 CA GLU A 278 -0.450 -6.020 1.029 1.00 0.00 C ATOM 669 C GLU A 278 -0.580 -5.703 2.512 1.00 0.00 C ATOM 670 O GLU A 278 0.414 -5.446 3.185 1.00 0.00 O ATOM 671 CB GLU A 278 0.401 -7.278 0.825 1.00 0.00 C ATOM 672 CG GLU A 278 -0.083 -8.486 1.609 1.00 0.00 C ATOM 673 CD GLU A 278 0.870 -9.657 1.520 1.00 0.00 C ATOM 674 OE1 GLU A 278 0.789 -10.420 0.541 1.00 0.00 O ATOM 675 OE2 GLU A 278 1.700 -9.824 2.435 1.00 0.00 O ATOM 0 H GLU A 278 0.918 -4.449 0.842 1.00 0.00 H new ATOM 0 HA GLU A 278 -1.444 -6.203 0.620 1.00 0.00 H new ATOM 0 HB2 GLU A 278 0.413 -7.528 -0.236 1.00 0.00 H new ATOM 0 HB3 GLU A 278 1.429 -7.059 1.113 1.00 0.00 H new ATOM 0 HG2 GLU A 278 -0.214 -8.207 2.655 1.00 0.00 H new ATOM 0 HG3 GLU A 278 -1.061 -8.789 1.235 1.00 0.00 H new ATOM 682 N CYS A 279 -1.799 -5.710 3.027 1.00 0.00 N ATOM 683 CA CYS A 279 -2.005 -5.422 4.429 1.00 0.00 C ATOM 684 C CYS A 279 -2.394 -6.696 5.155 1.00 0.00 C ATOM 685 O CYS A 279 -3.554 -7.116 5.117 1.00 0.00 O ATOM 686 CB CYS A 279 -3.086 -4.352 4.604 1.00 0.00 C ATOM 687 SG CYS A 279 -3.308 -3.792 6.309 1.00 0.00 S ATOM 0 H CYS A 279 -2.649 -5.910 2.499 1.00 0.00 H new ATOM 0 HA CYS A 279 -1.078 -5.038 4.855 1.00 0.00 H new ATOM 0 HB2 CYS A 279 -2.835 -3.493 3.981 1.00 0.00 H new ATOM 0 HB3 CYS A 279 -4.034 -4.746 4.237 1.00 0.00 H new ATOM 0 HG CYS A 279 -2.498 -2.805 6.550 1.00 0.00 H new ATOM 693 N ASN A 280 -1.400 -7.307 5.792 1.00 0.00 N ATOM 694 CA ASN A 280 -1.589 -8.508 6.606 1.00 0.00 C ATOM 695 C ASN A 280 -2.449 -9.562 5.900 1.00 0.00 C ATOM 696 O ASN A 280 -3.350 -10.150 6.503 1.00 0.00 O ATOM 697 CB ASN A 280 -2.200 -8.148 7.965 1.00 0.00 C ATOM 698 CG ASN A 280 -1.203 -7.541 8.940 1.00 0.00 C ATOM 699 OD1 ASN A 280 -0.285 -6.717 8.453 1.00 0.00 O flip ATOM 700 ND2 ASN A 280 -1.265 -7.803 10.142 1.00 0.00 N flip ATOM 0 H ASN A 280 -0.434 -6.982 5.759 1.00 0.00 H new ATOM 0 HA ASN A 280 -0.603 -8.945 6.761 1.00 0.00 H new ATOM 0 HB2 ASN A 280 -3.019 -7.445 7.811 1.00 0.00 H new ATOM 0 HB3 ASN A 280 -2.630 -9.045 8.410 1.00 0.00 H new ATOM 0 HD21 ASN A 280 -1.982 -8.440 10.489 1.00 0.00 H new ATOM 0 HD22 ASN A 280 -0.600 -7.382 10.791 1.00 0.00 H new ATOM 707 N GLY A 281 -2.154 -9.818 4.633 1.00 0.00 N ATOM 708 CA GLY A 281 -2.887 -10.828 3.890 1.00 0.00 C ATOM 709 C GLY A 281 -3.682 -10.262 2.727 1.00 0.00 C ATOM 710 O GLY A 281 -3.749 -10.878 1.663 1.00 0.00 O ATOM 0 H GLY A 281 -1.421 -9.345 4.105 1.00 0.00 H new ATOM 0 HA2 GLY A 281 -2.185 -11.572 3.513 1.00 0.00 H new ATOM 0 HA3 GLY A 281 -3.566 -11.345 4.567 1.00 0.00 H new ATOM 714 N LYS A 282 -4.294 -9.101 2.918 1.00 0.00 N ATOM 715 CA LYS A 282 -5.030 -8.453 1.840 1.00 0.00 C ATOM 716 C LYS A 282 -4.059 -7.946 0.790 1.00 0.00 C ATOM 717 O LYS A 282 -3.085 -7.288 1.128 1.00 0.00 O ATOM 718 CB LYS A 282 -5.826 -7.272 2.384 1.00 0.00 C ATOM 719 CG LYS A 282 -6.808 -7.635 3.477 1.00 0.00 C ATOM 720 CD LYS A 282 -6.986 -6.470 4.425 1.00 0.00 C ATOM 721 CE LYS A 282 -8.054 -6.755 5.471 1.00 0.00 C ATOM 722 NZ LYS A 282 -8.180 -5.650 6.458 1.00 0.00 N ATOM 0 H LYS A 282 -4.296 -8.592 3.802 1.00 0.00 H new ATOM 0 HA LYS A 282 -5.711 -9.180 1.397 1.00 0.00 H new ATOM 0 HB2 LYS A 282 -5.130 -6.526 2.769 1.00 0.00 H new ATOM 0 HB3 LYS A 282 -6.370 -6.806 1.563 1.00 0.00 H new ATOM 0 HG2 LYS A 282 -7.768 -7.907 3.038 1.00 0.00 H new ATOM 0 HG3 LYS A 282 -6.449 -8.507 4.024 1.00 0.00 H new ATOM 0 HD2 LYS A 282 -6.039 -6.256 4.920 1.00 0.00 H new ATOM 0 HD3 LYS A 282 -7.259 -5.579 3.860 1.00 0.00 H new ATOM 0 HE2 LYS A 282 -9.013 -6.910 4.976 1.00 0.00 H new ATOM 0 HE3 LYS A 282 -7.812 -7.681 5.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 282 -8.918 -5.886 7.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 282 -7.273 -5.518 6.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 282 -8.437 -4.771 5.965 1.00 0.00 H new ATOM 736 N ARG A 283 -4.312 -8.246 -0.473 1.00 0.00 N ATOM 737 CA ARG A 283 -3.468 -7.731 -1.542 1.00 0.00 C ATOM 738 C ARG A 283 -4.237 -6.760 -2.422 1.00 0.00 C ATOM 739 O ARG A 283 -5.341 -7.056 -2.884 1.00 0.00 O ATOM 740 CB ARG A 283 -2.900 -8.856 -2.385 1.00 0.00 C ATOM 741 CG ARG A 283 -2.021 -9.800 -1.594 1.00 0.00 C ATOM 742 CD ARG A 283 -1.028 -10.494 -2.493 1.00 0.00 C ATOM 743 NE ARG A 283 -0.108 -11.344 -1.741 1.00 0.00 N ATOM 744 CZ ARG A 283 0.342 -12.519 -2.172 1.00 0.00 C ATOM 745 NH1 ARG A 283 -0.059 -13.003 -3.337 1.00 0.00 N ATOM 746 NH2 ARG A 283 1.195 -13.214 -1.436 1.00 0.00 N ATOM 0 H ARG A 283 -5.084 -8.836 -0.782 1.00 0.00 H new ATOM 0 HA ARG A 283 -2.639 -7.199 -1.075 1.00 0.00 H new ATOM 0 HB2 ARG A 283 -3.720 -9.419 -2.830 1.00 0.00 H new ATOM 0 HB3 ARG A 283 -2.322 -8.432 -3.206 1.00 0.00 H new ATOM 0 HG2 ARG A 283 -1.491 -9.246 -0.819 1.00 0.00 H new ATOM 0 HG3 ARG A 283 -2.640 -10.541 -1.089 1.00 0.00 H new ATOM 0 HD2 ARG A 283 -1.563 -11.098 -3.225 1.00 0.00 H new ATOM 0 HD3 ARG A 283 -0.460 -9.748 -3.049 1.00 0.00 H new ATOM 0 HE ARG A 283 0.209 -11.016 -0.829 1.00 0.00 H new ATOM 0 HH11 ARG A 283 -0.717 -12.474 -3.910 1.00 0.00 H new ATOM 0 HH12 ARG A 283 0.290 -13.905 -3.662 1.00 0.00 H new ATOM 0 HH21 ARG A 283 1.508 -12.849 -0.537 1.00 0.00 H new ATOM 0 HH22 ARG A 283 1.539 -14.115 -1.768 1.00 0.00 H new ATOM 760 N GLY A 284 -3.640 -5.604 -2.636 1.00 0.00 N ATOM 761 CA GLY A 284 -4.255 -4.565 -3.432 1.00 0.00 C ATOM 762 C GLY A 284 -3.289 -3.433 -3.734 1.00 0.00 C ATOM 763 O GLY A 284 -2.500 -3.043 -2.875 1.00 0.00 O ATOM 0 H GLY A 284 -2.721 -5.361 -2.265 1.00 0.00 H new ATOM 0 HA2 GLY A 284 -4.618 -4.992 -4.367 1.00 0.00 H new ATOM 0 HA3 GLY A 284 -5.123 -4.170 -2.904 1.00 0.00 H new ATOM 767 N HIS A 285 -3.369 -2.870 -4.930 1.00 0.00 N ATOM 768 CA HIS A 285 -2.369 -1.893 -5.376 1.00 0.00 C ATOM 769 C HIS A 285 -2.880 -0.467 -5.209 1.00 0.00 C ATOM 770 O HIS A 285 -4.080 -0.220 -5.314 1.00 0.00 O ATOM 771 CB HIS A 285 -1.949 -2.150 -6.833 1.00 0.00 C ATOM 772 CG HIS A 285 -3.061 -2.043 -7.832 1.00 0.00 C ATOM 773 ND1 HIS A 285 -3.365 -0.878 -8.499 1.00 0.00 N ATOM 774 CD2 HIS A 285 -3.941 -2.970 -8.278 1.00 0.00 C ATOM 775 CE1 HIS A 285 -4.384 -1.091 -9.310 1.00 0.00 C ATOM 776 NE2 HIS A 285 -4.751 -2.352 -9.194 1.00 0.00 N ATOM 0 H HIS A 285 -4.105 -3.065 -5.608 1.00 0.00 H new ATOM 0 HA HIS A 285 -1.489 -2.015 -4.744 1.00 0.00 H new ATOM 0 HB2 HIS A 285 -1.167 -1.440 -7.102 1.00 0.00 H new ATOM 0 HB3 HIS A 285 -1.512 -3.146 -6.901 1.00 0.00 H new ATOM 0 HD2 HIS A 285 -3.995 -4.004 -7.969 1.00 0.00 H new ATOM 0 HE1 HIS A 285 -4.840 -0.357 -9.958 1.00 0.00 H new ATOM 0 HE2 HIS A 285 -5.515 -2.796 -9.704 1.00 0.00 H new ATOM 785 N PHE A 286 -1.959 0.460 -4.948 1.00 0.00 N ATOM 786 CA PHE A 286 -2.303 1.858 -4.685 1.00 0.00 C ATOM 787 C PHE A 286 -1.095 2.770 -4.925 1.00 0.00 C ATOM 788 O PHE A 286 0.046 2.311 -4.900 1.00 0.00 O ATOM 789 CB PHE A 286 -2.792 2.018 -3.244 1.00 0.00 C ATOM 790 CG PHE A 286 -4.288 1.928 -3.084 1.00 0.00 C ATOM 791 CD1 PHE A 286 -5.096 3.001 -3.428 1.00 0.00 C ATOM 792 CD2 PHE A 286 -4.886 0.782 -2.582 1.00 0.00 C ATOM 793 CE1 PHE A 286 -6.466 2.932 -3.278 1.00 0.00 C ATOM 794 CE2 PHE A 286 -6.258 0.711 -2.430 1.00 0.00 C ATOM 795 CZ PHE A 286 -7.048 1.787 -2.779 1.00 0.00 C ATOM 0 H PHE A 286 -0.958 0.265 -4.913 1.00 0.00 H new ATOM 0 HA PHE A 286 -3.100 2.147 -5.370 1.00 0.00 H new ATOM 0 HB2 PHE A 286 -2.325 1.250 -2.627 1.00 0.00 H new ATOM 0 HB3 PHE A 286 -2.455 2.982 -2.863 1.00 0.00 H new ATOM 0 HD1 PHE A 286 -4.647 3.902 -3.818 1.00 0.00 H new ATOM 0 HD2 PHE A 286 -4.273 -0.064 -2.307 1.00 0.00 H new ATOM 0 HE1 PHE A 286 -7.082 3.776 -3.552 1.00 0.00 H new ATOM 0 HE2 PHE A 286 -6.712 -0.187 -2.038 1.00 0.00 H new ATOM 0 HZ PHE A 286 -8.120 1.732 -2.661 1.00 0.00 H new ATOM 805 N PRO A 287 -1.332 4.078 -5.152 1.00 0.00 N ATOM 806 CA PRO A 287 -0.275 5.031 -5.478 1.00 0.00 C ATOM 807 C PRO A 287 0.327 5.734 -4.255 1.00 0.00 C ATOM 808 O PRO A 287 -0.193 5.646 -3.136 1.00 0.00 O ATOM 809 CB PRO A 287 -1.014 6.028 -6.361 1.00 0.00 C ATOM 810 CG PRO A 287 -2.411 6.056 -5.828 1.00 0.00 C ATOM 811 CD PRO A 287 -2.653 4.733 -5.138 1.00 0.00 C ATOM 0 HA PRO A 287 0.584 4.547 -5.942 1.00 0.00 H new ATOM 0 HB2 PRO A 287 -0.553 7.015 -6.313 1.00 0.00 H new ATOM 0 HB3 PRO A 287 -0.996 5.718 -7.406 1.00 0.00 H new ATOM 0 HG2 PRO A 287 -2.540 6.883 -5.130 1.00 0.00 H new ATOM 0 HG3 PRO A 287 -3.128 6.206 -6.635 1.00 0.00 H new ATOM 0 HD2 PRO A 287 -3.018 4.874 -4.121 1.00 0.00 H new ATOM 0 HD3 PRO A 287 -3.399 4.138 -5.665 1.00 0.00 H new ATOM 819 N PHE A 288 1.429 6.444 -4.509 1.00 0.00 N ATOM 820 CA PHE A 288 2.226 7.113 -3.475 1.00 0.00 C ATOM 821 C PHE A 288 1.544 8.395 -2.979 1.00 0.00 C ATOM 822 O PHE A 288 1.914 8.951 -1.938 1.00 0.00 O ATOM 823 CB PHE A 288 3.591 7.446 -4.083 1.00 0.00 C ATOM 824 CG PHE A 288 4.715 7.616 -3.104 1.00 0.00 C ATOM 825 CD1 PHE A 288 4.933 8.826 -2.471 1.00 0.00 C ATOM 826 CD2 PHE A 288 5.572 6.563 -2.841 1.00 0.00 C ATOM 827 CE1 PHE A 288 5.984 8.980 -1.588 1.00 0.00 C ATOM 828 CE2 PHE A 288 6.625 6.710 -1.966 1.00 0.00 C ATOM 829 CZ PHE A 288 6.831 7.921 -1.335 1.00 0.00 C ATOM 0 H PHE A 288 1.799 6.573 -5.451 1.00 0.00 H new ATOM 0 HA PHE A 288 2.332 6.453 -2.614 1.00 0.00 H new ATOM 0 HB2 PHE A 288 3.860 6.654 -4.783 1.00 0.00 H new ATOM 0 HB3 PHE A 288 3.496 8.364 -4.662 1.00 0.00 H new ATOM 0 HD1 PHE A 288 4.275 9.659 -2.669 1.00 0.00 H new ATOM 0 HD2 PHE A 288 5.413 5.612 -3.329 1.00 0.00 H new ATOM 0 HE1 PHE A 288 6.142 9.928 -1.096 1.00 0.00 H new ATOM 0 HE2 PHE A 288 7.288 5.880 -1.774 1.00 0.00 H new ATOM 0 HZ PHE A 288 7.653 8.039 -0.645 1.00 0.00 H new ATOM 839 N THR A 289 0.532 8.827 -3.726 1.00 0.00 N ATOM 840 CA THR A 289 -0.174 10.089 -3.509 1.00 0.00 C ATOM 841 C THR A 289 -0.603 10.336 -2.058 1.00 0.00 C ATOM 842 O THR A 289 -0.702 11.482 -1.618 1.00 0.00 O ATOM 843 CB THR A 289 -1.425 10.092 -4.390 1.00 0.00 C ATOM 844 OG1 THR A 289 -2.144 8.866 -4.179 1.00 0.00 O ATOM 845 CG2 THR A 289 -1.048 10.214 -5.854 1.00 0.00 C ATOM 0 H THR A 289 0.170 8.297 -4.519 1.00 0.00 H new ATOM 0 HA THR A 289 0.526 10.886 -3.762 1.00 0.00 H new ATOM 0 HB THR A 289 -2.048 10.945 -4.123 1.00 0.00 H new ATOM 0 HG1 THR A 289 -2.981 8.886 -4.689 1.00 0.00 H new ATOM 0 HG21 THR A 289 -1.952 10.214 -6.464 1.00 0.00 H new ATOM 0 HG22 THR A 289 -0.503 11.144 -6.013 1.00 0.00 H new ATOM 0 HG23 THR A 289 -0.418 9.371 -6.139 1.00 0.00 H new ATOM 853 N HIS A 290 -0.859 9.270 -1.323 1.00 0.00 N ATOM 854 CA HIS A 290 -1.456 9.382 0.003 1.00 0.00 C ATOM 855 C HIS A 290 -0.782 8.460 0.997 1.00 0.00 C ATOM 856 O HIS A 290 -1.444 7.844 1.836 1.00 0.00 O ATOM 857 CB HIS A 290 -2.952 9.058 -0.085 1.00 0.00 C ATOM 858 CG HIS A 290 -3.269 7.757 -0.771 1.00 0.00 C ATOM 859 ND1 HIS A 290 -4.363 7.600 -1.587 1.00 0.00 N ATOM 860 CD2 HIS A 290 -2.639 6.553 -0.760 1.00 0.00 C ATOM 861 CE1 HIS A 290 -4.400 6.370 -2.050 1.00 0.00 C ATOM 862 NE2 HIS A 290 -3.360 5.706 -1.571 1.00 0.00 N ATOM 0 H HIS A 290 -0.664 8.313 -1.619 1.00 0.00 H new ATOM 0 HA HIS A 290 -1.318 10.404 0.356 1.00 0.00 H new ATOM 0 HB2 HIS A 290 -3.365 9.033 0.923 1.00 0.00 H new ATOM 0 HB3 HIS A 290 -3.455 9.866 -0.616 1.00 0.00 H new ATOM 0 HD1 HIS A 290 -5.044 8.328 -1.801 1.00 0.00 H new ATOM 0 HD2 HIS A 290 -1.739 6.306 -0.216 1.00 0.00 H new ATOM 0 HE1 HIS A 290 -5.154 5.968 -2.711 1.00 0.00 H new ATOM 871 N VAL A 291 0.528 8.350 0.915 1.00 0.00 N ATOM 872 CA VAL A 291 1.217 7.417 1.774 1.00 0.00 C ATOM 873 C VAL A 291 2.551 7.959 2.274 1.00 0.00 C ATOM 874 O VAL A 291 3.202 8.775 1.623 1.00 0.00 O ATOM 875 CB VAL A 291 1.409 6.073 1.049 1.00 0.00 C ATOM 876 CG1 VAL A 291 2.582 6.101 0.090 1.00 0.00 C ATOM 877 CG2 VAL A 291 1.504 4.927 2.033 1.00 0.00 C ATOM 0 H VAL A 291 1.122 8.881 0.279 1.00 0.00 H new ATOM 0 HA VAL A 291 0.594 7.263 2.655 1.00 0.00 H new ATOM 0 HB VAL A 291 0.521 5.905 0.440 1.00 0.00 H new ATOM 0 HG11 VAL A 291 2.677 5.131 -0.397 1.00 0.00 H new ATOM 0 HG12 VAL A 291 2.417 6.871 -0.664 1.00 0.00 H new ATOM 0 HG13 VAL A 291 3.497 6.322 0.640 1.00 0.00 H new ATOM 0 HG21 VAL A 291 1.639 3.992 1.490 1.00 0.00 H new ATOM 0 HG22 VAL A 291 2.353 5.087 2.697 1.00 0.00 H new ATOM 0 HG23 VAL A 291 0.588 4.876 2.621 1.00 0.00 H new ATOM 887 N ARG A 292 2.923 7.497 3.452 1.00 0.00 N ATOM 888 CA ARG A 292 4.190 7.842 4.089 1.00 0.00 C ATOM 889 C ARG A 292 4.849 6.550 4.533 1.00 0.00 C ATOM 890 O ARG A 292 4.400 5.919 5.482 1.00 0.00 O ATOM 891 CB ARG A 292 3.957 8.747 5.305 1.00 0.00 C ATOM 892 CG ARG A 292 3.417 10.126 4.964 1.00 0.00 C ATOM 893 CD ARG A 292 4.438 10.943 4.196 1.00 0.00 C ATOM 894 NE ARG A 292 5.674 11.136 4.956 1.00 0.00 N ATOM 895 CZ ARG A 292 6.842 11.468 4.406 1.00 0.00 C ATOM 896 NH1 ARG A 292 6.948 11.613 3.090 1.00 0.00 N ATOM 897 NH2 ARG A 292 7.911 11.656 5.172 1.00 0.00 N ATOM 0 H ARG A 292 2.349 6.862 4.006 1.00 0.00 H new ATOM 0 HA ARG A 292 4.824 8.382 3.386 1.00 0.00 H new ATOM 0 HB2 ARG A 292 3.260 8.254 5.982 1.00 0.00 H new ATOM 0 HB3 ARG A 292 4.898 8.861 5.844 1.00 0.00 H new ATOM 0 HG2 ARG A 292 2.508 10.026 4.371 1.00 0.00 H new ATOM 0 HG3 ARG A 292 3.145 10.649 5.881 1.00 0.00 H new ATOM 0 HD2 ARG A 292 4.666 10.444 3.254 1.00 0.00 H new ATOM 0 HD3 ARG A 292 4.011 11.914 3.947 1.00 0.00 H new ATOM 0 HE ARG A 292 5.639 11.009 5.967 1.00 0.00 H new ATOM 0 HH11 ARG A 292 6.133 11.470 2.494 1.00 0.00 H new ATOM 0 HH12 ARG A 292 7.845 11.867 2.676 1.00 0.00 H new ATOM 0 HH21 ARG A 292 7.839 11.546 6.184 1.00 0.00 H new ATOM 0 HH22 ARG A 292 8.804 11.910 4.749 1.00 0.00 H new ATOM 911 N LEU A 293 5.915 6.151 3.876 1.00 0.00 N ATOM 912 CA LEU A 293 6.371 4.793 4.009 1.00 0.00 C ATOM 913 C LEU A 293 7.778 4.667 4.553 1.00 0.00 C ATOM 914 O LEU A 293 8.655 5.498 4.304 1.00 0.00 O ATOM 915 CB LEU A 293 6.252 4.089 2.666 1.00 0.00 C ATOM 916 CG LEU A 293 6.447 4.958 1.428 1.00 0.00 C ATOM 917 CD1 LEU A 293 7.915 5.026 1.034 1.00 0.00 C ATOM 918 CD2 LEU A 293 5.596 4.429 0.292 1.00 0.00 C ATOM 0 H LEU A 293 6.472 6.739 3.255 1.00 0.00 H new ATOM 0 HA LEU A 293 5.729 4.315 4.749 1.00 0.00 H new ATOM 0 HB2 LEU A 293 6.984 3.282 2.637 1.00 0.00 H new ATOM 0 HB3 LEU A 293 5.266 3.627 2.608 1.00 0.00 H new ATOM 0 HG LEU A 293 6.127 5.974 1.657 1.00 0.00 H new ATOM 0 HD11 LEU A 293 8.025 5.652 0.148 1.00 0.00 H new ATOM 0 HD12 LEU A 293 8.492 5.453 1.854 1.00 0.00 H new ATOM 0 HD13 LEU A 293 8.280 4.022 0.817 1.00 0.00 H new ATOM 0 HD21 LEU A 293 5.738 5.053 -0.590 1.00 0.00 H new ATOM 0 HD22 LEU A 293 5.890 3.405 0.063 1.00 0.00 H new ATOM 0 HD23 LEU A 293 4.546 4.448 0.584 1.00 0.00 H new ATOM 930 N LEU A 294 7.955 3.612 5.325 1.00 0.00 N ATOM 931 CA LEU A 294 9.251 3.166 5.746 1.00 0.00 C ATOM 932 C LEU A 294 9.860 2.379 4.598 1.00 0.00 C ATOM 933 O LEU A 294 9.276 1.407 4.102 1.00 0.00 O ATOM 934 CB LEU A 294 9.143 2.300 7.002 1.00 0.00 C ATOM 935 CG LEU A 294 8.453 2.959 8.202 1.00 0.00 C ATOM 936 CD1 LEU A 294 6.947 2.798 8.130 1.00 0.00 C ATOM 937 CD2 LEU A 294 8.994 2.391 9.502 1.00 0.00 C ATOM 0 H LEU A 294 7.187 3.040 5.677 1.00 0.00 H new ATOM 0 HA LEU A 294 9.883 4.018 5.997 1.00 0.00 H new ATOM 0 HB2 LEU A 294 8.600 1.389 6.748 1.00 0.00 H new ATOM 0 HB3 LEU A 294 10.147 2.000 7.302 1.00 0.00 H new ATOM 0 HG LEU A 294 8.672 4.026 8.172 1.00 0.00 H new ATOM 0 HD11 LEU A 294 6.488 3.276 8.995 1.00 0.00 H new ATOM 0 HD12 LEU A 294 6.574 3.264 7.218 1.00 0.00 H new ATOM 0 HD13 LEU A 294 6.694 1.738 8.125 1.00 0.00 H new ATOM 0 HD21 LEU A 294 8.494 2.869 10.344 1.00 0.00 H new ATOM 0 HD22 LEU A 294 8.811 1.317 9.534 1.00 0.00 H new ATOM 0 HD23 LEU A 294 10.066 2.578 9.563 1.00 0.00 H new ATOM 949 N ASP A 295 11.032 2.808 4.198 1.00 0.00 N ATOM 950 CA ASP A 295 11.626 2.402 2.944 1.00 0.00 C ATOM 951 C ASP A 295 12.340 1.066 3.070 1.00 0.00 C ATOM 952 O ASP A 295 12.836 0.699 4.134 1.00 0.00 O ATOM 953 CB ASP A 295 12.605 3.487 2.484 1.00 0.00 C ATOM 954 CG ASP A 295 12.980 3.374 1.019 1.00 0.00 C ATOM 955 OD1 ASP A 295 13.731 2.453 0.663 1.00 0.00 O ATOM 956 OD2 ASP A 295 12.539 4.229 0.222 1.00 0.00 O ATOM 0 H ASP A 295 11.607 3.455 4.738 1.00 0.00 H new ATOM 0 HA ASP A 295 10.834 2.277 2.206 1.00 0.00 H new ATOM 0 HB2 ASP A 295 12.162 4.466 2.664 1.00 0.00 H new ATOM 0 HB3 ASP A 295 13.510 3.430 3.089 1.00 0.00 H new ATOM 961 N GLN A 296 12.403 0.377 1.947 1.00 0.00 N ATOM 962 CA GLN A 296 13.028 -0.938 1.843 1.00 0.00 C ATOM 963 C GLN A 296 14.552 -0.851 1.859 1.00 0.00 C ATOM 964 O GLN A 296 15.231 -1.874 1.924 1.00 0.00 O ATOM 965 CB GLN A 296 12.572 -1.649 0.562 1.00 0.00 C ATOM 966 CG GLN A 296 12.458 -0.741 -0.661 1.00 0.00 C ATOM 967 CD GLN A 296 12.254 -1.514 -1.955 1.00 0.00 C ATOM 968 OE1 GLN A 296 12.819 -2.590 -2.146 1.00 0.00 O ATOM 969 NE2 GLN A 296 11.394 -1.008 -2.838 1.00 0.00 N ATOM 0 H GLN A 296 12.017 0.715 1.065 1.00 0.00 H new ATOM 0 HA GLN A 296 12.712 -1.511 2.715 1.00 0.00 H new ATOM 0 HB2 GLN A 296 13.274 -2.452 0.338 1.00 0.00 H new ATOM 0 HB3 GLN A 296 11.603 -2.114 0.745 1.00 0.00 H new ATOM 0 HG2 GLN A 296 11.625 -0.053 -0.520 1.00 0.00 H new ATOM 0 HG3 GLN A 296 13.361 -0.136 -0.744 1.00 0.00 H new ATOM 0 HE21 GLN A 296 10.940 -0.113 -2.653 1.00 0.00 H new ATOM 0 HE22 GLN A 296 11.189 -1.515 -3.699 1.00 0.00 H new ATOM 978 N GLN A 297 15.095 0.359 1.791 1.00 0.00 N ATOM 979 CA GLN A 297 16.529 0.536 1.971 1.00 0.00 C ATOM 980 C GLN A 297 16.884 0.475 3.452 1.00 0.00 C ATOM 981 O GLN A 297 18.023 0.182 3.819 1.00 0.00 O ATOM 982 CB GLN A 297 17.013 1.861 1.383 1.00 0.00 C ATOM 983 CG GLN A 297 16.420 3.088 2.057 1.00 0.00 C ATOM 984 CD GLN A 297 17.238 4.335 1.801 1.00 0.00 C ATOM 985 OE1 GLN A 297 18.546 4.168 1.694 1.00 0.00 O flip ATOM 986 NE2 GLN A 297 16.705 5.440 1.725 1.00 0.00 N flip ATOM 0 H GLN A 297 14.574 1.218 1.616 1.00 0.00 H new ATOM 0 HA GLN A 297 17.029 -0.274 1.439 1.00 0.00 H new ATOM 0 HB2 GLN A 297 18.099 1.906 1.460 1.00 0.00 H new ATOM 0 HB3 GLN A 297 16.767 1.887 0.321 1.00 0.00 H new ATOM 0 HG2 GLN A 297 15.403 3.243 1.696 1.00 0.00 H new ATOM 0 HG3 GLN A 297 16.354 2.914 3.131 1.00 0.00 H new ATOM 0 HE21 GLN A 297 15.692 5.525 1.813 1.00 0.00 H new ATOM 0 HE22 GLN A 297 17.275 6.272 1.574 1.00 0.00 H new ATOM 995 N ASN A 298 15.904 0.753 4.303 1.00 0.00 N ATOM 996 CA ASN A 298 16.112 0.728 5.747 1.00 0.00 C ATOM 997 C ASN A 298 14.870 0.204 6.478 1.00 0.00 C ATOM 998 O ASN A 298 14.332 0.876 7.356 1.00 0.00 O ATOM 999 CB ASN A 298 16.471 2.126 6.257 1.00 0.00 C ATOM 1000 CG ASN A 298 17.896 2.217 6.783 1.00 0.00 C ATOM 1001 OD1 ASN A 298 18.175 2.973 7.712 1.00 0.00 O ATOM 1002 ND2 ASN A 298 18.810 1.463 6.185 1.00 0.00 N ATOM 0 H ASN A 298 14.956 0.999 4.018 1.00 0.00 H new ATOM 0 HA ASN A 298 16.940 0.050 5.954 1.00 0.00 H new ATOM 0 HB2 ASN A 298 16.341 2.846 5.449 1.00 0.00 H new ATOM 0 HB3 ASN A 298 15.778 2.407 7.050 1.00 0.00 H new ATOM 0 HD21 ASN A 298 19.782 1.499 6.493 1.00 0.00 H new ATOM 0 HD22 ASN A 298 18.541 0.848 5.417 1.00 0.00 H new TER 1009 ASN A 298