USER MOD reduce.3.24.130724 H: found=0, std=0, add=881, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 879 hydrogens (32 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 NoAdj-H: A 18 HIS HE2 : A 18 HIS NE2 : A 105 HECFE :(H bumps) USER MOD NoAdj-H: A 105 HEC HAC : A 105 HEC CAC : A 17 CYS SG :(H bumps) USER MOD NoAdj-H: A 105 HEC HAB : A 105 HEC CAB : A 14 CYS SG :(H bumps) USER MOD Set 1.1: A 102 THR OG1 : rot 110:sc= 0.83 USER MOD Set 1.2: A 103 ASN : amide:sc= 2.03 K(o=2.9,f=0.9) USER MOD Set 2.1: A 87 LYS NZ :NH3+ 163:sc= 2.26 (180deg=1.02) USER MOD Set 2.2: A 89 THR OG1 : rot -150:sc= 0.881 USER MOD Set 3.1: A 49 THR OG1 : rot -177:sc= 0.983 USER MOD Set 3.2: A 52 ASN :FLIP amide:sc= -2.37! C(o=-2.7!,f=3.3!) USER MOD Set 3.3: A 53 LYS NZ :NH3+ 132:sc= 1.65 (180deg=-2.87!) USER MOD Set 3.4: A 78 THR OG1 : rot -35:sc= 1.18 USER MOD Set 3.5: A 79 LYS NZ :NH3+ -145:sc= 0.725 (180deg=-0.418) USER MOD Set 3.6: A 105 HEC O2D : rot 156:sc= 1.11 USER MOD Set 4.1: A 39 LYS NZ :NH3+ 172:sc= 1.79 (180deg=0.114!) USER MOD Set 4.2: A 58 THR OG1 : rot -169:sc= 0.945 USER MOD Set 5.1: A 19 THR OG1 : rot -20:sc= 2.21 USER MOD Set 5.2: A 27 LYS NZ :NH3+ -179:sc= 1.25 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ -177:sc= 2.17 (180deg=2.03) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ -179:sc= 1.07 (180deg=1.07) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= 0.847 K(o=0.85,f=-0.052) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= 1 K(o=1,f=-0.033) USER MOD Single : A 22 LYS NZ :NH3+ 164:sc= 1.2 (180deg=1) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HE2:sc= 0.432 K(o=0.43,f=-2.9!) USER MOD Single : A 28 THR OG1 : rot 180:sc=-0.00107 USER MOD Single : A 31 ASN : amide:sc= 1.1 K(o=1.1,f=-0.91) USER MOD Single : A 33 HIS : no HE2:sc= -0.694 K(o=-0.69,f=-6!) USER MOD Single : A 40 THR OG1 : rot -75:sc= 1.08 USER MOD Single : A 42 GLN : amide:sc= 0 X(o=0,f=-0.08) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot -178:sc= 1.23 USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ -147:sc= 1.23 (180deg=1.07) USER MOD Single : A 63 THR OG1 : rot -154:sc= 0.87 USER MOD Single : A 65 MET CE :methyl 159:sc= -0.137 (180deg=-0.803) USER MOD Single : A 67 TYR OH : rot -129:sc= 1.15 USER MOD Single : A 70 ASN : amide:sc= 0.329 K(o=0.33,f=-6.4!) USER MOD Single : A 72 LYS NZ :NH3+ -176:sc= 1.26 (180deg=1.17) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 TYR OH : rot 30:sc= -0.56 USER MOD Single : A 80 MET CE :methyl 169:sc= 0 (180deg=-0.28) USER MOD Single : A 86 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.101) USER MOD Single : A 88 LYS NZ :NH3+ -128:sc= -0.26 (180deg=-1.39!) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ -179:sc= 1.18 (180deg=1.18) USER MOD Single : A 100 LYS NZ :NH3+ 177:sc= 1.27 (180deg=1.15) USER MOD Single : A 105 HEC O2A : rot 80:sc= 1.63 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.148 1.348 -0.982 1.00 10.00 N ATOM 2 CA GLY A 1 1.247 0.308 -0.472 1.00 10.00 C ATOM 3 C GLY A 1 0.747 0.684 0.899 1.00 10.00 C ATOM 4 O GLY A 1 1.533 0.796 1.833 1.00 10.00 O ATOM 0 H1 GLY A 1 2.447 1.105 -1.948 1.00 10.00 H new ATOM 0 H2 GLY A 1 1.652 2.262 -0.993 1.00 10.00 H new ATOM 0 H3 GLY A 1 2.984 1.415 -0.367 1.00 10.00 H new ATOM 0 HA2 GLY A 1 0.405 0.180 -1.152 1.00 10.00 H new ATOM 0 HA3 GLY A 1 1.770 -0.647 -0.428 1.00 10.00 H new ATOM 10 N ASP A 2 -0.554 0.931 0.978 1.00 10.00 N ATOM 11 CA ASP A 2 -1.183 1.813 1.948 1.00 10.00 C ATOM 12 C ASP A 2 -2.412 1.075 2.515 1.00 10.00 C ATOM 13 O ASP A 2 -3.466 1.035 1.880 1.00 10.00 O ATOM 14 CB ASP A 2 -1.577 3.117 1.225 1.00 10.00 C ATOM 15 CG ASP A 2 -0.456 3.940 0.556 1.00 10.00 C ATOM 16 OD1 ASP A 2 0.428 3.359 -0.122 1.00 10.00 O ATOM 17 OD2 ASP A 2 -0.561 5.181 0.658 1.00 10.00 O ATOM 0 H ASP A 2 -1.226 0.504 0.341 1.00 10.00 H new ATOM 0 HA ASP A 2 -0.518 2.070 2.772 1.00 10.00 H new ATOM 0 HB2 ASP A 2 -2.310 2.866 0.458 1.00 10.00 H new ATOM 0 HB3 ASP A 2 -2.079 3.761 1.947 1.00 10.00 H new ATOM 22 N VAL A 3 -2.264 0.417 3.671 1.00 10.00 N ATOM 23 CA VAL A 3 -3.169 -0.627 4.189 1.00 10.00 C ATOM 24 C VAL A 3 -4.657 -0.229 4.166 1.00 10.00 C ATOM 25 O VAL A 3 -5.516 -1.038 3.807 1.00 10.00 O ATOM 26 CB VAL A 3 -2.675 -1.087 5.583 1.00 10.00 C ATOM 27 CG1 VAL A 3 -2.651 0.011 6.652 1.00 10.00 C ATOM 28 CG2 VAL A 3 -3.499 -2.244 6.143 1.00 10.00 C ATOM 0 H VAL A 3 -1.481 0.601 4.299 1.00 10.00 H new ATOM 0 HA VAL A 3 -3.126 -1.478 3.509 1.00 10.00 H new ATOM 0 HB VAL A 3 -1.650 -1.398 5.383 1.00 10.00 H new ATOM 0 HG11 VAL A 3 -2.292 -0.405 7.593 1.00 10.00 H new ATOM 0 HG12 VAL A 3 -1.987 0.814 6.333 1.00 10.00 H new ATOM 0 HG13 VAL A 3 -3.657 0.406 6.791 1.00 10.00 H new ATOM 0 HG21 VAL A 3 -3.111 -2.527 7.121 1.00 10.00 H new ATOM 0 HG22 VAL A 3 -4.540 -1.935 6.241 1.00 10.00 H new ATOM 0 HG23 VAL A 3 -3.436 -3.097 5.467 1.00 10.00 H new ATOM 38 N GLU A 4 -4.975 1.028 4.482 1.00 10.00 N ATOM 39 CA GLU A 4 -6.328 1.569 4.485 1.00 10.00 C ATOM 40 C GLU A 4 -6.926 1.751 3.094 1.00 10.00 C ATOM 41 O GLU A 4 -8.147 1.646 2.944 1.00 10.00 O ATOM 42 CB GLU A 4 -6.366 2.954 5.150 1.00 10.00 C ATOM 43 CG GLU A 4 -5.882 3.019 6.608 1.00 10.00 C ATOM 44 CD GLU A 4 -4.354 2.989 6.782 1.00 10.00 C ATOM 45 OE1 GLU A 4 -3.633 3.004 5.753 1.00 10.00 O ATOM 46 OE2 GLU A 4 -3.929 2.894 7.952 1.00 10.00 O ATOM 0 H GLU A 4 -4.272 1.717 4.751 1.00 10.00 H new ATOM 0 HA GLU A 4 -6.911 0.829 5.034 1.00 10.00 H new ATOM 0 HB2 GLU A 4 -5.758 3.636 4.556 1.00 10.00 H new ATOM 0 HB3 GLU A 4 -7.390 3.325 5.112 1.00 10.00 H new ATOM 0 HG2 GLU A 4 -6.268 3.931 7.064 1.00 10.00 H new ATOM 0 HG3 GLU A 4 -6.313 2.181 7.157 1.00 10.00 H new ATOM 53 N LYS A 5 -6.078 2.066 2.106 1.00 10.00 N ATOM 54 CA LYS A 5 -6.432 2.171 0.692 1.00 10.00 C ATOM 55 C LYS A 5 -6.605 0.797 0.058 1.00 10.00 C ATOM 56 O LYS A 5 -7.438 0.642 -0.835 1.00 10.00 O ATOM 57 CB LYS A 5 -5.349 2.932 -0.090 1.00 10.00 C ATOM 58 CG LYS A 5 -4.916 4.234 0.594 1.00 10.00 C ATOM 59 CD LYS A 5 -4.093 5.107 -0.359 1.00 10.00 C ATOM 60 CE LYS A 5 -3.566 6.334 0.393 1.00 10.00 C ATOM 61 NZ LYS A 5 -3.627 7.539 -0.458 1.00 10.00 N ATOM 0 H LYS A 5 -5.092 2.261 2.280 1.00 10.00 H new ATOM 0 HA LYS A 5 -7.376 2.714 0.644 1.00 10.00 H new ATOM 0 HB2 LYS A 5 -4.479 2.287 -0.215 1.00 10.00 H new ATOM 0 HB3 LYS A 5 -5.723 3.160 -1.088 1.00 10.00 H new ATOM 0 HG2 LYS A 5 -5.796 4.784 0.928 1.00 10.00 H new ATOM 0 HG3 LYS A 5 -4.328 4.004 1.482 1.00 10.00 H new ATOM 0 HD2 LYS A 5 -3.261 4.533 -0.767 1.00 10.00 H new ATOM 0 HD3 LYS A 5 -4.708 5.421 -1.203 1.00 10.00 H new ATOM 0 HE2 LYS A 5 -4.154 6.492 1.297 1.00 10.00 H new ATOM 0 HE3 LYS A 5 -2.538 6.158 0.709 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 -3.265 8.357 0.072 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 -3.046 7.393 -1.308 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 -4.613 7.717 -0.738 1.00 10.00 H new ATOM 75 N GLY A 6 -5.901 -0.206 0.586 1.00 10.00 N ATOM 76 CA GLY A 6 -5.851 -1.541 0.007 1.00 10.00 C ATOM 77 C GLY A 6 -7.211 -2.196 0.102 1.00 10.00 C ATOM 78 O GLY A 6 -7.705 -2.745 -0.880 1.00 10.00 O ATOM 0 H GLY A 6 -5.346 -0.109 1.436 1.00 10.00 H new ATOM 0 HA2 GLY A 6 -5.538 -1.483 -1.035 1.00 10.00 H new ATOM 0 HA3 GLY A 6 -5.110 -2.146 0.529 1.00 10.00 H new ATOM 82 N LYS A 7 -7.875 -2.039 1.254 1.00 10.00 N ATOM 83 CA LYS A 7 -9.247 -2.494 1.412 1.00 10.00 C ATOM 84 C LYS A 7 -10.231 -1.769 0.470 1.00 10.00 C ATOM 85 O LYS A 7 -11.051 -2.417 -0.174 1.00 10.00 O ATOM 86 CB LYS A 7 -9.652 -2.473 2.896 1.00 10.00 C ATOM 87 CG LYS A 7 -9.680 -1.071 3.513 1.00 10.00 C ATOM 88 CD LYS A 7 -10.411 -1.024 4.862 1.00 10.00 C ATOM 89 CE LYS A 7 -10.989 0.374 5.108 1.00 10.00 C ATOM 90 NZ LYS A 7 -9.940 1.423 5.092 1.00 10.00 N ATOM 0 H LYS A 7 -7.478 -1.600 2.085 1.00 10.00 H new ATOM 0 HA LYS A 7 -9.303 -3.534 1.091 1.00 10.00 H new ATOM 0 HB2 LYS A 7 -10.639 -2.924 2.999 1.00 10.00 H new ATOM 0 HB3 LYS A 7 -8.957 -3.094 3.461 1.00 10.00 H new ATOM 0 HG2 LYS A 7 -8.657 -0.719 3.648 1.00 10.00 H new ATOM 0 HG3 LYS A 7 -10.165 -0.384 2.819 1.00 10.00 H new ATOM 0 HD2 LYS A 7 -11.212 -1.763 4.875 1.00 10.00 H new ATOM 0 HD3 LYS A 7 -9.723 -1.286 5.665 1.00 10.00 H new ATOM 0 HE2 LYS A 7 -11.735 0.597 4.345 1.00 10.00 H new ATOM 0 HE3 LYS A 7 -11.502 0.390 6.070 1.00 10.00 H new ATOM 0 HZ1 LYS A 7 -10.373 2.350 5.279 1.00 10.00 H new ATOM 0 HZ2 LYS A 7 -9.232 1.217 5.825 1.00 10.00 H new ATOM 0 HZ3 LYS A 7 -9.479 1.438 4.160 1.00 10.00 H new ATOM 104 N LYS A 8 -10.080 -0.446 0.302 1.00 10.00 N ATOM 105 CA LYS A 8 -10.909 0.414 -0.562 1.00 10.00 C ATOM 106 C LYS A 8 -10.799 -0.001 -2.029 1.00 10.00 C ATOM 107 O LYS A 8 -11.816 -0.253 -2.670 1.00 10.00 O ATOM 108 CB LYS A 8 -10.527 1.900 -0.409 1.00 10.00 C ATOM 109 CG LYS A 8 -10.925 2.536 0.933 1.00 10.00 C ATOM 110 CD LYS A 8 -10.231 3.892 1.182 1.00 10.00 C ATOM 111 CE LYS A 8 -10.417 4.894 0.031 1.00 10.00 C ATOM 112 NZ LYS A 8 -9.740 6.189 0.293 1.00 10.00 N ATOM 0 H LYS A 8 -9.348 0.076 0.783 1.00 10.00 H new ATOM 0 HA LYS A 8 -11.943 0.286 -0.240 1.00 10.00 H new ATOM 0 HB2 LYS A 8 -9.449 1.998 -0.535 1.00 10.00 H new ATOM 0 HB3 LYS A 8 -10.995 2.465 -1.215 1.00 10.00 H new ATOM 0 HG2 LYS A 8 -12.006 2.676 0.957 1.00 10.00 H new ATOM 0 HG3 LYS A 8 -10.675 1.851 1.743 1.00 10.00 H new ATOM 0 HD2 LYS A 8 -10.623 4.329 2.101 1.00 10.00 H new ATOM 0 HD3 LYS A 8 -9.166 3.723 1.338 1.00 10.00 H new ATOM 0 HE2 LYS A 8 -10.025 4.462 -0.890 1.00 10.00 H new ATOM 0 HE3 LYS A 8 -11.481 5.069 -0.126 1.00 10.00 H new ATOM 0 HZ1 LYS A 8 -9.894 6.830 -0.511 1.00 10.00 H new ATOM 0 HZ2 LYS A 8 -10.131 6.616 1.157 1.00 10.00 H new ATOM 0 HZ3 LYS A 8 -8.720 6.029 0.417 1.00 10.00 H new ATOM 126 N ILE A 9 -9.574 -0.064 -2.568 1.00 10.00 N ATOM 127 CA ILE A 9 -9.344 -0.433 -3.970 1.00 10.00 C ATOM 128 C ILE A 9 -9.666 -1.916 -4.225 1.00 10.00 C ATOM 129 O ILE A 9 -10.225 -2.250 -5.273 1.00 10.00 O ATOM 130 CB ILE A 9 -7.921 -0.015 -4.407 1.00 10.00 C ATOM 131 CG1 ILE A 9 -7.707 0.012 -5.933 1.00 10.00 C ATOM 132 CG2 ILE A 9 -6.850 -0.943 -3.838 1.00 10.00 C ATOM 133 CD1 ILE A 9 -8.592 1.012 -6.685 1.00 10.00 C ATOM 0 H ILE A 9 -8.720 0.138 -2.048 1.00 10.00 H new ATOM 0 HA ILE A 9 -10.037 0.120 -4.604 1.00 10.00 H new ATOM 0 HB ILE A 9 -7.827 0.997 -4.013 1.00 10.00 H new ATOM 0 HG12 ILE A 9 -6.662 0.248 -6.136 1.00 10.00 H new ATOM 0 HG13 ILE A 9 -7.891 -0.986 -6.330 1.00 10.00 H new ATOM 0 HG21 ILE A 9 -5.867 -0.611 -4.171 1.00 10.00 H new ATOM 0 HG22 ILE A 9 -6.891 -0.921 -2.749 1.00 10.00 H new ATOM 0 HG23 ILE A 9 -7.027 -1.960 -4.187 1.00 10.00 H new ATOM 0 HD11 ILE A 9 -8.373 0.962 -7.752 1.00 10.00 H new ATOM 0 HD12 ILE A 9 -9.641 0.767 -6.518 1.00 10.00 H new ATOM 0 HD13 ILE A 9 -8.393 2.020 -6.321 1.00 10.00 H new ATOM 145 N PHE A 10 -9.432 -2.798 -3.238 1.00 10.00 N ATOM 146 CA PHE A 10 -9.925 -4.171 -3.278 1.00 10.00 C ATOM 147 C PHE A 10 -11.447 -4.194 -3.420 1.00 10.00 C ATOM 148 O PHE A 10 -11.974 -4.843 -4.322 1.00 10.00 O ATOM 149 CB PHE A 10 -9.447 -4.960 -2.052 1.00 10.00 C ATOM 150 CG PHE A 10 -9.888 -6.409 -2.031 1.00 10.00 C ATOM 151 CD1 PHE A 10 -11.187 -6.740 -1.601 1.00 10.00 C ATOM 152 CD2 PHE A 10 -8.997 -7.431 -2.412 1.00 10.00 C ATOM 153 CE1 PHE A 10 -11.603 -8.078 -1.584 1.00 10.00 C ATOM 154 CE2 PHE A 10 -9.409 -8.775 -2.366 1.00 10.00 C ATOM 155 CZ PHE A 10 -10.716 -9.095 -1.969 1.00 10.00 C ATOM 0 H PHE A 10 -8.898 -2.574 -2.398 1.00 10.00 H new ATOM 0 HA PHE A 10 -9.510 -4.664 -4.157 1.00 10.00 H new ATOM 0 HB2 PHE A 10 -8.358 -4.923 -2.013 1.00 10.00 H new ATOM 0 HB3 PHE A 10 -9.815 -4.468 -1.152 1.00 10.00 H new ATOM 0 HD1 PHE A 10 -11.864 -5.961 -1.284 1.00 10.00 H new ATOM 0 HD2 PHE A 10 -7.998 -7.183 -2.739 1.00 10.00 H new ATOM 0 HE1 PHE A 10 -12.607 -8.327 -1.274 1.00 10.00 H new ATOM 0 HE2 PHE A 10 -8.719 -9.561 -2.636 1.00 10.00 H new ATOM 0 HZ PHE A 10 -11.040 -10.125 -1.960 1.00 10.00 H new ATOM 165 N VAL A 11 -12.180 -3.441 -2.593 1.00 10.00 N ATOM 166 CA VAL A 11 -13.645 -3.384 -2.685 1.00 10.00 C ATOM 167 C VAL A 11 -14.161 -2.864 -4.040 1.00 10.00 C ATOM 168 O VAL A 11 -15.312 -3.105 -4.393 1.00 10.00 O ATOM 169 CB VAL A 11 -14.228 -2.617 -1.474 1.00 10.00 C ATOM 170 CG1 VAL A 11 -15.699 -2.190 -1.596 1.00 10.00 C ATOM 171 CG2 VAL A 11 -14.139 -3.501 -0.223 1.00 10.00 C ATOM 0 H VAL A 11 -11.784 -2.862 -1.852 1.00 10.00 H new ATOM 0 HA VAL A 11 -14.013 -4.409 -2.641 1.00 10.00 H new ATOM 0 HB VAL A 11 -13.629 -1.708 -1.421 1.00 10.00 H new ATOM 0 HG11 VAL A 11 -16.001 -1.661 -0.692 1.00 10.00 H new ATOM 0 HG12 VAL A 11 -15.817 -1.532 -2.457 1.00 10.00 H new ATOM 0 HG13 VAL A 11 -16.325 -3.073 -1.726 1.00 10.00 H new ATOM 0 HG21 VAL A 11 -14.549 -2.964 0.632 1.00 10.00 H new ATOM 0 HG22 VAL A 11 -14.708 -4.417 -0.383 1.00 10.00 H new ATOM 0 HG23 VAL A 11 -13.096 -3.752 -0.028 1.00 10.00 H new ATOM 181 N GLN A 12 -13.296 -2.236 -4.843 1.00 10.00 N ATOM 182 CA GLN A 12 -13.640 -1.681 -6.150 1.00 10.00 C ATOM 183 C GLN A 12 -13.388 -2.667 -7.294 1.00 10.00 C ATOM 184 O GLN A 12 -14.194 -2.713 -8.228 1.00 10.00 O ATOM 185 CB GLN A 12 -12.837 -0.394 -6.396 1.00 10.00 C ATOM 186 CG GLN A 12 -13.203 0.354 -7.691 1.00 10.00 C ATOM 187 CD GLN A 12 -14.687 0.686 -7.827 1.00 10.00 C ATOM 188 OE1 GLN A 12 -15.136 1.772 -7.502 1.00 10.00 O ATOM 189 NE2 GLN A 12 -15.493 -0.235 -8.323 1.00 10.00 N ATOM 0 H GLN A 12 -12.317 -2.098 -4.594 1.00 10.00 H new ATOM 0 HA GLN A 12 -14.708 -1.465 -6.135 1.00 10.00 H new ATOM 0 HB2 GLN A 12 -12.985 0.278 -5.550 1.00 10.00 H new ATOM 0 HB3 GLN A 12 -11.776 -0.643 -6.424 1.00 10.00 H new ATOM 0 HG2 GLN A 12 -12.630 1.280 -7.736 1.00 10.00 H new ATOM 0 HG3 GLN A 12 -12.898 -0.251 -8.545 1.00 10.00 H new ATOM 0 HE21 GLN A 12 -15.121 -1.145 -8.596 1.00 10.00 H new ATOM 0 HE22 GLN A 12 -16.487 -0.037 -8.433 1.00 10.00 H new ATOM 198 N LYS A 13 -12.262 -3.398 -7.261 1.00 10.00 N ATOM 199 CA LYS A 13 -11.807 -4.245 -8.378 1.00 10.00 C ATOM 200 C LYS A 13 -11.716 -5.739 -8.054 1.00 10.00 C ATOM 201 O LYS A 13 -11.555 -6.547 -8.961 1.00 10.00 O ATOM 202 CB LYS A 13 -10.443 -3.752 -8.900 1.00 10.00 C ATOM 203 CG LYS A 13 -10.417 -2.298 -9.395 1.00 10.00 C ATOM 204 CD LYS A 13 -11.373 -2.043 -10.569 1.00 10.00 C ATOM 205 CE LYS A 13 -11.176 -0.605 -11.051 1.00 10.00 C ATOM 206 NZ LYS A 13 -12.123 -0.225 -12.122 1.00 10.00 N ATOM 0 H LYS A 13 -11.638 -3.419 -6.455 1.00 10.00 H new ATOM 0 HA LYS A 13 -12.577 -4.147 -9.143 1.00 10.00 H new ATOM 0 HB2 LYS A 13 -9.707 -3.861 -8.104 1.00 10.00 H new ATOM 0 HB3 LYS A 13 -10.128 -4.402 -9.716 1.00 10.00 H new ATOM 0 HG2 LYS A 13 -10.679 -1.635 -8.570 1.00 10.00 H new ATOM 0 HG3 LYS A 13 -9.402 -2.042 -9.699 1.00 10.00 H new ATOM 0 HD2 LYS A 13 -11.174 -2.745 -11.379 1.00 10.00 H new ATOM 0 HD3 LYS A 13 -12.406 -2.200 -10.258 1.00 10.00 H new ATOM 0 HE2 LYS A 13 -11.296 0.076 -10.208 1.00 10.00 H new ATOM 0 HE3 LYS A 13 -10.156 -0.485 -11.415 1.00 10.00 H new ATOM 0 HZ1 LYS A 13 -11.945 0.758 -12.410 1.00 10.00 H new ATOM 0 HZ2 LYS A 13 -11.993 -0.855 -12.940 1.00 10.00 H new ATOM 0 HZ3 LYS A 13 -13.098 -0.311 -11.770 1.00 10.00 H new ATOM 220 N CYS A 14 -11.825 -6.105 -6.778 1.00 10.00 N ATOM 221 CA CYS A 14 -11.556 -7.437 -6.257 1.00 10.00 C ATOM 222 C CYS A 14 -12.776 -8.006 -5.537 1.00 10.00 C ATOM 223 O CYS A 14 -13.161 -9.136 -5.826 1.00 10.00 O ATOM 224 CB CYS A 14 -10.380 -7.348 -5.290 1.00 10.00 C ATOM 225 SG CYS A 14 -8.886 -6.491 -5.875 1.00 10.00 S ATOM 0 H CYS A 14 -12.116 -5.451 -6.051 1.00 10.00 H new ATOM 0 HA CYS A 14 -11.320 -8.104 -7.086 1.00 10.00 H new ATOM 0 HB2 CYS A 14 -10.724 -6.847 -4.385 1.00 10.00 H new ATOM 0 HB3 CYS A 14 -10.099 -8.362 -5.006 1.00 10.00 H new ATOM 230 N ALA A 15 -13.443 -7.224 -4.667 1.00 10.00 N ATOM 231 CA ALA A 15 -14.687 -7.672 -4.014 1.00 10.00 C ATOM 232 C ALA A 15 -15.822 -7.983 -5.009 1.00 10.00 C ATOM 233 O ALA A 15 -16.764 -8.701 -4.662 1.00 10.00 O ATOM 234 CB ALA A 15 -15.150 -6.655 -2.974 1.00 10.00 C ATOM 0 H ALA A 15 -13.144 -6.286 -4.402 1.00 10.00 H new ATOM 0 HA ALA A 15 -14.447 -8.611 -3.516 1.00 10.00 H new ATOM 0 HB1 ALA A 15 -16.069 -7.007 -2.505 1.00 10.00 H new ATOM 0 HB2 ALA A 15 -14.378 -6.535 -2.214 1.00 10.00 H new ATOM 0 HB3 ALA A 15 -15.334 -5.696 -3.459 1.00 10.00 H new ATOM 240 N GLN A 16 -15.665 -7.497 -6.247 1.00 10.00 N ATOM 241 CA GLN A 16 -16.386 -7.813 -7.479 1.00 10.00 C ATOM 242 C GLN A 16 -16.385 -9.319 -7.831 1.00 10.00 C ATOM 243 O GLN A 16 -17.278 -9.768 -8.548 1.00 10.00 O ATOM 244 CB GLN A 16 -15.736 -6.949 -8.581 1.00 10.00 C ATOM 245 CG GLN A 16 -16.574 -6.728 -9.851 1.00 10.00 C ATOM 246 CD GLN A 16 -16.174 -7.618 -11.026 1.00 10.00 C ATOM 247 OE1 GLN A 16 -15.491 -7.197 -11.942 1.00 10.00 O ATOM 248 NE2 GLN A 16 -16.587 -8.868 -11.046 1.00 10.00 N ATOM 0 H GLN A 16 -14.948 -6.794 -6.425 1.00 10.00 H new ATOM 0 HA GLN A 16 -17.445 -7.584 -7.365 1.00 10.00 H new ATOM 0 HB2 GLN A 16 -15.495 -5.975 -8.155 1.00 10.00 H new ATOM 0 HB3 GLN A 16 -14.793 -7.413 -8.869 1.00 10.00 H new ATOM 0 HG2 GLN A 16 -17.624 -6.905 -9.616 1.00 10.00 H new ATOM 0 HG3 GLN A 16 -16.487 -5.684 -10.154 1.00 10.00 H new ATOM 0 HE21 GLN A 16 -17.159 -9.228 -10.282 1.00 10.00 H new ATOM 0 HE22 GLN A 16 -16.334 -9.476 -11.825 1.00 10.00 H new ATOM 257 N CYS A 17 -15.440 -10.098 -7.288 1.00 10.00 N ATOM 258 CA CYS A 17 -15.286 -11.545 -7.467 1.00 10.00 C ATOM 259 C CYS A 17 -14.828 -12.277 -6.187 1.00 10.00 C ATOM 260 O CYS A 17 -14.966 -13.493 -6.108 1.00 10.00 O ATOM 261 CB CYS A 17 -14.237 -11.789 -8.550 1.00 10.00 C ATOM 262 SG CYS A 17 -14.741 -11.441 -10.261 1.00 10.00 S ATOM 0 H CYS A 17 -14.721 -9.711 -6.677 1.00 10.00 H new ATOM 0 HA CYS A 17 -16.266 -11.939 -7.737 1.00 10.00 H new ATOM 0 HB2 CYS A 17 -13.363 -11.180 -8.321 1.00 10.00 H new ATOM 0 HB3 CYS A 17 -13.923 -12.831 -8.492 1.00 10.00 H new ATOM 267 N HIS A 18 -14.327 -11.545 -5.184 1.00 10.00 N ATOM 268 CA HIS A 18 -13.841 -12.016 -3.894 1.00 10.00 C ATOM 269 C HIS A 18 -14.418 -11.140 -2.766 1.00 10.00 C ATOM 270 O HIS A 18 -13.686 -10.427 -2.081 1.00 10.00 O ATOM 271 CB HIS A 18 -12.310 -11.931 -3.890 1.00 10.00 C ATOM 272 CG HIS A 18 -11.583 -12.657 -4.969 1.00 10.00 C ATOM 273 ND1 HIS A 18 -11.294 -13.990 -4.958 1.00 10.00 N ATOM 274 CD2 HIS A 18 -10.885 -12.075 -5.989 1.00 10.00 C ATOM 275 CE1 HIS A 18 -10.427 -14.207 -5.961 1.00 10.00 C ATOM 276 NE2 HIS A 18 -10.147 -13.079 -6.624 1.00 10.00 N ATOM 0 H HIS A 18 -14.248 -10.531 -5.266 1.00 10.00 H new ATOM 0 HA HIS A 18 -14.157 -13.046 -3.730 1.00 10.00 H new ATOM 0 HB2 HIS A 18 -12.030 -10.879 -3.944 1.00 10.00 H new ATOM 0 HB3 HIS A 18 -11.954 -12.307 -2.931 1.00 10.00 H new ATOM 0 HD1 HIS A 18 -11.665 -14.688 -4.313 1.00 10.00 H new ATOM 0 HD2 HIS A 18 -10.900 -11.029 -6.257 1.00 10.00 H new ATOM 0 HE1 HIS A 18 -10.008 -15.173 -6.202 1.00 10.00 H new ATOM 284 N THR A 19 -15.738 -11.114 -2.599 1.00 10.00 N ATOM 285 CA THR A 19 -16.396 -10.271 -1.595 1.00 10.00 C ATOM 286 C THR A 19 -15.983 -10.720 -0.179 1.00 10.00 C ATOM 287 O THR A 19 -16.278 -11.842 0.222 1.00 10.00 O ATOM 288 CB THR A 19 -17.916 -10.305 -1.802 1.00 10.00 C ATOM 289 OG1 THR A 19 -18.253 -10.211 -3.178 1.00 10.00 O ATOM 290 CG2 THR A 19 -18.627 -9.157 -1.094 1.00 10.00 C ATOM 0 H THR A 19 -16.384 -11.675 -3.154 1.00 10.00 H new ATOM 0 HA THR A 19 -16.076 -9.235 -1.710 1.00 10.00 H new ATOM 0 HB THR A 19 -18.241 -11.257 -1.383 1.00 10.00 H new ATOM 0 HG1 THR A 19 -17.497 -9.834 -3.675 1.00 10.00 H new ATOM 0 HG21 THR A 19 -19.700 -9.228 -1.273 1.00 10.00 H new ATOM 0 HG22 THR A 19 -18.433 -9.214 -0.023 1.00 10.00 H new ATOM 0 HG23 THR A 19 -18.257 -8.207 -1.480 1.00 10.00 H new ATOM 298 N VAL A 20 -15.269 -9.857 0.564 1.00 10.00 N ATOM 299 CA VAL A 20 -14.452 -10.234 1.744 1.00 10.00 C ATOM 300 C VAL A 20 -14.558 -9.196 2.858 1.00 10.00 C ATOM 301 O VAL A 20 -14.871 -9.588 3.977 1.00 10.00 O ATOM 302 CB VAL A 20 -12.960 -10.420 1.363 1.00 10.00 C ATOM 303 CG1 VAL A 20 -11.981 -10.424 2.552 1.00 10.00 C ATOM 304 CG2 VAL A 20 -12.738 -11.730 0.607 1.00 10.00 C ATOM 0 H VAL A 20 -15.239 -8.858 0.362 1.00 10.00 H new ATOM 0 HA VAL A 20 -14.850 -11.182 2.106 1.00 10.00 H new ATOM 0 HB VAL A 20 -12.746 -9.547 0.746 1.00 10.00 H new ATOM 0 HG11 VAL A 20 -10.964 -10.560 2.185 1.00 10.00 H new ATOM 0 HG12 VAL A 20 -12.051 -9.475 3.084 1.00 10.00 H new ATOM 0 HG13 VAL A 20 -12.234 -11.240 3.229 1.00 10.00 H new ATOM 0 HG21 VAL A 20 -11.682 -11.830 0.355 1.00 10.00 H new ATOM 0 HG22 VAL A 20 -13.042 -12.568 1.234 1.00 10.00 H new ATOM 0 HG23 VAL A 20 -13.331 -11.727 -0.308 1.00 10.00 H new ATOM 314 N GLU A 21 -14.382 -7.894 2.576 1.00 10.00 N ATOM 315 CA GLU A 21 -14.404 -6.797 3.573 1.00 10.00 C ATOM 316 C GLU A 21 -15.716 -6.720 4.393 1.00 10.00 C ATOM 317 O GLU A 21 -15.785 -6.034 5.411 1.00 10.00 O ATOM 318 CB GLU A 21 -14.143 -5.461 2.846 1.00 10.00 C ATOM 319 CG GLU A 21 -13.590 -4.352 3.768 1.00 10.00 C ATOM 320 CD GLU A 21 -14.058 -2.947 3.363 1.00 10.00 C ATOM 321 OE1 GLU A 21 -15.294 -2.760 3.243 1.00 10.00 O ATOM 322 OE2 GLU A 21 -13.188 -2.058 3.202 1.00 10.00 O ATOM 0 H GLU A 21 -14.216 -7.561 1.626 1.00 10.00 H new ATOM 0 HA GLU A 21 -13.619 -7.005 4.300 1.00 10.00 H new ATOM 0 HB2 GLU A 21 -13.437 -5.631 2.033 1.00 10.00 H new ATOM 0 HB3 GLU A 21 -15.073 -5.116 2.394 1.00 10.00 H new ATOM 0 HG2 GLU A 21 -13.901 -4.551 4.794 1.00 10.00 H new ATOM 0 HG3 GLU A 21 -12.501 -4.384 3.753 1.00 10.00 H new ATOM 329 N LYS A 22 -16.735 -7.483 3.978 1.00 10.00 N ATOM 330 CA LYS A 22 -18.080 -7.599 4.550 1.00 10.00 C ATOM 331 C LYS A 22 -18.654 -9.015 4.299 1.00 10.00 C ATOM 332 O LYS A 22 -19.851 -9.234 4.463 1.00 10.00 O ATOM 333 CB LYS A 22 -18.995 -6.513 3.937 1.00 10.00 C ATOM 334 CG LYS A 22 -18.479 -5.075 4.148 1.00 10.00 C ATOM 335 CD LYS A 22 -19.473 -4.020 3.657 1.00 10.00 C ATOM 336 CE LYS A 22 -18.969 -2.593 3.925 1.00 10.00 C ATOM 337 NZ LYS A 22 -17.830 -2.198 3.062 1.00 10.00 N ATOM 0 H LYS A 22 -16.629 -8.087 3.163 1.00 10.00 H new ATOM 0 HA LYS A 22 -18.029 -7.448 5.628 1.00 10.00 H new ATOM 0 HB2 LYS A 22 -19.099 -6.699 2.868 1.00 10.00 H new ATOM 0 HB3 LYS A 22 -19.990 -6.600 4.374 1.00 10.00 H new ATOM 0 HG2 LYS A 22 -18.278 -4.916 5.207 1.00 10.00 H new ATOM 0 HG3 LYS A 22 -17.532 -4.951 3.622 1.00 10.00 H new ATOM 0 HD2 LYS A 22 -19.643 -4.151 2.588 1.00 10.00 H new ATOM 0 HD3 LYS A 22 -20.433 -4.166 4.153 1.00 10.00 H new ATOM 0 HE2 LYS A 22 -19.790 -1.892 3.774 1.00 10.00 H new ATOM 0 HE3 LYS A 22 -18.669 -2.512 4.970 1.00 10.00 H new ATOM 0 HZ1 LYS A 22 -17.713 -1.165 3.093 1.00 10.00 H new ATOM 0 HZ2 LYS A 22 -16.961 -2.655 3.404 1.00 10.00 H new ATOM 0 HZ3 LYS A 22 -18.016 -2.497 2.083 1.00 10.00 H new ATOM 351 N GLY A 23 -17.784 -9.968 3.928 1.00 10.00 N ATOM 352 CA GLY A 23 -18.086 -11.349 3.534 1.00 10.00 C ATOM 353 C GLY A 23 -18.850 -11.500 2.210 1.00 10.00 C ATOM 354 O GLY A 23 -19.440 -10.554 1.691 1.00 10.00 O ATOM 0 H GLY A 23 -16.782 -9.778 3.894 1.00 10.00 H new ATOM 0 HA2 GLY A 23 -17.149 -11.902 3.459 1.00 10.00 H new ATOM 0 HA3 GLY A 23 -18.670 -11.817 4.327 1.00 10.00 H new ATOM 358 N GLY A 24 -18.870 -12.729 1.681 1.00 10.00 N ATOM 359 CA GLY A 24 -19.716 -13.128 0.552 1.00 10.00 C ATOM 360 C GLY A 24 -19.447 -14.551 0.050 1.00 10.00 C ATOM 361 O GLY A 24 -18.334 -15.066 0.161 1.00 10.00 O ATOM 0 H GLY A 24 -18.287 -13.488 2.033 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -20.762 -13.049 0.848 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -19.563 -12.428 -0.269 1.00 10.00 H new ATOM 365 N LYS A 25 -20.483 -15.199 -0.499 1.00 10.00 N ATOM 366 CA LYS A 25 -20.468 -16.630 -0.876 1.00 10.00 C ATOM 367 C LYS A 25 -19.712 -16.958 -2.180 1.00 10.00 C ATOM 368 O LYS A 25 -20.278 -17.526 -3.114 1.00 10.00 O ATOM 369 CB LYS A 25 -21.874 -17.268 -0.784 1.00 10.00 C ATOM 370 CG LYS A 25 -22.969 -16.635 -1.662 1.00 10.00 C ATOM 371 CD LYS A 25 -23.862 -15.676 -0.863 1.00 10.00 C ATOM 372 CE LYS A 25 -24.889 -15.006 -1.782 1.00 10.00 C ATOM 373 NZ LYS A 25 -25.374 -13.733 -1.201 1.00 10.00 N ATOM 0 H LYS A 25 -21.372 -14.742 -0.699 1.00 10.00 H new ATOM 0 HA LYS A 25 -19.856 -17.118 -0.118 1.00 10.00 H new ATOM 0 HB2 LYS A 25 -21.790 -18.322 -1.049 1.00 10.00 H new ATOM 0 HB3 LYS A 25 -22.202 -17.226 0.255 1.00 10.00 H new ATOM 0 HG2 LYS A 25 -22.505 -16.096 -2.488 1.00 10.00 H new ATOM 0 HG3 LYS A 25 -23.583 -17.422 -2.100 1.00 10.00 H new ATOM 0 HD2 LYS A 25 -24.375 -16.222 -0.072 1.00 10.00 H new ATOM 0 HD3 LYS A 25 -23.248 -14.916 -0.379 1.00 10.00 H new ATOM 0 HE2 LYS A 25 -24.440 -14.817 -2.757 1.00 10.00 H new ATOM 0 HE3 LYS A 25 -25.731 -15.679 -1.944 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 -26.068 -13.300 -1.843 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 -25.823 -13.920 -0.282 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 -24.572 -13.084 -1.069 1.00 10.00 H new ATOM 387 N HIS A 26 -18.414 -16.639 -2.223 1.00 10.00 N ATOM 388 CA HIS A 26 -17.416 -16.973 -3.252 1.00 10.00 C ATOM 389 C HIS A 26 -17.692 -16.352 -4.631 1.00 10.00 C ATOM 390 O HIS A 26 -16.924 -15.509 -5.084 1.00 10.00 O ATOM 391 CB HIS A 26 -17.198 -18.498 -3.320 1.00 10.00 C ATOM 392 CG HIS A 26 -16.843 -19.137 -1.998 1.00 10.00 C ATOM 393 ND1 HIS A 26 -17.288 -20.356 -1.533 1.00 10.00 N ATOM 394 CD2 HIS A 26 -16.031 -18.606 -1.034 1.00 10.00 C ATOM 395 CE1 HIS A 26 -16.786 -20.526 -0.301 1.00 10.00 C ATOM 396 NE2 HIS A 26 -16.007 -19.490 0.043 1.00 10.00 N ATOM 0 H HIS A 26 -17.995 -16.091 -1.472 1.00 10.00 H new ATOM 0 HA HIS A 26 -16.483 -16.506 -2.937 1.00 10.00 H new ATOM 0 HB2 HIS A 26 -18.105 -18.966 -3.704 1.00 10.00 H new ATOM 0 HB3 HIS A 26 -16.403 -18.708 -4.036 1.00 10.00 H new ATOM 0 HD1 HIS A 26 -17.889 -21.010 -2.034 1.00 10.00 H new ATOM 0 HD2 HIS A 26 -15.502 -17.667 -1.096 1.00 10.00 H new ATOM 0 HE1 HIS A 26 -16.982 -21.381 0.329 1.00 10.00 H new ATOM 404 N LYS A 27 -18.794 -16.748 -5.280 1.00 10.00 N ATOM 405 CA LYS A 27 -19.337 -16.311 -6.580 1.00 10.00 C ATOM 406 C LYS A 27 -18.438 -16.552 -7.802 1.00 10.00 C ATOM 407 O LYS A 27 -18.910 -17.113 -8.785 1.00 10.00 O ATOM 408 CB LYS A 27 -19.802 -14.847 -6.512 1.00 10.00 C ATOM 409 CG LYS A 27 -20.956 -14.657 -5.511 1.00 10.00 C ATOM 410 CD LYS A 27 -21.354 -13.187 -5.340 1.00 10.00 C ATOM 411 CE LYS A 27 -20.219 -12.407 -4.667 1.00 10.00 C ATOM 412 NZ LYS A 27 -20.688 -11.119 -4.113 1.00 10.00 N ATOM 0 H LYS A 27 -19.395 -17.460 -4.865 1.00 10.00 H new ATOM 0 HA LYS A 27 -20.191 -16.966 -6.751 1.00 10.00 H new ATOM 0 HB2 LYS A 27 -18.964 -14.213 -6.224 1.00 10.00 H new ATOM 0 HB3 LYS A 27 -20.123 -14.522 -7.502 1.00 10.00 H new ATOM 0 HG2 LYS A 27 -21.822 -15.227 -5.848 1.00 10.00 H new ATOM 0 HG3 LYS A 27 -20.663 -15.065 -4.544 1.00 10.00 H new ATOM 0 HD2 LYS A 27 -21.580 -12.748 -6.312 1.00 10.00 H new ATOM 0 HD3 LYS A 27 -22.261 -13.115 -4.739 1.00 10.00 H new ATOM 0 HE2 LYS A 27 -19.788 -13.010 -3.868 1.00 10.00 H new ATOM 0 HE3 LYS A 27 -19.426 -12.223 -5.391 1.00 10.00 H new ATOM 0 HZ1 LYS A 27 -19.887 -10.614 -3.682 1.00 10.00 H new ATOM 0 HZ2 LYS A 27 -21.092 -10.539 -4.876 1.00 10.00 H new ATOM 0 HZ3 LYS A 27 -21.415 -11.296 -3.391 1.00 10.00 H new ATOM 426 N THR A 28 -17.160 -16.173 -7.728 1.00 10.00 N ATOM 427 CA THR A 28 -16.217 -16.135 -8.862 1.00 10.00 C ATOM 428 C THR A 28 -14.756 -16.342 -8.424 1.00 10.00 C ATOM 429 O THR A 28 -13.893 -16.519 -9.278 1.00 10.00 O ATOM 430 CB THR A 28 -16.299 -14.789 -9.622 1.00 10.00 C ATOM 431 OG1 THR A 28 -17.569 -14.173 -9.546 1.00 10.00 O ATOM 432 CG2 THR A 28 -15.992 -14.945 -11.116 1.00 10.00 C ATOM 0 H THR A 28 -16.734 -15.873 -6.851 1.00 10.00 H new ATOM 0 HA THR A 28 -16.515 -16.957 -9.513 1.00 10.00 H new ATOM 0 HB THR A 28 -15.553 -14.169 -9.125 1.00 10.00 H new ATOM 0 HG1 THR A 28 -17.553 -13.329 -10.044 1.00 10.00 H new ATOM 0 HG21 THR A 28 -16.062 -13.974 -11.605 1.00 10.00 H new ATOM 0 HG22 THR A 28 -14.985 -15.342 -11.241 1.00 10.00 H new ATOM 0 HG23 THR A 28 -16.710 -15.630 -11.565 1.00 10.00 H new ATOM 440 N GLY A 29 -14.472 -16.377 -7.117 1.00 10.00 N ATOM 441 CA GLY A 29 -13.178 -16.746 -6.545 1.00 10.00 C ATOM 442 C GLY A 29 -13.356 -17.334 -5.137 1.00 10.00 C ATOM 443 O GLY A 29 -14.434 -17.208 -4.557 1.00 10.00 O ATOM 0 H GLY A 29 -15.164 -16.140 -6.406 1.00 10.00 H new ATOM 0 HA2 GLY A 29 -12.684 -17.474 -7.189 1.00 10.00 H new ATOM 0 HA3 GLY A 29 -12.531 -15.870 -6.500 1.00 10.00 H new ATOM 447 N PRO A 30 -12.317 -17.930 -4.523 1.00 10.00 N ATOM 448 CA PRO A 30 -12.434 -18.715 -3.282 1.00 10.00 C ATOM 449 C PRO A 30 -12.695 -17.893 -2.008 1.00 10.00 C ATOM 450 O PRO A 30 -12.633 -18.448 -0.912 1.00 10.00 O ATOM 451 CB PRO A 30 -11.108 -19.481 -3.194 1.00 10.00 C ATOM 452 CG PRO A 30 -10.114 -18.570 -3.892 1.00 10.00 C ATOM 453 CD PRO A 30 -10.949 -17.967 -5.017 1.00 10.00 C ATOM 0 HA PRO A 30 -13.312 -19.359 -3.331 1.00 10.00 H new ATOM 0 HB2 PRO A 30 -10.822 -19.666 -2.159 1.00 10.00 H new ATOM 0 HB3 PRO A 30 -11.174 -20.452 -3.685 1.00 10.00 H new ATOM 0 HG2 PRO A 30 -9.725 -17.804 -3.221 1.00 10.00 H new ATOM 0 HG3 PRO A 30 -9.257 -19.123 -4.275 1.00 10.00 H new ATOM 0 HD2 PRO A 30 -10.598 -16.967 -5.271 1.00 10.00 H new ATOM 0 HD3 PRO A 30 -10.877 -18.569 -5.923 1.00 10.00 H new ATOM 461 N ASN A 31 -12.987 -16.593 -2.152 1.00 10.00 N ATOM 462 CA ASN A 31 -12.705 -15.465 -1.253 1.00 10.00 C ATOM 463 C ASN A 31 -11.255 -15.422 -0.718 1.00 10.00 C ATOM 464 O ASN A 31 -10.523 -16.410 -0.743 1.00 10.00 O ATOM 465 CB ASN A 31 -13.800 -15.319 -0.171 1.00 10.00 C ATOM 466 CG ASN A 31 -13.461 -15.867 1.213 1.00 10.00 C ATOM 467 OD1 ASN A 31 -13.408 -15.125 2.181 1.00 10.00 O ATOM 468 ND2 ASN A 31 -13.238 -17.153 1.368 1.00 10.00 N ATOM 0 H ASN A 31 -13.477 -16.273 -2.987 1.00 10.00 H new ATOM 0 HA ASN A 31 -12.758 -14.562 -1.861 1.00 10.00 H new ATOM 0 HB2 ASN A 31 -14.042 -14.261 -0.070 1.00 10.00 H new ATOM 0 HB3 ASN A 31 -14.701 -15.820 -0.526 1.00 10.00 H new ATOM 0 HD21 ASN A 31 -13.022 -17.525 2.293 1.00 10.00 H new ATOM 0 HD22 ASN A 31 -13.281 -17.779 0.564 1.00 10.00 H new ATOM 475 N LEU A 32 -10.830 -14.260 -0.212 1.00 10.00 N ATOM 476 CA LEU A 32 -9.558 -14.129 0.500 1.00 10.00 C ATOM 477 C LEU A 32 -9.757 -14.619 1.942 1.00 10.00 C ATOM 478 O LEU A 32 -9.864 -13.834 2.884 1.00 10.00 O ATOM 479 CB LEU A 32 -8.996 -12.694 0.405 1.00 10.00 C ATOM 480 CG LEU A 32 -8.220 -12.353 -0.885 1.00 10.00 C ATOM 481 CD1 LEU A 32 -6.852 -13.029 -0.896 1.00 10.00 C ATOM 482 CD2 LEU A 32 -8.943 -12.682 -2.192 1.00 10.00 C ATOM 0 H LEU A 32 -11.356 -13.389 -0.285 1.00 10.00 H new ATOM 0 HA LEU A 32 -8.797 -14.753 0.031 1.00 10.00 H new ATOM 0 HB2 LEU A 32 -9.825 -11.994 0.502 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -8.336 -12.527 1.257 1.00 10.00 H new ATOM 0 HG LEU A 32 -8.123 -11.268 -0.853 1.00 10.00 H new ATOM 0 HD11 LEU A 32 -6.327 -12.772 -1.816 1.00 10.00 H new ATOM 0 HD12 LEU A 32 -6.271 -12.689 -0.039 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -6.980 -14.110 -0.841 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -8.312 -12.404 -3.037 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -9.153 -13.751 -2.232 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -9.879 -12.126 -2.240 1.00 10.00 H new ATOM 494 N HIS A 33 -9.813 -15.946 2.083 1.00 10.00 N ATOM 495 CA HIS A 33 -9.710 -16.656 3.353 1.00 10.00 C ATOM 496 C HIS A 33 -8.310 -16.474 3.970 1.00 10.00 C ATOM 497 O HIS A 33 -7.459 -15.773 3.423 1.00 10.00 O ATOM 498 CB HIS A 33 -10.051 -18.139 3.104 1.00 10.00 C ATOM 499 CG HIS A 33 -9.234 -18.824 2.029 1.00 10.00 C ATOM 500 ND1 HIS A 33 -7.872 -18.746 1.833 1.00 10.00 N ATOM 501 CD2 HIS A 33 -9.733 -19.649 1.060 1.00 10.00 C ATOM 502 CE1 HIS A 33 -7.565 -19.487 0.751 1.00 10.00 C ATOM 503 NE2 HIS A 33 -8.663 -20.089 0.276 1.00 10.00 N ATOM 0 H HIS A 33 -9.935 -16.573 1.288 1.00 10.00 H new ATOM 0 HA HIS A 33 -10.416 -16.248 4.076 1.00 10.00 H new ATOM 0 HB2 HIS A 33 -9.921 -18.685 4.038 1.00 10.00 H new ATOM 0 HB3 HIS A 33 -11.105 -18.211 2.836 1.00 10.00 H new ATOM 0 HD1 HIS A 33 -7.213 -18.220 2.406 1.00 10.00 H new ATOM 0 HD2 HIS A 33 -10.771 -19.914 0.924 1.00 10.00 H new ATOM 0 HE1 HIS A 33 -6.576 -19.582 0.328 1.00 10.00 H new ATOM 511 N GLY A 34 -8.028 -17.171 5.079 1.00 10.00 N ATOM 512 CA GLY A 34 -6.675 -17.318 5.615 1.00 10.00 C ATOM 513 C GLY A 34 -5.638 -17.578 4.511 1.00 10.00 C ATOM 514 O GLY A 34 -5.754 -18.555 3.766 1.00 10.00 O ATOM 0 H GLY A 34 -8.740 -17.651 5.630 1.00 10.00 H new ATOM 0 HA2 GLY A 34 -6.403 -16.415 6.162 1.00 10.00 H new ATOM 0 HA3 GLY A 34 -6.657 -18.141 6.329 1.00 10.00 H new ATOM 518 N LEU A 35 -4.664 -16.673 4.406 1.00 10.00 N ATOM 519 CA LEU A 35 -3.535 -16.618 3.472 1.00 10.00 C ATOM 520 C LEU A 35 -2.220 -16.427 4.274 1.00 10.00 C ATOM 521 O LEU A 35 -2.188 -16.658 5.480 1.00 10.00 O ATOM 522 CB LEU A 35 -3.800 -15.490 2.433 1.00 10.00 C ATOM 523 CG LEU A 35 -4.154 -15.983 1.021 1.00 10.00 C ATOM 524 CD1 LEU A 35 -5.609 -16.404 0.878 1.00 10.00 C ATOM 525 CD2 LEU A 35 -3.856 -14.895 -0.009 1.00 10.00 C ATOM 0 H LEU A 35 -4.643 -15.875 5.041 1.00 10.00 H new ATOM 0 HA LEU A 35 -3.428 -17.548 2.914 1.00 10.00 H new ATOM 0 HB2 LEU A 35 -4.614 -14.863 2.798 1.00 10.00 H new ATOM 0 HB3 LEU A 35 -2.914 -14.858 2.370 1.00 10.00 H new ATOM 0 HG LEU A 35 -3.536 -16.864 0.846 1.00 10.00 H new ATOM 0 HD11 LEU A 35 -5.792 -16.741 -0.142 1.00 10.00 H new ATOM 0 HD12 LEU A 35 -5.823 -17.217 1.572 1.00 10.00 H new ATOM 0 HD13 LEU A 35 -6.257 -15.556 1.101 1.00 10.00 H new ATOM 0 HD21 LEU A 35 -4.111 -15.257 -1.005 1.00 10.00 H new ATOM 0 HD22 LEU A 35 -4.448 -14.008 0.217 1.00 10.00 H new ATOM 0 HD23 LEU A 35 -2.796 -14.643 0.025 1.00 10.00 H new ATOM 537 N PHE A 36 -1.116 -16.056 3.611 1.00 10.00 N ATOM 538 CA PHE A 36 0.213 -15.675 4.141 1.00 10.00 C ATOM 539 C PHE A 36 1.030 -16.723 4.911 1.00 10.00 C ATOM 540 O PHE A 36 2.255 -16.617 5.005 1.00 10.00 O ATOM 541 CB PHE A 36 0.170 -14.291 4.816 1.00 10.00 C ATOM 542 CG PHE A 36 -0.002 -13.165 3.810 1.00 10.00 C ATOM 543 CD1 PHE A 36 -1.284 -12.833 3.329 1.00 10.00 C ATOM 544 CD2 PHE A 36 1.127 -12.510 3.285 1.00 10.00 C ATOM 545 CE1 PHE A 36 -1.428 -11.923 2.269 1.00 10.00 C ATOM 546 CE2 PHE A 36 0.976 -11.568 2.252 1.00 10.00 C ATOM 547 CZ PHE A 36 -0.296 -11.298 1.721 1.00 10.00 C ATOM 0 H PHE A 36 -1.125 -16.009 2.592 1.00 10.00 H new ATOM 0 HA PHE A 36 0.823 -15.611 3.240 1.00 10.00 H new ATOM 0 HB2 PHE A 36 -0.651 -14.264 5.533 1.00 10.00 H new ATOM 0 HB3 PHE A 36 1.090 -14.135 5.379 1.00 10.00 H new ATOM 0 HD1 PHE A 36 -2.159 -13.280 3.777 1.00 10.00 H new ATOM 0 HD2 PHE A 36 2.110 -12.731 3.675 1.00 10.00 H new ATOM 0 HE1 PHE A 36 -2.409 -11.704 1.875 1.00 10.00 H new ATOM 0 HE2 PHE A 36 1.841 -11.050 1.865 1.00 10.00 H new ATOM 0 HZ PHE A 36 -0.403 -10.612 0.894 1.00 10.00 H new ATOM 557 N GLY A 37 0.364 -17.777 5.359 1.00 10.00 N ATOM 558 CA GLY A 37 0.927 -19.049 5.813 1.00 10.00 C ATOM 559 C GLY A 37 0.133 -20.272 5.337 1.00 10.00 C ATOM 560 O GLY A 37 0.710 -21.351 5.184 1.00 10.00 O ATOM 0 H GLY A 37 -0.654 -17.770 5.421 1.00 10.00 H new ATOM 0 HA2 GLY A 37 1.954 -19.131 5.457 1.00 10.00 H new ATOM 0 HA3 GLY A 37 0.966 -19.052 6.902 1.00 10.00 H new ATOM 564 N ARG A 38 -1.171 -20.110 5.060 1.00 10.00 N ATOM 565 CA ARG A 38 -2.063 -21.166 4.549 1.00 10.00 C ATOM 566 C ARG A 38 -1.760 -21.562 3.096 1.00 10.00 C ATOM 567 O ARG A 38 -0.897 -20.971 2.437 1.00 10.00 O ATOM 568 CB ARG A 38 -3.526 -20.725 4.690 1.00 10.00 C ATOM 569 CG ARG A 38 -4.097 -21.023 6.094 1.00 10.00 C ATOM 570 CD ARG A 38 -5.635 -21.055 6.215 1.00 10.00 C ATOM 571 NE ARG A 38 -6.358 -20.978 4.927 1.00 10.00 N ATOM 572 CZ ARG A 38 -7.216 -21.834 4.391 1.00 10.00 C ATOM 573 NH1 ARG A 38 -7.384 -23.047 4.853 1.00 10.00 N ATOM 574 NH2 ARG A 38 -7.902 -21.472 3.334 1.00 10.00 N ATOM 0 H ARG A 38 -1.648 -19.217 5.188 1.00 10.00 H new ATOM 0 HA ARG A 38 -1.883 -22.055 5.153 1.00 10.00 H new ATOM 0 HB2 ARG A 38 -3.602 -19.656 4.489 1.00 10.00 H new ATOM 0 HB3 ARG A 38 -4.130 -21.234 3.939 1.00 10.00 H new ATOM 0 HG2 ARG A 38 -3.708 -21.986 6.424 1.00 10.00 H new ATOM 0 HG3 ARG A 38 -3.715 -20.271 6.785 1.00 10.00 H new ATOM 0 HD2 ARG A 38 -5.927 -21.973 6.726 1.00 10.00 H new ATOM 0 HD3 ARG A 38 -5.954 -20.225 6.845 1.00 10.00 H new ATOM 0 HE ARG A 38 -6.169 -20.145 4.370 1.00 10.00 H new ATOM 0 HH11 ARG A 38 -6.843 -23.366 5.657 1.00 10.00 H new ATOM 0 HH12 ARG A 38 -8.056 -23.673 4.409 1.00 10.00 H new ATOM 0 HH21 ARG A 38 -7.772 -20.542 2.935 1.00 10.00 H new ATOM 0 HH22 ARG A 38 -8.566 -22.120 2.910 1.00 10.00 H new ATOM 588 N LYS A 39 -2.378 -22.643 2.608 1.00 10.00 N ATOM 589 CA LYS A 39 -2.219 -23.095 1.215 1.00 10.00 C ATOM 590 C LYS A 39 -3.203 -22.431 0.243 1.00 10.00 C ATOM 591 O LYS A 39 -4.224 -21.866 0.638 1.00 10.00 O ATOM 592 CB LYS A 39 -2.205 -24.634 1.115 1.00 10.00 C ATOM 593 CG LYS A 39 -1.345 -25.357 2.165 1.00 10.00 C ATOM 594 CD LYS A 39 0.169 -25.084 2.077 1.00 10.00 C ATOM 595 CE LYS A 39 0.698 -24.323 3.303 1.00 10.00 C ATOM 596 NZ LYS A 39 1.072 -22.924 2.995 1.00 10.00 N ATOM 0 H LYS A 39 -3.001 -23.230 3.163 1.00 10.00 H new ATOM 0 HA LYS A 39 -1.237 -22.753 0.887 1.00 10.00 H new ATOM 0 HB2 LYS A 39 -3.230 -24.996 1.199 1.00 10.00 H new ATOM 0 HB3 LYS A 39 -1.848 -24.913 0.124 1.00 10.00 H new ATOM 0 HG2 LYS A 39 -1.693 -25.068 3.157 1.00 10.00 H new ATOM 0 HG3 LYS A 39 -1.510 -26.430 2.070 1.00 10.00 H new ATOM 0 HD2 LYS A 39 0.701 -26.030 1.982 1.00 10.00 H new ATOM 0 HD3 LYS A 39 0.380 -24.508 1.176 1.00 10.00 H new ATOM 0 HE2 LYS A 39 -0.063 -24.327 4.083 1.00 10.00 H new ATOM 0 HE3 LYS A 39 1.567 -24.847 3.702 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 1.292 -22.421 3.878 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 1.907 -22.916 2.375 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 0.280 -22.451 2.515 1.00 10.00 H new ATOM 610 N THR A 40 -2.864 -22.507 -1.048 1.00 10.00 N ATOM 611 CA THR A 40 -3.643 -21.970 -2.172 1.00 10.00 C ATOM 612 C THR A 40 -4.826 -22.894 -2.498 1.00 10.00 C ATOM 613 O THR A 40 -4.705 -24.113 -2.398 1.00 10.00 O ATOM 614 CB THR A 40 -2.692 -21.842 -3.375 1.00 10.00 C ATOM 615 OG1 THR A 40 -1.652 -20.944 -3.055 1.00 10.00 O ATOM 616 CG2 THR A 40 -3.340 -21.388 -4.679 1.00 10.00 C ATOM 0 H THR A 40 -2.004 -22.963 -1.353 1.00 10.00 H new ATOM 0 HA THR A 40 -4.060 -20.995 -1.919 1.00 10.00 H new ATOM 0 HB THR A 40 -2.329 -22.853 -3.558 1.00 10.00 H new ATOM 0 HG1 THR A 40 -1.994 -20.026 -3.078 1.00 10.00 H new ATOM 0 HG21 THR A 40 -2.583 -21.331 -5.461 1.00 10.00 H new ATOM 0 HG22 THR A 40 -4.110 -22.102 -4.971 1.00 10.00 H new ATOM 0 HG23 THR A 40 -3.791 -20.406 -4.538 1.00 10.00 H new ATOM 624 N GLY A 41 -5.973 -22.322 -2.893 1.00 10.00 N ATOM 625 CA GLY A 41 -7.168 -23.070 -3.318 1.00 10.00 C ATOM 626 C GLY A 41 -7.987 -23.702 -2.194 1.00 10.00 C ATOM 627 O GLY A 41 -9.000 -24.347 -2.451 1.00 10.00 O ATOM 0 H GLY A 41 -6.100 -21.310 -2.927 1.00 10.00 H new ATOM 0 HA2 GLY A 41 -7.815 -22.397 -3.880 1.00 10.00 H new ATOM 0 HA3 GLY A 41 -6.856 -23.858 -4.003 1.00 10.00 H new ATOM 631 N GLN A 42 -7.564 -23.520 -0.949 1.00 10.00 N ATOM 632 CA GLN A 42 -8.175 -24.040 0.282 1.00 10.00 C ATOM 633 C GLN A 42 -9.517 -23.355 0.653 1.00 10.00 C ATOM 634 O GLN A 42 -9.712 -22.915 1.793 1.00 10.00 O ATOM 635 CB GLN A 42 -7.134 -23.897 1.400 1.00 10.00 C ATOM 636 CG GLN A 42 -5.870 -24.731 1.203 1.00 10.00 C ATOM 637 CD GLN A 42 -6.092 -26.213 1.478 1.00 10.00 C ATOM 638 OE1 GLN A 42 -6.648 -26.941 0.672 1.00 10.00 O ATOM 639 NE2 GLN A 42 -5.674 -26.706 2.628 1.00 10.00 N ATOM 0 H GLN A 42 -6.729 -22.969 -0.752 1.00 10.00 H new ATOM 0 HA GLN A 42 -8.445 -25.085 0.129 1.00 10.00 H new ATOM 0 HB2 GLN A 42 -6.852 -22.848 1.483 1.00 10.00 H new ATOM 0 HB3 GLN A 42 -7.596 -24.179 2.346 1.00 10.00 H new ATOM 0 HG2 GLN A 42 -5.513 -24.605 0.181 1.00 10.00 H new ATOM 0 HG3 GLN A 42 -5.087 -24.357 1.863 1.00 10.00 H new ATOM 0 HE21 GLN A 42 -5.209 -26.100 3.304 1.00 10.00 H new ATOM 0 HE22 GLN A 42 -5.816 -27.693 2.841 1.00 10.00 H new ATOM 648 N ALA A 43 -10.427 -23.257 -0.322 1.00 10.00 N ATOM 649 CA ALA A 43 -11.747 -22.636 -0.265 1.00 10.00 C ATOM 650 C ALA A 43 -12.789 -23.482 0.492 1.00 10.00 C ATOM 651 O ALA A 43 -12.906 -24.677 0.215 1.00 10.00 O ATOM 652 CB ALA A 43 -12.223 -22.438 -1.707 1.00 10.00 C ATOM 0 H ALA A 43 -10.239 -23.644 -1.247 1.00 10.00 H new ATOM 0 HA ALA A 43 -11.655 -21.696 0.279 1.00 10.00 H new ATOM 0 HB1 ALA A 43 -13.210 -21.975 -1.704 1.00 10.00 H new ATOM 0 HB2 ALA A 43 -11.521 -21.794 -2.237 1.00 10.00 H new ATOM 0 HB3 ALA A 43 -12.278 -23.404 -2.208 1.00 10.00 H new ATOM 658 N PRO A 44 -13.637 -22.887 1.353 1.00 10.00 N ATOM 659 CA PRO A 44 -14.749 -23.584 2.005 1.00 10.00 C ATOM 660 C PRO A 44 -15.957 -23.807 1.056 1.00 10.00 C ATOM 661 O PRO A 44 -17.101 -23.551 1.424 1.00 10.00 O ATOM 662 CB PRO A 44 -15.054 -22.730 3.245 1.00 10.00 C ATOM 663 CG PRO A 44 -14.748 -21.311 2.777 1.00 10.00 C ATOM 664 CD PRO A 44 -13.577 -21.501 1.808 1.00 10.00 C ATOM 0 HA PRO A 44 -14.498 -24.605 2.292 1.00 10.00 H new ATOM 0 HB2 PRO A 44 -16.092 -22.835 3.560 1.00 10.00 H new ATOM 0 HB3 PRO A 44 -14.433 -23.017 4.094 1.00 10.00 H new ATOM 0 HG2 PRO A 44 -15.607 -20.856 2.284 1.00 10.00 H new ATOM 0 HG3 PRO A 44 -14.479 -20.662 3.611 1.00 10.00 H new ATOM 0 HD2 PRO A 44 -13.654 -20.813 0.966 1.00 10.00 H new ATOM 0 HD3 PRO A 44 -12.627 -21.295 2.302 1.00 10.00 H new ATOM 672 N GLY A 45 -15.706 -24.283 -0.176 1.00 10.00 N ATOM 673 CA GLY A 45 -16.721 -24.685 -1.163 1.00 10.00 C ATOM 674 C GLY A 45 -16.847 -23.748 -2.373 1.00 10.00 C ATOM 675 O GLY A 45 -17.763 -22.927 -2.427 1.00 10.00 O ATOM 0 H GLY A 45 -14.755 -24.402 -0.524 1.00 10.00 H new ATOM 0 HA2 GLY A 45 -16.484 -25.687 -1.520 1.00 10.00 H new ATOM 0 HA3 GLY A 45 -17.689 -24.745 -0.665 1.00 10.00 H new ATOM 679 N PHE A 46 -15.950 -23.882 -3.361 1.00 10.00 N ATOM 680 CA PHE A 46 -16.012 -23.169 -4.646 1.00 10.00 C ATOM 681 C PHE A 46 -15.312 -23.962 -5.763 1.00 10.00 C ATOM 682 O PHE A 46 -14.144 -24.327 -5.637 1.00 10.00 O ATOM 683 CB PHE A 46 -15.393 -21.770 -4.488 1.00 10.00 C ATOM 684 CG PHE A 46 -14.919 -21.110 -5.772 1.00 10.00 C ATOM 685 CD1 PHE A 46 -15.794 -20.885 -6.856 1.00 10.00 C ATOM 686 CD2 PHE A 46 -13.564 -20.758 -5.895 1.00 10.00 C ATOM 687 CE1 PHE A 46 -15.306 -20.313 -8.047 1.00 10.00 C ATOM 688 CE2 PHE A 46 -13.079 -20.189 -7.082 1.00 10.00 C ATOM 689 CZ PHE A 46 -13.947 -19.969 -8.161 1.00 10.00 C ATOM 0 H PHE A 46 -15.144 -24.502 -3.288 1.00 10.00 H new ATOM 0 HA PHE A 46 -17.057 -23.064 -4.937 1.00 10.00 H new ATOM 0 HB2 PHE A 46 -16.129 -21.119 -4.017 1.00 10.00 H new ATOM 0 HB3 PHE A 46 -14.547 -21.842 -3.805 1.00 10.00 H new ATOM 0 HD1 PHE A 46 -16.837 -21.151 -6.772 1.00 10.00 H new ATOM 0 HD2 PHE A 46 -12.890 -20.927 -5.068 1.00 10.00 H new ATOM 0 HE1 PHE A 46 -15.977 -20.138 -8.875 1.00 10.00 H new ATOM 0 HE2 PHE A 46 -12.036 -19.920 -7.165 1.00 10.00 H new ATOM 0 HZ PHE A 46 -13.573 -19.537 -9.077 1.00 10.00 H new ATOM 699 N THR A 47 -16.032 -24.214 -6.863 1.00 10.00 N ATOM 700 CA THR A 47 -15.538 -24.937 -8.042 1.00 10.00 C ATOM 701 C THR A 47 -14.690 -24.036 -8.953 1.00 10.00 C ATOM 702 O THR A 47 -15.187 -23.448 -9.913 1.00 10.00 O ATOM 703 CB THR A 47 -16.707 -25.571 -8.818 1.00 10.00 C ATOM 704 OG1 THR A 47 -17.550 -26.266 -7.924 1.00 10.00 O ATOM 705 CG2 THR A 47 -16.227 -26.586 -9.859 1.00 10.00 C ATOM 0 H THR A 47 -17.001 -23.912 -6.960 1.00 10.00 H new ATOM 0 HA THR A 47 -14.886 -25.736 -7.689 1.00 10.00 H new ATOM 0 HB THR A 47 -17.228 -24.756 -9.320 1.00 10.00 H new ATOM 0 HG1 THR A 47 -18.294 -26.667 -8.420 1.00 10.00 H new ATOM 0 HG21 THR A 47 -17.087 -27.006 -10.381 1.00 10.00 H new ATOM 0 HG22 THR A 47 -15.574 -26.090 -10.577 1.00 10.00 H new ATOM 0 HG23 THR A 47 -15.678 -27.386 -9.361 1.00 10.00 H new ATOM 713 N TYR A 48 -13.390 -23.970 -8.668 1.00 10.00 N ATOM 714 CA TYR A 48 -12.352 -23.418 -9.547 1.00 10.00 C ATOM 715 C TYR A 48 -11.849 -24.444 -10.584 1.00 10.00 C ATOM 716 O TYR A 48 -12.207 -25.619 -10.571 1.00 10.00 O ATOM 717 CB TYR A 48 -11.175 -22.951 -8.677 1.00 10.00 C ATOM 718 CG TYR A 48 -10.856 -23.825 -7.481 1.00 10.00 C ATOM 719 CD1 TYR A 48 -10.453 -25.168 -7.641 1.00 10.00 C ATOM 720 CD2 TYR A 48 -10.948 -23.264 -6.196 1.00 10.00 C ATOM 721 CE1 TYR A 48 -10.109 -25.938 -6.516 1.00 10.00 C ATOM 722 CE2 TYR A 48 -10.601 -24.029 -5.070 1.00 10.00 C ATOM 723 CZ TYR A 48 -10.161 -25.362 -5.230 1.00 10.00 C ATOM 724 OH TYR A 48 -9.739 -26.076 -4.156 1.00 10.00 O ATOM 0 H TYR A 48 -13.013 -24.312 -7.784 1.00 10.00 H new ATOM 0 HA TYR A 48 -12.786 -22.587 -10.103 1.00 10.00 H new ATOM 0 HB2 TYR A 48 -10.286 -22.887 -9.305 1.00 10.00 H new ATOM 0 HB3 TYR A 48 -11.387 -21.943 -8.321 1.00 10.00 H new ATOM 0 HD1 TYR A 48 -10.409 -25.604 -8.628 1.00 10.00 H new ATOM 0 HD2 TYR A 48 -11.285 -22.245 -6.074 1.00 10.00 H new ATOM 0 HE1 TYR A 48 -9.806 -26.968 -6.636 1.00 10.00 H new ATOM 0 HE2 TYR A 48 -10.671 -23.598 -4.082 1.00 10.00 H new ATOM 0 HH TYR A 48 -9.869 -25.548 -3.341 1.00 10.00 H new ATOM 734 N THR A 49 -10.949 -23.977 -11.455 1.00 10.00 N ATOM 735 CA THR A 49 -9.993 -24.772 -12.243 1.00 10.00 C ATOM 736 C THR A 49 -8.998 -25.470 -11.307 1.00 10.00 C ATOM 737 O THR A 49 -8.453 -24.830 -10.411 1.00 10.00 O ATOM 738 CB THR A 49 -9.282 -23.852 -13.267 1.00 10.00 C ATOM 739 OG1 THR A 49 -8.083 -24.384 -13.797 1.00 10.00 O ATOM 740 CG2 THR A 49 -9.001 -22.427 -12.780 1.00 10.00 C ATOM 0 H THR A 49 -10.861 -22.978 -11.642 1.00 10.00 H new ATOM 0 HA THR A 49 -10.518 -25.550 -12.798 1.00 10.00 H new ATOM 0 HB THR A 49 -10.031 -23.800 -14.058 1.00 10.00 H new ATOM 0 HG1 THR A 49 -7.667 -23.725 -14.391 1.00 10.00 H new ATOM 0 HG21 THR A 49 -8.502 -21.865 -13.569 1.00 10.00 H new ATOM 0 HG22 THR A 49 -9.941 -21.938 -12.525 1.00 10.00 H new ATOM 0 HG23 THR A 49 -8.360 -22.463 -11.899 1.00 10.00 H new ATOM 748 N ASP A 50 -8.779 -26.781 -11.485 1.00 10.00 N ATOM 749 CA ASP A 50 -7.744 -27.546 -10.780 1.00 10.00 C ATOM 750 C ASP A 50 -6.330 -27.249 -11.342 1.00 10.00 C ATOM 751 O ASP A 50 -6.121 -26.195 -11.930 1.00 10.00 O ATOM 752 CB ASP A 50 -8.126 -29.033 -10.796 1.00 10.00 C ATOM 753 CG ASP A 50 -7.884 -29.660 -12.164 1.00 10.00 C ATOM 754 OD1 ASP A 50 -8.704 -29.393 -13.068 1.00 10.00 O ATOM 755 OD2 ASP A 50 -6.840 -30.340 -12.272 1.00 10.00 O ATOM 0 H ASP A 50 -9.326 -27.347 -12.134 1.00 10.00 H new ATOM 0 HA ASP A 50 -7.693 -27.234 -9.737 1.00 10.00 H new ATOM 0 HB2 ASP A 50 -7.546 -29.566 -10.043 1.00 10.00 H new ATOM 0 HB3 ASP A 50 -9.176 -29.142 -10.526 1.00 10.00 H new ATOM 760 N ALA A 51 -5.336 -28.122 -11.125 1.00 10.00 N ATOM 761 CA ALA A 51 -3.904 -27.910 -11.398 1.00 10.00 C ATOM 762 C ALA A 51 -3.307 -26.695 -10.652 1.00 10.00 C ATOM 763 O ALA A 51 -2.534 -26.880 -9.711 1.00 10.00 O ATOM 764 CB ALA A 51 -3.643 -27.896 -12.913 1.00 10.00 C ATOM 0 H ALA A 51 -5.518 -29.046 -10.733 1.00 10.00 H new ATOM 0 HA ALA A 51 -3.361 -28.760 -10.984 1.00 10.00 H new ATOM 0 HB1 ALA A 51 -2.580 -27.738 -13.098 1.00 10.00 H new ATOM 0 HB2 ALA A 51 -3.949 -28.850 -13.344 1.00 10.00 H new ATOM 0 HB3 ALA A 51 -4.215 -27.090 -13.373 1.00 10.00 H new ATOM 770 N ASN A 52 -3.688 -25.469 -11.027 1.00 10.00 N ATOM 771 CA ASN A 52 -3.326 -24.209 -10.374 1.00 10.00 C ATOM 772 C ASN A 52 -3.597 -24.225 -8.853 1.00 10.00 C ATOM 773 O ASN A 52 -2.692 -23.935 -8.071 1.00 10.00 O ATOM 774 CB ASN A 52 -3.971 -23.030 -11.152 1.00 10.00 C ATOM 775 CG ASN A 52 -5.447 -23.234 -11.477 1.00 10.00 C ATOM 776 OD1 ASN A 52 -6.292 -23.171 -10.480 1.00 10.00 O flip ATOM 777 ND2 ASN A 52 -5.851 -23.508 -12.598 1.00 10.00 N flip ATOM 0 H ASN A 52 -4.289 -25.323 -11.838 1.00 10.00 H new ATOM 0 HA ASN A 52 -2.247 -24.065 -10.422 1.00 10.00 H new ATOM 0 HB2 ASN A 52 -3.862 -22.118 -10.565 1.00 10.00 H new ATOM 0 HB3 ASN A 52 -3.423 -22.879 -12.082 1.00 10.00 H new ATOM 0 HD21 ASN A 52 -5.196 -23.558 -13.378 1.00 10.00 H new ATOM 0 HD22 ASN A 52 -6.843 -23.686 -12.753 1.00 10.00 H new ATOM 784 N LYS A 53 -4.808 -24.599 -8.410 1.00 10.00 N ATOM 785 CA LYS A 53 -5.142 -24.850 -6.993 1.00 10.00 C ATOM 786 C LYS A 53 -4.530 -26.138 -6.453 1.00 10.00 C ATOM 787 O LYS A 53 -3.977 -26.112 -5.361 1.00 10.00 O ATOM 788 CB LYS A 53 -6.660 -24.833 -6.809 1.00 10.00 C ATOM 789 CG LYS A 53 -7.321 -23.493 -7.179 1.00 10.00 C ATOM 790 CD LYS A 53 -6.648 -22.185 -6.726 1.00 10.00 C ATOM 791 CE LYS A 53 -5.359 -21.778 -7.457 1.00 10.00 C ATOM 792 NZ LYS A 53 -5.121 -20.324 -7.385 1.00 10.00 N ATOM 0 H LYS A 53 -5.600 -24.739 -9.037 1.00 10.00 H new ATOM 0 HA LYS A 53 -4.699 -24.046 -6.406 1.00 10.00 H new ATOM 0 HB2 LYS A 53 -7.098 -25.623 -7.419 1.00 10.00 H new ATOM 0 HB3 LYS A 53 -6.892 -25.066 -5.770 1.00 10.00 H new ATOM 0 HG2 LYS A 53 -7.412 -23.459 -8.265 1.00 10.00 H new ATOM 0 HG3 LYS A 53 -8.333 -23.501 -6.774 1.00 10.00 H new ATOM 0 HD2 LYS A 53 -7.370 -21.376 -6.836 1.00 10.00 H new ATOM 0 HD3 LYS A 53 -6.423 -22.270 -5.663 1.00 10.00 H new ATOM 0 HE2 LYS A 53 -4.512 -22.307 -7.020 1.00 10.00 H new ATOM 0 HE3 LYS A 53 -5.422 -22.084 -8.501 1.00 10.00 H new ATOM 0 HZ1 LYS A 53 -4.136 -20.147 -7.102 1.00 10.00 H new ATOM 0 HZ2 LYS A 53 -5.295 -19.897 -8.317 1.00 10.00 H new ATOM 0 HZ3 LYS A 53 -5.764 -19.901 -6.685 1.00 10.00 H new ATOM 806 N ASN A 54 -4.561 -27.231 -7.221 1.00 10.00 N ATOM 807 CA ASN A 54 -4.019 -28.530 -6.813 1.00 10.00 C ATOM 808 C ASN A 54 -2.542 -28.449 -6.374 1.00 10.00 C ATOM 809 O ASN A 54 -2.175 -29.045 -5.364 1.00 10.00 O ATOM 810 CB ASN A 54 -4.237 -29.526 -7.961 1.00 10.00 C ATOM 811 CG ASN A 54 -3.572 -30.870 -7.712 1.00 10.00 C ATOM 812 OD1 ASN A 54 -2.495 -31.144 -8.218 1.00 10.00 O ATOM 813 ND2 ASN A 54 -4.182 -31.737 -6.930 1.00 10.00 N ATOM 0 H ASN A 54 -4.969 -27.238 -8.156 1.00 10.00 H new ATOM 0 HA ASN A 54 -4.551 -28.877 -5.927 1.00 10.00 H new ATOM 0 HB2 ASN A 54 -5.307 -29.677 -8.106 1.00 10.00 H new ATOM 0 HB3 ASN A 54 -3.847 -29.099 -8.885 1.00 10.00 H new ATOM 0 HD21 ASN A 54 -3.755 -32.644 -6.744 1.00 10.00 H new ATOM 0 HD22 ASN A 54 -5.081 -31.501 -6.511 1.00 10.00 H new ATOM 820 N LYS A 55 -1.710 -27.675 -7.092 1.00 10.00 N ATOM 821 CA LYS A 55 -0.293 -27.446 -6.759 1.00 10.00 C ATOM 822 C LYS A 55 -0.066 -26.513 -5.558 1.00 10.00 C ATOM 823 O LYS A 55 1.048 -26.462 -5.046 1.00 10.00 O ATOM 824 CB LYS A 55 0.454 -26.965 -8.011 1.00 10.00 C ATOM 825 CG LYS A 55 0.531 -28.102 -9.045 1.00 10.00 C ATOM 826 CD LYS A 55 1.166 -27.656 -10.363 1.00 10.00 C ATOM 827 CE LYS A 55 1.109 -28.843 -11.331 1.00 10.00 C ATOM 828 NZ LYS A 55 1.732 -28.528 -12.637 1.00 10.00 N ATOM 0 H LYS A 55 -2.008 -27.183 -7.934 1.00 10.00 H new ATOM 0 HA LYS A 55 0.116 -28.402 -6.433 1.00 10.00 H new ATOM 0 HB2 LYS A 55 -0.057 -26.104 -8.442 1.00 10.00 H new ATOM 0 HB3 LYS A 55 1.458 -26.638 -7.742 1.00 10.00 H new ATOM 0 HG2 LYS A 55 1.108 -28.928 -8.629 1.00 10.00 H new ATOM 0 HG3 LYS A 55 -0.473 -28.480 -9.239 1.00 10.00 H new ATOM 0 HD2 LYS A 55 0.631 -26.800 -10.775 1.00 10.00 H new ATOM 0 HD3 LYS A 55 2.197 -27.341 -10.204 1.00 10.00 H new ATOM 0 HE2 LYS A 55 1.616 -29.698 -10.885 1.00 10.00 H new ATOM 0 HE3 LYS A 55 0.070 -29.134 -11.486 1.00 10.00 H new ATOM 0 HZ1 LYS A 55 1.671 -29.358 -13.260 1.00 10.00 H new ATOM 0 HZ2 LYS A 55 1.233 -27.728 -13.076 1.00 10.00 H new ATOM 0 HZ3 LYS A 55 2.731 -28.276 -12.493 1.00 10.00 H new ATOM 842 N GLY A 56 -1.100 -25.814 -5.075 1.00 10.00 N ATOM 843 CA GLY A 56 -1.226 -25.387 -3.668 1.00 10.00 C ATOM 844 C GLY A 56 -0.243 -24.324 -3.139 1.00 10.00 C ATOM 845 O GLY A 56 -0.265 -24.069 -1.933 1.00 10.00 O ATOM 0 H GLY A 56 -1.886 -25.523 -5.656 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -2.237 -25.006 -3.525 1.00 10.00 H new ATOM 0 HA3 GLY A 56 -1.127 -26.273 -3.041 1.00 10.00 H new ATOM 849 N ILE A 57 0.552 -23.710 -4.028 1.00 10.00 N ATOM 850 CA ILE A 57 1.870 -23.031 -3.971 1.00 10.00 C ATOM 851 C ILE A 57 2.261 -22.100 -2.796 1.00 10.00 C ATOM 852 O ILE A 57 3.315 -21.476 -2.857 1.00 10.00 O ATOM 853 CB ILE A 57 2.149 -22.357 -5.346 1.00 10.00 C ATOM 854 CG1 ILE A 57 1.150 -21.253 -5.768 1.00 10.00 C ATOM 855 CG2 ILE A 57 2.189 -23.419 -6.465 1.00 10.00 C ATOM 856 CD1 ILE A 57 1.189 -19.982 -4.914 1.00 10.00 C ATOM 0 H ILE A 57 0.221 -23.670 -4.992 1.00 10.00 H new ATOM 0 HA ILE A 57 2.531 -23.865 -3.735 1.00 10.00 H new ATOM 0 HB ILE A 57 3.112 -21.865 -5.208 1.00 10.00 H new ATOM 0 HG12 ILE A 57 1.348 -20.982 -6.805 1.00 10.00 H new ATOM 0 HG13 ILE A 57 0.141 -21.665 -5.734 1.00 10.00 H new ATOM 0 HG21 ILE A 57 2.385 -22.933 -7.421 1.00 10.00 H new ATOM 0 HG22 ILE A 57 2.980 -24.139 -6.255 1.00 10.00 H new ATOM 0 HG23 ILE A 57 1.230 -23.936 -6.510 1.00 10.00 H new ATOM 0 HD11 ILE A 57 0.454 -19.270 -5.288 1.00 10.00 H new ATOM 0 HD12 ILE A 57 0.958 -20.232 -3.879 1.00 10.00 H new ATOM 0 HD13 ILE A 57 2.183 -19.539 -4.967 1.00 10.00 H new ATOM 868 N THR A 58 1.503 -22.055 -1.700 1.00 10.00 N ATOM 869 CA THR A 58 1.627 -21.158 -0.540 1.00 10.00 C ATOM 870 C THR A 58 1.574 -19.667 -0.878 1.00 10.00 C ATOM 871 O THR A 58 2.507 -19.053 -1.403 1.00 10.00 O ATOM 872 CB THR A 58 2.872 -21.481 0.307 1.00 10.00 C ATOM 873 OG1 THR A 58 2.752 -22.802 0.788 1.00 10.00 O ATOM 874 CG2 THR A 58 3.017 -20.573 1.533 1.00 10.00 C ATOM 0 H THR A 58 0.719 -22.698 -1.587 1.00 10.00 H new ATOM 0 HA THR A 58 0.735 -21.359 0.054 1.00 10.00 H new ATOM 0 HB THR A 58 3.740 -21.335 -0.335 1.00 10.00 H new ATOM 0 HG1 THR A 58 3.441 -22.967 1.465 1.00 10.00 H new ATOM 0 HG21 THR A 58 3.913 -20.851 2.088 1.00 10.00 H new ATOM 0 HG22 THR A 58 3.098 -19.535 1.210 1.00 10.00 H new ATOM 0 HG23 THR A 58 2.143 -20.686 2.175 1.00 10.00 H new ATOM 882 N TRP A 59 0.466 -19.047 -0.476 1.00 10.00 N ATOM 883 CA TRP A 59 0.369 -17.597 -0.445 1.00 10.00 C ATOM 884 C TRP A 59 1.216 -16.988 0.672 1.00 10.00 C ATOM 885 O TRP A 59 1.183 -17.447 1.814 1.00 10.00 O ATOM 886 CB TRP A 59 -1.085 -17.180 -0.331 1.00 10.00 C ATOM 887 CG TRP A 59 -1.894 -17.561 -1.528 1.00 10.00 C ATOM 888 CD1 TRP A 59 -3.041 -18.273 -1.500 1.00 10.00 C ATOM 889 CD2 TRP A 59 -1.610 -17.304 -2.942 1.00 10.00 C ATOM 890 NE1 TRP A 59 -3.500 -18.439 -2.785 1.00 10.00 N ATOM 891 CE2 TRP A 59 -2.625 -17.930 -3.722 1.00 10.00 C ATOM 892 CE3 TRP A 59 -0.594 -16.628 -3.653 1.00 10.00 C ATOM 893 CZ2 TRP A 59 -2.612 -17.938 -5.122 1.00 10.00 C ATOM 894 CZ3 TRP A 59 -0.563 -16.640 -5.059 1.00 10.00 C ATOM 895 CH2 TRP A 59 -1.559 -17.299 -5.794 1.00 10.00 C ATOM 0 H TRP A 59 -0.377 -19.532 -0.167 1.00 10.00 H new ATOM 0 HA TRP A 59 0.772 -17.210 -1.381 1.00 10.00 H new ATOM 0 HB2 TRP A 59 -1.521 -17.638 0.557 1.00 10.00 H new ATOM 0 HB3 TRP A 59 -1.138 -16.100 -0.191 1.00 10.00 H new ATOM 0 HD1 TRP A 59 -3.521 -18.652 -0.610 1.00 10.00 H new ATOM 0 HE1 TRP A 59 -4.386 -18.887 -3.019 1.00 10.00 H new ATOM 0 HE3 TRP A 59 0.171 -16.094 -3.109 1.00 10.00 H new ATOM 0 HZ2 TRP A 59 -3.399 -18.428 -5.676 1.00 10.00 H new ATOM 0 HZ3 TRP A 59 0.238 -16.135 -5.579 1.00 10.00 H new ATOM 0 HH2 TRP A 59 -1.516 -17.315 -6.873 1.00 10.00 H new ATOM 906 N LYS A 60 1.941 -15.934 0.301 1.00 10.00 N ATOM 907 CA LYS A 60 2.761 -15.006 1.082 1.00 10.00 C ATOM 908 C LYS A 60 3.020 -13.802 0.156 1.00 10.00 C ATOM 909 O LYS A 60 2.605 -13.857 -1.010 1.00 10.00 O ATOM 910 CB LYS A 60 4.047 -15.726 1.527 1.00 10.00 C ATOM 911 CG LYS A 60 4.727 -15.030 2.715 1.00 10.00 C ATOM 912 CD LYS A 60 6.001 -15.754 3.171 1.00 10.00 C ATOM 913 CE LYS A 60 5.749 -17.142 3.772 1.00 10.00 C ATOM 914 NZ LYS A 60 4.939 -17.075 5.013 1.00 10.00 N ATOM 0 H LYS A 60 1.971 -15.677 -0.686 1.00 10.00 H new ATOM 0 HA LYS A 60 2.281 -14.659 1.997 1.00 10.00 H new ATOM 0 HB2 LYS A 60 3.809 -16.754 1.800 1.00 10.00 H new ATOM 0 HB3 LYS A 60 4.743 -15.772 0.689 1.00 10.00 H new ATOM 0 HG2 LYS A 60 4.975 -14.005 2.438 1.00 10.00 H new ATOM 0 HG3 LYS A 60 4.027 -14.974 3.548 1.00 10.00 H new ATOM 0 HD2 LYS A 60 6.674 -15.855 2.319 1.00 10.00 H new ATOM 0 HD3 LYS A 60 6.512 -15.137 3.910 1.00 10.00 H new ATOM 0 HE2 LYS A 60 5.238 -17.766 3.039 1.00 10.00 H new ATOM 0 HE3 LYS A 60 6.704 -17.621 3.988 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 5.233 -17.834 5.661 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 5.083 -16.153 5.472 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 3.933 -17.191 4.777 1.00 10.00 H new ATOM 928 N GLU A 61 3.640 -12.711 0.620 1.00 10.00 N ATOM 929 CA GLU A 61 3.779 -11.530 -0.240 1.00 10.00 C ATOM 930 C GLU A 61 4.508 -11.801 -1.558 1.00 10.00 C ATOM 931 O GLU A 61 4.096 -11.252 -2.567 1.00 10.00 O ATOM 932 CB GLU A 61 4.380 -10.321 0.488 1.00 10.00 C ATOM 933 CG GLU A 61 5.707 -10.575 1.209 1.00 10.00 C ATOM 934 CD GLU A 61 5.470 -10.701 2.715 1.00 10.00 C ATOM 935 OE1 GLU A 61 4.696 -11.595 3.148 1.00 10.00 O ATOM 936 OE2 GLU A 61 5.989 -9.843 3.468 1.00 10.00 O ATOM 0 H GLU A 61 4.041 -12.620 1.553 1.00 10.00 H new ATOM 0 HA GLU A 61 2.753 -11.273 -0.504 1.00 10.00 H new ATOM 0 HB2 GLU A 61 4.528 -9.520 -0.236 1.00 10.00 H new ATOM 0 HB3 GLU A 61 3.654 -9.961 1.217 1.00 10.00 H new ATOM 0 HG2 GLU A 61 6.169 -11.486 0.828 1.00 10.00 H new ATOM 0 HG3 GLU A 61 6.401 -9.758 1.009 1.00 10.00 H new ATOM 943 N GLU A 62 5.518 -12.668 -1.594 1.00 10.00 N ATOM 944 CA GLU A 62 6.282 -12.978 -2.806 1.00 10.00 C ATOM 945 C GLU A 62 5.387 -13.618 -3.877 1.00 10.00 C ATOM 946 O GLU A 62 5.291 -13.125 -5.002 1.00 10.00 O ATOM 947 CB GLU A 62 7.485 -13.891 -2.485 1.00 10.00 C ATOM 948 CG GLU A 62 8.290 -13.496 -1.232 1.00 10.00 C ATOM 949 CD GLU A 62 7.830 -14.270 0.015 1.00 10.00 C ATOM 950 OE1 GLU A 62 6.649 -14.098 0.389 1.00 10.00 O ATOM 951 OE2 GLU A 62 8.640 -15.046 0.566 1.00 10.00 O ATOM 0 H GLU A 62 5.835 -13.183 -0.773 1.00 10.00 H new ATOM 0 HA GLU A 62 6.665 -12.038 -3.204 1.00 10.00 H new ATOM 0 HB2 GLU A 62 7.123 -14.911 -2.358 1.00 10.00 H new ATOM 0 HB3 GLU A 62 8.157 -13.895 -3.343 1.00 10.00 H new ATOM 0 HG2 GLU A 62 9.349 -13.686 -1.407 1.00 10.00 H new ATOM 0 HG3 GLU A 62 8.183 -12.426 -1.055 1.00 10.00 H new ATOM 958 N THR A 63 4.700 -14.709 -3.514 1.00 10.00 N ATOM 959 CA THR A 63 3.813 -15.449 -4.414 1.00 10.00 C ATOM 960 C THR A 63 2.603 -14.621 -4.828 1.00 10.00 C ATOM 961 O THR A 63 2.247 -14.646 -6.003 1.00 10.00 O ATOM 962 CB THR A 63 3.426 -16.819 -3.824 1.00 10.00 C ATOM 963 OG1 THR A 63 2.728 -16.711 -2.607 1.00 10.00 O ATOM 964 CG2 THR A 63 4.644 -17.691 -3.501 1.00 10.00 C ATOM 0 H THR A 63 4.747 -15.105 -2.575 1.00 10.00 H new ATOM 0 HA THR A 63 4.368 -15.651 -5.330 1.00 10.00 H new ATOM 0 HB THR A 63 2.808 -17.265 -4.603 1.00 10.00 H new ATOM 0 HG1 THR A 63 2.865 -17.524 -2.078 1.00 10.00 H new ATOM 0 HG21 THR A 63 4.311 -18.643 -3.089 1.00 10.00 H new ATOM 0 HG22 THR A 63 5.215 -17.870 -4.412 1.00 10.00 H new ATOM 0 HG23 THR A 63 5.274 -17.181 -2.772 1.00 10.00 H new ATOM 972 N LEU A 64 2.010 -13.827 -3.930 1.00 10.00 N ATOM 973 CA LEU A 64 0.912 -12.925 -4.271 1.00 10.00 C ATOM 974 C LEU A 64 1.365 -11.671 -5.038 1.00 10.00 C ATOM 975 O LEU A 64 0.596 -11.165 -5.845 1.00 10.00 O ATOM 976 CB LEU A 64 0.128 -12.571 -2.992 1.00 10.00 C ATOM 977 CG LEU A 64 -1.403 -12.638 -3.135 1.00 10.00 C ATOM 978 CD1 LEU A 64 -2.040 -12.306 -1.781 1.00 10.00 C ATOM 979 CD2 LEU A 64 -1.964 -11.652 -4.163 1.00 10.00 C ATOM 0 H LEU A 64 2.280 -13.794 -2.947 1.00 10.00 H new ATOM 0 HA LEU A 64 0.253 -13.449 -4.963 1.00 10.00 H new ATOM 0 HB2 LEU A 64 0.435 -13.249 -2.195 1.00 10.00 H new ATOM 0 HB3 LEU A 64 0.406 -11.565 -2.679 1.00 10.00 H new ATOM 0 HG LEU A 64 -1.640 -13.646 -3.475 1.00 10.00 H new ATOM 0 HD11 LEU A 64 -3.126 -12.350 -1.869 1.00 10.00 H new ATOM 0 HD12 LEU A 64 -1.707 -13.028 -1.035 1.00 10.00 H new ATOM 0 HD13 LEU A 64 -1.741 -11.304 -1.474 1.00 10.00 H new ATOM 0 HD21 LEU A 64 -3.048 -11.754 -4.211 1.00 10.00 H new ATOM 0 HD22 LEU A 64 -1.708 -10.634 -3.868 1.00 10.00 H new ATOM 0 HD23 LEU A 64 -1.536 -11.864 -5.142 1.00 10.00 H new ATOM 991 N MET A 65 2.602 -11.191 -4.870 1.00 10.00 N ATOM 992 CA MET A 65 3.168 -10.131 -5.712 1.00 10.00 C ATOM 993 C MET A 65 3.270 -10.629 -7.145 1.00 10.00 C ATOM 994 O MET A 65 2.724 -9.999 -8.048 1.00 10.00 O ATOM 995 CB MET A 65 4.557 -9.677 -5.230 1.00 10.00 C ATOM 996 CG MET A 65 4.468 -8.598 -4.155 1.00 10.00 C ATOM 997 SD MET A 65 6.065 -7.820 -3.781 1.00 10.00 S ATOM 998 CE MET A 65 6.439 -8.623 -2.206 1.00 10.00 C ATOM 0 H MET A 65 3.239 -11.526 -4.147 1.00 10.00 H new ATOM 0 HA MET A 65 2.502 -9.270 -5.649 1.00 10.00 H new ATOM 0 HB2 MET A 65 5.102 -10.535 -4.837 1.00 10.00 H new ATOM 0 HB3 MET A 65 5.128 -9.297 -6.077 1.00 10.00 H new ATOM 0 HG2 MET A 65 3.765 -7.830 -4.478 1.00 10.00 H new ATOM 0 HG3 MET A 65 4.063 -9.037 -3.243 1.00 10.00 H new ATOM 0 HE1 MET A 65 7.510 -8.564 -2.013 1.00 10.00 H new ATOM 0 HE2 MET A 65 5.897 -8.121 -1.404 1.00 10.00 H new ATOM 0 HE3 MET A 65 6.135 -9.669 -2.250 1.00 10.00 H new ATOM 1008 N GLU A 66 3.921 -11.783 -7.328 1.00 10.00 N ATOM 1009 CA GLU A 66 4.083 -12.394 -8.644 1.00 10.00 C ATOM 1010 C GLU A 66 2.708 -12.678 -9.250 1.00 10.00 C ATOM 1011 O GLU A 66 2.438 -12.330 -10.403 1.00 10.00 O ATOM 1012 CB GLU A 66 4.904 -13.690 -8.500 1.00 10.00 C ATOM 1013 CG GLU A 66 5.472 -14.208 -9.827 1.00 10.00 C ATOM 1014 CD GLU A 66 6.351 -13.202 -10.574 1.00 10.00 C ATOM 1015 OE1 GLU A 66 7.213 -12.578 -9.919 1.00 10.00 O ATOM 1016 OE2 GLU A 66 6.131 -13.064 -11.800 1.00 10.00 O ATOM 0 H GLU A 66 4.347 -12.315 -6.569 1.00 10.00 H new ATOM 0 HA GLU A 66 4.615 -11.716 -9.311 1.00 10.00 H new ATOM 0 HB2 GLU A 66 5.726 -13.514 -7.807 1.00 10.00 H new ATOM 0 HB3 GLU A 66 4.274 -14.462 -8.058 1.00 10.00 H new ATOM 0 HG2 GLU A 66 6.056 -15.108 -9.632 1.00 10.00 H new ATOM 0 HG3 GLU A 66 4.644 -14.499 -10.474 1.00 10.00 H new ATOM 1023 N TYR A 67 1.810 -13.252 -8.442 1.00 10.00 N ATOM 1024 CA TYR A 67 0.475 -13.591 -8.896 1.00 10.00 C ATOM 1025 C TYR A 67 -0.363 -12.353 -9.257 1.00 10.00 C ATOM 1026 O TYR A 67 -0.965 -12.344 -10.321 1.00 10.00 O ATOM 1027 CB TYR A 67 -0.214 -14.443 -7.840 1.00 10.00 C ATOM 1028 CG TYR A 67 -1.636 -14.817 -8.189 1.00 10.00 C ATOM 1029 CD1 TYR A 67 -1.877 -15.870 -9.091 1.00 10.00 C ATOM 1030 CD2 TYR A 67 -2.714 -14.104 -7.633 1.00 10.00 C ATOM 1031 CE1 TYR A 67 -3.193 -16.249 -9.398 1.00 10.00 C ATOM 1032 CE2 TYR A 67 -4.033 -14.458 -7.965 1.00 10.00 C ATOM 1033 CZ TYR A 67 -4.278 -15.547 -8.831 1.00 10.00 C ATOM 1034 OH TYR A 67 -5.549 -15.920 -9.134 1.00 10.00 O ATOM 0 H TYR A 67 1.994 -13.489 -7.467 1.00 10.00 H new ATOM 0 HA TYR A 67 0.567 -14.163 -9.819 1.00 10.00 H new ATOM 0 HB2 TYR A 67 0.364 -15.354 -7.688 1.00 10.00 H new ATOM 0 HB3 TYR A 67 -0.212 -13.903 -6.893 1.00 10.00 H new ATOM 0 HD1 TYR A 67 -1.047 -16.388 -9.548 1.00 10.00 H new ATOM 0 HD2 TYR A 67 -2.528 -13.286 -6.952 1.00 10.00 H new ATOM 0 HE1 TYR A 67 -3.375 -17.077 -10.067 1.00 10.00 H new ATOM 0 HE2 TYR A 67 -4.861 -13.897 -7.557 1.00 10.00 H new ATOM 0 HH TYR A 67 -6.061 -15.135 -9.420 1.00 10.00 H new ATOM 1044 N LEU A 68 -0.435 -11.306 -8.425 1.00 10.00 N ATOM 1045 CA LEU A 68 -1.231 -10.117 -8.764 1.00 10.00 C ATOM 1046 C LEU A 68 -0.612 -9.317 -9.926 1.00 10.00 C ATOM 1047 O LEU A 68 -1.350 -8.705 -10.693 1.00 10.00 O ATOM 1048 CB LEU A 68 -1.457 -9.263 -7.495 1.00 10.00 C ATOM 1049 CG LEU A 68 -2.792 -8.499 -7.374 1.00 10.00 C ATOM 1050 CD1 LEU A 68 -3.000 -7.381 -8.397 1.00 10.00 C ATOM 1051 CD2 LEU A 68 -4.004 -9.437 -7.418 1.00 10.00 C ATOM 0 H LEU A 68 0.041 -11.256 -7.524 1.00 10.00 H new ATOM 0 HA LEU A 68 -2.207 -10.439 -9.128 1.00 10.00 H new ATOM 0 HB2 LEU A 68 -1.366 -9.918 -6.629 1.00 10.00 H new ATOM 0 HB3 LEU A 68 -0.647 -8.536 -7.431 1.00 10.00 H new ATOM 0 HG LEU A 68 -2.715 -8.025 -6.396 1.00 10.00 H new ATOM 0 HD11 LEU A 68 -3.967 -6.907 -8.227 1.00 10.00 H new ATOM 0 HD12 LEU A 68 -2.209 -6.639 -8.291 1.00 10.00 H new ATOM 0 HD13 LEU A 68 -2.973 -7.799 -9.403 1.00 10.00 H new ATOM 0 HD21 LEU A 68 -4.920 -8.853 -7.329 1.00 10.00 H new ATOM 0 HD22 LEU A 68 -4.010 -9.980 -8.363 1.00 10.00 H new ATOM 0 HD23 LEU A 68 -3.945 -10.147 -6.593 1.00 10.00 H new ATOM 1063 N GLU A 69 0.718 -9.339 -10.104 1.00 10.00 N ATOM 1064 CA GLU A 69 1.370 -8.697 -11.246 1.00 10.00 C ATOM 1065 C GLU A 69 1.326 -9.510 -12.554 1.00 10.00 C ATOM 1066 O GLU A 69 1.384 -8.899 -13.620 1.00 10.00 O ATOM 1067 CB GLU A 69 2.798 -8.297 -10.849 1.00 10.00 C ATOM 1068 CG GLU A 69 2.731 -7.031 -9.965 1.00 10.00 C ATOM 1069 CD GLU A 69 4.076 -6.367 -9.626 1.00 10.00 C ATOM 1070 OE1 GLU A 69 4.811 -5.997 -10.569 1.00 10.00 O ATOM 1071 OE2 GLU A 69 4.305 -6.093 -8.421 1.00 10.00 O ATOM 0 H GLU A 69 1.364 -9.800 -9.463 1.00 10.00 H new ATOM 0 HA GLU A 69 0.793 -7.804 -11.486 1.00 10.00 H new ATOM 0 HB2 GLU A 69 3.282 -9.110 -10.308 1.00 10.00 H new ATOM 0 HB3 GLU A 69 3.398 -8.105 -11.739 1.00 10.00 H new ATOM 0 HG2 GLU A 69 2.103 -6.295 -10.467 1.00 10.00 H new ATOM 0 HG3 GLU A 69 2.233 -7.291 -9.031 1.00 10.00 H new ATOM 1078 N ASN A 70 1.156 -10.840 -12.499 1.00 10.00 N ATOM 1079 CA ASN A 70 0.869 -11.703 -13.647 1.00 10.00 C ATOM 1080 C ASN A 70 0.315 -13.105 -13.274 1.00 10.00 C ATOM 1081 O ASN A 70 1.074 -14.078 -13.219 1.00 10.00 O ATOM 1082 CB ASN A 70 2.099 -11.792 -14.572 1.00 10.00 C ATOM 1083 CG ASN A 70 3.402 -12.438 -14.097 1.00 10.00 C ATOM 1084 OD1 ASN A 70 4.170 -12.891 -14.935 1.00 10.00 O ATOM 1085 ND2 ASN A 70 3.732 -12.463 -12.825 1.00 10.00 N ATOM 0 H ASN A 70 1.217 -11.358 -11.623 1.00 10.00 H new ATOM 0 HA ASN A 70 0.053 -11.227 -14.190 1.00 10.00 H new ATOM 0 HB2 ASN A 70 1.786 -12.328 -15.468 1.00 10.00 H new ATOM 0 HB3 ASN A 70 2.341 -10.774 -14.878 1.00 10.00 H new ATOM 0 HD21 ASN A 70 4.627 -12.859 -12.538 1.00 10.00 H new ATOM 0 HD22 ASN A 70 3.093 -12.086 -12.125 1.00 10.00 H new ATOM 1092 N PRO A 71 -1.008 -13.267 -13.048 1.00 10.00 N ATOM 1093 CA PRO A 71 -1.552 -14.463 -12.403 1.00 10.00 C ATOM 1094 C PRO A 71 -1.449 -15.719 -13.269 1.00 10.00 C ATOM 1095 O PRO A 71 -0.987 -16.760 -12.802 1.00 10.00 O ATOM 1096 CB PRO A 71 -3.006 -14.125 -12.045 1.00 10.00 C ATOM 1097 CG PRO A 71 -3.383 -12.996 -13.001 1.00 10.00 C ATOM 1098 CD PRO A 71 -2.057 -12.269 -13.238 1.00 10.00 C ATOM 0 HA PRO A 71 -0.969 -14.711 -11.516 1.00 10.00 H new ATOM 0 HB2 PRO A 71 -3.658 -14.989 -12.175 1.00 10.00 H new ATOM 0 HB3 PRO A 71 -3.096 -13.811 -11.005 1.00 10.00 H new ATOM 0 HG2 PRO A 71 -3.801 -13.381 -13.931 1.00 10.00 H new ATOM 0 HG3 PRO A 71 -4.131 -12.334 -12.565 1.00 10.00 H new ATOM 0 HD2 PRO A 71 -2.017 -11.848 -14.243 1.00 10.00 H new ATOM 0 HD3 PRO A 71 -1.937 -11.440 -12.541 1.00 10.00 H new ATOM 1106 N LYS A 72 -1.878 -15.620 -14.532 1.00 10.00 N ATOM 1107 CA LYS A 72 -2.004 -16.727 -15.477 1.00 10.00 C ATOM 1108 C LYS A 72 -0.634 -17.227 -15.942 1.00 10.00 C ATOM 1109 O LYS A 72 -0.467 -18.422 -16.168 1.00 10.00 O ATOM 1110 CB LYS A 72 -2.876 -16.302 -16.675 1.00 10.00 C ATOM 1111 CG LYS A 72 -4.012 -15.317 -16.338 1.00 10.00 C ATOM 1112 CD LYS A 72 -4.859 -14.926 -17.554 1.00 10.00 C ATOM 1113 CE LYS A 72 -5.633 -13.639 -17.221 1.00 10.00 C ATOM 1114 NZ LYS A 72 -7.065 -13.746 -17.573 1.00 10.00 N ATOM 0 H LYS A 72 -2.158 -14.727 -14.937 1.00 10.00 H new ATOM 0 HA LYS A 72 -2.492 -17.557 -14.967 1.00 10.00 H new ATOM 0 HB2 LYS A 72 -2.234 -15.848 -17.429 1.00 10.00 H new ATOM 0 HB3 LYS A 72 -3.311 -17.195 -17.123 1.00 10.00 H new ATOM 0 HG2 LYS A 72 -4.658 -15.764 -15.583 1.00 10.00 H new ATOM 0 HG3 LYS A 72 -3.584 -14.416 -15.898 1.00 10.00 H new ATOM 0 HD2 LYS A 72 -4.222 -14.769 -18.424 1.00 10.00 H new ATOM 0 HD3 LYS A 72 -5.551 -15.729 -17.806 1.00 10.00 H new ATOM 0 HE2 LYS A 72 -5.537 -13.423 -16.157 1.00 10.00 H new ATOM 0 HE3 LYS A 72 -5.190 -12.800 -17.758 1.00 10.00 H new ATOM 0 HZ1 LYS A 72 -7.535 -12.835 -17.396 1.00 10.00 H new ATOM 0 HZ2 LYS A 72 -7.158 -13.993 -18.579 1.00 10.00 H new ATOM 0 HZ3 LYS A 72 -7.511 -14.485 -16.992 1.00 10.00 H new ATOM 1128 N LYS A 73 0.355 -16.324 -16.040 1.00 10.00 N ATOM 1129 CA LYS A 73 1.768 -16.656 -16.229 1.00 10.00 C ATOM 1130 C LYS A 73 2.383 -17.267 -14.969 1.00 10.00 C ATOM 1131 O LYS A 73 3.127 -18.235 -15.099 1.00 10.00 O ATOM 1132 CB LYS A 73 2.548 -15.410 -16.672 1.00 10.00 C ATOM 1133 CG LYS A 73 2.287 -15.084 -18.151 1.00 10.00 C ATOM 1134 CD LYS A 73 3.224 -14.003 -18.717 1.00 10.00 C ATOM 1135 CE LYS A 73 3.138 -12.642 -18.014 1.00 10.00 C ATOM 1136 NZ LYS A 73 1.819 -11.989 -18.188 1.00 10.00 N ATOM 0 H LYS A 73 0.185 -15.320 -15.988 1.00 10.00 H new ATOM 0 HA LYS A 73 1.833 -17.410 -17.013 1.00 10.00 H new ATOM 0 HB2 LYS A 73 2.260 -14.560 -16.054 1.00 10.00 H new ATOM 0 HB3 LYS A 73 3.615 -15.571 -16.516 1.00 10.00 H new ATOM 0 HG2 LYS A 73 2.398 -15.994 -18.740 1.00 10.00 H new ATOM 0 HG3 LYS A 73 1.254 -14.754 -18.265 1.00 10.00 H new ATOM 0 HD2 LYS A 73 4.251 -14.364 -18.655 1.00 10.00 H new ATOM 0 HD3 LYS A 73 2.998 -13.864 -19.774 1.00 10.00 H new ATOM 0 HE2 LYS A 73 3.335 -12.774 -16.950 1.00 10.00 H new ATOM 0 HE3 LYS A 73 3.917 -11.987 -18.404 1.00 10.00 H new ATOM 0 HZ1 LYS A 73 1.817 -11.074 -17.693 1.00 10.00 H new ATOM 0 HZ2 LYS A 73 1.639 -11.835 -19.201 1.00 10.00 H new ATOM 0 HZ3 LYS A 73 1.075 -12.598 -17.792 1.00 10.00 H new ATOM 1150 N TYR A 74 2.080 -16.742 -13.773 1.00 10.00 N ATOM 1151 CA TYR A 74 2.615 -17.304 -12.535 1.00 10.00 C ATOM 1152 C TYR A 74 2.119 -18.729 -12.253 1.00 10.00 C ATOM 1153 O TYR A 74 2.933 -19.609 -11.977 1.00 10.00 O ATOM 1154 CB TYR A 74 2.350 -16.381 -11.346 1.00 10.00 C ATOM 1155 CG TYR A 74 3.004 -16.892 -10.074 1.00 10.00 C ATOM 1156 CD1 TYR A 74 4.370 -17.244 -10.063 1.00 10.00 C ATOM 1157 CD2 TYR A 74 2.236 -17.060 -8.911 1.00 10.00 C ATOM 1158 CE1 TYR A 74 4.963 -17.768 -8.902 1.00 10.00 C ATOM 1159 CE2 TYR A 74 2.834 -17.528 -7.730 1.00 10.00 C ATOM 1160 CZ TYR A 74 4.190 -17.911 -7.732 1.00 10.00 C ATOM 1161 OH TYR A 74 4.745 -18.435 -6.611 1.00 10.00 O ATOM 0 H TYR A 74 1.471 -15.934 -13.642 1.00 10.00 H new ATOM 0 HA TYR A 74 3.693 -17.379 -12.678 1.00 10.00 H new ATOM 0 HB2 TYR A 74 2.725 -15.383 -11.571 1.00 10.00 H new ATOM 0 HB3 TYR A 74 1.275 -16.290 -11.190 1.00 10.00 H new ATOM 0 HD1 TYR A 74 4.965 -17.110 -10.954 1.00 10.00 H new ATOM 0 HD2 TYR A 74 1.181 -16.828 -8.925 1.00 10.00 H new ATOM 0 HE1 TYR A 74 6.003 -18.059 -8.906 1.00 10.00 H new ATOM 0 HE2 TYR A 74 2.255 -17.594 -6.821 1.00 10.00 H new ATOM 0 HH TYR A 74 5.702 -18.224 -6.590 1.00 10.00 H new ATOM 1171 N ILE A 75 0.802 -18.965 -12.343 1.00 10.00 N ATOM 1172 CA ILE A 75 0.205 -20.301 -12.232 1.00 10.00 C ATOM 1173 C ILE A 75 -0.737 -20.579 -13.420 1.00 10.00 C ATOM 1174 O ILE A 75 -1.861 -20.072 -13.454 1.00 10.00 O ATOM 1175 CB ILE A 75 -0.436 -20.572 -10.849 1.00 10.00 C ATOM 1176 CG1 ILE A 75 -1.297 -19.409 -10.307 1.00 10.00 C ATOM 1177 CG2 ILE A 75 0.670 -20.937 -9.838 1.00 10.00 C ATOM 1178 CD1 ILE A 75 -2.089 -19.772 -9.040 1.00 10.00 C ATOM 0 H ILE A 75 0.116 -18.226 -12.496 1.00 10.00 H new ATOM 0 HA ILE A 75 1.015 -21.028 -12.293 1.00 10.00 H new ATOM 0 HB ILE A 75 -1.127 -21.404 -10.985 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -0.650 -18.559 -10.091 1.00 10.00 H new ATOM 0 HG13 ILE A 75 -1.993 -19.091 -11.083 1.00 10.00 H new ATOM 0 HG21 ILE A 75 0.223 -21.129 -8.863 1.00 10.00 H new ATOM 0 HG22 ILE A 75 1.194 -21.830 -10.179 1.00 10.00 H new ATOM 0 HG23 ILE A 75 1.376 -20.111 -9.757 1.00 10.00 H new ATOM 0 HD11 ILE A 75 -2.671 -18.909 -8.715 1.00 10.00 H new ATOM 0 HD12 ILE A 75 -2.761 -20.602 -9.257 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -1.397 -20.062 -8.249 1.00 10.00 H new ATOM 1190 N PRO A 76 -0.296 -21.372 -14.421 1.00 10.00 N ATOM 1191 CA PRO A 76 -1.095 -21.654 -15.607 1.00 10.00 C ATOM 1192 C PRO A 76 -2.325 -22.493 -15.246 1.00 10.00 C ATOM 1193 O PRO A 76 -2.254 -23.451 -14.478 1.00 10.00 O ATOM 1194 CB PRO A 76 -0.153 -22.368 -16.579 1.00 10.00 C ATOM 1195 CG PRO A 76 0.853 -23.055 -15.661 1.00 10.00 C ATOM 1196 CD PRO A 76 0.973 -22.083 -14.490 1.00 10.00 C ATOM 0 HA PRO A 76 -1.493 -20.748 -16.064 1.00 10.00 H new ATOM 0 HB2 PRO A 76 -0.687 -23.088 -17.199 1.00 10.00 H new ATOM 0 HB3 PRO A 76 0.335 -21.665 -17.254 1.00 10.00 H new ATOM 0 HG2 PRO A 76 0.500 -24.034 -15.337 1.00 10.00 H new ATOM 0 HG3 PRO A 76 1.811 -23.209 -16.157 1.00 10.00 H new ATOM 0 HD2 PRO A 76 1.172 -22.616 -13.560 1.00 10.00 H new ATOM 0 HD3 PRO A 76 1.800 -21.390 -14.643 1.00 10.00 H new ATOM 1204 N GLY A 77 -3.465 -22.103 -15.823 1.00 10.00 N ATOM 1205 CA GLY A 77 -4.775 -22.712 -15.613 1.00 10.00 C ATOM 1206 C GLY A 77 -5.805 -21.743 -15.031 1.00 10.00 C ATOM 1207 O GLY A 77 -6.965 -21.834 -15.411 1.00 10.00 O ATOM 0 H GLY A 77 -3.498 -21.321 -16.477 1.00 10.00 H new ATOM 0 HA2 GLY A 77 -5.145 -23.098 -16.563 1.00 10.00 H new ATOM 0 HA3 GLY A 77 -4.669 -23.565 -14.942 1.00 10.00 H new ATOM 1211 N THR A 78 -5.384 -20.781 -14.196 1.00 10.00 N ATOM 1212 CA THR A 78 -6.185 -19.924 -13.292 1.00 10.00 C ATOM 1213 C THR A 78 -7.406 -19.183 -13.863 1.00 10.00 C ATOM 1214 O THR A 78 -8.312 -18.848 -13.101 1.00 10.00 O ATOM 1215 CB THR A 78 -5.205 -18.939 -12.617 1.00 10.00 C ATOM 1216 OG1 THR A 78 -4.545 -19.619 -11.582 1.00 10.00 O ATOM 1217 CG2 THR A 78 -5.796 -17.664 -12.023 1.00 10.00 C ATOM 0 H THR A 78 -4.391 -20.559 -14.126 1.00 10.00 H new ATOM 0 HA THR A 78 -6.670 -20.612 -12.599 1.00 10.00 H new ATOM 0 HB THR A 78 -4.558 -18.603 -13.427 1.00 10.00 H new ATOM 0 HG1 THR A 78 -5.160 -20.259 -11.167 1.00 10.00 H new ATOM 0 HG21 THR A 78 -4.999 -17.065 -11.582 1.00 10.00 H new ATOM 0 HG22 THR A 78 -6.289 -17.091 -12.809 1.00 10.00 H new ATOM 0 HG23 THR A 78 -6.523 -17.924 -11.253 1.00 10.00 H new ATOM 1225 N LYS A 79 -7.464 -18.897 -15.170 1.00 10.00 N ATOM 1226 CA LYS A 79 -8.365 -17.891 -15.763 1.00 10.00 C ATOM 1227 C LYS A 79 -8.131 -16.496 -15.160 1.00 10.00 C ATOM 1228 O LYS A 79 -7.404 -15.737 -15.786 1.00 10.00 O ATOM 1229 CB LYS A 79 -9.859 -18.318 -15.738 1.00 10.00 C ATOM 1230 CG LYS A 79 -10.427 -18.902 -17.052 1.00 10.00 C ATOM 1231 CD LYS A 79 -10.637 -20.423 -17.021 1.00 10.00 C ATOM 1232 CE LYS A 79 -9.284 -21.121 -16.938 1.00 10.00 C ATOM 1233 NZ LYS A 79 -9.372 -22.533 -16.507 1.00 10.00 N ATOM 0 H LYS A 79 -6.877 -19.365 -15.860 1.00 10.00 H new ATOM 0 HA LYS A 79 -8.106 -17.826 -16.820 1.00 10.00 H new ATOM 0 HB2 LYS A 79 -9.990 -19.059 -14.950 1.00 10.00 H new ATOM 0 HB3 LYS A 79 -10.458 -17.450 -15.462 1.00 10.00 H new ATOM 0 HG2 LYS A 79 -11.379 -18.419 -17.271 1.00 10.00 H new ATOM 0 HG3 LYS A 79 -9.749 -18.656 -17.870 1.00 10.00 H new ATOM 0 HD2 LYS A 79 -11.253 -20.698 -16.165 1.00 10.00 H new ATOM 0 HD3 LYS A 79 -11.170 -20.746 -17.915 1.00 10.00 H new ATOM 0 HE2 LYS A 79 -8.801 -21.077 -17.914 1.00 10.00 H new ATOM 0 HE3 LYS A 79 -8.646 -20.576 -16.242 1.00 10.00 H new ATOM 0 HZ1 LYS A 79 -8.544 -22.770 -15.924 1.00 10.00 H new ATOM 0 HZ2 LYS A 79 -10.239 -22.673 -15.950 1.00 10.00 H new ATOM 0 HZ3 LYS A 79 -9.394 -23.151 -17.343 1.00 10.00 H new ATOM 1247 N MET A 80 -8.708 -16.164 -13.992 1.00 10.00 N ATOM 1248 CA MET A 80 -8.797 -14.830 -13.357 1.00 10.00 C ATOM 1249 C MET A 80 -8.864 -13.660 -14.365 1.00 10.00 C ATOM 1250 O MET A 80 -7.843 -13.156 -14.839 1.00 10.00 O ATOM 1251 CB MET A 80 -7.690 -14.642 -12.301 1.00 10.00 C ATOM 1252 CG MET A 80 -7.730 -13.256 -11.638 1.00 10.00 C ATOM 1253 SD MET A 80 -6.918 -13.149 -10.018 1.00 10.00 S ATOM 1254 CE MET A 80 -6.434 -11.405 -10.027 1.00 10.00 C ATOM 0 H MET A 80 -9.161 -16.876 -13.419 1.00 10.00 H new ATOM 0 HA MET A 80 -9.756 -14.801 -12.840 1.00 10.00 H new ATOM 0 HB2 MET A 80 -7.791 -15.410 -11.534 1.00 10.00 H new ATOM 0 HB3 MET A 80 -6.717 -14.787 -12.771 1.00 10.00 H new ATOM 0 HG2 MET A 80 -7.262 -12.536 -12.309 1.00 10.00 H new ATOM 0 HG3 MET A 80 -8.772 -12.955 -11.525 1.00 10.00 H new ATOM 0 HE1 MET A 80 -6.097 -11.116 -9.032 1.00 10.00 H new ATOM 0 HE2 MET A 80 -5.625 -11.256 -10.742 1.00 10.00 H new ATOM 0 HE3 MET A 80 -7.288 -10.792 -10.313 1.00 10.00 H new ATOM 1264 N ILE A 81 -10.085 -13.206 -14.679 1.00 10.00 N ATOM 1265 CA ILE A 81 -10.413 -12.166 -15.678 1.00 10.00 C ATOM 1266 C ILE A 81 -10.000 -10.740 -15.219 1.00 10.00 C ATOM 1267 O ILE A 81 -10.749 -9.775 -15.345 1.00 10.00 O ATOM 1268 CB ILE A 81 -11.906 -12.243 -16.118 1.00 10.00 C ATOM 1269 CG1 ILE A 81 -12.480 -13.685 -16.144 1.00 10.00 C ATOM 1270 CG2 ILE A 81 -12.044 -11.614 -17.522 1.00 10.00 C ATOM 1271 CD1 ILE A 81 -13.966 -13.771 -16.516 1.00 10.00 C ATOM 0 H ILE A 81 -10.920 -13.571 -14.221 1.00 10.00 H new ATOM 0 HA ILE A 81 -9.810 -12.378 -16.561 1.00 10.00 H new ATOM 0 HB ILE A 81 -12.484 -11.696 -15.373 1.00 10.00 H new ATOM 0 HG12 ILE A 81 -11.905 -14.279 -16.855 1.00 10.00 H new ATOM 0 HG13 ILE A 81 -12.337 -14.137 -15.163 1.00 10.00 H new ATOM 0 HG21 ILE A 81 -13.085 -11.662 -17.841 1.00 10.00 H new ATOM 0 HG22 ILE A 81 -11.722 -10.573 -17.488 1.00 10.00 H new ATOM 0 HG23 ILE A 81 -11.422 -12.163 -18.229 1.00 10.00 H new ATOM 0 HD11 ILE A 81 -14.283 -14.814 -16.510 1.00 10.00 H new ATOM 0 HD12 ILE A 81 -14.555 -13.208 -15.792 1.00 10.00 H new ATOM 0 HD13 ILE A 81 -14.117 -13.352 -17.511 1.00 10.00 H new ATOM 1283 N PHE A 82 -8.781 -10.604 -14.686 1.00 10.00 N ATOM 1284 CA PHE A 82 -8.159 -9.374 -14.206 1.00 10.00 C ATOM 1285 C PHE A 82 -6.640 -9.604 -14.070 1.00 10.00 C ATOM 1286 O PHE A 82 -6.147 -10.011 -13.023 1.00 10.00 O ATOM 1287 CB PHE A 82 -8.797 -8.949 -12.873 1.00 10.00 C ATOM 1288 CG PHE A 82 -8.519 -7.517 -12.501 1.00 10.00 C ATOM 1289 CD1 PHE A 82 -9.231 -6.456 -13.092 1.00 10.00 C ATOM 1290 CD2 PHE A 82 -7.525 -7.257 -11.559 1.00 10.00 C ATOM 1291 CE1 PHE A 82 -8.929 -5.128 -12.737 1.00 10.00 C ATOM 1292 CE2 PHE A 82 -7.207 -5.932 -11.212 1.00 10.00 C ATOM 1293 CZ PHE A 82 -7.914 -4.866 -11.798 1.00 10.00 C ATOM 0 H PHE A 82 -8.164 -11.408 -14.573 1.00 10.00 H new ATOM 0 HA PHE A 82 -8.322 -8.563 -14.916 1.00 10.00 H new ATOM 0 HB2 PHE A 82 -9.875 -9.097 -12.932 1.00 10.00 H new ATOM 0 HB3 PHE A 82 -8.429 -9.600 -12.080 1.00 10.00 H new ATOM 0 HD1 PHE A 82 -10.006 -6.660 -13.815 1.00 10.00 H new ATOM 0 HD2 PHE A 82 -6.997 -8.076 -11.094 1.00 10.00 H new ATOM 0 HE1 PHE A 82 -9.475 -4.311 -13.185 1.00 10.00 H new ATOM 0 HE2 PHE A 82 -6.422 -5.733 -10.497 1.00 10.00 H new ATOM 0 HZ PHE A 82 -7.678 -3.847 -11.527 1.00 10.00 H new ATOM 1303 N ALA A 83 -5.895 -9.411 -15.168 1.00 10.00 N ATOM 1304 CA ALA A 83 -4.473 -9.772 -15.263 1.00 10.00 C ATOM 1305 C ALA A 83 -3.516 -8.896 -14.424 1.00 10.00 C ATOM 1306 O ALA A 83 -2.364 -9.277 -14.235 1.00 10.00 O ATOM 1307 CB ALA A 83 -4.067 -9.748 -16.741 1.00 10.00 C ATOM 0 H ALA A 83 -6.266 -8.996 -16.023 1.00 10.00 H new ATOM 0 HA ALA A 83 -4.373 -10.769 -14.834 1.00 10.00 H new ATOM 0 HB1 ALA A 83 -3.014 -10.013 -16.833 1.00 10.00 H new ATOM 0 HB2 ALA A 83 -4.672 -10.465 -17.296 1.00 10.00 H new ATOM 0 HB3 ALA A 83 -4.226 -8.749 -17.146 1.00 10.00 H new ATOM 1313 N GLY A 84 -3.976 -7.745 -13.919 1.00 10.00 N ATOM 1314 CA GLY A 84 -3.214 -6.859 -13.045 1.00 10.00 C ATOM 1315 C GLY A 84 -3.989 -5.581 -12.714 1.00 10.00 C ATOM 1316 O GLY A 84 -4.983 -5.263 -13.367 1.00 10.00 O ATOM 0 H GLY A 84 -4.915 -7.399 -14.115 1.00 10.00 H new ATOM 0 HA2 GLY A 84 -2.967 -7.384 -12.122 1.00 10.00 H new ATOM 0 HA3 GLY A 84 -2.271 -6.598 -13.525 1.00 10.00 H new ATOM 1320 N ILE A 85 -3.528 -4.851 -11.693 1.00 10.00 N ATOM 1321 CA ILE A 85 -4.147 -3.613 -11.191 1.00 10.00 C ATOM 1322 C ILE A 85 -3.505 -2.354 -11.811 1.00 10.00 C ATOM 1323 O ILE A 85 -2.489 -2.433 -12.498 1.00 10.00 O ATOM 1324 CB ILE A 85 -4.149 -3.655 -9.641 1.00 10.00 C ATOM 1325 CG1 ILE A 85 -5.076 -2.606 -8.985 1.00 10.00 C ATOM 1326 CG2 ILE A 85 -2.729 -3.533 -9.069 1.00 10.00 C ATOM 1327 CD1 ILE A 85 -5.640 -3.073 -7.641 1.00 10.00 C ATOM 0 H ILE A 85 -2.688 -5.111 -11.175 1.00 10.00 H new ATOM 0 HA ILE A 85 -5.187 -3.548 -11.511 1.00 10.00 H new ATOM 0 HB ILE A 85 -4.556 -4.634 -9.388 1.00 10.00 H new ATOM 0 HG12 ILE A 85 -4.522 -1.679 -8.839 1.00 10.00 H new ATOM 0 HG13 ILE A 85 -5.900 -2.382 -9.662 1.00 10.00 H new ATOM 0 HG21 ILE A 85 -2.771 -3.566 -7.980 1.00 10.00 H new ATOM 0 HG22 ILE A 85 -2.118 -4.358 -9.434 1.00 10.00 H new ATOM 0 HG23 ILE A 85 -2.289 -2.588 -9.386 1.00 10.00 H new ATOM 0 HD11 ILE A 85 -6.283 -2.297 -7.227 1.00 10.00 H new ATOM 0 HD12 ILE A 85 -6.219 -3.985 -7.787 1.00 10.00 H new ATOM 0 HD13 ILE A 85 -4.820 -3.271 -6.951 1.00 10.00 H new ATOM 1339 N LYS A 86 -4.122 -1.184 -11.577 1.00 10.00 N ATOM 1340 CA LYS A 86 -3.879 0.112 -12.242 1.00 10.00 C ATOM 1341 C LYS A 86 -2.396 0.485 -12.394 1.00 10.00 C ATOM 1342 O LYS A 86 -1.991 0.928 -13.465 1.00 10.00 O ATOM 1343 CB LYS A 86 -4.627 1.213 -11.467 1.00 10.00 C ATOM 1344 CG LYS A 86 -6.162 1.104 -11.521 1.00 10.00 C ATOM 1345 CD LYS A 86 -6.767 1.685 -12.811 1.00 10.00 C ATOM 1346 CE LYS A 86 -6.756 3.222 -12.845 1.00 10.00 C ATOM 1347 NZ LYS A 86 -7.684 3.804 -11.844 1.00 10.00 N ATOM 0 H LYS A 86 -4.854 -1.111 -10.871 1.00 10.00 H new ATOM 0 HA LYS A 86 -4.254 0.017 -13.261 1.00 10.00 H new ATOM 0 HB2 LYS A 86 -4.310 1.185 -10.424 1.00 10.00 H new ATOM 0 HB3 LYS A 86 -4.331 2.184 -11.864 1.00 10.00 H new ATOM 0 HG2 LYS A 86 -6.448 0.056 -11.433 1.00 10.00 H new ATOM 0 HG3 LYS A 86 -6.587 1.624 -10.662 1.00 10.00 H new ATOM 0 HD2 LYS A 86 -6.212 1.305 -13.669 1.00 10.00 H new ATOM 0 HD3 LYS A 86 -7.793 1.333 -12.914 1.00 10.00 H new ATOM 0 HE2 LYS A 86 -5.745 3.582 -12.655 1.00 10.00 H new ATOM 0 HE3 LYS A 86 -7.035 3.565 -13.841 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 -7.777 4.827 -12.010 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 -8.617 3.353 -11.932 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 -7.310 3.641 -10.888 1.00 10.00 H new ATOM 1361 N LYS A 87 -1.610 0.308 -11.328 1.00 10.00 N ATOM 1362 CA LYS A 87 -0.141 0.368 -11.267 1.00 10.00 C ATOM 1363 C LYS A 87 0.323 -0.272 -9.949 1.00 10.00 C ATOM 1364 O LYS A 87 -0.505 -0.697 -9.141 1.00 10.00 O ATOM 1365 CB LYS A 87 0.370 1.818 -11.430 1.00 10.00 C ATOM 1366 CG LYS A 87 -0.134 2.739 -10.316 1.00 10.00 C ATOM 1367 CD LYS A 87 0.435 4.159 -10.391 1.00 10.00 C ATOM 1368 CE LYS A 87 -0.317 5.107 -9.446 1.00 10.00 C ATOM 1369 NZ LYS A 87 -0.366 4.601 -8.056 1.00 10.00 N ATOM 0 H LYS A 87 -2.012 0.103 -10.413 1.00 10.00 H new ATOM 0 HA LYS A 87 0.287 -0.194 -12.098 1.00 10.00 H new ATOM 0 HB2 LYS A 87 1.460 1.819 -11.434 1.00 10.00 H new ATOM 0 HB3 LYS A 87 0.048 2.208 -12.395 1.00 10.00 H new ATOM 0 HG2 LYS A 87 -1.222 2.789 -10.362 1.00 10.00 H new ATOM 0 HG3 LYS A 87 0.124 2.303 -9.351 1.00 10.00 H new ATOM 0 HD2 LYS A 87 1.493 4.144 -10.130 1.00 10.00 H new ATOM 0 HD3 LYS A 87 0.364 4.529 -11.414 1.00 10.00 H new ATOM 0 HE2 LYS A 87 0.166 6.084 -9.457 1.00 10.00 H new ATOM 0 HE3 LYS A 87 -1.333 5.250 -9.813 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 -0.617 5.378 -7.412 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 -1.081 3.849 -7.985 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 0.565 4.220 -7.792 1.00 10.00 H new ATOM 1383 N LYS A 88 1.635 -0.359 -9.714 1.00 10.00 N ATOM 1384 CA LYS A 88 2.189 -1.115 -8.582 1.00 10.00 C ATOM 1385 C LYS A 88 1.822 -0.580 -7.194 1.00 10.00 C ATOM 1386 O LYS A 88 1.667 -1.396 -6.295 1.00 10.00 O ATOM 1387 CB LYS A 88 3.697 -1.267 -8.796 1.00 10.00 C ATOM 1388 CG LYS A 88 4.411 -2.286 -7.904 1.00 10.00 C ATOM 1389 CD LYS A 88 5.853 -2.548 -8.372 1.00 10.00 C ATOM 1390 CE LYS A 88 5.919 -3.312 -9.708 1.00 10.00 C ATOM 1391 NZ LYS A 88 6.007 -2.434 -10.904 1.00 10.00 N ATOM 0 H LYS A 88 2.341 0.089 -10.298 1.00 10.00 H new ATOM 0 HA LYS A 88 1.715 -2.097 -8.577 1.00 10.00 H new ATOM 0 HB2 LYS A 88 3.868 -1.544 -9.836 1.00 10.00 H new ATOM 0 HB3 LYS A 88 4.164 -0.294 -8.644 1.00 10.00 H new ATOM 0 HG2 LYS A 88 4.423 -1.923 -6.876 1.00 10.00 H new ATOM 0 HG3 LYS A 88 3.853 -3.223 -7.905 1.00 10.00 H new ATOM 0 HD2 LYS A 88 6.374 -1.597 -8.477 1.00 10.00 H new ATOM 0 HD3 LYS A 88 6.380 -3.118 -7.607 1.00 10.00 H new ATOM 0 HE2 LYS A 88 6.784 -3.975 -9.693 1.00 10.00 H new ATOM 0 HE3 LYS A 88 5.035 -3.943 -9.798 1.00 10.00 H new ATOM 0 HZ1 LYS A 88 5.269 -2.701 -11.586 1.00 10.00 H new ATOM 0 HZ2 LYS A 88 5.872 -1.443 -10.618 1.00 10.00 H new ATOM 0 HZ3 LYS A 88 6.942 -2.542 -11.346 1.00 10.00 H new ATOM 1405 N THR A 89 1.556 0.719 -7.005 1.00 10.00 N ATOM 1406 CA THR A 89 1.203 1.263 -5.676 1.00 10.00 C ATOM 1407 C THR A 89 -0.028 0.568 -5.078 1.00 10.00 C ATOM 1408 O THR A 89 0.008 0.101 -3.942 1.00 10.00 O ATOM 1409 CB THR A 89 0.985 2.785 -5.694 1.00 10.00 C ATOM 1410 OG1 THR A 89 1.791 3.428 -6.663 1.00 10.00 O ATOM 1411 CG2 THR A 89 1.321 3.397 -4.335 1.00 10.00 C ATOM 0 H THR A 89 1.577 1.416 -7.750 1.00 10.00 H new ATOM 0 HA THR A 89 2.064 1.056 -5.040 1.00 10.00 H new ATOM 0 HB THR A 89 -0.066 2.937 -5.938 1.00 10.00 H new ATOM 0 HG1 THR A 89 2.003 4.336 -6.362 1.00 10.00 H new ATOM 0 HG21 THR A 89 1.159 4.474 -4.371 1.00 10.00 H new ATOM 0 HG22 THR A 89 0.679 2.959 -3.570 1.00 10.00 H new ATOM 0 HG23 THR A 89 2.364 3.195 -4.093 1.00 10.00 H new ATOM 1419 N GLU A 90 -1.110 0.460 -5.847 1.00 10.00 N ATOM 1420 CA GLU A 90 -2.309 -0.291 -5.536 1.00 10.00 C ATOM 1421 C GLU A 90 -2.174 -1.820 -5.715 1.00 10.00 C ATOM 1422 O GLU A 90 -3.076 -2.566 -5.352 1.00 10.00 O ATOM 1423 CB GLU A 90 -3.510 0.348 -6.254 1.00 10.00 C ATOM 1424 CG GLU A 90 -3.394 0.654 -7.755 1.00 10.00 C ATOM 1425 CD GLU A 90 -2.818 2.043 -8.082 1.00 10.00 C ATOM 1426 OE1 GLU A 90 -1.651 2.300 -7.704 1.00 10.00 O ATOM 1427 OE2 GLU A 90 -3.506 2.847 -8.749 1.00 10.00 O ATOM 0 H GLU A 90 -1.169 0.923 -6.754 1.00 10.00 H new ATOM 0 HA GLU A 90 -2.490 -0.216 -4.464 1.00 10.00 H new ATOM 0 HB2 GLU A 90 -4.367 -0.312 -6.116 1.00 10.00 H new ATOM 0 HB3 GLU A 90 -3.742 1.282 -5.743 1.00 10.00 H new ATOM 0 HG2 GLU A 90 -2.764 -0.105 -8.220 1.00 10.00 H new ATOM 0 HG3 GLU A 90 -4.382 0.569 -8.207 1.00 10.00 H new ATOM 1434 N ARG A 91 -1.060 -2.339 -6.253 1.00 10.00 N ATOM 1435 CA ARG A 91 -0.641 -3.731 -6.004 1.00 10.00 C ATOM 1436 C ARG A 91 0.035 -3.906 -4.634 1.00 10.00 C ATOM 1437 O ARG A 91 -0.141 -4.938 -3.993 1.00 10.00 O ATOM 1438 CB ARG A 91 0.082 -4.313 -7.244 1.00 10.00 C ATOM 1439 CG ARG A 91 1.561 -4.694 -7.134 1.00 10.00 C ATOM 1440 CD ARG A 91 1.825 -5.976 -6.329 1.00 10.00 C ATOM 1441 NE ARG A 91 2.502 -5.669 -5.062 1.00 10.00 N ATOM 1442 CZ ARG A 91 3.784 -5.363 -4.904 1.00 10.00 C ATOM 1443 NH1 ARG A 91 4.652 -5.364 -5.891 1.00 10.00 N ATOM 1444 NH2 ARG A 91 4.237 -5.083 -3.704 1.00 10.00 N ATOM 0 H ARG A 91 -0.431 -1.817 -6.864 1.00 10.00 H new ATOM 0 HA ARG A 91 -1.517 -4.370 -5.894 1.00 10.00 H new ATOM 0 HB2 ARG A 91 -0.464 -5.204 -7.555 1.00 10.00 H new ATOM 0 HB3 ARG A 91 -0.011 -3.585 -8.050 1.00 10.00 H new ATOM 0 HG2 ARG A 91 1.968 -4.819 -8.138 1.00 10.00 H new ATOM 0 HG3 ARG A 91 2.103 -3.870 -6.671 1.00 10.00 H new ATOM 0 HD2 ARG A 91 0.882 -6.485 -6.128 1.00 10.00 H new ATOM 0 HD3 ARG A 91 2.437 -6.660 -6.917 1.00 10.00 H new ATOM 0 HE ARG A 91 1.929 -5.693 -4.218 1.00 10.00 H new ATOM 0 HH11 ARG A 91 4.351 -5.608 -6.835 1.00 10.00 H new ATOM 0 HH12 ARG A 91 5.626 -5.120 -5.713 1.00 10.00 H new ATOM 0 HH21 ARG A 91 3.605 -5.102 -2.903 1.00 10.00 H new ATOM 0 HH22 ARG A 91 5.220 -4.847 -3.572 1.00 10.00 H new ATOM 1458 N GLU A 92 0.818 -2.929 -4.156 1.00 10.00 N ATOM 1459 CA GLU A 92 1.421 -2.937 -2.819 1.00 10.00 C ATOM 1460 C GLU A 92 0.355 -2.767 -1.736 1.00 10.00 C ATOM 1461 O GLU A 92 0.430 -3.434 -0.707 1.00 10.00 O ATOM 1462 CB GLU A 92 2.429 -1.794 -2.658 1.00 10.00 C ATOM 1463 CG GLU A 92 3.586 -1.704 -3.658 1.00 10.00 C ATOM 1464 CD GLU A 92 3.979 -0.240 -3.935 1.00 10.00 C ATOM 1465 OE1 GLU A 92 3.778 0.608 -3.028 1.00 10.00 O ATOM 1466 OE2 GLU A 92 4.424 0.036 -5.071 1.00 10.00 O ATOM 0 H GLU A 92 1.053 -2.098 -4.698 1.00 10.00 H new ATOM 0 HA GLU A 92 1.923 -3.898 -2.710 1.00 10.00 H new ATOM 0 HB2 GLU A 92 1.877 -0.855 -2.701 1.00 10.00 H new ATOM 0 HB3 GLU A 92 2.858 -1.866 -1.658 1.00 10.00 H new ATOM 0 HG2 GLU A 92 4.448 -2.246 -3.269 1.00 10.00 H new ATOM 0 HG3 GLU A 92 3.300 -2.188 -4.592 1.00 10.00 H new ATOM 1473 N ASP A 93 -0.607 -1.859 -1.941 1.00 10.00 N ATOM 1474 CA ASP A 93 -1.671 -1.593 -0.969 1.00 10.00 C ATOM 1475 C ASP A 93 -2.531 -2.839 -0.692 1.00 10.00 C ATOM 1476 O ASP A 93 -2.810 -3.139 0.466 1.00 10.00 O ATOM 1477 CB ASP A 93 -2.416 -0.283 -1.323 1.00 10.00 C ATOM 1478 CG ASP A 93 -3.616 -0.341 -2.250 1.00 10.00 C ATOM 1479 OD1 ASP A 93 -3.823 -1.398 -2.870 1.00 10.00 O ATOM 1480 OD2 ASP A 93 -4.315 0.692 -2.322 1.00 10.00 O ATOM 0 H ASP A 93 -0.668 -1.289 -2.785 1.00 10.00 H new ATOM 0 HA ASP A 93 -1.239 -1.394 0.011 1.00 10.00 H new ATOM 0 HB2 ASP A 93 -2.745 0.170 -0.388 1.00 10.00 H new ATOM 0 HB3 ASP A 93 -1.690 0.397 -1.768 1.00 10.00 H new ATOM 1485 N LEU A 94 -2.811 -3.642 -1.723 1.00 10.00 N ATOM 1486 CA LEU A 94 -3.367 -4.990 -1.650 1.00 10.00 C ATOM 1487 C LEU A 94 -2.525 -5.947 -0.807 1.00 10.00 C ATOM 1488 O LEU A 94 -3.095 -6.626 0.044 1.00 10.00 O ATOM 1489 CB LEU A 94 -3.543 -5.535 -3.080 1.00 10.00 C ATOM 1490 CG LEU A 94 -4.983 -5.496 -3.611 1.00 10.00 C ATOM 1491 CD1 LEU A 94 -5.685 -4.152 -3.451 1.00 10.00 C ATOM 1492 CD2 LEU A 94 -4.947 -5.818 -5.103 1.00 10.00 C ATOM 0 H LEU A 94 -2.645 -3.348 -2.686 1.00 10.00 H new ATOM 0 HA LEU A 94 -4.331 -4.923 -1.147 1.00 10.00 H new ATOM 0 HB2 LEU A 94 -2.907 -4.961 -3.753 1.00 10.00 H new ATOM 0 HB3 LEU A 94 -3.188 -6.565 -3.107 1.00 10.00 H new ATOM 0 HG LEU A 94 -5.545 -6.220 -3.021 1.00 10.00 H new ATOM 0 HD11 LEU A 94 -6.696 -4.219 -3.854 1.00 10.00 H new ATOM 0 HD12 LEU A 94 -5.732 -3.890 -2.394 1.00 10.00 H new ATOM 0 HD13 LEU A 94 -5.130 -3.385 -3.991 1.00 10.00 H new ATOM 0 HD21 LEU A 94 -5.960 -5.797 -5.504 1.00 10.00 H new ATOM 0 HD22 LEU A 94 -4.336 -5.078 -5.620 1.00 10.00 H new ATOM 0 HD23 LEU A 94 -4.519 -6.810 -5.251 1.00 10.00 H new ATOM 1504 N ILE A 95 -1.202 -6.005 -1.006 1.00 10.00 N ATOM 1505 CA ILE A 95 -0.312 -6.798 -0.144 1.00 10.00 C ATOM 1506 C ILE A 95 -0.436 -6.310 1.305 1.00 10.00 C ATOM 1507 O ILE A 95 -0.661 -7.121 2.201 1.00 10.00 O ATOM 1508 CB ILE A 95 1.151 -6.780 -0.647 1.00 10.00 C ATOM 1509 CG1 ILE A 95 1.315 -7.409 -2.050 1.00 10.00 C ATOM 1510 CG2 ILE A 95 2.102 -7.468 0.350 1.00 10.00 C ATOM 1511 CD1 ILE A 95 0.994 -8.905 -2.166 1.00 10.00 C ATOM 0 H ILE A 95 -0.722 -5.511 -1.758 1.00 10.00 H new ATOM 0 HA ILE A 95 -0.624 -7.842 -0.184 1.00 10.00 H new ATOM 0 HB ILE A 95 1.421 -5.727 -0.726 1.00 10.00 H new ATOM 0 HG12 ILE A 95 0.674 -6.867 -2.745 1.00 10.00 H new ATOM 0 HG13 ILE A 95 2.343 -7.253 -2.377 1.00 10.00 H new ATOM 0 HG21 ILE A 95 3.120 -7.436 -0.037 1.00 10.00 H new ATOM 0 HG22 ILE A 95 2.062 -6.950 1.308 1.00 10.00 H new ATOM 0 HG23 ILE A 95 1.798 -8.506 0.486 1.00 10.00 H new ATOM 0 HD11 ILE A 95 1.146 -9.231 -3.195 1.00 10.00 H new ATOM 0 HD12 ILE A 95 1.651 -9.470 -1.506 1.00 10.00 H new ATOM 0 HD13 ILE A 95 -0.043 -9.078 -1.880 1.00 10.00 H new ATOM 1523 N ALA A 96 -0.334 -4.995 1.533 1.00 10.00 N ATOM 1524 CA ALA A 96 -0.427 -4.383 2.856 1.00 10.00 C ATOM 1525 C ALA A 96 -1.764 -4.690 3.561 1.00 10.00 C ATOM 1526 O ALA A 96 -1.760 -5.094 4.723 1.00 10.00 O ATOM 1527 CB ALA A 96 -0.158 -2.873 2.725 1.00 10.00 C ATOM 0 H ALA A 96 -0.182 -4.317 0.786 1.00 10.00 H new ATOM 0 HA ALA A 96 0.333 -4.822 3.502 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -0.225 -2.405 3.707 1.00 10.00 H new ATOM 0 HB2 ALA A 96 0.840 -2.715 2.315 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -0.898 -2.428 2.060 1.00 10.00 H new ATOM 1533 N TYR A 97 -2.895 -4.551 2.858 1.00 10.00 N ATOM 1534 CA TYR A 97 -4.225 -4.967 3.311 1.00 10.00 C ATOM 1535 C TYR A 97 -4.287 -6.476 3.577 1.00 10.00 C ATOM 1536 O TYR A 97 -4.532 -6.887 4.710 1.00 10.00 O ATOM 1537 CB TYR A 97 -5.278 -4.480 2.299 1.00 10.00 C ATOM 1538 CG TYR A 97 -6.592 -5.242 2.250 1.00 10.00 C ATOM 1539 CD1 TYR A 97 -7.361 -5.479 3.410 1.00 10.00 C ATOM 1540 CD2 TYR A 97 -7.030 -5.746 1.011 1.00 10.00 C ATOM 1541 CE1 TYR A 97 -8.560 -6.219 3.323 1.00 10.00 C ATOM 1542 CE2 TYR A 97 -8.212 -6.498 0.936 1.00 10.00 C ATOM 1543 CZ TYR A 97 -8.991 -6.728 2.084 1.00 10.00 C ATOM 1544 OH TYR A 97 -10.139 -7.451 1.990 1.00 10.00 O ATOM 0 H TYR A 97 -2.908 -4.132 1.928 1.00 10.00 H new ATOM 0 HA TYR A 97 -4.447 -4.502 4.272 1.00 10.00 H new ATOM 0 HB2 TYR A 97 -5.500 -3.435 2.517 1.00 10.00 H new ATOM 0 HB3 TYR A 97 -4.832 -4.510 1.305 1.00 10.00 H new ATOM 0 HD1 TYR A 97 -7.032 -5.094 4.364 1.00 10.00 H new ATOM 0 HD2 TYR A 97 -6.455 -5.554 0.117 1.00 10.00 H new ATOM 0 HE1 TYR A 97 -9.149 -6.395 4.211 1.00 10.00 H new ATOM 0 HE2 TYR A 97 -8.527 -6.905 -0.014 1.00 10.00 H new ATOM 0 HH TYR A 97 -10.281 -7.720 1.058 1.00 10.00 H new ATOM 1554 N LEU A 98 -4.063 -7.319 2.565 1.00 10.00 N ATOM 1555 CA LEU A 98 -4.273 -8.760 2.691 1.00 10.00 C ATOM 1556 C LEU A 98 -3.317 -9.417 3.695 1.00 10.00 C ATOM 1557 O LEU A 98 -3.722 -10.368 4.362 1.00 10.00 O ATOM 1558 CB LEU A 98 -4.242 -9.425 1.304 1.00 10.00 C ATOM 1559 CG LEU A 98 -5.406 -8.975 0.395 1.00 10.00 C ATOM 1560 CD1 LEU A 98 -5.205 -9.503 -1.023 1.00 10.00 C ATOM 1561 CD2 LEU A 98 -6.759 -9.475 0.916 1.00 10.00 C ATOM 0 H LEU A 98 -3.735 -7.024 1.646 1.00 10.00 H new ATOM 0 HA LEU A 98 -5.266 -8.918 3.112 1.00 10.00 H new ATOM 0 HB2 LEU A 98 -3.296 -9.192 0.816 1.00 10.00 H new ATOM 0 HB3 LEU A 98 -4.280 -10.508 1.425 1.00 10.00 H new ATOM 0 HG LEU A 98 -5.410 -7.885 0.396 1.00 10.00 H new ATOM 0 HD11 LEU A 98 -6.033 -9.178 -1.653 1.00 10.00 H new ATOM 0 HD12 LEU A 98 -4.269 -9.116 -1.426 1.00 10.00 H new ATOM 0 HD13 LEU A 98 -5.169 -10.592 -1.004 1.00 10.00 H new ATOM 0 HD21 LEU A 98 -7.553 -9.138 0.249 1.00 10.00 H new ATOM 0 HD22 LEU A 98 -6.755 -10.564 0.953 1.00 10.00 H new ATOM 0 HD23 LEU A 98 -6.933 -9.079 1.916 1.00 10.00 H new ATOM 1573 N LYS A 99 -2.110 -8.865 3.903 1.00 10.00 N ATOM 1574 CA LYS A 99 -1.192 -9.311 4.957 1.00 10.00 C ATOM 1575 C LYS A 99 -1.703 -9.051 6.387 1.00 10.00 C ATOM 1576 O LYS A 99 -1.234 -9.718 7.311 1.00 10.00 O ATOM 1577 CB LYS A 99 0.220 -8.749 4.696 1.00 10.00 C ATOM 1578 CG LYS A 99 1.245 -9.343 5.675 1.00 10.00 C ATOM 1579 CD LYS A 99 2.677 -9.378 5.132 1.00 10.00 C ATOM 1580 CE LYS A 99 3.569 -10.005 6.212 1.00 10.00 C ATOM 1581 NZ LYS A 99 4.798 -10.591 5.639 1.00 10.00 N ATOM 0 H LYS A 99 -1.745 -8.095 3.342 1.00 10.00 H new ATOM 0 HA LYS A 99 -1.138 -10.398 4.904 1.00 10.00 H new ATOM 0 HB2 LYS A 99 0.520 -8.972 3.672 1.00 10.00 H new ATOM 0 HB3 LYS A 99 0.206 -7.664 4.794 1.00 10.00 H new ATOM 0 HG2 LYS A 99 1.231 -8.762 6.597 1.00 10.00 H new ATOM 0 HG3 LYS A 99 0.940 -10.357 5.933 1.00 10.00 H new ATOM 0 HD2 LYS A 99 2.723 -9.961 4.212 1.00 10.00 H new ATOM 0 HD3 LYS A 99 3.019 -8.372 4.890 1.00 10.00 H new ATOM 0 HE2 LYS A 99 3.837 -9.246 6.947 1.00 10.00 H new ATOM 0 HE3 LYS A 99 3.011 -10.778 6.741 1.00 10.00 H new ATOM 0 HZ1 LYS A 99 5.365 -11.019 6.398 1.00 10.00 H new ATOM 0 HZ2 LYS A 99 4.543 -11.321 4.944 1.00 10.00 H new ATOM 0 HZ3 LYS A 99 5.352 -9.846 5.171 1.00 10.00 H new ATOM 1595 N LYS A 100 -2.712 -8.187 6.580 1.00 10.00 N ATOM 1596 CA LYS A 100 -3.444 -8.061 7.856 1.00 10.00 C ATOM 1597 C LYS A 100 -4.868 -8.636 7.821 1.00 10.00 C ATOM 1598 O LYS A 100 -5.357 -9.081 8.853 1.00 10.00 O ATOM 1599 CB LYS A 100 -3.327 -6.641 8.445 1.00 10.00 C ATOM 1600 CG LYS A 100 -3.968 -5.461 7.692 1.00 10.00 C ATOM 1601 CD LYS A 100 -5.495 -5.557 7.608 1.00 10.00 C ATOM 1602 CE LYS A 100 -6.206 -4.221 7.394 1.00 10.00 C ATOM 1603 NZ LYS A 100 -6.409 -3.508 8.674 1.00 10.00 N ATOM 0 H LYS A 100 -3.046 -7.553 5.855 1.00 10.00 H new ATOM 0 HA LYS A 100 -2.942 -8.713 8.570 1.00 10.00 H new ATOM 0 HB2 LYS A 100 -3.758 -6.664 9.446 1.00 10.00 H new ATOM 0 HB3 LYS A 100 -2.266 -6.420 8.560 1.00 10.00 H new ATOM 0 HG2 LYS A 100 -3.696 -4.530 8.189 1.00 10.00 H new ATOM 0 HG3 LYS A 100 -3.557 -5.416 6.683 1.00 10.00 H new ATOM 0 HD2 LYS A 100 -5.759 -6.229 6.792 1.00 10.00 H new ATOM 0 HD3 LYS A 100 -5.869 -6.009 8.527 1.00 10.00 H new ATOM 0 HE2 LYS A 100 -5.619 -3.599 6.718 1.00 10.00 H new ATOM 0 HE3 LYS A 100 -7.170 -4.392 6.914 1.00 10.00 H new ATOM 0 HZ1 LYS A 100 -6.848 -2.583 8.490 1.00 10.00 H new ATOM 0 HZ2 LYS A 100 -7.031 -4.070 9.290 1.00 10.00 H new ATOM 0 HZ3 LYS A 100 -5.491 -3.369 9.143 1.00 10.00 H new ATOM 1617 N ALA A 101 -5.509 -8.734 6.651 1.00 10.00 N ATOM 1618 CA ALA A 101 -6.887 -9.223 6.513 1.00 10.00 C ATOM 1619 C ALA A 101 -7.085 -10.680 6.970 1.00 10.00 C ATOM 1620 O ALA A 101 -8.206 -11.101 7.239 1.00 10.00 O ATOM 1621 CB ALA A 101 -7.319 -9.067 5.053 1.00 10.00 C ATOM 0 H ALA A 101 -5.081 -8.473 5.763 1.00 10.00 H new ATOM 0 HA ALA A 101 -7.508 -8.621 7.176 1.00 10.00 H new ATOM 0 HB1 ALA A 101 -8.341 -9.427 4.936 1.00 10.00 H new ATOM 0 HB2 ALA A 101 -7.269 -8.016 4.769 1.00 10.00 H new ATOM 0 HB3 ALA A 101 -6.655 -9.647 4.413 1.00 10.00 H new ATOM 1627 N THR A 102 -5.996 -11.447 7.072 1.00 10.00 N ATOM 1628 CA THR A 102 -5.979 -12.826 7.577 1.00 10.00 C ATOM 1629 C THR A 102 -5.831 -12.922 9.101 1.00 10.00 C ATOM 1630 O THR A 102 -5.853 -14.036 9.623 1.00 10.00 O ATOM 1631 CB THR A 102 -4.838 -13.622 6.922 1.00 10.00 C ATOM 1632 OG1 THR A 102 -3.575 -13.112 7.293 1.00 10.00 O ATOM 1633 CG2 THR A 102 -4.895 -13.596 5.394 1.00 10.00 C ATOM 0 H THR A 102 -5.071 -11.116 6.797 1.00 10.00 H new ATOM 0 HA THR A 102 -6.950 -13.247 7.315 1.00 10.00 H new ATOM 0 HB THR A 102 -4.970 -14.644 7.276 1.00 10.00 H new ATOM 0 HG1 THR A 102 -3.125 -13.751 7.885 1.00 10.00 H new ATOM 0 HG21 THR A 102 -4.065 -14.175 4.989 1.00 10.00 H new ATOM 0 HG22 THR A 102 -5.837 -14.029 5.058 1.00 10.00 H new ATOM 0 HG23 THR A 102 -4.824 -12.566 5.045 1.00 10.00 H new ATOM 1641 N ASN A 103 -5.637 -11.799 9.810 1.00 10.00 N ATOM 1642 CA ASN A 103 -5.184 -11.792 11.207 1.00 10.00 C ATOM 1643 C ASN A 103 -5.600 -10.568 12.055 1.00 10.00 C ATOM 1644 O ASN A 103 -5.386 -10.606 13.266 1.00 10.00 O ATOM 1645 CB ASN A 103 -3.654 -12.000 11.225 1.00 10.00 C ATOM 1646 CG ASN A 103 -2.862 -10.981 10.413 1.00 10.00 C ATOM 1647 OD1 ASN A 103 -2.437 -9.949 10.905 1.00 10.00 O ATOM 1648 ND2 ASN A 103 -2.601 -11.261 9.151 1.00 10.00 N ATOM 0 H ASN A 103 -5.791 -10.866 9.427 1.00 10.00 H new ATOM 0 HA ASN A 103 -5.704 -12.613 11.700 1.00 10.00 H new ATOM 0 HB2 ASN A 103 -3.309 -11.968 12.258 1.00 10.00 H new ATOM 0 HB3 ASN A 103 -3.432 -12.998 10.846 1.00 10.00 H new ATOM 0 HD21 ASN A 103 -2.045 -10.615 8.590 1.00 10.00 H new ATOM 0 HD22 ASN A 103 -2.955 -12.123 8.736 1.00 10.00 H new ATOM 1655 N GLU A 104 -6.204 -9.522 11.472 1.00 10.00 N ATOM 1656 CA GLU A 104 -6.890 -8.445 12.209 1.00 10.00 C ATOM 1657 C GLU A 104 -8.173 -8.896 12.931 1.00 10.00 C ATOM 1658 O GLU A 104 -8.456 -8.279 13.982 1.00 10.00 O ATOM 1659 CB GLU A 104 -7.142 -7.232 11.293 1.00 10.00 C ATOM 1660 CG GLU A 104 -8.244 -7.409 10.229 1.00 10.00 C ATOM 1661 CD GLU A 104 -8.349 -6.179 9.312 1.00 10.00 C ATOM 1662 OE1 GLU A 104 -8.248 -5.033 9.816 1.00 10.00 O ATOM 1663 OE2 GLU A 104 -8.421 -6.350 8.072 1.00 10.00 O ATOM 1664 OXT GLU A 104 -8.851 -9.821 12.427 1.00 10.00 O ATOM 0 H GLU A 104 -6.231 -9.397 10.460 1.00 10.00 H new ATOM 0 HA GLU A 104 -6.212 -8.144 13.007 1.00 10.00 H new ATOM 0 HB2 GLU A 104 -7.401 -6.377 11.918 1.00 10.00 H new ATOM 0 HB3 GLU A 104 -6.210 -6.985 10.785 1.00 10.00 H new ATOM 0 HG2 GLU A 104 -8.032 -8.294 9.629 1.00 10.00 H new ATOM 0 HG3 GLU A 104 -9.202 -7.579 10.721 1.00 10.00 H new TER 1671 GLU A 104 HETATM 1672 FE HEC A 105 -8.766 -13.067 -8.068 1.00 10.00 FE HETATM 1673 CHA HEC A 105 -7.968 -16.271 -7.173 1.00 10.00 C HETATM 1674 CHB HEC A 105 -6.761 -11.897 -5.582 1.00 10.00 C HETATM 1675 CHC HEC A 105 -9.613 -9.901 -8.892 1.00 10.00 C HETATM 1676 CHD HEC A 105 -11.132 -14.267 -10.185 1.00 10.00 C HETATM 1677 NA HEC A 105 -7.554 -13.905 -6.721 1.00 10.00 N HETATM 1678 C1A HEC A 105 -7.335 -15.246 -6.489 1.00 10.00 C HETATM 1679 C2A HEC A 105 -6.348 -15.433 -5.434 1.00 10.00 C HETATM 1680 C3A HEC A 105 -6.005 -14.206 -4.991 1.00 10.00 C HETATM 1681 C4A HEC A 105 -6.794 -13.261 -5.763 1.00 10.00 C HETATM 1682 CMA HEC A 105 -4.969 -13.896 -3.929 1.00 10.00 C HETATM 1683 CAA HEC A 105 -5.784 -16.747 -4.958 1.00 10.00 C HETATM 1684 CBA HEC A 105 -6.760 -17.560 -4.091 1.00 10.00 C HETATM 1685 CGA HEC A 105 -6.382 -19.032 -3.970 1.00 10.00 C HETATM 1686 O1A HEC A 105 -6.361 -19.700 -5.021 1.00 10.00 O HETATM 1687 O2A HEC A 105 -6.064 -19.469 -2.842 1.00 10.00 O HETATM 1688 NB HEC A 105 -8.329 -11.279 -7.351 1.00 10.00 N HETATM 1689 C1B HEC A 105 -7.497 -10.980 -6.300 1.00 10.00 C HETATM 1690 C2B HEC A 105 -7.447 -9.556 -6.048 1.00 10.00 C HETATM 1691 C3B HEC A 105 -8.185 -8.967 -7.028 1.00 10.00 C HETATM 1692 C4B HEC A 105 -8.735 -10.055 -7.832 1.00 10.00 C HETATM 1693 CMB HEC A 105 -6.655 -8.924 -4.918 1.00 10.00 C HETATM 1694 CAB HEC A 105 -8.383 -7.486 -7.298 1.00 10.00 C HETATM 1695 CBB HEC A 105 -7.149 -6.903 -7.984 1.00 10.00 C HETATM 1696 NC HEC A 105 -10.155 -12.263 -9.193 1.00 10.00 N HETATM 1697 C1C HEC A 105 -10.331 -10.927 -9.472 1.00 10.00 C HETATM 1698 C2C HEC A 105 -11.492 -10.714 -10.319 1.00 10.00 C HETATM 1699 C3C HEC A 105 -12.033 -11.942 -10.537 1.00 10.00 C HETATM 1700 C4C HEC A 105 -11.102 -12.902 -9.960 1.00 10.00 C HETATM 1701 CMC HEC A 105 -12.060 -9.353 -10.679 1.00 10.00 C HETATM 1702 CAC HEC A 105 -13.390 -12.277 -11.135 1.00 10.00 C HETATM 1703 CBC HEC A 105 -13.450 -12.103 -12.657 1.00 10.00 C HETATM 1704 ND HEC A 105 -9.354 -14.888 -8.631 1.00 10.00 N HETATM 1705 C1D HEC A 105 -10.288 -15.190 -9.597 1.00 10.00 C HETATM 1706 C2D HEC A 105 -10.308 -16.616 -9.880 1.00 10.00 C HETATM 1707 C3D HEC A 105 -9.541 -17.203 -8.929 1.00 10.00 C HETATM 1708 C4D HEC A 105 -8.896 -16.115 -8.195 1.00 10.00 C HETATM 1709 CMD HEC A 105 -11.077 -17.299 -10.995 1.00 10.00 C HETATM 1710 CAD HEC A 105 -9.323 -18.691 -8.721 1.00 10.00 C HETATM 1711 CBD HEC A 105 -7.844 -19.114 -8.734 1.00 10.00 C HETATM 1712 CGD HEC A 105 -7.503 -20.342 -9.560 1.00 10.00 C HETATM 1713 O1D HEC A 105 -8.358 -21.233 -9.712 1.00 10.00 O HETATM 1714 O2D HEC A 105 -6.317 -20.417 -9.944 1.00 10.00 O HETATM 0 HMD3 HEC A 105 -12.143 -17.105 -10.874 1.00 10.00 H new HETATM 0 HMD2 HEC A 105 -10.745 -16.910 -11.957 1.00 10.00 H new HETATM 0 HMD1 HEC A 105 -10.897 -18.373 -10.956 1.00 10.00 H new HETATM 0 HMC3 HEC A 105 -12.358 -8.831 -9.770 1.00 10.00 H new HETATM 0 HMC2 HEC A 105 -11.302 -8.769 -11.201 1.00 10.00 H new HETATM 0 HMC1 HEC A 105 -12.929 -9.481 -11.325 1.00 10.00 H new HETATM 0 HMB3 HEC A 105 -7.014 -9.308 -3.963 1.00 10.00 H new HETATM 0 HMB2 HEC A 105 -5.599 -9.168 -5.033 1.00 10.00 H new HETATM 0 HMB1 HEC A 105 -6.782 -7.842 -4.945 1.00 10.00 H new HETATM 0 HMA3 HEC A 105 -5.254 -14.375 -2.992 1.00 10.00 H new HETATM 0 HMA2 HEC A 105 -3.997 -14.273 -4.248 1.00 10.00 H new HETATM 0 HMA1 HEC A 105 -4.910 -12.818 -3.782 1.00 10.00 H new HETATM 0 HBD2 HEC A 105 -7.252 -18.277 -9.105 1.00 10.00 H new HETATM 0 HBD1 HEC A 105 -7.531 -19.295 -7.706 1.00 10.00 H new HETATM 0 HBC3 HEC A 105 -13.228 -11.067 -12.914 1.00 10.00 H new HETATM 0 HBC2 HEC A 105 -12.717 -12.758 -13.127 1.00 10.00 H new HETATM 0 HBC1 HEC A 105 -14.448 -12.360 -13.014 1.00 10.00 H new HETATM 0 HBB3 HEC A 105 -6.279 -7.034 -7.341 1.00 10.00 H new HETATM 0 HBB2 HEC A 105 -6.981 -7.418 -8.930 1.00 10.00 H new HETATM 0 HBB1 HEC A 105 -7.305 -5.841 -8.172 1.00 10.00 H new HETATM 0 HBA2 HEC A 105 -6.802 -17.120 -3.094 1.00 10.00 H new HETATM 0 HBA1 HEC A 105 -7.761 -17.483 -4.515 1.00 10.00 H new HETATM 0 HAD2 HEC A 105 -9.766 -18.983 -7.769 1.00 10.00 H new HETATM 0 HAD1 HEC A 105 -9.854 -19.238 -9.500 1.00 10.00 H new HETATM 0 HAA2 HEC A 105 -5.497 -17.344 -5.824 1.00 10.00 H new HETATM 0 HAA1 HEC A 105 -4.876 -16.557 -4.386 1.00 10.00 H new HETATM 0 HHD HEC A 105 -11.881 -14.644 -10.881 1.00 10.00 H new HETATM 0 HHC HEC A 105 -9.746 -8.898 -9.297 1.00 10.00 H new HETATM 0 HHB HEC A 105 -6.099 -11.511 -4.807 1.00 10.00 H new HETATM 0 HHA HEC A 105 -7.715 -17.291 -6.883 1.00 10.00 H new HETATM 0 H2D HEC A 105 -6.085 -21.355 -10.109 1.00 10.00 H new HETATM 0 H2A HEC A 105 -6.874 -19.647 -2.320 1.00 10.00 H new