USER MOD reduce.3.24.130724 H: found=0, std=0, add=881, rem=0, adj=34 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 67 TYR OH : rot -131:sc= 0.74 USER MOD Set 1.2: A 78 THR OG1 : rot -48:sc= 0.916 USER MOD Set 1.3: A 105 HEC O2D : rot 100:sc= -0.0092 USER MOD Set 2.1: A 49 THR OG1 : rot -167:sc= 1.24 USER MOD Set 2.2: A 52 ASN : amide:sc= -0.342 K(o=0.9,f=-2.3!) USER MOD Set 3.1: A 33 HIS : no HE2:sc= -0.552 K(o=-0.55,f=-2.1) USER MOD Set 3.2: A 105 HEC O2A : rot 153:sc= 0 USER MOD Set 4.1: A 26 HIS : no HE2:sc= -0.321 K(o=-0.37,f=-3) USER MOD Set 4.2: A 31 ASN : amide:sc= -0.0444 X(o=-0.37,f=-0.63) USER MOD Single : A 1 GLY N :NH3+ -161:sc= 1.32 (180deg=-0.226) USER MOD Single : A 5 LYS NZ :NH3+ -152:sc= 1.24 (180deg=0.881) USER MOD Single : A 7 LYS NZ :NH3+ 165:sc= 1.3 (180deg=1.1) USER MOD Single : A 8 LYS NZ :NH3+ -176:sc= 1.29 (180deg=1.24) USER MOD Single : A 12 GLN : amide:sc=-0.00275 K(o=-0.0027,f=-1.6!) USER MOD Single : A 13 LYS NZ :NH3+ 146:sc= 1.19 (180deg=0.198!) USER MOD Single : A 16 GLN : amide:sc= -0.0212 K(o=-0.021,f=-2.2!) USER MOD Single : A 19 THR OG1 : rot -51:sc= 0.158 USER MOD Single : A 22 LYS NZ :NH3+ -179:sc= 1.19 (180deg=1.17) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot 39:sc= 1.15 USER MOD Single : A 42 GLN : amide:sc= 1.14 K(o=1.1,f=-3.9!) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0.00154 USER MOD Single : A 48 TYR OH : rot 180:sc= -0.588 USER MOD Single : A 53 LYS NZ :NH3+ -158:sc= 0.344 (180deg=-0.756!) USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=-0.0051) USER MOD Single : A 55 LYS NZ :NH3+ 173:sc= 1.27 (180deg=1.14) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 1.32 (180deg=1.32) USER MOD Single : A 63 THR OG1 : rot -91:sc= 1.24 USER MOD Single : A 65 MET CE :methyl -179:sc= 0 (180deg=-0.000574) USER MOD Single : A 70 ASN : amide:sc= -0.0728 X(o=-0.073,f=-0.01) USER MOD Single : A 72 LYS NZ :NH3+ 156:sc= -0.0701 (180deg=-0.592) USER MOD Single : A 73 LYS NZ :NH3+ -173:sc= 1.23 (180deg=1.15) USER MOD Single : A 74 TYR OH : rot 30:sc= -1.01 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0.672 (180deg=0.672) USER MOD Single : A 80 MET CE :methyl 174:sc= -0.522 (180deg=-0.736) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 178:sc= 1.2 (180deg=1.18) USER MOD Single : A 88 LYS NZ :NH3+ 179:sc= 2.38 (180deg=2.24) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.00237 USER MOD Single : A 97 TYR OH : rot 132:sc= 0.437 USER MOD Single : A 99 LYS NZ :NH3+ -133:sc= 1.04 (180deg=-2.71!) USER MOD Single : A 100 LYS NZ :NH3+ -105:sc= 0.4 (180deg=-1.58!) USER MOD Single : A 102 THR OG1 : rot -42:sc= 1 USER MOD Single : A 103 ASN : amide:sc= 0.381 X(o=0.38,f=-0.021) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.576 1.193 -0.486 1.00 10.00 N ATOM 2 CA GLY A 1 1.948 1.731 0.826 1.00 10.00 C ATOM 3 C GLY A 1 1.212 1.043 1.961 1.00 10.00 C ATOM 4 O GLY A 1 1.860 0.442 2.809 1.00 10.00 O ATOM 0 H1 GLY A 1 2.305 1.444 -1.184 1.00 10.00 H new ATOM 0 H2 GLY A 1 1.496 0.158 -0.427 1.00 10.00 H new ATOM 0 H3 GLY A 1 0.663 1.595 -0.780 1.00 10.00 H new ATOM 0 HA2 GLY A 1 3.022 1.618 0.971 1.00 10.00 H new ATOM 0 HA3 GLY A 1 1.734 2.799 0.852 1.00 10.00 H new ATOM 10 N ASP A 2 -0.117 1.165 2.014 1.00 10.00 N ATOM 11 CA ASP A 2 -0.873 1.165 3.267 1.00 10.00 C ATOM 12 C ASP A 2 -2.192 0.379 3.168 1.00 10.00 C ATOM 13 O ASP A 2 -2.931 0.470 2.187 1.00 10.00 O ATOM 14 CB ASP A 2 -1.167 2.622 3.660 1.00 10.00 C ATOM 15 CG ASP A 2 0.075 3.519 3.654 1.00 10.00 C ATOM 16 OD1 ASP A 2 0.777 3.540 4.683 1.00 10.00 O ATOM 17 OD2 ASP A 2 0.312 4.169 2.603 1.00 10.00 O ATOM 0 H ASP A 2 -0.701 1.267 1.184 1.00 10.00 H new ATOM 0 HA ASP A 2 -0.267 0.667 4.024 1.00 10.00 H new ATOM 0 HB2 ASP A 2 -1.906 3.033 2.972 1.00 10.00 H new ATOM 0 HB3 ASP A 2 -1.613 2.639 4.654 1.00 10.00 H new ATOM 22 N VAL A 3 -2.514 -0.347 4.242 1.00 10.00 N ATOM 23 CA VAL A 3 -3.721 -1.171 4.421 1.00 10.00 C ATOM 24 C VAL A 3 -5.020 -0.391 4.213 1.00 10.00 C ATOM 25 O VAL A 3 -5.888 -0.841 3.460 1.00 10.00 O ATOM 26 CB VAL A 3 -3.695 -1.915 5.784 1.00 10.00 C ATOM 27 CG1 VAL A 3 -2.862 -1.196 6.859 1.00 10.00 C ATOM 28 CG2 VAL A 3 -5.089 -2.239 6.351 1.00 10.00 C ATOM 0 H VAL A 3 -1.906 -0.380 5.060 1.00 10.00 H new ATOM 0 HA VAL A 3 -3.705 -1.923 3.632 1.00 10.00 H new ATOM 0 HB VAL A 3 -3.207 -2.859 5.541 1.00 10.00 H new ATOM 0 HG11 VAL A 3 -2.888 -1.771 7.785 1.00 10.00 H new ATOM 0 HG12 VAL A 3 -1.831 -1.103 6.518 1.00 10.00 H new ATOM 0 HG13 VAL A 3 -3.276 -0.204 7.037 1.00 10.00 H new ATOM 0 HG21 VAL A 3 -4.983 -2.758 7.304 1.00 10.00 H new ATOM 0 HG22 VAL A 3 -5.644 -1.313 6.502 1.00 10.00 H new ATOM 0 HG23 VAL A 3 -5.628 -2.875 5.649 1.00 10.00 H new ATOM 38 N GLU A 4 -5.188 0.770 4.853 1.00 10.00 N ATOM 39 CA GLU A 4 -6.448 1.518 4.801 1.00 10.00 C ATOM 40 C GLU A 4 -6.757 2.004 3.385 1.00 10.00 C ATOM 41 O GLU A 4 -7.929 2.065 2.999 1.00 10.00 O ATOM 42 CB GLU A 4 -6.418 2.727 5.738 1.00 10.00 C ATOM 43 CG GLU A 4 -6.439 2.353 7.233 1.00 10.00 C ATOM 44 CD GLU A 4 -5.180 1.597 7.678 1.00 10.00 C ATOM 45 OE1 GLU A 4 -4.105 1.942 7.139 1.00 10.00 O ATOM 46 OE2 GLU A 4 -5.311 0.630 8.463 1.00 10.00 O ATOM 0 H GLU A 4 -4.463 1.214 5.416 1.00 10.00 H new ATOM 0 HA GLU A 4 -7.229 0.828 5.122 1.00 10.00 H new ATOM 0 HB2 GLU A 4 -5.522 3.313 5.532 1.00 10.00 H new ATOM 0 HB3 GLU A 4 -7.274 3.366 5.520 1.00 10.00 H new ATOM 0 HG2 GLU A 4 -6.541 3.261 7.828 1.00 10.00 H new ATOM 0 HG3 GLU A 4 -7.316 1.739 7.436 1.00 10.00 H new ATOM 53 N LYS A 5 -5.702 2.320 2.625 1.00 10.00 N ATOM 54 CA LYS A 5 -5.737 2.659 1.206 1.00 10.00 C ATOM 55 C LYS A 5 -5.925 1.429 0.303 1.00 10.00 C ATOM 56 O LYS A 5 -6.227 1.594 -0.877 1.00 10.00 O ATOM 57 CB LYS A 5 -4.429 3.355 0.813 1.00 10.00 C ATOM 58 CG LYS A 5 -4.005 4.528 1.710 1.00 10.00 C ATOM 59 CD LYS A 5 -2.866 5.369 1.106 1.00 10.00 C ATOM 60 CE LYS A 5 -1.838 4.534 0.328 1.00 10.00 C ATOM 61 NZ LYS A 5 -0.521 5.198 0.319 1.00 10.00 N ATOM 0 H LYS A 5 -4.756 2.346 3.006 1.00 10.00 H new ATOM 0 HA LYS A 5 -6.595 3.316 1.060 1.00 10.00 H new ATOM 0 HB2 LYS A 5 -3.630 2.614 0.813 1.00 10.00 H new ATOM 0 HB3 LYS A 5 -4.526 3.720 -0.210 1.00 10.00 H new ATOM 0 HG2 LYS A 5 -4.867 5.170 1.890 1.00 10.00 H new ATOM 0 HG3 LYS A 5 -3.689 4.141 2.679 1.00 10.00 H new ATOM 0 HD2 LYS A 5 -3.292 6.120 0.440 1.00 10.00 H new ATOM 0 HD3 LYS A 5 -2.356 5.905 1.906 1.00 10.00 H new ATOM 0 HE2 LYS A 5 -1.749 3.546 0.780 1.00 10.00 H new ATOM 0 HE3 LYS A 5 -2.183 4.387 -0.695 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 0.001 4.923 -0.538 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 -0.652 6.230 0.328 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 0.019 4.910 1.160 1.00 10.00 H new ATOM 75 N GLY A 6 -5.783 0.215 0.839 1.00 10.00 N ATOM 76 CA GLY A 6 -5.888 -1.033 0.086 1.00 10.00 C ATOM 77 C GLY A 6 -7.309 -1.556 0.085 1.00 10.00 C ATOM 78 O GLY A 6 -7.857 -1.818 -0.985 1.00 10.00 O ATOM 0 H GLY A 6 -5.588 0.071 1.830 1.00 10.00 H new ATOM 0 HA2 GLY A 6 -5.557 -0.870 -0.940 1.00 10.00 H new ATOM 0 HA3 GLY A 6 -5.224 -1.780 0.521 1.00 10.00 H new ATOM 82 N LYS A 7 -7.963 -1.612 1.253 1.00 10.00 N ATOM 83 CA LYS A 7 -9.385 -1.985 1.333 1.00 10.00 C ATOM 84 C LYS A 7 -10.266 -1.192 0.353 1.00 10.00 C ATOM 85 O LYS A 7 -11.055 -1.775 -0.384 1.00 10.00 O ATOM 86 CB LYS A 7 -9.924 -1.915 2.774 1.00 10.00 C ATOM 87 CG LYS A 7 -9.597 -0.609 3.511 1.00 10.00 C ATOM 88 CD LYS A 7 -10.447 -0.442 4.779 1.00 10.00 C ATOM 89 CE LYS A 7 -10.034 0.783 5.610 1.00 10.00 C ATOM 90 NZ LYS A 7 -10.026 2.038 4.816 1.00 10.00 N ATOM 0 H LYS A 7 -7.533 -1.405 2.154 1.00 10.00 H new ATOM 0 HA LYS A 7 -9.440 -3.028 1.020 1.00 10.00 H new ATOM 0 HB2 LYS A 7 -11.006 -2.044 2.751 1.00 10.00 H new ATOM 0 HB3 LYS A 7 -9.516 -2.751 3.343 1.00 10.00 H new ATOM 0 HG2 LYS A 7 -8.540 -0.597 3.778 1.00 10.00 H new ATOM 0 HG3 LYS A 7 -9.768 0.237 2.845 1.00 10.00 H new ATOM 0 HD2 LYS A 7 -11.496 -0.349 4.499 1.00 10.00 H new ATOM 0 HD3 LYS A 7 -10.359 -1.339 5.392 1.00 10.00 H new ATOM 0 HE2 LYS A 7 -10.719 0.894 6.451 1.00 10.00 H new ATOM 0 HE3 LYS A 7 -9.041 0.616 6.028 1.00 10.00 H new ATOM 0 HZ1 LYS A 7 -9.993 2.855 5.459 1.00 10.00 H new ATOM 0 HZ2 LYS A 7 -9.191 2.051 4.196 1.00 10.00 H new ATOM 0 HZ3 LYS A 7 -10.888 2.088 4.236 1.00 10.00 H new ATOM 104 N LYS A 8 -10.050 0.127 0.265 1.00 10.00 N ATOM 105 CA LYS A 8 -10.808 1.072 -0.573 1.00 10.00 C ATOM 106 C LYS A 8 -10.617 0.871 -2.087 1.00 10.00 C ATOM 107 O LYS A 8 -11.382 1.445 -2.857 1.00 10.00 O ATOM 108 CB LYS A 8 -10.484 2.521 -0.151 1.00 10.00 C ATOM 109 CG LYS A 8 -9.120 3.015 -0.671 1.00 10.00 C ATOM 110 CD LYS A 8 -9.206 4.034 -1.824 1.00 10.00 C ATOM 111 CE LYS A 8 -8.038 3.972 -2.824 1.00 10.00 C ATOM 112 NZ LYS A 8 -6.704 3.936 -2.185 1.00 10.00 N ATOM 0 H LYS A 8 -9.311 0.587 0.798 1.00 10.00 H new ATOM 0 HA LYS A 8 -11.864 0.865 -0.397 1.00 10.00 H new ATOM 0 HB2 LYS A 8 -11.267 3.183 -0.519 1.00 10.00 H new ATOM 0 HB3 LYS A 8 -10.496 2.587 0.937 1.00 10.00 H new ATOM 0 HG2 LYS A 8 -8.572 3.467 0.156 1.00 10.00 H new ATOM 0 HG3 LYS A 8 -8.540 2.155 -1.006 1.00 10.00 H new ATOM 0 HD2 LYS A 8 -10.139 3.873 -2.365 1.00 10.00 H new ATOM 0 HD3 LYS A 8 -9.252 5.038 -1.401 1.00 10.00 H new ATOM 0 HE2 LYS A 8 -8.155 3.087 -3.450 1.00 10.00 H new ATOM 0 HE3 LYS A 8 -8.091 4.838 -3.484 1.00 10.00 H new ATOM 0 HZ1 LYS A 8 -5.967 3.963 -2.918 1.00 10.00 H new ATOM 0 HZ2 LYS A 8 -6.598 4.758 -1.556 1.00 10.00 H new ATOM 0 HZ3 LYS A 8 -6.608 3.061 -1.630 1.00 10.00 H new ATOM 126 N ILE A 9 -9.622 0.077 -2.516 1.00 10.00 N ATOM 127 CA ILE A 9 -9.417 -0.284 -3.927 1.00 10.00 C ATOM 128 C ILE A 9 -9.619 -1.785 -4.177 1.00 10.00 C ATOM 129 O ILE A 9 -10.119 -2.151 -5.241 1.00 10.00 O ATOM 130 CB ILE A 9 -8.080 0.286 -4.461 1.00 10.00 C ATOM 131 CG1 ILE A 9 -8.055 0.425 -5.996 1.00 10.00 C ATOM 132 CG2 ILE A 9 -6.851 -0.528 -4.050 1.00 10.00 C ATOM 133 CD1 ILE A 9 -8.994 1.508 -6.539 1.00 10.00 C ATOM 0 H ILE A 9 -8.932 -0.335 -1.888 1.00 10.00 H new ATOM 0 HA ILE A 9 -10.196 0.195 -4.521 1.00 10.00 H new ATOM 0 HB ILE A 9 -8.026 1.270 -3.996 1.00 10.00 H new ATOM 0 HG12 ILE A 9 -7.037 0.649 -6.314 1.00 10.00 H new ATOM 0 HG13 ILE A 9 -8.325 -0.532 -6.442 1.00 10.00 H new ATOM 0 HG21 ILE A 9 -5.954 -0.066 -4.462 1.00 10.00 H new ATOM 0 HG22 ILE A 9 -6.779 -0.554 -2.963 1.00 10.00 H new ATOM 0 HG23 ILE A 9 -6.944 -1.545 -4.432 1.00 10.00 H new ATOM 0 HD11 ILE A 9 -8.919 1.543 -7.626 1.00 10.00 H new ATOM 0 HD12 ILE A 9 -10.020 1.276 -6.254 1.00 10.00 H new ATOM 0 HD13 ILE A 9 -8.712 2.476 -6.124 1.00 10.00 H new ATOM 145 N PHE A 10 -9.378 -2.639 -3.170 1.00 10.00 N ATOM 146 CA PHE A 10 -9.837 -4.026 -3.141 1.00 10.00 C ATOM 147 C PHE A 10 -11.354 -4.091 -3.325 1.00 10.00 C ATOM 148 O PHE A 10 -11.839 -4.777 -4.222 1.00 10.00 O ATOM 149 CB PHE A 10 -9.416 -4.717 -1.837 1.00 10.00 C ATOM 150 CG PHE A 10 -9.762 -6.194 -1.844 1.00 10.00 C ATOM 151 CD1 PHE A 10 -11.068 -6.618 -1.535 1.00 10.00 C ATOM 152 CD2 PHE A 10 -8.800 -7.144 -2.233 1.00 10.00 C ATOM 153 CE1 PHE A 10 -11.421 -7.971 -1.661 1.00 10.00 C ATOM 154 CE2 PHE A 10 -9.140 -8.506 -2.309 1.00 10.00 C ATOM 155 CZ PHE A 10 -10.458 -8.915 -2.052 1.00 10.00 C ATOM 0 H PHE A 10 -8.848 -2.374 -2.340 1.00 10.00 H new ATOM 0 HA PHE A 10 -9.367 -4.558 -3.968 1.00 10.00 H new ATOM 0 HB2 PHE A 10 -8.342 -4.596 -1.692 1.00 10.00 H new ATOM 0 HB3 PHE A 10 -9.908 -4.233 -0.994 1.00 10.00 H new ATOM 0 HD1 PHE A 10 -11.801 -5.900 -1.200 1.00 10.00 H new ATOM 0 HD2 PHE A 10 -7.797 -6.826 -2.474 1.00 10.00 H new ATOM 0 HE1 PHE A 10 -12.434 -8.286 -1.457 1.00 10.00 H new ATOM 0 HE2 PHE A 10 -8.388 -9.237 -2.565 1.00 10.00 H new ATOM 0 HZ PHE A 10 -10.731 -9.955 -2.155 1.00 10.00 H new ATOM 165 N VAL A 11 -12.119 -3.350 -2.515 1.00 10.00 N ATOM 166 CA VAL A 11 -13.588 -3.381 -2.566 1.00 10.00 C ATOM 167 C VAL A 11 -14.152 -2.904 -3.918 1.00 10.00 C ATOM 168 O VAL A 11 -15.314 -3.157 -4.227 1.00 10.00 O ATOM 169 CB VAL A 11 -14.179 -2.604 -1.367 1.00 10.00 C ATOM 170 CG1 VAL A 11 -15.705 -2.417 -1.383 1.00 10.00 C ATOM 171 CG2 VAL A 11 -13.861 -3.343 -0.058 1.00 10.00 C ATOM 0 H VAL A 11 -11.742 -2.716 -1.810 1.00 10.00 H new ATOM 0 HA VAL A 11 -13.901 -4.422 -2.482 1.00 10.00 H new ATOM 0 HB VAL A 11 -13.718 -1.619 -1.443 1.00 10.00 H new ATOM 0 HG11 VAL A 11 -16.013 -1.860 -0.498 1.00 10.00 H new ATOM 0 HG12 VAL A 11 -15.995 -1.866 -2.278 1.00 10.00 H new ATOM 0 HG13 VAL A 11 -16.191 -3.393 -1.385 1.00 10.00 H new ATOM 0 HG21 VAL A 11 -14.280 -2.790 0.783 1.00 10.00 H new ATOM 0 HG22 VAL A 11 -14.296 -4.342 -0.089 1.00 10.00 H new ATOM 0 HG23 VAL A 11 -12.781 -3.422 0.062 1.00 10.00 H new ATOM 181 N GLN A 12 -13.314 -2.288 -4.758 1.00 10.00 N ATOM 182 CA GLN A 12 -13.630 -1.922 -6.131 1.00 10.00 C ATOM 183 C GLN A 12 -13.154 -3.037 -7.081 1.00 10.00 C ATOM 184 O GLN A 12 -13.976 -3.778 -7.616 1.00 10.00 O ATOM 185 CB GLN A 12 -13.046 -0.521 -6.417 1.00 10.00 C ATOM 186 CG GLN A 12 -13.643 0.187 -7.645 1.00 10.00 C ATOM 187 CD GLN A 12 -12.852 -0.043 -8.931 1.00 10.00 C ATOM 188 OE1 GLN A 12 -12.803 -1.129 -9.476 1.00 10.00 O ATOM 189 NE2 GLN A 12 -12.210 0.974 -9.473 1.00 10.00 N ATOM 0 H GLN A 12 -12.367 -2.024 -4.486 1.00 10.00 H new ATOM 0 HA GLN A 12 -14.704 -1.841 -6.299 1.00 10.00 H new ATOM 0 HB2 GLN A 12 -13.202 0.108 -5.541 1.00 10.00 H new ATOM 0 HB3 GLN A 12 -11.969 -0.613 -6.556 1.00 10.00 H new ATOM 0 HG2 GLN A 12 -14.666 -0.159 -7.791 1.00 10.00 H new ATOM 0 HG3 GLN A 12 -13.694 1.258 -7.447 1.00 10.00 H new ATOM 0 HE21 GLN A 12 -12.241 1.892 -9.029 1.00 10.00 H new ATOM 0 HE22 GLN A 12 -11.683 0.843 -10.336 1.00 10.00 H new ATOM 198 N LYS A 13 -11.832 -3.196 -7.247 1.00 10.00 N ATOM 199 CA LYS A 13 -11.208 -4.031 -8.289 1.00 10.00 C ATOM 200 C LYS A 13 -11.162 -5.530 -7.983 1.00 10.00 C ATOM 201 O LYS A 13 -10.842 -6.320 -8.866 1.00 10.00 O ATOM 202 CB LYS A 13 -9.773 -3.527 -8.541 1.00 10.00 C ATOM 203 CG LYS A 13 -9.741 -2.105 -9.118 1.00 10.00 C ATOM 204 CD LYS A 13 -8.315 -1.601 -9.372 1.00 10.00 C ATOM 205 CE LYS A 13 -8.407 -0.243 -10.076 1.00 10.00 C ATOM 206 NZ LYS A 13 -7.084 0.376 -10.306 1.00 10.00 N ATOM 0 H LYS A 13 -11.148 -2.736 -6.646 1.00 10.00 H new ATOM 0 HA LYS A 13 -11.844 -3.929 -9.168 1.00 10.00 H new ATOM 0 HB2 LYS A 13 -9.215 -3.548 -7.605 1.00 10.00 H new ATOM 0 HB3 LYS A 13 -9.269 -4.206 -9.229 1.00 10.00 H new ATOM 0 HG2 LYS A 13 -10.301 -2.084 -10.053 1.00 10.00 H new ATOM 0 HG3 LYS A 13 -10.244 -1.426 -8.429 1.00 10.00 H new ATOM 0 HD2 LYS A 13 -7.772 -1.506 -8.432 1.00 10.00 H new ATOM 0 HD3 LYS A 13 -7.764 -2.312 -9.988 1.00 10.00 H new ATOM 0 HE2 LYS A 13 -8.915 -0.369 -11.032 1.00 10.00 H new ATOM 0 HE3 LYS A 13 -9.019 0.431 -9.476 1.00 10.00 H new ATOM 0 HZ1 LYS A 13 -7.101 0.909 -11.199 1.00 10.00 H new ATOM 0 HZ2 LYS A 13 -6.861 1.021 -9.521 1.00 10.00 H new ATOM 0 HZ3 LYS A 13 -6.358 -0.367 -10.360 1.00 10.00 H new ATOM 220 N CYS A 14 -11.464 -5.931 -6.748 1.00 10.00 N ATOM 221 CA CYS A 14 -11.300 -7.295 -6.255 1.00 10.00 C ATOM 222 C CYS A 14 -12.610 -7.857 -5.695 1.00 10.00 C ATOM 223 O CYS A 14 -13.006 -8.960 -6.072 1.00 10.00 O ATOM 224 CB CYS A 14 -10.210 -7.299 -5.182 1.00 10.00 C ATOM 225 SG CYS A 14 -8.604 -6.554 -5.611 1.00 10.00 S ATOM 0 H CYS A 14 -11.840 -5.296 -6.044 1.00 10.00 H new ATOM 0 HA CYS A 14 -11.010 -7.938 -7.086 1.00 10.00 H new ATOM 0 HB2 CYS A 14 -10.598 -6.779 -4.306 1.00 10.00 H new ATOM 0 HB3 CYS A 14 -10.033 -8.333 -4.887 1.00 10.00 H new ATOM 230 N ALA A 15 -13.318 -7.105 -4.837 1.00 10.00 N ATOM 231 CA ALA A 15 -14.601 -7.552 -4.274 1.00 10.00 C ATOM 232 C ALA A 15 -15.716 -7.704 -5.323 1.00 10.00 C ATOM 233 O ALA A 15 -16.703 -8.387 -5.058 1.00 10.00 O ATOM 234 CB ALA A 15 -15.043 -6.646 -3.128 1.00 10.00 C ATOM 0 H ALA A 15 -13.022 -6.183 -4.518 1.00 10.00 H new ATOM 0 HA ALA A 15 -14.423 -8.553 -3.881 1.00 10.00 H new ATOM 0 HB1 ALA A 15 -15.994 -7.000 -2.731 1.00 10.00 H new ATOM 0 HB2 ALA A 15 -14.291 -6.664 -2.339 1.00 10.00 H new ATOM 0 HB3 ALA A 15 -15.160 -5.626 -3.495 1.00 10.00 H new ATOM 240 N GLN A 16 -15.510 -7.175 -6.538 1.00 10.00 N ATOM 241 CA GLN A 16 -16.257 -7.501 -7.752 1.00 10.00 C ATOM 242 C GLN A 16 -16.270 -9.006 -8.101 1.00 10.00 C ATOM 243 O GLN A 16 -17.089 -9.431 -8.912 1.00 10.00 O ATOM 244 CB GLN A 16 -15.678 -6.653 -8.898 1.00 10.00 C ATOM 245 CG GLN A 16 -14.270 -7.056 -9.352 1.00 10.00 C ATOM 246 CD GLN A 16 -13.892 -6.379 -10.667 1.00 10.00 C ATOM 247 OE1 GLN A 16 -13.261 -5.336 -10.712 1.00 10.00 O ATOM 248 NE2 GLN A 16 -14.277 -6.951 -11.793 1.00 10.00 N ATOM 0 H GLN A 16 -14.785 -6.477 -6.704 1.00 10.00 H new ATOM 0 HA GLN A 16 -17.307 -7.262 -7.584 1.00 10.00 H new ATOM 0 HB2 GLN A 16 -16.351 -6.716 -9.753 1.00 10.00 H new ATOM 0 HB3 GLN A 16 -15.658 -5.609 -8.584 1.00 10.00 H new ATOM 0 HG2 GLN A 16 -13.547 -6.787 -8.582 1.00 10.00 H new ATOM 0 HG3 GLN A 16 -14.221 -8.138 -9.471 1.00 10.00 H new ATOM 0 HE21 GLN A 16 -14.805 -7.823 -11.767 1.00 10.00 H new ATOM 0 HE22 GLN A 16 -14.046 -6.521 -12.689 1.00 10.00 H new ATOM 257 N CYS A 17 -15.396 -9.806 -7.472 1.00 10.00 N ATOM 258 CA CYS A 17 -15.240 -11.247 -7.655 1.00 10.00 C ATOM 259 C CYS A 17 -14.922 -11.996 -6.339 1.00 10.00 C ATOM 260 O CYS A 17 -15.254 -13.177 -6.234 1.00 10.00 O ATOM 261 CB CYS A 17 -14.104 -11.466 -8.658 1.00 10.00 C ATOM 262 SG CYS A 17 -14.465 -11.056 -10.392 1.00 10.00 S ATOM 0 H CYS A 17 -14.742 -9.437 -6.782 1.00 10.00 H new ATOM 0 HA CYS A 17 -16.186 -11.651 -8.016 1.00 10.00 H new ATOM 0 HB2 CYS A 17 -13.247 -10.873 -8.338 1.00 10.00 H new ATOM 0 HB3 CYS A 17 -13.803 -12.513 -8.610 1.00 10.00 H new ATOM 267 N HIS A 18 -14.331 -11.317 -5.339 1.00 10.00 N ATOM 268 CA HIS A 18 -13.874 -11.853 -4.056 1.00 10.00 C ATOM 269 C HIS A 18 -14.453 -11.064 -2.853 1.00 10.00 C ATOM 270 O HIS A 18 -13.751 -10.257 -2.236 1.00 10.00 O ATOM 271 CB HIS A 18 -12.339 -11.780 -4.021 1.00 10.00 C ATOM 272 CG HIS A 18 -11.569 -12.479 -5.095 1.00 10.00 C ATOM 273 ND1 HIS A 18 -11.126 -13.760 -4.984 1.00 10.00 N ATOM 274 CD2 HIS A 18 -10.897 -11.897 -6.133 1.00 10.00 C ATOM 275 CE1 HIS A 18 -10.189 -13.948 -5.924 1.00 10.00 C ATOM 276 NE2 HIS A 18 -10.034 -12.859 -6.679 1.00 10.00 N ATOM 0 H HIS A 18 -14.151 -10.316 -5.416 1.00 10.00 H new ATOM 0 HA HIS A 18 -14.223 -12.882 -3.969 1.00 10.00 H new ATOM 0 HB2 HIS A 18 -12.056 -10.728 -4.041 1.00 10.00 H new ATOM 0 HB3 HIS A 18 -12.009 -12.180 -3.062 1.00 10.00 H new ATOM 0 HD1 HIS A 18 -11.448 -14.452 -4.308 1.00 10.00 H new ATOM 0 HD2 HIS A 18 -11.010 -10.878 -6.473 1.00 10.00 H new ATOM 0 HE1 HIS A 18 -9.631 -14.864 -6.054 1.00 10.00 H new ATOM 284 N THR A 19 -15.719 -11.274 -2.482 1.00 10.00 N ATOM 285 CA THR A 19 -16.418 -10.516 -1.416 1.00 10.00 C ATOM 286 C THR A 19 -15.999 -10.904 0.033 1.00 10.00 C ATOM 287 O THR A 19 -16.821 -11.101 0.931 1.00 10.00 O ATOM 288 CB THR A 19 -17.934 -10.533 -1.693 1.00 10.00 C ATOM 289 OG1 THR A 19 -18.620 -9.670 -0.817 1.00 10.00 O ATOM 290 CG2 THR A 19 -18.560 -11.930 -1.654 1.00 10.00 C ATOM 0 H THR A 19 -16.306 -11.986 -2.916 1.00 10.00 H new ATOM 0 HA THR A 19 -16.090 -9.477 -1.459 1.00 10.00 H new ATOM 0 HB THR A 19 -18.043 -10.176 -2.717 1.00 10.00 H new ATOM 0 HG1 THR A 19 -18.354 -9.862 0.106 1.00 10.00 H new ATOM 0 HG21 THR A 19 -19.628 -11.856 -1.859 1.00 10.00 H new ATOM 0 HG22 THR A 19 -18.089 -12.561 -2.408 1.00 10.00 H new ATOM 0 HG23 THR A 19 -18.409 -12.369 -0.668 1.00 10.00 H new ATOM 298 N VAL A 20 -14.682 -11.007 0.272 1.00 10.00 N ATOM 299 CA VAL A 20 -14.066 -11.414 1.549 1.00 10.00 C ATOM 300 C VAL A 20 -14.333 -10.426 2.691 1.00 10.00 C ATOM 301 O VAL A 20 -14.791 -10.845 3.751 1.00 10.00 O ATOM 302 CB VAL A 20 -12.554 -11.699 1.377 1.00 10.00 C ATOM 303 CG1 VAL A 20 -11.712 -10.480 0.972 1.00 10.00 C ATOM 304 CG2 VAL A 20 -11.948 -12.310 2.644 1.00 10.00 C ATOM 0 H VAL A 20 -13.988 -10.801 -0.446 1.00 10.00 H new ATOM 0 HA VAL A 20 -14.552 -12.344 1.842 1.00 10.00 H new ATOM 0 HB VAL A 20 -12.514 -12.408 0.550 1.00 10.00 H new ATOM 0 HG11 VAL A 20 -10.667 -10.775 0.875 1.00 10.00 H new ATOM 0 HG12 VAL A 20 -12.069 -10.092 0.018 1.00 10.00 H new ATOM 0 HG13 VAL A 20 -11.801 -9.707 1.735 1.00 10.00 H new ATOM 0 HG21 VAL A 20 -10.886 -12.496 2.486 1.00 10.00 H new ATOM 0 HG22 VAL A 20 -12.075 -11.619 3.478 1.00 10.00 H new ATOM 0 HG23 VAL A 20 -12.451 -13.250 2.871 1.00 10.00 H new ATOM 314 N GLU A 21 -14.067 -9.126 2.488 1.00 10.00 N ATOM 315 CA GLU A 21 -14.102 -8.089 3.534 1.00 10.00 C ATOM 316 C GLU A 21 -15.440 -8.089 4.281 1.00 10.00 C ATOM 317 O GLU A 21 -15.486 -8.022 5.508 1.00 10.00 O ATOM 318 CB GLU A 21 -13.858 -6.711 2.887 1.00 10.00 C ATOM 319 CG GLU A 21 -13.740 -5.566 3.912 1.00 10.00 C ATOM 320 CD GLU A 21 -14.096 -4.207 3.301 1.00 10.00 C ATOM 321 OE1 GLU A 21 -15.280 -4.042 2.915 1.00 10.00 O ATOM 322 OE2 GLU A 21 -13.203 -3.333 3.236 1.00 10.00 O ATOM 0 H GLU A 21 -13.816 -8.757 1.571 1.00 10.00 H new ATOM 0 HA GLU A 21 -13.319 -8.304 4.261 1.00 10.00 H new ATOM 0 HB2 GLU A 21 -12.945 -6.753 2.294 1.00 10.00 H new ATOM 0 HB3 GLU A 21 -14.675 -6.491 2.200 1.00 10.00 H new ATOM 0 HG2 GLU A 21 -14.399 -5.767 4.757 1.00 10.00 H new ATOM 0 HG3 GLU A 21 -12.723 -5.532 4.302 1.00 10.00 H new ATOM 329 N LYS A 22 -16.531 -8.171 3.515 1.00 10.00 N ATOM 330 CA LYS A 22 -17.913 -8.120 3.992 1.00 10.00 C ATOM 331 C LYS A 22 -18.454 -9.491 4.428 1.00 10.00 C ATOM 332 O LYS A 22 -19.639 -9.605 4.727 1.00 10.00 O ATOM 333 CB LYS A 22 -18.785 -7.409 2.938 1.00 10.00 C ATOM 334 CG LYS A 22 -18.150 -6.063 2.525 1.00 10.00 C ATOM 335 CD LYS A 22 -19.109 -5.145 1.760 1.00 10.00 C ATOM 336 CE LYS A 22 -18.382 -3.941 1.139 1.00 10.00 C ATOM 337 NZ LYS A 22 -17.630 -3.138 2.136 1.00 10.00 N ATOM 0 H LYS A 22 -16.471 -8.279 2.503 1.00 10.00 H new ATOM 0 HA LYS A 22 -17.947 -7.532 4.909 1.00 10.00 H new ATOM 0 HB2 LYS A 22 -18.899 -8.047 2.062 1.00 10.00 H new ATOM 0 HB3 LYS A 22 -19.784 -7.238 3.340 1.00 10.00 H new ATOM 0 HG2 LYS A 22 -17.800 -5.546 3.418 1.00 10.00 H new ATOM 0 HG3 LYS A 22 -17.274 -6.258 1.906 1.00 10.00 H new ATOM 0 HD2 LYS A 22 -19.605 -5.714 0.974 1.00 10.00 H new ATOM 0 HD3 LYS A 22 -19.887 -4.790 2.436 1.00 10.00 H new ATOM 0 HE2 LYS A 22 -17.693 -4.296 0.373 1.00 10.00 H new ATOM 0 HE3 LYS A 22 -19.111 -3.301 0.641 1.00 10.00 H new ATOM 0 HZ1 LYS A 22 -17.176 -2.332 1.661 1.00 10.00 H new ATOM 0 HZ2 LYS A 22 -18.285 -2.787 2.864 1.00 10.00 H new ATOM 0 HZ3 LYS A 22 -16.902 -3.732 2.582 1.00 10.00 H new ATOM 351 N GLY A 23 -17.601 -10.524 4.473 1.00 10.00 N ATOM 352 CA GLY A 23 -17.943 -11.862 4.958 1.00 10.00 C ATOM 353 C GLY A 23 -18.828 -12.675 4.009 1.00 10.00 C ATOM 354 O GLY A 23 -19.531 -13.577 4.468 1.00 10.00 O ATOM 0 H GLY A 23 -16.632 -10.447 4.165 1.00 10.00 H new ATOM 0 HA2 GLY A 23 -17.022 -12.416 5.139 1.00 10.00 H new ATOM 0 HA3 GLY A 23 -18.452 -11.768 5.917 1.00 10.00 H new ATOM 358 N GLY A 24 -18.835 -12.365 2.706 1.00 10.00 N ATOM 359 CA GLY A 24 -19.647 -13.078 1.729 1.00 10.00 C ATOM 360 C GLY A 24 -18.981 -14.371 1.246 1.00 10.00 C ATOM 361 O GLY A 24 -17.806 -14.636 1.497 1.00 10.00 O ATOM 0 H GLY A 24 -18.276 -11.612 2.306 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -20.616 -13.314 2.169 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -19.835 -12.429 0.874 1.00 10.00 H new ATOM 365 N LYS A 25 -19.757 -15.182 0.520 1.00 10.00 N ATOM 366 CA LYS A 25 -19.285 -16.454 -0.034 1.00 10.00 C ATOM 367 C LYS A 25 -18.294 -16.223 -1.180 1.00 10.00 C ATOM 368 O LYS A 25 -18.393 -15.249 -1.926 1.00 10.00 O ATOM 369 CB LYS A 25 -20.447 -17.322 -0.556 1.00 10.00 C ATOM 370 CG LYS A 25 -21.540 -17.685 0.466 1.00 10.00 C ATOM 371 CD LYS A 25 -22.692 -16.669 0.501 1.00 10.00 C ATOM 372 CE LYS A 25 -23.939 -17.287 1.145 1.00 10.00 C ATOM 373 NZ LYS A 25 -25.148 -16.478 0.857 1.00 10.00 N ATOM 0 H LYS A 25 -20.731 -14.974 0.300 1.00 10.00 H new ATOM 0 HA LYS A 25 -18.790 -16.979 0.783 1.00 10.00 H new ATOM 0 HB2 LYS A 25 -20.917 -16.799 -1.389 1.00 10.00 H new ATOM 0 HB3 LYS A 25 -20.031 -18.247 -0.955 1.00 10.00 H new ATOM 0 HG2 LYS A 25 -21.940 -18.671 0.227 1.00 10.00 H new ATOM 0 HG3 LYS A 25 -21.093 -17.754 1.458 1.00 10.00 H new ATOM 0 HD2 LYS A 25 -22.387 -15.785 1.061 1.00 10.00 H new ATOM 0 HD3 LYS A 25 -22.925 -16.340 -0.512 1.00 10.00 H new ATOM 0 HE2 LYS A 25 -24.080 -18.301 0.772 1.00 10.00 H new ATOM 0 HE3 LYS A 25 -23.796 -17.361 2.223 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 -25.976 -16.920 1.305 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 -25.021 -15.517 1.235 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 -25.296 -16.429 -0.171 1.00 10.00 H new ATOM 387 N HIS A 26 -17.413 -17.200 -1.391 1.00 10.00 N ATOM 388 CA HIS A 26 -16.746 -17.413 -2.673 1.00 10.00 C ATOM 389 C HIS A 26 -17.755 -17.847 -3.740 1.00 10.00 C ATOM 390 O HIS A 26 -18.602 -18.704 -3.468 1.00 10.00 O ATOM 391 CB HIS A 26 -15.650 -18.468 -2.508 1.00 10.00 C ATOM 392 CG HIS A 26 -15.968 -19.648 -1.632 1.00 10.00 C ATOM 393 ND1 HIS A 26 -17.174 -20.300 -1.536 1.00 10.00 N ATOM 394 CD2 HIS A 26 -15.097 -20.239 -0.760 1.00 10.00 C ATOM 395 CE1 HIS A 26 -17.040 -21.250 -0.593 1.00 10.00 C ATOM 396 NE2 HIS A 26 -15.794 -21.242 -0.094 1.00 10.00 N ATOM 0 H HIS A 26 -17.141 -17.870 -0.672 1.00 10.00 H new ATOM 0 HA HIS A 26 -16.294 -16.477 -3.000 1.00 10.00 H new ATOM 0 HB2 HIS A 26 -15.387 -18.841 -3.498 1.00 10.00 H new ATOM 0 HB3 HIS A 26 -14.764 -17.977 -2.107 1.00 10.00 H new ATOM 0 HD1 HIS A 26 -18.014 -20.101 -2.079 1.00 10.00 H new ATOM 0 HD2 HIS A 26 -14.060 -19.976 -0.615 1.00 10.00 H new ATOM 0 HE1 HIS A 26 -17.824 -21.924 -0.281 1.00 10.00 H new ATOM 404 N LYS A 27 -17.656 -17.255 -4.940 1.00 10.00 N ATOM 405 CA LYS A 27 -18.589 -17.472 -6.060 1.00 10.00 C ATOM 406 C LYS A 27 -17.847 -17.440 -7.399 1.00 10.00 C ATOM 407 O LYS A 27 -17.593 -18.505 -7.950 1.00 10.00 O ATOM 408 CB LYS A 27 -19.781 -16.487 -6.010 1.00 10.00 C ATOM 409 CG LYS A 27 -20.627 -16.647 -4.732 1.00 10.00 C ATOM 410 CD LYS A 27 -21.962 -15.891 -4.756 1.00 10.00 C ATOM 411 CE LYS A 27 -22.997 -16.607 -5.634 1.00 10.00 C ATOM 412 NZ LYS A 27 -24.351 -16.033 -5.452 1.00 10.00 N ATOM 0 H LYS A 27 -16.909 -16.598 -5.165 1.00 10.00 H new ATOM 0 HA LYS A 27 -19.019 -18.468 -5.958 1.00 10.00 H new ATOM 0 HB2 LYS A 27 -19.406 -15.465 -6.068 1.00 10.00 H new ATOM 0 HB3 LYS A 27 -20.415 -16.644 -6.883 1.00 10.00 H new ATOM 0 HG2 LYS A 27 -20.827 -17.707 -4.573 1.00 10.00 H new ATOM 0 HG3 LYS A 27 -20.043 -16.301 -3.879 1.00 10.00 H new ATOM 0 HD2 LYS A 27 -22.347 -15.798 -3.741 1.00 10.00 H new ATOM 0 HD3 LYS A 27 -21.802 -14.880 -5.131 1.00 10.00 H new ATOM 0 HE2 LYS A 27 -22.705 -16.528 -6.681 1.00 10.00 H new ATOM 0 HE3 LYS A 27 -23.014 -17.668 -5.387 1.00 10.00 H new ATOM 0 HZ1 LYS A 27 -25.027 -16.539 -6.059 1.00 10.00 H new ATOM 0 HZ2 LYS A 27 -24.639 -16.131 -4.457 1.00 10.00 H new ATOM 0 HZ3 LYS A 27 -24.339 -15.026 -5.712 1.00 10.00 H new ATOM 426 N THR A 28 -17.478 -16.254 -7.899 1.00 10.00 N ATOM 427 CA THR A 28 -16.579 -16.100 -9.059 1.00 10.00 C ATOM 428 C THR A 28 -15.134 -16.364 -8.640 1.00 10.00 C ATOM 429 O THR A 28 -14.484 -17.240 -9.201 1.00 10.00 O ATOM 430 CB THR A 28 -16.699 -14.698 -9.680 1.00 10.00 C ATOM 431 OG1 THR A 28 -18.040 -14.460 -10.039 1.00 10.00 O ATOM 432 CG2 THR A 28 -15.850 -14.534 -10.944 1.00 10.00 C ATOM 0 H THR A 28 -17.795 -15.366 -7.510 1.00 10.00 H new ATOM 0 HA THR A 28 -16.876 -16.829 -9.813 1.00 10.00 H new ATOM 0 HB THR A 28 -16.344 -13.992 -8.929 1.00 10.00 H new ATOM 0 HG1 THR A 28 -18.119 -13.566 -10.433 1.00 10.00 H new ATOM 0 HG21 THR A 28 -15.975 -13.525 -11.338 1.00 10.00 H new ATOM 0 HG22 THR A 28 -14.801 -14.702 -10.702 1.00 10.00 H new ATOM 0 HG23 THR A 28 -16.170 -15.258 -11.693 1.00 10.00 H new ATOM 440 N GLY A 29 -14.640 -15.632 -7.635 1.00 10.00 N ATOM 441 CA GLY A 29 -13.370 -15.912 -6.974 1.00 10.00 C ATOM 442 C GLY A 29 -13.572 -16.568 -5.597 1.00 10.00 C ATOM 443 O GLY A 29 -14.689 -16.557 -5.058 1.00 10.00 O ATOM 0 H GLY A 29 -15.122 -14.817 -7.256 1.00 10.00 H new ATOM 0 HA2 GLY A 29 -12.770 -16.568 -7.604 1.00 10.00 H new ATOM 0 HA3 GLY A 29 -12.810 -14.984 -6.856 1.00 10.00 H new ATOM 447 N PRO A 30 -12.490 -17.110 -5.005 1.00 10.00 N ATOM 448 CA PRO A 30 -12.453 -17.564 -3.620 1.00 10.00 C ATOM 449 C PRO A 30 -12.550 -16.373 -2.648 1.00 10.00 C ATOM 450 O PRO A 30 -12.344 -15.224 -3.035 1.00 10.00 O ATOM 451 CB PRO A 30 -11.139 -18.332 -3.465 1.00 10.00 C ATOM 452 CG PRO A 30 -10.236 -17.761 -4.549 1.00 10.00 C ATOM 453 CD PRO A 30 -11.193 -17.282 -5.631 1.00 10.00 C ATOM 0 HA PRO A 30 -13.301 -18.205 -3.380 1.00 10.00 H new ATOM 0 HB2 PRO A 30 -10.709 -18.188 -2.474 1.00 10.00 H new ATOM 0 HB3 PRO A 30 -11.288 -19.404 -3.596 1.00 10.00 H new ATOM 0 HG2 PRO A 30 -9.627 -16.942 -4.167 1.00 10.00 H new ATOM 0 HG3 PRO A 30 -9.550 -18.516 -4.932 1.00 10.00 H new ATOM 0 HD2 PRO A 30 -10.847 -16.344 -6.064 1.00 10.00 H new ATOM 0 HD3 PRO A 30 -11.250 -18.006 -6.443 1.00 10.00 H new ATOM 461 N ASN A 31 -12.809 -16.625 -1.362 1.00 10.00 N ATOM 462 CA ASN A 31 -12.587 -15.625 -0.324 1.00 10.00 C ATOM 463 C ASN A 31 -11.116 -15.714 0.101 1.00 10.00 C ATOM 464 O ASN A 31 -10.557 -16.809 0.196 1.00 10.00 O ATOM 465 CB ASN A 31 -13.587 -15.808 0.835 1.00 10.00 C ATOM 466 CG ASN A 31 -13.336 -17.037 1.696 1.00 10.00 C ATOM 467 OD1 ASN A 31 -12.498 -17.035 2.582 1.00 10.00 O ATOM 468 ND2 ASN A 31 -14.074 -18.110 1.493 1.00 10.00 N ATOM 0 H ASN A 31 -13.172 -17.514 -1.019 1.00 10.00 H new ATOM 0 HA ASN A 31 -12.772 -14.617 -0.695 1.00 10.00 H new ATOM 0 HB2 ASN A 31 -13.554 -14.922 1.470 1.00 10.00 H new ATOM 0 HB3 ASN A 31 -14.594 -15.868 0.423 1.00 10.00 H new ATOM 0 HD21 ASN A 31 -13.944 -18.936 2.076 1.00 10.00 H new ATOM 0 HD22 ASN A 31 -14.776 -18.114 0.753 1.00 10.00 H new ATOM 475 N LEU A 32 -10.477 -14.566 0.335 1.00 10.00 N ATOM 476 CA LEU A 32 -9.083 -14.505 0.759 1.00 10.00 C ATOM 477 C LEU A 32 -9.014 -14.818 2.262 1.00 10.00 C ATOM 478 O LEU A 32 -8.852 -13.925 3.090 1.00 10.00 O ATOM 479 CB LEU A 32 -8.449 -13.151 0.375 1.00 10.00 C ATOM 480 CG LEU A 32 -8.290 -12.851 -1.132 1.00 10.00 C ATOM 481 CD1 LEU A 32 -7.548 -13.951 -1.889 1.00 10.00 C ATOM 482 CD2 LEU A 32 -9.608 -12.593 -1.864 1.00 10.00 C ATOM 0 H LEU A 32 -10.916 -13.651 0.234 1.00 10.00 H new ATOM 0 HA LEU A 32 -8.489 -15.256 0.238 1.00 10.00 H new ATOM 0 HB2 LEU A 32 -9.052 -12.358 0.816 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -7.463 -13.096 0.837 1.00 10.00 H new ATOM 0 HG LEU A 32 -7.701 -11.934 -1.134 1.00 10.00 H new ATOM 0 HD11 LEU A 32 -7.470 -13.679 -2.942 1.00 10.00 H new ATOM 0 HD12 LEU A 32 -6.549 -14.071 -1.470 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -8.095 -14.889 -1.796 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -9.406 -12.391 -2.916 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -10.249 -13.471 -1.779 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -10.109 -11.733 -1.419 1.00 10.00 H new ATOM 494 N HIS A 33 -9.180 -16.105 2.586 1.00 10.00 N ATOM 495 CA HIS A 33 -9.197 -16.741 3.908 1.00 10.00 C ATOM 496 C HIS A 33 -7.934 -16.441 4.742 1.00 10.00 C ATOM 497 O HIS A 33 -7.052 -17.288 4.895 1.00 10.00 O ATOM 498 CB HIS A 33 -9.486 -18.254 3.743 1.00 10.00 C ATOM 499 CG HIS A 33 -8.970 -18.925 2.481 1.00 10.00 C ATOM 500 ND1 HIS A 33 -7.817 -18.632 1.783 1.00 10.00 N ATOM 501 CD2 HIS A 33 -9.618 -19.913 1.791 1.00 10.00 C ATOM 502 CE1 HIS A 33 -7.787 -19.419 0.691 1.00 10.00 C ATOM 503 NE2 HIS A 33 -8.858 -20.227 0.663 1.00 10.00 N ATOM 0 H HIS A 33 -9.320 -16.799 1.852 1.00 10.00 H new ATOM 0 HA HIS A 33 -10.005 -16.303 4.494 1.00 10.00 H new ATOM 0 HB2 HIS A 33 -9.061 -18.775 4.601 1.00 10.00 H new ATOM 0 HB3 HIS A 33 -10.566 -18.399 3.785 1.00 10.00 H new ATOM 0 HD1 HIS A 33 -7.113 -17.943 2.047 1.00 10.00 H new ATOM 0 HD2 HIS A 33 -10.555 -20.371 2.071 1.00 10.00 H new ATOM 0 HE1 HIS A 33 -7.009 -19.402 -0.058 1.00 10.00 H new ATOM 511 N GLY A 34 -7.843 -15.204 5.250 1.00 10.00 N ATOM 512 CA GLY A 34 -6.671 -14.577 5.868 1.00 10.00 C ATOM 513 C GLY A 34 -5.529 -14.410 4.861 1.00 10.00 C ATOM 514 O GLY A 34 -5.200 -13.302 4.443 1.00 10.00 O ATOM 0 H GLY A 34 -8.644 -14.573 5.238 1.00 10.00 H new ATOM 0 HA2 GLY A 34 -6.948 -13.603 6.271 1.00 10.00 H new ATOM 0 HA3 GLY A 34 -6.332 -15.184 6.707 1.00 10.00 H new ATOM 518 N LEU A 35 -4.975 -15.559 4.472 1.00 10.00 N ATOM 519 CA LEU A 35 -4.064 -15.895 3.386 1.00 10.00 C ATOM 520 C LEU A 35 -2.702 -16.302 3.972 1.00 10.00 C ATOM 521 O LEU A 35 -2.631 -17.326 4.650 1.00 10.00 O ATOM 522 CB LEU A 35 -4.082 -14.857 2.239 1.00 10.00 C ATOM 523 CG LEU A 35 -3.868 -15.438 0.837 1.00 10.00 C ATOM 524 CD1 LEU A 35 -5.008 -16.356 0.369 1.00 10.00 C ATOM 525 CD2 LEU A 35 -3.788 -14.270 -0.141 1.00 10.00 C ATOM 0 H LEU A 35 -5.194 -16.404 4.999 1.00 10.00 H new ATOM 0 HA LEU A 35 -4.410 -16.780 2.851 1.00 10.00 H new ATOM 0 HB2 LEU A 35 -5.038 -14.334 2.257 1.00 10.00 H new ATOM 0 HB3 LEU A 35 -3.308 -14.113 2.430 1.00 10.00 H new ATOM 0 HG LEU A 35 -2.959 -16.038 0.871 1.00 10.00 H new ATOM 0 HD11 LEU A 35 -4.787 -16.730 -0.631 1.00 10.00 H new ATOM 0 HD12 LEU A 35 -5.105 -17.196 1.057 1.00 10.00 H new ATOM 0 HD13 LEU A 35 -5.942 -15.795 0.348 1.00 10.00 H new ATOM 0 HD21 LEU A 35 -3.635 -14.651 -1.151 1.00 10.00 H new ATOM 0 HD22 LEU A 35 -4.717 -13.700 -0.104 1.00 10.00 H new ATOM 0 HD23 LEU A 35 -2.955 -13.623 0.132 1.00 10.00 H new ATOM 537 N PHE A 36 -1.609 -15.641 3.600 1.00 10.00 N ATOM 538 CA PHE A 36 -0.276 -15.692 4.213 1.00 10.00 C ATOM 539 C PHE A 36 0.151 -17.039 4.836 1.00 10.00 C ATOM 540 O PHE A 36 0.367 -17.155 6.038 1.00 10.00 O ATOM 541 CB PHE A 36 -0.094 -14.465 5.120 1.00 10.00 C ATOM 542 CG PHE A 36 -0.306 -13.193 4.316 1.00 10.00 C ATOM 543 CD1 PHE A 36 -1.599 -12.666 4.157 1.00 10.00 C ATOM 544 CD2 PHE A 36 0.750 -12.694 3.533 1.00 10.00 C ATOM 545 CE1 PHE A 36 -1.848 -11.720 3.150 1.00 10.00 C ATOM 546 CE2 PHE A 36 0.493 -11.753 2.519 1.00 10.00 C ATOM 547 CZ PHE A 36 -0.810 -11.286 2.308 1.00 10.00 C ATOM 0 H PHE A 36 -1.629 -15.006 2.802 1.00 10.00 H new ATOM 0 HA PHE A 36 0.448 -15.637 3.400 1.00 10.00 H new ATOM 0 HB2 PHE A 36 -0.802 -14.505 5.948 1.00 10.00 H new ATOM 0 HB3 PHE A 36 0.905 -14.468 5.555 1.00 10.00 H new ATOM 0 HD1 PHE A 36 -2.399 -12.988 4.808 1.00 10.00 H new ATOM 0 HD2 PHE A 36 1.760 -13.034 3.710 1.00 10.00 H new ATOM 0 HE1 PHE A 36 -2.844 -11.323 3.022 1.00 10.00 H new ATOM 0 HE2 PHE A 36 1.302 -11.390 1.902 1.00 10.00 H new ATOM 0 HZ PHE A 36 -1.016 -10.596 1.503 1.00 10.00 H new ATOM 557 N GLY A 37 0.288 -18.054 3.977 1.00 10.00 N ATOM 558 CA GLY A 37 0.816 -19.388 4.269 1.00 10.00 C ATOM 559 C GLY A 37 -0.148 -20.545 3.979 1.00 10.00 C ATOM 560 O GLY A 37 0.267 -21.559 3.429 1.00 10.00 O ATOM 0 H GLY A 37 0.016 -17.959 2.999 1.00 10.00 H new ATOM 0 HA2 GLY A 37 1.725 -19.538 3.687 1.00 10.00 H new ATOM 0 HA3 GLY A 37 1.101 -19.427 5.320 1.00 10.00 H new ATOM 564 N ARG A 38 -1.437 -20.419 4.323 1.00 10.00 N ATOM 565 CA ARG A 38 -2.382 -21.546 4.536 1.00 10.00 C ATOM 566 C ARG A 38 -2.771 -22.477 3.357 1.00 10.00 C ATOM 567 O ARG A 38 -3.670 -23.297 3.521 1.00 10.00 O ATOM 568 CB ARG A 38 -3.600 -21.034 5.328 1.00 10.00 C ATOM 569 CG ARG A 38 -4.920 -20.700 4.604 1.00 10.00 C ATOM 570 CD ARG A 38 -4.891 -19.531 3.623 1.00 10.00 C ATOM 571 NE ARG A 38 -4.342 -19.883 2.300 1.00 10.00 N ATOM 572 CZ ARG A 38 -3.311 -19.365 1.643 1.00 10.00 C ATOM 573 NH1 ARG A 38 -2.440 -18.546 2.172 1.00 10.00 N ATOM 574 NH2 ARG A 38 -3.134 -19.685 0.394 1.00 10.00 N ATOM 0 H ARG A 38 -1.873 -19.508 4.467 1.00 10.00 H new ATOM 0 HA ARG A 38 -1.790 -22.263 5.104 1.00 10.00 H new ATOM 0 HB2 ARG A 38 -3.829 -21.783 6.086 1.00 10.00 H new ATOM 0 HB3 ARG A 38 -3.285 -20.133 5.855 1.00 10.00 H new ATOM 0 HG2 ARG A 38 -5.245 -21.589 4.063 1.00 10.00 H new ATOM 0 HG3 ARG A 38 -5.678 -20.491 5.359 1.00 10.00 H new ATOM 0 HD2 ARG A 38 -5.904 -19.149 3.497 1.00 10.00 H new ATOM 0 HD3 ARG A 38 -4.297 -18.724 4.051 1.00 10.00 H new ATOM 0 HE ARG A 38 -4.828 -20.639 1.817 1.00 10.00 H new ATOM 0 HH11 ARG A 38 -2.530 -18.268 3.149 1.00 10.00 H new ATOM 0 HH12 ARG A 38 -1.671 -18.186 1.608 1.00 10.00 H new ATOM 0 HH21 ARG A 38 -3.782 -20.325 -0.065 1.00 10.00 H new ATOM 0 HH22 ARG A 38 -2.347 -19.296 -0.126 1.00 10.00 H new ATOM 588 N LYS A 39 -2.083 -22.395 2.208 1.00 10.00 N ATOM 589 CA LYS A 39 -2.253 -23.161 0.949 1.00 10.00 C ATOM 590 C LYS A 39 -3.416 -22.653 0.077 1.00 10.00 C ATOM 591 O LYS A 39 -4.408 -22.100 0.555 1.00 10.00 O ATOM 592 CB LYS A 39 -2.389 -24.682 1.185 1.00 10.00 C ATOM 593 CG LYS A 39 -1.270 -25.286 2.052 1.00 10.00 C ATOM 594 CD LYS A 39 -1.523 -26.781 2.293 1.00 10.00 C ATOM 595 CE LYS A 39 -0.460 -27.353 3.236 1.00 10.00 C ATOM 596 NZ LYS A 39 -0.698 -28.791 3.497 1.00 10.00 N ATOM 0 H LYS A 39 -1.317 -21.727 2.122 1.00 10.00 H new ATOM 0 HA LYS A 39 -1.329 -22.986 0.397 1.00 10.00 H new ATOM 0 HB2 LYS A 39 -3.350 -24.881 1.660 1.00 10.00 H new ATOM 0 HB3 LYS A 39 -2.400 -25.189 0.220 1.00 10.00 H new ATOM 0 HG2 LYS A 39 -0.307 -25.149 1.560 1.00 10.00 H new ATOM 0 HG3 LYS A 39 -1.218 -24.762 3.006 1.00 10.00 H new ATOM 0 HD2 LYS A 39 -2.515 -26.925 2.722 1.00 10.00 H new ATOM 0 HD3 LYS A 39 -1.505 -27.318 1.345 1.00 10.00 H new ATOM 0 HE2 LYS A 39 0.529 -27.218 2.798 1.00 10.00 H new ATOM 0 HE3 LYS A 39 -0.470 -26.803 4.177 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 0.036 -29.154 4.138 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 -1.633 -28.914 3.936 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 -0.665 -29.317 2.600 1.00 10.00 H new ATOM 610 N THR A 40 -3.254 -22.761 -1.245 1.00 10.00 N ATOM 611 CA THR A 40 -4.234 -22.340 -2.270 1.00 10.00 C ATOM 612 C THR A 40 -5.451 -23.270 -2.315 1.00 10.00 C ATOM 613 O THR A 40 -6.593 -22.824 -2.383 1.00 10.00 O ATOM 614 CB THR A 40 -3.553 -22.244 -3.650 1.00 10.00 C ATOM 615 OG1 THR A 40 -4.505 -22.150 -4.679 1.00 10.00 O ATOM 616 CG2 THR A 40 -2.631 -23.422 -3.992 1.00 10.00 C ATOM 0 H THR A 40 -2.408 -23.158 -1.654 1.00 10.00 H new ATOM 0 HA THR A 40 -4.603 -21.352 -1.994 1.00 10.00 H new ATOM 0 HB THR A 40 -2.942 -21.344 -3.579 1.00 10.00 H new ATOM 0 HG1 THR A 40 -5.248 -21.581 -4.387 1.00 10.00 H new ATOM 0 HG21 THR A 40 -2.196 -23.269 -4.980 1.00 10.00 H new ATOM 0 HG22 THR A 40 -1.834 -23.487 -3.251 1.00 10.00 H new ATOM 0 HG23 THR A 40 -3.207 -24.348 -3.988 1.00 10.00 H new ATOM 624 N GLY A 41 -5.206 -24.577 -2.193 1.00 10.00 N ATOM 625 CA GLY A 41 -6.209 -25.643 -2.120 1.00 10.00 C ATOM 626 C GLY A 41 -6.967 -25.668 -0.794 1.00 10.00 C ATOM 627 O GLY A 41 -6.960 -26.688 -0.112 1.00 10.00 O ATOM 0 H GLY A 41 -4.254 -24.939 -2.140 1.00 10.00 H new ATOM 0 HA2 GLY A 41 -6.921 -25.519 -2.936 1.00 10.00 H new ATOM 0 HA3 GLY A 41 -5.719 -26.605 -2.269 1.00 10.00 H new ATOM 631 N GLN A 42 -7.601 -24.544 -0.443 1.00 10.00 N ATOM 632 CA GLN A 42 -8.261 -24.345 0.857 1.00 10.00 C ATOM 633 C GLN A 42 -9.705 -23.819 0.766 1.00 10.00 C ATOM 634 O GLN A 42 -10.475 -24.060 1.695 1.00 10.00 O ATOM 635 CB GLN A 42 -7.350 -23.467 1.745 1.00 10.00 C ATOM 636 CG GLN A 42 -7.605 -23.593 3.260 1.00 10.00 C ATOM 637 CD GLN A 42 -8.441 -22.465 3.869 1.00 10.00 C ATOM 638 OE1 GLN A 42 -7.927 -21.531 4.462 1.00 10.00 O ATOM 639 NE2 GLN A 42 -9.754 -22.519 3.794 1.00 10.00 N ATOM 0 H GLN A 42 -7.673 -23.735 -1.060 1.00 10.00 H new ATOM 0 HA GLN A 42 -8.387 -25.323 1.322 1.00 10.00 H new ATOM 0 HB2 GLN A 42 -6.311 -23.727 1.543 1.00 10.00 H new ATOM 0 HB3 GLN A 42 -7.480 -22.424 1.455 1.00 10.00 H new ATOM 0 HG2 GLN A 42 -8.107 -24.541 3.451 1.00 10.00 H new ATOM 0 HG3 GLN A 42 -6.644 -23.631 3.773 1.00 10.00 H new ATOM 0 HE21 GLN A 42 -10.205 -23.291 3.303 1.00 10.00 H new ATOM 0 HE22 GLN A 42 -10.320 -21.789 4.227 1.00 10.00 H new ATOM 648 N ALA A 43 -10.099 -23.162 -0.334 1.00 10.00 N ATOM 649 CA ALA A 43 -11.410 -22.531 -0.542 1.00 10.00 C ATOM 650 C ALA A 43 -12.609 -23.476 -0.242 1.00 10.00 C ATOM 651 O ALA A 43 -12.877 -24.384 -1.036 1.00 10.00 O ATOM 652 CB ALA A 43 -11.451 -21.977 -1.971 1.00 10.00 C ATOM 0 H ALA A 43 -9.484 -23.051 -1.140 1.00 10.00 H new ATOM 0 HA ALA A 43 -11.524 -21.719 0.176 1.00 10.00 H new ATOM 0 HB1 ALA A 43 -12.416 -21.503 -2.150 1.00 10.00 H new ATOM 0 HB2 ALA A 43 -10.656 -21.242 -2.099 1.00 10.00 H new ATOM 0 HB3 ALA A 43 -11.310 -22.792 -2.681 1.00 10.00 H new ATOM 658 N PRO A 44 -13.322 -23.307 0.895 1.00 10.00 N ATOM 659 CA PRO A 44 -14.231 -24.316 1.455 1.00 10.00 C ATOM 660 C PRO A 44 -15.619 -24.365 0.771 1.00 10.00 C ATOM 661 O PRO A 44 -16.651 -24.165 1.410 1.00 10.00 O ATOM 662 CB PRO A 44 -14.294 -23.973 2.952 1.00 10.00 C ATOM 663 CG PRO A 44 -14.196 -22.451 2.950 1.00 10.00 C ATOM 664 CD PRO A 44 -13.178 -22.203 1.839 1.00 10.00 C ATOM 0 HA PRO A 44 -13.864 -25.328 1.281 1.00 10.00 H new ATOM 0 HB2 PRO A 44 -15.222 -24.319 3.408 1.00 10.00 H new ATOM 0 HB3 PRO A 44 -13.476 -24.431 3.507 1.00 10.00 H new ATOM 0 HG2 PRO A 44 -15.156 -21.980 2.737 1.00 10.00 H new ATOM 0 HG3 PRO A 44 -13.856 -22.062 3.910 1.00 10.00 H new ATOM 0 HD2 PRO A 44 -13.362 -21.247 1.349 1.00 10.00 H new ATOM 0 HD3 PRO A 44 -12.166 -22.165 2.241 1.00 10.00 H new ATOM 672 N GLY A 45 -15.645 -24.687 -0.528 1.00 10.00 N ATOM 673 CA GLY A 45 -16.868 -24.892 -1.320 1.00 10.00 C ATOM 674 C GLY A 45 -16.918 -23.994 -2.553 1.00 10.00 C ATOM 675 O GLY A 45 -17.831 -23.183 -2.704 1.00 10.00 O ATOM 0 H GLY A 45 -14.793 -24.816 -1.074 1.00 10.00 H new ATOM 0 HA2 GLY A 45 -16.926 -25.935 -1.631 1.00 10.00 H new ATOM 0 HA3 GLY A 45 -17.740 -24.696 -0.695 1.00 10.00 H new ATOM 679 N PHE A 46 -15.935 -24.151 -3.442 1.00 10.00 N ATOM 680 CA PHE A 46 -15.665 -23.268 -4.575 1.00 10.00 C ATOM 681 C PHE A 46 -15.188 -24.099 -5.780 1.00 10.00 C ATOM 682 O PHE A 46 -14.911 -25.292 -5.645 1.00 10.00 O ATOM 683 CB PHE A 46 -14.609 -22.249 -4.106 1.00 10.00 C ATOM 684 CG PHE A 46 -14.102 -21.268 -5.140 1.00 10.00 C ATOM 685 CD1 PHE A 46 -15.000 -20.458 -5.855 1.00 10.00 C ATOM 686 CD2 PHE A 46 -12.725 -21.185 -5.410 1.00 10.00 C ATOM 687 CE1 PHE A 46 -14.524 -19.620 -6.876 1.00 10.00 C ATOM 688 CE2 PHE A 46 -12.260 -20.329 -6.421 1.00 10.00 C ATOM 689 CZ PHE A 46 -13.163 -19.570 -7.173 1.00 10.00 C ATOM 0 H PHE A 46 -15.279 -24.930 -3.388 1.00 10.00 H new ATOM 0 HA PHE A 46 -16.558 -22.736 -4.902 1.00 10.00 H new ATOM 0 HB2 PHE A 46 -15.030 -21.681 -3.276 1.00 10.00 H new ATOM 0 HB3 PHE A 46 -13.755 -22.801 -3.714 1.00 10.00 H new ATOM 0 HD1 PHE A 46 -16.054 -20.480 -5.620 1.00 10.00 H new ATOM 0 HD2 PHE A 46 -12.026 -21.779 -4.840 1.00 10.00 H new ATOM 0 HE1 PHE A 46 -15.217 -19.010 -7.435 1.00 10.00 H new ATOM 0 HE2 PHE A 46 -11.201 -20.256 -6.619 1.00 10.00 H new ATOM 0 HZ PHE A 46 -12.807 -18.948 -7.981 1.00 10.00 H new ATOM 699 N THR A 47 -15.076 -23.478 -6.959 1.00 10.00 N ATOM 700 CA THR A 47 -14.549 -24.122 -8.166 1.00 10.00 C ATOM 701 C THR A 47 -13.926 -23.092 -9.107 1.00 10.00 C ATOM 702 O THR A 47 -14.235 -21.903 -9.070 1.00 10.00 O ATOM 703 CB THR A 47 -15.622 -24.961 -8.877 1.00 10.00 C ATOM 704 OG1 THR A 47 -15.005 -25.716 -9.895 1.00 10.00 O ATOM 705 CG2 THR A 47 -16.750 -24.143 -9.512 1.00 10.00 C ATOM 0 H THR A 47 -15.351 -22.506 -7.103 1.00 10.00 H new ATOM 0 HA THR A 47 -13.762 -24.809 -7.857 1.00 10.00 H new ATOM 0 HB THR A 47 -16.078 -25.583 -8.107 1.00 10.00 H new ATOM 0 HG1 THR A 47 -15.680 -26.257 -10.355 1.00 10.00 H new ATOM 0 HG21 THR A 47 -17.462 -24.815 -9.991 1.00 10.00 H new ATOM 0 HG22 THR A 47 -17.259 -23.565 -8.741 1.00 10.00 H new ATOM 0 HG23 THR A 47 -16.333 -23.465 -10.257 1.00 10.00 H new ATOM 713 N TYR A 48 -12.978 -23.570 -9.905 1.00 10.00 N ATOM 714 CA TYR A 48 -11.858 -22.785 -10.409 1.00 10.00 C ATOM 715 C TYR A 48 -11.328 -23.389 -11.719 1.00 10.00 C ATOM 716 O TYR A 48 -12.034 -23.314 -12.725 1.00 10.00 O ATOM 717 CB TYR A 48 -10.823 -22.583 -9.279 1.00 10.00 C ATOM 718 CG TYR A 48 -10.696 -23.618 -8.160 1.00 10.00 C ATOM 719 CD1 TYR A 48 -10.842 -25.006 -8.385 1.00 10.00 C ATOM 720 CD2 TYR A 48 -10.440 -23.159 -6.853 1.00 10.00 C ATOM 721 CE1 TYR A 48 -10.758 -25.913 -7.311 1.00 10.00 C ATOM 722 CE2 TYR A 48 -10.325 -24.058 -5.782 1.00 10.00 C ATOM 723 CZ TYR A 48 -10.492 -25.437 -6.009 1.00 10.00 C ATOM 724 OH TYR A 48 -10.272 -26.296 -4.981 1.00 10.00 O ATOM 0 H TYR A 48 -12.967 -24.538 -10.227 1.00 10.00 H new ATOM 0 HA TYR A 48 -12.167 -21.779 -10.691 1.00 10.00 H new ATOM 0 HB2 TYR A 48 -9.844 -22.493 -9.749 1.00 10.00 H new ATOM 0 HB3 TYR A 48 -11.040 -21.624 -8.809 1.00 10.00 H new ATOM 0 HD1 TYR A 48 -11.019 -25.373 -9.385 1.00 10.00 H new ATOM 0 HD2 TYR A 48 -10.331 -22.100 -6.673 1.00 10.00 H new ATOM 0 HE1 TYR A 48 -10.897 -26.970 -7.483 1.00 10.00 H new ATOM 0 HE2 TYR A 48 -10.109 -23.694 -4.788 1.00 10.00 H new ATOM 0 HH TYR A 48 -10.105 -25.788 -4.160 1.00 10.00 H new ATOM 734 N THR A 49 -10.176 -24.070 -11.703 1.00 10.00 N ATOM 735 CA THR A 49 -9.661 -24.869 -12.840 1.00 10.00 C ATOM 736 C THR A 49 -8.981 -26.168 -12.395 1.00 10.00 C ATOM 737 O THR A 49 -8.408 -26.883 -13.217 1.00 10.00 O ATOM 738 CB THR A 49 -8.655 -24.086 -13.700 1.00 10.00 C ATOM 739 OG1 THR A 49 -7.484 -23.802 -12.972 1.00 10.00 O ATOM 740 CG2 THR A 49 -9.222 -22.782 -14.259 1.00 10.00 C ATOM 0 H THR A 49 -9.560 -24.087 -10.890 1.00 10.00 H new ATOM 0 HA THR A 49 -10.547 -25.106 -13.429 1.00 10.00 H new ATOM 0 HB THR A 49 -8.425 -24.735 -14.545 1.00 10.00 H new ATOM 0 HG1 THR A 49 -6.949 -23.140 -13.458 1.00 10.00 H new ATOM 0 HG21 THR A 49 -8.460 -22.280 -14.856 1.00 10.00 H new ATOM 0 HG22 THR A 49 -10.088 -23.000 -14.885 1.00 10.00 H new ATOM 0 HG23 THR A 49 -9.523 -22.134 -13.436 1.00 10.00 H new ATOM 748 N ASP A 50 -9.103 -26.513 -11.110 1.00 10.00 N ATOM 749 CA ASP A 50 -8.284 -27.424 -10.307 1.00 10.00 C ATOM 750 C ASP A 50 -6.762 -27.190 -10.404 1.00 10.00 C ATOM 751 O ASP A 50 -6.117 -27.011 -9.368 1.00 10.00 O ATOM 752 CB ASP A 50 -8.679 -28.874 -10.649 1.00 10.00 C ATOM 753 CG ASP A 50 -8.419 -29.794 -9.464 1.00 10.00 C ATOM 754 OD1 ASP A 50 -7.236 -30.004 -9.112 1.00 10.00 O ATOM 755 OD2 ASP A 50 -9.396 -30.151 -8.766 1.00 10.00 O ATOM 0 H ASP A 50 -9.858 -26.119 -10.548 1.00 10.00 H new ATOM 0 HA ASP A 50 -8.499 -27.214 -9.259 1.00 10.00 H new ATOM 0 HB2 ASP A 50 -9.733 -28.914 -10.923 1.00 10.00 H new ATOM 0 HB3 ASP A 50 -8.111 -29.217 -11.514 1.00 10.00 H new ATOM 760 N ALA A 51 -6.198 -27.095 -11.614 1.00 10.00 N ATOM 761 CA ALA A 51 -4.793 -26.813 -11.904 1.00 10.00 C ATOM 762 C ALA A 51 -4.223 -25.654 -11.069 1.00 10.00 C ATOM 763 O ALA A 51 -3.116 -25.773 -10.542 1.00 10.00 O ATOM 764 CB ALA A 51 -4.650 -26.541 -13.407 1.00 10.00 C ATOM 0 H ALA A 51 -6.746 -27.221 -12.465 1.00 10.00 H new ATOM 0 HA ALA A 51 -4.205 -27.686 -11.622 1.00 10.00 H new ATOM 0 HB1 ALA A 51 -3.607 -26.329 -13.641 1.00 10.00 H new ATOM 0 HB2 ALA A 51 -4.976 -27.417 -13.968 1.00 10.00 H new ATOM 0 HB3 ALA A 51 -5.265 -25.684 -13.682 1.00 10.00 H new ATOM 770 N ASN A 52 -5.003 -24.577 -10.887 1.00 10.00 N ATOM 771 CA ASN A 52 -4.677 -23.424 -10.049 1.00 10.00 C ATOM 772 C ASN A 52 -4.185 -23.825 -8.645 1.00 10.00 C ATOM 773 O ASN A 52 -3.046 -23.531 -8.277 1.00 10.00 O ATOM 774 CB ASN A 52 -5.897 -22.473 -10.027 1.00 10.00 C ATOM 775 CG ASN A 52 -7.142 -23.067 -9.365 1.00 10.00 C ATOM 776 OD1 ASN A 52 -7.819 -23.941 -9.890 1.00 10.00 O ATOM 777 ND2 ASN A 52 -7.443 -22.679 -8.141 1.00 10.00 N ATOM 0 H ASN A 52 -5.913 -24.487 -11.340 1.00 10.00 H new ATOM 0 HA ASN A 52 -3.829 -22.892 -10.481 1.00 10.00 H new ATOM 0 HB2 ASN A 52 -5.621 -21.558 -9.502 1.00 10.00 H new ATOM 0 HB3 ASN A 52 -6.143 -22.191 -11.051 1.00 10.00 H new ATOM 0 HD21 ASN A 52 -8.228 -23.106 -7.649 1.00 10.00 H new ATOM 0 HD22 ASN A 52 -6.891 -21.952 -7.686 1.00 10.00 H new ATOM 784 N LYS A 53 -5.030 -24.520 -7.875 1.00 10.00 N ATOM 785 CA LYS A 53 -4.714 -24.993 -6.530 1.00 10.00 C ATOM 786 C LYS A 53 -3.778 -26.205 -6.550 1.00 10.00 C ATOM 787 O LYS A 53 -2.937 -26.335 -5.666 1.00 10.00 O ATOM 788 CB LYS A 53 -5.971 -25.161 -5.682 1.00 10.00 C ATOM 789 CG LYS A 53 -7.151 -25.943 -6.247 1.00 10.00 C ATOM 790 CD LYS A 53 -6.939 -27.467 -6.181 1.00 10.00 C ATOM 791 CE LYS A 53 -8.241 -28.238 -6.373 1.00 10.00 C ATOM 792 NZ LYS A 53 -7.985 -29.679 -6.581 1.00 10.00 N ATOM 0 H LYS A 53 -5.970 -24.772 -8.179 1.00 10.00 H new ATOM 0 HA LYS A 53 -4.139 -24.219 -6.023 1.00 10.00 H new ATOM 0 HB2 LYS A 53 -5.676 -25.642 -4.749 1.00 10.00 H new ATOM 0 HB3 LYS A 53 -6.330 -24.164 -5.427 1.00 10.00 H new ATOM 0 HG2 LYS A 53 -8.053 -25.681 -5.694 1.00 10.00 H new ATOM 0 HG3 LYS A 53 -7.315 -25.647 -7.283 1.00 10.00 H new ATOM 0 HD2 LYS A 53 -6.225 -27.766 -6.948 1.00 10.00 H new ATOM 0 HD3 LYS A 53 -6.501 -27.730 -5.218 1.00 10.00 H new ATOM 0 HE2 LYS A 53 -8.879 -28.102 -5.500 1.00 10.00 H new ATOM 0 HE3 LYS A 53 -8.782 -27.835 -7.229 1.00 10.00 H new ATOM 0 HZ1 LYS A 53 -8.798 -30.110 -7.065 1.00 10.00 H new ATOM 0 HZ2 LYS A 53 -7.132 -29.800 -7.163 1.00 10.00 H new ATOM 0 HZ3 LYS A 53 -7.845 -30.143 -5.661 1.00 10.00 H new ATOM 806 N ASN A 54 -3.901 -27.074 -7.562 1.00 10.00 N ATOM 807 CA ASN A 54 -3.101 -28.290 -7.710 1.00 10.00 C ATOM 808 C ASN A 54 -1.611 -28.015 -7.977 1.00 10.00 C ATOM 809 O ASN A 54 -0.772 -28.785 -7.517 1.00 10.00 O ATOM 810 CB ASN A 54 -3.727 -29.184 -8.790 1.00 10.00 C ATOM 811 CG ASN A 54 -3.249 -30.622 -8.667 1.00 10.00 C ATOM 812 OD1 ASN A 54 -3.516 -31.296 -7.686 1.00 10.00 O ATOM 813 ND2 ASN A 54 -2.534 -31.137 -9.646 1.00 10.00 N ATOM 0 H ASN A 54 -4.576 -26.945 -8.316 1.00 10.00 H new ATOM 0 HA ASN A 54 -3.118 -28.816 -6.756 1.00 10.00 H new ATOM 0 HB2 ASN A 54 -4.813 -29.152 -8.706 1.00 10.00 H new ATOM 0 HB3 ASN A 54 -3.472 -28.798 -9.777 1.00 10.00 H new ATOM 0 HD21 ASN A 54 -2.203 -32.100 -9.584 1.00 10.00 H new ATOM 0 HD22 ASN A 54 -2.311 -30.573 -10.466 1.00 10.00 H new ATOM 820 N LYS A 55 -1.268 -26.923 -8.683 1.00 10.00 N ATOM 821 CA LYS A 55 0.123 -26.474 -8.860 1.00 10.00 C ATOM 822 C LYS A 55 0.771 -26.193 -7.497 1.00 10.00 C ATOM 823 O LYS A 55 1.862 -26.692 -7.229 1.00 10.00 O ATOM 824 CB LYS A 55 0.164 -25.259 -9.813 1.00 10.00 C ATOM 825 CG LYS A 55 1.542 -24.931 -10.427 1.00 10.00 C ATOM 826 CD LYS A 55 2.597 -24.371 -9.457 1.00 10.00 C ATOM 827 CE LYS A 55 3.662 -25.421 -9.116 1.00 10.00 C ATOM 828 NZ LYS A 55 4.334 -25.109 -7.834 1.00 10.00 N ATOM 0 H LYS A 55 -1.951 -26.325 -9.148 1.00 10.00 H new ATOM 0 HA LYS A 55 0.713 -27.264 -9.325 1.00 10.00 H new ATOM 0 HB2 LYS A 55 -0.542 -25.434 -10.625 1.00 10.00 H new ATOM 0 HB3 LYS A 55 -0.188 -24.383 -9.269 1.00 10.00 H new ATOM 0 HG2 LYS A 55 1.940 -25.838 -10.881 1.00 10.00 H new ATOM 0 HG3 LYS A 55 1.397 -24.209 -11.231 1.00 10.00 H new ATOM 0 HD2 LYS A 55 3.075 -23.498 -9.902 1.00 10.00 H new ATOM 0 HD3 LYS A 55 2.109 -24.036 -8.542 1.00 10.00 H new ATOM 0 HE2 LYS A 55 3.199 -26.406 -9.056 1.00 10.00 H new ATOM 0 HE3 LYS A 55 4.402 -25.465 -9.915 1.00 10.00 H new ATOM 0 HZ1 LYS A 55 4.962 -25.895 -7.571 1.00 10.00 H new ATOM 0 HZ2 LYS A 55 4.893 -24.238 -7.938 1.00 10.00 H new ATOM 0 HZ3 LYS A 55 3.619 -24.974 -7.091 1.00 10.00 H new ATOM 842 N GLY A 56 0.105 -25.404 -6.646 1.00 10.00 N ATOM 843 CA GLY A 56 0.543 -25.147 -5.270 1.00 10.00 C ATOM 844 C GLY A 56 1.674 -24.113 -5.168 1.00 10.00 C ATOM 845 O GLY A 56 2.708 -24.246 -5.823 1.00 10.00 O ATOM 0 H GLY A 56 -0.759 -24.923 -6.895 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -0.309 -24.800 -4.685 1.00 10.00 H new ATOM 0 HA3 GLY A 56 0.877 -26.083 -4.823 1.00 10.00 H new ATOM 849 N ILE A 57 1.482 -23.102 -4.312 1.00 10.00 N ATOM 850 CA ILE A 57 2.214 -21.814 -4.276 1.00 10.00 C ATOM 851 C ILE A 57 1.881 -20.980 -3.009 1.00 10.00 C ATOM 852 O ILE A 57 2.275 -19.824 -2.918 1.00 10.00 O ATOM 853 CB ILE A 57 1.956 -20.953 -5.558 1.00 10.00 C ATOM 854 CG1 ILE A 57 0.540 -21.070 -6.158 1.00 10.00 C ATOM 855 CG2 ILE A 57 2.984 -21.213 -6.672 1.00 10.00 C ATOM 856 CD1 ILE A 57 -0.556 -20.794 -5.131 1.00 10.00 C ATOM 0 H ILE A 57 0.773 -23.156 -3.581 1.00 10.00 H new ATOM 0 HA ILE A 57 3.271 -22.078 -4.243 1.00 10.00 H new ATOM 0 HB ILE A 57 2.065 -19.936 -5.181 1.00 10.00 H new ATOM 0 HG12 ILE A 57 0.441 -20.369 -6.987 1.00 10.00 H new ATOM 0 HG13 ILE A 57 0.405 -22.071 -6.569 1.00 10.00 H new ATOM 0 HG21 ILE A 57 2.752 -20.587 -7.534 1.00 10.00 H new ATOM 0 HG22 ILE A 57 3.983 -20.974 -6.308 1.00 10.00 H new ATOM 0 HG23 ILE A 57 2.946 -22.262 -6.965 1.00 10.00 H new ATOM 0 HD11 ILE A 57 -1.532 -20.890 -5.606 1.00 10.00 H new ATOM 0 HD12 ILE A 57 -0.478 -21.511 -4.314 1.00 10.00 H new ATOM 0 HD13 ILE A 57 -0.441 -19.784 -4.739 1.00 10.00 H new ATOM 868 N THR A 58 1.227 -21.579 -1.996 1.00 10.00 N ATOM 869 CA THR A 58 1.323 -21.194 -0.568 1.00 10.00 C ATOM 870 C THR A 58 1.243 -19.674 -0.315 1.00 10.00 C ATOM 871 O THR A 58 2.132 -19.102 0.310 1.00 10.00 O ATOM 872 CB THR A 58 2.625 -21.825 -0.017 1.00 10.00 C ATOM 873 OG1 THR A 58 2.722 -23.164 -0.465 1.00 10.00 O ATOM 874 CG2 THR A 58 2.712 -21.923 1.505 1.00 10.00 C ATOM 0 H THR A 58 0.598 -22.367 -2.149 1.00 10.00 H new ATOM 0 HA THR A 58 0.452 -21.576 -0.035 1.00 10.00 H new ATOM 0 HB THR A 58 3.413 -21.161 -0.374 1.00 10.00 H new ATOM 0 HG1 THR A 58 3.546 -23.566 -0.119 1.00 10.00 H new ATOM 0 HG21 THR A 58 3.661 -22.379 1.787 1.00 10.00 H new ATOM 0 HG22 THR A 58 2.646 -20.925 1.938 1.00 10.00 H new ATOM 0 HG23 THR A 58 1.891 -22.535 1.878 1.00 10.00 H new ATOM 882 N TRP A 59 0.159 -19.027 -0.775 1.00 10.00 N ATOM 883 CA TRP A 59 0.067 -17.564 -0.938 1.00 10.00 C ATOM 884 C TRP A 59 0.440 -16.766 0.315 1.00 10.00 C ATOM 885 O TRP A 59 -0.046 -17.107 1.399 1.00 10.00 O ATOM 886 CB TRP A 59 -1.377 -17.185 -1.269 1.00 10.00 C ATOM 887 CG TRP A 59 -1.946 -17.707 -2.542 1.00 10.00 C ATOM 888 CD1 TRP A 59 -3.082 -18.428 -2.651 1.00 10.00 C ATOM 889 CD2 TRP A 59 -1.464 -17.520 -3.904 1.00 10.00 C ATOM 890 NE1 TRP A 59 -3.283 -18.774 -3.964 1.00 10.00 N ATOM 891 CE2 TRP A 59 -2.361 -18.181 -4.793 1.00 10.00 C ATOM 892 CE3 TRP A 59 -0.362 -16.857 -4.480 1.00 10.00 C ATOM 893 CZ2 TRP A 59 -2.178 -18.195 -6.181 1.00 10.00 C ATOM 894 CZ3 TRP A 59 -0.131 -16.918 -5.864 1.00 10.00 C ATOM 895 CH2 TRP A 59 -1.029 -17.591 -6.710 1.00 10.00 C ATOM 0 H TRP A 59 -0.694 -19.514 -1.049 1.00 10.00 H new ATOM 0 HA TRP A 59 0.776 -17.316 -1.728 1.00 10.00 H new ATOM 0 HB2 TRP A 59 -2.011 -17.527 -0.451 1.00 10.00 H new ATOM 0 HB3 TRP A 59 -1.444 -16.097 -1.291 1.00 10.00 H new ATOM 0 HD1 TRP A 59 -3.733 -18.692 -1.831 1.00 10.00 H new ATOM 0 HE1 TRP A 59 -4.026 -19.395 -4.285 1.00 10.00 H new ATOM 0 HE3 TRP A 59 0.312 -16.296 -3.850 1.00 10.00 H new ATOM 0 HZ2 TRP A 59 -2.906 -18.661 -6.829 1.00 10.00 H new ATOM 0 HZ3 TRP A 59 0.745 -16.443 -6.282 1.00 10.00 H new ATOM 0 HH2 TRP A 59 -0.833 -17.643 -7.771 1.00 10.00 H new ATOM 906 N LYS A 60 1.233 -15.695 0.123 1.00 10.00 N ATOM 907 CA LYS A 60 1.960 -14.853 1.088 1.00 10.00 C ATOM 908 C LYS A 60 2.694 -13.698 0.359 1.00 10.00 C ATOM 909 O LYS A 60 2.357 -13.381 -0.781 1.00 10.00 O ATOM 910 CB LYS A 60 2.850 -15.716 2.019 1.00 10.00 C ATOM 911 CG LYS A 60 3.949 -16.536 1.324 1.00 10.00 C ATOM 912 CD LYS A 60 4.390 -17.740 2.172 1.00 10.00 C ATOM 913 CE LYS A 60 5.122 -18.800 1.338 1.00 10.00 C ATOM 914 NZ LYS A 60 6.429 -18.330 0.827 1.00 10.00 N ATOM 0 H LYS A 60 1.398 -15.361 -0.827 1.00 10.00 H new ATOM 0 HA LYS A 60 1.253 -14.364 1.758 1.00 10.00 H new ATOM 0 HB2 LYS A 60 3.321 -15.060 2.751 1.00 10.00 H new ATOM 0 HB3 LYS A 60 2.207 -16.401 2.572 1.00 10.00 H new ATOM 0 HG2 LYS A 60 3.584 -16.886 0.358 1.00 10.00 H new ATOM 0 HG3 LYS A 60 4.809 -15.896 1.127 1.00 10.00 H new ATOM 0 HD2 LYS A 60 5.043 -17.397 2.975 1.00 10.00 H new ATOM 0 HD3 LYS A 60 3.516 -18.190 2.643 1.00 10.00 H new ATOM 0 HE2 LYS A 60 5.275 -19.692 1.946 1.00 10.00 H new ATOM 0 HE3 LYS A 60 4.493 -19.092 0.497 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 6.877 -19.087 0.272 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 6.286 -17.496 0.223 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 7.044 -18.077 1.627 1.00 10.00 H new ATOM 928 N GLU A 61 3.604 -12.991 1.041 1.00 10.00 N ATOM 929 CA GLU A 61 4.128 -11.638 0.742 1.00 10.00 C ATOM 930 C GLU A 61 5.020 -11.499 -0.518 1.00 10.00 C ATOM 931 O GLU A 61 5.935 -10.677 -0.542 1.00 10.00 O ATOM 932 CB GLU A 61 4.849 -11.085 1.995 1.00 10.00 C ATOM 933 CG GLU A 61 3.949 -11.095 3.236 1.00 10.00 C ATOM 934 CD GLU A 61 4.507 -10.274 4.398 1.00 10.00 C ATOM 935 OE1 GLU A 61 4.355 -9.031 4.373 1.00 10.00 O ATOM 936 OE2 GLU A 61 4.940 -10.862 5.417 1.00 10.00 O ATOM 0 H GLU A 61 4.031 -13.374 1.884 1.00 10.00 H new ATOM 0 HA GLU A 61 3.251 -11.043 0.489 1.00 10.00 H new ATOM 0 HB2 GLU A 61 5.741 -11.681 2.191 1.00 10.00 H new ATOM 0 HB3 GLU A 61 5.183 -10.066 1.799 1.00 10.00 H new ATOM 0 HG2 GLU A 61 2.967 -10.708 2.966 1.00 10.00 H new ATOM 0 HG3 GLU A 61 3.807 -12.125 3.564 1.00 10.00 H new ATOM 943 N GLU A 62 4.781 -12.276 -1.579 1.00 10.00 N ATOM 944 CA GLU A 62 5.677 -12.390 -2.740 1.00 10.00 C ATOM 945 C GLU A 62 4.957 -12.989 -3.960 1.00 10.00 C ATOM 946 O GLU A 62 4.824 -12.362 -5.009 1.00 10.00 O ATOM 947 CB GLU A 62 6.940 -13.223 -2.387 1.00 10.00 C ATOM 948 CG GLU A 62 6.935 -14.137 -1.136 1.00 10.00 C ATOM 949 CD GLU A 62 6.029 -15.378 -1.200 1.00 10.00 C ATOM 950 OE1 GLU A 62 4.788 -15.247 -1.342 1.00 10.00 O ATOM 951 OE2 GLU A 62 6.569 -16.494 -1.044 1.00 10.00 O ATOM 0 H GLU A 62 3.945 -12.855 -1.659 1.00 10.00 H new ATOM 0 HA GLU A 62 5.992 -11.381 -3.006 1.00 10.00 H new ATOM 0 HB2 GLU A 62 7.166 -13.852 -3.248 1.00 10.00 H new ATOM 0 HB3 GLU A 62 7.769 -12.525 -2.276 1.00 10.00 H new ATOM 0 HG2 GLU A 62 7.957 -14.469 -0.951 1.00 10.00 H new ATOM 0 HG3 GLU A 62 6.634 -13.538 -0.276 1.00 10.00 H new ATOM 958 N THR A 63 4.420 -14.184 -3.771 1.00 10.00 N ATOM 959 CA THR A 63 3.644 -15.037 -4.667 1.00 10.00 C ATOM 960 C THR A 63 2.448 -14.293 -5.249 1.00 10.00 C ATOM 961 O THR A 63 2.261 -14.342 -6.461 1.00 10.00 O ATOM 962 CB THR A 63 3.188 -16.286 -3.869 1.00 10.00 C ATOM 963 OG1 THR A 63 2.727 -15.925 -2.573 1.00 10.00 O ATOM 964 CG2 THR A 63 4.297 -17.320 -3.662 1.00 10.00 C ATOM 0 H THR A 63 4.532 -14.641 -2.866 1.00 10.00 H new ATOM 0 HA THR A 63 4.263 -15.339 -5.511 1.00 10.00 H new ATOM 0 HB THR A 63 2.395 -16.724 -4.476 1.00 10.00 H new ATOM 0 HG1 THR A 63 3.475 -15.954 -1.940 1.00 10.00 H new ATOM 0 HG21 THR A 63 3.905 -18.165 -3.096 1.00 10.00 H new ATOM 0 HG22 THR A 63 4.657 -17.667 -4.631 1.00 10.00 H new ATOM 0 HG23 THR A 63 5.120 -16.865 -3.111 1.00 10.00 H new ATOM 972 N LEU A 64 1.690 -13.535 -4.446 1.00 10.00 N ATOM 973 CA LEU A 64 0.643 -12.646 -4.959 1.00 10.00 C ATOM 974 C LEU A 64 1.185 -11.501 -5.813 1.00 10.00 C ATOM 975 O LEU A 64 0.475 -11.069 -6.711 1.00 10.00 O ATOM 976 CB LEU A 64 -0.172 -11.982 -3.840 1.00 10.00 C ATOM 977 CG LEU A 64 -1.212 -12.856 -3.127 1.00 10.00 C ATOM 978 CD1 LEU A 64 -0.569 -13.534 -1.921 1.00 10.00 C ATOM 979 CD2 LEU A 64 -2.346 -11.951 -2.626 1.00 10.00 C ATOM 0 H LEU A 64 1.785 -13.521 -3.431 1.00 10.00 H new ATOM 0 HA LEU A 64 0.022 -13.311 -5.559 1.00 10.00 H new ATOM 0 HB2 LEU A 64 0.524 -11.604 -3.091 1.00 10.00 H new ATOM 0 HB3 LEU A 64 -0.686 -11.118 -4.261 1.00 10.00 H new ATOM 0 HG LEU A 64 -1.593 -13.611 -3.815 1.00 10.00 H new ATOM 0 HD11 LEU A 64 -1.309 -14.155 -1.415 1.00 10.00 H new ATOM 0 HD12 LEU A 64 0.261 -14.157 -2.254 1.00 10.00 H new ATOM 0 HD13 LEU A 64 -0.199 -12.775 -1.231 1.00 10.00 H new ATOM 0 HD21 LEU A 64 -3.096 -12.556 -2.116 1.00 10.00 H new ATOM 0 HD22 LEU A 64 -1.943 -11.212 -1.933 1.00 10.00 H new ATOM 0 HD23 LEU A 64 -2.806 -11.441 -3.473 1.00 10.00 H new ATOM 991 N MET A 65 2.379 -10.966 -5.538 1.00 10.00 N ATOM 992 CA MET A 65 2.915 -9.860 -6.338 1.00 10.00 C ATOM 993 C MET A 65 3.422 -10.335 -7.694 1.00 10.00 C ATOM 994 O MET A 65 3.359 -9.566 -8.644 1.00 10.00 O ATOM 995 CB MET A 65 3.984 -9.074 -5.569 1.00 10.00 C ATOM 996 CG MET A 65 3.334 -8.279 -4.434 1.00 10.00 C ATOM 997 SD MET A 65 4.440 -7.145 -3.559 1.00 10.00 S ATOM 998 CE MET A 65 5.307 -8.320 -2.486 1.00 10.00 C ATOM 0 H MET A 65 2.985 -11.275 -4.778 1.00 10.00 H new ATOM 0 HA MET A 65 2.091 -9.174 -6.533 1.00 10.00 H new ATOM 0 HB2 MET A 65 4.729 -9.758 -5.164 1.00 10.00 H new ATOM 0 HB3 MET A 65 4.506 -8.397 -6.245 1.00 10.00 H new ATOM 0 HG2 MET A 65 2.501 -7.706 -4.843 1.00 10.00 H new ATOM 0 HG3 MET A 65 2.915 -8.981 -3.713 1.00 10.00 H new ATOM 0 HE1 MET A 65 6.020 -7.783 -1.860 1.00 10.00 H new ATOM 0 HE2 MET A 65 4.585 -8.836 -1.853 1.00 10.00 H new ATOM 0 HE3 MET A 65 5.838 -9.048 -3.099 1.00 10.00 H new ATOM 1008 N GLU A 66 3.828 -11.602 -7.825 1.00 10.00 N ATOM 1009 CA GLU A 66 3.955 -12.216 -9.146 1.00 10.00 C ATOM 1010 C GLU A 66 2.581 -12.579 -9.740 1.00 10.00 C ATOM 1011 O GLU A 66 2.295 -12.247 -10.892 1.00 10.00 O ATOM 1012 CB GLU A 66 4.915 -13.422 -9.097 1.00 10.00 C ATOM 1013 CG GLU A 66 5.703 -13.441 -10.423 1.00 10.00 C ATOM 1014 CD GLU A 66 6.774 -14.531 -10.529 1.00 10.00 C ATOM 1015 OE1 GLU A 66 7.516 -14.744 -9.548 1.00 10.00 O ATOM 1016 OE2 GLU A 66 6.848 -15.154 -11.616 1.00 10.00 O ATOM 0 H GLU A 66 4.070 -12.212 -7.045 1.00 10.00 H new ATOM 0 HA GLU A 66 4.393 -11.481 -9.821 1.00 10.00 H new ATOM 0 HB2 GLU A 66 5.594 -13.337 -8.249 1.00 10.00 H new ATOM 0 HB3 GLU A 66 4.358 -14.350 -8.968 1.00 10.00 H new ATOM 0 HG2 GLU A 66 4.998 -13.566 -11.245 1.00 10.00 H new ATOM 0 HG3 GLU A 66 6.180 -12.470 -10.557 1.00 10.00 H new ATOM 1023 N TYR A 67 1.711 -13.231 -8.955 1.00 10.00 N ATOM 1024 CA TYR A 67 0.435 -13.748 -9.444 1.00 10.00 C ATOM 1025 C TYR A 67 -0.549 -12.663 -9.882 1.00 10.00 C ATOM 1026 O TYR A 67 -1.160 -12.813 -10.928 1.00 10.00 O ATOM 1027 CB TYR A 67 -0.183 -14.680 -8.409 1.00 10.00 C ATOM 1028 CG TYR A 67 -1.600 -15.133 -8.713 1.00 10.00 C ATOM 1029 CD1 TYR A 67 -1.837 -16.139 -9.671 1.00 10.00 C ATOM 1030 CD2 TYR A 67 -2.682 -14.555 -8.025 1.00 10.00 C ATOM 1031 CE1 TYR A 67 -3.151 -16.568 -9.933 1.00 10.00 C ATOM 1032 CE2 TYR A 67 -4.001 -14.957 -8.307 1.00 10.00 C ATOM 1033 CZ TYR A 67 -4.238 -15.972 -9.261 1.00 10.00 C ATOM 1034 OH TYR A 67 -5.507 -16.370 -9.550 1.00 10.00 O ATOM 0 H TYR A 67 1.877 -13.412 -7.965 1.00 10.00 H new ATOM 0 HA TYR A 67 0.654 -14.311 -10.351 1.00 10.00 H new ATOM 0 HB2 TYR A 67 0.451 -15.562 -8.313 1.00 10.00 H new ATOM 0 HB3 TYR A 67 -0.179 -14.177 -7.442 1.00 10.00 H new ATOM 0 HD1 TYR A 67 -1.009 -16.581 -10.205 1.00 10.00 H new ATOM 0 HD2 TYR A 67 -2.500 -13.798 -7.276 1.00 10.00 H new ATOM 0 HE1 TYR A 67 -3.328 -17.356 -10.651 1.00 10.00 H new ATOM 0 HE2 TYR A 67 -4.830 -14.491 -7.795 1.00 10.00 H new ATOM 0 HH TYR A 67 -6.069 -15.583 -9.706 1.00 10.00 H new ATOM 1044 N LEU A 68 -0.715 -11.566 -9.142 1.00 10.00 N ATOM 1045 CA LEU A 68 -1.595 -10.481 -9.586 1.00 10.00 C ATOM 1046 C LEU A 68 -1.082 -9.827 -10.864 1.00 10.00 C ATOM 1047 O LEU A 68 -1.880 -9.532 -11.749 1.00 10.00 O ATOM 1048 CB LEU A 68 -1.793 -9.431 -8.472 1.00 10.00 C ATOM 1049 CG LEU A 68 -3.071 -9.625 -7.638 1.00 10.00 C ATOM 1050 CD1 LEU A 68 -4.271 -9.108 -8.432 1.00 10.00 C ATOM 1051 CD2 LEU A 68 -3.299 -11.059 -7.157 1.00 10.00 C ATOM 0 H LEU A 68 -0.259 -11.405 -8.244 1.00 10.00 H new ATOM 0 HA LEU A 68 -2.566 -10.924 -9.810 1.00 10.00 H new ATOM 0 HB2 LEU A 68 -0.931 -9.459 -7.806 1.00 10.00 H new ATOM 0 HB3 LEU A 68 -1.815 -8.439 -8.924 1.00 10.00 H new ATOM 0 HG LEU A 68 -2.945 -9.046 -6.723 1.00 10.00 H new ATOM 0 HD11 LEU A 68 -5.180 -9.243 -7.846 1.00 10.00 H new ATOM 0 HD12 LEU A 68 -4.134 -8.049 -8.651 1.00 10.00 H new ATOM 0 HD13 LEU A 68 -4.356 -9.663 -9.366 1.00 10.00 H new ATOM 0 HD21 LEU A 68 -4.221 -11.106 -6.577 1.00 10.00 H new ATOM 0 HD22 LEU A 68 -3.377 -11.723 -8.018 1.00 10.00 H new ATOM 0 HD23 LEU A 68 -2.462 -11.371 -6.533 1.00 10.00 H new ATOM 1063 N GLU A 69 0.230 -9.606 -10.969 1.00 10.00 N ATOM 1064 CA GLU A 69 0.836 -8.969 -12.129 1.00 10.00 C ATOM 1065 C GLU A 69 0.785 -9.825 -13.409 1.00 10.00 C ATOM 1066 O GLU A 69 0.636 -9.259 -14.490 1.00 10.00 O ATOM 1067 CB GLU A 69 2.253 -8.544 -11.746 1.00 10.00 C ATOM 1068 CG GLU A 69 2.282 -7.445 -10.656 1.00 10.00 C ATOM 1069 CD GLU A 69 1.572 -6.121 -10.987 1.00 10.00 C ATOM 1070 OE1 GLU A 69 1.240 -5.845 -12.165 1.00 10.00 O ATOM 1071 OE2 GLU A 69 1.384 -5.295 -10.059 1.00 10.00 O ATOM 0 H GLU A 69 0.901 -9.867 -10.246 1.00 10.00 H new ATOM 0 HA GLU A 69 0.249 -8.090 -12.395 1.00 10.00 H new ATOM 0 HB2 GLU A 69 2.804 -9.415 -11.391 1.00 10.00 H new ATOM 0 HB3 GLU A 69 2.770 -8.181 -12.634 1.00 10.00 H new ATOM 0 HG2 GLU A 69 1.834 -7.853 -9.750 1.00 10.00 H new ATOM 0 HG3 GLU A 69 3.324 -7.223 -10.425 1.00 10.00 H new ATOM 1078 N ASN A 70 0.778 -11.161 -13.293 1.00 10.00 N ATOM 1079 CA ASN A 70 0.559 -12.097 -14.405 1.00 10.00 C ATOM 1080 C ASN A 70 0.153 -13.501 -13.887 1.00 10.00 C ATOM 1081 O ASN A 70 1.004 -14.387 -13.719 1.00 10.00 O ATOM 1082 CB ASN A 70 1.821 -12.176 -15.296 1.00 10.00 C ATOM 1083 CG ASN A 70 1.792 -11.262 -16.512 1.00 10.00 C ATOM 1084 OD1 ASN A 70 2.711 -10.497 -16.758 1.00 10.00 O ATOM 1085 ND2 ASN A 70 0.790 -11.374 -17.366 1.00 10.00 N ATOM 0 H ASN A 70 0.928 -11.632 -12.401 1.00 10.00 H new ATOM 0 HA ASN A 70 -0.267 -11.721 -15.009 1.00 10.00 H new ATOM 0 HB2 ASN A 70 2.693 -11.928 -14.691 1.00 10.00 H new ATOM 0 HB3 ASN A 70 1.949 -13.205 -15.633 1.00 10.00 H new ATOM 0 HD21 ASN A 70 0.788 -10.823 -18.224 1.00 10.00 H new ATOM 0 HD22 ASN A 70 0.019 -12.011 -17.167 1.00 10.00 H new ATOM 1092 N PRO A 71 -1.153 -13.746 -13.652 1.00 10.00 N ATOM 1093 CA PRO A 71 -1.611 -14.949 -12.959 1.00 10.00 C ATOM 1094 C PRO A 71 -1.309 -16.244 -13.712 1.00 10.00 C ATOM 1095 O PRO A 71 -0.757 -17.177 -13.126 1.00 10.00 O ATOM 1096 CB PRO A 71 -3.104 -14.725 -12.682 1.00 10.00 C ATOM 1097 CG PRO A 71 -3.530 -13.648 -13.673 1.00 10.00 C ATOM 1098 CD PRO A 71 -2.264 -12.807 -13.801 1.00 10.00 C ATOM 0 HA PRO A 71 -1.064 -15.093 -12.027 1.00 10.00 H new ATOM 0 HB2 PRO A 71 -3.675 -15.642 -12.826 1.00 10.00 H new ATOM 0 HB3 PRO A 71 -3.271 -14.404 -11.654 1.00 10.00 H new ATOM 0 HG2 PRO A 71 -3.835 -14.073 -14.629 1.00 10.00 H new ATOM 0 HG3 PRO A 71 -4.371 -13.063 -13.301 1.00 10.00 H new ATOM 0 HD2 PRO A 71 -2.224 -12.302 -14.766 1.00 10.00 H new ATOM 0 HD3 PRO A 71 -2.228 -12.033 -13.035 1.00 10.00 H new ATOM 1106 N LYS A 72 -1.628 -16.291 -15.013 1.00 10.00 N ATOM 1107 CA LYS A 72 -1.487 -17.468 -15.875 1.00 10.00 C ATOM 1108 C LYS A 72 -0.025 -17.824 -16.170 1.00 10.00 C ATOM 1109 O LYS A 72 0.258 -18.964 -16.531 1.00 10.00 O ATOM 1110 CB LYS A 72 -2.271 -17.239 -17.172 1.00 10.00 C ATOM 1111 CG LYS A 72 -3.754 -16.865 -16.967 1.00 10.00 C ATOM 1112 CD LYS A 72 -4.383 -16.327 -18.265 1.00 10.00 C ATOM 1113 CE LYS A 72 -5.599 -15.416 -18.028 1.00 10.00 C ATOM 1114 NZ LYS A 72 -5.247 -14.206 -17.242 1.00 10.00 N ATOM 0 H LYS A 72 -2.004 -15.483 -15.509 1.00 10.00 H new ATOM 0 HA LYS A 72 -1.898 -18.324 -15.340 1.00 10.00 H new ATOM 0 HB2 LYS A 72 -1.785 -16.446 -17.740 1.00 10.00 H new ATOM 0 HB3 LYS A 72 -2.218 -18.144 -17.778 1.00 10.00 H new ATOM 0 HG2 LYS A 72 -4.308 -17.740 -16.628 1.00 10.00 H new ATOM 0 HG3 LYS A 72 -3.836 -16.113 -16.182 1.00 10.00 H new ATOM 0 HD2 LYS A 72 -3.628 -15.773 -18.823 1.00 10.00 H new ATOM 0 HD3 LYS A 72 -4.686 -17.168 -18.888 1.00 10.00 H new ATOM 0 HE2 LYS A 72 -6.018 -15.115 -18.988 1.00 10.00 H new ATOM 0 HE3 LYS A 72 -6.374 -15.976 -17.504 1.00 10.00 H new ATOM 0 HZ1 LYS A 72 -5.935 -13.451 -17.440 1.00 10.00 H new ATOM 0 HZ2 LYS A 72 -5.265 -14.434 -16.227 1.00 10.00 H new ATOM 0 HZ3 LYS A 72 -4.294 -13.884 -17.508 1.00 10.00 H new ATOM 1128 N LYS A 73 0.902 -16.870 -15.984 1.00 10.00 N ATOM 1129 CA LYS A 73 2.351 -17.110 -15.968 1.00 10.00 C ATOM 1130 C LYS A 73 2.751 -17.832 -14.685 1.00 10.00 C ATOM 1131 O LYS A 73 3.529 -18.780 -14.743 1.00 10.00 O ATOM 1132 CB LYS A 73 3.108 -15.775 -16.116 1.00 10.00 C ATOM 1133 CG LYS A 73 4.592 -15.903 -16.523 1.00 10.00 C ATOM 1134 CD LYS A 73 5.637 -15.695 -15.408 1.00 10.00 C ATOM 1135 CE LYS A 73 5.833 -16.926 -14.516 1.00 10.00 C ATOM 1136 NZ LYS A 73 7.030 -16.807 -13.652 1.00 10.00 N ATOM 0 H LYS A 73 0.658 -15.891 -15.838 1.00 10.00 H new ATOM 0 HA LYS A 73 2.619 -17.748 -16.810 1.00 10.00 H new ATOM 0 HB2 LYS A 73 2.595 -15.165 -16.860 1.00 10.00 H new ATOM 0 HB3 LYS A 73 3.052 -15.237 -15.170 1.00 10.00 H new ATOM 0 HG2 LYS A 73 4.743 -16.894 -16.950 1.00 10.00 H new ATOM 0 HG3 LYS A 73 4.791 -15.181 -17.315 1.00 10.00 H new ATOM 0 HD2 LYS A 73 6.592 -15.429 -15.861 1.00 10.00 H new ATOM 0 HD3 LYS A 73 5.332 -14.852 -14.788 1.00 10.00 H new ATOM 0 HE2 LYS A 73 4.950 -17.065 -13.893 1.00 10.00 H new ATOM 0 HE3 LYS A 73 5.925 -17.814 -15.141 1.00 10.00 H new ATOM 0 HZ1 LYS A 73 7.190 -17.706 -13.155 1.00 10.00 H new ATOM 0 HZ2 LYS A 73 7.860 -16.582 -14.237 1.00 10.00 H new ATOM 0 HZ3 LYS A 73 6.882 -16.048 -12.956 1.00 10.00 H new ATOM 1150 N TYR A 74 2.274 -17.349 -13.532 1.00 10.00 N ATOM 1151 CA TYR A 74 2.676 -17.875 -12.228 1.00 10.00 C ATOM 1152 C TYR A 74 2.103 -19.263 -11.922 1.00 10.00 C ATOM 1153 O TYR A 74 2.824 -20.122 -11.414 1.00 10.00 O ATOM 1154 CB TYR A 74 2.332 -16.875 -11.118 1.00 10.00 C ATOM 1155 CG TYR A 74 3.200 -17.068 -9.892 1.00 10.00 C ATOM 1156 CD1 TYR A 74 4.593 -16.927 -10.028 1.00 10.00 C ATOM 1157 CD2 TYR A 74 2.650 -17.392 -8.637 1.00 10.00 C ATOM 1158 CE1 TYR A 74 5.440 -17.079 -8.920 1.00 10.00 C ATOM 1159 CE2 TYR A 74 3.493 -17.520 -7.516 1.00 10.00 C ATOM 1160 CZ TYR A 74 4.889 -17.353 -7.656 1.00 10.00 C ATOM 1161 OH TYR A 74 5.712 -17.444 -6.579 1.00 10.00 O ATOM 0 H TYR A 74 1.601 -16.585 -13.479 1.00 10.00 H new ATOM 0 HA TYR A 74 3.757 -18.007 -12.268 1.00 10.00 H new ATOM 0 HB2 TYR A 74 2.456 -15.859 -11.494 1.00 10.00 H new ATOM 0 HB3 TYR A 74 1.284 -16.987 -10.841 1.00 10.00 H new ATOM 0 HD1 TYR A 74 5.015 -16.699 -10.996 1.00 10.00 H new ATOM 0 HD2 TYR A 74 1.585 -17.542 -8.534 1.00 10.00 H new ATOM 0 HE1 TYR A 74 6.510 -16.986 -9.037 1.00 10.00 H new ATOM 0 HE2 TYR A 74 3.072 -17.746 -6.548 1.00 10.00 H new ATOM 0 HH TYR A 74 6.491 -16.865 -6.713 1.00 10.00 H new ATOM 1171 N ILE A 75 0.832 -19.501 -12.270 1.00 10.00 N ATOM 1172 CA ILE A 75 0.199 -20.824 -12.238 1.00 10.00 C ATOM 1173 C ILE A 75 -0.619 -21.029 -13.527 1.00 10.00 C ATOM 1174 O ILE A 75 -1.424 -20.164 -13.876 1.00 10.00 O ATOM 1175 CB ILE A 75 -0.629 -21.051 -10.947 1.00 10.00 C ATOM 1176 CG1 ILE A 75 -1.581 -19.884 -10.602 1.00 10.00 C ATOM 1177 CG2 ILE A 75 0.323 -21.324 -9.769 1.00 10.00 C ATOM 1178 CD1 ILE A 75 -2.488 -20.153 -9.395 1.00 10.00 C ATOM 0 H ILE A 75 0.203 -18.764 -12.588 1.00 10.00 H new ATOM 0 HA ILE A 75 0.976 -21.587 -12.206 1.00 10.00 H new ATOM 0 HB ILE A 75 -1.268 -21.914 -11.133 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -0.988 -18.991 -10.405 1.00 10.00 H new ATOM 0 HG13 ILE A 75 -2.204 -19.668 -11.470 1.00 10.00 H new ATOM 0 HG21 ILE A 75 -0.258 -21.484 -8.861 1.00 10.00 H new ATOM 0 HG22 ILE A 75 0.918 -22.213 -9.980 1.00 10.00 H new ATOM 0 HG23 ILE A 75 0.985 -20.469 -9.630 1.00 10.00 H new ATOM 0 HD11 ILE A 75 -3.125 -19.286 -9.218 1.00 10.00 H new ATOM 0 HD12 ILE A 75 -3.110 -21.026 -9.594 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -1.875 -20.338 -8.513 1.00 10.00 H new ATOM 1190 N PRO A 76 -0.403 -22.128 -14.278 1.00 10.00 N ATOM 1191 CA PRO A 76 -1.003 -22.306 -15.596 1.00 10.00 C ATOM 1192 C PRO A 76 -2.511 -22.553 -15.491 1.00 10.00 C ATOM 1193 O PRO A 76 -2.985 -23.158 -14.530 1.00 10.00 O ATOM 1194 CB PRO A 76 -0.270 -23.503 -16.211 1.00 10.00 C ATOM 1195 CG PRO A 76 0.110 -24.343 -14.993 1.00 10.00 C ATOM 1196 CD PRO A 76 0.407 -23.286 -13.931 1.00 10.00 C ATOM 0 HA PRO A 76 -0.900 -21.415 -16.216 1.00 10.00 H new ATOM 0 HB2 PRO A 76 -0.909 -24.057 -16.898 1.00 10.00 H new ATOM 0 HB3 PRO A 76 0.609 -23.191 -16.775 1.00 10.00 H new ATOM 0 HG2 PRO A 76 -0.701 -25.005 -14.689 1.00 10.00 H new ATOM 0 HG3 PRO A 76 0.978 -24.972 -15.191 1.00 10.00 H new ATOM 0 HD2 PRO A 76 0.157 -23.653 -12.935 1.00 10.00 H new ATOM 0 HD3 PRO A 76 1.467 -23.031 -13.920 1.00 10.00 H new ATOM 1204 N GLY A 77 -3.256 -22.106 -16.511 1.00 10.00 N ATOM 1205 CA GLY A 77 -4.702 -22.292 -16.641 1.00 10.00 C ATOM 1206 C GLY A 77 -5.469 -21.953 -15.361 1.00 10.00 C ATOM 1207 O GLY A 77 -6.046 -22.843 -14.750 1.00 10.00 O ATOM 0 H GLY A 77 -2.853 -21.589 -17.292 1.00 10.00 H new ATOM 0 HA2 GLY A 77 -5.071 -21.667 -17.455 1.00 10.00 H new ATOM 0 HA3 GLY A 77 -4.906 -23.327 -16.916 1.00 10.00 H new ATOM 1211 N THR A 78 -5.482 -20.677 -14.962 1.00 10.00 N ATOM 1212 CA THR A 78 -5.966 -20.199 -13.649 1.00 10.00 C ATOM 1213 C THR A 78 -7.076 -19.138 -13.742 1.00 10.00 C ATOM 1214 O THR A 78 -7.245 -18.338 -12.820 1.00 10.00 O ATOM 1215 CB THR A 78 -4.771 -19.712 -12.809 1.00 10.00 C ATOM 1216 OG1 THR A 78 -5.192 -19.414 -11.501 1.00 10.00 O ATOM 1217 CG2 THR A 78 -4.124 -18.456 -13.397 1.00 10.00 C ATOM 0 H THR A 78 -5.147 -19.920 -15.557 1.00 10.00 H new ATOM 0 HA THR A 78 -6.439 -21.045 -13.150 1.00 10.00 H new ATOM 0 HB THR A 78 -4.037 -20.518 -12.810 1.00 10.00 H new ATOM 0 HG1 THR A 78 -5.997 -18.856 -11.536 1.00 10.00 H new ATOM 0 HG21 THR A 78 -3.286 -18.151 -12.770 1.00 10.00 H new ATOM 0 HG22 THR A 78 -3.765 -18.669 -14.404 1.00 10.00 H new ATOM 0 HG23 THR A 78 -4.859 -17.652 -13.436 1.00 10.00 H new ATOM 1225 N LYS A 79 -7.804 -19.107 -14.870 1.00 10.00 N ATOM 1226 CA LYS A 79 -8.867 -18.149 -15.217 1.00 10.00 C ATOM 1227 C LYS A 79 -8.478 -16.684 -14.975 1.00 10.00 C ATOM 1228 O LYS A 79 -8.002 -16.035 -15.907 1.00 10.00 O ATOM 1229 CB LYS A 79 -10.174 -18.532 -14.493 1.00 10.00 C ATOM 1230 CG LYS A 79 -10.924 -19.720 -15.115 1.00 10.00 C ATOM 1231 CD LYS A 79 -11.840 -20.394 -14.083 1.00 10.00 C ATOM 1232 CE LYS A 79 -12.874 -19.440 -13.470 1.00 10.00 C ATOM 1233 NZ LYS A 79 -13.272 -19.858 -12.106 1.00 10.00 N ATOM 0 H LYS A 79 -7.657 -19.793 -15.610 1.00 10.00 H new ATOM 0 HA LYS A 79 -9.027 -18.218 -16.293 1.00 10.00 H new ATOM 0 HB2 LYS A 79 -9.943 -18.768 -13.454 1.00 10.00 H new ATOM 0 HB3 LYS A 79 -10.836 -17.666 -14.483 1.00 10.00 H new ATOM 0 HG2 LYS A 79 -11.516 -19.377 -15.963 1.00 10.00 H new ATOM 0 HG3 LYS A 79 -10.208 -20.446 -15.500 1.00 10.00 H new ATOM 0 HD2 LYS A 79 -12.361 -21.225 -14.559 1.00 10.00 H new ATOM 0 HD3 LYS A 79 -11.228 -20.816 -13.286 1.00 10.00 H new ATOM 0 HE2 LYS A 79 -12.461 -18.432 -13.435 1.00 10.00 H new ATOM 0 HE3 LYS A 79 -13.756 -19.401 -14.109 1.00 10.00 H new ATOM 0 HZ1 LYS A 79 -13.971 -19.188 -11.728 1.00 10.00 H new ATOM 0 HZ2 LYS A 79 -13.689 -20.810 -12.143 1.00 10.00 H new ATOM 0 HZ3 LYS A 79 -12.435 -19.870 -11.489 1.00 10.00 H new ATOM 1247 N MET A 80 -8.720 -16.192 -13.752 1.00 10.00 N ATOM 1248 CA MET A 80 -8.625 -14.828 -13.229 1.00 10.00 C ATOM 1249 C MET A 80 -8.535 -13.750 -14.320 1.00 10.00 C ATOM 1250 O MET A 80 -7.454 -13.355 -14.773 1.00 10.00 O ATOM 1251 CB MET A 80 -7.501 -14.745 -12.187 1.00 10.00 C ATOM 1252 CG MET A 80 -7.423 -13.346 -11.567 1.00 10.00 C ATOM 1253 SD MET A 80 -6.682 -13.315 -9.920 1.00 10.00 S ATOM 1254 CE MET A 80 -6.170 -11.588 -9.879 1.00 10.00 C ATOM 0 H MET A 80 -9.026 -16.826 -13.014 1.00 10.00 H new ATOM 0 HA MET A 80 -9.565 -14.600 -12.726 1.00 10.00 H new ATOM 0 HB2 MET A 80 -7.672 -15.484 -11.404 1.00 10.00 H new ATOM 0 HB3 MET A 80 -6.548 -14.992 -12.655 1.00 10.00 H new ATOM 0 HG2 MET A 80 -6.845 -12.699 -12.227 1.00 10.00 H new ATOM 0 HG3 MET A 80 -8.428 -12.928 -11.510 1.00 10.00 H new ATOM 0 HE1 MET A 80 -5.783 -11.347 -8.889 1.00 10.00 H new ATOM 0 HE2 MET A 80 -5.392 -11.421 -10.624 1.00 10.00 H new ATOM 0 HE3 MET A 80 -7.026 -10.950 -10.099 1.00 10.00 H new ATOM 1264 N ILE A 81 -9.716 -13.268 -14.726 1.00 10.00 N ATOM 1265 CA ILE A 81 -9.938 -12.218 -15.725 1.00 10.00 C ATOM 1266 C ILE A 81 -9.587 -10.836 -15.131 1.00 10.00 C ATOM 1267 O ILE A 81 -10.390 -9.905 -15.118 1.00 10.00 O ATOM 1268 CB ILE A 81 -11.377 -12.296 -16.314 1.00 10.00 C ATOM 1269 CG1 ILE A 81 -11.864 -13.738 -16.624 1.00 10.00 C ATOM 1270 CG2 ILE A 81 -11.424 -11.500 -17.633 1.00 10.00 C ATOM 1271 CD1 ILE A 81 -12.606 -14.426 -15.467 1.00 10.00 C ATOM 0 H ILE A 81 -10.593 -13.622 -14.343 1.00 10.00 H new ATOM 0 HA ILE A 81 -9.268 -12.376 -16.570 1.00 10.00 H new ATOM 0 HB ILE A 81 -12.034 -11.886 -15.547 1.00 10.00 H new ATOM 0 HG12 ILE A 81 -12.522 -13.706 -17.492 1.00 10.00 H new ATOM 0 HG13 ILE A 81 -11.003 -14.347 -16.899 1.00 10.00 H new ATOM 0 HG21 ILE A 81 -12.429 -11.550 -18.052 1.00 10.00 H new ATOM 0 HG22 ILE A 81 -11.162 -10.460 -17.440 1.00 10.00 H new ATOM 0 HG23 ILE A 81 -10.714 -11.927 -18.341 1.00 10.00 H new ATOM 0 HD11 ILE A 81 -12.909 -15.427 -15.773 1.00 10.00 H new ATOM 0 HD12 ILE A 81 -11.947 -14.495 -14.602 1.00 10.00 H new ATOM 0 HD13 ILE A 81 -13.490 -13.844 -15.204 1.00 10.00 H new ATOM 1283 N PHE A 82 -8.357 -10.718 -14.620 1.00 10.00 N ATOM 1284 CA PHE A 82 -7.781 -9.520 -14.014 1.00 10.00 C ATOM 1285 C PHE A 82 -6.249 -9.662 -13.937 1.00 10.00 C ATOM 1286 O PHE A 82 -5.651 -9.799 -12.870 1.00 10.00 O ATOM 1287 CB PHE A 82 -8.419 -9.245 -12.642 1.00 10.00 C ATOM 1288 CG PHE A 82 -8.391 -7.782 -12.284 1.00 10.00 C ATOM 1289 CD1 PHE A 82 -9.341 -6.885 -12.803 1.00 10.00 C ATOM 1290 CD2 PHE A 82 -7.365 -7.319 -11.461 1.00 10.00 C ATOM 1291 CE1 PHE A 82 -9.246 -5.515 -12.500 1.00 10.00 C ATOM 1292 CE2 PHE A 82 -7.247 -5.949 -11.172 1.00 10.00 C ATOM 1293 CZ PHE A 82 -8.190 -5.046 -11.696 1.00 10.00 C ATOM 0 H PHE A 82 -7.703 -11.501 -14.620 1.00 10.00 H new ATOM 0 HA PHE A 82 -8.000 -8.653 -14.637 1.00 10.00 H new ATOM 0 HB2 PHE A 82 -9.451 -9.597 -12.646 1.00 10.00 H new ATOM 0 HB3 PHE A 82 -7.891 -9.815 -11.877 1.00 10.00 H new ATOM 0 HD1 PHE A 82 -10.141 -7.247 -13.432 1.00 10.00 H new ATOM 0 HD2 PHE A 82 -6.656 -8.018 -11.043 1.00 10.00 H new ATOM 0 HE1 PHE A 82 -9.982 -4.824 -12.884 1.00 10.00 H new ATOM 0 HE2 PHE A 82 -6.438 -5.592 -10.552 1.00 10.00 H new ATOM 0 HZ PHE A 82 -8.104 -3.991 -11.481 1.00 10.00 H new ATOM 1303 N ALA A 83 -5.610 -9.686 -15.111 1.00 10.00 N ATOM 1304 CA ALA A 83 -4.158 -9.666 -15.254 1.00 10.00 C ATOM 1305 C ALA A 83 -3.612 -8.253 -14.986 1.00 10.00 C ATOM 1306 O ALA A 83 -3.872 -7.335 -15.765 1.00 10.00 O ATOM 1307 CB ALA A 83 -3.797 -10.158 -16.660 1.00 10.00 C ATOM 0 H ALA A 83 -6.101 -9.721 -16.004 1.00 10.00 H new ATOM 0 HA ALA A 83 -3.698 -10.329 -14.521 1.00 10.00 H new ATOM 0 HB1 ALA A 83 -2.714 -10.149 -16.782 1.00 10.00 H new ATOM 0 HB2 ALA A 83 -4.169 -11.174 -16.797 1.00 10.00 H new ATOM 0 HB3 ALA A 83 -4.251 -9.502 -17.403 1.00 10.00 H new ATOM 1313 N GLY A 84 -2.869 -8.082 -13.888 1.00 10.00 N ATOM 1314 CA GLY A 84 -2.256 -6.820 -13.490 1.00 10.00 C ATOM 1315 C GLY A 84 -3.060 -6.053 -12.440 1.00 10.00 C ATOM 1316 O GLY A 84 -4.193 -6.385 -12.096 1.00 10.00 O ATOM 0 H GLY A 84 -2.675 -8.842 -13.236 1.00 10.00 H new ATOM 0 HA2 GLY A 84 -1.258 -7.018 -13.098 1.00 10.00 H new ATOM 0 HA3 GLY A 84 -2.133 -6.191 -14.372 1.00 10.00 H new ATOM 1320 N ILE A 85 -2.475 -4.947 -11.983 1.00 10.00 N ATOM 1321 CA ILE A 85 -3.185 -3.821 -11.372 1.00 10.00 C ATOM 1322 C ILE A 85 -2.463 -2.535 -11.806 1.00 10.00 C ATOM 1323 O ILE A 85 -1.261 -2.568 -12.077 1.00 10.00 O ATOM 1324 CB ILE A 85 -3.296 -3.995 -9.841 1.00 10.00 C ATOM 1325 CG1 ILE A 85 -4.398 -3.067 -9.286 1.00 10.00 C ATOM 1326 CG2 ILE A 85 -1.951 -3.774 -9.130 1.00 10.00 C ATOM 1327 CD1 ILE A 85 -4.797 -3.398 -7.846 1.00 10.00 C ATOM 0 H ILE A 85 -1.466 -4.804 -12.028 1.00 10.00 H new ATOM 0 HA ILE A 85 -4.219 -3.768 -11.714 1.00 10.00 H new ATOM 0 HB ILE A 85 -3.577 -5.028 -9.637 1.00 10.00 H new ATOM 0 HG12 ILE A 85 -4.051 -2.035 -9.332 1.00 10.00 H new ATOM 0 HG13 ILE A 85 -5.278 -3.136 -9.925 1.00 10.00 H new ATOM 0 HG21 ILE A 85 -2.081 -3.907 -8.056 1.00 10.00 H new ATOM 0 HG22 ILE A 85 -1.221 -4.495 -9.499 1.00 10.00 H new ATOM 0 HG23 ILE A 85 -1.596 -2.763 -9.330 1.00 10.00 H new ATOM 0 HD11 ILE A 85 -5.575 -2.709 -7.517 1.00 10.00 H new ATOM 0 HD12 ILE A 85 -5.173 -4.420 -7.798 1.00 10.00 H new ATOM 0 HD13 ILE A 85 -3.927 -3.301 -7.196 1.00 10.00 H new ATOM 1339 N LYS A 86 -3.193 -1.420 -11.930 1.00 10.00 N ATOM 1340 CA LYS A 86 -2.730 -0.197 -12.605 1.00 10.00 C ATOM 1341 C LYS A 86 -1.576 0.498 -11.871 1.00 10.00 C ATOM 1342 O LYS A 86 -0.414 0.293 -12.224 1.00 10.00 O ATOM 1343 CB LYS A 86 -3.924 0.743 -12.865 1.00 10.00 C ATOM 1344 CG LYS A 86 -4.830 0.254 -14.016 1.00 10.00 C ATOM 1345 CD LYS A 86 -4.792 1.201 -15.225 1.00 10.00 C ATOM 1346 CE LYS A 86 -5.543 2.502 -14.910 1.00 10.00 C ATOM 1347 NZ LYS A 86 -5.197 3.589 -15.850 1.00 10.00 N ATOM 0 H LYS A 86 -4.139 -1.339 -11.558 1.00 10.00 H new ATOM 0 HA LYS A 86 -2.308 -0.487 -13.567 1.00 10.00 H new ATOM 0 HB2 LYS A 86 -4.517 0.831 -11.954 1.00 10.00 H new ATOM 0 HB3 LYS A 86 -3.551 1.740 -13.100 1.00 10.00 H new ATOM 0 HG2 LYS A 86 -4.515 -0.742 -14.327 1.00 10.00 H new ATOM 0 HG3 LYS A 86 -5.855 0.166 -13.657 1.00 10.00 H new ATOM 0 HD2 LYS A 86 -3.758 1.425 -15.487 1.00 10.00 H new ATOM 0 HD3 LYS A 86 -5.242 0.714 -16.090 1.00 10.00 H new ATOM 0 HE2 LYS A 86 -6.617 2.318 -14.949 1.00 10.00 H new ATOM 0 HE3 LYS A 86 -5.311 2.816 -13.893 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 -5.728 4.447 -15.599 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 -4.177 3.784 -15.795 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 -5.443 3.301 -16.819 1.00 10.00 H new ATOM 1361 N LYS A 87 -1.875 1.345 -10.882 1.00 10.00 N ATOM 1362 CA LYS A 87 -0.867 2.087 -10.115 1.00 10.00 C ATOM 1363 C LYS A 87 -0.234 1.126 -9.113 1.00 10.00 C ATOM 1364 O LYS A 87 -0.951 0.557 -8.299 1.00 10.00 O ATOM 1365 CB LYS A 87 -1.483 3.328 -9.436 1.00 10.00 C ATOM 1366 CG LYS A 87 -2.121 4.320 -10.431 1.00 10.00 C ATOM 1367 CD LYS A 87 -3.630 4.103 -10.646 1.00 10.00 C ATOM 1368 CE LYS A 87 -4.448 4.703 -9.496 1.00 10.00 C ATOM 1369 NZ LYS A 87 -5.832 4.177 -9.474 1.00 10.00 N ATOM 0 H LYS A 87 -2.832 1.538 -10.587 1.00 10.00 H new ATOM 0 HA LYS A 87 -0.092 2.469 -10.779 1.00 10.00 H new ATOM 0 HB2 LYS A 87 -2.240 3.004 -8.722 1.00 10.00 H new ATOM 0 HB3 LYS A 87 -0.709 3.843 -8.867 1.00 10.00 H new ATOM 0 HG2 LYS A 87 -1.957 5.336 -10.072 1.00 10.00 H new ATOM 0 HG3 LYS A 87 -1.611 4.235 -11.391 1.00 10.00 H new ATOM 0 HD2 LYS A 87 -3.935 4.559 -11.588 1.00 10.00 H new ATOM 0 HD3 LYS A 87 -3.839 3.036 -10.726 1.00 10.00 H new ATOM 0 HE2 LYS A 87 -3.959 4.481 -8.547 1.00 10.00 H new ATOM 0 HE3 LYS A 87 -4.473 5.788 -9.595 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 -6.344 4.580 -8.663 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 -6.318 4.440 -10.355 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 -5.808 3.141 -9.388 1.00 10.00 H new ATOM 1383 N LYS A 88 1.087 0.898 -9.143 1.00 10.00 N ATOM 1384 CA LYS A 88 1.711 -0.123 -8.275 1.00 10.00 C ATOM 1385 C LYS A 88 1.586 0.174 -6.769 1.00 10.00 C ATOM 1386 O LYS A 88 1.606 -0.760 -5.973 1.00 10.00 O ATOM 1387 CB LYS A 88 3.153 -0.443 -8.716 1.00 10.00 C ATOM 1388 CG LYS A 88 3.194 -1.579 -9.760 1.00 10.00 C ATOM 1389 CD LYS A 88 2.634 -1.189 -11.140 1.00 10.00 C ATOM 1390 CE LYS A 88 2.527 -2.393 -12.084 1.00 10.00 C ATOM 1391 NZ LYS A 88 1.361 -3.243 -11.756 1.00 10.00 N ATOM 0 H LYS A 88 1.740 1.396 -9.748 1.00 10.00 H new ATOM 0 HA LYS A 88 1.129 -1.034 -8.416 1.00 10.00 H new ATOM 0 HB2 LYS A 88 3.612 0.452 -9.135 1.00 10.00 H new ATOM 0 HB3 LYS A 88 3.745 -0.727 -7.846 1.00 10.00 H new ATOM 0 HG2 LYS A 88 4.226 -1.910 -9.879 1.00 10.00 H new ATOM 0 HG3 LYS A 88 2.628 -2.429 -9.378 1.00 10.00 H new ATOM 0 HD2 LYS A 88 1.649 -0.738 -11.016 1.00 10.00 H new ATOM 0 HD3 LYS A 88 3.277 -0.433 -11.590 1.00 10.00 H new ATOM 0 HE2 LYS A 88 2.444 -2.043 -13.113 1.00 10.00 H new ATOM 0 HE3 LYS A 88 3.439 -2.987 -12.022 1.00 10.00 H new ATOM 0 HZ1 LYS A 88 1.311 -4.037 -12.425 1.00 10.00 H new ATOM 0 HZ2 LYS A 88 1.461 -3.611 -10.789 1.00 10.00 H new ATOM 0 HZ3 LYS A 88 0.490 -2.679 -11.823 1.00 10.00 H new ATOM 1405 N THR A 89 1.261 1.409 -6.378 1.00 10.00 N ATOM 1406 CA THR A 89 0.781 1.721 -5.025 1.00 10.00 C ATOM 1407 C THR A 89 -0.449 0.890 -4.634 1.00 10.00 C ATOM 1408 O THR A 89 -0.537 0.465 -3.491 1.00 10.00 O ATOM 1409 CB THR A 89 0.490 3.219 -4.881 1.00 10.00 C ATOM 1410 OG1 THR A 89 1.559 3.955 -5.433 1.00 10.00 O ATOM 1411 CG2 THR A 89 0.344 3.646 -3.419 1.00 10.00 C ATOM 0 H THR A 89 1.323 2.223 -6.990 1.00 10.00 H new ATOM 0 HA THR A 89 1.581 1.452 -4.336 1.00 10.00 H new ATOM 0 HB THR A 89 -0.449 3.413 -5.399 1.00 10.00 H new ATOM 0 HG1 THR A 89 1.376 4.914 -5.345 1.00 10.00 H new ATOM 0 HG21 THR A 89 0.139 4.715 -3.371 1.00 10.00 H new ATOM 0 HG22 THR A 89 -0.479 3.098 -2.960 1.00 10.00 H new ATOM 0 HG23 THR A 89 1.268 3.430 -2.883 1.00 10.00 H new ATOM 1419 N GLU A 90 -1.353 0.575 -5.573 1.00 10.00 N ATOM 1420 CA GLU A 90 -2.492 -0.326 -5.374 1.00 10.00 C ATOM 1421 C GLU A 90 -2.022 -1.768 -5.120 1.00 10.00 C ATOM 1422 O GLU A 90 -2.590 -2.454 -4.271 1.00 10.00 O ATOM 1423 CB GLU A 90 -3.430 -0.294 -6.601 1.00 10.00 C ATOM 1424 CG GLU A 90 -3.913 1.112 -7.003 1.00 10.00 C ATOM 1425 CD GLU A 90 -4.665 1.146 -8.345 1.00 10.00 C ATOM 1426 OE1 GLU A 90 -4.154 0.670 -9.384 1.00 10.00 O ATOM 1427 OE2 GLU A 90 -5.781 1.716 -8.389 1.00 10.00 O ATOM 0 H GLU A 90 -1.308 0.953 -6.519 1.00 10.00 H new ATOM 0 HA GLU A 90 -3.038 0.021 -4.496 1.00 10.00 H new ATOM 0 HB2 GLU A 90 -2.912 -0.742 -7.449 1.00 10.00 H new ATOM 0 HB3 GLU A 90 -4.300 -0.917 -6.393 1.00 10.00 H new ATOM 0 HG2 GLU A 90 -4.565 1.500 -6.221 1.00 10.00 H new ATOM 0 HG3 GLU A 90 -3.053 1.779 -7.061 1.00 10.00 H new ATOM 1434 N ARG A 91 -0.966 -2.222 -5.820 1.00 10.00 N ATOM 1435 CA ARG A 91 -0.333 -3.536 -5.621 1.00 10.00 C ATOM 1436 C ARG A 91 0.217 -3.667 -4.205 1.00 10.00 C ATOM 1437 O ARG A 91 -0.096 -4.636 -3.517 1.00 10.00 O ATOM 1438 CB ARG A 91 0.752 -3.793 -6.698 1.00 10.00 C ATOM 1439 CG ARG A 91 1.521 -5.124 -6.639 1.00 10.00 C ATOM 1440 CD ARG A 91 0.689 -6.363 -6.988 1.00 10.00 C ATOM 1441 NE ARG A 91 -0.129 -6.810 -5.846 1.00 10.00 N ATOM 1442 CZ ARG A 91 -1.447 -6.870 -5.755 1.00 10.00 C ATOM 1443 NH1 ARG A 91 -2.233 -6.484 -6.734 1.00 10.00 N ATOM 1444 NH2 ARG A 91 -2.000 -7.309 -4.650 1.00 10.00 N ATOM 0 H ARG A 91 -0.521 -1.673 -6.555 1.00 10.00 H new ATOM 0 HA ARG A 91 -1.093 -4.308 -5.740 1.00 10.00 H new ATOM 0 HB2 ARG A 91 0.276 -3.725 -7.676 1.00 10.00 H new ATOM 0 HB3 ARG A 91 1.479 -2.983 -6.640 1.00 10.00 H new ATOM 0 HG2 ARG A 91 2.368 -5.068 -7.322 1.00 10.00 H new ATOM 0 HG3 ARG A 91 1.928 -5.248 -5.636 1.00 10.00 H new ATOM 0 HD2 ARG A 91 0.040 -6.139 -7.835 1.00 10.00 H new ATOM 0 HD3 ARG A 91 1.352 -7.171 -7.299 1.00 10.00 H new ATOM 0 HE ARG A 91 0.388 -7.112 -5.020 1.00 10.00 H new ATOM 0 HH11 ARG A 91 -1.831 -6.124 -7.599 1.00 10.00 H new ATOM 0 HH12 ARG A 91 -3.246 -6.544 -6.629 1.00 10.00 H new ATOM 0 HH21 ARG A 91 -1.414 -7.601 -3.868 1.00 10.00 H new ATOM 0 HH22 ARG A 91 -3.016 -7.358 -4.573 1.00 10.00 H new ATOM 1458 N GLU A 92 0.997 -2.675 -3.772 1.00 10.00 N ATOM 1459 CA GLU A 92 1.496 -2.551 -2.399 1.00 10.00 C ATOM 1460 C GLU A 92 0.346 -2.485 -1.373 1.00 10.00 C ATOM 1461 O GLU A 92 0.338 -3.248 -0.406 1.00 10.00 O ATOM 1462 CB GLU A 92 2.305 -1.258 -2.267 1.00 10.00 C ATOM 1463 CG GLU A 92 3.509 -1.021 -3.189 1.00 10.00 C ATOM 1464 CD GLU A 92 3.746 0.493 -3.364 1.00 10.00 C ATOM 1465 OE1 GLU A 92 3.485 1.244 -2.389 1.00 10.00 O ATOM 1466 OE2 GLU A 92 4.086 0.909 -4.493 1.00 10.00 O ATOM 0 H GLU A 92 1.307 -1.917 -4.380 1.00 10.00 H new ATOM 0 HA GLU A 92 2.107 -3.431 -2.196 1.00 10.00 H new ATOM 0 HB2 GLU A 92 1.616 -0.426 -2.410 1.00 10.00 H new ATOM 0 HB3 GLU A 92 2.665 -1.201 -1.240 1.00 10.00 H new ATOM 0 HG2 GLU A 92 4.398 -1.491 -2.769 1.00 10.00 H new ATOM 0 HG3 GLU A 92 3.332 -1.485 -4.159 1.00 10.00 H new ATOM 1473 N ASP A 93 -0.604 -1.559 -1.578 1.00 10.00 N ATOM 1474 CA ASP A 93 -1.721 -1.276 -0.672 1.00 10.00 C ATOM 1475 C ASP A 93 -2.547 -2.549 -0.416 1.00 10.00 C ATOM 1476 O ASP A 93 -2.866 -2.846 0.733 1.00 10.00 O ATOM 1477 CB ASP A 93 -2.617 -0.155 -1.244 1.00 10.00 C ATOM 1478 CG ASP A 93 -2.128 1.300 -1.108 1.00 10.00 C ATOM 1479 OD1 ASP A 93 -1.069 1.546 -0.483 1.00 10.00 O ATOM 1480 OD2 ASP A 93 -2.835 2.201 -1.613 1.00 10.00 O ATOM 0 H ASP A 93 -0.613 -0.968 -2.409 1.00 10.00 H new ATOM 0 HA ASP A 93 -1.311 -0.935 0.279 1.00 10.00 H new ATOM 0 HB2 ASP A 93 -2.771 -0.358 -2.304 1.00 10.00 H new ATOM 0 HB3 ASP A 93 -3.591 -0.227 -0.761 1.00 10.00 H new ATOM 1485 N LEU A 94 -2.849 -3.338 -1.459 1.00 10.00 N ATOM 1486 CA LEU A 94 -3.540 -4.630 -1.344 1.00 10.00 C ATOM 1487 C LEU A 94 -2.798 -5.665 -0.493 1.00 10.00 C ATOM 1488 O LEU A 94 -3.434 -6.336 0.323 1.00 10.00 O ATOM 1489 CB LEU A 94 -3.781 -5.214 -2.746 1.00 10.00 C ATOM 1490 CG LEU A 94 -5.185 -4.976 -3.316 1.00 10.00 C ATOM 1491 CD1 LEU A 94 -5.714 -3.553 -3.172 1.00 10.00 C ATOM 1492 CD2 LEU A 94 -5.159 -5.331 -4.802 1.00 10.00 C ATOM 0 H LEU A 94 -2.616 -3.091 -2.421 1.00 10.00 H new ATOM 0 HA LEU A 94 -4.480 -4.422 -0.832 1.00 10.00 H new ATOM 0 HB2 LEU A 94 -3.050 -4.786 -3.432 1.00 10.00 H new ATOM 0 HB3 LEU A 94 -3.596 -6.288 -2.712 1.00 10.00 H new ATOM 0 HG LEU A 94 -5.859 -5.604 -2.733 1.00 10.00 H new ATOM 0 HD11 LEU A 94 -6.712 -3.490 -3.606 1.00 10.00 H new ATOM 0 HD12 LEU A 94 -5.760 -3.287 -2.116 1.00 10.00 H new ATOM 0 HD13 LEU A 94 -5.049 -2.863 -3.691 1.00 10.00 H new ATOM 0 HD21 LEU A 94 -6.148 -5.170 -5.232 1.00 10.00 H new ATOM 0 HD22 LEU A 94 -4.433 -4.699 -5.314 1.00 10.00 H new ATOM 0 HD23 LEU A 94 -4.877 -6.377 -4.921 1.00 10.00 H new ATOM 1504 N ILE A 95 -1.484 -5.822 -0.697 1.00 10.00 N ATOM 1505 CA ILE A 95 -0.673 -6.734 0.119 1.00 10.00 C ATOM 1506 C ILE A 95 -0.721 -6.288 1.581 1.00 10.00 C ATOM 1507 O ILE A 95 -1.028 -7.107 2.446 1.00 10.00 O ATOM 1508 CB ILE A 95 0.772 -6.850 -0.418 1.00 10.00 C ATOM 1509 CG1 ILE A 95 0.821 -7.447 -1.843 1.00 10.00 C ATOM 1510 CG2 ILE A 95 1.675 -7.670 0.524 1.00 10.00 C ATOM 1511 CD1 ILE A 95 0.345 -8.895 -2.001 1.00 10.00 C ATOM 0 H ILE A 95 -0.960 -5.329 -1.420 1.00 10.00 H new ATOM 0 HA ILE A 95 -1.093 -7.738 0.056 1.00 10.00 H new ATOM 0 HB ILE A 95 1.155 -5.831 -0.462 1.00 10.00 H new ATOM 0 HG12 ILE A 95 0.217 -6.817 -2.496 1.00 10.00 H new ATOM 0 HG13 ILE A 95 1.848 -7.386 -2.202 1.00 10.00 H new ATOM 0 HG21 ILE A 95 2.681 -7.725 0.107 1.00 10.00 H new ATOM 0 HG22 ILE A 95 1.713 -7.189 1.501 1.00 10.00 H new ATOM 0 HG23 ILE A 95 1.271 -8.677 0.631 1.00 10.00 H new ATOM 0 HD11 ILE A 95 0.429 -9.194 -3.046 1.00 10.00 H new ATOM 0 HD12 ILE A 95 0.962 -9.550 -1.385 1.00 10.00 H new ATOM 0 HD13 ILE A 95 -0.695 -8.973 -1.684 1.00 10.00 H new ATOM 1523 N ALA A 96 -0.496 -4.994 1.849 1.00 10.00 N ATOM 1524 CA ALA A 96 -0.613 -4.433 3.193 1.00 10.00 C ATOM 1525 C ALA A 96 -1.999 -4.709 3.802 1.00 10.00 C ATOM 1526 O ALA A 96 -2.092 -5.220 4.919 1.00 10.00 O ATOM 1527 CB ALA A 96 -0.286 -2.936 3.143 1.00 10.00 C ATOM 0 H ALA A 96 -0.229 -4.312 1.139 1.00 10.00 H new ATOM 0 HA ALA A 96 0.105 -4.922 3.851 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -0.372 -2.511 4.143 1.00 10.00 H new ATOM 0 HB2 ALA A 96 0.731 -2.798 2.776 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -0.985 -2.433 2.474 1.00 10.00 H new ATOM 1533 N TYR A 97 -3.064 -4.426 3.039 1.00 10.00 N ATOM 1534 CA TYR A 97 -4.461 -4.686 3.389 1.00 10.00 C ATOM 1535 C TYR A 97 -4.701 -6.131 3.833 1.00 10.00 C ATOM 1536 O TYR A 97 -5.130 -6.336 4.968 1.00 10.00 O ATOM 1537 CB TYR A 97 -5.384 -4.222 2.244 1.00 10.00 C ATOM 1538 CG TYR A 97 -6.698 -4.960 2.086 1.00 10.00 C ATOM 1539 CD1 TYR A 97 -7.717 -4.845 3.047 1.00 10.00 C ATOM 1540 CD2 TYR A 97 -6.884 -5.812 0.985 1.00 10.00 C ATOM 1541 CE1 TYR A 97 -8.916 -5.570 2.909 1.00 10.00 C ATOM 1542 CE2 TYR A 97 -8.049 -6.589 0.884 1.00 10.00 C ATOM 1543 CZ TYR A 97 -9.083 -6.454 1.828 1.00 10.00 C ATOM 1544 OH TYR A 97 -10.225 -7.179 1.688 1.00 10.00 O ATOM 0 H TYR A 97 -2.967 -3.991 2.122 1.00 10.00 H new ATOM 0 HA TYR A 97 -4.714 -4.094 4.268 1.00 10.00 H new ATOM 0 HB2 TYR A 97 -5.604 -3.165 2.392 1.00 10.00 H new ATOM 0 HB3 TYR A 97 -4.832 -4.305 1.308 1.00 10.00 H new ATOM 0 HD1 TYR A 97 -7.579 -4.195 3.898 1.00 10.00 H new ATOM 0 HD2 TYR A 97 -6.129 -5.870 0.215 1.00 10.00 H new ATOM 0 HE1 TYR A 97 -9.708 -5.447 3.633 1.00 10.00 H new ATOM 0 HE2 TYR A 97 -8.152 -7.296 0.075 1.00 10.00 H new ATOM 0 HH TYR A 97 -10.554 -7.098 0.768 1.00 10.00 H new ATOM 1554 N LEU A 98 -4.411 -7.131 2.990 1.00 10.00 N ATOM 1555 CA LEU A 98 -4.656 -8.529 3.361 1.00 10.00 C ATOM 1556 C LEU A 98 -3.718 -9.004 4.484 1.00 10.00 C ATOM 1557 O LEU A 98 -4.160 -9.733 5.374 1.00 10.00 O ATOM 1558 CB LEU A 98 -4.595 -9.436 2.120 1.00 10.00 C ATOM 1559 CG LEU A 98 -5.757 -9.189 1.144 1.00 10.00 C ATOM 1560 CD1 LEU A 98 -5.461 -9.758 -0.237 1.00 10.00 C ATOM 1561 CD2 LEU A 98 -7.076 -9.786 1.655 1.00 10.00 C ATOM 0 H LEU A 98 -4.012 -7.001 2.060 1.00 10.00 H new ATOM 0 HA LEU A 98 -5.665 -8.596 3.768 1.00 10.00 H new ATOM 0 HB2 LEU A 98 -3.650 -9.272 1.602 1.00 10.00 H new ATOM 0 HB3 LEU A 98 -4.608 -10.479 2.437 1.00 10.00 H new ATOM 0 HG LEU A 98 -5.864 -8.107 1.073 1.00 10.00 H new ATOM 0 HD11 LEU A 98 -6.305 -9.564 -0.899 1.00 10.00 H new ATOM 0 HD12 LEU A 98 -4.566 -9.285 -0.641 1.00 10.00 H new ATOM 0 HD13 LEU A 98 -5.300 -10.833 -0.161 1.00 10.00 H new ATOM 0 HD21 LEU A 98 -7.869 -9.587 0.934 1.00 10.00 H new ATOM 0 HD22 LEU A 98 -6.963 -10.863 1.783 1.00 10.00 H new ATOM 0 HD23 LEU A 98 -7.334 -9.332 2.612 1.00 10.00 H new ATOM 1573 N LYS A 99 -2.453 -8.549 4.503 1.00 10.00 N ATOM 1574 CA LYS A 99 -1.477 -8.915 5.545 1.00 10.00 C ATOM 1575 C LYS A 99 -1.891 -8.411 6.933 1.00 10.00 C ATOM 1576 O LYS A 99 -1.661 -9.091 7.933 1.00 10.00 O ATOM 1577 CB LYS A 99 -0.070 -8.460 5.113 1.00 10.00 C ATOM 1578 CG LYS A 99 1.090 -9.146 5.856 1.00 10.00 C ATOM 1579 CD LYS A 99 1.585 -8.408 7.111 1.00 10.00 C ATOM 1580 CE LYS A 99 2.776 -9.155 7.729 1.00 10.00 C ATOM 1581 NZ LYS A 99 4.041 -8.922 6.991 1.00 10.00 N ATOM 0 H LYS A 99 -2.078 -7.917 3.796 1.00 10.00 H new ATOM 0 HA LYS A 99 -1.454 -10.000 5.647 1.00 10.00 H new ATOM 0 HB2 LYS A 99 0.043 -8.644 4.045 1.00 10.00 H new ATOM 0 HB3 LYS A 99 0.009 -7.383 5.261 1.00 10.00 H new ATOM 0 HG2 LYS A 99 0.775 -10.149 6.143 1.00 10.00 H new ATOM 0 HG3 LYS A 99 1.926 -9.260 5.166 1.00 10.00 H new ATOM 0 HD2 LYS A 99 1.879 -7.391 6.852 1.00 10.00 H new ATOM 0 HD3 LYS A 99 0.777 -8.331 7.839 1.00 10.00 H new ATOM 0 HE2 LYS A 99 2.900 -8.839 8.765 1.00 10.00 H new ATOM 0 HE3 LYS A 99 2.561 -10.223 7.746 1.00 10.00 H new ATOM 0 HZ1 LYS A 99 4.522 -9.830 6.831 1.00 10.00 H new ATOM 0 HZ2 LYS A 99 3.832 -8.476 6.075 1.00 10.00 H new ATOM 0 HZ3 LYS A 99 4.658 -8.297 7.548 1.00 10.00 H new ATOM 1595 N LYS A 100 -2.570 -7.261 6.992 1.00 10.00 N ATOM 1596 CA LYS A 100 -3.312 -6.770 8.164 1.00 10.00 C ATOM 1597 C LYS A 100 -4.606 -7.554 8.401 1.00 10.00 C ATOM 1598 O LYS A 100 -4.774 -8.102 9.485 1.00 10.00 O ATOM 1599 CB LYS A 100 -3.555 -5.259 8.013 1.00 10.00 C ATOM 1600 CG LYS A 100 -2.344 -4.461 8.531 1.00 10.00 C ATOM 1601 CD LYS A 100 -2.404 -4.130 10.037 1.00 10.00 C ATOM 1602 CE LYS A 100 -2.963 -2.734 10.387 1.00 10.00 C ATOM 1603 NZ LYS A 100 -4.393 -2.556 10.044 1.00 10.00 N ATOM 0 H LYS A 100 -2.622 -6.622 6.199 1.00 10.00 H new ATOM 0 HA LYS A 100 -2.710 -6.935 9.057 1.00 10.00 H new ATOM 0 HB2 LYS A 100 -3.736 -5.017 6.966 1.00 10.00 H new ATOM 0 HB3 LYS A 100 -4.450 -4.972 8.565 1.00 10.00 H new ATOM 0 HG2 LYS A 100 -1.436 -5.029 8.331 1.00 10.00 H new ATOM 0 HG3 LYS A 100 -2.268 -3.531 7.968 1.00 10.00 H new ATOM 0 HD2 LYS A 100 -3.017 -4.883 10.533 1.00 10.00 H new ATOM 0 HD3 LYS A 100 -1.399 -4.214 10.450 1.00 10.00 H new ATOM 0 HE2 LYS A 100 -2.831 -2.558 11.455 1.00 10.00 H new ATOM 0 HE3 LYS A 100 -2.377 -1.978 9.864 1.00 10.00 H new ATOM 0 HZ1 LYS A 100 -4.475 -1.963 9.193 1.00 10.00 H new ATOM 0 HZ2 LYS A 100 -4.824 -3.485 9.862 1.00 10.00 H new ATOM 0 HZ3 LYS A 100 -4.885 -2.095 10.836 1.00 10.00 H new ATOM 1617 N ALA A 101 -5.481 -7.700 7.400 1.00 10.00 N ATOM 1618 CA ALA A 101 -6.765 -8.397 7.541 1.00 10.00 C ATOM 1619 C ALA A 101 -6.666 -9.835 8.083 1.00 10.00 C ATOM 1620 O ALA A 101 -7.582 -10.296 8.757 1.00 10.00 O ATOM 1621 CB ALA A 101 -7.511 -8.361 6.203 1.00 10.00 C ATOM 0 H ALA A 101 -5.317 -7.335 6.462 1.00 10.00 H new ATOM 0 HA ALA A 101 -7.325 -7.858 8.305 1.00 10.00 H new ATOM 0 HB1 ALA A 101 -8.465 -8.878 6.304 1.00 10.00 H new ATOM 0 HB2 ALA A 101 -7.688 -7.325 5.913 1.00 10.00 H new ATOM 0 HB3 ALA A 101 -6.911 -8.854 5.438 1.00 10.00 H new ATOM 1627 N THR A 102 -5.544 -10.530 7.852 1.00 10.00 N ATOM 1628 CA THR A 102 -5.254 -11.843 8.455 1.00 10.00 C ATOM 1629 C THR A 102 -4.812 -11.816 9.932 1.00 10.00 C ATOM 1630 O THR A 102 -4.501 -12.885 10.463 1.00 10.00 O ATOM 1631 CB THR A 102 -4.245 -12.631 7.608 1.00 10.00 C ATOM 1632 OG1 THR A 102 -4.213 -13.967 8.052 1.00 10.00 O ATOM 1633 CG2 THR A 102 -2.821 -12.089 7.627 1.00 10.00 C ATOM 0 H THR A 102 -4.803 -10.195 7.236 1.00 10.00 H new ATOM 0 HA THR A 102 -6.218 -12.353 8.459 1.00 10.00 H new ATOM 0 HB THR A 102 -4.596 -12.538 6.580 1.00 10.00 H new ATOM 0 HG1 THR A 102 -4.222 -13.986 9.032 1.00 10.00 H new ATOM 0 HG21 THR A 102 -2.186 -12.714 6.999 1.00 10.00 H new ATOM 0 HG22 THR A 102 -2.815 -11.068 7.246 1.00 10.00 H new ATOM 0 HG23 THR A 102 -2.442 -12.097 8.649 1.00 10.00 H new ATOM 1641 N ASN A 103 -4.768 -10.652 10.595 1.00 10.00 N ATOM 1642 CA ASN A 103 -4.334 -10.515 11.993 1.00 10.00 C ATOM 1643 C ASN A 103 -4.972 -9.334 12.764 1.00 10.00 C ATOM 1644 O ASN A 103 -4.710 -9.201 13.957 1.00 10.00 O ATOM 1645 CB ASN A 103 -2.787 -10.479 12.048 1.00 10.00 C ATOM 1646 CG ASN A 103 -2.140 -9.112 11.854 1.00 10.00 C ATOM 1647 OD1 ASN A 103 -1.866 -8.388 12.794 1.00 10.00 O ATOM 1648 ND2 ASN A 103 -1.766 -8.718 10.658 1.00 10.00 N ATOM 0 H ASN A 103 -5.037 -9.765 10.169 1.00 10.00 H new ATOM 0 HA ASN A 103 -4.704 -11.393 12.522 1.00 10.00 H new ATOM 0 HB2 ASN A 103 -2.469 -10.875 13.012 1.00 10.00 H new ATOM 0 HB3 ASN A 103 -2.401 -11.153 11.283 1.00 10.00 H new ATOM 0 HD21 ASN A 103 -1.266 -7.836 10.545 1.00 10.00 H new ATOM 0 HD22 ASN A 103 -1.975 -9.294 9.843 1.00 10.00 H new ATOM 1655 N GLU A 104 -5.817 -8.526 12.109 1.00 10.00 N ATOM 1656 CA GLU A 104 -6.598 -7.407 12.662 1.00 10.00 C ATOM 1657 C GLU A 104 -7.480 -7.779 13.871 1.00 10.00 C ATOM 1658 O GLU A 104 -7.449 -6.996 14.843 1.00 10.00 O ATOM 1659 CB GLU A 104 -7.466 -6.810 11.532 1.00 10.00 C ATOM 1660 CG GLU A 104 -7.743 -5.305 11.694 1.00 10.00 C ATOM 1661 CD GLU A 104 -6.541 -4.411 11.339 1.00 10.00 C ATOM 1662 OE1 GLU A 104 -5.548 -4.881 10.744 1.00 10.00 O ATOM 1663 OE2 GLU A 104 -6.589 -3.182 11.565 1.00 10.00 O ATOM 1664 OXT GLU A 104 -8.202 -8.802 13.788 1.00 10.00 O ATOM 0 H GLU A 104 -5.986 -8.644 11.110 1.00 10.00 H new ATOM 0 HA GLU A 104 -5.883 -6.679 13.045 1.00 10.00 H new ATOM 0 HB2 GLU A 104 -6.969 -6.978 10.577 1.00 10.00 H new ATOM 0 HB3 GLU A 104 -8.416 -7.343 11.495 1.00 10.00 H new ATOM 0 HG2 GLU A 104 -8.588 -5.030 11.062 1.00 10.00 H new ATOM 0 HG3 GLU A 104 -8.039 -5.108 12.725 1.00 10.00 H new TER 1671 GLU A 104 HETATM 1672 FE HEC A 105 -8.603 -13.051 -8.068 1.00 10.00 FE HETATM 1673 CHA HEC A 105 -7.924 -16.356 -7.328 1.00 10.00 C HETATM 1674 CHB HEC A 105 -6.560 -12.067 -5.542 1.00 10.00 C HETATM 1675 CHC HEC A 105 -9.273 -9.818 -8.802 1.00 10.00 C HETATM 1676 CHD HEC A 105 -11.012 -14.069 -10.226 1.00 10.00 C HETATM 1677 NA HEC A 105 -7.434 -14.014 -6.748 1.00 10.00 N HETATM 1678 C1A HEC A 105 -7.238 -15.382 -6.603 1.00 10.00 C HETATM 1679 C2A HEC A 105 -6.260 -15.646 -5.549 1.00 10.00 C HETATM 1680 C3A HEC A 105 -5.860 -14.437 -5.077 1.00 10.00 C HETATM 1681 C4A HEC A 105 -6.629 -13.429 -5.793 1.00 10.00 C HETATM 1682 CMA HEC A 105 -4.811 -14.184 -4.010 1.00 10.00 C HETATM 1683 CAA HEC A 105 -5.758 -16.998 -5.080 1.00 10.00 C HETATM 1684 CBA HEC A 105 -6.802 -17.865 -4.346 1.00 10.00 C HETATM 1685 CGA HEC A 105 -6.229 -19.054 -3.577 1.00 10.00 C HETATM 1686 O1A HEC A 105 -5.796 -20.012 -4.255 1.00 10.00 O HETATM 1687 O2A HEC A 105 -6.179 -18.979 -2.330 1.00 10.00 O HETATM 1688 NB HEC A 105 -8.070 -11.298 -7.298 1.00 10.00 N HETATM 1689 C1B HEC A 105 -7.240 -11.077 -6.228 1.00 10.00 C HETATM 1690 C2B HEC A 105 -7.122 -9.653 -5.939 1.00 10.00 C HETATM 1691 C3B HEC A 105 -7.868 -8.998 -6.873 1.00 10.00 C HETATM 1692 C4B HEC A 105 -8.433 -10.040 -7.727 1.00 10.00 C HETATM 1693 CMB HEC A 105 -6.265 -9.069 -4.831 1.00 10.00 C HETATM 1694 CAB HEC A 105 -8.055 -7.492 -7.065 1.00 10.00 C HETATM 1695 CBB HEC A 105 -6.839 -6.834 -7.728 1.00 10.00 C HETATM 1696 NC HEC A 105 -9.906 -12.146 -9.204 1.00 10.00 N HETATM 1697 C1C HEC A 105 -10.019 -10.793 -9.429 1.00 10.00 C HETATM 1698 C2C HEC A 105 -11.156 -10.493 -10.273 1.00 10.00 C HETATM 1699 C3C HEC A 105 -11.747 -11.681 -10.557 1.00 10.00 C HETATM 1700 C4C HEC A 105 -10.878 -12.710 -9.998 1.00 10.00 C HETATM 1701 CMC HEC A 105 -11.653 -9.099 -10.579 1.00 10.00 C HETATM 1702 CAC HEC A 105 -13.093 -11.915 -11.223 1.00 10.00 C HETATM 1703 CBC HEC A 105 -13.061 -11.666 -12.737 1.00 10.00 C HETATM 1704 ND HEC A 105 -9.362 -14.850 -8.604 1.00 10.00 N HETATM 1705 C1D HEC A 105 -10.328 -15.069 -9.559 1.00 10.00 C HETATM 1706 C2D HEC A 105 -10.594 -16.492 -9.727 1.00 10.00 C HETATM 1707 C3D HEC A 105 -9.745 -17.157 -8.895 1.00 10.00 C HETATM 1708 C4D HEC A 105 -8.933 -16.118 -8.249 1.00 10.00 C HETATM 1709 CMD HEC A 105 -11.670 -17.076 -10.617 1.00 10.00 C HETATM 1710 CAD HEC A 105 -9.715 -18.662 -8.591 1.00 10.00 C HETATM 1711 CBD HEC A 105 -8.791 -19.558 -9.448 1.00 10.00 C HETATM 1712 CGD HEC A 105 -9.377 -20.039 -10.786 1.00 10.00 C HETATM 1713 O1D HEC A 105 -10.599 -19.885 -11.025 1.00 10.00 O HETATM 1714 O2D HEC A 105 -8.583 -20.648 -11.532 1.00 10.00 O HETATM 0 HMD3 HEC A 105 -12.646 -16.715 -10.293 1.00 10.00 H new HETATM 0 HMD2 HEC A 105 -11.495 -16.770 -11.648 1.00 10.00 H new HETATM 0 HMD1 HEC A 105 -11.645 -18.164 -10.552 1.00 10.00 H new HETATM 0 HMC3 HEC A 105 -11.935 -8.601 -9.651 1.00 10.00 H new HETATM 0 HMC2 HEC A 105 -10.863 -8.531 -11.070 1.00 10.00 H new HETATM 0 HMC1 HEC A 105 -12.520 -9.158 -11.237 1.00 10.00 H new HETATM 0 HMB3 HEC A 105 -6.598 -9.459 -3.869 1.00 10.00 H new HETATM 0 HMB2 HEC A 105 -5.223 -9.345 -4.993 1.00 10.00 H new HETATM 0 HMB1 HEC A 105 -6.357 -7.983 -4.834 1.00 10.00 H new HETATM 0 HMA3 HEC A 105 -5.114 -14.666 -3.081 1.00 10.00 H new HETATM 0 HMA2 HEC A 105 -3.855 -14.593 -4.336 1.00 10.00 H new HETATM 0 HMA1 HEC A 105 -4.710 -13.111 -3.846 1.00 10.00 H new HETATM 0 HBD2 HEC A 105 -7.872 -19.009 -9.652 1.00 10.00 H new HETATM 0 HBD1 HEC A 105 -8.516 -20.432 -8.858 1.00 10.00 H new HETATM 0 HBC3 HEC A 105 -12.770 -10.633 -12.930 1.00 10.00 H new HETATM 0 HBC2 HEC A 105 -12.340 -12.339 -13.201 1.00 10.00 H new HETATM 0 HBC1 HEC A 105 -14.050 -11.849 -13.157 1.00 10.00 H new HETATM 0 HBB3 HEC A 105 -5.958 -6.988 -7.105 1.00 10.00 H new HETATM 0 HBB2 HEC A 105 -6.673 -7.281 -8.708 1.00 10.00 H new HETATM 0 HBB1 HEC A 105 -7.021 -5.765 -7.842 1.00 10.00 H new HETATM 0 HBA2 HEC A 105 -7.352 -17.232 -3.650 1.00 10.00 H new HETATM 0 HBA1 HEC A 105 -7.521 -18.236 -5.076 1.00 10.00 H new HETATM 0 HAD2 HEC A 105 -9.426 -18.786 -7.547 1.00 10.00 H new HETATM 0 HAD1 HEC A 105 -10.732 -19.042 -8.687 1.00 10.00 H new HETATM 0 HAA2 HEC A 105 -5.391 -17.552 -5.944 1.00 10.00 H new HETATM 0 HAA1 HEC A 105 -4.907 -16.842 -4.417 1.00 10.00 H new HETATM 0 HHD HEC A 105 -11.717 -14.377 -10.998 1.00 10.00 H new HETATM 0 HHC HEC A 105 -9.351 -8.799 -9.181 1.00 10.00 H new HETATM 0 HHB HEC A 105 -5.909 -11.747 -4.728 1.00 10.00 H new HETATM 0 HHA HEC A 105 -7.643 -17.395 -7.156 1.00 10.00 H new HETATM 0 H2D HEC A 105 -8.730 -21.613 -11.448 1.00 10.00 H new HETATM 0 H2A HEC A 105 -6.219 -19.880 -1.946 1.00 10.00 H new