USER MOD reduce.3.24.130724 H: found=0, std=0, add=496, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 495 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 0 SER OG : rot 140:sc= 0.082 USER MOD Set 1.2: A -4 GLY N :NH3+ -124:sc= -1.05 (180deg=-3.2!) USER MOD Single : A 212 LYS NZ :NH3+ 159:sc= -0.0714 (180deg=-0.53) USER MOD Single : A 215 LYS NZ :NH3+ -129:sc= -0.0116 (180deg=-0.283) USER MOD Single : A 216 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 217 SER OG : rot 180:sc= 0 USER MOD Single : A 218 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 222 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0936) USER MOD Single : A 228 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 231 SER OG : rot 180:sc= -0.3 USER MOD Single : A 235 LYS NZ :NH3+ -163:sc= -0.0205 (180deg=-0.323) USER MOD Single : A 236 SER OG : rot 180:sc= 0 USER MOD Single : A 237 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 240 GLN : amide:sc= 0 K(o=0,f=-1.8!) USER MOD Single : A 242 HIS : no HE2:sc= 0.0837 K(o=0.084,f=-0.55) USER MOD Single : A 243 GLN : amide:sc= -0.161 X(o=-0.16,f=-0.27) USER MOD Single : A 246 GLN : amide:sc= -0.483 K(o=-0.48,f=-1.3) USER MOD Single : A 247 SER OG : rot -87:sc= 0.832 USER MOD Single : A 249 ASN :FLIP amide:sc= -0.577 F(o=-1.3!,f=-0.58) USER MOD Single : A 250 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 253 ASN : amide:sc= 0 X(o=0,f=-0.098) USER MOD Single : A 255 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 257 SER OG : rot 180:sc= 0 USER MOD Single : A 258 SER OG : rot 180:sc= -0.671 USER MOD Single : A 263 ASN : amide:sc= -0.417 X(o=-0.42,f=-0.62!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -4 -5.343 -17.871 -0.781 1.00 0.00 N ATOM 2 CA GLY A -4 -6.367 -17.922 -1.864 1.00 0.00 C ATOM 3 C GLY A -4 -7.001 -19.308 -1.897 1.00 0.00 C ATOM 4 O GLY A -4 -8.141 -19.494 -1.467 1.00 0.00 O ATOM 0 H1 GLY A -4 -5.564 -17.090 -0.131 1.00 0.00 H new ATOM 0 H2 GLY A -4 -5.347 -18.769 -0.257 1.00 0.00 H new ATOM 0 H3 GLY A -4 -4.403 -17.718 -1.199 1.00 0.00 H new ATOM 0 HA2 GLY A -4 -7.132 -17.164 -1.693 1.00 0.00 H new ATOM 0 HA3 GLY A -4 -5.906 -17.698 -2.826 1.00 0.00 H new ATOM 10 N PRO A -3 -6.283 -20.279 -2.398 1.00 0.00 N ATOM 11 CA PRO A -3 -6.781 -21.683 -2.490 1.00 0.00 C ATOM 12 C PRO A -3 -6.927 -22.333 -1.115 1.00 0.00 C ATOM 13 O PRO A -3 -8.034 -22.471 -0.598 1.00 0.00 O ATOM 14 CB PRO A -3 -5.706 -22.399 -3.324 1.00 0.00 C ATOM 15 CG PRO A -3 -4.462 -21.583 -3.152 1.00 0.00 C ATOM 16 CD PRO A -3 -4.919 -20.139 -2.932 1.00 0.00 C ATOM 0 HA PRO A -3 -7.775 -21.736 -2.934 1.00 0.00 H new ATOM 0 HB2 PRO A -3 -5.556 -23.422 -2.978 1.00 0.00 H new ATOM 0 HB3 PRO A -3 -5.996 -22.457 -4.373 1.00 0.00 H new ATOM 0 HG2 PRO A -3 -3.878 -21.939 -2.303 1.00 0.00 H new ATOM 0 HG3 PRO A -3 -3.823 -21.658 -4.032 1.00 0.00 H new ATOM 0 HD2 PRO A -3 -4.267 -19.616 -2.232 1.00 0.00 H new ATOM 0 HD3 PRO A -3 -4.910 -19.571 -3.862 1.00 0.00 H new ATOM 24 N LEU A -2 -5.799 -22.733 -0.537 1.00 0.00 N ATOM 25 CA LEU A -2 -5.810 -23.368 0.770 1.00 0.00 C ATOM 26 C LEU A -2 -4.397 -23.465 1.334 1.00 0.00 C ATOM 27 O LEU A -2 -4.209 -23.664 2.535 1.00 0.00 O ATOM 28 CB LEU A -2 -6.416 -24.773 0.663 1.00 0.00 C ATOM 29 CG LEU A -2 -6.885 -25.241 2.053 1.00 0.00 C ATOM 30 CD1 LEU A -2 -8.316 -24.752 2.303 1.00 0.00 C ATOM 31 CD2 LEU A -2 -6.850 -26.769 2.117 1.00 0.00 C ATOM 0 H LEU A -2 -4.873 -22.628 -0.952 1.00 0.00 H new ATOM 0 HA LEU A -2 -6.415 -22.759 1.442 1.00 0.00 H new ATOM 0 HB2 LEU A -2 -7.256 -24.766 -0.032 1.00 0.00 H new ATOM 0 HB3 LEU A -2 -5.678 -25.469 0.264 1.00 0.00 H new ATOM 0 HG LEU A -2 -6.223 -24.830 2.815 1.00 0.00 H new ATOM 0 HD11 LEU A -2 -8.647 -25.084 3.287 1.00 0.00 H new ATOM 0 HD12 LEU A -2 -8.341 -23.663 2.260 1.00 0.00 H new ATOM 0 HD13 LEU A -2 -8.979 -25.161 1.540 1.00 0.00 H new ATOM 0 HD21 LEU A -2 -7.182 -27.100 3.101 1.00 0.00 H new ATOM 0 HD22 LEU A -2 -7.511 -27.180 1.354 1.00 0.00 H new ATOM 0 HD23 LEU A -2 -5.832 -27.117 1.942 1.00 0.00 H new ATOM 43 N GLY A -1 -3.407 -23.327 0.463 1.00 0.00 N ATOM 44 CA GLY A -1 -2.012 -23.401 0.883 1.00 0.00 C ATOM 45 C GLY A -1 -1.520 -22.041 1.366 1.00 0.00 C ATOM 46 O GLY A -1 -0.429 -21.927 1.923 1.00 0.00 O ATOM 0 H GLY A -1 -3.541 -23.164 -0.535 1.00 0.00 H new ATOM 0 HA2 GLY A -1 -1.906 -24.136 1.681 1.00 0.00 H new ATOM 0 HA3 GLY A -1 -1.395 -23.742 0.052 1.00 0.00 H new ATOM 50 N SER A 0 -2.333 -21.011 1.151 1.00 0.00 N ATOM 51 CA SER A 0 -1.970 -19.663 1.572 1.00 0.00 C ATOM 52 C SER A 0 -1.808 -19.600 3.087 1.00 0.00 C ATOM 53 O SER A 0 -0.942 -18.892 3.600 1.00 0.00 O ATOM 54 CB SER A 0 -3.045 -18.671 1.128 1.00 0.00 C ATOM 55 OG SER A 0 -4.292 -19.043 1.701 1.00 0.00 O ATOM 0 H SER A 0 -3.241 -21.083 0.691 1.00 0.00 H new ATOM 0 HA SER A 0 -1.020 -19.400 1.107 1.00 0.00 H new ATOM 0 HB2 SER A 0 -2.775 -17.662 1.439 1.00 0.00 H new ATOM 0 HB3 SER A 0 -3.120 -18.661 0.041 1.00 0.00 H new ATOM 0 HG SER A 0 -4.772 -18.239 1.991 1.00 0.00 H new ATOM 61 N ILE A 211 -2.648 -20.346 3.797 1.00 0.00 N ATOM 62 CA ILE A 211 -2.589 -20.364 5.254 1.00 0.00 C ATOM 63 C ILE A 211 -1.279 -20.990 5.729 1.00 0.00 C ATOM 64 O ILE A 211 -0.642 -20.493 6.656 1.00 0.00 O ATOM 65 CB ILE A 211 -3.769 -21.164 5.812 1.00 0.00 C ATOM 66 CG1 ILE A 211 -3.846 -20.967 7.328 1.00 0.00 C ATOM 67 CG2 ILE A 211 -3.578 -22.650 5.500 1.00 0.00 C ATOM 68 CD1 ILE A 211 -5.155 -21.557 7.856 1.00 0.00 C ATOM 0 H ILE A 211 -3.371 -20.941 3.392 1.00 0.00 H new ATOM 0 HA ILE A 211 -2.641 -19.337 5.615 1.00 0.00 H new ATOM 0 HB ILE A 211 -4.693 -20.815 5.351 1.00 0.00 H new ATOM 0 HG12 ILE A 211 -2.997 -21.450 7.811 1.00 0.00 H new ATOM 0 HG13 ILE A 211 -3.790 -19.906 7.570 1.00 0.00 H new ATOM 0 HG21 ILE A 211 -4.420 -23.217 5.899 1.00 0.00 H new ATOM 0 HG22 ILE A 211 -3.524 -22.791 4.421 1.00 0.00 H new ATOM 0 HG23 ILE A 211 -2.654 -23.002 5.958 1.00 0.00 H new ATOM 0 HD11 ILE A 211 -5.208 -21.416 8.936 1.00 0.00 H new ATOM 0 HD12 ILE A 211 -5.998 -21.054 7.382 1.00 0.00 H new ATOM 0 HD13 ILE A 211 -5.193 -22.622 7.627 1.00 0.00 H new ATOM 80 N LYS A 212 -0.889 -22.084 5.086 1.00 0.00 N ATOM 81 CA LYS A 212 0.344 -22.773 5.449 1.00 0.00 C ATOM 82 C LYS A 212 1.548 -21.860 5.238 1.00 0.00 C ATOM 83 O LYS A 212 2.434 -21.783 6.086 1.00 0.00 O ATOM 84 CB LYS A 212 0.508 -24.039 4.605 1.00 0.00 C ATOM 85 CG LYS A 212 1.739 -24.816 5.080 1.00 0.00 C ATOM 86 CD LYS A 212 1.867 -26.110 4.275 1.00 0.00 C ATOM 87 CE LYS A 212 3.089 -26.893 4.760 1.00 0.00 C ATOM 88 NZ LYS A 212 2.887 -27.298 6.180 1.00 0.00 N ATOM 0 H LYS A 212 -1.404 -22.511 4.316 1.00 0.00 H new ATOM 0 HA LYS A 212 0.287 -23.046 6.503 1.00 0.00 H new ATOM 0 HB2 LYS A 212 -0.383 -24.662 4.689 1.00 0.00 H new ATOM 0 HB3 LYS A 212 0.615 -23.776 3.553 1.00 0.00 H new ATOM 0 HG2 LYS A 212 2.636 -24.208 4.957 1.00 0.00 H new ATOM 0 HG3 LYS A 212 1.651 -25.043 6.142 1.00 0.00 H new ATOM 0 HD2 LYS A 212 0.966 -26.713 4.390 1.00 0.00 H new ATOM 0 HD3 LYS A 212 1.965 -25.882 3.214 1.00 0.00 H new ATOM 0 HE2 LYS A 212 3.240 -27.775 4.137 1.00 0.00 H new ATOM 0 HE3 LYS A 212 3.986 -26.281 4.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 212 3.509 -28.101 6.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 212 3.115 -26.498 6.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 212 1.896 -27.578 6.324 1.00 0.00 H new ATOM 102 N GLU A 213 1.572 -21.173 4.102 1.00 0.00 N ATOM 103 CA GLU A 213 2.673 -20.269 3.789 1.00 0.00 C ATOM 104 C GLU A 213 2.700 -19.098 4.765 1.00 0.00 C ATOM 105 O GLU A 213 3.712 -18.414 4.909 1.00 0.00 O ATOM 106 CB GLU A 213 2.527 -19.743 2.360 1.00 0.00 C ATOM 107 CG GLU A 213 3.750 -18.897 1.997 1.00 0.00 C ATOM 108 CD GLU A 213 3.667 -18.456 0.541 1.00 0.00 C ATOM 109 OE1 GLU A 213 2.608 -18.612 -0.046 1.00 0.00 O ATOM 110 OE2 GLU A 213 4.663 -17.969 0.032 1.00 0.00 O ATOM 0 H GLU A 213 0.847 -21.224 3.386 1.00 0.00 H new ATOM 0 HA GLU A 213 3.608 -20.822 3.878 1.00 0.00 H new ATOM 0 HB2 GLU A 213 2.428 -20.576 1.664 1.00 0.00 H new ATOM 0 HB3 GLU A 213 1.620 -19.145 2.273 1.00 0.00 H new ATOM 0 HG2 GLU A 213 3.804 -18.024 2.647 1.00 0.00 H new ATOM 0 HG3 GLU A 213 4.661 -19.472 2.160 1.00 0.00 H new ATOM 117 N LEU A 214 1.579 -18.872 5.437 1.00 0.00 N ATOM 118 CA LEU A 214 1.486 -17.781 6.391 1.00 0.00 C ATOM 119 C LEU A 214 2.535 -17.925 7.487 1.00 0.00 C ATOM 120 O LEU A 214 3.030 -16.928 8.019 1.00 0.00 O ATOM 121 CB LEU A 214 0.085 -17.756 7.022 1.00 0.00 C ATOM 122 CG LEU A 214 -0.194 -16.359 7.610 1.00 0.00 C ATOM 123 CD1 LEU A 214 -0.746 -15.439 6.515 1.00 0.00 C ATOM 124 CD2 LEU A 214 -1.216 -16.476 8.741 1.00 0.00 C ATOM 0 H LEU A 214 0.728 -19.426 5.339 1.00 0.00 H new ATOM 0 HA LEU A 214 1.665 -16.847 5.859 1.00 0.00 H new ATOM 0 HB2 LEU A 214 -0.667 -18.002 6.272 1.00 0.00 H new ATOM 0 HB3 LEU A 214 0.014 -18.511 7.805 1.00 0.00 H new ATOM 0 HG LEU A 214 0.734 -15.940 8.000 1.00 0.00 H new ATOM 0 HD11 LEU A 214 -0.942 -14.452 6.934 1.00 0.00 H new ATOM 0 HD12 LEU A 214 -0.016 -15.353 5.710 1.00 0.00 H new ATOM 0 HD13 LEU A 214 -1.673 -15.857 6.122 1.00 0.00 H new ATOM 0 HD21 LEU A 214 -1.413 -15.488 9.157 1.00 0.00 H new ATOM 0 HD22 LEU A 214 -2.143 -16.898 8.352 1.00 0.00 H new ATOM 0 HD23 LEU A 214 -0.822 -17.126 9.522 1.00 0.00 H new ATOM 136 N LYS A 215 2.857 -19.162 7.830 1.00 0.00 N ATOM 137 CA LYS A 215 3.842 -19.426 8.871 1.00 0.00 C ATOM 138 C LYS A 215 5.069 -18.538 8.684 1.00 0.00 C ATOM 139 O LYS A 215 5.741 -18.182 9.650 1.00 0.00 O ATOM 140 CB LYS A 215 4.257 -20.900 8.828 1.00 0.00 C ATOM 141 CG LYS A 215 5.051 -21.176 7.547 1.00 0.00 C ATOM 142 CD LYS A 215 5.319 -22.676 7.425 1.00 0.00 C ATOM 143 CE LYS A 215 6.231 -22.933 6.225 1.00 0.00 C ATOM 144 NZ LYS A 215 5.511 -22.580 4.968 1.00 0.00 N ATOM 0 H LYS A 215 2.453 -19.997 7.406 1.00 0.00 H new ATOM 0 HA LYS A 215 3.395 -19.203 9.840 1.00 0.00 H new ATOM 0 HB2 LYS A 215 4.862 -21.143 9.702 1.00 0.00 H new ATOM 0 HB3 LYS A 215 3.374 -21.538 8.864 1.00 0.00 H new ATOM 0 HG2 LYS A 215 4.494 -20.824 6.679 1.00 0.00 H new ATOM 0 HG3 LYS A 215 5.993 -20.628 7.565 1.00 0.00 H new ATOM 0 HD2 LYS A 215 5.786 -23.049 8.337 1.00 0.00 H new ATOM 0 HD3 LYS A 215 4.380 -23.216 7.304 1.00 0.00 H new ATOM 0 HE2 LYS A 215 7.142 -22.341 6.314 1.00 0.00 H new ATOM 0 HE3 LYS A 215 6.533 -23.980 6.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 215 5.574 -23.372 4.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 215 4.512 -22.387 5.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 215 5.944 -21.734 4.546 1.00 0.00 H new ATOM 158 N MET A 216 5.359 -18.196 7.432 1.00 0.00 N ATOM 159 CA MET A 216 6.512 -17.360 7.130 1.00 0.00 C ATOM 160 C MET A 216 6.352 -15.985 7.773 1.00 0.00 C ATOM 161 O MET A 216 7.306 -15.425 8.304 1.00 0.00 O ATOM 162 CB MET A 216 6.665 -17.204 5.615 1.00 0.00 C ATOM 163 CG MET A 216 7.970 -16.466 5.303 1.00 0.00 C ATOM 164 SD MET A 216 9.375 -17.527 5.728 1.00 0.00 S ATOM 165 CE MET A 216 10.496 -16.953 4.429 1.00 0.00 C ATOM 0 H MET A 216 4.816 -18.483 6.618 1.00 0.00 H new ATOM 0 HA MET A 216 7.404 -17.840 7.534 1.00 0.00 H new ATOM 0 HB2 MET A 216 6.666 -18.184 5.137 1.00 0.00 H new ATOM 0 HB3 MET A 216 5.817 -16.652 5.209 1.00 0.00 H new ATOM 0 HG2 MET A 216 8.007 -16.200 4.247 1.00 0.00 H new ATOM 0 HG3 MET A 216 8.019 -15.535 5.868 1.00 0.00 H new ATOM 0 HE1 MET A 216 11.444 -17.486 4.505 1.00 0.00 H new ATOM 0 HE2 MET A 216 10.050 -17.143 3.453 1.00 0.00 H new ATOM 0 HE3 MET A 216 10.671 -15.883 4.546 1.00 0.00 H new ATOM 175 N SER A 217 5.137 -15.450 7.717 1.00 0.00 N ATOM 176 CA SER A 217 4.862 -14.138 8.295 1.00 0.00 C ATOM 177 C SER A 217 5.128 -14.151 9.796 1.00 0.00 C ATOM 178 O SER A 217 5.689 -13.204 10.345 1.00 0.00 O ATOM 179 CB SER A 217 3.407 -13.748 8.034 1.00 0.00 C ATOM 180 OG SER A 217 3.253 -12.350 8.242 1.00 0.00 O ATOM 0 H SER A 217 4.332 -15.900 7.281 1.00 0.00 H new ATOM 0 HA SER A 217 5.522 -13.407 7.827 1.00 0.00 H new ATOM 0 HB2 SER A 217 3.125 -14.009 7.014 1.00 0.00 H new ATOM 0 HB3 SER A 217 2.745 -14.302 8.699 1.00 0.00 H new ATOM 0 HG SER A 217 2.322 -12.095 8.074 1.00 0.00 H new ATOM 186 N LYS A 218 4.718 -15.228 10.454 1.00 0.00 N ATOM 187 CA LYS A 218 4.917 -15.355 11.892 1.00 0.00 C ATOM 188 C LYS A 218 6.405 -15.366 12.229 1.00 0.00 C ATOM 189 O LYS A 218 6.828 -14.799 13.233 1.00 0.00 O ATOM 190 CB LYS A 218 4.268 -16.643 12.400 1.00 0.00 C ATOM 191 CG LYS A 218 2.746 -16.532 12.277 1.00 0.00 C ATOM 192 CD LYS A 218 2.096 -17.824 12.774 1.00 0.00 C ATOM 193 CE LYS A 218 0.575 -17.710 12.655 1.00 0.00 C ATOM 194 NZ LYS A 218 -0.057 -18.972 13.132 1.00 0.00 N ATOM 0 H LYS A 218 4.248 -16.022 10.018 1.00 0.00 H new ATOM 0 HA LYS A 218 4.451 -14.498 12.379 1.00 0.00 H new ATOM 0 HB2 LYS A 218 4.629 -17.496 11.825 1.00 0.00 H new ATOM 0 HB3 LYS A 218 4.548 -16.818 13.439 1.00 0.00 H new ATOM 0 HG2 LYS A 218 2.385 -15.684 12.859 1.00 0.00 H new ATOM 0 HG3 LYS A 218 2.467 -16.348 11.239 1.00 0.00 H new ATOM 0 HD2 LYS A 218 2.454 -18.672 12.190 1.00 0.00 H new ATOM 0 HD3 LYS A 218 2.377 -18.009 13.811 1.00 0.00 H new ATOM 0 HE2 LYS A 218 0.216 -16.866 13.244 1.00 0.00 H new ATOM 0 HE3 LYS A 218 0.294 -17.519 11.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 218 -1.091 -18.895 13.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 218 0.277 -19.768 12.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 218 0.201 -19.135 14.126 1.00 0.00 H new ATOM 208 N ASP A 219 7.193 -16.021 11.385 1.00 0.00 N ATOM 209 CA ASP A 219 8.632 -16.104 11.606 1.00 0.00 C ATOM 210 C ASP A 219 9.266 -14.720 11.539 1.00 0.00 C ATOM 211 O ASP A 219 10.184 -14.409 12.299 1.00 0.00 O ATOM 212 CB ASP A 219 9.271 -17.013 10.554 1.00 0.00 C ATOM 213 CG ASP A 219 8.910 -18.469 10.830 1.00 0.00 C ATOM 214 OD1 ASP A 219 8.450 -18.749 11.925 1.00 0.00 O ATOM 215 OD2 ASP A 219 9.095 -19.283 9.941 1.00 0.00 O ATOM 0 H ASP A 219 6.863 -16.499 10.547 1.00 0.00 H new ATOM 0 HA ASP A 219 8.804 -16.521 12.598 1.00 0.00 H new ATOM 0 HB2 ASP A 219 8.929 -16.728 9.559 1.00 0.00 H new ATOM 0 HB3 ASP A 219 10.354 -16.890 10.566 1.00 0.00 H new ATOM 220 N GLU A 220 8.774 -13.891 10.624 1.00 0.00 N ATOM 221 CA GLU A 220 9.304 -12.543 10.469 1.00 0.00 C ATOM 222 C GLU A 220 9.223 -11.782 11.786 1.00 0.00 C ATOM 223 O GLU A 220 10.018 -10.882 12.038 1.00 0.00 O ATOM 224 CB GLU A 220 8.517 -11.790 9.393 1.00 0.00 C ATOM 225 CG GLU A 220 8.795 -12.411 8.024 1.00 0.00 C ATOM 226 CD GLU A 220 7.951 -11.724 6.957 1.00 0.00 C ATOM 227 OE1 GLU A 220 7.211 -10.819 7.307 1.00 0.00 O ATOM 228 OE2 GLU A 220 8.057 -12.112 5.804 1.00 0.00 O ATOM 0 H GLU A 220 8.016 -14.127 9.984 1.00 0.00 H new ATOM 0 HA GLU A 220 10.349 -12.617 10.168 1.00 0.00 H new ATOM 0 HB2 GLU A 220 7.450 -11.832 9.612 1.00 0.00 H new ATOM 0 HB3 GLU A 220 8.801 -10.738 9.390 1.00 0.00 H new ATOM 0 HG2 GLU A 220 9.853 -12.314 7.780 1.00 0.00 H new ATOM 0 HG3 GLU A 220 8.569 -13.477 8.047 1.00 0.00 H new ATOM 235 N ILE A 221 8.260 -12.153 12.619 1.00 0.00 N ATOM 236 CA ILE A 221 8.081 -11.504 13.912 1.00 0.00 C ATOM 237 C ILE A 221 9.299 -11.738 14.802 1.00 0.00 C ATOM 238 O ILE A 221 9.581 -10.949 15.704 1.00 0.00 O ATOM 239 CB ILE A 221 6.828 -12.043 14.602 1.00 0.00 C ATOM 240 CG1 ILE A 221 5.620 -11.853 13.681 1.00 0.00 C ATOM 241 CG2 ILE A 221 6.597 -11.281 15.907 1.00 0.00 C ATOM 242 CD1 ILE A 221 4.410 -12.582 14.268 1.00 0.00 C ATOM 0 H ILE A 221 7.592 -12.898 12.424 1.00 0.00 H new ATOM 0 HA ILE A 221 7.967 -10.433 13.746 1.00 0.00 H new ATOM 0 HB ILE A 221 6.959 -13.103 14.819 1.00 0.00 H new ATOM 0 HG12 ILE A 221 5.399 -10.792 13.568 1.00 0.00 H new ATOM 0 HG13 ILE A 221 5.843 -12.239 12.687 1.00 0.00 H new ATOM 0 HG21 ILE A 221 5.704 -11.665 16.399 1.00 0.00 H new ATOM 0 HG22 ILE A 221 7.458 -11.413 16.563 1.00 0.00 H new ATOM 0 HG23 ILE A 221 6.465 -10.221 15.691 1.00 0.00 H new ATOM 0 HD11 ILE A 221 3.550 -12.446 13.612 1.00 0.00 H new ATOM 0 HD12 ILE A 221 4.634 -13.645 14.358 1.00 0.00 H new ATOM 0 HD13 ILE A 221 4.183 -12.175 15.253 1.00 0.00 H new ATOM 254 N LYS A 222 10.011 -12.827 14.545 1.00 0.00 N ATOM 255 CA LYS A 222 11.190 -13.159 15.332 1.00 0.00 C ATOM 256 C LYS A 222 12.211 -12.028 15.273 1.00 0.00 C ATOM 257 O LYS A 222 12.954 -11.802 16.226 1.00 0.00 O ATOM 258 CB LYS A 222 11.824 -14.451 14.806 1.00 0.00 C ATOM 259 CG LYS A 222 12.752 -15.041 15.872 1.00 0.00 C ATOM 260 CD LYS A 222 13.248 -16.414 15.417 1.00 0.00 C ATOM 261 CE LYS A 222 14.174 -16.255 14.207 1.00 0.00 C ATOM 262 NZ LYS A 222 14.994 -17.485 14.044 1.00 0.00 N ATOM 0 H LYS A 222 9.794 -13.492 13.802 1.00 0.00 H new ATOM 0 HA LYS A 222 10.883 -13.301 16.368 1.00 0.00 H new ATOM 0 HB2 LYS A 222 11.047 -15.170 14.548 1.00 0.00 H new ATOM 0 HB3 LYS A 222 12.385 -14.247 13.894 1.00 0.00 H new ATOM 0 HG2 LYS A 222 13.598 -14.375 16.041 1.00 0.00 H new ATOM 0 HG3 LYS A 222 12.222 -15.130 16.821 1.00 0.00 H new ATOM 0 HD2 LYS A 222 13.779 -16.907 16.231 1.00 0.00 H new ATOM 0 HD3 LYS A 222 12.401 -17.049 15.158 1.00 0.00 H new ATOM 0 HE2 LYS A 222 13.586 -16.075 13.307 1.00 0.00 H new ATOM 0 HE3 LYS A 222 14.822 -15.389 14.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 222 15.623 -17.377 13.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 222 15.565 -17.637 14.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 222 14.368 -18.302 13.896 1.00 0.00 H new ATOM 276 N ARG A 223 12.246 -11.326 14.150 1.00 0.00 N ATOM 277 CA ARG A 223 13.186 -10.224 13.977 1.00 0.00 C ATOM 278 C ARG A 223 13.121 -9.276 15.173 1.00 0.00 C ATOM 279 O ARG A 223 14.130 -8.709 15.582 1.00 0.00 O ATOM 280 CB ARG A 223 12.853 -9.460 12.688 1.00 0.00 C ATOM 281 CG ARG A 223 11.604 -8.598 12.902 1.00 0.00 C ATOM 282 CD ARG A 223 11.097 -8.087 11.557 1.00 0.00 C ATOM 283 NE ARG A 223 9.931 -7.234 11.752 1.00 0.00 N ATOM 284 CZ ARG A 223 9.109 -6.959 10.746 1.00 0.00 C ATOM 285 NH1 ARG A 223 9.338 -7.454 9.560 1.00 0.00 N ATOM 286 NH2 ARG A 223 8.071 -6.194 10.943 1.00 0.00 N ATOM 0 H ARG A 223 11.639 -11.497 13.348 1.00 0.00 H new ATOM 0 HA ARG A 223 14.195 -10.629 13.908 1.00 0.00 H new ATOM 0 HB2 ARG A 223 13.695 -8.831 12.400 1.00 0.00 H new ATOM 0 HB3 ARG A 223 12.686 -10.162 11.871 1.00 0.00 H new ATOM 0 HG2 ARG A 223 10.828 -9.182 13.397 1.00 0.00 H new ATOM 0 HG3 ARG A 223 11.837 -7.758 13.557 1.00 0.00 H new ATOM 0 HD2 ARG A 223 11.885 -7.529 11.051 1.00 0.00 H new ATOM 0 HD3 ARG A 223 10.838 -8.928 10.914 1.00 0.00 H new ATOM 0 HE ARG A 223 9.744 -6.843 12.675 1.00 0.00 H new ATOM 0 HH11 ARG A 223 10.149 -8.053 9.405 1.00 0.00 H new ATOM 0 HH12 ARG A 223 8.706 -7.242 8.788 1.00 0.00 H new ATOM 0 HH21 ARG A 223 7.891 -5.807 11.870 1.00 0.00 H new ATOM 0 HH22 ARG A 223 7.439 -5.983 10.171 1.00 0.00 H new ATOM 300 N GLU A 224 11.919 -9.096 15.712 1.00 0.00 N ATOM 301 CA GLU A 224 11.730 -8.204 16.849 1.00 0.00 C ATOM 302 C GLU A 224 12.597 -8.649 18.020 1.00 0.00 C ATOM 303 O GLU A 224 12.894 -7.865 18.920 1.00 0.00 O ATOM 304 CB GLU A 224 10.260 -8.196 17.273 1.00 0.00 C ATOM 305 CG GLU A 224 9.417 -7.528 16.184 1.00 0.00 C ATOM 306 CD GLU A 224 7.939 -7.596 16.553 1.00 0.00 C ATOM 307 OE1 GLU A 224 7.633 -8.168 17.584 1.00 0.00 O ATOM 308 OE2 GLU A 224 7.136 -7.071 15.799 1.00 0.00 O ATOM 0 H GLU A 224 11.068 -9.552 15.383 1.00 0.00 H new ATOM 0 HA GLU A 224 12.023 -7.197 16.551 1.00 0.00 H new ATOM 0 HB2 GLU A 224 9.914 -9.216 17.441 1.00 0.00 H new ATOM 0 HB3 GLU A 224 10.145 -7.661 18.216 1.00 0.00 H new ATOM 0 HG2 GLU A 224 9.722 -6.489 16.062 1.00 0.00 H new ATOM 0 HG3 GLU A 224 9.585 -8.023 15.228 1.00 0.00 H new ATOM 315 N TYR A 225 12.999 -9.915 18.002 1.00 0.00 N ATOM 316 CA TYR A 225 13.832 -10.460 19.066 1.00 0.00 C ATOM 317 C TYR A 225 15.167 -9.725 19.124 1.00 0.00 C ATOM 318 O TYR A 225 15.672 -9.416 20.202 1.00 0.00 O ATOM 319 CB TYR A 225 14.075 -11.952 18.829 1.00 0.00 C ATOM 320 CG TYR A 225 14.928 -12.506 19.947 1.00 0.00 C ATOM 321 CD1 TYR A 225 14.358 -12.766 21.197 1.00 0.00 C ATOM 322 CD2 TYR A 225 16.289 -12.760 19.730 1.00 0.00 C ATOM 323 CE1 TYR A 225 15.147 -13.280 22.233 1.00 0.00 C ATOM 324 CE2 TYR A 225 17.078 -13.274 20.766 1.00 0.00 C ATOM 325 CZ TYR A 225 16.506 -13.533 22.018 1.00 0.00 C ATOM 326 OH TYR A 225 17.285 -14.038 23.039 1.00 0.00 O ATOM 0 H TYR A 225 12.763 -10.580 17.266 1.00 0.00 H new ATOM 0 HA TYR A 225 13.314 -10.327 20.016 1.00 0.00 H new ATOM 0 HB2 TYR A 225 13.125 -12.484 18.784 1.00 0.00 H new ATOM 0 HB3 TYR A 225 14.570 -12.103 17.870 1.00 0.00 H new ATOM 0 HD1 TYR A 225 13.309 -12.570 21.363 1.00 0.00 H new ATOM 0 HD2 TYR A 225 16.729 -12.559 18.764 1.00 0.00 H new ATOM 0 HE1 TYR A 225 14.706 -13.481 23.198 1.00 0.00 H new ATOM 0 HE2 TYR A 225 18.127 -13.471 20.600 1.00 0.00 H new ATOM 0 HH TYR A 225 18.204 -14.156 22.721 1.00 0.00 H new ATOM 336 N LYS A 226 15.737 -9.455 17.955 1.00 0.00 N ATOM 337 CA LYS A 226 17.017 -8.760 17.883 1.00 0.00 C ATOM 338 C LYS A 226 16.894 -7.353 18.446 1.00 0.00 C ATOM 339 O LYS A 226 17.782 -6.885 19.159 1.00 0.00 O ATOM 340 CB LYS A 226 17.496 -8.695 16.426 1.00 0.00 C ATOM 341 CG LYS A 226 18.056 -10.056 15.999 1.00 0.00 C ATOM 342 CD LYS A 226 16.909 -11.053 15.818 1.00 0.00 C ATOM 343 CE LYS A 226 17.430 -12.311 15.131 1.00 0.00 C ATOM 344 NZ LYS A 226 18.354 -13.033 16.051 1.00 0.00 N ATOM 0 H LYS A 226 15.337 -9.704 17.051 1.00 0.00 H new ATOM 0 HA LYS A 226 17.744 -9.312 18.478 1.00 0.00 H new ATOM 0 HB2 LYS A 226 16.669 -8.412 15.775 1.00 0.00 H new ATOM 0 HB3 LYS A 226 18.263 -7.927 16.320 1.00 0.00 H new ATOM 0 HG2 LYS A 226 18.613 -9.955 15.067 1.00 0.00 H new ATOM 0 HG3 LYS A 226 18.755 -10.424 16.750 1.00 0.00 H new ATOM 0 HD2 LYS A 226 16.478 -11.307 16.786 1.00 0.00 H new ATOM 0 HD3 LYS A 226 16.114 -10.604 15.223 1.00 0.00 H new ATOM 0 HE2 LYS A 226 16.598 -12.958 14.853 1.00 0.00 H new ATOM 0 HE3 LYS A 226 17.950 -12.047 14.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 226 18.603 -13.955 15.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 226 19.218 -12.470 16.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 226 17.887 -13.178 16.969 1.00 0.00 H new ATOM 358 N GLU A 227 15.796 -6.685 18.120 1.00 0.00 N ATOM 359 CA GLU A 227 15.573 -5.327 18.601 1.00 0.00 C ATOM 360 C GLU A 227 15.533 -5.301 20.126 1.00 0.00 C ATOM 361 O GLU A 227 16.052 -4.379 20.754 1.00 0.00 O ATOM 362 CB GLU A 227 14.251 -4.789 18.046 1.00 0.00 C ATOM 363 CG GLU A 227 14.076 -3.328 18.471 1.00 0.00 C ATOM 364 CD GLU A 227 12.798 -2.760 17.864 1.00 0.00 C ATOM 365 OE1 GLU A 227 12.010 -3.539 17.353 1.00 0.00 O ATOM 366 OE2 GLU A 227 12.625 -1.553 17.921 1.00 0.00 O ATOM 0 H GLU A 227 15.051 -7.056 17.530 1.00 0.00 H new ATOM 0 HA GLU A 227 16.395 -4.699 18.258 1.00 0.00 H new ATOM 0 HB2 GLU A 227 14.242 -4.866 16.959 1.00 0.00 H new ATOM 0 HB3 GLU A 227 13.419 -5.388 18.415 1.00 0.00 H new ATOM 0 HG2 GLU A 227 14.034 -3.259 19.558 1.00 0.00 H new ATOM 0 HG3 GLU A 227 14.935 -2.741 18.147 1.00 0.00 H new ATOM 373 N MET A 228 14.913 -6.319 20.713 1.00 0.00 N ATOM 374 CA MET A 228 14.810 -6.399 22.165 1.00 0.00 C ATOM 375 C MET A 228 16.196 -6.496 22.795 1.00 0.00 C ATOM 376 O MET A 228 16.468 -5.866 23.819 1.00 0.00 O ATOM 377 CB MET A 228 13.978 -7.621 22.563 1.00 0.00 C ATOM 378 CG MET A 228 13.819 -7.662 24.087 1.00 0.00 C ATOM 379 SD MET A 228 15.286 -8.421 24.830 1.00 0.00 S ATOM 380 CE MET A 228 14.741 -10.140 24.704 1.00 0.00 C ATOM 0 H MET A 228 14.478 -7.093 20.211 1.00 0.00 H new ATOM 0 HA MET A 228 14.322 -5.494 22.527 1.00 0.00 H new ATOM 0 HB2 MET A 228 12.999 -7.577 22.086 1.00 0.00 H new ATOM 0 HB3 MET A 228 14.462 -8.533 22.213 1.00 0.00 H new ATOM 0 HG2 MET A 228 13.683 -6.653 24.476 1.00 0.00 H new ATOM 0 HG3 MET A 228 12.928 -8.230 24.355 1.00 0.00 H new ATOM 0 HE1 MET A 228 15.509 -10.796 25.113 1.00 0.00 H new ATOM 0 HE2 MET A 228 13.816 -10.271 25.266 1.00 0.00 H new ATOM 0 HE3 MET A 228 14.568 -10.391 23.657 1.00 0.00 H new ATOM 390 N GLU A 229 17.066 -7.291 22.182 1.00 0.00 N ATOM 391 CA GLU A 229 18.421 -7.465 22.694 1.00 0.00 C ATOM 392 C GLU A 229 19.224 -6.181 22.518 1.00 0.00 C ATOM 393 O GLU A 229 20.065 -5.843 23.351 1.00 0.00 O ATOM 394 CB GLU A 229 19.115 -8.613 21.957 1.00 0.00 C ATOM 395 CG GLU A 229 20.498 -8.848 22.566 1.00 0.00 C ATOM 396 CD GLU A 229 21.167 -10.041 21.893 1.00 0.00 C ATOM 397 OE1 GLU A 229 20.472 -10.785 21.220 1.00 0.00 O ATOM 398 OE2 GLU A 229 22.367 -10.195 22.060 1.00 0.00 O ATOM 0 H GLU A 229 16.860 -7.822 21.336 1.00 0.00 H new ATOM 0 HA GLU A 229 18.363 -7.702 23.756 1.00 0.00 H new ATOM 0 HB2 GLU A 229 18.515 -9.520 22.029 1.00 0.00 H new ATOM 0 HB3 GLU A 229 19.208 -8.375 20.897 1.00 0.00 H new ATOM 0 HG2 GLU A 229 21.115 -7.958 22.443 1.00 0.00 H new ATOM 0 HG3 GLU A 229 20.407 -9.028 23.637 1.00 0.00 H new ATOM 405 N GLY A 230 18.962 -5.469 21.426 1.00 0.00 N ATOM 406 CA GLY A 230 19.668 -4.225 21.149 1.00 0.00 C ATOM 407 C GLY A 230 21.063 -4.501 20.608 1.00 0.00 C ATOM 408 O GLY A 230 21.226 -5.185 19.597 1.00 0.00 O ATOM 0 H GLY A 230 18.270 -5.731 20.723 1.00 0.00 H new ATOM 0 HA2 GLY A 230 19.104 -3.635 20.427 1.00 0.00 H new ATOM 0 HA3 GLY A 230 19.738 -3.631 22.060 1.00 0.00 H new ATOM 412 N SER A 231 22.074 -3.966 21.287 1.00 0.00 N ATOM 413 CA SER A 231 23.456 -4.165 20.863 1.00 0.00 C ATOM 414 C SER A 231 24.356 -4.416 22.070 1.00 0.00 C ATOM 415 O SER A 231 23.987 -4.117 23.207 1.00 0.00 O ATOM 416 CB SER A 231 23.950 -2.926 20.093 1.00 0.00 C ATOM 417 OG SER A 231 25.143 -2.433 20.695 1.00 0.00 O ATOM 0 H SER A 231 21.964 -3.396 22.126 1.00 0.00 H new ATOM 0 HA SER A 231 23.497 -5.037 20.210 1.00 0.00 H new ATOM 0 HB2 SER A 231 24.137 -3.184 19.051 1.00 0.00 H new ATOM 0 HB3 SER A 231 23.182 -2.153 20.098 1.00 0.00 H new ATOM 0 HG SER A 231 25.457 -1.646 20.203 1.00 0.00 H new ATOM 423 N PRO A 232 25.533 -4.938 21.836 1.00 0.00 N ATOM 424 CA PRO A 232 26.514 -5.225 22.920 1.00 0.00 C ATOM 425 C PRO A 232 27.110 -3.949 23.507 1.00 0.00 C ATOM 426 O PRO A 232 27.791 -3.192 22.813 1.00 0.00 O ATOM 427 CB PRO A 232 27.592 -6.066 22.219 1.00 0.00 C ATOM 428 CG PRO A 232 27.513 -5.679 20.774 1.00 0.00 C ATOM 429 CD PRO A 232 26.052 -5.313 20.509 1.00 0.00 C ATOM 0 HA PRO A 232 26.054 -5.735 23.767 1.00 0.00 H new ATOM 0 HB2 PRO A 232 28.581 -5.860 22.629 1.00 0.00 H new ATOM 0 HB3 PRO A 232 27.408 -7.132 22.352 1.00 0.00 H new ATOM 0 HG2 PRO A 232 28.170 -4.836 20.560 1.00 0.00 H new ATOM 0 HG3 PRO A 232 27.831 -6.501 20.133 1.00 0.00 H new ATOM 0 HD2 PRO A 232 25.969 -4.489 19.800 1.00 0.00 H new ATOM 0 HD3 PRO A 232 25.500 -6.153 20.087 1.00 0.00 H new ATOM 437 N GLU A 233 26.858 -3.721 24.791 1.00 0.00 N ATOM 438 CA GLU A 233 27.380 -2.538 25.464 1.00 0.00 C ATOM 439 C GLU A 233 28.817 -2.767 25.919 1.00 0.00 C ATOM 440 O GLU A 233 29.524 -1.824 26.273 1.00 0.00 O ATOM 441 CB GLU A 233 26.505 -2.203 26.675 1.00 0.00 C ATOM 442 CG GLU A 233 25.104 -1.809 26.202 1.00 0.00 C ATOM 443 CD GLU A 233 25.164 -0.502 25.416 1.00 0.00 C ATOM 444 OE1 GLU A 233 25.734 0.447 25.928 1.00 0.00 O ATOM 445 OE2 GLU A 233 24.642 -0.472 24.314 1.00 0.00 O ATOM 0 H GLU A 233 26.299 -4.335 25.383 1.00 0.00 H new ATOM 0 HA GLU A 233 27.365 -1.705 24.761 1.00 0.00 H new ATOM 0 HB2 GLU A 233 26.446 -3.062 27.343 1.00 0.00 H new ATOM 0 HB3 GLU A 233 26.951 -1.387 27.244 1.00 0.00 H new ATOM 0 HG2 GLU A 233 24.687 -2.599 25.578 1.00 0.00 H new ATOM 0 HG3 GLU A 233 24.440 -1.697 27.059 1.00 0.00 H new ATOM 452 N ILE A 234 29.244 -4.025 25.906 1.00 0.00 N ATOM 453 CA ILE A 234 30.599 -4.366 26.321 1.00 0.00 C ATOM 454 C ILE A 234 31.620 -3.730 25.381 1.00 0.00 C ATOM 455 O ILE A 234 32.630 -3.187 25.825 1.00 0.00 O ATOM 456 CB ILE A 234 30.777 -5.888 26.323 1.00 0.00 C ATOM 457 CG1 ILE A 234 29.911 -6.498 27.426 1.00 0.00 C ATOM 458 CG2 ILE A 234 32.247 -6.231 26.582 1.00 0.00 C ATOM 459 CD1 ILE A 234 29.861 -8.018 27.252 1.00 0.00 C ATOM 0 H ILE A 234 28.676 -4.820 25.615 1.00 0.00 H new ATOM 0 HA ILE A 234 30.761 -3.982 27.328 1.00 0.00 H new ATOM 0 HB ILE A 234 30.475 -6.291 25.356 1.00 0.00 H new ATOM 0 HG12 ILE A 234 30.319 -6.246 28.405 1.00 0.00 H new ATOM 0 HG13 ILE A 234 28.904 -6.083 27.384 1.00 0.00 H new ATOM 0 HG21 ILE A 234 32.373 -7.314 26.583 1.00 0.00 H new ATOM 0 HG22 ILE A 234 32.866 -5.794 25.798 1.00 0.00 H new ATOM 0 HG23 ILE A 234 32.549 -5.829 27.549 1.00 0.00 H new ATOM 0 HD11 ILE A 234 29.244 -8.454 28.038 1.00 0.00 H new ATOM 0 HD12 ILE A 234 29.433 -8.259 26.279 1.00 0.00 H new ATOM 0 HD13 ILE A 234 30.870 -8.425 27.315 1.00 0.00 H new ATOM 471 N LYS A 235 31.352 -3.810 24.083 1.00 0.00 N ATOM 472 CA LYS A 235 32.256 -3.243 23.089 1.00 0.00 C ATOM 473 C LYS A 235 32.230 -1.720 23.153 1.00 0.00 C ATOM 474 O LYS A 235 33.046 -1.049 22.520 1.00 0.00 O ATOM 475 CB LYS A 235 31.851 -3.706 21.689 1.00 0.00 C ATOM 476 CG LYS A 235 32.093 -5.212 21.557 1.00 0.00 C ATOM 477 CD LYS A 235 31.661 -5.678 20.166 1.00 0.00 C ATOM 478 CE LYS A 235 31.840 -7.194 20.058 1.00 0.00 C ATOM 479 NZ LYS A 235 33.291 -7.528 20.108 1.00 0.00 N ATOM 0 H LYS A 235 30.522 -4.259 23.696 1.00 0.00 H new ATOM 0 HA LYS A 235 33.267 -3.588 23.304 1.00 0.00 H new ATOM 0 HB2 LYS A 235 30.800 -3.479 21.510 1.00 0.00 H new ATOM 0 HB3 LYS A 235 32.426 -3.167 20.936 1.00 0.00 H new ATOM 0 HG2 LYS A 235 33.148 -5.437 21.716 1.00 0.00 H new ATOM 0 HG3 LYS A 235 31.533 -5.750 22.322 1.00 0.00 H new ATOM 0 HD2 LYS A 235 30.619 -5.410 19.988 1.00 0.00 H new ATOM 0 HD3 LYS A 235 32.254 -5.176 19.402 1.00 0.00 H new ATOM 0 HE2 LYS A 235 31.313 -7.692 20.872 1.00 0.00 H new ATOM 0 HE3 LYS A 235 31.404 -7.557 19.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 235 33.437 -8.494 19.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 235 33.822 -6.858 19.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 235 33.628 -7.465 21.090 1.00 0.00 H new ATOM 493 N SER A 236 31.288 -1.181 23.919 1.00 0.00 N ATOM 494 CA SER A 236 31.163 0.265 24.057 1.00 0.00 C ATOM 495 C SER A 236 32.398 0.847 24.736 1.00 0.00 C ATOM 496 O SER A 236 32.687 2.037 24.608 1.00 0.00 O ATOM 497 CB SER A 236 29.918 0.606 24.877 1.00 0.00 C ATOM 498 OG SER A 236 29.576 1.970 24.667 1.00 0.00 O ATOM 0 H SER A 236 30.604 -1.719 24.451 1.00 0.00 H new ATOM 0 HA SER A 236 31.071 0.700 23.062 1.00 0.00 H new ATOM 0 HB2 SER A 236 29.088 -0.038 24.585 1.00 0.00 H new ATOM 0 HB3 SER A 236 30.105 0.425 25.935 1.00 0.00 H new ATOM 0 HG SER A 236 28.777 2.191 25.190 1.00 0.00 H new ATOM 504 N LYS A 237 33.123 0.003 25.461 1.00 0.00 N ATOM 505 CA LYS A 237 34.324 0.447 26.158 1.00 0.00 C ATOM 506 C LYS A 237 35.397 0.871 25.161 1.00 0.00 C ATOM 507 O LYS A 237 36.317 1.612 25.503 1.00 0.00 O ATOM 508 CB LYS A 237 34.858 -0.682 27.041 1.00 0.00 C ATOM 509 CG LYS A 237 35.381 -1.820 26.159 1.00 0.00 C ATOM 510 CD LYS A 237 35.633 -3.060 27.019 1.00 0.00 C ATOM 511 CE LYS A 237 36.788 -2.791 27.987 1.00 0.00 C ATOM 512 NZ LYS A 237 37.272 -4.078 28.553 1.00 0.00 N ATOM 0 H LYS A 237 32.902 -0.986 25.581 1.00 0.00 H new ATOM 0 HA LYS A 237 34.067 1.304 26.780 1.00 0.00 H new ATOM 0 HB2 LYS A 237 35.656 -0.309 27.682 1.00 0.00 H new ATOM 0 HB3 LYS A 237 34.068 -1.050 27.696 1.00 0.00 H new ATOM 0 HG2 LYS A 237 34.658 -2.049 25.376 1.00 0.00 H new ATOM 0 HG3 LYS A 237 36.303 -1.515 25.663 1.00 0.00 H new ATOM 0 HD2 LYS A 237 34.732 -3.318 27.576 1.00 0.00 H new ATOM 0 HD3 LYS A 237 35.870 -3.913 26.383 1.00 0.00 H new ATOM 0 HE2 LYS A 237 37.600 -2.282 27.468 1.00 0.00 H new ATOM 0 HE3 LYS A 237 36.458 -2.130 28.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 237 38.057 -3.895 29.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 237 36.496 -4.547 29.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 237 37.602 -4.694 27.783 1.00 0.00 H new ATOM 526 N ARG A 238 35.273 0.392 23.927 1.00 0.00 N ATOM 527 CA ARG A 238 36.240 0.727 22.889 1.00 0.00 C ATOM 528 C ARG A 238 36.194 2.221 22.580 1.00 0.00 C ATOM 529 O ARG A 238 37.232 2.865 22.431 1.00 0.00 O ATOM 530 CB ARG A 238 35.941 -0.072 21.619 1.00 0.00 C ATOM 531 CG ARG A 238 37.015 0.218 20.567 1.00 0.00 C ATOM 532 CD ARG A 238 36.717 -0.581 19.299 1.00 0.00 C ATOM 533 NE ARG A 238 36.837 -2.012 19.565 1.00 0.00 N ATOM 534 CZ ARG A 238 38.018 -2.619 19.537 1.00 0.00 C ATOM 535 NH1 ARG A 238 39.098 -1.936 19.272 1.00 0.00 N ATOM 536 NH2 ARG A 238 38.099 -3.899 19.777 1.00 0.00 N ATOM 0 H ARG A 238 34.519 -0.224 23.624 1.00 0.00 H new ATOM 0 HA ARG A 238 37.237 0.473 23.248 1.00 0.00 H new ATOM 0 HB2 ARG A 238 35.917 -1.138 21.845 1.00 0.00 H new ATOM 0 HB3 ARG A 238 34.957 0.194 21.232 1.00 0.00 H new ATOM 0 HG2 ARG A 238 37.039 1.284 20.341 1.00 0.00 H new ATOM 0 HG3 ARG A 238 37.999 -0.047 20.954 1.00 0.00 H new ATOM 0 HD2 ARG A 238 35.712 -0.353 18.944 1.00 0.00 H new ATOM 0 HD3 ARG A 238 37.408 -0.292 18.507 1.00 0.00 H new ATOM 0 HE ARG A 238 35.999 -2.555 19.776 1.00 0.00 H new ATOM 0 HH11 ARG A 238 39.036 -0.935 19.086 1.00 0.00 H new ATOM 0 HH12 ARG A 238 40.004 -2.403 19.251 1.00 0.00 H new ATOM 0 HH21 ARG A 238 37.256 -4.433 19.986 1.00 0.00 H new ATOM 0 HH22 ARG A 238 39.006 -4.366 19.756 1.00 0.00 H new ATOM 550 N ARG A 239 34.986 2.763 22.479 1.00 0.00 N ATOM 551 CA ARG A 239 34.818 4.181 22.184 1.00 0.00 C ATOM 552 C ARG A 239 35.367 5.035 23.323 1.00 0.00 C ATOM 553 O ARG A 239 35.956 6.091 23.092 1.00 0.00 O ATOM 554 CB ARG A 239 33.338 4.500 21.970 1.00 0.00 C ATOM 555 CG ARG A 239 32.871 3.895 20.643 1.00 0.00 C ATOM 556 CD ARG A 239 31.381 4.184 20.448 1.00 0.00 C ATOM 557 NE ARG A 239 30.916 3.597 19.194 1.00 0.00 N ATOM 558 CZ ARG A 239 31.032 4.252 18.044 1.00 0.00 C ATOM 559 NH1 ARG A 239 31.572 5.440 18.020 1.00 0.00 N ATOM 560 NH2 ARG A 239 30.607 3.707 16.937 1.00 0.00 N ATOM 0 H ARG A 239 34.114 2.247 22.596 1.00 0.00 H new ATOM 0 HA ARG A 239 35.372 4.411 21.274 1.00 0.00 H new ATOM 0 HB2 ARG A 239 32.746 4.099 22.793 1.00 0.00 H new ATOM 0 HB3 ARG A 239 33.185 5.579 21.964 1.00 0.00 H new ATOM 0 HG2 ARG A 239 33.445 4.315 19.817 1.00 0.00 H new ATOM 0 HG3 ARG A 239 33.047 2.819 20.639 1.00 0.00 H new ATOM 0 HD2 ARG A 239 30.811 3.776 21.283 1.00 0.00 H new ATOM 0 HD3 ARG A 239 31.209 5.260 20.440 1.00 0.00 H new ATOM 0 HE ARG A 239 30.495 2.668 19.201 1.00 0.00 H new ATOM 0 HH11 ARG A 239 31.905 5.866 18.885 1.00 0.00 H new ATOM 0 HH12 ARG A 239 31.661 5.942 17.137 1.00 0.00 H new ATOM 0 HH21 ARG A 239 30.186 2.778 16.955 1.00 0.00 H new ATOM 0 HH22 ARG A 239 30.696 4.210 16.054 1.00 0.00 H new ATOM 574 N GLN A 240 35.166 4.570 24.551 1.00 0.00 N ATOM 575 CA GLN A 240 35.643 5.298 25.720 1.00 0.00 C ATOM 576 C GLN A 240 37.167 5.316 25.757 1.00 0.00 C ATOM 577 O GLN A 240 37.774 6.207 26.351 1.00 0.00 O ATOM 578 CB GLN A 240 35.105 4.648 26.997 1.00 0.00 C ATOM 579 CG GLN A 240 33.589 4.847 27.070 1.00 0.00 C ATOM 580 CD GLN A 240 33.032 4.155 28.310 1.00 0.00 C ATOM 581 OE1 GLN A 240 33.396 3.016 28.602 1.00 0.00 O ATOM 582 NE2 GLN A 240 32.166 4.778 29.061 1.00 0.00 N ATOM 0 H GLN A 240 34.680 3.699 24.762 1.00 0.00 H new ATOM 0 HA GLN A 240 35.282 6.325 25.656 1.00 0.00 H new ATOM 0 HB2 GLN A 240 35.344 3.585 27.005 1.00 0.00 H new ATOM 0 HB3 GLN A 240 35.583 5.089 27.872 1.00 0.00 H new ATOM 0 HG2 GLN A 240 33.355 5.911 27.101 1.00 0.00 H new ATOM 0 HG3 GLN A 240 33.117 4.442 26.175 1.00 0.00 H new ATOM 0 HE21 GLN A 240 31.866 5.722 28.818 1.00 0.00 H new ATOM 0 HE22 GLN A 240 31.789 4.321 29.892 1.00 0.00 H new ATOM 591 N PHE A 241 37.781 4.321 25.123 1.00 0.00 N ATOM 592 CA PHE A 241 39.237 4.230 25.092 1.00 0.00 C ATOM 593 C PHE A 241 39.830 5.443 24.383 1.00 0.00 C ATOM 594 O PHE A 241 40.790 6.046 24.863 1.00 0.00 O ATOM 595 CB PHE A 241 39.664 2.953 24.367 1.00 0.00 C ATOM 596 CG PHE A 241 41.158 2.777 24.494 1.00 0.00 C ATOM 597 CD1 PHE A 241 41.691 2.121 25.610 1.00 0.00 C ATOM 598 CD2 PHE A 241 42.009 3.271 23.500 1.00 0.00 C ATOM 599 CE1 PHE A 241 43.077 1.957 25.730 1.00 0.00 C ATOM 600 CE2 PHE A 241 43.395 3.108 23.619 1.00 0.00 C ATOM 601 CZ PHE A 241 43.929 2.451 24.735 1.00 0.00 C ATOM 0 H PHE A 241 37.297 3.572 24.627 1.00 0.00 H new ATOM 0 HA PHE A 241 39.605 4.205 26.118 1.00 0.00 H new ATOM 0 HB2 PHE A 241 39.148 2.092 24.791 1.00 0.00 H new ATOM 0 HB3 PHE A 241 39.382 3.007 23.316 1.00 0.00 H new ATOM 0 HD1 PHE A 241 41.034 1.741 26.378 1.00 0.00 H new ATOM 0 HD2 PHE A 241 41.597 3.778 22.640 1.00 0.00 H new ATOM 0 HE1 PHE A 241 43.488 1.449 26.590 1.00 0.00 H new ATOM 0 HE2 PHE A 241 44.052 3.489 22.851 1.00 0.00 H new ATOM 0 HZ PHE A 241 44.998 2.326 24.828 1.00 0.00 H new ATOM 611 N HIS A 242 39.251 5.794 23.240 1.00 0.00 N ATOM 612 CA HIS A 242 39.729 6.938 22.470 1.00 0.00 C ATOM 613 C HIS A 242 39.629 8.220 23.289 1.00 0.00 C ATOM 614 O HIS A 242 40.528 9.061 23.257 1.00 0.00 O ATOM 615 CB HIS A 242 38.906 7.083 21.189 1.00 0.00 C ATOM 616 CG HIS A 242 39.235 5.957 20.248 1.00 0.00 C ATOM 617 ND1 HIS A 242 38.608 4.723 20.325 1.00 0.00 N ATOM 618 CD2 HIS A 242 40.124 5.862 19.207 1.00 0.00 C ATOM 619 CE1 HIS A 242 39.122 3.945 19.356 1.00 0.00 C ATOM 620 NE2 HIS A 242 40.050 4.591 18.645 1.00 0.00 N ATOM 0 H HIS A 242 38.455 5.307 22.828 1.00 0.00 H new ATOM 0 HA HIS A 242 40.775 6.767 22.215 1.00 0.00 H new ATOM 0 HB2 HIS A 242 37.842 7.074 21.425 1.00 0.00 H new ATOM 0 HB3 HIS A 242 39.119 8.041 20.714 1.00 0.00 H new ATOM 0 HD1 HIS A 242 37.888 4.454 20.995 1.00 0.00 H new ATOM 0 HD2 HIS A 242 40.781 6.653 18.875 1.00 0.00 H new ATOM 0 HE1 HIS A 242 38.821 2.924 19.175 1.00 0.00 H new ATOM 628 N GLN A 243 38.531 8.366 24.022 1.00 0.00 N ATOM 629 CA GLN A 243 38.329 9.553 24.845 1.00 0.00 C ATOM 630 C GLN A 243 39.348 9.595 25.979 1.00 0.00 C ATOM 631 O GLN A 243 39.729 10.668 26.445 1.00 0.00 O ATOM 632 CB GLN A 243 36.912 9.555 25.423 1.00 0.00 C ATOM 633 CG GLN A 243 35.892 9.613 24.283 1.00 0.00 C ATOM 634 CD GLN A 243 36.008 10.942 23.543 1.00 0.00 C ATOM 635 OE1 GLN A 243 35.984 12.003 24.164 1.00 0.00 O ATOM 636 NE2 GLN A 243 36.138 10.945 22.245 1.00 0.00 N ATOM 0 H GLN A 243 37.773 7.684 24.064 1.00 0.00 H new ATOM 0 HA GLN A 243 38.463 10.435 24.219 1.00 0.00 H new ATOM 0 HB2 GLN A 243 36.752 8.659 26.022 1.00 0.00 H new ATOM 0 HB3 GLN A 243 36.780 10.410 26.086 1.00 0.00 H new ATOM 0 HG2 GLN A 243 36.060 8.787 23.592 1.00 0.00 H new ATOM 0 HG3 GLN A 243 34.884 9.496 24.680 1.00 0.00 H new ATOM 0 HE21 GLN A 243 36.158 10.063 21.732 1.00 0.00 H new ATOM 0 HE22 GLN A 243 36.220 11.829 21.743 1.00 0.00 H new ATOM 645 N GLU A 244 39.782 8.420 26.421 1.00 0.00 N ATOM 646 CA GLU A 244 40.754 8.334 27.504 1.00 0.00 C ATOM 647 C GLU A 244 42.095 8.917 27.065 1.00 0.00 C ATOM 648 O GLU A 244 42.816 9.509 27.867 1.00 0.00 O ATOM 649 CB GLU A 244 40.940 6.876 27.926 1.00 0.00 C ATOM 650 CG GLU A 244 41.770 6.817 29.212 1.00 0.00 C ATOM 651 CD GLU A 244 40.947 7.336 30.385 1.00 0.00 C ATOM 652 OE1 GLU A 244 39.763 7.572 30.197 1.00 0.00 O ATOM 653 OE2 GLU A 244 41.510 7.493 31.456 1.00 0.00 O ATOM 0 H GLU A 244 39.479 7.520 26.049 1.00 0.00 H new ATOM 0 HA GLU A 244 40.380 8.909 28.351 1.00 0.00 H new ATOM 0 HB2 GLU A 244 39.970 6.406 28.085 1.00 0.00 H new ATOM 0 HB3 GLU A 244 41.438 6.318 27.133 1.00 0.00 H new ATOM 0 HG2 GLU A 244 42.087 5.792 29.404 1.00 0.00 H new ATOM 0 HG3 GLU A 244 42.675 7.414 29.099 1.00 0.00 H new ATOM 660 N ILE A 245 42.429 8.738 25.793 1.00 0.00 N ATOM 661 CA ILE A 245 43.690 9.250 25.266 1.00 0.00 C ATOM 662 C ILE A 245 43.721 10.774 25.331 1.00 0.00 C ATOM 663 O ILE A 245 44.717 11.367 25.742 1.00 0.00 O ATOM 664 CB ILE A 245 43.876 8.794 23.819 1.00 0.00 C ATOM 665 CG1 ILE A 245 43.779 7.268 23.751 1.00 0.00 C ATOM 666 CG2 ILE A 245 45.249 9.240 23.314 1.00 0.00 C ATOM 667 CD1 ILE A 245 43.756 6.821 22.288 1.00 0.00 C ATOM 0 H ILE A 245 41.851 8.247 25.111 1.00 0.00 H new ATOM 0 HA ILE A 245 44.502 8.856 25.877 1.00 0.00 H new ATOM 0 HB ILE A 245 43.100 9.238 23.196 1.00 0.00 H new ATOM 0 HG12 ILE A 245 44.626 6.816 24.267 1.00 0.00 H new ATOM 0 HG13 ILE A 245 42.877 6.928 24.260 1.00 0.00 H new ATOM 0 HG21 ILE A 245 45.381 8.914 22.282 1.00 0.00 H new ATOM 0 HG22 ILE A 245 45.319 10.327 23.363 1.00 0.00 H new ATOM 0 HG23 ILE A 245 46.027 8.797 23.936 1.00 0.00 H new ATOM 0 HD11 ILE A 245 43.687 5.734 22.241 1.00 0.00 H new ATOM 0 HD12 ILE A 245 42.894 7.262 21.786 1.00 0.00 H new ATOM 0 HD13 ILE A 245 44.670 7.148 21.793 1.00 0.00 H new ATOM 679 N GLN A 246 42.627 11.403 24.919 1.00 0.00 N ATOM 680 CA GLN A 246 42.542 12.859 24.935 1.00 0.00 C ATOM 681 C GLN A 246 42.607 13.384 26.365 1.00 0.00 C ATOM 682 O GLN A 246 43.021 14.519 26.601 1.00 0.00 O ATOM 683 CB GLN A 246 41.234 13.312 24.280 1.00 0.00 C ATOM 684 CG GLN A 246 41.235 12.912 22.803 1.00 0.00 C ATOM 685 CD GLN A 246 42.289 13.712 22.044 1.00 0.00 C ATOM 686 OE1 GLN A 246 43.463 13.344 22.033 1.00 0.00 O ATOM 687 NE2 GLN A 246 41.936 14.792 21.404 1.00 0.00 N ATOM 0 H GLN A 246 41.791 10.932 24.572 1.00 0.00 H new ATOM 0 HA GLN A 246 43.387 13.261 24.375 1.00 0.00 H new ATOM 0 HB2 GLN A 246 40.384 12.858 24.790 1.00 0.00 H new ATOM 0 HB3 GLN A 246 41.123 14.392 24.375 1.00 0.00 H new ATOM 0 HG2 GLN A 246 41.438 11.845 22.707 1.00 0.00 H new ATOM 0 HG3 GLN A 246 40.251 13.089 22.370 1.00 0.00 H new ATOM 0 HE21 GLN A 246 40.962 15.096 21.414 1.00 0.00 H new ATOM 0 HE22 GLN A 246 42.634 15.333 20.893 1.00 0.00 H new ATOM 696 N SER A 247 42.188 12.553 27.315 1.00 0.00 N ATOM 697 CA SER A 247 42.196 12.948 28.719 1.00 0.00 C ATOM 698 C SER A 247 43.627 13.117 29.219 1.00 0.00 C ATOM 699 O SER A 247 43.862 13.734 30.258 1.00 0.00 O ATOM 700 CB SER A 247 41.482 11.892 29.563 1.00 0.00 C ATOM 701 OG SER A 247 42.361 10.800 29.791 1.00 0.00 O ATOM 0 H SER A 247 41.841 11.610 27.140 1.00 0.00 H new ATOM 0 HA SER A 247 41.675 13.901 28.812 1.00 0.00 H new ATOM 0 HB2 SER A 247 41.165 12.323 30.513 1.00 0.00 H new ATOM 0 HB3 SER A 247 40.582 11.549 29.052 1.00 0.00 H new ATOM 0 HG SER A 247 42.293 10.165 29.048 1.00 0.00 H new ATOM 707 N ARG A 248 44.579 12.566 28.473 1.00 0.00 N ATOM 708 CA ARG A 248 45.983 12.661 28.852 1.00 0.00 C ATOM 709 C ARG A 248 46.467 14.104 28.751 1.00 0.00 C ATOM 710 O ARG A 248 47.559 14.436 29.213 1.00 0.00 O ATOM 711 CB ARG A 248 46.832 11.770 27.941 1.00 0.00 C ATOM 712 CG ARG A 248 46.473 10.303 28.183 1.00 0.00 C ATOM 713 CD ARG A 248 47.249 9.419 27.205 1.00 0.00 C ATOM 714 NE ARG A 248 48.681 9.520 27.461 1.00 0.00 N ATOM 715 CZ ARG A 248 49.564 8.916 26.672 1.00 0.00 C ATOM 716 NH1 ARG A 248 49.156 8.219 25.648 1.00 0.00 N ATOM 717 NH2 ARG A 248 50.841 9.022 26.922 1.00 0.00 N ATOM 0 H ARG A 248 44.405 12.053 27.609 1.00 0.00 H new ATOM 0 HA ARG A 248 46.086 12.326 29.884 1.00 0.00 H new ATOM 0 HB2 ARG A 248 46.659 12.030 26.897 1.00 0.00 H new ATOM 0 HB3 ARG A 248 47.891 11.934 28.139 1.00 0.00 H new ATOM 0 HG2 ARG A 248 46.711 10.024 29.209 1.00 0.00 H new ATOM 0 HG3 ARG A 248 45.401 10.154 28.053 1.00 0.00 H new ATOM 0 HD2 ARG A 248 46.927 8.383 27.306 1.00 0.00 H new ATOM 0 HD3 ARG A 248 47.033 9.722 26.180 1.00 0.00 H new ATOM 0 HE ARG A 248 49.011 10.063 28.259 1.00 0.00 H new ATOM 0 HH11 ARG A 248 48.158 8.137 25.452 1.00 0.00 H new ATOM 0 HH12 ARG A 248 49.834 7.756 25.043 1.00 0.00 H new ATOM 0 HH21 ARG A 248 51.160 9.568 27.722 1.00 0.00 H new ATOM 0 HH22 ARG A 248 51.519 8.559 26.317 1.00 0.00 H new ATOM 731 N ASN A 249 45.649 14.956 28.143 1.00 0.00 N ATOM 732 CA ASN A 249 46.005 16.362 27.988 1.00 0.00 C ATOM 733 C ASN A 249 46.110 17.041 29.348 1.00 0.00 C ATOM 734 O ASN A 249 45.154 17.657 29.823 1.00 0.00 O ATOM 735 CB ASN A 249 44.950 17.075 27.139 1.00 0.00 C ATOM 736 CG ASN A 249 45.033 16.596 25.694 1.00 0.00 C ATOM 737 OD1 ASN A 249 46.194 16.293 25.181 1.00 0.00 O flip ATOM 738 ND2 ASN A 249 44.013 16.502 25.012 1.00 0.00 N flip ATOM 0 H ASN A 249 44.742 14.701 27.752 1.00 0.00 H new ATOM 0 HA ASN A 249 46.973 16.421 27.491 1.00 0.00 H new ATOM 0 HB2 ASN A 249 43.955 16.878 27.539 1.00 0.00 H new ATOM 0 HB3 ASN A 249 45.104 18.153 27.183 1.00 0.00 H new ATOM 0 HD21 ASN A 249 43.106 16.739 25.415 1.00 0.00 H new ATOM 0 HD22 ASN A 249 44.074 16.187 24.044 1.00 0.00 H new ATOM 745 N MET A 250 47.278 16.928 29.971 1.00 0.00 N ATOM 746 CA MET A 250 47.499 17.537 31.277 1.00 0.00 C ATOM 747 C MET A 250 47.518 19.058 31.159 1.00 0.00 C ATOM 748 O MET A 250 47.069 19.766 32.062 1.00 0.00 O ATOM 749 CB MET A 250 48.827 17.048 31.866 1.00 0.00 C ATOM 750 CG MET A 250 49.892 17.021 30.768 1.00 0.00 C ATOM 751 SD MET A 250 51.525 16.820 31.521 1.00 0.00 S ATOM 752 CE MET A 250 52.491 16.917 29.994 1.00 0.00 C ATOM 0 H MET A 250 48.081 16.424 29.596 1.00 0.00 H new ATOM 0 HA MET A 250 46.683 17.245 31.938 1.00 0.00 H new ATOM 0 HB2 MET A 250 49.142 17.705 32.677 1.00 0.00 H new ATOM 0 HB3 MET A 250 48.704 16.052 32.292 1.00 0.00 H new ATOM 0 HG2 MET A 250 49.695 16.203 30.075 1.00 0.00 H new ATOM 0 HG3 MET A 250 49.857 17.944 30.189 1.00 0.00 H new ATOM 0 HE1 MET A 250 53.551 16.815 30.227 1.00 0.00 H new ATOM 0 HE2 MET A 250 52.188 16.115 29.320 1.00 0.00 H new ATOM 0 HE3 MET A 250 52.316 17.880 29.514 1.00 0.00 H new ATOM 762 N ARG A 251 48.048 19.551 30.048 1.00 0.00 N ATOM 763 CA ARG A 251 48.126 20.987 29.829 1.00 0.00 C ATOM 764 C ARG A 251 46.732 21.607 29.838 1.00 0.00 C ATOM 765 O ARG A 251 46.509 22.648 30.456 1.00 0.00 O ATOM 766 CB ARG A 251 48.804 21.274 28.486 1.00 0.00 C ATOM 767 CG ARG A 251 49.166 22.768 28.398 1.00 0.00 C ATOM 768 CD ARG A 251 50.562 22.991 28.985 1.00 0.00 C ATOM 769 NE ARG A 251 51.561 22.297 28.180 1.00 0.00 N ATOM 770 CZ ARG A 251 52.799 22.121 28.627 1.00 0.00 C ATOM 771 NH1 ARG A 251 53.138 22.568 29.805 1.00 0.00 N ATOM 772 NH2 ARG A 251 53.679 21.498 27.889 1.00 0.00 N ATOM 0 H ARG A 251 48.427 18.983 29.291 1.00 0.00 H new ATOM 0 HA ARG A 251 48.713 21.427 30.635 1.00 0.00 H new ATOM 0 HB2 ARG A 251 49.702 20.665 28.383 1.00 0.00 H new ATOM 0 HB3 ARG A 251 48.139 21.002 27.666 1.00 0.00 H new ATOM 0 HG2 ARG A 251 49.139 23.099 27.360 1.00 0.00 H new ATOM 0 HG3 ARG A 251 48.432 23.363 28.941 1.00 0.00 H new ATOM 0 HD2 ARG A 251 50.786 24.057 29.016 1.00 0.00 H new ATOM 0 HD3 ARG A 251 50.595 22.628 30.012 1.00 0.00 H new ATOM 0 HE ARG A 251 51.305 21.941 27.259 1.00 0.00 H new ATOM 0 HH11 ARG A 251 52.452 23.053 30.383 1.00 0.00 H new ATOM 0 HH12 ARG A 251 54.089 22.432 30.148 1.00 0.00 H new ATOM 0 HH21 ARG A 251 53.415 21.146 26.969 1.00 0.00 H new ATOM 0 HH22 ARG A 251 54.630 21.363 28.233 1.00 0.00 H new ATOM 786 N GLU A 252 45.800 20.964 29.147 1.00 0.00 N ATOM 787 CA GLU A 252 44.431 21.463 29.082 1.00 0.00 C ATOM 788 C GLU A 252 43.772 21.388 30.456 1.00 0.00 C ATOM 789 O GLU A 252 43.002 22.272 30.834 1.00 0.00 O ATOM 790 CB GLU A 252 43.622 20.637 28.079 1.00 0.00 C ATOM 791 CG GLU A 252 42.218 21.231 27.941 1.00 0.00 C ATOM 792 CD GLU A 252 41.427 20.458 26.893 1.00 0.00 C ATOM 793 OE1 GLU A 252 42.043 19.738 26.124 1.00 0.00 O ATOM 794 OE2 GLU A 252 40.215 20.594 26.876 1.00 0.00 O ATOM 0 H GLU A 252 45.964 20.102 28.627 1.00 0.00 H new ATOM 0 HA GLU A 252 44.455 22.503 28.758 1.00 0.00 H new ATOM 0 HB2 GLU A 252 44.122 20.630 27.111 1.00 0.00 H new ATOM 0 HB3 GLU A 252 43.559 19.601 28.412 1.00 0.00 H new ATOM 0 HG2 GLU A 252 41.702 21.192 28.900 1.00 0.00 H new ATOM 0 HG3 GLU A 252 42.285 22.281 27.657 1.00 0.00 H new ATOM 801 N ASN A 253 44.076 20.328 31.197 1.00 0.00 N ATOM 802 CA ASN A 253 43.503 20.145 32.524 1.00 0.00 C ATOM 803 C ASN A 253 43.947 21.264 33.454 1.00 0.00 C ATOM 804 O ASN A 253 43.160 21.774 34.252 1.00 0.00 O ATOM 805 CB ASN A 253 43.940 18.797 33.101 1.00 0.00 C ATOM 806 CG ASN A 253 43.366 18.618 34.502 1.00 0.00 C ATOM 807 OD1 ASN A 253 42.165 18.794 34.709 1.00 0.00 O ATOM 808 ND2 ASN A 253 44.156 18.276 35.483 1.00 0.00 N ATOM 0 H ASN A 253 44.712 19.587 30.903 1.00 0.00 H new ATOM 0 HA ASN A 253 42.417 20.167 32.437 1.00 0.00 H new ATOM 0 HB2 ASN A 253 43.601 17.988 32.454 1.00 0.00 H new ATOM 0 HB3 ASN A 253 45.028 18.742 33.135 1.00 0.00 H new ATOM 0 HD21 ASN A 253 43.779 18.154 36.423 1.00 0.00 H new ATOM 0 HD22 ASN A 253 45.151 18.131 35.310 1.00 0.00 H new ATOM 815 N VAL A 254 45.218 21.644 33.355 1.00 0.00 N ATOM 816 CA VAL A 254 45.759 22.706 34.203 1.00 0.00 C ATOM 817 C VAL A 254 45.806 24.022 33.436 1.00 0.00 C ATOM 818 O VAL A 254 46.307 24.085 32.315 1.00 0.00 O ATOM 819 CB VAL A 254 47.171 22.335 34.668 1.00 0.00 C ATOM 820 CG1 VAL A 254 47.793 23.520 35.411 1.00 0.00 C ATOM 821 CG2 VAL A 254 47.094 21.129 35.607 1.00 0.00 C ATOM 0 H VAL A 254 45.889 21.238 32.703 1.00 0.00 H new ATOM 0 HA VAL A 254 45.110 22.822 35.071 1.00 0.00 H new ATOM 0 HB VAL A 254 47.786 22.087 33.803 1.00 0.00 H new ATOM 0 HG11 VAL A 254 48.797 23.256 35.742 1.00 0.00 H new ATOM 0 HG12 VAL A 254 47.845 24.381 34.744 1.00 0.00 H new ATOM 0 HG13 VAL A 254 47.180 23.769 36.277 1.00 0.00 H new ATOM 0 HG21 VAL A 254 48.097 20.862 35.940 1.00 0.00 H new ATOM 0 HG22 VAL A 254 46.480 21.380 36.472 1.00 0.00 H new ATOM 0 HG23 VAL A 254 46.650 20.285 35.079 1.00 0.00 H new ATOM 831 N LYS A 255 45.282 25.079 34.053 1.00 0.00 N ATOM 832 CA LYS A 255 45.271 26.395 33.421 1.00 0.00 C ATOM 833 C LYS A 255 45.327 27.495 34.473 1.00 0.00 C ATOM 834 O LYS A 255 45.236 28.680 34.150 1.00 0.00 O ATOM 835 CB LYS A 255 44.007 26.553 32.578 1.00 0.00 C ATOM 836 CG LYS A 255 42.778 26.523 33.488 1.00 0.00 C ATOM 837 CD LYS A 255 41.509 26.458 32.635 1.00 0.00 C ATOM 838 CE LYS A 255 41.316 27.784 31.894 1.00 0.00 C ATOM 839 NZ LYS A 255 39.918 27.871 31.389 1.00 0.00 N ATOM 0 H LYS A 255 44.863 25.050 34.982 1.00 0.00 H new ATOM 0 HA LYS A 255 46.149 26.480 32.780 1.00 0.00 H new ATOM 0 HB2 LYS A 255 44.041 27.492 32.026 1.00 0.00 H new ATOM 0 HB3 LYS A 255 43.946 25.752 31.841 1.00 0.00 H new ATOM 0 HG2 LYS A 255 42.826 25.660 34.153 1.00 0.00 H new ATOM 0 HG3 LYS A 255 42.759 27.411 34.119 1.00 0.00 H new ATOM 0 HD2 LYS A 255 41.581 25.638 31.920 1.00 0.00 H new ATOM 0 HD3 LYS A 255 40.645 26.254 33.267 1.00 0.00 H new ATOM 0 HE2 LYS A 255 41.526 28.620 32.561 1.00 0.00 H new ATOM 0 HE3 LYS A 255 42.019 27.855 31.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 255 39.786 28.771 30.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 255 39.734 27.081 30.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 255 39.256 27.822 32.190 1.00 0.00 H new ATOM 853 N ARG A 256 45.473 27.098 35.734 1.00 0.00 N ATOM 854 CA ARG A 256 45.534 28.069 36.826 1.00 0.00 C ATOM 855 C ARG A 256 46.984 28.416 37.145 1.00 0.00 C ATOM 856 O ARG A 256 47.767 27.554 37.546 1.00 0.00 O ATOM 857 CB ARG A 256 44.857 27.492 38.074 1.00 0.00 C ATOM 858 CG ARG A 256 44.839 28.550 39.178 1.00 0.00 C ATOM 859 CD ARG A 256 44.123 27.992 40.407 1.00 0.00 C ATOM 860 NE ARG A 256 43.954 29.037 41.411 1.00 0.00 N ATOM 861 CZ ARG A 256 43.408 28.773 42.594 1.00 0.00 C ATOM 862 NH1 ARG A 256 43.014 27.561 42.873 1.00 0.00 N ATOM 863 NH2 ARG A 256 43.266 29.725 43.474 1.00 0.00 N ATOM 0 H ARG A 256 45.551 26.123 36.025 1.00 0.00 H new ATOM 0 HA ARG A 256 45.013 28.975 36.517 1.00 0.00 H new ATOM 0 HB2 ARG A 256 43.840 27.180 37.838 1.00 0.00 H new ATOM 0 HB3 ARG A 256 45.392 26.605 38.414 1.00 0.00 H new ATOM 0 HG2 ARG A 256 45.858 28.838 39.437 1.00 0.00 H new ATOM 0 HG3 ARG A 256 44.333 29.449 38.826 1.00 0.00 H new ATOM 0 HD2 ARG A 256 43.150 27.593 40.120 1.00 0.00 H new ATOM 0 HD3 ARG A 256 44.696 27.165 40.826 1.00 0.00 H new ATOM 0 HE ARG A 256 44.260 29.987 41.202 1.00 0.00 H new ATOM 0 HH11 ARG A 256 43.125 26.817 42.184 1.00 0.00 H new ATOM 0 HH12 ARG A 256 42.595 27.357 43.780 1.00 0.00 H new ATOM 0 HH21 ARG A 256 43.574 30.672 43.255 1.00 0.00 H new ATOM 0 HH22 ARG A 256 42.847 29.522 44.382 1.00 0.00 H new ATOM 877 N SER A 257 47.333 29.685 36.969 1.00 0.00 N ATOM 878 CA SER A 257 48.690 30.139 37.245 1.00 0.00 C ATOM 879 C SER A 257 48.780 31.655 37.141 1.00 0.00 C ATOM 880 O SER A 257 49.105 32.338 38.113 1.00 0.00 O ATOM 881 CB SER A 257 49.666 29.499 36.255 1.00 0.00 C ATOM 882 OG SER A 257 50.979 29.543 36.797 1.00 0.00 O ATOM 0 H SER A 257 46.700 30.413 36.639 1.00 0.00 H new ATOM 0 HA SER A 257 48.953 29.840 38.260 1.00 0.00 H new ATOM 0 HB2 SER A 257 49.376 28.467 36.056 1.00 0.00 H new ATOM 0 HB3 SER A 257 49.635 30.028 35.302 1.00 0.00 H new ATOM 0 HG SER A 257 51.607 29.132 36.167 1.00 0.00 H new ATOM 888 N SER A 258 48.490 32.180 35.953 1.00 0.00 N ATOM 889 CA SER A 258 48.543 33.624 35.728 1.00 0.00 C ATOM 890 C SER A 258 47.324 34.082 34.946 1.00 0.00 C ATOM 891 O SER A 258 46.757 33.325 34.157 1.00 0.00 O ATOM 892 CB SER A 258 49.812 33.988 34.960 1.00 0.00 C ATOM 893 OG SER A 258 50.940 33.793 35.800 1.00 0.00 O ATOM 0 H SER A 258 48.218 31.633 35.136 1.00 0.00 H new ATOM 0 HA SER A 258 48.552 34.125 36.696 1.00 0.00 H new ATOM 0 HB2 SER A 258 49.899 33.371 34.065 1.00 0.00 H new ATOM 0 HB3 SER A 258 49.766 35.025 34.629 1.00 0.00 H new ATOM 0 HG SER A 258 51.757 34.025 35.310 1.00 0.00 H new ATOM 899 N VAL A 259 46.921 35.332 35.167 1.00 0.00 N ATOM 900 CA VAL A 259 45.759 35.891 34.474 1.00 0.00 C ATOM 901 C VAL A 259 46.122 37.215 33.808 1.00 0.00 C ATOM 902 O VAL A 259 46.654 37.235 32.697 1.00 0.00 O ATOM 903 CB VAL A 259 44.617 36.110 35.466 1.00 0.00 C ATOM 904 CG1 VAL A 259 43.385 36.625 34.716 1.00 0.00 C ATOM 905 CG2 VAL A 259 44.277 34.785 36.152 1.00 0.00 C ATOM 0 H VAL A 259 47.377 35.974 35.815 1.00 0.00 H new ATOM 0 HA VAL A 259 45.440 35.186 33.706 1.00 0.00 H new ATOM 0 HB VAL A 259 44.920 36.841 36.216 1.00 0.00 H new ATOM 0 HG11 VAL A 259 42.569 36.782 35.421 1.00 0.00 H new ATOM 0 HG12 VAL A 259 43.626 37.567 34.224 1.00 0.00 H new ATOM 0 HG13 VAL A 259 43.082 35.893 33.968 1.00 0.00 H new ATOM 0 HG21 VAL A 259 43.463 34.940 36.860 1.00 0.00 H new ATOM 0 HG22 VAL A 259 43.972 34.055 35.402 1.00 0.00 H new ATOM 0 HG23 VAL A 259 45.154 34.415 36.683 1.00 0.00 H new ATOM 915 N VAL A 260 45.824 38.319 34.485 1.00 0.00 N ATOM 916 CA VAL A 260 46.114 39.637 33.944 1.00 0.00 C ATOM 917 C VAL A 260 47.616 39.825 33.769 1.00 0.00 C ATOM 918 O VAL A 260 48.076 40.273 32.718 1.00 0.00 O ATOM 919 CB VAL A 260 45.569 40.717 34.882 1.00 0.00 C ATOM 920 CG1 VAL A 260 45.980 42.098 34.368 1.00 0.00 C ATOM 921 CG2 VAL A 260 44.042 40.627 34.933 1.00 0.00 C ATOM 0 H VAL A 260 45.384 38.325 35.405 1.00 0.00 H new ATOM 0 HA VAL A 260 45.632 39.724 32.970 1.00 0.00 H new ATOM 0 HB VAL A 260 45.976 40.566 35.882 1.00 0.00 H new ATOM 0 HG11 VAL A 260 45.591 42.866 35.037 1.00 0.00 H new ATOM 0 HG12 VAL A 260 47.067 42.164 34.333 1.00 0.00 H new ATOM 0 HG13 VAL A 260 45.575 42.249 33.368 1.00 0.00 H new ATOM 0 HG21 VAL A 260 43.654 41.396 35.601 1.00 0.00 H new ATOM 0 HG22 VAL A 260 43.635 40.776 33.933 1.00 0.00 H new ATOM 0 HG23 VAL A 260 43.748 39.644 35.302 1.00 0.00 H new ATOM 931 N VAL A 261 48.376 39.480 34.803 1.00 0.00 N ATOM 932 CA VAL A 261 49.826 39.613 34.749 1.00 0.00 C ATOM 933 C VAL A 261 50.482 38.728 35.800 1.00 0.00 C ATOM 934 O VAL A 261 49.995 38.617 36.926 1.00 0.00 O ATOM 935 CB VAL A 261 50.226 41.070 34.984 1.00 0.00 C ATOM 936 CG1 VAL A 261 49.857 41.478 36.412 1.00 0.00 C ATOM 937 CG2 VAL A 261 51.735 41.225 34.785 1.00 0.00 C ATOM 0 H VAL A 261 48.015 39.109 35.682 1.00 0.00 H new ATOM 0 HA VAL A 261 50.165 39.299 33.762 1.00 0.00 H new ATOM 0 HB VAL A 261 49.698 41.708 34.275 1.00 0.00 H new ATOM 0 HG11 VAL A 261 50.142 42.517 36.579 1.00 0.00 H new ATOM 0 HG12 VAL A 261 48.782 41.370 36.555 1.00 0.00 H new ATOM 0 HG13 VAL A 261 50.384 40.839 37.121 1.00 0.00 H new ATOM 0 HG21 VAL A 261 52.019 42.264 34.953 1.00 0.00 H new ATOM 0 HG22 VAL A 261 52.263 40.586 35.493 1.00 0.00 H new ATOM 0 HG23 VAL A 261 51.999 40.936 33.768 1.00 0.00 H new ATOM 947 N ALA A 262 51.597 38.104 35.432 1.00 0.00 N ATOM 948 CA ALA A 262 52.317 37.234 36.358 1.00 0.00 C ATOM 949 C ALA A 262 51.341 36.377 37.161 1.00 0.00 C ATOM 950 O ALA A 262 50.241 36.079 36.700 1.00 0.00 O ATOM 951 CB ALA A 262 53.165 38.077 37.313 1.00 0.00 C ATOM 0 H ALA A 262 52.019 38.183 34.507 1.00 0.00 H new ATOM 0 HA ALA A 262 52.966 36.577 35.779 1.00 0.00 H new ATOM 0 HB1 ALA A 262 53.699 37.421 38.001 1.00 0.00 H new ATOM 0 HB2 ALA A 262 53.883 38.664 36.740 1.00 0.00 H new ATOM 0 HB3 ALA A 262 52.518 38.747 37.879 1.00 0.00 H new ATOM 957 N ASN A 263 51.754 35.988 38.362 1.00 0.00 N ATOM 958 CA ASN A 263 50.907 35.169 39.219 1.00 0.00 C ATOM 959 C ASN A 263 49.783 36.007 39.824 1.00 0.00 C ATOM 960 O ASN A 263 50.001 37.188 40.038 1.00 0.00 O ATOM 961 CB ASN A 263 51.743 34.550 40.340 1.00 0.00 C ATOM 962 CG ASN A 263 50.934 33.479 41.062 1.00 0.00 C ATOM 963 OD1 ASN A 263 50.030 32.882 40.478 1.00 0.00 O ATOM 964 ND2 ASN A 263 51.207 33.197 42.308 1.00 0.00 N ATOM 965 OXT ASN A 263 48.722 35.455 40.063 1.00 0.00 O ATOM 0 H ASN A 263 52.662 36.224 38.761 1.00 0.00 H new ATOM 0 HA ASN A 263 50.468 34.377 38.612 1.00 0.00 H new ATOM 0 HB2 ASN A 263 52.653 34.114 39.928 1.00 0.00 H new ATOM 0 HB3 ASN A 263 52.050 35.323 41.045 1.00 0.00 H new ATOM 0 HD21 ASN A 263 50.671 32.481 42.798 1.00 0.00 H new ATOM 0 HD22 ASN A 263 51.957 33.693 42.791 1.00 0.00 H new TER 972 ASN A 263