USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 771 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 34 TYR OH : rot 130:sc= -2.98! USER MOD Set 1.2: A 71 ASN :FLIP amide:sc= -2.5! C(o=-6.9!,f=-5.5!) USER MOD Set 2.1: A 65 THR OG1 : rot -76:sc= 0.708 USER MOD Set 2.2: A 86 HIS :FLIP no HD1:sc= -0.124 F(o=0.0045,f=0.58) USER MOD Single : A 12 TYR OH : rot 165:sc= 0 USER MOD Single : A 14 TYR OH : rot 180:sc= -0.114 USER MOD Single : A 17 ASN : amide:sc= -2.37! C(o=-2.4!,f=-3!) USER MOD Single : A 19 ASN : amide:sc= -0.131 K(o=-0.13,f=-1.9) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 88:sc= 1.24 USER MOD Single : A 32 SER OG : rot 70:sc= -0.53 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 164:sc= -1.2 (180deg=-1.6) USER MOD Single : A 59 TYR OH : rot 83:sc= -0.932 USER MOD Single : A 62 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 64 SER OG : rot -104:sc= -0.279 USER MOD Single : A 73 ASN : amide:sc=-0.00663 K(o=-0.0066,f=-1.2!) USER MOD Single : A 76 LYS NZ :NH3+ 159:sc= -0.425 (180deg=-1.41!) USER MOD Single : A 83 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.165) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0.00341 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : B 314 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 317 SER OG : rot 180:sc= 0 USER MOD Single : B 323 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 325 SER OG : rot -159:sc= 1.33 USER MOD Single : B 331 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.192) USER MOD Single : B 335 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 336 GLN : amide:sc= -4.68! C(o=-4.7!,f=-5.6!) USER MOD Single : B 337 ASN : amide:sc= -0.311 X(o=-0.31,f=-0.026) USER MOD ----------------------------------------------------------------- ATOM 142 N ALA A 11 -0.923 -13.888 -1.204 1.00 0.00 N ATOM 143 CA ALA A 11 -0.097 -14.945 -0.628 1.00 0.00 C ATOM 144 C ALA A 11 -0.831 -15.612 0.535 1.00 0.00 C ATOM 145 O ALA A 11 -1.575 -14.960 1.267 1.00 0.00 O ATOM 146 CB ALA A 11 1.238 -14.363 -0.141 1.00 0.00 C ATOM 0 HA ALA A 11 0.101 -15.693 -1.395 1.00 0.00 H new ATOM 0 HB1 ALA A 11 1.847 -15.159 0.287 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.767 -13.913 -0.981 1.00 0.00 H new ATOM 0 HB3 ALA A 11 1.049 -13.603 0.617 1.00 0.00 H new ATOM 152 N TYR A 12 -0.616 -16.917 0.701 1.00 0.00 N ATOM 153 CA TYR A 12 -1.267 -17.665 1.783 1.00 0.00 C ATOM 154 C TYR A 12 -0.228 -18.362 2.661 1.00 0.00 C ATOM 155 O TYR A 12 0.742 -18.934 2.156 1.00 0.00 O ATOM 156 CB TYR A 12 -2.214 -18.709 1.186 1.00 0.00 C ATOM 157 CG TYR A 12 -3.258 -18.020 0.334 1.00 0.00 C ATOM 158 CD1 TYR A 12 -2.960 -17.673 -0.990 1.00 0.00 C ATOM 159 CD2 TYR A 12 -4.524 -17.728 0.862 1.00 0.00 C ATOM 160 CE1 TYR A 12 -3.925 -17.037 -1.782 1.00 0.00 C ATOM 161 CE2 TYR A 12 -5.488 -17.096 0.070 1.00 0.00 C ATOM 162 CZ TYR A 12 -5.189 -16.748 -1.253 1.00 0.00 C ATOM 163 OH TYR A 12 -6.138 -16.121 -2.032 1.00 0.00 O ATOM 0 H TYR A 12 -0.003 -17.476 0.108 1.00 0.00 H new ATOM 0 HA TYR A 12 -1.830 -16.964 2.400 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -1.652 -19.422 0.584 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -2.696 -19.275 1.983 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -1.986 -17.896 -1.400 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -4.755 -17.992 1.883 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -3.694 -16.769 -2.802 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -6.463 -16.876 0.479 1.00 0.00 H new ATOM 0 HH TYR A 12 -7.018 -16.208 -1.609 1.00 0.00 H new ATOM 173 N ILE A 13 -0.436 -18.320 3.979 1.00 0.00 N ATOM 174 CA ILE A 13 0.484 -18.962 4.929 1.00 0.00 C ATOM 175 C ILE A 13 -0.294 -19.835 5.914 1.00 0.00 C ATOM 176 O ILE A 13 -1.475 -19.602 6.170 1.00 0.00 O ATOM 177 CB ILE A 13 1.292 -17.901 5.692 1.00 0.00 C ATOM 178 CG1 ILE A 13 0.361 -16.766 6.118 1.00 0.00 C ATOM 179 CG2 ILE A 13 2.402 -17.347 4.792 1.00 0.00 C ATOM 180 CD1 ILE A 13 1.102 -15.818 7.067 1.00 0.00 C ATOM 0 H ILE A 13 -1.230 -17.850 4.415 1.00 0.00 H new ATOM 0 HA ILE A 13 1.174 -19.593 4.368 1.00 0.00 H new ATOM 0 HB ILE A 13 1.742 -18.354 6.575 1.00 0.00 H new ATOM 0 HG12 ILE A 13 0.013 -16.220 5.241 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.522 -17.173 6.611 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.972 -16.595 5.338 1.00 0.00 H new ATOM 0 HG22 ILE A 13 3.066 -18.158 4.492 1.00 0.00 H new ATOM 0 HG23 ILE A 13 1.959 -16.893 3.905 1.00 0.00 H new ATOM 0 HD11 ILE A 13 0.435 -15.010 7.368 1.00 0.00 H new ATOM 0 HD12 ILE A 13 1.428 -16.368 7.950 1.00 0.00 H new ATOM 0 HD13 ILE A 13 1.971 -15.400 6.559 1.00 0.00 H new ATOM 192 N TYR A 14 0.376 -20.844 6.464 1.00 0.00 N ATOM 193 CA TYR A 14 -0.255 -21.751 7.420 1.00 0.00 C ATOM 194 C TYR A 14 0.014 -21.303 8.853 1.00 0.00 C ATOM 195 O TYR A 14 1.170 -21.119 9.247 1.00 0.00 O ATOM 196 CB TYR A 14 0.278 -23.179 7.225 1.00 0.00 C ATOM 197 CG TYR A 14 -0.175 -24.058 8.373 1.00 0.00 C ATOM 198 CD1 TYR A 14 -1.510 -24.473 8.458 1.00 0.00 C ATOM 199 CD2 TYR A 14 0.742 -24.453 9.357 1.00 0.00 C ATOM 200 CE1 TYR A 14 -1.927 -25.280 9.523 1.00 0.00 C ATOM 201 CE2 TYR A 14 0.324 -25.262 10.421 1.00 0.00 C ATOM 202 CZ TYR A 14 -1.010 -25.674 10.504 1.00 0.00 C ATOM 203 OH TYR A 14 -1.422 -26.470 11.553 1.00 0.00 O ATOM 0 H TYR A 14 1.354 -21.054 6.265 1.00 0.00 H new ATOM 0 HA TYR A 14 -1.330 -21.734 7.242 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -0.082 -23.585 6.280 1.00 0.00 H new ATOM 0 HB3 TYR A 14 1.367 -23.166 7.172 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -2.218 -24.170 7.701 1.00 0.00 H new ATOM 0 HD2 TYR A 14 1.772 -24.133 9.295 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -2.957 -25.599 9.588 1.00 0.00 H new ATOM 0 HE2 TYR A 14 1.032 -25.568 11.177 1.00 0.00 H new ATOM 0 HH TYR A 14 -0.661 -26.652 12.144 1.00 0.00 H new ATOM 213 N ILE A 15 -1.056 -21.134 9.632 1.00 0.00 N ATOM 214 CA ILE A 15 -0.920 -20.720 11.032 1.00 0.00 C ATOM 215 C ILE A 15 -1.535 -21.782 11.941 1.00 0.00 C ATOM 216 O ILE A 15 -2.757 -21.868 12.067 1.00 0.00 O ATOM 217 CB ILE A 15 -1.619 -19.373 11.254 1.00 0.00 C ATOM 218 CG1 ILE A 15 -1.057 -18.337 10.273 1.00 0.00 C ATOM 219 CG2 ILE A 15 -1.365 -18.903 12.689 1.00 0.00 C ATOM 220 CD1 ILE A 15 -1.969 -17.107 10.244 1.00 0.00 C ATOM 0 H ILE A 15 -2.018 -21.275 9.323 1.00 0.00 H new ATOM 0 HA ILE A 15 0.138 -20.609 11.271 1.00 0.00 H new ATOM 0 HB ILE A 15 -2.690 -19.486 11.088 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -0.049 -18.048 10.572 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -0.982 -18.770 9.275 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -1.860 -17.946 12.851 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -1.761 -19.639 13.388 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -0.293 -18.789 12.850 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -1.567 -16.372 9.546 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.968 -17.402 9.924 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -2.022 -16.669 11.241 1.00 0.00 H new ATOM 232 N GLY A 16 -0.681 -22.590 12.577 1.00 0.00 N ATOM 233 CA GLY A 16 -1.156 -23.659 13.468 1.00 0.00 C ATOM 234 C GLY A 16 -0.614 -23.487 14.884 1.00 0.00 C ATOM 235 O GLY A 16 0.167 -22.575 15.151 1.00 0.00 O ATOM 0 H GLY A 16 0.334 -22.528 12.494 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.246 -23.657 13.491 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -0.847 -24.627 13.074 1.00 0.00 H new ATOM 239 N ASN A 17 -1.033 -24.374 15.787 1.00 0.00 N ATOM 240 CA ASN A 17 -0.584 -24.312 17.177 1.00 0.00 C ATOM 241 C ASN A 17 -0.999 -22.992 17.830 1.00 0.00 C ATOM 242 O ASN A 17 -0.220 -22.375 18.557 1.00 0.00 O ATOM 243 CB ASN A 17 0.938 -24.462 17.231 1.00 0.00 C ATOM 244 CG ASN A 17 1.385 -24.770 18.657 1.00 0.00 C ATOM 245 OD1 ASN A 17 0.952 -24.110 19.601 1.00 0.00 O ATOM 246 ND2 ASN A 17 2.228 -25.743 18.871 1.00 0.00 N ATOM 0 H ASN A 17 -1.677 -25.138 15.583 1.00 0.00 H new ATOM 0 HA ASN A 17 -1.054 -25.127 17.728 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.256 -25.261 16.561 1.00 0.00 H new ATOM 0 HB3 ASN A 17 1.414 -23.545 16.882 1.00 0.00 H new ATOM 0 HD21 ASN A 17 2.529 -25.957 19.822 1.00 0.00 H new ATOM 0 HD22 ASN A 17 2.586 -26.289 18.087 1.00 0.00 H new ATOM 253 N LEU A 18 -2.235 -22.559 17.566 1.00 0.00 N ATOM 254 CA LEU A 18 -2.756 -21.314 18.147 1.00 0.00 C ATOM 255 C LEU A 18 -3.750 -21.629 19.264 1.00 0.00 C ATOM 256 O LEU A 18 -4.329 -22.716 19.304 1.00 0.00 O ATOM 257 CB LEU A 18 -3.450 -20.469 17.067 1.00 0.00 C ATOM 258 CG LEU A 18 -4.504 -21.325 16.321 1.00 0.00 C ATOM 259 CD1 LEU A 18 -5.721 -20.463 15.961 1.00 0.00 C ATOM 260 CD2 LEU A 18 -3.891 -21.887 15.037 1.00 0.00 C ATOM 0 H LEU A 18 -2.892 -23.047 16.957 1.00 0.00 H new ATOM 0 HA LEU A 18 -1.919 -20.750 18.558 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -3.930 -19.603 17.523 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -2.712 -20.089 16.361 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.819 -22.143 16.969 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -6.457 -21.073 15.437 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -6.165 -20.062 16.872 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -5.407 -19.641 15.318 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -4.633 -22.489 14.513 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -3.572 -21.065 14.396 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.030 -22.508 15.286 1.00 0.00 H new ATOM 272 N ASN A 19 -3.946 -20.674 20.166 1.00 0.00 N ATOM 273 CA ASN A 19 -4.882 -20.859 21.274 1.00 0.00 C ATOM 274 C ASN A 19 -6.312 -20.558 20.816 1.00 0.00 C ATOM 275 O ASN A 19 -6.549 -19.602 20.080 1.00 0.00 O ATOM 276 CB ASN A 19 -4.490 -19.940 22.449 1.00 0.00 C ATOM 277 CG ASN A 19 -3.557 -20.671 23.416 1.00 0.00 C ATOM 278 OD1 ASN A 19 -3.013 -21.721 23.075 1.00 0.00 O ATOM 279 ND2 ASN A 19 -3.343 -20.180 24.605 1.00 0.00 N ATOM 0 H ASN A 19 -3.474 -19.770 20.155 1.00 0.00 H new ATOM 0 HA ASN A 19 -4.837 -21.896 21.607 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -3.999 -19.044 22.069 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -5.386 -19.613 22.977 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -2.724 -20.666 25.254 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -3.795 -19.310 24.886 1.00 0.00 H new ATOM 286 N ARG A 20 -7.262 -21.379 21.262 1.00 0.00 N ATOM 287 CA ARG A 20 -8.663 -21.192 20.889 1.00 0.00 C ATOM 288 C ARG A 20 -9.168 -19.822 21.337 1.00 0.00 C ATOM 289 O ARG A 20 -10.115 -19.280 20.767 1.00 0.00 O ATOM 290 CB ARG A 20 -9.522 -22.285 21.534 1.00 0.00 C ATOM 291 CG ARG A 20 -9.560 -22.084 23.054 1.00 0.00 C ATOM 292 CD ARG A 20 -9.990 -23.386 23.735 1.00 0.00 C ATOM 293 NE ARG A 20 -10.140 -23.180 25.172 1.00 0.00 N ATOM 294 CZ ARG A 20 -10.075 -24.198 26.023 1.00 0.00 C ATOM 295 NH1 ARG A 20 -9.870 -25.407 25.580 1.00 0.00 N ATOM 296 NH2 ARG A 20 -10.215 -23.989 27.304 1.00 0.00 N ATOM 0 H ARG A 20 -7.089 -22.174 21.877 1.00 0.00 H new ATOM 0 HA ARG A 20 -8.738 -21.255 19.803 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -10.533 -22.253 21.128 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -9.114 -23.268 21.298 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -8.577 -21.780 23.415 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -10.254 -21.283 23.308 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -10.932 -23.733 23.310 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -9.250 -24.164 23.547 1.00 0.00 H new ATOM 0 HE ARG A 20 -10.298 -22.238 25.529 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -9.759 -25.572 24.579 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -9.820 -26.188 26.234 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -10.374 -23.044 27.652 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -10.165 -24.771 27.957 1.00 0.00 H new ATOM 310 N GLU A 21 -8.529 -19.269 22.358 1.00 0.00 N ATOM 311 CA GLU A 21 -8.924 -17.963 22.878 1.00 0.00 C ATOM 312 C GLU A 21 -8.759 -16.888 21.811 1.00 0.00 C ATOM 313 O GLU A 21 -9.467 -15.881 21.814 1.00 0.00 O ATOM 314 CB GLU A 21 -8.070 -17.610 24.097 1.00 0.00 C ATOM 315 CG GLU A 21 -8.417 -18.550 25.253 1.00 0.00 C ATOM 316 CD GLU A 21 -7.482 -18.298 26.430 1.00 0.00 C ATOM 317 OE1 GLU A 21 -6.579 -17.490 26.281 1.00 0.00 O ATOM 318 OE2 GLU A 21 -7.680 -18.914 27.465 1.00 0.00 O ATOM 0 H GLU A 21 -7.740 -19.699 22.841 1.00 0.00 H new ATOM 0 HA GLU A 21 -9.973 -18.010 23.169 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.012 -17.695 23.850 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.246 -16.575 24.390 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -9.451 -18.395 25.560 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.333 -19.587 24.927 1.00 0.00 H new ATOM 325 N LEU A 22 -7.819 -17.105 20.902 1.00 0.00 N ATOM 326 CA LEU A 22 -7.564 -16.142 19.838 1.00 0.00 C ATOM 327 C LEU A 22 -8.695 -16.164 18.813 1.00 0.00 C ATOM 328 O LEU A 22 -9.049 -17.219 18.286 1.00 0.00 O ATOM 329 CB LEU A 22 -6.232 -16.469 19.148 1.00 0.00 C ATOM 330 CG LEU A 22 -5.071 -15.936 19.994 1.00 0.00 C ATOM 331 CD1 LEU A 22 -5.196 -16.463 21.429 1.00 0.00 C ATOM 332 CD2 LEU A 22 -3.744 -16.409 19.390 1.00 0.00 C ATOM 0 H LEU A 22 -7.224 -17.933 20.879 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.510 -15.146 20.277 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -6.134 -17.547 19.016 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -6.206 -16.022 18.154 1.00 0.00 H new ATOM 0 HG LEU A 22 -5.100 -14.846 20.006 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -4.369 -16.083 22.029 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -6.140 -16.129 21.858 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -5.167 -17.553 21.420 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -2.916 -16.031 19.990 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -3.717 -17.499 19.379 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -3.654 -16.034 18.371 1.00 0.00 H new ATOM 344 N THR A 23 -9.260 -14.992 18.530 1.00 0.00 N ATOM 345 CA THR A 23 -10.355 -14.882 17.561 1.00 0.00 C ATOM 346 C THR A 23 -9.865 -14.235 16.272 1.00 0.00 C ATOM 347 O THR A 23 -8.667 -14.022 16.091 1.00 0.00 O ATOM 348 CB THR A 23 -11.497 -14.049 18.149 1.00 0.00 C ATOM 349 OG1 THR A 23 -11.044 -12.720 18.373 1.00 0.00 O ATOM 350 CG2 THR A 23 -11.952 -14.665 19.472 1.00 0.00 C ATOM 0 H THR A 23 -8.981 -14.107 18.954 1.00 0.00 H new ATOM 0 HA THR A 23 -10.717 -15.886 17.338 1.00 0.00 H new ATOM 0 HB THR A 23 -12.334 -14.035 17.451 1.00 0.00 H new ATOM 0 HG1 THR A 23 -11.774 -12.184 18.748 1.00 0.00 H new ATOM 0 HG21 THR A 23 -12.765 -14.071 19.889 1.00 0.00 H new ATOM 0 HG22 THR A 23 -12.299 -15.684 19.299 1.00 0.00 H new ATOM 0 HG23 THR A 23 -11.117 -14.680 20.172 1.00 0.00 H new ATOM 358 N GLU A 24 -10.799 -13.927 15.378 1.00 0.00 N ATOM 359 CA GLU A 24 -10.448 -13.306 14.110 1.00 0.00 C ATOM 360 C GLU A 24 -9.752 -11.973 14.350 1.00 0.00 C ATOM 361 O GLU A 24 -8.761 -11.654 13.689 1.00 0.00 O ATOM 362 CB GLU A 24 -11.709 -13.077 13.275 1.00 0.00 C ATOM 363 CG GLU A 24 -12.251 -14.422 12.787 1.00 0.00 C ATOM 364 CD GLU A 24 -13.617 -14.230 12.139 1.00 0.00 C ATOM 365 OE1 GLU A 24 -14.172 -13.154 12.283 1.00 0.00 O ATOM 366 OE2 GLU A 24 -14.088 -15.164 11.509 1.00 0.00 O ATOM 0 H GLU A 24 -11.796 -14.096 15.508 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.772 -13.971 13.573 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -12.464 -12.564 13.871 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -11.483 -12.434 12.424 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -11.559 -14.864 12.071 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -12.331 -15.116 13.623 1.00 0.00 H new ATOM 373 N GLY A 25 -10.269 -11.200 15.299 1.00 0.00 N ATOM 374 CA GLY A 25 -9.682 -9.907 15.621 1.00 0.00 C ATOM 375 C GLY A 25 -8.271 -10.073 16.172 1.00 0.00 C ATOM 376 O GLY A 25 -7.369 -9.305 15.836 1.00 0.00 O ATOM 0 H GLY A 25 -11.088 -11.445 15.855 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -9.657 -9.282 14.728 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -10.305 -9.393 16.353 1.00 0.00 H new ATOM 380 N ASP A 26 -8.087 -11.080 17.022 1.00 0.00 N ATOM 381 CA ASP A 26 -6.781 -11.332 17.616 1.00 0.00 C ATOM 382 C ASP A 26 -5.756 -11.676 16.542 1.00 0.00 C ATOM 383 O ASP A 26 -4.637 -11.171 16.555 1.00 0.00 O ATOM 384 CB ASP A 26 -6.879 -12.488 18.613 1.00 0.00 C ATOM 385 CG ASP A 26 -7.660 -12.049 19.847 1.00 0.00 C ATOM 386 OD1 ASP A 26 -7.766 -10.853 20.063 1.00 0.00 O ATOM 387 OD2 ASP A 26 -8.139 -12.915 20.560 1.00 0.00 O ATOM 0 H ASP A 26 -8.819 -11.728 17.312 1.00 0.00 H new ATOM 0 HA ASP A 26 -6.459 -10.427 18.132 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -7.371 -13.341 18.146 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -5.880 -12.815 18.902 1.00 0.00 H new ATOM 392 N ILE A 27 -6.150 -12.532 15.606 1.00 0.00 N ATOM 393 CA ILE A 27 -5.253 -12.932 14.528 1.00 0.00 C ATOM 394 C ILE A 27 -4.855 -11.722 13.692 1.00 0.00 C ATOM 395 O ILE A 27 -3.683 -11.544 13.361 1.00 0.00 O ATOM 396 CB ILE A 27 -5.936 -13.974 13.634 1.00 0.00 C ATOM 397 CG1 ILE A 27 -6.102 -15.283 14.413 1.00 0.00 C ATOM 398 CG2 ILE A 27 -5.083 -14.230 12.383 1.00 0.00 C ATOM 399 CD1 ILE A 27 -6.996 -16.241 13.622 1.00 0.00 C ATOM 0 H ILE A 27 -7.076 -12.959 15.571 1.00 0.00 H new ATOM 0 HA ILE A 27 -4.356 -13.368 14.968 1.00 0.00 H new ATOM 0 HB ILE A 27 -6.914 -13.600 13.331 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -5.128 -15.740 14.588 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -6.541 -15.083 15.390 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -5.575 -14.971 11.753 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.966 -13.300 11.826 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -4.102 -14.600 12.681 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -7.113 -17.172 14.177 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -7.974 -15.784 13.469 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -6.539 -16.451 12.655 1.00 0.00 H new ATOM 411 N LEU A 28 -5.840 -10.896 13.352 1.00 0.00 N ATOM 412 CA LEU A 28 -5.576 -9.712 12.551 1.00 0.00 C ATOM 413 C LEU A 28 -4.619 -8.769 13.271 1.00 0.00 C ATOM 414 O LEU A 28 -3.654 -8.293 12.686 1.00 0.00 O ATOM 415 CB LEU A 28 -6.900 -8.975 12.259 1.00 0.00 C ATOM 416 CG LEU A 28 -7.704 -9.736 11.182 1.00 0.00 C ATOM 417 CD1 LEU A 28 -9.183 -9.347 11.266 1.00 0.00 C ATOM 418 CD2 LEU A 28 -7.177 -9.373 9.786 1.00 0.00 C ATOM 0 H LEU A 28 -6.817 -11.025 13.616 1.00 0.00 H new ATOM 0 HA LEU A 28 -5.114 -10.028 11.616 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -7.489 -8.892 13.173 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -6.693 -7.960 11.920 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.593 -10.807 11.353 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -9.745 -9.887 10.504 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -9.571 -9.602 12.252 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -9.287 -8.274 11.102 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.748 -9.913 9.030 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -7.284 -8.300 9.624 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -6.125 -9.648 9.711 1.00 0.00 H new ATOM 430 N THR A 29 -4.890 -8.511 14.545 1.00 0.00 N ATOM 431 CA THR A 29 -4.054 -7.604 15.328 1.00 0.00 C ATOM 432 C THR A 29 -2.622 -8.132 15.439 1.00 0.00 C ATOM 433 O THR A 29 -1.659 -7.372 15.351 1.00 0.00 O ATOM 434 CB THR A 29 -4.639 -7.438 16.735 1.00 0.00 C ATOM 435 OG1 THR A 29 -6.029 -7.156 16.635 1.00 0.00 O ATOM 436 CG2 THR A 29 -3.937 -6.275 17.453 1.00 0.00 C ATOM 0 H THR A 29 -5.676 -8.913 15.056 1.00 0.00 H new ATOM 0 HA THR A 29 -4.034 -6.641 14.818 1.00 0.00 H new ATOM 0 HB THR A 29 -4.488 -8.357 17.301 1.00 0.00 H new ATOM 0 HG1 THR A 29 -6.532 -7.997 16.607 1.00 0.00 H new ATOM 0 HG21 THR A 29 -4.355 -6.159 18.453 1.00 0.00 H new ATOM 0 HG22 THR A 29 -2.870 -6.485 17.528 1.00 0.00 H new ATOM 0 HG23 THR A 29 -4.087 -5.355 16.888 1.00 0.00 H new ATOM 444 N VAL A 30 -2.488 -9.437 15.640 1.00 0.00 N ATOM 445 CA VAL A 30 -1.164 -10.043 15.787 1.00 0.00 C ATOM 446 C VAL A 30 -0.313 -9.861 14.525 1.00 0.00 C ATOM 447 O VAL A 30 0.830 -9.410 14.595 1.00 0.00 O ATOM 448 CB VAL A 30 -1.318 -11.542 16.079 1.00 0.00 C ATOM 449 CG1 VAL A 30 0.061 -12.214 16.063 1.00 0.00 C ATOM 450 CG2 VAL A 30 -1.972 -11.734 17.462 1.00 0.00 C ATOM 0 H VAL A 30 -3.267 -10.092 15.705 1.00 0.00 H new ATOM 0 HA VAL A 30 -0.657 -9.543 16.613 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.949 -11.996 15.315 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.050 -13.278 16.271 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.519 -12.081 15.083 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.696 -11.760 16.824 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -2.081 -12.799 17.668 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -1.344 -11.278 18.228 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -2.954 -11.261 17.469 1.00 0.00 H new ATOM 460 N PHE A 31 -0.878 -10.211 13.374 1.00 0.00 N ATOM 461 CA PHE A 31 -0.162 -10.097 12.100 1.00 0.00 C ATOM 462 C PHE A 31 -0.329 -8.712 11.479 1.00 0.00 C ATOM 463 O PHE A 31 0.402 -8.333 10.563 1.00 0.00 O ATOM 464 CB PHE A 31 -0.675 -11.158 11.125 1.00 0.00 C ATOM 465 CG PHE A 31 -0.177 -12.517 11.552 1.00 0.00 C ATOM 466 CD1 PHE A 31 1.085 -12.956 11.140 1.00 0.00 C ATOM 467 CD2 PHE A 31 -0.977 -13.336 12.359 1.00 0.00 C ATOM 468 CE1 PHE A 31 1.550 -14.214 11.535 1.00 0.00 C ATOM 469 CE2 PHE A 31 -0.511 -14.595 12.753 1.00 0.00 C ATOM 470 CZ PHE A 31 0.751 -15.034 12.342 1.00 0.00 C ATOM 0 H PHE A 31 -1.827 -10.576 13.293 1.00 0.00 H new ATOM 0 HA PHE A 31 0.899 -10.251 12.299 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -1.765 -11.149 11.102 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.333 -10.934 10.115 1.00 0.00 H new ATOM 0 HD1 PHE A 31 1.700 -12.324 10.517 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -1.952 -12.996 12.677 1.00 0.00 H new ATOM 0 HE1 PHE A 31 2.525 -14.553 11.218 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -1.127 -15.228 13.375 1.00 0.00 H new ATOM 0 HZ PHE A 31 1.110 -16.006 12.647 1.00 0.00 H new ATOM 480 N SER A 32 -1.301 -7.966 11.973 1.00 0.00 N ATOM 481 CA SER A 32 -1.572 -6.636 11.439 1.00 0.00 C ATOM 482 C SER A 32 -0.285 -5.824 11.257 1.00 0.00 C ATOM 483 O SER A 32 0.008 -5.342 10.157 1.00 0.00 O ATOM 484 CB SER A 32 -2.509 -5.878 12.377 1.00 0.00 C ATOM 485 OG SER A 32 -2.317 -4.478 12.214 1.00 0.00 O ATOM 0 H SER A 32 -1.913 -8.252 12.737 1.00 0.00 H new ATOM 0 HA SER A 32 -2.039 -6.766 10.463 1.00 0.00 H new ATOM 0 HB2 SER A 32 -3.545 -6.141 12.163 1.00 0.00 H new ATOM 0 HB3 SER A 32 -2.315 -6.164 13.411 1.00 0.00 H new ATOM 0 HG SER A 32 -2.660 -4.200 11.339 1.00 0.00 H new ATOM 491 N GLU A 33 0.477 -5.683 12.337 1.00 0.00 N ATOM 492 CA GLU A 33 1.723 -4.918 12.294 1.00 0.00 C ATOM 493 C GLU A 33 2.739 -5.571 11.362 1.00 0.00 C ATOM 494 O GLU A 33 3.764 -4.978 11.028 1.00 0.00 O ATOM 495 CB GLU A 33 2.319 -4.814 13.702 1.00 0.00 C ATOM 496 CG GLU A 33 2.742 -6.202 14.190 1.00 0.00 C ATOM 497 CD GLU A 33 3.165 -6.137 15.653 1.00 0.00 C ATOM 498 OE1 GLU A 33 3.117 -5.056 16.215 1.00 0.00 O ATOM 499 OE2 GLU A 33 3.530 -7.170 16.190 1.00 0.00 O ATOM 0 H GLU A 33 0.257 -6.085 13.248 1.00 0.00 H new ATOM 0 HA GLU A 33 1.494 -3.922 11.914 1.00 0.00 H new ATOM 0 HB2 GLU A 33 3.178 -4.144 13.694 1.00 0.00 H new ATOM 0 HB3 GLU A 33 1.587 -4.386 14.386 1.00 0.00 H new ATOM 0 HG2 GLU A 33 1.917 -6.904 14.073 1.00 0.00 H new ATOM 0 HG3 GLU A 33 3.566 -6.574 13.581 1.00 0.00 H new ATOM 506 N TYR A 34 2.452 -6.801 10.952 1.00 0.00 N ATOM 507 CA TYR A 34 3.349 -7.552 10.069 1.00 0.00 C ATOM 508 C TYR A 34 2.713 -7.766 8.690 1.00 0.00 C ATOM 509 O TYR A 34 2.922 -8.801 8.058 1.00 0.00 O ATOM 510 CB TYR A 34 3.718 -8.910 10.720 1.00 0.00 C ATOM 511 CG TYR A 34 5.052 -8.801 11.439 1.00 0.00 C ATOM 512 CD1 TYR A 34 6.211 -8.471 10.717 1.00 0.00 C ATOM 513 CD2 TYR A 34 5.133 -9.022 12.820 1.00 0.00 C ATOM 514 CE1 TYR A 34 7.440 -8.363 11.376 1.00 0.00 C ATOM 515 CE2 TYR A 34 6.366 -8.915 13.475 1.00 0.00 C ATOM 516 CZ TYR A 34 7.519 -8.585 12.749 1.00 0.00 C ATOM 517 OH TYR A 34 8.733 -8.480 13.388 1.00 0.00 O ATOM 0 H TYR A 34 1.605 -7.304 11.215 1.00 0.00 H new ATOM 0 HA TYR A 34 4.260 -6.971 9.927 1.00 0.00 H new ATOM 0 HB2 TYR A 34 2.941 -9.208 11.424 1.00 0.00 H new ATOM 0 HB3 TYR A 34 3.771 -9.686 9.956 1.00 0.00 H new ATOM 0 HD1 TYR A 34 6.153 -8.301 9.652 1.00 0.00 H new ATOM 0 HD2 TYR A 34 4.244 -9.275 13.379 1.00 0.00 H new ATOM 0 HE1 TYR A 34 8.329 -8.107 10.819 1.00 0.00 H new ATOM 0 HE2 TYR A 34 6.429 -9.087 14.539 1.00 0.00 H new ATOM 0 HH TYR A 34 8.640 -7.902 14.174 1.00 0.00 H new ATOM 527 N GLY A 35 1.927 -6.790 8.232 1.00 0.00 N ATOM 528 CA GLY A 35 1.273 -6.927 6.932 1.00 0.00 C ATOM 529 C GLY A 35 -0.157 -7.415 7.081 1.00 0.00 C ATOM 530 O GLY A 35 -0.472 -8.554 6.739 1.00 0.00 O ATOM 0 H GLY A 35 1.732 -5.919 8.727 1.00 0.00 H new ATOM 0 HA2 GLY A 35 1.280 -5.967 6.416 1.00 0.00 H new ATOM 0 HA3 GLY A 35 1.835 -7.626 6.312 1.00 0.00 H new ATOM 534 N VAL A 36 -1.014 -6.553 7.612 1.00 0.00 N ATOM 535 CA VAL A 36 -2.398 -6.935 7.841 1.00 0.00 C ATOM 536 C VAL A 36 -3.052 -7.434 6.542 1.00 0.00 C ATOM 537 O VAL A 36 -3.001 -6.758 5.517 1.00 0.00 O ATOM 538 CB VAL A 36 -3.186 -5.715 8.363 1.00 0.00 C ATOM 539 CG1 VAL A 36 -3.502 -4.752 7.208 1.00 0.00 C ATOM 540 CG2 VAL A 36 -4.495 -6.193 9.000 1.00 0.00 C ATOM 0 H VAL A 36 -0.779 -5.600 7.888 1.00 0.00 H new ATOM 0 HA VAL A 36 -2.416 -7.741 8.575 1.00 0.00 H new ATOM 0 HB VAL A 36 -2.582 -5.192 9.104 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -4.058 -3.896 7.590 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -2.572 -4.408 6.756 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -4.101 -5.268 6.458 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -5.055 -5.334 9.370 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -5.091 -6.721 8.255 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -4.272 -6.865 9.829 1.00 0.00 H new ATOM 550 N PRO A 37 -3.662 -8.616 6.578 1.00 0.00 N ATOM 551 CA PRO A 37 -4.344 -9.232 5.396 1.00 0.00 C ATOM 552 C PRO A 37 -5.666 -8.536 5.079 1.00 0.00 C ATOM 553 O PRO A 37 -6.224 -7.831 5.918 1.00 0.00 O ATOM 554 CB PRO A 37 -4.575 -10.696 5.804 1.00 0.00 C ATOM 555 CG PRO A 37 -4.652 -10.683 7.294 1.00 0.00 C ATOM 556 CD PRO A 37 -3.773 -9.525 7.758 1.00 0.00 C ATOM 0 HA PRO A 37 -3.745 -9.141 4.490 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -5.494 -11.086 5.366 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -3.762 -11.334 5.458 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -5.681 -10.549 7.629 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -4.302 -11.628 7.710 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -4.218 -9.011 8.610 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -2.792 -9.879 8.076 1.00 0.00 H new ATOM 564 N VAL A 38 -6.159 -8.741 3.864 1.00 0.00 N ATOM 565 CA VAL A 38 -7.416 -8.120 3.443 1.00 0.00 C ATOM 566 C VAL A 38 -8.603 -9.010 3.798 1.00 0.00 C ATOM 567 O VAL A 38 -9.751 -8.568 3.765 1.00 0.00 O ATOM 568 CB VAL A 38 -7.398 -7.881 1.931 1.00 0.00 C ATOM 569 CG1 VAL A 38 -6.404 -6.771 1.599 1.00 0.00 C ATOM 570 CG2 VAL A 38 -6.977 -9.170 1.217 1.00 0.00 C ATOM 0 H VAL A 38 -5.715 -9.326 3.156 1.00 0.00 H new ATOM 0 HA VAL A 38 -7.519 -7.169 3.965 1.00 0.00 H new ATOM 0 HB VAL A 38 -8.394 -7.587 1.600 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -6.393 -6.603 0.522 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -6.701 -5.853 2.107 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -5.408 -7.064 1.931 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -6.964 -9.002 0.140 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -5.981 -9.462 1.551 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -7.686 -9.964 1.451 1.00 0.00 H new ATOM 580 N ASP A 39 -8.319 -10.261 4.140 1.00 0.00 N ATOM 581 CA ASP A 39 -9.373 -11.203 4.503 1.00 0.00 C ATOM 582 C ASP A 39 -8.782 -12.466 5.114 1.00 0.00 C ATOM 583 O ASP A 39 -7.678 -12.881 4.755 1.00 0.00 O ATOM 584 CB ASP A 39 -10.188 -11.573 3.266 1.00 0.00 C ATOM 585 CG ASP A 39 -11.397 -12.411 3.669 1.00 0.00 C ATOM 586 OD1 ASP A 39 -12.224 -11.904 4.409 1.00 0.00 O ATOM 587 OD2 ASP A 39 -11.475 -13.547 3.233 1.00 0.00 O ATOM 0 H ASP A 39 -7.375 -10.646 4.174 1.00 0.00 H new ATOM 0 HA ASP A 39 -10.019 -10.725 5.240 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -10.516 -10.669 2.753 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -9.567 -12.130 2.564 1.00 0.00 H new ATOM 592 N VAL A 40 -9.523 -13.084 6.037 1.00 0.00 N ATOM 593 CA VAL A 40 -9.062 -14.315 6.685 1.00 0.00 C ATOM 594 C VAL A 40 -10.086 -15.426 6.484 1.00 0.00 C ATOM 595 O VAL A 40 -11.276 -15.237 6.734 1.00 0.00 O ATOM 596 CB VAL A 40 -8.834 -14.069 8.182 1.00 0.00 C ATOM 597 CG1 VAL A 40 -7.984 -12.802 8.378 1.00 0.00 C ATOM 598 CG2 VAL A 40 -10.182 -13.893 8.879 1.00 0.00 C ATOM 0 H VAL A 40 -10.437 -12.756 6.351 1.00 0.00 H new ATOM 0 HA VAL A 40 -8.119 -14.621 6.233 1.00 0.00 H new ATOM 0 HB VAL A 40 -8.310 -14.922 8.612 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -7.825 -12.632 9.443 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -7.021 -12.930 7.883 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -8.503 -11.946 7.947 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -10.021 -13.718 9.943 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -10.707 -13.041 8.446 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -10.781 -14.794 8.746 1.00 0.00 H new ATOM 608 N ILE A 41 -9.615 -16.586 6.034 1.00 0.00 N ATOM 609 CA ILE A 41 -10.505 -17.721 5.802 1.00 0.00 C ATOM 610 C ILE A 41 -10.532 -18.634 7.016 1.00 0.00 C ATOM 611 O ILE A 41 -9.536 -19.284 7.336 1.00 0.00 O ATOM 612 CB ILE A 41 -10.033 -18.508 4.579 1.00 0.00 C ATOM 613 CG1 ILE A 41 -10.024 -17.590 3.353 1.00 0.00 C ATOM 614 CG2 ILE A 41 -10.983 -19.682 4.330 1.00 0.00 C ATOM 615 CD1 ILE A 41 -9.306 -18.288 2.195 1.00 0.00 C ATOM 0 H ILE A 41 -8.633 -16.765 5.824 1.00 0.00 H new ATOM 0 HA ILE A 41 -11.512 -17.342 5.625 1.00 0.00 H new ATOM 0 HB ILE A 41 -9.026 -18.886 4.757 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -11.045 -17.342 3.064 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -9.523 -16.652 3.592 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -10.647 -20.243 3.458 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -10.990 -20.336 5.202 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -11.990 -19.304 4.152 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -9.300 -17.634 1.323 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -8.280 -18.514 2.486 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -9.826 -19.214 1.950 1.00 0.00 H new ATOM 627 N LEU A 42 -11.679 -18.685 7.690 1.00 0.00 N ATOM 628 CA LEU A 42 -11.828 -19.532 8.874 1.00 0.00 C ATOM 629 C LEU A 42 -12.870 -20.624 8.624 1.00 0.00 C ATOM 630 O LEU A 42 -14.070 -20.394 8.780 1.00 0.00 O ATOM 631 CB LEU A 42 -12.248 -18.670 10.098 1.00 0.00 C ATOM 632 CG LEU A 42 -11.093 -18.582 11.110 1.00 0.00 C ATOM 633 CD1 LEU A 42 -10.004 -17.660 10.560 1.00 0.00 C ATOM 634 CD2 LEU A 42 -11.607 -18.021 12.437 1.00 0.00 C ATOM 0 H LEU A 42 -12.514 -18.155 7.440 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.869 -20.006 9.083 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -12.528 -17.670 9.768 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -13.126 -19.106 10.575 1.00 0.00 H new ATOM 0 HG LEU A 42 -10.684 -19.579 11.274 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -9.185 -17.597 11.276 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -9.631 -18.059 9.617 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -10.419 -16.666 10.394 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -10.784 -17.961 13.150 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -12.020 -17.025 12.275 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -12.383 -18.676 12.833 1.00 0.00 H new ATOM 646 N SER A 43 -12.403 -21.806 8.242 1.00 0.00 N ATOM 647 CA SER A 43 -13.306 -22.924 7.989 1.00 0.00 C ATOM 648 C SER A 43 -13.825 -23.487 9.306 1.00 0.00 C ATOM 649 O SER A 43 -13.053 -23.719 10.233 1.00 0.00 O ATOM 650 CB SER A 43 -12.574 -24.018 7.212 1.00 0.00 C ATOM 651 OG SER A 43 -13.416 -25.159 7.105 1.00 0.00 O ATOM 0 H SER A 43 -11.415 -22.015 8.101 1.00 0.00 H new ATOM 0 HA SER A 43 -14.150 -22.568 7.398 1.00 0.00 H new ATOM 0 HB2 SER A 43 -12.303 -23.657 6.220 1.00 0.00 H new ATOM 0 HB3 SER A 43 -11.646 -24.282 7.719 1.00 0.00 H new ATOM 0 HG SER A 43 -12.951 -25.863 6.606 1.00 0.00 H new ATOM 657 N ARG A 44 -15.139 -23.705 9.386 1.00 0.00 N ATOM 658 CA ARG A 44 -15.752 -24.239 10.607 1.00 0.00 C ATOM 659 C ARG A 44 -16.542 -25.511 10.309 1.00 0.00 C ATOM 660 O ARG A 44 -17.331 -25.557 9.365 1.00 0.00 O ATOM 661 CB ARG A 44 -16.690 -23.192 11.212 1.00 0.00 C ATOM 662 CG ARG A 44 -15.905 -21.911 11.503 1.00 0.00 C ATOM 663 CD ARG A 44 -16.830 -20.883 12.154 1.00 0.00 C ATOM 664 NE ARG A 44 -16.181 -19.575 12.193 1.00 0.00 N ATOM 665 CZ ARG A 44 -15.317 -19.259 13.152 1.00 0.00 C ATOM 666 NH1 ARG A 44 -15.034 -20.125 14.086 1.00 0.00 N ATOM 667 NH2 ARG A 44 -14.754 -18.082 13.161 1.00 0.00 N ATOM 0 H ARG A 44 -15.796 -23.522 8.627 1.00 0.00 H new ATOM 0 HA ARG A 44 -14.957 -24.479 11.313 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -17.509 -22.981 10.524 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -17.136 -23.575 12.130 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -15.065 -22.129 12.162 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -15.490 -21.509 10.579 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -17.764 -20.817 11.595 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -17.085 -21.201 13.165 1.00 0.00 H new ATOM 0 HE ARG A 44 -16.396 -18.890 11.469 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -15.476 -21.044 14.080 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -14.371 -19.883 14.822 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -14.977 -17.404 12.432 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -14.091 -17.839 13.897 1.00 0.00 H new ATOM 786 N GLY A 53 -8.592 -25.517 14.376 1.00 0.00 N ATOM 787 CA GLY A 53 -7.352 -24.884 14.834 1.00 0.00 C ATOM 788 C GLY A 53 -6.442 -24.520 13.660 1.00 0.00 C ATOM 789 O GLY A 53 -5.224 -24.682 13.731 1.00 0.00 O ATOM 0 HA2 GLY A 53 -7.590 -23.986 15.404 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -6.825 -25.559 15.508 1.00 0.00 H new ATOM 793 N PHE A 54 -7.042 -24.030 12.574 1.00 0.00 N ATOM 794 CA PHE A 54 -6.272 -23.631 11.394 1.00 0.00 C ATOM 795 C PHE A 54 -6.997 -22.524 10.627 1.00 0.00 C ATOM 796 O PHE A 54 -8.224 -22.437 10.659 1.00 0.00 O ATOM 797 CB PHE A 54 -6.060 -24.839 10.476 1.00 0.00 C ATOM 798 CG PHE A 54 -7.383 -25.263 9.885 1.00 0.00 C ATOM 799 CD1 PHE A 54 -7.819 -24.707 8.679 1.00 0.00 C ATOM 800 CD2 PHE A 54 -8.171 -26.208 10.546 1.00 0.00 C ATOM 801 CE1 PHE A 54 -9.047 -25.098 8.132 1.00 0.00 C ATOM 802 CE2 PHE A 54 -9.399 -26.601 9.999 1.00 0.00 C ATOM 803 CZ PHE A 54 -9.837 -26.045 8.791 1.00 0.00 C ATOM 0 H PHE A 54 -8.050 -23.900 12.486 1.00 0.00 H new ATOM 0 HA PHE A 54 -5.305 -23.252 11.725 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -5.359 -24.586 9.681 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -5.620 -25.663 11.038 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -7.209 -23.976 8.169 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -7.833 -26.636 11.479 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -9.384 -24.668 7.201 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -10.008 -27.333 10.509 1.00 0.00 H new ATOM 0 HZ PHE A 54 -10.784 -26.347 8.369 1.00 0.00 H new ATOM 813 N ALA A 55 -6.231 -21.681 9.939 1.00 0.00 N ATOM 814 CA ALA A 55 -6.811 -20.583 9.165 1.00 0.00 C ATOM 815 C ALA A 55 -5.828 -20.092 8.101 1.00 0.00 C ATOM 816 O ALA A 55 -4.633 -20.377 8.171 1.00 0.00 O ATOM 817 CB ALA A 55 -7.180 -19.428 10.094 1.00 0.00 C ATOM 0 H ALA A 55 -5.213 -21.735 9.900 1.00 0.00 H new ATOM 0 HA ALA A 55 -7.709 -20.951 8.668 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -7.611 -18.615 9.510 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -7.907 -19.771 10.830 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -6.286 -19.073 10.606 1.00 0.00 H new ATOM 823 N TYR A 56 -6.338 -19.350 7.113 1.00 0.00 N ATOM 824 CA TYR A 56 -5.486 -18.820 6.039 1.00 0.00 C ATOM 825 C TYR A 56 -5.842 -17.365 5.730 1.00 0.00 C ATOM 826 O TYR A 56 -6.986 -17.060 5.390 1.00 0.00 O ATOM 827 CB TYR A 56 -5.666 -19.668 4.781 1.00 0.00 C ATOM 828 CG TYR A 56 -5.434 -21.119 5.120 1.00 0.00 C ATOM 829 CD1 TYR A 56 -4.134 -21.604 5.256 1.00 0.00 C ATOM 830 CD2 TYR A 56 -6.526 -21.981 5.296 1.00 0.00 C ATOM 831 CE1 TYR A 56 -3.917 -22.952 5.567 1.00 0.00 C ATOM 832 CE2 TYR A 56 -6.310 -23.327 5.610 1.00 0.00 C ATOM 833 CZ TYR A 56 -5.006 -23.813 5.745 1.00 0.00 C ATOM 834 OH TYR A 56 -4.793 -25.141 6.054 1.00 0.00 O ATOM 0 H TYR A 56 -7.325 -19.104 7.033 1.00 0.00 H new ATOM 0 HA TYR A 56 -4.448 -18.860 6.368 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -6.670 -19.533 4.378 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -4.967 -19.347 4.009 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -3.293 -20.939 5.121 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -7.533 -21.606 5.189 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -2.909 -23.327 5.669 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -7.151 -23.991 5.748 1.00 0.00 H new ATOM 0 HH TYR A 56 -5.655 -25.598 6.145 1.00 0.00 H new ATOM 844 N LEU A 57 -4.856 -16.466 5.847 1.00 0.00 N ATOM 845 CA LEU A 57 -5.067 -15.036 5.584 1.00 0.00 C ATOM 846 C LEU A 57 -4.427 -14.641 4.251 1.00 0.00 C ATOM 847 O LEU A 57 -3.316 -15.069 3.934 1.00 0.00 O ATOM 848 CB LEU A 57 -4.469 -14.164 6.727 1.00 0.00 C ATOM 849 CG LEU A 57 -3.865 -15.062 7.811 1.00 0.00 C ATOM 850 CD1 LEU A 57 -2.551 -15.680 7.283 1.00 0.00 C ATOM 851 CD2 LEU A 57 -3.580 -14.235 9.074 1.00 0.00 C ATOM 0 H LEU A 57 -3.903 -16.704 6.122 1.00 0.00 H new ATOM 0 HA LEU A 57 -6.142 -14.860 5.536 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -3.704 -13.499 6.326 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -5.246 -13.532 7.158 1.00 0.00 H new ATOM 0 HG LEU A 57 -4.568 -15.856 8.060 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -2.116 -16.320 8.050 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -2.760 -16.272 6.392 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -1.849 -14.884 7.034 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -3.151 -14.879 9.841 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -2.877 -13.437 8.835 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -4.510 -13.802 9.443 1.00 0.00 H new ATOM 863 N LYS A 58 -5.132 -13.818 3.479 1.00 0.00 N ATOM 864 CA LYS A 58 -4.616 -13.364 2.190 1.00 0.00 C ATOM 865 C LYS A 58 -3.700 -12.155 2.377 1.00 0.00 C ATOM 866 O LYS A 58 -4.167 -11.041 2.628 1.00 0.00 O ATOM 867 CB LYS A 58 -5.779 -12.989 1.266 1.00 0.00 C ATOM 868 CG LYS A 58 -6.935 -14.004 1.431 1.00 0.00 C ATOM 869 CD LYS A 58 -7.752 -14.097 0.119 1.00 0.00 C ATOM 870 CE LYS A 58 -8.720 -12.904 0.018 1.00 0.00 C ATOM 871 NZ LYS A 58 -10.046 -13.294 0.576 1.00 0.00 N ATOM 0 H LYS A 58 -6.054 -13.454 3.720 1.00 0.00 H new ATOM 0 HA LYS A 58 -4.042 -14.175 1.741 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -6.130 -11.984 1.500 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -5.441 -12.976 0.230 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -6.535 -14.984 1.690 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -7.584 -13.698 2.252 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -7.079 -14.104 -0.739 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -8.311 -15.033 0.094 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -8.320 -12.050 0.564 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -8.827 -12.595 -1.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -10.610 -12.440 0.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -10.546 -13.898 -0.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -9.909 -13.817 1.464 1.00 0.00 H new ATOM 885 N TYR A 59 -2.395 -12.386 2.255 1.00 0.00 N ATOM 886 CA TYR A 59 -1.420 -11.311 2.410 1.00 0.00 C ATOM 887 C TYR A 59 -1.330 -10.476 1.128 1.00 0.00 C ATOM 888 O TYR A 59 -1.333 -11.017 0.022 1.00 0.00 O ATOM 889 CB TYR A 59 -0.031 -11.903 2.743 1.00 0.00 C ATOM 890 CG TYR A 59 0.139 -12.008 4.243 1.00 0.00 C ATOM 891 CD1 TYR A 59 -0.917 -12.473 5.031 1.00 0.00 C ATOM 892 CD2 TYR A 59 1.349 -11.636 4.844 1.00 0.00 C ATOM 893 CE1 TYR A 59 -0.765 -12.566 6.417 1.00 0.00 C ATOM 894 CE2 TYR A 59 1.501 -11.731 6.233 1.00 0.00 C ATOM 895 CZ TYR A 59 0.442 -12.196 7.020 1.00 0.00 C ATOM 896 OH TYR A 59 0.590 -12.288 8.387 1.00 0.00 O ATOM 0 H TYR A 59 -1.991 -13.300 2.051 1.00 0.00 H new ATOM 0 HA TYR A 59 -1.745 -10.666 3.227 1.00 0.00 H new ATOM 0 HB2 TYR A 59 0.073 -12.887 2.287 1.00 0.00 H new ATOM 0 HB3 TYR A 59 0.753 -11.273 2.323 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -1.850 -12.760 4.569 1.00 0.00 H new ATOM 0 HD2 TYR A 59 2.165 -11.276 4.235 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -1.582 -12.925 7.025 1.00 0.00 H new ATOM 0 HE2 TYR A 59 2.434 -11.446 6.696 1.00 0.00 H new ATOM 0 HH TYR A 59 0.827 -13.207 8.629 1.00 0.00 H new ATOM 906 N GLU A 60 -1.251 -9.158 1.288 1.00 0.00 N ATOM 907 CA GLU A 60 -1.153 -8.261 0.136 1.00 0.00 C ATOM 908 C GLU A 60 0.210 -8.398 -0.527 1.00 0.00 C ATOM 909 O GLU A 60 0.312 -8.454 -1.753 1.00 0.00 O ATOM 910 CB GLU A 60 -1.363 -6.811 0.587 1.00 0.00 C ATOM 911 CG GLU A 60 -2.780 -6.647 1.164 1.00 0.00 C ATOM 912 CD GLU A 60 -2.777 -6.973 2.657 1.00 0.00 C ATOM 913 OE1 GLU A 60 -1.801 -7.538 3.118 1.00 0.00 O ATOM 914 OE2 GLU A 60 -3.752 -6.652 3.316 1.00 0.00 O ATOM 0 H GLU A 60 -1.253 -8.689 2.194 1.00 0.00 H new ATOM 0 HA GLU A 60 -1.925 -8.532 -0.585 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -0.621 -6.543 1.339 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -1.222 -6.134 -0.256 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -3.130 -5.627 1.007 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -3.473 -7.306 0.641 1.00 0.00 H new ATOM 921 N ASP A 61 1.257 -8.459 0.290 1.00 0.00 N ATOM 922 CA ASP A 61 2.620 -8.594 -0.233 1.00 0.00 C ATOM 923 C ASP A 61 3.251 -9.883 0.276 1.00 0.00 C ATOM 924 O ASP A 61 3.314 -10.120 1.484 1.00 0.00 O ATOM 925 CB ASP A 61 3.466 -7.396 0.201 1.00 0.00 C ATOM 926 CG ASP A 61 2.746 -6.097 -0.144 1.00 0.00 C ATOM 927 OD1 ASP A 61 2.335 -5.954 -1.283 1.00 0.00 O ATOM 928 OD2 ASP A 61 2.614 -5.266 0.739 1.00 0.00 O ATOM 0 H ASP A 61 1.194 -8.418 1.307 1.00 0.00 H new ATOM 0 HA ASP A 61 2.578 -8.626 -1.322 1.00 0.00 H new ATOM 0 HB2 ASP A 61 3.655 -7.443 1.274 1.00 0.00 H new ATOM 0 HB3 ASP A 61 4.436 -7.427 -0.295 1.00 0.00 H new ATOM 933 N GLN A 62 3.719 -10.711 -0.651 1.00 0.00 N ATOM 934 CA GLN A 62 4.341 -11.976 -0.289 1.00 0.00 C ATOM 935 C GLN A 62 5.594 -11.736 0.537 1.00 0.00 C ATOM 936 O GLN A 62 5.916 -12.514 1.434 1.00 0.00 O ATOM 937 CB GLN A 62 4.700 -12.767 -1.549 1.00 0.00 C ATOM 938 CG GLN A 62 5.159 -14.173 -1.156 1.00 0.00 C ATOM 939 CD GLN A 62 5.416 -15.006 -2.407 1.00 0.00 C ATOM 940 OE1 GLN A 62 5.266 -14.512 -3.523 1.00 0.00 O ATOM 941 NE2 GLN A 62 5.797 -16.248 -2.284 1.00 0.00 N ATOM 0 H GLN A 62 3.679 -10.529 -1.654 1.00 0.00 H new ATOM 0 HA GLN A 62 3.630 -12.550 0.306 1.00 0.00 H new ATOM 0 HB2 GLN A 62 3.837 -12.827 -2.212 1.00 0.00 H new ATOM 0 HB3 GLN A 62 5.490 -12.256 -2.099 1.00 0.00 H new ATOM 0 HG2 GLN A 62 6.067 -14.114 -0.556 1.00 0.00 H new ATOM 0 HG3 GLN A 62 4.400 -14.653 -0.539 1.00 0.00 H new ATOM 0 HE21 GLN A 62 5.920 -16.654 -1.357 1.00 0.00 H new ATOM 0 HE22 GLN A 62 5.972 -16.813 -3.115 1.00 0.00 H new ATOM 950 N ARG A 63 6.299 -10.658 0.228 1.00 0.00 N ATOM 951 CA ARG A 63 7.525 -10.329 0.939 1.00 0.00 C ATOM 952 C ARG A 63 7.242 -10.150 2.429 1.00 0.00 C ATOM 953 O ARG A 63 8.082 -10.461 3.268 1.00 0.00 O ATOM 954 CB ARG A 63 8.136 -9.043 0.365 1.00 0.00 C ATOM 955 CG ARG A 63 8.832 -9.348 -0.968 1.00 0.00 C ATOM 956 CD ARG A 63 7.810 -9.893 -1.970 1.00 0.00 C ATOM 957 NE ARG A 63 8.348 -9.843 -3.324 1.00 0.00 N ATOM 958 CZ ARG A 63 7.648 -10.299 -4.359 1.00 0.00 C ATOM 959 NH1 ARG A 63 6.458 -10.799 -4.172 1.00 0.00 N ATOM 960 NH2 ARG A 63 8.151 -10.243 -5.562 1.00 0.00 N ATOM 0 H ARG A 63 6.044 -9.999 -0.507 1.00 0.00 H new ATOM 0 HA ARG A 63 8.233 -11.148 0.812 1.00 0.00 H new ATOM 0 HB2 ARG A 63 7.358 -8.295 0.216 1.00 0.00 H new ATOM 0 HB3 ARG A 63 8.852 -8.623 1.072 1.00 0.00 H new ATOM 0 HG2 ARG A 63 9.296 -8.444 -1.362 1.00 0.00 H new ATOM 0 HG3 ARG A 63 9.629 -10.075 -0.815 1.00 0.00 H new ATOM 0 HD2 ARG A 63 7.551 -10.920 -1.713 1.00 0.00 H new ATOM 0 HD3 ARG A 63 6.891 -9.309 -1.915 1.00 0.00 H new ATOM 0 HE ARG A 63 9.277 -9.452 -3.480 1.00 0.00 H new ATOM 0 HH11 ARG A 63 6.064 -10.840 -3.232 1.00 0.00 H new ATOM 0 HH12 ARG A 63 5.921 -11.149 -4.966 1.00 0.00 H new ATOM 0 HH21 ARG A 63 9.081 -9.850 -5.708 1.00 0.00 H new ATOM 0 HH22 ARG A 63 7.614 -10.593 -6.356 1.00 0.00 H new ATOM 974 N SER A 64 6.052 -9.645 2.748 1.00 0.00 N ATOM 975 CA SER A 64 5.672 -9.423 4.140 1.00 0.00 C ATOM 976 C SER A 64 5.705 -10.735 4.927 1.00 0.00 C ATOM 977 O SER A 64 6.094 -10.759 6.094 1.00 0.00 O ATOM 978 CB SER A 64 4.267 -8.826 4.212 1.00 0.00 C ATOM 979 OG SER A 64 3.922 -8.602 5.573 1.00 0.00 O ATOM 0 H SER A 64 5.339 -9.384 2.067 1.00 0.00 H new ATOM 0 HA SER A 64 6.388 -8.728 4.580 1.00 0.00 H new ATOM 0 HB2 SER A 64 4.228 -7.889 3.656 1.00 0.00 H new ATOM 0 HB3 SER A 64 3.548 -9.502 3.749 1.00 0.00 H new ATOM 0 HG SER A 64 3.296 -9.295 5.870 1.00 0.00 H new ATOM 985 N THR A 65 5.286 -11.822 4.282 1.00 0.00 N ATOM 986 CA THR A 65 5.255 -13.126 4.940 1.00 0.00 C ATOM 987 C THR A 65 6.641 -13.500 5.462 1.00 0.00 C ATOM 988 O THR A 65 6.766 -14.152 6.499 1.00 0.00 O ATOM 989 CB THR A 65 4.784 -14.199 3.955 1.00 0.00 C ATOM 990 OG1 THR A 65 5.731 -14.323 2.904 1.00 0.00 O ATOM 991 CG2 THR A 65 3.427 -13.799 3.376 1.00 0.00 C ATOM 0 H THR A 65 4.966 -11.826 3.313 1.00 0.00 H new ATOM 0 HA THR A 65 4.562 -13.067 5.779 1.00 0.00 H new ATOM 0 HB THR A 65 4.689 -15.153 4.473 1.00 0.00 H new ATOM 0 HG1 THR A 65 5.631 -13.571 2.284 1.00 0.00 H new ATOM 0 HG21 THR A 65 3.091 -14.563 2.675 1.00 0.00 H new ATOM 0 HG22 THR A 65 2.701 -13.703 4.183 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.520 -12.845 2.857 1.00 0.00 H new ATOM 999 N ILE A 66 7.680 -13.081 4.738 1.00 0.00 N ATOM 1000 CA ILE A 66 9.053 -13.378 5.136 1.00 0.00 C ATOM 1001 C ILE A 66 9.371 -12.726 6.478 1.00 0.00 C ATOM 1002 O ILE A 66 10.039 -13.314 7.324 1.00 0.00 O ATOM 1003 CB ILE A 66 10.037 -12.879 4.072 1.00 0.00 C ATOM 1004 CG1 ILE A 66 9.841 -13.684 2.782 1.00 0.00 C ATOM 1005 CG2 ILE A 66 11.477 -13.060 4.574 1.00 0.00 C ATOM 1006 CD1 ILE A 66 10.667 -13.055 1.656 1.00 0.00 C ATOM 0 H ILE A 66 7.596 -12.538 3.878 1.00 0.00 H new ATOM 0 HA ILE A 66 9.155 -14.459 5.234 1.00 0.00 H new ATOM 0 HB ILE A 66 9.854 -11.823 3.876 1.00 0.00 H new ATOM 0 HG12 ILE A 66 10.146 -14.719 2.937 1.00 0.00 H new ATOM 0 HG13 ILE A 66 8.786 -13.700 2.508 1.00 0.00 H new ATOM 0 HG21 ILE A 66 12.174 -12.704 3.815 1.00 0.00 H new ATOM 0 HG22 ILE A 66 11.617 -12.489 5.492 1.00 0.00 H new ATOM 0 HG23 ILE A 66 11.663 -14.116 4.772 1.00 0.00 H new ATOM 0 HD11 ILE A 66 10.528 -13.627 0.739 1.00 0.00 H new ATOM 0 HD12 ILE A 66 10.340 -12.028 1.496 1.00 0.00 H new ATOM 0 HD13 ILE A 66 11.722 -13.062 1.931 1.00 0.00 H new ATOM 1018 N LEU A 67 8.895 -11.501 6.658 1.00 0.00 N ATOM 1019 CA LEU A 67 9.122 -10.785 7.903 1.00 0.00 C ATOM 1020 C LEU A 67 8.333 -11.420 9.051 1.00 0.00 C ATOM 1021 O LEU A 67 8.818 -11.502 10.184 1.00 0.00 O ATOM 1022 CB LEU A 67 8.704 -9.316 7.745 1.00 0.00 C ATOM 1023 CG LEU A 67 9.773 -8.550 6.943 1.00 0.00 C ATOM 1024 CD1 LEU A 67 9.196 -7.186 6.484 1.00 0.00 C ATOM 1025 CD2 LEU A 67 11.032 -8.323 7.837 1.00 0.00 C ATOM 0 H LEU A 67 8.354 -10.987 5.963 1.00 0.00 H new ATOM 0 HA LEU A 67 10.185 -10.841 8.139 1.00 0.00 H new ATOM 0 HB2 LEU A 67 7.742 -9.255 7.236 1.00 0.00 H new ATOM 0 HB3 LEU A 67 8.575 -8.858 8.726 1.00 0.00 H new ATOM 0 HG LEU A 67 10.058 -9.131 6.066 1.00 0.00 H new ATOM 0 HD11 LEU A 67 9.952 -6.644 5.916 1.00 0.00 H new ATOM 0 HD12 LEU A 67 8.321 -7.354 5.855 1.00 0.00 H new ATOM 0 HD13 LEU A 67 8.908 -6.600 7.357 1.00 0.00 H new ATOM 0 HD21 LEU A 67 11.788 -7.781 7.269 1.00 0.00 H new ATOM 0 HD22 LEU A 67 10.754 -7.743 8.717 1.00 0.00 H new ATOM 0 HD23 LEU A 67 11.434 -9.286 8.150 1.00 0.00 H new ATOM 1037 N ALA A 68 7.114 -11.863 8.750 1.00 0.00 N ATOM 1038 CA ALA A 68 6.261 -12.467 9.771 1.00 0.00 C ATOM 1039 C ALA A 68 6.926 -13.686 10.385 1.00 0.00 C ATOM 1040 O ALA A 68 6.957 -13.837 11.601 1.00 0.00 O ATOM 1041 CB ALA A 68 4.926 -12.880 9.150 1.00 0.00 C ATOM 0 H ALA A 68 6.699 -11.816 7.820 1.00 0.00 H new ATOM 0 HA ALA A 68 6.094 -11.729 10.555 1.00 0.00 H new ATOM 0 HB1 ALA A 68 4.293 -13.330 9.915 1.00 0.00 H new ATOM 0 HB2 ALA A 68 4.429 -12.002 8.738 1.00 0.00 H new ATOM 0 HB3 ALA A 68 5.103 -13.603 8.354 1.00 0.00 H new ATOM 1047 N VAL A 69 7.464 -14.549 9.537 1.00 0.00 N ATOM 1048 CA VAL A 69 8.119 -15.757 10.018 1.00 0.00 C ATOM 1049 C VAL A 69 9.484 -15.437 10.624 1.00 0.00 C ATOM 1050 O VAL A 69 9.848 -15.950 11.667 1.00 0.00 O ATOM 1051 CB VAL A 69 8.292 -16.751 8.851 1.00 0.00 C ATOM 1052 CG1 VAL A 69 6.912 -17.083 8.232 1.00 0.00 C ATOM 1053 CG2 VAL A 69 9.188 -16.128 7.780 1.00 0.00 C ATOM 0 H VAL A 69 7.461 -14.438 8.523 1.00 0.00 H new ATOM 0 HA VAL A 69 7.494 -16.201 10.793 1.00 0.00 H new ATOM 0 HB VAL A 69 8.748 -17.667 9.227 1.00 0.00 H new ATOM 0 HG11 VAL A 69 7.042 -17.785 7.409 1.00 0.00 H new ATOM 0 HG12 VAL A 69 6.270 -17.529 8.992 1.00 0.00 H new ATOM 0 HG13 VAL A 69 6.451 -16.168 7.859 1.00 0.00 H new ATOM 0 HG21 VAL A 69 9.311 -16.830 6.955 1.00 0.00 H new ATOM 0 HG22 VAL A 69 8.730 -15.211 7.411 1.00 0.00 H new ATOM 0 HG23 VAL A 69 10.163 -15.899 8.210 1.00 0.00 H new ATOM 1063 N ASP A 70 10.231 -14.577 9.969 1.00 0.00 N ATOM 1064 CA ASP A 70 11.563 -14.233 10.442 1.00 0.00 C ATOM 1065 C ASP A 70 11.525 -13.641 11.855 1.00 0.00 C ATOM 1066 O ASP A 70 12.555 -13.559 12.525 1.00 0.00 O ATOM 1067 CB ASP A 70 12.196 -13.223 9.483 1.00 0.00 C ATOM 1068 CG ASP A 70 12.549 -13.904 8.165 1.00 0.00 C ATOM 1069 OD1 ASP A 70 12.549 -15.123 8.130 1.00 0.00 O ATOM 1070 OD2 ASP A 70 12.812 -13.195 7.207 1.00 0.00 O ATOM 0 H ASP A 70 9.946 -14.103 9.112 1.00 0.00 H new ATOM 0 HA ASP A 70 12.157 -15.146 10.476 1.00 0.00 H new ATOM 0 HB2 ASP A 70 11.506 -12.399 9.302 1.00 0.00 H new ATOM 0 HB3 ASP A 70 13.092 -12.795 9.932 1.00 0.00 H new ATOM 1075 N ASN A 71 10.334 -13.221 12.305 1.00 0.00 N ATOM 1076 CA ASN A 71 10.180 -12.620 13.641 1.00 0.00 C ATOM 1077 C ASN A 71 9.275 -13.443 14.582 1.00 0.00 C ATOM 1078 O ASN A 71 9.630 -13.718 15.726 1.00 0.00 O ATOM 1079 CB ASN A 71 9.573 -11.230 13.484 1.00 0.00 C ATOM 1080 CG ASN A 71 9.731 -10.444 14.780 1.00 0.00 C ATOM 1081 OD1 ASN A 71 8.829 -10.562 15.715 1.00 0.00 O flip ATOM 1082 ND2 ASN A 71 10.702 -9.706 14.945 1.00 0.00 N flip ATOM 0 H ASN A 71 9.468 -13.285 11.769 1.00 0.00 H new ATOM 0 HA ASN A 71 11.172 -12.587 14.092 1.00 0.00 H new ATOM 0 HB2 ASN A 71 10.062 -10.701 12.666 1.00 0.00 H new ATOM 0 HB3 ASN A 71 8.517 -11.312 13.225 1.00 0.00 H new ATOM 0 HD21 ASN A 71 11.405 -9.617 14.211 1.00 0.00 H new ATOM 0 HD22 ASN A 71 10.804 -9.184 15.815 1.00 0.00 H new ATOM 1089 N LEU A 72 8.099 -13.828 14.090 1.00 0.00 N ATOM 1090 CA LEU A 72 7.128 -14.576 14.911 1.00 0.00 C ATOM 1091 C LEU A 72 7.490 -16.067 15.029 1.00 0.00 C ATOM 1092 O LEU A 72 7.063 -16.750 15.959 1.00 0.00 O ATOM 1093 CB LEU A 72 5.732 -14.430 14.296 1.00 0.00 C ATOM 1094 CG LEU A 72 5.378 -12.934 14.152 1.00 0.00 C ATOM 1095 CD1 LEU A 72 3.972 -12.799 13.562 1.00 0.00 C ATOM 1096 CD2 LEU A 72 5.423 -12.236 15.532 1.00 0.00 C ATOM 0 H LEU A 72 7.790 -13.640 13.136 1.00 0.00 H new ATOM 0 HA LEU A 72 7.148 -14.157 15.917 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.702 -14.916 13.321 1.00 0.00 H new ATOM 0 HB3 LEU A 72 4.994 -14.929 14.924 1.00 0.00 H new ATOM 0 HG LEU A 72 6.105 -12.461 13.492 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.720 -11.743 13.460 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.941 -13.276 12.582 1.00 0.00 H new ATOM 0 HD13 LEU A 72 3.252 -13.281 14.223 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.171 -11.182 15.415 1.00 0.00 H new ATOM 0 HD22 LEU A 72 4.705 -12.708 16.202 1.00 0.00 H new ATOM 0 HD23 LEU A 72 6.425 -12.325 15.952 1.00 0.00 H new ATOM 1108 N ASN A 73 8.280 -16.567 14.085 1.00 0.00 N ATOM 1109 CA ASN A 73 8.688 -17.980 14.098 1.00 0.00 C ATOM 1110 C ASN A 73 9.630 -18.253 15.263 1.00 0.00 C ATOM 1111 O ASN A 73 10.717 -17.681 15.347 1.00 0.00 O ATOM 1112 CB ASN A 73 9.390 -18.340 12.789 1.00 0.00 C ATOM 1113 CG ASN A 73 9.601 -19.848 12.688 1.00 0.00 C ATOM 1114 OD1 ASN A 73 8.808 -20.624 13.220 1.00 0.00 O ATOM 1115 ND2 ASN A 73 10.630 -20.310 12.033 1.00 0.00 N ATOM 0 H ASN A 73 8.652 -16.026 13.304 1.00 0.00 H new ATOM 0 HA ASN A 73 7.792 -18.591 14.210 1.00 0.00 H new ATOM 0 HB2 ASN A 73 8.795 -17.994 11.944 1.00 0.00 H new ATOM 0 HB3 ASN A 73 10.351 -17.829 12.733 1.00 0.00 H new ATOM 0 HD21 ASN A 73 10.779 -21.317 11.961 1.00 0.00 H new ATOM 0 HD22 ASN A 73 11.286 -19.665 11.593 1.00 0.00 H new ATOM 1122 N GLY A 74 9.208 -19.134 16.161 1.00 0.00 N ATOM 1123 CA GLY A 74 10.024 -19.479 17.321 1.00 0.00 C ATOM 1124 C GLY A 74 9.742 -18.535 18.487 1.00 0.00 C ATOM 1125 O GLY A 74 10.463 -18.539 19.485 1.00 0.00 O ATOM 0 H GLY A 74 8.313 -19.620 16.111 1.00 0.00 H new ATOM 0 HA2 GLY A 74 9.819 -20.506 17.622 1.00 0.00 H new ATOM 0 HA3 GLY A 74 11.080 -19.430 17.055 1.00 0.00 H new ATOM 1129 N PHE A 75 8.691 -17.722 18.356 1.00 0.00 N ATOM 1130 CA PHE A 75 8.321 -16.774 19.412 1.00 0.00 C ATOM 1131 C PHE A 75 7.107 -17.270 20.182 1.00 0.00 C ATOM 1132 O PHE A 75 6.023 -17.421 19.619 1.00 0.00 O ATOM 1133 CB PHE A 75 8.003 -15.404 18.806 1.00 0.00 C ATOM 1134 CG PHE A 75 7.647 -14.434 19.907 1.00 0.00 C ATOM 1135 CD1 PHE A 75 8.658 -13.750 20.592 1.00 0.00 C ATOM 1136 CD2 PHE A 75 6.307 -14.220 20.242 1.00 0.00 C ATOM 1137 CE1 PHE A 75 8.327 -12.852 21.613 1.00 0.00 C ATOM 1138 CE2 PHE A 75 5.975 -13.321 21.262 1.00 0.00 C ATOM 1139 CZ PHE A 75 6.986 -12.637 21.949 1.00 0.00 C ATOM 0 H PHE A 75 8.085 -17.700 17.536 1.00 0.00 H new ATOM 0 HA PHE A 75 9.166 -16.687 20.095 1.00 0.00 H new ATOM 0 HB2 PHE A 75 8.862 -15.035 18.246 1.00 0.00 H new ATOM 0 HB3 PHE A 75 7.176 -15.490 18.101 1.00 0.00 H new ATOM 0 HD1 PHE A 75 9.693 -13.915 20.333 1.00 0.00 H new ATOM 0 HD2 PHE A 75 5.527 -14.749 19.714 1.00 0.00 H new ATOM 0 HE1 PHE A 75 9.107 -12.325 22.142 1.00 0.00 H new ATOM 0 HE2 PHE A 75 4.939 -13.155 21.519 1.00 0.00 H new ATOM 0 HZ PHE A 75 6.731 -11.944 22.737 1.00 0.00 H new ATOM 1149 N LYS A 76 7.297 -17.521 21.470 1.00 0.00 N ATOM 1150 CA LYS A 76 6.206 -17.991 22.307 1.00 0.00 C ATOM 1151 C LYS A 76 5.165 -16.888 22.465 1.00 0.00 C ATOM 1152 O LYS A 76 5.485 -15.772 22.871 1.00 0.00 O ATOM 1153 CB LYS A 76 6.740 -18.412 23.685 1.00 0.00 C ATOM 1154 CG LYS A 76 5.650 -19.192 24.461 1.00 0.00 C ATOM 1155 CD LYS A 76 5.719 -20.698 24.112 1.00 0.00 C ATOM 1156 CE LYS A 76 6.933 -21.352 24.806 1.00 0.00 C ATOM 1157 NZ LYS A 76 7.071 -20.812 26.189 1.00 0.00 N ATOM 0 H LYS A 76 8.188 -17.408 21.953 1.00 0.00 H new ATOM 0 HA LYS A 76 5.741 -18.855 21.832 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.628 -19.033 23.566 1.00 0.00 H new ATOM 0 HB3 LYS A 76 7.041 -17.531 24.252 1.00 0.00 H new ATOM 0 HG2 LYS A 76 5.787 -19.053 25.533 1.00 0.00 H new ATOM 0 HG3 LYS A 76 4.664 -18.798 24.212 1.00 0.00 H new ATOM 0 HD2 LYS A 76 4.801 -21.194 24.426 1.00 0.00 H new ATOM 0 HD3 LYS A 76 5.796 -20.825 23.032 1.00 0.00 H new ATOM 0 HE2 LYS A 76 6.806 -22.434 24.839 1.00 0.00 H new ATOM 0 HE3 LYS A 76 7.841 -21.154 24.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 7.630 -21.473 26.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 7.551 -19.890 26.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 6.128 -20.696 26.612 1.00 0.00 H new ATOM 1171 N ILE A 77 3.913 -17.209 22.143 1.00 0.00 N ATOM 1172 CA ILE A 77 2.830 -16.231 22.250 1.00 0.00 C ATOM 1173 C ILE A 77 1.588 -16.870 22.864 1.00 0.00 C ATOM 1174 O ILE A 77 1.163 -17.948 22.449 1.00 0.00 O ATOM 1175 CB ILE A 77 2.496 -15.673 20.849 1.00 0.00 C ATOM 1176 CG1 ILE A 77 1.699 -14.372 20.991 1.00 0.00 C ATOM 1177 CG2 ILE A 77 1.660 -16.698 20.070 1.00 0.00 C ATOM 1178 CD1 ILE A 77 1.701 -13.623 19.657 1.00 0.00 C ATOM 0 H ILE A 77 3.624 -18.129 21.809 1.00 0.00 H new ATOM 0 HA ILE A 77 3.155 -15.417 22.898 1.00 0.00 H new ATOM 0 HB ILE A 77 3.423 -15.476 20.311 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.676 -14.592 21.295 1.00 0.00 H new ATOM 0 HG13 ILE A 77 2.136 -13.749 21.771 1.00 0.00 H new ATOM 0 HG21 ILE A 77 1.426 -16.301 19.082 1.00 0.00 H new ATOM 0 HG22 ILE A 77 2.225 -17.624 19.965 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.734 -16.898 20.609 1.00 0.00 H new ATOM 0 HD11 ILE A 77 1.134 -12.698 19.758 1.00 0.00 H new ATOM 0 HD12 ILE A 77 2.727 -13.390 19.372 1.00 0.00 H new ATOM 0 HD13 ILE A 77 1.243 -14.247 18.889 1.00 0.00 H new ATOM 1190 N GLY A 78 1.007 -16.200 23.851 1.00 0.00 N ATOM 1191 CA GLY A 78 -0.188 -16.713 24.507 1.00 0.00 C ATOM 1192 C GLY A 78 0.135 -17.974 25.293 1.00 0.00 C ATOM 1193 O GLY A 78 -0.743 -18.800 25.548 1.00 0.00 O ATOM 0 H GLY A 78 1.341 -15.307 24.213 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -0.596 -15.955 25.176 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -0.955 -16.928 23.763 1.00 0.00 H new ATOM 1197 N GLY A 79 1.397 -18.120 25.673 1.00 0.00 N ATOM 1198 CA GLY A 79 1.826 -19.289 26.426 1.00 0.00 C ATOM 1199 C GLY A 79 2.108 -20.463 25.490 1.00 0.00 C ATOM 1200 O GLY A 79 2.475 -21.549 25.940 1.00 0.00 O ATOM 0 H GLY A 79 2.137 -17.447 25.473 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.723 -19.050 26.998 1.00 0.00 H new ATOM 0 HA3 GLY A 79 1.055 -19.568 27.144 1.00 0.00 H new ATOM 1204 N ARG A 80 1.936 -20.240 24.182 1.00 0.00 N ATOM 1205 CA ARG A 80 2.179 -21.286 23.192 1.00 0.00 C ATOM 1206 C ARG A 80 2.931 -20.720 21.980 1.00 0.00 C ATOM 1207 O ARG A 80 2.790 -19.546 21.642 1.00 0.00 O ATOM 1208 CB ARG A 80 0.834 -21.899 22.732 1.00 0.00 C ATOM 1209 CG ARG A 80 0.864 -23.419 22.918 1.00 0.00 C ATOM 1210 CD ARG A 80 -0.521 -23.997 22.646 1.00 0.00 C ATOM 1211 NE ARG A 80 -0.447 -25.449 22.542 1.00 0.00 N ATOM 1212 CZ ARG A 80 -0.375 -26.214 23.625 1.00 0.00 C ATOM 1213 NH1 ARG A 80 -0.369 -25.666 24.811 1.00 0.00 N ATOM 1214 NH2 ARG A 80 -0.308 -27.511 23.506 1.00 0.00 N ATOM 0 H ARG A 80 1.631 -19.349 23.790 1.00 0.00 H new ATOM 0 HA ARG A 80 2.792 -22.061 23.652 1.00 0.00 H new ATOM 0 HB2 ARG A 80 0.013 -21.470 23.306 1.00 0.00 H new ATOM 0 HB3 ARG A 80 0.652 -21.655 21.685 1.00 0.00 H new ATOM 0 HG2 ARG A 80 1.594 -23.864 22.241 1.00 0.00 H new ATOM 0 HG3 ARG A 80 1.179 -23.665 23.932 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -1.204 -23.717 23.448 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -0.923 -23.579 21.723 1.00 0.00 H new ATOM 0 HE ARG A 80 -0.451 -25.886 21.620 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -0.420 -24.652 24.904 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -0.314 -26.253 25.644 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -0.311 -27.939 22.580 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -0.253 -28.097 24.339 1.00 0.00 H new ATOM 1228 N ALA A 81 3.724 -21.566 21.328 1.00 0.00 N ATOM 1229 CA ALA A 81 4.484 -21.142 20.150 1.00 0.00 C ATOM 1230 C ALA A 81 3.711 -21.455 18.871 1.00 0.00 C ATOM 1231 O ALA A 81 3.397 -22.614 18.596 1.00 0.00 O ATOM 1232 CB ALA A 81 5.838 -21.854 20.119 1.00 0.00 C ATOM 0 H ALA A 81 3.858 -22.542 21.591 1.00 0.00 H new ATOM 0 HA ALA A 81 4.641 -20.065 20.210 1.00 0.00 H new ATOM 0 HB1 ALA A 81 6.398 -21.534 19.240 1.00 0.00 H new ATOM 0 HB2 ALA A 81 6.401 -21.604 21.018 1.00 0.00 H new ATOM 0 HB3 ALA A 81 5.681 -22.932 20.076 1.00 0.00 H new ATOM 1238 N LEU A 82 3.406 -20.416 18.094 1.00 0.00 N ATOM 1239 CA LEU A 82 2.668 -20.580 16.844 1.00 0.00 C ATOM 1240 C LEU A 82 3.591 -21.106 15.742 1.00 0.00 C ATOM 1241 O LEU A 82 4.797 -20.858 15.760 1.00 0.00 O ATOM 1242 CB LEU A 82 2.042 -19.230 16.403 1.00 0.00 C ATOM 1243 CG LEU A 82 2.895 -18.060 16.920 1.00 0.00 C ATOM 1244 CD1 LEU A 82 4.337 -18.206 16.409 1.00 0.00 C ATOM 1245 CD2 LEU A 82 2.311 -16.735 16.419 1.00 0.00 C ATOM 0 H LEU A 82 3.659 -19.452 18.309 1.00 0.00 H new ATOM 0 HA LEU A 82 1.870 -21.303 17.012 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.975 -19.189 15.316 1.00 0.00 H new ATOM 0 HB3 LEU A 82 1.026 -19.148 16.789 1.00 0.00 H new ATOM 0 HG LEU A 82 2.892 -18.070 18.010 1.00 0.00 H new ATOM 0 HD11 LEU A 82 4.939 -17.375 16.777 1.00 0.00 H new ATOM 0 HD12 LEU A 82 4.757 -19.146 16.768 1.00 0.00 H new ATOM 0 HD13 LEU A 82 4.339 -18.201 15.319 1.00 0.00 H new ATOM 0 HD21 LEU A 82 2.918 -15.908 16.787 1.00 0.00 H new ATOM 0 HD22 LEU A 82 2.310 -16.727 15.329 1.00 0.00 H new ATOM 0 HD23 LEU A 82 1.290 -16.626 16.784 1.00 0.00 H new ATOM 1257 N LYS A 83 3.018 -21.831 14.780 1.00 0.00 N ATOM 1258 CA LYS A 83 3.801 -22.381 13.668 1.00 0.00 C ATOM 1259 C LYS A 83 3.450 -21.668 12.365 1.00 0.00 C ATOM 1260 O LYS A 83 2.318 -21.750 11.885 1.00 0.00 O ATOM 1261 CB LYS A 83 3.522 -23.875 13.524 1.00 0.00 C ATOM 1262 CG LYS A 83 4.400 -24.451 12.413 1.00 0.00 C ATOM 1263 CD LYS A 83 4.285 -25.973 12.412 1.00 0.00 C ATOM 1264 CE LYS A 83 5.194 -26.552 11.327 1.00 0.00 C ATOM 1265 NZ LYS A 83 4.619 -26.255 9.985 1.00 0.00 N ATOM 0 H LYS A 83 2.023 -22.051 14.746 1.00 0.00 H new ATOM 0 HA LYS A 83 4.859 -22.228 13.880 1.00 0.00 H new ATOM 0 HB2 LYS A 83 3.725 -24.386 14.465 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.470 -24.039 13.293 1.00 0.00 H new ATOM 0 HG2 LYS A 83 4.091 -24.052 11.447 1.00 0.00 H new ATOM 0 HG3 LYS A 83 5.438 -24.154 12.564 1.00 0.00 H new ATOM 0 HD2 LYS A 83 4.566 -26.370 13.387 1.00 0.00 H new ATOM 0 HD3 LYS A 83 3.252 -26.270 12.233 1.00 0.00 H new ATOM 0 HE2 LYS A 83 6.193 -26.124 11.409 1.00 0.00 H new ATOM 0 HE3 LYS A 83 5.296 -27.629 11.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 5.105 -26.826 9.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 3.605 -26.485 9.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 4.745 -25.246 9.769 1.00 0.00 H new ATOM 1279 N ILE A 84 4.432 -20.966 11.792 1.00 0.00 N ATOM 1280 CA ILE A 84 4.218 -20.220 10.546 1.00 0.00 C ATOM 1281 C ILE A 84 4.900 -20.937 9.379 1.00 0.00 C ATOM 1282 O ILE A 84 6.083 -21.267 9.445 1.00 0.00 O ATOM 1283 CB ILE A 84 4.782 -18.775 10.675 1.00 0.00 C ATOM 1284 CG1 ILE A 84 4.579 -18.249 12.125 1.00 0.00 C ATOM 1285 CG2 ILE A 84 4.046 -17.844 9.680 1.00 0.00 C ATOM 1286 CD1 ILE A 84 3.168 -17.673 12.281 1.00 0.00 C ATOM 0 H ILE A 84 5.378 -20.898 12.167 1.00 0.00 H new ATOM 0 HA ILE A 84 3.146 -20.166 10.356 1.00 0.00 H new ATOM 0 HB ILE A 84 5.848 -18.787 10.447 1.00 0.00 H new ATOM 0 HG12 ILE A 84 4.731 -19.059 12.839 1.00 0.00 H new ATOM 0 HG13 ILE A 84 5.321 -17.482 12.350 1.00 0.00 H new ATOM 0 HG21 ILE A 84 4.440 -16.832 9.769 1.00 0.00 H new ATOM 0 HG22 ILE A 84 4.199 -18.205 8.663 1.00 0.00 H new ATOM 0 HG23 ILE A 84 2.980 -17.840 9.906 1.00 0.00 H new ATOM 0 HD11 ILE A 84 3.035 -17.307 13.299 1.00 0.00 H new ATOM 0 HD12 ILE A 84 3.031 -16.850 11.579 1.00 0.00 H new ATOM 0 HD13 ILE A 84 2.433 -18.451 12.076 1.00 0.00 H new ATOM 1298 N ASP A 85 4.143 -21.173 8.311 1.00 0.00 N ATOM 1299 CA ASP A 85 4.689 -21.850 7.134 1.00 0.00 C ATOM 1300 C ASP A 85 3.880 -21.505 5.890 1.00 0.00 C ATOM 1301 O ASP A 85 2.671 -21.326 5.962 1.00 0.00 O ATOM 1302 CB ASP A 85 4.666 -23.362 7.350 1.00 0.00 C ATOM 1303 CG ASP A 85 5.532 -24.050 6.301 1.00 0.00 C ATOM 1304 OD1 ASP A 85 5.886 -23.400 5.332 1.00 0.00 O ATOM 1305 OD2 ASP A 85 5.831 -25.220 6.484 1.00 0.00 O ATOM 0 H ASP A 85 3.161 -20.910 8.234 1.00 0.00 H new ATOM 0 HA ASP A 85 5.716 -21.514 6.990 1.00 0.00 H new ATOM 0 HB2 ASP A 85 5.031 -23.601 8.349 1.00 0.00 H new ATOM 0 HB3 ASP A 85 3.642 -23.731 7.288 1.00 0.00 H new ATOM 1310 N HIS A 86 4.559 -21.412 4.750 1.00 0.00 N ATOM 1311 CA HIS A 86 3.886 -21.086 3.498 1.00 0.00 C ATOM 1312 C HIS A 86 3.018 -22.257 3.047 1.00 0.00 C ATOM 1313 O HIS A 86 3.405 -23.416 3.190 1.00 0.00 O ATOM 1314 CB HIS A 86 4.918 -20.761 2.418 1.00 0.00 C ATOM 1315 CG HIS A 86 5.636 -19.489 2.778 1.00 0.00 C ATOM 1316 ND1 HIS A 86 5.784 -18.825 3.971 1.00 0.00 N flip ATOM 1317 CD2 HIS A 86 6.326 -18.739 1.838 1.00 0.00 C flip ATOM 1318 CE1 HIS A 86 6.551 -17.680 3.777 1.00 0.00 C flip ATOM 1319 NE2 HIS A 86 6.852 -17.677 2.476 1.00 0.00 N flip ATOM 0 H HIS A 86 5.565 -21.556 4.668 1.00 0.00 H new ATOM 0 HA HIS A 86 3.251 -20.215 3.659 1.00 0.00 H new ATOM 0 HB2 HIS A 86 5.631 -21.580 2.323 1.00 0.00 H new ATOM 0 HB3 HIS A 86 4.427 -20.653 1.451 1.00 0.00 H new ATOM 0 HD2 HIS A 86 6.424 -18.965 0.787 1.00 0.00 H new ATOM 0 HE1 HIS A 86 6.841 -16.951 4.519 1.00 0.00 H new ATOM 0 HE2 HIS A 86 7.413 -16.957 2.021 1.00 0.00 H new ATOM 1328 N THR A 87 1.842 -21.948 2.497 1.00 0.00 N ATOM 1329 CA THR A 87 0.922 -22.991 2.031 1.00 0.00 C ATOM 1330 C THR A 87 0.459 -22.706 0.605 1.00 0.00 C ATOM 1331 O THR A 87 -0.048 -21.624 0.313 1.00 0.00 O ATOM 1332 CB THR A 87 -0.295 -23.058 2.959 1.00 0.00 C ATOM 1333 OG1 THR A 87 -1.137 -24.130 2.559 1.00 0.00 O ATOM 1334 CG2 THR A 87 -1.074 -21.740 2.886 1.00 0.00 C ATOM 0 H THR A 87 1.505 -20.994 2.364 1.00 0.00 H new ATOM 0 HA THR A 87 1.448 -23.946 2.043 1.00 0.00 H new ATOM 0 HB THR A 87 0.041 -23.221 3.983 1.00 0.00 H new ATOM 0 HG1 THR A 87 -1.915 -24.174 3.153 1.00 0.00 H new ATOM 0 HG21 THR A 87 -1.939 -21.791 3.547 1.00 0.00 H new ATOM 0 HG22 THR A 87 -0.429 -20.918 3.196 1.00 0.00 H new ATOM 0 HG23 THR A 87 -1.409 -21.572 1.863 1.00 0.00 H new ATOM 1342 N PHE A 88 0.634 -23.687 -0.273 1.00 0.00 N ATOM 1343 CA PHE A 88 0.229 -23.533 -1.665 1.00 0.00 C ATOM 1344 C PHE A 88 -1.282 -23.663 -1.795 1.00 0.00 C ATOM 1345 O PHE A 88 -1.820 -23.700 -2.901 1.00 0.00 O ATOM 1346 CB PHE A 88 0.912 -24.595 -2.531 1.00 0.00 C ATOM 1347 CG PHE A 88 0.433 -25.965 -2.117 1.00 0.00 C ATOM 1348 CD1 PHE A 88 1.088 -26.656 -1.089 1.00 0.00 C ATOM 1349 CD2 PHE A 88 -0.665 -26.547 -2.760 1.00 0.00 C ATOM 1350 CE1 PHE A 88 0.645 -27.928 -0.707 1.00 0.00 C ATOM 1351 CE2 PHE A 88 -1.109 -27.818 -2.377 1.00 0.00 C ATOM 1352 CZ PHE A 88 -0.454 -28.509 -1.350 1.00 0.00 C ATOM 0 H PHE A 88 1.050 -24.591 -0.048 1.00 0.00 H new ATOM 0 HA PHE A 88 0.530 -22.542 -2.005 1.00 0.00 H new ATOM 0 HB2 PHE A 88 0.687 -24.422 -3.583 1.00 0.00 H new ATOM 0 HB3 PHE A 88 1.994 -24.528 -2.422 1.00 0.00 H new ATOM 0 HD1 PHE A 88 1.935 -26.207 -0.591 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -1.170 -26.015 -3.553 1.00 0.00 H new ATOM 0 HE1 PHE A 88 1.151 -28.461 0.084 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -1.957 -28.266 -2.874 1.00 0.00 H new ATOM 0 HZ PHE A 88 -0.797 -29.490 -1.054 1.00 0.00 H new ATOM 1362 N TYR A 89 -1.965 -23.732 -0.657 1.00 0.00 N ATOM 1363 CA TYR A 89 -3.417 -23.861 -0.659 1.00 0.00 C ATOM 1364 C TYR A 89 -4.050 -22.751 -1.494 1.00 0.00 C ATOM 1365 O TYR A 89 -3.870 -21.566 -1.212 1.00 0.00 O ATOM 1366 CB TYR A 89 -3.944 -23.792 0.775 1.00 0.00 C ATOM 1367 CG TYR A 89 -5.453 -23.856 0.760 1.00 0.00 C ATOM 1368 CD1 TYR A 89 -6.099 -25.054 0.435 1.00 0.00 C ATOM 1369 CD2 TYR A 89 -6.206 -22.715 1.071 1.00 0.00 C ATOM 1370 CE1 TYR A 89 -7.498 -25.113 0.420 1.00 0.00 C ATOM 1371 CE2 TYR A 89 -7.604 -22.776 1.057 1.00 0.00 C ATOM 1372 CZ TYR A 89 -8.250 -23.974 0.732 1.00 0.00 C ATOM 1373 OH TYR A 89 -9.629 -24.032 0.717 1.00 0.00 O ATOM 0 H TYR A 89 -1.541 -23.701 0.270 1.00 0.00 H new ATOM 0 HA TYR A 89 -3.682 -24.823 -1.097 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -3.540 -24.617 1.362 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -3.613 -22.869 1.251 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -5.519 -25.933 0.196 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -5.708 -21.790 1.321 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -7.997 -26.037 0.168 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -8.185 -21.898 1.297 1.00 0.00 H new ATOM 0 HH TYR A 89 -9.996 -23.156 0.958 1.00 0.00 H new ATOM 2031 N PHE B 311 13.349 -5.540 4.566 1.00 0.00 N ATOM 2032 CA PHE B 311 12.285 -4.637 4.128 1.00 0.00 C ATOM 2033 C PHE B 311 11.984 -3.611 5.221 1.00 0.00 C ATOM 2034 O PHE B 311 12.489 -3.712 6.339 1.00 0.00 O ATOM 2035 CB PHE B 311 11.004 -5.441 3.793 1.00 0.00 C ATOM 2036 CG PHE B 311 11.358 -6.895 3.543 1.00 0.00 C ATOM 2037 CD1 PHE B 311 11.761 -7.711 4.608 1.00 0.00 C ATOM 2038 CD2 PHE B 311 11.291 -7.427 2.249 1.00 0.00 C ATOM 2039 CE1 PHE B 311 12.091 -9.051 4.385 1.00 0.00 C ATOM 2040 CE2 PHE B 311 11.622 -8.770 2.025 1.00 0.00 C ATOM 2041 CZ PHE B 311 12.023 -9.581 3.095 1.00 0.00 C ATOM 0 HA PHE B 311 12.618 -4.114 3.231 1.00 0.00 H new ATOM 0 HB2 PHE B 311 10.292 -5.367 4.615 1.00 0.00 H new ATOM 0 HB3 PHE B 311 10.519 -5.019 2.913 1.00 0.00 H new ATOM 0 HD1 PHE B 311 11.817 -7.303 5.606 1.00 0.00 H new ATOM 0 HD2 PHE B 311 10.984 -6.802 1.424 1.00 0.00 H new ATOM 0 HE1 PHE B 311 12.398 -9.676 5.210 1.00 0.00 H new ATOM 0 HE2 PHE B 311 11.568 -9.180 1.027 1.00 0.00 H new ATOM 0 HZ PHE B 311 12.279 -10.616 2.922 1.00 0.00 H new ATOM 2051 N ALA B 312 11.157 -2.629 4.892 1.00 0.00 N ATOM 2052 CA ALA B 312 10.788 -1.590 5.855 1.00 0.00 C ATOM 2053 C ALA B 312 9.298 -1.287 5.763 1.00 0.00 C ATOM 2054 O ALA B 312 8.898 -0.220 5.291 1.00 0.00 O ATOM 2055 CB ALA B 312 11.588 -0.315 5.582 1.00 0.00 C ATOM 0 H ALA B 312 10.729 -2.526 3.972 1.00 0.00 H new ATOM 0 HA ALA B 312 11.015 -1.951 6.858 1.00 0.00 H new ATOM 0 HB1 ALA B 312 11.307 0.452 6.303 1.00 0.00 H new ATOM 0 HB2 ALA B 312 12.653 -0.527 5.674 1.00 0.00 H new ATOM 0 HB3 ALA B 312 11.375 0.039 4.574 1.00 0.00 H new ATOM 2061 N ILE B 313 8.475 -2.230 6.216 1.00 0.00 N ATOM 2062 CA ILE B 313 7.023 -2.053 6.174 1.00 0.00 C ATOM 2063 C ILE B 313 6.510 -1.480 7.494 1.00 0.00 C ATOM 2064 O ILE B 313 6.812 -2.002 8.567 1.00 0.00 O ATOM 2065 CB ILE B 313 6.347 -3.397 5.904 1.00 0.00 C ATOM 2066 CG1 ILE B 313 6.814 -3.934 4.548 1.00 0.00 C ATOM 2067 CG2 ILE B 313 4.827 -3.205 5.882 1.00 0.00 C ATOM 2068 CD1 ILE B 313 6.416 -5.404 4.419 1.00 0.00 C ATOM 0 H ILE B 313 8.784 -3.117 6.613 1.00 0.00 H new ATOM 0 HA ILE B 313 6.783 -1.354 5.373 1.00 0.00 H new ATOM 0 HB ILE B 313 6.612 -4.106 6.688 1.00 0.00 H new ATOM 0 HG12 ILE B 313 6.367 -3.353 3.741 1.00 0.00 H new ATOM 0 HG13 ILE B 313 7.895 -3.829 4.456 1.00 0.00 H new ATOM 0 HG21 ILE B 313 4.342 -4.162 5.690 1.00 0.00 H new ATOM 0 HG22 ILE B 313 4.495 -2.817 6.845 1.00 0.00 H new ATOM 0 HG23 ILE B 313 4.561 -2.499 5.096 1.00 0.00 H new ATOM 0 HD11 ILE B 313 6.748 -5.787 3.454 1.00 0.00 H new ATOM 0 HD12 ILE B 313 6.884 -5.979 5.218 1.00 0.00 H new ATOM 0 HD13 ILE B 313 5.332 -5.495 4.492 1.00 0.00 H new ATOM 2080 N MET B 314 5.735 -0.400 7.407 1.00 0.00 N ATOM 2081 CA MET B 314 5.188 0.239 8.603 1.00 0.00 C ATOM 2082 C MET B 314 3.896 -0.461 9.063 1.00 0.00 C ATOM 2083 O MET B 314 3.139 -0.971 8.239 1.00 0.00 O ATOM 2084 CB MET B 314 4.897 1.716 8.315 1.00 0.00 C ATOM 2085 CG MET B 314 6.199 2.432 7.950 1.00 0.00 C ATOM 2086 SD MET B 314 7.289 2.483 9.394 1.00 0.00 S ATOM 2087 CE MET B 314 8.763 3.102 8.546 1.00 0.00 C ATOM 0 H MET B 314 5.473 0.048 6.529 1.00 0.00 H new ATOM 0 HA MET B 314 5.927 0.158 9.401 1.00 0.00 H new ATOM 0 HB2 MET B 314 4.180 1.804 7.498 1.00 0.00 H new ATOM 0 HB3 MET B 314 4.444 2.185 9.188 1.00 0.00 H new ATOM 0 HG2 MET B 314 6.692 1.914 7.127 1.00 0.00 H new ATOM 0 HG3 MET B 314 5.985 3.444 7.607 1.00 0.00 H new ATOM 0 HE1 MET B 314 9.577 3.211 9.263 1.00 0.00 H new ATOM 0 HE2 MET B 314 9.057 2.398 7.767 1.00 0.00 H new ATOM 0 HE3 MET B 314 8.544 4.070 8.096 1.00 0.00 H new ATOM 2097 N PRO B 315 3.634 -0.486 10.360 1.00 0.00 N ATOM 2098 CA PRO B 315 2.403 -1.123 10.938 1.00 0.00 C ATOM 2099 C PRO B 315 1.141 -0.313 10.640 1.00 0.00 C ATOM 2100 O PRO B 315 1.206 0.897 10.427 1.00 0.00 O ATOM 2101 CB PRO B 315 2.682 -1.168 12.452 1.00 0.00 C ATOM 2102 CG PRO B 315 3.641 -0.052 12.716 1.00 0.00 C ATOM 2103 CD PRO B 315 4.480 0.083 11.445 1.00 0.00 C ATOM 0 HA PRO B 315 2.216 -2.107 10.509 1.00 0.00 H new ATOM 0 HB2 PRO B 315 1.763 -1.039 13.024 1.00 0.00 H new ATOM 0 HB3 PRO B 315 3.107 -2.128 12.744 1.00 0.00 H new ATOM 0 HG2 PRO B 315 3.112 0.875 12.936 1.00 0.00 H new ATOM 0 HG3 PRO B 315 4.270 -0.272 13.579 1.00 0.00 H new ATOM 0 HD2 PRO B 315 4.729 1.125 11.246 1.00 0.00 H new ATOM 0 HD3 PRO B 315 5.422 -0.458 11.535 1.00 0.00 H new ATOM 2111 N GLY B 316 -0.009 -0.988 10.627 1.00 0.00 N ATOM 2112 CA GLY B 316 -1.283 -0.320 10.358 1.00 0.00 C ATOM 2113 C GLY B 316 -2.032 -0.027 11.657 1.00 0.00 C ATOM 2114 O GLY B 316 -1.610 -0.443 12.735 1.00 0.00 O ATOM 0 H GLY B 316 -0.085 -1.991 10.798 1.00 0.00 H new ATOM 0 HA2 GLY B 316 -1.103 0.611 9.820 1.00 0.00 H new ATOM 0 HA3 GLY B 316 -1.898 -0.948 9.713 1.00 0.00 H new ATOM 2118 N SER B 317 -3.144 0.690 11.547 1.00 0.00 N ATOM 2119 CA SER B 317 -3.949 1.027 12.718 1.00 0.00 C ATOM 2120 C SER B 317 -4.618 -0.223 13.290 1.00 0.00 C ATOM 2121 O SER B 317 -4.887 -0.303 14.488 1.00 0.00 O ATOM 2122 CB SER B 317 -5.017 2.053 12.341 1.00 0.00 C ATOM 2123 OG SER B 317 -4.389 3.283 12.004 1.00 0.00 O ATOM 0 H SER B 317 -3.509 1.048 10.664 1.00 0.00 H new ATOM 0 HA SER B 317 -3.291 1.451 13.476 1.00 0.00 H new ATOM 0 HB2 SER B 317 -5.606 1.689 11.499 1.00 0.00 H new ATOM 0 HB3 SER B 317 -5.707 2.199 13.172 1.00 0.00 H new ATOM 0 HG SER B 317 -5.071 3.943 11.760 1.00 0.00 H new ATOM 2129 N ARG B 318 -4.889 -1.193 12.423 1.00 0.00 N ATOM 2130 CA ARG B 318 -5.535 -2.433 12.849 1.00 0.00 C ATOM 2131 C ARG B 318 -4.698 -3.140 13.915 1.00 0.00 C ATOM 2132 O ARG B 318 -5.190 -4.020 14.623 1.00 0.00 O ATOM 2133 CB ARG B 318 -5.736 -3.373 11.644 1.00 0.00 C ATOM 2134 CG ARG B 318 -6.863 -4.398 11.950 1.00 0.00 C ATOM 2135 CD ARG B 318 -8.217 -3.855 11.459 1.00 0.00 C ATOM 2136 NE ARG B 318 -8.645 -2.739 12.295 1.00 0.00 N ATOM 2137 CZ ARG B 318 -9.567 -1.878 11.874 1.00 0.00 C ATOM 2138 NH1 ARG B 318 -10.108 -2.024 10.696 1.00 0.00 N ATOM 2139 NH2 ARG B 318 -9.931 -0.887 12.640 1.00 0.00 N ATOM 0 H ARG B 318 -4.674 -1.147 11.427 1.00 0.00 H new ATOM 0 HA ARG B 318 -6.506 -2.180 13.274 1.00 0.00 H new ATOM 0 HB2 ARG B 318 -5.993 -2.792 10.758 1.00 0.00 H new ATOM 0 HB3 ARG B 318 -4.807 -3.898 11.423 1.00 0.00 H new ATOM 0 HG2 ARG B 318 -6.644 -5.348 11.462 1.00 0.00 H new ATOM 0 HG3 ARG B 318 -6.907 -4.593 13.021 1.00 0.00 H new ATOM 0 HD2 ARG B 318 -8.132 -3.530 10.422 1.00 0.00 H new ATOM 0 HD3 ARG B 318 -8.966 -4.647 11.485 1.00 0.00 H new ATOM 0 HE ARG B 318 -8.230 -2.617 13.219 1.00 0.00 H new ATOM 0 HH11 ARG B 318 -9.824 -2.799 10.097 1.00 0.00 H new ATOM 0 HH12 ARG B 318 -10.815 -1.363 10.374 1.00 0.00 H new ATOM 0 HH21 ARG B 318 -9.509 -0.773 13.561 1.00 0.00 H new ATOM 0 HH22 ARG B 318 -10.638 -0.226 12.318 1.00 0.00 H new ATOM 2153 N TRP B 319 -3.434 -2.749 14.024 1.00 0.00 N ATOM 2154 CA TRP B 319 -2.536 -3.352 15.003 1.00 0.00 C ATOM 2155 C TRP B 319 -3.058 -3.153 16.428 1.00 0.00 C ATOM 2156 O TRP B 319 -2.737 -3.919 17.335 1.00 0.00 O ATOM 2157 CB TRP B 319 -1.143 -2.736 14.884 1.00 0.00 C ATOM 2158 CG TRP B 319 -0.255 -3.309 15.941 1.00 0.00 C ATOM 2159 CD1 TRP B 319 -0.333 -4.570 16.425 1.00 0.00 C ATOM 2160 CD2 TRP B 319 0.825 -2.666 16.653 1.00 0.00 C ATOM 2161 NE1 TRP B 319 0.637 -4.741 17.387 1.00 0.00 N ATOM 2162 CE2 TRP B 319 1.378 -3.595 17.565 1.00 0.00 C ATOM 2163 CE3 TRP B 319 1.378 -1.377 16.599 1.00 0.00 C ATOM 2164 CZ2 TRP B 319 2.430 -3.266 18.387 1.00 0.00 C ATOM 2165 CZ3 TRP B 319 2.453 -1.038 17.430 1.00 0.00 C ATOM 2166 CH2 TRP B 319 2.979 -1.979 18.325 1.00 0.00 C ATOM 0 H TRP B 319 -3.009 -2.021 13.450 1.00 0.00 H new ATOM 0 HA TRP B 319 -2.485 -4.421 14.797 1.00 0.00 H new ATOM 0 HB2 TRP B 319 -0.728 -2.937 13.896 1.00 0.00 H new ATOM 0 HB3 TRP B 319 -1.202 -1.653 14.991 1.00 0.00 H new ATOM 0 HD1 TRP B 319 -1.042 -5.321 16.108 1.00 0.00 H new ATOM 0 HE1 TRP B 319 0.788 -5.608 17.903 1.00 0.00 H new ATOM 0 HE3 TRP B 319 0.974 -0.645 15.915 1.00 0.00 H new ATOM 0 HZ2 TRP B 319 2.830 -3.995 19.076 1.00 0.00 H new ATOM 0 HZ3 TRP B 319 2.879 -0.047 17.381 1.00 0.00 H new ATOM 0 HH2 TRP B 319 3.806 -1.712 18.966 1.00 0.00 H new ATOM 2177 N ASP B 320 -3.850 -2.113 16.618 1.00 0.00 N ATOM 2178 CA ASP B 320 -4.413 -1.815 17.939 1.00 0.00 C ATOM 2179 C ASP B 320 -3.305 -1.431 18.930 1.00 0.00 C ATOM 2180 O ASP B 320 -3.581 -0.942 20.025 1.00 0.00 O ATOM 2181 CB ASP B 320 -5.180 -3.033 18.468 1.00 0.00 C ATOM 2182 CG ASP B 320 -6.169 -2.603 19.549 1.00 0.00 C ATOM 2183 OD1 ASP B 320 -6.105 -1.455 19.957 1.00 0.00 O ATOM 2184 OD2 ASP B 320 -6.973 -3.426 19.951 1.00 0.00 O ATOM 0 H ASP B 320 -4.122 -1.459 15.884 1.00 0.00 H new ATOM 0 HA ASP B 320 -5.096 -0.972 17.838 1.00 0.00 H new ATOM 0 HB2 ASP B 320 -5.712 -3.520 17.651 1.00 0.00 H new ATOM 0 HB3 ASP B 320 -4.481 -3.764 18.874 1.00 0.00 H new ATOM 2189 N GLY B 321 -2.053 -1.653 18.536 1.00 0.00 N ATOM 2190 CA GLY B 321 -0.915 -1.322 19.394 1.00 0.00 C ATOM 2191 C GLY B 321 -0.668 -2.406 20.446 1.00 0.00 C ATOM 2192 O GLY B 321 0.073 -2.198 21.406 1.00 0.00 O ATOM 0 H GLY B 321 -1.800 -2.058 17.635 1.00 0.00 H new ATOM 0 HA2 GLY B 321 -0.021 -1.198 18.782 1.00 0.00 H new ATOM 0 HA3 GLY B 321 -1.097 -0.368 19.889 1.00 0.00 H new ATOM 2196 N VAL B 322 -1.295 -3.563 20.257 1.00 0.00 N ATOM 2197 CA VAL B 322 -1.135 -4.677 21.195 1.00 0.00 C ATOM 2198 C VAL B 322 0.341 -5.009 21.396 1.00 0.00 C ATOM 2199 O VAL B 322 1.161 -4.786 20.507 1.00 0.00 O ATOM 2200 CB VAL B 322 -1.864 -5.912 20.670 1.00 0.00 C ATOM 2201 CG1 VAL B 322 -1.270 -6.318 19.322 1.00 0.00 C ATOM 2202 CG2 VAL B 322 -1.700 -7.066 21.666 1.00 0.00 C ATOM 0 H VAL B 322 -1.915 -3.756 19.470 1.00 0.00 H new ATOM 0 HA VAL B 322 -1.562 -4.378 22.152 1.00 0.00 H new ATOM 0 HB VAL B 322 -2.923 -5.684 20.549 1.00 0.00 H new ATOM 0 HG11 VAL B 322 -1.789 -7.199 18.946 1.00 0.00 H new ATOM 0 HG12 VAL B 322 -1.385 -5.499 18.612 1.00 0.00 H new ATOM 0 HG13 VAL B 322 -0.211 -6.546 19.445 1.00 0.00 H new ATOM 0 HG21 VAL B 322 -2.220 -7.947 21.291 1.00 0.00 H new ATOM 0 HG22 VAL B 322 -0.641 -7.294 21.787 1.00 0.00 H new ATOM 0 HG23 VAL B 322 -2.122 -6.778 22.629 1.00 0.00 H new ATOM 2212 N HIS B 323 0.671 -5.542 22.569 1.00 0.00 N ATOM 2213 CA HIS B 323 2.052 -5.902 22.871 1.00 0.00 C ATOM 2214 C HIS B 323 2.482 -7.121 22.057 1.00 0.00 C ATOM 2215 O HIS B 323 2.070 -8.247 22.337 1.00 0.00 O ATOM 2216 CB HIS B 323 2.197 -6.212 24.362 1.00 0.00 C ATOM 2217 CG HIS B 323 2.037 -4.946 25.156 1.00 0.00 C ATOM 2218 ND1 HIS B 323 3.094 -4.079 25.387 1.00 0.00 N ATOM 2219 CD2 HIS B 323 0.950 -4.385 25.780 1.00 0.00 C ATOM 2220 CE1 HIS B 323 2.625 -3.053 26.120 1.00 0.00 C ATOM 2221 NE2 HIS B 323 1.324 -3.189 26.387 1.00 0.00 N ATOM 0 H HIS B 323 0.007 -5.733 23.320 1.00 0.00 H new ATOM 0 HA HIS B 323 2.690 -5.058 22.608 1.00 0.00 H new ATOM 0 HB2 HIS B 323 1.447 -6.942 24.667 1.00 0.00 H new ATOM 0 HB3 HIS B 323 3.173 -6.656 24.559 1.00 0.00 H new ATOM 0 HD2 HIS B 323 -0.044 -4.807 25.797 1.00 0.00 H new ATOM 0 HE1 HIS B 323 3.228 -2.221 26.452 1.00 0.00 H new ATOM 0 HE2 HIS B 323 0.731 -2.553 26.921 1.00 0.00 H new ATOM 2230 N ARG B 324 3.314 -6.893 21.041 1.00 0.00 N ATOM 2231 CA ARG B 324 3.799 -7.981 20.189 1.00 0.00 C ATOM 2232 C ARG B 324 5.283 -7.806 19.892 1.00 0.00 C ATOM 2233 O ARG B 324 5.786 -6.684 19.832 1.00 0.00 O ATOM 2234 CB ARG B 324 3.009 -8.012 18.875 1.00 0.00 C ATOM 2235 CG ARG B 324 1.617 -8.634 19.118 1.00 0.00 C ATOM 2236 CD ARG B 324 1.726 -10.172 19.224 1.00 0.00 C ATOM 2237 NE ARG B 324 1.933 -10.574 20.610 1.00 0.00 N ATOM 2238 CZ ARG B 324 0.930 -10.577 21.483 1.00 0.00 C ATOM 2239 NH1 ARG B 324 -0.266 -10.219 21.102 1.00 0.00 N ATOM 2240 NH2 ARG B 324 1.142 -10.938 22.720 1.00 0.00 N ATOM 0 H ARG B 324 3.665 -5.970 20.788 1.00 0.00 H new ATOM 0 HA ARG B 324 3.655 -8.923 20.718 1.00 0.00 H new ATOM 0 HB2 ARG B 324 2.902 -7.002 18.480 1.00 0.00 H new ATOM 0 HB3 ARG B 324 3.551 -8.591 18.127 1.00 0.00 H new ATOM 0 HG2 ARG B 324 1.186 -8.230 20.034 1.00 0.00 H new ATOM 0 HG3 ARG B 324 0.944 -8.366 18.303 1.00 0.00 H new ATOM 0 HD2 ARG B 324 0.818 -10.635 18.837 1.00 0.00 H new ATOM 0 HD3 ARG B 324 2.552 -10.527 18.609 1.00 0.00 H new ATOM 0 HE ARG B 324 2.864 -10.858 20.915 1.00 0.00 H new ATOM 0 HH11 ARG B 324 -0.430 -9.937 20.136 1.00 0.00 H new ATOM 0 HH12 ARG B 324 -1.036 -10.221 21.771 1.00 0.00 H new ATOM 0 HH21 ARG B 324 2.077 -11.218 23.017 1.00 0.00 H new ATOM 0 HH22 ARG B 324 0.373 -10.940 23.390 1.00 0.00 H new ATOM 2254 N SER B 325 5.976 -8.921 19.704 1.00 0.00 N ATOM 2255 CA SER B 325 7.399 -8.874 19.407 1.00 0.00 C ATOM 2256 C SER B 325 7.610 -8.597 17.926 1.00 0.00 C ATOM 2257 O SER B 325 6.863 -9.088 17.079 1.00 0.00 O ATOM 2258 CB SER B 325 8.056 -10.200 19.786 1.00 0.00 C ATOM 2259 OG SER B 325 7.524 -11.237 18.969 1.00 0.00 O ATOM 0 H SER B 325 5.580 -9.860 19.751 1.00 0.00 H new ATOM 0 HA SER B 325 7.856 -8.073 19.988 1.00 0.00 H new ATOM 0 HB2 SER B 325 9.136 -10.135 19.654 1.00 0.00 H new ATOM 0 HB3 SER B 325 7.876 -10.421 20.838 1.00 0.00 H new ATOM 0 HG SER B 325 7.669 -12.103 19.404 1.00 0.00 H new ATOM 2286 N PHE B 328 12.894 -5.243 16.369 1.00 0.00 N ATOM 2287 CA PHE B 328 13.317 -4.005 17.013 1.00 0.00 C ATOM 2288 C PHE B 328 14.666 -3.552 16.459 1.00 0.00 C ATOM 2289 O PHE B 328 15.008 -2.372 16.522 1.00 0.00 O ATOM 2290 CB PHE B 328 13.418 -4.209 18.527 1.00 0.00 C ATOM 2291 CG PHE B 328 13.497 -2.867 19.213 1.00 0.00 C ATOM 2292 CD1 PHE B 328 12.324 -2.157 19.493 1.00 0.00 C ATOM 2293 CD2 PHE B 328 14.742 -2.331 19.569 1.00 0.00 C ATOM 2294 CE1 PHE B 328 12.395 -0.911 20.129 1.00 0.00 C ATOM 2295 CE2 PHE B 328 14.812 -1.086 20.203 1.00 0.00 C ATOM 2296 CZ PHE B 328 13.639 -0.375 20.485 1.00 0.00 C ATOM 0 HA PHE B 328 12.575 -3.234 16.805 1.00 0.00 H new ATOM 0 HB2 PHE B 328 12.552 -4.763 18.888 1.00 0.00 H new ATOM 0 HB3 PHE B 328 14.300 -4.804 18.766 1.00 0.00 H new ATOM 0 HD1 PHE B 328 11.364 -2.570 19.219 1.00 0.00 H new ATOM 0 HD2 PHE B 328 15.647 -2.879 19.354 1.00 0.00 H new ATOM 0 HE1 PHE B 328 11.490 -0.363 20.345 1.00 0.00 H new ATOM 0 HE2 PHE B 328 15.772 -0.673 20.475 1.00 0.00 H new ATOM 0 HZ PHE B 328 13.694 0.585 20.976 1.00 0.00 H new ATOM 2306 N GLU B 329 15.427 -4.497 15.918 1.00 0.00 N ATOM 2307 CA GLU B 329 16.740 -4.190 15.359 1.00 0.00 C ATOM 2308 C GLU B 329 16.623 -3.115 14.281 1.00 0.00 C ATOM 2309 O GLU B 329 17.604 -2.456 13.939 1.00 0.00 O ATOM 2310 CB GLU B 329 17.364 -5.450 14.755 1.00 0.00 C ATOM 2311 CG GLU B 329 17.513 -6.518 15.839 1.00 0.00 C ATOM 2312 CD GLU B 329 18.515 -6.058 16.893 1.00 0.00 C ATOM 2313 OE1 GLU B 329 19.284 -5.157 16.597 1.00 0.00 O ATOM 2314 OE2 GLU B 329 18.499 -6.613 17.980 1.00 0.00 O ATOM 0 H GLU B 329 15.159 -5.479 15.854 1.00 0.00 H new ATOM 0 HA GLU B 329 17.377 -3.821 16.163 1.00 0.00 H new ATOM 0 HB2 GLU B 329 16.739 -5.825 13.944 1.00 0.00 H new ATOM 0 HB3 GLU B 329 18.338 -5.216 14.325 1.00 0.00 H new ATOM 0 HG2 GLU B 329 16.547 -6.712 16.305 1.00 0.00 H new ATOM 0 HG3 GLU B 329 17.846 -7.455 15.394 1.00 0.00 H new ATOM 2321 N GLU B 330 15.415 -2.940 13.750 1.00 0.00 N ATOM 2322 CA GLU B 330 15.184 -1.942 12.708 1.00 0.00 C ATOM 2323 C GLU B 330 15.796 -0.604 13.107 1.00 0.00 C ATOM 2324 O GLU B 330 16.293 0.143 12.258 1.00 0.00 O ATOM 2325 CB GLU B 330 13.680 -1.769 12.478 1.00 0.00 C ATOM 2326 CG GLU B 330 13.448 -0.782 11.332 1.00 0.00 C ATOM 2327 CD GLU B 330 11.955 -0.662 11.039 1.00 0.00 C ATOM 2328 OE1 GLU B 330 11.186 -1.322 11.716 1.00 0.00 O ATOM 2329 OE2 GLU B 330 11.607 0.088 10.143 1.00 0.00 O ATOM 0 H GLU B 330 14.587 -3.471 14.021 1.00 0.00 H new ATOM 0 HA GLU B 330 15.656 -2.285 11.787 1.00 0.00 H new ATOM 0 HB2 GLU B 330 13.225 -2.731 12.241 1.00 0.00 H new ATOM 0 HB3 GLU B 330 13.202 -1.405 13.388 1.00 0.00 H new ATOM 0 HG2 GLU B 330 13.855 0.195 11.595 1.00 0.00 H new ATOM 0 HG3 GLU B 330 13.976 -1.118 10.440 1.00 0.00 H new ATOM 2336 N LYS B 331 15.757 -0.305 14.400 1.00 0.00 N ATOM 2337 CA LYS B 331 16.314 0.946 14.895 1.00 0.00 C ATOM 2338 C LYS B 331 17.747 1.116 14.406 1.00 0.00 C ATOM 2339 O LYS B 331 18.223 2.238 14.235 1.00 0.00 O ATOM 2340 CB LYS B 331 16.293 0.949 16.431 1.00 0.00 C ATOM 2341 CG LYS B 331 17.220 -0.173 16.973 1.00 0.00 C ATOM 2342 CD LYS B 331 18.555 0.433 17.458 1.00 0.00 C ATOM 2343 CE LYS B 331 18.379 1.009 18.871 1.00 0.00 C ATOM 2344 NZ LYS B 331 19.369 2.102 19.092 1.00 0.00 N ATOM 0 H LYS B 331 15.350 -0.905 15.117 1.00 0.00 H new ATOM 0 HA LYS B 331 15.711 1.772 14.519 1.00 0.00 H new ATOM 0 HB2 LYS B 331 16.622 1.918 16.806 1.00 0.00 H new ATOM 0 HB3 LYS B 331 15.275 0.797 16.790 1.00 0.00 H new ATOM 0 HG2 LYS B 331 16.729 -0.697 17.794 1.00 0.00 H new ATOM 0 HG3 LYS B 331 17.408 -0.910 16.192 1.00 0.00 H new ATOM 0 HD2 LYS B 331 19.333 -0.331 17.460 1.00 0.00 H new ATOM 0 HD3 LYS B 331 18.880 1.216 16.773 1.00 0.00 H new ATOM 0 HE2 LYS B 331 17.366 1.392 18.995 1.00 0.00 H new ATOM 0 HE3 LYS B 331 18.517 0.224 19.615 1.00 0.00 H new ATOM 0 HZ1 LYS B 331 19.681 2.092 20.084 1.00 0.00 H new ATOM 0 HZ2 LYS B 331 20.189 1.959 18.469 1.00 0.00 H new ATOM 0 HZ3 LYS B 331 18.928 3.019 18.877 1.00 0.00 H new ATOM 2358 N TRP B 332 18.429 -0.002 14.182 1.00 0.00 N ATOM 2359 CA TRP B 332 19.806 0.035 13.706 1.00 0.00 C ATOM 2360 C TRP B 332 19.869 0.694 12.333 1.00 0.00 C ATOM 2361 O TRP B 332 20.734 1.532 12.075 1.00 0.00 O ATOM 2362 CB TRP B 332 20.374 -1.383 13.624 1.00 0.00 C ATOM 2363 CG TRP B 332 21.845 -1.316 13.364 1.00 0.00 C ATOM 2364 CD1 TRP B 332 22.757 -0.771 14.202 1.00 0.00 C ATOM 2365 CD2 TRP B 332 22.590 -1.800 12.208 1.00 0.00 C ATOM 2366 NE1 TRP B 332 24.011 -0.890 13.634 1.00 0.00 N ATOM 2367 CE2 TRP B 332 23.961 -1.518 12.406 1.00 0.00 C ATOM 2368 CE3 TRP B 332 22.210 -2.449 11.019 1.00 0.00 C ATOM 2369 CZ2 TRP B 332 24.924 -1.869 11.458 1.00 0.00 C ATOM 2370 CZ3 TRP B 332 23.177 -2.804 10.063 1.00 0.00 C ATOM 2371 CH2 TRP B 332 24.531 -2.514 10.283 1.00 0.00 C ATOM 0 H TRP B 332 18.053 -0.940 14.322 1.00 0.00 H new ATOM 0 HA TRP B 332 20.402 0.617 14.409 1.00 0.00 H new ATOM 0 HB2 TRP B 332 20.182 -1.917 14.554 1.00 0.00 H new ATOM 0 HB3 TRP B 332 19.878 -1.940 12.829 1.00 0.00 H new ATOM 0 HD1 TRP B 332 22.540 -0.317 15.158 1.00 0.00 H new ATOM 0 HE1 TRP B 332 24.870 -0.554 14.070 1.00 0.00 H new ATOM 0 HE3 TRP B 332 21.169 -2.676 10.840 1.00 0.00 H new ATOM 0 HZ2 TRP B 332 25.966 -1.643 11.632 1.00 0.00 H new ATOM 0 HZ3 TRP B 332 22.875 -3.303 9.154 1.00 0.00 H new ATOM 0 HH2 TRP B 332 25.270 -2.789 9.545 1.00 0.00 H new ATOM 2382 N PHE B 333 18.946 0.307 11.456 1.00 0.00 N ATOM 2383 CA PHE B 333 18.904 0.866 10.111 1.00 0.00 C ATOM 2384 C PHE B 333 18.695 2.374 10.173 1.00 0.00 C ATOM 2385 O PHE B 333 19.291 3.122 9.398 1.00 0.00 O ATOM 2386 CB PHE B 333 17.764 0.227 9.310 1.00 0.00 C ATOM 2387 CG PHE B 333 18.159 -1.172 8.893 1.00 0.00 C ATOM 2388 CD1 PHE B 333 18.105 -2.218 9.820 1.00 0.00 C ATOM 2389 CD2 PHE B 333 18.579 -1.420 7.577 1.00 0.00 C ATOM 2390 CE1 PHE B 333 18.472 -3.512 9.435 1.00 0.00 C ATOM 2391 CE2 PHE B 333 18.943 -2.716 7.192 1.00 0.00 C ATOM 2392 CZ PHE B 333 18.890 -3.761 8.121 1.00 0.00 C ATOM 0 H PHE B 333 18.223 -0.386 11.652 1.00 0.00 H new ATOM 0 HA PHE B 333 19.854 0.655 9.619 1.00 0.00 H new ATOM 0 HB2 PHE B 333 16.856 0.195 9.912 1.00 0.00 H new ATOM 0 HB3 PHE B 333 17.542 0.830 8.430 1.00 0.00 H new ATOM 0 HD1 PHE B 333 17.780 -2.027 10.832 1.00 0.00 H new ATOM 0 HD2 PHE B 333 18.621 -0.612 6.862 1.00 0.00 H new ATOM 0 HE1 PHE B 333 18.433 -4.320 10.151 1.00 0.00 H new ATOM 0 HE2 PHE B 333 19.264 -2.909 6.179 1.00 0.00 H new ATOM 0 HZ PHE B 333 19.172 -4.761 7.825 1.00 0.00 H new ATOM 2402 N ALA B 334 17.846 2.809 11.100 1.00 0.00 N ATOM 2403 CA ALA B 334 17.569 4.233 11.252 1.00 0.00 C ATOM 2404 C ALA B 334 18.838 4.992 11.626 1.00 0.00 C ATOM 2405 O ALA B 334 19.100 6.077 11.108 1.00 0.00 O ATOM 2406 CB ALA B 334 16.510 4.447 12.333 1.00 0.00 C ATOM 0 H ALA B 334 17.344 2.204 11.750 1.00 0.00 H new ATOM 0 HA ALA B 334 17.200 4.613 10.300 1.00 0.00 H new ATOM 0 HB1 ALA B 334 16.309 5.513 12.440 1.00 0.00 H new ATOM 0 HB2 ALA B 334 15.592 3.932 12.050 1.00 0.00 H new ATOM 0 HB3 ALA B 334 16.872 4.049 13.281 1.00 0.00 H new ATOM 2412 N LYS B 335 19.622 4.413 12.529 1.00 0.00 N ATOM 2413 CA LYS B 335 20.861 5.045 12.967 1.00 0.00 C ATOM 2414 C LYS B 335 21.834 5.185 11.796 1.00 0.00 C ATOM 2415 O LYS B 335 22.487 6.217 11.642 1.00 0.00 O ATOM 2416 CB LYS B 335 21.512 4.209 14.098 1.00 0.00 C ATOM 2417 CG LYS B 335 21.187 4.825 15.470 1.00 0.00 C ATOM 2418 CD LYS B 335 19.684 4.722 15.735 1.00 0.00 C ATOM 2419 CE LYS B 335 19.369 5.263 17.130 1.00 0.00 C ATOM 2420 NZ LYS B 335 17.899 5.196 17.370 1.00 0.00 N ATOM 0 H LYS B 335 19.424 3.514 12.969 1.00 0.00 H new ATOM 0 HA LYS B 335 20.628 6.040 13.347 1.00 0.00 H new ATOM 0 HB2 LYS B 335 21.148 3.182 14.057 1.00 0.00 H new ATOM 0 HB3 LYS B 335 22.592 4.170 13.956 1.00 0.00 H new ATOM 0 HG2 LYS B 335 21.741 4.307 16.253 1.00 0.00 H new ATOM 0 HG3 LYS B 335 21.500 5.869 15.495 1.00 0.00 H new ATOM 0 HD2 LYS B 335 19.133 5.286 14.983 1.00 0.00 H new ATOM 0 HD3 LYS B 335 19.361 3.684 15.655 1.00 0.00 H new ATOM 0 HE2 LYS B 335 19.898 4.682 17.885 1.00 0.00 H new ATOM 0 HE3 LYS B 335 19.716 6.292 17.219 1.00 0.00 H new ATOM 0 HZ1 LYS B 335 17.685 5.564 18.319 1.00 0.00 H new ATOM 0 HZ2 LYS B 335 17.404 5.769 16.657 1.00 0.00 H new ATOM 0 HZ3 LYS B 335 17.581 4.208 17.302 1.00 0.00 H new ATOM 2434 N GLN B 336 21.927 4.138 10.980 1.00 0.00 N ATOM 2435 CA GLN B 336 22.829 4.157 9.836 1.00 0.00 C ATOM 2436 C GLN B 336 22.443 5.261 8.859 1.00 0.00 C ATOM 2437 O GLN B 336 23.302 5.976 8.347 1.00 0.00 O ATOM 2438 CB GLN B 336 22.786 2.806 9.116 1.00 0.00 C ATOM 2439 CG GLN B 336 23.445 1.741 9.992 1.00 0.00 C ATOM 2440 CD GLN B 336 23.433 0.396 9.273 1.00 0.00 C ATOM 2441 OE1 GLN B 336 22.366 -0.132 8.956 1.00 0.00 O ATOM 2442 NE2 GLN B 336 24.564 -0.192 8.992 1.00 0.00 N ATOM 0 H GLN B 336 21.394 3.275 11.089 1.00 0.00 H new ATOM 0 HA GLN B 336 23.838 4.348 10.201 1.00 0.00 H new ATOM 0 HB2 GLN B 336 21.754 2.529 8.902 1.00 0.00 H new ATOM 0 HB3 GLN B 336 23.302 2.875 8.159 1.00 0.00 H new ATOM 0 HG2 GLN B 336 24.470 2.031 10.222 1.00 0.00 H new ATOM 0 HG3 GLN B 336 22.916 1.660 10.941 1.00 0.00 H new ATOM 0 HE21 GLN B 336 25.446 0.247 9.255 1.00 0.00 H new ATOM 0 HE22 GLN B 336 24.566 -1.090 8.509 1.00 0.00 H new ATOM 2451 N ASN B 337 21.144 5.395 8.604 1.00 0.00 N ATOM 2452 CA ASN B 337 20.656 6.420 7.688 1.00 0.00 C ATOM 2453 C ASN B 337 20.914 7.815 8.244 1.00 0.00 C ATOM 2454 O ASN B 337 21.284 8.730 7.508 1.00 0.00 O ATOM 2455 CB ASN B 337 19.155 6.237 7.452 1.00 0.00 C ATOM 2456 CG ASN B 337 18.908 5.002 6.594 1.00 0.00 C ATOM 2457 OD1 ASN B 337 18.406 3.992 7.088 1.00 0.00 O ATOM 2458 ND2 ASN B 337 19.232 5.022 5.331 1.00 0.00 N ATOM 0 H ASN B 337 20.416 4.811 9.016 1.00 0.00 H new ATOM 0 HA ASN B 337 21.192 6.315 6.745 1.00 0.00 H new ATOM 0 HB2 ASN B 337 18.638 6.136 8.406 1.00 0.00 H new ATOM 0 HB3 ASN B 337 18.746 7.119 6.960 1.00 0.00 H new ATOM 0 HD21 ASN B 337 19.070 4.200 4.750 1.00 0.00 H new ATOM 0 HD22 ASN B 337 19.648 5.860 4.924 1.00 0.00 H new ATOM 2465 N GLU B 338 20.717 7.968 9.547 1.00 0.00 N ATOM 2466 CA GLU B 338 20.921 9.261 10.186 1.00 0.00 C ATOM 2467 C GLU B 338 22.365 9.724 10.022 1.00 0.00 C ATOM 2468 O GLU B 338 22.620 10.861 9.626 1.00 0.00 O ATOM 2469 CB GLU B 338 20.582 9.163 11.679 1.00 0.00 C ATOM 2470 CG GLU B 338 20.587 10.567 12.305 1.00 0.00 C ATOM 2471 CD GLU B 338 22.022 11.029 12.554 1.00 0.00 C ATOM 2472 OE1 GLU B 338 22.868 10.178 12.776 1.00 0.00 O ATOM 2473 OE2 GLU B 338 22.255 12.226 12.518 1.00 0.00 O ATOM 0 H GLU B 338 20.420 7.222 10.176 1.00 0.00 H new ATOM 0 HA GLU B 338 20.264 9.987 9.707 1.00 0.00 H new ATOM 0 HB2 GLU B 338 19.604 8.699 11.810 1.00 0.00 H new ATOM 0 HB3 GLU B 338 21.307 8.526 12.185 1.00 0.00 H new ATOM 0 HG2 GLU B 338 20.081 11.270 11.643 1.00 0.00 H new ATOM 0 HG3 GLU B 338 20.033 10.557 13.243 1.00 0.00 H new