USER MOD reduce.3.24.130724 H: found=0, std=0, add=1101, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1096 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 70 TYR OH : rot -131:sc= 0.052 USER MOD Set 1.2: A 115 HIS : no HD1:sc= -1.48 K(o=-1.4,f=-8.1!) USER MOD Set 2.1: A 25 GLN :FLIP amide:sc= 0.602 F(o=0.99,f=2.4) USER MOD Set 2.2: A 28 SER OG : rot -42:sc= 1.78 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= -0.0207 X(o=-0.021,f=0) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 CYS SG : rot -7:sc= -1.56 USER MOD Single : A 9 ASN : amide:sc= -3.14 K(o=-3.1,f=-8.1!) USER MOD Single : A 14 ASN : amide:sc= -0.0832 X(o=-0.083,f=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot -51:sc= 1.21 USER MOD Single : A 22 THR OG1 : rot -137:sc= -2.06! USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 85:sc= 0.236 USER MOD Single : A 40 THR OG1 : rot 180:sc= -0.949 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 49 LYS NZ :NH3+ -133:sc= -0.0341 (180deg=-0.304) USER MOD Single : A 51 SER OG : rot -43:sc= -0.0649 USER MOD Single : A 53 GLN : amide:sc= -0.0283 K(o=-0.028,f=-0.97) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=-0.066) USER MOD Single : A 61 GLN : amide:sc= -0.626 X(o=-0.63,f=-0.68) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 THR OG1 : rot -54:sc= 1.24 USER MOD Single : A 76 THR OG1 : rot -54:sc= -0.208 USER MOD Single : A 78 CYS SG : rot -58:sc= -2.72! USER MOD Single : A 83 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 143:sc= 0.614 (180deg=0.0682) USER MOD Single : A 90 THR OG1 : rot 180:sc= -0.227 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= -0.583 K(o=-0.58,f=-3.7!) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 THR OG1 : rot 180:sc= 0.101 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 ASN : amide:sc= -7.31! C(o=-7.3!,f=-12!) USER MOD Single : A 114 CYS SG : rot -80:sc= -4.36! USER MOD Single : A 124 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 137 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 142 GLN : amide:sc= -0.419 K(o=-0.42,f=-3.6!) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.539 -14.551 -18.602 1.00 0.00 N ATOM 2 CA GLY A 1 1.251 -14.534 -17.153 1.00 0.00 C ATOM 3 C GLY A 1 0.139 -13.531 -16.793 1.00 0.00 C ATOM 4 O GLY A 1 0.152 -12.390 -17.265 1.00 0.00 O ATOM 0 H1 GLY A 1 2.293 -15.240 -18.798 1.00 0.00 H new ATOM 0 H2 GLY A 1 0.680 -14.820 -19.123 1.00 0.00 H new ATOM 0 H3 GLY A 1 1.847 -13.605 -18.906 1.00 0.00 H new ATOM 0 HA2 GLY A 1 0.955 -15.533 -16.831 1.00 0.00 H new ATOM 0 HA3 GLY A 1 2.159 -14.279 -16.607 1.00 0.00 H new ATOM 9 N SER A 2 -0.818 -13.996 -15.986 1.00 0.00 N ATOM 10 CA SER A 2 -1.966 -13.174 -15.546 1.00 0.00 C ATOM 11 C SER A 2 -1.496 -11.833 -14.982 1.00 0.00 C ATOM 12 O SER A 2 -0.549 -11.767 -14.203 1.00 0.00 O ATOM 13 CB SER A 2 -2.800 -13.859 -14.461 1.00 0.00 C ATOM 14 OG SER A 2 -3.739 -14.760 -15.049 1.00 0.00 O ATOM 0 H SER A 2 -0.826 -14.947 -15.617 1.00 0.00 H new ATOM 0 HA SER A 2 -2.580 -13.030 -16.435 1.00 0.00 H new ATOM 0 HB2 SER A 2 -2.145 -14.401 -13.778 1.00 0.00 H new ATOM 0 HB3 SER A 2 -3.327 -13.109 -13.871 1.00 0.00 H new ATOM 0 HG SER A 2 -4.264 -15.192 -14.343 1.00 0.00 H new ATOM 20 N HIS A 3 -2.137 -10.786 -15.477 1.00 0.00 N ATOM 21 CA HIS A 3 -1.802 -9.386 -15.143 1.00 0.00 C ATOM 22 C HIS A 3 -2.916 -8.489 -15.692 1.00 0.00 C ATOM 23 O HIS A 3 -3.627 -8.890 -16.613 1.00 0.00 O ATOM 24 CB HIS A 3 -0.421 -8.965 -15.677 1.00 0.00 C ATOM 25 CG HIS A 3 -0.387 -8.407 -17.120 1.00 0.00 C ATOM 26 ND1 HIS A 3 -0.341 -9.118 -18.228 1.00 0.00 N ATOM 27 CD2 HIS A 3 -0.459 -7.123 -17.433 1.00 0.00 C ATOM 28 CE1 HIS A 3 -0.416 -8.255 -19.255 1.00 0.00 C ATOM 29 NE2 HIS A 3 -0.490 -7.028 -18.764 1.00 0.00 N ATOM 0 H HIS A 3 -2.915 -10.872 -16.131 1.00 0.00 H new ATOM 0 HA HIS A 3 -1.736 -9.283 -14.060 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -0.011 -8.209 -15.008 1.00 0.00 H new ATOM 0 HB3 HIS A 3 0.243 -9.828 -15.628 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -0.488 -6.299 -16.736 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -0.416 -8.518 -20.303 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -0.558 -6.166 -19.305 1.00 0.00 H new ATOM 37 N MET A 4 -2.974 -7.281 -15.135 1.00 0.00 N ATOM 38 CA MET A 4 -3.976 -6.248 -15.471 1.00 0.00 C ATOM 39 C MET A 4 -5.403 -6.731 -15.148 1.00 0.00 C ATOM 40 O MET A 4 -5.694 -7.926 -15.106 1.00 0.00 O ATOM 41 CB MET A 4 -3.792 -5.807 -16.936 1.00 0.00 C ATOM 42 CG MET A 4 -4.770 -4.733 -17.421 1.00 0.00 C ATOM 43 SD MET A 4 -6.039 -5.399 -18.558 1.00 0.00 S ATOM 44 CE MET A 4 -5.152 -5.285 -20.098 1.00 0.00 C ATOM 0 H MET A 4 -2.314 -6.977 -14.419 1.00 0.00 H new ATOM 0 HA MET A 4 -3.820 -5.367 -14.848 1.00 0.00 H new ATOM 0 HB2 MET A 4 -2.776 -5.434 -17.061 1.00 0.00 H new ATOM 0 HB3 MET A 4 -3.891 -6.683 -17.578 1.00 0.00 H new ATOM 0 HG2 MET A 4 -5.261 -4.279 -16.560 1.00 0.00 H new ATOM 0 HG3 MET A 4 -4.215 -3.942 -17.925 1.00 0.00 H new ATOM 0 HE1 MET A 4 -5.781 -5.652 -20.908 1.00 0.00 H new ATOM 0 HE2 MET A 4 -4.886 -4.245 -20.288 1.00 0.00 H new ATOM 0 HE3 MET A 4 -4.245 -5.887 -20.041 1.00 0.00 H new ATOM 54 N GLY A 5 -6.177 -5.770 -14.644 1.00 0.00 N ATOM 55 CA GLY A 5 -7.585 -6.018 -14.274 1.00 0.00 C ATOM 56 C GLY A 5 -8.131 -4.964 -13.308 1.00 0.00 C ATOM 57 O GLY A 5 -9.282 -4.550 -13.409 1.00 0.00 O ATOM 0 H GLY A 5 -5.862 -4.814 -14.480 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -8.197 -6.032 -15.176 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -7.669 -7.004 -13.817 1.00 0.00 H new ATOM 61 N ALA A 6 -7.265 -4.538 -12.395 1.00 0.00 N ATOM 62 CA ALA A 6 -7.561 -3.448 -11.447 1.00 0.00 C ATOM 63 C ALA A 6 -6.632 -2.256 -11.696 1.00 0.00 C ATOM 64 O ALA A 6 -5.598 -2.404 -12.341 1.00 0.00 O ATOM 65 CB ALA A 6 -7.374 -3.962 -10.025 1.00 0.00 C ATOM 0 H ALA A 6 -6.332 -4.935 -12.284 1.00 0.00 H new ATOM 0 HA ALA A 6 -8.590 -3.118 -11.589 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -7.591 -3.162 -9.317 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -8.052 -4.797 -9.848 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -6.345 -4.296 -9.891 1.00 0.00 H new ATOM 71 N ALA A 7 -7.041 -1.093 -11.196 1.00 0.00 N ATOM 72 CA ALA A 7 -6.324 0.192 -11.348 1.00 0.00 C ATOM 73 C ALA A 7 -7.051 1.291 -10.568 1.00 0.00 C ATOM 74 O ALA A 7 -8.200 1.626 -10.852 1.00 0.00 O ATOM 75 CB ALA A 7 -6.202 0.632 -12.815 1.00 0.00 C ATOM 0 H ALA A 7 -7.903 -1.005 -10.657 1.00 0.00 H new ATOM 0 HA ALA A 7 -5.319 0.037 -10.956 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -5.668 1.581 -12.867 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -5.655 -0.124 -13.377 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -7.197 0.752 -13.243 1.00 0.00 H new ATOM 81 N CYS A 8 -6.466 1.608 -9.425 1.00 0.00 N ATOM 82 CA CYS A 8 -6.981 2.670 -8.544 1.00 0.00 C ATOM 83 C CYS A 8 -5.867 3.660 -8.187 1.00 0.00 C ATOM 84 O CYS A 8 -4.697 3.409 -8.457 1.00 0.00 O ATOM 85 CB CYS A 8 -7.595 2.024 -7.300 1.00 0.00 C ATOM 86 SG CYS A 8 -8.926 0.835 -7.718 1.00 0.00 S ATOM 0 H CYS A 8 -5.627 1.147 -9.074 1.00 0.00 H new ATOM 0 HA CYS A 8 -7.755 3.240 -9.057 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -6.815 1.510 -6.738 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -7.996 2.802 -6.650 1.00 0.00 H new ATOM 0 HG CYS A 8 -9.177 0.895 -8.992 1.00 0.00 H new ATOM 92 N ASN A 9 -6.244 4.799 -7.638 1.00 0.00 N ATOM 93 CA ASN A 9 -5.292 5.852 -7.250 1.00 0.00 C ATOM 94 C ASN A 9 -5.199 5.909 -5.726 1.00 0.00 C ATOM 95 O ASN A 9 -6.190 5.812 -4.997 1.00 0.00 O ATOM 96 CB ASN A 9 -5.770 7.199 -7.784 1.00 0.00 C ATOM 97 CG ASN A 9 -4.702 8.288 -7.719 1.00 0.00 C ATOM 98 OD1 ASN A 9 -3.898 8.418 -6.801 1.00 0.00 O ATOM 99 ND2 ASN A 9 -4.723 9.123 -8.723 1.00 0.00 N ATOM 0 H ASN A 9 -7.218 5.032 -7.443 1.00 0.00 H new ATOM 0 HA ASN A 9 -4.311 5.629 -7.669 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -6.093 7.078 -8.818 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -6.641 7.520 -7.213 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -4.063 9.900 -8.754 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -5.399 8.998 -9.476 1.00 0.00 H new ATOM 106 N VAL A 10 -3.947 5.931 -5.299 1.00 0.00 N ATOM 107 CA VAL A 10 -3.585 5.976 -3.876 1.00 0.00 C ATOM 108 C VAL A 10 -2.416 6.968 -3.709 1.00 0.00 C ATOM 109 O VAL A 10 -1.633 7.205 -4.628 1.00 0.00 O ATOM 110 CB VAL A 10 -3.306 4.568 -3.279 1.00 0.00 C ATOM 111 CG1 VAL A 10 -4.207 3.444 -3.812 1.00 0.00 C ATOM 112 CG2 VAL A 10 -1.852 4.125 -3.368 1.00 0.00 C ATOM 0 H VAL A 10 -3.143 5.918 -5.926 1.00 0.00 H new ATOM 0 HA VAL A 10 -4.432 6.335 -3.292 1.00 0.00 H new ATOM 0 HB VAL A 10 -3.557 4.724 -2.230 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -3.934 2.502 -3.336 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -5.248 3.676 -3.589 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -4.078 3.355 -4.891 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -1.746 3.133 -2.929 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -1.544 4.094 -4.413 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -1.223 4.831 -2.826 1.00 0.00 H new ATOM 122 N LEU A 11 -2.259 7.429 -2.483 1.00 0.00 N ATOM 123 CA LEU A 11 -1.173 8.329 -2.081 1.00 0.00 C ATOM 124 C LEU A 11 -0.058 7.512 -1.427 1.00 0.00 C ATOM 125 O LEU A 11 -0.301 6.710 -0.525 1.00 0.00 O ATOM 126 CB LEU A 11 -1.776 9.364 -1.127 1.00 0.00 C ATOM 127 CG LEU A 11 -1.247 10.787 -1.322 1.00 0.00 C ATOM 128 CD1 LEU A 11 -1.394 11.269 -2.764 1.00 0.00 C ATOM 129 CD2 LEU A 11 -2.056 11.724 -0.425 1.00 0.00 C ATOM 0 H LEU A 11 -2.889 7.189 -1.718 1.00 0.00 H new ATOM 0 HA LEU A 11 -0.729 8.846 -2.932 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -2.858 9.371 -1.255 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -1.578 9.053 -0.101 1.00 0.00 H new ATOM 0 HG LEU A 11 -0.186 10.788 -1.071 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -1.004 12.283 -2.850 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -0.836 10.608 -3.427 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -2.447 11.260 -3.045 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -1.696 12.746 -0.547 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -3.109 11.674 -0.703 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -1.941 11.421 0.616 1.00 0.00 H new ATOM 141 N PHE A 12 1.069 7.537 -2.121 1.00 0.00 N ATOM 142 CA PHE A 12 2.328 6.884 -1.751 1.00 0.00 C ATOM 143 C PHE A 12 2.956 7.605 -0.564 1.00 0.00 C ATOM 144 O PHE A 12 3.403 8.746 -0.678 1.00 0.00 O ATOM 145 CB PHE A 12 3.306 6.862 -2.934 1.00 0.00 C ATOM 146 CG PHE A 12 4.698 6.311 -2.607 1.00 0.00 C ATOM 147 CD1 PHE A 12 4.928 5.433 -1.542 1.00 0.00 C ATOM 148 CD2 PHE A 12 5.788 6.803 -3.319 1.00 0.00 C ATOM 149 CE1 PHE A 12 6.217 5.087 -1.194 1.00 0.00 C ATOM 150 CE2 PHE A 12 7.078 6.434 -2.981 1.00 0.00 C ATOM 151 CZ PHE A 12 7.301 5.572 -1.911 1.00 0.00 C ATOM 0 H PHE A 12 1.140 8.039 -3.006 1.00 0.00 H new ATOM 0 HA PHE A 12 2.111 5.853 -1.472 1.00 0.00 H new ATOM 0 HB2 PHE A 12 2.872 6.263 -3.735 1.00 0.00 H new ATOM 0 HB3 PHE A 12 3.413 7.877 -3.318 1.00 0.00 H new ATOM 0 HD1 PHE A 12 4.094 5.025 -0.991 1.00 0.00 H new ATOM 0 HD2 PHE A 12 5.625 7.480 -4.144 1.00 0.00 H new ATOM 0 HE1 PHE A 12 6.384 4.430 -0.353 1.00 0.00 H new ATOM 0 HE2 PHE A 12 7.914 6.816 -3.549 1.00 0.00 H new ATOM 0 HZ PHE A 12 8.307 5.284 -1.642 1.00 0.00 H new ATOM 161 N ILE A 13 2.842 6.925 0.561 1.00 0.00 N ATOM 162 CA ILE A 13 3.410 7.407 1.825 1.00 0.00 C ATOM 163 C ILE A 13 4.926 7.114 1.821 1.00 0.00 C ATOM 164 O ILE A 13 5.733 7.991 1.519 1.00 0.00 O ATOM 165 CB ILE A 13 2.534 6.791 2.938 1.00 0.00 C ATOM 166 CG1 ILE A 13 1.267 7.588 3.264 1.00 0.00 C ATOM 167 CG2 ILE A 13 3.267 6.696 4.258 1.00 0.00 C ATOM 168 CD1 ILE A 13 0.333 8.003 2.131 1.00 0.00 C ATOM 0 H ILE A 13 2.359 6.030 0.635 1.00 0.00 H new ATOM 0 HA ILE A 13 3.378 8.483 1.993 1.00 0.00 H new ATOM 0 HB ILE A 13 2.278 5.816 2.523 1.00 0.00 H new ATOM 0 HG12 ILE A 13 0.683 6.999 3.971 1.00 0.00 H new ATOM 0 HG13 ILE A 13 1.575 8.495 3.783 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.610 6.257 5.008 1.00 0.00 H new ATOM 0 HG22 ILE A 13 4.151 6.070 4.139 1.00 0.00 H new ATOM 0 HG23 ILE A 13 3.569 7.693 4.579 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -0.511 8.558 2.540 1.00 0.00 H new ATOM 0 HD12 ILE A 13 0.874 8.634 1.426 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -0.032 7.114 1.617 1.00 0.00 H new ATOM 180 N ASN A 14 5.272 5.862 2.127 1.00 0.00 N ATOM 181 CA ASN A 14 6.654 5.354 2.201 1.00 0.00 C ATOM 182 C ASN A 14 6.666 3.880 2.615 1.00 0.00 C ATOM 183 O ASN A 14 5.700 3.375 3.196 1.00 0.00 O ATOM 184 CB ASN A 14 7.482 6.128 3.229 1.00 0.00 C ATOM 185 CG ASN A 14 8.877 6.409 2.677 1.00 0.00 C ATOM 186 OD1 ASN A 14 9.872 5.835 3.099 1.00 0.00 O ATOM 187 ND2 ASN A 14 8.961 7.250 1.673 1.00 0.00 N ATOM 0 H ASN A 14 4.578 5.145 2.338 1.00 0.00 H new ATOM 0 HA ASN A 14 7.086 5.479 1.208 1.00 0.00 H new ATOM 0 HB2 ASN A 14 6.985 7.066 3.476 1.00 0.00 H new ATOM 0 HB3 ASN A 14 7.557 5.554 4.153 1.00 0.00 H new ATOM 0 HD21 ASN A 14 9.864 7.432 1.234 1.00 0.00 H new ATOM 0 HD22 ASN A 14 8.124 7.722 1.331 1.00 0.00 H new ATOM 194 N SER A 15 7.786 3.243 2.294 1.00 0.00 N ATOM 195 CA SER A 15 8.055 1.854 2.698 1.00 0.00 C ATOM 196 C SER A 15 9.137 1.839 3.772 1.00 0.00 C ATOM 197 O SER A 15 10.198 2.449 3.660 1.00 0.00 O ATOM 198 CB SER A 15 8.506 0.960 1.539 1.00 0.00 C ATOM 199 OG SER A 15 9.731 1.396 0.946 1.00 0.00 O ATOM 0 H SER A 15 8.536 3.667 1.748 1.00 0.00 H new ATOM 0 HA SER A 15 7.114 1.452 3.073 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.626 -0.062 1.900 1.00 0.00 H new ATOM 0 HB3 SER A 15 7.726 0.940 0.778 1.00 0.00 H new ATOM 0 HG SER A 15 9.974 0.791 0.214 1.00 0.00 H new ATOM 205 N VAL A 16 8.794 1.142 4.837 1.00 0.00 N ATOM 206 CA VAL A 16 9.681 0.991 6.001 1.00 0.00 C ATOM 207 C VAL A 16 9.966 -0.493 6.240 1.00 0.00 C ATOM 208 O VAL A 16 9.082 -1.293 6.542 1.00 0.00 O ATOM 209 CB VAL A 16 9.160 1.729 7.251 1.00 0.00 C ATOM 210 CG1 VAL A 16 9.140 3.246 7.040 1.00 0.00 C ATOM 211 CG2 VAL A 16 7.759 1.289 7.660 1.00 0.00 C ATOM 0 H VAL A 16 7.899 0.662 4.932 1.00 0.00 H new ATOM 0 HA VAL A 16 10.630 1.480 5.780 1.00 0.00 H new ATOM 0 HB VAL A 16 9.856 1.467 8.048 1.00 0.00 H new ATOM 0 HG11 VAL A 16 8.767 3.734 7.941 1.00 0.00 H new ATOM 0 HG12 VAL A 16 10.150 3.597 6.828 1.00 0.00 H new ATOM 0 HG13 VAL A 16 8.488 3.488 6.200 1.00 0.00 H new ATOM 0 HG21 VAL A 16 7.447 1.843 8.545 1.00 0.00 H new ATOM 0 HG22 VAL A 16 7.063 1.486 6.845 1.00 0.00 H new ATOM 0 HG23 VAL A 16 7.763 0.222 7.883 1.00 0.00 H new ATOM 221 N GLU A 17 11.157 -0.885 5.807 1.00 0.00 N ATOM 222 CA GLU A 17 11.603 -2.279 5.957 1.00 0.00 C ATOM 223 C GLU A 17 11.645 -2.639 7.450 1.00 0.00 C ATOM 224 O GLU A 17 12.264 -1.942 8.248 1.00 0.00 O ATOM 225 CB GLU A 17 12.949 -2.466 5.243 1.00 0.00 C ATOM 226 CG GLU A 17 13.565 -3.858 5.427 1.00 0.00 C ATOM 227 CD GLU A 17 14.676 -3.831 6.484 1.00 0.00 C ATOM 228 OE1 GLU A 17 14.331 -3.682 7.673 1.00 0.00 O ATOM 229 OE2 GLU A 17 15.841 -4.021 6.082 1.00 0.00 O ATOM 0 H GLU A 17 11.832 -0.270 5.352 1.00 0.00 H new ATOM 0 HA GLU A 17 10.903 -2.968 5.485 1.00 0.00 H new ATOM 0 HB2 GLU A 17 12.813 -2.278 4.178 1.00 0.00 H new ATOM 0 HB3 GLU A 17 13.651 -1.718 5.611 1.00 0.00 H new ATOM 0 HG2 GLU A 17 12.791 -4.566 5.725 1.00 0.00 H new ATOM 0 HG3 GLU A 17 13.969 -4.209 4.478 1.00 0.00 H new ATOM 236 N MET A 18 10.828 -3.622 7.801 1.00 0.00 N ATOM 237 CA MET A 18 10.819 -4.195 9.162 1.00 0.00 C ATOM 238 C MET A 18 11.920 -5.231 9.422 1.00 0.00 C ATOM 239 O MET A 18 12.106 -5.648 10.562 1.00 0.00 O ATOM 240 CB MET A 18 9.457 -4.807 9.476 1.00 0.00 C ATOM 241 CG MET A 18 8.564 -3.880 10.297 1.00 0.00 C ATOM 242 SD MET A 18 8.149 -2.293 9.494 1.00 0.00 S ATOM 243 CE MET A 18 8.920 -1.186 10.651 1.00 0.00 C ATOM 0 H MET A 18 10.154 -4.049 7.165 1.00 0.00 H new ATOM 0 HA MET A 18 11.025 -3.357 9.827 1.00 0.00 H new ATOM 0 HB2 MET A 18 8.952 -5.056 8.543 1.00 0.00 H new ATOM 0 HB3 MET A 18 9.601 -5.741 10.020 1.00 0.00 H new ATOM 0 HG2 MET A 18 7.638 -4.405 10.529 1.00 0.00 H new ATOM 0 HG3 MET A 18 9.058 -3.671 11.246 1.00 0.00 H new ATOM 0 HE1 MET A 18 8.771 -0.157 10.325 1.00 0.00 H new ATOM 0 HE2 MET A 18 8.475 -1.322 11.637 1.00 0.00 H new ATOM 0 HE3 MET A 18 9.988 -1.399 10.702 1.00 0.00 H new ATOM 253 N GLU A 19 12.435 -5.805 8.330 1.00 0.00 N ATOM 254 CA GLU A 19 13.479 -6.859 8.321 1.00 0.00 C ATOM 255 C GLU A 19 12.953 -8.210 8.854 1.00 0.00 C ATOM 256 O GLU A 19 13.737 -9.038 9.291 1.00 0.00 O ATOM 257 CB GLU A 19 14.719 -6.376 9.105 1.00 0.00 C ATOM 258 CG GLU A 19 16.004 -7.186 8.902 1.00 0.00 C ATOM 259 CD GLU A 19 16.526 -7.727 10.239 1.00 0.00 C ATOM 260 OE1 GLU A 19 17.206 -6.942 10.935 1.00 0.00 O ATOM 261 OE2 GLU A 19 16.295 -8.923 10.516 1.00 0.00 O ATOM 0 H GLU A 19 12.132 -5.546 7.391 1.00 0.00 H new ATOM 0 HA GLU A 19 13.770 -7.038 7.286 1.00 0.00 H new ATOM 0 HB2 GLU A 19 14.919 -5.341 8.827 1.00 0.00 H new ATOM 0 HB3 GLU A 19 14.476 -6.380 10.167 1.00 0.00 H new ATOM 0 HG2 GLU A 19 15.813 -8.014 8.220 1.00 0.00 H new ATOM 0 HG3 GLU A 19 16.765 -6.559 8.437 1.00 0.00 H new ATOM 268 N SER A 20 11.650 -8.436 8.655 1.00 0.00 N ATOM 269 CA SER A 20 10.864 -9.631 9.072 1.00 0.00 C ATOM 270 C SER A 20 10.435 -9.553 10.551 1.00 0.00 C ATOM 271 O SER A 20 10.480 -10.508 11.323 1.00 0.00 O ATOM 272 CB SER A 20 11.505 -11.003 8.757 1.00 0.00 C ATOM 273 OG SER A 20 12.500 -11.362 9.724 1.00 0.00 O ATOM 0 H SER A 20 11.068 -7.754 8.169 1.00 0.00 H new ATOM 0 HA SER A 20 9.979 -9.585 8.438 1.00 0.00 H new ATOM 0 HB2 SER A 20 10.730 -11.769 8.732 1.00 0.00 H new ATOM 0 HB3 SER A 20 11.956 -10.974 7.765 1.00 0.00 H new ATOM 0 HG SER A 20 13.133 -10.622 9.833 1.00 0.00 H new ATOM 279 N LEU A 21 9.870 -8.405 10.911 1.00 0.00 N ATOM 280 CA LEU A 21 9.364 -8.211 12.280 1.00 0.00 C ATOM 281 C LEU A 21 8.076 -9.035 12.485 1.00 0.00 C ATOM 282 O LEU A 21 8.104 -10.184 12.915 1.00 0.00 O ATOM 283 CB LEU A 21 9.196 -6.709 12.543 1.00 0.00 C ATOM 284 CG LEU A 21 8.702 -6.384 13.954 1.00 0.00 C ATOM 285 CD1 LEU A 21 9.840 -6.430 14.974 1.00 0.00 C ATOM 286 CD2 LEU A 21 7.990 -5.034 13.946 1.00 0.00 C ATOM 0 H LEU A 21 9.749 -7.603 10.292 1.00 0.00 H new ATOM 0 HA LEU A 21 10.074 -8.581 13.019 1.00 0.00 H new ATOM 0 HB2 LEU A 21 10.152 -6.211 12.378 1.00 0.00 H new ATOM 0 HB3 LEU A 21 8.493 -6.298 11.818 1.00 0.00 H new ATOM 0 HG LEU A 21 7.988 -7.147 14.264 1.00 0.00 H new ATOM 0 HD11 LEU A 21 9.451 -6.194 15.964 1.00 0.00 H new ATOM 0 HD12 LEU A 21 10.279 -7.428 14.985 1.00 0.00 H new ATOM 0 HD13 LEU A 21 10.603 -5.701 14.701 1.00 0.00 H new ATOM 0 HD21 LEU A 21 7.638 -4.802 14.951 1.00 0.00 H new ATOM 0 HD22 LEU A 21 8.682 -4.259 13.617 1.00 0.00 H new ATOM 0 HD23 LEU A 21 7.140 -5.075 13.264 1.00 0.00 H new ATOM 298 N THR A 22 6.951 -8.421 12.151 1.00 0.00 N ATOM 299 CA THR A 22 5.610 -9.018 12.299 1.00 0.00 C ATOM 300 C THR A 22 4.739 -8.736 11.064 1.00 0.00 C ATOM 301 O THR A 22 5.231 -8.248 10.045 1.00 0.00 O ATOM 302 CB THR A 22 4.983 -8.468 13.591 1.00 0.00 C ATOM 303 OG1 THR A 22 5.233 -7.060 13.681 1.00 0.00 O ATOM 304 CG2 THR A 22 5.458 -9.220 14.838 1.00 0.00 C ATOM 0 H THR A 22 6.932 -7.478 11.762 1.00 0.00 H new ATOM 0 HA THR A 22 5.685 -10.103 12.372 1.00 0.00 H new ATOM 0 HB THR A 22 3.906 -8.630 13.547 1.00 0.00 H new ATOM 0 HG1 THR A 22 5.491 -6.832 14.598 1.00 0.00 H new ATOM 0 HG21 THR A 22 4.986 -8.793 15.723 1.00 0.00 H new ATOM 0 HG22 THR A 22 5.186 -10.272 14.754 1.00 0.00 H new ATOM 0 HG23 THR A 22 6.541 -9.131 14.926 1.00 0.00 H new ATOM 312 N GLY A 23 3.446 -9.063 11.180 1.00 0.00 N ATOM 313 CA GLY A 23 2.461 -8.852 10.098 1.00 0.00 C ATOM 314 C GLY A 23 1.449 -7.758 10.484 1.00 0.00 C ATOM 315 O GLY A 23 1.700 -6.589 10.180 1.00 0.00 O ATOM 0 H GLY A 23 3.048 -9.480 12.022 1.00 0.00 H new ATOM 0 HA2 GLY A 23 2.977 -8.569 9.181 1.00 0.00 H new ATOM 0 HA3 GLY A 23 1.935 -9.784 9.893 1.00 0.00 H new ATOM 319 N PRO A 24 0.451 -8.092 11.322 1.00 0.00 N ATOM 320 CA PRO A 24 -0.538 -7.115 11.826 1.00 0.00 C ATOM 321 C PRO A 24 0.029 -6.077 12.815 1.00 0.00 C ATOM 322 O PRO A 24 -0.658 -5.135 13.192 1.00 0.00 O ATOM 323 CB PRO A 24 -1.641 -7.975 12.447 1.00 0.00 C ATOM 324 CG PRO A 24 -0.887 -9.196 12.969 1.00 0.00 C ATOM 325 CD PRO A 24 0.193 -9.427 11.911 1.00 0.00 C ATOM 0 HA PRO A 24 -0.901 -6.484 11.015 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -2.157 -7.448 13.250 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -2.396 -8.253 11.711 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -0.453 -9.010 13.952 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -1.543 -10.061 13.069 1.00 0.00 H new ATOM 0 HD2 PRO A 24 1.097 -9.843 12.355 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -0.143 -10.134 11.153 1.00 0.00 H new ATOM 333 N GLN A 25 1.304 -6.232 13.176 1.00 0.00 N ATOM 334 CA GLN A 25 2.036 -5.278 14.028 1.00 0.00 C ATOM 335 C GLN A 25 3.009 -4.424 13.200 1.00 0.00 C ATOM 336 O GLN A 25 3.187 -3.248 13.481 1.00 0.00 O ATOM 337 CB GLN A 25 2.795 -6.049 15.110 1.00 0.00 C ATOM 338 CG GLN A 25 3.647 -5.155 16.019 1.00 0.00 C ATOM 339 CD GLN A 25 2.852 -4.730 17.245 1.00 0.00 C ATOM 340 OE1 GLN A 25 3.122 -5.414 18.330 1.00 0.00 O flip ATOM 341 NE2 GLN A 25 1.968 -3.881 17.215 1.00 0.00 N flip ATOM 0 H GLN A 25 1.868 -7.030 12.885 1.00 0.00 H new ATOM 0 HA GLN A 25 1.318 -4.602 14.493 1.00 0.00 H new ATOM 0 HB2 GLN A 25 2.080 -6.598 15.722 1.00 0.00 H new ATOM 0 HB3 GLN A 25 3.440 -6.787 14.633 1.00 0.00 H new ATOM 0 HG2 GLN A 25 4.545 -5.691 16.328 1.00 0.00 H new ATOM 0 HG3 GLN A 25 3.976 -4.274 15.468 1.00 0.00 H new ATOM 0 HE21 GLN A 25 1.784 -3.367 16.354 1.00 0.00 H new ATOM 0 HE22 GLN A 25 1.417 -3.689 18.051 1.00 0.00 H new ATOM 350 N ALA A 26 3.562 -4.969 12.121 1.00 0.00 N ATOM 351 CA ALA A 26 4.479 -4.196 11.272 1.00 0.00 C ATOM 352 C ALA A 26 3.766 -3.000 10.627 1.00 0.00 C ATOM 353 O ALA A 26 4.334 -1.919 10.594 1.00 0.00 O ATOM 354 CB ALA A 26 5.103 -5.120 10.240 1.00 0.00 C ATOM 0 H ALA A 26 3.399 -5.927 11.812 1.00 0.00 H new ATOM 0 HA ALA A 26 5.277 -3.778 11.886 1.00 0.00 H new ATOM 0 HB1 ALA A 26 5.784 -4.551 9.607 1.00 0.00 H new ATOM 0 HB2 ALA A 26 5.654 -5.912 10.747 1.00 0.00 H new ATOM 0 HB3 ALA A 26 4.319 -5.560 9.624 1.00 0.00 H new ATOM 360 N ILE A 27 2.464 -3.144 10.364 1.00 0.00 N ATOM 361 CA ILE A 27 1.590 -2.046 9.891 1.00 0.00 C ATOM 362 C ILE A 27 1.518 -0.905 10.933 1.00 0.00 C ATOM 363 O ILE A 27 1.612 0.261 10.559 1.00 0.00 O ATOM 364 CB ILE A 27 0.181 -2.573 9.550 1.00 0.00 C ATOM 365 CG1 ILE A 27 0.258 -3.802 8.628 1.00 0.00 C ATOM 366 CG2 ILE A 27 -0.647 -1.464 8.879 1.00 0.00 C ATOM 367 CD1 ILE A 27 -1.053 -4.592 8.562 1.00 0.00 C ATOM 0 H ILE A 27 1.974 -4.032 10.472 1.00 0.00 H new ATOM 0 HA ILE A 27 2.027 -1.638 8.979 1.00 0.00 H new ATOM 0 HB ILE A 27 -0.304 -2.874 10.479 1.00 0.00 H new ATOM 0 HG12 ILE A 27 0.530 -3.478 7.623 1.00 0.00 H new ATOM 0 HG13 ILE A 27 1.054 -4.460 8.977 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -1.640 -1.845 8.642 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -0.736 -0.615 9.557 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -0.152 -1.145 7.962 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -0.930 -5.445 7.895 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -1.315 -4.946 9.559 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -1.847 -3.948 8.185 1.00 0.00 H new ATOM 379 N SER A 28 1.502 -1.253 12.222 1.00 0.00 N ATOM 380 CA SER A 28 1.483 -0.258 13.318 1.00 0.00 C ATOM 381 C SER A 28 2.892 0.278 13.592 1.00 0.00 C ATOM 382 O SER A 28 3.087 1.480 13.516 1.00 0.00 O ATOM 383 CB SER A 28 0.880 -0.790 14.628 1.00 0.00 C ATOM 384 OG SER A 28 1.755 -1.731 15.255 1.00 0.00 O ATOM 0 H SER A 28 1.502 -2.221 12.542 1.00 0.00 H new ATOM 0 HA SER A 28 0.834 0.545 12.969 1.00 0.00 H new ATOM 0 HB2 SER A 28 0.688 0.041 15.307 1.00 0.00 H new ATOM 0 HB3 SER A 28 -0.081 -1.263 14.424 1.00 0.00 H new ATOM 0 HG SER A 28 2.138 -2.325 14.576 1.00 0.00 H new ATOM 390 N LYS A 29 3.883 -0.610 13.668 1.00 0.00 N ATOM 391 CA LYS A 29 5.305 -0.254 13.836 1.00 0.00 C ATOM 392 C LYS A 29 5.834 0.605 12.665 1.00 0.00 C ATOM 393 O LYS A 29 6.843 1.284 12.792 1.00 0.00 O ATOM 394 CB LYS A 29 6.095 -1.553 14.018 1.00 0.00 C ATOM 395 CG LYS A 29 7.306 -1.356 14.936 1.00 0.00 C ATOM 396 CD LYS A 29 7.270 -2.213 16.212 1.00 0.00 C ATOM 397 CE LYS A 29 6.413 -1.639 17.344 1.00 0.00 C ATOM 398 NZ LYS A 29 6.789 -2.269 18.621 1.00 0.00 N ATOM 0 H LYS A 29 3.725 -1.616 13.614 1.00 0.00 H new ATOM 0 HA LYS A 29 5.429 0.373 14.719 1.00 0.00 H new ATOM 0 HB2 LYS A 29 5.443 -2.320 14.436 1.00 0.00 H new ATOM 0 HB3 LYS A 29 6.430 -1.914 13.046 1.00 0.00 H new ATOM 0 HG2 LYS A 29 8.213 -1.590 14.379 1.00 0.00 H new ATOM 0 HG3 LYS A 29 7.368 -0.305 15.218 1.00 0.00 H new ATOM 0 HD2 LYS A 29 6.895 -3.204 15.957 1.00 0.00 H new ATOM 0 HD3 LYS A 29 8.289 -2.342 16.576 1.00 0.00 H new ATOM 0 HE2 LYS A 29 6.551 -0.560 17.406 1.00 0.00 H new ATOM 0 HE3 LYS A 29 5.357 -1.814 17.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 6.205 -1.877 19.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 6.636 -3.296 18.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 7.792 -2.080 18.819 1.00 0.00 H new ATOM 412 N ALA A 30 5.120 0.551 11.543 1.00 0.00 N ATOM 413 CA ALA A 30 5.277 1.405 10.353 1.00 0.00 C ATOM 414 C ALA A 30 4.469 2.701 10.470 1.00 0.00 C ATOM 415 O ALA A 30 5.048 3.771 10.499 1.00 0.00 O ATOM 416 CB ALA A 30 4.765 0.657 9.128 1.00 0.00 C ATOM 0 H ALA A 30 4.369 -0.129 11.426 1.00 0.00 H new ATOM 0 HA ALA A 30 6.336 1.650 10.265 1.00 0.00 H new ATOM 0 HB1 ALA A 30 4.879 1.285 8.244 1.00 0.00 H new ATOM 0 HB2 ALA A 30 5.337 -0.261 8.997 1.00 0.00 H new ATOM 0 HB3 ALA A 30 3.712 0.412 9.265 1.00 0.00 H new ATOM 422 N VAL A 31 3.167 2.598 10.735 1.00 0.00 N ATOM 423 CA VAL A 31 2.262 3.757 10.909 1.00 0.00 C ATOM 424 C VAL A 31 2.725 4.693 12.037 1.00 0.00 C ATOM 425 O VAL A 31 2.819 5.903 11.854 1.00 0.00 O ATOM 426 CB VAL A 31 0.827 3.221 11.080 1.00 0.00 C ATOM 427 CG1 VAL A 31 -0.126 4.045 11.948 1.00 0.00 C ATOM 428 CG2 VAL A 31 0.203 3.189 9.696 1.00 0.00 C ATOM 0 H VAL A 31 2.695 1.700 10.838 1.00 0.00 H new ATOM 0 HA VAL A 31 2.285 4.392 10.023 1.00 0.00 H new ATOM 0 HB VAL A 31 0.941 2.262 11.585 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -1.100 3.556 11.984 1.00 0.00 H new ATOM 0 HG12 VAL A 31 0.278 4.124 12.957 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -0.236 5.042 11.522 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -0.818 2.815 9.766 1.00 0.00 H new ATOM 0 HG22 VAL A 31 0.193 4.196 9.278 1.00 0.00 H new ATOM 0 HG23 VAL A 31 0.786 2.534 9.049 1.00 0.00 H new ATOM 438 N ALA A 32 3.169 4.075 13.119 1.00 0.00 N ATOM 439 CA ALA A 32 3.688 4.743 14.323 1.00 0.00 C ATOM 440 C ALA A 32 5.117 5.280 14.131 1.00 0.00 C ATOM 441 O ALA A 32 5.625 5.975 14.999 1.00 0.00 O ATOM 442 CB ALA A 32 3.630 3.777 15.509 1.00 0.00 C ATOM 0 H ALA A 32 3.183 3.058 13.196 1.00 0.00 H new ATOM 0 HA ALA A 32 3.055 5.608 14.521 1.00 0.00 H new ATOM 0 HB1 ALA A 32 4.015 4.272 16.401 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.598 3.472 15.680 1.00 0.00 H new ATOM 0 HB3 ALA A 32 4.237 2.898 15.292 1.00 0.00 H new ATOM 448 N GLU A 33 5.767 4.875 13.040 1.00 0.00 N ATOM 449 CA GLU A 33 7.104 5.366 12.639 1.00 0.00 C ATOM 450 C GLU A 33 7.108 6.152 11.315 1.00 0.00 C ATOM 451 O GLU A 33 8.145 6.639 10.875 1.00 0.00 O ATOM 452 CB GLU A 33 8.040 4.162 12.532 1.00 0.00 C ATOM 453 CG GLU A 33 8.382 3.583 13.911 1.00 0.00 C ATOM 454 CD GLU A 33 9.630 4.214 14.525 1.00 0.00 C ATOM 455 OE1 GLU A 33 10.673 4.208 13.834 1.00 0.00 O ATOM 456 OE2 GLU A 33 9.533 4.629 15.700 1.00 0.00 O ATOM 0 H GLU A 33 5.381 4.186 12.394 1.00 0.00 H new ATOM 0 HA GLU A 33 7.438 6.070 13.401 1.00 0.00 H new ATOM 0 HB2 GLU A 33 7.572 3.391 11.920 1.00 0.00 H new ATOM 0 HB3 GLU A 33 8.958 4.459 12.024 1.00 0.00 H new ATOM 0 HG2 GLU A 33 7.537 3.733 14.583 1.00 0.00 H new ATOM 0 HG3 GLU A 33 8.531 2.507 13.821 1.00 0.00 H new ATOM 463 N THR A 34 5.921 6.309 10.739 1.00 0.00 N ATOM 464 CA THR A 34 5.712 7.015 9.465 1.00 0.00 C ATOM 465 C THR A 34 4.809 8.245 9.639 1.00 0.00 C ATOM 466 O THR A 34 5.090 9.297 9.078 1.00 0.00 O ATOM 467 CB THR A 34 5.153 6.020 8.440 1.00 0.00 C ATOM 468 OG1 THR A 34 6.149 5.054 8.097 1.00 0.00 O ATOM 469 CG2 THR A 34 4.709 6.703 7.164 1.00 0.00 C ATOM 0 H THR A 34 5.059 5.946 11.145 1.00 0.00 H new ATOM 0 HA THR A 34 6.664 7.400 9.100 1.00 0.00 H new ATOM 0 HB THR A 34 4.290 5.544 8.906 1.00 0.00 H new ATOM 0 HG1 THR A 34 6.144 4.330 8.758 1.00 0.00 H new ATOM 0 HG21 THR A 34 4.321 5.959 6.469 1.00 0.00 H new ATOM 0 HG22 THR A 34 3.928 7.428 7.392 1.00 0.00 H new ATOM 0 HG23 THR A 34 5.558 7.215 6.711 1.00 0.00 H new ATOM 477 N LEU A 35 3.759 8.121 10.443 1.00 0.00 N ATOM 478 CA LEU A 35 2.906 9.278 10.779 1.00 0.00 C ATOM 479 C LEU A 35 3.656 10.327 11.613 1.00 0.00 C ATOM 480 O LEU A 35 3.348 11.513 11.563 1.00 0.00 O ATOM 481 CB LEU A 35 1.623 8.821 11.476 1.00 0.00 C ATOM 482 CG LEU A 35 0.512 8.496 10.469 1.00 0.00 C ATOM 483 CD1 LEU A 35 0.745 7.214 9.664 1.00 0.00 C ATOM 484 CD2 LEU A 35 -0.817 8.435 11.213 1.00 0.00 C ATOM 0 H LEU A 35 3.471 7.243 10.876 1.00 0.00 H new ATOM 0 HA LEU A 35 2.630 9.763 9.843 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.833 7.940 12.082 1.00 0.00 H new ATOM 0 HB3 LEU A 35 1.281 9.602 12.155 1.00 0.00 H new ATOM 0 HG LEU A 35 0.507 9.294 9.727 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -0.087 7.060 8.977 1.00 0.00 H new ATOM 0 HD12 LEU A 35 1.672 7.304 9.097 1.00 0.00 H new ATOM 0 HD13 LEU A 35 0.816 6.365 10.344 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -1.617 8.205 10.510 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -0.771 7.659 11.977 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -1.014 9.398 11.685 1.00 0.00 H new ATOM 496 N VAL A 36 4.677 9.838 12.313 1.00 0.00 N ATOM 497 CA VAL A 36 5.608 10.666 13.106 1.00 0.00 C ATOM 498 C VAL A 36 7.004 10.787 12.469 1.00 0.00 C ATOM 499 O VAL A 36 7.845 11.491 13.026 1.00 0.00 O ATOM 500 CB VAL A 36 5.718 10.170 14.563 1.00 0.00 C ATOM 501 CG1 VAL A 36 4.355 10.129 15.260 1.00 0.00 C ATOM 502 CG2 VAL A 36 6.443 8.825 14.694 1.00 0.00 C ATOM 0 H VAL A 36 4.892 8.842 12.352 1.00 0.00 H new ATOM 0 HA VAL A 36 5.175 11.666 13.114 1.00 0.00 H new ATOM 0 HB VAL A 36 6.337 10.908 15.074 1.00 0.00 H new ATOM 0 HG11 VAL A 36 4.480 9.774 16.283 1.00 0.00 H new ATOM 0 HG12 VAL A 36 3.923 11.130 15.273 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.691 9.454 14.720 1.00 0.00 H new ATOM 0 HG21 VAL A 36 6.485 8.535 15.744 1.00 0.00 H new ATOM 0 HG22 VAL A 36 5.904 8.065 14.129 1.00 0.00 H new ATOM 0 HG23 VAL A 36 7.456 8.918 14.302 1.00 0.00 H new ATOM 512 N ALA A 37 7.272 9.998 11.415 1.00 0.00 N ATOM 513 CA ALA A 37 8.549 10.001 10.672 1.00 0.00 C ATOM 514 C ALA A 37 9.074 11.432 10.531 1.00 0.00 C ATOM 515 O ALA A 37 8.318 12.353 10.243 1.00 0.00 O ATOM 516 CB ALA A 37 8.369 9.398 9.276 1.00 0.00 C ATOM 0 H ALA A 37 6.597 9.328 11.047 1.00 0.00 H new ATOM 0 HA ALA A 37 9.264 9.398 11.232 1.00 0.00 H new ATOM 0 HB1 ALA A 37 9.323 9.411 8.748 1.00 0.00 H new ATOM 0 HB2 ALA A 37 8.018 8.370 9.366 1.00 0.00 H new ATOM 0 HB3 ALA A 37 7.638 9.983 8.718 1.00 0.00 H new ATOM 522 N ASP A 38 10.211 11.625 11.187 1.00 0.00 N ATOM 523 CA ASP A 38 10.824 12.955 11.275 1.00 0.00 C ATOM 524 C ASP A 38 12.251 12.903 10.704 1.00 0.00 C ATOM 525 O ASP A 38 13.119 12.285 11.322 1.00 0.00 O ATOM 526 CB ASP A 38 10.775 13.474 12.717 1.00 0.00 C ATOM 527 CG ASP A 38 10.868 15.003 12.736 1.00 0.00 C ATOM 528 OD1 ASP A 38 12.007 15.501 12.603 1.00 0.00 O ATOM 529 OD2 ASP A 38 9.801 15.645 12.835 1.00 0.00 O ATOM 0 H ASP A 38 10.728 10.887 11.665 1.00 0.00 H new ATOM 0 HA ASP A 38 10.259 13.667 10.673 1.00 0.00 H new ATOM 0 HB2 ASP A 38 9.849 13.153 13.195 1.00 0.00 H new ATOM 0 HB3 ASP A 38 11.596 13.046 13.293 1.00 0.00 H new ATOM 534 N PRO A 39 12.413 13.447 9.490 1.00 0.00 N ATOM 535 CA PRO A 39 11.354 14.074 8.669 1.00 0.00 C ATOM 536 C PRO A 39 10.407 13.051 8.016 1.00 0.00 C ATOM 537 O PRO A 39 10.743 11.875 7.892 1.00 0.00 O ATOM 538 CB PRO A 39 12.114 14.914 7.644 1.00 0.00 C ATOM 539 CG PRO A 39 13.414 14.136 7.440 1.00 0.00 C ATOM 540 CD PRO A 39 13.725 13.556 8.821 1.00 0.00 C ATOM 0 HA PRO A 39 10.681 14.680 9.276 1.00 0.00 H new ATOM 0 HB2 PRO A 39 11.556 15.014 6.713 1.00 0.00 H new ATOM 0 HB3 PRO A 39 12.303 15.922 8.012 1.00 0.00 H new ATOM 0 HG2 PRO A 39 13.294 13.349 6.695 1.00 0.00 H new ATOM 0 HG3 PRO A 39 14.216 14.786 7.091 1.00 0.00 H new ATOM 0 HD2 PRO A 39 14.210 12.583 8.741 1.00 0.00 H new ATOM 0 HD3 PRO A 39 14.401 14.204 9.379 1.00 0.00 H new ATOM 548 N THR A 40 9.177 13.500 7.789 1.00 0.00 N ATOM 549 CA THR A 40 8.124 12.639 7.208 1.00 0.00 C ATOM 550 C THR A 40 8.215 12.593 5.675 1.00 0.00 C ATOM 551 O THR A 40 8.592 13.598 5.061 1.00 0.00 O ATOM 552 CB THR A 40 6.719 12.990 7.749 1.00 0.00 C ATOM 553 OG1 THR A 40 5.999 11.763 7.860 1.00 0.00 O ATOM 554 CG2 THR A 40 5.887 13.980 6.920 1.00 0.00 C ATOM 0 H THR A 40 8.874 14.452 7.994 1.00 0.00 H new ATOM 0 HA THR A 40 8.305 11.617 7.542 1.00 0.00 H new ATOM 0 HB THR A 40 6.879 13.506 8.696 1.00 0.00 H new ATOM 0 HG1 THR A 40 5.099 11.942 8.203 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.925 14.142 7.405 1.00 0.00 H new ATOM 0 HG22 THR A 40 6.419 14.928 6.844 1.00 0.00 H new ATOM 0 HG23 THR A 40 5.726 13.573 5.922 1.00 0.00 H new ATOM 562 N PRO A 41 7.932 11.439 5.068 1.00 0.00 N ATOM 563 CA PRO A 41 7.886 11.321 3.603 1.00 0.00 C ATOM 564 C PRO A 41 6.679 12.066 3.027 1.00 0.00 C ATOM 565 O PRO A 41 5.631 12.205 3.659 1.00 0.00 O ATOM 566 CB PRO A 41 7.814 9.821 3.343 1.00 0.00 C ATOM 567 CG PRO A 41 7.082 9.289 4.572 1.00 0.00 C ATOM 568 CD PRO A 41 7.658 10.135 5.704 1.00 0.00 C ATOM 0 HA PRO A 41 8.753 11.771 3.119 1.00 0.00 H new ATOM 0 HB2 PRO A 41 7.273 9.597 2.424 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.806 9.381 3.244 1.00 0.00 H new ATOM 0 HG2 PRO A 41 6.003 9.412 4.484 1.00 0.00 H new ATOM 0 HG3 PRO A 41 7.270 8.226 4.726 1.00 0.00 H new ATOM 0 HD2 PRO A 41 6.952 10.233 6.529 1.00 0.00 H new ATOM 0 HD3 PRO A 41 8.566 9.691 6.113 1.00 0.00 H new ATOM 576 N THR A 42 6.891 12.559 1.815 1.00 0.00 N ATOM 577 CA THR A 42 5.846 13.283 1.071 1.00 0.00 C ATOM 578 C THR A 42 4.835 12.285 0.489 1.00 0.00 C ATOM 579 O THR A 42 5.176 11.157 0.137 1.00 0.00 O ATOM 580 CB THR A 42 6.433 14.211 -0.011 1.00 0.00 C ATOM 581 OG1 THR A 42 5.392 15.074 -0.476 1.00 0.00 O ATOM 582 CG2 THR A 42 7.091 13.482 -1.192 1.00 0.00 C ATOM 0 H THR A 42 7.777 12.475 1.317 1.00 0.00 H new ATOM 0 HA THR A 42 5.323 13.937 1.769 1.00 0.00 H new ATOM 0 HB THR A 42 7.242 14.773 0.455 1.00 0.00 H new ATOM 0 HG1 THR A 42 5.748 15.674 -1.165 1.00 0.00 H new ATOM 0 HG21 THR A 42 7.475 14.214 -1.903 1.00 0.00 H new ATOM 0 HG22 THR A 42 7.912 12.865 -0.827 1.00 0.00 H new ATOM 0 HG23 THR A 42 6.353 12.849 -1.686 1.00 0.00 H new ATOM 590 N ALA A 43 3.614 12.767 0.348 1.00 0.00 N ATOM 591 CA ALA A 43 2.518 11.977 -0.226 1.00 0.00 C ATOM 592 C ALA A 43 2.409 12.212 -1.743 1.00 0.00 C ATOM 593 O ALA A 43 2.302 13.343 -2.223 1.00 0.00 O ATOM 594 CB ALA A 43 1.258 12.358 0.541 1.00 0.00 C ATOM 0 H ALA A 43 3.345 13.712 0.624 1.00 0.00 H new ATOM 0 HA ALA A 43 2.690 10.906 -0.122 1.00 0.00 H new ATOM 0 HB1 ALA A 43 0.410 11.795 0.150 1.00 0.00 H new ATOM 0 HB2 ALA A 43 1.391 12.127 1.598 1.00 0.00 H new ATOM 0 HB3 ALA A 43 1.070 13.425 0.424 1.00 0.00 H new ATOM 600 N THR A 44 2.668 11.142 -2.486 1.00 0.00 N ATOM 601 CA THR A 44 2.653 11.180 -3.968 1.00 0.00 C ATOM 602 C THR A 44 1.535 10.315 -4.567 1.00 0.00 C ATOM 603 O THR A 44 1.309 9.190 -4.140 1.00 0.00 O ATOM 604 CB THR A 44 4.058 10.808 -4.482 1.00 0.00 C ATOM 605 OG1 THR A 44 4.924 11.890 -4.136 1.00 0.00 O ATOM 606 CG2 THR A 44 4.171 10.555 -5.989 1.00 0.00 C ATOM 0 H THR A 44 2.893 10.227 -2.096 1.00 0.00 H new ATOM 0 HA THR A 44 2.418 12.190 -4.304 1.00 0.00 H new ATOM 0 HB THR A 44 4.322 9.858 -4.017 1.00 0.00 H new ATOM 0 HG1 THR A 44 5.833 11.693 -4.445 1.00 0.00 H new ATOM 0 HG21 THR A 44 5.201 10.302 -6.239 1.00 0.00 H new ATOM 0 HG22 THR A 44 3.516 9.730 -6.270 1.00 0.00 H new ATOM 0 HG23 THR A 44 3.876 11.453 -6.532 1.00 0.00 H new ATOM 614 N ILE A 45 0.904 10.823 -5.621 1.00 0.00 N ATOM 615 CA ILE A 45 -0.160 10.093 -6.338 1.00 0.00 C ATOM 616 C ILE A 45 0.459 8.949 -7.157 1.00 0.00 C ATOM 617 O ILE A 45 1.392 9.150 -7.941 1.00 0.00 O ATOM 618 CB ILE A 45 -1.009 11.066 -7.188 1.00 0.00 C ATOM 619 CG1 ILE A 45 -1.991 11.850 -6.316 1.00 0.00 C ATOM 620 CG2 ILE A 45 -1.798 10.416 -8.331 1.00 0.00 C ATOM 621 CD1 ILE A 45 -1.484 13.210 -5.831 1.00 0.00 C ATOM 0 H ILE A 45 1.107 11.745 -6.007 1.00 0.00 H new ATOM 0 HA ILE A 45 -0.847 9.639 -5.624 1.00 0.00 H new ATOM 0 HB ILE A 45 -0.270 11.724 -7.644 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -2.912 12.002 -6.879 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -2.246 11.243 -5.447 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -2.360 11.181 -8.866 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -1.107 9.926 -9.017 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -2.488 9.678 -7.923 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -2.251 13.688 -5.221 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -0.582 13.071 -5.236 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -1.258 13.842 -6.690 1.00 0.00 H new ATOM 633 N VAL A 46 -0.092 7.771 -6.909 1.00 0.00 N ATOM 634 CA VAL A 46 0.284 6.517 -7.589 1.00 0.00 C ATOM 635 C VAL A 46 -0.954 5.685 -7.967 1.00 0.00 C ATOM 636 O VAL A 46 -2.023 5.810 -7.371 1.00 0.00 O ATOM 637 CB VAL A 46 1.309 5.687 -6.783 1.00 0.00 C ATOM 638 CG1 VAL A 46 2.678 6.371 -6.729 1.00 0.00 C ATOM 639 CG2 VAL A 46 0.856 5.387 -5.353 1.00 0.00 C ATOM 0 H VAL A 46 -0.830 7.645 -6.216 1.00 0.00 H new ATOM 0 HA VAL A 46 0.782 6.803 -8.515 1.00 0.00 H new ATOM 0 HB VAL A 46 1.387 4.742 -7.321 1.00 0.00 H new ATOM 0 HG11 VAL A 46 3.370 5.756 -6.154 1.00 0.00 H new ATOM 0 HG12 VAL A 46 3.061 6.498 -7.741 1.00 0.00 H new ATOM 0 HG13 VAL A 46 2.579 7.347 -6.253 1.00 0.00 H new ATOM 0 HG21 VAL A 46 1.622 4.802 -4.844 1.00 0.00 H new ATOM 0 HG22 VAL A 46 0.699 6.323 -4.817 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -0.076 4.822 -5.377 1.00 0.00 H new ATOM 649 N HIS A 47 -0.747 4.802 -8.935 1.00 0.00 N ATOM 650 CA HIS A 47 -1.791 3.889 -9.438 1.00 0.00 C ATOM 651 C HIS A 47 -1.533 2.454 -8.959 1.00 0.00 C ATOM 652 O HIS A 47 -0.462 1.895 -9.194 1.00 0.00 O ATOM 653 CB HIS A 47 -1.883 3.947 -10.965 1.00 0.00 C ATOM 654 CG HIS A 47 -2.607 5.210 -11.488 1.00 0.00 C ATOM 655 ND1 HIS A 47 -3.770 5.202 -12.114 1.00 0.00 N ATOM 656 CD2 HIS A 47 -2.164 6.456 -11.428 1.00 0.00 C ATOM 657 CE1 HIS A 47 -4.058 6.470 -12.451 1.00 0.00 C ATOM 658 NE2 HIS A 47 -3.069 7.238 -12.025 1.00 0.00 N ATOM 0 H HIS A 47 0.152 4.690 -9.403 1.00 0.00 H new ATOM 0 HA HIS A 47 -2.749 4.216 -9.034 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -0.877 3.914 -11.384 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -2.407 3.061 -11.324 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -1.238 6.782 -10.978 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -4.941 6.803 -12.977 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -3.008 8.250 -12.133 1.00 0.00 H new ATOM 666 N PHE A 48 -2.449 2.017 -8.106 1.00 0.00 N ATOM 667 CA PHE A 48 -2.506 0.679 -7.490 1.00 0.00 C ATOM 668 C PHE A 48 -3.186 -0.318 -8.439 1.00 0.00 C ATOM 669 O PHE A 48 -4.409 -0.319 -8.613 1.00 0.00 O ATOM 670 CB PHE A 48 -3.305 0.768 -6.186 1.00 0.00 C ATOM 671 CG PHE A 48 -2.608 0.055 -5.034 1.00 0.00 C ATOM 672 CD1 PHE A 48 -2.816 -1.292 -4.774 1.00 0.00 C ATOM 673 CD2 PHE A 48 -1.750 0.773 -4.211 1.00 0.00 C ATOM 674 CE1 PHE A 48 -2.176 -1.897 -3.705 1.00 0.00 C ATOM 675 CE2 PHE A 48 -1.097 0.177 -3.155 1.00 0.00 C ATOM 676 CZ PHE A 48 -1.305 -1.177 -2.895 1.00 0.00 C ATOM 0 H PHE A 48 -3.220 2.612 -7.802 1.00 0.00 H new ATOM 0 HA PHE A 48 -1.492 0.333 -7.288 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -3.455 1.816 -5.925 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -4.293 0.332 -6.337 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -3.477 -1.868 -5.405 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -1.591 1.824 -4.404 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -2.356 -2.942 -3.498 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -0.429 0.754 -2.533 1.00 0.00 H new ATOM 0 HZ PHE A 48 -0.796 -1.661 -2.074 1.00 0.00 H new ATOM 686 N LYS A 49 -2.346 -1.099 -9.102 1.00 0.00 N ATOM 687 CA LYS A 49 -2.808 -2.138 -10.039 1.00 0.00 C ATOM 688 C LYS A 49 -2.655 -3.518 -9.390 1.00 0.00 C ATOM 689 O LYS A 49 -1.555 -3.942 -9.049 1.00 0.00 O ATOM 690 CB LYS A 49 -2.068 -2.036 -11.380 1.00 0.00 C ATOM 691 CG LYS A 49 -2.648 -3.046 -12.376 1.00 0.00 C ATOM 692 CD LYS A 49 -2.831 -2.497 -13.791 1.00 0.00 C ATOM 693 CE LYS A 49 -1.610 -2.755 -14.669 1.00 0.00 C ATOM 694 NZ LYS A 49 -2.038 -2.824 -16.072 1.00 0.00 N ATOM 0 H LYS A 49 -1.332 -1.040 -9.014 1.00 0.00 H new ATOM 0 HA LYS A 49 -3.865 -1.986 -10.258 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.159 -1.026 -11.779 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.005 -2.226 -11.234 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -1.992 -3.916 -12.418 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -3.613 -3.392 -12.005 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -3.708 -2.956 -14.247 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -3.022 -1.425 -13.742 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -0.877 -1.960 -14.538 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -1.126 -3.687 -14.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -1.609 -3.656 -16.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -3.074 -2.902 -16.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -1.735 -1.963 -16.570 1.00 0.00 H new ATOM 708 N VAL A 50 -3.808 -4.100 -9.089 1.00 0.00 N ATOM 709 CA VAL A 50 -3.897 -5.406 -8.402 1.00 0.00 C ATOM 710 C VAL A 50 -4.319 -6.467 -9.431 1.00 0.00 C ATOM 711 O VAL A 50 -5.395 -6.390 -10.026 1.00 0.00 O ATOM 712 CB VAL A 50 -4.899 -5.356 -7.231 1.00 0.00 C ATOM 713 CG1 VAL A 50 -4.858 -6.635 -6.386 1.00 0.00 C ATOM 714 CG2 VAL A 50 -4.721 -4.136 -6.321 1.00 0.00 C ATOM 0 H VAL A 50 -4.715 -3.689 -9.309 1.00 0.00 H new ATOM 0 HA VAL A 50 -2.924 -5.660 -7.980 1.00 0.00 H new ATOM 0 HB VAL A 50 -5.876 -5.269 -7.706 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -5.579 -6.557 -5.572 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -5.108 -7.492 -7.011 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -3.858 -6.766 -5.973 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -5.460 -4.168 -5.520 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -3.719 -4.146 -5.891 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -4.857 -3.225 -6.903 1.00 0.00 H new ATOM 724 N SER A 51 -3.361 -7.324 -9.751 1.00 0.00 N ATOM 725 CA SER A 51 -3.570 -8.435 -10.701 1.00 0.00 C ATOM 726 C SER A 51 -3.176 -9.765 -10.048 1.00 0.00 C ATOM 727 O SER A 51 -2.491 -9.775 -9.021 1.00 0.00 O ATOM 728 CB SER A 51 -2.762 -8.212 -11.986 1.00 0.00 C ATOM 729 OG SER A 51 -1.361 -8.432 -11.787 1.00 0.00 O ATOM 0 H SER A 51 -2.417 -7.280 -9.368 1.00 0.00 H new ATOM 0 HA SER A 51 -4.627 -8.470 -10.966 1.00 0.00 H new ATOM 0 HB2 SER A 51 -3.127 -8.883 -12.764 1.00 0.00 H new ATOM 0 HB3 SER A 51 -2.922 -7.194 -12.342 1.00 0.00 H new ATOM 0 HG SER A 51 -1.083 -8.024 -10.941 1.00 0.00 H new ATOM 735 N ALA A 52 -3.597 -10.859 -10.682 1.00 0.00 N ATOM 736 CA ALA A 52 -3.288 -12.238 -10.248 1.00 0.00 C ATOM 737 C ALA A 52 -1.821 -12.614 -10.544 1.00 0.00 C ATOM 738 O ALA A 52 -1.491 -13.485 -11.349 1.00 0.00 O ATOM 739 CB ALA A 52 -4.290 -13.194 -10.907 1.00 0.00 C ATOM 0 H ALA A 52 -4.171 -10.821 -11.524 1.00 0.00 H new ATOM 0 HA ALA A 52 -3.392 -12.316 -9.166 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -4.075 -14.217 -10.597 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -5.302 -12.927 -10.602 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -4.206 -13.119 -11.991 1.00 0.00 H new ATOM 745 N GLN A 53 -0.958 -11.863 -9.868 1.00 0.00 N ATOM 746 CA GLN A 53 0.509 -11.910 -9.986 1.00 0.00 C ATOM 747 C GLN A 53 1.193 -11.002 -8.956 1.00 0.00 C ATOM 748 O GLN A 53 2.114 -11.443 -8.276 1.00 0.00 O ATOM 749 CB GLN A 53 0.971 -11.460 -11.373 1.00 0.00 C ATOM 750 CG GLN A 53 1.873 -12.547 -11.953 1.00 0.00 C ATOM 751 CD GLN A 53 2.859 -12.034 -13.000 1.00 0.00 C ATOM 752 OE1 GLN A 53 3.177 -10.855 -13.128 1.00 0.00 O ATOM 753 NE2 GLN A 53 3.456 -12.956 -13.715 1.00 0.00 N ATOM 0 H GLN A 53 -1.270 -11.169 -9.188 1.00 0.00 H new ATOM 0 HA GLN A 53 0.790 -12.948 -9.810 1.00 0.00 H new ATOM 0 HB2 GLN A 53 0.113 -11.292 -12.023 1.00 0.00 H new ATOM 0 HB3 GLN A 53 1.510 -10.515 -11.306 1.00 0.00 H new ATOM 0 HG2 GLN A 53 2.430 -13.016 -11.142 1.00 0.00 H new ATOM 0 HG3 GLN A 53 1.251 -13.322 -12.402 1.00 0.00 H new ATOM 0 HE21 GLN A 53 3.191 -13.935 -13.608 1.00 0.00 H new ATOM 0 HE22 GLN A 53 4.185 -12.694 -14.378 1.00 0.00 H new ATOM 762 N GLY A 54 0.633 -9.796 -8.781 1.00 0.00 N ATOM 763 CA GLY A 54 1.208 -8.785 -7.882 1.00 0.00 C ATOM 764 C GLY A 54 0.600 -7.397 -8.063 1.00 0.00 C ATOM 765 O GLY A 54 -0.125 -7.120 -9.022 1.00 0.00 O ATOM 0 H GLY A 54 -0.221 -9.497 -9.252 1.00 0.00 H new ATOM 0 HA2 GLY A 54 1.065 -9.104 -6.850 1.00 0.00 H new ATOM 0 HA3 GLY A 54 2.283 -8.728 -8.052 1.00 0.00 H new ATOM 769 N ILE A 55 0.916 -6.550 -7.095 1.00 0.00 N ATOM 770 CA ILE A 55 0.487 -5.145 -7.061 1.00 0.00 C ATOM 771 C ILE A 55 1.578 -4.284 -7.702 1.00 0.00 C ATOM 772 O ILE A 55 2.757 -4.400 -7.384 1.00 0.00 O ATOM 773 CB ILE A 55 0.131 -4.735 -5.616 1.00 0.00 C ATOM 774 CG1 ILE A 55 -1.298 -5.169 -5.268 1.00 0.00 C ATOM 775 CG2 ILE A 55 0.303 -3.241 -5.308 1.00 0.00 C ATOM 776 CD1 ILE A 55 -1.476 -6.680 -5.080 1.00 0.00 C ATOM 0 H ILE A 55 1.488 -6.817 -6.293 1.00 0.00 H new ATOM 0 HA ILE A 55 -0.423 -4.995 -7.642 1.00 0.00 H new ATOM 0 HB ILE A 55 0.855 -5.257 -4.991 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -1.605 -4.663 -4.353 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -1.969 -4.833 -6.058 1.00 0.00 H new ATOM 0 HG21 ILE A 55 0.029 -3.050 -4.270 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.342 -2.954 -5.468 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -0.340 -2.657 -5.967 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -2.516 -6.896 -4.837 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -1.204 -7.196 -6.001 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -0.834 -7.024 -4.269 1.00 0.00 H new ATOM 788 N THR A 56 1.125 -3.397 -8.563 1.00 0.00 N ATOM 789 CA THR A 56 2.021 -2.471 -9.276 1.00 0.00 C ATOM 790 C THR A 56 1.678 -1.032 -8.890 1.00 0.00 C ATOM 791 O THR A 56 0.511 -0.687 -8.699 1.00 0.00 O ATOM 792 CB THR A 56 1.920 -2.719 -10.786 1.00 0.00 C ATOM 793 OG1 THR A 56 2.032 -4.128 -11.011 1.00 0.00 O ATOM 794 CG2 THR A 56 3.041 -2.017 -11.558 1.00 0.00 C ATOM 0 H THR A 56 0.138 -3.287 -8.796 1.00 0.00 H new ATOM 0 HA THR A 56 3.058 -2.645 -8.990 1.00 0.00 H new ATOM 0 HB THR A 56 0.967 -2.323 -11.138 1.00 0.00 H new ATOM 0 HG1 THR A 56 1.968 -4.312 -11.971 1.00 0.00 H new ATOM 0 HG21 THR A 56 2.931 -2.219 -12.623 1.00 0.00 H new ATOM 0 HG22 THR A 56 2.984 -0.942 -11.385 1.00 0.00 H new ATOM 0 HG23 THR A 56 4.007 -2.389 -11.216 1.00 0.00 H new ATOM 802 N LEU A 57 2.752 -0.318 -8.574 1.00 0.00 N ATOM 803 CA LEU A 57 2.729 1.094 -8.161 1.00 0.00 C ATOM 804 C LEU A 57 3.648 1.940 -9.035 1.00 0.00 C ATOM 805 O LEU A 57 4.838 1.659 -9.161 1.00 0.00 O ATOM 806 CB LEU A 57 3.152 1.193 -6.694 1.00 0.00 C ATOM 807 CG LEU A 57 2.035 0.658 -5.803 1.00 0.00 C ATOM 808 CD1 LEU A 57 2.594 0.200 -4.459 1.00 0.00 C ATOM 809 CD2 LEU A 57 0.991 1.755 -5.615 1.00 0.00 C ATOM 0 H LEU A 57 3.693 -0.710 -8.596 1.00 0.00 H new ATOM 0 HA LEU A 57 1.716 1.479 -8.280 1.00 0.00 H new ATOM 0 HB2 LEU A 57 4.067 0.624 -6.529 1.00 0.00 H new ATOM 0 HB3 LEU A 57 3.371 2.229 -6.437 1.00 0.00 H new ATOM 0 HG LEU A 57 1.569 -0.207 -6.275 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.783 -0.178 -3.837 1.00 0.00 H new ATOM 0 HD12 LEU A 57 3.327 -0.591 -4.620 1.00 0.00 H new ATOM 0 HD13 LEU A 57 3.073 1.042 -3.958 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.186 1.386 -4.980 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.455 2.622 -5.146 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.585 2.041 -6.585 1.00 0.00 H new ATOM 821 N THR A 58 3.034 2.966 -9.602 1.00 0.00 N ATOM 822 CA THR A 58 3.682 3.904 -10.541 1.00 0.00 C ATOM 823 C THR A 58 3.383 5.354 -10.153 1.00 0.00 C ATOM 824 O THR A 58 2.241 5.685 -9.831 1.00 0.00 O ATOM 825 CB THR A 58 3.269 3.635 -12.006 1.00 0.00 C ATOM 826 OG1 THR A 58 3.785 4.672 -12.846 1.00 0.00 O ATOM 827 CG2 THR A 58 1.761 3.452 -12.228 1.00 0.00 C ATOM 0 H THR A 58 2.053 3.185 -9.428 1.00 0.00 H new ATOM 0 HA THR A 58 4.757 3.739 -10.471 1.00 0.00 H new ATOM 0 HB THR A 58 3.706 2.673 -12.273 1.00 0.00 H new ATOM 0 HG1 THR A 58 3.525 4.500 -13.775 1.00 0.00 H new ATOM 0 HG21 THR A 58 1.568 3.268 -13.285 1.00 0.00 H new ATOM 0 HG22 THR A 58 1.407 2.604 -11.642 1.00 0.00 H new ATOM 0 HG23 THR A 58 1.235 4.354 -11.915 1.00 0.00 H new ATOM 835 N ASP A 59 4.417 6.183 -10.253 1.00 0.00 N ATOM 836 CA ASP A 59 4.292 7.630 -10.018 1.00 0.00 C ATOM 837 C ASP A 59 3.878 8.345 -11.312 1.00 0.00 C ATOM 838 O ASP A 59 4.625 8.374 -12.288 1.00 0.00 O ATOM 839 CB ASP A 59 5.609 8.184 -9.456 1.00 0.00 C ATOM 840 CG ASP A 59 5.613 9.695 -9.189 1.00 0.00 C ATOM 841 OD1 ASP A 59 4.512 10.295 -9.123 1.00 0.00 O ATOM 842 OD2 ASP A 59 6.714 10.273 -9.206 1.00 0.00 O ATOM 0 H ASP A 59 5.360 5.881 -10.497 1.00 0.00 H new ATOM 0 HA ASP A 59 3.511 7.812 -9.280 1.00 0.00 H new ATOM 0 HB2 ASP A 59 5.837 7.665 -8.525 1.00 0.00 H new ATOM 0 HB3 ASP A 59 6.412 7.951 -10.155 1.00 0.00 H new ATOM 847 N ASN A 60 2.738 9.015 -11.212 1.00 0.00 N ATOM 848 CA ASN A 60 2.203 9.851 -12.309 1.00 0.00 C ATOM 849 C ASN A 60 1.984 11.315 -11.885 1.00 0.00 C ATOM 850 O ASN A 60 1.567 12.152 -12.677 1.00 0.00 O ATOM 851 CB ASN A 60 0.885 9.249 -12.808 1.00 0.00 C ATOM 852 CG ASN A 60 0.634 9.617 -14.272 1.00 0.00 C ATOM 853 OD1 ASN A 60 0.133 10.670 -14.635 1.00 0.00 O ATOM 854 ND2 ASN A 60 1.002 8.725 -15.161 1.00 0.00 N ATOM 0 H ASN A 60 2.151 9.003 -10.378 1.00 0.00 H new ATOM 0 HA ASN A 60 2.944 9.859 -13.108 1.00 0.00 H new ATOM 0 HB2 ASN A 60 0.913 8.165 -12.701 1.00 0.00 H new ATOM 0 HB3 ASN A 60 0.061 9.609 -12.192 1.00 0.00 H new ATOM 0 HD21 ASN A 60 0.870 8.911 -16.155 1.00 0.00 H new ATOM 0 HD22 ASN A 60 1.420 7.846 -14.858 1.00 0.00 H new ATOM 861 N GLN A 61 2.401 11.633 -10.662 1.00 0.00 N ATOM 862 CA GLN A 61 2.223 12.980 -10.102 1.00 0.00 C ATOM 863 C GLN A 61 3.512 13.805 -10.261 1.00 0.00 C ATOM 864 O GLN A 61 3.490 14.922 -10.764 1.00 0.00 O ATOM 865 CB GLN A 61 1.837 12.860 -8.628 1.00 0.00 C ATOM 866 CG GLN A 61 0.972 14.040 -8.175 1.00 0.00 C ATOM 867 CD GLN A 61 1.639 15.401 -8.364 1.00 0.00 C ATOM 868 OE1 GLN A 61 1.348 16.151 -9.283 1.00 0.00 O ATOM 869 NE2 GLN A 61 2.519 15.755 -7.460 1.00 0.00 N ATOM 0 H GLN A 61 2.866 10.977 -10.034 1.00 0.00 H new ATOM 0 HA GLN A 61 1.429 13.496 -10.642 1.00 0.00 H new ATOM 0 HB2 GLN A 61 1.295 11.928 -8.468 1.00 0.00 H new ATOM 0 HB3 GLN A 61 2.739 12.813 -8.018 1.00 0.00 H new ATOM 0 HG2 GLN A 61 0.034 14.025 -8.730 1.00 0.00 H new ATOM 0 HG3 GLN A 61 0.721 13.912 -7.122 1.00 0.00 H new ATOM 0 HE21 GLN A 61 2.752 15.118 -6.698 1.00 0.00 H new ATOM 0 HE22 GLN A 61 2.971 16.668 -7.518 1.00 0.00 H new ATOM 878 N ARG A 62 4.634 13.179 -9.928 1.00 0.00 N ATOM 879 CA ARG A 62 5.956 13.810 -10.100 1.00 0.00 C ATOM 880 C ARG A 62 6.734 13.179 -11.270 1.00 0.00 C ATOM 881 O ARG A 62 7.643 13.793 -11.827 1.00 0.00 O ATOM 882 CB ARG A 62 6.745 13.717 -8.789 1.00 0.00 C ATOM 883 CG ARG A 62 7.898 14.724 -8.820 1.00 0.00 C ATOM 884 CD ARG A 62 8.989 14.425 -7.786 1.00 0.00 C ATOM 885 NE ARG A 62 8.705 15.001 -6.460 1.00 0.00 N ATOM 886 CZ ARG A 62 8.753 16.298 -6.121 1.00 0.00 C ATOM 887 NH1 ARG A 62 9.020 17.248 -7.007 1.00 0.00 N ATOM 888 NH2 ARG A 62 8.530 16.662 -4.869 1.00 0.00 N ATOM 0 H ARG A 62 4.665 12.237 -9.538 1.00 0.00 H new ATOM 0 HA ARG A 62 5.811 14.861 -10.348 1.00 0.00 H new ATOM 0 HB2 ARG A 62 6.090 13.922 -7.942 1.00 0.00 H new ATOM 0 HB3 ARG A 62 7.132 12.707 -8.655 1.00 0.00 H new ATOM 0 HG2 ARG A 62 8.342 14.728 -9.816 1.00 0.00 H new ATOM 0 HG3 ARG A 62 7.503 15.724 -8.643 1.00 0.00 H new ATOM 0 HD2 ARG A 62 9.103 13.345 -7.689 1.00 0.00 H new ATOM 0 HD3 ARG A 62 9.940 14.815 -8.148 1.00 0.00 H new ATOM 0 HE ARG A 62 8.445 14.345 -5.723 1.00 0.00 H new ATOM 0 HH11 ARG A 62 9.197 17.002 -7.981 1.00 0.00 H new ATOM 0 HH12 ARG A 62 9.049 18.225 -6.714 1.00 0.00 H new ATOM 0 HH21 ARG A 62 8.322 15.957 -4.162 1.00 0.00 H new ATOM 0 HH22 ARG A 62 8.566 17.648 -4.610 1.00 0.00 H new ATOM 902 N LYS A 63 6.346 11.952 -11.637 1.00 0.00 N ATOM 903 CA LYS A 63 7.022 11.102 -12.635 1.00 0.00 C ATOM 904 C LYS A 63 8.528 11.010 -12.336 1.00 0.00 C ATOM 905 O LYS A 63 8.927 11.141 -11.180 1.00 0.00 O ATOM 906 CB LYS A 63 6.704 11.569 -14.064 1.00 0.00 C ATOM 907 CG LYS A 63 5.274 11.179 -14.430 1.00 0.00 C ATOM 908 CD LYS A 63 4.918 11.580 -15.859 1.00 0.00 C ATOM 909 CE LYS A 63 3.421 11.364 -16.061 1.00 0.00 C ATOM 910 NZ LYS A 63 3.062 11.358 -17.483 1.00 0.00 N ATOM 0 H LYS A 63 5.523 11.504 -11.235 1.00 0.00 H new ATOM 0 HA LYS A 63 6.633 10.086 -12.562 1.00 0.00 H new ATOM 0 HB2 LYS A 63 6.826 12.650 -14.139 1.00 0.00 H new ATOM 0 HB3 LYS A 63 7.405 11.119 -14.768 1.00 0.00 H new ATOM 0 HG2 LYS A 63 5.152 10.102 -14.315 1.00 0.00 H new ATOM 0 HG3 LYS A 63 4.580 11.655 -13.737 1.00 0.00 H new ATOM 0 HD2 LYS A 63 5.178 12.624 -16.036 1.00 0.00 H new ATOM 0 HD3 LYS A 63 5.487 10.984 -16.573 1.00 0.00 H new ATOM 0 HE2 LYS A 63 3.125 10.418 -15.607 1.00 0.00 H new ATOM 0 HE3 LYS A 63 2.867 12.151 -15.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 2.037 11.209 -17.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 3.322 12.270 -17.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 3.572 10.591 -17.966 1.00 0.00 H new ATOM 924 N LEU A 64 9.316 10.621 -13.340 1.00 0.00 N ATOM 925 CA LEU A 64 10.792 10.546 -13.251 1.00 0.00 C ATOM 926 C LEU A 64 11.214 9.525 -12.169 1.00 0.00 C ATOM 927 O LEU A 64 12.113 9.734 -11.358 1.00 0.00 O ATOM 928 CB LEU A 64 11.334 11.960 -12.967 1.00 0.00 C ATOM 929 CG LEU A 64 12.766 12.189 -13.448 1.00 0.00 C ATOM 930 CD1 LEU A 64 12.796 12.398 -14.965 1.00 0.00 C ATOM 931 CD2 LEU A 64 13.370 13.389 -12.717 1.00 0.00 C ATOM 0 H LEU A 64 8.952 10.344 -14.252 1.00 0.00 H new ATOM 0 HA LEU A 64 11.217 10.194 -14.191 1.00 0.00 H new ATOM 0 HB2 LEU A 64 10.681 12.690 -13.445 1.00 0.00 H new ATOM 0 HB3 LEU A 64 11.289 12.146 -11.894 1.00 0.00 H new ATOM 0 HG LEU A 64 13.364 11.306 -13.222 1.00 0.00 H new ATOM 0 HD11 LEU A 64 13.824 12.560 -15.290 1.00 0.00 H new ATOM 0 HD12 LEU A 64 12.393 11.516 -15.462 1.00 0.00 H new ATOM 0 HD13 LEU A 64 12.193 13.268 -15.224 1.00 0.00 H new ATOM 0 HD21 LEU A 64 14.391 13.549 -13.063 1.00 0.00 H new ATOM 0 HD22 LEU A 64 12.774 14.278 -12.922 1.00 0.00 H new ATOM 0 HD23 LEU A 64 13.376 13.196 -11.644 1.00 0.00 H new ATOM 943 N PHE A 65 10.532 8.381 -12.229 1.00 0.00 N ATOM 944 CA PHE A 65 10.624 7.276 -11.257 1.00 0.00 C ATOM 945 C PHE A 65 9.912 6.045 -11.830 1.00 0.00 C ATOM 946 O PHE A 65 8.733 6.100 -12.185 1.00 0.00 O ATOM 947 CB PHE A 65 9.992 7.719 -9.923 1.00 0.00 C ATOM 948 CG PHE A 65 9.693 6.578 -8.952 1.00 0.00 C ATOM 949 CD1 PHE A 65 10.690 5.997 -8.177 1.00 0.00 C ATOM 950 CD2 PHE A 65 8.391 6.086 -8.883 1.00 0.00 C ATOM 951 CE1 PHE A 65 10.390 4.933 -7.347 1.00 0.00 C ATOM 952 CE2 PHE A 65 8.085 5.032 -8.043 1.00 0.00 C ATOM 953 CZ PHE A 65 9.083 4.442 -7.276 1.00 0.00 C ATOM 0 H PHE A 65 9.873 8.185 -12.983 1.00 0.00 H new ATOM 0 HA PHE A 65 11.666 7.016 -11.071 1.00 0.00 H new ATOM 0 HB2 PHE A 65 10.662 8.427 -9.436 1.00 0.00 H new ATOM 0 HB3 PHE A 65 9.065 8.251 -10.134 1.00 0.00 H new ATOM 0 HD1 PHE A 65 11.700 6.377 -8.223 1.00 0.00 H new ATOM 0 HD2 PHE A 65 7.616 6.531 -9.490 1.00 0.00 H new ATOM 0 HE1 PHE A 65 11.168 4.479 -6.751 1.00 0.00 H new ATOM 0 HE2 PHE A 65 7.070 4.667 -7.982 1.00 0.00 H new ATOM 0 HZ PHE A 65 8.850 3.609 -6.629 1.00 0.00 H new ATOM 963 N PHE A 66 10.694 4.976 -11.962 1.00 0.00 N ATOM 964 CA PHE A 66 10.197 3.649 -12.377 1.00 0.00 C ATOM 965 C PHE A 66 9.047 3.164 -11.483 1.00 0.00 C ATOM 966 O PHE A 66 8.801 3.697 -10.410 1.00 0.00 O ATOM 967 CB PHE A 66 11.329 2.617 -12.320 1.00 0.00 C ATOM 968 CG PHE A 66 12.154 2.592 -13.601 1.00 0.00 C ATOM 969 CD1 PHE A 66 11.661 1.931 -14.726 1.00 0.00 C ATOM 970 CD2 PHE A 66 13.411 3.190 -13.644 1.00 0.00 C ATOM 971 CE1 PHE A 66 12.420 1.862 -15.878 1.00 0.00 C ATOM 972 CE2 PHE A 66 14.170 3.117 -14.797 1.00 0.00 C ATOM 973 CZ PHE A 66 13.681 2.453 -15.921 1.00 0.00 C ATOM 0 H PHE A 66 11.698 4.997 -11.785 1.00 0.00 H new ATOM 0 HA PHE A 66 9.828 3.751 -13.397 1.00 0.00 H new ATOM 0 HB2 PHE A 66 11.980 2.842 -11.475 1.00 0.00 H new ATOM 0 HB3 PHE A 66 10.907 1.628 -12.143 1.00 0.00 H new ATOM 0 HD1 PHE A 66 10.684 1.472 -14.696 1.00 0.00 H new ATOM 0 HD2 PHE A 66 13.792 3.710 -12.778 1.00 0.00 H new ATOM 0 HE1 PHE A 66 12.035 1.349 -16.747 1.00 0.00 H new ATOM 0 HE2 PHE A 66 15.147 3.577 -14.827 1.00 0.00 H new ATOM 0 HZ PHE A 66 14.276 2.397 -16.820 1.00 0.00 H new ATOM 983 N ARG A 67 8.414 2.078 -11.899 1.00 0.00 N ATOM 984 CA ARG A 67 7.317 1.493 -11.109 1.00 0.00 C ATOM 985 C ARG A 67 7.821 0.256 -10.352 1.00 0.00 C ATOM 986 O ARG A 67 8.779 -0.400 -10.764 1.00 0.00 O ATOM 987 CB ARG A 67 6.138 1.153 -12.027 1.00 0.00 C ATOM 988 CG ARG A 67 6.465 0.014 -12.989 1.00 0.00 C ATOM 989 CD ARG A 67 5.414 -0.079 -14.079 1.00 0.00 C ATOM 990 NE ARG A 67 6.156 -0.106 -15.345 1.00 0.00 N ATOM 991 CZ ARG A 67 5.649 -0.407 -16.539 1.00 0.00 C ATOM 992 NH1 ARG A 67 4.382 -0.767 -16.673 1.00 0.00 N ATOM 993 NH2 ARG A 67 6.425 -0.386 -17.608 1.00 0.00 N ATOM 0 H ARG A 67 8.629 1.583 -12.764 1.00 0.00 H new ATOM 0 HA ARG A 67 6.969 2.216 -10.372 1.00 0.00 H new ATOM 0 HB2 ARG A 67 5.275 0.877 -11.420 1.00 0.00 H new ATOM 0 HB3 ARG A 67 5.857 2.038 -12.597 1.00 0.00 H new ATOM 0 HG2 ARG A 67 7.446 0.177 -13.435 1.00 0.00 H new ATOM 0 HG3 ARG A 67 6.515 -0.928 -12.443 1.00 0.00 H new ATOM 0 HD2 ARG A 67 4.807 -0.977 -13.962 1.00 0.00 H new ATOM 0 HD3 ARG A 67 4.735 0.773 -14.041 1.00 0.00 H new ATOM 0 HE ARG A 67 7.148 0.127 -15.307 1.00 0.00 H new ATOM 0 HH11 ARG A 67 3.777 -0.817 -15.854 1.00 0.00 H new ATOM 0 HH12 ARG A 67 4.011 -0.994 -17.596 1.00 0.00 H new ATOM 0 HH21 ARG A 67 7.411 -0.140 -17.518 1.00 0.00 H new ATOM 0 HH22 ARG A 67 6.038 -0.616 -18.523 1.00 0.00 H new ATOM 1007 N ARG A 68 7.110 -0.063 -9.283 1.00 0.00 N ATOM 1008 CA ARG A 68 7.380 -1.274 -8.490 1.00 0.00 C ATOM 1009 C ARG A 68 6.227 -2.276 -8.643 1.00 0.00 C ATOM 1010 O ARG A 68 5.070 -1.888 -8.801 1.00 0.00 O ATOM 1011 CB ARG A 68 7.534 -0.908 -7.013 1.00 0.00 C ATOM 1012 CG ARG A 68 8.644 -1.730 -6.354 1.00 0.00 C ATOM 1013 CD ARG A 68 9.921 -0.894 -6.260 1.00 0.00 C ATOM 1014 NE ARG A 68 11.022 -1.683 -5.686 1.00 0.00 N ATOM 1015 CZ ARG A 68 12.219 -1.208 -5.316 1.00 0.00 C ATOM 1016 NH1 ARG A 68 12.506 0.086 -5.373 1.00 0.00 N ATOM 1017 NH2 ARG A 68 13.143 -2.031 -4.850 1.00 0.00 N ATOM 0 H ARG A 68 6.333 0.498 -8.934 1.00 0.00 H new ATOM 0 HA ARG A 68 8.303 -1.727 -8.853 1.00 0.00 H new ATOM 0 HB2 ARG A 68 7.760 0.154 -6.920 1.00 0.00 H new ATOM 0 HB3 ARG A 68 6.592 -1.080 -6.492 1.00 0.00 H new ATOM 0 HG2 ARG A 68 8.332 -2.048 -5.359 1.00 0.00 H new ATOM 0 HG3 ARG A 68 8.832 -2.634 -6.933 1.00 0.00 H new ATOM 0 HD2 ARG A 68 10.201 -0.538 -7.251 1.00 0.00 H new ATOM 0 HD3 ARG A 68 9.740 -0.013 -5.644 1.00 0.00 H new ATOM 0 HE ARG A 68 10.859 -2.682 -5.558 1.00 0.00 H new ATOM 0 HH11 ARG A 68 11.806 0.749 -5.705 1.00 0.00 H new ATOM 0 HH12 ARG A 68 13.426 0.417 -5.084 1.00 0.00 H new ATOM 0 HH21 ARG A 68 12.945 -3.029 -4.772 1.00 0.00 H new ATOM 0 HH22 ARG A 68 14.054 -1.668 -4.569 1.00 0.00 H new ATOM 1031 N HIS A 69 6.585 -3.553 -8.550 1.00 0.00 N ATOM 1032 CA HIS A 69 5.619 -4.669 -8.599 1.00 0.00 C ATOM 1033 C HIS A 69 5.901 -5.648 -7.449 1.00 0.00 C ATOM 1034 O HIS A 69 7.042 -6.039 -7.213 1.00 0.00 O ATOM 1035 CB HIS A 69 5.619 -5.359 -9.970 1.00 0.00 C ATOM 1036 CG HIS A 69 6.896 -6.177 -10.275 1.00 0.00 C ATOM 1037 ND1 HIS A 69 8.039 -5.688 -10.714 1.00 0.00 N ATOM 1038 CD2 HIS A 69 7.022 -7.483 -10.100 1.00 0.00 C ATOM 1039 CE1 HIS A 69 8.906 -6.711 -10.793 1.00 0.00 C ATOM 1040 NE2 HIS A 69 8.277 -7.812 -10.416 1.00 0.00 N ATOM 0 H HIS A 69 7.553 -3.854 -8.438 1.00 0.00 H new ATOM 0 HA HIS A 69 4.613 -4.271 -8.465 1.00 0.00 H new ATOM 0 HB2 HIS A 69 4.755 -6.021 -10.030 1.00 0.00 H new ATOM 0 HB3 HIS A 69 5.494 -4.602 -10.744 1.00 0.00 H new ATOM 0 HD2 HIS A 69 6.250 -8.159 -9.763 1.00 0.00 H new ATOM 0 HE1 HIS A 69 9.937 -6.646 -11.109 1.00 0.00 H new ATOM 0 HE2 HIS A 69 8.680 -8.748 -10.374 1.00 0.00 H new ATOM 1048 N TYR A 70 4.864 -5.873 -6.658 1.00 0.00 N ATOM 1049 CA TYR A 70 4.893 -6.745 -5.472 1.00 0.00 C ATOM 1050 C TYR A 70 3.980 -7.971 -5.627 1.00 0.00 C ATOM 1051 O TYR A 70 2.766 -7.825 -5.486 1.00 0.00 O ATOM 1052 CB TYR A 70 4.474 -5.971 -4.219 1.00 0.00 C ATOM 1053 CG TYR A 70 5.514 -4.924 -3.852 1.00 0.00 C ATOM 1054 CD1 TYR A 70 6.710 -5.336 -3.280 1.00 0.00 C ATOM 1055 CD2 TYR A 70 5.231 -3.573 -3.998 1.00 0.00 C ATOM 1056 CE1 TYR A 70 7.627 -4.401 -2.840 1.00 0.00 C ATOM 1057 CE2 TYR A 70 6.144 -2.632 -3.559 1.00 0.00 C ATOM 1058 CZ TYR A 70 7.346 -3.043 -2.986 1.00 0.00 C ATOM 1059 OH TYR A 70 8.193 -2.114 -2.487 1.00 0.00 O ATOM 0 H TYR A 70 3.951 -5.448 -6.819 1.00 0.00 H new ATOM 0 HA TYR A 70 5.921 -7.092 -5.370 1.00 0.00 H new ATOM 0 HB2 TYR A 70 3.512 -5.488 -4.390 1.00 0.00 H new ATOM 0 HB3 TYR A 70 4.340 -6.663 -3.388 1.00 0.00 H new ATOM 0 HD1 TYR A 70 6.924 -6.390 -3.179 1.00 0.00 H new ATOM 0 HD2 TYR A 70 4.303 -3.259 -4.452 1.00 0.00 H new ATOM 0 HE1 TYR A 70 8.554 -4.719 -2.387 1.00 0.00 H new ATOM 0 HE2 TYR A 70 5.926 -1.579 -3.660 1.00 0.00 H new ATOM 0 HH TYR A 70 7.687 -1.455 -1.968 1.00 0.00 H new ATOM 1069 N PRO A 71 4.553 -9.145 -5.912 1.00 0.00 N ATOM 1070 CA PRO A 71 3.764 -10.380 -6.075 1.00 0.00 C ATOM 1071 C PRO A 71 2.996 -10.770 -4.808 1.00 0.00 C ATOM 1072 O PRO A 71 3.364 -10.398 -3.696 1.00 0.00 O ATOM 1073 CB PRO A 71 4.754 -11.449 -6.545 1.00 0.00 C ATOM 1074 CG PRO A 71 6.128 -10.935 -6.119 1.00 0.00 C ATOM 1075 CD PRO A 71 5.995 -9.411 -6.084 1.00 0.00 C ATOM 0 HA PRO A 71 2.971 -10.246 -6.810 1.00 0.00 H new ATOM 0 HB2 PRO A 71 4.536 -12.415 -6.090 1.00 0.00 H new ATOM 0 HB3 PRO A 71 4.702 -11.587 -7.625 1.00 0.00 H new ATOM 0 HG2 PRO A 71 6.410 -11.328 -5.142 1.00 0.00 H new ATOM 0 HG3 PRO A 71 6.900 -11.247 -6.822 1.00 0.00 H new ATOM 0 HD2 PRO A 71 6.573 -8.985 -5.264 1.00 0.00 H new ATOM 0 HD3 PRO A 71 6.370 -8.963 -7.004 1.00 0.00 H new ATOM 1083 N LEU A 72 1.938 -11.558 -4.985 1.00 0.00 N ATOM 1084 CA LEU A 72 1.179 -12.101 -3.836 1.00 0.00 C ATOM 1085 C LEU A 72 1.987 -13.062 -2.942 1.00 0.00 C ATOM 1086 O LEU A 72 1.701 -13.213 -1.759 1.00 0.00 O ATOM 1087 CB LEU A 72 -0.127 -12.753 -4.287 1.00 0.00 C ATOM 1088 CG LEU A 72 -1.328 -11.910 -3.850 1.00 0.00 C ATOM 1089 CD1 LEU A 72 -1.890 -11.078 -5.005 1.00 0.00 C ATOM 1090 CD2 LEU A 72 -2.390 -12.830 -3.258 1.00 0.00 C ATOM 0 H LEU A 72 1.581 -11.839 -5.898 1.00 0.00 H new ATOM 0 HA LEU A 72 0.948 -11.236 -3.214 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -0.129 -12.864 -5.371 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -0.205 -13.754 -3.864 1.00 0.00 H new ATOM 0 HG LEU A 72 -1.003 -11.199 -3.091 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.741 -10.495 -4.653 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.118 -10.405 -5.378 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -2.212 -11.741 -5.808 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -3.250 -12.238 -2.944 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -2.703 -13.555 -4.009 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -1.977 -13.356 -2.397 1.00 0.00 H new ATOM 1102 N ASN A 73 3.153 -13.449 -3.458 1.00 0.00 N ATOM 1103 CA ASN A 73 4.136 -14.303 -2.768 1.00 0.00 C ATOM 1104 C ASN A 73 5.103 -13.506 -1.873 1.00 0.00 C ATOM 1105 O ASN A 73 6.154 -14.000 -1.461 1.00 0.00 O ATOM 1106 CB ASN A 73 4.919 -15.046 -3.851 1.00 0.00 C ATOM 1107 CG ASN A 73 4.655 -16.542 -3.739 1.00 0.00 C ATOM 1108 OD1 ASN A 73 3.662 -17.071 -4.225 1.00 0.00 O ATOM 1109 ND2 ASN A 73 5.524 -17.238 -3.049 1.00 0.00 N ATOM 0 H ASN A 73 3.454 -13.173 -4.393 1.00 0.00 H new ATOM 0 HA ASN A 73 3.607 -14.986 -2.103 1.00 0.00 H new ATOM 0 HB2 ASN A 73 4.624 -14.688 -4.837 1.00 0.00 H new ATOM 0 HB3 ASN A 73 5.985 -14.846 -3.745 1.00 0.00 H new ATOM 0 HD21 ASN A 73 5.380 -18.238 -2.908 1.00 0.00 H new ATOM 0 HD22 ASN A 73 6.344 -16.780 -2.652 1.00 0.00 H new ATOM 1116 N THR A 74 4.750 -12.240 -1.661 1.00 0.00 N ATOM 1117 CA THR A 74 5.577 -11.270 -0.918 1.00 0.00 C ATOM 1118 C THR A 74 4.733 -10.425 0.037 1.00 0.00 C ATOM 1119 O THR A 74 5.123 -10.259 1.190 1.00 0.00 O ATOM 1120 CB THR A 74 6.420 -10.355 -1.823 1.00 0.00 C ATOM 1121 OG1 THR A 74 5.614 -9.383 -2.500 1.00 0.00 O ATOM 1122 CG2 THR A 74 7.284 -11.171 -2.791 1.00 0.00 C ATOM 0 H THR A 74 3.873 -11.846 -2.001 1.00 0.00 H new ATOM 0 HA THR A 74 6.275 -11.876 -0.340 1.00 0.00 H new ATOM 0 HB THR A 74 7.101 -9.796 -1.181 1.00 0.00 H new ATOM 0 HG1 THR A 74 4.889 -9.836 -2.979 1.00 0.00 H new ATOM 0 HG21 THR A 74 7.867 -10.495 -3.416 1.00 0.00 H new ATOM 0 HG22 THR A 74 7.958 -11.813 -2.224 1.00 0.00 H new ATOM 0 HG23 THR A 74 6.642 -11.786 -3.422 1.00 0.00 H new ATOM 1130 N VAL A 75 3.607 -9.916 -0.466 1.00 0.00 N ATOM 1131 CA VAL A 75 2.623 -9.144 0.316 1.00 0.00 C ATOM 1132 C VAL A 75 1.917 -10.050 1.345 1.00 0.00 C ATOM 1133 O VAL A 75 0.796 -10.520 1.170 1.00 0.00 O ATOM 1134 CB VAL A 75 1.695 -8.355 -0.638 1.00 0.00 C ATOM 1135 CG1 VAL A 75 0.832 -9.221 -1.567 1.00 0.00 C ATOM 1136 CG2 VAL A 75 0.845 -7.340 0.130 1.00 0.00 C ATOM 0 H VAL A 75 3.343 -10.027 -1.445 1.00 0.00 H new ATOM 0 HA VAL A 75 3.117 -8.384 0.922 1.00 0.00 H new ATOM 0 HB VAL A 75 2.369 -7.820 -1.307 1.00 0.00 H new ATOM 0 HG11 VAL A 75 0.217 -8.578 -2.196 1.00 0.00 H new ATOM 0 HG12 VAL A 75 1.477 -9.834 -2.196 1.00 0.00 H new ATOM 0 HG13 VAL A 75 0.189 -9.866 -0.969 1.00 0.00 H new ATOM 0 HG21 VAL A 75 0.203 -6.801 -0.567 1.00 0.00 H new ATOM 0 HG22 VAL A 75 0.228 -7.862 0.862 1.00 0.00 H new ATOM 0 HG23 VAL A 75 1.497 -6.633 0.643 1.00 0.00 H new ATOM 1146 N THR A 76 2.648 -10.274 2.429 1.00 0.00 N ATOM 1147 CA THR A 76 2.254 -11.120 3.574 1.00 0.00 C ATOM 1148 C THR A 76 0.873 -10.687 4.096 1.00 0.00 C ATOM 1149 O THR A 76 -0.093 -11.445 4.046 1.00 0.00 O ATOM 1150 CB THR A 76 3.312 -11.084 4.701 1.00 0.00 C ATOM 1151 OG1 THR A 76 3.427 -9.773 5.255 1.00 0.00 O ATOM 1152 CG2 THR A 76 4.696 -11.549 4.232 1.00 0.00 C ATOM 0 H THR A 76 3.572 -9.859 2.550 1.00 0.00 H new ATOM 0 HA THR A 76 2.191 -12.152 3.229 1.00 0.00 H new ATOM 0 HB THR A 76 2.960 -11.780 5.462 1.00 0.00 H new ATOM 0 HG1 THR A 76 3.608 -9.130 4.538 1.00 0.00 H new ATOM 0 HG21 THR A 76 5.397 -11.502 5.065 1.00 0.00 H new ATOM 0 HG22 THR A 76 4.631 -12.575 3.869 1.00 0.00 H new ATOM 0 HG23 THR A 76 5.044 -10.901 3.428 1.00 0.00 H new ATOM 1160 N PHE A 77 0.792 -9.422 4.487 1.00 0.00 N ATOM 1161 CA PHE A 77 -0.444 -8.793 4.978 1.00 0.00 C ATOM 1162 C PHE A 77 -0.648 -7.449 4.279 1.00 0.00 C ATOM 1163 O PHE A 77 0.291 -6.659 4.241 1.00 0.00 O ATOM 1164 CB PHE A 77 -0.262 -8.570 6.480 1.00 0.00 C ATOM 1165 CG PHE A 77 -1.562 -8.830 7.219 1.00 0.00 C ATOM 1166 CD1 PHE A 77 -1.919 -10.144 7.513 1.00 0.00 C ATOM 1167 CD2 PHE A 77 -2.389 -7.781 7.605 1.00 0.00 C ATOM 1168 CE1 PHE A 77 -3.087 -10.403 8.196 1.00 0.00 C ATOM 1169 CE2 PHE A 77 -3.551 -8.039 8.301 1.00 0.00 C ATOM 1170 CZ PHE A 77 -3.910 -9.354 8.601 1.00 0.00 C ATOM 0 H PHE A 77 1.591 -8.788 4.475 1.00 0.00 H new ATOM 0 HA PHE A 77 -1.312 -9.421 4.777 1.00 0.00 H new ATOM 0 HB2 PHE A 77 0.517 -9.231 6.860 1.00 0.00 H new ATOM 0 HB3 PHE A 77 0.069 -7.548 6.664 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -1.281 -10.959 7.206 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -2.121 -6.764 7.360 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -3.366 -11.422 8.418 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -4.184 -7.222 8.615 1.00 0.00 H new ATOM 0 HZ PHE A 77 -4.821 -9.557 9.144 1.00 0.00 H new ATOM 1180 N CYS A 78 -1.882 -7.194 3.848 1.00 0.00 N ATOM 1181 CA CYS A 78 -2.272 -5.916 3.218 1.00 0.00 C ATOM 1182 C CYS A 78 -3.649 -5.474 3.727 1.00 0.00 C ATOM 1183 O CYS A 78 -4.701 -5.849 3.211 1.00 0.00 O ATOM 1184 CB CYS A 78 -2.258 -6.005 1.689 1.00 0.00 C ATOM 1185 SG CYS A 78 -2.371 -4.358 0.893 1.00 0.00 S ATOM 0 H CYS A 78 -2.648 -7.864 3.922 1.00 0.00 H new ATOM 0 HA CYS A 78 -1.534 -5.166 3.501 1.00 0.00 H new ATOM 0 HB2 CYS A 78 -1.343 -6.500 1.365 1.00 0.00 H new ATOM 0 HB3 CYS A 78 -3.091 -6.624 1.356 1.00 0.00 H new ATOM 0 HG CYS A 78 -3.456 -3.759 1.287 1.00 0.00 H new ATOM 1191 N ASP A 79 -3.587 -4.768 4.846 1.00 0.00 N ATOM 1192 CA ASP A 79 -4.793 -4.298 5.541 1.00 0.00 C ATOM 1193 C ASP A 79 -4.599 -2.859 6.030 1.00 0.00 C ATOM 1194 O ASP A 79 -3.484 -2.333 6.036 1.00 0.00 O ATOM 1195 CB ASP A 79 -5.148 -5.248 6.692 1.00 0.00 C ATOM 1196 CG ASP A 79 -6.660 -5.497 6.778 1.00 0.00 C ATOM 1197 OD1 ASP A 79 -7.379 -4.510 7.061 1.00 0.00 O ATOM 1198 OD2 ASP A 79 -7.068 -6.645 6.508 1.00 0.00 O ATOM 0 H ASP A 79 -2.713 -4.503 5.300 1.00 0.00 H new ATOM 0 HA ASP A 79 -5.631 -4.298 4.843 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -4.630 -6.197 6.553 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -4.795 -4.827 7.633 1.00 0.00 H new ATOM 1203 N LEU A 80 -5.712 -2.231 6.398 1.00 0.00 N ATOM 1204 CA LEU A 80 -5.689 -0.894 7.017 1.00 0.00 C ATOM 1205 C LEU A 80 -4.855 -0.911 8.298 1.00 0.00 C ATOM 1206 O LEU A 80 -4.463 -1.958 8.820 1.00 0.00 O ATOM 1207 CB LEU A 80 -7.095 -0.371 7.356 1.00 0.00 C ATOM 1208 CG LEU A 80 -7.875 0.310 6.222 1.00 0.00 C ATOM 1209 CD1 LEU A 80 -7.137 1.506 5.630 1.00 0.00 C ATOM 1210 CD2 LEU A 80 -8.235 -0.682 5.133 1.00 0.00 C ATOM 0 H LEU A 80 -6.647 -2.621 6.281 1.00 0.00 H new ATOM 0 HA LEU A 80 -5.245 -0.226 6.279 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -7.689 -1.208 7.721 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -7.004 0.338 8.179 1.00 0.00 H new ATOM 0 HG LEU A 80 -8.793 0.691 6.670 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -7.737 1.946 4.833 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -6.966 2.250 6.408 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -6.180 1.178 5.224 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -8.787 -0.171 4.344 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -7.324 -1.114 4.718 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -8.854 -1.475 5.553 1.00 0.00 H new ATOM 1222 N ASP A 81 -4.530 0.289 8.743 1.00 0.00 N ATOM 1223 CA ASP A 81 -3.748 0.464 9.976 1.00 0.00 C ATOM 1224 C ASP A 81 -4.536 -0.067 11.188 1.00 0.00 C ATOM 1225 O ASP A 81 -5.627 0.443 11.459 1.00 0.00 O ATOM 1226 CB ASP A 81 -3.432 1.935 10.226 1.00 0.00 C ATOM 1227 CG ASP A 81 -2.912 2.708 9.017 1.00 0.00 C ATOM 1228 OD1 ASP A 81 -2.426 2.090 8.041 1.00 0.00 O ATOM 1229 OD2 ASP A 81 -2.923 3.937 9.194 1.00 0.00 O ATOM 0 H ASP A 81 -4.789 1.160 8.279 1.00 0.00 H new ATOM 0 HA ASP A 81 -2.819 -0.092 9.851 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -4.335 2.426 10.589 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -2.691 2.000 11.023 1.00 0.00 H new ATOM 1234 N PRO A 82 -3.931 -0.961 11.981 1.00 0.00 N ATOM 1235 CA PRO A 82 -4.542 -1.469 13.224 1.00 0.00 C ATOM 1236 C PRO A 82 -4.615 -0.406 14.335 1.00 0.00 C ATOM 1237 O PRO A 82 -5.326 -0.582 15.316 1.00 0.00 O ATOM 1238 CB PRO A 82 -3.690 -2.681 13.602 1.00 0.00 C ATOM 1239 CG PRO A 82 -2.301 -2.321 13.080 1.00 0.00 C ATOM 1240 CD PRO A 82 -2.585 -1.538 11.798 1.00 0.00 C ATOM 0 HA PRO A 82 -5.587 -1.743 13.081 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -3.683 -2.846 14.679 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -4.067 -3.595 13.142 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -1.746 -1.721 13.801 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -1.705 -3.212 12.881 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -1.841 -0.757 11.642 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -2.552 -2.189 10.925 1.00 0.00 H new ATOM 1248 N GLN A 83 -3.945 0.728 14.117 1.00 0.00 N ATOM 1249 CA GLN A 83 -3.985 1.890 15.023 1.00 0.00 C ATOM 1250 C GLN A 83 -5.079 2.918 14.680 1.00 0.00 C ATOM 1251 O GLN A 83 -5.062 4.031 15.204 1.00 0.00 O ATOM 1252 CB GLN A 83 -2.605 2.552 14.978 1.00 0.00 C ATOM 1253 CG GLN A 83 -1.608 1.872 15.917 1.00 0.00 C ATOM 1254 CD GLN A 83 -1.335 2.761 17.129 1.00 0.00 C ATOM 1255 OE1 GLN A 83 -1.879 2.602 18.213 1.00 0.00 O ATOM 1256 NE2 GLN A 83 -0.443 3.711 16.955 1.00 0.00 N ATOM 0 H GLN A 83 -3.352 0.872 13.300 1.00 0.00 H new ATOM 0 HA GLN A 83 -4.236 1.531 16.021 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -2.221 2.520 13.958 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -2.699 3.603 15.250 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -2.003 0.910 16.244 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -0.677 1.671 15.387 1.00 0.00 H new ATOM 0 HE21 GLN A 83 0.003 3.832 16.045 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -0.196 4.327 17.730 1.00 0.00 H new ATOM 1265 N GLU A 84 -6.005 2.545 13.786 1.00 0.00 N ATOM 1266 CA GLU A 84 -7.088 3.424 13.287 1.00 0.00 C ATOM 1267 C GLU A 84 -6.654 4.884 13.037 1.00 0.00 C ATOM 1268 O GLU A 84 -7.199 5.850 13.569 1.00 0.00 O ATOM 1269 CB GLU A 84 -8.319 3.379 14.196 1.00 0.00 C ATOM 1270 CG GLU A 84 -9.248 2.207 13.885 1.00 0.00 C ATOM 1271 CD GLU A 84 -10.675 2.564 14.308 1.00 0.00 C ATOM 1272 OE1 GLU A 84 -10.886 2.796 15.519 1.00 0.00 O ATOM 1273 OE2 GLU A 84 -11.529 2.612 13.395 1.00 0.00 O ATOM 0 H GLU A 84 -6.029 1.610 13.379 1.00 0.00 H new ATOM 0 HA GLU A 84 -7.352 3.014 12.312 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -7.995 3.313 15.235 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -8.873 4.312 14.094 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -9.219 1.978 12.820 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -8.913 1.313 14.412 1.00 0.00 H new ATOM 1280 N ARG A 85 -5.550 4.977 12.315 1.00 0.00 N ATOM 1281 CA ARG A 85 -4.912 6.253 11.960 1.00 0.00 C ATOM 1282 C ARG A 85 -5.347 6.687 10.558 1.00 0.00 C ATOM 1283 O ARG A 85 -5.948 5.914 9.806 1.00 0.00 O ATOM 1284 CB ARG A 85 -3.396 6.064 12.021 1.00 0.00 C ATOM 1285 CG ARG A 85 -2.832 5.962 13.445 1.00 0.00 C ATOM 1286 CD ARG A 85 -2.690 7.315 14.149 1.00 0.00 C ATOM 1287 NE ARG A 85 -3.914 7.706 14.865 1.00 0.00 N ATOM 1288 CZ ARG A 85 -4.191 8.932 15.325 1.00 0.00 C ATOM 1289 NH1 ARG A 85 -3.427 9.983 15.050 1.00 0.00 N ATOM 1290 NH2 ARG A 85 -5.290 9.135 16.031 1.00 0.00 N ATOM 0 H ARG A 85 -5.057 4.162 11.949 1.00 0.00 H new ATOM 0 HA ARG A 85 -5.213 7.033 12.659 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -3.131 5.161 11.472 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -2.916 6.899 11.511 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -3.482 5.320 14.039 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -1.856 5.478 13.406 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -1.859 7.270 14.853 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -2.443 8.080 13.413 1.00 0.00 H new ATOM 0 HE ARG A 85 -4.612 6.980 15.025 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -2.596 9.871 14.469 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -3.671 10.902 15.419 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -5.923 8.359 16.223 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -5.505 10.068 16.383 1.00 0.00 H new ATOM 1304 N LYS A 86 -5.010 7.931 10.232 1.00 0.00 N ATOM 1305 CA LYS A 86 -5.374 8.572 8.955 1.00 0.00 C ATOM 1306 C LYS A 86 -4.256 9.529 8.531 1.00 0.00 C ATOM 1307 O LYS A 86 -3.713 10.260 9.357 1.00 0.00 O ATOM 1308 CB LYS A 86 -6.713 9.313 9.062 1.00 0.00 C ATOM 1309 CG LYS A 86 -7.872 8.325 9.219 1.00 0.00 C ATOM 1310 CD LYS A 86 -9.206 9.014 9.487 1.00 0.00 C ATOM 1311 CE LYS A 86 -10.256 7.973 9.874 1.00 0.00 C ATOM 1312 NZ LYS A 86 -11.494 8.644 10.286 1.00 0.00 N ATOM 0 H LYS A 86 -4.470 8.537 10.849 1.00 0.00 H new ATOM 0 HA LYS A 86 -5.494 7.798 8.197 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -6.691 9.992 9.914 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -6.868 9.923 8.172 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -7.955 7.723 8.314 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -7.651 7.641 10.038 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -9.094 9.746 10.287 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -9.530 9.558 8.600 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -10.454 7.312 9.030 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -9.882 7.350 10.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -12.205 7.931 10.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -11.301 9.257 11.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -11.855 9.220 9.499 1.00 0.00 H new ATOM 1326 N TRP A 87 -3.805 9.346 7.294 1.00 0.00 N ATOM 1327 CA TRP A 87 -2.766 10.209 6.704 1.00 0.00 C ATOM 1328 C TRP A 87 -3.390 11.583 6.432 1.00 0.00 C ATOM 1329 O TRP A 87 -4.454 11.673 5.811 1.00 0.00 O ATOM 1330 CB TRP A 87 -2.234 9.575 5.417 1.00 0.00 C ATOM 1331 CG TRP A 87 -0.963 10.274 4.914 1.00 0.00 C ATOM 1332 CD1 TRP A 87 -0.889 11.188 3.948 1.00 0.00 C ATOM 1333 CD2 TRP A 87 0.323 10.010 5.334 1.00 0.00 C ATOM 1334 NE1 TRP A 87 0.390 11.506 3.749 1.00 0.00 N ATOM 1335 CE2 TRP A 87 1.169 10.821 4.566 1.00 0.00 C ATOM 1336 CE3 TRP A 87 0.855 9.134 6.263 1.00 0.00 C ATOM 1337 CZ2 TRP A 87 2.541 10.750 4.742 1.00 0.00 C ATOM 1338 CZ3 TRP A 87 2.226 9.109 6.472 1.00 0.00 C ATOM 1339 CH2 TRP A 87 3.074 9.906 5.708 1.00 0.00 C ATOM 0 H TRP A 87 -4.138 8.609 6.673 1.00 0.00 H new ATOM 0 HA TRP A 87 -1.923 10.323 7.386 1.00 0.00 H new ATOM 0 HB2 TRP A 87 -2.022 8.520 5.593 1.00 0.00 H new ATOM 0 HB3 TRP A 87 -3.003 9.621 4.646 1.00 0.00 H new ATOM 0 HD1 TRP A 87 -1.729 11.604 3.413 1.00 0.00 H new ATOM 0 HE1 TRP A 87 0.721 12.184 3.062 1.00 0.00 H new ATOM 0 HE3 TRP A 87 0.208 8.474 6.822 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 3.196 11.351 4.128 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 2.639 8.465 7.234 1.00 0.00 H new ATOM 0 HH2 TRP A 87 4.142 9.868 5.866 1.00 0.00 H new ATOM 1350 N THR A 88 -2.833 12.580 7.116 1.00 0.00 N ATOM 1351 CA THR A 88 -3.248 14.004 7.037 1.00 0.00 C ATOM 1352 C THR A 88 -2.918 14.623 5.666 1.00 0.00 C ATOM 1353 O THR A 88 -2.231 15.642 5.532 1.00 0.00 O ATOM 1354 CB THR A 88 -2.622 14.780 8.215 1.00 0.00 C ATOM 1355 OG1 THR A 88 -2.945 14.094 9.427 1.00 0.00 O ATOM 1356 CG2 THR A 88 -3.123 16.225 8.343 1.00 0.00 C ATOM 0 H THR A 88 -2.058 12.430 7.762 1.00 0.00 H new ATOM 0 HA THR A 88 -4.332 14.069 7.126 1.00 0.00 H new ATOM 0 HB THR A 88 -1.549 14.826 8.027 1.00 0.00 H new ATOM 0 HG1 THR A 88 -2.554 14.572 10.188 1.00 0.00 H new ATOM 0 HG21 THR A 88 -2.638 16.704 9.193 1.00 0.00 H new ATOM 0 HG22 THR A 88 -2.885 16.775 7.432 1.00 0.00 H new ATOM 0 HG23 THR A 88 -4.202 16.224 8.495 1.00 0.00 H new ATOM 1364 N LYS A 89 -3.393 13.922 4.632 1.00 0.00 N ATOM 1365 CA LYS A 89 -3.185 14.232 3.208 1.00 0.00 C ATOM 1366 C LYS A 89 -1.702 14.571 2.940 1.00 0.00 C ATOM 1367 O LYS A 89 -0.811 14.137 3.671 1.00 0.00 O ATOM 1368 CB LYS A 89 -4.167 15.341 2.804 1.00 0.00 C ATOM 1369 CG LYS A 89 -5.088 14.866 1.675 1.00 0.00 C ATOM 1370 CD LYS A 89 -6.176 15.898 1.362 1.00 0.00 C ATOM 1371 CE LYS A 89 -5.668 17.054 0.494 1.00 0.00 C ATOM 1372 NZ LYS A 89 -6.215 18.330 0.973 1.00 0.00 N ATOM 0 H LYS A 89 -3.959 13.084 4.767 1.00 0.00 H new ATOM 0 HA LYS A 89 -3.397 13.367 2.580 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -4.764 15.637 3.667 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -3.614 16.223 2.482 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -4.497 14.676 0.779 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -5.552 13.921 1.957 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -7.003 15.404 0.852 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -6.570 16.298 2.296 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -4.579 17.085 0.519 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -5.958 16.893 -0.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -5.495 19.074 0.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -7.052 18.583 0.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -6.486 18.238 1.973 1.00 0.00 H new ATOM 1386 N THR A 90 -1.445 15.414 1.958 1.00 0.00 N ATOM 1387 CA THR A 90 -0.073 15.862 1.649 1.00 0.00 C ATOM 1388 C THR A 90 0.227 17.154 2.430 1.00 0.00 C ATOM 1389 O THR A 90 0.599 18.173 1.850 1.00 0.00 O ATOM 1390 CB THR A 90 0.053 16.040 0.127 1.00 0.00 C ATOM 1391 OG1 THR A 90 -0.610 14.950 -0.529 1.00 0.00 O ATOM 1392 CG2 THR A 90 1.518 16.079 -0.318 1.00 0.00 C ATOM 0 H THR A 90 -2.162 15.811 1.351 1.00 0.00 H new ATOM 0 HA THR A 90 0.667 15.124 1.959 1.00 0.00 H new ATOM 0 HB THR A 90 -0.408 16.990 -0.144 1.00 0.00 H new ATOM 0 HG1 THR A 90 -0.535 15.058 -1.500 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.566 16.206 -1.400 1.00 0.00 H new ATOM 0 HG22 THR A 90 2.024 16.913 0.168 1.00 0.00 H new ATOM 0 HG23 THR A 90 2.008 15.146 -0.040 1.00 0.00 H new ATOM 1400 N ASP A 91 0.036 17.080 3.755 1.00 0.00 N ATOM 1401 CA ASP A 91 0.235 18.182 4.722 1.00 0.00 C ATOM 1402 C ASP A 91 -0.815 19.295 4.507 1.00 0.00 C ATOM 1403 O ASP A 91 -0.603 20.241 3.749 1.00 0.00 O ATOM 1404 CB ASP A 91 1.683 18.701 4.600 1.00 0.00 C ATOM 1405 CG ASP A 91 2.211 19.485 5.801 1.00 0.00 C ATOM 1406 OD1 ASP A 91 2.077 18.954 6.925 1.00 0.00 O ATOM 1407 OD2 ASP A 91 2.791 20.567 5.565 1.00 0.00 O ATOM 0 H ASP A 91 -0.274 16.219 4.206 1.00 0.00 H new ATOM 0 HA ASP A 91 0.090 17.818 5.739 1.00 0.00 H new ATOM 0 HB2 ASP A 91 2.341 17.849 4.428 1.00 0.00 H new ATOM 0 HB3 ASP A 91 1.748 19.337 3.717 1.00 0.00 H new ATOM 1412 N GLY A 92 -1.983 19.094 5.132 1.00 0.00 N ATOM 1413 CA GLY A 92 -3.103 20.059 5.053 1.00 0.00 C ATOM 1414 C GLY A 92 -4.321 19.599 5.861 1.00 0.00 C ATOM 1415 O GLY A 92 -4.188 19.027 6.942 1.00 0.00 O ATOM 0 H GLY A 92 -2.183 18.271 5.701 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -2.771 21.030 5.421 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -3.391 20.195 4.010 1.00 0.00 H new ATOM 1419 N SER A 93 -5.481 19.760 5.237 1.00 0.00 N ATOM 1420 CA SER A 93 -6.778 19.350 5.817 1.00 0.00 C ATOM 1421 C SER A 93 -7.450 18.300 4.937 1.00 0.00 C ATOM 1422 O SER A 93 -7.320 18.333 3.715 1.00 0.00 O ATOM 1423 CB SER A 93 -7.739 20.533 5.978 1.00 0.00 C ATOM 1424 OG SER A 93 -7.400 21.264 7.157 1.00 0.00 O ATOM 0 H SER A 93 -5.562 20.179 4.311 1.00 0.00 H new ATOM 0 HA SER A 93 -6.561 18.938 6.803 1.00 0.00 H new ATOM 0 HB2 SER A 93 -7.682 21.183 5.105 1.00 0.00 H new ATOM 0 HB3 SER A 93 -8.766 20.175 6.042 1.00 0.00 H new ATOM 0 HG SER A 93 -8.013 22.022 7.260 1.00 0.00 H new ATOM 1430 N GLY A 94 -8.117 17.360 5.612 1.00 0.00 N ATOM 1431 CA GLY A 94 -8.845 16.274 4.931 1.00 0.00 C ATOM 1432 C GLY A 94 -8.153 14.928 5.200 1.00 0.00 C ATOM 1433 O GLY A 94 -7.176 14.612 4.519 1.00 0.00 O ATOM 0 H GLY A 94 -8.171 17.325 6.630 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -9.876 16.239 5.284 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -8.881 16.466 3.859 1.00 0.00 H new ATOM 1437 N PRO A 95 -8.563 14.207 6.254 1.00 0.00 N ATOM 1438 CA PRO A 95 -7.969 12.900 6.581 1.00 0.00 C ATOM 1439 C PRO A 95 -8.400 11.843 5.559 1.00 0.00 C ATOM 1440 O PRO A 95 -9.582 11.676 5.255 1.00 0.00 O ATOM 1441 CB PRO A 95 -8.444 12.601 8.004 1.00 0.00 C ATOM 1442 CG PRO A 95 -9.794 13.312 8.097 1.00 0.00 C ATOM 1443 CD PRO A 95 -9.608 14.565 7.239 1.00 0.00 C ATOM 0 HA PRO A 95 -6.880 12.897 6.536 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -8.544 11.529 8.175 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -7.742 12.978 8.747 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -10.603 12.686 7.720 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -10.042 13.566 9.128 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -10.538 14.845 6.743 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -9.302 15.417 7.846 1.00 0.00 H new ATOM 1451 N ALA A 96 -7.395 11.163 5.029 1.00 0.00 N ATOM 1452 CA ALA A 96 -7.588 10.128 4.001 1.00 0.00 C ATOM 1453 C ALA A 96 -7.025 8.811 4.532 1.00 0.00 C ATOM 1454 O ALA A 96 -5.833 8.697 4.825 1.00 0.00 O ATOM 1455 CB ALA A 96 -6.896 10.548 2.701 1.00 0.00 C ATOM 0 H ALA A 96 -6.420 11.306 5.293 1.00 0.00 H new ATOM 0 HA ALA A 96 -8.648 9.999 3.781 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -7.043 9.777 1.945 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -7.322 11.487 2.349 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -5.829 10.679 2.883 1.00 0.00 H new ATOM 1461 N LYS A 97 -7.959 7.937 4.907 1.00 0.00 N ATOM 1462 CA LYS A 97 -7.633 6.599 5.438 1.00 0.00 C ATOM 1463 C LYS A 97 -6.538 5.927 4.598 1.00 0.00 C ATOM 1464 O LYS A 97 -6.479 6.071 3.375 1.00 0.00 O ATOM 1465 CB LYS A 97 -8.879 5.716 5.432 1.00 0.00 C ATOM 1466 CG LYS A 97 -8.959 4.877 6.707 1.00 0.00 C ATOM 1467 CD LYS A 97 -10.207 4.002 6.638 1.00 0.00 C ATOM 1468 CE LYS A 97 -10.662 3.560 8.027 1.00 0.00 C ATOM 1469 NZ LYS A 97 -12.063 3.125 7.954 1.00 0.00 N ATOM 0 H LYS A 97 -8.960 8.128 4.855 1.00 0.00 H new ATOM 0 HA LYS A 97 -7.271 6.722 6.459 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -9.770 6.338 5.345 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -8.861 5.061 4.561 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -8.068 4.257 6.808 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -8.999 5.524 7.583 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -11.011 4.552 6.149 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -10.003 3.124 6.025 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -10.033 2.746 8.388 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -10.559 4.381 8.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -12.382 2.822 8.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -12.655 3.914 7.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -12.145 2.330 7.288 1.00 0.00 H new ATOM 1483 N LEU A 98 -5.673 5.243 5.323 1.00 0.00 N ATOM 1484 CA LEU A 98 -4.463 4.631 4.763 1.00 0.00 C ATOM 1485 C LEU A 98 -4.203 3.250 5.358 1.00 0.00 C ATOM 1486 O LEU A 98 -4.563 2.960 6.504 1.00 0.00 O ATOM 1487 CB LEU A 98 -3.265 5.592 4.910 1.00 0.00 C ATOM 1488 CG LEU A 98 -2.578 5.873 6.252 1.00 0.00 C ATOM 1489 CD1 LEU A 98 -3.557 6.131 7.395 1.00 0.00 C ATOM 1490 CD2 LEU A 98 -1.503 4.828 6.550 1.00 0.00 C ATOM 0 H LEU A 98 -5.783 5.090 6.325 1.00 0.00 H new ATOM 0 HA LEU A 98 -4.613 4.465 3.696 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -2.490 5.225 4.237 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -3.593 6.557 4.523 1.00 0.00 H new ATOM 0 HG LEU A 98 -2.053 6.823 6.159 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -3.002 6.322 8.313 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -4.174 6.997 7.157 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -4.195 5.258 7.532 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -1.033 5.052 7.507 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -1.959 3.839 6.593 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -0.749 4.846 5.763 1.00 0.00 H new ATOM 1502 N PHE A 99 -3.645 2.410 4.507 1.00 0.00 N ATOM 1503 CA PHE A 99 -3.319 1.023 4.854 1.00 0.00 C ATOM 1504 C PHE A 99 -1.817 0.774 4.729 1.00 0.00 C ATOM 1505 O PHE A 99 -1.138 1.389 3.903 1.00 0.00 O ATOM 1506 CB PHE A 99 -4.109 0.051 3.970 1.00 0.00 C ATOM 1507 CG PHE A 99 -3.891 0.221 2.473 1.00 0.00 C ATOM 1508 CD1 PHE A 99 -2.712 -0.234 1.886 1.00 0.00 C ATOM 1509 CD2 PHE A 99 -4.837 0.890 1.701 1.00 0.00 C ATOM 1510 CE1 PHE A 99 -2.471 -0.015 0.549 1.00 0.00 C ATOM 1511 CE2 PHE A 99 -4.592 1.113 0.365 1.00 0.00 C ATOM 1512 CZ PHE A 99 -3.414 0.656 -0.228 1.00 0.00 C ATOM 0 H PHE A 99 -3.401 2.663 3.550 1.00 0.00 H new ATOM 0 HA PHE A 99 -3.604 0.850 5.892 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -3.841 -0.969 4.247 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -5.171 0.171 4.183 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -1.983 -0.761 2.484 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -5.759 1.232 2.148 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -1.552 -0.363 0.102 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -5.318 1.647 -0.230 1.00 0.00 H new ATOM 0 HZ PHE A 99 -3.235 0.821 -1.280 1.00 0.00 H new ATOM 1522 N GLY A 100 -1.379 -0.202 5.520 1.00 0.00 N ATOM 1523 CA GLY A 100 0.023 -0.637 5.515 1.00 0.00 C ATOM 1524 C GLY A 100 0.081 -2.133 5.250 1.00 0.00 C ATOM 1525 O GLY A 100 -0.731 -2.914 5.750 1.00 0.00 O ATOM 0 H GLY A 100 -1.973 -0.710 6.175 1.00 0.00 H new ATOM 0 HA2 GLY A 100 0.581 -0.098 4.749 1.00 0.00 H new ATOM 0 HA3 GLY A 100 0.491 -0.407 6.472 1.00 0.00 H new ATOM 1529 N PHE A 101 1.005 -2.474 4.374 1.00 0.00 N ATOM 1530 CA PHE A 101 1.259 -3.874 4.041 1.00 0.00 C ATOM 1531 C PHE A 101 2.734 -4.219 4.208 1.00 0.00 C ATOM 1532 O PHE A 101 3.620 -3.410 3.933 1.00 0.00 O ATOM 1533 CB PHE A 101 0.765 -4.205 2.627 1.00 0.00 C ATOM 1534 CG PHE A 101 1.542 -3.559 1.496 1.00 0.00 C ATOM 1535 CD1 PHE A 101 2.787 -4.066 1.134 1.00 0.00 C ATOM 1536 CD2 PHE A 101 0.995 -2.476 0.820 1.00 0.00 C ATOM 1537 CE1 PHE A 101 3.497 -3.489 0.108 1.00 0.00 C ATOM 1538 CE2 PHE A 101 1.694 -1.919 -0.229 1.00 0.00 C ATOM 1539 CZ PHE A 101 2.942 -2.414 -0.594 1.00 0.00 C ATOM 0 H PHE A 101 1.595 -1.807 3.877 1.00 0.00 H new ATOM 0 HA PHE A 101 0.694 -4.491 4.740 1.00 0.00 H new ATOM 0 HB2 PHE A 101 0.796 -5.286 2.494 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -0.279 -3.903 2.546 1.00 0.00 H new ATOM 0 HD1 PHE A 101 3.196 -4.915 1.661 1.00 0.00 H new ATOM 0 HD2 PHE A 101 0.035 -2.076 1.112 1.00 0.00 H new ATOM 0 HE1 PHE A 101 4.476 -3.863 -0.154 1.00 0.00 H new ATOM 0 HE2 PHE A 101 1.268 -1.089 -0.774 1.00 0.00 H new ATOM 0 HZ PHE A 101 3.481 -1.969 -1.417 1.00 0.00 H new ATOM 1549 N VAL A 102 2.940 -5.482 4.514 1.00 0.00 N ATOM 1550 CA VAL A 102 4.281 -6.069 4.661 1.00 0.00 C ATOM 1551 C VAL A 102 4.619 -6.998 3.494 1.00 0.00 C ATOM 1552 O VAL A 102 3.893 -7.937 3.211 1.00 0.00 O ATOM 1553 CB VAL A 102 4.494 -6.727 6.035 1.00 0.00 C ATOM 1554 CG1 VAL A 102 5.115 -5.651 6.900 1.00 0.00 C ATOM 1555 CG2 VAL A 102 3.234 -7.181 6.785 1.00 0.00 C ATOM 0 H VAL A 102 2.183 -6.147 4.672 1.00 0.00 H new ATOM 0 HA VAL A 102 4.995 -5.246 4.622 1.00 0.00 H new ATOM 0 HB VAL A 102 5.081 -7.628 5.857 1.00 0.00 H new ATOM 0 HG11 VAL A 102 5.297 -6.047 7.899 1.00 0.00 H new ATOM 0 HG12 VAL A 102 6.059 -5.330 6.460 1.00 0.00 H new ATOM 0 HG13 VAL A 102 4.437 -4.800 6.965 1.00 0.00 H new ATOM 0 HG21 VAL A 102 3.519 -7.628 7.738 1.00 0.00 H new ATOM 0 HG22 VAL A 102 2.589 -6.321 6.966 1.00 0.00 H new ATOM 0 HG23 VAL A 102 2.699 -7.917 6.185 1.00 0.00 H new ATOM 1565 N ALA A 103 5.605 -6.584 2.705 1.00 0.00 N ATOM 1566 CA ALA A 103 6.023 -7.356 1.522 1.00 0.00 C ATOM 1567 C ALA A 103 7.441 -7.905 1.695 1.00 0.00 C ATOM 1568 O ALA A 103 8.395 -7.138 1.802 1.00 0.00 O ATOM 1569 CB ALA A 103 5.924 -6.497 0.256 1.00 0.00 C ATOM 0 H ALA A 103 6.132 -5.724 2.855 1.00 0.00 H new ATOM 0 HA ALA A 103 5.347 -8.204 1.416 1.00 0.00 H new ATOM 0 HB1 ALA A 103 6.237 -7.084 -0.607 1.00 0.00 H new ATOM 0 HB2 ALA A 103 4.894 -6.170 0.118 1.00 0.00 H new ATOM 0 HB3 ALA A 103 6.571 -5.626 0.356 1.00 0.00 H new ATOM 1575 N ARG A 104 7.558 -9.227 1.741 1.00 0.00 N ATOM 1576 CA ARG A 104 8.862 -9.922 1.842 1.00 0.00 C ATOM 1577 C ARG A 104 9.702 -9.873 0.545 1.00 0.00 C ATOM 1578 O ARG A 104 10.745 -10.520 0.427 1.00 0.00 O ATOM 1579 CB ARG A 104 8.647 -11.362 2.334 1.00 0.00 C ATOM 1580 CG ARG A 104 8.060 -12.308 1.282 1.00 0.00 C ATOM 1581 CD ARG A 104 9.085 -13.368 0.869 1.00 0.00 C ATOM 1582 NE ARG A 104 8.569 -14.691 1.254 1.00 0.00 N ATOM 1583 CZ ARG A 104 8.494 -15.202 2.490 1.00 0.00 C ATOM 1584 NH1 ARG A 104 9.006 -14.584 3.547 1.00 0.00 N ATOM 1585 NH2 ARG A 104 7.934 -16.384 2.673 1.00 0.00 N ATOM 0 H ARG A 104 6.758 -9.859 1.710 1.00 0.00 H new ATOM 0 HA ARG A 104 9.458 -9.378 2.575 1.00 0.00 H new ATOM 0 HB2 ARG A 104 9.602 -11.763 2.674 1.00 0.00 H new ATOM 0 HB3 ARG A 104 7.983 -11.343 3.199 1.00 0.00 H new ATOM 0 HG2 ARG A 104 7.169 -12.793 1.680 1.00 0.00 H new ATOM 0 HG3 ARG A 104 7.748 -11.737 0.407 1.00 0.00 H new ATOM 0 HD2 ARG A 104 9.259 -13.328 -0.206 1.00 0.00 H new ATOM 0 HD3 ARG A 104 10.042 -13.179 1.355 1.00 0.00 H new ATOM 0 HE ARG A 104 8.231 -15.284 0.496 1.00 0.00 H new ATOM 0 HH11 ARG A 104 9.477 -13.687 3.434 1.00 0.00 H new ATOM 0 HH12 ARG A 104 8.928 -15.006 4.472 1.00 0.00 H new ATOM 0 HH21 ARG A 104 7.562 -16.901 1.876 1.00 0.00 H new ATOM 0 HH22 ARG A 104 7.873 -16.780 3.611 1.00 0.00 H new ATOM 1599 N LYS A 105 9.320 -8.959 -0.346 1.00 0.00 N ATOM 1600 CA LYS A 105 9.992 -8.767 -1.638 1.00 0.00 C ATOM 1601 C LYS A 105 11.187 -7.838 -1.443 1.00 0.00 C ATOM 1602 O LYS A 105 10.996 -6.632 -1.300 1.00 0.00 O ATOM 1603 CB LYS A 105 9.042 -8.187 -2.700 1.00 0.00 C ATOM 1604 CG LYS A 105 9.667 -8.011 -4.094 1.00 0.00 C ATOM 1605 CD LYS A 105 10.552 -9.201 -4.476 1.00 0.00 C ATOM 1606 CE LYS A 105 10.812 -9.283 -5.971 1.00 0.00 C ATOM 1607 NZ LYS A 105 10.411 -10.631 -6.384 1.00 0.00 N ATOM 0 H LYS A 105 8.534 -8.327 -0.195 1.00 0.00 H new ATOM 0 HA LYS A 105 10.324 -9.740 -1.999 1.00 0.00 H new ATOM 0 HB2 LYS A 105 8.173 -8.840 -2.786 1.00 0.00 H new ATOM 0 HB3 LYS A 105 8.680 -7.219 -2.354 1.00 0.00 H new ATOM 0 HG2 LYS A 105 8.876 -7.894 -4.835 1.00 0.00 H new ATOM 0 HG3 LYS A 105 10.260 -7.096 -4.114 1.00 0.00 H new ATOM 0 HD2 LYS A 105 11.503 -9.125 -3.950 1.00 0.00 H new ATOM 0 HD3 LYS A 105 10.077 -10.124 -4.143 1.00 0.00 H new ATOM 0 HE2 LYS A 105 10.240 -8.526 -6.507 1.00 0.00 H new ATOM 0 HE3 LYS A 105 11.864 -9.105 -6.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 10.569 -10.742 -7.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 10.976 -11.335 -5.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 9.403 -10.774 -6.172 1.00 0.00 H new ATOM 1621 N GLN A 106 12.312 -8.496 -1.181 1.00 0.00 N ATOM 1622 CA GLN A 106 13.631 -7.850 -1.021 1.00 0.00 C ATOM 1623 C GLN A 106 14.737 -8.880 -0.746 1.00 0.00 C ATOM 1624 O GLN A 106 15.524 -9.211 -1.627 1.00 0.00 O ATOM 1625 CB GLN A 106 13.606 -6.791 0.094 1.00 0.00 C ATOM 1626 CG GLN A 106 14.264 -5.489 -0.364 1.00 0.00 C ATOM 1627 CD GLN A 106 13.455 -4.741 -1.430 1.00 0.00 C ATOM 1628 OE1 GLN A 106 13.111 -5.221 -2.504 1.00 0.00 O ATOM 1629 NE2 GLN A 106 13.275 -3.463 -1.203 1.00 0.00 N ATOM 0 H GLN A 106 12.344 -9.509 -1.070 1.00 0.00 H new ATOM 0 HA GLN A 106 13.855 -7.353 -1.965 1.00 0.00 H new ATOM 0 HB2 GLN A 106 12.575 -6.596 0.391 1.00 0.00 H new ATOM 0 HB3 GLN A 106 14.124 -7.173 0.974 1.00 0.00 H new ATOM 0 HG2 GLN A 106 14.404 -4.838 0.499 1.00 0.00 H new ATOM 0 HG3 GLN A 106 15.255 -5.711 -0.760 1.00 0.00 H new ATOM 0 HE21 GLN A 106 13.559 -3.058 -0.311 1.00 0.00 H new ATOM 0 HE22 GLN A 106 12.850 -2.873 -1.918 1.00 0.00 H new ATOM 1638 N GLY A 107 14.736 -9.367 0.501 1.00 0.00 N ATOM 1639 CA GLY A 107 15.696 -10.372 0.990 1.00 0.00 C ATOM 1640 C GLY A 107 15.157 -11.803 0.883 1.00 0.00 C ATOM 1641 O GLY A 107 15.948 -12.737 0.795 1.00 0.00 O ATOM 0 H GLY A 107 14.063 -9.073 1.209 1.00 0.00 H new ATOM 0 HA2 GLY A 107 16.621 -10.293 0.420 1.00 0.00 H new ATOM 0 HA3 GLY A 107 15.943 -10.157 2.030 1.00 0.00 H new ATOM 1645 N SER A 108 13.823 -11.934 0.898 1.00 0.00 N ATOM 1646 CA SER A 108 13.052 -13.201 0.916 1.00 0.00 C ATOM 1647 C SER A 108 13.230 -13.964 2.229 1.00 0.00 C ATOM 1648 O SER A 108 12.316 -13.953 3.052 1.00 0.00 O ATOM 1649 CB SER A 108 13.369 -14.128 -0.266 1.00 0.00 C ATOM 1650 OG SER A 108 13.193 -13.429 -1.498 1.00 0.00 O ATOM 0 H SER A 108 13.212 -11.117 0.898 1.00 0.00 H new ATOM 0 HA SER A 108 12.011 -12.894 0.821 1.00 0.00 H new ATOM 0 HB2 SER A 108 14.394 -14.492 -0.188 1.00 0.00 H new ATOM 0 HB3 SER A 108 12.718 -15.002 -0.238 1.00 0.00 H new ATOM 0 HG SER A 108 13.399 -14.028 -2.246 1.00 0.00 H new ATOM 1656 N THR A 109 14.481 -14.352 2.488 1.00 0.00 N ATOM 1657 CA THR A 109 14.975 -15.060 3.683 1.00 0.00 C ATOM 1658 C THR A 109 14.290 -14.510 4.949 1.00 0.00 C ATOM 1659 O THR A 109 13.450 -15.201 5.517 1.00 0.00 O ATOM 1660 CB THR A 109 16.507 -14.906 3.779 1.00 0.00 C ATOM 1661 OG1 THR A 109 17.089 -15.034 2.476 1.00 0.00 O ATOM 1662 CG2 THR A 109 17.125 -15.962 4.701 1.00 0.00 C ATOM 0 H THR A 109 15.233 -14.169 1.824 1.00 0.00 H new ATOM 0 HA THR A 109 14.734 -16.120 3.600 1.00 0.00 H new ATOM 0 HB THR A 109 16.713 -13.920 4.194 1.00 0.00 H new ATOM 0 HG1 THR A 109 18.062 -14.934 2.541 1.00 0.00 H new ATOM 0 HG21 THR A 109 18.205 -15.821 4.743 1.00 0.00 H new ATOM 0 HG22 THR A 109 16.707 -15.861 5.702 1.00 0.00 H new ATOM 0 HG23 THR A 109 16.904 -16.957 4.314 1.00 0.00 H new ATOM 1670 N THR A 110 14.489 -13.216 5.203 1.00 0.00 N ATOM 1671 CA THR A 110 13.922 -12.513 6.383 1.00 0.00 C ATOM 1672 C THR A 110 14.031 -10.984 6.256 1.00 0.00 C ATOM 1673 O THR A 110 14.963 -10.354 6.749 1.00 0.00 O ATOM 1674 CB THR A 110 14.627 -12.965 7.675 1.00 0.00 C ATOM 1675 OG1 THR A 110 16.019 -13.184 7.421 1.00 0.00 O ATOM 1676 CG2 THR A 110 13.959 -14.174 8.340 1.00 0.00 C ATOM 0 H THR A 110 15.049 -12.612 4.601 1.00 0.00 H new ATOM 0 HA THR A 110 12.865 -12.777 6.427 1.00 0.00 H new ATOM 0 HB THR A 110 14.529 -12.158 8.401 1.00 0.00 H new ATOM 0 HG1 THR A 110 16.461 -13.470 8.248 1.00 0.00 H new ATOM 0 HG21 THR A 110 14.506 -14.440 9.245 1.00 0.00 H new ATOM 0 HG22 THR A 110 12.930 -13.925 8.598 1.00 0.00 H new ATOM 0 HG23 THR A 110 13.966 -15.018 7.651 1.00 0.00 H new ATOM 1684 N ASP A 111 13.034 -10.386 5.600 1.00 0.00 N ATOM 1685 CA ASP A 111 12.979 -8.937 5.295 1.00 0.00 C ATOM 1686 C ASP A 111 11.678 -8.549 4.584 1.00 0.00 C ATOM 1687 O ASP A 111 11.437 -8.954 3.450 1.00 0.00 O ATOM 1688 CB ASP A 111 14.159 -8.467 4.426 1.00 0.00 C ATOM 1689 CG ASP A 111 15.282 -7.834 5.253 1.00 0.00 C ATOM 1690 OD1 ASP A 111 15.067 -6.663 5.631 1.00 0.00 O ATOM 1691 OD2 ASP A 111 16.351 -8.464 5.377 1.00 0.00 O ATOM 0 H ASP A 111 12.222 -10.897 5.255 1.00 0.00 H new ATOM 0 HA ASP A 111 13.032 -8.443 6.265 1.00 0.00 H new ATOM 0 HB2 ASP A 111 14.556 -9.316 3.869 1.00 0.00 H new ATOM 0 HB3 ASP A 111 13.801 -7.744 3.693 1.00 0.00 H new ATOM 1696 N ASN A 112 10.837 -7.822 5.310 1.00 0.00 N ATOM 1697 CA ASN A 112 9.593 -7.270 4.743 1.00 0.00 C ATOM 1698 C ASN A 112 9.705 -5.742 4.610 1.00 0.00 C ATOM 1699 O ASN A 112 10.379 -5.095 5.414 1.00 0.00 O ATOM 1700 CB ASN A 112 8.385 -7.667 5.607 1.00 0.00 C ATOM 1701 CG ASN A 112 8.242 -6.843 6.889 1.00 0.00 C ATOM 1702 OD1 ASN A 112 8.093 -5.626 6.864 1.00 0.00 O ATOM 1703 ND2 ASN A 112 8.366 -7.440 8.047 1.00 0.00 N ATOM 0 H ASN A 112 10.986 -7.596 6.293 1.00 0.00 H new ATOM 0 HA ASN A 112 9.442 -7.688 3.748 1.00 0.00 H new ATOM 0 HB2 ASN A 112 7.476 -7.560 5.015 1.00 0.00 H new ATOM 0 HB3 ASN A 112 8.471 -8.721 5.872 1.00 0.00 H new ATOM 0 HD21 ASN A 112 8.338 -6.894 8.908 1.00 0.00 H new ATOM 0 HD22 ASN A 112 8.491 -8.451 8.089 1.00 0.00 H new ATOM 1710 N VAL A 113 8.994 -5.218 3.625 1.00 0.00 N ATOM 1711 CA VAL A 113 8.808 -3.775 3.400 1.00 0.00 C ATOM 1712 C VAL A 113 7.372 -3.392 3.789 1.00 0.00 C ATOM 1713 O VAL A 113 6.409 -3.934 3.246 1.00 0.00 O ATOM 1714 CB VAL A 113 9.229 -3.464 1.946 1.00 0.00 C ATOM 1715 CG1 VAL A 113 8.224 -2.720 1.052 1.00 0.00 C ATOM 1716 CG2 VAL A 113 10.537 -2.675 1.994 1.00 0.00 C ATOM 0 H VAL A 113 8.512 -5.793 2.934 1.00 0.00 H new ATOM 0 HA VAL A 113 9.440 -3.150 4.031 1.00 0.00 H new ATOM 0 HB VAL A 113 9.315 -4.440 1.469 1.00 0.00 H new ATOM 0 HG11 VAL A 113 8.657 -2.572 0.063 1.00 0.00 H new ATOM 0 HG12 VAL A 113 7.310 -3.308 0.964 1.00 0.00 H new ATOM 0 HG13 VAL A 113 7.991 -1.751 1.494 1.00 0.00 H new ATOM 0 HG21 VAL A 113 10.858 -2.441 0.979 1.00 0.00 H new ATOM 0 HG22 VAL A 113 10.383 -1.749 2.548 1.00 0.00 H new ATOM 0 HG23 VAL A 113 11.304 -3.271 2.489 1.00 0.00 H new ATOM 1726 N CYS A 114 7.277 -2.588 4.838 1.00 0.00 N ATOM 1727 CA CYS A 114 5.984 -2.061 5.291 1.00 0.00 C ATOM 1728 C CYS A 114 5.650 -0.764 4.551 1.00 0.00 C ATOM 1729 O CYS A 114 6.168 0.314 4.838 1.00 0.00 O ATOM 1730 CB CYS A 114 6.025 -1.854 6.796 1.00 0.00 C ATOM 1731 SG CYS A 114 4.469 -2.372 7.591 1.00 0.00 S ATOM 0 H CYS A 114 8.075 -2.283 5.395 1.00 0.00 H new ATOM 0 HA CYS A 114 5.194 -2.777 5.064 1.00 0.00 H new ATOM 0 HB2 CYS A 114 6.855 -2.420 7.219 1.00 0.00 H new ATOM 0 HB3 CYS A 114 6.212 -0.802 7.014 1.00 0.00 H new ATOM 0 HG CYS A 114 3.578 -1.436 7.451 1.00 0.00 H new ATOM 1737 N HIS A 115 4.924 -0.962 3.465 1.00 0.00 N ATOM 1738 CA HIS A 115 4.517 0.137 2.583 1.00 0.00 C ATOM 1739 C HIS A 115 3.109 0.606 2.948 1.00 0.00 C ATOM 1740 O HIS A 115 2.189 -0.190 3.142 1.00 0.00 O ATOM 1741 CB HIS A 115 4.539 -0.378 1.157 1.00 0.00 C ATOM 1742 CG HIS A 115 5.349 0.477 0.172 1.00 0.00 C ATOM 1743 ND1 HIS A 115 6.107 -0.039 -0.777 1.00 0.00 N ATOM 1744 CD2 HIS A 115 5.340 1.795 0.056 1.00 0.00 C ATOM 1745 CE1 HIS A 115 6.585 0.976 -1.509 1.00 0.00 C ATOM 1746 NE2 HIS A 115 6.109 2.095 -0.990 1.00 0.00 N ATOM 0 H HIS A 115 4.598 -1.880 3.164 1.00 0.00 H new ATOM 0 HA HIS A 115 5.197 0.982 2.691 1.00 0.00 H new ATOM 0 HB2 HIS A 115 4.946 -1.389 1.158 1.00 0.00 H new ATOM 0 HB3 HIS A 115 3.513 -0.448 0.796 1.00 0.00 H new ATOM 0 HD2 HIS A 115 4.811 2.493 0.688 1.00 0.00 H new ATOM 0 HE1 HIS A 115 7.239 0.895 -2.365 1.00 0.00 H new ATOM 0 HE2 HIS A 115 6.300 3.036 -1.335 1.00 0.00 H new ATOM 1754 N LEU A 116 3.031 1.916 3.099 1.00 0.00 N ATOM 1755 CA LEU A 116 1.796 2.597 3.522 1.00 0.00 C ATOM 1756 C LEU A 116 1.289 3.510 2.407 1.00 0.00 C ATOM 1757 O LEU A 116 2.066 4.109 1.659 1.00 0.00 O ATOM 1758 CB LEU A 116 2.093 3.407 4.783 1.00 0.00 C ATOM 1759 CG LEU A 116 2.747 2.519 5.840 1.00 0.00 C ATOM 1760 CD1 LEU A 116 3.924 3.235 6.487 1.00 0.00 C ATOM 1761 CD2 LEU A 116 1.726 2.102 6.886 1.00 0.00 C ATOM 0 H LEU A 116 3.815 2.547 2.935 1.00 0.00 H new ATOM 0 HA LEU A 116 1.020 1.861 3.734 1.00 0.00 H new ATOM 0 HB2 LEU A 116 2.751 4.241 4.541 1.00 0.00 H new ATOM 0 HB3 LEU A 116 1.170 3.833 5.176 1.00 0.00 H new ATOM 0 HG LEU A 116 3.125 1.620 5.353 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.377 2.586 7.237 1.00 0.00 H new ATOM 0 HD12 LEU A 116 4.664 3.480 5.725 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.575 4.152 6.963 1.00 0.00 H new ATOM 0 HD21 LEU A 116 2.207 1.470 7.632 1.00 0.00 H new ATOM 0 HD22 LEU A 116 1.318 2.989 7.371 1.00 0.00 H new ATOM 0 HD23 LEU A 116 0.919 1.548 6.406 1.00 0.00 H new ATOM 1773 N PHE A 117 -0.031 3.501 2.283 1.00 0.00 N ATOM 1774 CA PHE A 117 -0.745 4.248 1.235 1.00 0.00 C ATOM 1775 C PHE A 117 -2.099 4.760 1.722 1.00 0.00 C ATOM 1776 O PHE A 117 -2.889 3.991 2.270 1.00 0.00 O ATOM 1777 CB PHE A 117 -0.978 3.337 0.027 1.00 0.00 C ATOM 1778 CG PHE A 117 0.323 2.955 -0.666 1.00 0.00 C ATOM 1779 CD1 PHE A 117 0.892 3.820 -1.599 1.00 0.00 C ATOM 1780 CD2 PHE A 117 0.964 1.758 -0.362 1.00 0.00 C ATOM 1781 CE1 PHE A 117 2.067 3.495 -2.237 1.00 0.00 C ATOM 1782 CE2 PHE A 117 2.151 1.443 -0.992 1.00 0.00 C ATOM 1783 CZ PHE A 117 2.712 2.305 -1.928 1.00 0.00 C ATOM 0 H PHE A 117 -0.647 2.976 2.904 1.00 0.00 H new ATOM 0 HA PHE A 117 -0.127 5.104 0.965 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -1.494 2.433 0.350 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -1.632 3.841 -0.685 1.00 0.00 H new ATOM 0 HD1 PHE A 117 0.405 4.757 -1.824 1.00 0.00 H new ATOM 0 HD2 PHE A 117 0.536 1.080 0.362 1.00 0.00 H new ATOM 0 HE1 PHE A 117 2.486 4.163 -2.975 1.00 0.00 H new ATOM 0 HE2 PHE A 117 2.650 0.515 -0.755 1.00 0.00 H new ATOM 0 HZ PHE A 117 3.644 2.050 -2.412 1.00 0.00 H new ATOM 1793 N ALA A 118 -2.374 6.016 1.386 1.00 0.00 N ATOM 1794 CA ALA A 118 -3.653 6.679 1.705 1.00 0.00 C ATOM 1795 C ALA A 118 -4.554 6.727 0.473 1.00 0.00 C ATOM 1796 O ALA A 118 -4.091 6.933 -0.646 1.00 0.00 O ATOM 1797 CB ALA A 118 -3.419 8.107 2.203 1.00 0.00 C ATOM 0 H ALA A 118 -1.719 6.614 0.882 1.00 0.00 H new ATOM 0 HA ALA A 118 -4.137 6.099 2.491 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -4.377 8.574 2.431 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -2.804 8.082 3.102 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -2.909 8.683 1.430 1.00 0.00 H new ATOM 1803 N GLU A 119 -5.841 6.492 0.683 1.00 0.00 N ATOM 1804 CA GLU A 119 -6.824 6.589 -0.411 1.00 0.00 C ATOM 1805 C GLU A 119 -6.891 8.041 -0.919 1.00 0.00 C ATOM 1806 O GLU A 119 -6.915 8.976 -0.124 1.00 0.00 O ATOM 1807 CB GLU A 119 -8.193 6.055 0.048 1.00 0.00 C ATOM 1808 CG GLU A 119 -9.050 6.971 0.939 1.00 0.00 C ATOM 1809 CD GLU A 119 -9.715 8.098 0.131 1.00 0.00 C ATOM 1810 OE1 GLU A 119 -10.217 7.790 -0.976 1.00 0.00 O ATOM 1811 OE2 GLU A 119 -9.706 9.239 0.632 1.00 0.00 O ATOM 0 H GLU A 119 -6.236 6.235 1.587 1.00 0.00 H new ATOM 0 HA GLU A 119 -6.511 5.964 -1.248 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -8.774 5.811 -0.841 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -8.027 5.122 0.586 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -9.818 6.379 1.436 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -8.426 7.404 1.721 1.00 0.00 H new ATOM 1818 N LEU A 120 -6.896 8.193 -2.235 1.00 0.00 N ATOM 1819 CA LEU A 120 -7.102 9.516 -2.858 1.00 0.00 C ATOM 1820 C LEU A 120 -8.116 9.446 -4.019 1.00 0.00 C ATOM 1821 O LEU A 120 -8.002 10.090 -5.059 1.00 0.00 O ATOM 1822 CB LEU A 120 -5.734 10.074 -3.273 1.00 0.00 C ATOM 1823 CG LEU A 120 -5.828 11.557 -3.641 1.00 0.00 C ATOM 1824 CD1 LEU A 120 -5.248 12.459 -2.551 1.00 0.00 C ATOM 1825 CD2 LEU A 120 -5.180 11.787 -5.002 1.00 0.00 C ATOM 0 H LEU A 120 -6.762 7.430 -2.898 1.00 0.00 H new ATOM 0 HA LEU A 120 -7.548 10.205 -2.141 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -5.023 9.944 -2.457 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -5.351 9.509 -4.123 1.00 0.00 H new ATOM 0 HG LEU A 120 -6.880 11.834 -3.715 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -5.337 13.502 -2.856 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -5.796 12.305 -1.622 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -4.197 12.214 -2.397 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -5.247 12.843 -5.263 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -4.132 11.489 -4.961 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -5.697 11.193 -5.756 1.00 0.00 H new ATOM 1837 N ASP A 121 -9.103 8.569 -3.846 1.00 0.00 N ATOM 1838 CA ASP A 121 -10.192 8.408 -4.819 1.00 0.00 C ATOM 1839 C ASP A 121 -11.564 8.583 -4.165 1.00 0.00 C ATOM 1840 O ASP A 121 -11.922 7.752 -3.324 1.00 0.00 O ATOM 1841 CB ASP A 121 -10.143 7.043 -5.501 1.00 0.00 C ATOM 1842 CG ASP A 121 -9.017 6.924 -6.521 1.00 0.00 C ATOM 1843 OD1 ASP A 121 -8.814 7.880 -7.299 1.00 0.00 O ATOM 1844 OD2 ASP A 121 -8.528 5.782 -6.618 1.00 0.00 O ATOM 0 H ASP A 121 -9.174 7.953 -3.036 1.00 0.00 H new ATOM 0 HA ASP A 121 -10.048 9.188 -5.567 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -10.022 6.269 -4.743 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -11.096 6.857 -5.997 1.00 0.00 H new ATOM 1849 N PRO A 122 -12.363 9.537 -4.664 1.00 0.00 N ATOM 1850 CA PRO A 122 -13.744 9.758 -4.194 1.00 0.00 C ATOM 1851 C PRO A 122 -14.726 8.698 -4.739 1.00 0.00 C ATOM 1852 O PRO A 122 -15.716 8.996 -5.401 1.00 0.00 O ATOM 1853 CB PRO A 122 -14.049 11.194 -4.635 1.00 0.00 C ATOM 1854 CG PRO A 122 -13.256 11.351 -5.932 1.00 0.00 C ATOM 1855 CD PRO A 122 -11.977 10.554 -5.668 1.00 0.00 C ATOM 0 HA PRO A 122 -13.858 9.645 -3.116 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -15.116 11.345 -4.797 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -13.735 11.919 -3.884 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -13.805 10.958 -6.788 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -13.040 12.398 -6.146 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -11.607 10.087 -6.581 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -11.181 11.197 -5.293 1.00 0.00 H new ATOM 1863 N ASP A 123 -14.362 7.440 -4.491 1.00 0.00 N ATOM 1864 CA ASP A 123 -15.089 6.218 -4.906 1.00 0.00 C ATOM 1865 C ASP A 123 -14.432 4.926 -4.399 1.00 0.00 C ATOM 1866 O ASP A 123 -15.126 4.006 -3.986 1.00 0.00 O ATOM 1867 CB ASP A 123 -15.197 6.103 -6.433 1.00 0.00 C ATOM 1868 CG ASP A 123 -16.634 5.880 -6.918 1.00 0.00 C ATOM 1869 OD1 ASP A 123 -17.485 5.450 -6.107 1.00 0.00 O ATOM 1870 OD2 ASP A 123 -16.840 6.127 -8.125 1.00 0.00 O ATOM 0 H ASP A 123 -13.512 7.224 -3.970 1.00 0.00 H new ATOM 0 HA ASP A 123 -16.077 6.324 -4.458 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -14.803 7.011 -6.889 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -14.572 5.278 -6.775 1.00 0.00 H new ATOM 1875 N GLN A 124 -13.096 4.912 -4.380 1.00 0.00 N ATOM 1876 CA GLN A 124 -12.309 3.758 -3.910 1.00 0.00 C ATOM 1877 C GLN A 124 -11.572 4.104 -2.608 1.00 0.00 C ATOM 1878 O GLN A 124 -10.497 4.711 -2.645 1.00 0.00 O ATOM 1879 CB GLN A 124 -11.331 3.265 -4.983 1.00 0.00 C ATOM 1880 CG GLN A 124 -11.836 1.999 -5.683 1.00 0.00 C ATOM 1881 CD GLN A 124 -13.133 2.226 -6.460 1.00 0.00 C ATOM 1882 OE1 GLN A 124 -14.205 1.754 -6.110 1.00 0.00 O ATOM 1883 NE2 GLN A 124 -13.046 2.950 -7.552 1.00 0.00 N ATOM 0 H GLN A 124 -12.525 5.699 -4.689 1.00 0.00 H new ATOM 0 HA GLN A 124 -13.003 2.942 -3.707 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -11.178 4.051 -5.722 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -10.362 3.064 -4.526 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -11.068 1.637 -6.366 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -11.996 1.218 -4.940 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -12.147 3.339 -7.835 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -13.878 3.123 -8.117 1.00 0.00 H new ATOM 1892 N PRO A 125 -12.236 3.873 -1.468 1.00 0.00 N ATOM 1893 CA PRO A 125 -11.626 4.078 -0.146 1.00 0.00 C ATOM 1894 C PRO A 125 -10.533 3.041 0.122 1.00 0.00 C ATOM 1895 O PRO A 125 -10.469 1.983 -0.503 1.00 0.00 O ATOM 1896 CB PRO A 125 -12.787 4.001 0.850 1.00 0.00 C ATOM 1897 CG PRO A 125 -13.808 3.097 0.161 1.00 0.00 C ATOM 1898 CD PRO A 125 -13.639 3.429 -1.321 1.00 0.00 C ATOM 0 HA PRO A 125 -11.118 5.039 -0.064 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -12.466 3.585 1.805 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -13.202 4.988 1.056 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -13.611 2.044 0.361 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -14.822 3.302 0.505 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -13.843 2.558 -1.944 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -14.333 4.211 -1.630 1.00 0.00 H new ATOM 1906 N ALA A 126 -9.745 3.332 1.148 1.00 0.00 N ATOM 1907 CA ALA A 126 -8.607 2.485 1.546 1.00 0.00 C ATOM 1908 C ALA A 126 -9.064 1.090 2.003 1.00 0.00 C ATOM 1909 O ALA A 126 -8.596 0.095 1.462 1.00 0.00 O ATOM 1910 CB ALA A 126 -7.809 3.209 2.627 1.00 0.00 C ATOM 0 H ALA A 126 -9.868 4.158 1.733 1.00 0.00 H new ATOM 0 HA ALA A 126 -7.964 2.318 0.682 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -6.963 2.592 2.930 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -7.443 4.158 2.235 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -8.450 3.395 3.489 1.00 0.00 H new ATOM 1916 N ALA A 127 -10.136 1.060 2.803 1.00 0.00 N ATOM 1917 CA ALA A 127 -10.851 -0.180 3.166 1.00 0.00 C ATOM 1918 C ALA A 127 -11.276 -1.028 1.959 1.00 0.00 C ATOM 1919 O ALA A 127 -10.875 -2.177 1.896 1.00 0.00 O ATOM 1920 CB ALA A 127 -12.047 0.126 4.068 1.00 0.00 C ATOM 0 H ALA A 127 -10.538 1.898 3.222 1.00 0.00 H new ATOM 0 HA ALA A 127 -10.134 -0.788 3.717 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -12.558 -0.803 4.322 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -11.700 0.611 4.981 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -12.737 0.788 3.545 1.00 0.00 H new ATOM 1926 N ALA A 128 -11.753 -0.379 0.895 1.00 0.00 N ATOM 1927 CA ALA A 128 -12.089 -1.067 -0.373 1.00 0.00 C ATOM 1928 C ALA A 128 -10.852 -1.607 -1.112 1.00 0.00 C ATOM 1929 O ALA A 128 -10.835 -2.770 -1.513 1.00 0.00 O ATOM 1930 CB ALA A 128 -12.891 -0.152 -1.297 1.00 0.00 C ATOM 0 H ALA A 128 -11.919 0.627 0.877 1.00 0.00 H new ATOM 0 HA ALA A 128 -12.699 -1.927 -0.097 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -13.124 -0.682 -2.221 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -13.817 0.142 -0.803 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -12.304 0.737 -1.527 1.00 0.00 H new ATOM 1936 N ILE A 129 -9.755 -0.850 -1.050 1.00 0.00 N ATOM 1937 CA ILE A 129 -8.442 -1.264 -1.595 1.00 0.00 C ATOM 1938 C ILE A 129 -7.796 -2.394 -0.766 1.00 0.00 C ATOM 1939 O ILE A 129 -6.990 -3.161 -1.286 1.00 0.00 O ATOM 1940 CB ILE A 129 -7.540 -0.029 -1.839 1.00 0.00 C ATOM 1941 CG1 ILE A 129 -8.129 0.864 -2.946 1.00 0.00 C ATOM 1942 CG2 ILE A 129 -6.074 -0.368 -2.167 1.00 0.00 C ATOM 1943 CD1 ILE A 129 -8.303 0.167 -4.305 1.00 0.00 C ATOM 0 H ILE A 129 -9.743 0.075 -0.620 1.00 0.00 H new ATOM 0 HA ILE A 129 -8.592 -1.716 -2.575 1.00 0.00 H new ATOM 0 HB ILE A 129 -7.524 0.507 -0.890 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -9.099 1.236 -2.617 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -7.482 1.732 -3.077 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -5.514 0.554 -2.323 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -5.635 -0.924 -1.338 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -6.034 -0.974 -3.072 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -8.723 0.871 -5.024 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -7.334 -0.181 -4.662 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -8.976 -0.684 -4.194 1.00 0.00 H new ATOM 1955 N VAL A 130 -8.292 -2.586 0.450 1.00 0.00 N ATOM 1956 CA VAL A 130 -7.878 -3.679 1.346 1.00 0.00 C ATOM 1957 C VAL A 130 -8.853 -4.869 1.343 1.00 0.00 C ATOM 1958 O VAL A 130 -8.451 -6.012 1.544 1.00 0.00 O ATOM 1959 CB VAL A 130 -7.593 -3.055 2.716 1.00 0.00 C ATOM 1960 CG1 VAL A 130 -7.755 -4.003 3.907 1.00 0.00 C ATOM 1961 CG2 VAL A 130 -6.155 -2.540 2.674 1.00 0.00 C ATOM 0 H VAL A 130 -9.006 -1.981 0.856 1.00 0.00 H new ATOM 0 HA VAL A 130 -6.963 -4.151 0.990 1.00 0.00 H new ATOM 0 HB VAL A 130 -8.332 -2.270 2.879 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -7.532 -3.469 4.830 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -8.780 -4.373 3.941 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -7.069 -4.843 3.799 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -5.904 -2.084 3.632 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -5.477 -3.370 2.478 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -6.058 -1.797 1.882 1.00 0.00 H new ATOM 1971 N ASN A 131 -10.109 -4.579 1.046 1.00 0.00 N ATOM 1972 CA ASN A 131 -11.183 -5.575 0.937 1.00 0.00 C ATOM 1973 C ASN A 131 -11.053 -6.365 -0.371 1.00 0.00 C ATOM 1974 O ASN A 131 -11.445 -7.522 -0.439 1.00 0.00 O ATOM 1975 CB ASN A 131 -12.526 -4.851 1.024 1.00 0.00 C ATOM 1976 CG ASN A 131 -13.528 -5.721 1.774 1.00 0.00 C ATOM 1977 OD1 ASN A 131 -13.518 -5.821 2.996 1.00 0.00 O ATOM 1978 ND2 ASN A 131 -14.375 -6.412 1.052 1.00 0.00 N ATOM 0 H ASN A 131 -10.426 -3.626 0.869 1.00 0.00 H new ATOM 0 HA ASN A 131 -11.112 -6.295 1.753 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -12.403 -3.896 1.536 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -12.898 -4.631 0.023 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -15.036 -7.042 1.506 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -14.373 -6.320 0.036 1.00 0.00 H new ATOM 1985 N PHE A 132 -10.464 -5.719 -1.374 1.00 0.00 N ATOM 1986 CA PHE A 132 -10.147 -6.324 -2.673 1.00 0.00 C ATOM 1987 C PHE A 132 -8.782 -7.031 -2.686 1.00 0.00 C ATOM 1988 O PHE A 132 -8.704 -8.202 -3.048 1.00 0.00 O ATOM 1989 CB PHE A 132 -10.232 -5.216 -3.727 1.00 0.00 C ATOM 1990 CG PHE A 132 -9.594 -5.561 -5.069 1.00 0.00 C ATOM 1991 CD1 PHE A 132 -9.691 -6.831 -5.643 1.00 0.00 C ATOM 1992 CD2 PHE A 132 -8.782 -4.601 -5.658 1.00 0.00 C ATOM 1993 CE1 PHE A 132 -8.986 -7.117 -6.798 1.00 0.00 C ATOM 1994 CE2 PHE A 132 -8.082 -4.897 -6.802 1.00 0.00 C ATOM 1995 CZ PHE A 132 -8.170 -6.170 -7.381 1.00 0.00 C ATOM 0 H PHE A 132 -10.186 -4.740 -1.309 1.00 0.00 H new ATOM 0 HA PHE A 132 -10.866 -7.113 -2.893 1.00 0.00 H new ATOM 0 HB2 PHE A 132 -11.281 -4.970 -3.892 1.00 0.00 H new ATOM 0 HB3 PHE A 132 -9.753 -4.320 -3.332 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -10.314 -7.586 -5.187 1.00 0.00 H new ATOM 0 HD2 PHE A 132 -8.701 -3.619 -5.216 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -9.076 -8.094 -7.249 1.00 0.00 H new ATOM 0 HE2 PHE A 132 -7.459 -4.143 -7.259 1.00 0.00 H new ATOM 0 HZ PHE A 132 -7.607 -6.406 -8.272 1.00 0.00 H new ATOM 2005 N VAL A 133 -7.742 -6.353 -2.198 1.00 0.00 N ATOM 2006 CA VAL A 133 -6.376 -6.919 -2.172 1.00 0.00 C ATOM 2007 C VAL A 133 -6.316 -8.227 -1.349 1.00 0.00 C ATOM 2008 O VAL A 133 -5.639 -9.181 -1.725 1.00 0.00 O ATOM 2009 CB VAL A 133 -5.380 -5.839 -1.706 1.00 0.00 C ATOM 2010 CG1 VAL A 133 -5.414 -5.570 -0.199 1.00 0.00 C ATOM 2011 CG2 VAL A 133 -3.963 -6.142 -2.192 1.00 0.00 C ATOM 0 H VAL A 133 -7.811 -5.411 -1.814 1.00 0.00 H new ATOM 0 HA VAL A 133 -6.082 -7.212 -3.180 1.00 0.00 H new ATOM 0 HB VAL A 133 -5.712 -4.911 -2.173 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -4.685 -4.798 0.049 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -6.410 -5.234 0.088 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -5.171 -6.486 0.340 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -3.285 -5.361 -1.846 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -3.640 -7.105 -1.795 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -3.952 -6.176 -3.281 1.00 0.00 H new ATOM 2021 N SER A 134 -7.160 -8.271 -0.317 1.00 0.00 N ATOM 2022 CA SER A 134 -7.344 -9.448 0.553 1.00 0.00 C ATOM 2023 C SER A 134 -8.288 -10.494 -0.065 1.00 0.00 C ATOM 2024 O SER A 134 -8.022 -11.688 0.025 1.00 0.00 O ATOM 2025 CB SER A 134 -7.864 -8.997 1.916 1.00 0.00 C ATOM 2026 OG SER A 134 -7.538 -9.973 2.902 1.00 0.00 O ATOM 0 H SER A 134 -7.747 -7.480 -0.053 1.00 0.00 H new ATOM 0 HA SER A 134 -6.374 -9.931 0.669 1.00 0.00 H new ATOM 0 HB2 SER A 134 -7.425 -8.036 2.183 1.00 0.00 H new ATOM 0 HB3 SER A 134 -8.944 -8.854 1.875 1.00 0.00 H new ATOM 0 HG SER A 134 -7.872 -9.680 3.775 1.00 0.00 H new ATOM 2032 N ARG A 135 -9.242 -10.036 -0.879 1.00 0.00 N ATOM 2033 CA ARG A 135 -10.141 -10.920 -1.648 1.00 0.00 C ATOM 2034 C ARG A 135 -9.415 -11.741 -2.725 1.00 0.00 C ATOM 2035 O ARG A 135 -9.839 -12.841 -3.053 1.00 0.00 O ATOM 2036 CB ARG A 135 -11.282 -10.125 -2.285 1.00 0.00 C ATOM 2037 CG ARG A 135 -12.520 -10.199 -1.394 1.00 0.00 C ATOM 2038 CD ARG A 135 -13.662 -10.858 -2.160 1.00 0.00 C ATOM 2039 NE ARG A 135 -14.698 -11.297 -1.213 1.00 0.00 N ATOM 2040 CZ ARG A 135 -15.720 -12.107 -1.505 1.00 0.00 C ATOM 2041 NH1 ARG A 135 -15.883 -12.601 -2.725 1.00 0.00 N ATOM 2042 NH2 ARG A 135 -16.575 -12.469 -0.563 1.00 0.00 N ATOM 0 H ARG A 135 -9.418 -9.043 -1.028 1.00 0.00 H new ATOM 0 HA ARG A 135 -10.547 -11.628 -0.925 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -10.982 -9.086 -2.422 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -11.509 -10.524 -3.274 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -12.298 -10.768 -0.492 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -12.812 -9.198 -1.076 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -14.085 -10.156 -2.879 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -13.289 -11.710 -2.728 1.00 0.00 H new ATOM 0 HE ARG A 135 -14.631 -10.955 -0.254 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -15.221 -12.365 -3.464 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -16.671 -13.217 -2.925 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -16.456 -12.130 0.392 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -17.353 -13.087 -0.791 1.00 0.00 H new ATOM 2056 N VAL A 136 -8.305 -11.196 -3.222 1.00 0.00 N ATOM 2057 CA VAL A 136 -7.425 -11.856 -4.217 1.00 0.00 C ATOM 2058 C VAL A 136 -6.434 -12.816 -3.528 1.00 0.00 C ATOM 2059 O VAL A 136 -5.954 -13.765 -4.145 1.00 0.00 O ATOM 2060 CB VAL A 136 -6.694 -10.812 -5.086 1.00 0.00 C ATOM 2061 CG1 VAL A 136 -5.849 -11.432 -6.206 1.00 0.00 C ATOM 2062 CG2 VAL A 136 -7.708 -9.900 -5.764 1.00 0.00 C ATOM 0 H VAL A 136 -7.977 -10.270 -2.948 1.00 0.00 H new ATOM 0 HA VAL A 136 -8.051 -12.453 -4.880 1.00 0.00 H new ATOM 0 HB VAL A 136 -6.037 -10.274 -4.403 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -5.364 -10.640 -6.777 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -5.091 -12.083 -5.772 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -6.491 -12.014 -6.867 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -7.185 -9.165 -6.376 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -8.367 -10.495 -6.396 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -8.299 -9.386 -5.006 1.00 0.00 H new ATOM 2072 N MET A 137 -6.130 -12.536 -2.258 1.00 0.00 N ATOM 2073 CA MET A 137 -5.307 -13.420 -1.405 1.00 0.00 C ATOM 2074 C MET A 137 -5.872 -14.839 -1.243 1.00 0.00 C ATOM 2075 O MET A 137 -5.156 -15.758 -0.846 1.00 0.00 O ATOM 2076 CB MET A 137 -5.075 -12.824 -0.014 1.00 0.00 C ATOM 2077 CG MET A 137 -3.712 -12.137 0.079 1.00 0.00 C ATOM 2078 SD MET A 137 -3.129 -11.907 1.799 1.00 0.00 S ATOM 2079 CE MET A 137 -2.484 -13.529 2.148 1.00 0.00 C ATOM 0 H MET A 137 -6.445 -11.689 -1.784 1.00 0.00 H new ATOM 0 HA MET A 137 -4.361 -13.497 -1.940 1.00 0.00 H new ATOM 0 HB2 MET A 137 -5.863 -12.105 0.211 1.00 0.00 H new ATOM 0 HB3 MET A 137 -5.139 -13.612 0.736 1.00 0.00 H new ATOM 0 HG2 MET A 137 -2.978 -12.727 -0.470 1.00 0.00 H new ATOM 0 HG3 MET A 137 -3.769 -11.165 -0.410 1.00 0.00 H new ATOM 0 HE1 MET A 137 -2.089 -13.553 3.164 1.00 0.00 H new ATOM 0 HE2 MET A 137 -3.281 -14.266 2.051 1.00 0.00 H new ATOM 0 HE3 MET A 137 -1.686 -13.763 1.443 1.00 0.00 H new ATOM 2089 N LEU A 138 -7.178 -14.960 -1.448 1.00 0.00 N ATOM 2090 CA LEU A 138 -7.902 -16.239 -1.383 1.00 0.00 C ATOM 2091 C LEU A 138 -8.917 -16.349 -2.531 1.00 0.00 C ATOM 2092 O LEU A 138 -9.051 -15.430 -3.335 1.00 0.00 O ATOM 2093 CB LEU A 138 -8.551 -16.409 0.001 1.00 0.00 C ATOM 2094 CG LEU A 138 -9.403 -15.217 0.450 1.00 0.00 C ATOM 2095 CD1 LEU A 138 -10.799 -15.698 0.848 1.00 0.00 C ATOM 2096 CD2 LEU A 138 -8.733 -14.502 1.628 1.00 0.00 C ATOM 0 H LEU A 138 -7.779 -14.166 -1.668 1.00 0.00 H new ATOM 0 HA LEU A 138 -7.197 -17.060 -1.512 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -9.175 -17.302 -0.011 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -7.767 -16.578 0.739 1.00 0.00 H new ATOM 0 HG LEU A 138 -9.493 -14.513 -0.378 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -11.400 -14.846 1.166 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -11.275 -16.179 -0.006 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -10.718 -16.412 1.668 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -9.348 -13.657 1.938 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -8.624 -15.197 2.461 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -7.750 -14.143 1.324 1.00 0.00 H new ATOM 2108 N GLY A 139 -9.430 -17.575 -2.711 1.00 0.00 N ATOM 2109 CA GLY A 139 -10.531 -17.849 -3.662 1.00 0.00 C ATOM 2110 C GLY A 139 -11.783 -17.023 -3.320 1.00 0.00 C ATOM 2111 O GLY A 139 -11.700 -16.001 -2.646 1.00 0.00 O ATOM 0 H GLY A 139 -9.101 -18.400 -2.210 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -10.205 -17.617 -4.676 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -10.776 -18.911 -3.642 1.00 0.00 H new ATOM 2115 N SER A 140 -12.945 -17.606 -3.612 1.00 0.00 N ATOM 2116 CA SER A 140 -14.262 -16.948 -3.431 1.00 0.00 C ATOM 2117 C SER A 140 -14.369 -15.649 -4.240 1.00 0.00 C ATOM 2118 O SER A 140 -13.577 -14.720 -4.108 1.00 0.00 O ATOM 2119 CB SER A 140 -14.586 -16.623 -1.965 1.00 0.00 C ATOM 2120 OG SER A 140 -14.678 -17.820 -1.189 1.00 0.00 O ATOM 0 H SER A 140 -13.012 -18.554 -3.984 1.00 0.00 H new ATOM 0 HA SER A 140 -14.984 -17.679 -3.794 1.00 0.00 H new ATOM 0 HB2 SER A 140 -13.813 -15.975 -1.552 1.00 0.00 H new ATOM 0 HB3 SER A 140 -15.526 -16.074 -1.908 1.00 0.00 H new ATOM 0 HG SER A 140 -14.883 -17.592 -0.258 1.00 0.00 H new ATOM 2126 N GLY A 141 -15.318 -15.667 -5.174 1.00 0.00 N ATOM 2127 CA GLY A 141 -15.569 -14.487 -6.020 1.00 0.00 C ATOM 2128 C GLY A 141 -16.687 -14.786 -7.004 1.00 0.00 C ATOM 2129 O GLY A 141 -17.827 -14.984 -6.587 1.00 0.00 O ATOM 0 H GLY A 141 -15.920 -16.467 -5.367 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -15.838 -13.633 -5.398 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -14.661 -14.215 -6.559 1.00 0.00 H new ATOM 2133 N GLN A 142 -16.269 -15.020 -8.248 1.00 0.00 N ATOM 2134 CA GLN A 142 -17.136 -15.297 -9.416 1.00 0.00 C ATOM 2135 C GLN A 142 -18.016 -14.092 -9.794 1.00 0.00 C ATOM 2136 O GLN A 142 -17.942 -13.575 -10.907 1.00 0.00 O ATOM 2137 CB GLN A 142 -18.005 -16.540 -9.155 1.00 0.00 C ATOM 2138 CG GLN A 142 -18.697 -17.070 -10.411 1.00 0.00 C ATOM 2139 CD GLN A 142 -17.726 -17.808 -11.334 1.00 0.00 C ATOM 2140 OE1 GLN A 142 -16.549 -17.502 -11.491 1.00 0.00 O ATOM 2141 NE2 GLN A 142 -18.226 -18.844 -11.958 1.00 0.00 N ATOM 0 H GLN A 142 -15.278 -15.024 -8.490 1.00 0.00 H new ATOM 0 HA GLN A 142 -16.480 -15.490 -10.265 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -17.382 -17.328 -8.732 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -18.760 -16.296 -8.408 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -19.505 -17.743 -10.123 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -19.151 -16.240 -10.952 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -19.205 -19.096 -11.825 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -17.636 -19.400 -12.577 1.00 0.00 H new ATOM 2150 N LYS A 143 -18.737 -13.583 -8.804 1.00 0.00 N ATOM 2151 CA LYS A 143 -19.680 -12.477 -8.981 1.00 0.00 C ATOM 2152 C LYS A 143 -19.221 -11.289 -8.122 1.00 0.00 C ATOM 2153 O LYS A 143 -19.347 -11.309 -6.904 1.00 0.00 O ATOM 2154 CB LYS A 143 -21.057 -13.005 -8.581 1.00 0.00 C ATOM 2155 CG LYS A 143 -22.137 -12.178 -9.266 1.00 0.00 C ATOM 2156 CD LYS A 143 -23.516 -12.792 -9.055 1.00 0.00 C ATOM 2157 CE LYS A 143 -24.552 -11.735 -9.425 1.00 0.00 C ATOM 2158 NZ LYS A 143 -25.732 -12.347 -10.043 1.00 0.00 N ATOM 0 H LYS A 143 -18.686 -13.927 -7.845 1.00 0.00 H new ATOM 0 HA LYS A 143 -19.726 -12.119 -10.010 1.00 0.00 H new ATOM 0 HB2 LYS A 143 -21.153 -14.053 -8.864 1.00 0.00 H new ATOM 0 HB3 LYS A 143 -21.177 -12.955 -7.499 1.00 0.00 H new ATOM 0 HG2 LYS A 143 -22.124 -11.161 -8.873 1.00 0.00 H new ATOM 0 HG3 LYS A 143 -21.925 -12.110 -10.333 1.00 0.00 H new ATOM 0 HD2 LYS A 143 -23.638 -13.681 -9.674 1.00 0.00 H new ATOM 0 HD3 LYS A 143 -23.641 -13.105 -8.018 1.00 0.00 H new ATOM 0 HE2 LYS A 143 -24.849 -11.184 -8.532 1.00 0.00 H new ATOM 0 HE3 LYS A 143 -24.111 -11.013 -10.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 -26.421 -11.606 -10.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 -25.449 -12.852 -10.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 -26.165 -13.018 -9.376 1.00 0.00 H new ATOM 2172 N ARG A 144 -18.443 -10.426 -8.775 1.00 0.00 N ATOM 2173 CA ARG A 144 -17.831 -9.216 -8.166 1.00 0.00 C ATOM 2174 C ARG A 144 -16.995 -9.451 -6.890 1.00 0.00 C ATOM 2175 O ARG A 144 -15.754 -9.474 -7.049 1.00 0.00 O ATOM 2176 CB ARG A 144 -18.850 -8.081 -7.970 1.00 0.00 C ATOM 2177 CG ARG A 144 -19.280 -7.497 -9.318 1.00 0.00 C ATOM 2178 CD ARG A 144 -19.367 -5.968 -9.286 1.00 0.00 C ATOM 2179 NE ARG A 144 -20.643 -5.474 -8.737 1.00 0.00 N ATOM 2180 CZ ARG A 144 -20.998 -4.185 -8.645 1.00 0.00 C ATOM 2181 NH1 ARG A 144 -20.166 -3.206 -8.975 1.00 0.00 N ATOM 2182 NH2 ARG A 144 -22.196 -3.851 -8.192 1.00 0.00 N ATOM 2183 OXT ARG A 144 -17.581 -9.551 -5.790 1.00 99.99 O ATOM 0 H ARG A 144 -18.208 -10.539 -9.761 1.00 0.00 H new ATOM 0 HA ARG A 144 -17.101 -8.903 -8.912 1.00 0.00 H new ATOM 0 HB2 ARG A 144 -19.723 -8.458 -7.437 1.00 0.00 H new ATOM 0 HB3 ARG A 144 -18.413 -7.297 -7.352 1.00 0.00 H new ATOM 0 HG2 ARG A 144 -18.571 -7.803 -10.087 1.00 0.00 H new ATOM 0 HG3 ARG A 144 -20.250 -7.908 -9.597 1.00 0.00 H new ATOM 0 HD2 ARG A 144 -18.545 -5.575 -8.688 1.00 0.00 H new ATOM 0 HD3 ARG A 144 -19.239 -5.581 -10.297 1.00 0.00 H new ATOM 0 HE ARG A 144 -21.309 -6.169 -8.400 1.00 0.00 H new ATOM 0 HH11 ARG A 144 -19.228 -3.425 -9.309 1.00 0.00 H new ATOM 0 HH12 ARG A 144 -20.465 -2.234 -8.894 1.00 0.00 H new ATOM 0 HH21 ARG A 144 -22.855 -4.577 -7.910 1.00 0.00 H new ATOM 0 HH22 ARG A 144 -22.460 -2.868 -8.124 1.00 0.00 H new TER 2197 ARG A 144