USER MOD reduce.3.24.130724 H: found=0, std=0, add=966, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 966 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 122 GLN : amide:sc= 2 K(o=3.2,f=-2.8) USER MOD Set 1.2: A 123 TYR OH : rot 103:sc= 1.24 USER MOD Set 2.1: A 112 SER OG : rot 180:sc= 1.03 USER MOD Set 2.2: A 115 GLN :FLIP amide:sc= -3.09! C(o=-4.2!,f=-2.1!) USER MOD Set 3.1: A 100 GLN :FLIP amide:sc= 0.243 F(o=-0.26,f=0.49) USER MOD Set 3.2: A 102 LYS NZ :NH3+ 139:sc= 0.248 (180deg=0) USER MOD Set 4.1: A 21 ASN : amide:sc= 1.05 K(o=2.3,f=-0.59) USER MOD Set 4.2: A 25 TYR OH : rot 172:sc= 1.28 USER MOD Single : A 7 ASN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ -169:sc= 0.767 (180deg=0.694) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 23 TYR OH : rot 119:sc= 1.03 USER MOD Single : A 26 SER OG : rot 46:sc= 0.197 USER MOD Single : A 28 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.282) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 173:sc= -0.0391 (180deg=-0.146) USER MOD Single : A 38 TYR OH : rot 90:sc= -0.412 USER MOD Single : A 39 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00235) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 CYS SG : rot -74:sc= 0.0299 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 CYS SG : rot -150:sc= -0.541 USER MOD Single : A 65 THR OG1 : rot 69:sc= 1.18 USER MOD Single : A 68 THR OG1 : rot 177:sc= 0.0481 USER MOD Single : A 71 SER OG : rot 7:sc= 0.264 USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 67:sc= 0.187 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 HIS : no HE2:sc= -1.98 X(o=-2,f=-2.3) USER MOD Single : A 86 LYS NZ :NH3+ -157:sc= -0.649 (180deg=-1.47!) USER MOD Single : A 88 SER OG : rot 51:sc= 0.122 USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 60:sc= 0.251 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.00824) USER MOD Single : A 104 TYR OH : rot 30:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 MET CE :methyl -122:sc=-0.00377 (180deg=-0.0351) USER MOD Single : A 117 ASN : amide:sc= -0.0577 K(o=-0.058,f=-1.4) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 7 -12.892 13.650 0.448 1.00 0.00 N ATOM 2 CA ASN A 7 -13.931 13.933 -0.511 1.00 0.00 C ATOM 3 C ASN A 7 -13.754 12.994 -1.681 1.00 0.00 C ATOM 4 O ASN A 7 -14.704 12.353 -2.123 1.00 0.00 O ATOM 5 CB ASN A 7 -13.956 15.422 -0.967 1.00 0.00 C ATOM 6 CG ASN A 7 -14.389 16.331 0.187 1.00 0.00 C ATOM 7 OD1 ASN A 7 -14.604 15.910 1.324 1.00 0.00 O ATOM 8 ND2 ASN A 7 -14.542 17.642 -0.123 1.00 0.00 N ATOM 0 HA ASN A 7 -14.899 13.770 -0.037 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -12.967 15.717 -1.318 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -14.641 15.540 -1.807 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -14.841 18.304 0.593 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -14.358 17.966 -1.072 1.00 0.00 H new ATOM 15 N SER A 8 -12.509 12.868 -2.217 1.00 0.00 N ATOM 16 CA SER A 8 -12.143 11.983 -3.331 1.00 0.00 C ATOM 17 C SER A 8 -11.390 10.751 -2.832 1.00 0.00 C ATOM 18 O SER A 8 -10.683 10.068 -3.569 1.00 0.00 O ATOM 19 CB SER A 8 -11.340 12.723 -4.447 1.00 0.00 C ATOM 20 OG SER A 8 -10.142 13.340 -3.967 1.00 0.00 O ATOM 0 H SER A 8 -11.714 13.402 -1.866 1.00 0.00 H new ATOM 0 HA SER A 8 -13.076 11.651 -3.787 1.00 0.00 H new ATOM 0 HB2 SER A 8 -11.085 12.012 -5.233 1.00 0.00 H new ATOM 0 HB3 SER A 8 -11.976 13.484 -4.899 1.00 0.00 H new ATOM 0 HG SER A 8 -9.683 13.785 -4.710 1.00 0.00 H new ATOM 26 N PHE A 9 -11.559 10.445 -1.522 1.00 0.00 N ATOM 27 CA PHE A 9 -10.916 9.360 -0.781 1.00 0.00 C ATOM 28 C PHE A 9 -11.859 8.227 -0.476 1.00 0.00 C ATOM 29 O PHE A 9 -11.624 7.406 0.398 1.00 0.00 O ATOM 30 CB PHE A 9 -10.299 9.905 0.528 1.00 0.00 C ATOM 31 CG PHE A 9 -9.277 10.933 0.150 1.00 0.00 C ATOM 32 CD1 PHE A 9 -8.184 10.566 -0.610 1.00 0.00 C ATOM 33 CD2 PHE A 9 -9.484 12.270 0.426 1.00 0.00 C ATOM 34 CE1 PHE A 9 -7.355 11.530 -1.141 1.00 0.00 C ATOM 35 CE2 PHE A 9 -8.643 13.236 -0.086 1.00 0.00 C ATOM 36 CZ PHE A 9 -7.571 12.868 -0.873 1.00 0.00 C ATOM 0 H PHE A 9 -12.187 10.988 -0.930 1.00 0.00 H new ATOM 0 HA PHE A 9 -10.130 8.958 -1.420 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -11.070 10.345 1.161 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -9.839 9.099 1.100 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -7.978 9.521 -0.789 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -10.315 12.563 1.051 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -6.529 11.237 -1.772 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -8.823 14.279 0.129 1.00 0.00 H new ATOM 0 HZ PHE A 9 -6.907 13.619 -1.276 1.00 0.00 H new ATOM 46 N VAL A 10 -12.955 8.178 -1.244 1.00 0.00 N ATOM 47 CA VAL A 10 -13.973 7.150 -1.288 1.00 0.00 C ATOM 48 C VAL A 10 -13.628 5.928 -2.181 1.00 0.00 C ATOM 49 O VAL A 10 -13.792 4.803 -1.725 1.00 0.00 O ATOM 50 CB VAL A 10 -15.309 7.800 -1.609 1.00 0.00 C ATOM 51 CG1 VAL A 10 -16.438 6.832 -1.236 1.00 0.00 C ATOM 52 CG2 VAL A 10 -15.426 9.142 -0.847 1.00 0.00 C ATOM 0 H VAL A 10 -13.159 8.928 -1.904 1.00 0.00 H new ATOM 0 HA VAL A 10 -14.034 6.692 -0.301 1.00 0.00 H new ATOM 0 HB VAL A 10 -15.384 8.016 -2.675 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -17.400 7.291 -1.463 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -16.331 5.910 -1.808 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -16.386 6.606 -0.171 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -16.384 9.609 -1.077 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -15.360 8.958 0.225 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -14.617 9.805 -1.152 1.00 0.00 H new ATOM 62 N GLY A 11 -13.103 6.055 -3.445 1.00 0.00 N ATOM 63 CA GLY A 11 -12.591 4.935 -4.235 1.00 0.00 C ATOM 64 C GLY A 11 -11.086 5.022 -4.394 1.00 0.00 C ATOM 65 O GLY A 11 -10.576 4.940 -5.507 1.00 0.00 O ATOM 0 H GLY A 11 -13.034 6.952 -3.925 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -12.855 3.994 -3.752 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -13.064 4.932 -5.217 1.00 0.00 H new ATOM 69 N LEU A 12 -10.332 5.168 -3.265 1.00 0.00 N ATOM 70 CA LEU A 12 -8.865 5.195 -3.214 1.00 0.00 C ATOM 71 C LEU A 12 -8.358 3.892 -2.642 1.00 0.00 C ATOM 72 O LEU A 12 -9.077 3.053 -2.081 1.00 0.00 O ATOM 73 CB LEU A 12 -8.332 6.501 -2.548 1.00 0.00 C ATOM 74 CG LEU A 12 -6.896 6.828 -2.027 1.00 0.00 C ATOM 75 CD1 LEU A 12 -6.572 8.188 -2.698 1.00 0.00 C ATOM 76 CD2 LEU A 12 -7.164 6.752 -0.504 1.00 0.00 C ATOM 0 H LEU A 12 -10.757 5.272 -2.343 1.00 0.00 H new ATOM 0 HA LEU A 12 -8.446 5.252 -4.218 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -8.554 7.290 -3.266 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -8.983 6.661 -1.688 1.00 0.00 H new ATOM 0 HG LEU A 12 -6.021 6.215 -2.242 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -5.576 8.514 -2.397 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -6.606 8.076 -3.782 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -7.306 8.931 -2.387 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -6.242 6.960 0.039 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -7.920 7.488 -0.230 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -7.519 5.754 -0.246 1.00 0.00 H new ATOM 88 N ARG A 13 -7.036 3.710 -2.832 1.00 0.00 N ATOM 89 CA ARG A 13 -6.250 2.522 -2.520 1.00 0.00 C ATOM 90 C ARG A 13 -5.387 2.903 -1.343 1.00 0.00 C ATOM 91 O ARG A 13 -4.960 4.054 -1.275 1.00 0.00 O ATOM 92 CB ARG A 13 -5.479 1.963 -3.748 1.00 0.00 C ATOM 93 CG ARG A 13 -4.848 3.020 -4.664 1.00 0.00 C ATOM 94 CD ARG A 13 -4.172 2.444 -5.915 1.00 0.00 C ATOM 95 NE ARG A 13 -3.534 3.604 -6.637 1.00 0.00 N ATOM 96 CZ ARG A 13 -3.642 3.862 -7.977 1.00 0.00 C ATOM 97 NH1 ARG A 13 -4.354 3.043 -8.801 1.00 0.00 N ATOM 98 NH2 ARG A 13 -3.017 4.961 -8.494 1.00 0.00 N ATOM 0 H ARG A 13 -6.458 4.447 -3.236 1.00 0.00 H new ATOM 0 HA ARG A 13 -6.883 1.676 -2.252 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -4.692 1.300 -3.390 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -6.163 1.355 -4.340 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -5.620 3.724 -4.973 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -4.111 3.585 -4.094 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -3.424 1.699 -5.642 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -4.901 1.945 -6.553 1.00 0.00 H new ATOM 0 HE ARG A 13 -2.975 4.251 -6.080 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -4.820 2.218 -8.422 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -4.421 3.255 -9.797 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -2.479 5.576 -7.884 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -3.088 5.167 -9.491 1.00 0.00 H new ATOM 112 N VAL A 14 -5.117 2.017 -0.340 1.00 0.00 N ATOM 113 CA VAL A 14 -4.402 2.437 0.863 1.00 0.00 C ATOM 114 C VAL A 14 -3.374 1.396 1.258 1.00 0.00 C ATOM 115 O VAL A 14 -3.401 0.257 0.808 1.00 0.00 O ATOM 116 CB VAL A 14 -5.263 3.011 2.041 1.00 0.00 C ATOM 117 CG1 VAL A 14 -6.114 4.198 1.569 1.00 0.00 C ATOM 118 CG2 VAL A 14 -6.275 2.087 2.710 1.00 0.00 C ATOM 0 H VAL A 14 -5.384 1.033 -0.355 1.00 0.00 H new ATOM 0 HA VAL A 14 -3.865 3.343 0.582 1.00 0.00 H new ATOM 0 HB VAL A 14 -4.482 3.243 2.765 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -6.702 4.579 2.404 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -5.462 4.987 1.195 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -6.783 3.872 0.773 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -6.791 2.627 3.504 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -7.001 1.747 1.971 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -5.757 1.226 3.134 1.00 0.00 H new ATOM 128 N VAL A 15 -2.370 1.754 2.099 1.00 0.00 N ATOM 129 CA VAL A 15 -1.330 0.826 2.576 1.00 0.00 C ATOM 130 C VAL A 15 -1.141 1.061 4.037 1.00 0.00 C ATOM 131 O VAL A 15 -1.264 2.205 4.473 1.00 0.00 O ATOM 132 CB VAL A 15 0.016 0.878 1.866 1.00 0.00 C ATOM 133 CG1 VAL A 15 -0.170 0.150 0.539 1.00 0.00 C ATOM 134 CG2 VAL A 15 0.532 2.318 1.699 1.00 0.00 C ATOM 0 H VAL A 15 -2.265 2.701 2.463 1.00 0.00 H new ATOM 0 HA VAL A 15 -1.700 -0.173 2.346 1.00 0.00 H new ATOM 0 HB VAL A 15 0.790 0.388 2.457 1.00 0.00 H new ATOM 0 HG11 VAL A 15 0.769 0.157 -0.015 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -0.472 -0.880 0.728 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -0.940 0.652 -0.047 1.00 0.00 H new ATOM 0 HG21 VAL A 15 1.494 2.303 1.187 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -0.182 2.895 1.111 1.00 0.00 H new ATOM 0 HG23 VAL A 15 0.650 2.778 2.680 1.00 0.00 H new ATOM 144 N ALA A 16 -0.891 -0.040 4.806 1.00 0.00 N ATOM 145 CA ALA A 16 -0.920 -0.045 6.257 1.00 0.00 C ATOM 146 C ALA A 16 0.409 -0.155 6.977 1.00 0.00 C ATOM 147 O ALA A 16 1.000 -1.227 7.068 1.00 0.00 O ATOM 148 CB ALA A 16 -1.810 -1.255 6.651 1.00 0.00 C ATOM 0 H ALA A 16 -0.663 -0.950 4.406 1.00 0.00 H new ATOM 0 HA ALA A 16 -1.292 0.931 6.569 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -1.876 -1.320 7.737 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -2.808 -1.123 6.234 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -1.371 -2.172 6.259 1.00 0.00 H new ATOM 154 N LYS A 17 0.868 0.965 7.587 1.00 0.00 N ATOM 155 CA LYS A 17 2.060 1.077 8.408 1.00 0.00 C ATOM 156 C LYS A 17 1.574 1.256 9.854 1.00 0.00 C ATOM 157 O LYS A 17 0.792 2.165 10.073 1.00 0.00 O ATOM 158 CB LYS A 17 2.858 2.359 8.028 1.00 0.00 C ATOM 159 CG LYS A 17 2.787 2.927 6.592 1.00 0.00 C ATOM 160 CD LYS A 17 3.432 4.327 6.612 1.00 0.00 C ATOM 161 CE LYS A 17 4.824 4.404 6.000 1.00 0.00 C ATOM 162 NZ LYS A 17 5.404 5.761 6.076 1.00 0.00 N ATOM 0 H LYS A 17 0.376 1.855 7.504 1.00 0.00 H new ATOM 0 HA LYS A 17 2.695 0.201 8.274 1.00 0.00 H new ATOM 0 HB2 LYS A 17 2.536 3.151 8.704 1.00 0.00 H new ATOM 0 HB3 LYS A 17 3.908 2.161 8.245 1.00 0.00 H new ATOM 0 HG2 LYS A 17 3.312 2.273 5.895 1.00 0.00 H new ATOM 0 HG3 LYS A 17 1.752 2.987 6.255 1.00 0.00 H new ATOM 0 HD2 LYS A 17 2.779 5.019 6.080 1.00 0.00 H new ATOM 0 HD3 LYS A 17 3.486 4.671 7.645 1.00 0.00 H new ATOM 0 HE2 LYS A 17 5.482 3.703 6.513 1.00 0.00 H new ATOM 0 HE3 LYS A 17 4.776 4.091 4.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 6.261 5.806 5.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 4.710 6.455 5.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 5.650 5.979 7.063 1.00 0.00 H new ATOM 176 N TRP A 18 1.934 0.474 10.901 1.00 0.00 N ATOM 177 CA TRP A 18 1.466 0.798 12.268 1.00 0.00 C ATOM 178 C TRP A 18 2.440 1.685 13.061 1.00 0.00 C ATOM 179 O TRP A 18 2.429 2.912 12.999 1.00 0.00 O ATOM 180 CB TRP A 18 0.905 -0.432 13.032 1.00 0.00 C ATOM 181 CG TRP A 18 -0.351 -1.010 12.402 1.00 0.00 C ATOM 182 CD1 TRP A 18 -0.620 -2.162 11.708 1.00 0.00 C ATOM 183 CD2 TRP A 18 -1.589 -0.317 12.543 1.00 0.00 C ATOM 184 NE1 TRP A 18 -1.973 -2.235 11.428 1.00 0.00 N ATOM 185 CE2 TRP A 18 -2.575 -1.100 11.940 1.00 0.00 C ATOM 186 CE3 TRP A 18 -1.871 0.870 13.150 1.00 0.00 C ATOM 187 CZ2 TRP A 18 -3.878 -0.694 11.934 1.00 0.00 C ATOM 188 CZ3 TRP A 18 -3.183 1.232 13.204 1.00 0.00 C ATOM 189 CH2 TRP A 18 -4.173 0.483 12.595 1.00 0.00 C ATOM 0 H TRP A 18 2.524 -0.355 10.831 1.00 0.00 H new ATOM 0 HA TRP A 18 0.595 1.441 12.143 1.00 0.00 H new ATOM 0 HB2 TRP A 18 1.672 -1.206 13.073 1.00 0.00 H new ATOM 0 HB3 TRP A 18 0.688 -0.144 14.060 1.00 0.00 H new ATOM 0 HD1 TRP A 18 0.114 -2.901 11.423 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -2.443 -2.992 10.932 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -1.093 1.492 13.567 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -4.645 -1.267 11.435 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -3.458 2.130 13.738 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -5.197 0.825 12.637 1.00 0.00 H new ATOM 200 N SER A 19 3.371 1.051 13.803 1.00 0.00 N ATOM 201 CA SER A 19 4.474 1.677 14.526 1.00 0.00 C ATOM 202 C SER A 19 5.660 1.224 13.696 1.00 0.00 C ATOM 203 O SER A 19 5.549 0.169 13.068 1.00 0.00 O ATOM 204 CB SER A 19 4.567 1.206 16.007 1.00 0.00 C ATOM 205 OG SER A 19 3.370 1.528 16.720 1.00 0.00 O ATOM 0 H SER A 19 3.365 0.037 13.913 1.00 0.00 H new ATOM 0 HA SER A 19 4.384 2.759 14.622 1.00 0.00 H new ATOM 0 HB2 SER A 19 4.737 0.130 16.041 1.00 0.00 H new ATOM 0 HB3 SER A 19 5.422 1.679 16.490 1.00 0.00 H new ATOM 0 HG SER A 19 3.449 1.222 17.648 1.00 0.00 H new ATOM 211 N SER A 20 6.795 1.988 13.595 1.00 0.00 N ATOM 212 CA SER A 20 7.874 1.677 12.637 1.00 0.00 C ATOM 213 C SER A 20 8.526 0.296 12.763 1.00 0.00 C ATOM 214 O SER A 20 9.258 -0.025 13.693 1.00 0.00 O ATOM 215 CB SER A 20 8.981 2.765 12.692 1.00 0.00 C ATOM 216 OG SER A 20 8.367 4.046 12.550 1.00 0.00 O ATOM 0 H SER A 20 6.972 2.814 14.167 1.00 0.00 H new ATOM 0 HA SER A 20 7.363 1.664 11.674 1.00 0.00 H new ATOM 0 HB2 SER A 20 9.522 2.707 13.637 1.00 0.00 H new ATOM 0 HB3 SER A 20 9.709 2.604 11.897 1.00 0.00 H new ATOM 0 HG SER A 20 9.054 4.744 12.585 1.00 0.00 H new ATOM 222 N ASN A 21 8.182 -0.536 11.756 1.00 0.00 N ATOM 223 CA ASN A 21 8.443 -1.956 11.650 1.00 0.00 C ATOM 224 C ASN A 21 9.331 -2.226 10.459 1.00 0.00 C ATOM 225 O ASN A 21 10.028 -3.231 10.374 1.00 0.00 O ATOM 226 CB ASN A 21 7.006 -2.587 11.552 1.00 0.00 C ATOM 227 CG ASN A 21 6.895 -4.093 11.306 1.00 0.00 C ATOM 228 OD1 ASN A 21 6.399 -4.504 10.252 1.00 0.00 O ATOM 229 ND2 ASN A 21 7.338 -4.928 12.278 1.00 0.00 N ATOM 0 H ASN A 21 7.676 -0.188 10.942 1.00 0.00 H new ATOM 0 HA ASN A 21 8.989 -2.388 12.489 1.00 0.00 H new ATOM 0 HB2 ASN A 21 6.479 -2.361 12.479 1.00 0.00 H new ATOM 0 HB3 ASN A 21 6.472 -2.078 10.749 1.00 0.00 H new ATOM 0 HD21 ASN A 21 7.268 -5.938 12.154 1.00 0.00 H new ATOM 0 HD22 ASN A 21 7.741 -4.546 13.134 1.00 0.00 H new ATOM 236 N GLY A 22 9.301 -1.269 9.515 1.00 0.00 N ATOM 237 CA GLY A 22 10.098 -1.226 8.310 1.00 0.00 C ATOM 238 C GLY A 22 9.344 -1.614 7.088 1.00 0.00 C ATOM 239 O GLY A 22 9.796 -1.270 6.012 1.00 0.00 O ATOM 0 H GLY A 22 8.678 -0.465 9.592 1.00 0.00 H new ATOM 0 HA2 GLY A 22 10.492 -0.218 8.180 1.00 0.00 H new ATOM 0 HA3 GLY A 22 10.954 -1.891 8.426 1.00 0.00 H new ATOM 243 N TYR A 23 8.176 -2.293 7.183 1.00 0.00 N ATOM 244 CA TYR A 23 7.285 -2.625 6.077 1.00 0.00 C ATOM 245 C TYR A 23 5.810 -2.380 6.367 1.00 0.00 C ATOM 246 O TYR A 23 5.384 -2.352 7.525 1.00 0.00 O ATOM 247 CB TYR A 23 7.622 -3.935 5.306 1.00 0.00 C ATOM 248 CG TYR A 23 8.297 -4.999 6.136 1.00 0.00 C ATOM 249 CD1 TYR A 23 7.610 -5.626 7.154 1.00 0.00 C ATOM 250 CD2 TYR A 23 9.585 -5.424 5.851 1.00 0.00 C ATOM 251 CE1 TYR A 23 8.175 -6.673 7.854 1.00 0.00 C ATOM 252 CE2 TYR A 23 10.154 -6.479 6.543 1.00 0.00 C ATOM 253 CZ TYR A 23 9.433 -7.130 7.524 1.00 0.00 C ATOM 254 OH TYR A 23 9.905 -8.316 8.129 1.00 0.00 O ATOM 0 H TYR A 23 7.826 -2.634 8.078 1.00 0.00 H new ATOM 0 HA TYR A 23 7.519 -1.873 5.324 1.00 0.00 H new ATOM 0 HB2 TYR A 23 6.700 -4.345 4.894 1.00 0.00 H new ATOM 0 HB3 TYR A 23 8.266 -3.688 4.462 1.00 0.00 H new ATOM 0 HD1 TYR A 23 6.614 -5.293 7.408 1.00 0.00 H new ATOM 0 HD2 TYR A 23 10.152 -4.925 5.079 1.00 0.00 H new ATOM 0 HE1 TYR A 23 7.630 -7.136 8.663 1.00 0.00 H new ATOM 0 HE2 TYR A 23 11.162 -6.793 6.316 1.00 0.00 H new ATOM 0 HH TYR A 23 10.081 -8.988 7.438 1.00 0.00 H new ATOM 264 N PHE A 24 5.019 -2.154 5.262 1.00 0.00 N ATOM 265 CA PHE A 24 3.584 -1.824 5.193 1.00 0.00 C ATOM 266 C PHE A 24 2.842 -2.924 4.457 1.00 0.00 C ATOM 267 O PHE A 24 3.314 -3.483 3.452 1.00 0.00 O ATOM 268 CB PHE A 24 3.178 -0.393 4.652 1.00 0.00 C ATOM 269 CG PHE A 24 4.306 0.586 4.551 1.00 0.00 C ATOM 270 CD1 PHE A 24 5.136 0.712 5.644 1.00 0.00 C ATOM 271 CD2 PHE A 24 4.489 1.462 3.483 1.00 0.00 C ATOM 272 CE1 PHE A 24 6.265 1.471 5.599 1.00 0.00 C ATOM 273 CE2 PHE A 24 5.630 2.201 3.416 1.00 0.00 C ATOM 274 CZ PHE A 24 6.490 2.224 4.477 1.00 0.00 C ATOM 0 H PHE A 24 5.423 -2.207 4.327 1.00 0.00 H new ATOM 0 HA PHE A 24 3.279 -1.764 6.238 1.00 0.00 H new ATOM 0 HB2 PHE A 24 2.727 -0.508 3.667 1.00 0.00 H new ATOM 0 HB3 PHE A 24 2.412 0.023 5.307 1.00 0.00 H new ATOM 0 HD1 PHE A 24 4.884 0.196 6.559 1.00 0.00 H new ATOM 0 HD2 PHE A 24 3.734 1.554 2.717 1.00 0.00 H new ATOM 0 HE1 PHE A 24 6.963 1.479 6.423 1.00 0.00 H new ATOM 0 HE2 PHE A 24 5.855 2.768 2.525 1.00 0.00 H new ATOM 0 HZ PHE A 24 7.368 2.851 4.430 1.00 0.00 H new ATOM 284 N TYR A 25 1.645 -3.190 5.040 1.00 0.00 N ATOM 285 CA TYR A 25 0.634 -4.193 4.773 1.00 0.00 C ATOM 286 C TYR A 25 -0.503 -3.605 3.939 1.00 0.00 C ATOM 287 O TYR A 25 -0.446 -2.480 3.453 1.00 0.00 O ATOM 288 CB TYR A 25 0.164 -4.804 6.134 1.00 0.00 C ATOM 289 CG TYR A 25 1.376 -5.203 6.961 1.00 0.00 C ATOM 290 CD1 TYR A 25 2.099 -6.342 6.651 1.00 0.00 C ATOM 291 CD2 TYR A 25 1.842 -4.397 7.994 1.00 0.00 C ATOM 292 CE1 TYR A 25 3.253 -6.655 7.341 1.00 0.00 C ATOM 293 CE2 TYR A 25 3.015 -4.697 8.668 1.00 0.00 C ATOM 294 CZ TYR A 25 3.724 -5.829 8.336 1.00 0.00 C ATOM 295 OH TYR A 25 4.923 -6.176 8.997 1.00 0.00 O ATOM 0 H TYR A 25 1.344 -2.607 5.821 1.00 0.00 H new ATOM 0 HA TYR A 25 1.044 -5.005 4.172 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -0.439 -4.079 6.681 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -0.468 -5.673 5.955 1.00 0.00 H new ATOM 0 HD1 TYR A 25 1.756 -6.993 5.860 1.00 0.00 H new ATOM 0 HD2 TYR A 25 1.279 -3.520 8.277 1.00 0.00 H new ATOM 0 HE1 TYR A 25 3.792 -7.558 7.097 1.00 0.00 H new ATOM 0 HE2 TYR A 25 3.372 -4.045 9.451 1.00 0.00 H new ATOM 0 HH TYR A 25 5.197 -5.441 9.584 1.00 0.00 H new ATOM 305 N SER A 26 -1.582 -4.359 3.657 1.00 0.00 N ATOM 306 CA SER A 26 -2.701 -3.928 2.816 1.00 0.00 C ATOM 307 C SER A 26 -3.746 -2.984 3.375 1.00 0.00 C ATOM 308 O SER A 26 -4.195 -3.143 4.500 1.00 0.00 O ATOM 309 CB SER A 26 -3.463 -5.269 2.450 1.00 0.00 C ATOM 310 OG SER A 26 -4.737 -5.184 1.775 1.00 0.00 O ATOM 0 H SER A 26 -1.697 -5.306 4.019 1.00 0.00 H new ATOM 0 HA SER A 26 -2.244 -3.347 2.015 1.00 0.00 H new ATOM 0 HB2 SER A 26 -2.798 -5.866 1.826 1.00 0.00 H new ATOM 0 HB3 SER A 26 -3.616 -5.824 3.375 1.00 0.00 H new ATOM 0 HG SER A 26 -4.674 -4.543 1.036 1.00 0.00 H new ATOM 316 N GLY A 27 -4.235 -2.056 2.508 1.00 0.00 N ATOM 317 CA GLY A 27 -5.464 -1.318 2.712 1.00 0.00 C ATOM 318 C GLY A 27 -6.323 -1.116 1.466 1.00 0.00 C ATOM 319 O GLY A 27 -5.858 -1.152 0.324 1.00 0.00 O ATOM 0 H GLY A 27 -3.760 -1.812 1.639 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -6.060 -1.838 3.462 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -5.216 -0.340 3.124 1.00 0.00 H new ATOM 323 N LYS A 28 -7.616 -0.769 1.715 1.00 0.00 N ATOM 324 CA LYS A 28 -8.622 -0.256 0.782 1.00 0.00 C ATOM 325 C LYS A 28 -9.451 0.795 1.540 1.00 0.00 C ATOM 326 O LYS A 28 -9.670 0.657 2.740 1.00 0.00 O ATOM 327 CB LYS A 28 -9.506 -1.325 0.089 1.00 0.00 C ATOM 328 CG LYS A 28 -10.312 -2.232 1.031 1.00 0.00 C ATOM 329 CD LYS A 28 -11.229 -3.202 0.274 1.00 0.00 C ATOM 330 CE LYS A 28 -12.020 -4.124 1.210 1.00 0.00 C ATOM 331 NZ LYS A 28 -12.806 -5.122 0.450 1.00 0.00 N ATOM 0 H LYS A 28 -7.999 -0.853 2.657 1.00 0.00 H new ATOM 0 HA LYS A 28 -8.098 0.186 -0.065 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -10.201 -0.818 -0.580 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -8.866 -1.953 -0.532 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -9.625 -2.801 1.657 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -10.914 -1.614 1.698 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -11.925 -2.632 -0.341 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -10.628 -3.808 -0.404 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -11.333 -4.636 1.884 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -12.689 -3.528 1.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -13.135 -5.869 1.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -13.626 -4.657 0.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -12.209 -5.543 -0.291 1.00 0.00 H new ATOM 345 N ILE A 29 -9.923 1.921 0.933 1.00 0.00 N ATOM 346 CA ILE A 29 -10.596 2.960 1.731 1.00 0.00 C ATOM 347 C ILE A 29 -12.131 2.907 1.799 1.00 0.00 C ATOM 348 O ILE A 29 -12.808 2.370 0.925 1.00 0.00 O ATOM 349 CB ILE A 29 -10.065 4.305 1.277 1.00 0.00 C ATOM 350 CG1 ILE A 29 -10.107 5.369 2.401 1.00 0.00 C ATOM 351 CG2 ILE A 29 -10.746 4.716 -0.043 1.00 0.00 C ATOM 352 CD1 ILE A 29 -9.105 6.499 2.204 1.00 0.00 C ATOM 0 H ILE A 29 -9.850 2.119 -0.065 1.00 0.00 H new ATOM 0 HA ILE A 29 -10.346 2.767 2.774 1.00 0.00 H new ATOM 0 HB ILE A 29 -9.001 4.219 1.058 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -11.111 5.790 2.455 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -9.912 4.884 3.357 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -10.361 5.683 -0.365 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -10.537 3.969 -0.809 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -11.823 4.787 0.110 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -9.189 7.208 3.028 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -8.095 6.090 2.180 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -9.312 7.009 1.263 1.00 0.00 H new ATOM 364 N THR A 30 -12.724 3.487 2.875 1.00 0.00 N ATOM 365 CA THR A 30 -14.174 3.630 3.032 1.00 0.00 C ATOM 366 C THR A 30 -14.540 5.111 2.924 1.00 0.00 C ATOM 367 O THR A 30 -15.445 5.479 2.175 1.00 0.00 O ATOM 368 CB THR A 30 -14.694 2.994 4.323 1.00 0.00 C ATOM 369 OG1 THR A 30 -14.218 1.657 4.409 1.00 0.00 O ATOM 370 CG2 THR A 30 -16.236 2.934 4.383 1.00 0.00 C ATOM 0 H THR A 30 -12.194 3.868 3.659 1.00 0.00 H new ATOM 0 HA THR A 30 -14.668 3.082 2.230 1.00 0.00 H new ATOM 0 HB THR A 30 -14.337 3.616 5.144 1.00 0.00 H new ATOM 0 HG1 THR A 30 -14.547 1.245 5.235 1.00 0.00 H new ATOM 0 HG21 THR A 30 -16.546 2.473 5.321 1.00 0.00 H new ATOM 0 HG22 THR A 30 -16.642 3.944 4.323 1.00 0.00 H new ATOM 0 HG23 THR A 30 -16.610 2.343 3.547 1.00 0.00 H new ATOM 378 N ARG A 31 -13.839 6.009 3.688 1.00 0.00 N ATOM 379 CA ARG A 31 -14.128 7.437 3.720 1.00 0.00 C ATOM 380 C ARG A 31 -12.812 8.045 4.175 1.00 0.00 C ATOM 381 O ARG A 31 -11.916 7.326 4.601 1.00 0.00 O ATOM 382 CB ARG A 31 -15.174 7.859 4.817 1.00 0.00 C ATOM 383 CG ARG A 31 -16.570 7.206 4.806 1.00 0.00 C ATOM 384 CD ARG A 31 -17.356 7.565 6.081 1.00 0.00 C ATOM 385 NE ARG A 31 -17.717 9.025 6.037 1.00 0.00 N ATOM 386 CZ ARG A 31 -18.236 9.702 7.109 1.00 0.00 C ATOM 387 NH1 ARG A 31 -18.458 9.068 8.296 1.00 0.00 N ATOM 388 NH2 ARG A 31 -18.533 11.028 6.985 1.00 0.00 N ATOM 0 H ARG A 31 -13.062 5.738 4.290 1.00 0.00 H new ATOM 0 HA ARG A 31 -14.525 7.746 2.753 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -14.726 7.663 5.791 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -15.314 8.937 4.741 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -17.124 7.537 3.928 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -16.469 6.123 4.729 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -18.257 6.956 6.152 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -16.756 7.352 6.966 1.00 0.00 H new ATOM 0 HE ARG A 31 -17.568 9.536 5.167 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -18.237 8.077 8.394 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -18.845 9.585 9.086 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -18.368 11.507 6.100 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -18.920 11.540 7.778 1.00 0.00 H new ATOM 402 N ASP A 32 -12.648 9.387 4.186 1.00 0.00 N ATOM 403 CA ASP A 32 -11.524 10.057 4.862 1.00 0.00 C ATOM 404 C ASP A 32 -11.907 10.400 6.320 1.00 0.00 C ATOM 405 O ASP A 32 -13.087 10.482 6.663 1.00 0.00 O ATOM 406 CB ASP A 32 -11.006 11.330 4.113 1.00 0.00 C ATOM 407 CG ASP A 32 -12.070 12.413 3.864 1.00 0.00 C ATOM 408 OD1 ASP A 32 -13.062 12.128 3.143 1.00 0.00 O ATOM 409 OD2 ASP A 32 -11.892 13.543 4.394 1.00 0.00 O ATOM 0 H ASP A 32 -13.292 10.031 3.726 1.00 0.00 H new ATOM 0 HA ASP A 32 -10.695 9.349 4.855 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -10.192 11.767 4.691 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -10.588 11.024 3.154 1.00 0.00 H new ATOM 414 N VAL A 33 -10.923 10.635 7.220 1.00 0.00 N ATOM 415 CA VAL A 33 -11.200 11.103 8.577 1.00 0.00 C ATOM 416 C VAL A 33 -10.453 12.428 8.627 1.00 0.00 C ATOM 417 O VAL A 33 -9.267 12.485 8.352 1.00 0.00 O ATOM 418 CB VAL A 33 -10.932 10.123 9.766 1.00 0.00 C ATOM 419 CG1 VAL A 33 -12.319 9.687 10.285 1.00 0.00 C ATOM 420 CG2 VAL A 33 -10.066 8.871 9.458 1.00 0.00 C ATOM 0 H VAL A 33 -9.932 10.504 7.019 1.00 0.00 H new ATOM 0 HA VAL A 33 -12.272 11.199 8.747 1.00 0.00 H new ATOM 0 HB VAL A 33 -10.331 10.665 10.496 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -12.195 8.998 11.120 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -12.875 10.564 10.617 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -12.868 9.191 9.484 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -9.955 8.274 10.363 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -10.552 8.273 8.687 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -9.083 9.186 9.108 1.00 0.00 H new ATOM 430 N GLY A 34 -11.153 13.549 8.923 1.00 0.00 N ATOM 431 CA GLY A 34 -10.722 14.971 8.951 1.00 0.00 C ATOM 432 C GLY A 34 -9.517 15.472 8.141 1.00 0.00 C ATOM 433 O GLY A 34 -9.503 15.446 6.913 1.00 0.00 O ATOM 0 H GLY A 34 -12.138 13.473 9.175 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -11.580 15.566 8.638 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -10.525 15.219 9.994 1.00 0.00 H new ATOM 437 N ALA A 35 -8.484 15.975 8.861 1.00 0.00 N ATOM 438 CA ALA A 35 -7.162 16.371 8.394 1.00 0.00 C ATOM 439 C ALA A 35 -6.136 15.357 8.830 1.00 0.00 C ATOM 440 O ALA A 35 -5.968 15.101 10.021 1.00 0.00 O ATOM 441 CB ALA A 35 -6.805 17.777 8.928 1.00 0.00 C ATOM 0 H ALA A 35 -8.578 16.120 9.866 1.00 0.00 H new ATOM 0 HA ALA A 35 -7.167 16.411 7.305 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -5.815 18.061 8.572 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -7.540 18.499 8.571 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -6.808 17.764 10.018 1.00 0.00 H new ATOM 447 N GLY A 36 -5.406 14.776 7.847 1.00 0.00 N ATOM 448 CA GLY A 36 -4.320 13.838 8.043 1.00 0.00 C ATOM 449 C GLY A 36 -4.747 12.408 8.135 1.00 0.00 C ATOM 450 O GLY A 36 -3.893 11.529 8.127 1.00 0.00 O ATOM 0 H GLY A 36 -5.581 14.969 6.861 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -3.614 13.941 7.219 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -3.786 14.104 8.955 1.00 0.00 H new ATOM 454 N LYS A 37 -6.062 12.118 8.262 1.00 0.00 N ATOM 455 CA LYS A 37 -6.549 10.773 8.490 1.00 0.00 C ATOM 456 C LYS A 37 -7.391 10.176 7.353 1.00 0.00 C ATOM 457 O LYS A 37 -7.938 10.839 6.473 1.00 0.00 O ATOM 458 CB LYS A 37 -7.072 10.598 9.965 1.00 0.00 C ATOM 459 CG LYS A 37 -7.454 11.808 10.834 1.00 0.00 C ATOM 460 CD LYS A 37 -8.029 11.303 12.170 1.00 0.00 C ATOM 461 CE LYS A 37 -8.736 12.384 12.997 1.00 0.00 C ATOM 462 NZ LYS A 37 -9.945 12.895 12.310 1.00 0.00 N ATOM 0 H LYS A 37 -6.799 12.820 8.207 1.00 0.00 H new ATOM 0 HA LYS A 37 -5.694 10.100 8.429 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -7.951 9.955 9.915 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -6.305 10.047 10.509 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -6.580 12.434 11.013 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -8.188 12.426 10.317 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -8.734 10.496 11.968 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -7.220 10.878 12.764 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -9.015 11.975 13.968 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -8.047 13.208 13.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -10.461 13.535 12.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -9.665 13.412 11.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -10.559 12.097 12.049 1.00 0.00 H new ATOM 476 N TYR A 38 -7.501 8.810 7.366 1.00 0.00 N ATOM 477 CA TYR A 38 -8.196 7.935 6.421 1.00 0.00 C ATOM 478 C TYR A 38 -9.000 6.880 7.212 1.00 0.00 C ATOM 479 O TYR A 38 -8.542 6.416 8.257 1.00 0.00 O ATOM 480 CB TYR A 38 -7.129 7.275 5.512 1.00 0.00 C ATOM 481 CG TYR A 38 -6.348 8.355 4.774 1.00 0.00 C ATOM 482 CD1 TYR A 38 -6.963 9.281 3.952 1.00 0.00 C ATOM 483 CD2 TYR A 38 -4.997 8.525 5.023 1.00 0.00 C ATOM 484 CE1 TYR A 38 -6.266 10.400 3.525 1.00 0.00 C ATOM 485 CE2 TYR A 38 -4.248 9.536 4.444 1.00 0.00 C ATOM 486 CZ TYR A 38 -4.919 10.548 3.789 1.00 0.00 C ATOM 487 OH TYR A 38 -4.246 11.714 3.341 1.00 0.00 O ATOM 0 H TYR A 38 -7.061 8.267 8.109 1.00 0.00 H new ATOM 0 HA TYR A 38 -8.897 8.492 5.799 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -6.451 6.667 6.112 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -7.609 6.606 4.797 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -7.987 9.132 3.643 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -4.506 7.840 5.698 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -6.786 11.171 2.975 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -3.170 9.532 4.504 1.00 0.00 H new ATOM 0 HH TYR A 38 -4.294 12.406 4.033 1.00 0.00 H new ATOM 497 N LYS A 39 -10.260 6.509 6.791 1.00 0.00 N ATOM 498 CA LYS A 39 -11.205 5.578 7.434 1.00 0.00 C ATOM 499 C LYS A 39 -11.235 4.483 6.436 1.00 0.00 C ATOM 500 O LYS A 39 -11.628 4.598 5.266 1.00 0.00 O ATOM 501 CB LYS A 39 -12.595 6.235 7.680 1.00 0.00 C ATOM 502 CG LYS A 39 -13.836 5.320 7.642 1.00 0.00 C ATOM 503 CD LYS A 39 -13.890 4.207 8.701 1.00 0.00 C ATOM 504 CE LYS A 39 -15.034 3.228 8.422 1.00 0.00 C ATOM 505 NZ LYS A 39 -16.358 3.872 8.577 1.00 0.00 N ATOM 0 H LYS A 39 -10.650 6.892 5.930 1.00 0.00 H new ATOM 0 HA LYS A 39 -10.920 5.248 8.433 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -12.568 6.723 8.654 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -12.733 7.018 6.935 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -14.724 5.942 7.753 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -13.891 4.858 6.656 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -12.943 3.668 8.714 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -14.019 4.648 9.689 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -14.937 2.835 7.410 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -14.961 2.379 9.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -17.107 3.173 8.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -16.454 4.240 9.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -16.445 4.655 7.898 1.00 0.00 H new ATOM 519 N LEU A 40 -10.631 3.391 6.910 1.00 0.00 N ATOM 520 CA LEU A 40 -10.204 2.362 6.002 1.00 0.00 C ATOM 521 C LEU A 40 -10.532 0.966 6.397 1.00 0.00 C ATOM 522 O LEU A 40 -10.769 0.640 7.555 1.00 0.00 O ATOM 523 CB LEU A 40 -8.684 2.577 5.802 1.00 0.00 C ATOM 524 CG LEU A 40 -7.755 2.211 6.994 1.00 0.00 C ATOM 525 CD1 LEU A 40 -8.290 2.366 8.411 1.00 0.00 C ATOM 526 CD2 LEU A 40 -7.228 0.778 6.833 1.00 0.00 C ATOM 0 H LEU A 40 -10.437 3.212 7.895 1.00 0.00 H new ATOM 0 HA LEU A 40 -10.765 2.463 5.073 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -8.370 1.993 4.937 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -8.520 3.626 5.555 1.00 0.00 H new ATOM 0 HG LEU A 40 -6.980 2.974 6.918 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -7.521 2.070 9.125 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -8.565 3.406 8.584 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -9.168 1.732 8.540 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -6.579 0.533 7.673 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -8.067 0.083 6.808 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -6.664 0.700 5.904 1.00 0.00 H new ATOM 538 N LEU A 41 -10.499 0.044 5.433 1.00 0.00 N ATOM 539 CA LEU A 41 -10.591 -1.361 5.728 1.00 0.00 C ATOM 540 C LEU A 41 -9.461 -2.049 5.037 1.00 0.00 C ATOM 541 O LEU A 41 -9.015 -1.588 4.007 1.00 0.00 O ATOM 542 CB LEU A 41 -12.055 -1.689 5.475 1.00 0.00 C ATOM 543 CG LEU A 41 -12.590 -3.051 5.961 1.00 0.00 C ATOM 544 CD1 LEU A 41 -14.073 -2.987 6.367 1.00 0.00 C ATOM 545 CD2 LEU A 41 -12.521 -4.068 4.830 1.00 0.00 C ATOM 0 H LEU A 41 -10.408 0.261 4.440 1.00 0.00 H new ATOM 0 HA LEU A 41 -10.420 -1.725 6.741 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -12.657 -0.909 5.942 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -12.230 -1.627 4.401 1.00 0.00 H new ATOM 0 HG LEU A 41 -11.974 -3.328 6.817 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -14.401 -3.971 6.702 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -14.198 -2.268 7.177 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -14.672 -2.677 5.511 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -12.900 -5.028 5.180 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -13.127 -3.722 3.992 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -11.486 -4.183 4.507 1.00 0.00 H new ATOM 557 N PHE A 42 -8.878 -3.178 5.509 1.00 0.00 N ATOM 558 CA PHE A 42 -7.798 -3.850 4.748 1.00 0.00 C ATOM 559 C PHE A 42 -8.420 -4.732 3.655 1.00 0.00 C ATOM 560 O PHE A 42 -9.551 -5.169 3.825 1.00 0.00 O ATOM 561 CB PHE A 42 -6.895 -4.773 5.640 1.00 0.00 C ATOM 562 CG PHE A 42 -6.035 -4.075 6.684 1.00 0.00 C ATOM 563 CD1 PHE A 42 -6.143 -2.743 7.074 1.00 0.00 C ATOM 564 CD2 PHE A 42 -5.052 -4.840 7.293 1.00 0.00 C ATOM 565 CE1 PHE A 42 -5.305 -2.209 8.032 1.00 0.00 C ATOM 566 CE2 PHE A 42 -4.192 -4.300 8.230 1.00 0.00 C ATOM 567 CZ PHE A 42 -4.317 -2.979 8.597 1.00 0.00 C ATOM 0 H PHE A 42 -9.128 -3.632 6.388 1.00 0.00 H new ATOM 0 HA PHE A 42 -7.174 -3.058 4.334 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -7.538 -5.489 6.151 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -6.239 -5.345 4.984 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -6.896 -2.116 6.619 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -4.956 -5.883 7.029 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -5.426 -1.181 8.339 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -3.422 -4.914 8.674 1.00 0.00 H new ATOM 0 HZ PHE A 42 -3.643 -2.551 9.324 1.00 0.00 H new ATOM 577 N ASP A 43 -7.740 -5.124 2.528 1.00 0.00 N ATOM 578 CA ASP A 43 -8.326 -6.025 1.486 1.00 0.00 C ATOM 579 C ASP A 43 -8.631 -7.457 1.966 1.00 0.00 C ATOM 580 O ASP A 43 -9.255 -8.264 1.285 1.00 0.00 O ATOM 581 CB ASP A 43 -7.488 -6.124 0.174 1.00 0.00 C ATOM 582 CG ASP A 43 -7.464 -4.776 -0.548 1.00 0.00 C ATOM 583 OD1 ASP A 43 -8.419 -4.512 -1.326 1.00 0.00 O ATOM 584 OD2 ASP A 43 -6.492 -4.003 -0.349 1.00 0.00 O ATOM 0 H ASP A 43 -6.786 -4.828 2.322 1.00 0.00 H new ATOM 0 HA ASP A 43 -9.268 -5.521 1.271 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -6.470 -6.436 0.408 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -7.913 -6.886 -0.479 1.00 0.00 H new ATOM 589 N ASP A 44 -8.214 -7.719 3.221 1.00 0.00 N ATOM 590 CA ASP A 44 -8.411 -8.887 4.039 1.00 0.00 C ATOM 591 C ASP A 44 -9.446 -8.670 5.179 1.00 0.00 C ATOM 592 O ASP A 44 -9.781 -9.627 5.869 1.00 0.00 O ATOM 593 CB ASP A 44 -7.005 -9.416 4.470 1.00 0.00 C ATOM 594 CG ASP A 44 -6.212 -8.459 5.377 1.00 0.00 C ATOM 595 OD1 ASP A 44 -6.566 -8.334 6.579 1.00 0.00 O ATOM 596 OD2 ASP A 44 -5.230 -7.851 4.872 1.00 0.00 O ATOM 0 H ASP A 44 -7.668 -7.021 3.726 1.00 0.00 H new ATOM 0 HA ASP A 44 -8.892 -9.681 3.468 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -7.132 -10.366 4.989 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -6.417 -9.618 3.575 1.00 0.00 H new ATOM 601 N GLY A 45 -10.035 -7.437 5.387 1.00 0.00 N ATOM 602 CA GLY A 45 -11.179 -7.188 6.278 1.00 0.00 C ATOM 603 C GLY A 45 -10.951 -6.624 7.655 1.00 0.00 C ATOM 604 O GLY A 45 -11.864 -6.638 8.474 1.00 0.00 O ATOM 0 H GLY A 45 -9.705 -6.591 4.922 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -11.854 -6.509 5.757 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -11.708 -8.133 6.398 1.00 0.00 H new ATOM 608 N TYR A 46 -9.752 -6.087 7.968 1.00 0.00 N ATOM 609 CA TYR A 46 -9.428 -5.458 9.247 1.00 0.00 C ATOM 610 C TYR A 46 -9.535 -3.933 9.093 1.00 0.00 C ATOM 611 O TYR A 46 -8.706 -3.293 8.454 1.00 0.00 O ATOM 612 CB TYR A 46 -8.014 -5.928 9.720 1.00 0.00 C ATOM 613 CG TYR A 46 -7.673 -5.519 11.135 1.00 0.00 C ATOM 614 CD1 TYR A 46 -8.060 -6.300 12.209 1.00 0.00 C ATOM 615 CD2 TYR A 46 -6.968 -4.350 11.376 1.00 0.00 C ATOM 616 CE1 TYR A 46 -7.761 -5.916 13.502 1.00 0.00 C ATOM 617 CE2 TYR A 46 -6.676 -3.957 12.669 1.00 0.00 C ATOM 618 CZ TYR A 46 -7.075 -4.741 13.733 1.00 0.00 C ATOM 619 OH TYR A 46 -6.785 -4.346 15.056 1.00 0.00 O ATOM 0 H TYR A 46 -8.969 -6.084 7.315 1.00 0.00 H new ATOM 0 HA TYR A 46 -10.134 -5.759 10.021 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -7.958 -7.014 9.643 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -7.262 -5.522 9.044 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -8.601 -7.218 12.035 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -6.644 -3.740 10.546 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -8.064 -6.536 14.333 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -6.137 -3.038 12.846 1.00 0.00 H new ATOM 0 HH TYR A 46 -6.296 -3.497 15.044 1.00 0.00 H new ATOM 629 N GLU A 47 -10.582 -3.302 9.682 1.00 0.00 N ATOM 630 CA GLU A 47 -10.846 -1.859 9.625 1.00 0.00 C ATOM 631 C GLU A 47 -10.485 -1.091 10.876 1.00 0.00 C ATOM 632 O GLU A 47 -10.363 -1.637 11.972 1.00 0.00 O ATOM 633 CB GLU A 47 -12.326 -1.585 9.201 1.00 0.00 C ATOM 634 CG GLU A 47 -12.985 -0.209 9.481 1.00 0.00 C ATOM 635 CD GLU A 47 -14.312 -0.122 8.735 1.00 0.00 C ATOM 636 OE1 GLU A 47 -14.290 0.235 7.527 1.00 0.00 O ATOM 637 OE2 GLU A 47 -15.366 -0.411 9.362 1.00 0.00 O ATOM 0 H GLU A 47 -11.282 -3.808 10.224 1.00 0.00 H new ATOM 0 HA GLU A 47 -10.169 -1.475 8.862 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -12.390 -1.759 8.127 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -12.944 -2.342 9.684 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -13.148 -0.082 10.551 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -12.322 0.596 9.162 1.00 0.00 H new ATOM 644 N CYS A 48 -10.324 0.250 10.697 1.00 0.00 N ATOM 645 CA CYS A 48 -10.019 1.159 11.780 1.00 0.00 C ATOM 646 C CYS A 48 -10.314 2.517 11.193 1.00 0.00 C ATOM 647 O CYS A 48 -10.643 2.633 10.009 1.00 0.00 O ATOM 648 CB CYS A 48 -8.527 1.049 12.262 1.00 0.00 C ATOM 649 SG CYS A 48 -8.191 1.722 13.934 1.00 0.00 S ATOM 0 H CYS A 48 -10.407 0.707 9.789 1.00 0.00 H new ATOM 0 HA CYS A 48 -10.603 0.942 12.674 1.00 0.00 H new ATOM 0 HB2 CYS A 48 -8.234 -0.001 12.245 1.00 0.00 H new ATOM 0 HB3 CYS A 48 -7.892 1.569 11.545 1.00 0.00 H new ATOM 0 HG CYS A 48 -8.202 3.021 13.889 1.00 0.00 H new ATOM 655 N ASP A 49 -10.145 3.598 11.984 1.00 0.00 N ATOM 656 CA ASP A 49 -10.040 4.945 11.446 1.00 0.00 C ATOM 657 C ASP A 49 -8.661 5.287 11.944 1.00 0.00 C ATOM 658 O ASP A 49 -8.365 5.046 13.118 1.00 0.00 O ATOM 659 CB ASP A 49 -10.921 6.064 12.083 1.00 0.00 C ATOM 660 CG ASP A 49 -12.400 5.822 11.795 1.00 0.00 C ATOM 661 OD1 ASP A 49 -12.938 4.787 12.270 1.00 0.00 O ATOM 662 OD2 ASP A 49 -13.024 6.678 11.115 1.00 0.00 O ATOM 0 H ASP A 49 -10.080 3.549 13.001 1.00 0.00 H new ATOM 0 HA ASP A 49 -10.306 4.928 10.389 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -10.756 6.093 13.160 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -10.624 7.036 11.688 1.00 0.00 H new ATOM 667 N VAL A 50 -7.769 5.822 11.093 1.00 0.00 N ATOM 668 CA VAL A 50 -6.414 6.081 11.511 1.00 0.00 C ATOM 669 C VAL A 50 -5.874 7.269 10.812 1.00 0.00 C ATOM 670 O VAL A 50 -6.426 7.734 9.817 1.00 0.00 O ATOM 671 CB VAL A 50 -5.454 4.924 11.228 1.00 0.00 C ATOM 672 CG1 VAL A 50 -5.593 3.882 12.344 1.00 0.00 C ATOM 673 CG2 VAL A 50 -5.793 4.351 9.839 1.00 0.00 C ATOM 0 H VAL A 50 -7.975 6.075 10.127 1.00 0.00 H new ATOM 0 HA VAL A 50 -6.473 6.233 12.589 1.00 0.00 H new ATOM 0 HB VAL A 50 -4.414 5.251 11.216 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -4.913 3.052 12.153 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -5.347 4.340 13.302 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -6.618 3.513 12.371 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -5.121 3.523 9.613 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -6.823 3.994 9.834 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -5.675 5.130 9.085 1.00 0.00 H new ATOM 683 N LEU A 51 -4.711 7.756 11.333 1.00 0.00 N ATOM 684 CA LEU A 51 -3.906 8.843 10.806 1.00 0.00 C ATOM 685 C LEU A 51 -3.032 8.355 9.689 1.00 0.00 C ATOM 686 O LEU A 51 -2.607 7.205 9.652 1.00 0.00 O ATOM 687 CB LEU A 51 -3.165 9.515 12.003 1.00 0.00 C ATOM 688 CG LEU A 51 -2.837 11.028 11.976 1.00 0.00 C ATOM 689 CD1 LEU A 51 -1.848 11.488 10.908 1.00 0.00 C ATOM 690 CD2 LEU A 51 -4.104 11.879 11.924 1.00 0.00 C ATOM 0 H LEU A 51 -4.307 7.361 12.182 1.00 0.00 H new ATOM 0 HA LEU A 51 -4.513 9.619 10.341 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -3.763 9.332 12.895 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -2.222 8.984 12.137 1.00 0.00 H new ATOM 0 HG LEU A 51 -2.317 11.185 12.921 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -1.699 12.565 10.990 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -0.895 10.978 11.051 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -2.242 11.250 9.920 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -3.833 12.935 11.906 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -4.670 11.635 11.025 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -4.715 11.676 12.804 1.00 0.00 H new ATOM 702 N GLY A 52 -2.866 9.168 8.618 1.00 0.00 N ATOM 703 CA GLY A 52 -2.482 8.638 7.323 1.00 0.00 C ATOM 704 C GLY A 52 -1.005 8.473 7.148 1.00 0.00 C ATOM 705 O GLY A 52 -0.509 8.182 6.083 1.00 0.00 O ATOM 0 H GLY A 52 -2.994 10.180 8.642 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -2.965 7.671 7.179 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -2.858 9.301 6.544 1.00 0.00 H new ATOM 709 N LYS A 53 -0.191 8.667 8.220 1.00 0.00 N ATOM 710 CA LYS A 53 1.223 8.284 8.227 1.00 0.00 C ATOM 711 C LYS A 53 1.305 6.828 8.690 1.00 0.00 C ATOM 712 O LYS A 53 2.372 6.249 8.836 1.00 0.00 O ATOM 713 CB LYS A 53 2.171 9.210 9.067 1.00 0.00 C ATOM 714 CG LYS A 53 1.612 9.892 10.338 1.00 0.00 C ATOM 715 CD LYS A 53 1.102 8.994 11.489 1.00 0.00 C ATOM 716 CE LYS A 53 2.122 8.017 12.104 1.00 0.00 C ATOM 717 NZ LYS A 53 3.263 8.735 12.712 1.00 0.00 N ATOM 0 H LYS A 53 -0.506 9.092 9.092 1.00 0.00 H new ATOM 0 HA LYS A 53 1.598 8.406 7.211 1.00 0.00 H new ATOM 0 HB2 LYS A 53 3.035 8.615 9.364 1.00 0.00 H new ATOM 0 HB3 LYS A 53 2.537 9.995 8.405 1.00 0.00 H new ATOM 0 HG2 LYS A 53 2.394 10.536 10.741 1.00 0.00 H new ATOM 0 HG3 LYS A 53 0.790 10.540 10.033 1.00 0.00 H new ATOM 0 HD2 LYS A 53 0.726 9.639 12.283 1.00 0.00 H new ATOM 0 HD3 LYS A 53 0.255 8.415 11.120 1.00 0.00 H new ATOM 0 HE2 LYS A 53 1.631 7.406 12.861 1.00 0.00 H new ATOM 0 HE3 LYS A 53 2.487 7.338 11.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 3.930 8.047 13.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 3.746 9.299 11.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 2.916 9.364 13.464 1.00 0.00 H new ATOM 731 N ASP A 54 0.110 6.213 8.917 1.00 0.00 N ATOM 732 CA ASP A 54 -0.192 4.845 9.253 1.00 0.00 C ATOM 733 C ASP A 54 -0.891 4.221 8.046 1.00 0.00 C ATOM 734 O ASP A 54 -0.257 3.583 7.217 1.00 0.00 O ATOM 735 CB ASP A 54 -1.051 4.655 10.545 1.00 0.00 C ATOM 736 CG ASP A 54 -0.412 5.373 11.734 1.00 0.00 C ATOM 737 OD1 ASP A 54 0.751 5.031 12.070 1.00 0.00 O ATOM 738 OD2 ASP A 54 -1.081 6.264 12.322 1.00 0.00 O ATOM 0 H ASP A 54 -0.751 6.757 8.854 1.00 0.00 H new ATOM 0 HA ASP A 54 0.750 4.349 9.485 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -2.056 5.042 10.379 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -1.151 3.593 10.767 1.00 0.00 H new ATOM 743 N ILE A 55 -2.235 4.347 7.884 1.00 0.00 N ATOM 744 CA ILE A 55 -2.960 3.727 6.758 1.00 0.00 C ATOM 745 C ILE A 55 -3.535 4.798 5.810 1.00 0.00 C ATOM 746 O ILE A 55 -4.485 5.492 6.158 1.00 0.00 O ATOM 747 CB ILE A 55 -3.994 2.659 7.136 1.00 0.00 C ATOM 748 CG1 ILE A 55 -3.594 1.473 8.089 1.00 0.00 C ATOM 749 CG2 ILE A 55 -4.460 2.031 5.794 1.00 0.00 C ATOM 750 CD1 ILE A 55 -2.478 1.565 9.147 1.00 0.00 C ATOM 0 H ILE A 55 -2.832 4.873 8.522 1.00 0.00 H new ATOM 0 HA ILE A 55 -2.203 3.157 6.220 1.00 0.00 H new ATOM 0 HB ILE A 55 -4.731 3.201 7.728 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -4.501 1.192 8.625 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -3.334 0.635 7.442 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -5.202 1.258 5.992 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -4.901 2.804 5.164 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -3.605 1.590 5.282 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -2.397 0.614 9.674 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -1.530 1.790 8.658 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -2.716 2.356 9.859 1.00 0.00 H new ATOM 762 N LEU A 56 -2.896 4.970 4.618 1.00 0.00 N ATOM 763 CA LEU A 56 -3.094 6.032 3.618 1.00 0.00 C ATOM 764 C LEU A 56 -3.209 5.727 2.173 1.00 0.00 C ATOM 765 O LEU A 56 -2.688 4.696 1.774 1.00 0.00 O ATOM 766 CB LEU A 56 -2.053 7.137 3.653 1.00 0.00 C ATOM 767 CG LEU A 56 -0.591 6.836 3.235 1.00 0.00 C ATOM 768 CD1 LEU A 56 0.140 6.045 4.275 1.00 0.00 C ATOM 769 CD2 LEU A 56 -0.173 6.303 1.829 1.00 0.00 C ATOM 0 H LEU A 56 -2.176 4.313 4.319 1.00 0.00 H new ATOM 0 HA LEU A 56 -4.086 6.299 3.983 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -2.414 7.943 3.014 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -2.026 7.525 4.671 1.00 0.00 H new ATOM 0 HG LEU A 56 -0.301 7.882 3.137 1.00 0.00 H new ATOM 0 HD11 LEU A 56 1.160 5.858 3.939 1.00 0.00 H new ATOM 0 HD12 LEU A 56 0.163 6.606 5.209 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.370 5.095 4.434 1.00 0.00 H new ATOM 0 HD21 LEU A 56 0.909 6.176 1.795 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -0.657 5.344 1.645 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -0.479 7.016 1.064 1.00 0.00 H new ATOM 781 N LEU A 57 -3.762 6.710 1.376 1.00 0.00 N ATOM 782 CA LEU A 57 -3.867 6.883 -0.064 1.00 0.00 C ATOM 783 C LEU A 57 -2.585 6.685 -0.838 1.00 0.00 C ATOM 784 O LEU A 57 -1.646 7.465 -0.913 1.00 0.00 O ATOM 785 CB LEU A 57 -4.236 8.407 -0.263 1.00 0.00 C ATOM 786 CG LEU A 57 -3.800 9.485 0.767 1.00 0.00 C ATOM 787 CD1 LEU A 57 -2.307 9.631 0.999 1.00 0.00 C ATOM 788 CD2 LEU A 57 -4.317 10.851 0.282 1.00 0.00 C ATOM 0 H LEU A 57 -4.203 7.506 1.836 1.00 0.00 H new ATOM 0 HA LEU A 57 -4.579 6.143 -0.429 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -3.831 8.708 -1.229 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -5.322 8.463 -0.341 1.00 0.00 H new ATOM 0 HG LEU A 57 -4.222 9.152 1.715 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -2.128 10.413 1.737 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -1.902 8.687 1.364 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -1.818 9.898 0.062 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -4.022 11.624 0.991 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -3.892 11.075 -0.696 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -5.404 10.823 0.207 1.00 0.00 H new ATOM 800 N CYS A 58 -2.528 5.509 -1.447 1.00 0.00 N ATOM 801 CA CYS A 58 -1.409 4.933 -2.059 1.00 0.00 C ATOM 802 C CYS A 58 -1.507 5.020 -3.575 1.00 0.00 C ATOM 803 O CYS A 58 -2.515 5.327 -4.205 1.00 0.00 O ATOM 804 CB CYS A 58 -1.406 3.481 -1.419 1.00 0.00 C ATOM 805 SG CYS A 58 -2.229 2.097 -2.280 1.00 0.00 S ATOM 0 H CYS A 58 -3.349 4.908 -1.514 1.00 0.00 H new ATOM 0 HA CYS A 58 -0.453 5.428 -1.886 1.00 0.00 H new ATOM 0 HB2 CYS A 58 -0.365 3.196 -1.270 1.00 0.00 H new ATOM 0 HB3 CYS A 58 -1.859 3.562 -0.431 1.00 0.00 H new ATOM 0 HG CYS A 58 -2.665 1.240 -1.405 1.00 0.00 H new ATOM 811 N ASP A 59 -0.375 4.620 -4.124 1.00 0.00 N ATOM 812 CA ASP A 59 -0.054 4.243 -5.507 1.00 0.00 C ATOM 813 C ASP A 59 -0.049 2.705 -5.592 1.00 0.00 C ATOM 814 O ASP A 59 -0.697 2.209 -6.503 1.00 0.00 O ATOM 815 CB ASP A 59 1.244 4.863 -6.153 1.00 0.00 C ATOM 816 CG ASP A 59 0.911 6.219 -6.782 1.00 0.00 C ATOM 817 OD1 ASP A 59 0.511 7.143 -6.023 1.00 0.00 O ATOM 818 OD2 ASP A 59 1.056 6.348 -8.027 1.00 0.00 O ATOM 0 H ASP A 59 0.457 4.538 -3.540 1.00 0.00 H new ATOM 0 HA ASP A 59 -0.836 4.691 -6.120 1.00 0.00 H new ATOM 0 HB2 ASP A 59 2.017 4.983 -5.394 1.00 0.00 H new ATOM 0 HB3 ASP A 59 1.643 4.188 -6.910 1.00 0.00 H new ATOM 823 N PRO A 60 0.549 1.848 -4.714 1.00 0.00 N ATOM 824 CA PRO A 60 1.178 2.131 -3.419 1.00 0.00 C ATOM 825 C PRO A 60 2.483 2.836 -3.519 1.00 0.00 C ATOM 826 O PRO A 60 2.549 3.997 -3.116 1.00 0.00 O ATOM 827 CB PRO A 60 1.241 0.781 -2.682 1.00 0.00 C ATOM 828 CG PRO A 60 0.343 -0.148 -3.497 1.00 0.00 C ATOM 829 CD PRO A 60 0.409 0.411 -4.912 1.00 0.00 C ATOM 0 HA PRO A 60 0.587 2.849 -2.851 1.00 0.00 H new ATOM 0 HB2 PRO A 60 2.262 0.403 -2.634 1.00 0.00 H new ATOM 0 HB3 PRO A 60 0.887 0.873 -1.655 1.00 0.00 H new ATOM 0 HG2 PRO A 60 0.698 -1.178 -3.459 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -0.678 -0.148 -3.117 1.00 0.00 H new ATOM 0 HD2 PRO A 60 1.253 -0.000 -5.465 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -0.491 0.171 -5.479 1.00 0.00 H new ATOM 837 N ILE A 61 3.503 2.138 -4.036 1.00 0.00 N ATOM 838 CA ILE A 61 4.846 2.613 -4.202 1.00 0.00 C ATOM 839 C ILE A 61 5.116 2.816 -5.698 1.00 0.00 C ATOM 840 O ILE A 61 4.413 2.237 -6.529 1.00 0.00 O ATOM 841 CB ILE A 61 5.749 1.701 -3.371 1.00 0.00 C ATOM 842 CG1 ILE A 61 6.328 2.372 -2.111 1.00 0.00 C ATOM 843 CG2 ILE A 61 6.966 1.165 -4.110 1.00 0.00 C ATOM 844 CD1 ILE A 61 5.575 3.503 -1.451 1.00 0.00 C ATOM 0 H ILE A 61 3.387 1.178 -4.361 1.00 0.00 H new ATOM 0 HA ILE A 61 5.058 3.607 -3.807 1.00 0.00 H new ATOM 0 HB ILE A 61 5.057 0.897 -3.121 1.00 0.00 H new ATOM 0 HG12 ILE A 61 6.467 1.593 -1.362 1.00 0.00 H new ATOM 0 HG13 ILE A 61 7.319 2.747 -2.368 1.00 0.00 H new ATOM 0 HG21 ILE A 61 7.546 0.529 -3.442 1.00 0.00 H new ATOM 0 HG22 ILE A 61 6.641 0.584 -4.973 1.00 0.00 H new ATOM 0 HG23 ILE A 61 7.584 1.998 -4.446 1.00 0.00 H new ATOM 0 HD11 ILE A 61 6.131 3.851 -0.581 1.00 0.00 H new ATOM 0 HD12 ILE A 61 5.457 4.324 -2.159 1.00 0.00 H new ATOM 0 HD13 ILE A 61 4.592 3.151 -1.137 1.00 0.00 H new ATOM 856 N PRO A 62 6.137 3.650 -6.063 1.00 0.00 N ATOM 857 CA PRO A 62 6.356 4.242 -7.398 1.00 0.00 C ATOM 858 C PRO A 62 6.635 3.244 -8.525 1.00 0.00 C ATOM 859 O PRO A 62 7.442 2.358 -8.329 1.00 0.00 O ATOM 860 CB PRO A 62 7.554 5.205 -7.130 1.00 0.00 C ATOM 861 CG PRO A 62 7.361 5.600 -5.675 1.00 0.00 C ATOM 862 CD PRO A 62 7.007 4.292 -5.072 1.00 0.00 C ATOM 0 HA PRO A 62 5.458 4.730 -7.778 1.00 0.00 H new ATOM 0 HB2 PRO A 62 8.512 4.710 -7.290 1.00 0.00 H new ATOM 0 HB3 PRO A 62 7.529 6.072 -7.790 1.00 0.00 H new ATOM 0 HG2 PRO A 62 8.266 6.024 -5.239 1.00 0.00 H new ATOM 0 HG3 PRO A 62 6.570 6.340 -5.550 1.00 0.00 H new ATOM 0 HD2 PRO A 62 7.896 3.692 -4.877 1.00 0.00 H new ATOM 0 HD3 PRO A 62 6.494 4.421 -4.119 1.00 0.00 H new ATOM 870 N LEU A 63 6.023 3.356 -9.722 1.00 0.00 N ATOM 871 CA LEU A 63 5.994 2.588 -10.989 1.00 0.00 C ATOM 872 C LEU A 63 7.271 2.140 -11.721 1.00 0.00 C ATOM 873 O LEU A 63 7.324 1.732 -12.883 1.00 0.00 O ATOM 874 CB LEU A 63 5.101 3.376 -11.943 1.00 0.00 C ATOM 875 CG LEU A 63 3.655 3.648 -11.465 1.00 0.00 C ATOM 876 CD1 LEU A 63 3.402 4.648 -10.308 1.00 0.00 C ATOM 877 CD2 LEU A 63 3.024 4.194 -12.734 1.00 0.00 C ATOM 0 H LEU A 63 5.408 4.161 -9.841 1.00 0.00 H new ATOM 0 HA LEU A 63 5.645 1.608 -10.665 1.00 0.00 H new ATOM 0 HB2 LEU A 63 5.580 4.334 -12.146 1.00 0.00 H new ATOM 0 HB3 LEU A 63 5.052 2.837 -12.889 1.00 0.00 H new ATOM 0 HG LEU A 63 3.261 2.732 -11.025 1.00 0.00 H new ATOM 0 HD11 LEU A 63 2.332 4.712 -10.109 1.00 0.00 H new ATOM 0 HD12 LEU A 63 3.918 4.305 -9.411 1.00 0.00 H new ATOM 0 HD13 LEU A 63 3.778 5.632 -10.589 1.00 0.00 H new ATOM 0 HD21 LEU A 63 1.978 4.436 -12.545 1.00 0.00 H new ATOM 0 HD22 LEU A 63 3.554 5.094 -13.046 1.00 0.00 H new ATOM 0 HD23 LEU A 63 3.086 3.444 -13.523 1.00 0.00 H new ATOM 889 N ASP A 64 8.322 2.286 -10.964 1.00 0.00 N ATOM 890 CA ASP A 64 9.728 2.062 -11.165 1.00 0.00 C ATOM 891 C ASP A 64 10.335 1.225 -10.046 1.00 0.00 C ATOM 892 O ASP A 64 11.549 1.264 -9.861 1.00 0.00 O ATOM 893 CB ASP A 64 10.294 3.484 -10.880 1.00 0.00 C ATOM 894 CG ASP A 64 9.987 4.437 -12.038 1.00 0.00 C ATOM 895 OD1 ASP A 64 10.512 4.195 -13.157 1.00 0.00 O ATOM 896 OD2 ASP A 64 9.224 5.415 -11.816 1.00 0.00 O ATOM 0 H ASP A 64 8.179 2.630 -10.014 1.00 0.00 H new ATOM 0 HA ASP A 64 9.924 1.589 -12.127 1.00 0.00 H new ATOM 0 HB2 ASP A 64 9.861 3.874 -9.959 1.00 0.00 H new ATOM 0 HB3 ASP A 64 11.372 3.427 -10.727 1.00 0.00 H new ATOM 901 N THR A 65 9.504 0.622 -9.153 1.00 0.00 N ATOM 902 CA THR A 65 9.963 0.240 -7.835 1.00 0.00 C ATOM 903 C THR A 65 9.956 -1.168 -7.546 1.00 0.00 C ATOM 904 O THR A 65 8.917 -1.785 -7.405 1.00 0.00 O ATOM 905 CB THR A 65 9.363 0.974 -6.639 1.00 0.00 C ATOM 906 OG1 THR A 65 9.495 2.366 -6.820 1.00 0.00 O ATOM 907 CG2 THR A 65 10.098 0.699 -5.320 1.00 0.00 C ATOM 0 H THR A 65 8.526 0.402 -9.341 1.00 0.00 H new ATOM 0 HA THR A 65 10.994 0.578 -7.941 1.00 0.00 H new ATOM 0 HB THR A 65 8.332 0.625 -6.583 1.00 0.00 H new ATOM 0 HG1 THR A 65 8.911 2.658 -7.551 1.00 0.00 H new ATOM 0 HG21 THR A 65 9.618 1.253 -4.513 1.00 0.00 H new ATOM 0 HG22 THR A 65 10.062 -0.368 -5.099 1.00 0.00 H new ATOM 0 HG23 THR A 65 11.137 1.016 -5.409 1.00 0.00 H new ATOM 915 N GLU A 66 11.137 -1.686 -7.253 1.00 0.00 N ATOM 916 CA GLU A 66 11.334 -2.984 -6.618 1.00 0.00 C ATOM 917 C GLU A 66 10.736 -3.048 -5.187 1.00 0.00 C ATOM 918 O GLU A 66 11.331 -2.681 -4.184 1.00 0.00 O ATOM 919 CB GLU A 66 12.813 -3.452 -6.729 1.00 0.00 C ATOM 920 CG GLU A 66 13.853 -2.623 -5.952 1.00 0.00 C ATOM 921 CD GLU A 66 15.255 -3.148 -6.256 1.00 0.00 C ATOM 922 OE1 GLU A 66 15.532 -4.329 -5.914 1.00 0.00 O ATOM 923 OE2 GLU A 66 16.069 -2.375 -6.832 1.00 0.00 O ATOM 0 H GLU A 66 12.012 -1.203 -7.455 1.00 0.00 H new ATOM 0 HA GLU A 66 10.755 -3.720 -7.176 1.00 0.00 H new ATOM 0 HB2 GLU A 66 12.872 -4.484 -6.384 1.00 0.00 H new ATOM 0 HB3 GLU A 66 13.093 -3.452 -7.782 1.00 0.00 H new ATOM 0 HG2 GLU A 66 13.778 -1.572 -6.232 1.00 0.00 H new ATOM 0 HG3 GLU A 66 13.655 -2.683 -4.882 1.00 0.00 H new ATOM 930 N VAL A 67 9.488 -3.573 -5.132 1.00 0.00 N ATOM 931 CA VAL A 67 8.557 -3.807 -4.020 1.00 0.00 C ATOM 932 C VAL A 67 8.716 -5.218 -3.648 1.00 0.00 C ATOM 933 O VAL A 67 9.401 -5.958 -4.320 1.00 0.00 O ATOM 934 CB VAL A 67 7.073 -3.558 -4.284 1.00 0.00 C ATOM 935 CG1 VAL A 67 6.666 -2.311 -3.494 1.00 0.00 C ATOM 936 CG2 VAL A 67 6.746 -3.512 -5.775 1.00 0.00 C ATOM 0 H VAL A 67 9.056 -3.885 -6.002 1.00 0.00 H new ATOM 0 HA VAL A 67 8.818 -3.080 -3.251 1.00 0.00 H new ATOM 0 HB VAL A 67 6.470 -4.394 -3.931 1.00 0.00 H new ATOM 0 HG11 VAL A 67 5.609 -2.104 -3.660 1.00 0.00 H new ATOM 0 HG12 VAL A 67 6.840 -2.481 -2.431 1.00 0.00 H new ATOM 0 HG13 VAL A 67 7.259 -1.459 -3.827 1.00 0.00 H new ATOM 0 HG21 VAL A 67 5.679 -3.333 -5.908 1.00 0.00 H new ATOM 0 HG22 VAL A 67 7.311 -2.708 -6.247 1.00 0.00 H new ATOM 0 HG23 VAL A 67 7.014 -4.463 -6.236 1.00 0.00 H new ATOM 946 N THR A 68 8.117 -5.650 -2.538 1.00 0.00 N ATOM 947 CA THR A 68 8.427 -7.000 -2.059 1.00 0.00 C ATOM 948 C THR A 68 7.250 -7.886 -2.364 1.00 0.00 C ATOM 949 O THR A 68 6.102 -7.474 -2.275 1.00 0.00 O ATOM 950 CB THR A 68 8.930 -6.938 -0.621 1.00 0.00 C ATOM 951 OG1 THR A 68 8.910 -8.168 0.098 1.00 0.00 O ATOM 952 CG2 THR A 68 8.040 -5.914 0.064 1.00 0.00 C ATOM 0 H THR A 68 7.449 -5.120 -1.978 1.00 0.00 H new ATOM 0 HA THR A 68 9.262 -7.469 -2.579 1.00 0.00 H new ATOM 0 HB THR A 68 9.988 -6.676 -0.635 1.00 0.00 H new ATOM 0 HG1 THR A 68 9.302 -8.034 0.986 1.00 0.00 H new ATOM 0 HG21 THR A 68 8.339 -5.811 1.107 1.00 0.00 H new ATOM 0 HG22 THR A 68 8.139 -4.952 -0.438 1.00 0.00 H new ATOM 0 HG23 THR A 68 7.002 -6.243 0.015 1.00 0.00 H new ATOM 960 N ALA A 69 7.502 -9.137 -2.776 1.00 0.00 N ATOM 961 CA ALA A 69 6.466 -10.083 -3.115 1.00 0.00 C ATOM 962 C ALA A 69 6.359 -11.123 -2.014 1.00 0.00 C ATOM 963 O ALA A 69 7.369 -11.540 -1.445 1.00 0.00 O ATOM 964 CB ALA A 69 6.882 -10.640 -4.466 1.00 0.00 C ATOM 0 H ALA A 69 8.446 -9.510 -2.879 1.00 0.00 H new ATOM 0 HA ALA A 69 5.467 -9.653 -3.192 1.00 0.00 H new ATOM 0 HB1 ALA A 69 6.146 -11.371 -4.800 1.00 0.00 H new ATOM 0 HB2 ALA A 69 6.943 -9.828 -5.191 1.00 0.00 H new ATOM 0 HB3 ALA A 69 7.856 -11.121 -4.377 1.00 0.00 H new ATOM 970 N LEU A 70 5.122 -11.524 -1.647 1.00 0.00 N ATOM 971 CA LEU A 70 4.877 -12.398 -0.495 1.00 0.00 C ATOM 972 C LEU A 70 5.355 -13.864 -0.505 1.00 0.00 C ATOM 973 O LEU A 70 4.862 -14.771 -1.176 1.00 0.00 O ATOM 974 CB LEU A 70 3.417 -12.311 -0.036 1.00 0.00 C ATOM 975 CG LEU A 70 3.138 -12.311 1.493 1.00 0.00 C ATOM 976 CD1 LEU A 70 3.476 -13.597 2.261 1.00 0.00 C ATOM 977 CD2 LEU A 70 3.772 -11.104 2.201 1.00 0.00 C ATOM 0 H LEU A 70 4.274 -11.249 -2.143 1.00 0.00 H new ATOM 0 HA LEU A 70 5.571 -11.963 0.224 1.00 0.00 H new ATOM 0 HB2 LEU A 70 2.988 -11.401 -0.455 1.00 0.00 H new ATOM 0 HB3 LEU A 70 2.877 -13.150 -0.475 1.00 0.00 H new ATOM 0 HG LEU A 70 2.051 -12.242 1.523 1.00 0.00 H new ATOM 0 HD11 LEU A 70 3.235 -13.465 3.316 1.00 0.00 H new ATOM 0 HD12 LEU A 70 2.895 -14.426 1.857 1.00 0.00 H new ATOM 0 HD13 LEU A 70 4.539 -13.814 2.157 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.549 -11.149 3.267 1.00 0.00 H new ATOM 0 HD22 LEU A 70 4.852 -11.123 2.055 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.365 -10.183 1.784 1.00 0.00 H new ATOM 989 N SER A 71 6.381 -14.032 0.346 1.00 0.00 N ATOM 990 CA SER A 71 7.105 -15.169 0.873 1.00 0.00 C ATOM 991 C SER A 71 7.265 -14.736 2.325 1.00 0.00 C ATOM 992 O SER A 71 6.970 -13.588 2.629 1.00 0.00 O ATOM 993 CB SER A 71 8.445 -15.515 0.166 1.00 0.00 C ATOM 994 OG SER A 71 8.972 -16.761 0.636 1.00 0.00 O ATOM 0 H SER A 71 6.788 -13.188 0.749 1.00 0.00 H new ATOM 0 HA SER A 71 6.584 -16.115 0.724 1.00 0.00 H new ATOM 0 HB2 SER A 71 8.288 -15.567 -0.911 1.00 0.00 H new ATOM 0 HB3 SER A 71 9.169 -14.720 0.345 1.00 0.00 H new ATOM 0 HG SER A 71 8.320 -17.189 1.230 1.00 0.00 H new ATOM 1000 N GLU A 72 7.692 -15.594 3.266 1.00 0.00 N ATOM 1001 CA GLU A 72 7.997 -15.308 4.682 1.00 0.00 C ATOM 1002 C GLU A 72 8.725 -13.991 5.117 1.00 0.00 C ATOM 1003 O GLU A 72 9.374 -13.292 4.345 1.00 0.00 O ATOM 1004 CB GLU A 72 8.870 -16.457 5.258 1.00 0.00 C ATOM 1005 CG GLU A 72 9.381 -17.472 4.224 1.00 0.00 C ATOM 1006 CD GLU A 72 8.344 -18.539 3.877 1.00 0.00 C ATOM 1007 OE1 GLU A 72 7.853 -19.211 4.824 1.00 0.00 O ATOM 1008 OE2 GLU A 72 8.033 -18.708 2.669 1.00 0.00 O ATOM 0 H GLU A 72 7.845 -16.578 3.043 1.00 0.00 H new ATOM 0 HA GLU A 72 6.983 -15.194 5.066 1.00 0.00 H new ATOM 0 HB2 GLU A 72 9.728 -16.019 5.768 1.00 0.00 H new ATOM 0 HB3 GLU A 72 8.290 -16.990 6.011 1.00 0.00 H new ATOM 0 HG2 GLU A 72 9.670 -16.944 3.315 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.278 -17.956 4.610 1.00 0.00 H new ATOM 1015 N ASP A 73 8.665 -13.703 6.441 1.00 0.00 N ATOM 1016 CA ASP A 73 9.119 -12.501 7.176 1.00 0.00 C ATOM 1017 C ASP A 73 10.480 -11.842 6.923 1.00 0.00 C ATOM 1018 O ASP A 73 10.557 -10.625 6.743 1.00 0.00 O ATOM 1019 CB ASP A 73 8.948 -12.675 8.714 1.00 0.00 C ATOM 1020 CG ASP A 73 7.507 -13.086 9.039 1.00 0.00 C ATOM 1021 OD1 ASP A 73 6.584 -12.276 8.755 1.00 0.00 O ATOM 1022 OD2 ASP A 73 7.316 -14.210 9.572 1.00 0.00 O ATOM 0 H ASP A 73 8.254 -14.379 7.085 1.00 0.00 H new ATOM 0 HA ASP A 73 8.440 -11.789 6.706 1.00 0.00 H new ATOM 0 HB2 ASP A 73 9.642 -13.431 9.082 1.00 0.00 H new ATOM 0 HB3 ASP A 73 9.192 -11.743 9.223 1.00 0.00 H new ATOM 1027 N GLU A 74 11.578 -12.631 6.913 1.00 0.00 N ATOM 1028 CA GLU A 74 12.941 -12.212 6.582 1.00 0.00 C ATOM 1029 C GLU A 74 13.417 -12.815 5.258 1.00 0.00 C ATOM 1030 O GLU A 74 14.605 -12.806 4.951 1.00 0.00 O ATOM 1031 CB GLU A 74 13.927 -12.508 7.750 1.00 0.00 C ATOM 1032 CG GLU A 74 14.065 -13.991 8.139 1.00 0.00 C ATOM 1033 CD GLU A 74 14.980 -14.126 9.355 1.00 0.00 C ATOM 1034 OE1 GLU A 74 16.178 -13.752 9.240 1.00 0.00 O ATOM 1035 OE2 GLU A 74 14.495 -14.610 10.413 1.00 0.00 O ATOM 0 H GLU A 74 11.526 -13.622 7.148 1.00 0.00 H new ATOM 0 HA GLU A 74 12.925 -11.131 6.444 1.00 0.00 H new ATOM 0 HB2 GLU A 74 14.912 -12.129 7.476 1.00 0.00 H new ATOM 0 HB3 GLU A 74 13.602 -11.949 8.627 1.00 0.00 H new ATOM 0 HG2 GLU A 74 13.084 -14.410 8.363 1.00 0.00 H new ATOM 0 HG3 GLU A 74 14.471 -14.559 7.302 1.00 0.00 H new ATOM 1042 N TYR A 75 12.485 -13.433 4.483 1.00 0.00 N ATOM 1043 CA TYR A 75 12.763 -14.203 3.278 1.00 0.00 C ATOM 1044 C TYR A 75 12.171 -13.551 2.048 1.00 0.00 C ATOM 1045 O TYR A 75 12.764 -13.625 0.968 1.00 0.00 O ATOM 1046 CB TYR A 75 12.206 -15.630 3.429 1.00 0.00 C ATOM 1047 CG TYR A 75 12.934 -16.389 4.505 1.00 0.00 C ATOM 1048 CD1 TYR A 75 12.573 -16.302 5.844 1.00 0.00 C ATOM 1049 CD2 TYR A 75 13.987 -17.208 4.149 1.00 0.00 C ATOM 1050 CE1 TYR A 75 13.242 -17.057 6.793 1.00 0.00 C ATOM 1051 CE2 TYR A 75 14.666 -17.946 5.098 1.00 0.00 C ATOM 1052 CZ TYR A 75 14.290 -17.874 6.421 1.00 0.00 C ATOM 1053 OH TYR A 75 14.984 -18.620 7.399 1.00 0.00 O ATOM 0 H TYR A 75 11.490 -13.397 4.703 1.00 0.00 H new ATOM 0 HA TYR A 75 13.845 -14.240 3.149 1.00 0.00 H new ATOM 0 HB2 TYR A 75 11.144 -15.585 3.668 1.00 0.00 H new ATOM 0 HB3 TYR A 75 12.297 -16.161 2.481 1.00 0.00 H new ATOM 0 HD1 TYR A 75 11.770 -15.645 6.145 1.00 0.00 H new ATOM 0 HD2 TYR A 75 14.284 -17.272 3.113 1.00 0.00 H new ATOM 0 HE1 TYR A 75 12.942 -17.006 7.829 1.00 0.00 H new ATOM 0 HE2 TYR A 75 15.490 -18.579 4.803 1.00 0.00 H new ATOM 0 HH TYR A 75 15.692 -19.144 6.969 1.00 0.00 H new ATOM 1063 N PHE A 76 11.000 -12.845 2.194 1.00 0.00 N ATOM 1064 CA PHE A 76 10.341 -12.095 1.076 1.00 0.00 C ATOM 1065 C PHE A 76 11.220 -11.082 0.315 1.00 0.00 C ATOM 1066 O PHE A 76 12.115 -10.433 0.859 1.00 0.00 O ATOM 1067 CB PHE A 76 8.979 -11.388 1.410 1.00 0.00 C ATOM 1068 CG PHE A 76 8.851 -10.551 2.670 1.00 0.00 C ATOM 1069 CD1 PHE A 76 9.776 -9.595 3.051 1.00 0.00 C ATOM 1070 CD2 PHE A 76 7.670 -10.617 3.393 1.00 0.00 C ATOM 1071 CE1 PHE A 76 9.505 -8.709 4.068 1.00 0.00 C ATOM 1072 CE2 PHE A 76 7.405 -9.761 4.435 1.00 0.00 C ATOM 1073 CZ PHE A 76 8.311 -8.779 4.752 1.00 0.00 C ATOM 0 H PHE A 76 10.496 -12.783 3.079 1.00 0.00 H new ATOM 0 HA PHE A 76 10.141 -12.945 0.424 1.00 0.00 H new ATOM 0 HB2 PHE A 76 8.732 -10.744 0.566 1.00 0.00 H new ATOM 0 HB3 PHE A 76 8.213 -12.163 1.455 1.00 0.00 H new ATOM 0 HD1 PHE A 76 10.727 -9.543 2.541 1.00 0.00 H new ATOM 0 HD2 PHE A 76 6.936 -11.364 3.129 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.232 -7.955 4.332 1.00 0.00 H new ATOM 0 HE2 PHE A 76 6.490 -9.860 5.001 1.00 0.00 H new ATOM 0 HZ PHE A 76 8.089 -8.066 5.532 1.00 0.00 H new ATOM 1083 N SER A 77 11.041 -11.102 -1.025 1.00 0.00 N ATOM 1084 CA SER A 77 12.020 -10.498 -1.927 1.00 0.00 C ATOM 1085 C SER A 77 11.350 -9.783 -3.066 1.00 0.00 C ATOM 1086 O SER A 77 10.162 -9.971 -3.332 1.00 0.00 O ATOM 1087 CB SER A 77 13.084 -11.532 -2.420 1.00 0.00 C ATOM 1088 OG SER A 77 13.965 -11.915 -1.358 1.00 0.00 O ATOM 0 H SER A 77 10.238 -11.525 -1.490 1.00 0.00 H new ATOM 0 HA SER A 77 12.565 -9.747 -1.355 1.00 0.00 H new ATOM 0 HB2 SER A 77 12.581 -12.415 -2.815 1.00 0.00 H new ATOM 0 HB3 SER A 77 13.662 -11.101 -3.238 1.00 0.00 H new ATOM 0 HG SER A 77 13.463 -12.415 -0.681 1.00 0.00 H new ATOM 1094 N ALA A 78 12.097 -8.861 -3.729 1.00 0.00 N ATOM 1095 CA ALA A 78 11.574 -7.929 -4.710 1.00 0.00 C ATOM 1096 C ALA A 78 11.347 -8.309 -6.176 1.00 0.00 C ATOM 1097 O ALA A 78 11.897 -9.248 -6.756 1.00 0.00 O ATOM 1098 CB ALA A 78 12.285 -6.554 -4.562 1.00 0.00 C ATOM 0 H ALA A 78 13.101 -8.759 -3.578 1.00 0.00 H new ATOM 0 HA ALA A 78 10.524 -7.919 -4.418 1.00 0.00 H new ATOM 0 HB1 ALA A 78 11.888 -5.858 -5.301 1.00 0.00 H new ATOM 0 HB2 ALA A 78 12.110 -6.160 -3.561 1.00 0.00 H new ATOM 0 HB3 ALA A 78 13.356 -6.679 -4.720 1.00 0.00 H new ATOM 1104 N GLY A 79 10.457 -7.474 -6.770 1.00 0.00 N ATOM 1105 CA GLY A 79 9.976 -7.428 -8.138 1.00 0.00 C ATOM 1106 C GLY A 79 9.514 -6.033 -8.297 1.00 0.00 C ATOM 1107 O GLY A 79 9.346 -5.356 -7.300 1.00 0.00 O ATOM 0 H GLY A 79 10.019 -6.736 -6.218 1.00 0.00 H new ATOM 0 HA2 GLY A 79 10.765 -7.672 -8.849 1.00 0.00 H new ATOM 0 HA3 GLY A 79 9.167 -8.140 -8.303 1.00 0.00 H new ATOM 1111 N VAL A 80 9.318 -5.534 -9.525 1.00 0.00 N ATOM 1112 CA VAL A 80 9.101 -4.144 -9.851 1.00 0.00 C ATOM 1113 C VAL A 80 7.676 -3.826 -10.076 1.00 0.00 C ATOM 1114 O VAL A 80 7.086 -4.348 -11.019 1.00 0.00 O ATOM 1115 CB VAL A 80 9.933 -3.837 -11.100 1.00 0.00 C ATOM 1116 CG1 VAL A 80 9.765 -2.396 -11.639 1.00 0.00 C ATOM 1117 CG2 VAL A 80 11.392 -4.066 -10.675 1.00 0.00 C ATOM 0 H VAL A 80 9.309 -6.132 -10.351 1.00 0.00 H new ATOM 0 HA VAL A 80 9.409 -3.524 -9.009 1.00 0.00 H new ATOM 0 HB VAL A 80 9.605 -4.477 -11.919 1.00 0.00 H new ATOM 0 HG11 VAL A 80 10.388 -2.263 -12.523 1.00 0.00 H new ATOM 0 HG12 VAL A 80 8.721 -2.225 -11.902 1.00 0.00 H new ATOM 0 HG13 VAL A 80 10.067 -1.683 -10.872 1.00 0.00 H new ATOM 0 HG21 VAL A 80 12.052 -3.866 -11.519 1.00 0.00 H new ATOM 0 HG22 VAL A 80 11.641 -3.396 -9.852 1.00 0.00 H new ATOM 0 HG23 VAL A 80 11.519 -5.099 -10.352 1.00 0.00 H new ATOM 1127 N VAL A 81 7.095 -2.897 -9.238 1.00 0.00 N ATOM 1128 CA VAL A 81 5.763 -2.351 -9.484 1.00 0.00 C ATOM 1129 C VAL A 81 5.849 -1.385 -10.643 1.00 0.00 C ATOM 1130 O VAL A 81 6.809 -0.601 -10.703 1.00 0.00 O ATOM 1131 CB VAL A 81 5.167 -1.570 -8.294 1.00 0.00 C ATOM 1132 CG1 VAL A 81 5.923 -0.269 -7.941 1.00 0.00 C ATOM 1133 CG2 VAL A 81 3.713 -1.160 -8.577 1.00 0.00 C ATOM 0 H VAL A 81 7.547 -2.531 -8.400 1.00 0.00 H new ATOM 0 HA VAL A 81 5.116 -3.207 -9.676 1.00 0.00 H new ATOM 0 HB VAL A 81 5.248 -2.264 -7.457 1.00 0.00 H new ATOM 0 HG11 VAL A 81 5.437 0.216 -7.094 1.00 0.00 H new ATOM 0 HG12 VAL A 81 6.954 -0.507 -7.680 1.00 0.00 H new ATOM 0 HG13 VAL A 81 5.912 0.403 -8.799 1.00 0.00 H new ATOM 0 HG21 VAL A 81 3.317 -0.611 -7.723 1.00 0.00 H new ATOM 0 HG22 VAL A 81 3.680 -0.526 -9.463 1.00 0.00 H new ATOM 0 HG23 VAL A 81 3.110 -2.052 -8.747 1.00 0.00 H new ATOM 1143 N LYS A 82 4.869 -1.501 -11.570 1.00 0.00 N ATOM 1144 CA LYS A 82 4.847 -0.731 -12.798 1.00 0.00 C ATOM 1145 C LYS A 82 3.492 -0.146 -13.130 1.00 0.00 C ATOM 1146 O LYS A 82 3.405 0.901 -13.766 1.00 0.00 O ATOM 1147 CB LYS A 82 5.396 -1.570 -13.985 1.00 0.00 C ATOM 1148 CG LYS A 82 4.899 -3.030 -14.028 1.00 0.00 C ATOM 1149 CD LYS A 82 5.273 -3.778 -15.319 1.00 0.00 C ATOM 1150 CE LYS A 82 6.755 -3.669 -15.710 1.00 0.00 C ATOM 1151 NZ LYS A 82 7.062 -4.541 -16.868 1.00 0.00 N ATOM 0 H LYS A 82 4.078 -2.137 -11.470 1.00 0.00 H new ATOM 0 HA LYS A 82 5.504 0.122 -12.628 1.00 0.00 H new ATOM 0 HB2 LYS A 82 5.119 -1.079 -14.918 1.00 0.00 H new ATOM 0 HB3 LYS A 82 6.485 -1.573 -13.937 1.00 0.00 H new ATOM 0 HG2 LYS A 82 5.311 -3.569 -13.175 1.00 0.00 H new ATOM 0 HG3 LYS A 82 3.815 -3.038 -13.916 1.00 0.00 H new ATOM 0 HD2 LYS A 82 5.018 -4.831 -15.201 1.00 0.00 H new ATOM 0 HD3 LYS A 82 4.665 -3.392 -16.137 1.00 0.00 H new ATOM 0 HE2 LYS A 82 6.995 -2.634 -15.955 1.00 0.00 H new ATOM 0 HE3 LYS A 82 7.380 -3.950 -14.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 8.069 -4.450 -17.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 6.853 -5.530 -16.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 6.480 -4.256 -17.681 1.00 0.00 H new ATOM 1165 N GLY A 83 2.371 -0.813 -12.761 1.00 0.00 N ATOM 1166 CA GLY A 83 1.051 -0.337 -13.175 1.00 0.00 C ATOM 1167 C GLY A 83 0.019 -0.852 -12.227 1.00 0.00 C ATOM 1168 O GLY A 83 0.038 -2.034 -11.874 1.00 0.00 O ATOM 0 H GLY A 83 2.363 -1.660 -12.192 1.00 0.00 H new ATOM 0 HA2 GLY A 83 1.034 0.753 -13.192 1.00 0.00 H new ATOM 0 HA3 GLY A 83 0.831 -0.675 -14.188 1.00 0.00 H new ATOM 1172 N HIS A 84 -0.904 0.040 -11.772 1.00 0.00 N ATOM 1173 CA HIS A 84 -1.883 -0.266 -10.738 1.00 0.00 C ATOM 1174 C HIS A 84 -3.276 0.315 -10.889 1.00 0.00 C ATOM 1175 O HIS A 84 -3.446 1.423 -11.398 1.00 0.00 O ATOM 1176 CB HIS A 84 -1.301 0.101 -9.350 1.00 0.00 C ATOM 1177 CG HIS A 84 -0.407 1.294 -9.282 1.00 0.00 C ATOM 1178 ND1 HIS A 84 -0.717 2.599 -9.582 1.00 0.00 N ATOM 1179 CD2 HIS A 84 0.875 1.305 -8.843 1.00 0.00 C ATOM 1180 CE1 HIS A 84 0.388 3.329 -9.300 1.00 0.00 C ATOM 1181 NE2 HIS A 84 1.381 2.581 -8.867 1.00 0.00 N ATOM 0 H HIS A 84 -0.974 0.994 -12.127 1.00 0.00 H new ATOM 0 HA HIS A 84 -2.050 -1.337 -10.850 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -2.134 0.263 -8.666 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -0.746 -0.760 -8.978 1.00 0.00 H new ATOM 0 HD1 HIS A 84 -1.604 2.948 -9.945 1.00 0.00 H new ATOM 0 HD2 HIS A 84 1.422 0.432 -8.519 1.00 0.00 H new ATOM 0 HE1 HIS A 84 0.448 4.401 -9.417 1.00 0.00 H new ATOM 1189 N ARG A 85 -4.296 -0.457 -10.386 1.00 0.00 N ATOM 1190 CA ARG A 85 -5.702 -0.108 -10.370 1.00 0.00 C ATOM 1191 C ARG A 85 -6.216 -0.233 -8.953 1.00 0.00 C ATOM 1192 O ARG A 85 -5.639 -0.931 -8.114 1.00 0.00 O ATOM 1193 CB ARG A 85 -6.564 -1.110 -11.224 1.00 0.00 C ATOM 1194 CG ARG A 85 -7.257 -2.279 -10.471 1.00 0.00 C ATOM 1195 CD ARG A 85 -8.073 -3.194 -11.389 1.00 0.00 C ATOM 1196 NE ARG A 85 -7.194 -3.862 -12.410 1.00 0.00 N ATOM 1197 CZ ARG A 85 -7.687 -4.687 -13.386 1.00 0.00 C ATOM 1198 NH1 ARG A 85 -9.024 -4.939 -13.482 1.00 0.00 N ATOM 1199 NH2 ARG A 85 -6.825 -5.272 -14.269 1.00 0.00 N ATOM 0 H ARG A 85 -4.120 -1.372 -9.971 1.00 0.00 H new ATOM 0 HA ARG A 85 -5.789 0.901 -10.773 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -7.335 -0.537 -11.739 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -5.920 -1.539 -11.992 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -6.499 -2.872 -9.960 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -7.913 -1.869 -9.703 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -8.583 -3.951 -10.793 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -8.845 -2.613 -11.894 1.00 0.00 H new ATOM 0 HE ARG A 85 -6.189 -3.694 -12.374 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -9.672 -4.511 -12.821 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -9.375 -5.556 -14.215 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -5.823 -5.093 -14.198 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -7.183 -5.888 -14.999 1.00 0.00 H new ATOM 1213 N LYS A 86 -7.415 0.340 -8.718 1.00 0.00 N ATOM 1214 CA LYS A 86 -8.267 0.009 -7.605 1.00 0.00 C ATOM 1215 C LYS A 86 -9.693 -0.055 -8.092 1.00 0.00 C ATOM 1216 O LYS A 86 -10.093 0.679 -8.998 1.00 0.00 O ATOM 1217 CB LYS A 86 -8.008 0.930 -6.415 1.00 0.00 C ATOM 1218 CG LYS A 86 -8.467 2.406 -6.509 1.00 0.00 C ATOM 1219 CD LYS A 86 -7.888 3.193 -7.707 1.00 0.00 C ATOM 1220 CE LYS A 86 -8.009 4.721 -7.646 1.00 0.00 C ATOM 1221 NZ LYS A 86 -7.200 5.293 -6.547 1.00 0.00 N ATOM 0 H LYS A 86 -7.808 1.061 -9.324 1.00 0.00 H new ATOM 0 HA LYS A 86 -8.036 -0.980 -7.209 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -8.490 0.488 -5.543 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -6.935 0.928 -6.222 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -9.555 2.430 -6.569 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -8.188 2.917 -5.588 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -6.833 2.938 -7.804 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -8.384 2.848 -8.614 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -7.687 5.149 -8.595 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -9.054 4.998 -7.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -7.583 6.223 -6.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -7.233 4.657 -5.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -6.215 5.402 -6.862 1.00 0.00 H new ATOM 1235 N GLU A 87 -10.488 -0.955 -7.478 1.00 0.00 N ATOM 1236 CA GLU A 87 -11.895 -1.183 -7.729 1.00 0.00 C ATOM 1237 C GLU A 87 -12.525 -1.104 -6.345 1.00 0.00 C ATOM 1238 O GLU A 87 -11.833 -1.244 -5.338 1.00 0.00 O ATOM 1239 CB GLU A 87 -12.098 -2.570 -8.402 1.00 0.00 C ATOM 1240 CG GLU A 87 -11.534 -2.691 -9.831 1.00 0.00 C ATOM 1241 CD GLU A 87 -12.252 -1.733 -10.779 1.00 0.00 C ATOM 1242 OE1 GLU A 87 -13.496 -1.866 -10.928 1.00 0.00 O ATOM 1243 OE2 GLU A 87 -11.565 -0.858 -11.371 1.00 0.00 O ATOM 0 H GLU A 87 -10.126 -1.572 -6.751 1.00 0.00 H new ATOM 0 HA GLU A 87 -12.346 -0.464 -8.413 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -11.631 -3.332 -7.778 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -13.165 -2.791 -8.429 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -10.466 -2.472 -9.825 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -11.648 -3.715 -10.186 1.00 0.00 H new ATOM 1250 N SER A 88 -13.855 -0.884 -6.207 1.00 0.00 N ATOM 1251 CA SER A 88 -14.550 -0.780 -4.914 1.00 0.00 C ATOM 1252 C SER A 88 -14.709 -2.110 -4.154 1.00 0.00 C ATOM 1253 O SER A 88 -15.798 -2.679 -4.095 1.00 0.00 O ATOM 1254 CB SER A 88 -15.933 -0.095 -5.104 1.00 0.00 C ATOM 1255 OG SER A 88 -16.731 -0.786 -6.067 1.00 0.00 O ATOM 0 H SER A 88 -14.479 -0.773 -7.007 1.00 0.00 H new ATOM 0 HA SER A 88 -13.904 -0.167 -4.285 1.00 0.00 H new ATOM 0 HB2 SER A 88 -16.459 -0.063 -4.150 1.00 0.00 H new ATOM 0 HB3 SER A 88 -15.788 0.937 -5.423 1.00 0.00 H new ATOM 0 HG SER A 88 -16.760 -1.740 -5.844 1.00 0.00 H new ATOM 1261 N GLY A 89 -13.586 -2.619 -3.592 1.00 0.00 N ATOM 1262 CA GLY A 89 -13.464 -3.890 -2.889 1.00 0.00 C ATOM 1263 C GLY A 89 -12.541 -4.870 -3.568 1.00 0.00 C ATOM 1264 O GLY A 89 -12.457 -6.020 -3.149 1.00 0.00 O ATOM 0 H GLY A 89 -12.700 -2.115 -3.627 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -13.102 -3.703 -1.878 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -14.452 -4.340 -2.795 1.00 0.00 H new ATOM 1268 N GLU A 90 -11.796 -4.458 -4.638 1.00 0.00 N ATOM 1269 CA GLU A 90 -10.863 -5.280 -5.355 1.00 0.00 C ATOM 1270 C GLU A 90 -9.672 -4.368 -5.550 1.00 0.00 C ATOM 1271 O GLU A 90 -9.807 -3.152 -5.647 1.00 0.00 O ATOM 1272 CB GLU A 90 -11.428 -5.820 -6.697 1.00 0.00 C ATOM 1273 CG GLU A 90 -12.957 -5.732 -6.881 1.00 0.00 C ATOM 1274 CD GLU A 90 -13.341 -6.320 -8.239 1.00 0.00 C ATOM 1275 OE1 GLU A 90 -13.081 -7.535 -8.454 1.00 0.00 O ATOM 1276 OE2 GLU A 90 -13.899 -5.565 -9.080 1.00 0.00 O ATOM 0 H GLU A 90 -11.855 -3.510 -5.010 1.00 0.00 H new ATOM 0 HA GLU A 90 -10.614 -6.191 -4.812 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -10.954 -5.274 -7.512 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -11.131 -6.864 -6.798 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -13.462 -6.274 -6.082 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -13.283 -4.694 -6.817 1.00 0.00 H new ATOM 1283 N LEU A 91 -8.456 -4.920 -5.597 1.00 0.00 N ATOM 1284 CA LEU A 91 -7.231 -4.165 -5.682 1.00 0.00 C ATOM 1285 C LEU A 91 -6.499 -4.872 -6.748 1.00 0.00 C ATOM 1286 O LEU A 91 -6.485 -6.100 -6.691 1.00 0.00 O ATOM 1287 CB LEU A 91 -6.399 -4.365 -4.378 1.00 0.00 C ATOM 1288 CG LEU A 91 -5.656 -3.095 -3.910 1.00 0.00 C ATOM 1289 CD1 LEU A 91 -4.555 -2.614 -4.874 1.00 0.00 C ATOM 1290 CD2 LEU A 91 -6.591 -1.924 -3.552 1.00 0.00 C ATOM 0 H LEU A 91 -8.307 -5.929 -5.576 1.00 0.00 H new ATOM 0 HA LEU A 91 -7.401 -3.100 -5.844 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -7.064 -4.699 -3.582 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -5.672 -5.160 -4.541 1.00 0.00 H new ATOM 0 HG LEU A 91 -5.165 -3.423 -2.994 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -4.084 -1.718 -4.470 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -3.806 -3.397 -4.990 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -4.995 -2.386 -5.845 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -5.996 -1.068 -3.232 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -7.181 -1.649 -4.426 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -7.258 -2.225 -2.744 1.00 0.00 H new ATOM 1302 N TYR A 92 -5.854 -4.216 -7.738 1.00 0.00 N ATOM 1303 CA TYR A 92 -5.009 -5.069 -8.550 1.00 0.00 C ATOM 1304 C TYR A 92 -3.809 -4.279 -8.945 1.00 0.00 C ATOM 1305 O TYR A 92 -3.911 -3.143 -9.399 1.00 0.00 O ATOM 1306 CB TYR A 92 -5.568 -5.650 -9.910 1.00 0.00 C ATOM 1307 CG TYR A 92 -6.884 -6.379 -10.023 1.00 0.00 C ATOM 1308 CD1 TYR A 92 -8.071 -5.911 -9.492 1.00 0.00 C ATOM 1309 CD2 TYR A 92 -6.963 -7.375 -10.987 1.00 0.00 C ATOM 1310 CE1 TYR A 92 -9.294 -6.390 -9.902 1.00 0.00 C ATOM 1311 CE2 TYR A 92 -8.181 -7.916 -11.350 1.00 0.00 C ATOM 1312 CZ TYR A 92 -9.350 -7.427 -10.800 1.00 0.00 C ATOM 1313 OH TYR A 92 -10.603 -7.908 -11.224 1.00 0.00 O ATOM 0 H TYR A 92 -5.897 -3.223 -7.966 1.00 0.00 H new ATOM 0 HA TYR A 92 -4.858 -5.932 -7.901 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -5.621 -4.811 -10.604 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -4.806 -6.331 -10.290 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -8.038 -5.145 -8.731 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -6.060 -7.732 -11.460 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -10.205 -5.953 -9.520 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -8.219 -8.724 -12.066 1.00 0.00 H new ATOM 0 HH TYR A 92 -10.473 -8.642 -11.860 1.00 0.00 H new ATOM 1323 N TYR A 93 -2.638 -4.925 -8.912 1.00 0.00 N ATOM 1324 CA TYR A 93 -1.491 -4.409 -9.590 1.00 0.00 C ATOM 1325 C TYR A 93 -0.540 -5.442 -10.078 1.00 0.00 C ATOM 1326 O TYR A 93 -0.593 -6.638 -9.772 1.00 0.00 O ATOM 1327 CB TYR A 93 -0.850 -3.156 -8.985 1.00 0.00 C ATOM 1328 CG TYR A 93 -0.190 -3.316 -7.682 1.00 0.00 C ATOM 1329 CD1 TYR A 93 -0.900 -3.173 -6.511 1.00 0.00 C ATOM 1330 CD2 TYR A 93 1.172 -3.450 -7.684 1.00 0.00 C ATOM 1331 CE1 TYR A 93 -0.185 -3.149 -5.317 1.00 0.00 C ATOM 1332 CE2 TYR A 93 1.877 -3.390 -6.516 1.00 0.00 C ATOM 1333 CZ TYR A 93 1.214 -3.220 -5.316 1.00 0.00 C ATOM 1334 OH TYR A 93 2.005 -3.118 -4.136 1.00 0.00 O ATOM 0 H TYR A 93 -2.481 -5.803 -8.418 1.00 0.00 H new ATOM 0 HA TYR A 93 -1.923 -4.006 -10.506 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -0.116 -2.774 -9.694 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -1.622 -2.394 -8.884 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -1.976 -3.082 -6.519 1.00 0.00 H new ATOM 0 HD2 TYR A 93 1.694 -3.604 -8.617 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -0.716 -3.075 -4.379 1.00 0.00 H new ATOM 0 HE2 TYR A 93 2.954 -3.476 -6.530 1.00 0.00 H new ATOM 0 HH TYR A 93 1.767 -3.841 -3.519 1.00 0.00 H new ATOM 1344 N SER A 94 0.336 -4.914 -10.956 1.00 0.00 N ATOM 1345 CA SER A 94 1.321 -5.641 -11.726 1.00 0.00 C ATOM 1346 C SER A 94 2.715 -5.444 -11.176 1.00 0.00 C ATOM 1347 O SER A 94 3.201 -4.311 -11.028 1.00 0.00 O ATOM 1348 CB SER A 94 1.318 -5.053 -13.158 1.00 0.00 C ATOM 1349 OG SER A 94 2.149 -5.774 -14.080 1.00 0.00 O ATOM 0 H SER A 94 0.363 -3.912 -11.145 1.00 0.00 H new ATOM 0 HA SER A 94 1.070 -6.701 -11.696 1.00 0.00 H new ATOM 0 HB2 SER A 94 0.295 -5.044 -13.535 1.00 0.00 H new ATOM 0 HB3 SER A 94 1.652 -4.016 -13.116 1.00 0.00 H new ATOM 0 HG SER A 94 2.100 -5.352 -14.963 1.00 0.00 H new ATOM 1355 N ILE A 95 3.378 -6.607 -10.920 1.00 0.00 N ATOM 1356 CA ILE A 95 4.736 -6.680 -10.410 1.00 0.00 C ATOM 1357 C ILE A 95 5.514 -7.489 -11.414 1.00 0.00 C ATOM 1358 O ILE A 95 5.123 -8.604 -11.767 1.00 0.00 O ATOM 1359 CB ILE A 95 4.913 -7.243 -8.978 1.00 0.00 C ATOM 1360 CG1 ILE A 95 3.686 -7.970 -8.348 1.00 0.00 C ATOM 1361 CG2 ILE A 95 5.443 -6.090 -8.097 1.00 0.00 C ATOM 1362 CD1 ILE A 95 2.385 -7.165 -8.163 1.00 0.00 C ATOM 0 H ILE A 95 2.957 -7.524 -11.072 1.00 0.00 H new ATOM 0 HA ILE A 95 5.101 -5.659 -10.298 1.00 0.00 H new ATOM 0 HB ILE A 95 5.626 -8.065 -9.042 1.00 0.00 H new ATOM 0 HG12 ILE A 95 3.457 -8.837 -8.968 1.00 0.00 H new ATOM 0 HG13 ILE A 95 3.987 -8.347 -7.371 1.00 0.00 H new ATOM 0 HG21 ILE A 95 5.582 -6.446 -7.076 1.00 0.00 H new ATOM 0 HG22 ILE A 95 6.397 -5.739 -8.492 1.00 0.00 H new ATOM 0 HG23 ILE A 95 4.725 -5.270 -8.101 1.00 0.00 H new ATOM 0 HD11 ILE A 95 1.623 -7.803 -7.715 1.00 0.00 H new ATOM 0 HD12 ILE A 95 2.574 -6.312 -7.511 1.00 0.00 H new ATOM 0 HD13 ILE A 95 2.036 -6.810 -9.133 1.00 0.00 H new ATOM 1374 N GLU A 96 6.662 -6.947 -11.892 1.00 0.00 N ATOM 1375 CA GLU A 96 7.559 -7.643 -12.832 1.00 0.00 C ATOM 1376 C GLU A 96 8.684 -8.286 -12.033 1.00 0.00 C ATOM 1377 O GLU A 96 9.520 -7.592 -11.464 1.00 0.00 O ATOM 1378 CB GLU A 96 8.064 -6.651 -13.906 1.00 0.00 C ATOM 1379 CG GLU A 96 9.023 -7.197 -14.984 1.00 0.00 C ATOM 1380 CD GLU A 96 8.373 -8.319 -15.791 1.00 0.00 C ATOM 1381 OE1 GLU A 96 7.248 -8.106 -16.316 1.00 0.00 O ATOM 1382 OE2 GLU A 96 9.008 -9.402 -15.906 1.00 0.00 O ATOM 0 H GLU A 96 6.987 -6.015 -11.633 1.00 0.00 H new ATOM 0 HA GLU A 96 7.036 -8.435 -13.368 1.00 0.00 H new ATOM 0 HB2 GLU A 96 7.194 -6.230 -14.411 1.00 0.00 H new ATOM 0 HB3 GLU A 96 8.565 -5.828 -13.395 1.00 0.00 H new ATOM 0 HG2 GLU A 96 9.318 -6.389 -15.654 1.00 0.00 H new ATOM 0 HG3 GLU A 96 9.932 -7.567 -14.511 1.00 0.00 H new ATOM 1389 N LYS A 97 8.700 -9.631 -11.871 1.00 0.00 N ATOM 1390 CA LYS A 97 9.558 -10.244 -10.857 1.00 0.00 C ATOM 1391 C LYS A 97 10.157 -11.561 -11.230 1.00 0.00 C ATOM 1392 O LYS A 97 9.512 -12.428 -11.818 1.00 0.00 O ATOM 1393 CB LYS A 97 8.684 -10.546 -9.612 1.00 0.00 C ATOM 1394 CG LYS A 97 9.391 -11.205 -8.409 1.00 0.00 C ATOM 1395 CD LYS A 97 8.603 -11.331 -7.112 1.00 0.00 C ATOM 1396 CE LYS A 97 9.124 -12.525 -6.284 1.00 0.00 C ATOM 1397 NZ LYS A 97 10.510 -12.292 -5.812 1.00 0.00 N ATOM 0 H LYS A 97 8.142 -10.287 -12.417 1.00 0.00 H new ATOM 0 HA LYS A 97 10.369 -9.532 -10.705 1.00 0.00 H new ATOM 0 HB2 LYS A 97 8.240 -9.610 -9.274 1.00 0.00 H new ATOM 0 HB3 LYS A 97 7.864 -11.195 -9.921 1.00 0.00 H new ATOM 0 HG2 LYS A 97 9.705 -12.204 -8.710 1.00 0.00 H new ATOM 0 HG3 LYS A 97 10.297 -10.636 -8.198 1.00 0.00 H new ATOM 0 HD2 LYS A 97 8.692 -10.412 -6.533 1.00 0.00 H new ATOM 0 HD3 LYS A 97 7.544 -11.467 -7.333 1.00 0.00 H new ATOM 0 HE2 LYS A 97 8.469 -12.689 -5.428 1.00 0.00 H new ATOM 0 HE3 LYS A 97 9.091 -13.431 -6.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 10.807 -13.081 -5.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 11.149 -12.227 -6.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 10.548 -11.404 -5.271 1.00 0.00 H new ATOM 1411 N GLU A 98 11.452 -11.776 -10.842 1.00 0.00 N ATOM 1412 CA GLU A 98 12.221 -13.020 -10.977 1.00 0.00 C ATOM 1413 C GLU A 98 12.494 -13.436 -12.436 1.00 0.00 C ATOM 1414 O GLU A 98 13.126 -14.441 -12.749 1.00 0.00 O ATOM 1415 CB GLU A 98 11.546 -14.111 -10.079 1.00 0.00 C ATOM 1416 CG GLU A 98 12.322 -15.422 -9.871 1.00 0.00 C ATOM 1417 CD GLU A 98 11.565 -16.378 -8.943 1.00 0.00 C ATOM 1418 OE1 GLU A 98 10.439 -16.036 -8.495 1.00 0.00 O ATOM 1419 OE2 GLU A 98 12.119 -17.478 -8.672 1.00 0.00 O ATOM 0 H GLU A 98 12.002 -11.036 -10.405 1.00 0.00 H new ATOM 0 HA GLU A 98 13.236 -12.864 -10.610 1.00 0.00 H new ATOM 0 HB2 GLU A 98 11.354 -13.672 -9.100 1.00 0.00 H new ATOM 0 HB3 GLU A 98 10.577 -14.356 -10.514 1.00 0.00 H new ATOM 0 HG2 GLU A 98 12.490 -15.904 -10.834 1.00 0.00 H new ATOM 0 HG3 GLU A 98 13.303 -15.203 -9.449 1.00 0.00 H new ATOM 1426 N GLY A 99 12.050 -12.548 -13.355 1.00 0.00 N ATOM 1427 CA GLY A 99 12.218 -12.600 -14.802 1.00 0.00 C ATOM 1428 C GLY A 99 10.896 -12.638 -15.514 1.00 0.00 C ATOM 1429 O GLY A 99 10.843 -12.545 -16.735 1.00 0.00 O ATOM 0 H GLY A 99 11.528 -11.720 -13.070 1.00 0.00 H new ATOM 0 HA2 GLY A 99 12.785 -11.730 -15.134 1.00 0.00 H new ATOM 0 HA3 GLY A 99 12.801 -13.482 -15.069 1.00 0.00 H new ATOM 1433 N GLN A 100 9.775 -12.782 -14.767 1.00 0.00 N ATOM 1434 CA GLN A 100 8.431 -12.877 -15.318 1.00 0.00 C ATOM 1435 C GLN A 100 7.435 -12.021 -14.596 1.00 0.00 C ATOM 1436 O GLN A 100 7.716 -11.419 -13.571 1.00 0.00 O ATOM 1437 CB GLN A 100 7.967 -14.357 -15.502 1.00 0.00 C ATOM 1438 CG GLN A 100 8.088 -15.317 -14.281 1.00 0.00 C ATOM 1439 CD GLN A 100 6.993 -15.149 -13.222 1.00 0.00 C ATOM 1440 OE1 GLN A 100 7.278 -14.279 -12.217 1.00 0.00 O flip ATOM 1441 NE2 GLN A 100 5.927 -15.770 -13.262 1.00 0.00 N flip ATOM 0 H GLN A 100 9.796 -12.835 -13.749 1.00 0.00 H new ATOM 0 HA GLN A 100 8.483 -12.456 -16.322 1.00 0.00 H new ATOM 0 HB2 GLN A 100 6.923 -14.343 -15.814 1.00 0.00 H new ATOM 0 HB3 GLN A 100 8.540 -14.787 -16.323 1.00 0.00 H new ATOM 0 HG2 GLN A 100 8.071 -16.345 -14.642 1.00 0.00 H new ATOM 0 HG3 GLN A 100 9.058 -15.161 -13.809 1.00 0.00 H new ATOM 0 HE21 GLN A 100 5.742 -16.416 -14.029 1.00 0.00 H new ATOM 0 HE22 GLN A 100 5.231 -15.637 -12.528 1.00 0.00 H new ATOM 1450 N ARG A 101 6.206 -11.882 -15.129 1.00 0.00 N ATOM 1451 CA ARG A 101 5.173 -11.039 -14.550 1.00 0.00 C ATOM 1452 C ARG A 101 4.296 -11.764 -13.546 1.00 0.00 C ATOM 1453 O ARG A 101 3.908 -12.912 -13.747 1.00 0.00 O ATOM 1454 CB ARG A 101 4.377 -10.322 -15.672 1.00 0.00 C ATOM 1455 CG ARG A 101 3.596 -9.070 -15.226 1.00 0.00 C ATOM 1456 CD ARG A 101 2.079 -9.280 -15.110 1.00 0.00 C ATOM 1457 NE ARG A 101 1.502 -9.542 -16.479 1.00 0.00 N ATOM 1458 CZ ARG A 101 1.124 -8.558 -17.355 1.00 0.00 C ATOM 1459 NH1 ARG A 101 1.221 -7.239 -17.022 1.00 0.00 N ATOM 1460 NH2 ARG A 101 0.631 -8.908 -18.580 1.00 0.00 N ATOM 0 H ARG A 101 5.912 -12.361 -15.980 1.00 0.00 H new ATOM 0 HA ARG A 101 5.665 -10.269 -13.955 1.00 0.00 H new ATOM 0 HB2 ARG A 101 5.072 -10.035 -16.462 1.00 0.00 H new ATOM 0 HB3 ARG A 101 3.675 -11.032 -16.108 1.00 0.00 H new ATOM 0 HG2 ARG A 101 3.980 -8.741 -14.261 1.00 0.00 H new ATOM 0 HG3 ARG A 101 3.786 -8.265 -15.936 1.00 0.00 H new ATOM 0 HD2 ARG A 101 1.867 -10.119 -14.447 1.00 0.00 H new ATOM 0 HD3 ARG A 101 1.612 -8.399 -14.669 1.00 0.00 H new ATOM 0 HE ARG A 101 1.386 -10.512 -16.771 1.00 0.00 H new ATOM 0 HH11 ARG A 101 1.580 -6.969 -16.106 1.00 0.00 H new ATOM 0 HH12 ARG A 101 0.934 -6.522 -17.689 1.00 0.00 H new ATOM 0 HH21 ARG A 101 0.548 -9.892 -18.834 1.00 0.00 H new ATOM 0 HH22 ARG A 101 0.346 -8.185 -19.241 1.00 0.00 H new ATOM 1474 N LYS A 102 3.981 -11.064 -12.422 1.00 0.00 N ATOM 1475 CA LYS A 102 3.081 -11.554 -11.381 1.00 0.00 C ATOM 1476 C LYS A 102 1.977 -10.521 -11.273 1.00 0.00 C ATOM 1477 O LYS A 102 2.242 -9.320 -11.229 1.00 0.00 O ATOM 1478 CB LYS A 102 3.790 -11.780 -10.002 1.00 0.00 C ATOM 1479 CG LYS A 102 4.539 -13.132 -9.949 1.00 0.00 C ATOM 1480 CD LYS A 102 5.704 -13.207 -8.942 1.00 0.00 C ATOM 1481 CE LYS A 102 5.996 -14.622 -8.407 1.00 0.00 C ATOM 1482 NZ LYS A 102 6.348 -15.565 -9.492 1.00 0.00 N ATOM 0 H LYS A 102 4.357 -10.136 -12.226 1.00 0.00 H new ATOM 0 HA LYS A 102 2.697 -12.538 -11.650 1.00 0.00 H new ATOM 0 HB2 LYS A 102 4.494 -10.968 -9.819 1.00 0.00 H new ATOM 0 HB3 LYS A 102 3.049 -11.745 -9.203 1.00 0.00 H new ATOM 0 HG2 LYS A 102 3.821 -13.916 -9.707 1.00 0.00 H new ATOM 0 HG3 LYS A 102 4.927 -13.352 -10.944 1.00 0.00 H new ATOM 0 HD2 LYS A 102 6.605 -12.819 -9.418 1.00 0.00 H new ATOM 0 HD3 LYS A 102 5.482 -12.552 -8.099 1.00 0.00 H new ATOM 0 HE2 LYS A 102 6.814 -14.576 -7.688 1.00 0.00 H new ATOM 0 HE3 LYS A 102 5.122 -14.995 -7.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 7.131 -16.175 -9.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 5.522 -16.153 -9.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 6.639 -15.031 -10.336 1.00 0.00 H new ATOM 1496 N TRP A 103 0.695 -10.954 -11.221 1.00 0.00 N ATOM 1497 CA TRP A 103 -0.460 -10.077 -11.038 1.00 0.00 C ATOM 1498 C TRP A 103 -1.071 -10.464 -9.682 1.00 0.00 C ATOM 1499 O TRP A 103 -1.432 -11.616 -9.433 1.00 0.00 O ATOM 1500 CB TRP A 103 -1.544 -10.268 -12.158 1.00 0.00 C ATOM 1501 CG TRP A 103 -1.606 -9.275 -13.318 1.00 0.00 C ATOM 1502 CD1 TRP A 103 -1.390 -9.515 -14.647 1.00 0.00 C ATOM 1503 CD2 TRP A 103 -2.215 -7.968 -13.242 1.00 0.00 C ATOM 1504 NE1 TRP A 103 -1.839 -8.449 -15.403 1.00 0.00 N ATOM 1505 CE2 TRP A 103 -2.370 -7.508 -14.549 1.00 0.00 C ATOM 1506 CE3 TRP A 103 -2.656 -7.224 -12.180 1.00 0.00 C ATOM 1507 CZ2 TRP A 103 -3.005 -6.326 -14.806 1.00 0.00 C ATOM 1508 CZ3 TRP A 103 -3.186 -5.975 -12.450 1.00 0.00 C ATOM 1509 CH2 TRP A 103 -3.388 -5.543 -13.741 1.00 0.00 C ATOM 0 H TRP A 103 0.443 -11.939 -11.307 1.00 0.00 H new ATOM 0 HA TRP A 103 -0.142 -9.036 -11.085 1.00 0.00 H new ATOM 0 HB2 TRP A 103 -1.402 -11.261 -12.585 1.00 0.00 H new ATOM 0 HB3 TRP A 103 -2.520 -10.266 -11.673 1.00 0.00 H new ATOM 0 HD1 TRP A 103 -0.934 -10.408 -15.048 1.00 0.00 H new ATOM 0 HE1 TRP A 103 -1.786 -8.372 -16.419 1.00 0.00 H new ATOM 0 HE3 TRP A 103 -2.592 -7.599 -11.169 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 -3.202 -6.013 -15.821 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 -3.447 -5.324 -11.629 1.00 0.00 H new ATOM 0 HH2 TRP A 103 -3.850 -4.583 -13.919 1.00 0.00 H new ATOM 1520 N TYR A 104 -1.173 -9.476 -8.771 1.00 0.00 N ATOM 1521 CA TYR A 104 -1.719 -9.575 -7.416 1.00 0.00 C ATOM 1522 C TYR A 104 -2.730 -8.477 -7.153 1.00 0.00 C ATOM 1523 O TYR A 104 -2.912 -7.571 -7.955 1.00 0.00 O ATOM 1524 CB TYR A 104 -0.633 -9.609 -6.311 1.00 0.00 C ATOM 1525 CG TYR A 104 0.307 -10.764 -6.524 1.00 0.00 C ATOM 1526 CD1 TYR A 104 -0.169 -12.067 -6.557 1.00 0.00 C ATOM 1527 CD2 TYR A 104 1.666 -10.555 -6.623 1.00 0.00 C ATOM 1528 CE1 TYR A 104 0.696 -13.134 -6.679 1.00 0.00 C ATOM 1529 CE2 TYR A 104 2.536 -11.618 -6.726 1.00 0.00 C ATOM 1530 CZ TYR A 104 2.052 -12.910 -6.751 1.00 0.00 C ATOM 1531 OH TYR A 104 2.959 -13.985 -6.841 1.00 0.00 O ATOM 0 H TYR A 104 -0.854 -8.530 -8.982 1.00 0.00 H new ATOM 0 HA TYR A 104 -2.227 -10.538 -7.367 1.00 0.00 H new ATOM 0 HB2 TYR A 104 -0.074 -8.673 -6.315 1.00 0.00 H new ATOM 0 HB3 TYR A 104 -1.105 -9.694 -5.332 1.00 0.00 H new ATOM 0 HD1 TYR A 104 -1.231 -12.248 -6.486 1.00 0.00 H new ATOM 0 HD2 TYR A 104 2.053 -9.547 -6.620 1.00 0.00 H new ATOM 0 HE1 TYR A 104 0.311 -14.142 -6.718 1.00 0.00 H new ATOM 0 HE2 TYR A 104 3.599 -11.440 -6.787 1.00 0.00 H new ATOM 0 HH TYR A 104 2.532 -14.736 -7.304 1.00 0.00 H new ATOM 1541 N LYS A 105 -3.356 -8.529 -5.949 1.00 0.00 N ATOM 1542 CA LYS A 105 -4.107 -7.557 -5.237 1.00 0.00 C ATOM 1543 C LYS A 105 -3.121 -7.292 -4.095 1.00 0.00 C ATOM 1544 O LYS A 105 -2.209 -8.100 -3.888 1.00 0.00 O ATOM 1545 CB LYS A 105 -5.459 -8.146 -4.721 1.00 0.00 C ATOM 1546 CG LYS A 105 -5.412 -9.462 -3.917 1.00 0.00 C ATOM 1547 CD LYS A 105 -5.483 -10.743 -4.767 1.00 0.00 C ATOM 1548 CE LYS A 105 -5.112 -11.996 -3.961 1.00 0.00 C ATOM 1549 NZ LYS A 105 -5.197 -13.214 -4.800 1.00 0.00 N ATOM 0 H LYS A 105 -3.316 -9.394 -5.411 1.00 0.00 H new ATOM 0 HA LYS A 105 -4.411 -6.678 -5.805 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -5.937 -7.390 -4.098 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -6.106 -8.304 -5.584 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -4.492 -9.481 -3.333 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -6.240 -9.467 -3.208 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -6.491 -10.856 -5.167 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -4.810 -10.649 -5.619 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -4.101 -11.892 -3.566 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -5.780 -12.093 -3.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -4.941 -14.046 -4.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -6.168 -13.323 -5.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -4.541 -13.129 -5.603 1.00 0.00 H new ATOM 1563 N ARG A 106 -3.287 -6.185 -3.329 1.00 0.00 N ATOM 1564 CA ARG A 106 -2.424 -5.699 -2.210 1.00 0.00 C ATOM 1565 C ARG A 106 -1.682 -6.712 -1.314 1.00 0.00 C ATOM 1566 O ARG A 106 -0.496 -6.585 -1.046 1.00 0.00 O ATOM 1567 CB ARG A 106 -3.167 -4.721 -1.221 1.00 0.00 C ATOM 1568 CG ARG A 106 -2.946 -3.204 -1.460 1.00 0.00 C ATOM 1569 CD ARG A 106 -1.479 -2.744 -1.467 1.00 0.00 C ATOM 1570 NE ARG A 106 -0.771 -3.237 -0.242 1.00 0.00 N ATOM 1571 CZ ARG A 106 0.581 -3.107 -0.079 1.00 0.00 C ATOM 1572 NH1 ARG A 106 1.347 -2.522 -1.043 1.00 0.00 N ATOM 1573 NH2 ARG A 106 1.164 -3.532 1.074 1.00 0.00 N ATOM 0 H ARG A 106 -4.080 -5.562 -3.483 1.00 0.00 H new ATOM 0 HA ARG A 106 -1.665 -5.215 -2.824 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -4.236 -4.924 -1.278 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -2.851 -4.957 -0.205 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -3.398 -2.934 -2.414 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -3.479 -2.650 -0.687 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -0.978 -3.119 -2.360 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -1.433 -1.656 -1.508 1.00 0.00 H new ATOM 0 HE ARG A 106 -1.315 -3.685 0.495 1.00 0.00 H new ATOM 0 HH11 ARG A 106 0.913 -2.175 -1.898 1.00 0.00 H new ATOM 0 HH12 ARG A 106 2.354 -2.431 -0.909 1.00 0.00 H new ATOM 0 HH21 ARG A 106 0.594 -3.945 1.812 1.00 0.00 H new ATOM 0 HH22 ARG A 106 2.172 -3.438 1.201 1.00 0.00 H new ATOM 1587 N MET A 107 -2.370 -7.773 -0.840 1.00 0.00 N ATOM 1588 CA MET A 107 -1.910 -8.783 0.112 1.00 0.00 C ATOM 1589 C MET A 107 -0.761 -9.704 -0.329 1.00 0.00 C ATOM 1590 O MET A 107 -0.106 -10.330 0.505 1.00 0.00 O ATOM 1591 CB MET A 107 -3.136 -9.548 0.675 1.00 0.00 C ATOM 1592 CG MET A 107 -3.927 -10.311 -0.406 1.00 0.00 C ATOM 1593 SD MET A 107 -5.569 -10.880 0.137 1.00 0.00 S ATOM 1594 CE MET A 107 -4.986 -12.233 1.201 1.00 0.00 C ATOM 0 H MET A 107 -3.329 -7.950 -1.140 1.00 0.00 H new ATOM 0 HA MET A 107 -1.415 -8.227 0.908 1.00 0.00 H new ATOM 0 HB2 MET A 107 -2.798 -10.253 1.434 1.00 0.00 H new ATOM 0 HB3 MET A 107 -3.801 -8.841 1.171 1.00 0.00 H new ATOM 0 HG2 MET A 107 -4.047 -9.666 -1.276 1.00 0.00 H new ATOM 0 HG3 MET A 107 -3.343 -11.174 -0.727 1.00 0.00 H new ATOM 0 HE1 MET A 107 -5.419 -13.174 0.862 1.00 0.00 H new ATOM 0 HE2 MET A 107 -3.899 -12.294 1.149 1.00 0.00 H new ATOM 0 HE3 MET A 107 -5.290 -12.043 2.230 1.00 0.00 H new ATOM 1604 N ALA A 108 -0.435 -9.768 -1.660 1.00 0.00 N ATOM 1605 CA ALA A 108 0.731 -10.510 -2.149 1.00 0.00 C ATOM 1606 C ALA A 108 1.907 -9.663 -2.559 1.00 0.00 C ATOM 1607 O ALA A 108 2.983 -10.183 -2.825 1.00 0.00 O ATOM 1608 CB ALA A 108 0.391 -11.541 -3.269 1.00 0.00 C ATOM 0 H ALA A 108 -0.974 -9.310 -2.395 1.00 0.00 H new ATOM 0 HA ALA A 108 1.045 -11.060 -1.262 1.00 0.00 H new ATOM 0 HB1 ALA A 108 1.302 -12.052 -3.582 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -0.322 -12.271 -2.887 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -0.044 -11.021 -4.122 1.00 0.00 H new ATOM 1614 N VAL A 109 1.703 -8.354 -2.671 1.00 0.00 N ATOM 1615 CA VAL A 109 2.673 -7.336 -3.061 1.00 0.00 C ATOM 1616 C VAL A 109 2.779 -6.193 -2.045 1.00 0.00 C ATOM 1617 O VAL A 109 2.048 -5.200 -2.077 1.00 0.00 O ATOM 1618 CB VAL A 109 2.468 -6.917 -4.514 1.00 0.00 C ATOM 1619 CG1 VAL A 109 1.021 -6.424 -4.783 1.00 0.00 C ATOM 1620 CG2 VAL A 109 3.597 -5.958 -4.953 1.00 0.00 C ATOM 0 H VAL A 109 0.788 -7.947 -2.477 1.00 0.00 H new ATOM 0 HA VAL A 109 3.670 -7.776 -3.031 1.00 0.00 H new ATOM 0 HB VAL A 109 2.556 -7.788 -5.163 1.00 0.00 H new ATOM 0 HG11 VAL A 109 0.923 -6.137 -5.830 1.00 0.00 H new ATOM 0 HG12 VAL A 109 0.316 -7.225 -4.559 1.00 0.00 H new ATOM 0 HG13 VAL A 109 0.806 -5.564 -4.149 1.00 0.00 H new ATOM 0 HG21 VAL A 109 3.442 -5.665 -5.991 1.00 0.00 H new ATOM 0 HG22 VAL A 109 3.587 -5.071 -4.320 1.00 0.00 H new ATOM 0 HG23 VAL A 109 4.559 -6.461 -4.858 1.00 0.00 H new ATOM 1630 N ILE A 110 3.738 -6.285 -1.122 1.00 0.00 N ATOM 1631 CA ILE A 110 3.976 -5.386 0.010 1.00 0.00 C ATOM 1632 C ILE A 110 5.053 -4.323 -0.248 1.00 0.00 C ATOM 1633 O ILE A 110 5.688 -4.353 -1.299 1.00 0.00 O ATOM 1634 CB ILE A 110 4.286 -6.216 1.261 1.00 0.00 C ATOM 1635 CG1 ILE A 110 4.894 -7.602 0.919 1.00 0.00 C ATOM 1636 CG2 ILE A 110 2.959 -6.426 2.030 1.00 0.00 C ATOM 1637 CD1 ILE A 110 5.723 -8.204 2.051 1.00 0.00 C ATOM 0 H ILE A 110 4.418 -7.045 -1.147 1.00 0.00 H new ATOM 0 HA ILE A 110 3.061 -4.815 0.164 1.00 0.00 H new ATOM 0 HB ILE A 110 5.023 -5.678 1.857 1.00 0.00 H new ATOM 0 HG12 ILE A 110 4.088 -8.290 0.665 1.00 0.00 H new ATOM 0 HG13 ILE A 110 5.521 -7.505 0.033 1.00 0.00 H new ATOM 0 HG21 ILE A 110 3.148 -7.015 2.928 1.00 0.00 H new ATOM 0 HG22 ILE A 110 2.545 -5.458 2.312 1.00 0.00 H new ATOM 0 HG23 ILE A 110 2.249 -6.953 1.393 1.00 0.00 H new ATOM 0 HD11 ILE A 110 6.116 -9.172 1.739 1.00 0.00 H new ATOM 0 HD12 ILE A 110 6.551 -7.537 2.290 1.00 0.00 H new ATOM 0 HD13 ILE A 110 5.095 -8.334 2.933 1.00 0.00 H new ATOM 1649 N LEU A 111 5.320 -3.391 0.725 1.00 0.00 N ATOM 1650 CA LEU A 111 6.375 -2.363 0.551 1.00 0.00 C ATOM 1651 C LEU A 111 7.097 -1.982 1.860 1.00 0.00 C ATOM 1652 O LEU A 111 6.523 -2.110 2.934 1.00 0.00 O ATOM 1653 CB LEU A 111 5.809 -1.091 -0.146 1.00 0.00 C ATOM 1654 CG LEU A 111 4.320 -0.782 0.113 1.00 0.00 C ATOM 1655 CD1 LEU A 111 3.970 -0.757 1.563 1.00 0.00 C ATOM 1656 CD2 LEU A 111 4.017 0.602 -0.410 1.00 0.00 C ATOM 0 H LEU A 111 4.825 -3.340 1.615 1.00 0.00 H new ATOM 0 HA LEU A 111 7.127 -2.822 -0.091 1.00 0.00 H new ATOM 0 HB2 LEU A 111 6.399 -0.232 0.175 1.00 0.00 H new ATOM 0 HB3 LEU A 111 5.956 -1.194 -1.221 1.00 0.00 H new ATOM 0 HG LEU A 111 3.750 -1.570 -0.379 1.00 0.00 H new ATOM 0 HD11 LEU A 111 2.909 -0.534 1.677 1.00 0.00 H new ATOM 0 HD12 LEU A 111 4.187 -1.729 2.006 1.00 0.00 H new ATOM 0 HD13 LEU A 111 4.558 0.011 2.066 1.00 0.00 H new ATOM 0 HD21 LEU A 111 2.967 0.836 -0.234 1.00 0.00 H new ATOM 0 HD22 LEU A 111 4.642 1.331 0.106 1.00 0.00 H new ATOM 0 HD23 LEU A 111 4.223 0.640 -1.480 1.00 0.00 H new ATOM 1668 N SER A 112 8.369 -1.488 1.823 1.00 0.00 N ATOM 1669 CA SER A 112 9.176 -1.110 3.003 1.00 0.00 C ATOM 1670 C SER A 112 9.307 0.410 3.203 1.00 0.00 C ATOM 1671 O SER A 112 8.950 1.166 2.304 1.00 0.00 O ATOM 1672 CB SER A 112 10.553 -1.836 2.986 1.00 0.00 C ATOM 1673 OG SER A 112 11.334 -1.553 1.824 1.00 0.00 O ATOM 0 H SER A 112 8.866 -1.341 0.945 1.00 0.00 H new ATOM 0 HA SER A 112 8.628 -1.454 3.880 1.00 0.00 H new ATOM 0 HB2 SER A 112 11.118 -1.547 3.872 1.00 0.00 H new ATOM 0 HB3 SER A 112 10.388 -2.912 3.050 1.00 0.00 H new ATOM 0 HG SER A 112 12.184 -2.037 1.876 1.00 0.00 H new ATOM 1679 N LEU A 113 9.839 0.948 4.367 1.00 0.00 N ATOM 1680 CA LEU A 113 9.985 2.407 4.627 1.00 0.00 C ATOM 1681 C LEU A 113 10.858 3.150 3.675 1.00 0.00 C ATOM 1682 O LEU A 113 10.412 4.156 3.210 1.00 0.00 O ATOM 1683 CB LEU A 113 10.438 2.950 6.007 1.00 0.00 C ATOM 1684 CG LEU A 113 9.692 2.480 7.270 1.00 0.00 C ATOM 1685 CD1 LEU A 113 10.691 2.457 8.439 1.00 0.00 C ATOM 1686 CD2 LEU A 113 8.475 3.354 7.621 1.00 0.00 C ATOM 0 H LEU A 113 10.172 0.368 5.137 1.00 0.00 H new ATOM 0 HA LEU A 113 8.915 2.587 4.522 1.00 0.00 H new ATOM 0 HB2 LEU A 113 11.491 2.697 6.132 1.00 0.00 H new ATOM 0 HB3 LEU A 113 10.374 4.038 5.971 1.00 0.00 H new ATOM 0 HG LEU A 113 9.294 1.484 7.075 1.00 0.00 H new ATOM 0 HD11 LEU A 113 10.183 2.127 9.345 1.00 0.00 H new ATOM 0 HD12 LEU A 113 11.505 1.770 8.208 1.00 0.00 H new ATOM 0 HD13 LEU A 113 11.094 3.458 8.593 1.00 0.00 H new ATOM 0 HD21 LEU A 113 7.996 2.967 8.520 1.00 0.00 H new ATOM 0 HD22 LEU A 113 8.802 4.379 7.796 1.00 0.00 H new ATOM 0 HD23 LEU A 113 7.764 3.336 6.795 1.00 0.00 H new ATOM 1698 N GLU A 114 12.082 2.787 3.296 1.00 0.00 N ATOM 1699 CA GLU A 114 12.820 3.592 2.270 1.00 0.00 C ATOM 1700 C GLU A 114 12.297 3.643 0.817 1.00 0.00 C ATOM 1701 O GLU A 114 12.658 4.523 0.042 1.00 0.00 O ATOM 1702 CB GLU A 114 14.314 3.898 2.524 1.00 0.00 C ATOM 1703 CG GLU A 114 14.435 5.301 3.183 1.00 0.00 C ATOM 1704 CD GLU A 114 15.898 5.640 3.443 1.00 0.00 C ATOM 1705 OE1 GLU A 114 16.665 5.754 2.450 1.00 0.00 O ATOM 1706 OE2 GLU A 114 16.269 5.793 4.638 1.00 0.00 O ATOM 0 H GLU A 114 12.586 1.976 3.655 1.00 0.00 H new ATOM 0 HA GLU A 114 12.395 4.554 2.557 1.00 0.00 H new ATOM 0 HB2 GLU A 114 14.750 3.138 3.173 1.00 0.00 H new ATOM 0 HB3 GLU A 114 14.869 3.873 1.586 1.00 0.00 H new ATOM 0 HG2 GLU A 114 13.990 6.055 2.533 1.00 0.00 H new ATOM 0 HG3 GLU A 114 13.879 5.319 4.120 1.00 0.00 H new ATOM 1713 N GLN A 115 11.303 2.763 0.514 1.00 0.00 N ATOM 1714 CA GLN A 115 10.380 2.793 -0.620 1.00 0.00 C ATOM 1715 C GLN A 115 9.143 3.670 -0.302 1.00 0.00 C ATOM 1716 O GLN A 115 8.582 4.341 -1.162 1.00 0.00 O ATOM 1717 CB GLN A 115 9.845 1.384 -0.961 1.00 0.00 C ATOM 1718 CG GLN A 115 10.935 0.304 -0.985 1.00 0.00 C ATOM 1719 CD GLN A 115 10.247 -1.030 -1.251 1.00 0.00 C ATOM 1720 OE1 GLN A 115 9.819 -1.169 -2.523 1.00 0.00 O flip ATOM 1721 NE2 GLN A 115 10.053 -1.894 -0.389 1.00 0.00 N flip ATOM 0 H GLN A 115 11.125 1.957 1.113 1.00 0.00 H new ATOM 0 HA GLN A 115 10.947 3.197 -1.459 1.00 0.00 H new ATOM 0 HB2 GLN A 115 9.085 1.106 -0.230 1.00 0.00 H new ATOM 0 HB3 GLN A 115 9.355 1.416 -1.934 1.00 0.00 H new ATOM 0 HG2 GLN A 115 11.671 0.518 -1.760 1.00 0.00 H new ATOM 0 HG3 GLN A 115 11.470 0.278 -0.036 1.00 0.00 H new ATOM 0 HE21 GLN A 115 10.393 -1.751 0.562 1.00 0.00 H new ATOM 0 HE22 GLN A 115 9.553 -2.750 -0.629 1.00 0.00 H new ATOM 1730 N GLY A 116 8.723 3.679 0.987 1.00 0.00 N ATOM 1731 CA GLY A 116 7.673 4.433 1.649 1.00 0.00 C ATOM 1732 C GLY A 116 8.001 5.879 1.925 1.00 0.00 C ATOM 1733 O GLY A 116 7.271 6.753 1.516 1.00 0.00 O ATOM 0 H GLY A 116 9.187 3.070 1.661 1.00 0.00 H new ATOM 0 HA2 GLY A 116 6.774 4.391 1.034 1.00 0.00 H new ATOM 0 HA3 GLY A 116 7.436 3.944 2.594 1.00 0.00 H new ATOM 1737 N ASN A 117 9.127 6.205 2.593 1.00 0.00 N ATOM 1738 CA ASN A 117 9.668 7.509 2.987 1.00 0.00 C ATOM 1739 C ASN A 117 10.164 8.343 1.815 1.00 0.00 C ATOM 1740 O ASN A 117 10.117 9.571 1.831 1.00 0.00 O ATOM 1741 CB ASN A 117 10.790 7.395 4.061 1.00 0.00 C ATOM 1742 CG ASN A 117 10.215 6.949 5.409 1.00 0.00 C ATOM 1743 OD1 ASN A 117 9.023 6.702 5.593 1.00 0.00 O ATOM 1744 ND2 ASN A 117 11.117 6.869 6.415 1.00 0.00 N ATOM 0 H ASN A 117 9.752 5.461 2.905 1.00 0.00 H new ATOM 0 HA ASN A 117 8.817 8.030 3.426 1.00 0.00 H new ATOM 0 HB2 ASN A 117 11.545 6.682 3.730 1.00 0.00 H new ATOM 0 HB3 ASN A 117 11.289 8.357 4.175 1.00 0.00 H new ATOM 0 HD21 ASN A 117 10.814 6.599 7.351 1.00 0.00 H new ATOM 0 HD22 ASN A 117 12.099 7.079 6.237 1.00 0.00 H new ATOM 1751 N ARG A 118 10.589 7.663 0.709 1.00 0.00 N ATOM 1752 CA ARG A 118 11.003 8.287 -0.539 1.00 0.00 C ATOM 1753 C ARG A 118 9.789 8.901 -1.278 1.00 0.00 C ATOM 1754 O ARG A 118 9.881 9.910 -1.965 1.00 0.00 O ATOM 1755 CB ARG A 118 11.721 7.311 -1.506 1.00 0.00 C ATOM 1756 CG ARG A 118 10.831 6.197 -2.096 1.00 0.00 C ATOM 1757 CD ARG A 118 10.693 6.203 -3.626 1.00 0.00 C ATOM 1758 NE ARG A 118 12.037 5.915 -4.236 1.00 0.00 N ATOM 1759 CZ ARG A 118 12.206 5.579 -5.554 1.00 0.00 C ATOM 1760 NH1 ARG A 118 11.140 5.500 -6.401 1.00 0.00 N ATOM 1761 NH2 ARG A 118 13.463 5.320 -6.024 1.00 0.00 N ATOM 0 H ARG A 118 10.646 6.645 0.683 1.00 0.00 H new ATOM 0 HA ARG A 118 11.713 9.063 -0.253 1.00 0.00 H new ATOM 0 HB2 ARG A 118 12.147 7.887 -2.328 1.00 0.00 H new ATOM 0 HB3 ARG A 118 12.553 6.847 -0.977 1.00 0.00 H new ATOM 0 HG2 ARG A 118 11.235 5.232 -1.789 1.00 0.00 H new ATOM 0 HG3 ARG A 118 9.836 6.280 -1.658 1.00 0.00 H new ATOM 0 HD2 ARG A 118 9.967 5.454 -3.942 1.00 0.00 H new ATOM 0 HD3 ARG A 118 10.323 7.170 -3.968 1.00 0.00 H new ATOM 0 HE ARG A 118 12.863 5.972 -3.640 1.00 0.00 H new ATOM 0 HH11 ARG A 118 10.199 5.692 -6.056 1.00 0.00 H new ATOM 0 HH12 ARG A 118 11.283 5.249 -7.379 1.00 0.00 H new ATOM 0 HH21 ARG A 118 14.264 5.378 -5.396 1.00 0.00 H new ATOM 0 HH22 ARG A 118 13.600 5.069 -7.003 1.00 0.00 H new ATOM 1775 N LEU A 119 8.608 8.232 -1.080 1.00 0.00 N ATOM 1776 CA LEU A 119 7.248 8.483 -1.538 1.00 0.00 C ATOM 1777 C LEU A 119 6.519 9.397 -0.604 1.00 0.00 C ATOM 1778 O LEU A 119 5.837 10.299 -1.075 1.00 0.00 O ATOM 1779 CB LEU A 119 6.381 7.173 -1.626 1.00 0.00 C ATOM 1780 CG LEU A 119 5.030 7.391 -2.324 1.00 0.00 C ATOM 1781 CD1 LEU A 119 4.593 6.256 -3.238 1.00 0.00 C ATOM 1782 CD2 LEU A 119 3.903 7.492 -1.327 1.00 0.00 C ATOM 0 H LEU A 119 8.620 7.386 -0.510 1.00 0.00 H new ATOM 0 HA LEU A 119 7.365 8.925 -2.528 1.00 0.00 H new ATOM 0 HB2 LEU A 119 6.942 6.409 -2.164 1.00 0.00 H new ATOM 0 HB3 LEU A 119 6.206 6.792 -0.620 1.00 0.00 H new ATOM 0 HG LEU A 119 5.202 8.303 -2.896 1.00 0.00 H new ATOM 0 HD11 LEU A 119 3.629 6.500 -3.685 1.00 0.00 H new ATOM 0 HD12 LEU A 119 5.334 6.117 -4.025 1.00 0.00 H new ATOM 0 HD13 LEU A 119 4.502 5.337 -2.659 1.00 0.00 H new ATOM 0 HD21 LEU A 119 2.962 7.646 -1.856 1.00 0.00 H new ATOM 0 HD22 LEU A 119 3.847 6.571 -0.747 1.00 0.00 H new ATOM 0 HD23 LEU A 119 4.084 8.332 -0.657 1.00 0.00 H new ATOM 1794 N ARG A 120 6.559 9.137 0.725 1.00 0.00 N ATOM 1795 CA ARG A 120 5.750 9.691 1.801 1.00 0.00 C ATOM 1796 C ARG A 120 5.305 11.162 1.747 1.00 0.00 C ATOM 1797 O ARG A 120 4.147 11.484 1.967 1.00 0.00 O ATOM 1798 CB ARG A 120 6.388 9.362 3.230 1.00 0.00 C ATOM 1799 CG ARG A 120 7.428 10.361 3.802 1.00 0.00 C ATOM 1800 CD ARG A 120 7.795 10.044 5.259 1.00 0.00 C ATOM 1801 NE ARG A 120 8.796 11.059 5.736 1.00 0.00 N ATOM 1802 CZ ARG A 120 9.380 10.999 6.974 1.00 0.00 C ATOM 1803 NH1 ARG A 120 9.096 9.979 7.834 1.00 0.00 N ATOM 1804 NH2 ARG A 120 10.259 11.975 7.349 1.00 0.00 N ATOM 0 H ARG A 120 7.232 8.464 1.091 1.00 0.00 H new ATOM 0 HA ARG A 120 4.809 9.167 1.632 1.00 0.00 H new ATOM 0 HB2 ARG A 120 5.574 9.277 3.949 1.00 0.00 H new ATOM 0 HB3 ARG A 120 6.862 8.383 3.168 1.00 0.00 H new ATOM 0 HG2 ARG A 120 8.329 10.337 3.189 1.00 0.00 H new ATOM 0 HG3 ARG A 120 7.029 11.373 3.742 1.00 0.00 H new ATOM 0 HD2 ARG A 120 6.904 10.068 5.887 1.00 0.00 H new ATOM 0 HD3 ARG A 120 8.211 9.039 5.334 1.00 0.00 H new ATOM 0 HE ARG A 120 9.051 11.824 5.112 1.00 0.00 H new ATOM 0 HH11 ARG A 120 8.441 9.247 7.559 1.00 0.00 H new ATOM 0 HH12 ARG A 120 9.539 9.948 8.752 1.00 0.00 H new ATOM 0 HH21 ARG A 120 10.475 12.740 6.709 1.00 0.00 H new ATOM 0 HH22 ARG A 120 10.699 11.939 8.269 1.00 0.00 H new ATOM 1818 N GLU A 121 6.239 12.074 1.378 1.00 0.00 N ATOM 1819 CA GLU A 121 6.055 13.501 1.214 1.00 0.00 C ATOM 1820 C GLU A 121 5.603 13.921 -0.190 1.00 0.00 C ATOM 1821 O GLU A 121 5.105 15.033 -0.350 1.00 0.00 O ATOM 1822 CB GLU A 121 7.371 14.226 1.614 1.00 0.00 C ATOM 1823 CG GLU A 121 8.636 13.694 0.906 1.00 0.00 C ATOM 1824 CD GLU A 121 9.862 14.468 1.392 1.00 0.00 C ATOM 1825 OE1 GLU A 121 10.171 14.382 2.611 1.00 0.00 O ATOM 1826 OE2 GLU A 121 10.506 15.149 0.551 1.00 0.00 O ATOM 0 H GLU A 121 7.199 11.792 1.178 1.00 0.00 H new ATOM 0 HA GLU A 121 5.237 13.797 1.871 1.00 0.00 H new ATOM 0 HB2 GLU A 121 7.267 15.289 1.394 1.00 0.00 H new ATOM 0 HB3 GLU A 121 7.508 14.135 2.692 1.00 0.00 H new ATOM 0 HG2 GLU A 121 8.760 12.631 1.112 1.00 0.00 H new ATOM 0 HG3 GLU A 121 8.532 13.799 -0.174 1.00 0.00 H new ATOM 1833 N GLN A 122 5.759 13.043 -1.225 1.00 0.00 N ATOM 1834 CA GLN A 122 5.368 13.260 -2.606 1.00 0.00 C ATOM 1835 C GLN A 122 4.044 12.576 -2.943 1.00 0.00 C ATOM 1836 O GLN A 122 3.215 13.213 -3.594 1.00 0.00 O ATOM 1837 CB GLN A 122 6.499 12.962 -3.659 1.00 0.00 C ATOM 1838 CG GLN A 122 7.218 11.585 -3.613 1.00 0.00 C ATOM 1839 CD GLN A 122 8.257 11.429 -4.747 1.00 0.00 C ATOM 1840 OE1 GLN A 122 8.028 11.798 -5.903 1.00 0.00 O ATOM 1841 NE2 GLN A 122 9.434 10.835 -4.433 1.00 0.00 N ATOM 0 H GLN A 122 6.184 12.126 -1.086 1.00 0.00 H new ATOM 0 HA GLN A 122 5.202 14.334 -2.690 1.00 0.00 H new ATOM 0 HB2 GLN A 122 6.064 13.075 -4.652 1.00 0.00 H new ATOM 0 HB3 GLN A 122 7.260 13.736 -3.555 1.00 0.00 H new ATOM 0 HG2 GLN A 122 7.714 11.469 -2.650 1.00 0.00 H new ATOM 0 HG3 GLN A 122 6.478 10.788 -3.689 1.00 0.00 H new ATOM 0 HE21 GLN A 122 9.614 10.534 -3.475 1.00 0.00 H new ATOM 0 HE22 GLN A 122 10.140 10.689 -5.154 1.00 0.00 H new ATOM 1850 N TYR A 123 3.781 11.276 -2.555 1.00 0.00 N ATOM 1851 CA TYR A 123 2.524 10.642 -3.011 1.00 0.00 C ATOM 1852 C TYR A 123 1.553 10.103 -1.969 1.00 0.00 C ATOM 1853 O TYR A 123 0.412 9.845 -2.353 1.00 0.00 O ATOM 1854 CB TYR A 123 2.695 9.530 -4.107 1.00 0.00 C ATOM 1855 CG TYR A 123 3.650 9.913 -5.202 1.00 0.00 C ATOM 1856 CD1 TYR A 123 3.496 11.055 -5.964 1.00 0.00 C ATOM 1857 CD2 TYR A 123 4.744 9.117 -5.447 1.00 0.00 C ATOM 1858 CE1 TYR A 123 4.441 11.394 -6.914 1.00 0.00 C ATOM 1859 CE2 TYR A 123 5.705 9.458 -6.359 1.00 0.00 C ATOM 1860 CZ TYR A 123 5.550 10.599 -7.116 1.00 0.00 C ATOM 1861 OH TYR A 123 6.584 11.035 -7.969 1.00 0.00 O ATOM 0 H TYR A 123 4.385 10.698 -1.970 1.00 0.00 H new ATOM 0 HA TYR A 123 2.069 11.540 -3.429 1.00 0.00 H new ATOM 0 HB2 TYR A 123 3.046 8.614 -3.633 1.00 0.00 H new ATOM 0 HB3 TYR A 123 1.722 9.309 -4.545 1.00 0.00 H new ATOM 0 HD1 TYR A 123 2.632 11.686 -5.817 1.00 0.00 H new ATOM 0 HD2 TYR A 123 4.848 8.191 -4.901 1.00 0.00 H new ATOM 0 HE1 TYR A 123 4.310 12.289 -7.503 1.00 0.00 H new ATOM 0 HE2 TYR A 123 6.580 8.837 -6.485 1.00 0.00 H new ATOM 0 HH TYR A 123 7.338 11.356 -7.432 1.00 0.00 H new ATOM 1871 N GLY A 124 1.857 9.840 -0.652 1.00 0.00 N ATOM 1872 CA GLY A 124 0.824 9.216 0.082 1.00 0.00 C ATOM 1873 C GLY A 124 1.367 9.053 1.428 1.00 0.00 C ATOM 1874 O GLY A 124 0.749 9.567 2.350 1.00 0.00 O ATOM 0 H GLY A 124 2.729 10.044 -0.163 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -0.079 9.827 0.091 1.00 0.00 H new ATOM 0 HA3 GLY A 124 0.554 8.254 -0.355 1.00 0.00 H new ATOM 1878 N LEU A 125 2.521 8.309 1.571 1.00 0.00 N ATOM 1879 CA LEU A 125 3.076 7.666 2.784 1.00 0.00 C ATOM 1880 C LEU A 125 3.201 8.458 4.105 1.00 0.00 C ATOM 1881 O LEU A 125 3.609 7.903 5.119 1.00 0.00 O ATOM 1882 CB LEU A 125 4.216 6.567 2.538 1.00 0.00 C ATOM 1883 CG LEU A 125 3.743 5.102 2.316 1.00 0.00 C ATOM 1884 CD1 LEU A 125 2.613 4.646 3.219 1.00 0.00 C ATOM 1885 CD2 LEU A 125 3.367 4.749 0.875 1.00 0.00 C ATOM 0 H LEU A 125 3.123 8.141 0.765 1.00 0.00 H new ATOM 0 HA LEU A 125 2.177 7.104 3.038 1.00 0.00 H new ATOM 0 HB2 LEU A 125 4.799 6.871 1.668 1.00 0.00 H new ATOM 0 HB3 LEU A 125 4.891 6.580 3.394 1.00 0.00 H new ATOM 0 HG LEU A 125 4.650 4.560 2.585 1.00 0.00 H new ATOM 0 HD11 LEU A 125 2.356 3.613 2.987 1.00 0.00 H new ATOM 0 HD12 LEU A 125 2.928 4.716 4.260 1.00 0.00 H new ATOM 0 HD13 LEU A 125 1.741 5.281 3.060 1.00 0.00 H new ATOM 0 HD21 LEU A 125 3.051 3.707 0.826 1.00 0.00 H new ATOM 0 HD22 LEU A 125 2.551 5.391 0.544 1.00 0.00 H new ATOM 0 HD23 LEU A 125 4.231 4.897 0.227 1.00 0.00 H new ATOM 1897 N GLY A 126 2.748 9.743 4.143 1.00 0.00 N ATOM 1898 CA GLY A 126 2.484 10.453 5.405 1.00 0.00 C ATOM 1899 C GLY A 126 2.011 11.901 5.337 1.00 0.00 C ATOM 1900 O GLY A 126 2.889 12.750 5.266 1.00 0.00 O ATOM 0 H GLY A 126 2.562 10.299 3.308 1.00 0.00 H new ATOM 0 HA2 GLY A 126 1.734 9.884 5.955 1.00 0.00 H new ATOM 0 HA3 GLY A 126 3.399 10.430 5.997 1.00 0.00 H new ATOM 1904 N PRO A 127 0.716 12.369 5.436 1.00 0.00 N ATOM 1905 CA PRO A 127 0.357 13.793 5.384 1.00 0.00 C ATOM 1906 C PRO A 127 0.621 14.540 6.711 1.00 0.00 C ATOM 1907 O PRO A 127 0.473 15.759 6.741 1.00 0.00 O ATOM 1908 CB PRO A 127 -1.145 13.754 5.034 1.00 0.00 C ATOM 1909 CG PRO A 127 -1.666 12.533 5.791 1.00 0.00 C ATOM 1910 CD PRO A 127 -0.476 11.552 5.671 1.00 0.00 C ATOM 0 HA PRO A 127 0.960 14.345 4.663 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -1.653 14.666 5.349 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -1.303 13.656 3.960 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -1.900 12.766 6.830 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -2.574 12.131 5.342 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -0.368 10.961 6.580 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -0.633 10.851 4.852 1.00 0.00 H new ATOM 1918 N TYR A 128 1.032 13.847 7.810 1.00 0.00 N ATOM 1919 CA TYR A 128 1.446 14.452 9.063 1.00 0.00 C ATOM 1920 C TYR A 128 2.917 14.091 9.296 1.00 0.00 C ATOM 1921 O TYR A 128 3.306 12.930 9.200 1.00 0.00 O ATOM 1922 CB TYR A 128 0.519 13.982 10.220 1.00 0.00 C ATOM 1923 CG TYR A 128 0.746 14.696 11.538 1.00 0.00 C ATOM 1924 CD1 TYR A 128 0.650 16.075 11.635 1.00 0.00 C ATOM 1925 CD2 TYR A 128 1.041 13.973 12.681 1.00 0.00 C ATOM 1926 CE1 TYR A 128 0.844 16.717 12.846 1.00 0.00 C ATOM 1927 CE2 TYR A 128 1.230 14.610 13.891 1.00 0.00 C ATOM 1928 CZ TYR A 128 1.129 15.981 13.978 1.00 0.00 C ATOM 1929 OH TYR A 128 1.309 16.606 15.230 1.00 0.00 O ATOM 0 H TYR A 128 1.078 12.828 7.827 1.00 0.00 H new ATOM 0 HA TYR A 128 1.357 15.538 9.026 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -0.519 14.125 9.918 1.00 0.00 H new ATOM 0 HB3 TYR A 128 0.662 12.912 10.372 1.00 0.00 H new ATOM 0 HD1 TYR A 128 0.421 16.657 10.754 1.00 0.00 H new ATOM 0 HD2 TYR A 128 1.124 12.898 12.625 1.00 0.00 H new ATOM 0 HE1 TYR A 128 0.772 17.793 12.905 1.00 0.00 H new ATOM 0 HE2 TYR A 128 1.458 14.031 14.774 1.00 0.00 H new ATOM 0 HH TYR A 128 1.501 15.927 15.910 1.00 0.00 H new ATOM 1939 N GLU A 129 3.752 15.103 9.628 1.00 0.00 N ATOM 1940 CA GLU A 129 5.162 14.980 9.960 1.00 0.00 C ATOM 1941 C GLU A 129 5.305 15.773 11.243 1.00 0.00 C ATOM 1942 O GLU A 129 4.638 16.796 11.407 1.00 0.00 O ATOM 1943 CB GLU A 129 6.113 15.546 8.855 1.00 0.00 C ATOM 1944 CG GLU A 129 6.663 14.496 7.861 1.00 0.00 C ATOM 1945 CD GLU A 129 5.583 13.933 6.942 1.00 0.00 C ATOM 1946 OE1 GLU A 129 4.920 14.742 6.238 1.00 0.00 O ATOM 1947 OE2 GLU A 129 5.416 12.684 6.922 1.00 0.00 O ATOM 0 H GLU A 129 3.429 16.070 9.669 1.00 0.00 H new ATOM 0 HA GLU A 129 5.451 13.933 10.055 1.00 0.00 H new ATOM 0 HB2 GLU A 129 5.576 16.310 8.292 1.00 0.00 H new ATOM 0 HB3 GLU A 129 6.955 16.040 9.340 1.00 0.00 H new ATOM 0 HG2 GLU A 129 7.448 14.950 7.257 1.00 0.00 H new ATOM 0 HG3 GLU A 129 7.122 13.679 8.418 1.00 0.00 H new TER 1954 GLU A 129