USER MOD reduce.3.24.130724 H: found=0, std=0, add=686, rem=0, adj=9 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 9 MET CE :methyl -160:sc= -0.294 (180deg=-1.48) USER MOD Set 1.2: B 217 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= -0.109 X(o=-0.11,f=-0.11) USER MOD Single : A 22 LYS NZ :NH3+ -162:sc= -0.0205 (180deg=-0.34) USER MOD Single : A 23 GLN : amide:sc= -0.352 K(o=-0.35,f=-2.6) USER MOD Single : A 30 GLN : amide:sc= -0.194 X(o=-0.19,f=-0.27) USER MOD Single : A 32 ASN : amide:sc= -0.184 X(o=-0.18,f=-0.097) USER MOD Single : A 45 GLN : amide:sc= -4.04! C(o=-4!,f=-5.4!) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : B 209 MET CE :methyl 158:sc= -1.57! (180deg=-2.23!) USER MOD Single : B 218 ASN :FLIP amide:sc= 0 F(o=-0.81,f=0) USER MOD Single : B 222 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 223 GLN : amide:sc= -0.364 K(o=-0.36,f=-3!) USER MOD Single : B 230 GLN :FLIP amide:sc= 0.827 F(o=0,f=0.83) USER MOD Single : B 232 ASN : amide:sc= -0.56 K(o=-0.56,f=-1.4) USER MOD Single : B 245 GLN : amide:sc= -0.0547 K(o=-0.055,f=-2!) USER MOD Single : B 246 TYR OH : rot 30:sc= 0.0517 USER MOD Single : B 249 ASN : amide:sc=-0.00113 K(o=-0.0011,f=-1.2) USER MOD ----------------------------------------------------------------- ATOM 111 N MET A 9 -14.288 -14.395 6.761 1.00 1.00 N ATOM 112 CA MET A 9 -13.393 -13.344 6.287 1.00 1.00 C ATOM 113 C MET A 9 -12.377 -13.917 5.304 1.00 1.00 C ATOM 114 O MET A 9 -11.682 -14.885 5.609 1.00 1.00 O ATOM 115 CB MET A 9 -12.660 -12.714 7.473 1.00 1.00 C ATOM 116 CG MET A 9 -13.657 -11.952 8.348 1.00 1.00 C ATOM 117 SD MET A 9 -12.788 -11.183 9.737 1.00 1.00 S ATOM 118 CE MET A 9 -12.338 -9.645 8.901 1.00 1.00 C ATOM 0 HA MET A 9 -13.985 -12.582 5.780 1.00 1.00 H new ATOM 0 HB2 MET A 9 -12.164 -13.488 8.059 1.00 1.00 H new ATOM 0 HB3 MET A 9 -11.884 -12.038 7.116 1.00 1.00 H new ATOM 0 HG2 MET A 9 -14.165 -11.189 7.757 1.00 1.00 H new ATOM 0 HG3 MET A 9 -14.424 -12.632 8.718 1.00 1.00 H new ATOM 0 HE1 MET A 9 -11.510 -9.173 9.429 1.00 1.00 H new ATOM 0 HE2 MET A 9 -12.038 -9.862 7.876 1.00 1.00 H new ATOM 0 HE3 MET A 9 -13.195 -8.971 8.893 1.00 1.00 H new ATOM 128 N GLY A 10 -12.298 -13.313 4.126 1.00 1.00 N ATOM 129 CA GLY A 10 -11.371 -13.770 3.103 1.00 1.00 C ATOM 130 C GLY A 10 -9.935 -13.666 3.589 1.00 1.00 C ATOM 131 O GLY A 10 -9.463 -12.586 3.944 1.00 1.00 O ATOM 0 H GLY A 10 -12.863 -12.508 3.857 1.00 1.00 H new ATOM 0 HA2 GLY A 10 -11.596 -14.803 2.838 1.00 1.00 H new ATOM 0 HA3 GLY A 10 -11.498 -13.174 2.199 1.00 1.00 H new ATOM 135 N ARG A 11 -9.241 -14.798 3.601 1.00 1.00 N ATOM 136 CA ARG A 11 -7.852 -14.825 4.046 1.00 1.00 C ATOM 137 C ARG A 11 -6.947 -14.208 2.989 1.00 1.00 C ATOM 138 O ARG A 11 -7.028 -14.557 1.814 1.00 1.00 O ATOM 139 CB ARG A 11 -7.416 -16.265 4.319 1.00 1.00 C ATOM 140 CG ARG A 11 -5.986 -16.277 4.864 1.00 1.00 C ATOM 141 CD ARG A 11 -5.572 -17.712 5.185 1.00 1.00 C ATOM 142 NE ARG A 11 -5.546 -18.513 3.967 1.00 1.00 N ATOM 143 CZ ARG A 11 -5.285 -19.814 4.007 1.00 1.00 C ATOM 144 NH1 ARG A 11 -5.042 -20.396 5.149 1.00 1.00 N ATOM 145 NH2 ARG A 11 -5.272 -20.511 2.904 1.00 1.00 N ATOM 0 H ARG A 11 -9.613 -15.702 3.310 1.00 1.00 H new ATOM 0 HA ARG A 11 -7.771 -14.245 4.965 1.00 1.00 H new ATOM 0 HB2 ARG A 11 -8.093 -16.730 5.036 1.00 1.00 H new ATOM 0 HB3 ARG A 11 -7.471 -16.852 3.402 1.00 1.00 H new ATOM 0 HG2 ARG A 11 -5.303 -15.846 4.132 1.00 1.00 H new ATOM 0 HG3 ARG A 11 -5.923 -15.660 5.761 1.00 1.00 H new ATOM 0 HD2 ARG A 11 -4.588 -17.718 5.654 1.00 1.00 H new ATOM 0 HD3 ARG A 11 -6.269 -18.148 5.901 1.00 1.00 H new ATOM 0 HE ARG A 11 -5.731 -18.066 3.069 1.00 1.00 H new ATOM 0 HH11 ARG A 11 -5.053 -19.851 6.011 1.00 1.00 H new ATOM 0 HH12 ARG A 11 -4.842 -21.396 5.179 1.00 1.00 H new ATOM 0 HH21 ARG A 11 -5.462 -20.056 2.011 1.00 1.00 H new ATOM 0 HH22 ARG A 11 -5.071 -21.511 2.935 1.00 1.00 H new ATOM 159 N ILE A 12 -6.082 -13.288 3.413 1.00 1.00 N ATOM 160 CA ILE A 12 -5.162 -12.622 2.490 1.00 1.00 C ATOM 161 C ILE A 12 -3.765 -12.579 3.086 1.00 1.00 C ATOM 162 O ILE A 12 -3.597 -12.389 4.289 1.00 1.00 O ATOM 163 CB ILE A 12 -5.640 -11.201 2.215 1.00 1.00 C ATOM 164 CG1 ILE A 12 -7.065 -11.243 1.646 1.00 1.00 C ATOM 165 CG2 ILE A 12 -4.709 -10.534 1.202 1.00 1.00 C ATOM 166 CD1 ILE A 12 -7.614 -9.818 1.505 1.00 1.00 C ATOM 0 H ILE A 12 -5.998 -12.987 4.384 1.00 1.00 H new ATOM 0 HA ILE A 12 -5.137 -13.183 1.556 1.00 1.00 H new ATOM 0 HB ILE A 12 -5.634 -10.631 3.144 1.00 1.00 H new ATOM 0 HG12 ILE A 12 -7.064 -11.739 0.675 1.00 1.00 H new ATOM 0 HG13 ILE A 12 -7.710 -11.827 2.302 1.00 1.00 H new ATOM 0 HG21 ILE A 12 -5.052 -9.518 1.006 1.00 1.00 H new ATOM 0 HG22 ILE A 12 -3.696 -10.504 1.604 1.00 1.00 H new ATOM 0 HG23 ILE A 12 -4.714 -11.104 0.273 1.00 1.00 H new ATOM 0 HD11 ILE A 12 -8.625 -9.856 1.101 1.00 1.00 H new ATOM 0 HD12 ILE A 12 -7.632 -9.337 2.483 1.00 1.00 H new ATOM 0 HD13 ILE A 12 -6.975 -9.247 0.831 1.00 1.00 H new ATOM 178 N LEU A 13 -2.764 -12.758 2.237 1.00 1.00 N ATOM 179 CA LEU A 13 -1.374 -12.742 2.686 1.00 1.00 C ATOM 180 C LEU A 13 -0.750 -11.387 2.414 1.00 1.00 C ATOM 181 O LEU A 13 -0.776 -10.893 1.286 1.00 1.00 O ATOM 182 CB LEU A 13 -0.576 -13.828 1.945 1.00 1.00 C ATOM 183 CG LEU A 13 -0.809 -15.182 2.605 1.00 1.00 C ATOM 184 CD1 LEU A 13 -2.291 -15.554 2.506 1.00 1.00 C ATOM 185 CD2 LEU A 13 0.037 -16.245 1.904 1.00 1.00 C ATOM 0 H LEU A 13 -2.884 -12.916 1.236 1.00 1.00 H new ATOM 0 HA LEU A 13 -1.351 -12.937 3.758 1.00 1.00 H new ATOM 0 HB2 LEU A 13 -0.881 -13.866 0.899 1.00 1.00 H new ATOM 0 HB3 LEU A 13 0.486 -13.585 1.959 1.00 1.00 H new ATOM 0 HG LEU A 13 -0.522 -15.127 3.655 1.00 1.00 H new ATOM 0 HD11 LEU A 13 -2.455 -16.522 2.978 1.00 1.00 H new ATOM 0 HD12 LEU A 13 -2.891 -14.797 3.012 1.00 1.00 H new ATOM 0 HD13 LEU A 13 -2.583 -15.608 1.457 1.00 1.00 H new ATOM 0 HD21 LEU A 13 -0.130 -17.213 2.377 1.00 1.00 H new ATOM 0 HD22 LEU A 13 -0.246 -16.301 0.853 1.00 1.00 H new ATOM 0 HD23 LEU A 13 1.092 -15.980 1.982 1.00 1.00 H new ATOM 197 N LEU A 14 -0.180 -10.789 3.459 1.00 1.00 N ATOM 198 CA LEU A 14 0.465 -9.487 3.335 1.00 1.00 C ATOM 199 C LEU A 14 1.963 -9.622 3.580 1.00 1.00 C ATOM 200 O LEU A 14 2.385 -10.182 4.589 1.00 1.00 O ATOM 201 CB LEU A 14 -0.141 -8.502 4.341 1.00 1.00 C ATOM 202 CG LEU A 14 0.604 -7.160 4.270 1.00 1.00 C ATOM 203 CD1 LEU A 14 0.581 -6.618 2.832 1.00 1.00 C ATOM 204 CD2 LEU A 14 -0.066 -6.157 5.212 1.00 1.00 C ATOM 0 H LEU A 14 -0.153 -11.186 4.398 1.00 1.00 H new ATOM 0 HA LEU A 14 0.302 -9.108 2.326 1.00 1.00 H new ATOM 0 HB2 LEU A 14 -1.199 -8.353 4.125 1.00 1.00 H new ATOM 0 HB3 LEU A 14 -0.076 -8.912 5.349 1.00 1.00 H new ATOM 0 HG LEU A 14 1.640 -7.309 4.573 1.00 1.00 H new ATOM 0 HD11 LEU A 14 1.112 -5.667 2.793 1.00 1.00 H new ATOM 0 HD12 LEU A 14 1.066 -7.332 2.166 1.00 1.00 H new ATOM 0 HD13 LEU A 14 -0.451 -6.471 2.515 1.00 1.00 H new ATOM 0 HD21 LEU A 14 0.461 -5.204 5.163 1.00 1.00 H new ATOM 0 HD22 LEU A 14 -1.104 -6.013 4.912 1.00 1.00 H new ATOM 0 HD23 LEU A 14 -0.033 -6.538 6.233 1.00 1.00 H new ATOM 216 N ASP A 15 2.759 -9.099 2.650 1.00 1.00 N ATOM 217 CA ASP A 15 4.216 -9.157 2.769 1.00 1.00 C ATOM 218 C ASP A 15 4.798 -7.780 3.062 1.00 1.00 C ATOM 219 O ASP A 15 4.786 -6.894 2.210 1.00 1.00 O ATOM 220 CB ASP A 15 4.813 -9.693 1.472 1.00 1.00 C ATOM 221 CG ASP A 15 4.411 -11.151 1.278 1.00 1.00 C ATOM 222 OD1 ASP A 15 4.186 -11.536 0.144 1.00 1.00 O ATOM 223 OD2 ASP A 15 4.336 -11.860 2.269 1.00 1.00 O ATOM 0 H ASP A 15 2.422 -8.632 1.808 1.00 1.00 H new ATOM 0 HA ASP A 15 4.465 -9.820 3.597 1.00 1.00 H new ATOM 0 HB2 ASP A 15 4.467 -9.096 0.628 1.00 1.00 H new ATOM 0 HB3 ASP A 15 5.899 -9.607 1.499 1.00 1.00 H new ATOM 229 N LEU A 16 5.320 -7.613 4.274 1.00 1.00 N ATOM 230 CA LEU A 16 5.926 -6.344 4.690 1.00 1.00 C ATOM 231 C LEU A 16 7.436 -6.466 4.694 1.00 1.00 C ATOM 232 O LEU A 16 7.987 -7.370 4.083 1.00 1.00 O ATOM 233 CB LEU A 16 5.440 -5.942 6.077 1.00 1.00 C ATOM 234 CG LEU A 16 3.913 -5.821 6.069 1.00 1.00 C ATOM 235 CD1 LEU A 16 3.426 -5.413 7.467 1.00 1.00 C ATOM 236 CD2 LEU A 16 3.467 -4.768 5.032 1.00 1.00 C ATOM 0 H LEU A 16 5.337 -8.340 4.989 1.00 1.00 H new ATOM 0 HA LEU A 16 5.627 -5.574 3.979 1.00 1.00 H new ATOM 0 HB2 LEU A 16 5.753 -6.683 6.812 1.00 1.00 H new ATOM 0 HB3 LEU A 16 5.889 -4.993 6.370 1.00 1.00 H new ATOM 0 HG LEU A 16 3.480 -6.784 5.799 1.00 1.00 H new ATOM 0 HD11 LEU A 16 2.339 -5.326 7.463 1.00 1.00 H new ATOM 0 HD12 LEU A 16 3.727 -6.169 8.192 1.00 1.00 H new ATOM 0 HD13 LEU A 16 3.865 -4.453 7.740 1.00 1.00 H new ATOM 0 HD21 LEU A 16 2.380 -4.691 5.036 1.00 1.00 H new ATOM 0 HD22 LEU A 16 3.900 -3.801 5.287 1.00 1.00 H new ATOM 0 HD23 LEU A 16 3.806 -5.068 4.040 1.00 1.00 H new ATOM 248 N SER A 17 8.104 -5.548 5.380 1.00 1.00 N ATOM 249 CA SER A 17 9.563 -5.563 5.450 1.00 1.00 C ATOM 250 C SER A 17 10.025 -5.445 6.902 1.00 1.00 C ATOM 251 O SER A 17 9.330 -4.865 7.740 1.00 1.00 O ATOM 252 CB SER A 17 10.124 -4.390 4.641 1.00 1.00 C ATOM 253 OG SER A 17 11.468 -4.677 4.278 1.00 1.00 O ATOM 0 H SER A 17 7.663 -4.786 5.895 1.00 1.00 H new ATOM 0 HA SER A 17 9.927 -6.504 5.038 1.00 1.00 H new ATOM 0 HB2 SER A 17 9.520 -4.226 3.749 1.00 1.00 H new ATOM 0 HB3 SER A 17 10.081 -3.473 5.229 1.00 1.00 H new ATOM 0 HG SER A 17 11.833 -3.931 3.758 1.00 1.00 H new ATOM 259 N ASN A 18 11.196 -5.994 7.191 1.00 1.00 N ATOM 260 CA ASN A 18 11.738 -5.947 8.545 1.00 1.00 C ATOM 261 C ASN A 18 11.723 -4.519 9.074 1.00 1.00 C ATOM 262 O ASN A 18 11.423 -4.287 10.245 1.00 1.00 O ATOM 263 CB ASN A 18 13.175 -6.477 8.545 1.00 1.00 C ATOM 264 CG ASN A 18 13.216 -7.882 7.952 1.00 1.00 C ATOM 265 OD1 ASN A 18 12.660 -8.815 8.531 1.00 1.00 O ATOM 266 ND2 ASN A 18 13.845 -8.089 6.828 1.00 1.00 N ATOM 0 H ASN A 18 11.787 -6.474 6.513 1.00 1.00 H new ATOM 0 HA ASN A 18 11.118 -6.569 9.191 1.00 1.00 H new ATOM 0 HB2 ASN A 18 13.816 -5.811 7.967 1.00 1.00 H new ATOM 0 HB3 ASN A 18 13.565 -6.492 9.563 1.00 1.00 H new ATOM 0 HD21 ASN A 18 13.877 -9.026 6.427 1.00 1.00 H new ATOM 0 HD22 ASN A 18 14.305 -7.314 6.351 1.00 1.00 H new ATOM 273 N GLU A 19 12.039 -3.566 8.205 1.00 1.00 N ATOM 274 CA GLU A 19 12.048 -2.165 8.602 1.00 1.00 C ATOM 275 C GLU A 19 10.630 -1.684 8.902 1.00 1.00 C ATOM 276 O GLU A 19 10.410 -0.923 9.840 1.00 1.00 O ATOM 277 CB GLU A 19 12.649 -1.310 7.483 1.00 1.00 C ATOM 278 CG GLU A 19 12.781 0.140 7.957 1.00 1.00 C ATOM 279 CD GLU A 19 13.381 0.998 6.849 1.00 1.00 C ATOM 280 OE1 GLU A 19 13.926 0.432 5.917 1.00 1.00 O ATOM 281 OE2 GLU A 19 13.281 2.210 6.948 1.00 1.00 O ATOM 0 H GLU A 19 12.290 -3.736 7.231 1.00 1.00 H new ATOM 0 HA GLU A 19 12.653 -2.066 9.503 1.00 1.00 H new ATOM 0 HB2 GLU A 19 13.626 -1.700 7.199 1.00 1.00 H new ATOM 0 HB3 GLU A 19 12.017 -1.357 6.596 1.00 1.00 H new ATOM 0 HG2 GLU A 19 11.803 0.529 8.240 1.00 1.00 H new ATOM 0 HG3 GLU A 19 13.412 0.185 8.845 1.00 1.00 H new ATOM 289 N VAL A 20 9.670 -2.140 8.104 1.00 1.00 N ATOM 290 CA VAL A 20 8.275 -1.753 8.302 1.00 1.00 C ATOM 291 C VAL A 20 7.716 -2.378 9.578 1.00 1.00 C ATOM 292 O VAL A 20 7.051 -1.713 10.369 1.00 1.00 O ATOM 293 CB VAL A 20 7.440 -2.200 7.098 1.00 1.00 C ATOM 294 CG1 VAL A 20 5.957 -1.925 7.369 1.00 1.00 C ATOM 295 CG2 VAL A 20 7.884 -1.428 5.855 1.00 1.00 C ATOM 0 H VAL A 20 9.829 -2.773 7.320 1.00 1.00 H new ATOM 0 HA VAL A 20 8.226 -0.668 8.398 1.00 1.00 H new ATOM 0 HB VAL A 20 7.585 -3.268 6.934 1.00 1.00 H new ATOM 0 HG11 VAL A 20 5.365 -2.244 6.511 1.00 1.00 H new ATOM 0 HG12 VAL A 20 5.640 -2.477 8.254 1.00 1.00 H new ATOM 0 HG13 VAL A 20 5.809 -0.858 7.535 1.00 1.00 H new ATOM 0 HG21 VAL A 20 7.290 -1.746 4.998 1.00 1.00 H new ATOM 0 HG22 VAL A 20 7.741 -0.360 6.020 1.00 1.00 H new ATOM 0 HG23 VAL A 20 8.938 -1.627 5.660 1.00 1.00 H new ATOM 305 N ILE A 21 7.995 -3.665 9.775 1.00 1.00 N ATOM 306 CA ILE A 21 7.516 -4.366 10.959 1.00 1.00 C ATOM 307 C ILE A 21 7.923 -3.603 12.215 1.00 1.00 C ATOM 308 O ILE A 21 7.182 -3.562 13.194 1.00 1.00 O ATOM 309 CB ILE A 21 8.094 -5.785 10.996 1.00 1.00 C ATOM 310 CG1 ILE A 21 7.508 -6.604 9.840 1.00 1.00 C ATOM 311 CG2 ILE A 21 7.736 -6.453 12.326 1.00 1.00 C ATOM 312 CD1 ILE A 21 8.266 -7.931 9.702 1.00 1.00 C ATOM 0 H ILE A 21 8.546 -4.237 9.135 1.00 1.00 H new ATOM 0 HA ILE A 21 6.428 -4.428 10.920 1.00 1.00 H new ATOM 0 HB ILE A 21 9.178 -5.736 10.897 1.00 1.00 H new ATOM 0 HG12 ILE A 21 6.450 -6.797 10.019 1.00 1.00 H new ATOM 0 HG13 ILE A 21 7.576 -6.038 8.911 1.00 1.00 H new ATOM 0 HG21 ILE A 21 8.148 -7.462 12.349 1.00 1.00 H new ATOM 0 HG22 ILE A 21 8.152 -5.872 13.149 1.00 1.00 H new ATOM 0 HG23 ILE A 21 6.652 -6.502 12.428 1.00 1.00 H new ATOM 0 HD11 ILE A 21 7.844 -8.507 8.879 1.00 1.00 H new ATOM 0 HD12 ILE A 21 9.318 -7.730 9.502 1.00 1.00 H new ATOM 0 HD13 ILE A 21 8.175 -8.500 10.627 1.00 1.00 H new ATOM 324 N LYS A 22 9.097 -2.982 12.169 1.00 1.00 N ATOM 325 CA LYS A 22 9.581 -2.202 13.298 1.00 1.00 C ATOM 326 C LYS A 22 8.714 -0.957 13.489 1.00 1.00 C ATOM 327 O LYS A 22 8.402 -0.574 14.616 1.00 1.00 O ATOM 328 CB LYS A 22 11.038 -1.797 13.078 1.00 1.00 C ATOM 329 CG LYS A 22 11.936 -3.022 13.252 1.00 1.00 C ATOM 330 CD LYS A 22 13.396 -2.621 13.032 1.00 1.00 C ATOM 331 CE LYS A 22 14.291 -3.854 13.171 1.00 1.00 C ATOM 332 NZ LYS A 22 14.265 -4.327 14.585 1.00 1.00 N ATOM 0 H LYS A 22 9.726 -3.004 11.367 1.00 1.00 H new ATOM 0 HA LYS A 22 9.520 -2.816 14.197 1.00 1.00 H new ATOM 0 HB2 LYS A 22 11.164 -1.379 12.079 1.00 1.00 H new ATOM 0 HB3 LYS A 22 11.322 -1.020 13.787 1.00 1.00 H new ATOM 0 HG2 LYS A 22 11.809 -3.440 14.251 1.00 1.00 H new ATOM 0 HG3 LYS A 22 11.650 -3.799 12.543 1.00 1.00 H new ATOM 0 HD2 LYS A 22 13.518 -2.180 12.043 1.00 1.00 H new ATOM 0 HD3 LYS A 22 13.689 -1.862 13.758 1.00 1.00 H new ATOM 0 HE2 LYS A 22 13.946 -4.645 12.505 1.00 1.00 H new ATOM 0 HE3 LYS A 22 15.312 -3.611 12.876 1.00 1.00 H new ATOM 0 HZ1 LYS A 22 15.079 -4.951 14.757 1.00 1.00 H new ATOM 0 HZ2 LYS A 22 14.314 -3.509 15.226 1.00 1.00 H new ATOM 0 HZ3 LYS A 22 13.384 -4.851 14.760 1.00 1.00 H new ATOM 346 N GLN A 23 8.335 -0.331 12.377 1.00 1.00 N ATOM 347 CA GLN A 23 7.512 0.869 12.428 1.00 1.00 C ATOM 348 C GLN A 23 6.145 0.543 13.026 1.00 1.00 C ATOM 349 O GLN A 23 5.658 1.247 13.910 1.00 1.00 O ATOM 350 CB GLN A 23 7.332 1.431 11.016 1.00 1.00 C ATOM 351 CG GLN A 23 8.680 1.875 10.465 1.00 1.00 C ATOM 352 CD GLN A 23 8.537 2.322 9.017 1.00 1.00 C ATOM 353 OE1 GLN A 23 7.704 1.792 8.283 1.00 1.00 O ATOM 354 NE2 GLN A 23 9.306 3.272 8.555 1.00 1.00 N ATOM 0 H GLN A 23 8.584 -0.635 11.436 1.00 1.00 H new ATOM 0 HA GLN A 23 8.007 1.611 13.055 1.00 1.00 H new ATOM 0 HB2 GLN A 23 6.894 0.674 10.366 1.00 1.00 H new ATOM 0 HB3 GLN A 23 6.641 2.273 11.035 1.00 1.00 H new ATOM 0 HG2 GLN A 23 9.076 2.692 11.068 1.00 1.00 H new ATOM 0 HG3 GLN A 23 9.395 1.055 10.531 1.00 1.00 H new ATOM 0 HE21 GLN A 23 9.996 3.711 9.164 1.00 1.00 H new ATOM 0 HE22 GLN A 23 9.216 3.575 7.585 1.00 1.00 H new ATOM 363 N LEU A 24 5.533 -0.531 12.536 1.00 1.00 N ATOM 364 CA LEU A 24 4.226 -0.946 13.028 1.00 1.00 C ATOM 365 C LEU A 24 4.290 -1.286 14.508 1.00 1.00 C ATOM 366 O LEU A 24 3.401 -0.924 15.275 1.00 1.00 O ATOM 367 CB LEU A 24 3.737 -2.165 12.240 1.00 1.00 C ATOM 368 CG LEU A 24 3.362 -1.745 10.813 1.00 1.00 C ATOM 369 CD1 LEU A 24 3.128 -2.997 9.961 1.00 1.00 C ATOM 370 CD2 LEU A 24 2.081 -0.878 10.822 1.00 1.00 C ATOM 0 H LEU A 24 5.919 -1.126 11.803 1.00 1.00 H new ATOM 0 HA LEU A 24 3.529 -0.120 12.891 1.00 1.00 H new ATOM 0 HB2 LEU A 24 4.515 -2.927 12.212 1.00 1.00 H new ATOM 0 HB3 LEU A 24 2.874 -2.609 12.737 1.00 1.00 H new ATOM 0 HG LEU A 24 4.178 -1.157 10.392 1.00 1.00 H new ATOM 0 HD11 LEU A 24 2.861 -2.702 8.946 1.00 1.00 H new ATOM 0 HD12 LEU A 24 4.038 -3.596 9.937 1.00 1.00 H new ATOM 0 HD13 LEU A 24 2.318 -3.585 10.393 1.00 1.00 H new ATOM 0 HD21 LEU A 24 1.830 -0.589 9.801 1.00 1.00 H new ATOM 0 HD22 LEU A 24 1.258 -1.450 11.250 1.00 1.00 H new ATOM 0 HD23 LEU A 24 2.251 0.017 11.421 1.00 1.00 H new ATOM 382 N ASP A 25 5.348 -1.976 14.905 1.00 1.00 N ATOM 383 CA ASP A 25 5.517 -2.356 16.302 1.00 1.00 C ATOM 384 C ASP A 25 5.526 -1.118 17.190 1.00 1.00 C ATOM 385 O ASP A 25 4.930 -1.111 18.265 1.00 1.00 O ATOM 386 CB ASP A 25 6.832 -3.117 16.473 1.00 1.00 C ATOM 387 CG ASP A 25 6.901 -3.732 17.866 1.00 1.00 C ATOM 388 OD1 ASP A 25 6.060 -4.560 18.168 1.00 1.00 O ATOM 389 OD2 ASP A 25 7.796 -3.363 18.610 1.00 1.00 O ATOM 0 H ASP A 25 6.098 -2.283 14.286 1.00 1.00 H new ATOM 0 HA ASP A 25 4.684 -2.995 16.595 1.00 1.00 H new ATOM 0 HB2 ASP A 25 6.910 -3.898 15.717 1.00 1.00 H new ATOM 0 HB3 ASP A 25 7.675 -2.442 16.322 1.00 1.00 H new ATOM 395 N ASP A 26 6.201 -0.068 16.733 1.00 1.00 N ATOM 396 CA ASP A 26 6.275 1.170 17.501 1.00 1.00 C ATOM 397 C ASP A 26 4.870 1.710 17.760 1.00 1.00 C ATOM 398 O ASP A 26 4.572 2.189 18.853 1.00 1.00 O ATOM 399 CB ASP A 26 7.096 2.210 16.735 1.00 1.00 C ATOM 400 CG ASP A 26 7.454 3.373 17.654 1.00 1.00 C ATOM 401 OD1 ASP A 26 6.782 3.537 18.658 1.00 1.00 O ATOM 402 OD2 ASP A 26 8.399 4.080 17.342 1.00 1.00 O ATOM 0 H ASP A 26 6.700 -0.049 15.844 1.00 1.00 H new ATOM 0 HA ASP A 26 6.759 0.965 18.456 1.00 1.00 H new ATOM 0 HB2 ASP A 26 8.005 1.752 16.344 1.00 1.00 H new ATOM 0 HB3 ASP A 26 6.529 2.574 15.878 1.00 1.00 H new ATOM 408 N LEU A 27 4.015 1.626 16.748 1.00 1.00 N ATOM 409 CA LEU A 27 2.641 2.102 16.876 1.00 1.00 C ATOM 410 C LEU A 27 1.829 1.167 17.763 1.00 1.00 C ATOM 411 O LEU A 27 0.901 1.599 18.444 1.00 1.00 O ATOM 412 CB LEU A 27 1.990 2.194 15.495 1.00 1.00 C ATOM 413 CG LEU A 27 2.785 3.173 14.620 1.00 1.00 C ATOM 414 CD1 LEU A 27 2.222 3.151 13.196 1.00 1.00 C ATOM 415 CD2 LEU A 27 2.685 4.601 15.189 1.00 1.00 C ATOM 0 H LEU A 27 4.246 1.235 15.834 1.00 1.00 H new ATOM 0 HA LEU A 27 2.661 3.091 17.335 1.00 1.00 H new ATOM 0 HB2 LEU A 27 1.964 1.210 15.027 1.00 1.00 H new ATOM 0 HB3 LEU A 27 0.957 2.530 15.589 1.00 1.00 H new ATOM 0 HG LEU A 27 3.832 2.870 14.609 1.00 1.00 H new ATOM 0 HD11 LEU A 27 2.784 3.845 12.572 1.00 1.00 H new ATOM 0 HD12 LEU A 27 2.307 2.144 12.787 1.00 1.00 H new ATOM 0 HD13 LEU A 27 1.173 3.448 13.215 1.00 1.00 H new ATOM 0 HD21 LEU A 27 3.254 5.285 14.558 1.00 1.00 H new ATOM 0 HD22 LEU A 27 1.640 4.912 15.211 1.00 1.00 H new ATOM 0 HD23 LEU A 27 3.090 4.619 16.201 1.00 1.00 H new ATOM 427 N GLU A 28 2.183 -0.114 17.748 1.00 1.00 N ATOM 428 CA GLU A 28 1.479 -1.099 18.551 1.00 1.00 C ATOM 429 C GLU A 28 1.780 -0.905 20.032 1.00 1.00 C ATOM 430 O GLU A 28 0.892 -1.023 20.874 1.00 1.00 O ATOM 431 CB GLU A 28 1.906 -2.504 18.119 1.00 1.00 C ATOM 432 CG GLU A 28 1.306 -2.825 16.749 1.00 1.00 C ATOM 433 CD GLU A 28 1.938 -4.092 16.190 1.00 1.00 C ATOM 434 OE1 GLU A 28 2.511 -4.016 15.115 1.00 1.00 O ATOM 435 OE2 GLU A 28 1.842 -5.120 16.841 1.00 1.00 O ATOM 0 H GLU A 28 2.950 -0.490 17.190 1.00 1.00 H new ATOM 0 HA GLU A 28 0.407 -0.973 18.398 1.00 1.00 H new ATOM 0 HB2 GLU A 28 2.993 -2.567 18.075 1.00 1.00 H new ATOM 0 HB3 GLU A 28 1.574 -3.238 18.853 1.00 1.00 H new ATOM 0 HG2 GLU A 28 0.227 -2.954 16.836 1.00 1.00 H new ATOM 0 HG3 GLU A 28 1.473 -1.993 16.065 1.00 1.00 H new ATOM 443 N VAL A 29 3.040 -0.616 20.345 1.00 1.00 N ATOM 444 CA VAL A 29 3.439 -0.416 21.730 1.00 1.00 C ATOM 445 C VAL A 29 2.798 0.841 22.310 1.00 1.00 C ATOM 446 O VAL A 29 2.211 0.809 23.392 1.00 1.00 O ATOM 447 CB VAL A 29 4.962 -0.296 21.822 1.00 1.00 C ATOM 448 CG1 VAL A 29 5.370 0.025 23.261 1.00 1.00 C ATOM 449 CG2 VAL A 29 5.605 -1.617 21.393 1.00 1.00 C ATOM 0 H VAL A 29 3.793 -0.516 19.665 1.00 1.00 H new ATOM 0 HA VAL A 29 3.100 -1.277 22.306 1.00 1.00 H new ATOM 0 HB VAL A 29 5.300 0.505 21.165 1.00 1.00 H new ATOM 0 HG11 VAL A 29 6.455 0.109 23.321 1.00 1.00 H new ATOM 0 HG12 VAL A 29 4.915 0.967 23.567 1.00 1.00 H new ATOM 0 HG13 VAL A 29 5.031 -0.773 23.922 1.00 1.00 H new ATOM 0 HG21 VAL A 29 6.690 -1.532 21.458 1.00 1.00 H new ATOM 0 HG22 VAL A 29 5.264 -2.418 22.049 1.00 1.00 H new ATOM 0 HG23 VAL A 29 5.320 -1.844 20.366 1.00 1.00 H new ATOM 459 N GLN A 30 2.914 1.947 21.580 1.00 1.00 N ATOM 460 CA GLN A 30 2.348 3.210 22.036 1.00 1.00 C ATOM 461 C GLN A 30 0.836 3.099 22.178 1.00 1.00 C ATOM 462 O GLN A 30 0.263 3.541 23.173 1.00 1.00 O ATOM 463 CB GLN A 30 2.686 4.319 21.039 1.00 1.00 C ATOM 464 CG GLN A 30 4.201 4.515 20.980 1.00 1.00 C ATOM 465 CD GLN A 30 4.716 5.036 22.318 1.00 1.00 C ATOM 466 OE1 GLN A 30 4.220 6.043 22.824 1.00 1.00 O ATOM 467 NE2 GLN A 30 5.685 4.408 22.924 1.00 1.00 N ATOM 0 H GLN A 30 3.390 1.994 20.679 1.00 1.00 H new ATOM 0 HA GLN A 30 2.776 3.449 23.009 1.00 1.00 H new ATOM 0 HB2 GLN A 30 2.304 4.062 20.051 1.00 1.00 H new ATOM 0 HB3 GLN A 30 2.201 5.249 21.336 1.00 1.00 H new ATOM 0 HG2 GLN A 30 4.688 3.571 20.737 1.00 1.00 H new ATOM 0 HG3 GLN A 30 4.454 5.218 20.186 1.00 1.00 H new ATOM 0 HE21 GLN A 30 6.094 3.574 22.503 1.00 1.00 H new ATOM 0 HE22 GLN A 30 6.034 4.751 23.819 1.00 1.00 H new ATOM 476 N ARG A 31 0.195 2.506 21.175 1.00 1.00 N ATOM 477 CA ARG A 31 -1.255 2.341 21.198 1.00 1.00 C ATOM 478 C ARG A 31 -1.644 1.087 21.972 1.00 1.00 C ATOM 479 O ARG A 31 -2.805 0.911 22.342 1.00 1.00 O ATOM 480 CB ARG A 31 -1.791 2.256 19.768 1.00 1.00 C ATOM 481 CG ARG A 31 -1.497 3.565 19.034 1.00 1.00 C ATOM 482 CD ARG A 31 -2.008 3.473 17.596 1.00 1.00 C ATOM 483 NE ARG A 31 -3.464 3.380 17.587 1.00 1.00 N ATOM 484 CZ ARG A 31 -4.145 3.364 16.446 1.00 1.00 C ATOM 485 NH1 ARG A 31 -3.512 3.441 15.309 1.00 1.00 N ATOM 486 NH2 ARG A 31 -5.447 3.276 16.462 1.00 1.00 N ATOM 0 H ARG A 31 0.652 2.134 20.342 1.00 1.00 H new ATOM 0 HA ARG A 31 -1.693 3.205 21.698 1.00 1.00 H new ATOM 0 HB2 ARG A 31 -1.327 1.421 19.244 1.00 1.00 H new ATOM 0 HB3 ARG A 31 -2.864 2.067 19.781 1.00 1.00 H new ATOM 0 HG2 ARG A 31 -1.977 4.398 19.548 1.00 1.00 H new ATOM 0 HG3 ARG A 31 -0.425 3.763 19.038 1.00 1.00 H new ATOM 0 HD2 ARG A 31 -1.688 4.349 17.031 1.00 1.00 H new ATOM 0 HD3 ARG A 31 -1.577 2.601 17.104 1.00 1.00 H new ATOM 0 HE ARG A 31 -3.968 3.326 18.472 1.00 1.00 H new ATOM 0 HH11 ARG A 31 -2.495 3.513 15.296 1.00 1.00 H new ATOM 0 HH12 ARG A 31 -4.034 3.429 14.433 1.00 1.00 H new ATOM 0 HH21 ARG A 31 -5.943 3.219 17.351 1.00 1.00 H new ATOM 0 HH22 ARG A 31 -5.968 3.264 15.585 1.00 1.00 H new ATOM 500 N ASN A 32 -0.667 0.219 22.216 1.00 1.00 N ATOM 501 CA ASN A 32 -0.921 -1.013 22.949 1.00 1.00 C ATOM 502 C ASN A 32 -2.025 -1.809 22.284 1.00 1.00 C ATOM 503 O ASN A 32 -2.887 -2.374 22.958 1.00 1.00 O ATOM 504 CB ASN A 32 -1.314 -0.694 24.387 1.00 1.00 C ATOM 505 CG ASN A 32 -0.262 0.204 25.026 1.00 1.00 C ATOM 506 OD1 ASN A 32 -0.405 1.426 25.025 1.00 1.00 O ATOM 507 ND2 ASN A 32 0.793 -0.333 25.576 1.00 1.00 N ATOM 0 H ASN A 32 0.300 0.346 21.919 1.00 1.00 H new ATOM 0 HA ASN A 32 -0.008 -1.609 22.948 1.00 1.00 H new ATOM 0 HB2 ASN A 32 -2.286 -0.201 24.407 1.00 1.00 H new ATOM 0 HB3 ASN A 32 -1.413 -1.616 24.959 1.00 1.00 H new ATOM 0 HD21 ASN A 32 1.502 0.261 26.007 1.00 1.00 H new ATOM 0 HD22 ASN A 32 0.909 -1.346 25.575 1.00 1.00 H new ATOM 514 N LEU A 33 -2.001 -1.851 20.951 1.00 1.00 N ATOM 515 CA LEU A 33 -3.019 -2.585 20.200 1.00 1.00 C ATOM 516 C LEU A 33 -2.379 -3.446 19.116 1.00 1.00 C ATOM 517 O LEU A 33 -1.311 -3.118 18.604 1.00 1.00 O ATOM 518 CB LEU A 33 -4.004 -1.596 19.562 1.00 1.00 C ATOM 519 CG LEU A 33 -5.023 -1.121 20.617 1.00 1.00 C ATOM 520 CD1 LEU A 33 -5.623 0.217 20.187 1.00 1.00 C ATOM 521 CD2 LEU A 33 -6.152 -2.155 20.775 1.00 1.00 C ATOM 0 H LEU A 33 -1.296 -1.391 20.375 1.00 1.00 H new ATOM 0 HA LEU A 33 -3.552 -3.239 20.890 1.00 1.00 H new ATOM 0 HB2 LEU A 33 -3.463 -0.742 19.155 1.00 1.00 H new ATOM 0 HB3 LEU A 33 -4.523 -2.071 18.730 1.00 1.00 H new ATOM 0 HG LEU A 33 -4.509 -1.006 21.571 1.00 1.00 H new ATOM 0 HD11 LEU A 33 -6.343 0.550 20.935 1.00 1.00 H new ATOM 0 HD12 LEU A 33 -4.829 0.958 20.092 1.00 1.00 H new ATOM 0 HD13 LEU A 33 -6.126 0.099 19.227 1.00 1.00 H new ATOM 0 HD21 LEU A 33 -6.863 -1.805 21.523 1.00 1.00 H new ATOM 0 HD22 LEU A 33 -6.663 -2.284 19.821 1.00 1.00 H new ATOM 0 HD23 LEU A 33 -5.730 -3.108 21.093 1.00 1.00 H new ATOM 533 N PRO A 34 -3.020 -4.534 18.759 1.00 1.00 N ATOM 534 CA PRO A 34 -2.505 -5.462 17.707 1.00 1.00 C ATOM 535 C PRO A 34 -2.414 -4.789 16.340 1.00 1.00 C ATOM 536 O PRO A 34 -3.176 -3.870 16.035 1.00 1.00 O ATOM 537 CB PRO A 34 -3.536 -6.610 17.692 1.00 1.00 C ATOM 538 CG PRO A 34 -4.775 -6.037 18.307 1.00 1.00 C ATOM 539 CD PRO A 34 -4.303 -5.004 19.317 1.00 1.00 C ATOM 0 HA PRO A 34 -1.491 -5.800 17.921 1.00 1.00 H new ATOM 0 HB2 PRO A 34 -3.725 -6.955 16.676 1.00 1.00 H new ATOM 0 HB3 PRO A 34 -3.177 -7.469 18.259 1.00 1.00 H new ATOM 0 HG2 PRO A 34 -5.411 -5.579 17.549 1.00 1.00 H new ATOM 0 HG3 PRO A 34 -5.366 -6.815 18.791 1.00 1.00 H new ATOM 0 HD2 PRO A 34 -5.018 -4.188 19.420 1.00 1.00 H new ATOM 0 HD3 PRO A 34 -4.173 -5.441 20.307 1.00 1.00 H new ATOM 547 N ARG A 35 -1.483 -5.260 15.519 1.00 1.00 N ATOM 548 CA ARG A 35 -1.304 -4.710 14.183 1.00 1.00 C ATOM 549 C ARG A 35 -2.544 -4.966 13.336 1.00 1.00 C ATOM 550 O ARG A 35 -3.017 -4.071 12.633 1.00 1.00 O ATOM 551 CB ARG A 35 -0.084 -5.353 13.528 1.00 1.00 C ATOM 552 CG ARG A 35 -0.363 -6.832 13.241 1.00 1.00 C ATOM 553 CD ARG A 35 0.950 -7.547 12.927 1.00 1.00 C ATOM 554 NE ARG A 35 1.774 -7.622 14.129 1.00 1.00 N ATOM 555 CZ ARG A 35 3.059 -7.955 14.062 1.00 1.00 C ATOM 556 NH1 ARG A 35 3.603 -8.219 12.906 1.00 1.00 N ATOM 557 NH2 ARG A 35 3.775 -8.017 15.150 1.00 1.00 N ATOM 0 H ARG A 35 -0.843 -6.019 15.755 1.00 1.00 H new ATOM 0 HA ARG A 35 -1.151 -3.633 14.258 1.00 1.00 H new ATOM 0 HB2 ARG A 35 0.158 -4.833 12.601 1.00 1.00 H new ATOM 0 HB3 ARG A 35 0.783 -5.258 14.182 1.00 1.00 H new ATOM 0 HG2 ARG A 35 -0.845 -7.296 14.102 1.00 1.00 H new ATOM 0 HG3 ARG A 35 -1.051 -6.927 12.401 1.00 1.00 H new ATOM 0 HD2 ARG A 35 0.747 -8.550 12.551 1.00 1.00 H new ATOM 0 HD3 ARG A 35 1.485 -7.014 12.141 1.00 1.00 H new ATOM 0 HE ARG A 35 1.357 -7.415 15.036 1.00 1.00 H new ATOM 0 HH11 ARG A 35 3.042 -8.170 12.055 1.00 1.00 H new ATOM 0 HH12 ARG A 35 4.589 -8.475 12.853 1.00 1.00 H new ATOM 0 HH21 ARG A 35 3.349 -7.810 16.053 1.00 1.00 H new ATOM 0 HH22 ARG A 35 4.761 -8.273 15.098 1.00 1.00 H new ATOM 571 N ALA A 36 -3.051 -6.193 13.388 1.00 1.00 N ATOM 572 CA ALA A 36 -4.223 -6.553 12.597 1.00 1.00 C ATOM 573 C ALA A 36 -5.285 -5.471 12.714 1.00 1.00 C ATOM 574 O ALA A 36 -5.921 -5.106 11.727 1.00 1.00 O ATOM 575 CB ALA A 36 -4.791 -7.884 13.097 1.00 1.00 C ATOM 0 H ALA A 36 -2.675 -6.947 13.962 1.00 1.00 H new ATOM 0 HA ALA A 36 -3.929 -6.651 11.552 1.00 1.00 H new ATOM 0 HB1 ALA A 36 -5.666 -8.151 12.505 1.00 1.00 H new ATOM 0 HB2 ALA A 36 -4.035 -8.663 12.998 1.00 1.00 H new ATOM 0 HB3 ALA A 36 -5.077 -7.787 14.144 1.00 1.00 H new ATOM 581 N ASP A 37 -5.465 -4.953 13.922 1.00 1.00 N ATOM 582 CA ASP A 37 -6.449 -3.899 14.144 1.00 1.00 C ATOM 583 C ASP A 37 -6.021 -2.609 13.443 1.00 1.00 C ATOM 584 O ASP A 37 -6.847 -1.886 12.889 1.00 1.00 O ATOM 585 CB ASP A 37 -6.604 -3.651 15.651 1.00 1.00 C ATOM 586 CG ASP A 37 -7.537 -4.696 16.265 1.00 1.00 C ATOM 587 OD1 ASP A 37 -8.095 -5.483 15.518 1.00 1.00 O ATOM 588 OD2 ASP A 37 -7.675 -4.694 17.477 1.00 1.00 O ATOM 0 H ASP A 37 -4.950 -5.240 14.754 1.00 1.00 H new ATOM 0 HA ASP A 37 -7.405 -4.216 13.728 1.00 1.00 H new ATOM 0 HB2 ASP A 37 -5.629 -3.694 16.136 1.00 1.00 H new ATOM 0 HB3 ASP A 37 -7.002 -2.651 15.823 1.00 1.00 H new ATOM 594 N LEU A 38 -4.723 -2.327 13.477 1.00 1.00 N ATOM 595 CA LEU A 38 -4.195 -1.125 12.847 1.00 1.00 C ATOM 596 C LEU A 38 -4.321 -1.213 11.334 1.00 1.00 C ATOM 597 O LEU A 38 -4.629 -0.224 10.669 1.00 1.00 O ATOM 598 CB LEU A 38 -2.726 -0.931 13.239 1.00 1.00 C ATOM 599 CG LEU A 38 -2.626 -0.706 14.757 1.00 1.00 C ATOM 600 CD1 LEU A 38 -1.150 -0.596 15.157 1.00 1.00 C ATOM 601 CD2 LEU A 38 -3.371 0.584 15.160 1.00 1.00 C ATOM 0 H LEU A 38 -4.022 -2.911 13.932 1.00 1.00 H new ATOM 0 HA LEU A 38 -4.775 -0.270 13.193 1.00 1.00 H new ATOM 0 HB2 LEU A 38 -2.143 -1.806 12.951 1.00 1.00 H new ATOM 0 HB3 LEU A 38 -2.306 -0.078 12.706 1.00 1.00 H new ATOM 0 HG LEU A 38 -3.086 -1.549 15.272 1.00 1.00 H new ATOM 0 HD11 LEU A 38 -1.075 -0.436 16.233 1.00 1.00 H new ATOM 0 HD12 LEU A 38 -0.631 -1.517 14.890 1.00 1.00 H new ATOM 0 HD13 LEU A 38 -0.693 0.243 14.633 1.00 1.00 H new ATOM 0 HD21 LEU A 38 -3.291 0.729 16.237 1.00 1.00 H new ATOM 0 HD22 LEU A 38 -2.927 1.436 14.645 1.00 1.00 H new ATOM 0 HD23 LEU A 38 -4.422 0.499 14.883 1.00 1.00 H new ATOM 613 N LEU A 39 -4.070 -2.398 10.795 1.00 1.00 N ATOM 614 CA LEU A 39 -4.148 -2.600 9.356 1.00 1.00 C ATOM 615 C LEU A 39 -5.564 -2.344 8.856 1.00 1.00 C ATOM 616 O LEU A 39 -5.760 -1.668 7.846 1.00 1.00 O ATOM 617 CB LEU A 39 -3.738 -4.032 9.017 1.00 1.00 C ATOM 618 CG LEU A 39 -2.251 -4.239 9.346 1.00 1.00 C ATOM 619 CD1 LEU A 39 -1.889 -5.720 9.180 1.00 1.00 C ATOM 620 CD2 LEU A 39 -1.370 -3.382 8.412 1.00 1.00 C ATOM 0 H LEU A 39 -3.812 -3.228 11.328 1.00 1.00 H new ATOM 0 HA LEU A 39 -3.472 -1.898 8.868 1.00 1.00 H new ATOM 0 HB2 LEU A 39 -4.347 -4.738 9.582 1.00 1.00 H new ATOM 0 HB3 LEU A 39 -3.917 -4.231 7.960 1.00 1.00 H new ATOM 0 HG LEU A 39 -2.072 -3.932 10.377 1.00 1.00 H new ATOM 0 HD11 LEU A 39 -0.834 -5.865 9.414 1.00 1.00 H new ATOM 0 HD12 LEU A 39 -2.497 -6.321 9.856 1.00 1.00 H new ATOM 0 HD13 LEU A 39 -2.079 -6.028 8.152 1.00 1.00 H new ATOM 0 HD21 LEU A 39 -0.320 -3.539 8.657 1.00 1.00 H new ATOM 0 HD22 LEU A 39 -1.548 -3.672 7.376 1.00 1.00 H new ATOM 0 HD23 LEU A 39 -1.619 -2.329 8.542 1.00 1.00 H new ATOM 632 N ARG A 40 -6.544 -2.883 9.570 1.00 1.00 N ATOM 633 CA ARG A 40 -7.938 -2.705 9.185 1.00 1.00 C ATOM 634 C ARG A 40 -8.270 -1.220 9.088 1.00 1.00 C ATOM 635 O ARG A 40 -8.941 -0.784 8.153 1.00 1.00 O ATOM 636 CB ARG A 40 -8.851 -3.375 10.213 1.00 1.00 C ATOM 637 CG ARG A 40 -10.308 -3.231 9.774 1.00 1.00 C ATOM 638 CD ARG A 40 -11.198 -4.055 10.704 1.00 1.00 C ATOM 639 NE ARG A 40 -11.073 -3.583 12.077 1.00 1.00 N ATOM 640 CZ ARG A 40 -11.465 -4.334 13.100 1.00 1.00 C ATOM 641 NH1 ARG A 40 -11.974 -5.518 12.883 1.00 1.00 N ATOM 642 NH2 ARG A 40 -11.337 -3.894 14.321 1.00 1.00 N ATOM 0 H ARG A 40 -6.402 -3.442 10.411 1.00 1.00 H new ATOM 0 HA ARG A 40 -8.097 -3.167 8.211 1.00 1.00 H new ATOM 0 HB2 ARG A 40 -8.593 -4.429 10.312 1.00 1.00 H new ATOM 0 HB3 ARG A 40 -8.709 -2.919 11.193 1.00 1.00 H new ATOM 0 HG2 ARG A 40 -10.606 -2.183 9.800 1.00 1.00 H new ATOM 0 HG3 ARG A 40 -10.425 -3.570 8.745 1.00 1.00 H new ATOM 0 HD2 ARG A 40 -12.237 -3.983 10.381 1.00 1.00 H new ATOM 0 HD3 ARG A 40 -10.918 -5.107 10.648 1.00 1.00 H new ATOM 0 HE ARG A 40 -10.678 -2.660 12.256 1.00 1.00 H new ATOM 0 HH11 ARG A 40 -12.070 -5.865 11.929 1.00 1.00 H new ATOM 0 HH12 ARG A 40 -12.275 -6.095 13.668 1.00 1.00 H new ATOM 0 HH21 ARG A 40 -10.935 -2.972 14.491 1.00 1.00 H new ATOM 0 HH22 ARG A 40 -11.639 -4.472 15.106 1.00 1.00 H new ATOM 656 N GLU A 41 -7.789 -0.447 10.055 1.00 1.00 N ATOM 657 CA GLU A 41 -8.034 0.990 10.064 1.00 1.00 C ATOM 658 C GLU A 41 -7.284 1.666 8.919 1.00 1.00 C ATOM 659 O GLU A 41 -7.784 2.609 8.307 1.00 1.00 O ATOM 660 CB GLU A 41 -7.582 1.588 11.398 1.00 1.00 C ATOM 661 CG GLU A 41 -8.458 1.039 12.526 1.00 1.00 C ATOM 662 CD GLU A 41 -9.886 1.557 12.382 1.00 1.00 C ATOM 663 OE1 GLU A 41 -10.062 2.573 11.729 1.00 1.00 O ATOM 664 OE2 GLU A 41 -10.781 0.929 12.922 1.00 1.00 O ATOM 0 H GLU A 41 -7.231 -0.788 10.838 1.00 1.00 H new ATOM 0 HA GLU A 41 -9.103 1.160 9.935 1.00 1.00 H new ATOM 0 HB2 GLU A 41 -6.536 1.343 11.583 1.00 1.00 H new ATOM 0 HB3 GLU A 41 -7.653 2.675 11.364 1.00 1.00 H new ATOM 0 HG2 GLU A 41 -8.454 -0.051 12.502 1.00 1.00 H new ATOM 0 HG3 GLU A 41 -8.050 1.338 13.492 1.00 1.00 H new ATOM 672 N ALA A 42 -6.082 1.177 8.632 1.00 1.00 N ATOM 673 CA ALA A 42 -5.275 1.744 7.558 1.00 1.00 C ATOM 674 C ALA A 42 -6.035 1.687 6.236 1.00 1.00 C ATOM 675 O ALA A 42 -6.096 2.676 5.505 1.00 1.00 O ATOM 676 CB ALA A 42 -3.966 0.965 7.425 1.00 1.00 C ATOM 0 H ALA A 42 -5.648 0.396 9.124 1.00 1.00 H new ATOM 0 HA ALA A 42 -5.058 2.785 7.799 1.00 1.00 H new ATOM 0 HB1 ALA A 42 -3.368 1.394 6.621 1.00 1.00 H new ATOM 0 HB2 ALA A 42 -3.411 1.024 8.361 1.00 1.00 H new ATOM 0 HB3 ALA A 42 -4.185 -0.078 7.198 1.00 1.00 H new ATOM 682 N VAL A 43 -6.608 0.524 5.934 1.00 1.00 N ATOM 683 CA VAL A 43 -7.355 0.362 4.690 1.00 1.00 C ATOM 684 C VAL A 43 -8.554 1.308 4.660 1.00 1.00 C ATOM 685 O VAL A 43 -8.727 2.081 3.715 1.00 1.00 O ATOM 686 CB VAL A 43 -7.837 -1.084 4.563 1.00 1.00 C ATOM 687 CG1 VAL A 43 -8.787 -1.211 3.366 1.00 1.00 C ATOM 688 CG2 VAL A 43 -6.633 -2.005 4.355 1.00 1.00 C ATOM 0 H VAL A 43 -6.571 -0.308 6.523 1.00 1.00 H new ATOM 0 HA VAL A 43 -6.698 0.602 3.854 1.00 1.00 H new ATOM 0 HB VAL A 43 -8.364 -1.369 5.474 1.00 1.00 H new ATOM 0 HG11 VAL A 43 -9.128 -2.243 3.280 1.00 1.00 H new ATOM 0 HG12 VAL A 43 -9.646 -0.556 3.512 1.00 1.00 H new ATOM 0 HG13 VAL A 43 -8.263 -0.924 2.454 1.00 1.00 H new ATOM 0 HG21 VAL A 43 -6.975 -3.036 4.264 1.00 1.00 H new ATOM 0 HG22 VAL A 43 -6.107 -1.716 3.445 1.00 1.00 H new ATOM 0 HG23 VAL A 43 -5.958 -1.920 5.207 1.00 1.00 H new ATOM 698 N ASP A 44 -9.387 1.237 5.694 1.00 1.00 N ATOM 699 CA ASP A 44 -10.572 2.084 5.764 1.00 1.00 C ATOM 700 C ASP A 44 -10.182 3.548 5.587 1.00 1.00 C ATOM 701 O ASP A 44 -10.755 4.251 4.758 1.00 1.00 O ATOM 702 CB ASP A 44 -11.261 1.895 7.115 1.00 1.00 C ATOM 703 CG ASP A 44 -12.576 2.666 7.145 1.00 1.00 C ATOM 704 OD1 ASP A 44 -12.770 3.499 6.276 1.00 1.00 O ATOM 705 OD2 ASP A 44 -13.372 2.408 8.034 1.00 1.00 O ATOM 0 H ASP A 44 -9.265 0.608 6.488 1.00 1.00 H new ATOM 0 HA ASP A 44 -11.257 1.801 4.965 1.00 1.00 H new ATOM 0 HB2 ASP A 44 -11.447 0.836 7.292 1.00 1.00 H new ATOM 0 HB3 ASP A 44 -10.609 2.242 7.916 1.00 1.00 H new ATOM 711 N GLN A 45 -9.200 3.994 6.363 1.00 1.00 N ATOM 712 CA GLN A 45 -8.737 5.369 6.268 1.00 1.00 C ATOM 713 C GLN A 45 -8.104 5.624 4.904 1.00 1.00 C ATOM 714 O GLN A 45 -8.260 6.700 4.331 1.00 1.00 O ATOM 715 CB GLN A 45 -7.714 5.640 7.379 1.00 1.00 C ATOM 716 CG GLN A 45 -8.446 6.003 8.670 1.00 1.00 C ATOM 717 CD GLN A 45 -9.424 4.897 9.048 1.00 1.00 C ATOM 718 OE1 GLN A 45 -9.059 3.960 9.757 1.00 1.00 O ATOM 719 NE2 GLN A 45 -10.652 4.950 8.612 1.00 1.00 N ATOM 0 H GLN A 45 -8.714 3.427 7.058 1.00 1.00 H new ATOM 0 HA GLN A 45 -9.588 6.040 6.385 1.00 1.00 H new ATOM 0 HB2 GLN A 45 -7.091 4.759 7.537 1.00 1.00 H new ATOM 0 HB3 GLN A 45 -7.049 6.452 7.085 1.00 1.00 H new ATOM 0 HG2 GLN A 45 -7.727 6.153 9.475 1.00 1.00 H new ATOM 0 HG3 GLN A 45 -8.981 6.944 8.541 1.00 1.00 H new ATOM 0 HE21 GLN A 45 -10.951 5.728 8.024 1.00 1.00 H new ATOM 0 HE22 GLN A 45 -11.313 4.213 8.859 1.00 1.00 H new ATOM 728 N TYR A 46 -7.389 4.631 4.394 1.00 1.00 N ATOM 729 CA TYR A 46 -6.736 4.766 3.099 1.00 1.00 C ATOM 730 C TYR A 46 -7.761 5.010 2.009 1.00 1.00 C ATOM 731 O TYR A 46 -7.558 5.858 1.148 1.00 1.00 O ATOM 732 CB TYR A 46 -5.944 3.501 2.777 1.00 1.00 C ATOM 733 CG TYR A 46 -5.413 3.571 1.363 1.00 1.00 C ATOM 734 CD1 TYR A 46 -4.288 4.348 1.070 1.00 1.00 C ATOM 735 CD2 TYR A 46 -6.057 2.860 0.342 1.00 1.00 C ATOM 736 CE1 TYR A 46 -3.808 4.413 -0.245 1.00 1.00 C ATOM 737 CE2 TYR A 46 -5.576 2.925 -0.969 1.00 1.00 C ATOM 738 CZ TYR A 46 -4.451 3.702 -1.263 1.00 1.00 C ATOM 739 OH TYR A 46 -3.978 3.771 -2.556 1.00 1.00 O ATOM 0 H TYR A 46 -7.247 3.731 4.852 1.00 1.00 H new ATOM 0 HA TYR A 46 -6.057 5.618 3.145 1.00 1.00 H new ATOM 0 HB2 TYR A 46 -5.118 3.390 3.480 1.00 1.00 H new ATOM 0 HB3 TYR A 46 -6.581 2.624 2.892 1.00 1.00 H new ATOM 0 HD1 TYR A 46 -3.790 4.897 1.856 1.00 1.00 H new ATOM 0 HD2 TYR A 46 -6.927 2.261 0.568 1.00 1.00 H new ATOM 0 HE1 TYR A 46 -2.940 5.013 -0.473 1.00 1.00 H new ATOM 0 HE2 TYR A 46 -6.073 2.375 -1.755 1.00 1.00 H new ATOM 0 HH TYR A 46 -4.538 3.218 -3.139 1.00 1.00 H new ATOM 749 N LEU A 47 -8.847 4.250 2.038 1.00 1.00 N ATOM 750 CA LEU A 47 -9.887 4.388 1.018 1.00 1.00 C ATOM 751 C LEU A 47 -10.421 5.817 0.980 1.00 1.00 C ATOM 752 O LEU A 47 -10.537 6.415 -0.089 1.00 1.00 O ATOM 753 CB LEU A 47 -11.044 3.423 1.339 1.00 1.00 C ATOM 754 CG LEU A 47 -10.714 2.009 0.814 1.00 1.00 C ATOM 755 CD1 LEU A 47 -11.452 0.957 1.648 1.00 1.00 C ATOM 756 CD2 LEU A 47 -11.152 1.893 -0.657 1.00 1.00 C ATOM 0 H LEU A 47 -9.033 3.539 2.745 1.00 1.00 H new ATOM 0 HA LEU A 47 -9.456 4.150 0.046 1.00 1.00 H new ATOM 0 HB2 LEU A 47 -11.213 3.390 2.415 1.00 1.00 H new ATOM 0 HB3 LEU A 47 -11.966 3.783 0.883 1.00 1.00 H new ATOM 0 HG LEU A 47 -9.640 1.841 0.892 1.00 1.00 H new ATOM 0 HD11 LEU A 47 -11.214 -0.038 1.272 1.00 1.00 H new ATOM 0 HD12 LEU A 47 -11.141 1.035 2.690 1.00 1.00 H new ATOM 0 HD13 LEU A 47 -12.527 1.125 1.577 1.00 1.00 H new ATOM 0 HD21 LEU A 47 -10.919 0.895 -1.028 1.00 1.00 H new ATOM 0 HD22 LEU A 47 -12.225 2.067 -0.732 1.00 1.00 H new ATOM 0 HD23 LEU A 47 -10.622 2.635 -1.254 1.00 1.00 H new ATOM 768 N ILE A 48 -10.741 6.358 2.142 1.00 1.00 N ATOM 769 CA ILE A 48 -11.246 7.722 2.209 1.00 1.00 C ATOM 770 C ILE A 48 -10.131 8.725 1.956 1.00 1.00 C ATOM 771 O ILE A 48 -10.271 9.643 1.149 1.00 1.00 O ATOM 772 CB ILE A 48 -11.866 7.972 3.581 1.00 1.00 C ATOM 773 CG1 ILE A 48 -12.972 6.944 3.840 1.00 1.00 C ATOM 774 CG2 ILE A 48 -12.464 9.379 3.623 1.00 1.00 C ATOM 775 CD1 ILE A 48 -13.400 7.012 5.307 1.00 1.00 C ATOM 0 H ILE A 48 -10.663 5.884 3.042 1.00 1.00 H new ATOM 0 HA ILE A 48 -12.004 7.850 1.436 1.00 1.00 H new ATOM 0 HB ILE A 48 -11.096 7.879 4.347 1.00 1.00 H new ATOM 0 HG12 ILE A 48 -13.826 7.142 3.192 1.00 1.00 H new ATOM 0 HG13 ILE A 48 -12.615 5.942 3.601 1.00 1.00 H new ATOM 0 HG21 ILE A 48 -12.907 9.557 4.603 1.00 1.00 H new ATOM 0 HG22 ILE A 48 -11.680 10.113 3.440 1.00 1.00 H new ATOM 0 HG23 ILE A 48 -13.233 9.471 2.856 1.00 1.00 H new ATOM 0 HD11 ILE A 48 -14.187 6.280 5.491 1.00 1.00 H new ATOM 0 HD12 ILE A 48 -12.545 6.793 5.946 1.00 1.00 H new ATOM 0 HD13 ILE A 48 -13.774 8.011 5.531 1.00 1.00 H new ATOM 1413 N MET B 209 11.397 -10.522 3.196 1.00 1.00 N ATOM 1414 CA MET B 209 10.217 -10.137 3.976 1.00 1.00 C ATOM 1415 C MET B 209 9.999 -11.118 5.118 1.00 1.00 C ATOM 1416 O MET B 209 10.772 -12.059 5.292 1.00 1.00 O ATOM 1417 CB MET B 209 8.984 -10.118 3.078 1.00 1.00 C ATOM 1418 CG MET B 209 9.321 -9.378 1.785 1.00 1.00 C ATOM 1419 SD MET B 209 9.828 -7.675 2.145 1.00 1.00 S ATOM 1420 CE MET B 209 8.360 -6.833 1.503 1.00 1.00 C ATOM 0 HA MET B 209 10.380 -9.141 4.388 1.00 1.00 H new ATOM 0 HB2 MET B 209 8.664 -11.136 2.856 1.00 1.00 H new ATOM 0 HB3 MET B 209 8.155 -9.627 3.587 1.00 1.00 H new ATOM 0 HG2 MET B 209 10.121 -9.899 1.258 1.00 1.00 H new ATOM 0 HG3 MET B 209 8.454 -9.374 1.124 1.00 1.00 H new ATOM 0 HE1 MET B 209 8.278 -5.847 1.959 1.00 1.00 H new ATOM 0 HE2 MET B 209 8.445 -6.727 0.422 1.00 1.00 H new ATOM 0 HE3 MET B 209 7.472 -7.418 1.741 1.00 1.00 H new ATOM 1430 N GLY B 210 8.945 -10.887 5.897 1.00 1.00 N ATOM 1431 CA GLY B 210 8.622 -11.755 7.030 1.00 1.00 C ATOM 1432 C GLY B 210 7.293 -12.456 6.821 1.00 1.00 C ATOM 1433 O GLY B 210 6.920 -13.330 7.600 1.00 1.00 O ATOM 0 H GLY B 210 8.300 -10.108 5.766 1.00 1.00 H new ATOM 0 HA2 GLY B 210 9.411 -12.496 7.161 1.00 1.00 H new ATOM 0 HA3 GLY B 210 8.585 -11.164 7.945 1.00 1.00 H new ATOM 1437 N ARG B 211 6.585 -12.067 5.766 1.00 1.00 N ATOM 1438 CA ARG B 211 5.287 -12.665 5.459 1.00 1.00 C ATOM 1439 C ARG B 211 4.329 -12.486 6.630 1.00 1.00 C ATOM 1440 O ARG B 211 4.684 -12.727 7.781 1.00 1.00 O ATOM 1441 CB ARG B 211 5.450 -14.161 5.169 1.00 1.00 C ATOM 1442 CG ARG B 211 4.103 -14.753 4.734 1.00 1.00 C ATOM 1443 CD ARG B 211 4.241 -16.261 4.550 1.00 1.00 C ATOM 1444 NE ARG B 211 4.483 -16.904 5.837 1.00 1.00 N ATOM 1445 CZ ARG B 211 4.670 -18.217 5.926 1.00 1.00 C ATOM 1446 NH1 ARG B 211 4.643 -18.953 4.849 1.00 1.00 N ATOM 1447 NH2 ARG B 211 4.881 -18.770 7.089 1.00 1.00 N ATOM 0 H ARG B 211 6.884 -11.344 5.111 1.00 1.00 H new ATOM 0 HA ARG B 211 4.880 -12.165 4.580 1.00 1.00 H new ATOM 0 HB2 ARG B 211 6.194 -14.311 4.386 1.00 1.00 H new ATOM 0 HB3 ARG B 211 5.815 -14.676 6.058 1.00 1.00 H new ATOM 0 HG2 ARG B 211 3.341 -14.536 5.482 1.00 1.00 H new ATOM 0 HG3 ARG B 211 3.776 -14.291 3.802 1.00 1.00 H new ATOM 0 HD2 ARG B 211 3.335 -16.664 4.098 1.00 1.00 H new ATOM 0 HD3 ARG B 211 5.062 -16.478 3.866 1.00 1.00 H new ATOM 0 HE ARG B 211 4.509 -16.336 6.684 1.00 1.00 H new ATOM 0 HH11 ARG B 211 4.479 -18.521 3.940 1.00 1.00 H new ATOM 0 HH12 ARG B 211 4.786 -19.961 4.916 1.00 1.00 H new ATOM 0 HH21 ARG B 211 4.903 -18.195 7.931 1.00 1.00 H new ATOM 0 HH22 ARG B 211 5.024 -19.778 7.156 1.00 1.00 H new ATOM 1461 N ILE B 212 3.104 -12.069 6.331 1.00 1.00 N ATOM 1462 CA ILE B 212 2.090 -11.867 7.366 1.00 1.00 C ATOM 1463 C ILE B 212 0.733 -12.338 6.868 1.00 1.00 C ATOM 1464 O ILE B 212 0.481 -12.378 5.666 1.00 1.00 O ATOM 1465 CB ILE B 212 2.009 -10.389 7.750 1.00 1.00 C ATOM 1466 CG1 ILE B 212 3.309 -9.970 8.448 1.00 1.00 C ATOM 1467 CG2 ILE B 212 0.826 -10.164 8.697 1.00 1.00 C ATOM 1468 CD1 ILE B 212 3.327 -8.455 8.648 1.00 1.00 C ATOM 0 H ILE B 212 2.787 -11.864 5.384 1.00 1.00 H new ATOM 0 HA ILE B 212 2.373 -12.448 8.244 1.00 1.00 H new ATOM 0 HB ILE B 212 1.869 -9.791 6.850 1.00 1.00 H new ATOM 0 HG12 ILE B 212 3.394 -10.474 9.411 1.00 1.00 H new ATOM 0 HG13 ILE B 212 4.168 -10.277 7.851 1.00 1.00 H new ATOM 0 HG21 ILE B 212 0.772 -9.110 8.968 1.00 1.00 H new ATOM 0 HG22 ILE B 212 -0.099 -10.459 8.201 1.00 1.00 H new ATOM 0 HG23 ILE B 212 0.961 -10.763 9.597 1.00 1.00 H new ATOM 0 HD11 ILE B 212 4.253 -8.164 9.144 1.00 1.00 H new ATOM 0 HD12 ILE B 212 3.263 -7.959 7.679 1.00 1.00 H new ATOM 0 HD13 ILE B 212 2.477 -8.159 9.263 1.00 1.00 H new ATOM 1480 N LEU B 213 -0.135 -12.697 7.806 1.00 1.00 N ATOM 1481 CA LEU B 213 -1.479 -13.174 7.469 1.00 1.00 C ATOM 1482 C LEU B 213 -2.527 -12.200 7.957 1.00 1.00 C ATOM 1483 O LEU B 213 -2.416 -11.641 9.049 1.00 1.00 O ATOM 1484 CB LEU B 213 -1.716 -14.548 8.106 1.00 1.00 C ATOM 1485 CG LEU B 213 -2.921 -15.222 7.440 1.00 1.00 C ATOM 1486 CD1 LEU B 213 -2.501 -15.876 6.101 1.00 1.00 C ATOM 1487 CD2 LEU B 213 -3.494 -16.292 8.375 1.00 1.00 C ATOM 0 H LEU B 213 0.063 -12.668 8.806 1.00 1.00 H new ATOM 0 HA LEU B 213 -1.557 -13.256 6.385 1.00 1.00 H new ATOM 0 HB2 LEU B 213 -0.829 -15.171 7.992 1.00 1.00 H new ATOM 0 HB3 LEU B 213 -1.893 -14.438 9.176 1.00 1.00 H new ATOM 0 HG LEU B 213 -3.680 -14.466 7.240 1.00 1.00 H new ATOM 0 HD11 LEU B 213 -3.367 -16.350 5.640 1.00 1.00 H new ATOM 0 HD12 LEU B 213 -2.106 -15.112 5.431 1.00 1.00 H new ATOM 0 HD13 LEU B 213 -1.733 -16.627 6.288 1.00 1.00 H new ATOM 0 HD21 LEU B 213 -4.351 -16.770 7.899 1.00 1.00 H new ATOM 0 HD22 LEU B 213 -2.730 -17.041 8.583 1.00 1.00 H new ATOM 0 HD23 LEU B 213 -3.810 -15.828 9.309 1.00 1.00 H new ATOM 1499 N LEU B 214 -3.551 -11.999 7.132 1.00 1.00 N ATOM 1500 CA LEU B 214 -4.626 -11.079 7.480 1.00 1.00 C ATOM 1501 C LEU B 214 -5.970 -11.610 6.995 1.00 1.00 C ATOM 1502 O LEU B 214 -6.054 -12.260 5.957 1.00 1.00 O ATOM 1503 CB LEU B 214 -4.341 -9.698 6.848 1.00 1.00 C ATOM 1504 CG LEU B 214 -4.535 -8.590 7.893 1.00 1.00 C ATOM 1505 CD1 LEU B 214 -4.234 -7.236 7.256 1.00 1.00 C ATOM 1506 CD2 LEU B 214 -5.983 -8.611 8.424 1.00 1.00 C ATOM 0 H LEU B 214 -3.658 -12.457 6.227 1.00 1.00 H new ATOM 0 HA LEU B 214 -4.671 -10.982 8.565 1.00 1.00 H new ATOM 0 HB2 LEU B 214 -3.322 -9.670 6.461 1.00 1.00 H new ATOM 0 HB3 LEU B 214 -5.008 -9.532 6.002 1.00 1.00 H new ATOM 0 HG LEU B 214 -3.854 -8.758 8.727 1.00 1.00 H new ATOM 0 HD11 LEU B 214 -4.371 -6.447 7.996 1.00 1.00 H new ATOM 0 HD12 LEU B 214 -3.204 -7.223 6.898 1.00 1.00 H new ATOM 0 HD13 LEU B 214 -4.911 -7.069 6.418 1.00 1.00 H new ATOM 0 HD21 LEU B 214 -6.110 -7.821 9.165 1.00 1.00 H new ATOM 0 HD22 LEU B 214 -6.676 -8.449 7.598 1.00 1.00 H new ATOM 0 HD23 LEU B 214 -6.187 -9.577 8.885 1.00 1.00 H new ATOM 1518 N ASP B 215 -7.025 -11.316 7.753 1.00 1.00 N ATOM 1519 CA ASP B 215 -8.375 -11.752 7.395 1.00 1.00 C ATOM 1520 C ASP B 215 -9.264 -10.551 7.079 1.00 1.00 C ATOM 1521 O ASP B 215 -9.545 -9.733 7.952 1.00 1.00 O ATOM 1522 CB ASP B 215 -8.981 -12.541 8.548 1.00 1.00 C ATOM 1523 CG ASP B 215 -8.304 -13.901 8.651 1.00 1.00 C ATOM 1524 OD1 ASP B 215 -7.537 -14.229 7.761 1.00 1.00 O ATOM 1525 OD2 ASP B 215 -8.563 -14.597 9.619 1.00 1.00 O ATOM 0 H ASP B 215 -6.972 -10.778 8.618 1.00 1.00 H new ATOM 0 HA ASP B 215 -8.311 -12.383 6.509 1.00 1.00 H new ATOM 0 HB2 ASP B 215 -8.859 -11.991 9.481 1.00 1.00 H new ATOM 0 HB3 ASP B 215 -10.052 -12.668 8.391 1.00 1.00 H new ATOM 1531 N LEU B 216 -9.704 -10.461 5.822 1.00 1.00 N ATOM 1532 CA LEU B 216 -10.570 -9.362 5.377 1.00 1.00 C ATOM 1533 C LEU B 216 -11.931 -9.881 4.964 1.00 1.00 C ATOM 1534 O LEU B 216 -12.056 -10.978 4.429 1.00 1.00 O ATOM 1535 CB LEU B 216 -9.907 -8.622 4.198 1.00 1.00 C ATOM 1536 CG LEU B 216 -9.069 -7.446 4.724 1.00 1.00 C ATOM 1537 CD1 LEU B 216 -9.997 -6.359 5.330 1.00 1.00 C ATOM 1538 CD2 LEU B 216 -8.074 -7.951 5.790 1.00 1.00 C ATOM 0 H LEU B 216 -9.476 -11.136 5.092 1.00 1.00 H new ATOM 0 HA LEU B 216 -10.707 -8.670 6.208 1.00 1.00 H new ATOM 0 HB2 LEU B 216 -9.274 -9.309 3.636 1.00 1.00 H new ATOM 0 HB3 LEU B 216 -10.670 -8.257 3.511 1.00 1.00 H new ATOM 0 HG LEU B 216 -8.511 -7.007 3.897 1.00 1.00 H new ATOM 0 HD11 LEU B 216 -9.393 -5.530 5.700 1.00 1.00 H new ATOM 0 HD12 LEU B 216 -10.681 -5.996 4.563 1.00 1.00 H new ATOM 0 HD13 LEU B 216 -10.569 -6.787 6.153 1.00 1.00 H new ATOM 0 HD21 LEU B 216 -7.482 -7.114 6.160 1.00 1.00 H new ATOM 0 HD22 LEU B 216 -8.624 -8.401 6.617 1.00 1.00 H new ATOM 0 HD23 LEU B 216 -7.413 -8.695 5.347 1.00 1.00 H new ATOM 1550 N SER B 217 -12.948 -9.073 5.222 1.00 1.00 N ATOM 1551 CA SER B 217 -14.307 -9.443 4.872 1.00 1.00 C ATOM 1552 C SER B 217 -14.406 -9.686 3.371 1.00 1.00 C ATOM 1553 O SER B 217 -13.397 -9.907 2.705 1.00 1.00 O ATOM 1554 CB SER B 217 -15.265 -8.325 5.277 1.00 1.00 C ATOM 1555 OG SER B 217 -15.309 -8.232 6.695 1.00 1.00 O ATOM 0 H SER B 217 -12.857 -8.161 5.670 1.00 1.00 H new ATOM 0 HA SER B 217 -14.577 -10.357 5.401 1.00 1.00 H new ATOM 0 HB2 SER B 217 -14.937 -7.377 4.849 1.00 1.00 H new ATOM 0 HB3 SER B 217 -16.262 -8.525 4.883 1.00 1.00 H new ATOM 0 HG SER B 217 -15.922 -7.514 6.957 1.00 1.00 H new ATOM 1561 N ASN B 218 -15.625 -9.643 2.839 1.00 1.00 N ATOM 1562 CA ASN B 218 -15.849 -9.852 1.406 1.00 1.00 C ATOM 1563 C ASN B 218 -16.204 -8.534 0.722 1.00 1.00 C ATOM 1564 O ASN B 218 -16.028 -8.387 -0.486 1.00 1.00 O ATOM 1565 CB ASN B 218 -16.986 -10.856 1.208 1.00 1.00 C ATOM 1566 CG ASN B 218 -16.589 -12.212 1.783 1.00 1.00 C ATOM 1567 OD1 ASN B 218 -15.358 -12.629 1.656 1.00 1.00 O flip ATOM 1568 ND2 ASN B 218 -17.422 -12.911 2.361 1.00 1.00 N flip ATOM 0 H ASN B 218 -16.474 -9.466 3.376 1.00 1.00 H new ATOM 0 HA ASN B 218 -14.933 -10.241 0.960 1.00 1.00 H new ATOM 0 HB2 ASN B 218 -17.891 -10.495 1.697 1.00 1.00 H new ATOM 0 HB3 ASN B 218 -17.215 -10.954 0.147 1.00 1.00 H new ATOM 0 HD21 ASN B 218 -18.383 -12.583 2.459 1.00 1.00 H new ATOM 0 HD22 ASN B 218 -17.151 -13.818 2.742 1.00 1.00 H new ATOM 1575 N GLU B 219 -16.693 -7.580 1.502 1.00 1.00 N ATOM 1576 CA GLU B 219 -17.064 -6.276 0.969 1.00 1.00 C ATOM 1577 C GLU B 219 -15.827 -5.436 0.695 1.00 1.00 C ATOM 1578 O GLU B 219 -15.801 -4.640 -0.237 1.00 1.00 O ATOM 1579 CB GLU B 219 -17.986 -5.538 1.957 1.00 1.00 C ATOM 1580 CG GLU B 219 -19.301 -6.318 2.087 1.00 1.00 C ATOM 1581 CD GLU B 219 -19.123 -7.503 3.032 1.00 1.00 C ATOM 1582 OE1 GLU B 219 -20.105 -8.167 3.312 1.00 1.00 O ATOM 1583 OE2 GLU B 219 -18.011 -7.710 3.492 1.00 1.00 O ATOM 0 H GLU B 219 -16.842 -7.684 2.506 1.00 1.00 H new ATOM 0 HA GLU B 219 -17.597 -6.431 0.031 1.00 1.00 H new ATOM 0 HB2 GLU B 219 -17.502 -5.450 2.930 1.00 1.00 H new ATOM 0 HB3 GLU B 219 -18.182 -4.525 1.605 1.00 1.00 H new ATOM 0 HG2 GLU B 219 -20.086 -5.661 2.461 1.00 1.00 H new ATOM 0 HG3 GLU B 219 -19.621 -6.671 1.107 1.00 1.00 H new ATOM 1591 N VAL B 220 -14.798 -5.624 1.512 1.00 1.00 N ATOM 1592 CA VAL B 220 -13.554 -4.878 1.345 1.00 1.00 C ATOM 1593 C VAL B 220 -12.822 -5.322 0.081 1.00 1.00 C ATOM 1594 O VAL B 220 -12.351 -4.496 -0.699 1.00 1.00 O ATOM 1595 CB VAL B 220 -12.653 -5.100 2.564 1.00 1.00 C ATOM 1596 CG1 VAL B 220 -11.318 -4.386 2.349 1.00 1.00 C ATOM 1597 CG2 VAL B 220 -13.339 -4.536 3.811 1.00 1.00 C ATOM 0 H VAL B 220 -14.798 -6.281 2.292 1.00 1.00 H new ATOM 0 HA VAL B 220 -13.795 -3.819 1.253 1.00 1.00 H new ATOM 0 HB VAL B 220 -12.475 -6.167 2.697 1.00 1.00 H new ATOM 0 HG11 VAL B 220 -10.677 -4.544 3.216 1.00 1.00 H new ATOM 0 HG12 VAL B 220 -10.831 -4.786 1.460 1.00 1.00 H new ATOM 0 HG13 VAL B 220 -11.493 -3.318 2.217 1.00 1.00 H new ATOM 0 HG21 VAL B 220 -12.700 -4.693 4.680 1.00 1.00 H new ATOM 0 HG22 VAL B 220 -13.515 -3.469 3.678 1.00 1.00 H new ATOM 0 HG23 VAL B 220 -14.291 -5.045 3.964 1.00 1.00 H new ATOM 1607 N ILE B 221 -12.742 -6.634 -0.123 1.00 1.00 N ATOM 1608 CA ILE B 221 -12.074 -7.174 -1.301 1.00 1.00 C ATOM 1609 C ILE B 221 -12.647 -6.536 -2.560 1.00 1.00 C ATOM 1610 O ILE B 221 -11.930 -6.306 -3.533 1.00 1.00 O ATOM 1611 CB ILE B 221 -12.254 -8.694 -1.353 1.00 1.00 C ATOM 1612 CG1 ILE B 221 -11.667 -9.321 -0.083 1.00 1.00 C ATOM 1613 CG2 ILE B 221 -11.529 -9.253 -2.580 1.00 1.00 C ATOM 1614 CD1 ILE B 221 -12.049 -10.803 -0.014 1.00 1.00 C ATOM 0 H ILE B 221 -13.128 -7.337 0.507 1.00 1.00 H new ATOM 0 HA ILE B 221 -11.010 -6.947 -1.242 1.00 1.00 H new ATOM 0 HB ILE B 221 -13.316 -8.932 -1.419 1.00 1.00 H new ATOM 0 HG12 ILE B 221 -10.582 -9.215 -0.082 1.00 1.00 H new ATOM 0 HG13 ILE B 221 -12.040 -8.798 0.798 1.00 1.00 H new ATOM 0 HG21 ILE B 221 -11.657 -10.335 -2.617 1.00 1.00 H new ATOM 0 HG22 ILE B 221 -11.946 -8.807 -3.483 1.00 1.00 H new ATOM 0 HG23 ILE B 221 -10.467 -9.015 -2.515 1.00 1.00 H new ATOM 0 HD11 ILE B 221 -11.630 -11.245 0.890 1.00 1.00 H new ATOM 0 HD12 ILE B 221 -13.135 -10.898 0.005 1.00 1.00 H new ATOM 0 HD13 ILE B 221 -11.655 -11.321 -0.888 1.00 1.00 H new ATOM 1626 N LYS B 222 -13.942 -6.238 -2.527 1.00 1.00 N ATOM 1627 CA LYS B 222 -14.597 -5.604 -3.662 1.00 1.00 C ATOM 1628 C LYS B 222 -14.089 -4.168 -3.832 1.00 1.00 C ATOM 1629 O LYS B 222 -13.882 -3.705 -4.953 1.00 1.00 O ATOM 1630 CB LYS B 222 -16.113 -5.600 -3.464 1.00 1.00 C ATOM 1631 CG LYS B 222 -16.803 -5.307 -4.799 1.00 1.00 C ATOM 1632 CD LYS B 222 -18.319 -5.415 -4.623 1.00 1.00 C ATOM 1633 CE LYS B 222 -19.007 -5.164 -5.967 1.00 1.00 C ATOM 1634 NZ LYS B 222 -20.483 -5.278 -5.796 1.00 1.00 N ATOM 0 H LYS B 222 -14.554 -6.424 -1.732 1.00 1.00 H new ATOM 0 HA LYS B 222 -14.360 -6.172 -4.562 1.00 1.00 H new ATOM 0 HB2 LYS B 222 -16.442 -6.564 -3.077 1.00 1.00 H new ATOM 0 HB3 LYS B 222 -16.392 -4.848 -2.726 1.00 1.00 H new ATOM 0 HG2 LYS B 222 -16.537 -4.309 -5.147 1.00 1.00 H new ATOM 0 HG3 LYS B 222 -16.463 -6.011 -5.559 1.00 1.00 H new ATOM 0 HD2 LYS B 222 -18.583 -6.403 -4.246 1.00 1.00 H new ATOM 0 HD3 LYS B 222 -18.663 -4.690 -3.885 1.00 1.00 H new ATOM 0 HE2 LYS B 222 -18.749 -4.173 -6.341 1.00 1.00 H new ATOM 0 HE3 LYS B 222 -18.659 -5.885 -6.707 1.00 1.00 H new ATOM 0 HZ1 LYS B 222 -20.952 -5.108 -6.708 1.00 1.00 H new ATOM 0 HZ2 LYS B 222 -20.721 -6.232 -5.457 1.00 1.00 H new ATOM 0 HZ3 LYS B 222 -20.808 -4.574 -5.103 1.00 1.00 H new ATOM 1648 N GLN B 223 -13.901 -3.473 -2.711 1.00 1.00 N ATOM 1649 CA GLN B 223 -13.427 -2.097 -2.745 1.00 1.00 C ATOM 1650 C GLN B 223 -11.997 -2.050 -3.280 1.00 1.00 C ATOM 1651 O GLN B 223 -11.673 -1.238 -4.147 1.00 1.00 O ATOM 1652 CB GLN B 223 -13.470 -1.509 -1.333 1.00 1.00 C ATOM 1653 CG GLN B 223 -14.899 -1.547 -0.808 1.00 1.00 C ATOM 1654 CD GLN B 223 -14.916 -1.277 0.691 1.00 1.00 C ATOM 1655 OE1 GLN B 223 -13.892 -1.422 1.357 1.00 1.00 O ATOM 1656 NE2 GLN B 223 -16.024 -0.898 1.268 1.00 1.00 N ATOM 0 H GLN B 223 -14.070 -3.841 -1.775 1.00 1.00 H new ATOM 0 HA GLN B 223 -14.070 -1.512 -3.403 1.00 1.00 H new ATOM 0 HB2 GLN B 223 -12.814 -2.075 -0.672 1.00 1.00 H new ATOM 0 HB3 GLN B 223 -13.103 -0.483 -1.344 1.00 1.00 H new ATOM 0 HG2 GLN B 223 -15.504 -0.803 -1.326 1.00 1.00 H new ATOM 0 HG3 GLN B 223 -15.344 -2.520 -1.015 1.00 1.00 H new ATOM 0 HE21 GLN B 223 -16.872 -0.778 0.714 1.00 1.00 H new ATOM 0 HE22 GLN B 223 -16.041 -0.722 2.272 1.00 1.00 H new ATOM 1665 N LEU B 224 -11.149 -2.928 -2.756 1.00 1.00 N ATOM 1666 CA LEU B 224 -9.759 -2.984 -3.188 1.00 1.00 C ATOM 1667 C LEU B 224 -9.668 -3.351 -4.660 1.00 1.00 C ATOM 1668 O LEU B 224 -8.877 -2.776 -5.403 1.00 1.00 O ATOM 1669 CB LEU B 224 -8.997 -4.018 -2.354 1.00 1.00 C ATOM 1670 CG LEU B 224 -8.848 -3.509 -0.910 1.00 1.00 C ATOM 1671 CD1 LEU B 224 -8.325 -4.644 -0.015 1.00 1.00 C ATOM 1672 CD2 LEU B 224 -7.865 -2.316 -0.857 1.00 1.00 C ATOM 0 H LEU B 224 -11.398 -3.606 -2.036 1.00 1.00 H new ATOM 0 HA LEU B 224 -9.314 -1.999 -3.045 1.00 1.00 H new ATOM 0 HB2 LEU B 224 -9.529 -4.969 -2.362 1.00 1.00 H new ATOM 0 HB3 LEU B 224 -8.014 -4.199 -2.790 1.00 1.00 H new ATOM 0 HG LEU B 224 -9.823 -3.178 -0.553 1.00 1.00 H new ATOM 0 HD11 LEU B 224 -8.220 -4.282 1.008 1.00 1.00 H new ATOM 0 HD12 LEU B 224 -9.028 -5.476 -0.035 1.00 1.00 H new ATOM 0 HD13 LEU B 224 -7.355 -4.980 -0.382 1.00 1.00 H new ATOM 0 HD21 LEU B 224 -7.771 -1.968 0.172 1.00 1.00 H new ATOM 0 HD22 LEU B 224 -6.889 -2.632 -1.224 1.00 1.00 H new ATOM 0 HD23 LEU B 224 -8.242 -1.506 -1.481 1.00 1.00 H new ATOM 1684 N ASP B 225 -10.486 -4.308 -5.076 1.00 1.00 N ATOM 1685 CA ASP B 225 -10.490 -4.743 -6.469 1.00 1.00 C ATOM 1686 C ASP B 225 -10.860 -3.580 -7.383 1.00 1.00 C ATOM 1687 O ASP B 225 -10.282 -3.416 -8.455 1.00 1.00 O ATOM 1688 CB ASP B 225 -11.496 -5.881 -6.650 1.00 1.00 C ATOM 1689 CG ASP B 225 -11.281 -6.557 -7.999 1.00 1.00 C ATOM 1690 OD1 ASP B 225 -10.158 -6.947 -8.270 1.00 1.00 O ATOM 1691 OD2 ASP B 225 -12.241 -6.671 -8.744 1.00 1.00 O ATOM 0 H ASP B 225 -11.151 -4.796 -4.476 1.00 1.00 H new ATOM 0 HA ASP B 225 -9.493 -5.095 -6.732 1.00 1.00 H new ATOM 0 HB2 ASP B 225 -11.382 -6.609 -5.847 1.00 1.00 H new ATOM 0 HB3 ASP B 225 -12.512 -5.492 -6.587 1.00 1.00 H new ATOM 1697 N ASP B 226 -11.823 -2.773 -6.951 1.00 1.00 N ATOM 1698 CA ASP B 226 -12.256 -1.627 -7.745 1.00 1.00 C ATOM 1699 C ASP B 226 -11.079 -0.690 -7.995 1.00 1.00 C ATOM 1700 O ASP B 226 -10.939 -0.130 -9.082 1.00 1.00 O ATOM 1701 CB ASP B 226 -13.368 -0.875 -7.011 1.00 1.00 C ATOM 1702 CG ASP B 226 -14.009 0.148 -7.941 1.00 1.00 C ATOM 1703 OD1 ASP B 226 -15.015 0.723 -7.558 1.00 1.00 O ATOM 1704 OD2 ASP B 226 -13.485 0.344 -9.025 1.00 1.00 O ATOM 0 H ASP B 226 -12.315 -2.888 -6.065 1.00 1.00 H new ATOM 0 HA ASP B 226 -12.636 -1.984 -8.702 1.00 1.00 H new ATOM 0 HB2 ASP B 226 -14.121 -1.579 -6.657 1.00 1.00 H new ATOM 0 HB3 ASP B 226 -12.961 -0.375 -6.132 1.00 1.00 H new ATOM 1710 N LEU B 227 -10.237 -0.526 -6.982 1.00 1.00 N ATOM 1711 CA LEU B 227 -9.069 0.339 -7.103 1.00 1.00 C ATOM 1712 C LEU B 227 -8.008 -0.311 -7.975 1.00 1.00 C ATOM 1713 O LEU B 227 -7.231 0.378 -8.633 1.00 1.00 O ATOM 1714 CB LEU B 227 -8.489 0.631 -5.718 1.00 1.00 C ATOM 1715 CG LEU B 227 -9.518 1.405 -4.881 1.00 1.00 C ATOM 1716 CD1 LEU B 227 -8.995 1.562 -3.446 1.00 1.00 C ATOM 1717 CD2 LEU B 227 -9.777 2.796 -5.501 1.00 1.00 C ATOM 0 H LEU B 227 -10.339 -0.977 -6.073 1.00 1.00 H new ATOM 0 HA LEU B 227 -9.380 1.274 -7.570 1.00 1.00 H new ATOM 0 HB2 LEU B 227 -8.227 -0.302 -5.219 1.00 1.00 H new ATOM 0 HB3 LEU B 227 -7.571 1.211 -5.812 1.00 1.00 H new ATOM 0 HG LEU B 227 -10.456 0.850 -4.868 1.00 1.00 H new ATOM 0 HD11 LEU B 227 -9.725 2.111 -2.851 1.00 1.00 H new ATOM 0 HD12 LEU B 227 -8.836 0.577 -3.007 1.00 1.00 H new ATOM 0 HD13 LEU B 227 -8.052 2.109 -3.460 1.00 1.00 H new ATOM 0 HD21 LEU B 227 -10.508 3.333 -4.897 1.00 1.00 H new ATOM 0 HD22 LEU B 227 -8.845 3.361 -5.530 1.00 1.00 H new ATOM 0 HD23 LEU B 227 -10.160 2.677 -6.514 1.00 1.00 H new ATOM 1729 N GLU B 228 -7.976 -1.640 -7.976 1.00 1.00 N ATOM 1730 CA GLU B 228 -7.005 -2.369 -8.771 1.00 1.00 C ATOM 1731 C GLU B 228 -7.326 -2.252 -10.256 1.00 1.00 C ATOM 1732 O GLU B 228 -6.429 -2.133 -11.087 1.00 1.00 O ATOM 1733 CB GLU B 228 -7.003 -3.843 -8.353 1.00 1.00 C ATOM 1734 CG GLU B 228 -6.302 -3.995 -7.002 1.00 1.00 C ATOM 1735 CD GLU B 228 -6.337 -5.451 -6.558 1.00 1.00 C ATOM 1736 OE1 GLU B 228 -5.682 -6.261 -7.194 1.00 1.00 O ATOM 1737 OE2 GLU B 228 -7.023 -5.737 -5.590 1.00 1.00 O ATOM 0 H GLU B 228 -8.610 -2.229 -7.436 1.00 1.00 H new ATOM 0 HA GLU B 228 -6.018 -1.939 -8.598 1.00 1.00 H new ATOM 0 HB2 GLU B 228 -8.026 -4.213 -8.286 1.00 1.00 H new ATOM 0 HB3 GLU B 228 -6.495 -4.444 -9.107 1.00 1.00 H new ATOM 0 HG2 GLU B 228 -5.269 -3.654 -7.078 1.00 1.00 H new ATOM 0 HG3 GLU B 228 -6.791 -3.367 -6.257 1.00 1.00 H new ATOM 1745 N VAL B 229 -8.615 -2.299 -10.584 1.00 1.00 N ATOM 1746 CA VAL B 229 -9.033 -2.203 -11.973 1.00 1.00 C ATOM 1747 C VAL B 229 -8.715 -0.824 -12.549 1.00 1.00 C ATOM 1748 O VAL B 229 -8.135 -0.712 -13.628 1.00 1.00 O ATOM 1749 CB VAL B 229 -10.540 -2.465 -12.082 1.00 1.00 C ATOM 1750 CG1 VAL B 229 -11.013 -2.201 -13.515 1.00 1.00 C ATOM 1751 CG2 VAL B 229 -10.834 -3.919 -11.709 1.00 1.00 C ATOM 0 H VAL B 229 -9.377 -2.402 -9.914 1.00 1.00 H new ATOM 0 HA VAL B 229 -8.485 -2.952 -12.544 1.00 1.00 H new ATOM 0 HB VAL B 229 -11.069 -1.798 -11.401 1.00 1.00 H new ATOM 0 HG11 VAL B 229 -12.084 -2.389 -13.585 1.00 1.00 H new ATOM 0 HG12 VAL B 229 -10.809 -1.164 -13.780 1.00 1.00 H new ATOM 0 HG13 VAL B 229 -10.483 -2.862 -14.201 1.00 1.00 H new ATOM 0 HG21 VAL B 229 -11.905 -4.105 -11.787 1.00 1.00 H new ATOM 0 HG22 VAL B 229 -10.300 -4.584 -12.388 1.00 1.00 H new ATOM 0 HG23 VAL B 229 -10.506 -4.106 -10.686 1.00 1.00 H new ATOM 1761 N GLN B 230 -9.105 0.217 -11.822 1.00 1.00 N ATOM 1762 CA GLN B 230 -8.865 1.580 -12.276 1.00 1.00 C ATOM 1763 C GLN B 230 -7.372 1.860 -12.370 1.00 1.00 C ATOM 1764 O GLN B 230 -6.895 2.418 -13.357 1.00 1.00 O ATOM 1765 CB GLN B 230 -9.510 2.572 -11.306 1.00 1.00 C ATOM 1766 CG GLN B 230 -11.032 2.423 -11.352 1.00 1.00 C ATOM 1767 CD GLN B 230 -11.680 3.378 -10.356 1.00 1.00 C ATOM 1768 OE1 GLN B 230 -11.518 4.665 -10.499 1.00 1.00 O flip ATOM 1769 NE2 GLN B 230 -12.359 2.941 -9.427 1.00 1.00 N flip ATOM 0 H GLN B 230 -9.584 0.144 -10.924 1.00 1.00 H new ATOM 0 HA GLN B 230 -9.307 1.696 -13.266 1.00 1.00 H new ATOM 0 HB2 GLN B 230 -9.148 2.393 -10.294 1.00 1.00 H new ATOM 0 HB3 GLN B 230 -9.227 3.591 -11.571 1.00 1.00 H new ATOM 0 HG2 GLN B 230 -11.396 2.632 -12.358 1.00 1.00 H new ATOM 0 HG3 GLN B 230 -11.312 1.396 -11.119 1.00 1.00 H new ATOM 0 HE21 GLN B 230 -12.485 1.935 -9.317 1.00 1.00 H new ATOM 0 HE22 GLN B 230 -12.796 3.585 -8.768 1.00 1.00 H new ATOM 1778 N ARG B 231 -6.636 1.469 -11.333 1.00 1.00 N ATOM 1779 CA ARG B 231 -5.192 1.684 -11.307 1.00 1.00 C ATOM 1780 C ARG B 231 -4.469 0.581 -12.071 1.00 1.00 C ATOM 1781 O ARG B 231 -3.288 0.708 -12.392 1.00 1.00 O ATOM 1782 CB ARG B 231 -4.700 1.720 -9.860 1.00 1.00 C ATOM 1783 CG ARG B 231 -5.234 2.980 -9.172 1.00 1.00 C ATOM 1784 CD ARG B 231 -4.807 2.978 -7.705 1.00 1.00 C ATOM 1785 NE ARG B 231 -5.301 4.174 -7.032 1.00 1.00 N ATOM 1786 CZ ARG B 231 -4.633 5.322 -7.094 1.00 1.00 C ATOM 1787 NH1 ARG B 231 -3.517 5.390 -7.767 1.00 1.00 N ATOM 1788 NH2 ARG B 231 -5.092 6.380 -6.485 1.00 1.00 N ATOM 0 H ARG B 231 -7.012 1.005 -10.506 1.00 1.00 H new ATOM 0 HA ARG B 231 -4.975 2.638 -11.788 1.00 1.00 H new ATOM 0 HB2 ARG B 231 -5.037 0.831 -9.327 1.00 1.00 H new ATOM 0 HB3 ARG B 231 -3.610 1.713 -9.835 1.00 1.00 H new ATOM 0 HG2 ARG B 231 -4.852 3.870 -9.672 1.00 1.00 H new ATOM 0 HG3 ARG B 231 -6.321 3.015 -9.246 1.00 1.00 H new ATOM 0 HD2 ARG B 231 -5.192 2.088 -7.208 1.00 1.00 H new ATOM 0 HD3 ARG B 231 -3.720 2.936 -7.636 1.00 1.00 H new ATOM 0 HE ARG B 231 -6.173 4.129 -6.505 1.00 1.00 H new ATOM 0 HH11 ARG B 231 -3.158 4.563 -8.245 1.00 1.00 H new ATOM 0 HH12 ARG B 231 -3.003 6.270 -7.815 1.00 1.00 H new ATOM 0 HH21 ARG B 231 -5.965 6.328 -5.960 1.00 1.00 H new ATOM 0 HH22 ARG B 231 -4.578 7.260 -6.534 1.00 1.00 H new ATOM 1802 N ASN B 232 -5.185 -0.502 -12.363 1.00 1.00 N ATOM 1803 CA ASN B 232 -4.597 -1.618 -13.091 1.00 1.00 C ATOM 1804 C ASN B 232 -3.300 -2.057 -12.441 1.00 1.00 C ATOM 1805 O ASN B 232 -2.290 -2.254 -13.116 1.00 1.00 O ATOM 1806 CB ASN B 232 -4.333 -1.216 -14.536 1.00 1.00 C ATOM 1807 CG ASN B 232 -5.652 -0.941 -15.249 1.00 1.00 C ATOM 1808 OD1 ASN B 232 -6.517 -1.816 -15.317 1.00 1.00 O ATOM 1809 ND2 ASN B 232 -5.861 0.229 -15.783 1.00 1.00 N ATOM 0 H ASN B 232 -6.165 -0.628 -12.108 1.00 1.00 H new ATOM 0 HA ASN B 232 -5.300 -2.451 -13.068 1.00 1.00 H new ATOM 0 HB2 ASN B 232 -3.702 -0.328 -14.566 1.00 1.00 H new ATOM 0 HB3 ASN B 232 -3.791 -2.010 -15.050 1.00 1.00 H new ATOM 0 HD21 ASN B 232 -6.742 0.422 -16.259 1.00 1.00 H new ATOM 0 HD22 ASN B 232 -5.143 0.952 -15.725 1.00 1.00 H new ATOM 1816 N LEU B 233 -3.322 -2.209 -11.121 1.00 1.00 N ATOM 1817 CA LEU B 233 -2.127 -2.626 -10.390 1.00 1.00 C ATOM 1818 C LEU B 233 -2.499 -3.700 -9.352 1.00 1.00 C ATOM 1819 O LEU B 233 -3.653 -3.792 -8.923 1.00 1.00 O ATOM 1820 CB LEU B 233 -1.475 -1.386 -9.707 1.00 1.00 C ATOM 1821 CG LEU B 233 -1.769 -1.379 -8.189 1.00 1.00 C ATOM 1822 CD1 LEU B 233 -1.025 -0.241 -7.519 1.00 1.00 C ATOM 1823 CD2 LEU B 233 -3.299 -1.254 -7.959 1.00 1.00 C ATOM 0 H LEU B 233 -4.145 -2.052 -10.539 1.00 1.00 H new ATOM 0 HA LEU B 233 -1.404 -3.058 -11.081 1.00 1.00 H new ATOM 0 HB2 LEU B 233 -0.398 -1.398 -9.874 1.00 1.00 H new ATOM 0 HB3 LEU B 233 -1.858 -0.472 -10.161 1.00 1.00 H new ATOM 0 HG LEU B 233 -1.425 -2.314 -7.746 1.00 1.00 H new ATOM 0 HD11 LEU B 233 -1.239 -0.246 -6.450 1.00 1.00 H new ATOM 0 HD12 LEU B 233 0.047 -0.365 -7.675 1.00 1.00 H new ATOM 0 HD13 LEU B 233 -1.347 0.707 -7.950 1.00 1.00 H new ATOM 0 HD21 LEU B 233 -3.507 -1.249 -6.889 1.00 1.00 H new ATOM 0 HD22 LEU B 233 -3.659 -0.326 -8.403 1.00 1.00 H new ATOM 0 HD23 LEU B 233 -3.807 -2.099 -8.423 1.00 1.00 H new ATOM 1835 N PRO B 234 -1.537 -4.482 -8.934 1.00 1.00 N ATOM 1836 CA PRO B 234 -1.750 -5.548 -7.910 1.00 1.00 C ATOM 1837 C PRO B 234 -2.142 -4.986 -6.541 1.00 1.00 C ATOM 1838 O PRO B 234 -1.722 -3.894 -6.151 1.00 1.00 O ATOM 1839 CB PRO B 234 -0.388 -6.265 -7.846 1.00 1.00 C ATOM 1840 CG PRO B 234 0.604 -5.275 -8.367 1.00 1.00 C ATOM 1841 CD PRO B 234 -0.137 -4.442 -9.399 1.00 1.00 C ATOM 0 HA PRO B 234 -2.576 -6.207 -8.178 1.00 1.00 H new ATOM 0 HB2 PRO B 234 -0.148 -6.563 -6.825 1.00 1.00 H new ATOM 0 HB3 PRO B 234 -0.392 -7.172 -8.450 1.00 1.00 H new ATOM 0 HG2 PRO B 234 0.988 -4.648 -7.563 1.00 1.00 H new ATOM 0 HG3 PRO B 234 1.460 -5.779 -8.815 1.00 1.00 H new ATOM 0 HD2 PRO B 234 0.244 -3.421 -9.439 1.00 1.00 H new ATOM 0 HD3 PRO B 234 -0.035 -4.860 -10.401 1.00 1.00 H new ATOM 1849 N ARG B 235 -2.934 -5.748 -5.807 1.00 1.00 N ATOM 1850 CA ARG B 235 -3.361 -5.326 -4.480 1.00 1.00 C ATOM 1851 C ARG B 235 -2.152 -5.130 -3.571 1.00 1.00 C ATOM 1852 O ARG B 235 -2.073 -4.151 -2.832 1.00 1.00 O ATOM 1853 CB ARG B 235 -4.281 -6.382 -3.870 1.00 1.00 C ATOM 1854 CG ARG B 235 -4.808 -5.886 -2.518 1.00 1.00 C ATOM 1855 CD ARG B 235 -5.747 -6.929 -1.922 1.00 1.00 C ATOM 1856 NE ARG B 235 -5.046 -8.205 -1.767 1.00 1.00 N ATOM 1857 CZ ARG B 235 -5.355 -9.276 -2.502 1.00 1.00 C ATOM 1858 NH1 ARG B 235 -6.297 -9.212 -3.399 1.00 1.00 N ATOM 1859 NH2 ARG B 235 -4.702 -10.396 -2.329 1.00 1.00 N ATOM 0 H ARG B 235 -3.293 -6.656 -6.102 1.00 1.00 H new ATOM 0 HA ARG B 235 -3.897 -4.381 -4.573 1.00 1.00 H new ATOM 0 HB2 ARG B 235 -5.113 -6.586 -4.543 1.00 1.00 H new ATOM 0 HB3 ARG B 235 -3.739 -7.319 -3.739 1.00 1.00 H new ATOM 0 HG2 ARG B 235 -3.977 -5.700 -1.838 1.00 1.00 H new ATOM 0 HG3 ARG B 235 -5.333 -4.940 -2.646 1.00 1.00 H new ATOM 0 HD2 ARG B 235 -6.116 -6.588 -0.955 1.00 1.00 H new ATOM 0 HD3 ARG B 235 -6.616 -7.058 -2.567 1.00 1.00 H new ATOM 0 HE ARG B 235 -4.299 -8.278 -1.076 1.00 1.00 H new ATOM 0 HH11 ARG B 235 -6.805 -8.339 -3.544 1.00 1.00 H new ATOM 0 HH12 ARG B 235 -6.527 -10.035 -3.956 1.00 1.00 H new ATOM 0 HH21 ARG B 235 -3.958 -10.450 -1.633 1.00 1.00 H new ATOM 0 HH22 ARG B 235 -4.937 -11.215 -2.890 1.00 1.00 H new ATOM 1873 N ALA B 236 -1.222 -6.074 -3.612 1.00 1.00 N ATOM 1874 CA ALA B 236 -0.035 -5.989 -2.761 1.00 1.00 C ATOM 1875 C ALA B 236 0.552 -4.585 -2.814 1.00 1.00 C ATOM 1876 O ALA B 236 0.967 -4.039 -1.791 1.00 1.00 O ATOM 1877 CB ALA B 236 1.014 -6.995 -3.242 1.00 1.00 C ATOM 0 H ALA B 236 -1.261 -6.897 -4.214 1.00 1.00 H new ATOM 0 HA ALA B 236 -0.321 -6.217 -1.734 1.00 1.00 H new ATOM 0 HB1 ALA B 236 1.898 -6.931 -2.607 1.00 1.00 H new ATOM 0 HB2 ALA B 236 0.602 -8.003 -3.190 1.00 1.00 H new ATOM 0 HB3 ALA B 236 1.290 -6.769 -4.272 1.00 1.00 H new ATOM 1883 N ASP B 237 0.582 -4.001 -4.005 1.00 1.00 N ATOM 1884 CA ASP B 237 1.122 -2.654 -4.157 1.00 1.00 C ATOM 1885 C ASP B 237 0.250 -1.644 -3.417 1.00 1.00 C ATOM 1886 O ASP B 237 0.753 -0.692 -2.823 1.00 1.00 O ATOM 1887 CB ASP B 237 1.186 -2.295 -5.653 1.00 1.00 C ATOM 1888 CG ASP B 237 2.478 -2.823 -6.281 1.00 1.00 C ATOM 1889 OD1 ASP B 237 3.391 -3.155 -5.541 1.00 1.00 O ATOM 1890 OD2 ASP B 237 2.533 -2.889 -7.497 1.00 1.00 O ATOM 0 H ASP B 237 0.245 -4.429 -4.867 1.00 1.00 H new ATOM 0 HA ASP B 237 2.125 -2.623 -3.731 1.00 1.00 H new ATOM 0 HB2 ASP B 237 0.325 -2.718 -6.171 1.00 1.00 H new ATOM 0 HB3 ASP B 237 1.132 -1.213 -5.775 1.00 1.00 H new ATOM 1896 N LEU B 238 -1.059 -1.858 -3.454 1.00 1.00 N ATOM 1897 CA LEU B 238 -1.984 -0.958 -2.778 1.00 1.00 C ATOM 1898 C LEU B 238 -1.804 -1.029 -1.270 1.00 1.00 C ATOM 1899 O LEU B 238 -1.823 -0.007 -0.585 1.00 1.00 O ATOM 1900 CB LEU B 238 -3.429 -1.318 -3.153 1.00 1.00 C ATOM 1901 CG LEU B 238 -3.746 -0.785 -4.558 1.00 1.00 C ATOM 1902 CD1 LEU B 238 -5.097 -1.345 -5.018 1.00 1.00 C ATOM 1903 CD2 LEU B 238 -3.792 0.760 -4.555 1.00 1.00 C ATOM 0 H LEU B 238 -1.501 -2.639 -3.940 1.00 1.00 H new ATOM 0 HA LEU B 238 -1.771 0.061 -3.100 1.00 1.00 H new ATOM 0 HB2 LEU B 238 -3.564 -2.399 -3.125 1.00 1.00 H new ATOM 0 HB3 LEU B 238 -4.121 -0.891 -2.427 1.00 1.00 H new ATOM 0 HG LEU B 238 -2.962 -1.105 -5.244 1.00 1.00 H new ATOM 0 HD11 LEU B 238 -5.326 -0.969 -6.015 1.00 1.00 H new ATOM 0 HD12 LEU B 238 -5.050 -2.434 -5.042 1.00 1.00 H new ATOM 0 HD13 LEU B 238 -5.876 -1.031 -4.324 1.00 1.00 H new ATOM 0 HD21 LEU B 238 -4.018 1.119 -5.559 1.00 1.00 H new ATOM 0 HD22 LEU B 238 -4.565 1.100 -3.866 1.00 1.00 H new ATOM 0 HD23 LEU B 238 -2.826 1.152 -4.238 1.00 1.00 H new ATOM 1915 N LEU B 239 -1.641 -2.240 -0.759 1.00 1.00 N ATOM 1916 CA LEU B 239 -1.468 -2.431 0.674 1.00 1.00 C ATOM 1917 C LEU B 239 -0.181 -1.778 1.155 1.00 1.00 C ATOM 1918 O LEU B 239 -0.175 -1.075 2.163 1.00 1.00 O ATOM 1919 CB LEU B 239 -1.436 -3.927 0.990 1.00 1.00 C ATOM 1920 CG LEU B 239 -2.827 -4.536 0.754 1.00 1.00 C ATOM 1921 CD1 LEU B 239 -2.733 -6.067 0.815 1.00 1.00 C ATOM 1922 CD2 LEU B 239 -3.823 -4.036 1.824 1.00 1.00 C ATOM 0 H LEU B 239 -1.625 -3.099 -1.309 1.00 1.00 H new ATOM 0 HA LEU B 239 -2.306 -1.963 1.191 1.00 1.00 H new ATOM 0 HB2 LEU B 239 -0.699 -4.426 0.361 1.00 1.00 H new ATOM 0 HB3 LEU B 239 -1.131 -4.084 2.025 1.00 1.00 H new ATOM 0 HG LEU B 239 -3.184 -4.228 -0.229 1.00 1.00 H new ATOM 0 HD11 LEU B 239 -3.720 -6.499 0.648 1.00 1.00 H new ATOM 0 HD12 LEU B 239 -2.047 -6.420 0.045 1.00 1.00 H new ATOM 0 HD13 LEU B 239 -2.366 -6.370 1.795 1.00 1.00 H new ATOM 0 HD21 LEU B 239 -4.803 -4.477 1.643 1.00 1.00 H new ATOM 0 HD22 LEU B 239 -3.471 -4.328 2.813 1.00 1.00 H new ATOM 0 HD23 LEU B 239 -3.898 -2.950 1.772 1.00 1.00 H new ATOM 1934 N ARG B 240 0.901 -2.019 0.430 1.00 1.00 N ATOM 1935 CA ARG B 240 2.192 -1.454 0.799 1.00 1.00 C ATOM 1936 C ARG B 240 2.116 0.067 0.816 1.00 1.00 C ATOM 1937 O ARG B 240 2.618 0.714 1.734 1.00 1.00 O ATOM 1938 CB ARG B 240 3.263 -1.905 -0.197 1.00 1.00 C ATOM 1939 CG ARG B 240 4.631 -1.390 0.250 1.00 1.00 C ATOM 1940 CD ARG B 240 5.703 -1.867 -0.729 1.00 1.00 C ATOM 1941 NE ARG B 240 5.819 -3.318 -0.684 1.00 1.00 N ATOM 1942 CZ ARG B 240 6.717 -3.959 -1.423 1.00 1.00 C ATOM 1943 NH1 ARG B 240 7.520 -3.287 -2.202 1.00 1.00 N ATOM 1944 NH2 ARG B 240 6.797 -5.260 -1.371 1.00 1.00 N ATOM 0 H ARG B 240 0.913 -2.597 -0.410 1.00 1.00 H new ATOM 0 HA ARG B 240 2.456 -1.807 1.796 1.00 1.00 H new ATOM 0 HB2 ARG B 240 3.277 -2.993 -0.263 1.00 1.00 H new ATOM 0 HB3 ARG B 240 3.029 -1.528 -1.193 1.00 1.00 H new ATOM 0 HG2 ARG B 240 4.624 -0.301 0.295 1.00 1.00 H new ATOM 0 HG3 ARG B 240 4.856 -1.749 1.254 1.00 1.00 H new ATOM 0 HD2 ARG B 240 5.450 -1.547 -1.740 1.00 1.00 H new ATOM 0 HD3 ARG B 240 6.661 -1.411 -0.480 1.00 1.00 H new ATOM 0 HE ARG B 240 5.199 -3.851 -0.074 1.00 1.00 H new ATOM 0 HH11 ARG B 240 7.458 -2.270 -2.243 1.00 1.00 H new ATOM 0 HH12 ARG B 240 8.210 -3.779 -2.770 1.00 1.00 H new ATOM 0 HH21 ARG B 240 6.170 -5.786 -0.762 1.00 1.00 H new ATOM 0 HH22 ARG B 240 7.487 -5.752 -1.939 1.00 1.00 H new ATOM 1958 N GLU B 241 1.481 0.633 -0.205 1.00 1.00 N ATOM 1959 CA GLU B 241 1.340 2.080 -0.296 1.00 1.00 C ATOM 1960 C GLU B 241 0.418 2.603 0.799 1.00 1.00 C ATOM 1961 O GLU B 241 0.654 3.667 1.368 1.00 1.00 O ATOM 1962 CB GLU B 241 0.781 2.468 -1.666 1.00 1.00 C ATOM 1963 CG GLU B 241 1.838 2.210 -2.742 1.00 1.00 C ATOM 1964 CD GLU B 241 1.252 2.479 -4.123 1.00 1.00 C ATOM 1965 OE1 GLU B 241 1.970 2.301 -5.094 1.00 1.00 O ATOM 1966 OE2 GLU B 241 0.095 2.858 -4.190 1.00 1.00 O ATOM 0 H GLU B 241 1.059 0.115 -0.976 1.00 1.00 H new ATOM 0 HA GLU B 241 2.326 2.527 -0.167 1.00 1.00 H new ATOM 0 HB2 GLU B 241 -0.119 1.891 -1.880 1.00 1.00 H new ATOM 0 HB3 GLU B 241 0.494 3.519 -1.669 1.00 1.00 H new ATOM 0 HG2 GLU B 241 2.704 2.851 -2.574 1.00 1.00 H new ATOM 0 HG3 GLU B 241 2.187 1.179 -2.681 1.00 1.00 H new ATOM 1974 N ALA B 242 -0.635 1.848 1.092 1.00 1.00 N ATOM 1975 CA ALA B 242 -1.584 2.251 2.123 1.00 1.00 C ATOM 1976 C ALA B 242 -0.882 2.384 3.468 1.00 1.00 C ATOM 1977 O ALA B 242 -1.118 3.341 4.206 1.00 1.00 O ATOM 1978 CB ALA B 242 -2.705 1.212 2.228 1.00 1.00 C ATOM 0 H ALA B 242 -0.852 0.962 0.635 1.00 1.00 H new ATOM 0 HA ALA B 242 -2.008 3.218 1.850 1.00 1.00 H new ATOM 0 HB1 ALA B 242 -3.412 1.517 2.999 1.00 1.00 H new ATOM 0 HB2 ALA B 242 -3.222 1.136 1.271 1.00 1.00 H new ATOM 0 HB3 ALA B 242 -2.280 0.243 2.488 1.00 1.00 H new ATOM 1984 N VAL B 243 -0.014 1.425 3.784 1.00 1.00 N ATOM 1985 CA VAL B 243 0.715 1.466 5.047 1.00 1.00 C ATOM 1986 C VAL B 243 1.666 2.661 5.067 1.00 1.00 C ATOM 1987 O VAL B 243 1.657 3.460 6.005 1.00 1.00 O ATOM 1988 CB VAL B 243 1.507 0.169 5.223 1.00 1.00 C ATOM 1989 CG1 VAL B 243 2.418 0.281 6.448 1.00 1.00 C ATOM 1990 CG2 VAL B 243 0.536 -0.999 5.418 1.00 1.00 C ATOM 0 H VAL B 243 0.199 0.622 3.192 1.00 1.00 H new ATOM 0 HA VAL B 243 0.003 1.570 5.866 1.00 1.00 H new ATOM 0 HB VAL B 243 2.115 -0.004 4.335 1.00 1.00 H new ATOM 0 HG11 VAL B 243 2.980 -0.645 6.569 1.00 1.00 H new ATOM 0 HG12 VAL B 243 3.111 1.111 6.311 1.00 1.00 H new ATOM 0 HG13 VAL B 243 1.812 0.457 7.337 1.00 1.00 H new ATOM 0 HG21 VAL B 243 1.100 -1.924 5.543 1.00 1.00 H new ATOM 0 HG22 VAL B 243 -0.073 -0.822 6.305 1.00 1.00 H new ATOM 0 HG23 VAL B 243 -0.111 -1.084 4.545 1.00 1.00 H new ATOM 2000 N ASP B 244 2.490 2.775 4.027 1.00 1.00 N ATOM 2001 CA ASP B 244 3.448 3.868 3.945 1.00 1.00 C ATOM 2002 C ASP B 244 2.735 5.201 4.150 1.00 1.00 C ATOM 2003 O ASP B 244 3.184 6.039 4.931 1.00 1.00 O ATOM 2004 CB ASP B 244 4.127 3.861 2.575 1.00 1.00 C ATOM 2005 CG ASP B 244 5.314 4.819 2.571 1.00 1.00 C ATOM 2006 OD1 ASP B 244 5.814 5.108 1.497 1.00 1.00 O ATOM 2007 OD2 ASP B 244 5.705 5.249 3.644 1.00 1.00 O ATOM 0 H ASP B 244 2.512 2.129 3.238 1.00 1.00 H new ATOM 0 HA ASP B 244 4.200 3.737 4.723 1.00 1.00 H new ATOM 0 HB2 ASP B 244 4.463 2.853 2.333 1.00 1.00 H new ATOM 0 HB3 ASP B 244 3.412 4.152 1.805 1.00 1.00 H new ATOM 2013 N GLN B 245 1.619 5.383 3.454 1.00 1.00 N ATOM 2014 CA GLN B 245 0.847 6.610 3.580 1.00 1.00 C ATOM 2015 C GLN B 245 0.336 6.785 5.004 1.00 1.00 C ATOM 2016 O GLN B 245 0.364 7.887 5.553 1.00 1.00 O ATOM 2017 CB GLN B 245 -0.334 6.582 2.608 1.00 1.00 C ATOM 2018 CG GLN B 245 0.170 6.774 1.176 1.00 1.00 C ATOM 2019 CD GLN B 245 -1.007 6.802 0.209 1.00 1.00 C ATOM 2020 OE1 GLN B 245 -2.156 6.903 0.635 1.00 1.00 O ATOM 2021 NE2 GLN B 245 -0.786 6.719 -1.076 1.00 1.00 N ATOM 0 H GLN B 245 1.232 4.701 2.802 1.00 1.00 H new ATOM 0 HA GLN B 245 1.497 7.451 3.340 1.00 1.00 H new ATOM 0 HB2 GLN B 245 -0.864 5.634 2.693 1.00 1.00 H new ATOM 0 HB3 GLN B 245 -1.045 7.368 2.862 1.00 1.00 H new ATOM 0 HG2 GLN B 245 0.734 7.704 1.102 1.00 1.00 H new ATOM 0 HG3 GLN B 245 0.851 5.966 0.910 1.00 1.00 H new ATOM 0 HE21 GLN B 245 0.169 6.635 -1.425 1.00 1.00 H new ATOM 0 HE22 GLN B 245 -1.568 6.738 -1.730 1.00 1.00 H new ATOM 2030 N TYR B 246 -0.129 5.694 5.597 1.00 1.00 N ATOM 2031 CA TYR B 246 -0.644 5.737 6.961 1.00 1.00 C ATOM 2032 C TYR B 246 0.444 6.193 7.922 1.00 1.00 C ATOM 2033 O TYR B 246 0.196 6.984 8.832 1.00 1.00 O ATOM 2034 CB TYR B 246 -1.154 4.355 7.368 1.00 1.00 C ATOM 2035 CG TYR B 246 -1.730 4.421 8.765 1.00 1.00 C ATOM 2036 CD1 TYR B 246 -2.940 5.091 8.988 1.00 1.00 C ATOM 2037 CD2 TYR B 246 -1.058 3.817 9.835 1.00 1.00 C ATOM 2038 CE1 TYR B 246 -3.477 5.157 10.280 1.00 1.00 C ATOM 2039 CE2 TYR B 246 -1.595 3.882 11.125 1.00 1.00 C ATOM 2040 CZ TYR B 246 -2.804 4.551 11.348 1.00 1.00 C ATOM 2041 OH TYR B 246 -3.332 4.615 12.621 1.00 1.00 O ATOM 0 H TYR B 246 -0.161 4.773 5.159 1.00 1.00 H new ATOM 0 HA TYR B 246 -1.468 6.449 7.003 1.00 1.00 H new ATOM 0 HB2 TYR B 246 -1.915 4.015 6.665 1.00 1.00 H new ATOM 0 HB3 TYR B 246 -0.340 3.630 7.332 1.00 1.00 H new ATOM 0 HD1 TYR B 246 -3.459 5.557 8.163 1.00 1.00 H new ATOM 0 HD2 TYR B 246 -0.125 3.301 9.664 1.00 1.00 H new ATOM 0 HE1 TYR B 246 -4.409 5.675 10.452 1.00 1.00 H new ATOM 0 HE2 TYR B 246 -1.076 3.416 11.950 1.00 1.00 H new ATOM 0 HH TYR B 246 -4.310 4.660 12.568 1.00 1.00 H new ATOM 2051 N LEU B 247 1.651 5.686 7.720 1.00 1.00 N ATOM 2052 CA LEU B 247 2.774 6.050 8.579 1.00 1.00 C ATOM 2053 C LEU B 247 3.073 7.540 8.476 1.00 1.00 C ATOM 2054 O LEU B 247 3.337 8.198 9.483 1.00 1.00 O ATOM 2055 CB LEU B 247 4.019 5.246 8.174 1.00 1.00 C ATOM 2056 CG LEU B 247 3.945 3.827 8.769 1.00 1.00 C ATOM 2057 CD1 LEU B 247 4.781 2.867 7.918 1.00 1.00 C ATOM 2058 CD2 LEU B 247 4.501 3.837 10.202 1.00 1.00 C ATOM 0 H LEU B 247 1.880 5.027 6.976 1.00 1.00 H new ATOM 0 HA LEU B 247 2.508 5.819 9.610 1.00 1.00 H new ATOM 0 HB2 LEU B 247 4.089 5.191 7.088 1.00 1.00 H new ATOM 0 HB3 LEU B 247 4.919 5.751 8.526 1.00 1.00 H new ATOM 0 HG LEU B 247 2.905 3.500 8.780 1.00 1.00 H new ATOM 0 HD11 LEU B 247 4.727 1.864 8.341 1.00 1.00 H new ATOM 0 HD12 LEU B 247 4.394 2.852 6.899 1.00 1.00 H new ATOM 0 HD13 LEU B 247 5.819 3.200 7.907 1.00 1.00 H new ATOM 0 HD21 LEU B 247 4.447 2.832 10.620 1.00 1.00 H new ATOM 0 HD22 LEU B 247 5.539 4.169 10.187 1.00 1.00 H new ATOM 0 HD23 LEU B 247 3.911 4.517 10.816 1.00 1.00 H new ATOM 2070 N ILE B 248 3.030 8.063 7.259 1.00 1.00 N ATOM 2071 CA ILE B 248 3.301 9.478 7.047 1.00 1.00 C ATOM 2072 C ILE B 248 2.277 10.324 7.795 1.00 1.00 C ATOM 2073 O ILE B 248 2.629 11.304 8.450 1.00 1.00 O ATOM 2074 CB ILE B 248 3.250 9.796 5.549 1.00 1.00 C ATOM 2075 CG1 ILE B 248 4.442 9.137 4.845 1.00 1.00 C ATOM 2076 CG2 ILE B 248 3.305 11.311 5.337 1.00 1.00 C ATOM 2077 CD1 ILE B 248 4.252 9.217 3.326 1.00 1.00 C ATOM 0 H ILE B 248 2.813 7.537 6.413 1.00 1.00 H new ATOM 0 HA ILE B 248 4.295 9.711 7.428 1.00 1.00 H new ATOM 0 HB ILE B 248 2.320 9.409 5.132 1.00 1.00 H new ATOM 0 HG12 ILE B 248 5.368 9.636 5.132 1.00 1.00 H new ATOM 0 HG13 ILE B 248 4.531 8.096 5.156 1.00 1.00 H new ATOM 0 HG21 ILE B 248 3.268 11.531 4.270 1.00 1.00 H new ATOM 0 HG22 ILE B 248 2.455 11.779 5.833 1.00 1.00 H new ATOM 0 HG23 ILE B 248 4.231 11.704 5.757 1.00 1.00 H new ATOM 0 HD11 ILE B 248 5.101 8.748 2.828 1.00 1.00 H new ATOM 0 HD12 ILE B 248 3.335 8.698 3.046 1.00 1.00 H new ATOM 0 HD13 ILE B 248 4.185 10.262 3.022 1.00 1.00 H new ATOM 2089 N ASN B 249 1.011 9.938 7.697 1.00 1.00 N ATOM 2090 CA ASN B 249 -0.051 10.670 8.373 1.00 1.00 C ATOM 2091 C ASN B 249 0.137 10.591 9.884 1.00 1.00 C ATOM 2092 O ASN B 249 -0.082 11.568 10.599 1.00 1.00 O ATOM 2093 CB ASN B 249 -1.412 10.088 7.991 1.00 1.00 C ATOM 2094 CG ASN B 249 -2.527 10.908 8.629 1.00 1.00 C ATOM 2095 OD1 ASN B 249 -2.362 12.106 8.863 1.00 1.00 O ATOM 2096 ND2 ASN B 249 -3.660 10.333 8.925 1.00 1.00 N ATOM 0 H ASN B 249 0.697 9.129 7.161 1.00 1.00 H new ATOM 0 HA ASN B 249 -0.009 11.714 8.064 1.00 1.00 H new ATOM 0 HB2 ASN B 249 -1.525 10.087 6.907 1.00 1.00 H new ATOM 0 HB3 ASN B 249 -1.478 9.051 8.320 1.00 1.00 H new ATOM 0 HD21 ASN B 249 -4.411 10.876 9.351 1.00 1.00 H new ATOM 0 HD22 ASN B 249 -3.795 9.341 8.730 1.00 1.00 H new