USER MOD reduce.3.24.130724 H: found=0, std=0, add=686, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 704 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 17 SER OG : rot 180:sc= 0 USER MOD Set 1.2: B 209 MET CE :methyl -133:sc= -0.0499 (180deg=-1.08) USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 18 ASN :FLIP amide:sc= -0.0201 F(o=-1.7!,f=-0.02) USER MOD Single : A 22 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0163) USER MOD Single : A 23 GLN : amide:sc= -0.485 K(o=-0.49,f=-3.2!) USER MOD Single : A 30 GLN : amide:sc= -0.174 X(o=-0.17,f=-0.6) USER MOD Single : A 32 ASN : amide:sc= -1.35 K(o=-1.3,f=-2.6!) USER MOD Single : A 45 GLN : amide:sc= 0 K(o=0,f=-1.1!) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : B 217 SER OG : rot 180:sc= 0 USER MOD Single : B 218 ASN :FLIP amide:sc= -0.0538 F(o=-0.65,f=-0.054) USER MOD Single : B 222 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 223 GLN : amide:sc= -0.124 K(o=-0.12,f=-2.6!) USER MOD Single : B 230 GLN : amide:sc= -0.675 X(o=-0.68,f=-0.67) USER MOD Single : B 232 ASN : amide:sc= -2.05! C(o=-2.1!,f=-5.3!) USER MOD Single : B 245 GLN : amide:sc= -4.89! C(o=-4.9!,f=-5.3!) USER MOD Single : B 246 TYR OH : rot 180:sc= 0 USER MOD Single : B 249 ASN : amide:sc= -0.0212 K(o=-0.021,f=-1.3) USER MOD ----------------------------------------------------------------- ATOM 111 N MET A 9 -15.595 -13.941 6.235 1.00 1.00 N ATOM 112 CA MET A 9 -14.532 -12.959 6.070 1.00 1.00 C ATOM 113 C MET A 9 -13.544 -13.419 5.006 1.00 1.00 C ATOM 114 O MET A 9 -13.599 -14.559 4.547 1.00 1.00 O ATOM 115 CB MET A 9 -13.798 -12.751 7.395 1.00 1.00 C ATOM 116 CG MET A 9 -14.723 -12.044 8.387 1.00 1.00 C ATOM 117 SD MET A 9 -13.848 -11.777 9.949 1.00 1.00 S ATOM 118 CE MET A 9 -13.106 -10.181 9.526 1.00 1.00 C ATOM 0 HA MET A 9 -14.980 -12.017 5.754 1.00 1.00 H new ATOM 0 HB2 MET A 9 -13.479 -13.711 7.800 1.00 1.00 H new ATOM 0 HB3 MET A 9 -12.898 -12.158 7.235 1.00 1.00 H new ATOM 0 HG2 MET A 9 -15.053 -11.090 7.976 1.00 1.00 H new ATOM 0 HG3 MET A 9 -15.617 -12.644 8.557 1.00 1.00 H new ATOM 0 HE1 MET A 9 -12.510 -9.823 10.365 1.00 1.00 H new ATOM 0 HE2 MET A 9 -12.467 -10.297 8.651 1.00 1.00 H new ATOM 0 HE3 MET A 9 -13.894 -9.460 9.307 1.00 1.00 H new ATOM 128 N GLY A 10 -12.641 -12.522 4.615 1.00 1.00 N ATOM 129 CA GLY A 10 -11.636 -12.839 3.601 1.00 1.00 C ATOM 130 C GLY A 10 -10.249 -12.928 4.225 1.00 1.00 C ATOM 131 O GLY A 10 -10.068 -12.629 5.403 1.00 1.00 O ATOM 0 H GLY A 10 -12.584 -11.573 4.983 1.00 1.00 H new ATOM 0 HA2 GLY A 10 -11.884 -13.785 3.119 1.00 1.00 H new ATOM 0 HA3 GLY A 10 -11.642 -12.074 2.824 1.00 1.00 H new ATOM 135 N ARG A 11 -9.274 -13.342 3.423 1.00 1.00 N ATOM 136 CA ARG A 11 -7.900 -13.466 3.901 1.00 1.00 C ATOM 137 C ARG A 11 -6.915 -13.171 2.777 1.00 1.00 C ATOM 138 O ARG A 11 -7.097 -13.620 1.647 1.00 1.00 O ATOM 139 CB ARG A 11 -7.659 -14.884 4.434 1.00 1.00 C ATOM 140 CG ARG A 11 -6.179 -15.057 4.806 1.00 1.00 C ATOM 141 CD ARG A 11 -5.964 -16.431 5.430 1.00 1.00 C ATOM 142 NE ARG A 11 -6.278 -17.476 4.462 1.00 1.00 N ATOM 143 CZ ARG A 11 -6.320 -18.755 4.821 1.00 1.00 C ATOM 144 NH1 ARG A 11 -6.074 -19.094 6.057 1.00 1.00 N ATOM 145 NH2 ARG A 11 -6.608 -19.671 3.937 1.00 1.00 N ATOM 0 H ARG A 11 -9.407 -13.596 2.444 1.00 1.00 H new ATOM 0 HA ARG A 11 -7.746 -12.744 4.703 1.00 1.00 H new ATOM 0 HB2 ARG A 11 -8.286 -15.065 5.307 1.00 1.00 H new ATOM 0 HB3 ARG A 11 -7.942 -15.618 3.680 1.00 1.00 H new ATOM 0 HG2 ARG A 11 -5.556 -14.948 3.918 1.00 1.00 H new ATOM 0 HG3 ARG A 11 -5.876 -14.278 5.505 1.00 1.00 H new ATOM 0 HD2 ARG A 11 -4.931 -16.531 5.762 1.00 1.00 H new ATOM 0 HD3 ARG A 11 -6.594 -16.541 6.313 1.00 1.00 H new ATOM 0 HE ARG A 11 -6.469 -17.221 3.493 1.00 1.00 H new ATOM 0 HH11 ARG A 11 -5.850 -18.377 6.747 1.00 1.00 H new ATOM 0 HH12 ARG A 11 -6.106 -20.076 6.333 1.00 1.00 H new ATOM 0 HH21 ARG A 11 -6.801 -19.405 2.971 1.00 1.00 H new ATOM 0 HH22 ARG A 11 -6.640 -20.653 4.212 1.00 1.00 H new ATOM 159 N ILE A 12 -5.864 -12.423 3.100 1.00 1.00 N ATOM 160 CA ILE A 12 -4.841 -12.080 2.113 1.00 1.00 C ATOM 161 C ILE A 12 -3.457 -12.185 2.736 1.00 1.00 C ATOM 162 O ILE A 12 -3.288 -11.967 3.936 1.00 1.00 O ATOM 163 CB ILE A 12 -5.060 -10.666 1.587 1.00 1.00 C ATOM 164 CG1 ILE A 12 -6.476 -10.557 1.006 1.00 1.00 C ATOM 165 CG2 ILE A 12 -4.034 -10.359 0.490 1.00 1.00 C ATOM 166 CD1 ILE A 12 -6.712 -9.141 0.472 1.00 1.00 C ATOM 0 H ILE A 12 -5.697 -12.044 4.032 1.00 1.00 H new ATOM 0 HA ILE A 12 -4.916 -12.781 1.282 1.00 1.00 H new ATOM 0 HB ILE A 12 -4.940 -9.952 2.402 1.00 1.00 H new ATOM 0 HG12 ILE A 12 -6.607 -11.284 0.204 1.00 1.00 H new ATOM 0 HG13 ILE A 12 -7.213 -10.793 1.774 1.00 1.00 H new ATOM 0 HG21 ILE A 12 -4.193 -9.348 0.116 1.00 1.00 H new ATOM 0 HG22 ILE A 12 -3.027 -10.440 0.900 1.00 1.00 H new ATOM 0 HG23 ILE A 12 -4.151 -11.071 -0.327 1.00 1.00 H new ATOM 0 HD11 ILE A 12 -7.719 -9.070 0.061 1.00 1.00 H new ATOM 0 HD12 ILE A 12 -6.600 -8.423 1.284 1.00 1.00 H new ATOM 0 HD13 ILE A 12 -5.985 -8.921 -0.310 1.00 1.00 H new ATOM 178 N LEU A 13 -2.467 -12.521 1.915 1.00 1.00 N ATOM 179 CA LEU A 13 -1.100 -12.659 2.403 1.00 1.00 C ATOM 180 C LEU A 13 -0.350 -11.345 2.218 1.00 1.00 C ATOM 181 O LEU A 13 -0.205 -10.856 1.097 1.00 1.00 O ATOM 182 CB LEU A 13 -0.381 -13.778 1.628 1.00 1.00 C ATOM 183 CG LEU A 13 0.682 -14.423 2.515 1.00 1.00 C ATOM 184 CD1 LEU A 13 1.450 -15.478 1.720 1.00 1.00 C ATOM 185 CD2 LEU A 13 1.649 -13.356 3.032 1.00 1.00 C ATOM 0 H LEU A 13 -2.584 -12.701 0.918 1.00 1.00 H new ATOM 0 HA LEU A 13 -1.124 -12.913 3.463 1.00 1.00 H new ATOM 0 HB2 LEU A 13 -1.102 -14.529 1.304 1.00 1.00 H new ATOM 0 HB3 LEU A 13 0.081 -13.371 0.729 1.00 1.00 H new ATOM 0 HG LEU A 13 0.194 -14.901 3.364 1.00 1.00 H new ATOM 0 HD11 LEU A 13 2.207 -15.935 2.358 1.00 1.00 H new ATOM 0 HD12 LEU A 13 0.759 -16.245 1.371 1.00 1.00 H new ATOM 0 HD13 LEU A 13 1.933 -15.008 0.863 1.00 1.00 H new ATOM 0 HD21 LEU A 13 2.404 -13.824 3.664 1.00 1.00 H new ATOM 0 HD22 LEU A 13 2.135 -12.866 2.188 1.00 1.00 H new ATOM 0 HD23 LEU A 13 1.098 -12.616 3.613 1.00 1.00 H new ATOM 197 N LEU A 14 0.125 -10.780 3.325 1.00 1.00 N ATOM 198 CA LEU A 14 0.863 -9.522 3.284 1.00 1.00 C ATOM 199 C LEU A 14 2.311 -9.731 3.705 1.00 1.00 C ATOM 200 O LEU A 14 2.586 -10.337 4.740 1.00 1.00 O ATOM 201 CB LEU A 14 0.203 -8.506 4.222 1.00 1.00 C ATOM 202 CG LEU A 14 0.884 -7.138 4.068 1.00 1.00 C ATOM 203 CD1 LEU A 14 0.681 -6.599 2.639 1.00 1.00 C ATOM 204 CD2 LEU A 14 0.286 -6.159 5.082 1.00 1.00 C ATOM 0 H LEU A 14 0.012 -11.173 4.259 1.00 1.00 H new ATOM 0 HA LEU A 14 0.847 -9.147 2.261 1.00 1.00 H new ATOM 0 HB2 LEU A 14 -0.859 -8.422 3.992 1.00 1.00 H new ATOM 0 HB3 LEU A 14 0.280 -8.847 5.254 1.00 1.00 H new ATOM 0 HG LEU A 14 1.953 -7.247 4.251 1.00 1.00 H new ATOM 0 HD11 LEU A 14 1.169 -5.629 2.543 1.00 1.00 H new ATOM 0 HD12 LEU A 14 1.116 -7.296 1.922 1.00 1.00 H new ATOM 0 HD13 LEU A 14 -0.385 -6.491 2.439 1.00 1.00 H new ATOM 0 HD21 LEU A 14 0.767 -5.187 4.976 1.00 1.00 H new ATOM 0 HD22 LEU A 14 -0.784 -6.056 4.901 1.00 1.00 H new ATOM 0 HD23 LEU A 14 0.449 -6.536 6.092 1.00 1.00 H new ATOM 216 N ASP A 15 3.237 -9.217 2.896 1.00 1.00 N ATOM 217 CA ASP A 15 4.666 -9.336 3.189 1.00 1.00 C ATOM 218 C ASP A 15 5.274 -7.960 3.443 1.00 1.00 C ATOM 219 O ASP A 15 5.107 -7.040 2.643 1.00 1.00 O ATOM 220 CB ASP A 15 5.380 -10.003 2.016 1.00 1.00 C ATOM 221 CG ASP A 15 5.175 -9.190 0.743 1.00 1.00 C ATOM 222 OD1 ASP A 15 4.377 -8.268 0.771 1.00 1.00 O ATOM 223 OD2 ASP A 15 5.822 -9.502 -0.244 1.00 1.00 O ATOM 0 H ASP A 15 3.024 -8.715 2.034 1.00 1.00 H new ATOM 0 HA ASP A 15 4.789 -9.946 4.084 1.00 1.00 H new ATOM 0 HB2 ASP A 15 6.445 -10.092 2.232 1.00 1.00 H new ATOM 0 HB3 ASP A 15 4.998 -11.014 1.876 1.00 1.00 H new ATOM 229 N LEU A 16 5.973 -7.825 4.569 1.00 1.00 N ATOM 230 CA LEU A 16 6.602 -6.554 4.932 1.00 1.00 C ATOM 231 C LEU A 16 8.042 -6.774 5.370 1.00 1.00 C ATOM 232 O LEU A 16 8.369 -7.785 5.990 1.00 1.00 O ATOM 233 CB LEU A 16 5.814 -5.896 6.065 1.00 1.00 C ATOM 234 CG LEU A 16 4.416 -5.513 5.565 1.00 1.00 C ATOM 235 CD1 LEU A 16 3.536 -5.120 6.759 1.00 1.00 C ATOM 236 CD2 LEU A 16 4.504 -4.333 4.579 1.00 1.00 C ATOM 0 H LEU A 16 6.118 -8.576 5.244 1.00 1.00 H new ATOM 0 HA LEU A 16 6.600 -5.902 4.058 1.00 1.00 H new ATOM 0 HB2 LEU A 16 5.734 -6.579 6.910 1.00 1.00 H new ATOM 0 HB3 LEU A 16 6.340 -5.010 6.420 1.00 1.00 H new ATOM 0 HG LEU A 16 3.978 -6.369 5.051 1.00 1.00 H new ATOM 0 HD11 LEU A 16 2.542 -4.848 6.404 1.00 1.00 H new ATOM 0 HD12 LEU A 16 3.458 -5.962 7.446 1.00 1.00 H new ATOM 0 HD13 LEU A 16 3.982 -4.270 7.276 1.00 1.00 H new ATOM 0 HD21 LEU A 16 3.504 -4.073 4.233 1.00 1.00 H new ATOM 0 HD22 LEU A 16 4.950 -3.473 5.079 1.00 1.00 H new ATOM 0 HD23 LEU A 16 5.121 -4.617 3.726 1.00 1.00 H new ATOM 248 N SER A 17 8.898 -5.816 5.040 1.00 1.00 N ATOM 249 CA SER A 17 10.305 -5.904 5.402 1.00 1.00 C ATOM 250 C SER A 17 10.469 -5.835 6.918 1.00 1.00 C ATOM 251 O SER A 17 9.575 -5.375 7.629 1.00 1.00 O ATOM 252 CB SER A 17 11.086 -4.763 4.745 1.00 1.00 C ATOM 253 OG SER A 17 11.356 -5.096 3.390 1.00 1.00 O ATOM 0 H SER A 17 8.644 -4.973 4.525 1.00 1.00 H new ATOM 0 HA SER A 17 10.696 -6.858 5.049 1.00 1.00 H new ATOM 0 HB2 SER A 17 10.512 -3.838 4.796 1.00 1.00 H new ATOM 0 HB3 SER A 17 12.019 -4.590 5.281 1.00 1.00 H new ATOM 0 HG SER A 17 11.855 -4.366 2.967 1.00 1.00 H new ATOM 259 N ASN A 18 11.614 -6.300 7.404 1.00 1.00 N ATOM 260 CA ASN A 18 11.884 -6.295 8.836 1.00 1.00 C ATOM 261 C ASN A 18 11.863 -4.869 9.375 1.00 1.00 C ATOM 262 O ASN A 18 11.399 -4.624 10.489 1.00 1.00 O ATOM 263 CB ASN A 18 13.249 -6.927 9.115 1.00 1.00 C ATOM 264 CG ASN A 18 13.213 -8.415 8.782 1.00 1.00 C ATOM 265 OD1 ASN A 18 12.095 -8.958 8.383 1.00 1.00 O flip ATOM 266 ND2 ASN A 18 14.230 -9.099 8.881 1.00 1.00 N flip ATOM 0 H ASN A 18 12.366 -6.683 6.831 1.00 1.00 H new ATOM 0 HA ASN A 18 11.108 -6.875 9.336 1.00 1.00 H new ATOM 0 HB2 ASN A 18 14.017 -6.431 8.521 1.00 1.00 H new ATOM 0 HB3 ASN A 18 13.517 -6.787 10.162 1.00 1.00 H new ATOM 0 HD21 ASN A 18 15.103 -8.673 9.193 1.00 1.00 H new ATOM 0 HD22 ASN A 18 14.201 -10.092 8.651 1.00 1.00 H new ATOM 273 N GLU A 19 12.372 -3.933 8.583 1.00 1.00 N ATOM 274 CA GLU A 19 12.410 -2.534 8.995 1.00 1.00 C ATOM 275 C GLU A 19 10.999 -2.014 9.255 1.00 1.00 C ATOM 276 O GLU A 19 10.778 -1.221 10.166 1.00 1.00 O ATOM 277 CB GLU A 19 13.072 -1.687 7.905 1.00 1.00 C ATOM 278 CG GLU A 19 13.338 -0.277 8.440 1.00 1.00 C ATOM 279 CD GLU A 19 14.466 -0.315 9.464 1.00 1.00 C ATOM 280 OE1 GLU A 19 15.073 -1.365 9.610 1.00 1.00 O ATOM 281 OE2 GLU A 19 14.707 0.704 10.090 1.00 1.00 O ATOM 0 H GLU A 19 12.762 -4.115 7.658 1.00 1.00 H new ATOM 0 HA GLU A 19 12.989 -2.461 9.916 1.00 1.00 H new ATOM 0 HB2 GLU A 19 14.007 -2.149 7.589 1.00 1.00 H new ATOM 0 HB3 GLU A 19 12.428 -1.638 7.027 1.00 1.00 H new ATOM 0 HG2 GLU A 19 13.603 0.389 7.619 1.00 1.00 H new ATOM 0 HG3 GLU A 19 12.434 0.125 8.897 1.00 1.00 H new ATOM 289 N VAL A 20 10.045 -2.472 8.454 1.00 1.00 N ATOM 290 CA VAL A 20 8.655 -2.048 8.612 1.00 1.00 C ATOM 291 C VAL A 20 8.074 -2.583 9.918 1.00 1.00 C ATOM 292 O VAL A 20 7.386 -1.865 10.642 1.00 1.00 O ATOM 293 CB VAL A 20 7.822 -2.553 7.432 1.00 1.00 C ATOM 294 CG1 VAL A 20 6.345 -2.219 7.662 1.00 1.00 C ATOM 295 CG2 VAL A 20 8.303 -1.883 6.142 1.00 1.00 C ATOM 0 H VAL A 20 10.204 -3.132 7.693 1.00 1.00 H new ATOM 0 HA VAL A 20 8.626 -0.959 8.638 1.00 1.00 H new ATOM 0 HB VAL A 20 7.938 -3.633 7.346 1.00 1.00 H new ATOM 0 HG11 VAL A 20 5.755 -2.580 6.820 1.00 1.00 H new ATOM 0 HG12 VAL A 20 6.002 -2.700 8.578 1.00 1.00 H new ATOM 0 HG13 VAL A 20 6.226 -1.139 7.752 1.00 1.00 H new ATOM 0 HG21 VAL A 20 7.709 -2.243 5.302 1.00 1.00 H new ATOM 0 HG22 VAL A 20 8.190 -0.802 6.229 1.00 1.00 H new ATOM 0 HG23 VAL A 20 9.352 -2.126 5.975 1.00 1.00 H new ATOM 305 N ILE A 21 8.356 -3.847 10.214 1.00 1.00 N ATOM 306 CA ILE A 21 7.853 -4.465 11.437 1.00 1.00 C ATOM 307 C ILE A 21 8.246 -3.615 12.643 1.00 1.00 C ATOM 308 O ILE A 21 7.469 -3.462 13.585 1.00 1.00 O ATOM 309 CB ILE A 21 8.426 -5.877 11.584 1.00 1.00 C ATOM 310 CG1 ILE A 21 7.858 -6.774 10.476 1.00 1.00 C ATOM 311 CG2 ILE A 21 8.043 -6.450 12.952 1.00 1.00 C ATOM 312 CD1 ILE A 21 8.555 -8.140 10.499 1.00 1.00 C ATOM 0 H ILE A 21 8.925 -4.460 9.630 1.00 1.00 H new ATOM 0 HA ILE A 21 6.766 -4.529 11.384 1.00 1.00 H new ATOM 0 HB ILE A 21 9.512 -5.837 11.502 1.00 1.00 H new ATOM 0 HG12 ILE A 21 6.784 -6.902 10.615 1.00 1.00 H new ATOM 0 HG13 ILE A 21 8.000 -6.300 9.505 1.00 1.00 H new ATOM 0 HG21 ILE A 21 8.453 -7.455 13.053 1.00 1.00 H new ATOM 0 HG22 ILE A 21 8.446 -5.813 13.739 1.00 1.00 H new ATOM 0 HG23 ILE A 21 6.957 -6.490 13.039 1.00 1.00 H new ATOM 0 HD11 ILE A 21 8.146 -8.771 9.710 1.00 1.00 H new ATOM 0 HD12 ILE A 21 9.625 -8.005 10.338 1.00 1.00 H new ATOM 0 HD13 ILE A 21 8.390 -8.616 11.466 1.00 1.00 H new ATOM 324 N LYS A 22 9.453 -3.060 12.604 1.00 1.00 N ATOM 325 CA LYS A 22 9.926 -2.212 13.688 1.00 1.00 C ATOM 326 C LYS A 22 9.067 -0.950 13.782 1.00 1.00 C ATOM 327 O LYS A 22 8.764 -0.475 14.876 1.00 1.00 O ATOM 328 CB LYS A 22 11.390 -1.830 13.459 1.00 1.00 C ATOM 329 CG LYS A 22 12.265 -3.073 13.619 1.00 1.00 C ATOM 330 CD LYS A 22 13.731 -2.699 13.389 1.00 1.00 C ATOM 331 CE LYS A 22 14.619 -3.922 13.637 1.00 1.00 C ATOM 332 NZ LYS A 22 14.522 -4.849 12.473 1.00 1.00 N ATOM 0 H LYS A 22 10.116 -3.182 11.839 1.00 1.00 H new ATOM 0 HA LYS A 22 9.847 -2.765 14.624 1.00 1.00 H new ATOM 0 HB2 LYS A 22 11.516 -1.408 12.462 1.00 1.00 H new ATOM 0 HB3 LYS A 22 11.694 -1.063 14.171 1.00 1.00 H new ATOM 0 HG2 LYS A 22 12.138 -3.494 14.616 1.00 1.00 H new ATOM 0 HG3 LYS A 22 11.959 -3.840 12.908 1.00 1.00 H new ATOM 0 HD2 LYS A 22 13.869 -2.338 12.370 1.00 1.00 H new ATOM 0 HD3 LYS A 22 14.019 -1.887 14.057 1.00 1.00 H new ATOM 0 HE2 LYS A 22 15.653 -3.611 13.783 1.00 1.00 H new ATOM 0 HE3 LYS A 22 14.308 -4.432 14.549 1.00 1.00 H new ATOM 0 HZ1 LYS A 22 15.188 -5.638 12.601 1.00 1.00 H new ATOM 0 HZ2 LYS A 22 13.553 -5.221 12.405 1.00 1.00 H new ATOM 0 HZ3 LYS A 22 14.757 -4.336 11.600 1.00 1.00 H new ATOM 346 N GLN A 23 8.683 -0.413 12.624 1.00 1.00 N ATOM 347 CA GLN A 23 7.859 0.787 12.586 1.00 1.00 C ATOM 348 C GLN A 23 6.478 0.494 13.171 1.00 1.00 C ATOM 349 O GLN A 23 5.984 1.232 14.023 1.00 1.00 O ATOM 350 CB GLN A 23 7.714 1.266 11.140 1.00 1.00 C ATOM 351 CG GLN A 23 9.083 1.652 10.591 1.00 1.00 C ATOM 352 CD GLN A 23 8.971 2.048 9.124 1.00 1.00 C ATOM 353 OE1 GLN A 23 7.871 2.105 8.578 1.00 1.00 O ATOM 354 NE2 GLN A 23 10.052 2.329 8.449 1.00 1.00 N ATOM 0 H GLN A 23 8.929 -0.789 11.708 1.00 1.00 H new ATOM 0 HA GLN A 23 8.338 1.565 13.180 1.00 1.00 H new ATOM 0 HB2 GLN A 23 7.274 0.479 10.528 1.00 1.00 H new ATOM 0 HB3 GLN A 23 7.039 2.120 11.095 1.00 1.00 H new ATOM 0 HG2 GLN A 23 9.494 2.480 11.168 1.00 1.00 H new ATOM 0 HG3 GLN A 23 9.774 0.816 10.697 1.00 1.00 H new ATOM 0 HE21 GLN A 23 10.964 2.281 8.903 1.00 1.00 H new ATOM 0 HE22 GLN A 23 9.985 2.596 7.467 1.00 1.00 H new ATOM 363 N LEU A 24 5.864 -0.591 12.709 1.00 1.00 N ATOM 364 CA LEU A 24 4.544 -0.978 13.192 1.00 1.00 C ATOM 365 C LEU A 24 4.586 -1.271 14.685 1.00 1.00 C ATOM 366 O LEU A 24 3.680 -0.893 15.426 1.00 1.00 O ATOM 367 CB LEU A 24 4.057 -2.219 12.438 1.00 1.00 C ATOM 368 CG LEU A 24 3.731 -1.850 10.985 1.00 1.00 C ATOM 369 CD1 LEU A 24 3.534 -3.132 10.168 1.00 1.00 C ATOM 370 CD2 LEU A 24 2.449 -0.995 10.922 1.00 1.00 C ATOM 0 H LEU A 24 6.257 -1.215 12.004 1.00 1.00 H new ATOM 0 HA LEU A 24 3.855 -0.152 13.016 1.00 1.00 H new ATOM 0 HB2 LEU A 24 4.823 -2.995 12.463 1.00 1.00 H new ATOM 0 HB3 LEU A 24 3.173 -2.628 12.926 1.00 1.00 H new ATOM 0 HG LEU A 24 4.558 -1.272 10.572 1.00 1.00 H new ATOM 0 HD11 LEU A 24 3.302 -2.873 9.135 1.00 1.00 H new ATOM 0 HD12 LEU A 24 4.448 -3.726 10.197 1.00 1.00 H new ATOM 0 HD13 LEU A 24 2.712 -3.710 10.590 1.00 1.00 H new ATOM 0 HD21 LEU A 24 2.231 -0.741 9.884 1.00 1.00 H new ATOM 0 HD22 LEU A 24 1.615 -1.558 11.341 1.00 1.00 H new ATOM 0 HD23 LEU A 24 2.593 -0.080 11.496 1.00 1.00 H new ATOM 382 N ASP A 25 5.645 -1.939 15.120 1.00 1.00 N ATOM 383 CA ASP A 25 5.793 -2.278 16.529 1.00 1.00 C ATOM 384 C ASP A 25 5.714 -1.020 17.389 1.00 1.00 C ATOM 385 O ASP A 25 5.056 -1.010 18.429 1.00 1.00 O ATOM 386 CB ASP A 25 7.141 -2.967 16.755 1.00 1.00 C ATOM 387 CG ASP A 25 7.199 -3.551 18.162 1.00 1.00 C ATOM 388 OD1 ASP A 25 6.459 -3.078 19.009 1.00 1.00 O ATOM 389 OD2 ASP A 25 7.982 -4.462 18.373 1.00 1.00 O ATOM 0 H ASP A 25 6.409 -2.255 14.523 1.00 1.00 H new ATOM 0 HA ASP A 25 4.985 -2.952 16.813 1.00 1.00 H new ATOM 0 HB2 ASP A 25 7.283 -3.758 16.018 1.00 1.00 H new ATOM 0 HB3 ASP A 25 7.952 -2.252 16.615 1.00 1.00 H new ATOM 395 N ASP A 26 6.383 0.040 16.949 1.00 1.00 N ATOM 396 CA ASP A 26 6.377 1.295 17.691 1.00 1.00 C ATOM 397 C ASP A 26 4.952 1.832 17.811 1.00 1.00 C ATOM 398 O ASP A 26 4.547 2.317 18.866 1.00 1.00 O ATOM 399 CB ASP A 26 7.261 2.324 16.982 1.00 1.00 C ATOM 400 CG ASP A 26 7.382 3.584 17.833 1.00 1.00 C ATOM 401 OD1 ASP A 26 8.165 4.447 17.471 1.00 1.00 O ATOM 402 OD2 ASP A 26 6.689 3.668 18.833 1.00 1.00 O ATOM 0 H ASP A 26 6.932 0.056 16.090 1.00 1.00 H new ATOM 0 HA ASP A 26 6.770 1.113 18.691 1.00 1.00 H new ATOM 0 HB2 ASP A 26 8.249 1.902 16.800 1.00 1.00 H new ATOM 0 HB3 ASP A 26 6.836 2.572 16.009 1.00 1.00 H new ATOM 408 N LEU A 27 4.201 1.742 16.723 1.00 1.00 N ATOM 409 CA LEU A 27 2.821 2.212 16.712 1.00 1.00 C ATOM 410 C LEU A 27 1.930 1.279 17.526 1.00 1.00 C ATOM 411 O LEU A 27 0.956 1.716 18.136 1.00 1.00 O ATOM 412 CB LEU A 27 2.302 2.308 15.270 1.00 1.00 C ATOM 413 CG LEU A 27 2.773 3.623 14.622 1.00 1.00 C ATOM 414 CD1 LEU A 27 4.217 3.474 14.137 1.00 1.00 C ATOM 415 CD2 LEU A 27 1.869 3.960 13.436 1.00 1.00 C ATOM 0 H LEU A 27 4.522 1.349 15.838 1.00 1.00 H new ATOM 0 HA LEU A 27 2.793 3.203 17.165 1.00 1.00 H new ATOM 0 HB2 LEU A 27 2.661 1.459 14.689 1.00 1.00 H new ATOM 0 HB3 LEU A 27 1.213 2.261 15.264 1.00 1.00 H new ATOM 0 HG LEU A 27 2.722 4.425 15.359 1.00 1.00 H new ATOM 0 HD11 LEU A 27 4.545 4.407 13.679 1.00 1.00 H new ATOM 0 HD12 LEU A 27 4.862 3.238 14.983 1.00 1.00 H new ATOM 0 HD13 LEU A 27 4.273 2.670 13.403 1.00 1.00 H new ATOM 0 HD21 LEU A 27 2.202 4.891 12.977 1.00 1.00 H new ATOM 0 HD22 LEU A 27 1.917 3.156 12.702 1.00 1.00 H new ATOM 0 HD23 LEU A 27 0.842 4.074 13.782 1.00 1.00 H new ATOM 427 N GLU A 28 2.265 -0.005 17.520 1.00 1.00 N ATOM 428 CA GLU A 28 1.488 -0.987 18.257 1.00 1.00 C ATOM 429 C GLU A 28 1.670 -0.801 19.758 1.00 1.00 C ATOM 430 O GLU A 28 0.719 -0.928 20.523 1.00 1.00 O ATOM 431 CB GLU A 28 1.922 -2.397 17.849 1.00 1.00 C ATOM 432 CG GLU A 28 1.321 -2.750 16.486 1.00 1.00 C ATOM 433 CD GLU A 28 1.750 -4.153 16.075 1.00 1.00 C ATOM 434 OE1 GLU A 28 2.792 -4.274 15.453 1.00 1.00 O ATOM 435 OE2 GLU A 28 1.030 -5.087 16.388 1.00 1.00 O ATOM 0 H GLU A 28 3.065 -0.387 17.015 1.00 1.00 H new ATOM 0 HA GLU A 28 0.433 -0.848 18.019 1.00 1.00 H new ATOM 0 HB2 GLU A 28 3.010 -2.454 17.803 1.00 1.00 H new ATOM 0 HB3 GLU A 28 1.597 -3.119 18.598 1.00 1.00 H new ATOM 0 HG2 GLU A 28 0.234 -2.692 16.533 1.00 1.00 H new ATOM 0 HG3 GLU A 28 1.646 -2.027 15.738 1.00 1.00 H new ATOM 443 N VAL A 29 2.899 -0.507 20.171 1.00 1.00 N ATOM 444 CA VAL A 29 3.184 -0.313 21.588 1.00 1.00 C ATOM 445 C VAL A 29 2.498 0.948 22.110 1.00 1.00 C ATOM 446 O VAL A 29 1.818 0.915 23.136 1.00 1.00 O ATOM 447 CB VAL A 29 4.696 -0.201 21.804 1.00 1.00 C ATOM 448 CG1 VAL A 29 4.984 0.175 23.262 1.00 1.00 C ATOM 449 CG2 VAL A 29 5.359 -1.544 21.482 1.00 1.00 C ATOM 0 H VAL A 29 3.704 -0.399 19.554 1.00 1.00 H new ATOM 0 HA VAL A 29 2.799 -1.173 22.137 1.00 1.00 H new ATOM 0 HB VAL A 29 5.098 0.571 21.147 1.00 1.00 H new ATOM 0 HG11 VAL A 29 6.061 0.254 23.412 1.00 1.00 H new ATOM 0 HG12 VAL A 29 4.515 1.132 23.490 1.00 1.00 H new ATOM 0 HG13 VAL A 29 4.581 -0.593 23.922 1.00 1.00 H new ATOM 0 HG21 VAL A 29 6.435 -1.465 21.636 1.00 1.00 H new ATOM 0 HG22 VAL A 29 4.955 -2.316 22.137 1.00 1.00 H new ATOM 0 HG23 VAL A 29 5.159 -1.809 20.444 1.00 1.00 H new ATOM 459 N GLN A 30 2.687 2.055 21.398 1.00 1.00 N ATOM 460 CA GLN A 30 2.091 3.319 21.808 1.00 1.00 C ATOM 461 C GLN A 30 0.594 3.153 22.033 1.00 1.00 C ATOM 462 O GLN A 30 0.063 3.567 23.062 1.00 1.00 O ATOM 463 CB GLN A 30 2.328 4.376 20.729 1.00 1.00 C ATOM 464 CG GLN A 30 3.807 4.769 20.705 1.00 1.00 C ATOM 465 CD GLN A 30 4.163 5.539 21.972 1.00 1.00 C ATOM 466 OE1 GLN A 30 3.432 6.444 22.374 1.00 1.00 O ATOM 467 NE2 GLN A 30 5.250 5.236 22.627 1.00 1.00 N ATOM 0 H GLN A 30 3.242 2.102 20.544 1.00 1.00 H new ATOM 0 HA GLN A 30 2.556 3.636 22.741 1.00 1.00 H new ATOM 0 HB2 GLN A 30 2.029 3.988 19.755 1.00 1.00 H new ATOM 0 HB3 GLN A 30 1.712 5.254 20.925 1.00 1.00 H new ATOM 0 HG2 GLN A 30 4.428 3.876 20.626 1.00 1.00 H new ATOM 0 HG3 GLN A 30 4.015 5.381 19.827 1.00 1.00 H new ATOM 0 HE21 GLN A 30 5.855 4.486 22.292 1.00 1.00 H new ATOM 0 HE22 GLN A 30 5.495 5.749 23.474 1.00 1.00 H new ATOM 476 N ARG A 31 -0.079 2.538 21.065 1.00 1.00 N ATOM 477 CA ARG A 31 -1.520 2.319 21.169 1.00 1.00 C ATOM 478 C ARG A 31 -1.815 0.991 21.861 1.00 1.00 C ATOM 479 O ARG A 31 -2.950 0.725 22.252 1.00 1.00 O ATOM 480 CB ARG A 31 -2.147 2.320 19.774 1.00 1.00 C ATOM 481 CG ARG A 31 -1.967 3.698 19.135 1.00 1.00 C ATOM 482 CD ARG A 31 -2.548 3.689 17.719 1.00 1.00 C ATOM 483 NE ARG A 31 -3.991 3.482 17.772 1.00 1.00 N ATOM 484 CZ ARG A 31 -4.812 4.465 18.127 1.00 1.00 C ATOM 485 NH1 ARG A 31 -4.332 5.636 18.444 1.00 1.00 N ATOM 486 NH2 ARG A 31 -6.100 4.257 18.166 1.00 1.00 N ATOM 0 H ARG A 31 0.344 2.185 20.207 1.00 1.00 H new ATOM 0 HA ARG A 31 -1.949 3.126 21.763 1.00 1.00 H new ATOM 0 HB2 ARG A 31 -1.680 1.556 19.153 1.00 1.00 H new ATOM 0 HB3 ARG A 31 -3.207 2.073 19.840 1.00 1.00 H new ATOM 0 HG2 ARG A 31 -2.465 4.457 19.738 1.00 1.00 H new ATOM 0 HG3 ARG A 31 -0.909 3.960 19.103 1.00 1.00 H new ATOM 0 HD2 ARG A 31 -2.326 4.632 17.220 1.00 1.00 H new ATOM 0 HD3 ARG A 31 -2.081 2.899 17.130 1.00 1.00 H new ATOM 0 HE ARG A 31 -4.376 2.568 17.533 1.00 1.00 H new ATOM 0 HH11 ARG A 31 -3.325 5.798 18.420 1.00 1.00 H new ATOM 0 HH12 ARG A 31 -4.963 6.389 18.716 1.00 1.00 H new ATOM 0 HH21 ARG A 31 -6.476 3.340 17.924 1.00 1.00 H new ATOM 0 HH22 ARG A 31 -6.730 5.011 18.438 1.00 1.00 H new ATOM 500 N ASN A 32 -0.786 0.165 22.007 1.00 1.00 N ATOM 501 CA ASN A 32 -0.939 -1.135 22.645 1.00 1.00 C ATOM 502 C ASN A 32 -1.957 -1.976 21.897 1.00 1.00 C ATOM 503 O ASN A 32 -2.646 -2.803 22.494 1.00 1.00 O ATOM 504 CB ASN A 32 -1.397 -0.955 24.090 1.00 1.00 C ATOM 505 CG ASN A 32 -0.501 0.054 24.796 1.00 1.00 C ATOM 506 OD1 ASN A 32 0.688 -0.199 24.988 1.00 1.00 O ATOM 507 ND2 ASN A 32 -1.002 1.191 25.191 1.00 1.00 N ATOM 0 H ASN A 32 0.162 0.373 21.692 1.00 1.00 H new ATOM 0 HA ASN A 32 0.025 -1.643 22.628 1.00 1.00 H new ATOM 0 HB2 ASN A 32 -2.432 -0.614 24.113 1.00 1.00 H new ATOM 0 HB3 ASN A 32 -1.365 -1.911 24.613 1.00 1.00 H new ATOM 0 HD21 ASN A 32 -0.408 1.874 25.661 1.00 1.00 H new ATOM 0 HD22 ASN A 32 -1.988 1.397 25.030 1.00 1.00 H new ATOM 514 N LEU A 33 -2.049 -1.764 20.582 1.00 1.00 N ATOM 515 CA LEU A 33 -2.996 -2.514 19.754 1.00 1.00 C ATOM 516 C LEU A 33 -2.248 -3.426 18.782 1.00 1.00 C ATOM 517 O LEU A 33 -1.088 -3.181 18.452 1.00 1.00 O ATOM 518 CB LEU A 33 -3.898 -1.537 18.963 1.00 1.00 C ATOM 519 CG LEU A 33 -5.246 -1.360 19.674 1.00 1.00 C ATOM 520 CD1 LEU A 33 -5.045 -0.538 20.941 1.00 1.00 C ATOM 521 CD2 LEU A 33 -6.217 -0.639 18.743 1.00 1.00 C ATOM 0 H LEU A 33 -1.484 -1.085 20.071 1.00 1.00 H new ATOM 0 HA LEU A 33 -3.617 -3.128 20.407 1.00 1.00 H new ATOM 0 HB2 LEU A 33 -3.401 -0.572 18.865 1.00 1.00 H new ATOM 0 HB3 LEU A 33 -4.059 -1.916 17.954 1.00 1.00 H new ATOM 0 HG LEU A 33 -5.654 -2.336 19.937 1.00 1.00 H new ATOM 0 HD11 LEU A 33 -6.002 -0.411 21.448 1.00 1.00 H new ATOM 0 HD12 LEU A 33 -4.349 -1.054 21.603 1.00 1.00 H new ATOM 0 HD13 LEU A 33 -4.640 0.440 20.680 1.00 1.00 H new ATOM 0 HD21 LEU A 33 -7.176 -0.512 19.245 1.00 1.00 H new ATOM 0 HD22 LEU A 33 -5.812 0.338 18.481 1.00 1.00 H new ATOM 0 HD23 LEU A 33 -6.358 -1.228 17.837 1.00 1.00 H new ATOM 533 N PRO A 34 -2.903 -4.460 18.313 1.00 1.00 N ATOM 534 CA PRO A 34 -2.302 -5.420 17.346 1.00 1.00 C ATOM 535 C PRO A 34 -2.117 -4.791 15.966 1.00 1.00 C ATOM 536 O PRO A 34 -2.806 -3.836 15.609 1.00 1.00 O ATOM 537 CB PRO A 34 -3.313 -6.577 17.299 1.00 1.00 C ATOM 538 CG PRO A 34 -4.622 -5.982 17.715 1.00 1.00 C ATOM 539 CD PRO A 34 -4.291 -4.829 18.662 1.00 1.00 C ATOM 0 HA PRO A 34 -1.305 -5.742 17.648 1.00 1.00 H new ATOM 0 HB2 PRO A 34 -3.376 -7.003 16.297 1.00 1.00 H new ATOM 0 HB3 PRO A 34 -3.018 -7.384 17.970 1.00 1.00 H new ATOM 0 HG2 PRO A 34 -5.179 -5.625 16.849 1.00 1.00 H new ATOM 0 HG3 PRO A 34 -5.246 -6.725 18.211 1.00 1.00 H new ATOM 0 HD2 PRO A 34 -4.973 -3.990 18.522 1.00 1.00 H new ATOM 0 HD3 PRO A 34 -4.371 -5.135 19.705 1.00 1.00 H new ATOM 547 N ARG A 35 -1.185 -5.339 15.192 1.00 1.00 N ATOM 548 CA ARG A 35 -0.924 -4.832 13.852 1.00 1.00 C ATOM 549 C ARG A 35 -2.139 -5.038 12.958 1.00 1.00 C ATOM 550 O ARG A 35 -2.530 -4.140 12.212 1.00 1.00 O ATOM 551 CB ARG A 35 0.285 -5.558 13.257 1.00 1.00 C ATOM 552 CG ARG A 35 -0.068 -7.024 12.989 1.00 1.00 C ATOM 553 CD ARG A 35 1.209 -7.811 12.691 1.00 1.00 C ATOM 554 NE ARG A 35 0.894 -9.223 12.506 1.00 1.00 N ATOM 555 CZ ARG A 35 1.831 -10.157 12.633 1.00 1.00 C ATOM 556 NH1 ARG A 35 3.056 -9.817 12.925 1.00 1.00 N ATOM 557 NH2 ARG A 35 1.526 -11.415 12.467 1.00 1.00 N ATOM 0 H ARG A 35 -0.602 -6.129 15.469 1.00 1.00 H new ATOM 0 HA ARG A 35 -0.715 -3.764 13.914 1.00 1.00 H new ATOM 0 HB2 ARG A 35 0.591 -5.073 12.330 1.00 1.00 H new ATOM 0 HB3 ARG A 35 1.130 -5.498 13.943 1.00 1.00 H new ATOM 0 HG2 ARG A 35 -0.577 -7.450 13.854 1.00 1.00 H new ATOM 0 HG3 ARG A 35 -0.756 -7.095 12.147 1.00 1.00 H new ATOM 0 HD2 ARG A 35 1.688 -7.417 11.795 1.00 1.00 H new ATOM 0 HD3 ARG A 35 1.918 -7.693 13.510 1.00 1.00 H new ATOM 0 HE ARG A 35 -0.061 -9.498 12.275 1.00 1.00 H new ATOM 0 HH11 ARG A 35 3.295 -8.834 13.056 1.00 1.00 H new ATOM 0 HH12 ARG A 35 3.775 -10.534 13.022 1.00 1.00 H new ATOM 0 HH21 ARG A 35 0.568 -11.682 12.240 1.00 1.00 H new ATOM 0 HH22 ARG A 35 2.246 -12.131 12.565 1.00 1.00 H new ATOM 571 N ALA A 36 -2.733 -6.227 13.030 1.00 1.00 N ATOM 572 CA ALA A 36 -3.893 -6.534 12.204 1.00 1.00 C ATOM 573 C ALA A 36 -4.911 -5.403 12.286 1.00 1.00 C ATOM 574 O ALA A 36 -5.505 -5.022 11.279 1.00 1.00 O ATOM 575 CB ALA A 36 -4.539 -7.838 12.687 1.00 1.00 C ATOM 0 H ALA A 36 -2.433 -6.984 13.645 1.00 1.00 H new ATOM 0 HA ALA A 36 -3.569 -6.647 11.169 1.00 1.00 H new ATOM 0 HB1 ALA A 36 -5.407 -8.065 12.068 1.00 1.00 H new ATOM 0 HB2 ALA A 36 -3.817 -8.651 12.613 1.00 1.00 H new ATOM 0 HB3 ALA A 36 -4.853 -7.726 13.725 1.00 1.00 H new ATOM 581 N ASP A 37 -5.103 -4.870 13.484 1.00 1.00 N ATOM 582 CA ASP A 37 -6.057 -3.782 13.675 1.00 1.00 C ATOM 583 C ASP A 37 -5.584 -2.531 12.933 1.00 1.00 C ATOM 584 O ASP A 37 -6.386 -1.805 12.349 1.00 1.00 O ATOM 585 CB ASP A 37 -6.202 -3.479 15.174 1.00 1.00 C ATOM 586 CG ASP A 37 -7.229 -4.418 15.811 1.00 1.00 C ATOM 587 OD1 ASP A 37 -7.389 -4.354 17.019 1.00 1.00 O ATOM 588 OD2 ASP A 37 -7.830 -5.196 15.086 1.00 1.00 O ATOM 0 H ASP A 37 -4.618 -5.167 14.331 1.00 1.00 H new ATOM 0 HA ASP A 37 -7.025 -4.083 13.274 1.00 1.00 H new ATOM 0 HB2 ASP A 37 -5.238 -3.594 15.670 1.00 1.00 H new ATOM 0 HB3 ASP A 37 -6.511 -2.443 15.314 1.00 1.00 H new ATOM 594 N LEU A 38 -4.279 -2.288 12.963 1.00 1.00 N ATOM 595 CA LEU A 38 -3.716 -1.126 12.289 1.00 1.00 C ATOM 596 C LEU A 38 -3.898 -1.241 10.782 1.00 1.00 C ATOM 597 O LEU A 38 -4.214 -0.262 10.110 1.00 1.00 O ATOM 598 CB LEU A 38 -2.228 -0.997 12.626 1.00 1.00 C ATOM 599 CG LEU A 38 -2.063 -0.663 14.116 1.00 1.00 C ATOM 600 CD1 LEU A 38 -0.573 -0.677 14.479 1.00 1.00 C ATOM 601 CD2 LEU A 38 -2.657 0.727 14.425 1.00 1.00 C ATOM 0 H LEU A 38 -3.596 -2.875 13.443 1.00 1.00 H new ATOM 0 HA LEU A 38 -4.241 -0.236 12.635 1.00 1.00 H new ATOM 0 HB2 LEU A 38 -1.710 -1.927 12.392 1.00 1.00 H new ATOM 0 HB3 LEU A 38 -1.773 -0.217 12.016 1.00 1.00 H new ATOM 0 HG LEU A 38 -2.594 -1.410 14.707 1.00 1.00 H new ATOM 0 HD11 LEU A 38 -0.454 -0.440 15.536 1.00 1.00 H new ATOM 0 HD12 LEU A 38 -0.159 -1.666 14.280 1.00 1.00 H new ATOM 0 HD13 LEU A 38 -0.045 0.065 13.879 1.00 1.00 H new ATOM 0 HD21 LEU A 38 -2.532 0.949 15.485 1.00 1.00 H new ATOM 0 HD22 LEU A 38 -2.141 1.483 13.833 1.00 1.00 H new ATOM 0 HD23 LEU A 38 -3.718 0.733 14.176 1.00 1.00 H new ATOM 613 N LEU A 39 -3.691 -2.444 10.259 1.00 1.00 N ATOM 614 CA LEU A 39 -3.828 -2.672 8.827 1.00 1.00 C ATOM 615 C LEU A 39 -5.259 -2.405 8.375 1.00 1.00 C ATOM 616 O LEU A 39 -5.484 -1.728 7.373 1.00 1.00 O ATOM 617 CB LEU A 39 -3.449 -4.118 8.500 1.00 1.00 C ATOM 618 CG LEU A 39 -1.948 -4.325 8.740 1.00 1.00 C ATOM 619 CD1 LEU A 39 -1.616 -5.818 8.631 1.00 1.00 C ATOM 620 CD2 LEU A 39 -1.127 -3.533 7.702 1.00 1.00 C ATOM 0 H LEU A 39 -3.430 -3.269 10.800 1.00 1.00 H new ATOM 0 HA LEU A 39 -3.162 -1.988 8.300 1.00 1.00 H new ATOM 0 HB2 LEU A 39 -4.025 -4.804 9.121 1.00 1.00 H new ATOM 0 HB3 LEU A 39 -3.696 -4.343 7.463 1.00 1.00 H new ATOM 0 HG LEU A 39 -1.694 -3.965 9.737 1.00 1.00 H new ATOM 0 HD11 LEU A 39 -0.550 -5.967 8.801 1.00 1.00 H new ATOM 0 HD12 LEU A 39 -2.184 -6.372 9.378 1.00 1.00 H new ATOM 0 HD13 LEU A 39 -1.878 -6.177 7.636 1.00 1.00 H new ATOM 0 HD21 LEU A 39 -0.064 -3.689 7.884 1.00 1.00 H new ATOM 0 HD22 LEU A 39 -1.378 -3.878 6.699 1.00 1.00 H new ATOM 0 HD23 LEU A 39 -1.358 -2.471 7.789 1.00 1.00 H new ATOM 632 N ARG A 40 -6.219 -2.939 9.120 1.00 1.00 N ATOM 633 CA ARG A 40 -7.623 -2.752 8.781 1.00 1.00 C ATOM 634 C ARG A 40 -7.978 -1.270 8.789 1.00 1.00 C ATOM 635 O ARG A 40 -8.662 -0.780 7.891 1.00 1.00 O ATOM 636 CB ARG A 40 -8.505 -3.502 9.781 1.00 1.00 C ATOM 637 CG ARG A 40 -9.973 -3.346 9.385 1.00 1.00 C ATOM 638 CD ARG A 40 -10.839 -4.257 10.257 1.00 1.00 C ATOM 639 NE ARG A 40 -10.576 -5.657 9.937 1.00 1.00 N ATOM 640 CZ ARG A 40 -11.192 -6.257 8.922 1.00 1.00 C ATOM 641 NH1 ARG A 40 -12.051 -5.594 8.196 1.00 1.00 N ATOM 642 NH2 ARG A 40 -10.938 -7.508 8.651 1.00 1.00 N ATOM 0 H ARG A 40 -6.053 -3.500 9.955 1.00 1.00 H new ATOM 0 HA ARG A 40 -7.796 -3.149 7.781 1.00 1.00 H new ATOM 0 HB2 ARG A 40 -8.233 -4.557 9.801 1.00 1.00 H new ATOM 0 HB3 ARG A 40 -8.345 -3.112 10.786 1.00 1.00 H new ATOM 0 HG2 ARG A 40 -10.284 -2.308 9.505 1.00 1.00 H new ATOM 0 HG3 ARG A 40 -10.105 -3.599 8.333 1.00 1.00 H new ATOM 0 HD2 ARG A 40 -10.629 -4.071 11.310 1.00 1.00 H new ATOM 0 HD3 ARG A 40 -11.893 -4.031 10.097 1.00 1.00 H new ATOM 0 HE ARG A 40 -9.909 -6.184 10.501 1.00 1.00 H new ATOM 0 HH11 ARG A 40 -12.250 -4.616 8.407 1.00 1.00 H new ATOM 0 HH12 ARG A 40 -12.523 -6.054 7.418 1.00 1.00 H new ATOM 0 HH21 ARG A 40 -10.267 -8.026 9.218 1.00 1.00 H new ATOM 0 HH22 ARG A 40 -11.411 -7.967 7.873 1.00 1.00 H new ATOM 656 N GLU A 41 -7.503 -0.559 9.806 1.00 1.00 N ATOM 657 CA GLU A 41 -7.772 0.872 9.914 1.00 1.00 C ATOM 658 C GLU A 41 -7.054 1.636 8.808 1.00 1.00 C ATOM 659 O GLU A 41 -7.623 2.537 8.193 1.00 1.00 O ATOM 660 CB GLU A 41 -7.307 1.386 11.279 1.00 1.00 C ATOM 661 CG GLU A 41 -8.205 0.812 12.376 1.00 1.00 C ATOM 662 CD GLU A 41 -7.697 1.247 13.747 1.00 1.00 C ATOM 663 OE1 GLU A 41 -6.721 1.978 13.792 1.00 1.00 O ATOM 664 OE2 GLU A 41 -8.292 0.844 14.733 1.00 1.00 O ATOM 0 H GLU A 41 -6.935 -0.944 10.561 1.00 1.00 H new ATOM 0 HA GLU A 41 -8.845 1.032 9.811 1.00 1.00 H new ATOM 0 HB2 GLU A 41 -6.271 1.096 11.454 1.00 1.00 H new ATOM 0 HB3 GLU A 41 -7.341 2.475 11.300 1.00 1.00 H new ATOM 0 HG2 GLU A 41 -9.230 1.154 12.234 1.00 1.00 H new ATOM 0 HG3 GLU A 41 -8.220 -0.276 12.313 1.00 1.00 H new ATOM 672 N ALA A 42 -5.802 1.267 8.553 1.00 1.00 N ATOM 673 CA ALA A 42 -5.022 1.926 7.512 1.00 1.00 C ATOM 674 C ALA A 42 -5.730 1.799 6.166 1.00 1.00 C ATOM 675 O ALA A 42 -5.843 2.774 5.423 1.00 1.00 O ATOM 676 CB ALA A 42 -3.629 1.295 7.424 1.00 1.00 C ATOM 0 H ALA A 42 -5.310 0.523 9.048 1.00 1.00 H new ATOM 0 HA ALA A 42 -4.922 2.982 7.763 1.00 1.00 H new ATOM 0 HB1 ALA A 42 -3.053 1.793 6.644 1.00 1.00 H new ATOM 0 HB2 ALA A 42 -3.118 1.407 8.380 1.00 1.00 H new ATOM 0 HB3 ALA A 42 -3.724 0.236 7.185 1.00 1.00 H new ATOM 682 N VAL A 43 -6.215 0.595 5.864 1.00 1.00 N ATOM 683 CA VAL A 43 -6.922 0.369 4.610 1.00 1.00 C ATOM 684 C VAL A 43 -8.257 1.111 4.619 1.00 1.00 C ATOM 685 O VAL A 43 -8.568 1.859 3.694 1.00 1.00 O ATOM 686 CB VAL A 43 -7.161 -1.128 4.415 1.00 1.00 C ATOM 687 CG1 VAL A 43 -7.986 -1.355 3.148 1.00 1.00 C ATOM 688 CG2 VAL A 43 -5.811 -1.841 4.278 1.00 1.00 C ATOM 0 H VAL A 43 -6.132 -0.227 6.463 1.00 1.00 H new ATOM 0 HA VAL A 43 -6.315 0.746 3.787 1.00 1.00 H new ATOM 0 HB VAL A 43 -7.702 -1.525 5.274 1.00 1.00 H new ATOM 0 HG11 VAL A 43 -8.155 -2.423 3.011 1.00 1.00 H new ATOM 0 HG12 VAL A 43 -8.945 -0.845 3.242 1.00 1.00 H new ATOM 0 HG13 VAL A 43 -7.447 -0.959 2.287 1.00 1.00 H new ATOM 0 HG21 VAL A 43 -5.976 -2.909 4.139 1.00 1.00 H new ATOM 0 HG22 VAL A 43 -5.274 -1.442 3.417 1.00 1.00 H new ATOM 0 HG23 VAL A 43 -5.221 -1.680 5.180 1.00 1.00 H new ATOM 698 N ASP A 44 -9.047 0.895 5.671 1.00 1.00 N ATOM 699 CA ASP A 44 -10.343 1.549 5.782 1.00 1.00 C ATOM 700 C ASP A 44 -10.176 3.058 5.633 1.00 1.00 C ATOM 701 O ASP A 44 -10.896 3.693 4.864 1.00 1.00 O ATOM 702 CB ASP A 44 -10.962 1.221 7.152 1.00 1.00 C ATOM 703 CG ASP A 44 -11.713 -0.107 7.100 1.00 1.00 C ATOM 704 OD1 ASP A 44 -11.643 -0.844 8.070 1.00 1.00 O ATOM 705 OD2 ASP A 44 -12.363 -0.361 6.097 1.00 1.00 O ATOM 0 H ASP A 44 -8.812 0.278 6.449 1.00 1.00 H new ATOM 0 HA ASP A 44 -11.002 1.189 4.992 1.00 1.00 H new ATOM 0 HB2 ASP A 44 -10.179 1.172 7.908 1.00 1.00 H new ATOM 0 HB3 ASP A 44 -11.643 2.018 7.449 1.00 1.00 H new ATOM 711 N GLN A 45 -9.217 3.620 6.359 1.00 1.00 N ATOM 712 CA GLN A 45 -8.964 5.048 6.282 1.00 1.00 C ATOM 713 C GLN A 45 -8.564 5.441 4.864 1.00 1.00 C ATOM 714 O GLN A 45 -8.985 6.481 4.356 1.00 1.00 O ATOM 715 CB GLN A 45 -7.847 5.427 7.259 1.00 1.00 C ATOM 716 CG GLN A 45 -8.388 5.417 8.691 1.00 1.00 C ATOM 717 CD GLN A 45 -7.267 5.740 9.674 1.00 1.00 C ATOM 718 OE1 GLN A 45 -6.156 6.071 9.263 1.00 1.00 O ATOM 719 NE2 GLN A 45 -7.494 5.659 10.957 1.00 1.00 N ATOM 0 H GLN A 45 -8.609 3.112 7.001 1.00 1.00 H new ATOM 0 HA GLN A 45 -9.876 5.582 6.549 1.00 1.00 H new ATOM 0 HB2 GLN A 45 -7.018 4.725 7.168 1.00 1.00 H new ATOM 0 HB3 GLN A 45 -7.457 6.415 7.014 1.00 1.00 H new ATOM 0 HG2 GLN A 45 -9.191 6.147 8.790 1.00 1.00 H new ATOM 0 HG3 GLN A 45 -8.814 4.440 8.921 1.00 1.00 H new ATOM 0 HE21 GLN A 45 -8.416 5.384 11.295 1.00 1.00 H new ATOM 0 HE22 GLN A 45 -6.749 5.870 11.621 1.00 1.00 H new ATOM 728 N TYR A 46 -7.753 4.602 4.234 1.00 1.00 N ATOM 729 CA TYR A 46 -7.299 4.867 2.874 1.00 1.00 C ATOM 730 C TYR A 46 -8.489 4.935 1.922 1.00 1.00 C ATOM 731 O TYR A 46 -8.545 5.790 1.039 1.00 1.00 O ATOM 732 CB TYR A 46 -6.335 3.770 2.422 1.00 1.00 C ATOM 733 CG TYR A 46 -5.675 4.182 1.127 1.00 1.00 C ATOM 734 CD1 TYR A 46 -4.675 5.162 1.135 1.00 1.00 C ATOM 735 CD2 TYR A 46 -6.055 3.584 -0.081 1.00 1.00 C ATOM 736 CE1 TYR A 46 -4.058 5.546 -0.061 1.00 1.00 C ATOM 737 CE2 TYR A 46 -5.439 3.967 -1.278 1.00 1.00 C ATOM 738 CZ TYR A 46 -4.440 4.948 -1.268 1.00 1.00 C ATOM 739 OH TYR A 46 -3.833 5.326 -2.449 1.00 1.00 O ATOM 0 H TYR A 46 -7.397 3.736 4.639 1.00 1.00 H new ATOM 0 HA TYR A 46 -6.782 5.826 2.859 1.00 1.00 H new ATOM 0 HB2 TYR A 46 -5.580 3.596 3.188 1.00 1.00 H new ATOM 0 HB3 TYR A 46 -6.873 2.832 2.286 1.00 1.00 H new ATOM 0 HD1 TYR A 46 -4.379 5.623 2.066 1.00 1.00 H new ATOM 0 HD2 TYR A 46 -6.824 2.826 -0.089 1.00 1.00 H new ATOM 0 HE1 TYR A 46 -3.288 6.303 -0.053 1.00 1.00 H new ATOM 0 HE2 TYR A 46 -5.734 3.506 -2.209 1.00 1.00 H new ATOM 0 HH TYR A 46 -4.214 4.813 -3.192 1.00 1.00 H new ATOM 749 N LEU A 47 -9.437 4.024 2.109 1.00 1.00 N ATOM 750 CA LEU A 47 -10.625 3.986 1.261 1.00 1.00 C ATOM 751 C LEU A 47 -11.430 5.272 1.398 1.00 1.00 C ATOM 752 O LEU A 47 -11.929 5.808 0.410 1.00 1.00 O ATOM 753 CB LEU A 47 -11.504 2.795 1.651 1.00 1.00 C ATOM 754 CG LEU A 47 -10.802 1.486 1.264 1.00 1.00 C ATOM 755 CD1 LEU A 47 -11.572 0.298 1.855 1.00 1.00 C ATOM 756 CD2 LEU A 47 -10.735 1.350 -0.272 1.00 1.00 C ATOM 0 H LEU A 47 -9.408 3.307 2.834 1.00 1.00 H new ATOM 0 HA LEU A 47 -10.302 3.883 0.225 1.00 1.00 H new ATOM 0 HB2 LEU A 47 -11.700 2.811 2.723 1.00 1.00 H new ATOM 0 HB3 LEU A 47 -12.469 2.863 1.150 1.00 1.00 H new ATOM 0 HG LEU A 47 -9.787 1.497 1.661 1.00 1.00 H new ATOM 0 HD11 LEU A 47 -11.074 -0.632 1.580 1.00 1.00 H new ATOM 0 HD12 LEU A 47 -11.601 0.387 2.941 1.00 1.00 H new ATOM 0 HD13 LEU A 47 -12.590 0.293 1.464 1.00 1.00 H new ATOM 0 HD21 LEU A 47 -10.235 0.417 -0.533 1.00 1.00 H new ATOM 0 HD22 LEU A 47 -11.745 1.347 -0.681 1.00 1.00 H new ATOM 0 HD23 LEU A 47 -10.178 2.189 -0.688 1.00 1.00 H new ATOM 768 N ILE A 48 -11.549 5.764 2.626 1.00 1.00 N ATOM 769 CA ILE A 48 -12.305 6.985 2.871 1.00 1.00 C ATOM 770 C ILE A 48 -11.674 8.153 2.114 1.00 1.00 C ATOM 771 O ILE A 48 -12.375 8.936 1.474 1.00 1.00 O ATOM 772 CB ILE A 48 -12.318 7.293 4.371 1.00 1.00 C ATOM 773 CG1 ILE A 48 -13.144 6.230 5.102 1.00 1.00 C ATOM 774 CG2 ILE A 48 -12.933 8.675 4.611 1.00 1.00 C ATOM 775 CD1 ILE A 48 -12.987 6.404 6.616 1.00 1.00 C ATOM 0 H ILE A 48 -11.137 5.342 3.458 1.00 1.00 H new ATOM 0 HA ILE A 48 -13.328 6.844 2.521 1.00 1.00 H new ATOM 0 HB ILE A 48 -11.296 7.285 4.750 1.00 1.00 H new ATOM 0 HG12 ILE A 48 -14.194 6.317 4.823 1.00 1.00 H new ATOM 0 HG13 ILE A 48 -12.817 5.234 4.805 1.00 1.00 H new ATOM 0 HG21 ILE A 48 -12.940 8.890 5.680 1.00 1.00 H new ATOM 0 HG22 ILE A 48 -12.343 9.431 4.093 1.00 1.00 H new ATOM 0 HG23 ILE A 48 -13.955 8.690 4.231 1.00 1.00 H new ATOM 0 HD11 ILE A 48 -13.576 5.646 7.132 1.00 1.00 H new ATOM 0 HD12 ILE A 48 -11.937 6.295 6.888 1.00 1.00 H new ATOM 0 HD13 ILE A 48 -13.336 7.395 6.906 1.00 1.00 H new ATOM 1413 N MET B 209 11.732 -11.108 3.777 1.00 1.00 N ATOM 1414 CA MET B 209 10.489 -10.380 4.024 1.00 1.00 C ATOM 1415 C MET B 209 9.551 -11.209 4.897 1.00 1.00 C ATOM 1416 O MET B 209 9.177 -12.325 4.537 1.00 1.00 O ATOM 1417 CB MET B 209 9.803 -10.059 2.697 1.00 1.00 C ATOM 1418 CG MET B 209 10.656 -9.061 1.910 1.00 1.00 C ATOM 1419 SD MET B 209 9.822 -8.643 0.358 1.00 1.00 S ATOM 1420 CE MET B 209 8.830 -7.270 0.995 1.00 1.00 C ATOM 0 HA MET B 209 10.727 -9.452 4.544 1.00 1.00 H new ATOM 0 HB2 MET B 209 9.664 -10.971 2.117 1.00 1.00 H new ATOM 0 HB3 MET B 209 8.812 -9.643 2.879 1.00 1.00 H new ATOM 0 HG2 MET B 209 10.819 -8.160 2.502 1.00 1.00 H new ATOM 0 HG3 MET B 209 11.637 -9.489 1.704 1.00 1.00 H new ATOM 0 HE1 MET B 209 7.800 -7.377 0.655 1.00 1.00 H new ATOM 0 HE2 MET B 209 8.855 -7.278 2.085 1.00 1.00 H new ATOM 0 HE3 MET B 209 9.236 -6.327 0.629 1.00 1.00 H new ATOM 1430 N GLY B 210 9.181 -10.656 6.046 1.00 1.00 N ATOM 1431 CA GLY B 210 8.292 -11.350 6.966 1.00 1.00 C ATOM 1432 C GLY B 210 6.897 -11.476 6.373 1.00 1.00 C ATOM 1433 O GLY B 210 6.394 -10.549 5.740 1.00 1.00 O ATOM 0 H GLY B 210 9.482 -9.734 6.361 1.00 1.00 H new ATOM 0 HA2 GLY B 210 8.690 -12.341 7.186 1.00 1.00 H new ATOM 0 HA3 GLY B 210 8.243 -10.809 7.911 1.00 1.00 H new ATOM 1437 N ARG B 211 6.275 -12.631 6.584 1.00 1.00 N ATOM 1438 CA ARG B 211 4.928 -12.882 6.070 1.00 1.00 C ATOM 1439 C ARG B 211 3.889 -12.617 7.150 1.00 1.00 C ATOM 1440 O ARG B 211 4.046 -13.037 8.294 1.00 1.00 O ATOM 1441 CB ARG B 211 4.817 -14.330 5.591 1.00 1.00 C ATOM 1442 CG ARG B 211 5.083 -15.279 6.761 1.00 1.00 C ATOM 1443 CD ARG B 211 5.120 -16.716 6.249 1.00 1.00 C ATOM 1444 NE ARG B 211 5.376 -17.637 7.350 1.00 1.00 N ATOM 1445 CZ ARG B 211 5.394 -18.953 7.157 1.00 1.00 C ATOM 1446 NH1 ARG B 211 5.186 -19.441 5.966 1.00 1.00 N ATOM 1447 NH2 ARG B 211 5.621 -19.756 8.161 1.00 1.00 N ATOM 0 H ARG B 211 6.679 -13.409 7.106 1.00 1.00 H new ATOM 0 HA ARG B 211 4.743 -12.209 5.233 1.00 1.00 H new ATOM 0 HB2 ARG B 211 3.824 -14.513 5.180 1.00 1.00 H new ATOM 0 HB3 ARG B 211 5.533 -14.515 4.790 1.00 1.00 H new ATOM 0 HG2 ARG B 211 6.029 -15.027 7.240 1.00 1.00 H new ATOM 0 HG3 ARG B 211 4.305 -15.170 7.516 1.00 1.00 H new ATOM 0 HD2 ARG B 211 4.172 -16.964 5.771 1.00 1.00 H new ATOM 0 HD3 ARG B 211 5.896 -16.820 5.491 1.00 1.00 H new ATOM 0 HE ARG B 211 5.544 -17.266 8.285 1.00 1.00 H new ATOM 0 HH11 ARG B 211 5.009 -18.814 5.181 1.00 1.00 H new ATOM 0 HH12 ARG B 211 5.200 -20.450 5.819 1.00 1.00 H new ATOM 0 HH21 ARG B 211 5.784 -19.374 9.093 1.00 1.00 H new ATOM 0 HH22 ARG B 211 5.635 -20.765 8.014 1.00 1.00 H new ATOM 1461 N ILE B 212 2.830 -11.905 6.777 1.00 1.00 N ATOM 1462 CA ILE B 212 1.765 -11.567 7.727 1.00 1.00 C ATOM 1463 C ILE B 212 0.402 -11.854 7.124 1.00 1.00 C ATOM 1464 O ILE B 212 0.166 -11.600 5.944 1.00 1.00 O ATOM 1465 CB ILE B 212 1.852 -10.085 8.114 1.00 1.00 C ATOM 1466 CG1 ILE B 212 3.320 -9.685 8.373 1.00 1.00 C ATOM 1467 CG2 ILE B 212 1.023 -9.827 9.381 1.00 1.00 C ATOM 1468 CD1 ILE B 212 3.808 -10.278 9.701 1.00 1.00 C ATOM 0 H ILE B 212 2.683 -11.551 5.832 1.00 1.00 H new ATOM 0 HA ILE B 212 1.894 -12.181 8.618 1.00 1.00 H new ATOM 0 HB ILE B 212 1.458 -9.487 7.292 1.00 1.00 H new ATOM 0 HG12 ILE B 212 3.950 -10.038 7.556 1.00 1.00 H new ATOM 0 HG13 ILE B 212 3.409 -8.599 8.398 1.00 1.00 H new ATOM 0 HG21 ILE B 212 1.089 -8.773 9.651 1.00 1.00 H new ATOM 0 HG22 ILE B 212 -0.018 -10.089 9.194 1.00 1.00 H new ATOM 0 HG23 ILE B 212 1.409 -10.435 10.199 1.00 1.00 H new ATOM 0 HD11 ILE B 212 4.845 -9.987 9.870 1.00 1.00 H new ATOM 0 HD12 ILE B 212 3.189 -9.904 10.516 1.00 1.00 H new ATOM 0 HD13 ILE B 212 3.738 -11.365 9.662 1.00 1.00 H new ATOM 1480 N LEU B 213 -0.491 -12.390 7.946 1.00 1.00 N ATOM 1481 CA LEU B 213 -1.834 -12.717 7.493 1.00 1.00 C ATOM 1482 C LEU B 213 -2.763 -11.542 7.709 1.00 1.00 C ATOM 1483 O LEU B 213 -2.838 -10.990 8.807 1.00 1.00 O ATOM 1484 CB LEU B 213 -2.357 -13.936 8.260 1.00 1.00 C ATOM 1485 CG LEU B 213 -1.743 -15.216 7.672 1.00 1.00 C ATOM 1486 CD1 LEU B 213 -2.277 -15.461 6.241 1.00 1.00 C ATOM 1487 CD2 LEU B 213 -0.212 -15.072 7.640 1.00 1.00 C ATOM 0 H LEU B 213 -0.309 -12.606 8.926 1.00 1.00 H new ATOM 0 HA LEU B 213 -1.798 -12.946 6.428 1.00 1.00 H new ATOM 0 HB2 LEU B 213 -2.103 -13.850 9.316 1.00 1.00 H new ATOM 0 HB3 LEU B 213 -3.444 -13.979 8.196 1.00 1.00 H new ATOM 0 HG LEU B 213 -2.020 -16.066 8.295 1.00 1.00 H new ATOM 0 HD11 LEU B 213 -1.833 -16.371 5.838 1.00 1.00 H new ATOM 0 HD12 LEU B 213 -3.361 -15.569 6.271 1.00 1.00 H new ATOM 0 HD13 LEU B 213 -2.014 -14.616 5.605 1.00 1.00 H new ATOM 0 HD21 LEU B 213 0.230 -15.977 7.224 1.00 1.00 H new ATOM 0 HD22 LEU B 213 0.060 -14.217 7.021 1.00 1.00 H new ATOM 0 HD23 LEU B 213 0.160 -14.919 8.653 1.00 1.00 H new ATOM 1499 N LEU B 214 -3.472 -11.163 6.650 1.00 1.00 N ATOM 1500 CA LEU B 214 -4.407 -10.043 6.724 1.00 1.00 C ATOM 1501 C LEU B 214 -5.843 -10.531 6.569 1.00 1.00 C ATOM 1502 O LEU B 214 -6.174 -11.221 5.607 1.00 1.00 O ATOM 1503 CB LEU B 214 -4.090 -9.022 5.625 1.00 1.00 C ATOM 1504 CG LEU B 214 -5.136 -7.897 5.638 1.00 1.00 C ATOM 1505 CD1 LEU B 214 -5.194 -7.254 7.031 1.00 1.00 C ATOM 1506 CD2 LEU B 214 -4.753 -6.840 4.601 1.00 1.00 C ATOM 0 H LEU B 214 -3.418 -11.611 5.735 1.00 1.00 H new ATOM 0 HA LEU B 214 -4.300 -9.570 7.700 1.00 1.00 H new ATOM 0 HB2 LEU B 214 -3.094 -8.606 5.779 1.00 1.00 H new ATOM 0 HB3 LEU B 214 -4.083 -9.513 4.652 1.00 1.00 H new ATOM 0 HG LEU B 214 -6.115 -8.311 5.396 1.00 1.00 H new ATOM 0 HD11 LEU B 214 -5.938 -6.457 7.033 1.00 1.00 H new ATOM 0 HD12 LEU B 214 -5.468 -8.008 7.769 1.00 1.00 H new ATOM 0 HD13 LEU B 214 -4.217 -6.840 7.281 1.00 1.00 H new ATOM 0 HD21 LEU B 214 -5.493 -6.040 4.607 1.00 1.00 H new ATOM 0 HD22 LEU B 214 -3.773 -6.430 4.844 1.00 1.00 H new ATOM 0 HD23 LEU B 214 -4.720 -7.296 3.612 1.00 1.00 H new ATOM 1518 N ASP B 215 -6.695 -10.157 7.522 1.00 1.00 N ATOM 1519 CA ASP B 215 -8.103 -10.549 7.483 1.00 1.00 C ATOM 1520 C ASP B 215 -8.960 -9.406 6.950 1.00 1.00 C ATOM 1521 O ASP B 215 -8.821 -8.261 7.377 1.00 1.00 O ATOM 1522 CB ASP B 215 -8.574 -10.931 8.883 1.00 1.00 C ATOM 1523 CG ASP B 215 -8.393 -9.754 9.837 1.00 1.00 C ATOM 1524 OD1 ASP B 215 -8.858 -9.853 10.961 1.00 1.00 O ATOM 1525 OD2 ASP B 215 -7.790 -8.773 9.433 1.00 1.00 O ATOM 0 H ASP B 215 -6.437 -9.586 8.327 1.00 1.00 H new ATOM 0 HA ASP B 215 -8.206 -11.407 6.818 1.00 1.00 H new ATOM 0 HB2 ASP B 215 -9.622 -11.228 8.854 1.00 1.00 H new ATOM 0 HB3 ASP B 215 -8.009 -11.791 9.243 1.00 1.00 H new ATOM 1531 N LEU B 216 -9.847 -9.724 6.009 1.00 1.00 N ATOM 1532 CA LEU B 216 -10.728 -8.717 5.412 1.00 1.00 C ATOM 1533 C LEU B 216 -12.154 -9.239 5.328 1.00 1.00 C ATOM 1534 O LEU B 216 -12.490 -10.245 5.949 1.00 1.00 O ATOM 1535 CB LEU B 216 -10.222 -8.363 4.012 1.00 1.00 C ATOM 1536 CG LEU B 216 -8.947 -7.503 4.122 1.00 1.00 C ATOM 1537 CD1 LEU B 216 -8.080 -7.708 2.878 1.00 1.00 C ATOM 1538 CD2 LEU B 216 -9.330 -6.019 4.229 1.00 1.00 C ATOM 0 H LEU B 216 -9.976 -10.667 5.643 1.00 1.00 H new ATOM 0 HA LEU B 216 -10.722 -7.826 6.040 1.00 1.00 H new ATOM 0 HB2 LEU B 216 -10.011 -9.273 3.450 1.00 1.00 H new ATOM 0 HB3 LEU B 216 -10.992 -7.821 3.463 1.00 1.00 H new ATOM 0 HG LEU B 216 -8.391 -7.802 5.011 1.00 1.00 H new ATOM 0 HD11 LEU B 216 -7.179 -7.099 2.958 1.00 1.00 H new ATOM 0 HD12 LEU B 216 -7.802 -8.759 2.798 1.00 1.00 H new ATOM 0 HD13 LEU B 216 -8.640 -7.412 1.991 1.00 1.00 H new ATOM 0 HD21 LEU B 216 -8.426 -5.415 4.307 1.00 1.00 H new ATOM 0 HD22 LEU B 216 -9.890 -5.723 3.342 1.00 1.00 H new ATOM 0 HD23 LEU B 216 -9.946 -5.865 5.115 1.00 1.00 H new ATOM 1550 N SER B 217 -12.992 -8.550 4.555 1.00 1.00 N ATOM 1551 CA SER B 217 -14.383 -8.948 4.389 1.00 1.00 C ATOM 1552 C SER B 217 -14.769 -8.925 2.914 1.00 1.00 C ATOM 1553 O SER B 217 -14.190 -8.180 2.121 1.00 1.00 O ATOM 1554 CB SER B 217 -15.279 -7.999 5.182 1.00 1.00 C ATOM 1555 OG SER B 217 -15.345 -8.434 6.532 1.00 1.00 O ATOM 0 H SER B 217 -12.729 -7.713 4.035 1.00 1.00 H new ATOM 0 HA SER B 217 -14.512 -9.964 4.762 1.00 1.00 H new ATOM 0 HB2 SER B 217 -14.885 -6.984 5.134 1.00 1.00 H new ATOM 0 HB3 SER B 217 -16.278 -7.975 4.747 1.00 1.00 H new ATOM 0 HG SER B 217 -15.918 -7.826 7.044 1.00 1.00 H new ATOM 1561 N ASN B 218 -15.751 -9.744 2.557 1.00 1.00 N ATOM 1562 CA ASN B 218 -16.206 -9.817 1.176 1.00 1.00 C ATOM 1563 C ASN B 218 -16.625 -8.438 0.683 1.00 1.00 C ATOM 1564 O ASN B 218 -16.355 -8.071 -0.461 1.00 1.00 O ATOM 1565 CB ASN B 218 -17.394 -10.778 1.072 1.00 1.00 C ATOM 1566 CG ASN B 218 -17.003 -12.154 1.596 1.00 1.00 C ATOM 1567 OD1 ASN B 218 -15.802 -12.612 1.368 1.00 1.00 O flip ATOM 1568 ND2 ASN B 218 -17.811 -12.833 2.228 1.00 1.00 N flip ATOM 0 H ASN B 218 -16.244 -10.363 3.201 1.00 1.00 H new ATOM 0 HA ASN B 218 -15.386 -10.181 0.557 1.00 1.00 H new ATOM 0 HB2 ASN B 218 -18.237 -10.389 1.643 1.00 1.00 H new ATOM 0 HB3 ASN B 218 -17.720 -10.855 0.035 1.00 1.00 H new ATOM 0 HD21 ASN B 218 -18.749 -12.475 2.406 1.00 1.00 H new ATOM 0 HD22 ASN B 218 -17.543 -13.754 2.574 1.00 1.00 H new ATOM 1575 N GLU B 219 -17.279 -7.676 1.550 1.00 1.00 N ATOM 1576 CA GLU B 219 -17.724 -6.337 1.187 1.00 1.00 C ATOM 1577 C GLU B 219 -16.533 -5.438 0.870 1.00 1.00 C ATOM 1578 O GLU B 219 -16.578 -4.639 -0.062 1.00 1.00 O ATOM 1579 CB GLU B 219 -18.530 -5.724 2.335 1.00 1.00 C ATOM 1580 CG GLU B 219 -19.841 -6.492 2.507 1.00 1.00 C ATOM 1581 CD GLU B 219 -20.647 -5.899 3.658 1.00 1.00 C ATOM 1582 OE1 GLU B 219 -21.689 -6.450 3.971 1.00 1.00 O ATOM 1583 OE2 GLU B 219 -20.212 -4.900 4.207 1.00 1.00 O ATOM 0 H GLU B 219 -17.512 -7.959 2.502 1.00 1.00 H new ATOM 0 HA GLU B 219 -18.352 -6.416 0.299 1.00 1.00 H new ATOM 0 HB2 GLU B 219 -17.952 -5.759 3.258 1.00 1.00 H new ATOM 0 HB3 GLU B 219 -18.736 -4.674 2.128 1.00 1.00 H new ATOM 0 HG2 GLU B 219 -20.421 -6.448 1.585 1.00 1.00 H new ATOM 0 HG3 GLU B 219 -19.633 -7.544 2.702 1.00 1.00 H new ATOM 1591 N VAL B 220 -15.465 -5.580 1.645 1.00 1.00 N ATOM 1592 CA VAL B 220 -14.262 -4.778 1.435 1.00 1.00 C ATOM 1593 C VAL B 220 -13.558 -5.184 0.145 1.00 1.00 C ATOM 1594 O VAL B 220 -13.107 -4.336 -0.623 1.00 1.00 O ATOM 1595 CB VAL B 220 -13.308 -4.954 2.618 1.00 1.00 C ATOM 1596 CG1 VAL B 220 -12.022 -4.166 2.363 1.00 1.00 C ATOM 1597 CG2 VAL B 220 -13.978 -4.439 3.894 1.00 1.00 C ATOM 0 H VAL B 220 -15.405 -6.239 2.421 1.00 1.00 H new ATOM 0 HA VAL B 220 -14.557 -3.732 1.355 1.00 1.00 H new ATOM 0 HB VAL B 220 -13.067 -6.011 2.734 1.00 1.00 H new ATOM 0 HG11 VAL B 220 -11.344 -4.293 3.207 1.00 1.00 H new ATOM 0 HG12 VAL B 220 -11.544 -4.534 1.455 1.00 1.00 H new ATOM 0 HG13 VAL B 220 -12.260 -3.109 2.245 1.00 1.00 H new ATOM 0 HG21 VAL B 220 -13.299 -4.564 4.737 1.00 1.00 H new ATOM 0 HG22 VAL B 220 -14.220 -3.383 3.777 1.00 1.00 H new ATOM 0 HG23 VAL B 220 -14.893 -5.003 4.078 1.00 1.00 H new ATOM 1607 N ILE B 221 -13.466 -6.491 -0.091 1.00 1.00 N ATOM 1608 CA ILE B 221 -12.812 -6.996 -1.292 1.00 1.00 C ATOM 1609 C ILE B 221 -13.415 -6.337 -2.529 1.00 1.00 C ATOM 1610 O ILE B 221 -12.702 -5.999 -3.473 1.00 1.00 O ATOM 1611 CB ILE B 221 -12.972 -8.518 -1.378 1.00 1.00 C ATOM 1612 CG1 ILE B 221 -12.154 -9.180 -0.260 1.00 1.00 C ATOM 1613 CG2 ILE B 221 -12.476 -9.017 -2.739 1.00 1.00 C ATOM 1614 CD1 ILE B 221 -12.415 -10.693 -0.244 1.00 1.00 C ATOM 0 H ILE B 221 -13.833 -7.213 0.529 1.00 1.00 H new ATOM 0 HA ILE B 221 -11.750 -6.756 -1.244 1.00 1.00 H new ATOM 0 HB ILE B 221 -14.025 -8.777 -1.264 1.00 1.00 H new ATOM 0 HG12 ILE B 221 -11.092 -8.987 -0.412 1.00 1.00 H new ATOM 0 HG13 ILE B 221 -12.422 -8.746 0.703 1.00 1.00 H new ATOM 0 HG21 ILE B 221 -12.592 -10.099 -2.794 1.00 1.00 H new ATOM 0 HG22 ILE B 221 -13.058 -8.549 -3.533 1.00 1.00 H new ATOM 0 HG23 ILE B 221 -11.424 -8.758 -2.860 1.00 1.00 H new ATOM 0 HD11 ILE B 221 -11.831 -11.155 0.552 1.00 1.00 H new ATOM 0 HD12 ILE B 221 -13.475 -10.878 -0.070 1.00 1.00 H new ATOM 0 HD13 ILE B 221 -12.125 -11.122 -1.203 1.00 1.00 H new ATOM 1626 N LYS B 222 -14.729 -6.148 -2.514 1.00 1.00 N ATOM 1627 CA LYS B 222 -15.410 -5.508 -3.631 1.00 1.00 C ATOM 1628 C LYS B 222 -14.958 -4.053 -3.760 1.00 1.00 C ATOM 1629 O LYS B 222 -14.771 -3.549 -4.866 1.00 1.00 O ATOM 1630 CB LYS B 222 -16.924 -5.570 -3.428 1.00 1.00 C ATOM 1631 CG LYS B 222 -17.393 -7.021 -3.551 1.00 1.00 C ATOM 1632 CD LYS B 222 -18.904 -7.092 -3.318 1.00 1.00 C ATOM 1633 CE LYS B 222 -19.375 -8.542 -3.448 1.00 1.00 C ATOM 1634 NZ LYS B 222 -20.845 -8.610 -3.208 1.00 1.00 N ATOM 0 H LYS B 222 -15.340 -6.427 -1.746 1.00 1.00 H new ATOM 0 HA LYS B 222 -15.155 -6.039 -4.548 1.00 1.00 H new ATOM 0 HB2 LYS B 222 -17.187 -5.173 -2.448 1.00 1.00 H new ATOM 0 HB3 LYS B 222 -17.427 -4.949 -4.169 1.00 1.00 H new ATOM 0 HG2 LYS B 222 -17.148 -7.411 -4.539 1.00 1.00 H new ATOM 0 HG3 LYS B 222 -16.873 -7.645 -2.824 1.00 1.00 H new ATOM 0 HD2 LYS B 222 -19.148 -6.707 -2.328 1.00 1.00 H new ATOM 0 HD3 LYS B 222 -19.424 -6.464 -4.041 1.00 1.00 H new ATOM 0 HE2 LYS B 222 -19.140 -8.924 -4.441 1.00 1.00 H new ATOM 0 HE3 LYS B 222 -18.849 -9.172 -2.731 1.00 1.00 H new ATOM 0 HZ1 LYS B 222 -21.166 -9.595 -3.296 1.00 1.00 H new ATOM 0 HZ2 LYS B 222 -21.057 -8.261 -2.252 1.00 1.00 H new ATOM 0 HZ3 LYS B 222 -21.339 -8.021 -3.909 1.00 1.00 H new ATOM 1648 N GLN B 223 -14.788 -3.390 -2.619 1.00 1.00 N ATOM 1649 CA GLN B 223 -14.354 -1.999 -2.614 1.00 1.00 C ATOM 1650 C GLN B 223 -12.931 -1.893 -3.154 1.00 1.00 C ATOM 1651 O GLN B 223 -12.649 -1.073 -4.026 1.00 1.00 O ATOM 1652 CB GLN B 223 -14.404 -1.445 -1.189 1.00 1.00 C ATOM 1653 CG GLN B 223 -15.844 -1.446 -0.692 1.00 1.00 C ATOM 1654 CD GLN B 223 -15.903 -0.974 0.756 1.00 1.00 C ATOM 1655 OE1 GLN B 223 -14.894 -0.541 1.310 1.00 1.00 O ATOM 1656 NE2 GLN B 223 -17.034 -1.029 1.405 1.00 1.00 N ATOM 0 H GLN B 223 -14.943 -3.791 -1.694 1.00 1.00 H new ATOM 0 HA GLN B 223 -15.022 -1.419 -3.251 1.00 1.00 H new ATOM 0 HB2 GLN B 223 -13.781 -2.050 -0.531 1.00 1.00 H new ATOM 0 HB3 GLN B 223 -14.002 -0.432 -1.167 1.00 1.00 H new ATOM 0 HG2 GLN B 223 -16.453 -0.795 -1.319 1.00 1.00 H new ATOM 0 HG3 GLN B 223 -16.263 -2.449 -0.772 1.00 1.00 H new ATOM 0 HE21 GLN B 223 -17.870 -1.388 0.944 1.00 1.00 H new ATOM 0 HE22 GLN B 223 -17.082 -0.713 2.373 1.00 1.00 H new ATOM 1665 N LEU B 224 -12.040 -2.731 -2.632 1.00 1.00 N ATOM 1666 CA LEU B 224 -10.649 -2.721 -3.068 1.00 1.00 C ATOM 1667 C LEU B 224 -10.548 -3.041 -4.552 1.00 1.00 C ATOM 1668 O LEU B 224 -9.801 -2.395 -5.282 1.00 1.00 O ATOM 1669 CB LEU B 224 -9.850 -3.756 -2.268 1.00 1.00 C ATOM 1670 CG LEU B 224 -9.667 -3.273 -0.823 1.00 1.00 C ATOM 1671 CD1 LEU B 224 -9.213 -4.445 0.055 1.00 1.00 C ATOM 1672 CD2 LEU B 224 -8.607 -2.154 -0.766 1.00 1.00 C ATOM 0 H LEU B 224 -12.255 -3.421 -1.912 1.00 1.00 H new ATOM 0 HA LEU B 224 -10.240 -1.725 -2.896 1.00 1.00 H new ATOM 0 HB2 LEU B 224 -10.369 -4.715 -2.277 1.00 1.00 H new ATOM 0 HB3 LEU B 224 -8.877 -3.916 -2.733 1.00 1.00 H new ATOM 0 HG LEU B 224 -10.617 -2.884 -0.458 1.00 1.00 H new ATOM 0 HD11 LEU B 224 -9.083 -4.102 1.081 1.00 1.00 H new ATOM 0 HD12 LEU B 224 -9.966 -5.233 0.028 1.00 1.00 H new ATOM 0 HD13 LEU B 224 -8.267 -4.835 -0.320 1.00 1.00 H new ATOM 0 HD21 LEU B 224 -8.486 -1.820 0.264 1.00 1.00 H new ATOM 0 HD22 LEU B 224 -7.656 -2.535 -1.138 1.00 1.00 H new ATOM 0 HD23 LEU B 224 -8.929 -1.316 -1.384 1.00 1.00 H new ATOM 1684 N ASP B 225 -11.315 -4.026 -4.996 1.00 1.00 N ATOM 1685 CA ASP B 225 -11.294 -4.418 -6.401 1.00 1.00 C ATOM 1686 C ASP B 225 -11.479 -3.196 -7.293 1.00 1.00 C ATOM 1687 O ASP B 225 -10.791 -3.047 -8.302 1.00 1.00 O ATOM 1688 CB ASP B 225 -12.420 -5.420 -6.667 1.00 1.00 C ATOM 1689 CG ASP B 225 -12.398 -5.854 -8.127 1.00 1.00 C ATOM 1690 OD1 ASP B 225 -11.360 -6.313 -8.573 1.00 1.00 O ATOM 1691 OD2 ASP B 225 -13.420 -5.720 -8.781 1.00 1.00 O ATOM 0 H ASP B 225 -11.954 -4.565 -4.412 1.00 1.00 H new ATOM 0 HA ASP B 225 -10.332 -4.877 -6.626 1.00 1.00 H new ATOM 0 HB2 ASP B 225 -12.305 -6.289 -6.019 1.00 1.00 H new ATOM 0 HB3 ASP B 225 -13.383 -4.969 -6.428 1.00 1.00 H new ATOM 1697 N ASP B 226 -12.402 -2.322 -6.914 1.00 1.00 N ATOM 1698 CA ASP B 226 -12.656 -1.114 -7.693 1.00 1.00 C ATOM 1699 C ASP B 226 -11.382 -0.276 -7.790 1.00 1.00 C ATOM 1700 O ASP B 226 -11.059 0.257 -8.852 1.00 1.00 O ATOM 1701 CB ASP B 226 -13.766 -0.293 -7.033 1.00 1.00 C ATOM 1702 CG ASP B 226 -14.139 0.890 -7.920 1.00 1.00 C ATOM 1703 OD1 ASP B 226 -13.444 1.116 -8.897 1.00 1.00 O ATOM 1704 OD2 ASP B 226 -15.119 1.551 -7.613 1.00 1.00 O ATOM 0 H ASP B 226 -12.982 -2.423 -6.081 1.00 1.00 H new ATOM 0 HA ASP B 226 -12.970 -1.400 -8.697 1.00 1.00 H new ATOM 0 HB2 ASP B 226 -14.641 -0.920 -6.863 1.00 1.00 H new ATOM 0 HB3 ASP B 226 -13.435 0.064 -6.058 1.00 1.00 H new ATOM 1710 N LEU B 227 -10.668 -0.165 -6.676 1.00 1.00 N ATOM 1711 CA LEU B 227 -9.432 0.601 -6.644 1.00 1.00 C ATOM 1712 C LEU B 227 -8.364 -0.077 -7.497 1.00 1.00 C ATOM 1713 O LEU B 227 -7.540 0.592 -8.114 1.00 1.00 O ATOM 1714 CB LEU B 227 -8.930 0.746 -5.200 1.00 1.00 C ATOM 1715 CG LEU B 227 -9.683 1.885 -4.497 1.00 1.00 C ATOM 1716 CD1 LEU B 227 -11.093 1.421 -4.129 1.00 1.00 C ATOM 1717 CD2 LEU B 227 -8.931 2.286 -3.229 1.00 1.00 C ATOM 0 H LEU B 227 -10.924 -0.595 -5.787 1.00 1.00 H new ATOM 0 HA LEU B 227 -9.632 1.592 -7.050 1.00 1.00 H new ATOM 0 HB2 LEU B 227 -9.078 -0.188 -4.659 1.00 1.00 H new ATOM 0 HB3 LEU B 227 -7.859 0.950 -5.197 1.00 1.00 H new ATOM 0 HG LEU B 227 -9.749 2.742 -5.168 1.00 1.00 H new ATOM 0 HD11 LEU B 227 -11.624 2.232 -3.630 1.00 1.00 H new ATOM 0 HD12 LEU B 227 -11.630 1.137 -5.034 1.00 1.00 H new ATOM 0 HD13 LEU B 227 -11.031 0.563 -3.460 1.00 1.00 H new ATOM 0 HD21 LEU B 227 -9.465 3.094 -2.730 1.00 1.00 H new ATOM 0 HD22 LEU B 227 -8.863 1.428 -2.560 1.00 1.00 H new ATOM 0 HD23 LEU B 227 -7.928 2.622 -3.492 1.00 1.00 H new ATOM 1729 N GLU B 228 -8.381 -1.403 -7.514 1.00 1.00 N ATOM 1730 CA GLU B 228 -7.405 -2.158 -8.283 1.00 1.00 C ATOM 1731 C GLU B 228 -7.626 -1.969 -9.777 1.00 1.00 C ATOM 1732 O GLU B 228 -6.674 -1.938 -10.551 1.00 1.00 O ATOM 1733 CB GLU B 228 -7.509 -3.650 -7.923 1.00 1.00 C ATOM 1734 CG GLU B 228 -6.710 -3.952 -6.650 1.00 1.00 C ATOM 1735 CD GLU B 228 -7.499 -3.509 -5.428 1.00 1.00 C ATOM 1736 OE1 GLU B 228 -7.336 -2.373 -5.018 1.00 1.00 O ATOM 1737 OE2 GLU B 228 -8.268 -4.313 -4.927 1.00 1.00 O ATOM 0 H GLU B 228 -9.057 -1.974 -7.006 1.00 1.00 H new ATOM 0 HA GLU B 228 -6.409 -1.790 -8.037 1.00 1.00 H new ATOM 0 HB2 GLU B 228 -8.554 -3.923 -7.777 1.00 1.00 H new ATOM 0 HB3 GLU B 228 -7.134 -4.256 -8.747 1.00 1.00 H new ATOM 0 HG2 GLU B 228 -6.496 -5.019 -6.589 1.00 1.00 H new ATOM 0 HG3 GLU B 228 -5.750 -3.436 -6.681 1.00 1.00 H new ATOM 1745 N VAL B 229 -8.883 -1.867 -10.179 1.00 1.00 N ATOM 1746 CA VAL B 229 -9.199 -1.702 -11.592 1.00 1.00 C ATOM 1747 C VAL B 229 -8.667 -0.373 -12.124 1.00 1.00 C ATOM 1748 O VAL B 229 -7.972 -0.332 -13.140 1.00 1.00 O ATOM 1749 CB VAL B 229 -10.718 -1.762 -11.790 1.00 1.00 C ATOM 1750 CG1 VAL B 229 -11.069 -1.386 -13.234 1.00 1.00 C ATOM 1751 CG2 VAL B 229 -11.220 -3.177 -11.494 1.00 1.00 C ATOM 0 H VAL B 229 -9.692 -1.895 -9.558 1.00 1.00 H new ATOM 0 HA VAL B 229 -8.720 -2.510 -12.146 1.00 1.00 H new ATOM 0 HB VAL B 229 -11.195 -1.058 -11.109 1.00 1.00 H new ATOM 0 HG11 VAL B 229 -12.150 -1.430 -13.369 1.00 1.00 H new ATOM 0 HG12 VAL B 229 -10.718 -0.375 -13.442 1.00 1.00 H new ATOM 0 HG13 VAL B 229 -10.589 -2.085 -13.919 1.00 1.00 H new ATOM 0 HG21 VAL B 229 -12.300 -3.217 -11.635 1.00 1.00 H new ATOM 0 HG22 VAL B 229 -10.739 -3.883 -12.171 1.00 1.00 H new ATOM 0 HG23 VAL B 229 -10.979 -3.441 -10.464 1.00 1.00 H new ATOM 1761 N GLN B 230 -9.001 0.708 -11.432 1.00 1.00 N ATOM 1762 CA GLN B 230 -8.559 2.033 -11.848 1.00 1.00 C ATOM 1763 C GLN B 230 -7.042 2.125 -11.809 1.00 1.00 C ATOM 1764 O GLN B 230 -6.424 2.710 -12.697 1.00 1.00 O ATOM 1765 CB GLN B 230 -9.170 3.102 -10.939 1.00 1.00 C ATOM 1766 CG GLN B 230 -8.895 2.744 -9.483 1.00 1.00 C ATOM 1767 CD GLN B 230 -9.617 3.717 -8.556 1.00 1.00 C ATOM 1768 OE1 GLN B 230 -8.999 4.627 -8.006 1.00 1.00 O ATOM 1769 NE2 GLN B 230 -10.898 3.576 -8.347 1.00 1.00 N ATOM 0 H GLN B 230 -9.572 0.695 -10.587 1.00 1.00 H new ATOM 0 HA GLN B 230 -8.893 2.203 -12.872 1.00 1.00 H new ATOM 0 HB2 GLN B 230 -8.746 4.079 -11.171 1.00 1.00 H new ATOM 0 HB3 GLN B 230 -10.244 3.172 -11.112 1.00 1.00 H new ATOM 0 HG2 GLN B 230 -9.227 1.725 -9.282 1.00 1.00 H new ATOM 0 HG3 GLN B 230 -7.823 2.774 -9.290 1.00 1.00 H new ATOM 0 HE21 GLN B 230 -11.409 2.821 -8.804 1.00 1.00 H new ATOM 0 HE22 GLN B 230 -11.388 4.221 -7.727 1.00 1.00 H new ATOM 1778 N ARG B 231 -6.445 1.548 -10.772 1.00 1.00 N ATOM 1779 CA ARG B 231 -4.992 1.574 -10.625 1.00 1.00 C ATOM 1780 C ARG B 231 -4.352 0.432 -11.400 1.00 1.00 C ATOM 1781 O ARG B 231 -3.152 0.453 -11.677 1.00 1.00 O ATOM 1782 CB ARG B 231 -4.626 1.467 -9.137 1.00 1.00 C ATOM 1783 CG ARG B 231 -4.773 2.839 -8.455 1.00 1.00 C ATOM 1784 CD ARG B 231 -3.499 3.668 -8.663 1.00 1.00 C ATOM 1785 NE ARG B 231 -3.590 4.915 -7.917 1.00 1.00 N ATOM 1786 CZ ARG B 231 -4.156 5.993 -8.447 1.00 1.00 C ATOM 1787 NH1 ARG B 231 -4.653 5.944 -9.654 1.00 1.00 N ATOM 1788 NH2 ARG B 231 -4.217 7.099 -7.760 1.00 1.00 N ATOM 0 H ARG B 231 -6.939 1.060 -10.025 1.00 1.00 H new ATOM 0 HA ARG B 231 -4.615 2.514 -11.027 1.00 1.00 H new ATOM 0 HB2 ARG B 231 -5.272 0.738 -8.647 1.00 1.00 H new ATOM 0 HB3 ARG B 231 -3.602 1.108 -9.031 1.00 1.00 H new ATOM 0 HG2 ARG B 231 -5.632 3.368 -8.866 1.00 1.00 H new ATOM 0 HG3 ARG B 231 -4.960 2.706 -7.389 1.00 1.00 H new ATOM 0 HD2 ARG B 231 -2.628 3.101 -8.334 1.00 1.00 H new ATOM 0 HD3 ARG B 231 -3.361 3.878 -9.724 1.00 1.00 H new ATOM 0 HE ARG B 231 -3.212 4.961 -6.971 1.00 1.00 H new ATOM 0 HH11 ARG B 231 -4.606 5.077 -10.190 1.00 1.00 H new ATOM 0 HH12 ARG B 231 -5.088 6.772 -10.061 1.00 1.00 H new ATOM 0 HH21 ARG B 231 -3.830 7.136 -6.817 1.00 1.00 H new ATOM 0 HH22 ARG B 231 -4.651 7.928 -8.166 1.00 1.00 H new ATOM 1802 N ASN B 232 -5.156 -0.566 -11.743 1.00 1.00 N ATOM 1803 CA ASN B 232 -4.655 -1.714 -12.483 1.00 1.00 C ATOM 1804 C ASN B 232 -3.432 -2.291 -11.791 1.00 1.00 C ATOM 1805 O ASN B 232 -2.422 -2.582 -12.435 1.00 1.00 O ATOM 1806 CB ASN B 232 -4.294 -1.305 -13.909 1.00 1.00 C ATOM 1807 CG ASN B 232 -3.997 -2.544 -14.745 1.00 1.00 C ATOM 1808 OD1 ASN B 232 -3.666 -3.598 -14.202 1.00 1.00 O ATOM 1809 ND2 ASN B 232 -4.098 -2.481 -16.044 1.00 1.00 N ATOM 0 H ASN B 232 -6.151 -0.603 -11.522 1.00 1.00 H new ATOM 0 HA ASN B 232 -5.437 -2.473 -12.517 1.00 1.00 H new ATOM 0 HB2 ASN B 232 -5.115 -0.744 -14.354 1.00 1.00 H new ATOM 0 HB3 ASN B 232 -3.426 -0.646 -13.899 1.00 1.00 H new ATOM 0 HD21 ASN B 232 -3.903 -3.306 -16.611 1.00 1.00 H new ATOM 0 HD22 ASN B 232 -4.372 -1.607 -16.492 1.00 1.00 H new ATOM 1816 N LEU B 233 -3.521 -2.449 -10.473 1.00 1.00 N ATOM 1817 CA LEU B 233 -2.399 -2.987 -9.701 1.00 1.00 C ATOM 1818 C LEU B 233 -2.889 -3.969 -8.641 1.00 1.00 C ATOM 1819 O LEU B 233 -4.021 -3.870 -8.170 1.00 1.00 O ATOM 1820 CB LEU B 233 -1.639 -1.835 -9.027 1.00 1.00 C ATOM 1821 CG LEU B 233 -0.712 -1.152 -10.049 1.00 1.00 C ATOM 1822 CD1 LEU B 233 -0.424 0.282 -9.604 1.00 1.00 C ATOM 1823 CD2 LEU B 233 0.614 -1.923 -10.167 1.00 1.00 C ATOM 0 H LEU B 233 -4.346 -2.216 -9.921 1.00 1.00 H new ATOM 0 HA LEU B 233 -1.734 -3.519 -10.382 1.00 1.00 H new ATOM 0 HB2 LEU B 233 -2.345 -1.110 -8.621 1.00 1.00 H new ATOM 0 HB3 LEU B 233 -1.054 -2.214 -8.189 1.00 1.00 H new ATOM 0 HG LEU B 233 -1.207 -1.144 -11.020 1.00 1.00 H new ATOM 0 HD11 LEU B 233 0.232 0.763 -10.329 1.00 1.00 H new ATOM 0 HD12 LEU B 233 -1.360 0.837 -9.537 1.00 1.00 H new ATOM 0 HD13 LEU B 233 0.061 0.270 -8.628 1.00 1.00 H new ATOM 0 HD21 LEU B 233 1.259 -1.428 -10.893 1.00 1.00 H new ATOM 0 HD22 LEU B 233 1.110 -1.945 -9.197 1.00 1.00 H new ATOM 0 HD23 LEU B 233 0.414 -2.943 -10.495 1.00 1.00 H new ATOM 1835 N PRO B 234 -2.054 -4.903 -8.257 1.00 1.00 N ATOM 1836 CA PRO B 234 -2.406 -5.922 -7.224 1.00 1.00 C ATOM 1837 C PRO B 234 -2.680 -5.285 -5.862 1.00 1.00 C ATOM 1838 O PRO B 234 -2.155 -4.218 -5.547 1.00 1.00 O ATOM 1839 CB PRO B 234 -1.168 -6.837 -7.169 1.00 1.00 C ATOM 1840 CG PRO B 234 -0.048 -6.027 -7.745 1.00 1.00 C ATOM 1841 CD PRO B 234 -0.685 -5.102 -8.772 1.00 1.00 C ATOM 0 HA PRO B 234 -3.321 -6.459 -7.474 1.00 1.00 H new ATOM 0 HB2 PRO B 234 -0.948 -7.139 -6.145 1.00 1.00 H new ATOM 0 HB3 PRO B 234 -1.328 -7.750 -7.743 1.00 1.00 H new ATOM 0 HG2 PRO B 234 0.461 -5.456 -6.968 1.00 1.00 H new ATOM 0 HG3 PRO B 234 0.700 -6.670 -8.209 1.00 1.00 H new ATOM 0 HD2 PRO B 234 -0.145 -4.158 -8.851 1.00 1.00 H new ATOM 0 HD3 PRO B 234 -0.691 -5.550 -9.766 1.00 1.00 H new ATOM 1849 N ARG B 235 -3.502 -5.955 -5.060 1.00 1.00 N ATOM 1850 CA ARG B 235 -3.831 -5.452 -3.734 1.00 1.00 C ATOM 1851 C ARG B 235 -2.579 -5.361 -2.871 1.00 1.00 C ATOM 1852 O ARG B 235 -2.364 -4.363 -2.182 1.00 1.00 O ATOM 1853 CB ARG B 235 -4.842 -6.383 -3.064 1.00 1.00 C ATOM 1854 CG ARG B 235 -6.202 -6.238 -3.745 1.00 1.00 C ATOM 1855 CD ARG B 235 -7.195 -7.221 -3.121 1.00 1.00 C ATOM 1856 NE ARG B 235 -6.824 -8.591 -3.457 1.00 1.00 N ATOM 1857 CZ ARG B 235 -7.448 -9.627 -2.905 1.00 1.00 C ATOM 1858 NH1 ARG B 235 -8.410 -9.427 -2.047 1.00 1.00 N ATOM 1859 NH2 ARG B 235 -7.097 -10.843 -3.220 1.00 1.00 N ATOM 0 H ARG B 235 -3.948 -6.839 -5.304 1.00 1.00 H new ATOM 0 HA ARG B 235 -4.261 -4.456 -3.839 1.00 1.00 H new ATOM 0 HB2 ARG B 235 -4.500 -7.416 -3.129 1.00 1.00 H new ATOM 0 HB3 ARG B 235 -4.927 -6.142 -2.004 1.00 1.00 H new ATOM 0 HG2 ARG B 235 -6.568 -5.217 -3.636 1.00 1.00 H new ATOM 0 HG3 ARG B 235 -6.107 -6.430 -4.814 1.00 1.00 H new ATOM 0 HD2 ARG B 235 -7.211 -7.096 -2.038 1.00 1.00 H new ATOM 0 HD3 ARG B 235 -8.202 -7.010 -3.481 1.00 1.00 H new ATOM 0 HE ARG B 235 -6.073 -8.757 -4.127 1.00 1.00 H new ATOM 0 HH11 ARG B 235 -8.683 -8.476 -1.800 1.00 1.00 H new ATOM 0 HH12 ARG B 235 -8.889 -10.222 -1.623 1.00 1.00 H new ATOM 0 HH21 ARG B 235 -6.344 -10.999 -3.890 1.00 1.00 H new ATOM 0 HH22 ARG B 235 -7.576 -11.638 -2.796 1.00 1.00 H new ATOM 1873 N ALA B 236 -1.753 -6.405 -2.907 1.00 1.00 N ATOM 1874 CA ALA B 236 -0.535 -6.425 -2.108 1.00 1.00 C ATOM 1875 C ALA B 236 0.216 -5.109 -2.259 1.00 1.00 C ATOM 1876 O ALA B 236 0.710 -4.552 -1.278 1.00 1.00 O ATOM 1877 CB ALA B 236 0.362 -7.578 -2.567 1.00 1.00 C ATOM 0 H ALA B 236 -1.904 -7.238 -3.475 1.00 1.00 H new ATOM 0 HA ALA B 236 -0.804 -6.563 -1.061 1.00 1.00 H new ATOM 0 HB1 ALA B 236 1.273 -7.591 -1.968 1.00 1.00 H new ATOM 0 HB2 ALA B 236 -0.168 -8.523 -2.443 1.00 1.00 H new ATOM 0 HB3 ALA B 236 0.620 -7.442 -3.617 1.00 1.00 H new ATOM 1883 N ASP B 237 0.293 -4.614 -3.486 1.00 1.00 N ATOM 1884 CA ASP B 237 0.984 -3.353 -3.742 1.00 1.00 C ATOM 1885 C ASP B 237 0.250 -2.195 -3.069 1.00 1.00 C ATOM 1886 O ASP B 237 0.871 -1.284 -2.521 1.00 1.00 O ATOM 1887 CB ASP B 237 1.071 -3.108 -5.254 1.00 1.00 C ATOM 1888 CG ASP B 237 2.230 -3.903 -5.855 1.00 1.00 C ATOM 1889 OD1 ASP B 237 2.964 -4.517 -5.096 1.00 1.00 O ATOM 1890 OD2 ASP B 237 2.367 -3.885 -7.067 1.00 1.00 O ATOM 0 H ASP B 237 -0.108 -5.058 -4.312 1.00 1.00 H new ATOM 0 HA ASP B 237 1.990 -3.414 -3.327 1.00 1.00 H new ATOM 0 HB2 ASP B 237 0.135 -3.400 -5.731 1.00 1.00 H new ATOM 0 HB3 ASP B 237 1.211 -2.045 -5.449 1.00 1.00 H new ATOM 1896 N LEU B 238 -1.076 -2.235 -3.119 1.00 1.00 N ATOM 1897 CA LEU B 238 -1.888 -1.187 -2.512 1.00 1.00 C ATOM 1898 C LEU B 238 -1.761 -1.211 -0.996 1.00 1.00 C ATOM 1899 O LEU B 238 -1.688 -0.166 -0.351 1.00 1.00 O ATOM 1900 CB LEU B 238 -3.354 -1.362 -2.915 1.00 1.00 C ATOM 1901 CG LEU B 238 -3.543 -0.908 -4.372 1.00 1.00 C ATOM 1902 CD1 LEU B 238 -4.916 -1.368 -4.866 1.00 1.00 C ATOM 1903 CD2 LEU B 238 -3.436 0.628 -4.479 1.00 1.00 C ATOM 0 H LEU B 238 -1.610 -2.977 -3.571 1.00 1.00 H new ATOM 0 HA LEU B 238 -1.527 -0.223 -2.872 1.00 1.00 H new ATOM 0 HB2 LEU B 238 -3.650 -2.405 -2.807 1.00 1.00 H new ATOM 0 HB3 LEU B 238 -3.996 -0.779 -2.255 1.00 1.00 H new ATOM 0 HG LEU B 238 -2.761 -1.351 -4.988 1.00 1.00 H new ATOM 0 HD11 LEU B 238 -5.057 -1.049 -5.899 1.00 1.00 H new ATOM 0 HD12 LEU B 238 -4.977 -2.455 -4.810 1.00 1.00 H new ATOM 0 HD13 LEU B 238 -5.694 -0.928 -4.241 1.00 1.00 H new ATOM 0 HD21 LEU B 238 -3.572 0.931 -5.517 1.00 1.00 H new ATOM 0 HD22 LEU B 238 -4.207 1.090 -3.862 1.00 1.00 H new ATOM 0 HD23 LEU B 238 -2.453 0.949 -4.133 1.00 1.00 H new ATOM 1915 N LEU B 239 -1.745 -2.413 -0.431 1.00 1.00 N ATOM 1916 CA LEU B 239 -1.642 -2.560 1.015 1.00 1.00 C ATOM 1917 C LEU B 239 -0.342 -1.951 1.521 1.00 1.00 C ATOM 1918 O LEU B 239 -0.337 -1.219 2.511 1.00 1.00 O ATOM 1919 CB LEU B 239 -1.692 -4.045 1.383 1.00 1.00 C ATOM 1920 CG LEU B 239 -3.097 -4.602 1.106 1.00 1.00 C ATOM 1921 CD1 LEU B 239 -3.076 -6.129 1.238 1.00 1.00 C ATOM 1922 CD2 LEU B 239 -4.112 -4.010 2.104 1.00 1.00 C ATOM 0 H LEU B 239 -1.801 -3.291 -0.946 1.00 1.00 H new ATOM 0 HA LEU B 239 -2.477 -2.038 1.482 1.00 1.00 H new ATOM 0 HB2 LEU B 239 -0.951 -4.598 0.805 1.00 1.00 H new ATOM 0 HB3 LEU B 239 -1.439 -4.177 2.435 1.00 1.00 H new ATOM 0 HG LEU B 239 -3.395 -4.326 0.095 1.00 1.00 H new ATOM 0 HD11 LEU B 239 -4.072 -6.525 1.042 1.00 1.00 H new ATOM 0 HD12 LEU B 239 -2.371 -6.547 0.519 1.00 1.00 H new ATOM 0 HD13 LEU B 239 -2.769 -6.403 2.247 1.00 1.00 H new ATOM 0 HD21 LEU B 239 -5.103 -4.413 1.897 1.00 1.00 H new ATOM 0 HD22 LEU B 239 -3.819 -4.273 3.120 1.00 1.00 H new ATOM 0 HD23 LEU B 239 -4.133 -2.925 2.002 1.00 1.00 H new ATOM 1934 N ARG B 240 0.752 -2.252 0.837 1.00 1.00 N ATOM 1935 CA ARG B 240 2.051 -1.724 1.230 1.00 1.00 C ATOM 1936 C ARG B 240 2.005 -0.200 1.275 1.00 1.00 C ATOM 1937 O ARG B 240 2.529 0.418 2.202 1.00 1.00 O ATOM 1938 CB ARG B 240 3.119 -2.178 0.233 1.00 1.00 C ATOM 1939 CG ARG B 240 4.495 -1.700 0.700 1.00 1.00 C ATOM 1940 CD ARG B 240 5.564 -2.190 -0.277 1.00 1.00 C ATOM 1941 NE ARG B 240 5.651 -3.645 -0.239 1.00 1.00 N ATOM 1942 CZ ARG B 240 6.506 -4.302 -1.017 1.00 1.00 C ATOM 1943 NH1 ARG B 240 7.290 -3.645 -1.828 1.00 1.00 N ATOM 1944 NH2 ARG B 240 6.562 -5.604 -0.969 1.00 1.00 N ATOM 0 H ARG B 240 0.768 -2.854 0.014 1.00 1.00 H new ATOM 0 HA ARG B 240 2.300 -2.102 2.222 1.00 1.00 H new ATOM 0 HB2 ARG B 240 3.111 -3.264 0.146 1.00 1.00 H new ATOM 0 HB3 ARG B 240 2.900 -1.777 -0.757 1.00 1.00 H new ATOM 0 HG2 ARG B 240 4.513 -0.612 0.759 1.00 1.00 H new ATOM 0 HG3 ARG B 240 4.702 -2.077 1.701 1.00 1.00 H new ATOM 0 HD2 ARG B 240 5.323 -1.859 -1.287 1.00 1.00 H new ATOM 0 HD3 ARG B 240 6.529 -1.754 -0.020 1.00 1.00 H new ATOM 0 HE ARG B 240 5.046 -4.167 0.395 1.00 1.00 H new ATOM 0 HH11 ARG B 240 7.247 -2.627 -1.865 1.00 1.00 H new ATOM 0 HH12 ARG B 240 7.946 -4.150 -2.424 1.00 1.00 H new ATOM 0 HH21 ARG B 240 5.950 -6.118 -0.335 1.00 1.00 H new ATOM 0 HH22 ARG B 240 7.218 -6.109 -1.566 1.00 1.00 H new ATOM 1958 N GLU B 241 1.375 0.399 0.270 1.00 1.00 N ATOM 1959 CA GLU B 241 1.263 1.851 0.209 1.00 1.00 C ATOM 1960 C GLU B 241 0.366 2.368 1.330 1.00 1.00 C ATOM 1961 O GLU B 241 0.626 3.422 1.910 1.00 1.00 O ATOM 1962 CB GLU B 241 0.686 2.274 -1.143 1.00 1.00 C ATOM 1963 CG GLU B 241 1.702 1.977 -2.247 1.00 1.00 C ATOM 1964 CD GLU B 241 1.100 2.300 -3.610 1.00 1.00 C ATOM 1965 OE1 GLU B 241 1.760 2.043 -4.604 1.00 1.00 O ATOM 1966 OE2 GLU B 241 -0.012 2.800 -3.642 1.00 1.00 O ATOM 0 H GLU B 241 0.937 -0.095 -0.508 1.00 1.00 H new ATOM 0 HA GLU B 241 2.259 2.278 0.329 1.00 1.00 H new ATOM 0 HB2 GLU B 241 -0.244 1.739 -1.337 1.00 1.00 H new ATOM 0 HB3 GLU B 241 0.446 3.337 -1.131 1.00 1.00 H new ATOM 0 HG2 GLU B 241 2.605 2.567 -2.090 1.00 1.00 H new ATOM 0 HG3 GLU B 241 1.996 0.928 -2.209 1.00 1.00 H new ATOM 1974 N ALA B 242 -0.689 1.618 1.634 1.00 1.00 N ATOM 1975 CA ALA B 242 -1.616 2.014 2.687 1.00 1.00 C ATOM 1976 C ALA B 242 -0.869 2.226 4.000 1.00 1.00 C ATOM 1977 O ALA B 242 -1.140 3.181 4.728 1.00 1.00 O ATOM 1978 CB ALA B 242 -2.681 0.932 2.875 1.00 1.00 C ATOM 0 H ALA B 242 -0.922 0.740 1.170 1.00 1.00 H new ATOM 0 HA ALA B 242 -2.094 2.949 2.396 1.00 1.00 H new ATOM 0 HB1 ALA B 242 -3.371 1.234 3.663 1.00 1.00 H new ATOM 0 HB2 ALA B 242 -3.231 0.797 1.944 1.00 1.00 H new ATOM 0 HB3 ALA B 242 -2.201 -0.007 3.152 1.00 1.00 H new ATOM 1984 N VAL B 243 0.075 1.336 4.296 1.00 1.00 N ATOM 1985 CA VAL B 243 0.850 1.451 5.527 1.00 1.00 C ATOM 1986 C VAL B 243 1.699 2.719 5.505 1.00 1.00 C ATOM 1987 O VAL B 243 1.653 3.526 6.434 1.00 1.00 O ATOM 1988 CB VAL B 243 1.757 0.229 5.678 1.00 1.00 C ATOM 1989 CG1 VAL B 243 2.650 0.400 6.909 1.00 1.00 C ATOM 1990 CG2 VAL B 243 0.895 -1.026 5.846 1.00 1.00 C ATOM 0 H VAL B 243 0.319 0.538 3.709 1.00 1.00 H new ATOM 0 HA VAL B 243 0.163 1.503 6.371 1.00 1.00 H new ATOM 0 HB VAL B 243 2.381 0.129 4.790 1.00 1.00 H new ATOM 0 HG11 VAL B 243 3.295 -0.472 7.014 1.00 1.00 H new ATOM 0 HG12 VAL B 243 3.263 1.293 6.792 1.00 1.00 H new ATOM 0 HG13 VAL B 243 2.028 0.501 7.798 1.00 1.00 H new ATOM 0 HG21 VAL B 243 1.540 -1.898 5.954 1.00 1.00 H new ATOM 0 HG22 VAL B 243 0.272 -0.923 6.734 1.00 1.00 H new ATOM 0 HG23 VAL B 243 0.259 -1.151 4.969 1.00 1.00 H new ATOM 2000 N ASP B 244 2.476 2.889 4.438 1.00 1.00 N ATOM 2001 CA ASP B 244 3.333 4.061 4.313 1.00 1.00 C ATOM 2002 C ASP B 244 2.520 5.329 4.558 1.00 1.00 C ATOM 2003 O ASP B 244 2.911 6.177 5.360 1.00 1.00 O ATOM 2004 CB ASP B 244 3.946 4.111 2.913 1.00 1.00 C ATOM 2005 CG ASP B 244 5.058 5.154 2.863 1.00 1.00 C ATOM 2006 OD1 ASP B 244 5.080 5.922 1.916 1.00 1.00 O ATOM 2007 OD2 ASP B 244 5.873 5.166 3.771 1.00 1.00 O ATOM 0 H ASP B 244 2.529 2.236 3.656 1.00 1.00 H new ATOM 0 HA ASP B 244 4.130 3.995 5.054 1.00 1.00 H new ATOM 0 HB2 ASP B 244 4.344 3.132 2.647 1.00 1.00 H new ATOM 0 HB3 ASP B 244 3.177 4.353 2.180 1.00 1.00 H new ATOM 2013 N GLN B 245 1.384 5.446 3.878 1.00 1.00 N ATOM 2014 CA GLN B 245 0.525 6.608 4.046 1.00 1.00 C ATOM 2015 C GLN B 245 0.056 6.711 5.495 1.00 1.00 C ATOM 2016 O GLN B 245 0.007 7.802 6.062 1.00 1.00 O ATOM 2017 CB GLN B 245 -0.687 6.484 3.110 1.00 1.00 C ATOM 2018 CG GLN B 245 -0.320 7.005 1.721 1.00 1.00 C ATOM 2019 CD GLN B 245 0.847 6.205 1.155 1.00 1.00 C ATOM 2020 OE1 GLN B 245 0.640 5.241 0.419 1.00 1.00 O ATOM 2021 NE2 GLN B 245 2.068 6.550 1.459 1.00 1.00 N ATOM 0 H GLN B 245 1.040 4.755 3.211 1.00 1.00 H new ATOM 0 HA GLN B 245 1.086 7.509 3.797 1.00 1.00 H new ATOM 0 HB2 GLN B 245 -1.005 5.443 3.046 1.00 1.00 H new ATOM 0 HB3 GLN B 245 -1.528 7.050 3.511 1.00 1.00 H new ATOM 0 HG2 GLN B 245 -1.180 6.929 1.056 1.00 1.00 H new ATOM 0 HG3 GLN B 245 -0.054 8.061 1.778 1.00 1.00 H new ATOM 0 HE21 GLN B 245 2.235 7.350 2.070 1.00 1.00 H new ATOM 0 HE22 GLN B 245 2.856 6.020 1.086 1.00 1.00 H new ATOM 2030 N TYR B 246 -0.290 5.573 6.082 1.00 1.00 N ATOM 2031 CA TYR B 246 -0.757 5.551 7.462 1.00 1.00 C ATOM 2032 C TYR B 246 0.334 6.051 8.402 1.00 1.00 C ATOM 2033 O TYR B 246 0.081 6.866 9.287 1.00 1.00 O ATOM 2034 CB TYR B 246 -1.160 4.130 7.854 1.00 1.00 C ATOM 2035 CG TYR B 246 -1.676 4.124 9.274 1.00 1.00 C ATOM 2036 CD1 TYR B 246 -2.928 4.685 9.564 1.00 1.00 C ATOM 2037 CD2 TYR B 246 -0.909 3.559 10.301 1.00 1.00 C ATOM 2038 CE1 TYR B 246 -3.410 4.680 10.879 1.00 1.00 C ATOM 2039 CE2 TYR B 246 -1.393 3.555 11.616 1.00 1.00 C ATOM 2040 CZ TYR B 246 -2.643 4.116 11.905 1.00 1.00 C ATOM 2041 OH TYR B 246 -3.117 4.113 13.200 1.00 1.00 O ATOM 0 H TYR B 246 -0.257 4.660 5.629 1.00 1.00 H new ATOM 0 HA TYR B 246 -1.622 6.208 7.545 1.00 1.00 H new ATOM 0 HB2 TYR B 246 -1.928 3.759 7.176 1.00 1.00 H new ATOM 0 HB3 TYR B 246 -0.305 3.461 7.764 1.00 1.00 H new ATOM 0 HD1 TYR B 246 -3.521 5.121 8.773 1.00 1.00 H new ATOM 0 HD2 TYR B 246 0.055 3.126 10.079 1.00 1.00 H new ATOM 0 HE1 TYR B 246 -4.375 5.112 11.102 1.00 1.00 H new ATOM 0 HE2 TYR B 246 -0.801 3.119 12.407 1.00 1.00 H new ATOM 0 HH TYR B 246 -2.461 3.682 13.787 1.00 1.00 H new ATOM 2051 N LEU B 247 1.549 5.554 8.202 1.00 1.00 N ATOM 2052 CA LEU B 247 2.673 5.949 9.044 1.00 1.00 C ATOM 2053 C LEU B 247 2.939 7.444 8.914 1.00 1.00 C ATOM 2054 O LEU B 247 3.194 8.125 9.908 1.00 1.00 O ATOM 2055 CB LEU B 247 3.928 5.174 8.634 1.00 1.00 C ATOM 2056 CG LEU B 247 3.739 3.682 8.945 1.00 1.00 C ATOM 2057 CD1 LEU B 247 4.921 2.890 8.377 1.00 1.00 C ATOM 2058 CD2 LEU B 247 3.649 3.461 10.467 1.00 1.00 C ATOM 0 H LEU B 247 1.781 4.882 7.470 1.00 1.00 H new ATOM 0 HA LEU B 247 2.424 5.722 10.080 1.00 1.00 H new ATOM 0 HB2 LEU B 247 4.121 5.312 7.570 1.00 1.00 H new ATOM 0 HB3 LEU B 247 4.796 5.560 9.168 1.00 1.00 H new ATOM 0 HG LEU B 247 2.813 3.337 8.486 1.00 1.00 H new ATOM 0 HD11 LEU B 247 4.788 1.831 8.597 1.00 1.00 H new ATOM 0 HD12 LEU B 247 4.970 3.033 7.298 1.00 1.00 H new ATOM 0 HD13 LEU B 247 5.847 3.242 8.832 1.00 1.00 H new ATOM 0 HD21 LEU B 247 3.515 2.399 10.673 1.00 1.00 H new ATOM 0 HD22 LEU B 247 4.567 3.810 10.940 1.00 1.00 H new ATOM 0 HD23 LEU B 247 2.801 4.018 10.866 1.00 1.00 H new ATOM 2070 N ILE B 248 2.877 7.950 7.688 1.00 1.00 N ATOM 2071 CA ILE B 248 3.117 9.368 7.453 1.00 1.00 C ATOM 2072 C ILE B 248 2.078 10.209 8.188 1.00 1.00 C ATOM 2073 O ILE B 248 2.419 11.188 8.853 1.00 1.00 O ATOM 2074 CB ILE B 248 3.049 9.656 5.950 1.00 1.00 C ATOM 2075 CG1 ILE B 248 4.249 9.011 5.252 1.00 1.00 C ATOM 2076 CG2 ILE B 248 3.073 11.168 5.711 1.00 1.00 C ATOM 2077 CD1 ILE B 248 4.023 9.013 3.738 1.00 1.00 C ATOM 0 H ILE B 248 2.665 7.407 6.851 1.00 1.00 H new ATOM 0 HA ILE B 248 4.107 9.628 7.829 1.00 1.00 H new ATOM 0 HB ILE B 248 2.125 9.242 5.546 1.00 1.00 H new ATOM 0 HG12 ILE B 248 5.161 9.557 5.495 1.00 1.00 H new ATOM 0 HG13 ILE B 248 4.385 7.990 5.609 1.00 1.00 H new ATOM 0 HG21 ILE B 248 3.024 11.368 4.641 1.00 1.00 H new ATOM 0 HG22 ILE B 248 2.217 11.628 6.205 1.00 1.00 H new ATOM 0 HG23 ILE B 248 3.994 11.586 6.117 1.00 1.00 H new ATOM 0 HD11 ILE B 248 4.878 8.554 3.242 1.00 1.00 H new ATOM 0 HD12 ILE B 248 3.121 8.448 3.504 1.00 1.00 H new ATOM 0 HD13 ILE B 248 3.909 10.039 3.388 1.00 1.00 H new ATOM 2089 N ASN B 249 0.813 9.825 8.066 1.00 1.00 N ATOM 2090 CA ASN B 249 -0.260 10.556 8.727 1.00 1.00 C ATOM 2091 C ASN B 249 -0.095 10.486 10.241 1.00 1.00 C ATOM 2092 O ASN B 249 -0.288 11.479 10.944 1.00 1.00 O ATOM 2093 CB ASN B 249 -1.614 9.966 8.332 1.00 1.00 C ATOM 2094 CG ASN B 249 -2.738 10.720 9.034 1.00 1.00 C ATOM 2095 OD1 ASN B 249 -2.586 11.896 9.365 1.00 1.00 O ATOM 2096 ND2 ASN B 249 -3.864 10.109 9.283 1.00 1.00 N ATOM 0 H ASN B 249 0.507 9.019 7.521 1.00 1.00 H new ATOM 0 HA ASN B 249 -0.214 11.599 8.413 1.00 1.00 H new ATOM 0 HB2 ASN B 249 -1.745 10.026 7.252 1.00 1.00 H new ATOM 0 HB3 ASN B 249 -1.651 8.910 8.599 1.00 1.00 H new ATOM 0 HD21 ASN B 249 -4.621 10.606 9.753 1.00 1.00 H new ATOM 0 HD22 ASN B 249 -3.987 9.135 9.008 1.00 1.00 H new