USER MOD reduce.3.24.130724 H: found=0, std=0, add=1056, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1051 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 63 TYR OH : rot -90:sc= 0.0694 USER MOD Set 1.2: A 127 GLN : amide:sc= -3.51! C(o=-3.4!,f=-7.2!) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0.0319 USER MOD Single : A 4 TYR OH : rot -100:sc= -12.5! USER MOD Single : A 5 HIS : no HD1:sc= -1.78! C(o=-1.8!,f=-4.2!) USER MOD Single : A 10 SER OG : rot 150:sc= 0 USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=-0.0051) USER MOD Single : A 14 GLN : amide:sc= -0.113 K(o=-0.11,f=-3.3!) USER MOD Single : A 15 MET CE :methyl -137:sc= -12.1! (180deg=-14.6!) USER MOD Single : A 17 SER OG : rot 46:sc= 1.18 USER MOD Single : A 22 LYS NZ :NH3+ -166:sc= 0.025 (180deg=0.00542) USER MOD Single : A 24 GLN : amide:sc= -0.139 K(o=-0.14,f=-2.4!) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= -1.86! USER MOD Single : A 35 TYR OH : rot 180:sc= 0.175 USER MOD Single : A 38 HIS : no HE2:sc= -4.6! C(o=-4.6!,f=-11!) USER MOD Single : A 43 THR OG1 : rot 180:sc= -0.837! USER MOD Single : A 46 LYS NZ :NH3+ 144:sc= -0.581 (180deg=-2.3!) USER MOD Single : A 49 MET CE :methyl 140:sc= -4.22! (180deg=-8.91!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 GLN : amide:sc= -6.79! C(o=-6.8!,f=-14!) USER MOD Single : A 56 HIS : no HD1:sc= -0.276 X(o=-0.28,f=-0.091) USER MOD Single : A 58 HIS : no HD1:sc= -3.18! C(o=-3.2!,f=-5.4!) USER MOD Single : A 65 SER OG : rot 156:sc= -1.31 USER MOD Single : A 72 GLN : amide:sc= -1.89 K(o=-1.9,f=-5.1!) USER MOD Single : A 75 ASN : amide:sc= -1.01 K(o=-1,f=-2.1!) USER MOD Single : A 77 THR OG1 : rot 180:sc= -0.107 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 MET CE :methyl -123:sc= -0.0688 (180deg=-0.5) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 HIS : no HD1:sc= -0.439 X(o=-0.44,f=-0.24) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 7:sc= 0.607 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 HIS : no HD1:sc= -0.704 X(o=-0.7,f=-0.43) USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 GLN : amide:sc= -0.0577 X(o=-0.058,f=-0.31) USER MOD Single : A 118 SER OG : rot 65:sc= 0.298 USER MOD Single : A 123 LYS NZ :NH3+ 151:sc= -2.76! (180deg=-2.96!) USER MOD Single : A 134 THR OG1 : rot 34:sc= 0.572 USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 143:sc= -0.0361 (180deg=-0.144) USER MOD Single : A 138 MET CE :methyl 159:sc= -0.24 (180deg=-0.991) USER MOD ----------------------------------------------------------------- ATOM 13 N MET A 2 -21.082 1.187 10.258 1.00 0.00 N ATOM 14 CA MET A 2 -21.104 1.523 8.807 1.00 0.00 C ATOM 15 C MET A 2 -20.121 0.620 8.062 1.00 0.00 C ATOM 16 O MET A 2 -18.942 0.601 8.350 1.00 0.00 O ATOM 17 CB MET A 2 -20.696 2.986 8.615 1.00 0.00 C ATOM 18 CG MET A 2 -21.326 3.525 7.330 1.00 0.00 C ATOM 19 SD MET A 2 -20.889 5.270 7.131 1.00 0.00 S ATOM 20 CE MET A 2 -22.354 5.965 7.932 1.00 0.00 C ATOM 0 HA MET A 2 -22.109 1.371 8.414 1.00 0.00 H new ATOM 0 HB2 MET A 2 -21.020 3.580 9.469 1.00 0.00 H new ATOM 0 HB3 MET A 2 -19.610 3.068 8.563 1.00 0.00 H new ATOM 0 HG2 MET A 2 -20.976 2.951 6.472 1.00 0.00 H new ATOM 0 HG3 MET A 2 -22.409 3.412 7.368 1.00 0.00 H new ATOM 0 HE1 MET A 2 -22.293 7.053 7.921 1.00 0.00 H new ATOM 0 HE2 MET A 2 -23.248 5.647 7.395 1.00 0.00 H new ATOM 0 HE3 MET A 2 -22.406 5.615 8.963 1.00 0.00 H new ATOM 30 N THR A 3 -20.594 -0.131 7.103 1.00 0.00 N ATOM 31 CA THR A 3 -19.678 -1.028 6.348 1.00 0.00 C ATOM 32 C THR A 3 -18.979 -0.236 5.254 1.00 0.00 C ATOM 33 O THR A 3 -18.728 0.944 5.400 1.00 0.00 O ATOM 34 CB THR A 3 -20.468 -2.184 5.730 1.00 0.00 C ATOM 35 OG1 THR A 3 -21.688 -2.351 6.437 1.00 0.00 O ATOM 36 CG2 THR A 3 -19.646 -3.471 5.813 1.00 0.00 C ATOM 0 H THR A 3 -21.571 -0.161 6.812 1.00 0.00 H new ATOM 0 HA THR A 3 -18.933 -1.436 7.031 1.00 0.00 H new ATOM 0 HB THR A 3 -20.681 -1.961 4.684 1.00 0.00 H new ATOM 0 HG1 THR A 3 -22.197 -3.090 6.042 1.00 0.00 H new ATOM 0 HG21 THR A 3 -20.211 -4.293 5.372 1.00 0.00 H new ATOM 0 HG22 THR A 3 -18.710 -3.341 5.269 1.00 0.00 H new ATOM 0 HG23 THR A 3 -19.430 -3.698 6.857 1.00 0.00 H new ATOM 44 N TYR A 4 -18.587 -0.879 4.192 1.00 0.00 N ATOM 45 CA TYR A 4 -17.828 -0.140 3.163 1.00 0.00 C ATOM 46 C TYR A 4 -18.206 -0.428 1.731 1.00 0.00 C ATOM 47 O TYR A 4 -18.984 -1.294 1.387 1.00 0.00 O ATOM 48 CB TYR A 4 -16.422 -0.643 3.210 1.00 0.00 C ATOM 49 CG TYR A 4 -15.507 0.309 3.839 1.00 0.00 C ATOM 50 CD1 TYR A 4 -15.544 0.502 5.206 1.00 0.00 C ATOM 51 CD2 TYR A 4 -14.565 0.929 3.043 1.00 0.00 C ATOM 52 CE1 TYR A 4 -14.632 1.346 5.796 1.00 0.00 C ATOM 53 CE2 TYR A 4 -13.635 1.771 3.605 1.00 0.00 C ATOM 54 CZ TYR A 4 -13.659 1.992 5.003 1.00 0.00 C ATOM 55 OH TYR A 4 -12.745 2.831 5.594 1.00 0.00 O ATOM 0 H TYR A 4 -18.758 -1.866 3.998 1.00 0.00 H new ATOM 0 HA TYR A 4 -18.009 0.911 3.389 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -16.395 -1.585 3.758 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -16.081 -0.854 2.196 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -16.283 -0.006 5.807 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -14.559 0.752 1.978 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -14.660 1.514 6.862 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -12.895 2.258 2.987 1.00 0.00 H new ATOM 0 HH TYR A 4 -13.026 3.761 5.469 1.00 0.00 H new ATOM 65 N HIS A 5 -17.442 0.255 0.928 1.00 0.00 N ATOM 66 CA HIS A 5 -17.414 0.130 -0.531 1.00 0.00 C ATOM 67 C HIS A 5 -15.978 0.523 -0.882 1.00 0.00 C ATOM 68 O HIS A 5 -15.688 1.684 -1.094 1.00 0.00 O ATOM 69 CB HIS A 5 -18.384 1.108 -1.190 1.00 0.00 C ATOM 70 CG HIS A 5 -18.308 0.953 -2.685 1.00 0.00 C ATOM 71 ND1 HIS A 5 -17.109 0.992 -3.388 1.00 0.00 N ATOM 72 CD2 HIS A 5 -19.279 0.730 -3.623 1.00 0.00 C ATOM 73 CE1 HIS A 5 -17.388 0.790 -4.683 1.00 0.00 C ATOM 74 NE2 HIS A 5 -18.699 0.626 -4.887 1.00 0.00 N ATOM 0 H HIS A 5 -16.783 0.953 1.274 1.00 0.00 H new ATOM 0 HA HIS A 5 -17.702 -0.865 -0.870 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -19.400 0.918 -0.844 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -18.136 2.131 -0.906 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -20.336 0.647 -3.416 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -16.645 0.763 -5.466 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -19.173 0.461 -5.775 1.00 0.00 H new ATOM 82 N LEU A 6 -15.057 -0.406 -0.889 1.00 0.00 N ATOM 83 CA LEU A 6 -13.659 -0.042 -1.165 1.00 0.00 C ATOM 84 C LEU A 6 -13.407 -0.216 -2.659 1.00 0.00 C ATOM 85 O LEU A 6 -13.782 -1.215 -3.234 1.00 0.00 O ATOM 86 CB LEU A 6 -12.734 -1.002 -0.427 1.00 0.00 C ATOM 87 CG LEU A 6 -11.584 -0.219 0.179 1.00 0.00 C ATOM 88 CD1 LEU A 6 -11.047 0.757 -0.861 1.00 0.00 C ATOM 89 CD2 LEU A 6 -12.092 0.546 1.395 1.00 0.00 C ATOM 0 H LEU A 6 -15.224 -1.397 -0.714 1.00 0.00 H new ATOM 0 HA LEU A 6 -13.475 0.984 -0.847 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -13.284 -1.527 0.354 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -12.353 -1.759 -1.113 1.00 0.00 H new ATOM 0 HG LEU A 6 -10.786 -0.896 0.485 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -10.220 1.325 -0.434 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -10.696 0.204 -1.732 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -11.840 1.442 -1.161 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -11.272 1.112 1.837 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -12.883 1.231 1.090 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -12.485 -0.157 2.129 1.00 0.00 H new ATOM 101 N ASP A 7 -12.789 0.727 -3.305 1.00 0.00 N ATOM 102 CA ASP A 7 -12.545 0.560 -4.764 1.00 0.00 C ATOM 103 C ASP A 7 -11.217 1.213 -5.149 1.00 0.00 C ATOM 104 O ASP A 7 -11.180 2.329 -5.625 1.00 0.00 O ATOM 105 CB ASP A 7 -13.683 1.220 -5.544 1.00 0.00 C ATOM 106 CG ASP A 7 -14.286 0.210 -6.523 1.00 0.00 C ATOM 107 OD1 ASP A 7 -14.082 -0.975 -6.319 1.00 0.00 O ATOM 108 OD2 ASP A 7 -14.941 0.639 -7.457 1.00 0.00 O ATOM 0 H ASP A 7 -12.445 1.596 -2.895 1.00 0.00 H new ATOM 0 HA ASP A 7 -12.502 -0.503 -5.003 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -14.449 1.578 -4.856 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -13.310 2.089 -6.086 1.00 0.00 H new ATOM 113 N VAL A 8 -10.128 0.525 -4.954 1.00 0.00 N ATOM 114 CA VAL A 8 -8.807 1.107 -5.317 1.00 0.00 C ATOM 115 C VAL A 8 -8.237 0.356 -6.522 1.00 0.00 C ATOM 116 O VAL A 8 -7.728 -0.740 -6.397 1.00 0.00 O ATOM 117 CB VAL A 8 -7.847 0.978 -4.134 1.00 0.00 C ATOM 118 CG1 VAL A 8 -7.893 -0.452 -3.589 1.00 0.00 C ATOM 119 CG2 VAL A 8 -6.426 1.300 -4.599 1.00 0.00 C ATOM 0 H VAL A 8 -10.095 -0.415 -4.559 1.00 0.00 H new ATOM 0 HA VAL A 8 -8.930 2.161 -5.568 1.00 0.00 H new ATOM 0 HB VAL A 8 -8.142 1.674 -3.348 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -7.208 -0.542 -2.746 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -8.906 -0.684 -3.260 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -7.598 -1.150 -4.373 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -5.739 1.209 -3.758 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -6.133 0.603 -5.384 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -6.392 2.318 -4.987 1.00 0.00 H new ATOM 129 N VAL A 9 -8.318 0.934 -7.689 1.00 0.00 N ATOM 130 CA VAL A 9 -7.781 0.248 -8.897 1.00 0.00 C ATOM 131 C VAL A 9 -6.471 0.917 -9.323 1.00 0.00 C ATOM 132 O VAL A 9 -6.231 2.072 -9.036 1.00 0.00 O ATOM 133 CB VAL A 9 -8.798 0.347 -10.035 1.00 0.00 C ATOM 134 CG1 VAL A 9 -10.140 -0.225 -9.575 1.00 0.00 C ATOM 135 CG2 VAL A 9 -8.978 1.814 -10.432 1.00 0.00 C ATOM 0 H VAL A 9 -8.732 1.851 -7.858 1.00 0.00 H new ATOM 0 HA VAL A 9 -7.596 -0.801 -8.667 1.00 0.00 H new ATOM 0 HB VAL A 9 -8.438 -0.221 -10.893 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -10.864 -0.154 -10.387 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -10.013 -1.270 -9.293 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -10.502 0.341 -8.716 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -9.703 1.885 -11.243 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -9.337 2.382 -9.574 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -8.023 2.221 -10.762 1.00 0.00 H new ATOM 145 N SER A 10 -5.623 0.198 -10.009 1.00 0.00 N ATOM 146 CA SER A 10 -4.331 0.794 -10.454 1.00 0.00 C ATOM 147 C SER A 10 -4.397 1.088 -11.953 1.00 0.00 C ATOM 148 O SER A 10 -5.461 1.252 -12.517 1.00 0.00 O ATOM 149 CB SER A 10 -3.192 -0.190 -10.178 1.00 0.00 C ATOM 150 OG SER A 10 -3.361 -1.343 -10.992 1.00 0.00 O ATOM 0 H SER A 10 -5.769 -0.774 -10.280 1.00 0.00 H new ATOM 0 HA SER A 10 -4.151 1.720 -9.908 1.00 0.00 H new ATOM 0 HB2 SER A 10 -2.231 0.280 -10.388 1.00 0.00 H new ATOM 0 HB3 SER A 10 -3.186 -0.472 -9.125 1.00 0.00 H new ATOM 0 HG SER A 10 -2.484 -1.728 -11.201 1.00 0.00 H new ATOM 156 N ALA A 11 -3.268 1.159 -12.604 1.00 0.00 N ATOM 157 CA ALA A 11 -3.265 1.444 -14.066 1.00 0.00 C ATOM 158 C ALA A 11 -4.301 0.558 -14.761 1.00 0.00 C ATOM 159 O ALA A 11 -5.088 1.020 -15.564 1.00 0.00 O ATOM 160 CB ALA A 11 -1.878 1.152 -14.641 1.00 0.00 C ATOM 0 H ALA A 11 -2.347 1.032 -12.185 1.00 0.00 H new ATOM 0 HA ALA A 11 -3.513 2.492 -14.231 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -1.876 1.361 -15.711 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -1.139 1.783 -14.147 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -1.629 0.104 -14.475 1.00 0.00 H new ATOM 166 N GLU A 12 -4.308 -0.713 -14.460 1.00 0.00 N ATOM 167 CA GLU A 12 -5.292 -1.627 -15.105 1.00 0.00 C ATOM 168 C GLU A 12 -5.435 -2.896 -14.263 1.00 0.00 C ATOM 169 O GLU A 12 -5.158 -3.989 -14.719 1.00 0.00 O ATOM 170 CB GLU A 12 -4.804 -1.994 -16.508 1.00 0.00 C ATOM 171 CG GLU A 12 -3.353 -2.470 -16.435 1.00 0.00 C ATOM 172 CD GLU A 12 -2.588 -1.964 -17.659 1.00 0.00 C ATOM 173 OE1 GLU A 12 -2.806 -2.502 -18.733 1.00 0.00 O ATOM 174 OE2 GLU A 12 -1.799 -1.047 -17.504 1.00 0.00 O ATOM 0 H GLU A 12 -3.674 -1.157 -13.795 1.00 0.00 H new ATOM 0 HA GLU A 12 -6.259 -1.129 -15.178 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -5.434 -2.777 -16.930 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -4.882 -1.131 -17.169 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -2.884 -2.102 -15.522 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -3.318 -3.559 -16.395 1.00 0.00 H new ATOM 181 N GLN A 13 -5.863 -2.763 -13.037 1.00 0.00 N ATOM 182 CA GLN A 13 -6.023 -3.963 -12.169 1.00 0.00 C ATOM 183 C GLN A 13 -6.881 -3.603 -10.954 1.00 0.00 C ATOM 184 O GLN A 13 -6.527 -2.752 -10.162 1.00 0.00 O ATOM 185 CB GLN A 13 -4.648 -4.440 -11.697 1.00 0.00 C ATOM 186 CG GLN A 13 -4.672 -5.959 -11.514 1.00 0.00 C ATOM 187 CD GLN A 13 -3.815 -6.617 -12.597 1.00 0.00 C ATOM 188 OE1 GLN A 13 -2.612 -6.443 -12.626 1.00 0.00 O ATOM 189 NE2 GLN A 13 -4.386 -7.372 -13.496 1.00 0.00 N ATOM 0 H GLN A 13 -6.109 -1.875 -12.599 1.00 0.00 H new ATOM 0 HA GLN A 13 -6.509 -4.758 -12.735 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -3.885 -4.162 -12.424 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -4.385 -3.954 -10.758 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -4.294 -6.223 -10.526 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -5.696 -6.327 -11.572 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -5.395 -7.519 -13.473 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -3.823 -7.815 -14.222 1.00 0.00 H new ATOM 198 N GLN A 14 -8.005 -4.246 -10.800 1.00 0.00 N ATOM 199 CA GLN A 14 -8.886 -3.941 -9.636 1.00 0.00 C ATOM 200 C GLN A 14 -8.324 -4.612 -8.381 1.00 0.00 C ATOM 201 O GLN A 14 -8.230 -5.821 -8.300 1.00 0.00 O ATOM 202 CB GLN A 14 -10.294 -4.471 -9.911 1.00 0.00 C ATOM 203 CG GLN A 14 -10.206 -5.899 -10.452 1.00 0.00 C ATOM 204 CD GLN A 14 -10.546 -5.903 -11.944 1.00 0.00 C ATOM 205 OE1 GLN A 14 -10.043 -5.093 -12.696 1.00 0.00 O ATOM 206 NE2 GLN A 14 -11.385 -6.789 -12.407 1.00 0.00 N ATOM 0 H GLN A 14 -8.352 -4.970 -11.429 1.00 0.00 H new ATOM 0 HA GLN A 14 -8.927 -2.863 -9.483 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -10.886 -4.454 -8.996 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -10.801 -3.829 -10.631 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -9.203 -6.297 -10.296 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -10.894 -6.547 -9.910 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -11.808 -7.470 -11.776 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -11.618 -6.801 -13.400 1.00 0.00 H new ATOM 215 N MET A 15 -7.945 -3.837 -7.402 1.00 0.00 N ATOM 216 CA MET A 15 -7.388 -4.429 -6.153 1.00 0.00 C ATOM 217 C MET A 15 -8.528 -4.768 -5.192 1.00 0.00 C ATOM 218 O MET A 15 -8.869 -5.919 -5.001 1.00 0.00 O ATOM 219 CB MET A 15 -6.444 -3.426 -5.488 1.00 0.00 C ATOM 220 CG MET A 15 -5.112 -3.400 -6.239 1.00 0.00 C ATOM 221 SD MET A 15 -4.168 -1.936 -5.746 1.00 0.00 S ATOM 222 CE MET A 15 -2.675 -2.801 -5.199 1.00 0.00 C ATOM 0 H MET A 15 -7.997 -2.818 -7.413 1.00 0.00 H new ATOM 0 HA MET A 15 -6.839 -5.338 -6.399 1.00 0.00 H new ATOM 0 HB2 MET A 15 -6.893 -2.433 -5.489 1.00 0.00 H new ATOM 0 HB3 MET A 15 -6.280 -3.701 -4.446 1.00 0.00 H new ATOM 0 HG2 MET A 15 -4.542 -4.303 -6.021 1.00 0.00 H new ATOM 0 HG3 MET A 15 -5.289 -3.386 -7.314 1.00 0.00 H new ATOM 0 HE1 MET A 15 -2.323 -2.364 -4.264 1.00 0.00 H new ATOM 0 HE2 MET A 15 -2.902 -3.856 -5.044 1.00 0.00 H new ATOM 0 HE3 MET A 15 -1.900 -2.705 -5.959 1.00 0.00 H new ATOM 232 N PHE A 16 -9.119 -3.778 -4.580 1.00 0.00 N ATOM 233 CA PHE A 16 -10.232 -4.058 -3.630 1.00 0.00 C ATOM 234 C PHE A 16 -11.534 -3.448 -4.144 1.00 0.00 C ATOM 235 O PHE A 16 -11.686 -2.244 -4.198 1.00 0.00 O ATOM 236 CB PHE A 16 -9.918 -3.449 -2.259 1.00 0.00 C ATOM 237 CG PHE A 16 -10.999 -3.840 -1.268 1.00 0.00 C ATOM 238 CD1 PHE A 16 -11.983 -4.771 -1.631 1.00 0.00 C ATOM 239 CD2 PHE A 16 -11.009 -3.286 0.022 1.00 0.00 C ATOM 240 CE1 PHE A 16 -12.966 -5.147 -0.712 1.00 0.00 C ATOM 241 CE2 PHE A 16 -11.996 -3.658 0.931 1.00 0.00 C ATOM 242 CZ PHE A 16 -12.972 -4.591 0.566 1.00 0.00 C ATOM 0 H PHE A 16 -8.881 -2.793 -4.696 1.00 0.00 H new ATOM 0 HA PHE A 16 -10.341 -5.139 -3.542 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -8.946 -3.798 -1.909 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -9.858 -2.363 -2.337 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -11.981 -5.198 -2.623 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -10.252 -2.572 0.309 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -13.720 -5.868 -0.992 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -12.008 -3.225 1.920 1.00 0.00 H new ATOM 0 HZ PHE A 16 -13.732 -4.881 1.276 1.00 0.00 H new ATOM 252 N SER A 17 -12.489 -4.265 -4.497 1.00 0.00 N ATOM 253 CA SER A 17 -13.782 -3.717 -4.974 1.00 0.00 C ATOM 254 C SER A 17 -14.937 -4.531 -4.385 1.00 0.00 C ATOM 255 O SER A 17 -15.369 -5.517 -4.949 1.00 0.00 O ATOM 256 CB SER A 17 -13.835 -3.760 -6.500 1.00 0.00 C ATOM 257 OG SER A 17 -13.756 -5.109 -6.938 1.00 0.00 O ATOM 0 H SER A 17 -12.427 -5.283 -4.475 1.00 0.00 H new ATOM 0 HA SER A 17 -13.874 -2.681 -4.648 1.00 0.00 H new ATOM 0 HB2 SER A 17 -14.759 -3.304 -6.856 1.00 0.00 H new ATOM 0 HB3 SER A 17 -13.012 -3.181 -6.920 1.00 0.00 H new ATOM 0 HG SER A 17 -14.358 -5.664 -6.399 1.00 0.00 H new ATOM 263 N GLY A 18 -15.437 -4.121 -3.247 1.00 0.00 N ATOM 264 CA GLY A 18 -16.564 -4.862 -2.608 1.00 0.00 C ATOM 265 C GLY A 18 -16.885 -4.230 -1.249 1.00 0.00 C ATOM 266 O GLY A 18 -16.353 -3.197 -0.894 1.00 0.00 O ATOM 0 H GLY A 18 -15.112 -3.303 -2.732 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -17.443 -4.833 -3.251 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -16.297 -5.911 -2.479 1.00 0.00 H new ATOM 270 N LEU A 19 -17.753 -4.841 -0.484 1.00 0.00 N ATOM 271 CA LEU A 19 -18.104 -4.271 0.851 1.00 0.00 C ATOM 272 C LEU A 19 -16.924 -4.462 1.810 1.00 0.00 C ATOM 273 O LEU A 19 -16.107 -5.342 1.632 1.00 0.00 O ATOM 274 CB LEU A 19 -19.338 -4.988 1.404 1.00 0.00 C ATOM 275 CG LEU A 19 -20.483 -4.887 0.392 1.00 0.00 C ATOM 276 CD1 LEU A 19 -21.790 -5.325 1.053 1.00 0.00 C ATOM 277 CD2 LEU A 19 -20.615 -3.440 -0.086 1.00 0.00 C ATOM 0 H LEU A 19 -18.233 -5.708 -0.726 1.00 0.00 H new ATOM 0 HA LEU A 19 -18.321 -3.208 0.749 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -19.105 -6.034 1.603 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -19.636 -4.542 2.353 1.00 0.00 H new ATOM 0 HG LEU A 19 -20.272 -5.534 -0.459 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -22.604 -5.253 0.332 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -21.698 -6.356 1.394 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -22.001 -4.679 1.905 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -21.430 -3.368 -0.806 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -20.825 -2.793 0.766 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -19.684 -3.127 -0.559 1.00 0.00 H new ATOM 289 N VAL A 20 -16.813 -3.630 2.813 1.00 0.00 N ATOM 290 CA VAL A 20 -15.654 -3.765 3.765 1.00 0.00 C ATOM 291 C VAL A 20 -16.054 -3.186 5.133 1.00 0.00 C ATOM 292 O VAL A 20 -17.177 -2.768 5.327 1.00 0.00 O ATOM 293 CB VAL A 20 -14.394 -3.043 3.168 1.00 0.00 C ATOM 294 CG1 VAL A 20 -14.718 -2.411 1.807 1.00 0.00 C ATOM 295 CG2 VAL A 20 -13.851 -1.919 4.082 1.00 0.00 C ATOM 0 H VAL A 20 -17.462 -2.870 3.018 1.00 0.00 H new ATOM 0 HA VAL A 20 -15.396 -4.815 3.905 1.00 0.00 H new ATOM 0 HB VAL A 20 -13.635 -3.820 3.071 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -13.829 -1.917 1.414 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -15.038 -3.187 1.112 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -15.517 -1.679 1.927 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -12.981 -1.459 3.615 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -14.624 -1.165 4.231 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -13.565 -2.340 5.046 1.00 0.00 H new ATOM 305 N GLU A 21 -15.148 -3.133 6.075 1.00 0.00 N ATOM 306 CA GLU A 21 -15.514 -2.551 7.399 1.00 0.00 C ATOM 307 C GLU A 21 -14.311 -1.833 8.011 1.00 0.00 C ATOM 308 O GLU A 21 -14.446 -0.775 8.594 1.00 0.00 O ATOM 309 CB GLU A 21 -15.986 -3.662 8.338 1.00 0.00 C ATOM 310 CG GLU A 21 -17.104 -3.133 9.239 1.00 0.00 C ATOM 311 CD GLU A 21 -17.426 -4.171 10.316 1.00 0.00 C ATOM 312 OE1 GLU A 21 -17.294 -5.350 10.034 1.00 0.00 O ATOM 313 OE2 GLU A 21 -17.799 -3.768 11.406 1.00 0.00 O ATOM 0 H GLU A 21 -14.186 -3.462 5.987 1.00 0.00 H new ATOM 0 HA GLU A 21 -16.320 -1.831 7.258 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -16.344 -4.513 7.759 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -15.153 -4.017 8.945 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -16.799 -2.195 9.703 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -17.994 -2.921 8.646 1.00 0.00 H new ATOM 320 N LYS A 22 -13.137 -2.388 7.895 1.00 0.00 N ATOM 321 CA LYS A 22 -11.953 -1.709 8.487 1.00 0.00 C ATOM 322 C LYS A 22 -10.759 -1.817 7.541 1.00 0.00 C ATOM 323 O LYS A 22 -9.989 -2.749 7.610 1.00 0.00 O ATOM 324 CB LYS A 22 -11.608 -2.366 9.824 1.00 0.00 C ATOM 325 CG LYS A 22 -12.384 -1.674 10.947 1.00 0.00 C ATOM 326 CD LYS A 22 -13.784 -2.282 11.049 1.00 0.00 C ATOM 327 CE LYS A 22 -14.194 -2.377 12.520 1.00 0.00 C ATOM 328 NZ LYS A 22 -15.508 -1.702 12.714 1.00 0.00 N ATOM 0 H LYS A 22 -12.948 -3.272 7.422 1.00 0.00 H new ATOM 0 HA LYS A 22 -12.186 -0.656 8.644 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -11.857 -3.427 9.795 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -10.536 -2.295 10.011 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -11.856 -1.790 11.893 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -12.454 -0.604 10.750 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -14.499 -1.669 10.500 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -13.796 -3.272 10.593 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -14.262 -3.422 12.823 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -13.437 -1.911 13.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -15.676 -1.555 13.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -15.501 -0.783 12.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -16.265 -2.296 12.320 1.00 0.00 H new ATOM 342 N ILE A 23 -10.590 -0.855 6.674 1.00 0.00 N ATOM 343 CA ILE A 23 -9.430 -0.887 5.732 1.00 0.00 C ATOM 344 C ILE A 23 -8.332 0.020 6.300 1.00 0.00 C ATOM 345 O ILE A 23 -8.592 0.872 7.127 1.00 0.00 O ATOM 346 CB ILE A 23 -9.868 -0.394 4.340 1.00 0.00 C ATOM 347 CG1 ILE A 23 -8.679 0.242 3.598 1.00 0.00 C ATOM 348 CG2 ILE A 23 -10.986 0.637 4.489 1.00 0.00 C ATOM 349 CD1 ILE A 23 -9.137 0.760 2.234 1.00 0.00 C ATOM 0 H ILE A 23 -11.205 -0.047 6.576 1.00 0.00 H new ATOM 0 HA ILE A 23 -9.054 -1.905 5.626 1.00 0.00 H new ATOM 0 HB ILE A 23 -10.229 -1.246 3.764 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -8.266 1.060 4.188 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -7.884 -0.492 3.470 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -11.294 0.984 3.503 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -11.837 0.181 4.995 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -10.626 1.482 5.075 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -8.292 1.209 1.713 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -9.529 -0.068 1.643 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -9.917 1.508 2.372 1.00 0.00 H new ATOM 361 N GLN A 24 -7.111 -0.155 5.878 1.00 0.00 N ATOM 362 CA GLN A 24 -6.020 0.705 6.420 1.00 0.00 C ATOM 363 C GLN A 24 -4.962 0.955 5.345 1.00 0.00 C ATOM 364 O GLN A 24 -4.936 0.309 4.318 1.00 0.00 O ATOM 365 CB GLN A 24 -5.374 0.006 7.616 1.00 0.00 C ATOM 366 CG GLN A 24 -6.320 0.074 8.815 1.00 0.00 C ATOM 367 CD GLN A 24 -5.531 -0.168 10.102 1.00 0.00 C ATOM 368 OE1 GLN A 24 -4.334 0.032 10.141 1.00 0.00 O ATOM 369 NE2 GLN A 24 -6.157 -0.595 11.165 1.00 0.00 N ATOM 0 H GLN A 24 -6.822 -0.849 5.188 1.00 0.00 H new ATOM 0 HA GLN A 24 -6.441 1.661 6.732 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -5.155 -1.033 7.370 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -4.424 0.482 7.860 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -6.807 1.048 8.852 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -7.108 -0.673 8.713 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -7.163 -0.763 11.132 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -5.641 -0.761 12.029 1.00 0.00 H new ATOM 378 N VAL A 25 -4.087 1.893 5.581 1.00 0.00 N ATOM 379 CA VAL A 25 -3.023 2.197 4.588 1.00 0.00 C ATOM 380 C VAL A 25 -1.887 2.943 5.287 1.00 0.00 C ATOM 381 O VAL A 25 -2.112 3.752 6.166 1.00 0.00 O ATOM 382 CB VAL A 25 -3.596 3.072 3.475 1.00 0.00 C ATOM 383 CG1 VAL A 25 -4.315 4.277 4.088 1.00 0.00 C ATOM 384 CG2 VAL A 25 -2.460 3.562 2.575 1.00 0.00 C ATOM 0 H VAL A 25 -4.065 2.465 6.425 1.00 0.00 H new ATOM 0 HA VAL A 25 -2.646 1.269 4.158 1.00 0.00 H new ATOM 0 HB VAL A 25 -4.303 2.489 2.885 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -4.723 4.900 3.293 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -5.125 3.930 4.729 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -3.609 4.860 4.679 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -2.869 4.186 1.781 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -1.753 4.144 3.166 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -1.948 2.705 2.136 1.00 0.00 H new ATOM 394 N THR A 26 -0.671 2.683 4.903 1.00 0.00 N ATOM 395 CA THR A 26 0.476 3.383 5.547 1.00 0.00 C ATOM 396 C THR A 26 1.383 3.962 4.463 1.00 0.00 C ATOM 397 O THR A 26 1.779 3.276 3.540 1.00 0.00 O ATOM 398 CB THR A 26 1.268 2.394 6.406 1.00 0.00 C ATOM 399 OG1 THR A 26 0.503 2.045 7.551 1.00 0.00 O ATOM 400 CG2 THR A 26 2.583 3.040 6.845 1.00 0.00 C ATOM 0 H THR A 26 -0.420 2.017 4.172 1.00 0.00 H new ATOM 0 HA THR A 26 0.103 4.187 6.181 1.00 0.00 H new ATOM 0 HB THR A 26 1.482 1.496 5.826 1.00 0.00 H new ATOM 0 HG1 THR A 26 1.008 1.410 8.101 1.00 0.00 H new ATOM 0 HG21 THR A 26 3.148 2.336 7.457 1.00 0.00 H new ATOM 0 HG22 THR A 26 3.169 3.307 5.965 1.00 0.00 H new ATOM 0 HG23 THR A 26 2.371 3.937 7.426 1.00 0.00 H new ATOM 408 N GLY A 27 1.715 5.219 4.567 1.00 0.00 N ATOM 409 CA GLY A 27 2.597 5.847 3.543 1.00 0.00 C ATOM 410 C GLY A 27 1.928 7.106 2.982 1.00 0.00 C ATOM 411 O GLY A 27 2.335 7.634 1.967 1.00 0.00 O ATOM 0 H GLY A 27 1.413 5.840 5.318 1.00 0.00 H new ATOM 0 HA2 GLY A 27 3.559 6.103 3.986 1.00 0.00 H new ATOM 0 HA3 GLY A 27 2.795 5.140 2.738 1.00 0.00 H new ATOM 415 N SER A 28 0.905 7.593 3.633 1.00 0.00 N ATOM 416 CA SER A 28 0.217 8.817 3.134 1.00 0.00 C ATOM 417 C SER A 28 0.373 9.943 4.158 1.00 0.00 C ATOM 418 O SER A 28 1.316 9.971 4.924 1.00 0.00 O ATOM 419 CB SER A 28 -1.268 8.517 2.928 1.00 0.00 C ATOM 420 OG SER A 28 -1.749 9.266 1.819 1.00 0.00 O ATOM 0 H SER A 28 0.517 7.195 4.488 1.00 0.00 H new ATOM 0 HA SER A 28 0.661 9.124 2.187 1.00 0.00 H new ATOM 0 HB2 SER A 28 -1.415 7.451 2.753 1.00 0.00 H new ATOM 0 HB3 SER A 28 -1.831 8.773 3.826 1.00 0.00 H new ATOM 0 HG SER A 28 -2.700 9.075 1.683 1.00 0.00 H new ATOM 426 N GLU A 29 -0.544 10.872 4.180 1.00 0.00 N ATOM 427 CA GLU A 29 -0.444 11.992 5.158 1.00 0.00 C ATOM 428 C GLU A 29 -0.360 11.421 6.575 1.00 0.00 C ATOM 429 O GLU A 29 -1.358 11.077 7.175 1.00 0.00 O ATOM 430 CB GLU A 29 -1.679 12.887 5.040 1.00 0.00 C ATOM 431 CG GLU A 29 -1.250 14.356 5.064 1.00 0.00 C ATOM 432 CD GLU A 29 -2.227 15.162 5.923 1.00 0.00 C ATOM 433 OE1 GLU A 29 -3.420 14.961 5.776 1.00 0.00 O ATOM 434 OE2 GLU A 29 -1.763 15.969 6.713 1.00 0.00 O ATOM 0 H GLU A 29 -1.356 10.904 3.564 1.00 0.00 H new ATOM 0 HA GLU A 29 0.449 12.580 4.948 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -2.213 12.668 4.115 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -2.367 12.685 5.861 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -0.240 14.444 5.464 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -1.227 14.755 4.050 1.00 0.00 H new ATOM 441 N GLY A 30 0.824 11.316 7.114 1.00 0.00 N ATOM 442 CA GLY A 30 0.970 10.765 8.490 1.00 0.00 C ATOM 443 C GLY A 30 0.903 9.237 8.439 1.00 0.00 C ATOM 444 O GLY A 30 1.897 8.569 8.226 1.00 0.00 O ATOM 0 H GLY A 30 1.696 11.588 6.661 1.00 0.00 H new ATOM 0 HA2 GLY A 30 1.919 11.084 8.922 1.00 0.00 H new ATOM 0 HA3 GLY A 30 0.181 11.153 9.134 1.00 0.00 H new ATOM 448 N GLU A 31 -0.260 8.677 8.635 1.00 0.00 N ATOM 449 CA GLU A 31 -0.387 7.192 8.598 1.00 0.00 C ATOM 450 C GLU A 31 -1.853 6.793 8.793 1.00 0.00 C ATOM 451 O GLU A 31 -2.149 5.731 9.304 1.00 0.00 O ATOM 452 CB GLU A 31 0.453 6.584 9.722 1.00 0.00 C ATOM 453 CG GLU A 31 1.073 5.271 9.243 1.00 0.00 C ATOM 454 CD GLU A 31 2.029 4.740 10.313 1.00 0.00 C ATOM 455 OE1 GLU A 31 1.552 4.133 11.257 1.00 0.00 O ATOM 456 OE2 GLU A 31 3.223 4.950 10.170 1.00 0.00 O ATOM 0 H GLU A 31 -1.126 9.183 8.819 1.00 0.00 H new ATOM 0 HA GLU A 31 -0.036 6.825 7.634 1.00 0.00 H new ATOM 0 HB2 GLU A 31 1.236 7.280 10.022 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -0.169 6.406 10.599 1.00 0.00 H new ATOM 0 HG2 GLU A 31 0.291 4.539 9.043 1.00 0.00 H new ATOM 0 HG3 GLU A 31 1.609 5.429 8.307 1.00 0.00 H new ATOM 463 N LEU A 32 -2.773 7.627 8.392 1.00 0.00 N ATOM 464 CA LEU A 32 -4.209 7.273 8.563 1.00 0.00 C ATOM 465 C LEU A 32 -4.569 6.150 7.597 1.00 0.00 C ATOM 466 O LEU A 32 -4.069 6.082 6.491 1.00 0.00 O ATOM 467 CB LEU A 32 -5.091 8.489 8.261 1.00 0.00 C ATOM 468 CG LEU A 32 -5.092 9.433 9.467 1.00 0.00 C ATOM 469 CD1 LEU A 32 -6.104 10.557 9.236 1.00 0.00 C ATOM 470 CD2 LEU A 32 -5.477 8.654 10.727 1.00 0.00 C ATOM 0 H LEU A 32 -2.594 8.532 7.956 1.00 0.00 H new ATOM 0 HA LEU A 32 -4.375 6.952 9.591 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -4.720 9.010 7.378 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -6.108 8.167 8.037 1.00 0.00 H new ATOM 0 HG LEU A 32 -4.097 9.859 9.593 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -6.104 11.228 10.095 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -5.831 11.114 8.340 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -7.099 10.130 9.109 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -5.477 9.327 11.585 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -6.472 8.226 10.601 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -4.756 7.853 10.894 1.00 0.00 H new ATOM 482 N GLY A 33 -5.447 5.279 7.997 1.00 0.00 N ATOM 483 CA GLY A 33 -5.857 4.173 7.096 1.00 0.00 C ATOM 484 C GLY A 33 -7.179 4.560 6.445 1.00 0.00 C ATOM 485 O GLY A 33 -7.288 5.595 5.817 1.00 0.00 O ATOM 0 H GLY A 33 -5.899 5.285 8.911 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -5.095 3.998 6.336 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -5.966 3.245 7.657 1.00 0.00 H new ATOM 489 N ILE A 34 -8.190 3.759 6.602 1.00 0.00 N ATOM 490 CA ILE A 34 -9.502 4.112 6.001 1.00 0.00 C ATOM 491 C ILE A 34 -10.623 3.496 6.837 1.00 0.00 C ATOM 492 O ILE A 34 -10.671 2.303 7.059 1.00 0.00 O ATOM 493 CB ILE A 34 -9.571 3.593 4.563 1.00 0.00 C ATOM 494 CG1 ILE A 34 -8.597 4.383 3.692 1.00 0.00 C ATOM 495 CG2 ILE A 34 -10.986 3.791 4.020 1.00 0.00 C ATOM 496 CD1 ILE A 34 -9.110 5.819 3.555 1.00 0.00 C ATOM 0 H ILE A 34 -8.166 2.879 7.118 1.00 0.00 H new ATOM 0 HA ILE A 34 -9.617 5.196 5.988 1.00 0.00 H new ATOM 0 HB ILE A 34 -9.310 2.535 4.548 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -7.603 4.379 4.138 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -8.507 3.919 2.710 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -11.038 3.422 2.996 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -11.694 3.241 4.640 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -11.237 4.852 4.037 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -8.422 6.393 2.935 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -10.096 5.810 3.091 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -9.177 6.277 4.542 1.00 0.00 H new ATOM 508 N TYR A 35 -11.522 4.315 7.305 1.00 0.00 N ATOM 509 CA TYR A 35 -12.652 3.811 8.135 1.00 0.00 C ATOM 510 C TYR A 35 -13.937 4.516 7.666 1.00 0.00 C ATOM 511 O TYR A 35 -13.916 5.197 6.660 1.00 0.00 O ATOM 512 CB TYR A 35 -12.372 4.129 9.609 1.00 0.00 C ATOM 513 CG TYR A 35 -10.880 4.175 9.870 1.00 0.00 C ATOM 514 CD1 TYR A 35 -10.100 5.223 9.360 1.00 0.00 C ATOM 515 CD2 TYR A 35 -10.279 3.167 10.634 1.00 0.00 C ATOM 516 CE1 TYR A 35 -8.723 5.259 9.614 1.00 0.00 C ATOM 517 CE2 TYR A 35 -8.901 3.204 10.887 1.00 0.00 C ATOM 518 CZ TYR A 35 -8.125 4.250 10.378 1.00 0.00 C ATOM 519 OH TYR A 35 -6.767 4.287 10.628 1.00 0.00 O ATOM 0 H TYR A 35 -11.523 5.323 7.146 1.00 0.00 H new ATOM 0 HA TYR A 35 -12.766 2.732 8.028 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -12.822 5.086 9.872 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -12.835 3.374 10.244 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -10.561 6.002 8.771 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -10.878 2.360 11.029 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -8.122 6.066 9.220 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -8.439 2.425 11.475 1.00 0.00 H new ATOM 0 HH TYR A 35 -6.514 3.513 11.174 1.00 0.00 H new ATOM 529 N PRO A 36 -15.025 4.347 8.387 1.00 0.00 N ATOM 530 CA PRO A 36 -16.300 4.978 8.013 1.00 0.00 C ATOM 531 C PRO A 36 -16.276 6.463 8.379 1.00 0.00 C ATOM 532 O PRO A 36 -16.730 6.867 9.430 1.00 0.00 O ATOM 533 CB PRO A 36 -17.343 4.208 8.828 1.00 0.00 C ATOM 534 CG PRO A 36 -16.585 3.568 10.014 1.00 0.00 C ATOM 535 CD PRO A 36 -15.093 3.538 9.624 1.00 0.00 C ATOM 0 HA PRO A 36 -16.510 4.937 6.944 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -18.128 4.875 9.184 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -17.826 3.444 8.218 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -16.735 4.146 10.926 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -16.954 2.561 10.211 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -14.467 3.960 10.411 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -14.746 2.519 9.453 1.00 0.00 H new ATOM 543 N GLY A 37 -15.733 7.274 7.512 1.00 0.00 N ATOM 544 CA GLY A 37 -15.654 8.734 7.793 1.00 0.00 C ATOM 545 C GLY A 37 -14.187 9.124 7.969 1.00 0.00 C ATOM 546 O GLY A 37 -13.812 9.753 8.938 1.00 0.00 O ATOM 0 H GLY A 37 -15.339 6.985 6.617 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -16.099 9.300 6.975 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -16.219 8.976 8.693 1.00 0.00 H new ATOM 550 N HIS A 38 -13.351 8.745 7.038 1.00 0.00 N ATOM 551 CA HIS A 38 -11.905 9.079 7.147 1.00 0.00 C ATOM 552 C HIS A 38 -11.655 10.487 6.586 1.00 0.00 C ATOM 553 O HIS A 38 -10.737 10.713 5.822 1.00 0.00 O ATOM 554 CB HIS A 38 -11.091 8.040 6.365 1.00 0.00 C ATOM 555 CG HIS A 38 -9.652 8.467 6.285 1.00 0.00 C ATOM 556 ND1 HIS A 38 -9.000 8.642 5.075 1.00 0.00 N ATOM 557 CD2 HIS A 38 -8.728 8.760 7.255 1.00 0.00 C ATOM 558 CE1 HIS A 38 -7.739 9.023 5.346 1.00 0.00 C ATOM 559 NE2 HIS A 38 -7.519 9.110 6.661 1.00 0.00 N ATOM 0 H HIS A 38 -13.611 8.217 6.205 1.00 0.00 H new ATOM 0 HA HIS A 38 -11.598 9.063 8.193 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -11.164 7.068 6.852 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -11.501 7.925 5.362 1.00 0.00 H new ATOM 0 HD1 HIS A 38 -9.403 8.507 4.148 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -8.911 8.725 8.319 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -6.995 9.233 4.592 1.00 0.00 H new ATOM 567 N ALA A 39 -12.463 11.438 6.971 1.00 0.00 N ATOM 568 CA ALA A 39 -12.273 12.834 6.476 1.00 0.00 C ATOM 569 C ALA A 39 -12.288 12.856 4.945 1.00 0.00 C ATOM 570 O ALA A 39 -12.084 11.842 4.309 1.00 0.00 O ATOM 571 CB ALA A 39 -10.932 13.371 6.979 1.00 0.00 C ATOM 0 H ALA A 39 -13.249 11.309 7.609 1.00 0.00 H new ATOM 0 HA ALA A 39 -13.085 13.459 6.849 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -10.790 14.390 6.619 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -10.924 13.366 8.069 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -10.125 12.740 6.608 1.00 0.00 H new ATOM 577 N PRO A 40 -12.528 14.023 4.399 1.00 0.00 N ATOM 578 CA PRO A 40 -12.576 14.228 2.941 1.00 0.00 C ATOM 579 C PRO A 40 -11.159 14.341 2.370 1.00 0.00 C ATOM 580 O PRO A 40 -10.760 15.380 1.882 1.00 0.00 O ATOM 581 CB PRO A 40 -13.328 15.554 2.792 1.00 0.00 C ATOM 582 CG PRO A 40 -13.162 16.303 4.135 1.00 0.00 C ATOM 583 CD PRO A 40 -12.780 15.246 5.188 1.00 0.00 C ATOM 0 HA PRO A 40 -13.055 13.407 2.408 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -12.922 16.140 1.968 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -14.381 15.381 2.572 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -12.390 17.069 4.058 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -14.087 16.809 4.413 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -11.896 15.546 5.751 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -13.582 15.096 5.911 1.00 0.00 H new ATOM 591 N LEU A 41 -10.396 13.283 2.423 1.00 0.00 N ATOM 592 CA LEU A 41 -9.009 13.341 1.880 1.00 0.00 C ATOM 593 C LEU A 41 -9.059 13.246 0.354 1.00 0.00 C ATOM 594 O LEU A 41 -9.824 12.484 -0.204 1.00 0.00 O ATOM 595 CB LEU A 41 -8.190 12.174 2.437 1.00 0.00 C ATOM 596 CG LEU A 41 -7.210 12.693 3.490 1.00 0.00 C ATOM 597 CD1 LEU A 41 -6.272 13.719 2.853 1.00 0.00 C ATOM 598 CD2 LEU A 41 -7.989 13.355 4.629 1.00 0.00 C ATOM 0 H LEU A 41 -10.672 12.384 2.818 1.00 0.00 H new ATOM 0 HA LEU A 41 -8.543 14.282 2.173 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -8.852 11.429 2.878 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -7.646 11.680 1.631 1.00 0.00 H new ATOM 0 HG LEU A 41 -6.626 11.861 3.883 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -5.574 14.089 3.604 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -5.717 13.250 2.041 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -6.856 14.551 2.460 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -7.291 13.725 5.380 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -8.573 14.187 4.235 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -8.658 12.625 5.084 1.00 0.00 H new ATOM 610 N LEU A 42 -8.253 14.014 -0.325 1.00 0.00 N ATOM 611 CA LEU A 42 -8.262 13.968 -1.811 1.00 0.00 C ATOM 612 C LEU A 42 -6.900 14.417 -2.346 1.00 0.00 C ATOM 613 O LEU A 42 -6.779 15.446 -2.980 1.00 0.00 O ATOM 614 CB LEU A 42 -9.349 14.906 -2.336 1.00 0.00 C ATOM 615 CG LEU A 42 -9.527 14.688 -3.837 1.00 0.00 C ATOM 616 CD1 LEU A 42 -10.290 13.385 -4.075 1.00 0.00 C ATOM 617 CD2 LEU A 42 -10.314 15.857 -4.432 1.00 0.00 C ATOM 0 H LEU A 42 -7.589 14.671 0.086 1.00 0.00 H new ATOM 0 HA LEU A 42 -8.463 12.950 -2.144 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -10.289 14.718 -1.816 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -9.077 15.943 -2.138 1.00 0.00 H new ATOM 0 HG LEU A 42 -8.549 14.629 -4.315 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -10.418 13.229 -5.146 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -9.729 12.552 -3.651 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -11.268 13.444 -3.598 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -10.441 15.702 -5.503 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -11.292 15.917 -3.955 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -9.770 16.786 -4.262 1.00 0.00 H new ATOM 629 N THR A 43 -5.872 13.652 -2.095 1.00 0.00 N ATOM 630 CA THR A 43 -4.521 14.039 -2.591 1.00 0.00 C ATOM 631 C THR A 43 -3.823 12.808 -3.181 1.00 0.00 C ATOM 632 O THR A 43 -4.022 12.466 -4.330 1.00 0.00 O ATOM 633 CB THR A 43 -3.696 14.603 -1.430 1.00 0.00 C ATOM 634 OG1 THR A 43 -2.313 14.413 -1.694 1.00 0.00 O ATOM 635 CG2 THR A 43 -4.076 13.888 -0.132 1.00 0.00 C ATOM 0 H THR A 43 -5.909 12.779 -1.570 1.00 0.00 H new ATOM 0 HA THR A 43 -4.617 14.800 -3.365 1.00 0.00 H new ATOM 0 HB THR A 43 -3.901 15.668 -1.325 1.00 0.00 H new ATOM 0 HG1 THR A 43 -1.785 14.775 -0.952 1.00 0.00 H new ATOM 0 HG21 THR A 43 -3.487 14.292 0.692 1.00 0.00 H new ATOM 0 HG22 THR A 43 -5.136 14.041 0.071 1.00 0.00 H new ATOM 0 HG23 THR A 43 -3.876 12.821 -0.232 1.00 0.00 H new ATOM 643 N ALA A 44 -3.012 12.136 -2.408 1.00 0.00 N ATOM 644 CA ALA A 44 -2.311 10.930 -2.932 1.00 0.00 C ATOM 645 C ALA A 44 -2.047 9.963 -1.777 1.00 0.00 C ATOM 646 O ALA A 44 -2.135 10.328 -0.622 1.00 0.00 O ATOM 647 CB ALA A 44 -0.983 11.343 -3.567 1.00 0.00 C ATOM 0 H ALA A 44 -2.805 12.371 -1.437 1.00 0.00 H new ATOM 0 HA ALA A 44 -2.932 10.444 -3.684 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -0.472 10.459 -3.949 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -1.172 12.036 -4.387 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -0.357 11.828 -2.818 1.00 0.00 H new ATOM 653 N ILE A 45 -1.726 8.732 -2.073 1.00 0.00 N ATOM 654 CA ILE A 45 -1.463 7.756 -0.977 1.00 0.00 C ATOM 655 C ILE A 45 0.006 7.344 -0.980 1.00 0.00 C ATOM 656 O ILE A 45 0.427 6.508 -0.206 1.00 0.00 O ATOM 657 CB ILE A 45 -2.339 6.517 -1.168 1.00 0.00 C ATOM 658 CG1 ILE A 45 -3.769 6.946 -1.504 1.00 0.00 C ATOM 659 CG2 ILE A 45 -2.345 5.693 0.121 1.00 0.00 C ATOM 660 CD1 ILE A 45 -4.300 6.088 -2.654 1.00 0.00 C ATOM 0 H ILE A 45 -1.635 8.362 -3.019 1.00 0.00 H new ATOM 0 HA ILE A 45 -1.700 8.227 -0.023 1.00 0.00 H new ATOM 0 HB ILE A 45 -1.940 5.915 -1.984 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -4.409 6.836 -0.628 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -3.788 8.000 -1.783 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -2.969 4.810 -0.015 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -1.327 5.385 0.361 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -2.743 6.297 0.937 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -5.319 6.392 -2.895 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -3.665 6.221 -3.530 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -4.295 5.039 -2.358 1.00 0.00 H new ATOM 672 N LYS A 46 0.786 7.936 -1.832 1.00 0.00 N ATOM 673 CA LYS A 46 2.238 7.593 -1.888 1.00 0.00 C ATOM 674 C LYS A 46 2.409 6.067 -1.921 1.00 0.00 C ATOM 675 O LYS A 46 1.441 5.334 -1.898 1.00 0.00 O ATOM 676 CB LYS A 46 2.933 8.165 -0.650 1.00 0.00 C ATOM 677 CG LYS A 46 4.001 9.172 -1.082 1.00 0.00 C ATOM 678 CD LYS A 46 3.404 10.580 -1.086 1.00 0.00 C ATOM 679 CE LYS A 46 3.916 11.354 0.131 1.00 0.00 C ATOM 680 NZ LYS A 46 5.401 11.244 0.200 1.00 0.00 N ATOM 0 H LYS A 46 0.484 8.647 -2.498 1.00 0.00 H new ATOM 0 HA LYS A 46 2.682 8.019 -2.788 1.00 0.00 H new ATOM 0 HB2 LYS A 46 2.203 8.649 -0.002 1.00 0.00 H new ATOM 0 HB3 LYS A 46 3.389 7.361 -0.072 1.00 0.00 H new ATOM 0 HG2 LYS A 46 4.852 9.129 -0.403 1.00 0.00 H new ATOM 0 HG3 LYS A 46 4.372 8.920 -2.075 1.00 0.00 H new ATOM 0 HD2 LYS A 46 3.679 11.101 -2.003 1.00 0.00 H new ATOM 0 HD3 LYS A 46 2.316 10.525 -1.064 1.00 0.00 H new ATOM 0 HE2 LYS A 46 3.621 12.401 0.060 1.00 0.00 H new ATOM 0 HE3 LYS A 46 3.468 10.958 1.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 5.800 12.139 0.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 5.662 10.473 0.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 5.779 11.043 -0.748 1.00 0.00 H new ATOM 694 N PRO A 47 3.644 5.633 -1.975 1.00 0.00 N ATOM 695 CA PRO A 47 3.979 4.198 -2.010 1.00 0.00 C ATOM 696 C PRO A 47 3.917 3.604 -0.597 1.00 0.00 C ATOM 697 O PRO A 47 4.631 4.023 0.293 1.00 0.00 O ATOM 698 CB PRO A 47 5.412 4.180 -2.547 1.00 0.00 C ATOM 699 CG PRO A 47 6.009 5.578 -2.255 1.00 0.00 C ATOM 700 CD PRO A 47 4.819 6.527 -2.016 1.00 0.00 C ATOM 0 HA PRO A 47 3.293 3.609 -2.619 1.00 0.00 H new ATOM 0 HB2 PRO A 47 5.998 3.399 -2.062 1.00 0.00 H new ATOM 0 HB3 PRO A 47 5.423 3.969 -3.616 1.00 0.00 H new ATOM 0 HG2 PRO A 47 6.660 5.546 -1.381 1.00 0.00 H new ATOM 0 HG3 PRO A 47 6.616 5.922 -3.092 1.00 0.00 H new ATOM 0 HD2 PRO A 47 4.932 7.080 -1.083 1.00 0.00 H new ATOM 0 HD3 PRO A 47 4.731 7.264 -2.814 1.00 0.00 H new ATOM 708 N GLY A 48 3.067 2.636 -0.382 1.00 0.00 N ATOM 709 CA GLY A 48 2.965 2.026 0.975 1.00 0.00 C ATOM 710 C GLY A 48 2.195 0.704 0.898 1.00 0.00 C ATOM 711 O GLY A 48 2.178 0.044 -0.121 1.00 0.00 O ATOM 0 H GLY A 48 2.441 2.242 -1.085 1.00 0.00 H new ATOM 0 HA2 GLY A 48 3.962 1.853 1.381 1.00 0.00 H new ATOM 0 HA3 GLY A 48 2.459 2.712 1.654 1.00 0.00 H new ATOM 715 N MET A 49 1.558 0.315 1.970 1.00 0.00 N ATOM 716 CA MET A 49 0.789 -0.966 1.961 1.00 0.00 C ATOM 717 C MET A 49 -0.633 -0.714 2.470 1.00 0.00 C ATOM 718 O MET A 49 -1.029 0.413 2.695 1.00 0.00 O ATOM 719 CB MET A 49 1.480 -1.985 2.871 1.00 0.00 C ATOM 720 CG MET A 49 1.577 -1.423 4.289 1.00 0.00 C ATOM 721 SD MET A 49 0.244 -2.108 5.304 1.00 0.00 S ATOM 722 CE MET A 49 0.618 -3.856 5.022 1.00 0.00 C ATOM 0 H MET A 49 1.536 0.828 2.852 1.00 0.00 H new ATOM 0 HA MET A 49 0.748 -1.355 0.943 1.00 0.00 H new ATOM 0 HB2 MET A 49 0.920 -2.920 2.877 1.00 0.00 H new ATOM 0 HB3 MET A 49 2.476 -2.212 2.490 1.00 0.00 H new ATOM 0 HG2 MET A 49 2.545 -1.672 4.725 1.00 0.00 H new ATOM 0 HG3 MET A 49 1.508 -0.335 4.266 1.00 0.00 H new ATOM 0 HE1 MET A 49 0.488 -4.410 5.951 1.00 0.00 H new ATOM 0 HE2 MET A 49 -0.057 -4.255 4.264 1.00 0.00 H new ATOM 0 HE3 MET A 49 1.648 -3.957 4.680 1.00 0.00 H new ATOM 732 N ILE A 50 -1.407 -1.753 2.653 1.00 0.00 N ATOM 733 CA ILE A 50 -2.801 -1.560 3.147 1.00 0.00 C ATOM 734 C ILE A 50 -3.247 -2.794 3.941 1.00 0.00 C ATOM 735 O ILE A 50 -2.859 -3.909 3.657 1.00 0.00 O ATOM 736 CB ILE A 50 -3.741 -1.343 1.951 1.00 0.00 C ATOM 737 CG1 ILE A 50 -3.638 0.112 1.484 1.00 0.00 C ATOM 738 CG2 ILE A 50 -5.190 -1.650 2.354 1.00 0.00 C ATOM 739 CD1 ILE A 50 -4.667 0.371 0.382 1.00 0.00 C ATOM 0 H ILE A 50 -1.135 -2.721 2.482 1.00 0.00 H new ATOM 0 HA ILE A 50 -2.836 -0.687 3.799 1.00 0.00 H new ATOM 0 HB ILE A 50 -3.450 -2.012 1.142 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -3.810 0.787 2.322 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -2.634 0.315 1.113 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -5.847 -1.493 1.498 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -5.264 -2.687 2.683 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -5.489 -0.989 3.167 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -4.592 1.407 0.051 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -4.474 -0.294 -0.460 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -5.669 0.185 0.769 1.00 0.00 H new ATOM 751 N ARG A 51 -4.076 -2.590 4.929 1.00 0.00 N ATOM 752 CA ARG A 51 -4.578 -3.730 5.747 1.00 0.00 C ATOM 753 C ARG A 51 -6.079 -3.537 5.966 1.00 0.00 C ATOM 754 O ARG A 51 -6.512 -2.512 6.455 1.00 0.00 O ATOM 755 CB ARG A 51 -3.855 -3.746 7.096 1.00 0.00 C ATOM 756 CG ARG A 51 -4.340 -4.939 7.922 1.00 0.00 C ATOM 757 CD ARG A 51 -3.285 -6.046 7.886 1.00 0.00 C ATOM 758 NE ARG A 51 -3.959 -7.375 7.894 1.00 0.00 N ATOM 759 CZ ARG A 51 -3.626 -8.270 8.783 1.00 0.00 C ATOM 760 NH1 ARG A 51 -3.811 -8.029 10.051 1.00 0.00 N ATOM 761 NH2 ARG A 51 -3.107 -9.405 8.402 1.00 0.00 N ATOM 0 H ARG A 51 -4.430 -1.674 5.206 1.00 0.00 H new ATOM 0 HA ARG A 51 -4.393 -4.675 5.237 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -2.778 -3.811 6.942 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -4.045 -2.817 7.633 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -4.525 -4.631 8.951 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -5.285 -5.310 7.525 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -2.667 -5.945 6.994 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -2.621 -5.958 8.746 1.00 0.00 H new ATOM 0 HE ARG A 51 -4.681 -7.585 7.204 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -4.216 -7.141 10.348 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -3.551 -8.728 10.746 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -2.962 -9.592 7.410 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -2.846 -10.105 9.096 1.00 0.00 H new ATOM 775 N ILE A 52 -6.887 -4.492 5.590 1.00 0.00 N ATOM 776 CA ILE A 52 -8.356 -4.314 5.766 1.00 0.00 C ATOM 777 C ILE A 52 -8.974 -5.504 6.497 1.00 0.00 C ATOM 778 O ILE A 52 -8.356 -6.535 6.680 1.00 0.00 O ATOM 779 CB ILE A 52 -9.019 -4.175 4.397 1.00 0.00 C ATOM 780 CG1 ILE A 52 -8.264 -3.141 3.557 1.00 0.00 C ATOM 781 CG2 ILE A 52 -10.475 -3.741 4.572 1.00 0.00 C ATOM 782 CD1 ILE A 52 -8.863 -3.090 2.152 1.00 0.00 C ATOM 0 H ILE A 52 -6.598 -5.377 5.174 1.00 0.00 H new ATOM 0 HA ILE A 52 -8.520 -3.416 6.362 1.00 0.00 H new ATOM 0 HB ILE A 52 -8.991 -5.137 3.885 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -8.327 -2.159 4.027 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -7.207 -3.402 3.504 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -10.945 -3.643 3.594 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -11.010 -4.489 5.158 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -10.509 -2.782 5.089 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -8.326 -2.354 1.554 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -8.777 -4.071 1.684 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -9.914 -2.809 2.215 1.00 0.00 H new ATOM 794 N VAL A 53 -10.205 -5.358 6.911 1.00 0.00 N ATOM 795 CA VAL A 53 -10.898 -6.453 7.628 1.00 0.00 C ATOM 796 C VAL A 53 -12.346 -6.540 7.135 1.00 0.00 C ATOM 797 O VAL A 53 -12.924 -5.564 6.687 1.00 0.00 O ATOM 798 CB VAL A 53 -10.892 -6.158 9.126 1.00 0.00 C ATOM 799 CG1 VAL A 53 -11.835 -7.126 9.836 1.00 0.00 C ATOM 800 CG2 VAL A 53 -9.474 -6.327 9.673 1.00 0.00 C ATOM 0 H VAL A 53 -10.761 -4.514 6.778 1.00 0.00 H new ATOM 0 HA VAL A 53 -10.388 -7.397 7.439 1.00 0.00 H new ATOM 0 HB VAL A 53 -11.225 -5.135 9.299 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -11.833 -6.917 10.906 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -12.845 -7.003 9.445 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -11.502 -8.150 9.665 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -9.469 -6.116 10.742 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -9.138 -7.350 9.503 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -8.803 -5.635 9.164 1.00 0.00 H new ATOM 810 N LYS A 54 -12.928 -7.703 7.218 1.00 0.00 N ATOM 811 CA LYS A 54 -14.338 -7.883 6.764 1.00 0.00 C ATOM 812 C LYS A 54 -14.370 -8.046 5.244 1.00 0.00 C ATOM 813 O LYS A 54 -14.583 -9.128 4.736 1.00 0.00 O ATOM 814 CB LYS A 54 -15.175 -6.669 7.175 1.00 0.00 C ATOM 815 CG LYS A 54 -16.650 -7.069 7.244 1.00 0.00 C ATOM 816 CD LYS A 54 -17.329 -6.761 5.907 1.00 0.00 C ATOM 817 CE LYS A 54 -18.222 -7.936 5.503 1.00 0.00 C ATOM 818 NZ LYS A 54 -19.621 -7.674 5.947 1.00 0.00 N ATOM 0 H LYS A 54 -12.484 -8.545 7.584 1.00 0.00 H new ATOM 0 HA LYS A 54 -14.755 -8.776 7.230 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -14.842 -6.295 8.143 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -15.039 -5.860 6.457 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -16.739 -8.131 7.472 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -17.147 -6.527 8.049 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -17.923 -5.851 5.990 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -16.577 -6.581 5.139 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -18.192 -8.074 4.422 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -17.853 -8.858 5.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -20.228 -8.473 5.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -19.642 -7.563 6.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -19.970 -6.803 5.498 1.00 0.00 H new ATOM 832 N GLN A 55 -14.160 -6.983 4.516 1.00 0.00 N ATOM 833 CA GLN A 55 -14.181 -7.083 3.029 1.00 0.00 C ATOM 834 C GLN A 55 -15.359 -7.960 2.590 1.00 0.00 C ATOM 835 O GLN A 55 -16.470 -7.491 2.447 1.00 0.00 O ATOM 836 CB GLN A 55 -12.862 -7.691 2.538 1.00 0.00 C ATOM 837 CG GLN A 55 -12.891 -7.809 1.012 1.00 0.00 C ATOM 838 CD GLN A 55 -12.908 -9.285 0.609 1.00 0.00 C ATOM 839 OE1 GLN A 55 -13.918 -9.792 0.164 1.00 0.00 O ATOM 840 NE2 GLN A 55 -11.825 -10.002 0.743 1.00 0.00 N ATOM 0 H GLN A 55 -13.975 -6.051 4.886 1.00 0.00 H new ATOM 0 HA GLN A 55 -14.298 -6.089 2.598 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -12.024 -7.068 2.849 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -12.713 -8.673 2.987 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -13.771 -7.304 0.615 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -12.019 -7.315 0.583 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -10.976 -9.578 1.116 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -11.828 -10.986 0.474 1.00 0.00 H new ATOM 849 N HIS A 56 -15.135 -9.229 2.380 1.00 0.00 N ATOM 850 CA HIS A 56 -16.253 -10.117 1.955 1.00 0.00 C ATOM 851 C HIS A 56 -15.917 -11.572 2.293 1.00 0.00 C ATOM 852 O HIS A 56 -16.191 -12.474 1.528 1.00 0.00 O ATOM 853 CB HIS A 56 -16.463 -9.982 0.446 1.00 0.00 C ATOM 854 CG HIS A 56 -17.933 -9.859 0.151 1.00 0.00 C ATOM 855 ND1 HIS A 56 -18.406 -9.235 -0.991 1.00 0.00 N ATOM 856 CD2 HIS A 56 -19.045 -10.276 0.839 1.00 0.00 C ATOM 857 CE1 HIS A 56 -19.750 -9.292 -0.958 1.00 0.00 C ATOM 858 NE2 HIS A 56 -20.192 -9.916 0.137 1.00 0.00 N ATOM 0 H HIS A 56 -14.230 -9.687 2.484 1.00 0.00 H new ATOM 0 HA HIS A 56 -17.163 -9.826 2.480 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -15.932 -9.107 0.071 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -16.050 -10.850 -0.068 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -19.032 -10.803 1.782 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -20.393 -8.883 -1.724 1.00 0.00 H new ATOM 0 HE2 HIS A 56 -21.161 -10.091 0.402 1.00 0.00 H new ATOM 866 N GLY A 57 -15.331 -11.810 3.436 1.00 0.00 N ATOM 867 CA GLY A 57 -14.989 -13.210 3.814 1.00 0.00 C ATOM 868 C GLY A 57 -13.916 -13.207 4.903 1.00 0.00 C ATOM 869 O GLY A 57 -13.916 -14.039 5.789 1.00 0.00 O ATOM 0 H GLY A 57 -15.076 -11.098 4.121 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -15.880 -13.728 4.170 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -14.631 -13.755 2.940 1.00 0.00 H new ATOM 873 N HIS A 58 -12.996 -12.284 4.848 1.00 0.00 N ATOM 874 CA HIS A 58 -11.924 -12.240 5.882 1.00 0.00 C ATOM 875 C HIS A 58 -11.141 -10.932 5.752 1.00 0.00 C ATOM 876 O HIS A 58 -11.672 -9.916 5.347 1.00 0.00 O ATOM 877 CB HIS A 58 -10.977 -13.423 5.675 1.00 0.00 C ATOM 878 CG HIS A 58 -10.459 -13.897 7.005 1.00 0.00 C ATOM 879 ND1 HIS A 58 -10.257 -13.035 8.072 1.00 0.00 N ATOM 880 CD2 HIS A 58 -10.094 -15.142 7.455 1.00 0.00 C ATOM 881 CE1 HIS A 58 -9.791 -13.766 9.102 1.00 0.00 C ATOM 882 NE2 HIS A 58 -9.673 -15.057 8.778 1.00 0.00 N ATOM 0 H HIS A 58 -12.940 -11.559 4.133 1.00 0.00 H new ATOM 0 HA HIS A 58 -12.371 -12.296 6.875 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -11.499 -14.234 5.167 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -10.146 -13.128 5.034 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -10.129 -16.049 6.870 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -9.543 -13.359 10.071 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -9.345 -15.817 9.373 1.00 0.00 H new ATOM 890 N GLU A 59 -9.881 -10.948 6.092 1.00 0.00 N ATOM 891 CA GLU A 59 -9.064 -9.706 5.988 1.00 0.00 C ATOM 892 C GLU A 59 -8.201 -9.766 4.725 1.00 0.00 C ATOM 893 O GLU A 59 -7.964 -10.822 4.173 1.00 0.00 O ATOM 894 CB GLU A 59 -8.159 -9.587 7.216 1.00 0.00 C ATOM 895 CG GLU A 59 -7.045 -10.632 7.133 1.00 0.00 C ATOM 896 CD GLU A 59 -7.060 -11.497 8.395 1.00 0.00 C ATOM 897 OE1 GLU A 59 -8.137 -11.726 8.921 1.00 0.00 O ATOM 898 OE2 GLU A 59 -5.994 -11.916 8.813 1.00 0.00 O ATOM 0 H GLU A 59 -9.382 -11.768 6.437 1.00 0.00 H new ATOM 0 HA GLU A 59 -9.725 -8.841 5.936 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -7.730 -8.586 7.269 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -8.742 -9.733 8.126 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -7.183 -11.256 6.250 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -6.078 -10.140 7.028 1.00 0.00 H new ATOM 905 N GLU A 60 -7.728 -8.641 4.265 1.00 0.00 N ATOM 906 CA GLU A 60 -6.878 -8.631 3.041 1.00 0.00 C ATOM 907 C GLU A 60 -6.061 -7.337 2.999 1.00 0.00 C ATOM 908 O GLU A 60 -6.550 -6.274 3.322 1.00 0.00 O ATOM 909 CB GLU A 60 -7.770 -8.710 1.801 1.00 0.00 C ATOM 910 CG GLU A 60 -8.713 -7.506 1.775 1.00 0.00 C ATOM 911 CD GLU A 60 -8.404 -6.640 0.553 1.00 0.00 C ATOM 912 OE1 GLU A 60 -7.255 -6.614 0.145 1.00 0.00 O ATOM 913 OE2 GLU A 60 -9.321 -6.014 0.048 1.00 0.00 O ATOM 0 H GLU A 60 -7.894 -7.726 4.685 1.00 0.00 H new ATOM 0 HA GLU A 60 -6.204 -9.487 3.059 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -7.158 -8.726 0.899 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -8.345 -9.636 1.812 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -9.749 -7.843 1.742 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -8.597 -6.921 2.687 1.00 0.00 H new ATOM 920 N PHE A 61 -4.819 -7.420 2.604 1.00 0.00 N ATOM 921 CA PHE A 61 -3.973 -6.192 2.544 1.00 0.00 C ATOM 922 C PHE A 61 -3.690 -5.834 1.084 1.00 0.00 C ATOM 923 O PHE A 61 -3.666 -6.687 0.218 1.00 0.00 O ATOM 924 CB PHE A 61 -2.650 -6.449 3.266 1.00 0.00 C ATOM 925 CG PHE A 61 -2.224 -7.878 3.040 1.00 0.00 C ATOM 926 CD1 PHE A 61 -1.665 -8.253 1.815 1.00 0.00 C ATOM 927 CD2 PHE A 61 -2.389 -8.827 4.056 1.00 0.00 C ATOM 928 CE1 PHE A 61 -1.269 -9.579 1.602 1.00 0.00 C ATOM 929 CE2 PHE A 61 -1.993 -10.153 3.844 1.00 0.00 C ATOM 930 CZ PHE A 61 -1.434 -10.530 2.617 1.00 0.00 C ATOM 0 H PHE A 61 -4.354 -8.283 2.321 1.00 0.00 H new ATOM 0 HA PHE A 61 -4.499 -5.368 3.025 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -1.884 -5.767 2.897 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -2.762 -6.256 4.333 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -1.538 -7.520 1.032 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -2.821 -8.537 5.002 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -0.837 -9.868 0.656 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -2.119 -10.886 4.628 1.00 0.00 H new ATOM 0 HZ PHE A 61 -1.130 -11.553 2.453 1.00 0.00 H new ATOM 940 N ILE A 62 -3.468 -4.578 0.805 1.00 0.00 N ATOM 941 CA ILE A 62 -3.178 -4.165 -0.596 1.00 0.00 C ATOM 942 C ILE A 62 -1.893 -3.338 -0.622 1.00 0.00 C ATOM 943 O ILE A 62 -1.611 -2.583 0.286 1.00 0.00 O ATOM 944 CB ILE A 62 -4.333 -3.321 -1.136 1.00 0.00 C ATOM 945 CG1 ILE A 62 -5.632 -4.126 -1.055 1.00 0.00 C ATOM 946 CG2 ILE A 62 -4.054 -2.946 -2.592 1.00 0.00 C ATOM 947 CD1 ILE A 62 -6.791 -3.188 -0.713 1.00 0.00 C ATOM 0 H ILE A 62 -3.475 -3.820 1.488 1.00 0.00 H new ATOM 0 HA ILE A 62 -3.059 -5.053 -1.217 1.00 0.00 H new ATOM 0 HB ILE A 62 -4.430 -2.413 -0.541 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -5.823 -4.626 -2.005 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -5.544 -4.904 -0.297 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -4.877 -2.344 -2.977 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -3.128 -2.373 -2.649 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -3.957 -3.853 -3.189 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -7.717 -3.760 -0.655 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -6.600 -2.709 0.247 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -6.883 -2.426 -1.487 1.00 0.00 H new ATOM 959 N TYR A 63 -1.113 -3.474 -1.656 1.00 0.00 N ATOM 960 CA TYR A 63 0.151 -2.693 -1.738 1.00 0.00 C ATOM 961 C TYR A 63 0.059 -1.694 -2.893 1.00 0.00 C ATOM 962 O TYR A 63 -0.299 -2.041 -4.001 1.00 0.00 O ATOM 963 CB TYR A 63 1.323 -3.651 -1.970 1.00 0.00 C ATOM 964 CG TYR A 63 2.538 -2.868 -2.406 1.00 0.00 C ATOM 965 CD1 TYR A 63 2.735 -2.585 -3.761 1.00 0.00 C ATOM 966 CD2 TYR A 63 3.463 -2.425 -1.455 1.00 0.00 C ATOM 967 CE1 TYR A 63 3.859 -1.858 -4.168 1.00 0.00 C ATOM 968 CE2 TYR A 63 4.588 -1.697 -1.861 1.00 0.00 C ATOM 969 CZ TYR A 63 4.787 -1.413 -3.218 1.00 0.00 C ATOM 970 OH TYR A 63 5.894 -0.695 -3.618 1.00 0.00 O ATOM 0 H TYR A 63 -1.296 -4.091 -2.447 1.00 0.00 H new ATOM 0 HA TYR A 63 0.309 -2.149 -0.807 1.00 0.00 H new ATOM 0 HB2 TYR A 63 1.542 -4.202 -1.055 1.00 0.00 H new ATOM 0 HB3 TYR A 63 1.060 -4.387 -2.730 1.00 0.00 H new ATOM 0 HD1 TYR A 63 2.019 -2.928 -4.494 1.00 0.00 H new ATOM 0 HD2 TYR A 63 3.310 -2.644 -0.409 1.00 0.00 H new ATOM 0 HE1 TYR A 63 4.011 -1.640 -5.215 1.00 0.00 H new ATOM 0 HE2 TYR A 63 5.303 -1.354 -1.127 1.00 0.00 H new ATOM 0 HH TYR A 63 6.632 -1.311 -3.808 1.00 0.00 H new ATOM 980 N LEU A 64 0.378 -0.453 -2.641 1.00 0.00 N ATOM 981 CA LEU A 64 0.309 0.571 -3.721 1.00 0.00 C ATOM 982 C LEU A 64 1.687 1.207 -3.910 1.00 0.00 C ATOM 983 O LEU A 64 2.609 0.947 -3.163 1.00 0.00 O ATOM 984 CB LEU A 64 -0.700 1.651 -3.328 1.00 0.00 C ATOM 985 CG LEU A 64 -2.032 1.388 -4.032 1.00 0.00 C ATOM 986 CD1 LEU A 64 -3.147 2.151 -3.314 1.00 0.00 C ATOM 987 CD2 LEU A 64 -1.942 1.864 -5.483 1.00 0.00 C ATOM 0 H LEU A 64 0.684 -0.105 -1.732 1.00 0.00 H new ATOM 0 HA LEU A 64 -0.003 0.099 -4.653 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -0.842 1.654 -2.247 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -0.320 2.635 -3.602 1.00 0.00 H new ATOM 0 HG LEU A 64 -2.251 0.320 -4.011 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -4.097 1.964 -3.815 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -3.210 1.814 -2.279 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -2.929 3.219 -3.335 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -2.890 1.677 -5.987 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -1.725 2.932 -5.503 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -1.147 1.322 -5.995 1.00 0.00 H new ATOM 999 N SER A 65 1.833 2.041 -4.903 1.00 0.00 N ATOM 1000 CA SER A 65 3.151 2.697 -5.140 1.00 0.00 C ATOM 1001 C SER A 65 2.964 4.214 -5.179 1.00 0.00 C ATOM 1002 O SER A 65 3.795 4.964 -4.706 1.00 0.00 O ATOM 1003 CB SER A 65 3.726 2.220 -6.474 1.00 0.00 C ATOM 1004 OG SER A 65 3.273 3.076 -7.514 1.00 0.00 O ATOM 0 H SER A 65 1.097 2.297 -5.561 1.00 0.00 H new ATOM 0 HA SER A 65 3.837 2.435 -4.335 1.00 0.00 H new ATOM 0 HB2 SER A 65 4.815 2.221 -6.435 1.00 0.00 H new ATOM 0 HB3 SER A 65 3.415 1.194 -6.671 1.00 0.00 H new ATOM 0 HG SER A 65 3.900 3.038 -8.266 1.00 0.00 H new ATOM 1010 N GLY A 66 1.879 4.674 -5.738 1.00 0.00 N ATOM 1011 CA GLY A 66 1.643 6.145 -5.805 1.00 0.00 C ATOM 1012 C GLY A 66 0.429 6.431 -6.689 1.00 0.00 C ATOM 1013 O GLY A 66 0.190 5.756 -7.671 1.00 0.00 O ATOM 0 H GLY A 66 1.146 4.097 -6.151 1.00 0.00 H new ATOM 0 HA2 GLY A 66 1.478 6.543 -4.804 1.00 0.00 H new ATOM 0 HA3 GLY A 66 2.524 6.647 -6.206 1.00 0.00 H new ATOM 1017 N GLY A 67 -0.341 7.430 -6.351 1.00 0.00 N ATOM 1018 CA GLY A 67 -1.539 7.760 -7.175 1.00 0.00 C ATOM 1019 C GLY A 67 -2.423 8.760 -6.424 1.00 0.00 C ATOM 1020 O GLY A 67 -2.063 9.256 -5.373 1.00 0.00 O ATOM 0 H GLY A 67 -0.192 8.031 -5.541 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.230 8.181 -8.132 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -2.103 6.853 -7.393 1.00 0.00 H new ATOM 1024 N ILE A 68 -3.579 9.055 -6.954 1.00 0.00 N ATOM 1025 CA ILE A 68 -4.492 10.019 -6.274 1.00 0.00 C ATOM 1026 C ILE A 68 -5.558 9.239 -5.503 1.00 0.00 C ATOM 1027 O ILE A 68 -5.892 8.124 -5.849 1.00 0.00 O ATOM 1028 CB ILE A 68 -5.164 10.907 -7.326 1.00 0.00 C ATOM 1029 CG1 ILE A 68 -4.088 11.610 -8.161 1.00 0.00 C ATOM 1030 CG2 ILE A 68 -6.035 11.958 -6.636 1.00 0.00 C ATOM 1031 CD1 ILE A 68 -4.755 12.466 -9.240 1.00 0.00 C ATOM 0 H ILE A 68 -3.931 8.670 -7.830 1.00 0.00 H new ATOM 0 HA ILE A 68 -3.925 10.643 -5.583 1.00 0.00 H new ATOM 0 HB ILE A 68 -5.787 10.289 -7.973 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -3.466 12.234 -7.520 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -3.431 10.872 -8.622 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -6.511 12.587 -7.388 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -6.801 11.462 -6.041 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -5.414 12.575 -5.987 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -3.989 12.966 -9.833 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -5.358 11.830 -9.888 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -5.393 13.213 -8.769 1.00 0.00 H new ATOM 1043 N LEU A 69 -6.090 9.803 -4.452 1.00 0.00 N ATOM 1044 CA LEU A 69 -7.120 9.068 -3.665 1.00 0.00 C ATOM 1045 C LEU A 69 -8.332 9.966 -3.392 1.00 0.00 C ATOM 1046 O LEU A 69 -8.243 11.178 -3.402 1.00 0.00 O ATOM 1047 CB LEU A 69 -6.514 8.619 -2.334 1.00 0.00 C ATOM 1048 CG LEU A 69 -6.351 9.827 -1.410 1.00 0.00 C ATOM 1049 CD1 LEU A 69 -7.661 10.080 -0.664 1.00 0.00 C ATOM 1050 CD2 LEU A 69 -5.235 9.549 -0.400 1.00 0.00 C ATOM 0 H LEU A 69 -5.858 10.734 -4.107 1.00 0.00 H new ATOM 0 HA LEU A 69 -7.447 8.201 -4.239 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -7.155 7.873 -1.864 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -5.547 8.146 -2.505 1.00 0.00 H new ATOM 0 HG LEU A 69 -6.095 10.705 -2.003 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -7.544 10.941 -0.006 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -8.457 10.278 -1.382 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.918 9.202 -0.071 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -5.118 10.409 0.259 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -5.491 8.670 0.192 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -4.300 9.369 -0.931 1.00 0.00 H new ATOM 1062 N GLU A 70 -9.462 9.364 -3.134 1.00 0.00 N ATOM 1063 CA GLU A 70 -10.696 10.144 -2.839 1.00 0.00 C ATOM 1064 C GLU A 70 -11.580 9.311 -1.910 1.00 0.00 C ATOM 1065 O GLU A 70 -12.045 8.251 -2.273 1.00 0.00 O ATOM 1066 CB GLU A 70 -11.448 10.441 -4.140 1.00 0.00 C ATOM 1067 CG GLU A 70 -11.623 9.149 -4.944 1.00 0.00 C ATOM 1068 CD GLU A 70 -12.428 9.442 -6.211 1.00 0.00 C ATOM 1069 OE1 GLU A 70 -13.641 9.521 -6.113 1.00 0.00 O ATOM 1070 OE2 GLU A 70 -11.816 9.585 -7.258 1.00 0.00 O ATOM 0 H GLU A 70 -9.583 8.351 -3.115 1.00 0.00 H new ATOM 0 HA GLU A 70 -10.436 11.090 -2.363 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.422 10.876 -3.917 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -10.898 11.175 -4.729 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -10.649 8.737 -5.207 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -12.134 8.399 -4.341 1.00 0.00 H new ATOM 1077 N VAL A 71 -11.796 9.759 -0.705 1.00 0.00 N ATOM 1078 CA VAL A 71 -12.628 8.961 0.240 1.00 0.00 C ATOM 1079 C VAL A 71 -14.025 9.571 0.379 1.00 0.00 C ATOM 1080 O VAL A 71 -14.217 10.762 0.234 1.00 0.00 O ATOM 1081 CB VAL A 71 -11.949 8.937 1.609 1.00 0.00 C ATOM 1082 CG1 VAL A 71 -12.063 10.316 2.256 1.00 0.00 C ATOM 1083 CG2 VAL A 71 -12.631 7.897 2.500 1.00 0.00 C ATOM 0 H VAL A 71 -11.435 10.638 -0.334 1.00 0.00 H new ATOM 0 HA VAL A 71 -12.727 7.948 -0.149 1.00 0.00 H new ATOM 0 HB VAL A 71 -10.897 8.677 1.489 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -11.579 10.301 3.233 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -11.577 11.057 1.622 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -13.115 10.576 2.376 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -12.146 7.880 3.476 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -13.683 8.156 2.621 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -12.550 6.913 2.038 1.00 0.00 H new ATOM 1093 N GLN A 72 -14.997 8.752 0.674 1.00 0.00 N ATOM 1094 CA GLN A 72 -16.390 9.255 0.843 1.00 0.00 C ATOM 1095 C GLN A 72 -16.999 8.586 2.081 1.00 0.00 C ATOM 1096 O GLN A 72 -16.348 7.790 2.728 1.00 0.00 O ATOM 1097 CB GLN A 72 -17.220 8.915 -0.402 1.00 0.00 C ATOM 1098 CG GLN A 72 -16.307 8.792 -1.624 1.00 0.00 C ATOM 1099 CD GLN A 72 -15.824 10.182 -2.041 1.00 0.00 C ATOM 1100 OE1 GLN A 72 -16.207 11.172 -1.449 1.00 0.00 O ATOM 1101 NE2 GLN A 72 -14.996 10.300 -3.042 1.00 0.00 N ATOM 0 H GLN A 72 -14.885 7.747 0.806 1.00 0.00 H new ATOM 0 HA GLN A 72 -16.386 10.337 0.971 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -17.759 7.981 -0.245 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -17.968 9.690 -0.573 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -15.455 8.154 -1.392 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -16.844 8.320 -2.447 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -14.675 9.469 -3.539 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -14.670 11.223 -3.328 1.00 0.00 H new ATOM 1110 N PRO A 73 -18.224 8.931 2.383 1.00 0.00 N ATOM 1111 CA PRO A 73 -18.934 8.381 3.552 1.00 0.00 C ATOM 1112 C PRO A 73 -19.479 6.981 3.250 1.00 0.00 C ATOM 1113 O PRO A 73 -20.492 6.827 2.597 1.00 0.00 O ATOM 1114 CB PRO A 73 -20.075 9.376 3.776 1.00 0.00 C ATOM 1115 CG PRO A 73 -20.300 10.096 2.425 1.00 0.00 C ATOM 1116 CD PRO A 73 -19.015 9.896 1.597 1.00 0.00 C ATOM 0 HA PRO A 73 -18.292 8.267 4.426 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -20.981 8.862 4.097 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -19.819 10.090 4.559 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -21.164 9.682 1.905 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -20.499 11.156 2.580 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -19.238 9.511 0.602 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -18.478 10.835 1.462 1.00 0.00 H new ATOM 1124 N GLY A 74 -18.820 5.961 3.730 1.00 0.00 N ATOM 1125 CA GLY A 74 -19.305 4.574 3.481 1.00 0.00 C ATOM 1126 C GLY A 74 -18.895 4.120 2.078 1.00 0.00 C ATOM 1127 O GLY A 74 -19.610 3.392 1.418 1.00 0.00 O ATOM 0 H GLY A 74 -17.966 6.029 4.284 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -18.891 3.896 4.227 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -20.390 4.536 3.582 1.00 0.00 H new ATOM 1131 N ASN A 75 -17.748 4.539 1.618 1.00 0.00 N ATOM 1132 CA ASN A 75 -17.296 4.123 0.260 1.00 0.00 C ATOM 1133 C ASN A 75 -16.044 4.916 -0.123 1.00 0.00 C ATOM 1134 O ASN A 75 -16.097 6.106 -0.358 1.00 0.00 O ATOM 1135 CB ASN A 75 -18.415 4.390 -0.760 1.00 0.00 C ATOM 1136 CG ASN A 75 -17.840 4.382 -2.180 1.00 0.00 C ATOM 1137 OD1 ASN A 75 -16.822 3.769 -2.432 1.00 0.00 O ATOM 1138 ND2 ASN A 75 -18.454 5.042 -3.123 1.00 0.00 N ATOM 0 H ASN A 75 -17.106 5.150 2.122 1.00 0.00 H new ATOM 0 HA ASN A 75 -17.062 3.058 0.263 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -19.191 3.630 -0.668 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -18.885 5.352 -0.554 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -18.079 5.043 -4.072 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -19.309 5.557 -2.912 1.00 0.00 H new ATOM 1145 N VAL A 76 -14.917 4.261 -0.192 1.00 0.00 N ATOM 1146 CA VAL A 76 -13.665 4.975 -0.565 1.00 0.00 C ATOM 1147 C VAL A 76 -13.183 4.473 -1.930 1.00 0.00 C ATOM 1148 O VAL A 76 -13.449 3.352 -2.318 1.00 0.00 O ATOM 1149 CB VAL A 76 -12.592 4.718 0.498 1.00 0.00 C ATOM 1150 CG1 VAL A 76 -13.221 4.806 1.889 1.00 0.00 C ATOM 1151 CG2 VAL A 76 -11.992 3.323 0.305 1.00 0.00 C ATOM 0 H VAL A 76 -14.810 3.264 -0.006 1.00 0.00 H new ATOM 0 HA VAL A 76 -13.856 6.046 -0.624 1.00 0.00 H new ATOM 0 HB VAL A 76 -11.806 5.467 0.400 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -12.458 4.623 2.646 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -13.645 5.799 2.034 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -14.009 4.058 1.980 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -11.230 3.147 1.064 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -12.777 2.573 0.398 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -11.541 3.255 -0.685 1.00 0.00 H new ATOM 1161 N THR A 77 -12.479 5.293 -2.657 1.00 0.00 N ATOM 1162 CA THR A 77 -11.980 4.868 -3.994 1.00 0.00 C ATOM 1163 C THR A 77 -10.703 5.642 -4.326 1.00 0.00 C ATOM 1164 O THR A 77 -10.619 6.837 -4.119 1.00 0.00 O ATOM 1165 CB THR A 77 -13.045 5.162 -5.053 1.00 0.00 C ATOM 1166 OG1 THR A 77 -14.240 4.466 -4.728 1.00 0.00 O ATOM 1167 CG2 THR A 77 -12.545 4.711 -6.425 1.00 0.00 C ATOM 0 H THR A 77 -12.227 6.242 -2.382 1.00 0.00 H new ATOM 0 HA THR A 77 -11.767 3.799 -3.982 1.00 0.00 H new ATOM 0 HB THR A 77 -13.244 6.233 -5.078 1.00 0.00 H new ATOM 0 HG1 THR A 77 -14.923 4.655 -5.405 1.00 0.00 H new ATOM 0 HG21 THR A 77 -13.306 4.922 -7.177 1.00 0.00 H new ATOM 0 HG22 THR A 77 -11.630 5.249 -6.674 1.00 0.00 H new ATOM 0 HG23 THR A 77 -12.342 3.640 -6.404 1.00 0.00 H new ATOM 1175 N VAL A 78 -9.708 4.974 -4.838 1.00 0.00 N ATOM 1176 CA VAL A 78 -8.440 5.675 -5.180 1.00 0.00 C ATOM 1177 C VAL A 78 -7.835 5.051 -6.439 1.00 0.00 C ATOM 1178 O VAL A 78 -7.973 3.868 -6.685 1.00 0.00 O ATOM 1179 CB VAL A 78 -7.458 5.546 -4.013 1.00 0.00 C ATOM 1180 CG1 VAL A 78 -8.192 5.821 -2.699 1.00 0.00 C ATOM 1181 CG2 VAL A 78 -6.878 4.130 -3.983 1.00 0.00 C ATOM 0 H VAL A 78 -9.718 3.973 -5.034 1.00 0.00 H new ATOM 0 HA VAL A 78 -8.643 6.730 -5.365 1.00 0.00 H new ATOM 0 HB VAL A 78 -6.650 6.266 -4.139 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -7.494 5.730 -1.867 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -8.605 6.830 -2.717 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -9.000 5.100 -2.576 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -6.179 4.041 -3.151 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -7.685 3.409 -3.858 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -6.356 3.931 -4.919 1.00 0.00 H new ATOM 1191 N LEU A 79 -7.169 5.835 -7.239 1.00 0.00 N ATOM 1192 CA LEU A 79 -6.557 5.286 -8.482 1.00 0.00 C ATOM 1193 C LEU A 79 -5.038 5.452 -8.417 1.00 0.00 C ATOM 1194 O LEU A 79 -4.533 6.438 -7.920 1.00 0.00 O ATOM 1195 CB LEU A 79 -7.104 6.043 -9.694 1.00 0.00 C ATOM 1196 CG LEU A 79 -8.631 5.966 -9.694 1.00 0.00 C ATOM 1197 CD1 LEU A 79 -9.215 7.376 -9.602 1.00 0.00 C ATOM 1198 CD2 LEU A 79 -9.106 5.301 -10.988 1.00 0.00 C ATOM 0 H LEU A 79 -7.021 6.833 -7.087 1.00 0.00 H new ATOM 0 HA LEU A 79 -6.802 4.228 -8.574 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -6.781 7.084 -9.663 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -6.707 5.614 -10.614 1.00 0.00 H new ATOM 0 HG LEU A 79 -8.965 5.380 -8.838 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -10.304 7.320 -9.602 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -8.876 7.851 -8.681 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -8.882 7.964 -10.457 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -10.195 5.245 -10.990 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -8.771 5.888 -11.843 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -8.691 4.295 -11.054 1.00 0.00 H new ATOM 1210 N ALA A 80 -4.307 4.494 -8.914 1.00 0.00 N ATOM 1211 CA ALA A 80 -2.822 4.595 -8.880 1.00 0.00 C ATOM 1212 C ALA A 80 -2.247 4.090 -10.205 1.00 0.00 C ATOM 1213 O ALA A 80 -2.971 3.680 -11.089 1.00 0.00 O ATOM 1214 CB ALA A 80 -2.279 3.743 -7.732 1.00 0.00 C ATOM 0 H ALA A 80 -4.674 3.645 -9.343 1.00 0.00 H new ATOM 0 HA ALA A 80 -2.532 5.635 -8.730 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -1.192 3.817 -7.707 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -2.689 4.101 -6.788 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -2.569 2.703 -7.882 1.00 0.00 H new ATOM 1220 N ASP A 81 -0.951 4.116 -10.349 1.00 0.00 N ATOM 1221 CA ASP A 81 -0.335 3.637 -11.618 1.00 0.00 C ATOM 1222 C ASP A 81 0.200 2.217 -11.425 1.00 0.00 C ATOM 1223 O ASP A 81 0.176 1.406 -12.330 1.00 0.00 O ATOM 1224 CB ASP A 81 0.818 4.564 -12.010 1.00 0.00 C ATOM 1225 CG ASP A 81 1.197 4.319 -13.473 1.00 0.00 C ATOM 1226 OD1 ASP A 81 0.317 3.968 -14.241 1.00 0.00 O ATOM 1227 OD2 ASP A 81 2.360 4.488 -13.799 1.00 0.00 O ATOM 0 H ASP A 81 -0.293 4.448 -9.644 1.00 0.00 H new ATOM 0 HA ASP A 81 -1.088 3.638 -12.406 1.00 0.00 H new ATOM 0 HB2 ASP A 81 0.526 5.605 -11.868 1.00 0.00 H new ATOM 0 HB3 ASP A 81 1.678 4.384 -11.366 1.00 0.00 H new ATOM 1232 N THR A 82 0.684 1.907 -10.254 1.00 0.00 N ATOM 1233 CA THR A 82 1.222 0.541 -10.011 1.00 0.00 C ATOM 1234 C THR A 82 0.412 -0.145 -8.909 1.00 0.00 C ATOM 1235 O THR A 82 -0.080 0.489 -7.997 1.00 0.00 O ATOM 1236 CB THR A 82 2.685 0.641 -9.577 1.00 0.00 C ATOM 1237 OG1 THR A 82 3.482 1.023 -10.688 1.00 0.00 O ATOM 1238 CG2 THR A 82 3.154 -0.715 -9.052 1.00 0.00 C ATOM 0 H THR A 82 0.730 2.541 -9.456 1.00 0.00 H new ATOM 0 HA THR A 82 1.150 -0.043 -10.929 1.00 0.00 H new ATOM 0 HB THR A 82 2.781 1.387 -8.788 1.00 0.00 H new ATOM 0 HG1 THR A 82 4.420 1.089 -10.411 1.00 0.00 H new ATOM 0 HG21 THR A 82 4.197 -0.644 -8.742 1.00 0.00 H new ATOM 0 HG22 THR A 82 2.541 -1.007 -8.199 1.00 0.00 H new ATOM 0 HG23 THR A 82 3.059 -1.463 -9.839 1.00 0.00 H new ATOM 1246 N ALA A 83 0.276 -1.439 -8.988 1.00 0.00 N ATOM 1247 CA ALA A 83 -0.495 -2.177 -7.949 1.00 0.00 C ATOM 1248 C ALA A 83 0.178 -3.526 -7.690 1.00 0.00 C ATOM 1249 O ALA A 83 -0.101 -4.506 -8.352 1.00 0.00 O ATOM 1250 CB ALA A 83 -1.925 -2.407 -8.442 1.00 0.00 C ATOM 0 H ALA A 83 0.667 -2.019 -9.730 1.00 0.00 H new ATOM 0 HA ALA A 83 -0.520 -1.595 -7.027 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -2.489 -2.947 -7.682 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -2.403 -1.446 -8.634 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -1.903 -2.992 -9.362 1.00 0.00 H new ATOM 1256 N ILE A 84 1.067 -3.584 -6.735 1.00 0.00 N ATOM 1257 CA ILE A 84 1.756 -4.870 -6.444 1.00 0.00 C ATOM 1258 C ILE A 84 1.081 -5.543 -5.249 1.00 0.00 C ATOM 1259 O ILE A 84 1.721 -5.911 -4.284 1.00 0.00 O ATOM 1260 CB ILE A 84 3.226 -4.601 -6.119 1.00 0.00 C ATOM 1261 CG1 ILE A 84 3.714 -3.389 -6.918 1.00 0.00 C ATOM 1262 CG2 ILE A 84 4.058 -5.822 -6.499 1.00 0.00 C ATOM 1263 CD1 ILE A 84 5.190 -3.133 -6.610 1.00 0.00 C ATOM 0 H ILE A 84 1.344 -2.798 -6.147 1.00 0.00 H new ATOM 0 HA ILE A 84 1.694 -5.524 -7.314 1.00 0.00 H new ATOM 0 HB ILE A 84 3.331 -4.401 -5.053 1.00 0.00 H new ATOM 0 HG12 ILE A 84 3.580 -3.566 -7.985 1.00 0.00 H new ATOM 0 HG13 ILE A 84 3.121 -2.510 -6.664 1.00 0.00 H new ATOM 0 HG21 ILE A 84 5.107 -5.634 -6.269 1.00 0.00 H new ATOM 0 HG22 ILE A 84 3.712 -6.688 -5.934 1.00 0.00 H new ATOM 0 HG23 ILE A 84 3.950 -6.018 -7.566 1.00 0.00 H new ATOM 0 HD11 ILE A 84 5.536 -2.270 -7.179 1.00 0.00 H new ATOM 0 HD12 ILE A 84 5.311 -2.937 -5.545 1.00 0.00 H new ATOM 0 HD13 ILE A 84 5.777 -4.009 -6.886 1.00 0.00 H new ATOM 1275 N ARG A 85 -0.213 -5.708 -5.312 1.00 0.00 N ATOM 1276 CA ARG A 85 -0.946 -6.360 -4.191 1.00 0.00 C ATOM 1277 C ARG A 85 -0.147 -7.565 -3.692 1.00 0.00 C ATOM 1278 O ARG A 85 0.534 -8.226 -4.451 1.00 0.00 O ATOM 1279 CB ARG A 85 -2.317 -6.821 -4.692 1.00 0.00 C ATOM 1280 CG ARG A 85 -3.075 -7.519 -3.561 1.00 0.00 C ATOM 1281 CD ARG A 85 -4.169 -8.406 -4.159 1.00 0.00 C ATOM 1282 NE ARG A 85 -4.851 -9.164 -3.072 1.00 0.00 N ATOM 1283 CZ ARG A 85 -5.584 -10.204 -3.365 1.00 0.00 C ATOM 1284 NH1 ARG A 85 -6.627 -10.070 -4.138 1.00 0.00 N ATOM 1285 NH2 ARG A 85 -5.273 -11.377 -2.885 1.00 0.00 N ATOM 0 H ARG A 85 -0.796 -5.417 -6.097 1.00 0.00 H new ATOM 0 HA ARG A 85 -1.075 -5.652 -3.372 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -2.889 -5.966 -5.052 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -2.196 -7.501 -5.535 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -2.389 -8.120 -2.964 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -3.515 -6.780 -2.892 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -4.892 -7.794 -4.698 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -3.735 -9.098 -4.881 1.00 0.00 H new ATOM 0 HE ARG A 85 -4.745 -8.871 -2.101 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -6.869 -9.153 -4.513 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -7.200 -10.882 -4.367 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -4.458 -11.481 -2.281 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -5.845 -12.190 -3.114 1.00 0.00 H new ATOM 1299 N GLY A 86 -0.221 -7.853 -2.421 1.00 0.00 N ATOM 1300 CA GLY A 86 0.539 -9.014 -1.873 1.00 0.00 C ATOM 1301 C GLY A 86 0.414 -10.206 -2.824 1.00 0.00 C ATOM 1302 O GLY A 86 1.317 -11.010 -2.949 1.00 0.00 O ATOM 0 H GLY A 86 -0.774 -7.335 -1.738 1.00 0.00 H new ATOM 0 HA2 GLY A 86 1.588 -8.747 -1.745 1.00 0.00 H new ATOM 0 HA3 GLY A 86 0.155 -9.280 -0.888 1.00 0.00 H new ATOM 1306 N GLN A 87 -0.700 -10.331 -3.493 1.00 0.00 N ATOM 1307 CA GLN A 87 -0.881 -11.470 -4.431 1.00 0.00 C ATOM 1308 C GLN A 87 -0.905 -10.950 -5.871 1.00 0.00 C ATOM 1309 O GLN A 87 -1.901 -11.047 -6.560 1.00 0.00 O ATOM 1310 CB GLN A 87 -2.202 -12.171 -4.120 1.00 0.00 C ATOM 1311 CG GLN A 87 -2.232 -13.526 -4.824 1.00 0.00 C ATOM 1312 CD GLN A 87 -3.248 -14.439 -4.136 1.00 0.00 C ATOM 1313 OE1 GLN A 87 -4.339 -14.636 -4.631 1.00 0.00 O ATOM 1314 NE2 GLN A 87 -2.932 -15.009 -3.005 1.00 0.00 N ATOM 0 H GLN A 87 -1.492 -9.692 -3.429 1.00 0.00 H new ATOM 0 HA GLN A 87 -0.056 -12.173 -4.316 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -2.311 -12.305 -3.044 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -3.040 -11.557 -4.452 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -2.497 -13.396 -5.873 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -1.242 -13.982 -4.799 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -2.015 -14.844 -2.589 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -3.602 -15.620 -2.537 1.00 0.00 H new ATOM 1323 N ASP A 88 0.186 -10.399 -6.329 1.00 0.00 N ATOM 1324 CA ASP A 88 0.228 -9.872 -7.723 1.00 0.00 C ATOM 1325 C ASP A 88 1.457 -10.432 -8.443 1.00 0.00 C ATOM 1326 O ASP A 88 1.376 -11.407 -9.164 1.00 0.00 O ATOM 1327 CB ASP A 88 0.311 -8.344 -7.687 1.00 0.00 C ATOM 1328 CG ASP A 88 -0.968 -7.748 -8.278 1.00 0.00 C ATOM 1329 OD1 ASP A 88 -1.339 -8.154 -9.367 1.00 0.00 O ATOM 1330 OD2 ASP A 88 -1.555 -6.896 -7.632 1.00 0.00 O ATOM 0 H ASP A 88 1.050 -10.291 -5.798 1.00 0.00 H new ATOM 0 HA ASP A 88 -0.674 -10.175 -8.254 1.00 0.00 H new ATOM 0 HB2 ASP A 88 0.444 -8.001 -6.661 1.00 0.00 H new ATOM 0 HB3 ASP A 88 1.178 -8.003 -8.252 1.00 0.00 H new ATOM 1335 N LEU A 89 2.595 -9.824 -8.251 1.00 0.00 N ATOM 1336 CA LEU A 89 3.830 -10.323 -8.922 1.00 0.00 C ATOM 1337 C LEU A 89 5.058 -9.859 -8.135 1.00 0.00 C ATOM 1338 O LEU A 89 4.948 -9.350 -7.038 1.00 0.00 O ATOM 1339 CB LEU A 89 3.897 -9.772 -10.348 1.00 0.00 C ATOM 1340 CG LEU A 89 3.628 -10.901 -11.344 1.00 0.00 C ATOM 1341 CD1 LEU A 89 2.962 -10.331 -12.598 1.00 0.00 C ATOM 1342 CD2 LEU A 89 4.952 -11.565 -11.730 1.00 0.00 C ATOM 0 H LEU A 89 2.724 -9.004 -7.659 1.00 0.00 H new ATOM 0 HA LEU A 89 3.810 -11.412 -8.957 1.00 0.00 H new ATOM 0 HB2 LEU A 89 3.163 -8.977 -10.477 1.00 0.00 H new ATOM 0 HB3 LEU A 89 4.878 -9.334 -10.534 1.00 0.00 H new ATOM 0 HG LEU A 89 2.969 -11.638 -10.886 1.00 0.00 H new ATOM 0 HD11 LEU A 89 2.771 -11.137 -13.307 1.00 0.00 H new ATOM 0 HD12 LEU A 89 2.019 -9.856 -12.326 1.00 0.00 H new ATOM 0 HD13 LEU A 89 3.621 -9.593 -13.056 1.00 0.00 H new ATOM 0 HD21 LEU A 89 4.762 -12.370 -12.440 1.00 0.00 H new ATOM 0 HD22 LEU A 89 5.610 -10.826 -12.187 1.00 0.00 H new ATOM 0 HD23 LEU A 89 5.428 -11.973 -10.838 1.00 0.00 H new ATOM 1354 N ASP A 90 6.228 -10.030 -8.689 1.00 0.00 N ATOM 1355 CA ASP A 90 7.460 -9.599 -7.970 1.00 0.00 C ATOM 1356 C ASP A 90 7.459 -10.192 -6.560 1.00 0.00 C ATOM 1357 O ASP A 90 7.238 -9.501 -5.586 1.00 0.00 O ATOM 1358 CB ASP A 90 7.493 -8.071 -7.883 1.00 0.00 C ATOM 1359 CG ASP A 90 8.560 -7.527 -8.834 1.00 0.00 C ATOM 1360 OD1 ASP A 90 9.715 -7.882 -8.664 1.00 0.00 O ATOM 1361 OD2 ASP A 90 8.204 -6.763 -9.717 1.00 0.00 O ATOM 0 H ASP A 90 6.383 -10.449 -9.606 1.00 0.00 H new ATOM 0 HA ASP A 90 8.339 -9.949 -8.511 1.00 0.00 H new ATOM 0 HB2 ASP A 90 6.517 -7.661 -8.142 1.00 0.00 H new ATOM 0 HB3 ASP A 90 7.709 -7.759 -6.861 1.00 0.00 H new ATOM 1366 N GLU A 91 7.704 -11.469 -6.444 1.00 0.00 N ATOM 1367 CA GLU A 91 7.718 -12.107 -5.098 1.00 0.00 C ATOM 1368 C GLU A 91 9.165 -12.285 -4.633 1.00 0.00 C ATOM 1369 O GLU A 91 9.607 -11.651 -3.695 1.00 0.00 O ATOM 1370 CB GLU A 91 7.035 -13.476 -5.172 1.00 0.00 C ATOM 1371 CG GLU A 91 5.719 -13.351 -5.944 1.00 0.00 C ATOM 1372 CD GLU A 91 5.733 -14.307 -7.138 1.00 0.00 C ATOM 1373 OE1 GLU A 91 6.178 -15.430 -6.968 1.00 0.00 O ATOM 1374 OE2 GLU A 91 5.299 -13.901 -8.203 1.00 0.00 O ATOM 0 H GLU A 91 7.895 -12.098 -7.224 1.00 0.00 H new ATOM 0 HA GLU A 91 7.183 -11.472 -4.391 1.00 0.00 H new ATOM 0 HB2 GLU A 91 7.690 -14.195 -5.664 1.00 0.00 H new ATOM 0 HB3 GLU A 91 6.845 -13.854 -4.167 1.00 0.00 H new ATOM 0 HG2 GLU A 91 4.878 -13.582 -5.290 1.00 0.00 H new ATOM 0 HG3 GLU A 91 5.583 -12.326 -6.288 1.00 0.00 H new ATOM 1381 N ALA A 92 9.905 -13.145 -5.277 1.00 0.00 N ATOM 1382 CA ALA A 92 11.323 -13.363 -4.869 1.00 0.00 C ATOM 1383 C ALA A 92 12.160 -12.139 -5.245 1.00 0.00 C ATOM 1384 O ALA A 92 13.232 -11.923 -4.715 1.00 0.00 O ATOM 1385 CB ALA A 92 11.877 -14.597 -5.585 1.00 0.00 C ATOM 0 H ALA A 92 9.590 -13.706 -6.068 1.00 0.00 H new ATOM 0 HA ALA A 92 11.368 -13.516 -3.791 1.00 0.00 H new ATOM 0 HB1 ALA A 92 12.913 -14.756 -5.287 1.00 0.00 H new ATOM 0 HB2 ALA A 92 11.284 -15.471 -5.316 1.00 0.00 H new ATOM 0 HB3 ALA A 92 11.829 -14.444 -6.663 1.00 0.00 H new ATOM 1391 N ARG A 93 11.682 -11.336 -6.155 1.00 0.00 N ATOM 1392 CA ARG A 93 12.455 -10.128 -6.561 1.00 0.00 C ATOM 1393 C ARG A 93 12.355 -9.062 -5.469 1.00 0.00 C ATOM 1394 O ARG A 93 12.943 -8.003 -5.566 1.00 0.00 O ATOM 1395 CB ARG A 93 11.889 -9.575 -7.870 1.00 0.00 C ATOM 1396 CG ARG A 93 12.794 -9.988 -9.032 1.00 0.00 C ATOM 1397 CD ARG A 93 11.946 -10.594 -10.151 1.00 0.00 C ATOM 1398 NE ARG A 93 12.829 -11.322 -11.104 1.00 0.00 N ATOM 1399 CZ ARG A 93 12.489 -11.425 -12.360 1.00 0.00 C ATOM 1400 NH1 ARG A 93 11.282 -11.104 -12.739 1.00 0.00 N ATOM 1401 NH2 ARG A 93 13.356 -11.851 -13.236 1.00 0.00 N ATOM 0 H ARG A 93 10.791 -11.463 -6.635 1.00 0.00 H new ATOM 0 HA ARG A 93 13.501 -10.400 -6.704 1.00 0.00 H new ATOM 0 HB2 ARG A 93 10.879 -9.952 -8.030 1.00 0.00 H new ATOM 0 HB3 ARG A 93 11.819 -8.488 -7.818 1.00 0.00 H new ATOM 0 HG2 ARG A 93 13.342 -9.123 -9.405 1.00 0.00 H new ATOM 0 HG3 ARG A 93 13.534 -10.711 -8.690 1.00 0.00 H new ATOM 0 HD2 ARG A 93 11.205 -11.275 -9.732 1.00 0.00 H new ATOM 0 HD3 ARG A 93 11.399 -9.809 -10.673 1.00 0.00 H new ATOM 0 HE ARG A 93 13.699 -11.740 -10.775 1.00 0.00 H new ATOM 0 HH11 ARG A 93 10.603 -10.772 -12.053 1.00 0.00 H new ATOM 0 HH12 ARG A 93 11.017 -11.185 -13.721 1.00 0.00 H new ATOM 0 HH21 ARG A 93 14.299 -12.103 -12.939 1.00 0.00 H new ATOM 0 HH22 ARG A 93 13.091 -11.932 -14.218 1.00 0.00 H new ATOM 1415 N ALA A 94 11.618 -9.332 -4.425 1.00 0.00 N ATOM 1416 CA ALA A 94 11.489 -8.334 -3.327 1.00 0.00 C ATOM 1417 C ALA A 94 12.605 -8.568 -2.312 1.00 0.00 C ATOM 1418 O ALA A 94 12.934 -7.706 -1.521 1.00 0.00 O ATOM 1419 CB ALA A 94 10.130 -8.500 -2.642 1.00 0.00 C ATOM 0 H ALA A 94 11.101 -10.200 -4.286 1.00 0.00 H new ATOM 0 HA ALA A 94 11.565 -7.325 -3.733 1.00 0.00 H new ATOM 0 HB1 ALA A 94 10.036 -7.770 -1.838 1.00 0.00 H new ATOM 0 HB2 ALA A 94 9.334 -8.343 -3.370 1.00 0.00 H new ATOM 0 HB3 ALA A 94 10.051 -9.506 -2.229 1.00 0.00 H new ATOM 1425 N MET A 95 13.192 -9.733 -2.333 1.00 0.00 N ATOM 1426 CA MET A 95 14.291 -10.034 -1.377 1.00 0.00 C ATOM 1427 C MET A 95 15.617 -9.537 -1.957 1.00 0.00 C ATOM 1428 O MET A 95 16.486 -9.078 -1.243 1.00 0.00 O ATOM 1429 CB MET A 95 14.363 -11.546 -1.153 1.00 0.00 C ATOM 1430 CG MET A 95 13.824 -11.883 0.239 1.00 0.00 C ATOM 1431 SD MET A 95 14.237 -13.597 0.647 1.00 0.00 S ATOM 1432 CE MET A 95 15.974 -13.316 1.069 1.00 0.00 C ATOM 0 H MET A 95 12.956 -10.491 -2.974 1.00 0.00 H new ATOM 0 HA MET A 95 14.101 -9.534 -0.427 1.00 0.00 H new ATOM 0 HB2 MET A 95 13.782 -12.065 -1.915 1.00 0.00 H new ATOM 0 HB3 MET A 95 15.393 -11.890 -1.249 1.00 0.00 H new ATOM 0 HG2 MET A 95 14.253 -11.208 0.980 1.00 0.00 H new ATOM 0 HG3 MET A 95 12.744 -11.742 0.266 1.00 0.00 H new ATOM 0 HE1 MET A 95 16.607 -13.946 0.444 1.00 0.00 H new ATOM 0 HE2 MET A 95 16.225 -12.269 0.900 1.00 0.00 H new ATOM 0 HE3 MET A 95 16.138 -13.563 2.118 1.00 0.00 H new ATOM 1442 N GLU A 96 15.775 -9.622 -3.251 1.00 0.00 N ATOM 1443 CA GLU A 96 17.040 -9.152 -3.881 1.00 0.00 C ATOM 1444 C GLU A 96 16.953 -7.646 -4.132 1.00 0.00 C ATOM 1445 O GLU A 96 17.951 -6.954 -4.167 1.00 0.00 O ATOM 1446 CB GLU A 96 17.245 -9.877 -5.214 1.00 0.00 C ATOM 1447 CG GLU A 96 18.735 -9.908 -5.557 1.00 0.00 C ATOM 1448 CD GLU A 96 19.062 -8.762 -6.516 1.00 0.00 C ATOM 1449 OE1 GLU A 96 18.364 -8.627 -7.507 1.00 0.00 O ATOM 1450 OE2 GLU A 96 20.006 -8.039 -6.242 1.00 0.00 O ATOM 0 H GLU A 96 15.081 -9.997 -3.898 1.00 0.00 H new ATOM 0 HA GLU A 96 17.878 -9.364 -3.217 1.00 0.00 H new ATOM 0 HB2 GLU A 96 16.855 -10.893 -5.151 1.00 0.00 H new ATOM 0 HB3 GLU A 96 16.690 -9.371 -6.004 1.00 0.00 H new ATOM 0 HG2 GLU A 96 19.330 -9.817 -4.648 1.00 0.00 H new ATOM 0 HG3 GLU A 96 18.994 -10.863 -6.013 1.00 0.00 H new ATOM 1457 N ALA A 97 15.766 -7.135 -4.310 1.00 0.00 N ATOM 1458 CA ALA A 97 15.612 -5.674 -4.562 1.00 0.00 C ATOM 1459 C ALA A 97 16.216 -4.885 -3.398 1.00 0.00 C ATOM 1460 O ALA A 97 17.058 -4.029 -3.588 1.00 0.00 O ATOM 1461 CB ALA A 97 14.126 -5.334 -4.695 1.00 0.00 C ATOM 0 H ALA A 97 14.895 -7.666 -4.292 1.00 0.00 H new ATOM 0 HA ALA A 97 16.130 -5.409 -5.484 1.00 0.00 H new ATOM 0 HB1 ALA A 97 14.012 -4.266 -4.879 1.00 0.00 H new ATOM 0 HB2 ALA A 97 13.698 -5.893 -5.527 1.00 0.00 H new ATOM 0 HB3 ALA A 97 13.608 -5.600 -3.774 1.00 0.00 H new ATOM 1467 N LYS A 98 15.795 -5.163 -2.196 1.00 0.00 N ATOM 1468 CA LYS A 98 16.349 -4.426 -1.025 1.00 0.00 C ATOM 1469 C LYS A 98 17.877 -4.484 -1.064 1.00 0.00 C ATOM 1470 O LYS A 98 18.555 -3.669 -0.470 1.00 0.00 O ATOM 1471 CB LYS A 98 15.847 -5.070 0.268 1.00 0.00 C ATOM 1472 CG LYS A 98 16.304 -4.233 1.464 1.00 0.00 C ATOM 1473 CD LYS A 98 16.914 -5.148 2.526 1.00 0.00 C ATOM 1474 CE LYS A 98 16.132 -5.009 3.834 1.00 0.00 C ATOM 1475 NZ LYS A 98 16.872 -5.693 4.930 1.00 0.00 N ATOM 0 H LYS A 98 15.092 -5.868 -1.973 1.00 0.00 H new ATOM 0 HA LYS A 98 16.023 -3.387 -1.062 1.00 0.00 H new ATOM 0 HB2 LYS A 98 14.759 -5.140 0.254 1.00 0.00 H new ATOM 0 HB3 LYS A 98 16.231 -6.087 0.354 1.00 0.00 H new ATOM 0 HG2 LYS A 98 17.036 -3.492 1.144 1.00 0.00 H new ATOM 0 HG3 LYS A 98 15.459 -3.686 1.882 1.00 0.00 H new ATOM 0 HD2 LYS A 98 16.891 -6.183 2.185 1.00 0.00 H new ATOM 0 HD3 LYS A 98 17.960 -4.888 2.687 1.00 0.00 H new ATOM 0 HE2 LYS A 98 15.993 -3.956 4.077 1.00 0.00 H new ATOM 0 HE3 LYS A 98 15.139 -5.444 3.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 16.341 -5.599 5.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 16.983 -6.701 4.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 17.810 -5.258 5.040 1.00 0.00 H new ATOM 1489 N ARG A 99 18.424 -5.446 -1.757 1.00 0.00 N ATOM 1490 CA ARG A 99 19.908 -5.560 -1.832 1.00 0.00 C ATOM 1491 C ARG A 99 20.451 -4.567 -2.863 1.00 0.00 C ATOM 1492 O ARG A 99 21.278 -3.731 -2.556 1.00 0.00 O ATOM 1493 CB ARG A 99 20.286 -6.983 -2.249 1.00 0.00 C ATOM 1494 CG ARG A 99 19.626 -7.987 -1.303 1.00 0.00 C ATOM 1495 CD ARG A 99 20.247 -9.368 -1.512 1.00 0.00 C ATOM 1496 NE ARG A 99 21.276 -9.616 -0.463 1.00 0.00 N ATOM 1497 CZ ARG A 99 21.406 -10.806 0.054 1.00 0.00 C ATOM 1498 NH1 ARG A 99 21.391 -11.858 -0.717 1.00 0.00 N ATOM 1499 NH2 ARG A 99 21.553 -10.946 1.344 1.00 0.00 N ATOM 0 H ARG A 99 17.907 -6.157 -2.274 1.00 0.00 H new ATOM 0 HA ARG A 99 20.338 -5.337 -0.855 1.00 0.00 H new ATOM 0 HB2 ARG A 99 19.966 -7.169 -3.274 1.00 0.00 H new ATOM 0 HB3 ARG A 99 21.369 -7.104 -2.226 1.00 0.00 H new ATOM 0 HG2 ARG A 99 19.758 -7.670 -0.269 1.00 0.00 H new ATOM 0 HG3 ARG A 99 18.553 -8.027 -1.489 1.00 0.00 H new ATOM 0 HD2 ARG A 99 19.475 -10.136 -1.467 1.00 0.00 H new ATOM 0 HD3 ARG A 99 20.700 -9.429 -2.502 1.00 0.00 H new ATOM 0 HE ARG A 99 21.879 -8.855 -0.149 1.00 0.00 H new ATOM 0 HH11 ARG A 99 21.278 -11.750 -1.725 1.00 0.00 H new ATOM 0 HH12 ARG A 99 21.493 -12.789 -0.312 1.00 0.00 H new ATOM 0 HH21 ARG A 99 21.566 -10.124 1.948 1.00 0.00 H new ATOM 0 HH22 ARG A 99 21.655 -11.877 1.748 1.00 0.00 H new ATOM 1513 N LYS A 100 19.997 -4.654 -4.084 1.00 0.00 N ATOM 1514 CA LYS A 100 20.493 -3.718 -5.132 1.00 0.00 C ATOM 1515 C LYS A 100 20.190 -2.277 -4.719 1.00 0.00 C ATOM 1516 O LYS A 100 20.789 -1.341 -5.213 1.00 0.00 O ATOM 1517 CB LYS A 100 19.800 -4.025 -6.461 1.00 0.00 C ATOM 1518 CG LYS A 100 20.828 -4.555 -7.462 1.00 0.00 C ATOM 1519 CD LYS A 100 20.493 -4.035 -8.861 1.00 0.00 C ATOM 1520 CE LYS A 100 21.771 -3.968 -9.699 1.00 0.00 C ATOM 1521 NZ LYS A 100 21.431 -4.164 -11.137 1.00 0.00 N ATOM 0 H LYS A 100 19.304 -5.333 -4.401 1.00 0.00 H new ATOM 0 HA LYS A 100 21.570 -3.842 -5.247 1.00 0.00 H new ATOM 0 HB2 LYS A 100 19.011 -4.761 -6.310 1.00 0.00 H new ATOM 0 HB3 LYS A 100 19.326 -3.125 -6.853 1.00 0.00 H new ATOM 0 HG2 LYS A 100 21.830 -4.236 -7.174 1.00 0.00 H new ATOM 0 HG3 LYS A 100 20.827 -5.645 -7.458 1.00 0.00 H new ATOM 0 HD2 LYS A 100 19.765 -4.690 -9.340 1.00 0.00 H new ATOM 0 HD3 LYS A 100 20.037 -3.047 -8.794 1.00 0.00 H new ATOM 0 HE2 LYS A 100 22.261 -3.005 -9.558 1.00 0.00 H new ATOM 0 HE3 LYS A 100 22.474 -4.734 -9.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 22.299 -4.119 -11.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 20.981 -5.093 -11.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 20.775 -3.417 -11.444 1.00 0.00 H new ATOM 1535 N ALA A 101 19.266 -2.087 -3.817 1.00 0.00 N ATOM 1536 CA ALA A 101 18.932 -0.703 -3.375 1.00 0.00 C ATOM 1537 C ALA A 101 19.886 -0.284 -2.255 1.00 0.00 C ATOM 1538 O ALA A 101 20.394 0.820 -2.240 1.00 0.00 O ATOM 1539 CB ALA A 101 17.491 -0.663 -2.862 1.00 0.00 C ATOM 0 H ALA A 101 18.729 -2.829 -3.368 1.00 0.00 H new ATOM 0 HA ALA A 101 19.035 -0.017 -4.216 1.00 0.00 H new ATOM 0 HB1 ALA A 101 17.248 0.349 -2.539 1.00 0.00 H new ATOM 0 HB2 ALA A 101 16.812 -0.962 -3.661 1.00 0.00 H new ATOM 0 HB3 ALA A 101 17.385 -1.348 -2.020 1.00 0.00 H new ATOM 1545 N GLU A 102 20.136 -1.158 -1.319 1.00 0.00 N ATOM 1546 CA GLU A 102 21.060 -0.811 -0.202 1.00 0.00 C ATOM 1547 C GLU A 102 22.414 -0.389 -0.774 1.00 0.00 C ATOM 1548 O GLU A 102 23.085 0.471 -0.239 1.00 0.00 O ATOM 1549 CB GLU A 102 21.244 -2.031 0.704 1.00 0.00 C ATOM 1550 CG GLU A 102 22.291 -1.722 1.775 1.00 0.00 C ATOM 1551 CD GLU A 102 22.874 -3.031 2.309 1.00 0.00 C ATOM 1552 OE1 GLU A 102 22.105 -3.947 2.544 1.00 0.00 O ATOM 1553 OE2 GLU A 102 24.082 -3.095 2.473 1.00 0.00 O ATOM 0 H GLU A 102 19.741 -2.097 -1.279 1.00 0.00 H new ATOM 0 HA GLU A 102 20.639 0.011 0.377 1.00 0.00 H new ATOM 0 HB2 GLU A 102 20.296 -2.294 1.173 1.00 0.00 H new ATOM 0 HB3 GLU A 102 21.557 -2.892 0.113 1.00 0.00 H new ATOM 0 HG2 GLU A 102 23.084 -1.102 1.356 1.00 0.00 H new ATOM 0 HG3 GLU A 102 21.839 -1.154 2.588 1.00 0.00 H new ATOM 1560 N GLU A 103 22.821 -0.990 -1.859 1.00 0.00 N ATOM 1561 CA GLU A 103 24.131 -0.625 -2.468 1.00 0.00 C ATOM 1562 C GLU A 103 24.134 0.864 -2.819 1.00 0.00 C ATOM 1563 O GLU A 103 25.038 1.594 -2.465 1.00 0.00 O ATOM 1564 CB GLU A 103 24.348 -1.451 -3.738 1.00 0.00 C ATOM 1565 CG GLU A 103 25.418 -2.514 -3.482 1.00 0.00 C ATOM 1566 CD GLU A 103 26.145 -2.832 -4.790 1.00 0.00 C ATOM 1567 OE1 GLU A 103 25.490 -3.283 -5.715 1.00 0.00 O ATOM 1568 OE2 GLU A 103 27.345 -2.619 -4.846 1.00 0.00 O ATOM 0 H GLU A 103 22.302 -1.718 -2.350 1.00 0.00 H new ATOM 0 HA GLU A 103 24.933 -0.831 -1.759 1.00 0.00 H new ATOM 0 HB2 GLU A 103 23.414 -1.926 -4.039 1.00 0.00 H new ATOM 0 HB3 GLU A 103 24.655 -0.802 -4.558 1.00 0.00 H new ATOM 0 HG2 GLU A 103 26.128 -2.158 -2.736 1.00 0.00 H new ATOM 0 HG3 GLU A 103 24.959 -3.417 -3.080 1.00 0.00 H new ATOM 1575 N HIS A 104 23.127 1.319 -3.514 1.00 0.00 N ATOM 1576 CA HIS A 104 23.069 2.761 -3.890 1.00 0.00 C ATOM 1577 C HIS A 104 22.865 3.610 -2.633 1.00 0.00 C ATOM 1578 O HIS A 104 23.107 4.800 -2.630 1.00 0.00 O ATOM 1579 CB HIS A 104 21.900 2.987 -4.851 1.00 0.00 C ATOM 1580 CG HIS A 104 22.424 3.426 -6.190 1.00 0.00 C ATOM 1581 ND1 HIS A 104 21.781 3.103 -7.375 1.00 0.00 N ATOM 1582 CD2 HIS A 104 23.525 4.164 -6.551 1.00 0.00 C ATOM 1583 CE1 HIS A 104 22.494 3.641 -8.383 1.00 0.00 C ATOM 1584 NE2 HIS A 104 23.567 4.298 -7.936 1.00 0.00 N ATOM 0 H HIS A 104 22.342 0.754 -3.838 1.00 0.00 H new ATOM 0 HA HIS A 104 24.002 3.049 -4.374 1.00 0.00 H new ATOM 0 HB2 HIS A 104 21.322 2.069 -4.959 1.00 0.00 H new ATOM 0 HB3 HIS A 104 21.226 3.743 -4.448 1.00 0.00 H new ATOM 0 HD2 HIS A 104 24.249 4.578 -5.864 1.00 0.00 H new ATOM 0 HE1 HIS A 104 22.230 3.552 -9.426 1.00 0.00 H new ATOM 0 HE2 HIS A 104 24.267 4.792 -8.490 1.00 0.00 H new ATOM 1592 N ILE A 105 22.418 3.008 -1.565 1.00 0.00 N ATOM 1593 CA ILE A 105 22.197 3.780 -0.310 1.00 0.00 C ATOM 1594 C ILE A 105 23.531 3.966 0.417 1.00 0.00 C ATOM 1595 O ILE A 105 23.713 4.901 1.169 1.00 0.00 O ATOM 1596 CB ILE A 105 21.221 3.017 0.590 1.00 0.00 C ATOM 1597 CG1 ILE A 105 19.803 3.157 0.033 1.00 0.00 C ATOM 1598 CG2 ILE A 105 21.267 3.593 2.008 1.00 0.00 C ATOM 1599 CD1 ILE A 105 18.815 2.457 0.968 1.00 0.00 C ATOM 0 H ILE A 105 22.196 2.014 -1.508 1.00 0.00 H new ATOM 0 HA ILE A 105 21.779 4.758 -0.551 1.00 0.00 H new ATOM 0 HB ILE A 105 21.504 1.965 0.618 1.00 0.00 H new ATOM 0 HG12 ILE A 105 19.542 4.211 -0.066 1.00 0.00 H new ATOM 0 HG13 ILE A 105 19.748 2.720 -0.964 1.00 0.00 H new ATOM 0 HG21 ILE A 105 20.571 3.047 2.645 1.00 0.00 H new ATOM 0 HG22 ILE A 105 22.277 3.497 2.407 1.00 0.00 H new ATOM 0 HG23 ILE A 105 20.986 4.646 1.982 1.00 0.00 H new ATOM 0 HD11 ILE A 105 17.805 2.557 0.571 1.00 0.00 H new ATOM 0 HD12 ILE A 105 19.072 1.400 1.044 1.00 0.00 H new ATOM 0 HD13 ILE A 105 18.863 2.914 1.956 1.00 0.00 H new ATOM 1611 N SER A 106 24.465 3.081 0.199 1.00 0.00 N ATOM 1612 CA SER A 106 25.784 3.210 0.881 1.00 0.00 C ATOM 1613 C SER A 106 26.808 3.791 -0.094 1.00 0.00 C ATOM 1614 O SER A 106 27.317 3.104 -0.958 1.00 0.00 O ATOM 1615 CB SER A 106 26.251 1.831 1.351 1.00 0.00 C ATOM 1616 OG SER A 106 27.082 1.982 2.496 1.00 0.00 O ATOM 0 H SER A 106 24.372 2.276 -0.420 1.00 0.00 H new ATOM 0 HA SER A 106 25.686 3.873 1.741 1.00 0.00 H new ATOM 0 HB2 SER A 106 25.391 1.205 1.591 1.00 0.00 H new ATOM 0 HB3 SER A 106 26.798 1.328 0.554 1.00 0.00 H new ATOM 0 HG SER A 106 27.382 1.100 2.801 1.00 0.00 H new ATOM 1622 N SER A 107 27.116 5.052 0.035 1.00 0.00 N ATOM 1623 CA SER A 107 28.107 5.675 -0.887 1.00 0.00 C ATOM 1624 C SER A 107 28.773 6.870 -0.199 1.00 0.00 C ATOM 1625 O SER A 107 29.966 7.071 -0.303 1.00 0.00 O ATOM 1626 CB SER A 107 27.397 6.151 -2.154 1.00 0.00 C ATOM 1627 OG SER A 107 27.010 5.024 -2.929 1.00 0.00 O ATOM 0 H SER A 107 26.724 5.678 0.739 1.00 0.00 H new ATOM 0 HA SER A 107 28.867 4.938 -1.148 1.00 0.00 H new ATOM 0 HB2 SER A 107 26.521 6.745 -1.892 1.00 0.00 H new ATOM 0 HB3 SER A 107 28.057 6.796 -2.734 1.00 0.00 H new ATOM 0 HG SER A 107 27.195 4.203 -2.427 1.00 0.00 H new ATOM 1633 N SER A 108 28.011 7.667 0.502 1.00 0.00 N ATOM 1634 CA SER A 108 28.606 8.849 1.189 1.00 0.00 C ATOM 1635 C SER A 108 27.723 9.257 2.372 1.00 0.00 C ATOM 1636 O SER A 108 26.849 8.524 2.790 1.00 0.00 O ATOM 1637 CB SER A 108 28.706 10.013 0.204 1.00 0.00 C ATOM 1638 OG SER A 108 27.863 9.755 -0.913 1.00 0.00 O ATOM 0 H SER A 108 27.006 7.551 0.628 1.00 0.00 H new ATOM 0 HA SER A 108 29.601 8.592 1.553 1.00 0.00 H new ATOM 0 HB2 SER A 108 28.411 10.943 0.690 1.00 0.00 H new ATOM 0 HB3 SER A 108 29.737 10.139 -0.125 1.00 0.00 H new ATOM 0 HG SER A 108 27.923 10.500 -1.547 1.00 0.00 H new ATOM 1644 N HIS A 109 27.948 10.425 2.913 1.00 0.00 N ATOM 1645 CA HIS A 109 27.127 10.885 4.068 1.00 0.00 C ATOM 1646 C HIS A 109 26.285 12.092 3.645 1.00 0.00 C ATOM 1647 O HIS A 109 25.151 11.955 3.230 1.00 0.00 O ATOM 1648 CB HIS A 109 28.050 11.288 5.219 1.00 0.00 C ATOM 1649 CG HIS A 109 27.984 10.252 6.307 1.00 0.00 C ATOM 1650 ND1 HIS A 109 28.886 10.227 7.359 1.00 0.00 N ATOM 1651 CD2 HIS A 109 27.132 9.196 6.519 1.00 0.00 C ATOM 1652 CE1 HIS A 109 28.557 9.190 8.151 1.00 0.00 C ATOM 1653 NE2 HIS A 109 27.495 8.528 7.685 1.00 0.00 N ATOM 0 H HIS A 109 28.666 11.080 2.604 1.00 0.00 H new ATOM 0 HA HIS A 109 26.470 10.078 4.393 1.00 0.00 H new ATOM 0 HB2 HIS A 109 29.074 11.387 4.859 1.00 0.00 H new ATOM 0 HB3 HIS A 109 27.755 12.261 5.611 1.00 0.00 H new ATOM 0 HD2 HIS A 109 26.306 8.925 5.878 1.00 0.00 H new ATOM 0 HE1 HIS A 109 29.087 8.925 9.054 1.00 0.00 H new ATOM 0 HE2 HIS A 109 27.046 7.709 8.095 1.00 0.00 H new ATOM 1661 N GLY A 110 26.832 13.273 3.745 1.00 0.00 N ATOM 1662 CA GLY A 110 26.064 14.486 3.345 1.00 0.00 C ATOM 1663 C GLY A 110 24.887 14.689 4.299 1.00 0.00 C ATOM 1664 O GLY A 110 24.660 13.902 5.198 1.00 0.00 O ATOM 0 H GLY A 110 27.777 13.450 4.086 1.00 0.00 H new ATOM 0 HA2 GLY A 110 26.713 15.361 3.362 1.00 0.00 H new ATOM 0 HA3 GLY A 110 25.701 14.378 2.323 1.00 0.00 H new ATOM 1668 N ASP A 111 24.135 15.738 4.110 1.00 0.00 N ATOM 1669 CA ASP A 111 22.968 15.995 5.004 1.00 0.00 C ATOM 1670 C ASP A 111 21.674 15.849 4.202 1.00 0.00 C ATOM 1671 O ASP A 111 21.502 16.464 3.168 1.00 0.00 O ATOM 1672 CB ASP A 111 23.059 17.413 5.575 1.00 0.00 C ATOM 1673 CG ASP A 111 23.777 18.327 4.580 1.00 0.00 C ATOM 1674 OD1 ASP A 111 23.254 18.516 3.494 1.00 0.00 O ATOM 1675 OD2 ASP A 111 24.840 18.819 4.920 1.00 0.00 O ATOM 0 H ASP A 111 24.278 16.430 3.374 1.00 0.00 H new ATOM 0 HA ASP A 111 22.973 15.276 5.823 1.00 0.00 H new ATOM 0 HB2 ASP A 111 22.060 17.797 5.780 1.00 0.00 H new ATOM 0 HB3 ASP A 111 23.596 17.399 6.523 1.00 0.00 H new ATOM 1680 N VAL A 112 20.764 15.034 4.669 1.00 0.00 N ATOM 1681 CA VAL A 112 19.478 14.837 3.937 1.00 0.00 C ATOM 1682 C VAL A 112 19.751 14.757 2.435 1.00 0.00 C ATOM 1683 O VAL A 112 18.922 15.112 1.622 1.00 0.00 O ATOM 1684 CB VAL A 112 18.533 16.006 4.227 1.00 0.00 C ATOM 1685 CG1 VAL A 112 18.332 16.137 5.736 1.00 0.00 C ATOM 1686 CG2 VAL A 112 19.134 17.301 3.681 1.00 0.00 C ATOM 0 H VAL A 112 20.857 14.494 5.530 1.00 0.00 H new ATOM 0 HA VAL A 112 19.013 13.909 4.270 1.00 0.00 H new ATOM 0 HB VAL A 112 17.573 15.821 3.745 1.00 0.00 H new ATOM 0 HG11 VAL A 112 17.659 16.969 5.943 1.00 0.00 H new ATOM 0 HG12 VAL A 112 17.900 15.216 6.127 1.00 0.00 H new ATOM 0 HG13 VAL A 112 19.293 16.320 6.217 1.00 0.00 H new ATOM 0 HG21 VAL A 112 18.459 18.131 3.889 1.00 0.00 H new ATOM 0 HG22 VAL A 112 20.095 17.486 4.160 1.00 0.00 H new ATOM 0 HG23 VAL A 112 19.277 17.210 2.604 1.00 0.00 H new ATOM 1696 N ASP A 113 20.910 14.291 2.065 1.00 0.00 N ATOM 1697 CA ASP A 113 21.245 14.183 0.619 1.00 0.00 C ATOM 1698 C ASP A 113 20.680 12.871 0.070 1.00 0.00 C ATOM 1699 O ASP A 113 19.529 12.793 -0.311 1.00 0.00 O ATOM 1700 CB ASP A 113 22.764 14.195 0.457 1.00 0.00 C ATOM 1701 CG ASP A 113 23.124 13.908 -1.001 1.00 0.00 C ATOM 1702 OD1 ASP A 113 22.989 14.809 -1.812 1.00 0.00 O ATOM 1703 OD2 ASP A 113 23.525 12.791 -1.283 1.00 0.00 O ATOM 0 H ASP A 113 21.642 13.979 2.704 1.00 0.00 H new ATOM 0 HA ASP A 113 20.813 15.021 0.072 1.00 0.00 H new ATOM 0 HB2 ASP A 113 23.165 15.163 0.758 1.00 0.00 H new ATOM 0 HB3 ASP A 113 23.216 13.447 1.108 1.00 0.00 H new ATOM 1708 N TYR A 114 21.473 11.834 0.040 1.00 0.00 N ATOM 1709 CA TYR A 114 20.963 10.533 -0.466 1.00 0.00 C ATOM 1710 C TYR A 114 20.048 9.940 0.603 1.00 0.00 C ATOM 1711 O TYR A 114 19.181 9.135 0.326 1.00 0.00 O ATOM 1712 CB TYR A 114 22.139 9.586 -0.745 1.00 0.00 C ATOM 1713 CG TYR A 114 22.667 9.019 0.554 1.00 0.00 C ATOM 1714 CD1 TYR A 114 22.107 7.851 1.081 1.00 0.00 C ATOM 1715 CD2 TYR A 114 23.715 9.661 1.225 1.00 0.00 C ATOM 1716 CE1 TYR A 114 22.594 7.322 2.282 1.00 0.00 C ATOM 1717 CE2 TYR A 114 24.202 9.132 2.427 1.00 0.00 C ATOM 1718 CZ TYR A 114 23.641 7.962 2.955 1.00 0.00 C ATOM 1719 OH TYR A 114 24.121 7.440 4.138 1.00 0.00 O ATOM 0 H TYR A 114 22.447 11.834 0.343 1.00 0.00 H new ATOM 0 HA TYR A 114 20.411 10.673 -1.395 1.00 0.00 H new ATOM 0 HB2 TYR A 114 21.817 8.777 -1.400 1.00 0.00 H new ATOM 0 HB3 TYR A 114 22.932 10.122 -1.266 1.00 0.00 H new ATOM 0 HD1 TYR A 114 21.299 7.357 0.562 1.00 0.00 H new ATOM 0 HD2 TYR A 114 24.147 10.563 0.816 1.00 0.00 H new ATOM 0 HE1 TYR A 114 22.162 6.420 2.689 1.00 0.00 H new ATOM 0 HE2 TYR A 114 25.010 9.626 2.947 1.00 0.00 H new ATOM 0 HH TYR A 114 24.848 8.005 4.474 1.00 0.00 H new ATOM 1729 N ALA A 115 20.237 10.356 1.825 1.00 0.00 N ATOM 1730 CA ALA A 115 19.387 9.850 2.932 1.00 0.00 C ATOM 1731 C ALA A 115 17.922 10.124 2.594 1.00 0.00 C ATOM 1732 O ALA A 115 17.025 9.452 3.061 1.00 0.00 O ATOM 1733 CB ALA A 115 19.762 10.584 4.221 1.00 0.00 C ATOM 0 H ALA A 115 20.950 11.030 2.103 1.00 0.00 H new ATOM 0 HA ALA A 115 19.538 8.779 3.065 1.00 0.00 H new ATOM 0 HB1 ALA A 115 19.143 10.219 5.041 1.00 0.00 H new ATOM 0 HB2 ALA A 115 20.812 10.403 4.451 1.00 0.00 H new ATOM 0 HB3 ALA A 115 19.599 11.654 4.091 1.00 0.00 H new ATOM 1739 N GLN A 116 17.678 11.110 1.774 1.00 0.00 N ATOM 1740 CA GLN A 116 16.279 11.437 1.389 1.00 0.00 C ATOM 1741 C GLN A 116 15.801 10.433 0.339 1.00 0.00 C ATOM 1742 O GLN A 116 14.647 10.055 0.305 1.00 0.00 O ATOM 1743 CB GLN A 116 16.234 12.852 0.806 1.00 0.00 C ATOM 1744 CG GLN A 116 15.904 13.851 1.915 1.00 0.00 C ATOM 1745 CD GLN A 116 14.402 14.138 1.912 1.00 0.00 C ATOM 1746 OE1 GLN A 116 13.842 14.494 0.894 1.00 0.00 O ATOM 1747 NE2 GLN A 116 13.721 13.996 3.016 1.00 0.00 N ATOM 0 H GLN A 116 18.392 11.705 1.353 1.00 0.00 H new ATOM 0 HA GLN A 116 15.631 11.385 2.264 1.00 0.00 H new ATOM 0 HB2 GLN A 116 17.193 13.100 0.352 1.00 0.00 H new ATOM 0 HB3 GLN A 116 15.484 12.908 0.017 1.00 0.00 H new ATOM 0 HG2 GLN A 116 16.207 13.450 2.882 1.00 0.00 H new ATOM 0 HG3 GLN A 116 16.462 14.775 1.765 1.00 0.00 H new ATOM 0 HE21 GLN A 116 14.191 13.697 3.870 1.00 0.00 H new ATOM 0 HE22 GLN A 116 12.718 14.184 3.025 1.00 0.00 H new ATOM 1756 N ALA A 117 16.684 9.996 -0.517 1.00 0.00 N ATOM 1757 CA ALA A 117 16.289 9.012 -1.562 1.00 0.00 C ATOM 1758 C ALA A 117 16.185 7.621 -0.932 1.00 0.00 C ATOM 1759 O ALA A 117 15.543 6.735 -1.460 1.00 0.00 O ATOM 1760 CB ALA A 117 17.346 8.992 -2.669 1.00 0.00 C ATOM 0 H ALA A 117 17.664 10.279 -0.537 1.00 0.00 H new ATOM 0 HA ALA A 117 15.325 9.295 -1.986 1.00 0.00 H new ATOM 0 HB1 ALA A 117 17.058 8.272 -3.435 1.00 0.00 H new ATOM 0 HB2 ALA A 117 17.425 9.984 -3.115 1.00 0.00 H new ATOM 0 HB3 ALA A 117 18.310 8.706 -2.247 1.00 0.00 H new ATOM 1766 N SER A 118 16.815 7.424 0.194 1.00 0.00 N ATOM 1767 CA SER A 118 16.755 6.092 0.859 1.00 0.00 C ATOM 1768 C SER A 118 15.318 5.811 1.303 1.00 0.00 C ATOM 1769 O SER A 118 14.831 4.703 1.200 1.00 0.00 O ATOM 1770 CB SER A 118 17.675 6.091 2.079 1.00 0.00 C ATOM 1771 OG SER A 118 18.974 6.517 1.689 1.00 0.00 O ATOM 0 H SER A 118 17.369 8.128 0.682 1.00 0.00 H new ATOM 0 HA SER A 118 17.078 5.320 0.160 1.00 0.00 H new ATOM 0 HB2 SER A 118 17.278 6.754 2.848 1.00 0.00 H new ATOM 0 HB3 SER A 118 17.722 5.092 2.512 1.00 0.00 H new ATOM 0 HG SER A 118 18.938 7.452 1.396 1.00 0.00 H new ATOM 1777 N ALA A 119 14.634 6.809 1.793 1.00 0.00 N ATOM 1778 CA ALA A 119 13.229 6.599 2.240 1.00 0.00 C ATOM 1779 C ALA A 119 12.371 6.195 1.040 1.00 0.00 C ATOM 1780 O ALA A 119 11.255 5.740 1.188 1.00 0.00 O ATOM 1781 CB ALA A 119 12.686 7.897 2.843 1.00 0.00 C ATOM 0 H ALA A 119 14.988 7.759 1.903 1.00 0.00 H new ATOM 0 HA ALA A 119 13.199 5.810 2.992 1.00 0.00 H new ATOM 0 HB1 ALA A 119 11.658 7.744 3.170 1.00 0.00 H new ATOM 0 HB2 ALA A 119 13.299 8.186 3.696 1.00 0.00 H new ATOM 0 HB3 ALA A 119 12.714 8.687 2.092 1.00 0.00 H new ATOM 1787 N GLU A 120 12.887 6.357 -0.149 1.00 0.00 N ATOM 1788 CA GLU A 120 12.103 5.980 -1.358 1.00 0.00 C ATOM 1789 C GLU A 120 12.192 4.469 -1.570 1.00 0.00 C ATOM 1790 O GLU A 120 11.271 3.843 -2.058 1.00 0.00 O ATOM 1791 CB GLU A 120 12.674 6.700 -2.582 1.00 0.00 C ATOM 1792 CG GLU A 120 12.568 8.212 -2.383 1.00 0.00 C ATOM 1793 CD GLU A 120 11.409 8.758 -3.218 1.00 0.00 C ATOM 1794 OE1 GLU A 120 10.689 7.959 -3.793 1.00 0.00 O ATOM 1795 OE2 GLU A 120 11.261 9.968 -3.269 1.00 0.00 O ATOM 0 H GLU A 120 13.817 6.734 -0.334 1.00 0.00 H new ATOM 0 HA GLU A 120 11.061 6.268 -1.220 1.00 0.00 H new ATOM 0 HB2 GLU A 120 13.715 6.415 -2.731 1.00 0.00 H new ATOM 0 HB3 GLU A 120 12.130 6.402 -3.478 1.00 0.00 H new ATOM 0 HG2 GLU A 120 12.410 8.440 -1.329 1.00 0.00 H new ATOM 0 HG3 GLU A 120 13.500 8.694 -2.677 1.00 0.00 H new ATOM 1802 N LEU A 121 13.295 3.875 -1.205 1.00 0.00 N ATOM 1803 CA LEU A 121 13.445 2.404 -1.384 1.00 0.00 C ATOM 1804 C LEU A 121 12.803 1.679 -0.199 1.00 0.00 C ATOM 1805 O LEU A 121 12.173 0.653 -0.353 1.00 0.00 O ATOM 1806 CB LEU A 121 14.931 2.048 -1.455 1.00 0.00 C ATOM 1807 CG LEU A 121 15.656 3.044 -2.364 1.00 0.00 C ATOM 1808 CD1 LEU A 121 17.162 2.780 -2.310 1.00 0.00 C ATOM 1809 CD2 LEU A 121 15.161 2.875 -3.803 1.00 0.00 C ATOM 0 H LEU A 121 14.099 4.346 -0.790 1.00 0.00 H new ATOM 0 HA LEU A 121 12.954 2.098 -2.308 1.00 0.00 H new ATOM 0 HB2 LEU A 121 15.368 2.067 -0.457 1.00 0.00 H new ATOM 0 HB3 LEU A 121 15.055 1.035 -1.838 1.00 0.00 H new ATOM 0 HG LEU A 121 15.452 4.060 -2.026 1.00 0.00 H new ATOM 0 HD11 LEU A 121 17.679 3.489 -2.957 1.00 0.00 H new ATOM 0 HD12 LEU A 121 17.516 2.899 -1.286 1.00 0.00 H new ATOM 0 HD13 LEU A 121 17.366 1.764 -2.649 1.00 0.00 H new ATOM 0 HD21 LEU A 121 15.677 3.584 -4.451 1.00 0.00 H new ATOM 0 HD22 LEU A 121 15.365 1.859 -4.141 1.00 0.00 H new ATOM 0 HD23 LEU A 121 14.088 3.062 -3.843 1.00 0.00 H new ATOM 1821 N ALA A 122 12.962 2.204 0.986 1.00 0.00 N ATOM 1822 CA ALA A 122 12.366 1.545 2.182 1.00 0.00 C ATOM 1823 C ALA A 122 10.852 1.402 1.992 1.00 0.00 C ATOM 1824 O ALA A 122 10.221 0.555 2.592 1.00 0.00 O ATOM 1825 CB ALA A 122 12.651 2.392 3.424 1.00 0.00 C ATOM 0 H ALA A 122 13.480 3.062 1.177 1.00 0.00 H new ATOM 0 HA ALA A 122 12.806 0.556 2.308 1.00 0.00 H new ATOM 0 HB1 ALA A 122 12.216 1.911 4.300 1.00 0.00 H new ATOM 0 HB2 ALA A 122 13.728 2.487 3.560 1.00 0.00 H new ATOM 0 HB3 ALA A 122 12.212 3.382 3.298 1.00 0.00 H new ATOM 1831 N LYS A 123 10.265 2.222 1.165 1.00 0.00 N ATOM 1832 CA LYS A 123 8.794 2.127 0.942 1.00 0.00 C ATOM 1833 C LYS A 123 8.497 0.986 -0.032 1.00 0.00 C ATOM 1834 O LYS A 123 7.459 0.356 0.031 1.00 0.00 O ATOM 1835 CB LYS A 123 8.276 3.443 0.355 1.00 0.00 C ATOM 1836 CG LYS A 123 8.508 4.577 1.355 1.00 0.00 C ATOM 1837 CD LYS A 123 7.385 4.582 2.393 1.00 0.00 C ATOM 1838 CE LYS A 123 6.923 6.021 2.638 1.00 0.00 C ATOM 1839 NZ LYS A 123 5.465 6.029 2.942 1.00 0.00 N ATOM 0 H LYS A 123 10.739 2.953 0.634 1.00 0.00 H new ATOM 0 HA LYS A 123 8.298 1.934 1.893 1.00 0.00 H new ATOM 0 HB2 LYS A 123 8.787 3.661 -0.583 1.00 0.00 H new ATOM 0 HB3 LYS A 123 7.214 3.358 0.126 1.00 0.00 H new ATOM 0 HG2 LYS A 123 9.472 4.450 1.848 1.00 0.00 H new ATOM 0 HG3 LYS A 123 8.540 5.534 0.834 1.00 0.00 H new ATOM 0 HD2 LYS A 123 6.550 3.975 2.044 1.00 0.00 H new ATOM 0 HD3 LYS A 123 7.734 4.137 3.325 1.00 0.00 H new ATOM 0 HE2 LYS A 123 7.481 6.457 3.467 1.00 0.00 H new ATOM 0 HE3 LYS A 123 7.126 6.634 1.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 5.244 6.836 3.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 4.926 6.113 2.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 5.206 5.144 3.423 1.00 0.00 H new ATOM 1853 N ALA A 124 9.400 0.712 -0.934 1.00 0.00 N ATOM 1854 CA ALA A 124 9.167 -0.387 -1.913 1.00 0.00 C ATOM 1855 C ALA A 124 9.243 -1.736 -1.196 1.00 0.00 C ATOM 1856 O ALA A 124 8.669 -2.714 -1.632 1.00 0.00 O ATOM 1857 CB ALA A 124 10.233 -0.330 -3.008 1.00 0.00 C ATOM 0 H ALA A 124 10.289 1.202 -1.035 1.00 0.00 H new ATOM 0 HA ALA A 124 8.180 -0.270 -2.361 1.00 0.00 H new ATOM 0 HB1 ALA A 124 10.062 -1.134 -3.724 1.00 0.00 H new ATOM 0 HB2 ALA A 124 10.177 0.630 -3.521 1.00 0.00 H new ATOM 0 HB3 ALA A 124 11.220 -0.446 -2.561 1.00 0.00 H new ATOM 1863 N ILE A 125 9.947 -1.800 -0.100 1.00 0.00 N ATOM 1864 CA ILE A 125 10.055 -3.090 0.637 1.00 0.00 C ATOM 1865 C ILE A 125 8.801 -3.301 1.489 1.00 0.00 C ATOM 1866 O ILE A 125 8.681 -4.278 2.202 1.00 0.00 O ATOM 1867 CB ILE A 125 11.287 -3.060 1.541 1.00 0.00 C ATOM 1868 CG1 ILE A 125 12.549 -3.025 0.677 1.00 0.00 C ATOM 1869 CG2 ILE A 125 11.308 -4.313 2.418 1.00 0.00 C ATOM 1870 CD1 ILE A 125 13.399 -1.815 1.066 1.00 0.00 C ATOM 0 H ILE A 125 10.451 -1.017 0.316 1.00 0.00 H new ATOM 0 HA ILE A 125 10.149 -3.908 -0.078 1.00 0.00 H new ATOM 0 HB ILE A 125 11.252 -2.174 2.174 1.00 0.00 H new ATOM 0 HG12 ILE A 125 13.121 -3.943 0.812 1.00 0.00 H new ATOM 0 HG13 ILE A 125 12.279 -2.970 -0.378 1.00 0.00 H new ATOM 0 HG21 ILE A 125 12.187 -4.291 3.063 1.00 0.00 H new ATOM 0 HG22 ILE A 125 10.408 -4.342 3.032 1.00 0.00 H new ATOM 0 HG23 ILE A 125 11.344 -5.200 1.785 1.00 0.00 H new ATOM 0 HD11 ILE A 125 14.298 -1.789 0.451 1.00 0.00 H new ATOM 0 HD12 ILE A 125 12.825 -0.902 0.908 1.00 0.00 H new ATOM 0 HD13 ILE A 125 13.680 -1.890 2.116 1.00 0.00 H new ATOM 1882 N ALA A 126 7.864 -2.394 1.420 1.00 0.00 N ATOM 1883 CA ALA A 126 6.620 -2.549 2.225 1.00 0.00 C ATOM 1884 C ALA A 126 5.790 -3.701 1.655 1.00 0.00 C ATOM 1885 O ALA A 126 4.972 -4.288 2.337 1.00 0.00 O ATOM 1886 CB ALA A 126 5.809 -1.252 2.162 1.00 0.00 C ATOM 0 H ALA A 126 7.907 -1.555 0.842 1.00 0.00 H new ATOM 0 HA ALA A 126 6.878 -2.764 3.262 1.00 0.00 H new ATOM 0 HB1 ALA A 126 4.898 -1.363 2.750 1.00 0.00 H new ATOM 0 HB2 ALA A 126 6.403 -0.432 2.565 1.00 0.00 H new ATOM 0 HB3 ALA A 126 5.547 -1.036 1.126 1.00 0.00 H new ATOM 1892 N GLN A 127 5.995 -4.030 0.409 1.00 0.00 N ATOM 1893 CA GLN A 127 5.220 -5.144 -0.209 1.00 0.00 C ATOM 1894 C GLN A 127 5.821 -6.483 0.222 1.00 0.00 C ATOM 1895 O GLN A 127 5.248 -7.531 0.003 1.00 0.00 O ATOM 1896 CB GLN A 127 5.285 -5.023 -1.734 1.00 0.00 C ATOM 1897 CG GLN A 127 6.678 -5.423 -2.222 1.00 0.00 C ATOM 1898 CD GLN A 127 7.113 -4.491 -3.354 1.00 0.00 C ATOM 1899 OE1 GLN A 127 6.418 -3.552 -3.685 1.00 0.00 O ATOM 1900 NE2 GLN A 127 8.244 -4.712 -3.965 1.00 0.00 N ATOM 0 H GLN A 127 6.667 -3.575 -0.209 1.00 0.00 H new ATOM 0 HA GLN A 127 4.181 -5.090 0.117 1.00 0.00 H new ATOM 0 HB2 GLN A 127 4.531 -5.663 -2.192 1.00 0.00 H new ATOM 0 HB3 GLN A 127 5.062 -4.000 -2.037 1.00 0.00 H new ATOM 0 HG2 GLN A 127 7.391 -5.370 -1.400 1.00 0.00 H new ATOM 0 HG3 GLN A 127 6.669 -6.456 -2.571 1.00 0.00 H new ATOM 0 HE21 GLN A 127 8.828 -5.501 -3.687 1.00 0.00 H new ATOM 0 HE22 GLN A 127 8.544 -4.096 -4.721 1.00 0.00 H new ATOM 1909 N LEU A 128 6.976 -6.459 0.829 1.00 0.00 N ATOM 1910 CA LEU A 128 7.615 -7.731 1.267 1.00 0.00 C ATOM 1911 C LEU A 128 6.872 -8.293 2.481 1.00 0.00 C ATOM 1912 O LEU A 128 6.820 -9.489 2.686 1.00 0.00 O ATOM 1913 CB LEU A 128 9.073 -7.463 1.642 1.00 0.00 C ATOM 1914 CG LEU A 128 9.918 -8.693 1.304 1.00 0.00 C ATOM 1915 CD1 LEU A 128 11.303 -8.248 0.834 1.00 0.00 C ATOM 1916 CD2 LEU A 128 10.061 -9.569 2.551 1.00 0.00 C ATOM 0 H LEU A 128 7.505 -5.613 1.040 1.00 0.00 H new ATOM 0 HA LEU A 128 7.572 -8.455 0.453 1.00 0.00 H new ATOM 0 HB2 LEU A 128 9.445 -6.593 1.102 1.00 0.00 H new ATOM 0 HB3 LEU A 128 9.151 -7.235 2.705 1.00 0.00 H new ATOM 0 HG LEU A 128 9.431 -9.262 0.512 1.00 0.00 H new ATOM 0 HD11 LEU A 128 11.905 -9.125 0.593 1.00 0.00 H new ATOM 0 HD12 LEU A 128 11.203 -7.622 -0.053 1.00 0.00 H new ATOM 0 HD13 LEU A 128 11.791 -7.680 1.626 1.00 0.00 H new ATOM 0 HD21 LEU A 128 10.663 -10.446 2.313 1.00 0.00 H new ATOM 0 HD22 LEU A 128 10.548 -8.999 3.342 1.00 0.00 H new ATOM 0 HD23 LEU A 128 9.074 -9.887 2.888 1.00 0.00 H new ATOM 1928 N ARG A 129 6.301 -7.444 3.288 1.00 0.00 N ATOM 1929 CA ARG A 129 5.569 -7.940 4.488 1.00 0.00 C ATOM 1930 C ARG A 129 4.194 -8.467 4.070 1.00 0.00 C ATOM 1931 O ARG A 129 3.795 -9.551 4.445 1.00 0.00 O ATOM 1932 CB ARG A 129 5.393 -6.796 5.488 1.00 0.00 C ATOM 1933 CG ARG A 129 4.920 -7.364 6.828 1.00 0.00 C ATOM 1934 CD ARG A 129 3.658 -6.628 7.279 1.00 0.00 C ATOM 1935 NE ARG A 129 3.936 -5.900 8.549 1.00 0.00 N ATOM 1936 CZ ARG A 129 4.991 -5.138 8.646 1.00 0.00 C ATOM 1937 NH1 ARG A 129 5.408 -4.465 7.608 1.00 0.00 N ATOM 1938 NH2 ARG A 129 5.626 -5.048 9.782 1.00 0.00 N ATOM 0 H ARG A 129 6.309 -6.431 3.170 1.00 0.00 H new ATOM 0 HA ARG A 129 6.140 -8.745 4.952 1.00 0.00 H new ATOM 0 HB2 ARG A 129 6.335 -6.263 5.618 1.00 0.00 H new ATOM 0 HB3 ARG A 129 4.668 -6.075 5.109 1.00 0.00 H new ATOM 0 HG2 ARG A 129 4.716 -8.430 6.731 1.00 0.00 H new ATOM 0 HG3 ARG A 129 5.704 -7.256 7.578 1.00 0.00 H new ATOM 0 HD2 ARG A 129 3.337 -5.927 6.508 1.00 0.00 H new ATOM 0 HD3 ARG A 129 2.843 -7.337 7.424 1.00 0.00 H new ATOM 0 HE ARG A 129 3.302 -5.997 9.342 1.00 0.00 H new ATOM 0 HH11 ARG A 129 4.909 -4.535 6.721 1.00 0.00 H new ATOM 0 HH12 ARG A 129 6.233 -3.869 7.684 1.00 0.00 H new ATOM 0 HH21 ARG A 129 5.298 -5.573 10.593 1.00 0.00 H new ATOM 0 HH22 ARG A 129 6.451 -4.453 9.859 1.00 0.00 H new ATOM 1952 N VAL A 130 3.465 -7.707 3.300 1.00 0.00 N ATOM 1953 CA VAL A 130 2.116 -8.165 2.864 1.00 0.00 C ATOM 1954 C VAL A 130 2.251 -9.450 2.044 1.00 0.00 C ATOM 1955 O VAL A 130 1.463 -10.366 2.177 1.00 0.00 O ATOM 1956 CB VAL A 130 1.458 -7.078 2.013 1.00 0.00 C ATOM 1957 CG1 VAL A 130 1.232 -5.828 2.865 1.00 0.00 C ATOM 1958 CG2 VAL A 130 2.366 -6.732 0.832 1.00 0.00 C ATOM 0 H VAL A 130 3.745 -6.789 2.954 1.00 0.00 H new ATOM 0 HA VAL A 130 1.498 -8.361 3.741 1.00 0.00 H new ATOM 0 HB VAL A 130 0.500 -7.442 1.640 1.00 0.00 H new ATOM 0 HG11 VAL A 130 0.763 -5.054 2.258 1.00 0.00 H new ATOM 0 HG12 VAL A 130 0.583 -6.073 3.705 1.00 0.00 H new ATOM 0 HG13 VAL A 130 2.189 -5.465 3.240 1.00 0.00 H new ATOM 0 HG21 VAL A 130 1.896 -5.957 0.226 1.00 0.00 H new ATOM 0 HG22 VAL A 130 3.325 -6.370 1.204 1.00 0.00 H new ATOM 0 HG23 VAL A 130 2.526 -7.622 0.223 1.00 0.00 H new ATOM 1968 N ILE A 131 3.243 -9.527 1.199 1.00 0.00 N ATOM 1969 CA ILE A 131 3.422 -10.758 0.379 1.00 0.00 C ATOM 1970 C ILE A 131 3.755 -11.934 1.299 1.00 0.00 C ATOM 1971 O ILE A 131 3.232 -13.019 1.149 1.00 0.00 O ATOM 1972 CB ILE A 131 4.564 -10.552 -0.619 1.00 0.00 C ATOM 1973 CG1 ILE A 131 4.713 -11.808 -1.483 1.00 0.00 C ATOM 1974 CG2 ILE A 131 5.868 -10.303 0.140 1.00 0.00 C ATOM 1975 CD1 ILE A 131 5.874 -11.624 -2.462 1.00 0.00 C ATOM 0 H ILE A 131 3.934 -8.794 1.042 1.00 0.00 H new ATOM 0 HA ILE A 131 2.502 -10.968 -0.166 1.00 0.00 H new ATOM 0 HB ILE A 131 4.343 -9.693 -1.253 1.00 0.00 H new ATOM 0 HG12 ILE A 131 4.892 -12.677 -0.850 1.00 0.00 H new ATOM 0 HG13 ILE A 131 3.789 -11.997 -2.030 1.00 0.00 H new ATOM 0 HG21 ILE A 131 6.681 -10.156 -0.571 1.00 0.00 H new ATOM 0 HG22 ILE A 131 5.764 -9.413 0.760 1.00 0.00 H new ATOM 0 HG23 ILE A 131 6.090 -11.162 0.773 1.00 0.00 H new ATOM 0 HD11 ILE A 131 5.978 -12.519 -3.075 1.00 0.00 H new ATOM 0 HD12 ILE A 131 5.676 -10.765 -3.104 1.00 0.00 H new ATOM 0 HD13 ILE A 131 6.796 -11.457 -1.905 1.00 0.00 H new ATOM 1987 N GLU A 132 4.619 -11.724 2.255 1.00 0.00 N ATOM 1988 CA GLU A 132 4.980 -12.828 3.186 1.00 0.00 C ATOM 1989 C GLU A 132 3.702 -13.404 3.799 1.00 0.00 C ATOM 1990 O GLU A 132 3.651 -14.553 4.191 1.00 0.00 O ATOM 1991 CB GLU A 132 5.881 -12.285 4.298 1.00 0.00 C ATOM 1992 CG GLU A 132 7.269 -11.978 3.729 1.00 0.00 C ATOM 1993 CD GLU A 132 8.290 -12.955 4.315 1.00 0.00 C ATOM 1994 OE1 GLU A 132 7.967 -14.127 4.418 1.00 0.00 O ATOM 1995 OE2 GLU A 132 9.378 -12.515 4.649 1.00 0.00 O ATOM 0 H GLU A 132 5.089 -10.836 2.430 1.00 0.00 H new ATOM 0 HA GLU A 132 5.511 -13.609 2.642 1.00 0.00 H new ATOM 0 HB2 GLU A 132 5.444 -11.383 4.726 1.00 0.00 H new ATOM 0 HB3 GLU A 132 5.960 -13.014 5.104 1.00 0.00 H new ATOM 0 HG2 GLU A 132 7.254 -12.060 2.642 1.00 0.00 H new ATOM 0 HG3 GLU A 132 7.553 -10.953 3.968 1.00 0.00 H new ATOM 2002 N LEU A 133 2.666 -12.613 3.880 1.00 0.00 N ATOM 2003 CA LEU A 133 1.389 -13.111 4.462 1.00 0.00 C ATOM 2004 C LEU A 133 0.693 -14.018 3.445 1.00 0.00 C ATOM 2005 O LEU A 133 0.274 -15.114 3.760 1.00 0.00 O ATOM 2006 CB LEU A 133 0.481 -11.925 4.797 1.00 0.00 C ATOM 2007 CG LEU A 133 0.639 -11.558 6.274 1.00 0.00 C ATOM 2008 CD1 LEU A 133 1.334 -10.201 6.395 1.00 0.00 C ATOM 2009 CD2 LEU A 133 -0.741 -11.482 6.931 1.00 0.00 C ATOM 0 H LEU A 133 2.650 -11.642 3.567 1.00 0.00 H new ATOM 0 HA LEU A 133 1.596 -13.673 5.373 1.00 0.00 H new ATOM 0 HB2 LEU A 133 0.736 -11.070 4.170 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -0.558 -12.178 4.584 1.00 0.00 H new ATOM 0 HG LEU A 133 1.240 -12.319 6.773 1.00 0.00 H new ATOM 0 HD11 LEU A 133 1.445 -9.942 7.448 1.00 0.00 H new ATOM 0 HD12 LEU A 133 2.318 -10.253 5.928 1.00 0.00 H new ATOM 0 HD13 LEU A 133 0.735 -9.440 5.895 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -0.629 -11.221 7.983 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -1.341 -10.722 6.430 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -1.237 -12.449 6.848 1.00 0.00 H new ATOM 2021 N THR A 134 0.571 -13.571 2.224 1.00 0.00 N ATOM 2022 CA THR A 134 -0.093 -14.410 1.187 1.00 0.00 C ATOM 2023 C THR A 134 0.582 -15.783 1.141 1.00 0.00 C ATOM 2024 O THR A 134 0.019 -16.746 0.660 1.00 0.00 O ATOM 2025 CB THR A 134 0.039 -13.731 -0.179 1.00 0.00 C ATOM 2026 OG1 THR A 134 1.317 -13.119 -0.281 1.00 0.00 O ATOM 2027 CG2 THR A 134 -1.050 -12.669 -0.331 1.00 0.00 C ATOM 0 H THR A 134 0.902 -12.662 1.901 1.00 0.00 H new ATOM 0 HA THR A 134 -1.148 -14.529 1.432 1.00 0.00 H new ATOM 0 HB THR A 134 -0.071 -14.476 -0.967 1.00 0.00 H new ATOM 0 HG1 THR A 134 1.976 -13.655 0.207 1.00 0.00 H new ATOM 0 HG21 THR A 134 -0.955 -12.187 -1.304 1.00 0.00 H new ATOM 0 HG22 THR A 134 -2.030 -13.139 -0.254 1.00 0.00 H new ATOM 0 HG23 THR A 134 -0.943 -11.923 0.456 1.00 0.00 H new ATOM 2035 N LYS A 135 1.785 -15.879 1.640 1.00 0.00 N ATOM 2036 CA LYS A 135 2.496 -17.189 1.628 1.00 0.00 C ATOM 2037 C LYS A 135 1.925 -18.089 2.724 1.00 0.00 C ATOM 2038 O LYS A 135 1.482 -19.190 2.469 1.00 0.00 O ATOM 2039 CB LYS A 135 3.988 -16.963 1.882 1.00 0.00 C ATOM 2040 CG LYS A 135 4.658 -16.471 0.598 1.00 0.00 C ATOM 2041 CD LYS A 135 6.028 -15.878 0.929 1.00 0.00 C ATOM 2042 CE LYS A 135 7.102 -16.956 0.777 1.00 0.00 C ATOM 2043 NZ LYS A 135 7.589 -16.976 -0.632 1.00 0.00 N ATOM 0 H LYS A 135 2.306 -15.107 2.055 1.00 0.00 H new ATOM 0 HA LYS A 135 2.360 -17.666 0.657 1.00 0.00 H new ATOM 0 HB2 LYS A 135 4.125 -16.232 2.679 1.00 0.00 H new ATOM 0 HB3 LYS A 135 4.455 -17.890 2.216 1.00 0.00 H new ATOM 0 HG2 LYS A 135 4.768 -17.296 -0.106 1.00 0.00 H new ATOM 0 HG3 LYS A 135 4.033 -15.720 0.114 1.00 0.00 H new ATOM 0 HD2 LYS A 135 6.243 -15.040 0.266 1.00 0.00 H new ATOM 0 HD3 LYS A 135 6.031 -15.488 1.947 1.00 0.00 H new ATOM 0 HE2 LYS A 135 7.931 -16.758 1.457 1.00 0.00 H new ATOM 0 HE3 LYS A 135 6.695 -17.931 1.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 8.319 -17.709 -0.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 6.795 -17.185 -1.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 7.992 -16.048 -0.873 1.00 0.00 H new ATOM 2057 N LYS A 136 1.932 -17.627 3.945 1.00 0.00 N ATOM 2058 CA LYS A 136 1.391 -18.457 5.058 1.00 0.00 C ATOM 2059 C LYS A 136 -0.122 -18.246 5.165 1.00 0.00 C ATOM 2060 O LYS A 136 -0.759 -18.719 6.085 1.00 0.00 O ATOM 2061 CB LYS A 136 2.058 -18.041 6.371 1.00 0.00 C ATOM 2062 CG LYS A 136 1.758 -16.567 6.650 1.00 0.00 C ATOM 2063 CD LYS A 136 1.777 -16.319 8.160 1.00 0.00 C ATOM 2064 CE LYS A 136 3.147 -16.701 8.725 1.00 0.00 C ATOM 2065 NZ LYS A 136 3.012 -17.924 9.565 1.00 0.00 N ATOM 0 H LYS A 136 2.289 -16.712 4.219 1.00 0.00 H new ATOM 0 HA LYS A 136 1.597 -19.509 4.861 1.00 0.00 H new ATOM 0 HB2 LYS A 136 1.691 -18.659 7.190 1.00 0.00 H new ATOM 0 HB3 LYS A 136 3.135 -18.199 6.310 1.00 0.00 H new ATOM 0 HG2 LYS A 136 2.497 -15.935 6.158 1.00 0.00 H new ATOM 0 HG3 LYS A 136 0.785 -16.299 6.239 1.00 0.00 H new ATOM 0 HD2 LYS A 136 1.565 -15.270 8.369 1.00 0.00 H new ATOM 0 HD3 LYS A 136 0.996 -16.905 8.645 1.00 0.00 H new ATOM 0 HE2 LYS A 136 3.851 -16.881 7.912 1.00 0.00 H new ATOM 0 HE3 LYS A 136 3.549 -15.881 9.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 3.850 -18.527 9.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 2.930 -17.651 10.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 2.161 -18.449 9.279 1.00 0.00 H new ATOM 2079 N ALA A 137 -0.701 -17.541 4.233 1.00 0.00 N ATOM 2080 CA ALA A 137 -2.171 -17.302 4.285 1.00 0.00 C ATOM 2081 C ALA A 137 -2.912 -18.618 4.036 1.00 0.00 C ATOM 2082 O ALA A 137 -3.772 -19.009 4.800 1.00 0.00 O ATOM 2083 CB ALA A 137 -2.560 -16.288 3.206 1.00 0.00 C ATOM 0 H ALA A 137 -0.220 -17.120 3.438 1.00 0.00 H new ATOM 0 HA ALA A 137 -2.441 -16.913 5.267 1.00 0.00 H new ATOM 0 HB1 ALA A 137 -3.635 -16.112 3.243 1.00 0.00 H new ATOM 0 HB2 ALA A 137 -2.033 -15.350 3.381 1.00 0.00 H new ATOM 0 HB3 ALA A 137 -2.290 -16.679 2.225 1.00 0.00 H new ATOM 2089 N MET A 138 -2.587 -19.302 2.973 1.00 0.00 N ATOM 2090 CA MET A 138 -3.276 -20.589 2.677 1.00 0.00 C ATOM 2091 C MET A 138 -2.282 -21.744 2.815 1.00 0.00 C ATOM 2092 O MET A 138 -1.091 -21.484 2.775 1.00 0.00 O ATOM 2093 CB MET A 138 -3.823 -20.553 1.249 1.00 0.00 C ATOM 2094 CG MET A 138 -4.689 -19.305 1.065 1.00 0.00 C ATOM 2095 SD MET A 138 -6.374 -19.799 0.625 1.00 0.00 S ATOM 2096 CE MET A 138 -6.740 -20.726 2.135 1.00 0.00 C ATOM 2097 OXT MET A 138 -2.729 -22.871 2.958 1.00 0.00 O ATOM 0 H MET A 138 -1.875 -19.025 2.298 1.00 0.00 H new ATOM 0 HA MET A 138 -4.097 -20.733 3.379 1.00 0.00 H new ATOM 0 HB2 MET A 138 -3.001 -20.547 0.533 1.00 0.00 H new ATOM 0 HB3 MET A 138 -4.411 -21.449 1.051 1.00 0.00 H new ATOM 0 HG2 MET A 138 -4.699 -18.718 1.983 1.00 0.00 H new ATOM 0 HG3 MET A 138 -4.269 -18.670 0.285 1.00 0.00 H new ATOM 0 HE1 MET A 138 -7.820 -20.808 2.259 1.00 0.00 H new ATOM 0 HE2 MET A 138 -6.306 -21.724 2.064 1.00 0.00 H new ATOM 0 HE3 MET A 138 -6.314 -20.206 2.993 1.00 0.00 H new