USER MOD reduce.3.24.130724 H: found=0, std=0, add=1198, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1202 hydrogens (4 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 96 HIS HE2 : A 96 HIS NE2 : A 180 FE2FE :(H bumps) USER MOD NoAdj-H: A 98 HIS HE2 : A 98 HIS NE2 : A 180 FE2FE :(H bumps) USER MOD NoAdj-H: A 140 HIS HE2 : A 140 HIS NE2 : A 180 FE2FE :(H bumps) USER MOD Set 1.1: A 4 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 123 GLN : amide:sc= -0.0135 X(o=-0.013,f=0.43) USER MOD Single : A 1 SER N :NH3+ -170:sc= -0.0452 (180deg=-0.182) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= -0.0224 K(o=-0.022,f=-1.2) USER MOD Single : A 13 ASN : amide:sc= -0.0479 K(o=-0.048,f=-1.1) USER MOD Single : A 14 SER OG : rot 130:sc= 0 USER MOD Single : A 17 HIS : no HE2:sc= 1.03 K(o=1,f=-5!) USER MOD Single : A 18 SER OG : rot 21:sc= 1 USER MOD Single : A 19 THR OG1 : rot 139:sc= 0.735 USER MOD Single : A 20 ASN :FLIP amide:sc= -4.72! C(o=-11!,f=-4.7!) USER MOD Single : A 25 GLN : amide:sc= -0.322 X(o=-0.32,f=-0.011) USER MOD Single : A 26 GLN :FLIP amide:sc= 0 F(o=-1.3!,f=0) USER MOD Single : A 27 GLN : amide:sc= -0.338 K(o=-0.34,f=-1.4) USER MOD Single : A 29 ASN :FLIP amide:sc= -3.85! C(o=-4.3!,f=-3.8!) USER MOD Single : A 31 LYS NZ :NH3+ 178:sc= 0.475 (180deg=0.473) USER MOD Single : A 39 GLN : amide:sc= -0.159 X(o=-0.16,f=-0.16) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 150:sc= -0.648 USER MOD Single : A 57 TYR OH : rot 83:sc= 0.807 USER MOD Single : A 58 GLN :FLIP amide:sc= -4.13! C(o=-6.4!,f=-4.1!) USER MOD Single : A 59 HIS :FLIP no HE2:sc= -2.09! C(o=-4.5!,f=-2.1!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 TYR OH : rot -130:sc= -2.42 USER MOD Single : A 71 GLN : amide:sc= -0.142 K(o=-0.14,f=-0.99) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0.00817 USER MOD Single : A 82 ASN : amide:sc= -0.18 K(o=-0.18,f=-2.7!) USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=-0.032) USER MOD Single : A 85 LYS NZ :NH3+ -159:sc= -0.38 (180deg=-0.996) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 ASN : amide:sc= -1.28! C(o=-1.3!,f=-5.7!) USER MOD Single : A 97 THR OG1 : rot 180:sc= -0.0202 USER MOD Single : A 114 CYS SG : rot 180:sc= -0.661 USER MOD Single : A 116 HIS : no HD1:sc= -0.197 K(o=-0.2,f=-2.1) USER MOD Single : A 126 CYS SG : rot 98:sc= -2.39! USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 ASN : amide:sc= -2.27 K(o=-2.3,f=-3.2!) USER MOD Single : A 133 SER OG : rot 18:sc= -3.24! USER MOD Single : A 137 HIS : no HD1:sc= -0.405 X(o=-0.4,f=-0.63) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 MET CE :methyl 179:sc= 0 (180deg=-0.00127) USER MOD Single : A 146 SER OG : rot 180:sc= -0.863 USER MOD Single : A 149 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 151 THR OG1 : rot 79:sc= 0.66 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 8.166 6.385 1.299 1.00 0.00 N ATOM 2 CA SER A 1 9.124 7.518 1.166 1.00 0.00 C ATOM 3 C SER A 1 9.390 8.131 2.544 1.00 0.00 C ATOM 4 O SER A 1 10.381 8.803 2.752 1.00 0.00 O ATOM 5 CB SER A 1 8.533 8.580 0.239 1.00 0.00 C ATOM 6 OG SER A 1 7.522 9.301 0.932 1.00 0.00 O ATOM 0 H1 SER A 1 8.116 5.865 0.400 1.00 0.00 H new ATOM 0 H2 SER A 1 8.489 5.744 2.052 1.00 0.00 H new ATOM 0 H3 SER A 1 7.223 6.754 1.538 1.00 0.00 H new ATOM 0 HA SER A 1 10.061 7.152 0.747 1.00 0.00 H new ATOM 0 HB2 SER A 1 9.315 9.261 -0.098 1.00 0.00 H new ATOM 0 HB3 SER A 1 8.115 8.110 -0.651 1.00 0.00 H new ATOM 0 HG SER A 1 7.143 9.984 0.340 1.00 0.00 H new ATOM 14 N ALA A 2 8.514 7.909 3.487 1.00 0.00 N ATOM 15 CA ALA A 2 8.730 8.490 4.851 1.00 0.00 C ATOM 16 C ALA A 2 8.053 7.616 5.902 1.00 0.00 C ATOM 17 O ALA A 2 7.098 6.921 5.616 1.00 0.00 O ATOM 18 CB ALA A 2 8.142 9.899 4.896 1.00 0.00 C ATOM 0 H ALA A 2 7.664 7.356 3.377 1.00 0.00 H new ATOM 0 HA ALA A 2 9.799 8.532 5.062 1.00 0.00 H new ATOM 0 HB1 ALA A 2 8.297 10.326 5.887 1.00 0.00 H new ATOM 0 HB2 ALA A 2 8.635 10.523 4.151 1.00 0.00 H new ATOM 0 HB3 ALA A 2 7.074 9.855 4.683 1.00 0.00 H new ATOM 24 N LEU A 3 8.525 7.650 7.128 1.00 0.00 N ATOM 25 CA LEU A 3 7.882 6.830 8.182 1.00 0.00 C ATOM 26 C LEU A 3 7.797 7.667 9.457 1.00 0.00 C ATOM 27 O LEU A 3 8.751 8.299 9.867 1.00 0.00 O ATOM 28 CB LEU A 3 8.702 5.562 8.418 1.00 0.00 C ATOM 29 CG LEU A 3 8.132 4.793 9.613 1.00 0.00 C ATOM 30 CD1 LEU A 3 6.661 4.464 9.353 1.00 0.00 C ATOM 31 CD2 LEU A 3 8.921 3.494 9.797 1.00 0.00 C ATOM 0 H LEU A 3 9.322 8.209 7.433 1.00 0.00 H new ATOM 0 HA LEU A 3 6.879 6.532 7.877 1.00 0.00 H new ATOM 0 HB2 LEU A 3 8.683 4.934 7.527 1.00 0.00 H new ATOM 0 HB3 LEU A 3 9.744 5.821 8.604 1.00 0.00 H new ATOM 0 HG LEU A 3 8.212 5.402 10.514 1.00 0.00 H new ATOM 0 HD11 LEU A 3 6.255 3.916 10.203 1.00 0.00 H new ATOM 0 HD12 LEU A 3 6.100 5.388 9.215 1.00 0.00 H new ATOM 0 HD13 LEU A 3 6.578 3.852 8.455 1.00 0.00 H new ATOM 0 HD21 LEU A 3 8.520 2.942 10.647 1.00 0.00 H new ATOM 0 HD22 LEU A 3 8.836 2.886 8.896 1.00 0.00 H new ATOM 0 HD23 LEU A 3 9.970 3.728 9.979 1.00 0.00 H new ATOM 43 N THR A 4 6.654 7.675 10.078 1.00 0.00 N ATOM 44 CA THR A 4 6.483 8.466 11.325 1.00 0.00 C ATOM 45 C THR A 4 5.792 7.598 12.372 1.00 0.00 C ATOM 46 O THR A 4 4.874 6.876 12.073 1.00 0.00 O ATOM 47 CB THR A 4 5.625 9.693 11.033 1.00 0.00 C ATOM 48 OG1 THR A 4 5.958 10.214 9.755 1.00 0.00 O ATOM 49 CG2 THR A 4 5.883 10.754 12.093 1.00 0.00 C ATOM 0 H THR A 4 5.825 7.164 9.774 1.00 0.00 H new ATOM 0 HA THR A 4 7.456 8.787 11.697 1.00 0.00 H new ATOM 0 HB THR A 4 4.572 9.410 11.046 1.00 0.00 H new ATOM 0 HG1 THR A 4 5.405 11.001 9.568 1.00 0.00 H new ATOM 0 HG21 THR A 4 5.271 11.632 11.886 1.00 0.00 H new ATOM 0 HG22 THR A 4 5.627 10.357 13.075 1.00 0.00 H new ATOM 0 HG23 THR A 4 6.936 11.035 12.078 1.00 0.00 H new ATOM 57 N ILE A 5 6.199 7.672 13.600 1.00 0.00 N ATOM 58 CA ILE A 5 5.507 6.854 14.634 1.00 0.00 C ATOM 59 C ILE A 5 5.451 7.649 15.930 1.00 0.00 C ATOM 60 O ILE A 5 6.477 7.967 16.494 1.00 0.00 O ATOM 61 CB ILE A 5 6.290 5.555 14.873 1.00 0.00 C ATOM 62 CG1 ILE A 5 6.830 5.022 13.537 1.00 0.00 C ATOM 63 CG2 ILE A 5 5.355 4.513 15.494 1.00 0.00 C ATOM 64 CD1 ILE A 5 7.733 3.811 13.777 1.00 0.00 C ATOM 0 H ILE A 5 6.968 8.252 13.934 1.00 0.00 H new ATOM 0 HA ILE A 5 4.499 6.611 14.298 1.00 0.00 H new ATOM 0 HB ILE A 5 7.125 5.752 15.546 1.00 0.00 H new ATOM 0 HG12 ILE A 5 6.001 4.743 12.887 1.00 0.00 H new ATOM 0 HG13 ILE A 5 7.388 5.805 13.024 1.00 0.00 H new ATOM 0 HG21 ILE A 5 5.905 3.588 15.666 1.00 0.00 H new ATOM 0 HG22 ILE A 5 4.970 4.889 16.442 1.00 0.00 H new ATOM 0 HG23 ILE A 5 4.524 4.320 14.816 1.00 0.00 H new ATOM 0 HD11 ILE A 5 8.109 3.443 12.823 1.00 0.00 H new ATOM 0 HD12 ILE A 5 8.572 4.102 14.410 1.00 0.00 H new ATOM 0 HD13 ILE A 5 7.163 3.024 14.270 1.00 0.00 H new ATOM 76 N PHE A 6 4.291 8.010 16.420 1.00 0.00 N ATOM 77 CA PHE A 6 4.208 8.803 17.676 1.00 0.00 C ATOM 78 C PHE A 6 3.564 7.934 18.752 1.00 0.00 C ATOM 79 O PHE A 6 3.055 6.868 18.471 1.00 0.00 O ATOM 80 CB PHE A 6 3.323 10.032 17.456 1.00 0.00 C ATOM 81 CG PHE A 6 3.140 10.307 15.977 1.00 0.00 C ATOM 82 CD1 PHE A 6 2.371 9.446 15.181 1.00 0.00 C ATOM 83 CD2 PHE A 6 3.731 11.438 15.404 1.00 0.00 C ATOM 84 CE1 PHE A 6 2.200 9.716 13.820 1.00 0.00 C ATOM 85 CE2 PHE A 6 3.558 11.707 14.044 1.00 0.00 C ATOM 86 CZ PHE A 6 2.793 10.845 13.251 1.00 0.00 C ATOM 0 H PHE A 6 3.391 7.785 15.996 1.00 0.00 H new ATOM 0 HA PHE A 6 5.207 9.120 17.975 1.00 0.00 H new ATOM 0 HB2 PHE A 6 2.351 9.874 17.924 1.00 0.00 H new ATOM 0 HB3 PHE A 6 3.772 10.900 17.939 1.00 0.00 H new ATOM 0 HD1 PHE A 6 1.910 8.573 15.620 1.00 0.00 H new ATOM 0 HD2 PHE A 6 4.322 12.105 16.014 1.00 0.00 H new ATOM 0 HE1 PHE A 6 1.609 9.051 13.208 1.00 0.00 H new ATOM 0 HE2 PHE A 6 4.015 12.581 13.604 1.00 0.00 H new ATOM 0 HZ PHE A 6 2.661 11.053 12.199 1.00 0.00 H new ATOM 96 N SER A 7 3.546 8.382 19.978 1.00 0.00 N ATOM 97 CA SER A 7 2.894 7.573 21.040 1.00 0.00 C ATOM 98 C SER A 7 1.380 7.809 20.989 1.00 0.00 C ATOM 99 O SER A 7 0.914 8.828 20.519 1.00 0.00 O ATOM 100 CB SER A 7 3.427 7.997 22.408 1.00 0.00 C ATOM 101 OG SER A 7 4.829 7.767 22.457 1.00 0.00 O ATOM 0 H SER A 7 3.952 9.266 20.286 1.00 0.00 H new ATOM 0 HA SER A 7 3.110 6.517 20.881 1.00 0.00 H new ATOM 0 HB2 SER A 7 3.213 9.051 22.584 1.00 0.00 H new ATOM 0 HB3 SER A 7 2.927 7.435 23.196 1.00 0.00 H new ATOM 0 HG SER A 7 5.175 8.039 23.333 1.00 0.00 H new ATOM 107 N VAL A 8 0.616 6.873 21.476 1.00 0.00 N ATOM 108 CA VAL A 8 -0.869 7.040 21.462 1.00 0.00 C ATOM 109 C VAL A 8 -1.251 8.289 22.264 1.00 0.00 C ATOM 110 O VAL A 8 -2.346 8.800 22.145 1.00 0.00 O ATOM 111 CB VAL A 8 -1.545 5.815 22.092 1.00 0.00 C ATOM 112 CG1 VAL A 8 -1.748 4.731 21.032 1.00 0.00 C ATOM 113 CG2 VAL A 8 -0.667 5.261 23.214 1.00 0.00 C ATOM 0 H VAL A 8 0.952 6.000 21.883 1.00 0.00 H new ATOM 0 HA VAL A 8 -1.202 7.144 20.429 1.00 0.00 H new ATOM 0 HB VAL A 8 -2.512 6.114 22.497 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -2.228 3.864 21.486 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -2.379 5.118 20.232 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -0.782 4.437 20.622 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -1.151 4.391 23.659 1.00 0.00 H new ATOM 0 HG22 VAL A 8 0.302 4.969 22.808 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -0.525 6.027 23.977 1.00 0.00 H new ATOM 123 N LYS A 9 -0.358 8.789 23.073 1.00 0.00 N ATOM 124 CA LYS A 9 -0.679 10.008 23.870 1.00 0.00 C ATOM 125 C LYS A 9 -0.140 11.260 23.167 1.00 0.00 C ATOM 126 O LYS A 9 -0.708 12.329 23.271 1.00 0.00 O ATOM 127 CB LYS A 9 -0.037 9.890 25.253 1.00 0.00 C ATOM 128 CG LYS A 9 -0.702 8.755 26.033 1.00 0.00 C ATOM 129 CD LYS A 9 -0.139 8.717 27.455 1.00 0.00 C ATOM 130 CE LYS A 9 -0.732 7.524 28.204 1.00 0.00 C ATOM 131 NZ LYS A 9 -0.141 7.452 29.568 1.00 0.00 N ATOM 0 H LYS A 9 0.577 8.408 23.217 1.00 0.00 H new ATOM 0 HA LYS A 9 -1.761 10.094 23.967 1.00 0.00 H new ATOM 0 HB2 LYS A 9 1.032 9.699 25.154 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -0.144 10.829 25.796 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -1.782 8.902 26.061 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -0.523 7.803 25.534 1.00 0.00 H new ATOM 0 HD2 LYS A 9 0.948 8.638 27.426 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -0.378 9.643 27.977 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -1.815 7.624 28.270 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -0.530 6.602 27.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -0.544 6.640 30.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 0.890 7.337 29.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -0.356 8.328 30.086 1.00 0.00 H new ATOM 145 N ASP A 10 0.965 11.138 22.473 1.00 0.00 N ATOM 146 CA ASP A 10 1.556 12.324 21.778 1.00 0.00 C ATOM 147 C ASP A 10 1.545 12.126 20.254 1.00 0.00 C ATOM 148 O ASP A 10 2.516 11.680 19.676 1.00 0.00 O ATOM 149 CB ASP A 10 2.999 12.508 22.250 1.00 0.00 C ATOM 150 CG ASP A 10 3.445 13.946 21.983 1.00 0.00 C ATOM 151 OD1 ASP A 10 2.771 14.625 21.224 1.00 0.00 O ATOM 152 OD2 ASP A 10 4.454 14.344 22.540 1.00 0.00 O ATOM 0 H ASP A 10 1.484 10.267 22.358 1.00 0.00 H new ATOM 0 HA ASP A 10 0.961 13.205 22.018 1.00 0.00 H new ATOM 0 HB2 ASP A 10 3.076 12.284 23.314 1.00 0.00 H new ATOM 0 HB3 ASP A 10 3.655 11.810 21.729 1.00 0.00 H new ATOM 157 N PRO A 11 0.463 12.466 19.606 1.00 0.00 N ATOM 158 CA PRO A 11 0.329 12.340 18.128 1.00 0.00 C ATOM 159 C PRO A 11 0.844 13.580 17.391 1.00 0.00 C ATOM 160 O PRO A 11 0.953 13.596 16.182 1.00 0.00 O ATOM 161 CB PRO A 11 -1.177 12.191 17.936 1.00 0.00 C ATOM 162 CG PRO A 11 -1.800 12.942 19.072 1.00 0.00 C ATOM 163 CD PRO A 11 -0.764 13.009 20.205 1.00 0.00 C ATOM 0 HA PRO A 11 0.913 11.511 17.727 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -1.493 12.599 16.976 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -1.473 11.142 17.950 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -2.088 13.945 18.756 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -2.707 12.441 19.411 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -0.619 14.032 20.551 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -1.079 12.422 21.068 1.00 0.00 H new ATOM 171 N GLN A 12 1.152 14.623 18.112 1.00 0.00 N ATOM 172 CA GLN A 12 1.643 15.866 17.454 1.00 0.00 C ATOM 173 C GLN A 12 3.174 15.853 17.367 1.00 0.00 C ATOM 174 O GLN A 12 3.761 16.564 16.575 1.00 0.00 O ATOM 175 CB GLN A 12 1.195 17.075 18.280 1.00 0.00 C ATOM 176 CG GLN A 12 0.121 17.855 17.519 1.00 0.00 C ATOM 177 CD GLN A 12 -1.147 17.006 17.410 1.00 0.00 C ATOM 178 OE1 GLN A 12 -1.559 16.382 18.367 1.00 0.00 O ATOM 179 NE2 GLN A 12 -1.788 16.958 16.275 1.00 0.00 N ATOM 0 H GLN A 12 1.085 14.668 19.129 1.00 0.00 H new ATOM 0 HA GLN A 12 1.233 15.924 16.446 1.00 0.00 H new ATOM 0 HB2 GLN A 12 0.804 16.744 19.242 1.00 0.00 H new ATOM 0 HB3 GLN A 12 2.048 17.721 18.488 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -0.098 18.790 18.035 1.00 0.00 H new ATOM 0 HG3 GLN A 12 0.483 18.117 16.525 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -1.442 17.482 15.471 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -2.635 16.396 16.191 1.00 0.00 H new ATOM 188 N ASN A 13 3.825 15.054 18.169 1.00 0.00 N ATOM 189 CA ASN A 13 5.319 15.002 18.122 1.00 0.00 C ATOM 190 C ASN A 13 5.785 13.550 18.023 1.00 0.00 C ATOM 191 O ASN A 13 5.717 12.813 18.986 1.00 0.00 O ATOM 192 CB ASN A 13 5.883 15.626 19.397 1.00 0.00 C ATOM 193 CG ASN A 13 5.388 17.066 19.513 1.00 0.00 C ATOM 194 OD1 ASN A 13 5.307 17.771 18.528 1.00 0.00 O ATOM 195 ND2 ASN A 13 5.049 17.535 20.682 1.00 0.00 N ATOM 0 H ASN A 13 3.390 14.436 18.854 1.00 0.00 H new ATOM 0 HA ASN A 13 5.672 15.553 17.250 1.00 0.00 H new ATOM 0 HB2 ASN A 13 5.569 15.050 20.268 1.00 0.00 H new ATOM 0 HB3 ASN A 13 6.973 15.604 19.376 1.00 0.00 H new ATOM 0 HD21 ASN A 13 4.715 18.495 20.769 1.00 0.00 H new ATOM 0 HD22 ASN A 13 5.117 16.942 21.509 1.00 0.00 H new ATOM 202 N SER A 14 6.248 13.111 16.882 1.00 0.00 N ATOM 203 CA SER A 14 6.696 11.695 16.777 1.00 0.00 C ATOM 204 C SER A 14 8.022 11.493 17.508 1.00 0.00 C ATOM 205 O SER A 14 8.941 12.278 17.388 1.00 0.00 O ATOM 206 CB SER A 14 6.881 11.329 15.303 1.00 0.00 C ATOM 207 OG SER A 14 8.213 11.632 14.906 1.00 0.00 O ATOM 0 H SER A 14 6.334 13.665 16.030 1.00 0.00 H new ATOM 0 HA SER A 14 5.939 11.057 17.233 1.00 0.00 H new ATOM 0 HB2 SER A 14 6.676 10.269 15.151 1.00 0.00 H new ATOM 0 HB3 SER A 14 6.171 11.882 14.687 1.00 0.00 H new ATOM 0 HG SER A 14 8.605 10.855 14.455 1.00 0.00 H new ATOM 213 N LEU A 15 8.130 10.424 18.243 1.00 0.00 N ATOM 214 CA LEU A 15 9.394 10.133 18.969 1.00 0.00 C ATOM 215 C LEU A 15 10.310 9.331 18.044 1.00 0.00 C ATOM 216 O LEU A 15 11.306 8.784 18.472 1.00 0.00 O ATOM 217 CB LEU A 15 9.098 9.293 20.214 1.00 0.00 C ATOM 218 CG LEU A 15 8.051 9.992 21.079 1.00 0.00 C ATOM 219 CD1 LEU A 15 7.837 9.191 22.366 1.00 0.00 C ATOM 220 CD2 LEU A 15 8.538 11.397 21.426 1.00 0.00 C ATOM 0 H LEU A 15 7.390 9.734 18.373 1.00 0.00 H new ATOM 0 HA LEU A 15 9.868 11.068 19.267 1.00 0.00 H new ATOM 0 HB2 LEU A 15 8.739 8.307 19.920 1.00 0.00 H new ATOM 0 HB3 LEU A 15 10.013 9.142 20.787 1.00 0.00 H new ATOM 0 HG LEU A 15 7.110 10.058 20.533 1.00 0.00 H new ATOM 0 HD11 LEU A 15 7.090 9.689 22.984 1.00 0.00 H new ATOM 0 HD12 LEU A 15 7.492 8.188 22.117 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.777 9.126 22.914 1.00 0.00 H new ATOM 0 HD21 LEU A 15 7.793 11.898 22.043 1.00 0.00 H new ATOM 0 HD22 LEU A 15 9.478 11.331 21.974 1.00 0.00 H new ATOM 0 HD23 LEU A 15 8.691 11.966 20.509 1.00 0.00 H new ATOM 232 N TRP A 16 10.018 9.302 16.768 1.00 0.00 N ATOM 233 CA TRP A 16 10.925 8.588 15.825 1.00 0.00 C ATOM 234 C TRP A 16 10.606 8.965 14.367 1.00 0.00 C ATOM 235 O TRP A 16 9.586 8.573 13.847 1.00 0.00 O ATOM 236 CB TRP A 16 10.770 7.068 16.000 1.00 0.00 C ATOM 237 CG TRP A 16 11.831 6.366 15.204 1.00 0.00 C ATOM 238 CD1 TRP A 16 13.024 5.943 15.688 1.00 0.00 C ATOM 239 CD2 TRP A 16 11.817 6.009 13.792 1.00 0.00 C ATOM 240 NE1 TRP A 16 13.744 5.358 14.657 1.00 0.00 N ATOM 241 CE2 TRP A 16 13.042 5.378 13.468 1.00 0.00 C ATOM 242 CE3 TRP A 16 10.870 6.173 12.770 1.00 0.00 C ATOM 243 CZ2 TRP A 16 13.312 4.934 12.170 1.00 0.00 C ATOM 244 CZ3 TRP A 16 11.139 5.730 11.475 1.00 0.00 C ATOM 245 CH2 TRP A 16 12.353 5.116 11.170 1.00 0.00 C ATOM 0 H TRP A 16 9.199 9.738 16.344 1.00 0.00 H new ATOM 0 HA TRP A 16 11.950 8.884 16.049 1.00 0.00 H new ATOM 0 HB2 TRP A 16 10.854 6.801 17.054 1.00 0.00 H new ATOM 0 HB3 TRP A 16 9.781 6.751 15.668 1.00 0.00 H new ATOM 0 HD1 TRP A 16 13.359 6.045 16.710 1.00 0.00 H new ATOM 0 HE1 TRP A 16 14.678 4.962 14.764 1.00 0.00 H new ATOM 0 HE3 TRP A 16 9.924 6.647 12.988 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 14.253 4.455 11.942 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 10.399 5.864 10.700 1.00 0.00 H new ATOM 0 HH2 TRP A 16 12.552 4.782 10.163 1.00 0.00 H new ATOM 256 N HIS A 17 11.446 9.717 13.700 1.00 0.00 N ATOM 257 CA HIS A 17 11.148 10.067 12.269 1.00 0.00 C ATOM 258 C HIS A 17 12.415 9.928 11.450 1.00 0.00 C ATOM 259 O HIS A 17 13.431 10.538 11.723 1.00 0.00 O ATOM 260 CB HIS A 17 10.630 11.485 12.132 1.00 0.00 C ATOM 261 CG HIS A 17 10.259 11.747 10.694 1.00 0.00 C ATOM 262 ND1 HIS A 17 9.741 10.757 9.869 1.00 0.00 N ATOM 263 CD2 HIS A 17 10.319 12.883 9.921 1.00 0.00 C ATOM 264 CE1 HIS A 17 9.509 11.310 8.662 1.00 0.00 C ATOM 265 NE2 HIS A 17 9.843 12.603 8.644 1.00 0.00 N ATOM 0 H HIS A 17 12.314 10.101 14.074 1.00 0.00 H new ATOM 0 HA HIS A 17 10.376 9.386 11.911 1.00 0.00 H new ATOM 0 HB2 HIS A 17 9.762 11.630 12.775 1.00 0.00 H new ATOM 0 HB3 HIS A 17 11.391 12.195 12.458 1.00 0.00 H new ATOM 0 HD1 HIS A 17 9.567 9.786 10.130 1.00 0.00 H new ATOM 0 HD2 HIS A 17 10.680 13.845 10.254 1.00 0.00 H new ATOM 0 HE1 HIS A 17 9.104 10.775 7.816 1.00 0.00 H new ATOM 274 N SER A 18 12.353 9.109 10.453 1.00 0.00 N ATOM 275 CA SER A 18 13.553 8.883 9.592 1.00 0.00 C ATOM 276 C SER A 18 13.143 8.320 8.230 1.00 0.00 C ATOM 277 O SER A 18 12.294 7.457 8.148 1.00 0.00 O ATOM 278 CB SER A 18 14.465 7.872 10.280 1.00 0.00 C ATOM 279 OG SER A 18 15.242 8.530 11.270 1.00 0.00 O ATOM 0 H SER A 18 11.523 8.579 10.187 1.00 0.00 H new ATOM 0 HA SER A 18 14.065 9.834 9.444 1.00 0.00 H new ATOM 0 HB2 SER A 18 13.870 7.081 10.736 1.00 0.00 H new ATOM 0 HB3 SER A 18 15.117 7.397 9.547 1.00 0.00 H new ATOM 0 HG SER A 18 14.807 9.372 11.521 1.00 0.00 H new ATOM 285 N THR A 19 13.764 8.765 7.167 1.00 0.00 N ATOM 286 CA THR A 19 13.415 8.189 5.836 1.00 0.00 C ATOM 287 C THR A 19 14.698 7.832 5.076 1.00 0.00 C ATOM 288 O THR A 19 15.260 8.651 4.375 1.00 0.00 O ATOM 289 CB THR A 19 12.671 9.269 5.056 1.00 0.00 C ATOM 290 OG1 THR A 19 12.481 8.847 3.713 1.00 0.00 O ATOM 291 CG2 THR A 19 13.494 10.559 5.081 1.00 0.00 C ATOM 0 H THR A 19 14.484 9.488 7.162 1.00 0.00 H new ATOM 0 HA THR A 19 12.808 7.292 5.955 1.00 0.00 H new ATOM 0 HB THR A 19 11.697 9.446 5.512 1.00 0.00 H new ATOM 0 HG1 THR A 19 11.583 9.101 3.414 1.00 0.00 H new ATOM 0 HG21 THR A 19 12.969 11.336 4.526 1.00 0.00 H new ATOM 0 HG22 THR A 19 13.634 10.882 6.113 1.00 0.00 H new ATOM 0 HG23 THR A 19 14.466 10.379 4.622 1.00 0.00 H new ATOM 299 N ASN A 20 15.128 6.595 5.154 1.00 0.00 N ATOM 300 CA ASN A 20 16.333 6.144 4.392 1.00 0.00 C ATOM 301 C ASN A 20 16.062 4.743 3.818 1.00 0.00 C ATOM 302 O ASN A 20 15.269 4.004 4.371 1.00 0.00 O ATOM 303 CB ASN A 20 17.559 6.156 5.296 1.00 0.00 C ATOM 304 CG ASN A 20 17.348 7.197 6.398 1.00 0.00 C ATOM 305 OD1 ASN A 20 16.295 7.117 7.169 1.00 0.00 O flip ATOM 306 ND2 ASN A 20 18.141 8.103 6.551 1.00 0.00 N flip ATOM 0 H ASN A 20 14.688 5.870 5.721 1.00 0.00 H new ATOM 0 HA ASN A 20 16.534 6.825 3.565 1.00 0.00 H new ATOM 0 HB2 ASN A 20 17.715 5.170 5.733 1.00 0.00 H new ATOM 0 HB3 ASN A 20 18.452 6.394 4.718 1.00 0.00 H new ATOM 0 HD21 ASN A 20 18.963 8.168 5.951 1.00 0.00 H new ATOM 0 HD22 ASN A 20 17.985 8.800 7.280 1.00 0.00 H new ATOM 313 N ALA A 21 16.681 4.341 2.730 1.00 0.00 N ATOM 314 CA ALA A 21 16.366 2.966 2.218 1.00 0.00 C ATOM 315 C ALA A 21 16.638 1.932 3.325 1.00 0.00 C ATOM 316 O ALA A 21 15.765 1.176 3.690 1.00 0.00 O ATOM 317 CB ALA A 21 17.256 2.642 1.009 1.00 0.00 C ATOM 0 H ALA A 21 17.362 4.879 2.194 1.00 0.00 H new ATOM 0 HA ALA A 21 15.318 2.930 1.921 1.00 0.00 H new ATOM 0 HB1 ALA A 21 17.022 1.642 0.642 1.00 0.00 H new ATOM 0 HB2 ALA A 21 17.075 3.370 0.218 1.00 0.00 H new ATOM 0 HB3 ALA A 21 18.304 2.683 1.307 1.00 0.00 H new ATOM 323 N GLU A 22 17.836 1.870 3.856 1.00 0.00 N ATOM 324 CA GLU A 22 18.128 0.858 4.922 1.00 0.00 C ATOM 325 C GLU A 22 17.301 1.147 6.176 1.00 0.00 C ATOM 326 O GLU A 22 16.981 0.258 6.928 1.00 0.00 O ATOM 327 CB GLU A 22 19.620 0.890 5.283 1.00 0.00 C ATOM 328 CG GLU A 22 20.456 0.344 4.121 1.00 0.00 C ATOM 329 CD GLU A 22 20.162 -1.146 3.928 1.00 0.00 C ATOM 330 OE1 GLU A 22 19.670 -1.758 4.863 1.00 0.00 O ATOM 331 OE2 GLU A 22 20.442 -1.652 2.854 1.00 0.00 O ATOM 0 H GLU A 22 18.619 2.471 3.600 1.00 0.00 H new ATOM 0 HA GLU A 22 17.865 -0.128 4.539 1.00 0.00 H new ATOM 0 HB2 GLU A 22 19.925 1.911 5.512 1.00 0.00 H new ATOM 0 HB3 GLU A 22 19.798 0.296 6.179 1.00 0.00 H new ATOM 0 HG2 GLU A 22 20.226 0.891 3.207 1.00 0.00 H new ATOM 0 HG3 GLU A 22 21.517 0.492 4.323 1.00 0.00 H new ATOM 338 N GLU A 23 16.984 2.383 6.429 1.00 0.00 N ATOM 339 CA GLU A 23 16.199 2.693 7.661 1.00 0.00 C ATOM 340 C GLU A 23 14.737 2.280 7.457 1.00 0.00 C ATOM 341 O GLU A 23 14.159 1.616 8.285 1.00 0.00 O ATOM 342 CB GLU A 23 16.271 4.185 7.982 1.00 0.00 C ATOM 343 CG GLU A 23 17.689 4.559 8.453 1.00 0.00 C ATOM 344 CD GLU A 23 18.739 3.750 7.688 1.00 0.00 C ATOM 345 OE1 GLU A 23 18.795 2.548 7.890 1.00 0.00 O ATOM 346 OE2 GLU A 23 19.475 4.345 6.917 1.00 0.00 O ATOM 0 H GLU A 23 17.228 3.185 5.848 1.00 0.00 H new ATOM 0 HA GLU A 23 16.624 2.136 8.496 1.00 0.00 H new ATOM 0 HB2 GLU A 23 16.007 4.768 7.099 1.00 0.00 H new ATOM 0 HB3 GLU A 23 15.545 4.433 8.756 1.00 0.00 H new ATOM 0 HG2 GLU A 23 17.860 5.625 8.300 1.00 0.00 H new ATOM 0 HG3 GLU A 23 17.785 4.371 9.522 1.00 0.00 H new ATOM 353 N ILE A 24 14.126 2.666 6.369 1.00 0.00 N ATOM 354 CA ILE A 24 12.700 2.286 6.142 1.00 0.00 C ATOM 355 C ILE A 24 12.584 0.761 6.060 1.00 0.00 C ATOM 356 O ILE A 24 11.668 0.172 6.594 1.00 0.00 O ATOM 357 CB ILE A 24 12.227 2.923 4.824 1.00 0.00 C ATOM 358 CG1 ILE A 24 12.291 4.448 4.932 1.00 0.00 C ATOM 359 CG2 ILE A 24 10.788 2.517 4.536 1.00 0.00 C ATOM 360 CD1 ILE A 24 11.976 5.068 3.567 1.00 0.00 C ATOM 0 H ILE A 24 14.550 3.226 5.630 1.00 0.00 H new ATOM 0 HA ILE A 24 12.079 2.641 6.965 1.00 0.00 H new ATOM 0 HB ILE A 24 12.876 2.579 4.019 1.00 0.00 H new ATOM 0 HG12 ILE A 24 11.578 4.801 5.677 1.00 0.00 H new ATOM 0 HG13 ILE A 24 13.281 4.759 5.265 1.00 0.00 H new ATOM 0 HG21 ILE A 24 10.462 2.973 3.601 1.00 0.00 H new ATOM 0 HG22 ILE A 24 10.726 1.432 4.452 1.00 0.00 H new ATOM 0 HG23 ILE A 24 10.145 2.855 5.348 1.00 0.00 H new ATOM 0 HD11 ILE A 24 12.021 6.154 3.642 1.00 0.00 H new ATOM 0 HD12 ILE A 24 12.706 4.724 2.834 1.00 0.00 H new ATOM 0 HD13 ILE A 24 10.977 4.767 3.253 1.00 0.00 H new ATOM 372 N GLN A 25 13.503 0.115 5.404 1.00 0.00 N ATOM 373 CA GLN A 25 13.437 -1.370 5.298 1.00 0.00 C ATOM 374 C GLN A 25 13.745 -2.034 6.651 1.00 0.00 C ATOM 375 O GLN A 25 13.107 -2.985 7.035 1.00 0.00 O ATOM 376 CB GLN A 25 14.443 -1.849 4.255 1.00 0.00 C ATOM 377 CG GLN A 25 14.205 -3.331 3.973 1.00 0.00 C ATOM 378 CD GLN A 25 15.208 -3.817 2.928 1.00 0.00 C ATOM 379 OE1 GLN A 25 16.362 -4.046 3.232 1.00 0.00 O ATOM 380 NE2 GLN A 25 14.812 -3.979 1.696 1.00 0.00 N ATOM 0 H GLN A 25 14.298 0.549 4.936 1.00 0.00 H new ATOM 0 HA GLN A 25 12.427 -1.651 4.999 1.00 0.00 H new ATOM 0 HB2 GLN A 25 14.337 -1.270 3.337 1.00 0.00 H new ATOM 0 HB3 GLN A 25 15.460 -1.694 4.615 1.00 0.00 H new ATOM 0 HG2 GLN A 25 14.311 -3.909 4.891 1.00 0.00 H new ATOM 0 HG3 GLN A 25 13.187 -3.485 3.615 1.00 0.00 H new ATOM 0 HE21 GLN A 25 13.843 -3.786 1.442 1.00 0.00 H new ATOM 0 HE22 GLN A 25 15.471 -4.298 0.986 1.00 0.00 H new ATOM 389 N GLN A 26 14.733 -1.557 7.361 1.00 0.00 N ATOM 390 CA GLN A 26 15.092 -2.175 8.680 1.00 0.00 C ATOM 391 C GLN A 26 13.957 -2.018 9.696 1.00 0.00 C ATOM 392 O GLN A 26 13.618 -2.943 10.405 1.00 0.00 O ATOM 393 CB GLN A 26 16.354 -1.507 9.237 1.00 0.00 C ATOM 394 CG GLN A 26 17.596 -2.083 8.550 1.00 0.00 C ATOM 395 CD GLN A 26 18.848 -1.423 9.133 1.00 0.00 C ATOM 396 OE1 GLN A 26 18.720 -0.388 9.917 1.00 0.00 O flip ATOM 397 NE2 GLN A 26 19.955 -1.850 8.868 1.00 0.00 N flip ATOM 0 H GLN A 26 15.311 -0.763 7.086 1.00 0.00 H new ATOM 0 HA GLN A 26 15.268 -3.238 8.515 1.00 0.00 H new ATOM 0 HB2 GLN A 26 16.306 -0.430 9.077 1.00 0.00 H new ATOM 0 HB3 GLN A 26 16.416 -1.667 10.313 1.00 0.00 H new ATOM 0 HG2 GLN A 26 17.639 -3.162 8.696 1.00 0.00 H new ATOM 0 HG3 GLN A 26 17.545 -1.908 7.475 1.00 0.00 H new ATOM 0 HE21 GLN A 26 20.056 -2.659 8.255 1.00 0.00 H new ATOM 0 HE22 GLN A 26 20.782 -1.399 9.258 1.00 0.00 H new ATOM 406 N GLN A 27 13.377 -0.854 9.787 1.00 0.00 N ATOM 407 CA GLN A 27 12.277 -0.643 10.768 1.00 0.00 C ATOM 408 C GLN A 27 11.051 -1.439 10.342 1.00 0.00 C ATOM 409 O GLN A 27 10.405 -2.078 11.139 1.00 0.00 O ATOM 410 CB GLN A 27 11.919 0.845 10.821 1.00 0.00 C ATOM 411 CG GLN A 27 12.506 1.468 12.088 1.00 0.00 C ATOM 412 CD GLN A 27 11.802 0.874 13.309 1.00 0.00 C ATOM 413 OE1 GLN A 27 10.591 0.777 13.337 1.00 0.00 O ATOM 414 NE2 GLN A 27 12.512 0.469 14.324 1.00 0.00 N ATOM 0 H GLN A 27 13.618 -0.039 9.223 1.00 0.00 H new ATOM 0 HA GLN A 27 12.604 -0.978 11.753 1.00 0.00 H new ATOM 0 HB2 GLN A 27 12.307 1.355 9.939 1.00 0.00 H new ATOM 0 HB3 GLN A 27 10.836 0.970 10.810 1.00 0.00 H new ATOM 0 HG2 GLN A 27 13.577 1.275 12.141 1.00 0.00 H new ATOM 0 HG3 GLN A 27 12.378 2.550 12.069 1.00 0.00 H new ATOM 0 HE21 GLN A 27 13.528 0.550 14.300 1.00 0.00 H new ATOM 0 HE22 GLN A 27 12.051 0.070 15.142 1.00 0.00 H new ATOM 423 N LEU A 28 10.730 -1.400 9.089 1.00 0.00 N ATOM 424 CA LEU A 28 9.537 -2.146 8.609 1.00 0.00 C ATOM 425 C LEU A 28 9.755 -3.652 8.817 1.00 0.00 C ATOM 426 O LEU A 28 8.843 -4.381 9.144 1.00 0.00 O ATOM 427 CB LEU A 28 9.319 -1.833 7.125 1.00 0.00 C ATOM 428 CG LEU A 28 8.864 -0.379 6.972 1.00 0.00 C ATOM 429 CD1 LEU A 28 8.812 -0.021 5.492 1.00 0.00 C ATOM 430 CD2 LEU A 28 7.468 -0.203 7.574 1.00 0.00 C ATOM 0 H LEU A 28 11.240 -0.884 8.371 1.00 0.00 H new ATOM 0 HA LEU A 28 8.653 -1.844 9.171 1.00 0.00 H new ATOM 0 HB2 LEU A 28 10.242 -1.997 6.568 1.00 0.00 H new ATOM 0 HB3 LEU A 28 8.570 -2.506 6.707 1.00 0.00 H new ATOM 0 HG LEU A 28 9.568 0.271 7.491 1.00 0.00 H new ATOM 0 HD11 LEU A 28 8.488 1.014 5.379 1.00 0.00 H new ATOM 0 HD12 LEU A 28 9.803 -0.141 5.054 1.00 0.00 H new ATOM 0 HD13 LEU A 28 8.108 -0.679 4.983 1.00 0.00 H new ATOM 0 HD21 LEU A 28 7.151 0.834 7.461 1.00 0.00 H new ATOM 0 HD22 LEU A 28 6.764 -0.856 7.058 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.493 -0.462 8.633 1.00 0.00 H new ATOM 442 N ASN A 29 10.960 -4.111 8.652 1.00 0.00 N ATOM 443 CA ASN A 29 11.252 -5.559 8.858 1.00 0.00 C ATOM 444 C ASN A 29 11.112 -5.907 10.343 1.00 0.00 C ATOM 445 O ASN A 29 10.704 -6.993 10.702 1.00 0.00 O ATOM 446 CB ASN A 29 12.677 -5.857 8.390 1.00 0.00 C ATOM 447 CG ASN A 29 12.772 -5.622 6.882 1.00 0.00 C ATOM 448 OD1 ASN A 29 11.694 -5.306 6.218 1.00 0.00 O flip ATOM 449 ND2 ASN A 29 13.835 -5.730 6.302 1.00 0.00 N flip ATOM 0 H ASN A 29 11.763 -3.544 8.381 1.00 0.00 H new ATOM 0 HA ASN A 29 10.547 -6.159 8.283 1.00 0.00 H new ATOM 0 HB2 ASN A 29 13.386 -5.217 8.915 1.00 0.00 H new ATOM 0 HB3 ASN A 29 12.942 -6.887 8.627 1.00 0.00 H new ATOM 0 HD21 ASN A 29 14.677 -5.977 6.822 1.00 0.00 H new ATOM 0 HD22 ASN A 29 13.885 -5.574 5.295 1.00 0.00 H new ATOM 456 N ALA A 30 11.464 -4.994 11.208 1.00 0.00 N ATOM 457 CA ALA A 30 11.371 -5.274 12.670 1.00 0.00 C ATOM 458 C ALA A 30 9.922 -5.589 13.044 1.00 0.00 C ATOM 459 O ALA A 30 9.659 -6.285 14.004 1.00 0.00 O ATOM 460 CB ALA A 30 11.847 -4.053 13.462 1.00 0.00 C ATOM 0 H ALA A 30 11.812 -4.066 10.965 1.00 0.00 H new ATOM 0 HA ALA A 30 12.002 -6.130 12.910 1.00 0.00 H new ATOM 0 HB1 ALA A 30 11.777 -4.262 14.530 1.00 0.00 H new ATOM 0 HB2 ALA A 30 12.882 -3.832 13.202 1.00 0.00 H new ATOM 0 HB3 ALA A 30 11.221 -3.195 13.219 1.00 0.00 H new ATOM 466 N LYS A 31 8.978 -5.094 12.291 1.00 0.00 N ATOM 467 CA LYS A 31 7.550 -5.378 12.603 1.00 0.00 C ATOM 468 C LYS A 31 7.017 -6.438 11.636 1.00 0.00 C ATOM 469 O LYS A 31 5.840 -6.735 11.614 1.00 0.00 O ATOM 470 CB LYS A 31 6.739 -4.092 12.455 1.00 0.00 C ATOM 471 CG LYS A 31 6.897 -3.249 13.720 1.00 0.00 C ATOM 472 CD LYS A 31 6.745 -1.768 13.372 1.00 0.00 C ATOM 473 CE LYS A 31 8.023 -1.277 12.693 1.00 0.00 C ATOM 474 NZ LYS A 31 7.681 -0.582 11.419 1.00 0.00 N ATOM 0 H LYS A 31 9.135 -4.505 11.473 1.00 0.00 H new ATOM 0 HA LYS A 31 7.463 -5.748 13.624 1.00 0.00 H new ATOM 0 HB2 LYS A 31 7.080 -3.531 11.585 1.00 0.00 H new ATOM 0 HB3 LYS A 31 5.688 -4.328 12.290 1.00 0.00 H new ATOM 0 HG2 LYS A 31 6.148 -3.538 14.458 1.00 0.00 H new ATOM 0 HG3 LYS A 31 7.874 -3.429 14.169 1.00 0.00 H new ATOM 0 HD2 LYS A 31 5.890 -1.623 12.712 1.00 0.00 H new ATOM 0 HD3 LYS A 31 6.553 -1.188 14.275 1.00 0.00 H new ATOM 0 HE2 LYS A 31 8.560 -0.599 13.355 1.00 0.00 H new ATOM 0 HE3 LYS A 31 8.686 -2.119 12.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 8.550 -0.220 10.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 7.217 -1.251 10.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 7.038 0.211 11.618 1.00 0.00 H new ATOM 488 N GLY A 32 7.876 -7.008 10.836 1.00 0.00 N ATOM 489 CA GLY A 32 7.413 -8.045 9.875 1.00 0.00 C ATOM 490 C GLY A 32 6.804 -7.367 8.647 1.00 0.00 C ATOM 491 O GLY A 32 6.035 -7.959 7.916 1.00 0.00 O ATOM 0 H GLY A 32 8.874 -6.801 10.807 1.00 0.00 H new ATOM 0 HA2 GLY A 32 8.248 -8.679 9.577 1.00 0.00 H new ATOM 0 HA3 GLY A 32 6.675 -8.692 10.349 1.00 0.00 H new ATOM 495 N VAL A 33 7.143 -6.127 8.412 1.00 0.00 N ATOM 496 CA VAL A 33 6.582 -5.416 7.231 1.00 0.00 C ATOM 497 C VAL A 33 7.631 -5.395 6.114 1.00 0.00 C ATOM 498 O VAL A 33 8.737 -4.918 6.287 1.00 0.00 O ATOM 499 CB VAL A 33 6.206 -3.982 7.634 1.00 0.00 C ATOM 500 CG1 VAL A 33 5.675 -3.221 6.418 1.00 0.00 C ATOM 501 CG2 VAL A 33 5.121 -4.025 8.709 1.00 0.00 C ATOM 0 H VAL A 33 7.783 -5.579 8.987 1.00 0.00 H new ATOM 0 HA VAL A 33 5.689 -5.929 6.874 1.00 0.00 H new ATOM 0 HB VAL A 33 7.091 -3.476 8.019 1.00 0.00 H new ATOM 0 HG11 VAL A 33 5.410 -2.205 6.712 1.00 0.00 H new ATOM 0 HG12 VAL A 33 6.444 -3.187 5.646 1.00 0.00 H new ATOM 0 HG13 VAL A 33 4.792 -3.728 6.029 1.00 0.00 H new ATOM 0 HG21 VAL A 33 4.853 -3.008 8.996 1.00 0.00 H new ATOM 0 HG22 VAL A 33 4.241 -4.535 8.318 1.00 0.00 H new ATOM 0 HG23 VAL A 33 5.494 -4.562 9.581 1.00 0.00 H new ATOM 511 N ARG A 34 7.288 -5.925 4.972 1.00 0.00 N ATOM 512 CA ARG A 34 8.250 -5.960 3.832 1.00 0.00 C ATOM 513 C ARG A 34 8.163 -4.661 3.031 1.00 0.00 C ATOM 514 O ARG A 34 7.113 -4.060 2.910 1.00 0.00 O ATOM 515 CB ARG A 34 7.907 -7.145 2.926 1.00 0.00 C ATOM 516 CG ARG A 34 8.218 -8.455 3.650 1.00 0.00 C ATOM 517 CD ARG A 34 7.709 -9.629 2.812 1.00 0.00 C ATOM 518 NE ARG A 34 6.223 -9.560 2.733 1.00 0.00 N ATOM 519 CZ ARG A 34 5.574 -10.313 1.891 1.00 0.00 C ATOM 520 NH1 ARG A 34 6.225 -11.125 1.104 1.00 0.00 N ATOM 521 NH2 ARG A 34 4.271 -10.253 1.834 1.00 0.00 N ATOM 0 H ARG A 34 6.376 -6.339 4.778 1.00 0.00 H new ATOM 0 HA ARG A 34 9.264 -6.068 4.217 1.00 0.00 H new ATOM 0 HB2 ARG A 34 6.853 -7.112 2.651 1.00 0.00 H new ATOM 0 HB3 ARG A 34 8.480 -7.085 2.000 1.00 0.00 H new ATOM 0 HG2 ARG A 34 9.292 -8.548 3.813 1.00 0.00 H new ATOM 0 HG3 ARG A 34 7.745 -8.462 4.632 1.00 0.00 H new ATOM 0 HD2 ARG A 34 8.141 -9.593 1.812 1.00 0.00 H new ATOM 0 HD3 ARG A 34 8.019 -10.573 3.260 1.00 0.00 H new ATOM 0 HE ARG A 34 5.711 -8.920 3.341 1.00 0.00 H new ATOM 0 HH11 ARG A 34 7.243 -11.171 1.148 1.00 0.00 H new ATOM 0 HH12 ARG A 34 5.716 -11.714 0.445 1.00 0.00 H new ATOM 0 HH21 ARG A 34 3.762 -9.617 2.448 1.00 0.00 H new ATOM 0 HH22 ARG A 34 3.762 -10.842 1.175 1.00 0.00 H new ATOM 535 N PHE A 35 9.259 -4.225 2.477 1.00 0.00 N ATOM 536 CA PHE A 35 9.249 -2.970 1.676 1.00 0.00 C ATOM 537 C PHE A 35 10.365 -3.040 0.630 1.00 0.00 C ATOM 538 O PHE A 35 11.485 -3.405 0.927 1.00 0.00 O ATOM 539 CB PHE A 35 9.478 -1.772 2.605 1.00 0.00 C ATOM 540 CG PHE A 35 9.309 -0.482 1.834 1.00 0.00 C ATOM 541 CD1 PHE A 35 8.025 0.041 1.600 1.00 0.00 C ATOM 542 CD2 PHE A 35 10.439 0.196 1.354 1.00 0.00 C ATOM 543 CE1 PHE A 35 7.880 1.238 0.887 1.00 0.00 C ATOM 544 CE2 PHE A 35 10.288 1.392 0.644 1.00 0.00 C ATOM 545 CZ PHE A 35 9.009 1.912 0.409 1.00 0.00 C ATOM 0 H PHE A 35 10.166 -4.686 2.545 1.00 0.00 H new ATOM 0 HA PHE A 35 8.288 -2.853 1.175 1.00 0.00 H new ATOM 0 HB2 PHE A 35 8.772 -1.805 3.435 1.00 0.00 H new ATOM 0 HB3 PHE A 35 10.478 -1.820 3.035 1.00 0.00 H new ATOM 0 HD1 PHE A 35 7.153 -0.479 1.969 1.00 0.00 H new ATOM 0 HD2 PHE A 35 11.426 -0.205 1.532 1.00 0.00 H new ATOM 0 HE1 PHE A 35 6.895 1.641 0.706 1.00 0.00 H new ATOM 0 HE2 PHE A 35 11.159 1.915 0.277 1.00 0.00 H new ATOM 0 HZ PHE A 35 8.894 2.834 -0.142 1.00 0.00 H new ATOM 555 N GLU A 36 10.066 -2.702 -0.594 1.00 0.00 N ATOM 556 CA GLU A 36 11.105 -2.753 -1.665 1.00 0.00 C ATOM 557 C GLU A 36 10.831 -1.640 -2.675 1.00 0.00 C ATOM 558 O GLU A 36 9.797 -1.013 -2.641 1.00 0.00 O ATOM 559 CB GLU A 36 11.050 -4.107 -2.382 1.00 0.00 C ATOM 560 CG GLU A 36 11.397 -5.232 -1.403 1.00 0.00 C ATOM 561 CD GLU A 36 12.808 -5.020 -0.850 1.00 0.00 C ATOM 562 OE1 GLU A 36 13.580 -4.329 -1.495 1.00 0.00 O ATOM 563 OE2 GLU A 36 13.096 -5.557 0.206 1.00 0.00 O ATOM 0 H GLU A 36 9.144 -2.391 -0.901 1.00 0.00 H new ATOM 0 HA GLU A 36 12.091 -2.623 -1.220 1.00 0.00 H new ATOM 0 HB2 GLU A 36 10.055 -4.268 -2.796 1.00 0.00 H new ATOM 0 HB3 GLU A 36 11.749 -4.113 -3.219 1.00 0.00 H new ATOM 0 HG2 GLU A 36 10.675 -5.251 -0.586 1.00 0.00 H new ATOM 0 HG3 GLU A 36 11.335 -6.197 -1.906 1.00 0.00 H new ATOM 570 N ARG A 37 11.747 -1.387 -3.571 1.00 0.00 N ATOM 571 CA ARG A 37 11.525 -0.306 -4.577 1.00 0.00 C ATOM 572 C ARG A 37 11.384 -0.924 -5.970 1.00 0.00 C ATOM 573 O ARG A 37 12.281 -1.589 -6.451 1.00 0.00 O ATOM 574 CB ARG A 37 12.727 0.639 -4.569 1.00 0.00 C ATOM 575 CG ARG A 37 12.888 1.243 -3.173 1.00 0.00 C ATOM 576 CD ARG A 37 13.950 2.342 -3.208 1.00 0.00 C ATOM 577 NE ARG A 37 14.224 2.807 -1.820 1.00 0.00 N ATOM 578 CZ ARG A 37 14.808 3.957 -1.620 1.00 0.00 C ATOM 579 NH1 ARG A 37 15.156 4.697 -2.637 1.00 0.00 N ATOM 580 NH2 ARG A 37 15.041 4.367 -0.404 1.00 0.00 N ATOM 0 H ARG A 37 12.637 -1.880 -3.651 1.00 0.00 H new ATOM 0 HA ARG A 37 10.617 0.243 -4.328 1.00 0.00 H new ATOM 0 HB2 ARG A 37 13.631 0.098 -4.850 1.00 0.00 H new ATOM 0 HB3 ARG A 37 12.587 1.430 -5.306 1.00 0.00 H new ATOM 0 HG2 ARG A 37 11.937 1.653 -2.831 1.00 0.00 H new ATOM 0 HG3 ARG A 37 13.175 0.469 -2.462 1.00 0.00 H new ATOM 0 HD2 ARG A 37 14.865 1.965 -3.665 1.00 0.00 H new ATOM 0 HD3 ARG A 37 13.607 3.175 -3.822 1.00 0.00 H new ATOM 0 HE ARG A 37 13.955 2.227 -1.025 1.00 0.00 H new ATOM 0 HH11 ARG A 37 14.972 4.377 -3.588 1.00 0.00 H new ATOM 0 HH12 ARG A 37 15.612 5.596 -2.481 1.00 0.00 H new ATOM 0 HH21 ARG A 37 14.767 3.789 0.390 1.00 0.00 H new ATOM 0 HH22 ARG A 37 15.497 5.266 -0.247 1.00 0.00 H new ATOM 594 N TRP A 38 10.265 -0.724 -6.621 1.00 0.00 N ATOM 595 CA TRP A 38 10.083 -1.321 -7.978 1.00 0.00 C ATOM 596 C TRP A 38 10.219 -0.230 -9.036 1.00 0.00 C ATOM 597 O TRP A 38 9.944 0.928 -8.790 1.00 0.00 O ATOM 598 CB TRP A 38 8.692 -1.943 -8.094 1.00 0.00 C ATOM 599 CG TRP A 38 8.567 -3.126 -7.188 1.00 0.00 C ATOM 600 CD1 TRP A 38 8.619 -3.087 -5.838 1.00 0.00 C ATOM 601 CD2 TRP A 38 8.355 -4.518 -7.548 1.00 0.00 C ATOM 602 NE1 TRP A 38 8.429 -4.364 -5.346 1.00 0.00 N ATOM 603 CE2 TRP A 38 8.265 -5.283 -6.362 1.00 0.00 C ATOM 604 CE3 TRP A 38 8.229 -5.184 -8.777 1.00 0.00 C ATOM 605 CZ2 TRP A 38 8.053 -6.660 -6.397 1.00 0.00 C ATOM 606 CZ3 TRP A 38 8.021 -6.570 -8.814 1.00 0.00 C ATOM 607 CH2 TRP A 38 7.931 -7.306 -7.625 1.00 0.00 C ATOM 0 H TRP A 38 9.476 -0.178 -6.274 1.00 0.00 H new ATOM 0 HA TRP A 38 10.842 -2.089 -8.129 1.00 0.00 H new ATOM 0 HB2 TRP A 38 7.934 -1.202 -7.840 1.00 0.00 H new ATOM 0 HB3 TRP A 38 8.508 -2.246 -9.125 1.00 0.00 H new ATOM 0 HD1 TRP A 38 8.782 -2.202 -5.241 1.00 0.00 H new ATOM 0 HE1 TRP A 38 8.412 -4.599 -4.353 1.00 0.00 H new ATOM 0 HE3 TRP A 38 8.293 -4.626 -9.699 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 7.984 -7.223 -5.478 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 7.930 -7.074 -9.765 1.00 0.00 H new ATOM 0 HH2 TRP A 38 7.767 -8.373 -7.661 1.00 0.00 H new ATOM 618 N GLN A 39 10.645 -0.590 -10.212 1.00 0.00 N ATOM 619 CA GLN A 39 10.804 0.425 -11.288 1.00 0.00 C ATOM 620 C GLN A 39 9.552 0.450 -12.169 1.00 0.00 C ATOM 621 O GLN A 39 9.221 -0.520 -12.822 1.00 0.00 O ATOM 622 CB GLN A 39 12.026 0.067 -12.134 1.00 0.00 C ATOM 623 CG GLN A 39 12.328 1.216 -13.093 1.00 0.00 C ATOM 624 CD GLN A 39 12.923 2.386 -12.309 1.00 0.00 C ATOM 625 OE1 GLN A 39 14.058 2.331 -11.881 1.00 0.00 O ATOM 626 NE2 GLN A 39 12.195 3.448 -12.093 1.00 0.00 N ATOM 0 H GLN A 39 10.890 -1.544 -10.475 1.00 0.00 H new ATOM 0 HA GLN A 39 10.941 1.411 -10.844 1.00 0.00 H new ATOM 0 HB2 GLN A 39 12.886 -0.121 -11.491 1.00 0.00 H new ATOM 0 HB3 GLN A 39 11.840 -0.850 -12.693 1.00 0.00 H new ATOM 0 HG2 GLN A 39 13.025 0.888 -13.864 1.00 0.00 H new ATOM 0 HG3 GLN A 39 11.416 1.530 -13.601 1.00 0.00 H new ATOM 0 HE21 GLN A 39 11.242 3.494 -12.452 1.00 0.00 H new ATOM 0 HE22 GLN A 39 12.580 4.231 -11.565 1.00 0.00 H new ATOM 635 N ALA A 40 8.855 1.555 -12.197 1.00 0.00 N ATOM 636 CA ALA A 40 7.627 1.641 -13.040 1.00 0.00 C ATOM 637 C ALA A 40 7.993 2.187 -14.426 1.00 0.00 C ATOM 638 O ALA A 40 7.608 3.276 -14.801 1.00 0.00 O ATOM 639 CB ALA A 40 6.610 2.569 -12.364 1.00 0.00 C ATOM 0 H ALA A 40 9.083 2.400 -11.673 1.00 0.00 H new ATOM 0 HA ALA A 40 7.189 0.649 -13.152 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.712 2.633 -12.978 1.00 0.00 H new ATOM 0 HB2 ALA A 40 6.351 2.172 -11.383 1.00 0.00 H new ATOM 0 HB3 ALA A 40 7.044 3.563 -12.250 1.00 0.00 H new ATOM 645 N ASP A 41 8.738 1.433 -15.189 1.00 0.00 N ATOM 646 CA ASP A 41 9.134 1.897 -16.551 1.00 0.00 C ATOM 647 C ASP A 41 8.184 1.307 -17.596 1.00 0.00 C ATOM 648 O ASP A 41 8.317 1.560 -18.777 1.00 0.00 O ATOM 649 CB ASP A 41 10.567 1.451 -16.856 1.00 0.00 C ATOM 650 CG ASP A 41 11.547 2.251 -15.995 1.00 0.00 C ATOM 651 OD1 ASP A 41 11.106 3.184 -15.344 1.00 0.00 O ATOM 652 OD2 ASP A 41 12.720 1.915 -16.000 1.00 0.00 O ATOM 0 H ASP A 41 9.091 0.512 -14.927 1.00 0.00 H new ATOM 0 HA ASP A 41 9.079 2.985 -16.585 1.00 0.00 H new ATOM 0 HB2 ASP A 41 10.677 0.385 -16.656 1.00 0.00 H new ATOM 0 HB3 ASP A 41 10.789 1.602 -17.913 1.00 0.00 H new ATOM 657 N ARG A 42 7.234 0.511 -17.181 1.00 0.00 N ATOM 658 CA ARG A 42 6.297 -0.097 -18.171 1.00 0.00 C ATOM 659 C ARG A 42 5.083 0.819 -18.360 1.00 0.00 C ATOM 660 O ARG A 42 4.376 1.134 -17.423 1.00 0.00 O ATOM 661 CB ARG A 42 5.827 -1.457 -17.643 1.00 0.00 C ATOM 662 CG ARG A 42 7.035 -2.327 -17.276 1.00 0.00 C ATOM 663 CD ARG A 42 7.768 -2.762 -18.547 1.00 0.00 C ATOM 664 NE ARG A 42 8.759 -3.823 -18.211 1.00 0.00 N ATOM 665 CZ ARG A 42 9.280 -4.547 -19.163 1.00 0.00 C ATOM 666 NH1 ARG A 42 8.927 -4.344 -20.402 1.00 0.00 N ATOM 667 NH2 ARG A 42 10.152 -5.476 -18.877 1.00 0.00 N ATOM 0 H ARG A 42 7.067 0.257 -16.207 1.00 0.00 H new ATOM 0 HA ARG A 42 6.806 -0.224 -19.126 1.00 0.00 H new ATOM 0 HB2 ARG A 42 5.192 -1.316 -16.769 1.00 0.00 H new ATOM 0 HB3 ARG A 42 5.223 -1.960 -18.398 1.00 0.00 H new ATOM 0 HG2 ARG A 42 7.712 -1.770 -16.628 1.00 0.00 H new ATOM 0 HG3 ARG A 42 6.707 -3.203 -16.717 1.00 0.00 H new ATOM 0 HD2 ARG A 42 7.054 -3.136 -19.281 1.00 0.00 H new ATOM 0 HD3 ARG A 42 8.273 -1.908 -18.999 1.00 0.00 H new ATOM 0 HE ARG A 42 9.029 -3.983 -17.240 1.00 0.00 H new ATOM 0 HH11 ARG A 42 8.244 -3.620 -20.626 1.00 0.00 H new ATOM 0 HH12 ARG A 42 9.334 -4.909 -21.147 1.00 0.00 H new ATOM 0 HH21 ARG A 42 10.427 -5.637 -17.908 1.00 0.00 H new ATOM 0 HH22 ARG A 42 10.558 -6.041 -19.623 1.00 0.00 H new ATOM 681 N ASP A 43 4.840 1.244 -19.573 1.00 0.00 N ATOM 682 CA ASP A 43 3.677 2.140 -19.843 1.00 0.00 C ATOM 683 C ASP A 43 2.499 1.322 -20.393 1.00 0.00 C ATOM 684 O ASP A 43 2.661 0.485 -21.257 1.00 0.00 O ATOM 685 CB ASP A 43 4.091 3.202 -20.861 1.00 0.00 C ATOM 686 CG ASP A 43 5.221 4.049 -20.272 1.00 0.00 C ATOM 687 OD1 ASP A 43 5.375 4.034 -19.062 1.00 0.00 O ATOM 688 OD2 ASP A 43 5.916 4.693 -21.040 1.00 0.00 O ATOM 0 H ASP A 43 5.400 1.007 -20.392 1.00 0.00 H new ATOM 0 HA ASP A 43 3.366 2.621 -18.916 1.00 0.00 H new ATOM 0 HB2 ASP A 43 4.420 2.728 -21.786 1.00 0.00 H new ATOM 0 HB3 ASP A 43 3.239 3.834 -21.112 1.00 0.00 H new ATOM 693 N LEU A 44 1.312 1.567 -19.900 1.00 0.00 N ATOM 694 CA LEU A 44 0.116 0.816 -20.394 1.00 0.00 C ATOM 695 C LEU A 44 -0.544 1.609 -21.506 1.00 0.00 C ATOM 696 O LEU A 44 -1.642 1.312 -21.931 1.00 0.00 O ATOM 697 CB LEU A 44 -0.891 0.652 -19.258 1.00 0.00 C ATOM 698 CG LEU A 44 -0.166 0.150 -18.012 1.00 0.00 C ATOM 699 CD1 LEU A 44 0.798 -0.964 -18.406 1.00 0.00 C ATOM 700 CD2 LEU A 44 0.623 1.284 -17.354 1.00 0.00 C ATOM 0 H LEU A 44 1.118 2.257 -19.174 1.00 0.00 H new ATOM 0 HA LEU A 44 0.431 -0.162 -20.758 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -1.380 1.603 -19.050 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -1.672 -0.051 -19.547 1.00 0.00 H new ATOM 0 HG LEU A 44 -0.906 -0.223 -17.303 1.00 0.00 H new ATOM 0 HD11 LEU A 44 1.318 -1.326 -17.519 1.00 0.00 H new ATOM 0 HD12 LEU A 44 0.241 -1.784 -18.859 1.00 0.00 H new ATOM 0 HD13 LEU A 44 1.525 -0.580 -19.122 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.133 0.906 -16.468 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.359 1.671 -18.058 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -0.060 2.083 -17.067 1.00 0.00 H new ATOM 712 N GLY A 45 0.107 2.631 -21.953 1.00 0.00 N ATOM 713 CA GLY A 45 -0.481 3.483 -23.017 1.00 0.00 C ATOM 714 C GLY A 45 -0.666 4.878 -22.430 1.00 0.00 C ATOM 715 O GLY A 45 0.255 5.427 -21.860 1.00 0.00 O ATOM 0 H GLY A 45 1.030 2.920 -21.628 1.00 0.00 H new ATOM 0 HA2 GLY A 45 0.173 3.516 -23.888 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -1.436 3.077 -23.351 1.00 0.00 H new ATOM 719 N ALA A 46 -1.830 5.467 -22.534 1.00 0.00 N ATOM 720 CA ALA A 46 -2.012 6.820 -21.939 1.00 0.00 C ATOM 721 C ALA A 46 -2.700 6.682 -20.575 1.00 0.00 C ATOM 722 O ALA A 46 -2.171 7.084 -19.559 1.00 0.00 O ATOM 723 CB ALA A 46 -2.890 7.651 -22.875 1.00 0.00 C ATOM 0 H ALA A 46 -2.649 5.075 -22.998 1.00 0.00 H new ATOM 0 HA ALA A 46 -1.046 7.308 -21.808 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -3.033 8.646 -22.453 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -2.406 7.736 -23.848 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -3.858 7.165 -22.993 1.00 0.00 H new ATOM 729 N ALA A 47 -3.873 6.104 -20.549 1.00 0.00 N ATOM 730 CA ALA A 47 -4.598 5.922 -19.256 1.00 0.00 C ATOM 731 C ALA A 47 -4.409 4.471 -18.786 1.00 0.00 C ATOM 732 O ALA A 47 -4.696 3.551 -19.524 1.00 0.00 O ATOM 733 CB ALA A 47 -6.090 6.188 -19.458 1.00 0.00 C ATOM 0 H ALA A 47 -4.362 5.749 -21.371 1.00 0.00 H new ATOM 0 HA ALA A 47 -4.204 6.617 -18.514 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -6.615 6.054 -18.512 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -6.233 7.209 -19.811 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -6.487 5.490 -20.195 1.00 0.00 H new ATOM 739 N PRO A 48 -3.943 4.248 -17.581 1.00 0.00 N ATOM 740 CA PRO A 48 -3.738 2.874 -17.061 1.00 0.00 C ATOM 741 C PRO A 48 -5.051 2.226 -16.630 1.00 0.00 C ATOM 742 O PRO A 48 -5.866 2.831 -15.965 1.00 0.00 O ATOM 743 CB PRO A 48 -2.827 3.073 -15.855 1.00 0.00 C ATOM 744 CG PRO A 48 -3.143 4.443 -15.363 1.00 0.00 C ATOM 745 CD PRO A 48 -3.563 5.256 -16.588 1.00 0.00 C ATOM 0 HA PRO A 48 -3.318 2.212 -17.818 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -3.017 2.323 -15.087 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -1.777 2.985 -16.133 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -3.943 4.415 -14.623 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -2.276 4.891 -14.878 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -4.396 5.921 -16.358 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -2.747 5.881 -16.949 1.00 0.00 H new ATOM 753 N THR A 49 -5.246 0.994 -16.988 1.00 0.00 N ATOM 754 CA THR A 49 -6.491 0.265 -16.589 1.00 0.00 C ATOM 755 C THR A 49 -6.118 -0.903 -15.668 1.00 0.00 C ATOM 756 O THR A 49 -4.963 -1.107 -15.353 1.00 0.00 O ATOM 757 CB THR A 49 -7.198 -0.277 -17.831 1.00 0.00 C ATOM 758 OG1 THR A 49 -6.811 0.488 -18.963 1.00 0.00 O ATOM 759 CG2 THR A 49 -8.712 -0.184 -17.641 1.00 0.00 C ATOM 0 H THR A 49 -4.592 0.447 -17.548 1.00 0.00 H new ATOM 0 HA THR A 49 -7.159 0.951 -16.067 1.00 0.00 H new ATOM 0 HB THR A 49 -6.919 -1.320 -17.984 1.00 0.00 H new ATOM 0 HG1 THR A 49 -7.262 0.142 -19.761 1.00 0.00 H new ATOM 0 HG21 THR A 49 -9.214 -0.571 -18.528 1.00 0.00 H new ATOM 0 HG22 THR A 49 -9.006 -0.772 -16.772 1.00 0.00 H new ATOM 0 HG23 THR A 49 -8.996 0.857 -17.488 1.00 0.00 H new ATOM 767 N ALA A 50 -7.082 -1.676 -15.229 1.00 0.00 N ATOM 768 CA ALA A 50 -6.755 -2.823 -14.328 1.00 0.00 C ATOM 769 C ALA A 50 -6.213 -4.014 -15.139 1.00 0.00 C ATOM 770 O ALA A 50 -5.184 -4.567 -14.820 1.00 0.00 O ATOM 771 CB ALA A 50 -8.029 -3.256 -13.594 1.00 0.00 C ATOM 0 H ALA A 50 -8.071 -1.564 -15.453 1.00 0.00 H new ATOM 0 HA ALA A 50 -5.992 -2.507 -13.617 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -7.802 -4.093 -12.934 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -8.411 -2.422 -13.005 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -8.782 -3.561 -14.321 1.00 0.00 H new ATOM 777 N GLU A 51 -6.913 -4.436 -16.161 1.00 0.00 N ATOM 778 CA GLU A 51 -6.443 -5.615 -16.961 1.00 0.00 C ATOM 779 C GLU A 51 -5.079 -5.321 -17.596 1.00 0.00 C ATOM 780 O GLU A 51 -4.194 -6.151 -17.608 1.00 0.00 O ATOM 781 CB GLU A 51 -7.459 -5.907 -18.067 1.00 0.00 C ATOM 782 CG GLU A 51 -7.080 -7.204 -18.786 1.00 0.00 C ATOM 783 CD GLU A 51 -7.312 -8.387 -17.847 1.00 0.00 C ATOM 784 OE1 GLU A 51 -8.118 -8.249 -16.942 1.00 0.00 O ATOM 785 OE2 GLU A 51 -6.679 -9.411 -18.046 1.00 0.00 O ATOM 0 H GLU A 51 -7.788 -4.019 -16.478 1.00 0.00 H new ATOM 0 HA GLU A 51 -6.347 -6.476 -16.300 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -8.459 -5.994 -17.642 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -7.486 -5.081 -18.777 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -7.677 -7.320 -19.690 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -6.036 -7.170 -19.096 1.00 0.00 H new ATOM 792 N THR A 52 -4.921 -4.155 -18.151 1.00 0.00 N ATOM 793 CA THR A 52 -3.613 -3.851 -18.801 1.00 0.00 C ATOM 794 C THR A 52 -2.554 -3.756 -17.699 1.00 0.00 C ATOM 795 O THR A 52 -1.599 -4.489 -17.694 1.00 0.00 O ATOM 796 CB THR A 52 -3.705 -2.527 -19.568 1.00 0.00 C ATOM 797 OG1 THR A 52 -2.417 -2.172 -20.048 1.00 0.00 O ATOM 798 CG2 THR A 52 -4.231 -1.423 -18.651 1.00 0.00 C ATOM 0 H THR A 52 -5.620 -3.413 -18.185 1.00 0.00 H new ATOM 0 HA THR A 52 -3.347 -4.634 -19.511 1.00 0.00 H new ATOM 0 HB THR A 52 -4.391 -2.647 -20.407 1.00 0.00 H new ATOM 0 HG1 THR A 52 -2.507 -1.662 -20.880 1.00 0.00 H new ATOM 0 HG21 THR A 52 -4.292 -0.487 -19.206 1.00 0.00 H new ATOM 0 HG22 THR A 52 -5.222 -1.694 -18.286 1.00 0.00 H new ATOM 0 HG23 THR A 52 -3.555 -1.299 -17.805 1.00 0.00 H new ATOM 806 N VAL A 53 -2.706 -2.852 -16.779 1.00 0.00 N ATOM 807 CA VAL A 53 -1.688 -2.705 -15.698 1.00 0.00 C ATOM 808 C VAL A 53 -1.336 -4.096 -15.141 1.00 0.00 C ATOM 809 O VAL A 53 -0.225 -4.343 -14.716 1.00 0.00 O ATOM 810 CB VAL A 53 -2.283 -1.836 -14.577 1.00 0.00 C ATOM 811 CG1 VAL A 53 -1.340 -1.790 -13.372 1.00 0.00 C ATOM 812 CG2 VAL A 53 -2.485 -0.411 -15.097 1.00 0.00 C ATOM 0 H VAL A 53 -3.492 -2.204 -16.725 1.00 0.00 H new ATOM 0 HA VAL A 53 -0.786 -2.236 -16.091 1.00 0.00 H new ATOM 0 HB VAL A 53 -3.235 -2.269 -14.269 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -1.779 -1.170 -12.590 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -1.186 -2.800 -12.991 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.382 -1.367 -13.675 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -2.907 0.209 -14.306 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -1.526 0.002 -15.409 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -3.167 -0.427 -15.947 1.00 0.00 H new ATOM 822 N ILE A 54 -2.271 -5.000 -15.156 1.00 0.00 N ATOM 823 CA ILE A 54 -2.000 -6.378 -14.643 1.00 0.00 C ATOM 824 C ILE A 54 -1.070 -7.146 -15.589 1.00 0.00 C ATOM 825 O ILE A 54 -0.072 -7.704 -15.169 1.00 0.00 O ATOM 826 CB ILE A 54 -3.320 -7.137 -14.509 1.00 0.00 C ATOM 827 CG1 ILE A 54 -3.982 -6.801 -13.165 1.00 0.00 C ATOM 828 CG2 ILE A 54 -3.068 -8.643 -14.619 1.00 0.00 C ATOM 829 CD1 ILE A 54 -3.096 -7.241 -11.990 1.00 0.00 C ATOM 0 H ILE A 54 -3.218 -4.848 -15.502 1.00 0.00 H new ATOM 0 HA ILE A 54 -1.512 -6.293 -13.672 1.00 0.00 H new ATOM 0 HB ILE A 54 -3.991 -6.835 -15.313 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -4.166 -5.728 -13.104 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -4.951 -7.295 -13.099 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -4.013 -9.178 -14.523 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -2.621 -8.867 -15.588 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -2.390 -8.957 -13.825 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -3.588 -6.991 -11.050 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -2.934 -8.318 -12.040 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -2.137 -6.727 -12.045 1.00 0.00 H new ATOM 841 N ALA A 55 -1.399 -7.198 -16.855 1.00 0.00 N ATOM 842 CA ALA A 55 -0.546 -7.953 -17.819 1.00 0.00 C ATOM 843 C ALA A 55 0.833 -7.288 -17.928 1.00 0.00 C ATOM 844 O ALA A 55 1.829 -7.941 -18.172 1.00 0.00 O ATOM 845 CB ALA A 55 -1.219 -7.964 -19.195 1.00 0.00 C ATOM 0 H ALA A 55 -2.221 -6.750 -17.261 1.00 0.00 H new ATOM 0 HA ALA A 55 -0.423 -8.976 -17.464 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -0.597 -8.515 -19.900 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -2.194 -8.445 -19.119 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -1.345 -6.940 -19.546 1.00 0.00 H new ATOM 851 N ALA A 56 0.902 -5.993 -17.790 1.00 0.00 N ATOM 852 CA ALA A 56 2.234 -5.345 -17.927 1.00 0.00 C ATOM 853 C ALA A 56 3.072 -5.667 -16.690 1.00 0.00 C ATOM 854 O ALA A 56 4.114 -6.280 -16.797 1.00 0.00 O ATOM 855 CB ALA A 56 2.033 -3.832 -18.035 1.00 0.00 C ATOM 0 H ALA A 56 0.118 -5.371 -17.594 1.00 0.00 H new ATOM 0 HA ALA A 56 2.746 -5.712 -18.816 1.00 0.00 H new ATOM 0 HB1 ALA A 56 3.002 -3.343 -18.136 1.00 0.00 H new ATOM 0 HB2 ALA A 56 1.420 -3.608 -18.908 1.00 0.00 H new ATOM 0 HB3 ALA A 56 1.534 -3.466 -17.138 1.00 0.00 H new ATOM 861 N TYR A 57 2.658 -5.273 -15.514 1.00 0.00 N ATOM 862 CA TYR A 57 3.489 -5.577 -14.320 1.00 0.00 C ATOM 863 C TYR A 57 3.301 -7.041 -13.923 1.00 0.00 C ATOM 864 O TYR A 57 3.734 -7.469 -12.871 1.00 0.00 O ATOM 865 CB TYR A 57 3.076 -4.659 -13.163 1.00 0.00 C ATOM 866 CG TYR A 57 3.281 -3.211 -13.561 1.00 0.00 C ATOM 867 CD1 TYR A 57 4.576 -2.684 -13.652 1.00 0.00 C ATOM 868 CD2 TYR A 57 2.175 -2.395 -13.821 1.00 0.00 C ATOM 869 CE1 TYR A 57 4.762 -1.339 -14.004 1.00 0.00 C ATOM 870 CE2 TYR A 57 2.361 -1.052 -14.176 1.00 0.00 C ATOM 871 CZ TYR A 57 3.654 -0.525 -14.266 1.00 0.00 C ATOM 872 OH TYR A 57 3.837 0.799 -14.610 1.00 0.00 O ATOM 0 H TYR A 57 1.794 -4.762 -15.333 1.00 0.00 H new ATOM 0 HA TYR A 57 4.540 -5.406 -14.553 1.00 0.00 H new ATOM 0 HB2 TYR A 57 2.031 -4.831 -12.905 1.00 0.00 H new ATOM 0 HB3 TYR A 57 3.665 -4.889 -12.275 1.00 0.00 H new ATOM 0 HD1 TYR A 57 5.431 -3.313 -13.451 1.00 0.00 H new ATOM 0 HD2 TYR A 57 1.177 -2.800 -13.748 1.00 0.00 H new ATOM 0 HE1 TYR A 57 5.760 -0.932 -14.073 1.00 0.00 H new ATOM 0 HE2 TYR A 57 1.506 -0.424 -14.380 1.00 0.00 H new ATOM 0 HH TYR A 57 4.034 0.864 -15.568 1.00 0.00 H new ATOM 882 N GLN A 58 2.659 -7.812 -14.759 1.00 0.00 N ATOM 883 CA GLN A 58 2.448 -9.249 -14.435 1.00 0.00 C ATOM 884 C GLN A 58 3.806 -9.915 -14.216 1.00 0.00 C ATOM 885 O GLN A 58 4.018 -10.630 -13.257 1.00 0.00 O ATOM 886 CB GLN A 58 1.749 -9.928 -15.620 1.00 0.00 C ATOM 887 CG GLN A 58 0.468 -10.638 -15.170 1.00 0.00 C ATOM 888 CD GLN A 58 0.759 -11.510 -13.955 1.00 0.00 C ATOM 889 OE1 GLN A 58 0.461 -11.049 -12.776 1.00 0.00 O flip ATOM 890 NE2 GLN A 58 1.271 -12.605 -14.077 1.00 0.00 N flip ATOM 0 H GLN A 58 2.272 -7.507 -15.652 1.00 0.00 H new ATOM 0 HA GLN A 58 1.838 -9.342 -13.536 1.00 0.00 H new ATOM 0 HB2 GLN A 58 1.509 -9.184 -16.380 1.00 0.00 H new ATOM 0 HB3 GLN A 58 2.425 -10.648 -16.081 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -0.299 -9.903 -14.926 1.00 0.00 H new ATOM 0 HG3 GLN A 58 0.076 -11.250 -15.982 1.00 0.00 H new ATOM 0 HE21 GLN A 58 1.502 -12.960 -15.005 1.00 0.00 H new ATOM 0 HE22 GLN A 58 1.470 -13.170 -13.251 1.00 0.00 H new ATOM 899 N HIS A 59 4.725 -9.685 -15.112 1.00 0.00 N ATOM 900 CA HIS A 59 6.073 -10.288 -14.994 1.00 0.00 C ATOM 901 C HIS A 59 6.731 -9.803 -13.702 1.00 0.00 C ATOM 902 O HIS A 59 7.597 -10.451 -13.149 1.00 0.00 O ATOM 903 CB HIS A 59 6.903 -9.867 -16.210 1.00 0.00 C ATOM 904 CG HIS A 59 7.371 -8.448 -16.046 1.00 0.00 C ATOM 905 ND1 HIS A 59 8.188 -7.848 -15.120 1.00 0.00 N flip ATOM 906 CD2 HIS A 59 6.990 -7.441 -16.922 1.00 0.00 C flip ATOM 907 CE1 HIS A 59 8.310 -6.497 -15.416 1.00 0.00 C flip ATOM 908 NE2 HIS A 59 7.572 -6.301 -16.508 1.00 0.00 N flip ATOM 0 H HIS A 59 4.592 -9.094 -15.933 1.00 0.00 H new ATOM 0 HA HIS A 59 6.005 -11.375 -14.963 1.00 0.00 H new ATOM 0 HB2 HIS A 59 7.760 -10.531 -16.323 1.00 0.00 H new ATOM 0 HB3 HIS A 59 6.306 -9.959 -17.118 1.00 0.00 H new ATOM 0 HD1 HIS A 59 8.636 -8.322 -14.336 1.00 0.00 H new ATOM 0 HD2 HIS A 59 6.344 -7.552 -17.780 1.00 0.00 H new ATOM 0 HE1 HIS A 59 8.883 -5.759 -14.874 1.00 0.00 H new ATOM 917 N ALA A 60 6.322 -8.663 -13.215 1.00 0.00 N ATOM 918 CA ALA A 60 6.920 -8.131 -11.957 1.00 0.00 C ATOM 919 C ALA A 60 6.363 -8.915 -10.763 1.00 0.00 C ATOM 920 O ALA A 60 7.046 -9.150 -9.786 1.00 0.00 O ATOM 921 CB ALA A 60 6.560 -6.646 -11.815 1.00 0.00 C ATOM 0 H ALA A 60 5.600 -8.077 -13.634 1.00 0.00 H new ATOM 0 HA ALA A 60 8.004 -8.239 -11.987 1.00 0.00 H new ATOM 0 HB1 ALA A 60 6.995 -6.252 -10.896 1.00 0.00 H new ATOM 0 HB2 ALA A 60 6.953 -6.093 -12.668 1.00 0.00 H new ATOM 0 HB3 ALA A 60 5.476 -6.536 -11.779 1.00 0.00 H new ATOM 927 N ILE A 61 5.131 -9.334 -10.837 1.00 0.00 N ATOM 928 CA ILE A 61 4.537 -10.108 -9.711 1.00 0.00 C ATOM 929 C ILE A 61 5.302 -11.422 -9.510 1.00 0.00 C ATOM 930 O ILE A 61 5.437 -11.907 -8.404 1.00 0.00 O ATOM 931 CB ILE A 61 3.065 -10.405 -10.020 1.00 0.00 C ATOM 932 CG1 ILE A 61 2.281 -9.089 -10.027 1.00 0.00 C ATOM 933 CG2 ILE A 61 2.491 -11.343 -8.955 1.00 0.00 C ATOM 934 CD1 ILE A 61 0.815 -9.354 -10.379 1.00 0.00 C ATOM 0 H ILE A 61 4.509 -9.174 -11.629 1.00 0.00 H new ATOM 0 HA ILE A 61 4.606 -9.520 -8.796 1.00 0.00 H new ATOM 0 HB ILE A 61 2.985 -10.886 -10.995 1.00 0.00 H new ATOM 0 HG12 ILE A 61 2.348 -8.611 -9.050 1.00 0.00 H new ATOM 0 HG13 ILE A 61 2.718 -8.400 -10.749 1.00 0.00 H new ATOM 0 HG21 ILE A 61 1.445 -11.551 -9.179 1.00 0.00 H new ATOM 0 HG22 ILE A 61 3.054 -12.276 -8.951 1.00 0.00 H new ATOM 0 HG23 ILE A 61 2.565 -10.870 -7.976 1.00 0.00 H new ATOM 0 HD11 ILE A 61 0.266 -8.413 -10.382 1.00 0.00 H new ATOM 0 HD12 ILE A 61 0.755 -9.812 -11.366 1.00 0.00 H new ATOM 0 HD13 ILE A 61 0.379 -10.026 -9.640 1.00 0.00 H new ATOM 946 N ASP A 62 5.800 -12.009 -10.564 1.00 0.00 N ATOM 947 CA ASP A 62 6.550 -13.294 -10.433 1.00 0.00 C ATOM 948 C ASP A 62 7.801 -13.107 -9.559 1.00 0.00 C ATOM 949 O ASP A 62 8.182 -13.982 -8.810 1.00 0.00 O ATOM 950 CB ASP A 62 6.972 -13.760 -11.829 1.00 0.00 C ATOM 951 CG ASP A 62 7.554 -15.172 -11.750 1.00 0.00 C ATOM 952 OD1 ASP A 62 7.537 -15.740 -10.671 1.00 0.00 O ATOM 953 OD2 ASP A 62 8.006 -15.662 -12.772 1.00 0.00 O ATOM 0 H ASP A 62 5.720 -11.653 -11.516 1.00 0.00 H new ATOM 0 HA ASP A 62 5.907 -14.036 -9.961 1.00 0.00 H new ATOM 0 HB2 ASP A 62 6.114 -13.747 -12.501 1.00 0.00 H new ATOM 0 HB3 ASP A 62 7.712 -13.075 -12.243 1.00 0.00 H new ATOM 958 N LYS A 63 8.428 -11.965 -9.642 1.00 0.00 N ATOM 959 CA LYS A 63 9.649 -11.660 -8.827 1.00 0.00 C ATOM 960 C LYS A 63 9.250 -11.187 -7.429 1.00 0.00 C ATOM 961 O LYS A 63 10.059 -11.120 -6.524 1.00 0.00 O ATOM 962 CB LYS A 63 10.464 -10.559 -9.520 1.00 0.00 C ATOM 963 CG LYS A 63 11.826 -10.400 -8.835 1.00 0.00 C ATOM 964 CD LYS A 63 12.635 -9.305 -9.541 1.00 0.00 C ATOM 965 CE LYS A 63 12.234 -7.925 -9.002 1.00 0.00 C ATOM 966 NZ LYS A 63 13.062 -6.875 -9.667 1.00 0.00 N ATOM 0 H LYS A 63 8.139 -11.206 -10.258 1.00 0.00 H new ATOM 0 HA LYS A 63 10.248 -12.566 -8.738 1.00 0.00 H new ATOM 0 HB2 LYS A 63 10.604 -10.807 -10.572 1.00 0.00 H new ATOM 0 HB3 LYS A 63 9.919 -9.616 -9.485 1.00 0.00 H new ATOM 0 HG2 LYS A 63 11.688 -10.143 -7.785 1.00 0.00 H new ATOM 0 HG3 LYS A 63 12.371 -11.344 -8.864 1.00 0.00 H new ATOM 0 HD2 LYS A 63 13.701 -9.470 -9.383 1.00 0.00 H new ATOM 0 HD3 LYS A 63 12.461 -9.349 -10.616 1.00 0.00 H new ATOM 0 HE2 LYS A 63 11.176 -7.742 -9.189 1.00 0.00 H new ATOM 0 HE3 LYS A 63 12.378 -7.888 -7.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 12.792 -5.939 -9.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 14.068 -7.048 -9.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 12.903 -6.907 -10.694 1.00 0.00 H new ATOM 980 N LEU A 64 8.011 -10.844 -7.256 1.00 0.00 N ATOM 981 CA LEU A 64 7.590 -10.354 -5.918 1.00 0.00 C ATOM 982 C LEU A 64 7.944 -11.433 -4.907 1.00 0.00 C ATOM 983 O LEU A 64 8.963 -11.362 -4.247 1.00 0.00 O ATOM 984 CB LEU A 64 6.079 -10.096 -5.892 1.00 0.00 C ATOM 985 CG LEU A 64 5.570 -9.941 -4.451 1.00 0.00 C ATOM 986 CD1 LEU A 64 6.483 -9.030 -3.628 1.00 0.00 C ATOM 987 CD2 LEU A 64 4.196 -9.295 -4.494 1.00 0.00 C ATOM 0 H LEU A 64 7.281 -10.879 -7.967 1.00 0.00 H new ATOM 0 HA LEU A 64 8.095 -9.417 -5.683 1.00 0.00 H new ATOM 0 HB2 LEU A 64 5.851 -9.194 -6.461 1.00 0.00 H new ATOM 0 HB3 LEU A 64 5.558 -10.920 -6.379 1.00 0.00 H new ATOM 0 HG LEU A 64 5.545 -10.929 -3.991 1.00 0.00 H new ATOM 0 HD11 LEU A 64 6.092 -8.943 -2.614 1.00 0.00 H new ATOM 0 HD12 LEU A 64 7.486 -9.454 -3.595 1.00 0.00 H new ATOM 0 HD13 LEU A 64 6.522 -8.042 -4.088 1.00 0.00 H new ATOM 0 HD21 LEU A 64 3.818 -9.177 -3.479 1.00 0.00 H new ATOM 0 HD22 LEU A 64 4.268 -8.317 -4.971 1.00 0.00 H new ATOM 0 HD23 LEU A 64 3.515 -9.927 -5.064 1.00 0.00 H new ATOM 999 N VAL A 65 7.150 -12.441 -4.795 1.00 0.00 N ATOM 1000 CA VAL A 65 7.491 -13.522 -3.842 1.00 0.00 C ATOM 1001 C VAL A 65 7.043 -14.848 -4.427 1.00 0.00 C ATOM 1002 O VAL A 65 5.882 -15.040 -4.731 1.00 0.00 O ATOM 1003 CB VAL A 65 6.771 -13.265 -2.521 1.00 0.00 C ATOM 1004 CG1 VAL A 65 6.725 -14.550 -1.692 1.00 0.00 C ATOM 1005 CG2 VAL A 65 7.503 -12.177 -1.730 1.00 0.00 C ATOM 0 H VAL A 65 6.283 -12.569 -5.316 1.00 0.00 H new ATOM 0 HA VAL A 65 8.566 -13.548 -3.666 1.00 0.00 H new ATOM 0 HB VAL A 65 5.754 -12.936 -2.734 1.00 0.00 H new ATOM 0 HG11 VAL A 65 6.210 -14.358 -0.751 1.00 0.00 H new ATOM 0 HG12 VAL A 65 6.192 -15.322 -2.247 1.00 0.00 H new ATOM 0 HG13 VAL A 65 7.741 -14.887 -1.487 1.00 0.00 H new ATOM 0 HG21 VAL A 65 6.983 -11.999 -0.789 1.00 0.00 H new ATOM 0 HG22 VAL A 65 8.524 -12.500 -1.525 1.00 0.00 H new ATOM 0 HG23 VAL A 65 7.524 -11.256 -2.312 1.00 0.00 H new ATOM 1015 N ALA A 66 7.940 -15.776 -4.576 1.00 0.00 N ATOM 1016 CA ALA A 66 7.526 -17.085 -5.129 1.00 0.00 C ATOM 1017 C ALA A 66 7.255 -18.042 -3.964 1.00 0.00 C ATOM 1018 O ALA A 66 8.162 -18.508 -3.301 1.00 0.00 O ATOM 1019 CB ALA A 66 8.661 -17.621 -6.010 1.00 0.00 C ATOM 0 H ALA A 66 8.929 -15.686 -4.342 1.00 0.00 H new ATOM 0 HA ALA A 66 6.621 -16.989 -5.730 1.00 0.00 H new ATOM 0 HB1 ALA A 66 8.373 -18.586 -6.427 1.00 0.00 H new ATOM 0 HB2 ALA A 66 8.855 -16.919 -6.821 1.00 0.00 H new ATOM 0 HB3 ALA A 66 9.563 -17.739 -5.409 1.00 0.00 H new ATOM 1025 N GLU A 67 6.006 -18.341 -3.720 1.00 0.00 N ATOM 1026 CA GLU A 67 5.655 -19.276 -2.612 1.00 0.00 C ATOM 1027 C GLU A 67 4.203 -19.737 -2.778 1.00 0.00 C ATOM 1028 O GLU A 67 3.362 -18.994 -3.244 1.00 0.00 O ATOM 1029 CB GLU A 67 5.825 -18.566 -1.266 1.00 0.00 C ATOM 1030 CG GLU A 67 5.626 -19.575 -0.130 1.00 0.00 C ATOM 1031 CD GLU A 67 5.723 -18.856 1.218 1.00 0.00 C ATOM 1032 OE1 GLU A 67 5.944 -17.656 1.214 1.00 0.00 O ATOM 1033 OE2 GLU A 67 5.578 -19.519 2.232 1.00 0.00 O ATOM 0 H GLU A 67 5.211 -17.976 -4.244 1.00 0.00 H new ATOM 0 HA GLU A 67 6.315 -20.143 -2.643 1.00 0.00 H new ATOM 0 HB2 GLU A 67 6.817 -18.119 -1.201 1.00 0.00 H new ATOM 0 HB3 GLU A 67 5.103 -17.754 -1.177 1.00 0.00 H new ATOM 0 HG2 GLU A 67 4.654 -20.059 -0.226 1.00 0.00 H new ATOM 0 HG3 GLU A 67 6.380 -20.359 -0.190 1.00 0.00 H new ATOM 1040 N LYS A 68 3.891 -20.936 -2.375 1.00 0.00 N ATOM 1041 CA LYS A 68 2.479 -21.416 -2.485 1.00 0.00 C ATOM 1042 C LYS A 68 1.894 -21.000 -3.844 1.00 0.00 C ATOM 1043 O LYS A 68 2.603 -20.569 -4.732 1.00 0.00 O ATOM 1044 CB LYS A 68 1.654 -20.780 -1.359 1.00 0.00 C ATOM 1045 CG LYS A 68 0.510 -21.719 -0.950 1.00 0.00 C ATOM 1046 CD LYS A 68 1.009 -22.719 0.097 1.00 0.00 C ATOM 1047 CE LYS A 68 -0.146 -23.624 0.534 1.00 0.00 C ATOM 1048 NZ LYS A 68 0.079 -24.081 1.935 1.00 0.00 N ATOM 0 H LYS A 68 4.548 -21.606 -1.975 1.00 0.00 H new ATOM 0 HA LYS A 68 2.451 -22.503 -2.402 1.00 0.00 H new ATOM 0 HB2 LYS A 68 2.293 -20.576 -0.500 1.00 0.00 H new ATOM 0 HB3 LYS A 68 1.249 -19.823 -1.689 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -0.321 -21.140 -0.547 1.00 0.00 H new ATOM 0 HG3 LYS A 68 0.134 -22.251 -1.824 1.00 0.00 H new ATOM 0 HD2 LYS A 68 1.819 -23.320 -0.316 1.00 0.00 H new ATOM 0 HD3 LYS A 68 1.414 -22.188 0.958 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -1.091 -23.084 0.464 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -0.220 -24.484 -0.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -0.706 -24.696 2.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 0.972 -24.611 1.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 0.128 -23.256 2.566 1.00 0.00 H new ATOM 1062 N GLY A 69 0.602 -21.122 -4.009 1.00 0.00 N ATOM 1063 CA GLY A 69 -0.036 -20.731 -5.301 1.00 0.00 C ATOM 1064 C GLY A 69 -0.744 -19.380 -5.142 1.00 0.00 C ATOM 1065 O GLY A 69 -1.541 -18.991 -5.972 1.00 0.00 O ATOM 0 H GLY A 69 -0.041 -21.477 -3.301 1.00 0.00 H new ATOM 0 HA2 GLY A 69 0.718 -20.667 -6.085 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -0.752 -21.493 -5.609 1.00 0.00 H new ATOM 1069 N TYR A 70 -0.473 -18.670 -4.079 1.00 0.00 N ATOM 1070 CA TYR A 70 -1.147 -17.355 -3.861 1.00 0.00 C ATOM 1071 C TYR A 70 -2.631 -17.490 -4.218 1.00 0.00 C ATOM 1072 O TYR A 70 -3.351 -18.246 -3.599 1.00 0.00 O ATOM 1073 CB TYR A 70 -0.480 -16.270 -4.728 1.00 0.00 C ATOM 1074 CG TYR A 70 0.722 -15.690 -4.008 1.00 0.00 C ATOM 1075 CD1 TYR A 70 1.444 -16.473 -3.094 1.00 0.00 C ATOM 1076 CD2 TYR A 70 1.113 -14.360 -4.254 1.00 0.00 C ATOM 1077 CE1 TYR A 70 2.545 -15.934 -2.430 1.00 0.00 C ATOM 1078 CE2 TYR A 70 2.219 -13.817 -3.586 1.00 0.00 C ATOM 1079 CZ TYR A 70 2.935 -14.607 -2.670 1.00 0.00 C ATOM 1080 OH TYR A 70 4.017 -14.081 -2.001 1.00 0.00 O ATOM 0 H TYR A 70 0.187 -18.944 -3.351 1.00 0.00 H new ATOM 0 HA TYR A 70 -1.053 -17.062 -2.815 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -0.171 -16.696 -5.682 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -1.197 -15.479 -4.949 1.00 0.00 H new ATOM 0 HD1 TYR A 70 1.146 -17.494 -2.905 1.00 0.00 H new ATOM 0 HD2 TYR A 70 0.560 -13.757 -4.959 1.00 0.00 H new ATOM 0 HE1 TYR A 70 3.100 -16.539 -1.729 1.00 0.00 H new ATOM 0 HE2 TYR A 70 2.520 -12.797 -3.774 1.00 0.00 H new ATOM 0 HH TYR A 70 3.770 -13.219 -1.606 1.00 0.00 H new ATOM 1090 N GLN A 71 -3.093 -16.775 -5.207 1.00 0.00 N ATOM 1091 CA GLN A 71 -4.527 -16.868 -5.598 1.00 0.00 C ATOM 1092 C GLN A 71 -4.762 -15.988 -6.823 1.00 0.00 C ATOM 1093 O GLN A 71 -4.673 -16.434 -7.950 1.00 0.00 O ATOM 1094 CB GLN A 71 -5.412 -16.380 -4.443 1.00 0.00 C ATOM 1095 CG GLN A 71 -6.886 -16.556 -4.815 1.00 0.00 C ATOM 1096 CD GLN A 71 -7.222 -18.047 -4.859 1.00 0.00 C ATOM 1097 OE1 GLN A 71 -6.780 -18.805 -4.019 1.00 0.00 O ATOM 1098 NE2 GLN A 71 -7.991 -18.504 -5.809 1.00 0.00 N ATOM 0 H GLN A 71 -2.535 -16.127 -5.764 1.00 0.00 H new ATOM 0 HA GLN A 71 -4.778 -17.903 -5.828 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -5.186 -16.941 -3.536 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -5.203 -15.332 -4.229 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -7.520 -16.050 -4.086 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -7.086 -16.098 -5.784 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -8.363 -17.868 -6.515 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -8.221 -19.497 -5.846 1.00 0.00 H new ATOM 1107 N SER A 72 -5.064 -14.736 -6.611 1.00 0.00 N ATOM 1108 CA SER A 72 -5.305 -13.825 -7.759 1.00 0.00 C ATOM 1109 C SER A 72 -4.983 -12.386 -7.352 1.00 0.00 C ATOM 1110 O SER A 72 -4.714 -12.093 -6.204 1.00 0.00 O ATOM 1111 CB SER A 72 -6.770 -13.919 -8.187 1.00 0.00 C ATOM 1112 OG SER A 72 -7.593 -13.350 -7.178 1.00 0.00 O ATOM 0 H SER A 72 -5.154 -14.307 -5.690 1.00 0.00 H new ATOM 0 HA SER A 72 -4.664 -14.116 -8.591 1.00 0.00 H new ATOM 0 HB2 SER A 72 -6.919 -13.396 -9.131 1.00 0.00 H new ATOM 0 HB3 SER A 72 -7.046 -14.960 -8.353 1.00 0.00 H new ATOM 0 HG SER A 72 -8.532 -13.408 -7.451 1.00 0.00 H new ATOM 1118 N TRP A 73 -5.017 -11.492 -8.296 1.00 0.00 N ATOM 1119 CA TRP A 73 -4.721 -10.067 -7.985 1.00 0.00 C ATOM 1120 C TRP A 73 -5.648 -9.157 -8.796 1.00 0.00 C ATOM 1121 O TRP A 73 -6.018 -9.466 -9.911 1.00 0.00 O ATOM 1122 CB TRP A 73 -3.262 -9.753 -8.326 1.00 0.00 C ATOM 1123 CG TRP A 73 -2.731 -10.787 -9.264 1.00 0.00 C ATOM 1124 CD1 TRP A 73 -2.825 -10.736 -10.613 1.00 0.00 C ATOM 1125 CD2 TRP A 73 -2.018 -12.018 -8.949 1.00 0.00 C ATOM 1126 NE1 TRP A 73 -2.217 -11.857 -11.144 1.00 0.00 N ATOM 1127 CE2 TRP A 73 -1.707 -12.680 -10.158 1.00 0.00 C ATOM 1128 CE3 TRP A 73 -1.619 -12.619 -7.741 1.00 0.00 C ATOM 1129 CZ2 TRP A 73 -1.023 -13.896 -10.172 1.00 0.00 C ATOM 1130 CZ3 TRP A 73 -0.927 -13.843 -7.748 1.00 0.00 C ATOM 1131 CH2 TRP A 73 -0.630 -14.480 -8.963 1.00 0.00 C ATOM 0 H TRP A 73 -5.238 -11.686 -9.273 1.00 0.00 H new ATOM 0 HA TRP A 73 -4.886 -9.892 -6.922 1.00 0.00 H new ATOM 0 HB2 TRP A 73 -3.189 -8.765 -8.780 1.00 0.00 H new ATOM 0 HB3 TRP A 73 -2.662 -9.731 -7.416 1.00 0.00 H new ATOM 0 HD1 TRP A 73 -3.298 -9.948 -11.181 1.00 0.00 H new ATOM 0 HE1 TRP A 73 -2.152 -12.053 -12.143 1.00 0.00 H new ATOM 0 HE3 TRP A 73 -1.846 -12.137 -6.802 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 -0.799 -14.383 -11.109 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 -0.623 -14.295 -6.815 1.00 0.00 H new ATOM 0 HH2 TRP A 73 -0.099 -15.420 -8.965 1.00 0.00 H new ATOM 1142 N ASP A 74 -6.027 -8.040 -8.239 1.00 0.00 N ATOM 1143 CA ASP A 74 -6.937 -7.110 -8.968 1.00 0.00 C ATOM 1144 C ASP A 74 -6.455 -5.676 -8.765 1.00 0.00 C ATOM 1145 O ASP A 74 -5.734 -5.382 -7.835 1.00 0.00 O ATOM 1146 CB ASP A 74 -8.358 -7.241 -8.416 1.00 0.00 C ATOM 1147 CG ASP A 74 -8.901 -8.641 -8.707 1.00 0.00 C ATOM 1148 OD1 ASP A 74 -8.297 -9.333 -9.509 1.00 0.00 O ATOM 1149 OD2 ASP A 74 -9.910 -8.996 -8.122 1.00 0.00 O ATOM 0 H ASP A 74 -5.746 -7.730 -7.309 1.00 0.00 H new ATOM 0 HA ASP A 74 -6.934 -7.359 -10.029 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -8.359 -7.057 -7.342 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -9.004 -6.489 -8.869 1.00 0.00 H new ATOM 1154 N VAL A 75 -6.838 -4.787 -9.638 1.00 0.00 N ATOM 1155 CA VAL A 75 -6.390 -3.374 -9.508 1.00 0.00 C ATOM 1156 C VAL A 75 -7.538 -2.507 -8.993 1.00 0.00 C ATOM 1157 O VAL A 75 -8.696 -2.827 -9.172 1.00 0.00 O ATOM 1158 CB VAL A 75 -5.923 -2.855 -10.866 1.00 0.00 C ATOM 1159 CG1 VAL A 75 -5.058 -1.608 -10.676 1.00 0.00 C ATOM 1160 CG2 VAL A 75 -5.104 -3.941 -11.562 1.00 0.00 C ATOM 0 H VAL A 75 -7.443 -4.979 -10.437 1.00 0.00 H new ATOM 0 HA VAL A 75 -5.563 -3.327 -8.799 1.00 0.00 H new ATOM 0 HB VAL A 75 -6.790 -2.598 -11.474 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -4.728 -1.243 -11.648 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -5.640 -0.834 -10.176 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -4.188 -1.858 -10.068 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -4.767 -3.577 -12.533 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -4.239 -4.193 -10.949 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -5.721 -4.829 -11.702 1.00 0.00 H new ATOM 1170 N ILE A 76 -7.224 -1.412 -8.353 1.00 0.00 N ATOM 1171 CA ILE A 76 -8.296 -0.523 -7.823 1.00 0.00 C ATOM 1172 C ILE A 76 -8.088 0.886 -8.376 1.00 0.00 C ATOM 1173 O ILE A 76 -7.282 1.646 -7.877 1.00 0.00 O ATOM 1174 CB ILE A 76 -8.211 -0.475 -6.297 1.00 0.00 C ATOM 1175 CG1 ILE A 76 -8.244 -1.897 -5.732 1.00 0.00 C ATOM 1176 CG2 ILE A 76 -9.402 0.314 -5.748 1.00 0.00 C ATOM 1177 CD1 ILE A 76 -7.983 -1.848 -4.225 1.00 0.00 C ATOM 0 H ILE A 76 -6.271 -1.096 -8.175 1.00 0.00 H new ATOM 0 HA ILE A 76 -9.272 -0.905 -8.123 1.00 0.00 H new ATOM 0 HB ILE A 76 -7.280 0.009 -6.003 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -9.212 -2.357 -5.930 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -7.491 -2.514 -6.223 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -9.344 0.350 -4.660 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -9.381 1.328 -6.146 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -10.330 -0.174 -6.046 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -8.006 -2.859 -3.819 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -7.005 -1.404 -4.039 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -8.752 -1.246 -3.742 1.00 0.00 H new ATOM 1189 N SER A 77 -8.813 1.237 -9.403 1.00 0.00 N ATOM 1190 CA SER A 77 -8.668 2.593 -10.000 1.00 0.00 C ATOM 1191 C SER A 77 -9.982 3.361 -9.835 1.00 0.00 C ATOM 1192 O SER A 77 -11.050 2.840 -10.084 1.00 0.00 O ATOM 1193 CB SER A 77 -8.333 2.453 -11.484 1.00 0.00 C ATOM 1194 OG SER A 77 -8.732 1.164 -11.936 1.00 0.00 O ATOM 0 H SER A 77 -9.503 0.638 -9.856 1.00 0.00 H new ATOM 0 HA SER A 77 -7.868 3.137 -9.498 1.00 0.00 H new ATOM 0 HB2 SER A 77 -8.843 3.226 -12.058 1.00 0.00 H new ATOM 0 HB3 SER A 77 -7.263 2.592 -11.642 1.00 0.00 H new ATOM 0 HG SER A 77 -8.520 1.071 -12.888 1.00 0.00 H new ATOM 1200 N LEU A 78 -9.910 4.597 -9.421 1.00 0.00 N ATOM 1201 CA LEU A 78 -11.150 5.400 -9.242 1.00 0.00 C ATOM 1202 C LEU A 78 -11.288 6.384 -10.403 1.00 0.00 C ATOM 1203 O LEU A 78 -10.385 7.139 -10.701 1.00 0.00 O ATOM 1204 CB LEU A 78 -11.072 6.171 -7.922 1.00 0.00 C ATOM 1205 CG LEU A 78 -11.911 5.456 -6.861 1.00 0.00 C ATOM 1206 CD1 LEU A 78 -11.387 4.034 -6.659 1.00 0.00 C ATOM 1207 CD2 LEU A 78 -11.821 6.222 -5.538 1.00 0.00 C ATOM 0 H LEU A 78 -9.042 5.085 -9.199 1.00 0.00 H new ATOM 0 HA LEU A 78 -12.015 4.737 -9.223 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -10.036 6.244 -7.592 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -11.435 7.189 -8.062 1.00 0.00 H new ATOM 0 HG LEU A 78 -12.949 5.415 -7.192 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -11.988 3.529 -5.903 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -11.451 3.486 -7.599 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -10.348 4.072 -6.331 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -12.419 5.713 -4.782 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -10.782 6.264 -5.212 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -12.199 7.235 -5.678 1.00 0.00 H new ATOM 1219 N ARG A 79 -12.412 6.381 -11.059 1.00 0.00 N ATOM 1220 CA ARG A 79 -12.612 7.318 -12.203 1.00 0.00 C ATOM 1221 C ARG A 79 -13.444 8.521 -11.739 1.00 0.00 C ATOM 1222 O ARG A 79 -14.325 8.399 -10.912 1.00 0.00 O ATOM 1223 CB ARG A 79 -13.345 6.590 -13.334 1.00 0.00 C ATOM 1224 CG ARG A 79 -13.279 7.421 -14.621 1.00 0.00 C ATOM 1225 CD ARG A 79 -11.972 7.124 -15.362 1.00 0.00 C ATOM 1226 NE ARG A 79 -11.883 7.982 -16.577 1.00 0.00 N ATOM 1227 CZ ARG A 79 -10.882 7.840 -17.402 1.00 0.00 C ATOM 1228 NH1 ARG A 79 -9.962 6.947 -17.164 1.00 0.00 N ATOM 1229 NH2 ARG A 79 -10.802 8.592 -18.467 1.00 0.00 N ATOM 0 H ARG A 79 -13.203 5.771 -10.855 1.00 0.00 H new ATOM 0 HA ARG A 79 -11.644 7.666 -12.564 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -12.895 5.611 -13.500 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -14.385 6.419 -13.054 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -14.131 7.188 -15.260 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -13.340 8.483 -14.383 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -11.120 7.312 -14.708 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -11.932 6.072 -15.643 1.00 0.00 H new ATOM 0 HE ARG A 79 -12.604 8.679 -16.764 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -10.025 6.359 -16.333 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -9.180 6.836 -17.809 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -11.522 9.290 -18.654 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -10.020 8.481 -19.112 1.00 0.00 H new ATOM 1243 N ALA A 80 -13.167 9.682 -12.272 1.00 0.00 N ATOM 1244 CA ALA A 80 -13.937 10.899 -11.874 1.00 0.00 C ATOM 1245 C ALA A 80 -15.281 10.920 -12.613 1.00 0.00 C ATOM 1246 O ALA A 80 -16.207 11.606 -12.231 1.00 0.00 O ATOM 1247 CB ALA A 80 -13.126 12.145 -12.235 1.00 0.00 C ATOM 0 H ALA A 80 -12.439 9.841 -12.968 1.00 0.00 H new ATOM 0 HA ALA A 80 -14.122 10.884 -10.800 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -13.682 13.037 -11.947 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -12.173 12.125 -11.706 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -12.944 12.162 -13.310 1.00 0.00 H new ATOM 1253 N ASP A 81 -15.382 10.167 -13.670 1.00 0.00 N ATOM 1254 CA ASP A 81 -16.654 10.130 -14.447 1.00 0.00 C ATOM 1255 C ASP A 81 -17.577 9.063 -13.852 1.00 0.00 C ATOM 1256 O ASP A 81 -18.498 8.604 -14.495 1.00 0.00 O ATOM 1257 CB ASP A 81 -16.359 9.795 -15.914 1.00 0.00 C ATOM 1258 CG ASP A 81 -15.587 10.947 -16.564 1.00 0.00 C ATOM 1259 OD1 ASP A 81 -15.555 12.020 -15.981 1.00 0.00 O ATOM 1260 OD2 ASP A 81 -15.042 10.738 -17.636 1.00 0.00 O ATOM 0 H ASP A 81 -14.637 9.572 -14.032 1.00 0.00 H new ATOM 0 HA ASP A 81 -17.139 11.105 -14.396 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -15.778 8.875 -15.977 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -17.291 9.621 -16.451 1.00 0.00 H new ATOM 1265 N ASN A 82 -17.340 8.675 -12.624 1.00 0.00 N ATOM 1266 CA ASN A 82 -18.210 7.644 -11.980 1.00 0.00 C ATOM 1267 C ASN A 82 -18.679 8.135 -10.593 1.00 0.00 C ATOM 1268 O ASN A 82 -17.891 8.647 -9.822 1.00 0.00 O ATOM 1269 CB ASN A 82 -17.421 6.343 -11.828 1.00 0.00 C ATOM 1270 CG ASN A 82 -17.881 5.348 -12.898 1.00 0.00 C ATOM 1271 OD1 ASN A 82 -19.065 5.169 -13.105 1.00 0.00 O ATOM 1272 ND2 ASN A 82 -16.992 4.692 -13.592 1.00 0.00 N ATOM 0 H ASN A 82 -16.582 9.028 -12.040 1.00 0.00 H new ATOM 0 HA ASN A 82 -19.086 7.471 -12.605 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -16.353 6.537 -11.930 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -17.576 5.924 -10.834 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -17.291 4.030 -14.308 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -15.998 4.842 -13.419 1.00 0.00 H new ATOM 1279 N PRO A 83 -19.944 7.969 -10.262 1.00 0.00 N ATOM 1280 CA PRO A 83 -20.489 8.392 -8.932 1.00 0.00 C ATOM 1281 C PRO A 83 -20.053 7.437 -7.810 1.00 0.00 C ATOM 1282 O PRO A 83 -20.356 7.630 -6.648 1.00 0.00 O ATOM 1283 CB PRO A 83 -22.004 8.330 -9.126 1.00 0.00 C ATOM 1284 CG PRO A 83 -22.224 7.322 -10.204 1.00 0.00 C ATOM 1285 CD PRO A 83 -20.991 7.367 -11.106 1.00 0.00 C ATOM 0 HA PRO A 83 -20.130 9.378 -8.635 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -22.506 8.036 -8.205 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -22.404 9.303 -9.410 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -22.358 6.326 -9.781 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -23.126 7.552 -10.770 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -20.707 6.370 -11.441 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -21.173 7.964 -12.000 1.00 0.00 H new ATOM 1293 N GLN A 84 -19.351 6.404 -8.174 1.00 0.00 N ATOM 1294 CA GLN A 84 -18.895 5.413 -7.154 1.00 0.00 C ATOM 1295 C GLN A 84 -17.638 5.935 -6.461 1.00 0.00 C ATOM 1296 O GLN A 84 -17.023 5.251 -5.680 1.00 0.00 O ATOM 1297 CB GLN A 84 -18.588 4.073 -7.823 1.00 0.00 C ATOM 1298 CG GLN A 84 -19.856 3.515 -8.467 1.00 0.00 C ATOM 1299 CD GLN A 84 -19.554 2.147 -9.080 1.00 0.00 C ATOM 1300 OE1 GLN A 84 -18.644 2.011 -9.874 1.00 0.00 O ATOM 1301 NE2 GLN A 84 -20.277 1.116 -8.736 1.00 0.00 N ATOM 0 H GLN A 84 -19.071 6.199 -9.133 1.00 0.00 H new ATOM 0 HA GLN A 84 -19.687 5.271 -6.419 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -17.812 4.202 -8.578 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -18.202 3.368 -7.086 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -20.647 3.425 -7.722 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -20.218 4.198 -9.235 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -21.041 1.228 -8.070 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -20.078 0.198 -9.133 1.00 0.00 H new ATOM 1310 N LYS A 85 -17.258 7.148 -6.725 1.00 0.00 N ATOM 1311 CA LYS A 85 -16.042 7.699 -6.068 1.00 0.00 C ATOM 1312 C LYS A 85 -16.398 8.188 -4.660 1.00 0.00 C ATOM 1313 O LYS A 85 -15.571 8.200 -3.768 1.00 0.00 O ATOM 1314 CB LYS A 85 -15.511 8.861 -6.910 1.00 0.00 C ATOM 1315 CG LYS A 85 -16.569 9.962 -6.973 1.00 0.00 C ATOM 1316 CD LYS A 85 -16.147 11.020 -7.993 1.00 0.00 C ATOM 1317 CE LYS A 85 -17.093 12.217 -7.908 1.00 0.00 C ATOM 1318 NZ LYS A 85 -16.606 13.162 -6.865 1.00 0.00 N ATOM 0 H LYS A 85 -17.734 7.783 -7.366 1.00 0.00 H new ATOM 0 HA LYS A 85 -15.276 6.927 -5.988 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -14.590 9.250 -6.475 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -15.268 8.516 -7.915 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -17.534 9.538 -7.252 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -16.693 10.418 -5.991 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -15.123 11.338 -7.800 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -16.166 10.599 -8.998 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -17.147 12.720 -8.873 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -18.101 11.881 -7.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -17.391 13.769 -6.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -16.240 12.625 -6.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -15.847 13.753 -7.260 1.00 0.00 H new ATOM 1332 N GLU A 86 -17.627 8.578 -4.451 1.00 0.00 N ATOM 1333 CA GLU A 86 -18.041 9.052 -3.098 1.00 0.00 C ATOM 1334 C GLU A 86 -18.351 7.848 -2.201 1.00 0.00 C ATOM 1335 O GLU A 86 -17.856 7.738 -1.089 1.00 0.00 O ATOM 1336 CB GLU A 86 -19.284 9.933 -3.218 1.00 0.00 C ATOM 1337 CG GLU A 86 -19.597 10.556 -1.855 1.00 0.00 C ATOM 1338 CD GLU A 86 -18.525 11.592 -1.511 1.00 0.00 C ATOM 1339 OE1 GLU A 86 -17.912 12.110 -2.430 1.00 0.00 O ATOM 1340 OE2 GLU A 86 -18.335 11.850 -0.333 1.00 0.00 O ATOM 0 H GLU A 86 -18.362 8.589 -5.158 1.00 0.00 H new ATOM 0 HA GLU A 86 -17.229 9.631 -2.658 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -19.119 10.715 -3.959 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -20.131 9.341 -3.563 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -20.580 11.027 -1.875 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -19.630 9.782 -1.088 1.00 0.00 H new ATOM 1347 N ALA A 87 -19.162 6.933 -2.670 1.00 0.00 N ATOM 1348 CA ALA A 87 -19.500 5.738 -1.849 1.00 0.00 C ATOM 1349 C ALA A 87 -18.250 4.879 -1.659 1.00 0.00 C ATOM 1350 O ALA A 87 -18.126 4.157 -0.689 1.00 0.00 O ATOM 1351 CB ALA A 87 -20.584 4.920 -2.553 1.00 0.00 C ATOM 0 H ALA A 87 -19.604 6.965 -3.589 1.00 0.00 H new ATOM 0 HA ALA A 87 -19.869 6.061 -0.875 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -20.829 4.046 -1.950 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -21.476 5.533 -2.683 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -20.220 4.597 -3.529 1.00 0.00 H new ATOM 1357 N LEU A 88 -17.321 4.934 -2.582 1.00 0.00 N ATOM 1358 CA LEU A 88 -16.094 4.105 -2.447 1.00 0.00 C ATOM 1359 C LEU A 88 -15.300 4.572 -1.230 1.00 0.00 C ATOM 1360 O LEU A 88 -14.511 3.834 -0.684 1.00 0.00 O ATOM 1361 CB LEU A 88 -15.205 4.201 -3.697 1.00 0.00 C ATOM 1362 CG LEU A 88 -15.710 3.218 -4.764 1.00 0.00 C ATOM 1363 CD1 LEU A 88 -15.180 3.609 -6.153 1.00 0.00 C ATOM 1364 CD2 LEU A 88 -15.210 1.810 -4.433 1.00 0.00 C ATOM 0 H LEU A 88 -17.363 5.516 -3.418 1.00 0.00 H new ATOM 0 HA LEU A 88 -16.401 3.066 -2.327 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -15.219 5.218 -4.089 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -14.171 3.974 -3.439 1.00 0.00 H new ATOM 0 HG LEU A 88 -16.800 3.246 -4.772 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -15.548 2.901 -6.895 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -15.525 4.612 -6.405 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -14.090 3.592 -6.145 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -15.567 1.110 -5.189 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -14.120 1.805 -4.419 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -15.586 1.511 -3.455 1.00 0.00 H new ATOM 1376 N ARG A 89 -15.482 5.793 -0.797 1.00 0.00 N ATOM 1377 CA ARG A 89 -14.700 6.255 0.387 1.00 0.00 C ATOM 1378 C ARG A 89 -15.018 5.363 1.595 1.00 0.00 C ATOM 1379 O ARG A 89 -14.168 4.728 2.133 1.00 0.00 O ATOM 1380 CB ARG A 89 -15.131 7.684 0.717 1.00 0.00 C ATOM 1381 CG ARG A 89 -14.539 8.651 -0.301 1.00 0.00 C ATOM 1382 CD ARG A 89 -13.345 9.343 0.340 1.00 0.00 C ATOM 1383 NE ARG A 89 -13.831 10.229 1.434 1.00 0.00 N ATOM 1384 CZ ARG A 89 -12.978 10.851 2.194 1.00 0.00 C ATOM 1385 NH1 ARG A 89 -11.702 10.699 1.989 1.00 0.00 N ATOM 1386 NH2 ARG A 89 -13.399 11.624 3.155 1.00 0.00 N ATOM 0 H ARG A 89 -16.123 6.476 -1.201 1.00 0.00 H new ATOM 0 HA ARG A 89 -13.634 6.209 0.167 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -16.219 7.756 0.711 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -14.800 7.951 1.721 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -14.231 8.116 -1.199 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -15.285 9.385 -0.607 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -12.648 8.604 0.735 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -12.803 9.926 -0.404 1.00 0.00 H new ATOM 0 HE ARG A 89 -14.832 10.348 1.587 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -11.375 10.094 1.235 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -11.029 11.184 2.582 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -14.400 11.743 3.313 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -12.728 12.110 3.749 1.00 0.00 H new ATOM 1400 N GLU A 90 -16.238 5.323 2.018 1.00 0.00 N ATOM 1401 CA GLU A 90 -16.588 4.460 3.205 1.00 0.00 C ATOM 1402 C GLU A 90 -16.308 2.992 2.859 1.00 0.00 C ATOM 1403 O GLU A 90 -16.051 2.149 3.696 1.00 0.00 O ATOM 1404 CB GLU A 90 -18.055 4.650 3.585 1.00 0.00 C ATOM 1405 CG GLU A 90 -18.257 6.068 4.129 1.00 0.00 C ATOM 1406 CD GLU A 90 -17.446 6.243 5.415 1.00 0.00 C ATOM 1407 OE1 GLU A 90 -17.059 5.237 5.988 1.00 0.00 O ATOM 1408 OE2 GLU A 90 -17.226 7.377 5.805 1.00 0.00 O ATOM 0 H GLU A 90 -17.016 5.840 1.609 1.00 0.00 H new ATOM 0 HA GLU A 90 -15.977 4.752 4.059 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -18.692 4.487 2.715 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -18.346 3.915 4.335 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -17.944 6.802 3.386 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -19.314 6.246 4.326 1.00 0.00 H new ATOM 1415 N LYS A 91 -16.374 2.730 1.604 1.00 0.00 N ATOM 1416 CA LYS A 91 -16.138 1.349 1.099 1.00 0.00 C ATOM 1417 C LYS A 91 -14.687 0.904 1.370 1.00 0.00 C ATOM 1418 O LYS A 91 -14.446 -0.213 1.780 1.00 0.00 O ATOM 1419 CB LYS A 91 -16.399 1.280 -0.399 1.00 0.00 C ATOM 1420 CG LYS A 91 -16.632 -0.176 -0.815 1.00 0.00 C ATOM 1421 CD LYS A 91 -16.748 -0.262 -2.339 1.00 0.00 C ATOM 1422 CE LYS A 91 -17.477 -1.552 -2.726 1.00 0.00 C ATOM 1423 NZ LYS A 91 -17.695 -1.581 -4.200 1.00 0.00 N ATOM 0 H LYS A 91 -16.585 3.419 0.882 1.00 0.00 H new ATOM 0 HA LYS A 91 -16.823 0.684 1.625 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -17.269 1.885 -0.655 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -15.551 1.693 -0.945 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -15.809 -0.800 -0.467 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -17.541 -0.557 -0.349 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -17.290 0.603 -2.722 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -15.756 -0.243 -2.791 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -16.892 -2.419 -2.418 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -18.433 -1.611 -2.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -18.190 -2.458 -4.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -18.270 -0.762 -4.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -16.777 -1.544 -4.687 1.00 0.00 H new ATOM 1437 N PHE A 92 -13.715 1.762 1.176 1.00 0.00 N ATOM 1438 CA PHE A 92 -12.296 1.363 1.451 1.00 0.00 C ATOM 1439 C PHE A 92 -11.788 1.988 2.740 1.00 0.00 C ATOM 1440 O PHE A 92 -10.722 1.661 3.223 1.00 0.00 O ATOM 1441 CB PHE A 92 -11.395 1.844 0.315 1.00 0.00 C ATOM 1442 CG PHE A 92 -11.122 0.708 -0.626 1.00 0.00 C ATOM 1443 CD1 PHE A 92 -10.531 -0.473 -0.154 1.00 0.00 C ATOM 1444 CD2 PHE A 92 -11.465 0.836 -1.970 1.00 0.00 C ATOM 1445 CE1 PHE A 92 -10.289 -1.531 -1.031 1.00 0.00 C ATOM 1446 CE2 PHE A 92 -11.230 -0.212 -2.855 1.00 0.00 C ATOM 1447 CZ PHE A 92 -10.640 -1.405 -2.388 1.00 0.00 C ATOM 0 H PHE A 92 -13.840 2.717 0.841 1.00 0.00 H new ATOM 0 HA PHE A 92 -12.272 0.277 1.537 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -11.873 2.665 -0.219 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -10.458 2.229 0.718 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -10.263 -0.564 0.888 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -11.915 1.751 -2.326 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -9.835 -2.442 -0.670 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -11.499 -0.112 -3.896 1.00 0.00 H new ATOM 0 HZ PHE A 92 -10.458 -2.221 -3.071 1.00 0.00 H new ATOM 1457 N LEU A 93 -12.503 2.922 3.256 1.00 0.00 N ATOM 1458 CA LEU A 93 -12.039 3.622 4.478 1.00 0.00 C ATOM 1459 C LEU A 93 -12.526 2.894 5.723 1.00 0.00 C ATOM 1460 O LEU A 93 -12.400 3.406 6.819 1.00 0.00 O ATOM 1461 CB LEU A 93 -12.553 5.072 4.502 1.00 0.00 C ATOM 1462 CG LEU A 93 -11.886 5.928 3.409 1.00 0.00 C ATOM 1463 CD1 LEU A 93 -12.343 7.379 3.559 1.00 0.00 C ATOM 1464 CD2 LEU A 93 -10.366 5.866 3.548 1.00 0.00 C ATOM 0 H LEU A 93 -13.399 3.240 2.887 1.00 0.00 H new ATOM 0 HA LEU A 93 -10.949 3.631 4.467 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -13.634 5.078 4.361 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -12.357 5.512 5.480 1.00 0.00 H new ATOM 0 HG LEU A 93 -12.172 5.544 2.430 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -11.874 7.990 2.788 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -13.427 7.432 3.454 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -12.055 7.751 4.542 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -9.904 6.475 2.770 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -10.074 6.246 4.527 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -10.033 4.833 3.446 1.00 0.00 H new ATOM 1476 N ASN A 94 -13.065 1.707 5.604 1.00 0.00 N ATOM 1477 CA ASN A 94 -13.515 0.992 6.827 1.00 0.00 C ATOM 1478 C ASN A 94 -12.418 0.012 7.242 1.00 0.00 C ATOM 1479 O ASN A 94 -11.497 -0.252 6.493 1.00 0.00 O ATOM 1480 CB ASN A 94 -14.799 0.225 6.511 1.00 0.00 C ATOM 1481 CG ASN A 94 -14.486 -0.873 5.494 1.00 0.00 C ATOM 1482 OD1 ASN A 94 -13.403 -0.915 4.945 1.00 0.00 O ATOM 1483 ND2 ASN A 94 -15.395 -1.765 5.211 1.00 0.00 N ATOM 0 H ASN A 94 -13.210 1.211 4.724 1.00 0.00 H new ATOM 0 HA ASN A 94 -13.707 1.698 7.635 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -15.211 -0.211 7.421 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -15.554 0.903 6.113 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -15.196 -2.497 4.529 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -16.304 -1.730 5.672 1.00 0.00 H new ATOM 1490 N GLU A 95 -12.500 -0.534 8.416 1.00 0.00 N ATOM 1491 CA GLU A 95 -11.452 -1.500 8.851 1.00 0.00 C ATOM 1492 C GLU A 95 -11.743 -2.894 8.267 1.00 0.00 C ATOM 1493 O GLU A 95 -12.793 -3.464 8.490 1.00 0.00 O ATOM 1494 CB GLU A 95 -11.445 -1.576 10.383 1.00 0.00 C ATOM 1495 CG GLU A 95 -12.611 -2.449 10.861 1.00 0.00 C ATOM 1496 CD GLU A 95 -12.857 -2.207 12.352 1.00 0.00 C ATOM 1497 OE1 GLU A 95 -11.999 -2.567 13.141 1.00 0.00 O ATOM 1498 OE2 GLU A 95 -13.901 -1.664 12.680 1.00 0.00 O ATOM 0 H GLU A 95 -13.242 -0.358 9.094 1.00 0.00 H new ATOM 0 HA GLU A 95 -10.479 -1.164 8.492 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -10.500 -1.992 10.732 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -11.529 -0.575 10.807 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -13.510 -2.216 10.291 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -12.386 -3.501 10.685 1.00 0.00 H new ATOM 1505 N HIS A 96 -10.816 -3.454 7.540 1.00 0.00 N ATOM 1506 CA HIS A 96 -11.033 -4.815 6.972 1.00 0.00 C ATOM 1507 C HIS A 96 -9.725 -5.619 7.125 1.00 0.00 C ATOM 1508 O HIS A 96 -8.657 -5.143 6.792 1.00 0.00 O ATOM 1509 CB HIS A 96 -11.463 -4.682 5.507 1.00 0.00 C ATOM 1510 CG HIS A 96 -10.441 -5.304 4.613 1.00 0.00 C ATOM 1511 ND1 HIS A 96 -10.693 -6.484 3.927 1.00 0.00 N ATOM 1512 CD2 HIS A 96 -9.150 -4.953 4.306 1.00 0.00 C ATOM 1513 CE1 HIS A 96 -9.577 -6.804 3.255 1.00 0.00 C ATOM 1514 NE2 HIS A 96 -8.617 -5.907 3.461 1.00 0.00 N ATOM 0 H HIS A 96 -9.917 -3.028 7.314 1.00 0.00 H new ATOM 0 HA HIS A 96 -11.824 -5.347 7.500 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -12.429 -5.164 5.358 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -11.589 -3.630 5.251 1.00 0.00 H new ATOM 0 HD1 HIS A 96 -11.566 -7.011 3.933 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -8.635 -4.075 4.666 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -9.472 -7.677 2.628 1.00 0.00 H new ATOM 1522 N THR A 97 -9.787 -6.806 7.689 1.00 0.00 N ATOM 1523 CA THR A 97 -8.528 -7.594 7.918 1.00 0.00 C ATOM 1524 C THR A 97 -8.644 -9.044 7.428 1.00 0.00 C ATOM 1525 O THR A 97 -9.709 -9.630 7.388 1.00 0.00 O ATOM 1526 CB THR A 97 -8.229 -7.613 9.414 1.00 0.00 C ATOM 1527 OG1 THR A 97 -8.091 -6.278 9.880 1.00 0.00 O ATOM 1528 CG2 THR A 97 -6.934 -8.391 9.671 1.00 0.00 C ATOM 0 H THR A 97 -10.646 -7.260 7.998 1.00 0.00 H new ATOM 0 HA THR A 97 -7.730 -7.113 7.352 1.00 0.00 H new ATOM 0 HB THR A 97 -9.047 -8.100 9.945 1.00 0.00 H new ATOM 0 HG1 THR A 97 -7.900 -6.285 10.841 1.00 0.00 H new ATOM 0 HG21 THR A 97 -6.723 -8.403 10.740 1.00 0.00 H new ATOM 0 HG22 THR A 97 -7.047 -9.414 9.312 1.00 0.00 H new ATOM 0 HG23 THR A 97 -6.110 -7.910 9.144 1.00 0.00 H new ATOM 1536 N HIS A 98 -7.518 -9.629 7.110 1.00 0.00 N ATOM 1537 CA HIS A 98 -7.487 -11.054 6.672 1.00 0.00 C ATOM 1538 C HIS A 98 -6.509 -11.830 7.555 1.00 0.00 C ATOM 1539 O HIS A 98 -5.612 -11.264 8.147 1.00 0.00 O ATOM 1540 CB HIS A 98 -7.009 -11.158 5.230 1.00 0.00 C ATOM 1541 CG HIS A 98 -6.515 -9.830 4.756 1.00 0.00 C ATOM 1542 ND1 HIS A 98 -5.274 -9.317 5.119 1.00 0.00 N ATOM 1543 CD2 HIS A 98 -7.090 -8.898 3.945 1.00 0.00 C ATOM 1544 CE1 HIS A 98 -5.151 -8.114 4.526 1.00 0.00 C ATOM 1545 NE2 HIS A 98 -6.229 -7.824 3.803 1.00 0.00 N ATOM 0 H HIS A 98 -6.607 -9.172 7.136 1.00 0.00 H new ATOM 0 HA HIS A 98 -8.494 -11.464 6.754 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -6.213 -11.899 5.155 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -7.824 -11.500 4.592 1.00 0.00 H new ATOM 0 HD1 HIS A 98 -4.586 -9.768 5.722 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -8.064 -8.984 3.486 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -4.290 -7.469 4.625 1.00 0.00 H new ATOM 1553 N GLY A 99 -6.682 -13.119 7.652 1.00 0.00 N ATOM 1554 CA GLY A 99 -5.772 -13.939 8.505 1.00 0.00 C ATOM 1555 C GLY A 99 -4.476 -14.250 7.750 1.00 0.00 C ATOM 1556 O GLY A 99 -3.822 -15.240 8.005 1.00 0.00 O ATOM 0 H GLY A 99 -7.417 -13.643 7.176 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -5.545 -13.403 9.427 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -6.267 -14.867 8.790 1.00 0.00 H new ATOM 1560 N GLU A 100 -4.073 -13.395 6.853 1.00 0.00 N ATOM 1561 CA GLU A 100 -2.792 -13.602 6.118 1.00 0.00 C ATOM 1562 C GLU A 100 -2.228 -12.214 5.820 1.00 0.00 C ATOM 1563 O GLU A 100 -2.952 -11.242 5.887 1.00 0.00 O ATOM 1564 CB GLU A 100 -3.042 -14.371 4.818 1.00 0.00 C ATOM 1565 CG GLU A 100 -3.353 -15.836 5.140 1.00 0.00 C ATOM 1566 CD GLU A 100 -4.822 -15.978 5.543 1.00 0.00 C ATOM 1567 OE1 GLU A 100 -5.529 -14.986 5.495 1.00 0.00 O ATOM 1568 OE2 GLU A 100 -5.216 -17.079 5.891 1.00 0.00 O ATOM 0 H GLU A 100 -4.583 -12.550 6.594 1.00 0.00 H new ATOM 0 HA GLU A 100 -2.090 -14.188 6.711 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -3.873 -13.924 4.273 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -2.166 -14.308 4.172 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -3.143 -16.461 4.272 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -2.710 -16.185 5.948 1.00 0.00 H new ATOM 1575 N ASP A 101 -0.966 -12.062 5.527 1.00 0.00 N ATOM 1576 CA ASP A 101 -0.449 -10.692 5.280 1.00 0.00 C ATOM 1577 C ASP A 101 -1.004 -10.165 3.961 1.00 0.00 C ATOM 1578 O ASP A 101 -1.939 -10.709 3.410 1.00 0.00 O ATOM 1579 CB ASP A 101 1.077 -10.765 5.199 1.00 0.00 C ATOM 1580 CG ASP A 101 1.472 -11.714 4.066 1.00 0.00 C ATOM 1581 OD1 ASP A 101 0.606 -12.052 3.277 1.00 0.00 O ATOM 1582 OD2 ASP A 101 2.631 -12.092 4.011 1.00 0.00 O ATOM 0 H ASP A 101 -0.282 -12.815 5.449 1.00 0.00 H new ATOM 0 HA ASP A 101 -0.755 -10.023 6.085 1.00 0.00 H new ATOM 0 HB2 ASP A 101 1.492 -9.773 5.021 1.00 0.00 H new ATOM 0 HB3 ASP A 101 1.488 -11.117 6.145 1.00 0.00 H new ATOM 1587 N GLU A 102 -0.441 -9.115 3.449 1.00 0.00 N ATOM 1588 CA GLU A 102 -0.951 -8.576 2.165 1.00 0.00 C ATOM 1589 C GLU A 102 0.153 -7.831 1.437 1.00 0.00 C ATOM 1590 O GLU A 102 0.935 -7.125 2.039 1.00 0.00 O ATOM 1591 CB GLU A 102 -2.101 -7.621 2.450 1.00 0.00 C ATOM 1592 CG GLU A 102 -2.865 -7.306 1.161 1.00 0.00 C ATOM 1593 CD GLU A 102 -4.353 -7.178 1.482 1.00 0.00 C ATOM 1594 OE1 GLU A 102 -4.761 -6.103 1.877 1.00 0.00 O ATOM 1595 OE2 GLU A 102 -5.058 -8.162 1.333 1.00 0.00 O ATOM 0 H GLU A 102 0.344 -8.609 3.859 1.00 0.00 H new ATOM 0 HA GLU A 102 -1.295 -9.400 1.539 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -2.777 -8.064 3.182 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -1.717 -6.699 2.887 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -2.494 -6.381 0.720 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -2.705 -8.095 0.426 1.00 0.00 H new ATOM 1602 N VAL A 103 0.197 -7.951 0.145 1.00 0.00 N ATOM 1603 CA VAL A 103 1.224 -7.219 -0.631 1.00 0.00 C ATOM 1604 C VAL A 103 0.527 -6.390 -1.695 1.00 0.00 C ATOM 1605 O VAL A 103 -0.373 -6.857 -2.363 1.00 0.00 O ATOM 1606 CB VAL A 103 2.174 -8.195 -1.312 1.00 0.00 C ATOM 1607 CG1 VAL A 103 3.257 -7.398 -2.038 1.00 0.00 C ATOM 1608 CG2 VAL A 103 2.813 -9.110 -0.264 1.00 0.00 C ATOM 0 H VAL A 103 -0.437 -8.527 -0.408 1.00 0.00 H new ATOM 0 HA VAL A 103 1.796 -6.582 0.044 1.00 0.00 H new ATOM 0 HB VAL A 103 1.627 -8.810 -2.027 1.00 0.00 H new ATOM 0 HG11 VAL A 103 3.945 -8.085 -2.531 1.00 0.00 H new ATOM 0 HG12 VAL A 103 2.795 -6.751 -2.783 1.00 0.00 H new ATOM 0 HG13 VAL A 103 3.805 -6.789 -1.319 1.00 0.00 H new ATOM 0 HG21 VAL A 103 3.492 -9.807 -0.755 1.00 0.00 H new ATOM 0 HG22 VAL A 103 3.369 -8.508 0.455 1.00 0.00 H new ATOM 0 HG23 VAL A 103 2.034 -9.668 0.256 1.00 0.00 H new ATOM 1618 N ARG A 104 0.943 -5.172 -1.872 1.00 0.00 N ATOM 1619 CA ARG A 104 0.304 -4.330 -2.914 1.00 0.00 C ATOM 1620 C ARG A 104 1.380 -3.577 -3.696 1.00 0.00 C ATOM 1621 O ARG A 104 2.372 -3.148 -3.142 1.00 0.00 O ATOM 1622 CB ARG A 104 -0.647 -3.321 -2.268 1.00 0.00 C ATOM 1623 CG ARG A 104 -1.635 -4.048 -1.356 1.00 0.00 C ATOM 1624 CD ARG A 104 -2.568 -3.024 -0.707 1.00 0.00 C ATOM 1625 NE ARG A 104 -1.760 -2.056 0.091 1.00 0.00 N ATOM 1626 CZ ARG A 104 -1.159 -2.453 1.180 1.00 0.00 C ATOM 1627 NH1 ARG A 104 -1.282 -3.688 1.578 1.00 0.00 N ATOM 1628 NH2 ARG A 104 -0.436 -1.614 1.871 1.00 0.00 N ATOM 0 H ARG A 104 1.693 -4.725 -1.344 1.00 0.00 H new ATOM 0 HA ARG A 104 -0.260 -4.974 -3.588 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -0.079 -2.589 -1.694 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -1.187 -2.772 -3.039 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -2.213 -4.772 -1.930 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -1.098 -4.606 -0.589 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -3.136 -2.496 -1.473 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -3.290 -3.529 -0.065 1.00 0.00 H new ATOM 0 HE ARG A 104 -1.677 -1.086 -0.214 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -1.847 -4.344 1.039 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -0.813 -3.999 2.429 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -0.340 -0.647 1.560 1.00 0.00 H new ATOM 0 HH22 ARG A 104 0.033 -1.925 2.722 1.00 0.00 H new ATOM 1642 N PHE A 105 1.186 -3.404 -4.977 1.00 0.00 N ATOM 1643 CA PHE A 105 2.186 -2.665 -5.799 1.00 0.00 C ATOM 1644 C PHE A 105 1.486 -1.516 -6.509 1.00 0.00 C ATOM 1645 O PHE A 105 0.616 -1.730 -7.326 1.00 0.00 O ATOM 1646 CB PHE A 105 2.788 -3.600 -6.852 1.00 0.00 C ATOM 1647 CG PHE A 105 3.648 -2.827 -7.837 1.00 0.00 C ATOM 1648 CD1 PHE A 105 4.447 -1.739 -7.433 1.00 0.00 C ATOM 1649 CD2 PHE A 105 3.633 -3.210 -9.180 1.00 0.00 C ATOM 1650 CE1 PHE A 105 5.219 -1.051 -8.377 1.00 0.00 C ATOM 1651 CE2 PHE A 105 4.402 -2.522 -10.116 1.00 0.00 C ATOM 1652 CZ PHE A 105 5.197 -1.443 -9.718 1.00 0.00 C ATOM 0 H PHE A 105 0.373 -3.745 -5.491 1.00 0.00 H new ATOM 0 HA PHE A 105 2.978 -2.288 -5.152 1.00 0.00 H new ATOM 0 HB2 PHE A 105 3.389 -4.366 -6.362 1.00 0.00 H new ATOM 0 HB3 PHE A 105 1.989 -4.114 -7.386 1.00 0.00 H new ATOM 0 HD1 PHE A 105 4.464 -1.436 -6.396 1.00 0.00 H new ATOM 0 HD2 PHE A 105 3.022 -4.043 -9.494 1.00 0.00 H new ATOM 0 HE1 PHE A 105 5.832 -0.217 -8.068 1.00 0.00 H new ATOM 0 HE2 PHE A 105 4.384 -2.823 -11.153 1.00 0.00 H new ATOM 0 HZ PHE A 105 5.793 -0.913 -10.446 1.00 0.00 H new ATOM 1662 N PHE A 106 1.826 -0.299 -6.204 1.00 0.00 N ATOM 1663 CA PHE A 106 1.135 0.838 -6.866 1.00 0.00 C ATOM 1664 C PHE A 106 1.941 1.299 -8.085 1.00 0.00 C ATOM 1665 O PHE A 106 3.103 1.616 -7.969 1.00 0.00 O ATOM 1666 CB PHE A 106 1.069 1.998 -5.870 1.00 0.00 C ATOM 1667 CG PHE A 106 0.354 1.561 -4.624 1.00 0.00 C ATOM 1668 CD1 PHE A 106 -1.042 1.629 -4.539 1.00 0.00 C ATOM 1669 CD2 PHE A 106 1.102 1.081 -3.545 1.00 0.00 C ATOM 1670 CE1 PHE A 106 -1.690 1.215 -3.367 1.00 0.00 C ATOM 1671 CE2 PHE A 106 0.455 0.665 -2.379 1.00 0.00 C ATOM 1672 CZ PHE A 106 -0.938 0.732 -2.288 1.00 0.00 C ATOM 0 H PHE A 106 2.547 -0.042 -5.530 1.00 0.00 H new ATOM 0 HA PHE A 106 0.139 0.529 -7.182 1.00 0.00 H new ATOM 0 HB2 PHE A 106 2.076 2.335 -5.623 1.00 0.00 H new ATOM 0 HB3 PHE A 106 0.551 2.845 -6.319 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -1.618 1.999 -5.374 1.00 0.00 H new ATOM 0 HD2 PHE A 106 2.179 1.032 -3.613 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -2.766 1.268 -3.296 1.00 0.00 H new ATOM 0 HE2 PHE A 106 1.032 0.291 -1.546 1.00 0.00 H new ATOM 0 HZ PHE A 106 -1.435 0.411 -1.385 1.00 0.00 H new ATOM 1682 N VAL A 107 1.364 1.309 -9.258 1.00 0.00 N ATOM 1683 CA VAL A 107 2.144 1.749 -10.450 1.00 0.00 C ATOM 1684 C VAL A 107 1.644 3.125 -10.909 1.00 0.00 C ATOM 1685 O VAL A 107 2.382 3.895 -11.488 1.00 0.00 O ATOM 1686 CB VAL A 107 1.958 0.744 -11.582 1.00 0.00 C ATOM 1687 CG1 VAL A 107 2.559 -0.602 -11.177 1.00 0.00 C ATOM 1688 CG2 VAL A 107 0.465 0.570 -11.862 1.00 0.00 C ATOM 0 H VAL A 107 0.399 1.035 -9.441 1.00 0.00 H new ATOM 0 HA VAL A 107 3.200 1.811 -10.187 1.00 0.00 H new ATOM 0 HB VAL A 107 2.460 1.109 -12.478 1.00 0.00 H new ATOM 0 HG11 VAL A 107 2.425 -1.319 -11.987 1.00 0.00 H new ATOM 0 HG12 VAL A 107 3.623 -0.479 -10.973 1.00 0.00 H new ATOM 0 HG13 VAL A 107 2.058 -0.969 -10.281 1.00 0.00 H new ATOM 0 HG21 VAL A 107 0.328 -0.148 -12.671 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -0.033 0.205 -10.964 1.00 0.00 H new ATOM 0 HG23 VAL A 107 0.035 1.529 -12.151 1.00 0.00 H new ATOM 1698 N GLU A 108 0.402 3.452 -10.646 1.00 0.00 N ATOM 1699 CA GLU A 108 -0.117 4.782 -11.056 1.00 0.00 C ATOM 1700 C GLU A 108 -1.138 5.251 -10.021 1.00 0.00 C ATOM 1701 O GLU A 108 -2.327 5.259 -10.267 1.00 0.00 O ATOM 1702 CB GLU A 108 -0.756 4.685 -12.449 1.00 0.00 C ATOM 1703 CG GLU A 108 0.344 4.528 -13.508 1.00 0.00 C ATOM 1704 CD GLU A 108 1.233 5.775 -13.516 1.00 0.00 C ATOM 1705 OE1 GLU A 108 0.763 6.814 -13.081 1.00 0.00 O ATOM 1706 OE2 GLU A 108 2.370 5.667 -13.946 1.00 0.00 O ATOM 0 H GLU A 108 -0.269 2.853 -10.166 1.00 0.00 H new ATOM 0 HA GLU A 108 0.698 5.504 -11.107 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -1.438 3.836 -12.489 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -1.347 5.578 -12.653 1.00 0.00 H new ATOM 0 HG2 GLU A 108 0.944 3.643 -13.295 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -0.103 4.381 -14.491 1.00 0.00 H new ATOM 1713 N GLY A 109 -0.684 5.625 -8.855 1.00 0.00 N ATOM 1714 CA GLY A 109 -1.641 6.078 -7.805 1.00 0.00 C ATOM 1715 C GLY A 109 -0.939 6.196 -6.454 1.00 0.00 C ATOM 1716 O GLY A 109 -0.162 5.342 -6.073 1.00 0.00 O ATOM 0 H GLY A 109 0.300 5.637 -8.586 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -2.067 7.041 -8.085 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -2.469 5.373 -7.731 1.00 0.00 H new ATOM 1720 N ALA A 110 -1.220 7.241 -5.719 1.00 0.00 N ATOM 1721 CA ALA A 110 -0.585 7.405 -4.384 1.00 0.00 C ATOM 1722 C ALA A 110 -1.625 7.159 -3.293 1.00 0.00 C ATOM 1723 O ALA A 110 -2.678 7.765 -3.272 1.00 0.00 O ATOM 1724 CB ALA A 110 -0.025 8.822 -4.239 1.00 0.00 C ATOM 0 H ALA A 110 -1.862 7.986 -5.988 1.00 0.00 H new ATOM 0 HA ALA A 110 0.229 6.687 -4.287 1.00 0.00 H new ATOM 0 HB1 ALA A 110 0.438 8.932 -3.258 1.00 0.00 H new ATOM 0 HB2 ALA A 110 0.721 9.000 -5.014 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -0.834 9.545 -4.341 1.00 0.00 H new ATOM 1730 N GLY A 111 -1.327 6.277 -2.384 1.00 0.00 N ATOM 1731 CA GLY A 111 -2.275 5.979 -1.278 1.00 0.00 C ATOM 1732 C GLY A 111 -1.502 5.957 0.040 1.00 0.00 C ATOM 1733 O GLY A 111 -0.438 5.375 0.129 1.00 0.00 O ATOM 0 H GLY A 111 -0.458 5.744 -2.360 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -3.062 6.733 -1.242 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -2.762 5.018 -1.446 1.00 0.00 H new ATOM 1737 N LEU A 112 -2.017 6.578 1.069 1.00 0.00 N ATOM 1738 CA LEU A 112 -1.289 6.572 2.369 1.00 0.00 C ATOM 1739 C LEU A 112 -1.715 5.334 3.148 1.00 0.00 C ATOM 1740 O LEU A 112 -2.889 5.071 3.316 1.00 0.00 O ATOM 1741 CB LEU A 112 -1.654 7.822 3.185 1.00 0.00 C ATOM 1742 CG LEU A 112 -0.405 8.434 3.847 1.00 0.00 C ATOM 1743 CD1 LEU A 112 0.066 9.632 3.022 1.00 0.00 C ATOM 1744 CD2 LEU A 112 -0.753 8.905 5.265 1.00 0.00 C ATOM 0 H LEU A 112 -2.902 7.084 1.065 1.00 0.00 H new ATOM 0 HA LEU A 112 -0.214 6.567 2.188 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -2.124 8.560 2.535 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -2.384 7.560 3.951 1.00 0.00 H new ATOM 0 HG LEU A 112 0.384 7.684 3.896 1.00 0.00 H new ATOM 0 HD11 LEU A 112 0.950 10.069 3.487 1.00 0.00 H new ATOM 0 HD12 LEU A 112 0.311 9.304 2.012 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -0.727 10.378 2.979 1.00 0.00 H new ATOM 0 HD21 LEU A 112 0.132 9.338 5.732 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -1.541 9.656 5.216 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -1.097 8.056 5.856 1.00 0.00 H new ATOM 1756 N PHE A 113 -0.779 4.563 3.612 1.00 0.00 N ATOM 1757 CA PHE A 113 -1.145 3.335 4.363 1.00 0.00 C ATOM 1758 C PHE A 113 -0.948 3.576 5.858 1.00 0.00 C ATOM 1759 O PHE A 113 0.160 3.733 6.331 1.00 0.00 O ATOM 1760 CB PHE A 113 -0.235 2.201 3.908 1.00 0.00 C ATOM 1761 CG PHE A 113 -1.032 0.932 3.766 1.00 0.00 C ATOM 1762 CD1 PHE A 113 -1.926 0.769 2.694 1.00 0.00 C ATOM 1763 CD2 PHE A 113 -0.866 -0.092 4.703 1.00 0.00 C ATOM 1764 CE1 PHE A 113 -2.645 -0.428 2.569 1.00 0.00 C ATOM 1765 CE2 PHE A 113 -1.580 -1.281 4.572 1.00 0.00 C ATOM 1766 CZ PHE A 113 -2.465 -1.452 3.511 1.00 0.00 C ATOM 0 H PHE A 113 0.222 4.728 3.505 1.00 0.00 H new ATOM 0 HA PHE A 113 -2.187 3.077 4.176 1.00 0.00 H new ATOM 0 HB2 PHE A 113 0.231 2.456 2.957 1.00 0.00 H new ATOM 0 HB3 PHE A 113 0.570 2.057 4.629 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -2.058 1.561 1.971 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -0.183 0.039 5.530 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -3.336 -0.562 1.750 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -1.447 -2.072 5.295 1.00 0.00 H new ATOM 0 HZ PHE A 113 -3.015 -2.376 3.413 1.00 0.00 H new ATOM 1776 N CYS A 114 -2.020 3.604 6.603 1.00 0.00 N ATOM 1777 CA CYS A 114 -1.910 3.831 8.069 1.00 0.00 C ATOM 1778 C CYS A 114 -2.492 2.626 8.811 1.00 0.00 C ATOM 1779 O CYS A 114 -3.604 2.209 8.554 1.00 0.00 O ATOM 1780 CB CYS A 114 -2.688 5.094 8.443 1.00 0.00 C ATOM 1781 SG CYS A 114 -1.700 6.554 8.030 1.00 0.00 S ATOM 0 H CYS A 114 -2.971 3.479 6.256 1.00 0.00 H new ATOM 0 HA CYS A 114 -0.864 3.955 8.347 1.00 0.00 H new ATOM 0 HB2 CYS A 114 -3.638 5.121 7.909 1.00 0.00 H new ATOM 0 HB3 CYS A 114 -2.921 5.089 9.508 1.00 0.00 H new ATOM 0 HG CYS A 114 -2.361 7.628 8.345 1.00 0.00 H new ATOM 1787 N LEU A 115 -1.751 2.065 9.727 1.00 0.00 N ATOM 1788 CA LEU A 115 -2.265 0.887 10.485 1.00 0.00 C ATOM 1789 C LEU A 115 -1.971 1.071 11.975 1.00 0.00 C ATOM 1790 O LEU A 115 -1.075 1.801 12.353 1.00 0.00 O ATOM 1791 CB LEU A 115 -1.577 -0.387 9.991 1.00 0.00 C ATOM 1792 CG LEU A 115 -0.110 -0.088 9.674 1.00 0.00 C ATOM 1793 CD1 LEU A 115 0.658 -1.405 9.546 1.00 0.00 C ATOM 1794 CD2 LEU A 115 -0.005 0.690 8.356 1.00 0.00 C ATOM 0 H LEU A 115 -0.812 2.371 9.984 1.00 0.00 H new ATOM 0 HA LEU A 115 -3.341 0.803 10.329 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -1.644 -1.166 10.750 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -2.082 -0.764 9.102 1.00 0.00 H new ATOM 0 HG LEU A 115 0.315 0.512 10.479 1.00 0.00 H new ATOM 0 HD11 LEU A 115 1.704 -1.196 9.320 1.00 0.00 H new ATOM 0 HD12 LEU A 115 0.593 -1.957 10.484 1.00 0.00 H new ATOM 0 HD13 LEU A 115 0.226 -2.002 8.743 1.00 0.00 H new ATOM 0 HD21 LEU A 115 1.043 0.898 8.139 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -0.432 0.096 7.548 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -0.551 1.629 8.443 1.00 0.00 H new ATOM 1806 N HIS A 116 -2.712 0.416 12.824 1.00 0.00 N ATOM 1807 CA HIS A 116 -2.468 0.556 14.286 1.00 0.00 C ATOM 1808 C HIS A 116 -1.616 -0.617 14.775 1.00 0.00 C ATOM 1809 O HIS A 116 -2.019 -1.761 14.685 1.00 0.00 O ATOM 1810 CB HIS A 116 -3.807 0.549 15.027 1.00 0.00 C ATOM 1811 CG HIS A 116 -3.664 1.298 16.332 1.00 0.00 C ATOM 1812 ND1 HIS A 116 -2.423 1.583 16.898 1.00 0.00 N ATOM 1813 CD2 HIS A 116 -4.596 1.825 17.192 1.00 0.00 C ATOM 1814 CE1 HIS A 116 -2.645 2.254 18.049 1.00 0.00 C ATOM 1815 NE2 HIS A 116 -3.949 2.425 18.270 1.00 0.00 N ATOM 0 H HIS A 116 -3.476 -0.210 12.569 1.00 0.00 H new ATOM 0 HA HIS A 116 -1.946 1.493 14.479 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -4.578 1.013 14.412 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -4.125 -0.476 15.217 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -5.666 1.781 17.054 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -1.865 2.607 18.707 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -4.383 2.897 19.063 1.00 0.00 H new ATOM 1824 N ILE A 117 -0.446 -0.344 15.295 1.00 0.00 N ATOM 1825 CA ILE A 117 0.425 -1.448 15.794 1.00 0.00 C ATOM 1826 C ILE A 117 0.668 -1.271 17.298 1.00 0.00 C ATOM 1827 O ILE A 117 1.478 -0.468 17.717 1.00 0.00 O ATOM 1828 CB ILE A 117 1.761 -1.407 15.053 1.00 0.00 C ATOM 1829 CG1 ILE A 117 1.512 -1.544 13.549 1.00 0.00 C ATOM 1830 CG2 ILE A 117 2.647 -2.560 15.530 1.00 0.00 C ATOM 1831 CD1 ILE A 117 2.826 -1.337 12.793 1.00 0.00 C ATOM 0 H ILE A 117 -0.058 0.594 15.395 1.00 0.00 H new ATOM 0 HA ILE A 117 -0.063 -2.407 15.619 1.00 0.00 H new ATOM 0 HB ILE A 117 2.260 -0.459 15.256 1.00 0.00 H new ATOM 0 HG12 ILE A 117 1.103 -2.529 13.326 1.00 0.00 H new ATOM 0 HG13 ILE A 117 0.774 -0.811 13.224 1.00 0.00 H new ATOM 0 HG21 ILE A 117 3.600 -2.530 15.001 1.00 0.00 H new ATOM 0 HG22 ILE A 117 2.824 -2.464 16.601 1.00 0.00 H new ATOM 0 HG23 ILE A 117 2.150 -3.509 15.328 1.00 0.00 H new ATOM 0 HD11 ILE A 117 2.649 -1.435 11.722 1.00 0.00 H new ATOM 0 HD12 ILE A 117 3.216 -0.342 13.007 1.00 0.00 H new ATOM 0 HD13 ILE A 117 3.551 -2.087 13.111 1.00 0.00 H new ATOM 1843 N GLY A 118 -0.032 -2.013 18.108 1.00 0.00 N ATOM 1844 CA GLY A 118 0.149 -1.892 19.585 1.00 0.00 C ATOM 1845 C GLY A 118 -0.359 -0.525 20.053 1.00 0.00 C ATOM 1846 O GLY A 118 -1.431 -0.092 19.679 1.00 0.00 O ATOM 0 H GLY A 118 -0.725 -2.701 17.812 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -0.394 -2.688 20.095 1.00 0.00 H new ATOM 0 HA3 GLY A 118 1.201 -2.008 19.844 1.00 0.00 H new ATOM 1850 N ASP A 119 0.397 0.157 20.877 1.00 0.00 N ATOM 1851 CA ASP A 119 -0.047 1.494 21.376 1.00 0.00 C ATOM 1852 C ASP A 119 0.639 2.600 20.566 1.00 0.00 C ATOM 1853 O ASP A 119 0.959 3.651 21.075 1.00 0.00 O ATOM 1854 CB ASP A 119 0.332 1.634 22.853 1.00 0.00 C ATOM 1855 CG ASP A 119 -0.471 0.637 23.690 1.00 0.00 C ATOM 1856 OD1 ASP A 119 -1.420 0.078 23.164 1.00 0.00 O ATOM 1857 OD2 ASP A 119 -0.125 0.449 24.845 1.00 0.00 O ATOM 0 H ASP A 119 1.303 -0.155 21.226 1.00 0.00 H new ATOM 0 HA ASP A 119 -1.128 1.583 21.265 1.00 0.00 H new ATOM 0 HB2 ASP A 119 1.399 1.455 22.983 1.00 0.00 H new ATOM 0 HB3 ASP A 119 0.135 2.651 23.194 1.00 0.00 H new ATOM 1862 N GLU A 120 0.863 2.372 19.307 1.00 0.00 N ATOM 1863 CA GLU A 120 1.516 3.415 18.460 1.00 0.00 C ATOM 1864 C GLU A 120 0.838 3.441 17.095 1.00 0.00 C ATOM 1865 O GLU A 120 0.313 2.440 16.646 1.00 0.00 O ATOM 1866 CB GLU A 120 3.000 3.087 18.277 1.00 0.00 C ATOM 1867 CG GLU A 120 3.791 3.571 19.492 1.00 0.00 C ATOM 1868 CD GLU A 120 3.430 2.726 20.716 1.00 0.00 C ATOM 1869 OE1 GLU A 120 3.018 1.593 20.529 1.00 0.00 O ATOM 1870 OE2 GLU A 120 3.569 3.228 21.818 1.00 0.00 O ATOM 0 H GLU A 120 0.623 1.508 18.822 1.00 0.00 H new ATOM 0 HA GLU A 120 1.421 4.386 18.946 1.00 0.00 H new ATOM 0 HB2 GLU A 120 3.131 2.012 18.151 1.00 0.00 H new ATOM 0 HB3 GLU A 120 3.378 3.563 17.372 1.00 0.00 H new ATOM 0 HG2 GLU A 120 4.860 3.501 19.293 1.00 0.00 H new ATOM 0 HG3 GLU A 120 3.571 4.621 19.686 1.00 0.00 H new ATOM 1877 N VAL A 121 0.848 4.559 16.411 1.00 0.00 N ATOM 1878 CA VAL A 121 0.212 4.617 15.070 1.00 0.00 C ATOM 1879 C VAL A 121 1.302 4.919 14.037 1.00 0.00 C ATOM 1880 O VAL A 121 1.982 5.923 14.121 1.00 0.00 O ATOM 1881 CB VAL A 121 -0.825 5.746 15.056 1.00 0.00 C ATOM 1882 CG1 VAL A 121 -2.116 5.262 14.391 1.00 0.00 C ATOM 1883 CG2 VAL A 121 -1.122 6.179 16.495 1.00 0.00 C ATOM 0 H VAL A 121 1.271 5.431 16.729 1.00 0.00 H new ATOM 0 HA VAL A 121 -0.278 3.671 14.838 1.00 0.00 H new ATOM 0 HB VAL A 121 -0.429 6.591 14.492 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -2.847 6.070 14.385 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -1.905 4.956 13.366 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -2.516 4.414 14.947 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -1.859 6.982 16.489 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -1.514 5.331 17.057 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -0.204 6.533 16.965 1.00 0.00 H new ATOM 1893 N PHE A 122 1.495 4.058 13.078 1.00 0.00 N ATOM 1894 CA PHE A 122 2.556 4.296 12.064 1.00 0.00 C ATOM 1895 C PHE A 122 1.946 5.075 10.895 1.00 0.00 C ATOM 1896 O PHE A 122 0.855 4.790 10.446 1.00 0.00 O ATOM 1897 CB PHE A 122 3.096 2.940 11.583 1.00 0.00 C ATOM 1898 CG PHE A 122 3.921 2.285 12.681 1.00 0.00 C ATOM 1899 CD1 PHE A 122 3.352 2.001 13.934 1.00 0.00 C ATOM 1900 CD2 PHE A 122 5.264 1.965 12.443 1.00 0.00 C ATOM 1901 CE1 PHE A 122 4.125 1.403 14.936 1.00 0.00 C ATOM 1902 CE2 PHE A 122 6.034 1.369 13.449 1.00 0.00 C ATOM 1903 CZ PHE A 122 5.464 1.089 14.695 1.00 0.00 C ATOM 0 H PHE A 122 0.962 3.198 12.953 1.00 0.00 H new ATOM 0 HA PHE A 122 3.377 4.872 12.490 1.00 0.00 H new ATOM 0 HB2 PHE A 122 2.268 2.289 11.303 1.00 0.00 H new ATOM 0 HB3 PHE A 122 3.708 3.079 10.692 1.00 0.00 H new ATOM 0 HD1 PHE A 122 2.317 2.244 14.124 1.00 0.00 H new ATOM 0 HD2 PHE A 122 5.706 2.179 11.481 1.00 0.00 H new ATOM 0 HE1 PHE A 122 3.685 1.184 15.898 1.00 0.00 H new ATOM 0 HE2 PHE A 122 7.069 1.125 13.263 1.00 0.00 H new ATOM 0 HZ PHE A 122 6.059 0.630 15.471 1.00 0.00 H new ATOM 1913 N GLN A 123 2.661 6.038 10.388 1.00 0.00 N ATOM 1914 CA GLN A 123 2.164 6.829 9.229 1.00 0.00 C ATOM 1915 C GLN A 123 3.206 6.769 8.109 1.00 0.00 C ATOM 1916 O GLN A 123 4.235 7.409 8.191 1.00 0.00 O ATOM 1917 CB GLN A 123 1.947 8.287 9.644 1.00 0.00 C ATOM 1918 CG GLN A 123 1.204 9.024 8.530 1.00 0.00 C ATOM 1919 CD GLN A 123 2.007 10.256 8.115 1.00 0.00 C ATOM 1920 OE1 GLN A 123 3.184 10.159 7.827 1.00 0.00 O ATOM 1921 NE2 GLN A 123 1.419 11.419 8.069 1.00 0.00 N ATOM 0 H GLN A 123 3.581 6.315 10.732 1.00 0.00 H new ATOM 0 HA GLN A 123 1.217 6.415 8.884 1.00 0.00 H new ATOM 0 HB2 GLN A 123 1.374 8.332 10.570 1.00 0.00 H new ATOM 0 HB3 GLN A 123 2.905 8.768 9.838 1.00 0.00 H new ATOM 0 HG2 GLN A 123 1.061 8.364 7.674 1.00 0.00 H new ATOM 0 HG3 GLN A 123 0.213 9.321 8.873 1.00 0.00 H new ATOM 0 HE21 GLN A 123 0.431 11.501 8.311 1.00 0.00 H new ATOM 0 HE22 GLN A 123 1.947 12.247 7.791 1.00 0.00 H new ATOM 1930 N VAL A 124 2.966 6.011 7.070 1.00 0.00 N ATOM 1931 CA VAL A 124 3.971 5.932 5.965 1.00 0.00 C ATOM 1932 C VAL A 124 3.333 6.362 4.645 1.00 0.00 C ATOM 1933 O VAL A 124 2.254 5.926 4.297 1.00 0.00 O ATOM 1934 CB VAL A 124 4.471 4.491 5.825 1.00 0.00 C ATOM 1935 CG1 VAL A 124 3.322 3.595 5.358 1.00 0.00 C ATOM 1936 CG2 VAL A 124 5.601 4.441 4.791 1.00 0.00 C ATOM 0 H VAL A 124 2.126 5.448 6.938 1.00 0.00 H new ATOM 0 HA VAL A 124 4.804 6.594 6.201 1.00 0.00 H new ATOM 0 HB VAL A 124 4.840 4.141 6.789 1.00 0.00 H new ATOM 0 HG11 VAL A 124 3.678 2.570 5.258 1.00 0.00 H new ATOM 0 HG12 VAL A 124 2.514 3.629 6.089 1.00 0.00 H new ATOM 0 HG13 VAL A 124 2.955 3.947 4.394 1.00 0.00 H new ATOM 0 HG21 VAL A 124 5.957 3.416 4.691 1.00 0.00 H new ATOM 0 HG22 VAL A 124 5.229 4.792 3.828 1.00 0.00 H new ATOM 0 HG23 VAL A 124 6.421 5.080 5.117 1.00 0.00 H new ATOM 1946 N LEU A 125 3.991 7.217 3.909 1.00 0.00 N ATOM 1947 CA LEU A 125 3.412 7.672 2.619 1.00 0.00 C ATOM 1948 C LEU A 125 3.757 6.639 1.553 1.00 0.00 C ATOM 1949 O LEU A 125 4.849 6.091 1.538 1.00 0.00 O ATOM 1950 CB LEU A 125 4.004 9.031 2.229 1.00 0.00 C ATOM 1951 CG LEU A 125 3.739 10.049 3.342 1.00 0.00 C ATOM 1952 CD1 LEU A 125 5.045 10.353 4.075 1.00 0.00 C ATOM 1953 CD2 LEU A 125 3.188 11.345 2.738 1.00 0.00 C ATOM 0 H LEU A 125 4.899 7.616 4.146 1.00 0.00 H new ATOM 0 HA LEU A 125 2.331 7.777 2.711 1.00 0.00 H new ATOM 0 HB2 LEU A 125 5.076 8.936 2.058 1.00 0.00 H new ATOM 0 HB3 LEU A 125 3.562 9.376 1.294 1.00 0.00 H new ATOM 0 HG LEU A 125 3.012 9.635 4.040 1.00 0.00 H new ATOM 0 HD11 LEU A 125 4.857 11.078 4.867 1.00 0.00 H new ATOM 0 HD12 LEU A 125 5.441 9.435 4.509 1.00 0.00 H new ATOM 0 HD13 LEU A 125 5.770 10.764 3.372 1.00 0.00 H new ATOM 0 HD21 LEU A 125 3.001 12.066 3.533 1.00 0.00 H new ATOM 0 HD22 LEU A 125 3.914 11.757 2.038 1.00 0.00 H new ATOM 0 HD23 LEU A 125 2.256 11.134 2.213 1.00 0.00 H new ATOM 1965 N CYS A 126 2.829 6.374 0.664 1.00 0.00 N ATOM 1966 CA CYS A 126 3.072 5.370 -0.408 1.00 0.00 C ATOM 1967 C CYS A 126 2.803 5.997 -1.776 1.00 0.00 C ATOM 1968 O CYS A 126 1.820 6.684 -1.974 1.00 0.00 O ATOM 1969 CB CYS A 126 2.137 4.178 -0.204 1.00 0.00 C ATOM 1970 SG CYS A 126 1.511 4.193 1.495 1.00 0.00 S ATOM 0 H CYS A 126 1.910 6.815 0.639 1.00 0.00 H new ATOM 0 HA CYS A 126 4.109 5.038 -0.363 1.00 0.00 H new ATOM 0 HB2 CYS A 126 1.308 4.227 -0.910 1.00 0.00 H new ATOM 0 HB3 CYS A 126 2.668 3.247 -0.400 1.00 0.00 H new ATOM 0 HG CYS A 126 0.332 4.741 1.518 1.00 0.00 H new ATOM 1976 N GLU A 127 3.665 5.757 -2.721 1.00 0.00 N ATOM 1977 CA GLU A 127 3.465 6.327 -4.079 1.00 0.00 C ATOM 1978 C GLU A 127 3.786 5.264 -5.124 1.00 0.00 C ATOM 1979 O GLU A 127 4.489 4.314 -4.852 1.00 0.00 O ATOM 1980 CB GLU A 127 4.400 7.518 -4.273 1.00 0.00 C ATOM 1981 CG GLU A 127 4.071 8.599 -3.246 1.00 0.00 C ATOM 1982 CD GLU A 127 4.958 9.818 -3.497 1.00 0.00 C ATOM 1983 OE1 GLU A 127 5.860 9.712 -4.311 1.00 0.00 O ATOM 1984 OE2 GLU A 127 4.719 10.839 -2.873 1.00 0.00 O ATOM 0 H GLU A 127 4.504 5.187 -2.610 1.00 0.00 H new ATOM 0 HA GLU A 127 2.430 6.652 -4.188 1.00 0.00 H new ATOM 0 HB2 GLU A 127 5.437 7.201 -4.163 1.00 0.00 H new ATOM 0 HB3 GLU A 127 4.294 7.916 -5.282 1.00 0.00 H new ATOM 0 HG2 GLU A 127 3.020 8.878 -3.318 1.00 0.00 H new ATOM 0 HG3 GLU A 127 4.231 8.219 -2.237 1.00 0.00 H new ATOM 1991 N LYS A 128 3.282 5.410 -6.320 1.00 0.00 N ATOM 1992 CA LYS A 128 3.568 4.404 -7.381 1.00 0.00 C ATOM 1993 C LYS A 128 5.084 4.252 -7.578 1.00 0.00 C ATOM 1994 O LYS A 128 5.546 3.609 -8.500 1.00 0.00 O ATOM 1995 CB LYS A 128 2.929 4.853 -8.697 1.00 0.00 C ATOM 1996 CG LYS A 128 3.082 6.369 -8.853 1.00 0.00 C ATOM 1997 CD LYS A 128 3.516 6.698 -10.283 1.00 0.00 C ATOM 1998 CE LYS A 128 4.913 6.131 -10.540 1.00 0.00 C ATOM 1999 NZ LYS A 128 5.716 7.123 -11.306 1.00 0.00 N ATOM 0 H LYS A 128 2.684 6.184 -6.608 1.00 0.00 H new ATOM 0 HA LYS A 128 3.152 3.444 -7.076 1.00 0.00 H new ATOM 0 HB2 LYS A 128 3.402 4.342 -9.535 1.00 0.00 H new ATOM 0 HB3 LYS A 128 1.874 4.581 -8.712 1.00 0.00 H new ATOM 0 HG2 LYS A 128 2.138 6.865 -8.626 1.00 0.00 H new ATOM 0 HG3 LYS A 128 3.819 6.745 -8.143 1.00 0.00 H new ATOM 0 HD2 LYS A 128 2.806 6.278 -10.995 1.00 0.00 H new ATOM 0 HD3 LYS A 128 3.518 7.778 -10.434 1.00 0.00 H new ATOM 0 HE2 LYS A 128 5.404 5.902 -9.594 1.00 0.00 H new ATOM 0 HE3 LYS A 128 4.842 5.197 -11.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 6.666 6.739 -11.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 5.249 7.321 -12.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 5.794 8.004 -10.758 1.00 0.00 H new ATOM 2013 N ASN A 129 5.846 4.835 -6.707 1.00 0.00 N ATOM 2014 CA ASN A 129 7.327 4.738 -6.807 1.00 0.00 C ATOM 2015 C ASN A 129 7.837 3.389 -6.304 1.00 0.00 C ATOM 2016 O ASN A 129 8.538 2.679 -6.998 1.00 0.00 O ATOM 2017 CB ASN A 129 7.964 5.844 -5.980 1.00 0.00 C ATOM 2018 CG ASN A 129 7.362 7.185 -6.393 1.00 0.00 C ATOM 2019 OD1 ASN A 129 7.099 8.032 -5.562 1.00 0.00 O ATOM 2020 ND2 ASN A 129 7.128 7.415 -7.656 1.00 0.00 N ATOM 0 H ASN A 129 5.505 5.383 -5.917 1.00 0.00 H new ATOM 0 HA ASN A 129 7.598 4.839 -7.858 1.00 0.00 H new ATOM 0 HB2 ASN A 129 7.793 5.666 -4.918 1.00 0.00 H new ATOM 0 HB3 ASN A 129 9.043 5.853 -6.132 1.00 0.00 H new ATOM 0 HD21 ASN A 129 6.724 8.306 -7.946 1.00 0.00 H new ATOM 0 HD22 ASN A 129 7.349 6.704 -8.353 1.00 0.00 H new ATOM 2027 N ASP A 130 7.534 3.064 -5.078 1.00 0.00 N ATOM 2028 CA ASP A 130 8.049 1.793 -4.491 1.00 0.00 C ATOM 2029 C ASP A 130 6.924 0.779 -4.223 1.00 0.00 C ATOM 2030 O ASP A 130 5.942 0.695 -4.940 1.00 0.00 O ATOM 2031 CB ASP A 130 8.773 2.117 -3.182 1.00 0.00 C ATOM 2032 CG ASP A 130 9.922 3.092 -3.461 1.00 0.00 C ATOM 2033 OD1 ASP A 130 10.360 3.152 -4.599 1.00 0.00 O ATOM 2034 OD2 ASP A 130 10.347 3.757 -2.531 1.00 0.00 O ATOM 0 H ASP A 130 6.951 3.624 -4.456 1.00 0.00 H new ATOM 0 HA ASP A 130 8.730 1.336 -5.209 1.00 0.00 H new ATOM 0 HB2 ASP A 130 8.076 2.555 -2.467 1.00 0.00 H new ATOM 0 HB3 ASP A 130 9.159 1.203 -2.732 1.00 0.00 H new ATOM 2039 N LEU A 131 7.088 -0.004 -3.190 1.00 0.00 N ATOM 2040 CA LEU A 131 6.079 -1.044 -2.846 1.00 0.00 C ATOM 2041 C LEU A 131 5.921 -1.139 -1.330 1.00 0.00 C ATOM 2042 O LEU A 131 6.847 -0.906 -0.580 1.00 0.00 O ATOM 2043 CB LEU A 131 6.538 -2.392 -3.398 1.00 0.00 C ATOM 2044 CG LEU A 131 5.469 -3.461 -3.123 1.00 0.00 C ATOM 2045 CD1 LEU A 131 5.025 -4.104 -4.433 1.00 0.00 C ATOM 2046 CD2 LEU A 131 6.040 -4.552 -2.215 1.00 0.00 C ATOM 0 H LEU A 131 7.891 0.035 -2.562 1.00 0.00 H new ATOM 0 HA LEU A 131 5.119 -0.773 -3.285 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.719 -2.313 -4.470 1.00 0.00 H new ATOM 0 HB3 LEU A 131 7.482 -2.682 -2.936 1.00 0.00 H new ATOM 0 HG LEU A 131 4.619 -2.981 -2.638 1.00 0.00 H new ATOM 0 HD11 LEU A 131 4.267 -4.860 -4.229 1.00 0.00 H new ATOM 0 HD12 LEU A 131 4.608 -3.341 -5.090 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.882 -4.571 -4.918 1.00 0.00 H new ATOM 0 HD21 LEU A 131 5.275 -5.305 -2.026 1.00 0.00 H new ATOM 0 HD22 LEU A 131 6.896 -5.019 -2.702 1.00 0.00 H new ATOM 0 HD23 LEU A 131 6.356 -4.110 -1.270 1.00 0.00 H new ATOM 2058 N ILE A 132 4.759 -1.512 -0.880 1.00 0.00 N ATOM 2059 CA ILE A 132 4.544 -1.663 0.583 1.00 0.00 C ATOM 2060 C ILE A 132 3.712 -2.923 0.838 1.00 0.00 C ATOM 2061 O ILE A 132 2.793 -3.233 0.108 1.00 0.00 O ATOM 2062 CB ILE A 132 3.808 -0.442 1.126 1.00 0.00 C ATOM 2063 CG1 ILE A 132 3.930 -0.396 2.651 1.00 0.00 C ATOM 2064 CG2 ILE A 132 2.335 -0.542 0.753 1.00 0.00 C ATOM 2065 CD1 ILE A 132 3.536 0.995 3.144 1.00 0.00 C ATOM 0 H ILE A 132 3.948 -1.719 -1.462 1.00 0.00 H new ATOM 0 HA ILE A 132 5.506 -1.749 1.087 1.00 0.00 H new ATOM 0 HB ILE A 132 4.245 0.460 0.699 1.00 0.00 H new ATOM 0 HG12 ILE A 132 3.286 -1.151 3.102 1.00 0.00 H new ATOM 0 HG13 ILE A 132 4.952 -0.626 2.953 1.00 0.00 H new ATOM 0 HG21 ILE A 132 1.802 0.328 1.138 1.00 0.00 H new ATOM 0 HG22 ILE A 132 2.236 -0.577 -0.332 1.00 0.00 H new ATOM 0 HG23 ILE A 132 1.911 -1.448 1.186 1.00 0.00 H new ATOM 0 HD11 ILE A 132 3.621 1.034 4.230 1.00 0.00 H new ATOM 0 HD12 ILE A 132 4.198 1.739 2.701 1.00 0.00 H new ATOM 0 HD13 ILE A 132 2.507 1.206 2.853 1.00 0.00 H new ATOM 2077 N SER A 133 4.022 -3.646 1.874 1.00 0.00 N ATOM 2078 CA SER A 133 3.250 -4.880 2.191 1.00 0.00 C ATOM 2079 C SER A 133 3.223 -5.055 3.705 1.00 0.00 C ATOM 2080 O SER A 133 4.257 -5.065 4.336 1.00 0.00 O ATOM 2081 CB SER A 133 3.938 -6.084 1.555 1.00 0.00 C ATOM 2082 OG SER A 133 3.212 -7.263 1.870 1.00 0.00 O ATOM 0 H SER A 133 4.782 -3.435 2.521 1.00 0.00 H new ATOM 0 HA SER A 133 2.235 -4.799 1.803 1.00 0.00 H new ATOM 0 HB2 SER A 133 3.994 -5.956 0.474 1.00 0.00 H new ATOM 0 HB3 SER A 133 4.962 -6.166 1.919 1.00 0.00 H new ATOM 0 HG SER A 133 2.307 -7.022 2.160 1.00 0.00 H new ATOM 2088 N VAL A 134 2.065 -5.161 4.308 1.00 0.00 N ATOM 2089 CA VAL A 134 2.010 -5.289 5.793 1.00 0.00 C ATOM 2090 C VAL A 134 1.676 -6.737 6.182 1.00 0.00 C ATOM 2091 O VAL A 134 1.297 -7.525 5.343 1.00 0.00 O ATOM 2092 CB VAL A 134 0.926 -4.355 6.328 1.00 0.00 C ATOM 2093 CG1 VAL A 134 1.009 -3.006 5.602 1.00 0.00 C ATOM 2094 CG2 VAL A 134 -0.446 -4.989 6.082 1.00 0.00 C ATOM 0 H VAL A 134 1.160 -5.164 3.837 1.00 0.00 H new ATOM 0 HA VAL A 134 2.977 -5.022 6.219 1.00 0.00 H new ATOM 0 HB VAL A 134 1.070 -4.196 7.397 1.00 0.00 H new ATOM 0 HG11 VAL A 134 0.236 -2.339 5.983 1.00 0.00 H new ATOM 0 HG12 VAL A 134 1.989 -2.560 5.773 1.00 0.00 H new ATOM 0 HG13 VAL A 134 0.861 -3.159 4.533 1.00 0.00 H new ATOM 0 HG21 VAL A 134 -1.225 -4.328 6.461 1.00 0.00 H new ATOM 0 HG22 VAL A 134 -0.589 -5.143 5.012 1.00 0.00 H new ATOM 0 HG23 VAL A 134 -0.501 -5.948 6.597 1.00 0.00 H new ATOM 2104 N PRO A 135 1.846 -7.105 7.437 1.00 0.00 N ATOM 2105 CA PRO A 135 1.592 -8.491 7.912 1.00 0.00 C ATOM 2106 C PRO A 135 0.116 -8.753 8.213 1.00 0.00 C ATOM 2107 O PRO A 135 -0.708 -7.861 8.176 1.00 0.00 O ATOM 2108 CB PRO A 135 2.413 -8.602 9.207 1.00 0.00 C ATOM 2109 CG PRO A 135 3.052 -7.261 9.422 1.00 0.00 C ATOM 2110 CD PRO A 135 2.278 -6.270 8.561 1.00 0.00 C ATOM 0 HA PRO A 135 1.868 -9.220 7.150 1.00 0.00 H new ATOM 0 HB2 PRO A 135 1.775 -8.867 10.050 1.00 0.00 H new ATOM 0 HB3 PRO A 135 3.169 -9.383 9.122 1.00 0.00 H new ATOM 0 HG2 PRO A 135 3.011 -6.976 10.473 1.00 0.00 H new ATOM 0 HG3 PRO A 135 4.104 -7.283 9.138 1.00 0.00 H new ATOM 0 HD2 PRO A 135 1.432 -5.840 9.097 1.00 0.00 H new ATOM 0 HD3 PRO A 135 2.904 -5.440 8.234 1.00 0.00 H new ATOM 2118 N ALA A 136 -0.217 -9.977 8.518 1.00 0.00 N ATOM 2119 CA ALA A 136 -1.631 -10.319 8.837 1.00 0.00 C ATOM 2120 C ALA A 136 -1.948 -9.932 10.280 1.00 0.00 C ATOM 2121 O ALA A 136 -1.074 -9.579 11.045 1.00 0.00 O ATOM 2122 CB ALA A 136 -1.842 -11.822 8.685 1.00 0.00 C ATOM 0 H ALA A 136 0.435 -10.760 8.560 1.00 0.00 H new ATOM 0 HA ALA A 136 -2.284 -9.775 8.154 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -2.877 -12.070 8.919 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -1.621 -12.119 7.660 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -1.179 -12.353 9.368 1.00 0.00 H new ATOM 2128 N HIS A 137 -3.200 -10.006 10.650 1.00 0.00 N ATOM 2129 CA HIS A 137 -3.612 -9.658 12.041 1.00 0.00 C ATOM 2130 C HIS A 137 -3.415 -8.169 12.279 1.00 0.00 C ATOM 2131 O HIS A 137 -3.704 -7.656 13.340 1.00 0.00 O ATOM 2132 CB HIS A 137 -2.782 -10.459 13.047 1.00 0.00 C ATOM 2133 CG HIS A 137 -2.681 -11.875 12.570 1.00 0.00 C ATOM 2134 ND1 HIS A 137 -3.776 -12.547 12.054 1.00 0.00 N ATOM 2135 CD2 HIS A 137 -1.633 -12.761 12.511 1.00 0.00 C ATOM 2136 CE1 HIS A 137 -3.372 -13.779 11.707 1.00 0.00 C ATOM 2137 NE2 HIS A 137 -2.074 -13.961 11.965 1.00 0.00 N ATOM 0 H HIS A 137 -3.963 -10.297 10.039 1.00 0.00 H new ATOM 0 HA HIS A 137 -4.665 -9.905 12.173 1.00 0.00 H new ATOM 0 HB2 HIS A 137 -1.788 -10.023 13.148 1.00 0.00 H new ATOM 0 HB3 HIS A 137 -3.247 -10.425 14.032 1.00 0.00 H new ATOM 0 HD2 HIS A 137 -0.624 -12.557 12.838 1.00 0.00 H new ATOM 0 HE1 HIS A 137 -4.016 -14.530 11.273 1.00 0.00 H new ATOM 0 HE2 HIS A 137 -1.523 -14.803 11.797 1.00 0.00 H new ATOM 2146 N THR A 138 -2.955 -7.470 11.287 1.00 0.00 N ATOM 2147 CA THR A 138 -2.770 -6.004 11.441 1.00 0.00 C ATOM 2148 C THR A 138 -3.801 -5.283 10.554 1.00 0.00 C ATOM 2149 O THR A 138 -3.706 -5.336 9.345 1.00 0.00 O ATOM 2150 CB THR A 138 -1.351 -5.620 11.006 1.00 0.00 C ATOM 2151 OG1 THR A 138 -0.433 -6.599 11.481 1.00 0.00 O ATOM 2152 CG2 THR A 138 -0.991 -4.255 11.598 1.00 0.00 C ATOM 0 H THR A 138 -2.698 -7.849 10.375 1.00 0.00 H new ATOM 0 HA THR A 138 -2.912 -5.715 12.482 1.00 0.00 H new ATOM 0 HB THR A 138 -1.302 -5.570 9.918 1.00 0.00 H new ATOM 0 HG1 THR A 138 0.475 -6.358 11.203 1.00 0.00 H new ATOM 0 HG21 THR A 138 0.018 -3.980 11.290 1.00 0.00 H new ATOM 0 HG22 THR A 138 -1.697 -3.506 11.240 1.00 0.00 H new ATOM 0 HG23 THR A 138 -1.037 -4.307 12.686 1.00 0.00 H new ATOM 2160 N PRO A 139 -4.764 -4.585 11.126 1.00 0.00 N ATOM 2161 CA PRO A 139 -5.778 -3.832 10.319 1.00 0.00 C ATOM 2162 C PRO A 139 -5.122 -2.754 9.452 1.00 0.00 C ATOM 2163 O PRO A 139 -4.201 -2.081 9.870 1.00 0.00 O ATOM 2164 CB PRO A 139 -6.654 -3.147 11.382 1.00 0.00 C ATOM 2165 CG PRO A 139 -6.462 -3.940 12.625 1.00 0.00 C ATOM 2166 CD PRO A 139 -5.034 -4.471 12.573 1.00 0.00 C ATOM 0 HA PRO A 139 -6.324 -4.491 9.644 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -6.354 -2.109 11.528 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -7.701 -3.137 11.081 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -6.616 -3.321 13.509 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -7.180 -4.758 12.680 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -4.335 -3.791 13.060 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -4.945 -5.434 13.076 1.00 0.00 H new ATOM 2174 N HIS A 140 -5.617 -2.567 8.259 1.00 0.00 N ATOM 2175 CA HIS A 140 -5.061 -1.508 7.373 1.00 0.00 C ATOM 2176 C HIS A 140 -6.202 -0.743 6.698 1.00 0.00 C ATOM 2177 O HIS A 140 -7.234 -1.305 6.385 1.00 0.00 O ATOM 2178 CB HIS A 140 -4.167 -2.138 6.312 1.00 0.00 C ATOM 2179 CG HIS A 140 -4.862 -3.327 5.717 1.00 0.00 C ATOM 2180 ND1 HIS A 140 -5.199 -4.436 6.484 1.00 0.00 N ATOM 2181 CD2 HIS A 140 -5.267 -3.615 4.434 1.00 0.00 C ATOM 2182 CE1 HIS A 140 -5.774 -5.334 5.666 1.00 0.00 C ATOM 2183 NE2 HIS A 140 -5.835 -4.879 4.416 1.00 0.00 N ATOM 0 H HIS A 140 -6.386 -3.105 7.859 1.00 0.00 H new ATOM 0 HA HIS A 140 -4.471 -0.815 7.974 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -3.938 -1.410 5.534 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -3.218 -2.441 6.754 1.00 0.00 H new ATOM 0 HD1 HIS A 140 -5.039 -4.548 7.485 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -5.160 -2.962 3.580 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -6.139 -6.300 5.982 1.00 0.00 H new ATOM 2191 N TRP A 141 -6.013 0.516 6.428 1.00 0.00 N ATOM 2192 CA TRP A 141 -7.069 1.296 5.721 1.00 0.00 C ATOM 2193 C TRP A 141 -6.374 2.287 4.775 1.00 0.00 C ATOM 2194 O TRP A 141 -5.272 2.724 5.038 1.00 0.00 O ATOM 2195 CB TRP A 141 -7.936 2.059 6.723 1.00 0.00 C ATOM 2196 CG TRP A 141 -7.078 2.912 7.592 1.00 0.00 C ATOM 2197 CD1 TRP A 141 -6.662 4.166 7.296 1.00 0.00 C ATOM 2198 CD2 TRP A 141 -6.534 2.596 8.901 1.00 0.00 C ATOM 2199 NE1 TRP A 141 -5.893 4.638 8.345 1.00 0.00 N ATOM 2200 CE2 TRP A 141 -5.785 3.704 9.360 1.00 0.00 C ATOM 2201 CE3 TRP A 141 -6.618 1.462 9.725 1.00 0.00 C ATOM 2202 CZ2 TRP A 141 -5.142 3.686 10.599 1.00 0.00 C ATOM 2203 CZ3 TRP A 141 -5.973 1.439 10.970 1.00 0.00 C ATOM 2204 CH2 TRP A 141 -5.236 2.548 11.407 1.00 0.00 C ATOM 0 H TRP A 141 -5.172 1.042 6.666 1.00 0.00 H new ATOM 0 HA TRP A 141 -7.715 0.620 5.162 1.00 0.00 H new ATOM 0 HB2 TRP A 141 -8.660 2.678 6.193 1.00 0.00 H new ATOM 0 HB3 TRP A 141 -8.503 1.357 7.334 1.00 0.00 H new ATOM 0 HD1 TRP A 141 -6.892 4.708 6.391 1.00 0.00 H new ATOM 0 HE1 TRP A 141 -5.459 5.561 8.367 1.00 0.00 H new ATOM 0 HE3 TRP A 141 -7.183 0.602 9.398 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 -4.576 4.544 10.931 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 -6.045 0.562 11.596 1.00 0.00 H new ATOM 0 HH2 TRP A 141 -4.741 2.524 12.367 1.00 0.00 H new ATOM 2215 N PHE A 142 -6.991 2.648 3.682 1.00 0.00 N ATOM 2216 CA PHE A 142 -6.330 3.614 2.744 1.00 0.00 C ATOM 2217 C PHE A 142 -6.743 5.045 3.105 1.00 0.00 C ATOM 2218 O PHE A 142 -7.852 5.289 3.528 1.00 0.00 O ATOM 2219 CB PHE A 142 -6.777 3.331 1.305 1.00 0.00 C ATOM 2220 CG PHE A 142 -5.880 2.303 0.651 1.00 0.00 C ATOM 2221 CD1 PHE A 142 -4.663 2.697 0.070 1.00 0.00 C ATOM 2222 CD2 PHE A 142 -6.274 0.960 0.596 1.00 0.00 C ATOM 2223 CE1 PHE A 142 -3.851 1.755 -0.560 1.00 0.00 C ATOM 2224 CE2 PHE A 142 -5.452 0.015 -0.032 1.00 0.00 C ATOM 2225 CZ PHE A 142 -4.242 0.415 -0.612 1.00 0.00 C ATOM 0 H PHE A 142 -7.914 2.322 3.396 1.00 0.00 H new ATOM 0 HA PHE A 142 -5.249 3.501 2.828 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -7.807 2.974 1.304 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -6.760 4.255 0.727 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -4.356 3.732 0.112 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -7.211 0.653 1.037 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -2.918 2.062 -1.009 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -5.752 -1.022 -0.069 1.00 0.00 H new ATOM 0 HZ PHE A 142 -3.611 -0.313 -1.100 1.00 0.00 H new ATOM 2235 N ASP A 143 -5.866 5.999 2.938 1.00 0.00 N ATOM 2236 CA ASP A 143 -6.241 7.405 3.266 1.00 0.00 C ATOM 2237 C ASP A 143 -6.678 8.112 1.981 1.00 0.00 C ATOM 2238 O ASP A 143 -5.876 8.391 1.113 1.00 0.00 O ATOM 2239 CB ASP A 143 -5.033 8.130 3.861 1.00 0.00 C ATOM 2240 CG ASP A 143 -5.476 9.468 4.456 1.00 0.00 C ATOM 2241 OD1 ASP A 143 -6.662 9.745 4.418 1.00 0.00 O ATOM 2242 OD2 ASP A 143 -4.620 10.191 4.941 1.00 0.00 O ATOM 0 H ASP A 143 -4.915 5.868 2.592 1.00 0.00 H new ATOM 0 HA ASP A 143 -7.056 7.412 3.989 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -4.570 7.514 4.632 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -4.280 8.295 3.090 1.00 0.00 H new ATOM 2247 N MET A 144 -7.941 8.409 1.850 1.00 0.00 N ATOM 2248 CA MET A 144 -8.418 9.100 0.619 1.00 0.00 C ATOM 2249 C MET A 144 -8.461 10.611 0.841 1.00 0.00 C ATOM 2250 O MET A 144 -7.707 11.361 0.251 1.00 0.00 O ATOM 2251 CB MET A 144 -9.806 8.582 0.239 1.00 0.00 C ATOM 2252 CG MET A 144 -9.686 7.137 -0.253 1.00 0.00 C ATOM 2253 SD MET A 144 -11.258 6.608 -0.979 1.00 0.00 S ATOM 2254 CE MET A 144 -10.709 4.975 -1.534 1.00 0.00 C ATOM 0 H MET A 144 -8.663 8.204 2.541 1.00 0.00 H new ATOM 0 HA MET A 144 -7.725 8.890 -0.195 1.00 0.00 H new ATOM 0 HB2 MET A 144 -10.474 8.632 1.099 1.00 0.00 H new ATOM 0 HB3 MET A 144 -10.241 9.209 -0.539 1.00 0.00 H new ATOM 0 HG2 MET A 144 -8.888 7.059 -0.992 1.00 0.00 H new ATOM 0 HG3 MET A 144 -9.418 6.481 0.576 1.00 0.00 H new ATOM 0 HE1 MET A 144 -11.541 4.452 -2.006 1.00 0.00 H new ATOM 0 HE2 MET A 144 -9.898 5.089 -2.253 1.00 0.00 H new ATOM 0 HE3 MET A 144 -10.357 4.399 -0.678 1.00 0.00 H new ATOM 2264 N GLY A 145 -9.350 11.062 1.676 1.00 0.00 N ATOM 2265 CA GLY A 145 -9.469 12.526 1.936 1.00 0.00 C ATOM 2266 C GLY A 145 -10.135 13.192 0.731 1.00 0.00 C ATOM 2267 O GLY A 145 -10.817 14.190 0.850 1.00 0.00 O ATOM 0 H GLY A 145 -10.006 10.478 2.195 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -10.057 12.702 2.837 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -8.484 12.959 2.109 1.00 0.00 H new ATOM 2271 N SER A 146 -9.920 12.643 -0.430 1.00 0.00 N ATOM 2272 CA SER A 146 -10.499 13.218 -1.674 1.00 0.00 C ATOM 2273 C SER A 146 -10.878 12.078 -2.622 1.00 0.00 C ATOM 2274 O SER A 146 -10.685 10.920 -2.314 1.00 0.00 O ATOM 2275 CB SER A 146 -9.459 14.120 -2.341 1.00 0.00 C ATOM 2276 OG SER A 146 -8.193 13.474 -2.310 1.00 0.00 O ATOM 0 H SER A 146 -9.357 11.804 -0.572 1.00 0.00 H new ATOM 0 HA SER A 146 -11.387 13.804 -1.437 1.00 0.00 H new ATOM 0 HB2 SER A 146 -9.749 14.330 -3.371 1.00 0.00 H new ATOM 0 HB3 SER A 146 -9.405 15.078 -1.823 1.00 0.00 H new ATOM 0 HG SER A 146 -7.523 14.047 -2.738 1.00 0.00 H new ATOM 2282 N GLU A 147 -11.413 12.397 -3.774 1.00 0.00 N ATOM 2283 CA GLU A 147 -11.794 11.328 -4.747 1.00 0.00 C ATOM 2284 C GLU A 147 -10.852 11.327 -5.981 1.00 0.00 C ATOM 2285 O GLU A 147 -11.311 11.339 -7.106 1.00 0.00 O ATOM 2286 CB GLU A 147 -13.240 11.578 -5.203 1.00 0.00 C ATOM 2287 CG GLU A 147 -13.528 13.084 -5.180 1.00 0.00 C ATOM 2288 CD GLU A 147 -14.066 13.482 -3.804 1.00 0.00 C ATOM 2289 OE1 GLU A 147 -13.564 12.962 -2.820 1.00 0.00 O ATOM 2290 OE2 GLU A 147 -14.968 14.302 -3.756 1.00 0.00 O ATOM 0 H GLU A 147 -11.602 13.351 -4.082 1.00 0.00 H new ATOM 0 HA GLU A 147 -11.706 10.357 -4.259 1.00 0.00 H new ATOM 0 HB2 GLU A 147 -13.389 11.183 -6.208 1.00 0.00 H new ATOM 0 HB3 GLU A 147 -13.935 11.053 -4.548 1.00 0.00 H new ATOM 0 HG2 GLU A 147 -12.618 13.642 -5.401 1.00 0.00 H new ATOM 0 HG3 GLU A 147 -14.254 13.338 -5.953 1.00 0.00 H new ATOM 2297 N PRO A 148 -9.544 11.294 -5.791 1.00 0.00 N ATOM 2298 CA PRO A 148 -8.569 11.264 -6.922 1.00 0.00 C ATOM 2299 C PRO A 148 -8.428 9.870 -7.531 1.00 0.00 C ATOM 2300 O PRO A 148 -8.820 8.879 -6.948 1.00 0.00 O ATOM 2301 CB PRO A 148 -7.253 11.669 -6.269 1.00 0.00 C ATOM 2302 CG PRO A 148 -7.363 11.160 -4.877 1.00 0.00 C ATOM 2303 CD PRO A 148 -8.837 11.295 -4.500 1.00 0.00 C ATOM 0 HA PRO A 148 -8.883 11.914 -7.739 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -6.400 11.230 -6.787 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -7.116 12.750 -6.288 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -7.037 10.122 -4.813 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -6.732 11.735 -4.199 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -9.163 10.469 -3.867 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -9.023 12.215 -3.945 1.00 0.00 H new ATOM 2311 N ASN A 149 -7.849 9.785 -8.691 1.00 0.00 N ATOM 2312 CA ASN A 149 -7.657 8.466 -9.333 1.00 0.00 C ATOM 2313 C ASN A 149 -6.331 7.866 -8.853 1.00 0.00 C ATOM 2314 O ASN A 149 -5.305 8.518 -8.850 1.00 0.00 O ATOM 2315 CB ASN A 149 -7.638 8.649 -10.850 1.00 0.00 C ATOM 2316 CG ASN A 149 -6.730 7.597 -11.481 1.00 0.00 C ATOM 2317 OD1 ASN A 149 -7.045 6.424 -11.481 1.00 0.00 O ATOM 2318 ND2 ASN A 149 -5.604 7.973 -12.020 1.00 0.00 N ATOM 0 H ASN A 149 -7.498 10.581 -9.224 1.00 0.00 H new ATOM 0 HA ASN A 149 -8.471 7.792 -9.066 1.00 0.00 H new ATOM 0 HB2 ASN A 149 -8.648 8.559 -11.250 1.00 0.00 H new ATOM 0 HB3 ASN A 149 -7.283 9.648 -11.102 1.00 0.00 H new ATOM 0 HD21 ASN A 149 -4.985 7.281 -12.443 1.00 0.00 H new ATOM 0 HD22 ASN A 149 -5.342 8.959 -12.019 1.00 0.00 H new ATOM 2325 N PHE A 150 -6.348 6.626 -8.447 1.00 0.00 N ATOM 2326 CA PHE A 150 -5.093 5.973 -7.959 1.00 0.00 C ATOM 2327 C PHE A 150 -5.095 4.501 -8.374 1.00 0.00 C ATOM 2328 O PHE A 150 -6.047 3.780 -8.158 1.00 0.00 O ATOM 2329 CB PHE A 150 -5.007 6.091 -6.419 1.00 0.00 C ATOM 2330 CG PHE A 150 -5.768 4.956 -5.746 1.00 0.00 C ATOM 2331 CD1 PHE A 150 -7.115 4.709 -6.073 1.00 0.00 C ATOM 2332 CD2 PHE A 150 -5.121 4.137 -4.798 1.00 0.00 C ATOM 2333 CE1 PHE A 150 -7.806 3.653 -5.459 1.00 0.00 C ATOM 2334 CE2 PHE A 150 -5.818 3.083 -4.196 1.00 0.00 C ATOM 2335 CZ PHE A 150 -7.157 2.843 -4.526 1.00 0.00 C ATOM 0 H PHE A 150 -7.178 6.033 -8.431 1.00 0.00 H new ATOM 0 HA PHE A 150 -4.228 6.469 -8.398 1.00 0.00 H new ATOM 0 HB2 PHE A 150 -3.963 6.071 -6.106 1.00 0.00 H new ATOM 0 HB3 PHE A 150 -5.417 7.049 -6.100 1.00 0.00 H new ATOM 0 HD1 PHE A 150 -7.617 5.333 -6.797 1.00 0.00 H new ATOM 0 HD2 PHE A 150 -4.090 4.323 -4.537 1.00 0.00 H new ATOM 0 HE1 PHE A 150 -8.840 3.467 -5.709 1.00 0.00 H new ATOM 0 HE2 PHE A 150 -5.321 2.452 -3.474 1.00 0.00 H new ATOM 0 HZ PHE A 150 -7.689 2.029 -4.057 1.00 0.00 H new ATOM 2345 N THR A 151 -4.029 4.054 -8.983 1.00 0.00 N ATOM 2346 CA THR A 151 -3.961 2.637 -9.425 1.00 0.00 C ATOM 2347 C THR A 151 -3.200 1.830 -8.379 1.00 0.00 C ATOM 2348 O THR A 151 -2.106 2.181 -7.983 1.00 0.00 O ATOM 2349 CB THR A 151 -3.219 2.554 -10.764 1.00 0.00 C ATOM 2350 OG1 THR A 151 -3.824 3.443 -11.694 1.00 0.00 O ATOM 2351 CG2 THR A 151 -3.277 1.124 -11.312 1.00 0.00 C ATOM 0 H THR A 151 -3.202 4.613 -9.192 1.00 0.00 H new ATOM 0 HA THR A 151 -4.969 2.239 -9.543 1.00 0.00 H new ATOM 0 HB THR A 151 -2.176 2.833 -10.612 1.00 0.00 H new ATOM 0 HG1 THR A 151 -3.519 4.358 -11.518 1.00 0.00 H new ATOM 0 HG21 THR A 151 -2.747 1.077 -12.263 1.00 0.00 H new ATOM 0 HG22 THR A 151 -2.809 0.443 -10.602 1.00 0.00 H new ATOM 0 HG23 THR A 151 -4.317 0.834 -11.462 1.00 0.00 H new ATOM 2359 N ALA A 152 -3.769 0.750 -7.936 1.00 0.00 N ATOM 2360 CA ALA A 152 -3.087 -0.093 -6.922 1.00 0.00 C ATOM 2361 C ALA A 152 -3.187 -1.551 -7.344 1.00 0.00 C ATOM 2362 O ALA A 152 -4.080 -1.934 -8.057 1.00 0.00 O ATOM 2363 CB ALA A 152 -3.723 0.102 -5.550 1.00 0.00 C ATOM 0 H ALA A 152 -4.684 0.412 -8.235 1.00 0.00 H new ATOM 0 HA ALA A 152 -2.039 0.199 -6.855 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -3.211 -0.524 -4.819 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -3.639 1.148 -5.255 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -4.775 -0.179 -5.594 1.00 0.00 H new ATOM 2369 N ILE A 153 -2.280 -2.361 -6.891 1.00 0.00 N ATOM 2370 CA ILE A 153 -2.319 -3.806 -7.244 1.00 0.00 C ATOM 2371 C ILE A 153 -2.430 -4.607 -5.958 1.00 0.00 C ATOM 2372 O ILE A 153 -1.668 -4.408 -5.052 1.00 0.00 O ATOM 2373 CB ILE A 153 -1.034 -4.193 -7.966 1.00 0.00 C ATOM 2374 CG1 ILE A 153 -0.889 -3.360 -9.245 1.00 0.00 C ATOM 2375 CG2 ILE A 153 -1.064 -5.684 -8.310 1.00 0.00 C ATOM 2376 CD1 ILE A 153 0.398 -3.741 -9.976 1.00 0.00 C ATOM 0 H ILE A 153 -1.506 -2.085 -6.287 1.00 0.00 H new ATOM 0 HA ILE A 153 -3.169 -4.009 -7.895 1.00 0.00 H new ATOM 0 HB ILE A 153 -0.181 -3.997 -7.316 1.00 0.00 H new ATOM 0 HG12 ILE A 153 -1.748 -3.525 -9.895 1.00 0.00 H new ATOM 0 HG13 ILE A 153 -0.875 -2.299 -8.998 1.00 0.00 H new ATOM 0 HG21 ILE A 153 -0.144 -5.957 -8.826 1.00 0.00 H new ATOM 0 HG22 ILE A 153 -1.153 -6.267 -7.393 1.00 0.00 H new ATOM 0 HG23 ILE A 153 -1.917 -5.891 -8.956 1.00 0.00 H new ATOM 0 HD11 ILE A 153 0.492 -3.144 -10.883 1.00 0.00 H new ATOM 0 HD12 ILE A 153 1.254 -3.553 -9.328 1.00 0.00 H new ATOM 0 HD13 ILE A 153 0.368 -4.798 -10.239 1.00 0.00 H new ATOM 2388 N ARG A 154 -3.390 -5.481 -5.851 1.00 0.00 N ATOM 2389 CA ARG A 154 -3.537 -6.262 -4.588 1.00 0.00 C ATOM 2390 C ARG A 154 -3.141 -7.720 -4.828 1.00 0.00 C ATOM 2391 O ARG A 154 -3.694 -8.396 -5.672 1.00 0.00 O ATOM 2392 CB ARG A 154 -4.988 -6.173 -4.117 1.00 0.00 C ATOM 2393 CG ARG A 154 -5.135 -6.882 -2.767 1.00 0.00 C ATOM 2394 CD ARG A 154 -5.932 -6.000 -1.802 1.00 0.00 C ATOM 2395 NE ARG A 154 -7.351 -5.912 -2.250 1.00 0.00 N ATOM 2396 CZ ARG A 154 -8.137 -4.999 -1.746 1.00 0.00 C ATOM 2397 NH1 ARG A 154 -7.676 -4.159 -0.860 1.00 0.00 N ATOM 2398 NH2 ARG A 154 -9.383 -4.926 -2.127 1.00 0.00 N ATOM 0 H ARG A 154 -4.076 -5.689 -6.577 1.00 0.00 H new ATOM 0 HA ARG A 154 -2.882 -5.851 -3.819 1.00 0.00 H new ATOM 0 HB2 ARG A 154 -5.288 -5.129 -4.025 1.00 0.00 H new ATOM 0 HB3 ARG A 154 -5.649 -6.631 -4.853 1.00 0.00 H new ATOM 0 HG2 ARG A 154 -5.640 -7.839 -2.901 1.00 0.00 H new ATOM 0 HG3 ARG A 154 -4.151 -7.097 -2.350 1.00 0.00 H new ATOM 0 HD2 ARG A 154 -5.885 -6.413 -0.794 1.00 0.00 H new ATOM 0 HD3 ARG A 154 -5.493 -5.003 -1.759 1.00 0.00 H new ATOM 0 HE ARG A 154 -7.707 -6.564 -2.949 1.00 0.00 H new ATOM 0 HH11 ARG A 154 -6.702 -4.216 -0.562 1.00 0.00 H new ATOM 0 HH12 ARG A 154 -8.289 -3.446 -0.466 1.00 0.00 H new ATOM 0 HH21 ARG A 154 -9.744 -5.583 -2.819 1.00 0.00 H new ATOM 0 HH22 ARG A 154 -9.996 -4.212 -1.733 1.00 0.00 H new ATOM 2412 N ILE A 155 -2.172 -8.202 -4.092 1.00 0.00 N ATOM 2413 CA ILE A 155 -1.717 -9.612 -4.272 1.00 0.00 C ATOM 2414 C ILE A 155 -1.816 -10.348 -2.936 1.00 0.00 C ATOM 2415 O ILE A 155 -1.242 -9.933 -1.949 1.00 0.00 O ATOM 2416 CB ILE A 155 -0.263 -9.612 -4.742 1.00 0.00 C ATOM 2417 CG1 ILE A 155 -0.087 -8.589 -5.866 1.00 0.00 C ATOM 2418 CG2 ILE A 155 0.092 -11.001 -5.272 1.00 0.00 C ATOM 2419 CD1 ILE A 155 1.389 -8.512 -6.246 1.00 0.00 C ATOM 0 H ILE A 155 -1.675 -7.677 -3.372 1.00 0.00 H new ATOM 0 HA ILE A 155 -2.343 -10.111 -5.012 1.00 0.00 H new ATOM 0 HB ILE A 155 0.389 -9.353 -3.907 1.00 0.00 H new ATOM 0 HG12 ILE A 155 -0.684 -8.876 -6.732 1.00 0.00 H new ATOM 0 HG13 ILE A 155 -0.444 -7.611 -5.543 1.00 0.00 H new ATOM 0 HG21 ILE A 155 1.129 -11.008 -5.609 1.00 0.00 H new ATOM 0 HG22 ILE A 155 -0.036 -11.737 -4.478 1.00 0.00 H new ATOM 0 HG23 ILE A 155 -0.563 -11.250 -6.107 1.00 0.00 H new ATOM 0 HD11 ILE A 155 1.521 -7.784 -7.047 1.00 0.00 H new ATOM 0 HD12 ILE A 155 1.973 -8.206 -5.378 1.00 0.00 H new ATOM 0 HD13 ILE A 155 1.729 -9.491 -6.585 1.00 0.00 H new ATOM 2431 N PHE A 156 -2.527 -11.444 -2.901 1.00 0.00 N ATOM 2432 CA PHE A 156 -2.663 -12.216 -1.630 1.00 0.00 C ATOM 2433 C PHE A 156 -3.510 -13.464 -1.884 1.00 0.00 C ATOM 2434 O PHE A 156 -3.847 -13.781 -3.007 1.00 0.00 O ATOM 2435 CB PHE A 156 -3.356 -11.354 -0.567 1.00 0.00 C ATOM 2436 CG PHE A 156 -4.826 -11.237 -0.891 1.00 0.00 C ATOM 2437 CD1 PHE A 156 -5.246 -10.461 -1.979 1.00 0.00 C ATOM 2438 CD2 PHE A 156 -5.770 -11.908 -0.104 1.00 0.00 C ATOM 2439 CE1 PHE A 156 -6.610 -10.355 -2.278 1.00 0.00 C ATOM 2440 CE2 PHE A 156 -7.133 -11.802 -0.402 1.00 0.00 C ATOM 2441 CZ PHE A 156 -7.554 -11.026 -1.489 1.00 0.00 C ATOM 0 H PHE A 156 -3.021 -11.839 -3.701 1.00 0.00 H new ATOM 0 HA PHE A 156 -1.671 -12.501 -1.278 1.00 0.00 H new ATOM 0 HB2 PHE A 156 -3.225 -11.799 0.419 1.00 0.00 H new ATOM 0 HB3 PHE A 156 -2.901 -10.364 -0.533 1.00 0.00 H new ATOM 0 HD1 PHE A 156 -4.518 -9.945 -2.587 1.00 0.00 H new ATOM 0 HD2 PHE A 156 -5.446 -12.508 0.734 1.00 0.00 H new ATOM 0 HE1 PHE A 156 -6.934 -9.756 -3.116 1.00 0.00 H new ATOM 0 HE2 PHE A 156 -7.860 -12.319 0.206 1.00 0.00 H new ATOM 0 HZ PHE A 156 -8.606 -10.945 -1.719 1.00 0.00 H new TER 2451 PHE A 156 HETATM 2452 FE FE2 A 180 -6.582 -5.982 2.690 1.00 0.00 FE HETATM 2453 O HOH A 181 -7.331 -7.029 1.159 1.00 0.00 O HETATM 2456 O HOH A 182 -6.902 -4.276 1.703 1.00 0.00 O