USER MOD reduce.3.24.130724 H: found=0, std=0, add=683, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 685 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 74 MET CE :methyl -155:sc= -0.0861 (180deg=-0.386) USER MOD Set 1.2: A 91 ASN :FLIP amide:sc= -1.87! C(o=-3.4!,f=-2!) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 5:sc= 1.06 USER MOD Single : A 22 ASN : amide:sc= -0.358 K(o=-0.36,f=-7.1!) USER MOD Single : A 25 TYR OH : rot -56:sc= -0.515 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.0922 USER MOD Single : A 31 GLN : amide:sc= -0.168 K(o=-0.17,f=-0.72) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 CYS SG : rot 118:sc= -2.43! USER MOD Single : A 64 TYR OH : rot 148:sc= 0.387 USER MOD Single : A 65 GLN : amide:sc= -0.27 K(o=-0.27,f=-2.6!) USER MOD Single : A 67 GLN : amide:sc= -0.903 X(o=-0.9,f=-1.4!) USER MOD Single : A 69 THR OG1 : rot -159:sc= -0.856 USER MOD Single : A 72 SER OG : rot 77:sc= 0.978 USER MOD Single : A 76 ASN :FLIP amide:sc= -3.53 F(o=-4.4!,f=-3.5) USER MOD Single : A 78 ASN :FLIP amide:sc= -1.22! C(o=-1.9!,f=-1.2!) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= -10.1! C(o=-10!,f=-18!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 89 N SER A 14 8.293 -9.978 -4.598 1.00 0.00 N ATOM 90 CA SER A 14 8.345 -11.191 -3.798 1.00 0.00 C ATOM 91 C SER A 14 8.123 -12.415 -4.689 1.00 0.00 C ATOM 92 O SER A 14 8.674 -13.484 -4.429 1.00 0.00 O ATOM 93 CB SER A 14 7.305 -11.155 -2.677 1.00 0.00 C ATOM 94 OG SER A 14 7.906 -11.254 -1.388 1.00 0.00 O ATOM 0 HA SER A 14 9.332 -11.257 -3.340 1.00 0.00 H new ATOM 0 HB2 SER A 14 6.735 -10.228 -2.741 1.00 0.00 H new ATOM 0 HB3 SER A 14 6.598 -11.974 -2.811 1.00 0.00 H new ATOM 0 HG SER A 14 7.209 -11.226 -0.699 1.00 0.00 H new ATOM 100 N LEU A 15 7.316 -12.218 -5.721 1.00 0.00 N ATOM 101 CA LEU A 15 7.015 -13.292 -6.652 1.00 0.00 C ATOM 102 C LEU A 15 8.269 -13.624 -7.464 1.00 0.00 C ATOM 103 O LEU A 15 8.358 -14.693 -8.065 1.00 0.00 O ATOM 104 CB LEU A 15 5.802 -12.932 -7.512 1.00 0.00 C ATOM 105 CG LEU A 15 4.433 -13.153 -6.866 1.00 0.00 C ATOM 106 CD1 LEU A 15 3.728 -14.366 -7.477 1.00 0.00 C ATOM 107 CD2 LEU A 15 4.556 -13.267 -5.346 1.00 0.00 C ATOM 0 H LEU A 15 6.861 -11.330 -5.933 1.00 0.00 H new ATOM 0 HA LEU A 15 6.736 -14.197 -6.112 1.00 0.00 H new ATOM 0 HB2 LEU A 15 5.882 -11.883 -7.797 1.00 0.00 H new ATOM 0 HB3 LEU A 15 5.847 -13.516 -8.431 1.00 0.00 H new ATOM 0 HG LEU A 15 3.812 -12.281 -7.074 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.757 -14.501 -7.000 1.00 0.00 H new ATOM 0 HD12 LEU A 15 3.588 -14.205 -8.546 1.00 0.00 H new ATOM 0 HD13 LEU A 15 4.336 -15.257 -7.321 1.00 0.00 H new ATOM 0 HD21 LEU A 15 3.569 -13.424 -4.912 1.00 0.00 H new ATOM 0 HD22 LEU A 15 5.201 -14.110 -5.095 1.00 0.00 H new ATOM 0 HD23 LEU A 15 4.987 -12.349 -4.946 1.00 0.00 H new ATOM 119 N ARG A 16 9.206 -12.687 -7.455 1.00 0.00 N ATOM 120 CA ARG A 16 10.450 -12.866 -8.184 1.00 0.00 C ATOM 121 C ARG A 16 11.562 -13.312 -7.232 1.00 0.00 C ATOM 122 O ARG A 16 12.643 -12.725 -7.216 1.00 0.00 O ATOM 123 CB ARG A 16 10.873 -11.571 -8.879 1.00 0.00 C ATOM 124 CG ARG A 16 9.824 -11.131 -9.903 1.00 0.00 C ATOM 125 CD ARG A 16 10.095 -9.705 -10.387 1.00 0.00 C ATOM 126 NE ARG A 16 11.503 -9.578 -10.825 1.00 0.00 N ATOM 127 CZ ARG A 16 12.096 -8.413 -11.118 1.00 0.00 C ATOM 128 NH1 ARG A 16 11.408 -7.268 -11.023 1.00 0.00 N ATOM 129 NH2 ARG A 16 13.379 -8.394 -11.507 1.00 0.00 N ATOM 0 H ARG A 16 9.129 -11.802 -6.954 1.00 0.00 H new ATOM 0 HA ARG A 16 10.284 -13.633 -8.941 1.00 0.00 H new ATOM 0 HB2 ARG A 16 11.014 -10.785 -8.137 1.00 0.00 H new ATOM 0 HB3 ARG A 16 11.832 -11.717 -9.375 1.00 0.00 H new ATOM 0 HG2 ARG A 16 9.830 -11.814 -10.752 1.00 0.00 H new ATOM 0 HG3 ARG A 16 8.831 -11.185 -9.458 1.00 0.00 H new ATOM 0 HD2 ARG A 16 9.426 -9.459 -11.211 1.00 0.00 H new ATOM 0 HD3 ARG A 16 9.889 -8.995 -9.586 1.00 0.00 H new ATOM 0 HE ARG A 16 12.056 -10.431 -10.909 1.00 0.00 H new ATOM 0 HH11 ARG A 16 10.432 -7.283 -10.727 1.00 0.00 H new ATOM 0 HH12 ARG A 16 11.860 -6.381 -11.246 1.00 0.00 H new ATOM 0 HH21 ARG A 16 13.903 -9.266 -11.580 1.00 0.00 H new ATOM 0 HH22 ARG A 16 13.831 -7.507 -11.730 1.00 0.00 H new ATOM 143 N SER A 17 11.259 -14.347 -6.463 1.00 0.00 N ATOM 144 CA SER A 17 12.220 -14.879 -5.511 1.00 0.00 C ATOM 145 C SER A 17 11.780 -16.268 -5.044 1.00 0.00 C ATOM 146 O SER A 17 10.670 -16.435 -4.541 1.00 0.00 O ATOM 147 CB SER A 17 12.383 -13.943 -4.312 1.00 0.00 C ATOM 148 OG SER A 17 13.107 -12.763 -4.650 1.00 0.00 O ATOM 0 H SER A 17 10.362 -14.832 -6.479 1.00 0.00 H new ATOM 0 HA SER A 17 13.186 -14.959 -6.009 1.00 0.00 H new ATOM 0 HB2 SER A 17 11.400 -13.668 -3.930 1.00 0.00 H new ATOM 0 HB3 SER A 17 12.901 -14.469 -3.510 1.00 0.00 H new ATOM 0 HG SER A 17 13.295 -12.759 -5.612 1.00 0.00 H new ATOM 154 N VAL A 18 12.673 -17.229 -5.228 1.00 0.00 N ATOM 155 CA VAL A 18 12.391 -18.598 -4.832 1.00 0.00 C ATOM 156 C VAL A 18 13.422 -19.047 -3.794 1.00 0.00 C ATOM 157 O VAL A 18 14.625 -18.965 -4.033 1.00 0.00 O ATOM 158 CB VAL A 18 12.353 -19.503 -6.066 1.00 0.00 C ATOM 159 CG1 VAL A 18 10.917 -19.696 -6.559 1.00 0.00 C ATOM 160 CG2 VAL A 18 13.245 -18.950 -7.179 1.00 0.00 C ATOM 0 H VAL A 18 13.592 -17.087 -5.646 1.00 0.00 H new ATOM 0 HA VAL A 18 11.408 -18.665 -4.365 1.00 0.00 H new ATOM 0 HB VAL A 18 12.743 -20.479 -5.778 1.00 0.00 H new ATOM 0 HG11 VAL A 18 10.917 -20.343 -7.436 1.00 0.00 H new ATOM 0 HG12 VAL A 18 10.320 -20.154 -5.771 1.00 0.00 H new ATOM 0 HG13 VAL A 18 10.489 -18.728 -6.822 1.00 0.00 H new ATOM 0 HG21 VAL A 18 13.200 -19.612 -8.044 1.00 0.00 H new ATOM 0 HG22 VAL A 18 12.898 -17.957 -7.464 1.00 0.00 H new ATOM 0 HG23 VAL A 18 14.273 -18.887 -6.824 1.00 0.00 H new ATOM 170 N PHE A 19 12.911 -19.511 -2.663 1.00 0.00 N ATOM 171 CA PHE A 19 13.772 -19.973 -1.587 1.00 0.00 C ATOM 172 C PHE A 19 14.321 -21.370 -1.885 1.00 0.00 C ATOM 173 O PHE A 19 13.563 -22.281 -2.216 1.00 0.00 O ATOM 174 CB PHE A 19 12.914 -20.034 -0.322 1.00 0.00 C ATOM 175 CG PHE A 19 13.627 -20.648 0.884 1.00 0.00 C ATOM 176 CD1 PHE A 19 14.890 -20.254 1.202 1.00 0.00 C ATOM 177 CD2 PHE A 19 12.999 -21.588 1.640 1.00 0.00 C ATOM 178 CE1 PHE A 19 15.551 -20.824 2.321 1.00 0.00 C ATOM 179 CE2 PHE A 19 13.660 -22.158 2.759 1.00 0.00 C ATOM 180 CZ PHE A 19 14.923 -21.764 3.076 1.00 0.00 C ATOM 0 H PHE A 19 11.912 -19.577 -2.468 1.00 0.00 H new ATOM 0 HA PHE A 19 14.619 -19.296 -1.472 1.00 0.00 H new ATOM 0 HB2 PHE A 19 12.591 -19.025 -0.065 1.00 0.00 H new ATOM 0 HB3 PHE A 19 12.015 -20.613 -0.533 1.00 0.00 H new ATOM 0 HD1 PHE A 19 15.390 -19.507 0.603 1.00 0.00 H new ATOM 0 HD2 PHE A 19 11.996 -21.901 1.389 1.00 0.00 H new ATOM 0 HE1 PHE A 19 16.553 -20.511 2.573 1.00 0.00 H new ATOM 0 HE2 PHE A 19 13.161 -22.904 3.359 1.00 0.00 H new ATOM 0 HZ PHE A 19 15.427 -22.198 3.927 1.00 0.00 H new ATOM 190 N VAL A 20 15.634 -21.495 -1.757 1.00 0.00 N ATOM 191 CA VAL A 20 16.292 -22.765 -2.009 1.00 0.00 C ATOM 192 C VAL A 20 17.049 -23.200 -0.752 1.00 0.00 C ATOM 193 O VAL A 20 17.767 -22.404 -0.149 1.00 0.00 O ATOM 194 CB VAL A 20 17.194 -22.653 -3.240 1.00 0.00 C ATOM 195 CG1 VAL A 20 17.435 -24.026 -3.870 1.00 0.00 C ATOM 196 CG2 VAL A 20 16.607 -21.677 -4.261 1.00 0.00 C ATOM 0 H VAL A 20 16.259 -20.738 -1.482 1.00 0.00 H new ATOM 0 HA VAL A 20 15.556 -23.538 -2.231 1.00 0.00 H new ATOM 0 HB VAL A 20 18.157 -22.260 -2.915 1.00 0.00 H new ATOM 0 HG11 VAL A 20 18.079 -23.918 -4.743 1.00 0.00 H new ATOM 0 HG12 VAL A 20 17.916 -24.681 -3.143 1.00 0.00 H new ATOM 0 HG13 VAL A 20 16.482 -24.459 -4.174 1.00 0.00 H new ATOM 0 HG21 VAL A 20 17.267 -21.615 -5.126 1.00 0.00 H new ATOM 0 HG22 VAL A 20 15.625 -22.029 -4.578 1.00 0.00 H new ATOM 0 HG23 VAL A 20 16.510 -20.691 -3.807 1.00 0.00 H new ATOM 206 N GLY A 21 16.862 -24.462 -0.394 1.00 0.00 N ATOM 207 CA GLY A 21 17.518 -25.012 0.780 1.00 0.00 C ATOM 208 C GLY A 21 18.088 -26.402 0.489 1.00 0.00 C ATOM 209 O GLY A 21 18.161 -26.818 -0.666 1.00 0.00 O ATOM 0 H GLY A 21 16.265 -25.119 -0.896 1.00 0.00 H new ATOM 0 HA2 GLY A 21 18.320 -24.346 1.099 1.00 0.00 H new ATOM 0 HA3 GLY A 21 16.807 -25.072 1.604 1.00 0.00 H new ATOM 213 N ASN A 22 18.478 -27.082 1.557 1.00 0.00 N ATOM 214 CA ASN A 22 19.040 -28.416 1.431 1.00 0.00 C ATOM 215 C ASN A 22 20.168 -28.394 0.397 1.00 0.00 C ATOM 216 O ASN A 22 20.412 -29.391 -0.281 1.00 0.00 O ATOM 217 CB ASN A 22 17.983 -29.416 0.956 1.00 0.00 C ATOM 218 CG ASN A 22 18.227 -30.800 1.561 1.00 0.00 C ATOM 219 OD1 ASN A 22 17.358 -31.402 2.170 1.00 0.00 O ATOM 220 ND2 ASN A 22 19.455 -31.270 1.358 1.00 0.00 N ATOM 0 H ASN A 22 18.416 -26.734 2.514 1.00 0.00 H new ATOM 0 HA ASN A 22 19.410 -28.720 2.410 1.00 0.00 H new ATOM 0 HB2 ASN A 22 16.991 -29.062 1.236 1.00 0.00 H new ATOM 0 HB3 ASN A 22 18.002 -29.482 -0.132 1.00 0.00 H new ATOM 0 HD21 ASN A 22 19.717 -32.187 1.721 1.00 0.00 H new ATOM 0 HD22 ASN A 22 20.135 -30.714 0.839 1.00 0.00 H new ATOM 227 N ILE A 23 20.825 -27.247 0.310 1.00 0.00 N ATOM 228 CA ILE A 23 21.921 -27.083 -0.629 1.00 0.00 C ATOM 229 C ILE A 23 23.249 -27.287 0.103 1.00 0.00 C ATOM 230 O ILE A 23 23.607 -26.500 0.978 1.00 0.00 O ATOM 231 CB ILE A 23 21.815 -25.735 -1.346 1.00 0.00 C ATOM 232 CG1 ILE A 23 20.360 -25.268 -1.422 1.00 0.00 C ATOM 233 CG2 ILE A 23 22.471 -25.795 -2.727 1.00 0.00 C ATOM 234 CD1 ILE A 23 20.255 -23.913 -2.125 1.00 0.00 C ATOM 0 H ILE A 23 20.619 -26.423 0.874 1.00 0.00 H new ATOM 0 HA ILE A 23 21.868 -27.840 -1.412 1.00 0.00 H new ATOM 0 HB ILE A 23 22.361 -24.994 -0.763 1.00 0.00 H new ATOM 0 HG12 ILE A 23 19.765 -26.007 -1.958 1.00 0.00 H new ATOM 0 HG13 ILE A 23 19.945 -25.193 -0.417 1.00 0.00 H new ATOM 0 HG21 ILE A 23 22.382 -24.824 -3.215 1.00 0.00 H new ATOM 0 HG22 ILE A 23 23.525 -26.051 -2.618 1.00 0.00 H new ATOM 0 HG23 ILE A 23 21.974 -26.553 -3.333 1.00 0.00 H new ATOM 0 HD11 ILE A 23 19.210 -23.604 -2.166 1.00 0.00 H new ATOM 0 HD12 ILE A 23 20.832 -23.171 -1.573 1.00 0.00 H new ATOM 0 HD13 ILE A 23 20.648 -23.997 -3.138 1.00 0.00 H new ATOM 246 N PRO A 24 23.962 -28.375 -0.293 1.00 0.00 N ATOM 247 CA PRO A 24 25.243 -28.692 0.315 1.00 0.00 C ATOM 248 C PRO A 24 26.338 -27.749 -0.187 1.00 0.00 C ATOM 249 O PRO A 24 26.089 -26.906 -1.048 1.00 0.00 O ATOM 250 CB PRO A 24 25.501 -30.146 -0.046 1.00 0.00 C ATOM 251 CG PRO A 24 24.590 -30.451 -1.224 1.00 0.00 C ATOM 252 CD PRO A 24 23.570 -29.328 -1.327 1.00 0.00 C ATOM 0 HA PRO A 24 25.239 -28.558 1.397 1.00 0.00 H new ATOM 0 HB2 PRO A 24 26.547 -30.303 -0.310 1.00 0.00 H new ATOM 0 HB3 PRO A 24 25.283 -30.802 0.797 1.00 0.00 H new ATOM 0 HG2 PRO A 24 25.169 -30.527 -2.145 1.00 0.00 H new ATOM 0 HG3 PRO A 24 24.090 -31.409 -1.082 1.00 0.00 H new ATOM 0 HD2 PRO A 24 23.585 -28.869 -2.315 1.00 0.00 H new ATOM 0 HD3 PRO A 24 22.557 -29.696 -1.163 1.00 0.00 H new ATOM 260 N TYR A 25 27.526 -27.921 0.373 1.00 0.00 N ATOM 261 CA TYR A 25 28.660 -27.096 -0.008 1.00 0.00 C ATOM 262 C TYR A 25 29.178 -27.482 -1.394 1.00 0.00 C ATOM 263 O TYR A 25 30.102 -26.856 -1.912 1.00 0.00 O ATOM 264 CB TYR A 25 29.751 -27.375 1.028 1.00 0.00 C ATOM 265 CG TYR A 25 29.576 -26.606 2.339 1.00 0.00 C ATOM 266 CD1 TYR A 25 28.345 -26.573 2.961 1.00 0.00 C ATOM 267 CD2 TYR A 25 30.650 -25.944 2.899 1.00 0.00 C ATOM 268 CE1 TYR A 25 28.180 -25.849 4.195 1.00 0.00 C ATOM 269 CE2 TYR A 25 30.486 -25.220 4.133 1.00 0.00 C ATOM 270 CZ TYR A 25 29.259 -25.208 4.720 1.00 0.00 C ATOM 271 OH TYR A 25 29.104 -24.524 5.885 1.00 0.00 O ATOM 0 H TYR A 25 27.728 -28.620 1.088 1.00 0.00 H new ATOM 0 HA TYR A 25 28.375 -26.044 -0.042 1.00 0.00 H new ATOM 0 HB2 TYR A 25 29.767 -28.443 1.245 1.00 0.00 H new ATOM 0 HB3 TYR A 25 30.720 -27.122 0.597 1.00 0.00 H new ATOM 0 HD1 TYR A 25 27.505 -27.090 2.522 1.00 0.00 H new ATOM 0 HD2 TYR A 25 31.613 -25.969 2.412 1.00 0.00 H new ATOM 0 HE1 TYR A 25 27.222 -25.816 4.692 1.00 0.00 H new ATOM 0 HE2 TYR A 25 31.318 -24.698 4.582 1.00 0.00 H new ATOM 0 HH TYR A 25 28.391 -23.859 5.782 1.00 0.00 H new ATOM 281 N GLU A 26 28.562 -28.511 -1.956 1.00 0.00 N ATOM 282 CA GLU A 26 28.950 -28.988 -3.273 1.00 0.00 C ATOM 283 C GLU A 26 28.119 -28.294 -4.355 1.00 0.00 C ATOM 284 O GLU A 26 28.411 -28.420 -5.543 1.00 0.00 O ATOM 285 CB GLU A 26 28.813 -30.509 -3.367 1.00 0.00 C ATOM 286 CG GLU A 26 29.926 -31.107 -4.229 1.00 0.00 C ATOM 287 CD GLU A 26 29.621 -32.563 -4.586 1.00 0.00 C ATOM 288 OE1 GLU A 26 28.859 -32.762 -5.556 1.00 0.00 O ATOM 289 OE2 GLU A 26 30.158 -33.445 -3.880 1.00 0.00 O ATOM 0 H GLU A 26 27.797 -29.028 -1.524 1.00 0.00 H new ATOM 0 HA GLU A 26 29.999 -28.740 -3.434 1.00 0.00 H new ATOM 0 HB2 GLU A 26 28.849 -30.943 -2.368 1.00 0.00 H new ATOM 0 HB3 GLU A 26 27.842 -30.765 -3.791 1.00 0.00 H new ATOM 0 HG2 GLU A 26 30.039 -30.521 -5.141 1.00 0.00 H new ATOM 0 HG3 GLU A 26 30.874 -31.051 -3.695 1.00 0.00 H new ATOM 296 N ALA A 27 27.100 -27.578 -3.904 1.00 0.00 N ATOM 297 CA ALA A 27 26.225 -26.864 -4.819 1.00 0.00 C ATOM 298 C ALA A 27 26.341 -25.360 -4.561 1.00 0.00 C ATOM 299 O ALA A 27 25.689 -24.829 -3.664 1.00 0.00 O ATOM 300 CB ALA A 27 24.791 -27.374 -4.657 1.00 0.00 C ATOM 0 H ALA A 27 26.860 -27.477 -2.918 1.00 0.00 H new ATOM 0 HA ALA A 27 26.521 -27.045 -5.852 1.00 0.00 H new ATOM 0 HB1 ALA A 27 24.135 -26.839 -5.343 1.00 0.00 H new ATOM 0 HB2 ALA A 27 24.757 -28.440 -4.880 1.00 0.00 H new ATOM 0 HB3 ALA A 27 24.459 -27.207 -3.632 1.00 0.00 H new ATOM 306 N THR A 28 27.177 -24.718 -5.363 1.00 0.00 N ATOM 307 CA THR A 28 27.388 -23.286 -5.233 1.00 0.00 C ATOM 308 C THR A 28 26.403 -22.520 -6.119 1.00 0.00 C ATOM 309 O THR A 28 25.661 -23.121 -6.893 1.00 0.00 O ATOM 310 CB THR A 28 28.854 -22.992 -5.558 1.00 0.00 C ATOM 311 OG1 THR A 28 29.141 -23.844 -6.664 1.00 0.00 O ATOM 312 CG2 THR A 28 29.805 -23.473 -4.460 1.00 0.00 C ATOM 0 H THR A 28 27.717 -25.163 -6.106 1.00 0.00 H new ATOM 0 HA THR A 28 27.192 -22.948 -4.215 1.00 0.00 H new ATOM 0 HB THR A 28 28.985 -21.920 -5.707 1.00 0.00 H new ATOM 0 HG1 THR A 28 30.072 -23.717 -6.942 1.00 0.00 H new ATOM 0 HG21 THR A 28 30.832 -23.240 -4.741 1.00 0.00 H new ATOM 0 HG22 THR A 28 29.562 -22.972 -3.523 1.00 0.00 H new ATOM 0 HG23 THR A 28 29.699 -24.550 -4.333 1.00 0.00 H new ATOM 320 N GLU A 29 26.429 -21.203 -5.974 1.00 0.00 N ATOM 321 CA GLU A 29 25.548 -20.348 -6.752 1.00 0.00 C ATOM 322 C GLU A 29 25.777 -20.570 -8.248 1.00 0.00 C ATOM 323 O GLU A 29 24.851 -20.440 -9.047 1.00 0.00 O ATOM 324 CB GLU A 29 25.744 -18.876 -6.380 1.00 0.00 C ATOM 325 CG GLU A 29 24.757 -18.450 -5.292 1.00 0.00 C ATOM 326 CD GLU A 29 24.761 -16.930 -5.112 1.00 0.00 C ATOM 327 OE1 GLU A 29 25.013 -16.240 -6.124 1.00 0.00 O ATOM 328 OE2 GLU A 29 24.513 -16.493 -3.968 1.00 0.00 O ATOM 0 H GLU A 29 27.046 -20.708 -5.330 1.00 0.00 H new ATOM 0 HA GLU A 29 24.517 -20.614 -6.519 1.00 0.00 H new ATOM 0 HB2 GLU A 29 26.765 -18.718 -6.032 1.00 0.00 H new ATOM 0 HB3 GLU A 29 25.608 -18.253 -7.264 1.00 0.00 H new ATOM 0 HG2 GLU A 29 23.754 -18.786 -5.554 1.00 0.00 H new ATOM 0 HG3 GLU A 29 25.018 -18.932 -4.350 1.00 0.00 H new ATOM 335 N GLU A 30 27.015 -20.902 -8.582 1.00 0.00 N ATOM 336 CA GLU A 30 27.377 -21.143 -9.968 1.00 0.00 C ATOM 337 C GLU A 30 26.616 -22.354 -10.512 1.00 0.00 C ATOM 338 O GLU A 30 26.273 -22.397 -11.693 1.00 0.00 O ATOM 339 CB GLU A 30 28.888 -21.335 -10.115 1.00 0.00 C ATOM 340 CG GLU A 30 29.557 -20.054 -10.619 1.00 0.00 C ATOM 341 CD GLU A 30 31.009 -19.971 -10.145 1.00 0.00 C ATOM 342 OE1 GLU A 30 31.739 -20.959 -10.377 1.00 0.00 O ATOM 343 OE2 GLU A 30 31.357 -18.921 -9.563 1.00 0.00 O ATOM 0 H GLU A 30 27.780 -21.010 -7.916 1.00 0.00 H new ATOM 0 HA GLU A 30 27.096 -20.268 -10.554 1.00 0.00 H new ATOM 0 HB2 GLU A 30 29.317 -21.620 -9.154 1.00 0.00 H new ATOM 0 HB3 GLU A 30 29.089 -22.152 -10.809 1.00 0.00 H new ATOM 0 HG2 GLU A 30 29.524 -20.027 -11.708 1.00 0.00 H new ATOM 0 HG3 GLU A 30 29.004 -19.186 -10.261 1.00 0.00 H new ATOM 350 N GLN A 31 26.375 -23.308 -9.626 1.00 0.00 N ATOM 351 CA GLN A 31 25.660 -24.516 -10.002 1.00 0.00 C ATOM 352 C GLN A 31 24.150 -24.284 -9.929 1.00 0.00 C ATOM 353 O GLN A 31 23.413 -24.678 -10.832 1.00 0.00 O ATOM 354 CB GLN A 31 26.077 -25.697 -9.122 1.00 0.00 C ATOM 355 CG GLN A 31 27.523 -26.108 -9.406 1.00 0.00 C ATOM 356 CD GLN A 31 27.670 -27.632 -9.405 1.00 0.00 C ATOM 357 OE1 GLN A 31 27.010 -28.345 -10.142 1.00 0.00 O ATOM 358 NE2 GLN A 31 28.569 -28.087 -8.537 1.00 0.00 N ATOM 0 H GLN A 31 26.662 -23.269 -8.648 1.00 0.00 H new ATOM 0 HA GLN A 31 25.920 -24.763 -11.031 1.00 0.00 H new ATOM 0 HB2 GLN A 31 25.971 -25.427 -8.071 1.00 0.00 H new ATOM 0 HB3 GLN A 31 25.413 -26.542 -9.302 1.00 0.00 H new ATOM 0 HG2 GLN A 31 27.835 -25.710 -10.371 1.00 0.00 H new ATOM 0 HG3 GLN A 31 28.182 -25.675 -8.654 1.00 0.00 H new ATOM 0 HE21 GLN A 31 29.087 -27.434 -7.950 1.00 0.00 H new ATOM 0 HE22 GLN A 31 28.740 -29.089 -8.459 1.00 0.00 H new ATOM 367 N LEU A 32 23.733 -23.646 -8.845 1.00 0.00 N ATOM 368 CA LEU A 32 22.324 -23.357 -8.642 1.00 0.00 C ATOM 369 C LEU A 32 21.810 -22.504 -9.803 1.00 0.00 C ATOM 370 O LEU A 32 20.776 -22.811 -10.394 1.00 0.00 O ATOM 371 CB LEU A 32 22.099 -22.724 -7.267 1.00 0.00 C ATOM 372 CG LEU A 32 21.927 -23.698 -6.100 1.00 0.00 C ATOM 373 CD1 LEU A 32 21.837 -22.948 -4.769 1.00 0.00 C ATOM 374 CD2 LEU A 32 20.723 -24.615 -6.324 1.00 0.00 C ATOM 0 H LEU A 32 24.347 -23.321 -8.098 1.00 0.00 H new ATOM 0 HA LEU A 32 21.743 -24.279 -8.642 1.00 0.00 H new ATOM 0 HB2 LEU A 32 22.943 -22.071 -7.047 1.00 0.00 H new ATOM 0 HB3 LEU A 32 21.212 -22.092 -7.321 1.00 0.00 H new ATOM 0 HG LEU A 32 22.811 -24.334 -6.052 1.00 0.00 H new ATOM 0 HD11 LEU A 32 21.715 -23.663 -3.956 1.00 0.00 H new ATOM 0 HD12 LEU A 32 22.750 -22.373 -4.613 1.00 0.00 H new ATOM 0 HD13 LEU A 32 20.982 -22.272 -4.789 1.00 0.00 H new ATOM 0 HD21 LEU A 32 20.623 -25.297 -5.480 1.00 0.00 H new ATOM 0 HD22 LEU A 32 19.819 -24.013 -6.413 1.00 0.00 H new ATOM 0 HD23 LEU A 32 20.868 -25.189 -7.239 1.00 0.00 H new ATOM 386 N LYS A 33 22.557 -21.449 -10.096 1.00 0.00 N ATOM 387 CA LYS A 33 22.190 -20.549 -11.176 1.00 0.00 C ATOM 388 C LYS A 33 22.078 -21.343 -12.480 1.00 0.00 C ATOM 389 O LYS A 33 21.201 -21.076 -13.300 1.00 0.00 O ATOM 390 CB LYS A 33 23.169 -19.376 -11.253 1.00 0.00 C ATOM 391 CG LYS A 33 22.490 -18.132 -11.828 1.00 0.00 C ATOM 392 CD LYS A 33 23.350 -16.886 -11.606 1.00 0.00 C ATOM 393 CE LYS A 33 23.906 -16.361 -12.931 1.00 0.00 C ATOM 394 NZ LYS A 33 23.817 -14.884 -12.982 1.00 0.00 N ATOM 0 H LYS A 33 23.414 -21.198 -9.604 1.00 0.00 H new ATOM 0 HA LYS A 33 21.212 -20.106 -10.986 1.00 0.00 H new ATOM 0 HB2 LYS A 33 23.557 -19.156 -10.259 1.00 0.00 H new ATOM 0 HB3 LYS A 33 24.022 -19.649 -11.875 1.00 0.00 H new ATOM 0 HG2 LYS A 33 22.312 -18.270 -12.894 1.00 0.00 H new ATOM 0 HG3 LYS A 33 21.516 -17.995 -11.358 1.00 0.00 H new ATOM 0 HD2 LYS A 33 22.755 -16.110 -11.124 1.00 0.00 H new ATOM 0 HD3 LYS A 33 24.172 -17.123 -10.931 1.00 0.00 H new ATOM 0 HE2 LYS A 33 24.944 -16.673 -13.046 1.00 0.00 H new ATOM 0 HE3 LYS A 33 23.350 -16.794 -13.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 24.199 -14.544 -13.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 22.822 -14.593 -12.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 24.367 -14.476 -12.200 1.00 0.00 H new ATOM 408 N ASP A 34 22.979 -22.302 -12.630 1.00 0.00 N ATOM 409 CA ASP A 34 22.993 -23.137 -13.820 1.00 0.00 C ATOM 410 C ASP A 34 21.736 -24.009 -13.840 1.00 0.00 C ATOM 411 O ASP A 34 21.171 -24.266 -14.902 1.00 0.00 O ATOM 412 CB ASP A 34 24.211 -24.062 -13.830 1.00 0.00 C ATOM 413 CG ASP A 34 24.958 -24.133 -15.163 1.00 0.00 C ATOM 414 OD1 ASP A 34 24.838 -23.156 -15.934 1.00 0.00 O ATOM 415 OD2 ASP A 34 25.632 -25.163 -15.382 1.00 0.00 O ATOM 0 H ASP A 34 23.705 -22.520 -11.948 1.00 0.00 H new ATOM 0 HA ASP A 34 23.031 -22.483 -14.691 1.00 0.00 H new ATOM 0 HB2 ASP A 34 24.906 -23.731 -13.058 1.00 0.00 H new ATOM 0 HB3 ASP A 34 23.888 -25.067 -13.558 1.00 0.00 H new ATOM 420 N ILE A 35 21.336 -24.442 -12.653 1.00 0.00 N ATOM 421 CA ILE A 35 20.157 -25.280 -12.521 1.00 0.00 C ATOM 422 C ILE A 35 18.912 -24.461 -12.869 1.00 0.00 C ATOM 423 O ILE A 35 18.068 -24.907 -13.645 1.00 0.00 O ATOM 424 CB ILE A 35 20.105 -25.917 -11.130 1.00 0.00 C ATOM 425 CG1 ILE A 35 21.363 -26.744 -10.859 1.00 0.00 C ATOM 426 CG2 ILE A 35 18.828 -26.740 -10.952 1.00 0.00 C ATOM 427 CD1 ILE A 35 21.755 -26.676 -9.381 1.00 0.00 C ATOM 0 H ILE A 35 21.808 -24.228 -11.774 1.00 0.00 H new ATOM 0 HA ILE A 35 20.200 -26.111 -13.226 1.00 0.00 H new ATOM 0 HB ILE A 35 20.079 -25.118 -10.389 1.00 0.00 H new ATOM 0 HG12 ILE A 35 21.190 -27.781 -11.146 1.00 0.00 H new ATOM 0 HG13 ILE A 35 22.184 -26.376 -11.474 1.00 0.00 H new ATOM 0 HG21 ILE A 35 18.816 -27.182 -9.956 1.00 0.00 H new ATOM 0 HG22 ILE A 35 17.959 -26.094 -11.073 1.00 0.00 H new ATOM 0 HG23 ILE A 35 18.798 -27.532 -11.700 1.00 0.00 H new ATOM 0 HD11 ILE A 35 22.652 -27.272 -9.215 1.00 0.00 H new ATOM 0 HD12 ILE A 35 21.951 -25.640 -9.104 1.00 0.00 H new ATOM 0 HD13 ILE A 35 20.941 -27.067 -8.770 1.00 0.00 H new ATOM 439 N PHE A 36 18.838 -23.277 -12.279 1.00 0.00 N ATOM 440 CA PHE A 36 17.710 -22.392 -12.517 1.00 0.00 C ATOM 441 C PHE A 36 17.736 -21.844 -13.945 1.00 0.00 C ATOM 442 O PHE A 36 16.691 -21.526 -14.511 1.00 0.00 O ATOM 443 CB PHE A 36 17.841 -21.227 -11.534 1.00 0.00 C ATOM 444 CG PHE A 36 17.128 -21.455 -10.200 1.00 0.00 C ATOM 445 CD1 PHE A 36 15.893 -22.025 -10.178 1.00 0.00 C ATOM 446 CD2 PHE A 36 17.728 -21.088 -9.036 1.00 0.00 C ATOM 447 CE1 PHE A 36 15.231 -22.236 -8.940 1.00 0.00 C ATOM 448 CE2 PHE A 36 17.066 -21.300 -7.798 1.00 0.00 C ATOM 449 CZ PHE A 36 15.831 -21.870 -7.776 1.00 0.00 C ATOM 0 H PHE A 36 19.540 -22.910 -11.637 1.00 0.00 H new ATOM 0 HA PHE A 36 16.775 -22.936 -12.382 1.00 0.00 H new ATOM 0 HB2 PHE A 36 18.898 -21.044 -11.342 1.00 0.00 H new ATOM 0 HB3 PHE A 36 17.441 -20.326 -11.999 1.00 0.00 H new ATOM 0 HD1 PHE A 36 15.416 -22.317 -11.102 1.00 0.00 H new ATOM 0 HD2 PHE A 36 18.708 -20.635 -9.053 1.00 0.00 H new ATOM 0 HE1 PHE A 36 14.250 -22.688 -8.923 1.00 0.00 H new ATOM 0 HE2 PHE A 36 17.543 -21.009 -6.874 1.00 0.00 H new ATOM 0 HZ PHE A 36 15.327 -22.032 -6.834 1.00 0.00 H new ATOM 459 N SER A 37 18.941 -21.751 -14.488 1.00 0.00 N ATOM 460 CA SER A 37 19.116 -21.247 -15.840 1.00 0.00 C ATOM 461 C SER A 37 18.395 -22.158 -16.835 1.00 0.00 C ATOM 462 O SER A 37 17.886 -21.691 -17.853 1.00 0.00 O ATOM 463 CB SER A 37 20.599 -21.138 -16.199 1.00 0.00 C ATOM 464 OG SER A 37 20.887 -21.729 -17.463 1.00 0.00 O ATOM 0 H SER A 37 19.806 -22.016 -14.016 1.00 0.00 H new ATOM 0 HA SER A 37 18.683 -20.248 -15.892 1.00 0.00 H new ATOM 0 HB2 SER A 37 20.892 -20.088 -16.214 1.00 0.00 H new ATOM 0 HB3 SER A 37 21.196 -21.624 -15.427 1.00 0.00 H new ATOM 0 HG SER A 37 21.843 -21.637 -17.657 1.00 0.00 H new ATOM 470 N GLU A 38 18.373 -23.441 -16.506 1.00 0.00 N ATOM 471 CA GLU A 38 17.722 -24.421 -17.359 1.00 0.00 C ATOM 472 C GLU A 38 16.204 -24.230 -17.325 1.00 0.00 C ATOM 473 O GLU A 38 15.487 -24.784 -18.156 1.00 0.00 O ATOM 474 CB GLU A 38 18.105 -25.845 -16.949 1.00 0.00 C ATOM 475 CG GLU A 38 17.055 -26.852 -17.421 1.00 0.00 C ATOM 476 CD GLU A 38 16.955 -26.865 -18.948 1.00 0.00 C ATOM 477 OE1 GLU A 38 18.009 -26.663 -19.588 1.00 0.00 O ATOM 478 OE2 GLU A 38 15.826 -27.078 -19.440 1.00 0.00 O ATOM 0 H GLU A 38 18.795 -23.825 -15.661 1.00 0.00 H new ATOM 0 HA GLU A 38 18.065 -24.268 -18.382 1.00 0.00 H new ATOM 0 HB2 GLU A 38 19.076 -26.101 -17.373 1.00 0.00 H new ATOM 0 HB3 GLU A 38 18.206 -25.901 -15.865 1.00 0.00 H new ATOM 0 HG2 GLU A 38 17.314 -27.848 -17.061 1.00 0.00 H new ATOM 0 HG3 GLU A 38 16.085 -26.600 -16.992 1.00 0.00 H new ATOM 485 N VAL A 39 15.761 -23.446 -16.354 1.00 0.00 N ATOM 486 CA VAL A 39 14.341 -23.175 -16.200 1.00 0.00 C ATOM 487 C VAL A 39 14.041 -21.758 -16.693 1.00 0.00 C ATOM 488 O VAL A 39 12.891 -21.321 -16.673 1.00 0.00 O ATOM 489 CB VAL A 39 13.919 -23.405 -14.748 1.00 0.00 C ATOM 490 CG1 VAL A 39 12.406 -23.243 -14.585 1.00 0.00 C ATOM 491 CG2 VAL A 39 14.380 -24.778 -14.254 1.00 0.00 C ATOM 0 H VAL A 39 16.360 -22.989 -15.666 1.00 0.00 H new ATOM 0 HA VAL A 39 13.752 -23.862 -16.808 1.00 0.00 H new ATOM 0 HB VAL A 39 14.405 -22.647 -14.133 1.00 0.00 H new ATOM 0 HG11 VAL A 39 12.132 -23.412 -13.544 1.00 0.00 H new ATOM 0 HG12 VAL A 39 12.114 -22.234 -14.878 1.00 0.00 H new ATOM 0 HG13 VAL A 39 11.892 -23.967 -15.217 1.00 0.00 H new ATOM 0 HG21 VAL A 39 14.067 -24.916 -13.219 1.00 0.00 H new ATOM 0 HG22 VAL A 39 13.935 -25.556 -14.874 1.00 0.00 H new ATOM 0 HG23 VAL A 39 15.466 -24.841 -14.316 1.00 0.00 H new ATOM 501 N GLY A 40 15.094 -21.080 -17.124 1.00 0.00 N ATOM 502 CA GLY A 40 14.957 -19.721 -17.621 1.00 0.00 C ATOM 503 C GLY A 40 16.104 -18.838 -17.126 1.00 0.00 C ATOM 504 O GLY A 40 16.915 -19.268 -16.307 1.00 0.00 O ATOM 0 H GLY A 40 16.046 -21.446 -17.140 1.00 0.00 H new ATOM 0 HA2 GLY A 40 14.943 -19.728 -18.711 1.00 0.00 H new ATOM 0 HA3 GLY A 40 14.005 -19.304 -17.293 1.00 0.00 H new ATOM 508 N PRO A 41 16.137 -17.587 -17.658 1.00 0.00 N ATOM 509 CA PRO A 41 17.172 -16.639 -17.279 1.00 0.00 C ATOM 510 C PRO A 41 16.913 -16.075 -15.881 1.00 0.00 C ATOM 511 O PRO A 41 15.888 -15.438 -15.645 1.00 0.00 O ATOM 512 CB PRO A 41 17.146 -15.575 -18.364 1.00 0.00 C ATOM 513 CG PRO A 41 15.798 -15.714 -19.053 1.00 0.00 C ATOM 514 CD PRO A 41 15.194 -17.043 -18.631 1.00 0.00 C ATOM 0 HA PRO A 41 18.159 -17.097 -17.212 1.00 0.00 H new ATOM 0 HB2 PRO A 41 17.265 -14.579 -17.937 1.00 0.00 H new ATOM 0 HB3 PRO A 41 17.963 -15.719 -19.071 1.00 0.00 H new ATOM 0 HG2 PRO A 41 15.140 -14.890 -18.775 1.00 0.00 H new ATOM 0 HG3 PRO A 41 15.917 -15.675 -20.136 1.00 0.00 H new ATOM 0 HD2 PRO A 41 14.206 -16.907 -18.191 1.00 0.00 H new ATOM 0 HD3 PRO A 41 15.074 -17.712 -19.483 1.00 0.00 H new ATOM 522 N VAL A 42 17.860 -16.330 -14.990 1.00 0.00 N ATOM 523 CA VAL A 42 17.747 -15.855 -13.622 1.00 0.00 C ATOM 524 C VAL A 42 18.287 -14.426 -13.536 1.00 0.00 C ATOM 525 O VAL A 42 19.205 -14.061 -14.269 1.00 0.00 O ATOM 526 CB VAL A 42 18.460 -16.821 -12.673 1.00 0.00 C ATOM 527 CG1 VAL A 42 18.117 -18.274 -13.010 1.00 0.00 C ATOM 528 CG2 VAL A 42 19.973 -16.595 -12.695 1.00 0.00 C ATOM 0 H VAL A 42 18.709 -16.859 -15.189 1.00 0.00 H new ATOM 0 HA VAL A 42 16.702 -15.827 -13.313 1.00 0.00 H new ATOM 0 HB VAL A 42 18.106 -16.619 -11.662 1.00 0.00 H new ATOM 0 HG11 VAL A 42 18.637 -18.940 -12.321 1.00 0.00 H new ATOM 0 HG12 VAL A 42 17.041 -18.425 -12.918 1.00 0.00 H new ATOM 0 HG13 VAL A 42 18.428 -18.494 -14.031 1.00 0.00 H new ATOM 0 HG21 VAL A 42 20.455 -17.294 -12.012 1.00 0.00 H new ATOM 0 HG22 VAL A 42 20.350 -16.756 -13.705 1.00 0.00 H new ATOM 0 HG23 VAL A 42 20.193 -15.574 -12.384 1.00 0.00 H new ATOM 538 N VAL A 43 17.694 -13.657 -12.635 1.00 0.00 N ATOM 539 CA VAL A 43 18.103 -12.276 -12.444 1.00 0.00 C ATOM 540 C VAL A 43 19.313 -12.232 -11.509 1.00 0.00 C ATOM 541 O VAL A 43 20.318 -11.593 -11.818 1.00 0.00 O ATOM 542 CB VAL A 43 16.923 -11.446 -11.935 1.00 0.00 C ATOM 543 CG1 VAL A 43 17.407 -10.268 -11.086 1.00 0.00 C ATOM 544 CG2 VAL A 43 16.051 -10.963 -13.095 1.00 0.00 C ATOM 0 H VAL A 43 16.933 -13.964 -12.029 1.00 0.00 H new ATOM 0 HA VAL A 43 18.409 -11.833 -13.392 1.00 0.00 H new ATOM 0 HB VAL A 43 16.311 -12.088 -11.301 1.00 0.00 H new ATOM 0 HG11 VAL A 43 16.549 -9.694 -10.737 1.00 0.00 H new ATOM 0 HG12 VAL A 43 17.966 -10.643 -10.229 1.00 0.00 H new ATOM 0 HG13 VAL A 43 18.052 -9.627 -11.687 1.00 0.00 H new ATOM 0 HG21 VAL A 43 15.220 -10.376 -12.705 1.00 0.00 H new ATOM 0 HG22 VAL A 43 16.648 -10.346 -13.767 1.00 0.00 H new ATOM 0 HG23 VAL A 43 15.663 -11.823 -13.641 1.00 0.00 H new ATOM 554 N SER A 44 19.177 -12.919 -10.385 1.00 0.00 N ATOM 555 CA SER A 44 20.247 -12.966 -9.402 1.00 0.00 C ATOM 556 C SER A 44 19.958 -14.055 -8.367 1.00 0.00 C ATOM 557 O SER A 44 18.844 -14.570 -8.296 1.00 0.00 O ATOM 558 CB SER A 44 20.422 -11.612 -8.713 1.00 0.00 C ATOM 559 OG SER A 44 21.673 -11.009 -9.031 1.00 0.00 O ATOM 0 H SER A 44 18.342 -13.448 -10.132 1.00 0.00 H new ATOM 0 HA SER A 44 21.177 -13.202 -9.919 1.00 0.00 H new ATOM 0 HB2 SER A 44 19.612 -10.946 -9.011 1.00 0.00 H new ATOM 0 HB3 SER A 44 20.346 -11.742 -7.633 1.00 0.00 H new ATOM 0 HG SER A 44 21.746 -10.146 -8.573 1.00 0.00 H new ATOM 565 N PHE A 45 20.983 -14.374 -7.590 1.00 0.00 N ATOM 566 CA PHE A 45 20.854 -15.393 -6.561 1.00 0.00 C ATOM 567 C PHE A 45 21.782 -15.101 -5.381 1.00 0.00 C ATOM 568 O PHE A 45 23.002 -15.075 -5.537 1.00 0.00 O ATOM 569 CB PHE A 45 21.259 -16.724 -7.197 1.00 0.00 C ATOM 570 CG PHE A 45 20.613 -17.948 -6.545 1.00 0.00 C ATOM 571 CD1 PHE A 45 20.315 -17.933 -5.218 1.00 0.00 C ATOM 572 CD2 PHE A 45 20.336 -19.050 -7.292 1.00 0.00 C ATOM 573 CE1 PHE A 45 19.715 -19.069 -4.613 1.00 0.00 C ATOM 574 CE2 PHE A 45 19.736 -20.186 -6.687 1.00 0.00 C ATOM 575 CZ PHE A 45 19.438 -20.171 -5.360 1.00 0.00 C ATOM 0 H PHE A 45 21.906 -13.945 -7.652 1.00 0.00 H new ATOM 0 HA PHE A 45 19.831 -15.416 -6.186 1.00 0.00 H new ATOM 0 HB2 PHE A 45 20.993 -16.706 -8.254 1.00 0.00 H new ATOM 0 HB3 PHE A 45 22.343 -16.826 -7.143 1.00 0.00 H new ATOM 0 HD1 PHE A 45 20.535 -17.058 -4.625 1.00 0.00 H new ATOM 0 HD2 PHE A 45 20.572 -19.061 -8.346 1.00 0.00 H new ATOM 0 HE1 PHE A 45 19.479 -19.058 -3.559 1.00 0.00 H new ATOM 0 HE2 PHE A 45 19.516 -21.061 -7.280 1.00 0.00 H new ATOM 0 HZ PHE A 45 18.981 -21.035 -4.899 1.00 0.00 H new ATOM 585 N ARG A 46 21.169 -14.889 -4.225 1.00 0.00 N ATOM 586 CA ARG A 46 21.925 -14.600 -3.019 1.00 0.00 C ATOM 587 C ARG A 46 21.548 -15.582 -1.908 1.00 0.00 C ATOM 588 O ARG A 46 20.367 -15.812 -1.652 1.00 0.00 O ATOM 589 CB ARG A 46 21.667 -13.171 -2.536 1.00 0.00 C ATOM 590 CG ARG A 46 22.597 -12.179 -3.238 1.00 0.00 C ATOM 591 CD ARG A 46 23.032 -11.066 -2.283 1.00 0.00 C ATOM 592 NE ARG A 46 21.984 -10.024 -2.208 1.00 0.00 N ATOM 593 CZ ARG A 46 21.761 -9.113 -3.165 1.00 0.00 C ATOM 594 NH1 ARG A 46 22.512 -9.109 -4.275 1.00 0.00 N ATOM 595 NH2 ARG A 46 20.788 -8.205 -3.012 1.00 0.00 N ATOM 0 H ARG A 46 20.157 -14.912 -4.099 1.00 0.00 H new ATOM 0 HA ARG A 46 22.983 -14.705 -3.258 1.00 0.00 H new ATOM 0 HB2 ARG A 46 20.629 -12.900 -2.728 1.00 0.00 H new ATOM 0 HB3 ARG A 46 21.817 -13.115 -1.458 1.00 0.00 H new ATOM 0 HG2 ARG A 46 23.475 -12.703 -3.616 1.00 0.00 H new ATOM 0 HG3 ARG A 46 22.089 -11.746 -4.100 1.00 0.00 H new ATOM 0 HD2 ARG A 46 23.218 -11.479 -1.291 1.00 0.00 H new ATOM 0 HD3 ARG A 46 23.969 -10.627 -2.626 1.00 0.00 H new ATOM 0 HE ARG A 46 21.395 -9.998 -1.376 1.00 0.00 H new ATOM 0 HH11 ARG A 46 23.254 -9.800 -4.392 1.00 0.00 H new ATOM 0 HH12 ARG A 46 22.342 -8.415 -5.003 1.00 0.00 H new ATOM 0 HH21 ARG A 46 20.217 -8.207 -2.167 1.00 0.00 H new ATOM 0 HH22 ARG A 46 20.618 -7.512 -3.741 1.00 0.00 H new ATOM 609 N LEU A 47 22.574 -16.136 -1.279 1.00 0.00 N ATOM 610 CA LEU A 47 22.365 -17.089 -0.201 1.00 0.00 C ATOM 611 C LEU A 47 22.958 -16.527 1.092 1.00 0.00 C ATOM 612 O LEU A 47 23.644 -15.506 1.073 1.00 0.00 O ATOM 613 CB LEU A 47 22.918 -18.462 -0.586 1.00 0.00 C ATOM 614 CG LEU A 47 23.083 -18.724 -2.084 1.00 0.00 C ATOM 615 CD1 LEU A 47 24.088 -19.849 -2.338 1.00 0.00 C ATOM 616 CD2 LEU A 47 21.730 -19.004 -2.743 1.00 0.00 C ATOM 0 H LEU A 47 23.552 -15.944 -1.495 1.00 0.00 H new ATOM 0 HA LEU A 47 21.300 -17.238 -0.025 1.00 0.00 H new ATOM 0 HB2 LEU A 47 23.889 -18.588 -0.107 1.00 0.00 H new ATOM 0 HB3 LEU A 47 22.258 -19.226 -0.175 1.00 0.00 H new ATOM 0 HG LEU A 47 23.487 -17.823 -2.546 1.00 0.00 H new ATOM 0 HD11 LEU A 47 24.186 -20.014 -3.411 1.00 0.00 H new ATOM 0 HD12 LEU A 47 25.057 -19.571 -1.924 1.00 0.00 H new ATOM 0 HD13 LEU A 47 23.738 -20.764 -1.860 1.00 0.00 H new ATOM 0 HD21 LEU A 47 21.875 -19.187 -3.808 1.00 0.00 H new ATOM 0 HD22 LEU A 47 21.276 -19.881 -2.283 1.00 0.00 H new ATOM 0 HD23 LEU A 47 21.075 -18.143 -2.609 1.00 0.00 H new ATOM 628 N VAL A 48 22.673 -17.219 2.186 1.00 0.00 N ATOM 629 CA VAL A 48 23.169 -16.802 3.486 1.00 0.00 C ATOM 630 C VAL A 48 24.568 -17.382 3.703 1.00 0.00 C ATOM 631 O VAL A 48 24.753 -18.597 3.664 1.00 0.00 O ATOM 632 CB VAL A 48 22.178 -17.207 4.579 1.00 0.00 C ATOM 633 CG1 VAL A 48 20.988 -16.247 4.623 1.00 0.00 C ATOM 634 CG2 VAL A 48 21.711 -18.651 4.388 1.00 0.00 C ATOM 0 H VAL A 48 22.105 -18.066 2.198 1.00 0.00 H new ATOM 0 HA VAL A 48 23.256 -15.716 3.531 1.00 0.00 H new ATOM 0 HB VAL A 48 22.693 -17.146 5.538 1.00 0.00 H new ATOM 0 HG11 VAL A 48 20.299 -16.558 5.408 1.00 0.00 H new ATOM 0 HG12 VAL A 48 21.343 -15.237 4.830 1.00 0.00 H new ATOM 0 HG13 VAL A 48 20.473 -16.261 3.662 1.00 0.00 H new ATOM 0 HG21 VAL A 48 21.007 -18.913 5.178 1.00 0.00 H new ATOM 0 HG22 VAL A 48 21.222 -18.750 3.419 1.00 0.00 H new ATOM 0 HG23 VAL A 48 22.570 -19.320 4.431 1.00 0.00 H new ATOM 644 N TYR A 49 25.518 -16.485 3.927 1.00 0.00 N ATOM 645 CA TYR A 49 26.894 -16.892 4.150 1.00 0.00 C ATOM 646 C TYR A 49 27.425 -16.331 5.470 1.00 0.00 C ATOM 647 O TYR A 49 27.487 -15.116 5.652 1.00 0.00 O ATOM 648 CB TYR A 49 27.703 -16.297 2.995 1.00 0.00 C ATOM 649 CG TYR A 49 28.157 -17.327 1.958 1.00 0.00 C ATOM 650 CD1 TYR A 49 27.274 -17.772 0.995 1.00 0.00 C ATOM 651 CD2 TYR A 49 29.450 -17.810 1.986 1.00 0.00 C ATOM 652 CE1 TYR A 49 27.702 -18.741 0.020 1.00 0.00 C ATOM 653 CE2 TYR A 49 29.877 -18.779 1.010 1.00 0.00 C ATOM 654 CZ TYR A 49 28.982 -19.197 0.075 1.00 0.00 C ATOM 655 OH TYR A 49 29.386 -20.112 -0.846 1.00 0.00 O ATOM 0 H TYR A 49 25.361 -15.478 3.959 1.00 0.00 H new ATOM 0 HA TYR A 49 26.969 -17.978 4.197 1.00 0.00 H new ATOM 0 HB2 TYR A 49 27.101 -15.536 2.497 1.00 0.00 H new ATOM 0 HB3 TYR A 49 28.581 -15.794 3.401 1.00 0.00 H new ATOM 0 HD1 TYR A 49 26.263 -17.394 0.973 1.00 0.00 H new ATOM 0 HD2 TYR A 49 30.141 -17.461 2.739 1.00 0.00 H new ATOM 0 HE1 TYR A 49 27.021 -19.098 -0.739 1.00 0.00 H new ATOM 0 HE2 TYR A 49 30.886 -19.165 1.020 1.00 0.00 H new ATOM 0 HH TYR A 49 30.324 -20.346 -0.685 1.00 0.00 H new ATOM 665 N ASP A 50 27.796 -17.242 6.358 1.00 0.00 N ATOM 666 CA ASP A 50 28.320 -16.853 7.656 1.00 0.00 C ATOM 667 C ASP A 50 29.716 -16.253 7.479 1.00 0.00 C ATOM 668 O ASP A 50 30.668 -16.969 7.173 1.00 0.00 O ATOM 669 CB ASP A 50 28.439 -18.062 8.586 1.00 0.00 C ATOM 670 CG ASP A 50 27.107 -18.655 9.050 1.00 0.00 C ATOM 671 OD1 ASP A 50 26.065 -18.096 8.645 1.00 0.00 O ATOM 672 OD2 ASP A 50 27.161 -19.654 9.799 1.00 0.00 O ATOM 0 H ASP A 50 27.744 -18.249 6.204 1.00 0.00 H new ATOM 0 HA ASP A 50 27.634 -16.128 8.093 1.00 0.00 H new ATOM 0 HB2 ASP A 50 29.007 -18.839 8.075 1.00 0.00 H new ATOM 0 HB3 ASP A 50 29.015 -17.771 9.464 1.00 0.00 H new ATOM 677 N ARG A 51 29.793 -14.946 7.679 1.00 0.00 N ATOM 678 CA ARG A 51 31.057 -14.241 7.545 1.00 0.00 C ATOM 679 C ARG A 51 31.972 -14.563 8.728 1.00 0.00 C ATOM 680 O ARG A 51 33.194 -14.558 8.592 1.00 0.00 O ATOM 681 CB ARG A 51 30.839 -12.729 7.474 1.00 0.00 C ATOM 682 CG ARG A 51 30.259 -12.321 6.119 1.00 0.00 C ATOM 683 CD ARG A 51 29.955 -10.822 6.081 1.00 0.00 C ATOM 684 NE ARG A 51 31.078 -10.093 5.449 1.00 0.00 N ATOM 685 CZ ARG A 51 31.084 -8.773 5.223 1.00 0.00 C ATOM 686 NH1 ARG A 51 30.027 -8.028 5.575 1.00 0.00 N ATOM 687 NH2 ARG A 51 32.146 -8.197 4.644 1.00 0.00 N ATOM 0 H ARG A 51 29.001 -14.356 7.933 1.00 0.00 H new ATOM 0 HA ARG A 51 31.525 -14.573 6.618 1.00 0.00 H new ATOM 0 HB2 ARG A 51 30.164 -12.418 8.271 1.00 0.00 H new ATOM 0 HB3 ARG A 51 31.785 -12.214 7.638 1.00 0.00 H new ATOM 0 HG2 ARG A 51 30.964 -12.573 5.327 1.00 0.00 H new ATOM 0 HG3 ARG A 51 29.347 -12.886 5.925 1.00 0.00 H new ATOM 0 HD2 ARG A 51 29.035 -10.643 5.524 1.00 0.00 H new ATOM 0 HD3 ARG A 51 29.793 -10.450 7.093 1.00 0.00 H new ATOM 0 HE ARG A 51 31.899 -10.630 5.168 1.00 0.00 H new ATOM 0 HH11 ARG A 51 29.218 -8.466 6.015 1.00 0.00 H new ATOM 0 HH12 ARG A 51 30.032 -7.023 5.403 1.00 0.00 H new ATOM 0 HH21 ARG A 51 32.950 -8.764 4.375 1.00 0.00 H new ATOM 0 HH22 ARG A 51 32.150 -7.192 4.472 1.00 0.00 H new ATOM 701 N GLU A 52 31.345 -14.836 9.863 1.00 0.00 N ATOM 702 CA GLU A 52 32.087 -15.160 11.069 1.00 0.00 C ATOM 703 C GLU A 52 32.728 -16.544 10.943 1.00 0.00 C ATOM 704 O GLU A 52 33.804 -16.786 11.488 1.00 0.00 O ATOM 705 CB GLU A 52 31.187 -15.084 12.304 1.00 0.00 C ATOM 706 CG GLU A 52 31.515 -13.849 13.146 1.00 0.00 C ATOM 707 CD GLU A 52 31.156 -14.076 14.616 1.00 0.00 C ATOM 708 OE1 GLU A 52 31.246 -15.246 15.048 1.00 0.00 O ATOM 709 OE2 GLU A 52 30.799 -13.075 15.274 1.00 0.00 O ATOM 0 H GLU A 52 30.331 -14.839 9.973 1.00 0.00 H new ATOM 0 HA GLU A 52 32.881 -14.423 11.192 1.00 0.00 H new ATOM 0 HB2 GLU A 52 30.142 -15.051 11.996 1.00 0.00 H new ATOM 0 HB3 GLU A 52 31.313 -15.983 12.907 1.00 0.00 H new ATOM 0 HG2 GLU A 52 32.576 -13.617 13.059 1.00 0.00 H new ATOM 0 HG3 GLU A 52 30.968 -12.988 12.763 1.00 0.00 H new ATOM 716 N THR A 53 32.040 -17.415 10.220 1.00 0.00 N ATOM 717 CA THR A 53 32.528 -18.768 10.015 1.00 0.00 C ATOM 718 C THR A 53 33.040 -18.940 8.583 1.00 0.00 C ATOM 719 O THR A 53 33.569 -19.993 8.231 1.00 0.00 O ATOM 720 CB THR A 53 31.402 -19.738 10.378 1.00 0.00 C ATOM 721 OG1 THR A 53 31.310 -19.649 11.797 1.00 0.00 O ATOM 722 CG2 THR A 53 31.780 -21.198 10.120 1.00 0.00 C ATOM 0 H THR A 53 31.148 -17.210 9.769 1.00 0.00 H new ATOM 0 HA THR A 53 33.381 -18.982 10.659 1.00 0.00 H new ATOM 0 HB THR A 53 30.509 -19.488 9.805 1.00 0.00 H new ATOM 0 HG1 THR A 53 30.602 -20.246 12.117 1.00 0.00 H new ATOM 0 HG21 THR A 53 30.946 -21.844 10.394 1.00 0.00 H new ATOM 0 HG22 THR A 53 32.011 -21.333 9.063 1.00 0.00 H new ATOM 0 HG23 THR A 53 32.653 -21.459 10.718 1.00 0.00 H new ATOM 730 N GLY A 54 32.863 -17.888 7.796 1.00 0.00 N ATOM 731 CA GLY A 54 33.300 -17.909 6.411 1.00 0.00 C ATOM 732 C GLY A 54 32.718 -19.115 5.670 1.00 0.00 C ATOM 733 O GLY A 54 33.209 -19.490 4.607 1.00 0.00 O ATOM 0 H GLY A 54 32.423 -17.016 8.092 1.00 0.00 H new ATOM 0 HA2 GLY A 54 32.991 -16.989 5.915 1.00 0.00 H new ATOM 0 HA3 GLY A 54 34.389 -17.943 6.370 1.00 0.00 H new ATOM 737 N LYS A 55 31.681 -19.688 6.262 1.00 0.00 N ATOM 738 CA LYS A 55 31.026 -20.843 5.672 1.00 0.00 C ATOM 739 C LYS A 55 29.573 -20.491 5.348 1.00 0.00 C ATOM 740 O LYS A 55 28.940 -19.724 6.072 1.00 0.00 O ATOM 741 CB LYS A 55 31.175 -22.065 6.581 1.00 0.00 C ATOM 742 CG LYS A 55 32.624 -22.554 6.610 1.00 0.00 C ATOM 743 CD LYS A 55 33.080 -23.001 5.219 1.00 0.00 C ATOM 744 CE LYS A 55 33.609 -24.436 5.250 1.00 0.00 C ATOM 745 NZ LYS A 55 34.993 -24.468 5.773 1.00 0.00 N ATOM 0 H LYS A 55 31.278 -19.374 7.145 1.00 0.00 H new ATOM 0 HA LYS A 55 31.505 -21.113 4.731 1.00 0.00 H new ATOM 0 HB2 LYS A 55 30.852 -21.813 7.591 1.00 0.00 H new ATOM 0 HB3 LYS A 55 30.524 -22.866 6.229 1.00 0.00 H new ATOM 0 HG2 LYS A 55 33.274 -21.756 6.971 1.00 0.00 H new ATOM 0 HG3 LYS A 55 32.718 -23.383 7.311 1.00 0.00 H new ATOM 0 HD2 LYS A 55 32.247 -22.932 4.520 1.00 0.00 H new ATOM 0 HD3 LYS A 55 33.858 -22.331 4.855 1.00 0.00 H new ATOM 0 HE2 LYS A 55 32.964 -25.054 5.874 1.00 0.00 H new ATOM 0 HE3 LYS A 55 33.583 -24.861 4.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 35.336 -25.450 5.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 35.609 -23.895 5.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 35.008 -24.082 6.739 1.00 0.00 H new ATOM 759 N PRO A 56 29.074 -21.082 4.229 1.00 0.00 N ATOM 760 CA PRO A 56 27.708 -20.839 3.800 1.00 0.00 C ATOM 761 C PRO A 56 26.713 -21.593 4.685 1.00 0.00 C ATOM 762 O PRO A 56 26.937 -22.752 5.030 1.00 0.00 O ATOM 763 CB PRO A 56 27.666 -21.284 2.348 1.00 0.00 C ATOM 764 CG PRO A 56 28.874 -22.186 2.154 1.00 0.00 C ATOM 765 CD PRO A 56 29.795 -21.995 3.347 1.00 0.00 C ATOM 0 HA PRO A 56 27.419 -19.792 3.890 1.00 0.00 H new ATOM 0 HB2 PRO A 56 26.741 -21.818 2.130 1.00 0.00 H new ATOM 0 HB3 PRO A 56 27.706 -20.427 1.675 1.00 0.00 H new ATOM 0 HG2 PRO A 56 28.564 -23.228 2.075 1.00 0.00 H new ATOM 0 HG3 PRO A 56 29.392 -21.936 1.228 1.00 0.00 H new ATOM 0 HD2 PRO A 56 30.003 -22.943 3.843 1.00 0.00 H new ATOM 0 HD3 PRO A 56 30.755 -21.577 3.043 1.00 0.00 H new ATOM 773 N LYS A 57 25.634 -20.903 5.028 1.00 0.00 N ATOM 774 CA LYS A 57 24.604 -21.493 5.866 1.00 0.00 C ATOM 775 C LYS A 57 24.141 -22.812 5.244 1.00 0.00 C ATOM 776 O LYS A 57 24.224 -23.864 5.877 1.00 0.00 O ATOM 777 CB LYS A 57 23.470 -20.494 6.104 1.00 0.00 C ATOM 778 CG LYS A 57 23.432 -20.046 7.567 1.00 0.00 C ATOM 779 CD LYS A 57 23.088 -21.217 8.490 1.00 0.00 C ATOM 780 CE LYS A 57 23.972 -21.209 9.738 1.00 0.00 C ATOM 781 NZ LYS A 57 23.321 -20.449 10.829 1.00 0.00 N ATOM 0 H LYS A 57 25.451 -19.942 4.741 1.00 0.00 H new ATOM 0 HA LYS A 57 25.003 -21.728 6.853 1.00 0.00 H new ATOM 0 HB2 LYS A 57 23.603 -19.626 5.458 1.00 0.00 H new ATOM 0 HB3 LYS A 57 22.517 -20.949 5.834 1.00 0.00 H new ATOM 0 HG2 LYS A 57 24.399 -19.628 7.848 1.00 0.00 H new ATOM 0 HG3 LYS A 57 22.694 -19.253 7.689 1.00 0.00 H new ATOM 0 HD2 LYS A 57 22.040 -21.159 8.782 1.00 0.00 H new ATOM 0 HD3 LYS A 57 23.218 -22.157 7.954 1.00 0.00 H new ATOM 0 HE2 LYS A 57 24.162 -22.232 10.063 1.00 0.00 H new ATOM 0 HE3 LYS A 57 24.939 -20.764 9.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 23.934 -20.453 11.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 23.161 -19.468 10.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 22.409 -20.891 11.064 1.00 0.00 H new ATOM 795 N GLY A 58 23.662 -22.714 4.013 1.00 0.00 N ATOM 796 CA GLY A 58 23.185 -23.886 3.299 1.00 0.00 C ATOM 797 C GLY A 58 21.925 -23.563 2.494 1.00 0.00 C ATOM 798 O GLY A 58 21.550 -24.312 1.593 1.00 0.00 O ATOM 0 H GLY A 58 23.594 -21.840 3.491 1.00 0.00 H new ATOM 0 HA2 GLY A 58 23.964 -24.251 2.630 1.00 0.00 H new ATOM 0 HA3 GLY A 58 22.973 -24.686 4.008 1.00 0.00 H new ATOM 802 N TYR A 59 21.305 -22.446 2.848 1.00 0.00 N ATOM 803 CA TYR A 59 20.095 -22.015 2.169 1.00 0.00 C ATOM 804 C TYR A 59 20.245 -20.589 1.635 1.00 0.00 C ATOM 805 O TYR A 59 21.074 -19.823 2.123 1.00 0.00 O ATOM 806 CB TYR A 59 18.989 -22.038 3.225 1.00 0.00 C ATOM 807 CG TYR A 59 19.183 -21.021 4.352 1.00 0.00 C ATOM 808 CD1 TYR A 59 19.896 -21.370 5.481 1.00 0.00 C ATOM 809 CD2 TYR A 59 18.645 -19.755 4.240 1.00 0.00 C ATOM 810 CE1 TYR A 59 20.078 -20.413 6.542 1.00 0.00 C ATOM 811 CE2 TYR A 59 18.828 -18.798 5.300 1.00 0.00 C ATOM 812 CZ TYR A 59 19.536 -19.175 6.399 1.00 0.00 C ATOM 813 OH TYR A 59 19.708 -18.271 7.401 1.00 0.00 O ATOM 0 H TYR A 59 21.618 -21.827 3.596 1.00 0.00 H new ATOM 0 HA TYR A 59 19.877 -22.665 1.321 1.00 0.00 H new ATOM 0 HB2 TYR A 59 18.032 -21.848 2.739 1.00 0.00 H new ATOM 0 HB3 TYR A 59 18.934 -23.037 3.657 1.00 0.00 H new ATOM 0 HD1 TYR A 59 20.317 -22.360 5.569 1.00 0.00 H new ATOM 0 HD2 TYR A 59 18.086 -19.482 3.357 1.00 0.00 H new ATOM 0 HE1 TYR A 59 20.633 -20.673 7.431 1.00 0.00 H new ATOM 0 HE2 TYR A 59 18.413 -17.804 5.225 1.00 0.00 H new ATOM 0 HH TYR A 59 19.268 -17.429 7.161 1.00 0.00 H new ATOM 823 N GLY A 60 19.428 -20.275 0.640 1.00 0.00 N ATOM 824 CA GLY A 60 19.459 -18.955 0.034 1.00 0.00 C ATOM 825 C GLY A 60 18.205 -18.708 -0.807 1.00 0.00 C ATOM 826 O GLY A 60 17.284 -19.523 -0.809 1.00 0.00 O ATOM 0 H GLY A 60 18.740 -20.912 0.238 1.00 0.00 H new ATOM 0 HA2 GLY A 60 19.535 -18.195 0.812 1.00 0.00 H new ATOM 0 HA3 GLY A 60 20.346 -18.859 -0.592 1.00 0.00 H new ATOM 830 N PHE A 61 18.211 -17.580 -1.502 1.00 0.00 N ATOM 831 CA PHE A 61 17.085 -17.216 -2.346 1.00 0.00 C ATOM 832 C PHE A 61 17.559 -16.775 -3.732 1.00 0.00 C ATOM 833 O PHE A 61 18.622 -16.170 -3.866 1.00 0.00 O ATOM 834 CB PHE A 61 16.377 -16.042 -1.666 1.00 0.00 C ATOM 835 CG PHE A 61 15.584 -16.434 -0.417 1.00 0.00 C ATOM 836 CD1 PHE A 61 16.222 -16.588 0.774 1.00 0.00 C ATOM 837 CD2 PHE A 61 14.240 -16.627 -0.499 1.00 0.00 C ATOM 838 CE1 PHE A 61 15.485 -16.951 1.932 1.00 0.00 C ATOM 839 CE2 PHE A 61 13.503 -16.990 0.659 1.00 0.00 C ATOM 840 CZ PHE A 61 14.141 -17.144 1.850 1.00 0.00 C ATOM 0 H PHE A 61 18.977 -16.906 -1.498 1.00 0.00 H new ATOM 0 HA PHE A 61 16.423 -18.073 -2.473 1.00 0.00 H new ATOM 0 HB2 PHE A 61 17.119 -15.292 -1.392 1.00 0.00 H new ATOM 0 HB3 PHE A 61 15.701 -15.575 -2.382 1.00 0.00 H new ATOM 0 HD1 PHE A 61 17.289 -16.434 0.839 1.00 0.00 H new ATOM 0 HD2 PHE A 61 13.734 -16.504 -1.445 1.00 0.00 H new ATOM 0 HE1 PHE A 61 15.991 -17.074 2.878 1.00 0.00 H new ATOM 0 HE2 PHE A 61 12.436 -17.144 0.594 1.00 0.00 H new ATOM 0 HZ PHE A 61 13.580 -17.420 2.731 1.00 0.00 H new ATOM 850 N CYS A 62 16.748 -17.096 -4.730 1.00 0.00 N ATOM 851 CA CYS A 62 17.071 -16.741 -6.101 1.00 0.00 C ATOM 852 C CYS A 62 15.933 -15.882 -6.656 1.00 0.00 C ATOM 853 O CYS A 62 14.775 -16.295 -6.640 1.00 0.00 O ATOM 854 CB CYS A 62 17.323 -17.981 -6.962 1.00 0.00 C ATOM 855 SG CYS A 62 18.147 -17.501 -8.524 1.00 0.00 S ATOM 0 H CYS A 62 15.868 -17.598 -4.616 1.00 0.00 H new ATOM 0 HA CYS A 62 17.999 -16.170 -6.122 1.00 0.00 H new ATOM 0 HB2 CYS A 62 17.944 -18.692 -6.417 1.00 0.00 H new ATOM 0 HB3 CYS A 62 16.379 -18.482 -7.178 1.00 0.00 H new ATOM 0 HG CYS A 62 19.313 -18.072 -8.593 1.00 0.00 H new ATOM 861 N GLU A 63 16.303 -14.703 -7.133 1.00 0.00 N ATOM 862 CA GLU A 63 15.327 -13.783 -7.692 1.00 0.00 C ATOM 863 C GLU A 63 15.344 -13.855 -9.220 1.00 0.00 C ATOM 864 O GLU A 63 16.398 -13.722 -9.840 1.00 0.00 O ATOM 865 CB GLU A 63 15.582 -12.354 -7.208 1.00 0.00 C ATOM 866 CG GLU A 63 14.915 -11.334 -8.134 1.00 0.00 C ATOM 867 CD GLU A 63 14.415 -10.122 -7.346 1.00 0.00 C ATOM 868 OE1 GLU A 63 15.213 -9.605 -6.534 1.00 0.00 O ATOM 869 OE2 GLU A 63 13.247 -9.740 -7.573 1.00 0.00 O ATOM 0 H GLU A 63 17.265 -14.364 -7.144 1.00 0.00 H new ATOM 0 HA GLU A 63 14.337 -14.079 -7.345 1.00 0.00 H new ATOM 0 HB2 GLU A 63 15.199 -12.236 -6.195 1.00 0.00 H new ATOM 0 HB3 GLU A 63 16.655 -12.166 -7.167 1.00 0.00 H new ATOM 0 HG2 GLU A 63 15.625 -11.010 -8.895 1.00 0.00 H new ATOM 0 HG3 GLU A 63 14.080 -11.802 -8.656 1.00 0.00 H new ATOM 876 N TYR A 64 14.163 -14.066 -9.784 1.00 0.00 N ATOM 877 CA TYR A 64 14.029 -14.157 -11.228 1.00 0.00 C ATOM 878 C TYR A 64 13.553 -12.829 -11.820 1.00 0.00 C ATOM 879 O TYR A 64 13.448 -11.831 -11.109 1.00 0.00 O ATOM 880 CB TYR A 64 12.965 -15.227 -11.485 1.00 0.00 C ATOM 881 CG TYR A 64 13.536 -16.622 -11.749 1.00 0.00 C ATOM 882 CD1 TYR A 64 14.145 -16.901 -12.955 1.00 0.00 C ATOM 883 CD2 TYR A 64 13.443 -17.600 -10.780 1.00 0.00 C ATOM 884 CE1 TYR A 64 14.682 -18.214 -13.203 1.00 0.00 C ATOM 885 CE2 TYR A 64 13.980 -18.913 -11.028 1.00 0.00 C ATOM 886 CZ TYR A 64 14.574 -19.155 -12.227 1.00 0.00 C ATOM 887 OH TYR A 64 15.081 -20.395 -12.462 1.00 0.00 O ATOM 0 H TYR A 64 13.291 -14.176 -9.267 1.00 0.00 H new ATOM 0 HA TYR A 64 14.987 -14.400 -11.688 1.00 0.00 H new ATOM 0 HB2 TYR A 64 12.298 -15.276 -10.624 1.00 0.00 H new ATOM 0 HB3 TYR A 64 12.360 -14.925 -12.340 1.00 0.00 H new ATOM 0 HD1 TYR A 64 14.219 -16.135 -13.713 1.00 0.00 H new ATOM 0 HD2 TYR A 64 12.967 -17.381 -9.835 1.00 0.00 H new ATOM 0 HE1 TYR A 64 15.160 -18.446 -14.143 1.00 0.00 H new ATOM 0 HE2 TYR A 64 13.912 -19.688 -10.279 1.00 0.00 H new ATOM 0 HH TYR A 64 15.412 -20.778 -11.623 1.00 0.00 H new ATOM 897 N GLN A 65 13.278 -12.860 -13.115 1.00 0.00 N ATOM 898 CA GLN A 65 12.816 -11.671 -13.811 1.00 0.00 C ATOM 899 C GLN A 65 11.375 -11.862 -14.288 1.00 0.00 C ATOM 900 O GLN A 65 10.703 -10.896 -14.647 1.00 0.00 O ATOM 901 CB GLN A 65 13.740 -11.326 -14.981 1.00 0.00 C ATOM 902 CG GLN A 65 13.979 -9.817 -15.064 1.00 0.00 C ATOM 903 CD GLN A 65 13.103 -9.183 -16.147 1.00 0.00 C ATOM 904 OE1 GLN A 65 12.550 -9.851 -17.005 1.00 0.00 O ATOM 905 NE2 GLN A 65 13.009 -7.859 -16.060 1.00 0.00 N ATOM 0 H GLN A 65 13.366 -13.690 -13.701 1.00 0.00 H new ATOM 0 HA GLN A 65 12.840 -10.833 -13.114 1.00 0.00 H new ATOM 0 HB2 GLN A 65 14.692 -11.843 -14.862 1.00 0.00 H new ATOM 0 HB3 GLN A 65 13.300 -11.680 -15.913 1.00 0.00 H new ATOM 0 HG2 GLN A 65 13.762 -9.357 -14.100 1.00 0.00 H new ATOM 0 HG3 GLN A 65 15.029 -9.623 -15.281 1.00 0.00 H new ATOM 0 HE21 GLN A 65 13.498 -7.361 -15.316 1.00 0.00 H new ATOM 0 HE22 GLN A 65 12.448 -7.342 -16.737 1.00 0.00 H new ATOM 914 N ASP A 66 10.942 -13.114 -14.277 1.00 0.00 N ATOM 915 CA ASP A 66 9.593 -13.444 -14.704 1.00 0.00 C ATOM 916 C ASP A 66 8.930 -14.330 -13.648 1.00 0.00 C ATOM 917 O ASP A 66 9.538 -15.283 -13.162 1.00 0.00 O ATOM 918 CB ASP A 66 9.607 -14.214 -16.026 1.00 0.00 C ATOM 919 CG ASP A 66 10.820 -13.945 -16.919 1.00 0.00 C ATOM 920 OD1 ASP A 66 11.900 -14.477 -16.584 1.00 0.00 O ATOM 921 OD2 ASP A 66 10.640 -13.213 -17.916 1.00 0.00 O ATOM 0 H ASP A 66 11.502 -13.913 -13.979 1.00 0.00 H new ATOM 0 HA ASP A 66 9.044 -12.512 -14.835 1.00 0.00 H new ATOM 0 HB2 ASP A 66 9.565 -15.281 -15.808 1.00 0.00 H new ATOM 0 HB3 ASP A 66 8.703 -13.967 -16.583 1.00 0.00 H new ATOM 926 N GLN A 67 7.693 -13.984 -13.323 1.00 0.00 N ATOM 927 CA GLN A 67 6.942 -14.736 -12.332 1.00 0.00 C ATOM 928 C GLN A 67 6.800 -16.195 -12.770 1.00 0.00 C ATOM 929 O GLN A 67 7.046 -17.109 -11.984 1.00 0.00 O ATOM 930 CB GLN A 67 5.571 -14.101 -12.087 1.00 0.00 C ATOM 931 CG GLN A 67 5.574 -13.271 -10.802 1.00 0.00 C ATOM 932 CD GLN A 67 5.314 -11.793 -11.103 1.00 0.00 C ATOM 933 OE1 GLN A 67 5.580 -11.298 -12.186 1.00 0.00 O ATOM 934 NE2 GLN A 67 4.782 -11.119 -10.088 1.00 0.00 N ATOM 0 H GLN A 67 7.192 -13.193 -13.728 1.00 0.00 H new ATOM 0 HA GLN A 67 7.491 -14.711 -11.391 1.00 0.00 H new ATOM 0 HB2 GLN A 67 5.303 -13.468 -12.933 1.00 0.00 H new ATOM 0 HB3 GLN A 67 4.812 -14.880 -12.019 1.00 0.00 H new ATOM 0 HG2 GLN A 67 4.811 -13.647 -10.120 1.00 0.00 H new ATOM 0 HG3 GLN A 67 6.534 -13.380 -10.297 1.00 0.00 H new ATOM 0 HE21 GLN A 67 4.584 -11.595 -9.208 1.00 0.00 H new ATOM 0 HE22 GLN A 67 4.572 -10.126 -10.190 1.00 0.00 H new ATOM 943 N GLU A 68 6.404 -16.369 -14.022 1.00 0.00 N ATOM 944 CA GLU A 68 6.227 -17.701 -14.573 1.00 0.00 C ATOM 945 C GLU A 68 7.548 -18.471 -14.537 1.00 0.00 C ATOM 946 O GLU A 68 7.562 -19.677 -14.297 1.00 0.00 O ATOM 947 CB GLU A 68 5.669 -17.636 -15.996 1.00 0.00 C ATOM 948 CG GLU A 68 5.606 -19.030 -16.625 1.00 0.00 C ATOM 949 CD GLU A 68 4.479 -19.116 -17.657 1.00 0.00 C ATOM 950 OE1 GLU A 68 3.350 -19.448 -17.237 1.00 0.00 O ATOM 951 OE2 GLU A 68 4.773 -18.847 -18.842 1.00 0.00 O ATOM 0 H GLU A 68 6.201 -15.609 -14.671 1.00 0.00 H new ATOM 0 HA GLU A 68 5.502 -18.234 -13.957 1.00 0.00 H new ATOM 0 HB2 GLU A 68 4.672 -17.195 -15.980 1.00 0.00 H new ATOM 0 HB3 GLU A 68 6.295 -16.986 -16.607 1.00 0.00 H new ATOM 0 HG2 GLU A 68 6.559 -19.261 -17.102 1.00 0.00 H new ATOM 0 HG3 GLU A 68 5.449 -19.777 -15.847 1.00 0.00 H new ATOM 958 N THR A 69 8.628 -17.741 -14.779 1.00 0.00 N ATOM 959 CA THR A 69 9.952 -18.341 -14.777 1.00 0.00 C ATOM 960 C THR A 69 10.299 -18.862 -13.382 1.00 0.00 C ATOM 961 O THR A 69 10.813 -19.971 -13.240 1.00 0.00 O ATOM 962 CB THR A 69 10.942 -17.299 -15.301 1.00 0.00 C ATOM 963 OG1 THR A 69 10.547 -17.093 -16.654 1.00 0.00 O ATOM 964 CG2 THR A 69 12.367 -17.848 -15.409 1.00 0.00 C ATOM 0 H THR A 69 8.613 -16.741 -14.978 1.00 0.00 H new ATOM 0 HA THR A 69 9.994 -19.210 -15.433 1.00 0.00 H new ATOM 0 HB THR A 69 10.936 -16.430 -14.643 1.00 0.00 H new ATOM 0 HG1 THR A 69 11.296 -16.712 -17.159 1.00 0.00 H new ATOM 0 HG21 THR A 69 13.030 -17.069 -15.786 1.00 0.00 H new ATOM 0 HG22 THR A 69 12.708 -18.170 -14.425 1.00 0.00 H new ATOM 0 HG23 THR A 69 12.379 -18.696 -16.093 1.00 0.00 H new ATOM 972 N ALA A 70 10.005 -18.038 -12.387 1.00 0.00 N ATOM 973 CA ALA A 70 10.279 -18.402 -11.007 1.00 0.00 C ATOM 974 C ALA A 70 9.364 -19.558 -10.598 1.00 0.00 C ATOM 975 O ALA A 70 9.794 -20.480 -9.906 1.00 0.00 O ATOM 976 CB ALA A 70 10.106 -17.175 -10.111 1.00 0.00 C ATOM 0 H ALA A 70 9.580 -17.119 -12.509 1.00 0.00 H new ATOM 0 HA ALA A 70 11.309 -18.742 -10.897 1.00 0.00 H new ATOM 0 HB1 ALA A 70 10.312 -17.448 -9.076 1.00 0.00 H new ATOM 0 HB2 ALA A 70 10.799 -16.395 -10.425 1.00 0.00 H new ATOM 0 HB3 ALA A 70 9.084 -16.806 -10.193 1.00 0.00 H new ATOM 982 N LEU A 71 8.119 -19.470 -11.041 1.00 0.00 N ATOM 983 CA LEU A 71 7.139 -20.497 -10.729 1.00 0.00 C ATOM 984 C LEU A 71 7.524 -21.796 -11.441 1.00 0.00 C ATOM 985 O LEU A 71 7.374 -22.882 -10.882 1.00 0.00 O ATOM 986 CB LEU A 71 5.728 -20.009 -11.061 1.00 0.00 C ATOM 987 CG LEU A 71 4.908 -19.477 -9.883 1.00 0.00 C ATOM 988 CD1 LEU A 71 3.850 -18.479 -10.358 1.00 0.00 C ATOM 989 CD2 LEU A 71 4.293 -20.625 -9.080 1.00 0.00 C ATOM 0 H LEU A 71 7.766 -18.703 -11.614 1.00 0.00 H new ATOM 0 HA LEU A 71 7.135 -20.708 -9.660 1.00 0.00 H new ATOM 0 HB2 LEU A 71 5.804 -19.221 -11.810 1.00 0.00 H new ATOM 0 HB3 LEU A 71 5.179 -20.832 -11.518 1.00 0.00 H new ATOM 0 HG LEU A 71 5.580 -18.940 -9.214 1.00 0.00 H new ATOM 0 HD11 LEU A 71 3.281 -18.116 -9.502 1.00 0.00 H new ATOM 0 HD12 LEU A 71 4.338 -17.639 -10.852 1.00 0.00 H new ATOM 0 HD13 LEU A 71 3.176 -18.970 -11.060 1.00 0.00 H new ATOM 0 HD21 LEU A 71 3.716 -20.219 -8.249 1.00 0.00 H new ATOM 0 HD22 LEU A 71 3.638 -21.210 -9.725 1.00 0.00 H new ATOM 0 HD23 LEU A 71 5.087 -21.264 -8.693 1.00 0.00 H new ATOM 1001 N SER A 72 8.012 -21.642 -12.662 1.00 0.00 N ATOM 1002 CA SER A 72 8.420 -22.789 -13.456 1.00 0.00 C ATOM 1003 C SER A 72 9.621 -23.476 -12.804 1.00 0.00 C ATOM 1004 O SER A 72 9.716 -24.702 -12.807 1.00 0.00 O ATOM 1005 CB SER A 72 8.759 -22.374 -14.889 1.00 0.00 C ATOM 1006 OG SER A 72 7.593 -22.041 -15.639 1.00 0.00 O ATOM 0 H SER A 72 8.134 -20.740 -13.122 1.00 0.00 H new ATOM 0 HA SER A 72 7.587 -23.490 -13.497 1.00 0.00 H new ATOM 0 HB2 SER A 72 9.434 -21.518 -14.869 1.00 0.00 H new ATOM 0 HB3 SER A 72 9.290 -23.186 -15.386 1.00 0.00 H new ATOM 0 HG SER A 72 7.278 -21.151 -15.376 1.00 0.00 H new ATOM 1012 N ALA A 73 10.509 -22.656 -12.261 1.00 0.00 N ATOM 1013 CA ALA A 73 11.700 -23.169 -11.607 1.00 0.00 C ATOM 1014 C ALA A 73 11.294 -23.940 -10.349 1.00 0.00 C ATOM 1015 O ALA A 73 11.879 -24.976 -10.035 1.00 0.00 O ATOM 1016 CB ALA A 73 12.653 -22.013 -11.300 1.00 0.00 C ATOM 0 H ALA A 73 10.427 -21.639 -12.261 1.00 0.00 H new ATOM 0 HA ALA A 73 12.229 -23.861 -12.262 1.00 0.00 H new ATOM 0 HB1 ALA A 73 13.547 -22.399 -10.809 1.00 0.00 H new ATOM 0 HB2 ALA A 73 12.935 -21.517 -12.229 1.00 0.00 H new ATOM 0 HB3 ALA A 73 12.158 -21.298 -10.643 1.00 0.00 H new ATOM 1022 N MET A 74 10.295 -23.405 -9.663 1.00 0.00 N ATOM 1023 CA MET A 74 9.803 -24.030 -8.447 1.00 0.00 C ATOM 1024 C MET A 74 9.213 -25.411 -8.739 1.00 0.00 C ATOM 1025 O MET A 74 9.510 -26.377 -8.038 1.00 0.00 O ATOM 1026 CB MET A 74 8.732 -23.140 -7.813 1.00 0.00 C ATOM 1027 CG MET A 74 9.160 -22.673 -6.421 1.00 0.00 C ATOM 1028 SD MET A 74 7.821 -22.897 -5.262 1.00 0.00 S ATOM 1029 CE MET A 74 6.587 -21.844 -6.008 1.00 0.00 C ATOM 0 H MET A 74 9.813 -22.546 -9.926 1.00 0.00 H new ATOM 0 HA MET A 74 10.640 -24.152 -7.760 1.00 0.00 H new ATOM 0 HB2 MET A 74 8.549 -22.275 -8.450 1.00 0.00 H new ATOM 0 HB3 MET A 74 7.793 -23.689 -7.743 1.00 0.00 H new ATOM 0 HG2 MET A 74 10.034 -23.236 -6.093 1.00 0.00 H new ATOM 0 HG3 MET A 74 9.451 -21.623 -6.454 1.00 0.00 H new ATOM 0 HE1 MET A 74 5.885 -21.509 -5.244 1.00 0.00 H new ATOM 0 HE2 MET A 74 7.072 -20.979 -6.460 1.00 0.00 H new ATOM 0 HE3 MET A 74 6.049 -22.401 -6.775 1.00 0.00 H new ATOM 1039 N ARG A 75 8.389 -25.460 -9.775 1.00 0.00 N ATOM 1040 CA ARG A 75 7.755 -26.706 -10.169 1.00 0.00 C ATOM 1041 C ARG A 75 8.747 -27.589 -10.930 1.00 0.00 C ATOM 1042 O ARG A 75 8.611 -28.812 -10.944 1.00 0.00 O ATOM 1043 CB ARG A 75 6.532 -26.448 -11.051 1.00 0.00 C ATOM 1044 CG ARG A 75 5.809 -27.755 -11.383 1.00 0.00 C ATOM 1045 CD ARG A 75 5.345 -28.463 -10.109 1.00 0.00 C ATOM 1046 NE ARG A 75 3.959 -28.956 -10.281 1.00 0.00 N ATOM 1047 CZ ARG A 75 2.895 -28.160 -10.455 1.00 0.00 C ATOM 1048 NH1 ARG A 75 3.051 -26.830 -10.483 1.00 0.00 N ATOM 1049 NH2 ARG A 75 1.676 -28.695 -10.602 1.00 0.00 N ATOM 0 H ARG A 75 8.146 -24.656 -10.354 1.00 0.00 H new ATOM 0 HA ARG A 75 7.432 -27.215 -9.261 1.00 0.00 H new ATOM 0 HB2 ARG A 75 5.848 -25.770 -10.541 1.00 0.00 H new ATOM 0 HB3 ARG A 75 6.841 -25.955 -11.973 1.00 0.00 H new ATOM 0 HG2 ARG A 75 4.950 -27.548 -12.022 1.00 0.00 H new ATOM 0 HG3 ARG A 75 6.474 -28.410 -11.946 1.00 0.00 H new ATOM 0 HD2 ARG A 75 6.011 -29.296 -9.883 1.00 0.00 H new ATOM 0 HD3 ARG A 75 5.394 -27.777 -9.263 1.00 0.00 H new ATOM 0 HE ARG A 75 3.805 -29.964 -10.266 1.00 0.00 H new ATOM 0 HH11 ARG A 75 3.980 -26.423 -10.372 1.00 0.00 H new ATOM 0 HH12 ARG A 75 2.241 -26.224 -10.615 1.00 0.00 H new ATOM 0 HH21 ARG A 75 1.558 -29.708 -10.581 1.00 0.00 H new ATOM 0 HH22 ARG A 75 0.866 -28.090 -10.734 1.00 0.00 H new ATOM 1063 N ASN A 76 9.722 -26.935 -11.544 1.00 0.00 N ATOM 1064 CA ASN A 76 10.736 -27.646 -12.304 1.00 0.00 C ATOM 1065 C ASN A 76 11.725 -28.302 -11.339 1.00 0.00 C ATOM 1066 O ASN A 76 12.227 -29.393 -11.606 1.00 0.00 O ATOM 1067 CB ASN A 76 11.519 -26.689 -13.206 1.00 0.00 C ATOM 1068 CG ASN A 76 10.810 -26.497 -14.548 1.00 0.00 C ATOM 1069 OD1 ASN A 76 9.483 -26.539 -14.470 1.00 0.00 O flip ATOM 1070 ND2 ASN A 76 11.428 -26.322 -15.586 1.00 0.00 N flip ATOM 0 H ASN A 76 9.831 -25.921 -11.531 1.00 0.00 H new ATOM 0 HA ASN A 76 10.234 -28.393 -12.919 1.00 0.00 H new ATOM 0 HB2 ASN A 76 11.632 -25.725 -12.709 1.00 0.00 H new ATOM 0 HB3 ASN A 76 12.522 -27.080 -13.373 1.00 0.00 H new ATOM 0 HD21 ASN A 76 12.448 -26.301 -15.575 1.00 0.00 H new ATOM 0 HD22 ASN A 76 10.925 -26.197 -16.464 1.00 0.00 H new ATOM 1077 N LEU A 77 11.975 -27.610 -10.237 1.00 0.00 N ATOM 1078 CA LEU A 77 12.895 -28.112 -9.231 1.00 0.00 C ATOM 1079 C LEU A 77 12.099 -28.639 -8.036 1.00 0.00 C ATOM 1080 O LEU A 77 11.722 -29.810 -8.005 1.00 0.00 O ATOM 1081 CB LEU A 77 13.922 -27.039 -8.861 1.00 0.00 C ATOM 1082 CG LEU A 77 14.890 -26.625 -9.971 1.00 0.00 C ATOM 1083 CD1 LEU A 77 14.223 -25.651 -10.945 1.00 0.00 C ATOM 1084 CD2 LEU A 77 16.183 -26.054 -9.386 1.00 0.00 C ATOM 0 H LEU A 77 11.556 -26.706 -10.019 1.00 0.00 H new ATOM 0 HA LEU A 77 13.471 -28.949 -9.625 1.00 0.00 H new ATOM 0 HB2 LEU A 77 13.386 -26.152 -8.525 1.00 0.00 H new ATOM 0 HB3 LEU A 77 14.505 -27.399 -8.014 1.00 0.00 H new ATOM 0 HG LEU A 77 15.159 -27.515 -10.539 1.00 0.00 H new ATOM 0 HD11 LEU A 77 14.933 -25.373 -11.724 1.00 0.00 H new ATOM 0 HD12 LEU A 77 13.354 -26.128 -11.399 1.00 0.00 H new ATOM 0 HD13 LEU A 77 13.906 -24.758 -10.407 1.00 0.00 H new ATOM 0 HD21 LEU A 77 16.854 -25.768 -10.196 1.00 0.00 H new ATOM 0 HD22 LEU A 77 15.952 -25.178 -8.779 1.00 0.00 H new ATOM 0 HD23 LEU A 77 16.666 -26.809 -8.765 1.00 0.00 H new ATOM 1096 N ASN A 78 11.866 -27.750 -7.082 1.00 0.00 N ATOM 1097 CA ASN A 78 11.121 -28.112 -5.888 1.00 0.00 C ATOM 1098 C ASN A 78 11.530 -29.518 -5.444 1.00 0.00 C ATOM 1099 O ASN A 78 10.934 -30.505 -5.871 1.00 0.00 O ATOM 1100 CB ASN A 78 9.616 -28.120 -6.159 1.00 0.00 C ATOM 1101 CG ASN A 78 8.892 -29.075 -5.207 1.00 0.00 C ATOM 1102 OD1 ASN A 78 9.289 -28.981 -3.942 1.00 0.00 O flip ATOM 1103 ND2 ASN A 78 8.031 -29.846 -5.597 1.00 0.00 N flip ATOM 0 H ASN A 78 12.180 -26.780 -7.111 1.00 0.00 H new ATOM 0 HA ASN A 78 11.344 -27.376 -5.115 1.00 0.00 H new ATOM 0 HB2 ASN A 78 9.217 -27.113 -6.042 1.00 0.00 H new ATOM 0 HB3 ASN A 78 9.430 -28.419 -7.191 1.00 0.00 H new ATOM 0 HD21 ASN A 78 7.774 -29.866 -6.584 1.00 0.00 H new ATOM 0 HD22 ASN A 78 7.568 -30.470 -4.936 1.00 0.00 H new ATOM 1110 N GLY A 79 12.543 -29.564 -4.591 1.00 0.00 N ATOM 1111 CA GLY A 79 13.038 -30.833 -4.085 1.00 0.00 C ATOM 1112 C GLY A 79 13.551 -31.715 -5.224 1.00 0.00 C ATOM 1113 O GLY A 79 13.319 -32.923 -5.231 1.00 0.00 O ATOM 0 H GLY A 79 13.034 -28.743 -4.238 1.00 0.00 H new ATOM 0 HA2 GLY A 79 13.840 -30.655 -3.369 1.00 0.00 H new ATOM 0 HA3 GLY A 79 12.242 -31.351 -3.550 1.00 0.00 H new ATOM 1117 N ARG A 80 14.239 -31.078 -6.160 1.00 0.00 N ATOM 1118 CA ARG A 80 14.787 -31.791 -7.301 1.00 0.00 C ATOM 1119 C ARG A 80 16.181 -32.329 -6.972 1.00 0.00 C ATOM 1120 O ARG A 80 17.029 -31.598 -6.462 1.00 0.00 O ATOM 1121 CB ARG A 80 14.877 -30.880 -8.527 1.00 0.00 C ATOM 1122 CG ARG A 80 15.797 -31.482 -9.592 1.00 0.00 C ATOM 1123 CD ARG A 80 15.156 -31.401 -10.979 1.00 0.00 C ATOM 1124 NE ARG A 80 16.046 -30.665 -11.904 1.00 0.00 N ATOM 1125 CZ ARG A 80 15.625 -30.038 -13.012 1.00 0.00 C ATOM 1126 NH1 ARG A 80 14.326 -30.056 -13.339 1.00 0.00 N ATOM 1127 NH2 ARG A 80 16.504 -29.395 -13.793 1.00 0.00 N ATOM 0 H ARG A 80 14.429 -30.076 -6.151 1.00 0.00 H new ATOM 0 HA ARG A 80 14.117 -32.621 -7.526 1.00 0.00 H new ATOM 0 HB2 ARG A 80 13.882 -30.728 -8.945 1.00 0.00 H new ATOM 0 HB3 ARG A 80 15.251 -29.900 -8.230 1.00 0.00 H new ATOM 0 HG2 ARG A 80 16.750 -30.952 -9.596 1.00 0.00 H new ATOM 0 HG3 ARG A 80 16.012 -32.522 -9.347 1.00 0.00 H new ATOM 0 HD2 ARG A 80 14.969 -32.404 -11.362 1.00 0.00 H new ATOM 0 HD3 ARG A 80 14.190 -30.900 -10.914 1.00 0.00 H new ATOM 0 HE ARG A 80 17.042 -30.633 -11.685 1.00 0.00 H new ATOM 0 HH11 ARG A 80 13.657 -30.547 -12.745 1.00 0.00 H new ATOM 0 HH12 ARG A 80 14.006 -29.579 -14.182 1.00 0.00 H new ATOM 0 HH21 ARG A 80 17.493 -29.383 -13.545 1.00 0.00 H new ATOM 0 HH22 ARG A 80 16.184 -28.918 -14.636 1.00 0.00 H new ATOM 1141 N GLU A 81 16.375 -33.604 -7.276 1.00 0.00 N ATOM 1142 CA GLU A 81 17.651 -34.250 -7.018 1.00 0.00 C ATOM 1143 C GLU A 81 18.739 -33.649 -7.910 1.00 0.00 C ATOM 1144 O GLU A 81 18.546 -33.500 -9.116 1.00 0.00 O ATOM 1145 CB GLU A 81 17.550 -35.763 -7.218 1.00 0.00 C ATOM 1146 CG GLU A 81 16.202 -36.293 -6.727 1.00 0.00 C ATOM 1147 CD GLU A 81 15.369 -36.834 -7.891 1.00 0.00 C ATOM 1148 OE1 GLU A 81 15.575 -38.018 -8.235 1.00 0.00 O ATOM 1149 OE2 GLU A 81 14.544 -36.051 -8.411 1.00 0.00 O ATOM 0 H GLU A 81 15.670 -34.207 -7.699 1.00 0.00 H new ATOM 0 HA GLU A 81 17.923 -34.073 -5.977 1.00 0.00 H new ATOM 0 HB2 GLU A 81 17.676 -36.003 -8.274 1.00 0.00 H new ATOM 0 HB3 GLU A 81 18.358 -36.259 -6.680 1.00 0.00 H new ATOM 0 HG2 GLU A 81 16.363 -37.082 -5.993 1.00 0.00 H new ATOM 0 HG3 GLU A 81 15.655 -35.496 -6.223 1.00 0.00 H new ATOM 1156 N PHE A 82 19.859 -33.321 -7.284 1.00 0.00 N ATOM 1157 CA PHE A 82 20.978 -32.741 -8.006 1.00 0.00 C ATOM 1158 C PHE A 82 22.304 -33.060 -7.312 1.00 0.00 C ATOM 1159 O PHE A 82 23.206 -33.632 -7.922 1.00 0.00 O ATOM 1160 CB PHE A 82 20.770 -31.225 -8.010 1.00 0.00 C ATOM 1161 CG PHE A 82 22.062 -30.420 -8.171 1.00 0.00 C ATOM 1162 CD1 PHE A 82 22.792 -30.080 -7.075 1.00 0.00 C ATOM 1163 CD2 PHE A 82 22.479 -30.045 -9.410 1.00 0.00 C ATOM 1164 CE1 PHE A 82 23.991 -29.333 -7.225 1.00 0.00 C ATOM 1165 CE2 PHE A 82 23.677 -29.298 -9.559 1.00 0.00 C ATOM 1166 CZ PHE A 82 24.408 -28.958 -8.464 1.00 0.00 C ATOM 0 H PHE A 82 20.016 -33.446 -6.284 1.00 0.00 H new ATOM 0 HA PHE A 82 21.020 -33.149 -9.016 1.00 0.00 H new ATOM 0 HB2 PHE A 82 20.088 -30.964 -8.820 1.00 0.00 H new ATOM 0 HB3 PHE A 82 20.285 -30.933 -7.078 1.00 0.00 H new ATOM 0 HD1 PHE A 82 22.460 -30.378 -6.091 1.00 0.00 H new ATOM 0 HD2 PHE A 82 21.899 -30.315 -10.280 1.00 0.00 H new ATOM 0 HE1 PHE A 82 24.571 -29.063 -6.355 1.00 0.00 H new ATOM 0 HE2 PHE A 82 24.008 -29.000 -10.543 1.00 0.00 H new ATOM 0 HZ PHE A 82 25.320 -28.390 -8.578 1.00 0.00 H new ATOM 1218 N ALA A 86 18.366 -33.517 -2.890 1.00 0.00 N ATOM 1219 CA ALA A 86 17.211 -32.800 -3.402 1.00 0.00 C ATOM 1220 C ALA A 86 17.369 -31.308 -3.104 1.00 0.00 C ATOM 1221 O ALA A 86 17.870 -30.932 -2.045 1.00 0.00 O ATOM 1222 CB ALA A 86 15.935 -33.384 -2.792 1.00 0.00 C ATOM 0 HA ALA A 86 17.137 -32.914 -4.483 1.00 0.00 H new ATOM 0 HB1 ALA A 86 15.069 -32.846 -3.176 1.00 0.00 H new ATOM 0 HB2 ALA A 86 15.854 -34.438 -3.057 1.00 0.00 H new ATOM 0 HB3 ALA A 86 15.972 -33.285 -1.707 1.00 0.00 H new ATOM 1228 N LEU A 87 16.933 -30.497 -4.057 1.00 0.00 N ATOM 1229 CA LEU A 87 17.020 -29.054 -3.909 1.00 0.00 C ATOM 1230 C LEU A 87 15.628 -28.491 -3.612 1.00 0.00 C ATOM 1231 O LEU A 87 14.860 -28.208 -4.530 1.00 0.00 O ATOM 1232 CB LEU A 87 17.686 -28.429 -5.137 1.00 0.00 C ATOM 1233 CG LEU A 87 19.201 -28.234 -5.051 1.00 0.00 C ATOM 1234 CD1 LEU A 87 19.709 -27.370 -6.206 1.00 0.00 C ATOM 1235 CD2 LEU A 87 19.604 -27.665 -3.689 1.00 0.00 C ATOM 0 H LEU A 87 16.519 -30.812 -4.934 1.00 0.00 H new ATOM 0 HA LEU A 87 17.656 -28.796 -3.063 1.00 0.00 H new ATOM 0 HB2 LEU A 87 17.469 -29.056 -6.002 1.00 0.00 H new ATOM 0 HB3 LEU A 87 17.225 -27.459 -5.322 1.00 0.00 H new ATOM 0 HG LEU A 87 19.677 -29.210 -5.146 1.00 0.00 H new ATOM 0 HD11 LEU A 87 20.789 -27.247 -6.121 1.00 0.00 H new ATOM 0 HD12 LEU A 87 19.472 -27.854 -7.154 1.00 0.00 H new ATOM 0 HD13 LEU A 87 19.228 -26.392 -6.168 1.00 0.00 H new ATOM 0 HD21 LEU A 87 20.686 -27.536 -3.654 1.00 0.00 H new ATOM 0 HD22 LEU A 87 19.119 -26.701 -3.540 1.00 0.00 H new ATOM 0 HD23 LEU A 87 19.295 -28.353 -2.902 1.00 0.00 H new ATOM 1247 N ARG A 88 15.346 -28.347 -2.326 1.00 0.00 N ATOM 1248 CA ARG A 88 14.061 -27.823 -1.896 1.00 0.00 C ATOM 1249 C ARG A 88 13.880 -26.387 -2.392 1.00 0.00 C ATOM 1250 O ARG A 88 14.666 -25.505 -2.050 1.00 0.00 O ATOM 1251 CB ARG A 88 13.938 -27.848 -0.371 1.00 0.00 C ATOM 1252 CG ARG A 88 13.723 -29.274 0.139 1.00 0.00 C ATOM 1253 CD ARG A 88 13.109 -29.269 1.540 1.00 0.00 C ATOM 1254 NE ARG A 88 12.709 -30.642 1.922 1.00 0.00 N ATOM 1255 CZ ARG A 88 13.534 -31.536 2.484 1.00 0.00 C ATOM 1256 NH1 ARG A 88 14.809 -31.207 2.732 1.00 0.00 N ATOM 1257 NH2 ARG A 88 13.084 -32.759 2.797 1.00 0.00 N ATOM 0 H ARG A 88 15.985 -28.584 -1.567 1.00 0.00 H new ATOM 0 HA ARG A 88 13.285 -28.459 -2.322 1.00 0.00 H new ATOM 0 HB2 ARG A 88 14.840 -27.430 0.077 1.00 0.00 H new ATOM 0 HB3 ARG A 88 13.105 -27.217 -0.059 1.00 0.00 H new ATOM 0 HG2 ARG A 88 13.070 -29.814 -0.546 1.00 0.00 H new ATOM 0 HG3 ARG A 88 14.675 -29.805 0.157 1.00 0.00 H new ATOM 0 HD2 ARG A 88 13.828 -28.877 2.260 1.00 0.00 H new ATOM 0 HD3 ARG A 88 12.242 -28.609 1.564 1.00 0.00 H new ATOM 0 HE ARG A 88 11.745 -30.925 1.746 1.00 0.00 H new ATOM 0 HH11 ARG A 88 15.151 -30.276 2.493 1.00 0.00 H new ATOM 0 HH12 ARG A 88 15.437 -31.887 3.160 1.00 0.00 H new ATOM 0 HH21 ARG A 88 12.114 -33.009 2.607 1.00 0.00 H new ATOM 0 HH22 ARG A 88 13.712 -33.439 3.225 1.00 0.00 H new ATOM 1271 N VAL A 89 12.839 -26.197 -3.189 1.00 0.00 N ATOM 1272 CA VAL A 89 12.545 -24.883 -3.735 1.00 0.00 C ATOM 1273 C VAL A 89 11.104 -24.503 -3.391 1.00 0.00 C ATOM 1274 O VAL A 89 10.174 -25.253 -3.681 1.00 0.00 O ATOM 1275 CB VAL A 89 12.824 -24.867 -5.240 1.00 0.00 C ATOM 1276 CG1 VAL A 89 12.687 -23.453 -5.808 1.00 0.00 C ATOM 1277 CG2 VAL A 89 14.204 -25.451 -5.548 1.00 0.00 C ATOM 0 H VAL A 89 12.189 -26.931 -3.470 1.00 0.00 H new ATOM 0 HA VAL A 89 13.195 -24.130 -3.289 1.00 0.00 H new ATOM 0 HB VAL A 89 12.078 -25.496 -5.726 1.00 0.00 H new ATOM 0 HG11 VAL A 89 12.890 -23.470 -6.879 1.00 0.00 H new ATOM 0 HG12 VAL A 89 11.674 -23.089 -5.637 1.00 0.00 H new ATOM 0 HG13 VAL A 89 13.399 -22.792 -5.314 1.00 0.00 H new ATOM 0 HG21 VAL A 89 14.377 -25.428 -6.624 1.00 0.00 H new ATOM 0 HG22 VAL A 89 14.970 -24.861 -5.045 1.00 0.00 H new ATOM 0 HG23 VAL A 89 14.250 -26.481 -5.195 1.00 0.00 H new ATOM 1287 N ASP A 90 10.964 -23.338 -2.775 1.00 0.00 N ATOM 1288 CA ASP A 90 9.651 -22.849 -2.388 1.00 0.00 C ATOM 1289 C ASP A 90 9.568 -21.347 -2.670 1.00 0.00 C ATOM 1290 O ASP A 90 10.587 -20.659 -2.697 1.00 0.00 O ATOM 1291 CB ASP A 90 9.403 -23.064 -0.894 1.00 0.00 C ATOM 1292 CG ASP A 90 10.553 -23.730 -0.136 1.00 0.00 C ATOM 1293 OD1 ASP A 90 11.708 -23.325 -0.387 1.00 0.00 O ATOM 1294 OD2 ASP A 90 10.251 -24.630 0.677 1.00 0.00 O ATOM 0 H ASP A 90 11.738 -22.719 -2.534 1.00 0.00 H new ATOM 0 HA ASP A 90 8.903 -23.398 -2.961 1.00 0.00 H new ATOM 0 HB2 ASP A 90 9.195 -22.098 -0.433 1.00 0.00 H new ATOM 0 HB3 ASP A 90 8.508 -23.674 -0.774 1.00 0.00 H new ATOM 1299 N ASN A 91 8.343 -20.883 -2.872 1.00 0.00 N ATOM 1300 CA ASN A 91 8.113 -19.476 -3.151 1.00 0.00 C ATOM 1301 C ASN A 91 8.674 -18.635 -2.003 1.00 0.00 C ATOM 1302 O ASN A 91 8.379 -18.893 -0.837 1.00 0.00 O ATOM 1303 CB ASN A 91 6.618 -19.175 -3.270 1.00 0.00 C ATOM 1304 CG ASN A 91 6.354 -18.127 -4.352 1.00 0.00 C ATOM 1305 OD1 ASN A 91 5.575 -17.124 -3.955 1.00 0.00 O flip ATOM 1306 ND2 ASN A 91 6.825 -18.222 -5.473 1.00 0.00 N flip ATOM 0 H ASN A 91 7.500 -21.457 -2.848 1.00 0.00 H new ATOM 0 HA ASN A 91 8.606 -19.234 -4.093 1.00 0.00 H new ATOM 0 HB2 ASN A 91 6.077 -20.091 -3.506 1.00 0.00 H new ATOM 0 HB3 ASN A 91 6.238 -18.818 -2.313 1.00 0.00 H new ATOM 0 HD21 ASN A 91 7.416 -19.018 -5.712 1.00 0.00 H new ATOM 0 HD22 ASN A 91 6.628 -17.505 -6.171 1.00 0.00 H new ATOM 1313 N ALA A 92 9.474 -17.645 -2.372 1.00 0.00 N ATOM 1314 CA ALA A 92 10.080 -16.765 -1.388 1.00 0.00 C ATOM 1315 C ALA A 92 8.991 -15.910 -0.737 1.00 0.00 C ATOM 1316 O ALA A 92 9.246 -15.218 0.248 1.00 0.00 O ATOM 1317 CB ALA A 92 11.163 -15.917 -2.058 1.00 0.00 C ATOM 0 H ALA A 92 9.716 -17.433 -3.340 1.00 0.00 H new ATOM 0 HA ALA A 92 10.561 -17.344 -0.600 1.00 0.00 H new ATOM 0 HB1 ALA A 92 11.617 -15.257 -1.319 1.00 0.00 H new ATOM 0 HB2 ALA A 92 11.927 -16.570 -2.480 1.00 0.00 H new ATOM 0 HB3 ALA A 92 10.717 -15.319 -2.853 1.00 0.00 H new ATOM 1323 N ALA A 93 7.800 -15.986 -1.313 1.00 0.00 N ATOM 1324 CA ALA A 93 6.671 -15.227 -0.801 1.00 0.00 C ATOM 1325 C ALA A 93 5.832 -16.124 0.112 1.00 0.00 C ATOM 1326 O ALA A 93 4.665 -15.833 0.372 1.00 0.00 O ATOM 1327 CB ALA A 93 5.861 -14.665 -1.970 1.00 0.00 C ATOM 0 H ALA A 93 7.592 -16.561 -2.129 1.00 0.00 H new ATOM 0 HA ALA A 93 7.015 -14.381 -0.207 1.00 0.00 H new ATOM 0 HB1 ALA A 93 5.014 -14.096 -1.586 1.00 0.00 H new ATOM 0 HB2 ALA A 93 6.494 -14.012 -2.571 1.00 0.00 H new ATOM 0 HB3 ALA A 93 5.496 -15.486 -2.588 1.00 0.00 H new ATOM 1333 N SER A 94 6.458 -17.197 0.572 1.00 0.00 N ATOM 1334 CA SER A 94 5.783 -18.138 1.450 1.00 0.00 C ATOM 1335 C SER A 94 5.764 -17.598 2.881 1.00 0.00 C ATOM 1336 O SER A 94 6.646 -16.834 3.272 1.00 0.00 O ATOM 1337 CB SER A 94 6.458 -19.510 1.410 1.00 0.00 C ATOM 1338 OG SER A 94 5.600 -20.542 1.889 1.00 0.00 O ATOM 0 H SER A 94 7.425 -17.436 0.353 1.00 0.00 H new ATOM 0 HA SER A 94 4.758 -18.257 1.100 1.00 0.00 H new ATOM 0 HB2 SER A 94 6.760 -19.736 0.387 1.00 0.00 H new ATOM 0 HB3 SER A 94 7.366 -19.485 2.012 1.00 0.00 H new ATOM 0 HG SER A 94 6.067 -21.402 1.846 1.00 0.00 H new ATOM 1344 N GLU A 95 4.750 -18.016 3.624 1.00 0.00 N ATOM 1345 CA GLU A 95 4.605 -17.583 5.004 1.00 0.00 C ATOM 1346 C GLU A 95 5.827 -18.003 5.823 1.00 0.00 C ATOM 1347 O GLU A 95 6.274 -17.265 6.701 1.00 0.00 O ATOM 1348 CB GLU A 95 3.317 -18.135 5.619 1.00 0.00 C ATOM 1349 CG GLU A 95 2.132 -17.211 5.331 1.00 0.00 C ATOM 1350 CD GLU A 95 0.808 -17.891 5.686 1.00 0.00 C ATOM 1351 OE1 GLU A 95 0.762 -18.514 6.768 1.00 0.00 O ATOM 1352 OE2 GLU A 95 -0.128 -17.773 4.866 1.00 0.00 O ATOM 0 H GLU A 95 4.021 -18.650 3.297 1.00 0.00 H new ATOM 0 HA GLU A 95 4.539 -16.495 5.018 1.00 0.00 H new ATOM 0 HB2 GLU A 95 3.115 -19.128 5.217 1.00 0.00 H new ATOM 0 HB3 GLU A 95 3.443 -18.246 6.696 1.00 0.00 H new ATOM 0 HG2 GLU A 95 2.237 -16.290 5.904 1.00 0.00 H new ATOM 0 HG3 GLU A 95 2.131 -16.933 4.277 1.00 0.00 H new ATOM 1359 N LYS A 96 6.335 -19.185 5.507 1.00 0.00 N ATOM 1360 CA LYS A 96 7.497 -19.711 6.202 1.00 0.00 C ATOM 1361 C LYS A 96 8.765 -19.101 5.602 1.00 0.00 C ATOM 1362 O LYS A 96 9.786 -18.991 6.279 1.00 0.00 O ATOM 1363 CB LYS A 96 7.484 -21.241 6.187 1.00 0.00 C ATOM 1364 CG LYS A 96 7.864 -21.779 4.806 1.00 0.00 C ATOM 1365 CD LYS A 96 7.312 -23.190 4.595 1.00 0.00 C ATOM 1366 CE LYS A 96 8.422 -24.156 4.178 1.00 0.00 C ATOM 1367 NZ LYS A 96 7.891 -25.532 4.049 1.00 0.00 N ATOM 0 H LYS A 96 5.963 -19.794 4.778 1.00 0.00 H new ATOM 0 HA LYS A 96 7.473 -19.426 7.254 1.00 0.00 H new ATOM 0 HB2 LYS A 96 8.181 -21.621 6.934 1.00 0.00 H new ATOM 0 HB3 LYS A 96 6.493 -21.603 6.462 1.00 0.00 H new ATOM 0 HG2 LYS A 96 7.477 -21.114 4.034 1.00 0.00 H new ATOM 0 HG3 LYS A 96 8.949 -21.790 4.702 1.00 0.00 H new ATOM 0 HD2 LYS A 96 6.844 -23.543 5.514 1.00 0.00 H new ATOM 0 HD3 LYS A 96 6.536 -23.170 3.830 1.00 0.00 H new ATOM 0 HE2 LYS A 96 8.853 -23.836 3.229 1.00 0.00 H new ATOM 0 HE3 LYS A 96 9.224 -24.137 4.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 8.658 -26.175 3.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 7.501 -25.840 4.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 7.141 -25.549 3.329 1.00 0.00 H new ATOM 1381 N ASN A 97 8.658 -18.720 4.337 1.00 0.00 N ATOM 1382 CA ASN A 97 9.783 -18.124 3.638 1.00 0.00 C ATOM 1383 C ASN A 97 10.019 -16.710 4.172 1.00 0.00 C ATOM 1384 O ASN A 97 11.119 -16.172 4.052 1.00 0.00 O ATOM 1385 CB ASN A 97 9.508 -18.023 2.136 1.00 0.00 C ATOM 1386 CG ASN A 97 9.858 -19.331 1.425 1.00 0.00 C ATOM 1387 OD1 ASN A 97 10.452 -19.349 0.360 1.00 0.00 O ATOM 1388 ND2 ASN A 97 9.457 -20.422 2.071 1.00 0.00 N ATOM 0 H ASN A 97 7.809 -18.813 3.779 1.00 0.00 H new ATOM 0 HA ASN A 97 10.655 -18.756 3.803 1.00 0.00 H new ATOM 0 HB2 ASN A 97 8.457 -17.785 1.970 1.00 0.00 H new ATOM 0 HB3 ASN A 97 10.091 -17.206 1.710 1.00 0.00 H new ATOM 0 HD21 ASN A 97 9.643 -21.345 1.678 1.00 0.00 H new ATOM 0 HD22 ASN A 97 8.964 -20.336 2.960 1.00 0.00 H new ATOM 1395 N LYS A 98 8.968 -16.147 4.750 1.00 0.00 N ATOM 1396 CA LYS A 98 9.046 -14.806 5.303 1.00 0.00 C ATOM 1397 C LYS A 98 9.963 -14.817 6.528 1.00 0.00 C ATOM 1398 O LYS A 98 10.694 -13.857 6.769 1.00 0.00 O ATOM 1399 CB LYS A 98 7.645 -14.261 5.588 1.00 0.00 C ATOM 1400 CG LYS A 98 7.051 -13.599 4.343 1.00 0.00 C ATOM 1401 CD LYS A 98 5.523 -13.565 4.416 1.00 0.00 C ATOM 1402 CE LYS A 98 4.992 -12.156 4.146 1.00 0.00 C ATOM 1403 NZ LYS A 98 4.400 -12.076 2.792 1.00 0.00 N ATOM 0 H LYS A 98 8.057 -16.596 4.847 1.00 0.00 H new ATOM 0 HA LYS A 98 9.488 -14.121 4.580 1.00 0.00 H new ATOM 0 HB2 LYS A 98 6.996 -15.072 5.918 1.00 0.00 H new ATOM 0 HB3 LYS A 98 7.691 -13.538 6.402 1.00 0.00 H new ATOM 0 HG2 LYS A 98 7.437 -12.584 4.247 1.00 0.00 H new ATOM 0 HG3 LYS A 98 7.364 -14.144 3.453 1.00 0.00 H new ATOM 0 HD2 LYS A 98 5.105 -14.261 3.688 1.00 0.00 H new ATOM 0 HD3 LYS A 98 5.195 -13.899 5.400 1.00 0.00 H new ATOM 0 HE2 LYS A 98 4.243 -11.894 4.893 1.00 0.00 H new ATOM 0 HE3 LYS A 98 5.801 -11.432 4.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 4.044 -11.113 2.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 5.125 -12.306 2.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 3.614 -12.753 2.716 1.00 0.00 H new ATOM 1417 N GLU A 99 9.895 -15.913 7.269 1.00 0.00 N ATOM 1418 CA GLU A 99 10.709 -16.061 8.463 1.00 0.00 C ATOM 1419 C GLU A 99 12.191 -16.127 8.089 1.00 0.00 C ATOM 1420 O GLU A 99 13.029 -15.512 8.748 1.00 0.00 O ATOM 1421 CB GLU A 99 10.290 -17.296 9.262 1.00 0.00 C ATOM 1422 CG GLU A 99 9.891 -16.916 10.690 1.00 0.00 C ATOM 1423 CD GLU A 99 8.716 -17.767 11.176 1.00 0.00 C ATOM 1424 OE1 GLU A 99 8.965 -18.950 11.493 1.00 0.00 O ATOM 1425 OE2 GLU A 99 7.595 -17.215 11.219 1.00 0.00 O ATOM 0 H GLU A 99 9.288 -16.707 7.065 1.00 0.00 H new ATOM 0 HA GLU A 99 10.552 -15.188 9.097 1.00 0.00 H new ATOM 0 HB2 GLU A 99 9.454 -17.788 8.766 1.00 0.00 H new ATOM 0 HB3 GLU A 99 11.111 -18.012 9.288 1.00 0.00 H new ATOM 0 HG2 GLU A 99 10.742 -17.050 11.357 1.00 0.00 H new ATOM 0 HG3 GLU A 99 9.620 -15.861 10.727 1.00 0.00 H new ATOM 1432 N GLU A 100 12.470 -16.877 7.033 1.00 0.00 N ATOM 1433 CA GLU A 100 13.837 -17.030 6.564 1.00 0.00 C ATOM 1434 C GLU A 100 14.325 -15.733 5.916 1.00 0.00 C ATOM 1435 O GLU A 100 15.455 -15.306 6.147 1.00 0.00 O ATOM 1436 CB GLU A 100 13.954 -18.207 5.593 1.00 0.00 C ATOM 1437 CG GLU A 100 15.071 -19.161 6.021 1.00 0.00 C ATOM 1438 CD GLU A 100 14.504 -20.528 6.411 1.00 0.00 C ATOM 1439 OE1 GLU A 100 13.445 -20.885 5.849 1.00 0.00 O ATOM 1440 OE2 GLU A 100 15.142 -21.185 7.262 1.00 0.00 O ATOM 0 H GLU A 100 11.773 -17.385 6.489 1.00 0.00 H new ATOM 0 HA GLU A 100 14.473 -17.245 7.422 1.00 0.00 H new ATOM 0 HB2 GLU A 100 13.007 -18.745 5.552 1.00 0.00 H new ATOM 0 HB3 GLU A 100 14.153 -17.836 4.588 1.00 0.00 H new ATOM 0 HG2 GLU A 100 15.786 -19.279 5.207 1.00 0.00 H new ATOM 0 HG3 GLU A 100 15.615 -18.735 6.864 1.00 0.00 H new ATOM 1447 N LEU A 101 13.448 -15.142 5.117 1.00 0.00 N ATOM 1448 CA LEU A 101 13.775 -13.902 4.434 1.00 0.00 C ATOM 1449 C LEU A 101 14.060 -12.814 5.471 1.00 0.00 C ATOM 1450 O LEU A 101 14.885 -11.932 5.239 1.00 0.00 O ATOM 1451 CB LEU A 101 12.673 -13.532 3.439 1.00 0.00 C ATOM 1452 CG LEU A 101 12.801 -14.137 2.040 1.00 0.00 C ATOM 1453 CD1 LEU A 101 11.518 -14.868 1.639 1.00 0.00 C ATOM 1454 CD2 LEU A 101 13.199 -13.072 1.016 1.00 0.00 C ATOM 0 H LEU A 101 12.512 -15.499 4.928 1.00 0.00 H new ATOM 0 HA LEU A 101 14.681 -14.021 3.840 1.00 0.00 H new ATOM 0 HB2 LEU A 101 11.715 -13.837 3.859 1.00 0.00 H new ATOM 0 HB3 LEU A 101 12.647 -12.447 3.343 1.00 0.00 H new ATOM 0 HG LEU A 101 13.600 -14.878 2.060 1.00 0.00 H new ATOM 0 HD11 LEU A 101 11.636 -15.289 0.640 1.00 0.00 H new ATOM 0 HD12 LEU A 101 11.319 -15.670 2.350 1.00 0.00 H new ATOM 0 HD13 LEU A 101 10.684 -14.166 1.641 1.00 0.00 H new ATOM 0 HD21 LEU A 101 13.283 -13.529 0.030 1.00 0.00 H new ATOM 0 HD22 LEU A 101 12.440 -12.290 0.990 1.00 0.00 H new ATOM 0 HD23 LEU A 101 14.158 -12.637 1.297 1.00 0.00 H new ATOM 1466 N LYS A 102 13.359 -12.911 6.591 1.00 0.00 N ATOM 1467 CA LYS A 102 13.526 -11.945 7.664 1.00 0.00 C ATOM 1468 C LYS A 102 15.006 -11.864 8.045 1.00 0.00 C ATOM 1469 O LYS A 102 15.491 -10.805 8.441 1.00 0.00 O ATOM 1470 CB LYS A 102 12.606 -12.284 8.838 1.00 0.00 C ATOM 1471 CG LYS A 102 12.600 -11.158 9.873 1.00 0.00 C ATOM 1472 CD LYS A 102 11.347 -11.224 10.749 1.00 0.00 C ATOM 1473 CE LYS A 102 11.651 -10.768 12.177 1.00 0.00 C ATOM 1474 NZ LYS A 102 10.596 -11.234 13.106 1.00 0.00 N ATOM 0 H LYS A 102 12.674 -13.643 6.779 1.00 0.00 H new ATOM 0 HA LYS A 102 13.227 -10.951 7.332 1.00 0.00 H new ATOM 0 HB2 LYS A 102 11.593 -12.453 8.473 1.00 0.00 H new ATOM 0 HB3 LYS A 102 12.935 -13.212 9.306 1.00 0.00 H new ATOM 0 HG2 LYS A 102 13.490 -11.230 10.499 1.00 0.00 H new ATOM 0 HG3 LYS A 102 12.644 -10.194 9.367 1.00 0.00 H new ATOM 0 HD2 LYS A 102 10.566 -10.595 10.321 1.00 0.00 H new ATOM 0 HD3 LYS A 102 10.962 -12.244 10.763 1.00 0.00 H new ATOM 0 HE2 LYS A 102 12.619 -11.158 12.491 1.00 0.00 H new ATOM 0 HE3 LYS A 102 11.719 -9.681 12.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 10.818 -10.916 14.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 9.678 -10.841 12.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 10.550 -12.273 13.086 1.00 0.00 H new ATOM 1488 N SER A 103 15.681 -12.996 7.913 1.00 0.00 N ATOM 1489 CA SER A 103 17.096 -13.066 8.239 1.00 0.00 C ATOM 1490 C SER A 103 17.933 -12.647 7.029 1.00 0.00 C ATOM 1491 O SER A 103 19.073 -12.211 7.179 1.00 0.00 O ATOM 1492 CB SER A 103 17.487 -14.473 8.694 1.00 0.00 C ATOM 1493 OG SER A 103 17.379 -14.627 10.106 1.00 0.00 O ATOM 0 H SER A 103 15.275 -13.872 7.585 1.00 0.00 H new ATOM 0 HA SER A 103 17.292 -12.380 9.063 1.00 0.00 H new ATOM 0 HB2 SER A 103 16.848 -15.205 8.200 1.00 0.00 H new ATOM 0 HB3 SER A 103 18.511 -14.683 8.384 1.00 0.00 H new ATOM 0 HG SER A 103 17.636 -15.539 10.356 1.00 0.00 H new ATOM 1499 N LEU A 104 17.334 -12.795 5.856 1.00 0.00 N ATOM 1500 CA LEU A 104 18.011 -12.438 4.621 1.00 0.00 C ATOM 1501 C LEU A 104 17.955 -10.920 4.434 1.00 0.00 C ATOM 1502 O LEU A 104 18.612 -10.375 3.548 1.00 0.00 O ATOM 1503 CB LEU A 104 17.429 -13.224 3.444 1.00 0.00 C ATOM 1504 CG LEU A 104 18.430 -14.030 2.615 1.00 0.00 C ATOM 1505 CD1 LEU A 104 19.780 -13.313 2.537 1.00 0.00 C ATOM 1506 CD2 LEU A 104 18.568 -15.455 3.155 1.00 0.00 C ATOM 0 H LEU A 104 16.388 -13.157 5.735 1.00 0.00 H new ATOM 0 HA LEU A 104 19.064 -12.715 4.670 1.00 0.00 H new ATOM 0 HB2 LEU A 104 16.672 -13.908 3.828 1.00 0.00 H new ATOM 0 HB3 LEU A 104 16.920 -12.524 2.782 1.00 0.00 H new ATOM 0 HG LEU A 104 18.047 -14.107 1.597 1.00 0.00 H new ATOM 0 HD11 LEU A 104 20.474 -13.907 1.942 1.00 0.00 H new ATOM 0 HD12 LEU A 104 19.647 -12.336 2.072 1.00 0.00 H new ATOM 0 HD13 LEU A 104 20.182 -13.184 3.542 1.00 0.00 H new ATOM 0 HD21 LEU A 104 19.286 -16.006 2.547 1.00 0.00 H new ATOM 0 HD22 LEU A 104 18.917 -15.421 4.187 1.00 0.00 H new ATOM 0 HD23 LEU A 104 17.600 -15.954 3.116 1.00 0.00 H new