USER MOD reduce.3.24.130724 H: found=0, std=0, add=924, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 924 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 44 TYR OH : rot 130:sc= -0.872 USER MOD Set 1.2: A 89 THR OG1 : rot 180:sc= 0.0357 USER MOD Set 2.1: A 8 LYS NZ :NH3+ -157:sc= 0 (180deg=0) USER MOD Set 2.2: A 47 TYR OH : rot 171:sc= 1.73 USER MOD Set 2.3: A 108 LYS NZ :NH3+ 151:sc= 1.11 (180deg=0) USER MOD Set 3.1: A 9 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 35 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 0 GLY N :NH3+ -172:sc=-0.00782 (180deg=0) USER MOD Set 4.2: A 4 MET CE :methyl -147:sc= -0.0425 (180deg=-0.0325) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= 0.0237 K(o=0.024,f=-0.91) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc= -2.9! C(o=-2.9!,f=-3.2!) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 MET CE :methyl -154:sc= -2 (180deg=-2.8!) USER MOD Single : A 30 SER OG : rot 180:sc= -2.87! USER MOD Single : A 34 ASN : amide:sc= -6.7! C(o=-6.7!,f=-13!) USER MOD Single : A 38 MET CE :methyl -136:sc= -4.61! (180deg=-12!) USER MOD Single : A 42 SER OG : rot 91:sc= 1.12 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot -39:sc= -3.02 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.297 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 86:sc= 0.0381 USER MOD Single : A 67 SER OG : rot 47:sc= -1.25 USER MOD Single : A 68 HIS : no HE2:sc= -4.81! C(o=-4.8!,f=-8.4!) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.18) USER MOD Single : A 72 THR OG1 : rot -130:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot -87:sc= 0.455 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 7:sc= 0.668 USER MOD Single : A 92 LYS NZ :NH3+ -148:sc= -0.304 (180deg=-0.96) USER MOD Single : A 94 SER OG : rot 180:sc= 0.0411 USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 LYS NZ :NH3+ 159:sc= 0 (180deg=-0.229) USER MOD Single : A 107 TYR OH : rot 110:sc=-0.00717 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 0 29.924 -2.457 9.505 1.00 0.00 N ATOM 2 CA GLY A 0 29.098 -1.670 10.462 1.00 0.00 C ATOM 3 C GLY A 0 29.905 -1.153 11.636 1.00 0.00 C ATOM 4 O GLY A 0 29.855 -1.719 12.729 1.00 0.00 O ATOM 0 H1 GLY A 0 29.362 -2.672 8.657 1.00 0.00 H new ATOM 0 H2 GLY A 0 30.762 -1.904 9.234 1.00 0.00 H new ATOM 0 H3 GLY A 0 30.225 -3.345 9.955 1.00 0.00 H new ATOM 0 HA2 GLY A 0 28.644 -0.829 9.939 1.00 0.00 H new ATOM 0 HA3 GLY A 0 28.283 -2.293 10.831 1.00 0.00 H new ATOM 10 N SER A 1 30.651 -0.076 11.412 1.00 0.00 N ATOM 11 CA SER A 1 31.473 0.517 12.461 1.00 0.00 C ATOM 12 C SER A 1 30.978 1.918 12.808 1.00 0.00 C ATOM 13 O SER A 1 30.957 2.308 13.976 1.00 0.00 O ATOM 14 CB SER A 1 32.936 0.575 12.020 1.00 0.00 C ATOM 15 OG SER A 1 33.041 0.654 10.609 1.00 0.00 O ATOM 0 H SER A 1 30.703 0.404 10.513 1.00 0.00 H new ATOM 0 HA SER A 1 31.395 -0.109 13.350 1.00 0.00 H new ATOM 0 HB2 SER A 1 33.421 1.440 12.473 1.00 0.00 H new ATOM 0 HB3 SER A 1 33.462 -0.310 12.378 1.00 0.00 H new ATOM 0 HG SER A 1 33.986 0.692 10.353 1.00 0.00 H new ATOM 21 N MET A 2 30.581 2.668 11.787 1.00 0.00 N ATOM 22 CA MET A 2 30.084 4.026 11.984 1.00 0.00 C ATOM 23 C MET A 2 28.564 4.073 11.848 1.00 0.00 C ATOM 24 O MET A 2 27.999 5.088 11.442 1.00 0.00 O ATOM 25 CB MET A 2 30.730 4.977 10.974 1.00 0.00 C ATOM 26 CG MET A 2 31.950 5.704 11.519 1.00 0.00 C ATOM 27 SD MET A 2 31.584 7.397 12.020 1.00 0.00 S ATOM 28 CE MET A 2 32.397 7.461 13.615 1.00 0.00 C ATOM 0 H MET A 2 30.593 2.360 10.815 1.00 0.00 H new ATOM 0 HA MET A 2 30.350 4.343 12.992 1.00 0.00 H new ATOM 0 HB2 MET A 2 31.020 4.411 10.088 1.00 0.00 H new ATOM 0 HB3 MET A 2 29.991 5.712 10.655 1.00 0.00 H new ATOM 0 HG2 MET A 2 32.344 5.154 12.373 1.00 0.00 H new ATOM 0 HG3 MET A 2 32.731 5.715 10.759 1.00 0.00 H new ATOM 0 HE1 MET A 2 32.260 8.449 14.054 1.00 0.00 H new ATOM 0 HE2 MET A 2 31.965 6.708 14.274 1.00 0.00 H new ATOM 0 HE3 MET A 2 33.462 7.264 13.489 1.00 0.00 H new ATOM 38 N MET A 3 27.910 2.967 12.190 1.00 0.00 N ATOM 39 CA MET A 3 26.456 2.882 12.107 1.00 0.00 C ATOM 40 C MET A 3 25.974 3.155 10.686 1.00 0.00 C ATOM 41 O MET A 3 25.694 4.298 10.325 1.00 0.00 O ATOM 42 CB MET A 3 25.809 3.872 13.078 1.00 0.00 C ATOM 43 CG MET A 3 26.320 3.747 14.503 1.00 0.00 C ATOM 44 SD MET A 3 26.125 5.271 15.448 1.00 0.00 S ATOM 45 CE MET A 3 27.637 6.130 15.021 1.00 0.00 C ATOM 0 H MET A 3 28.364 2.118 12.527 1.00 0.00 H new ATOM 0 HA MET A 3 26.161 1.869 12.382 1.00 0.00 H new ATOM 0 HB2 MET A 3 25.990 4.887 12.724 1.00 0.00 H new ATOM 0 HB3 MET A 3 24.730 3.720 13.073 1.00 0.00 H new ATOM 0 HG2 MET A 3 25.786 2.941 15.007 1.00 0.00 H new ATOM 0 HG3 MET A 3 27.374 3.468 14.484 1.00 0.00 H new ATOM 0 HE1 MET A 3 27.664 7.094 15.530 1.00 0.00 H new ATOM 0 HE2 MET A 3 28.495 5.532 15.330 1.00 0.00 H new ATOM 0 HE3 MET A 3 27.674 6.288 13.943 1.00 0.00 H new ATOM 55 N MET A 4 25.881 2.100 9.884 1.00 0.00 N ATOM 56 CA MET A 4 25.434 2.226 8.502 1.00 0.00 C ATOM 57 C MET A 4 24.027 1.663 8.332 1.00 0.00 C ATOM 58 O MET A 4 23.253 2.140 7.502 1.00 0.00 O ATOM 59 CB MET A 4 26.402 1.504 7.563 1.00 0.00 C ATOM 60 CG MET A 4 27.859 1.874 7.791 1.00 0.00 C ATOM 61 SD MET A 4 28.949 1.225 6.509 1.00 0.00 S ATOM 62 CE MET A 4 30.303 0.600 7.500 1.00 0.00 C ATOM 0 H MET A 4 26.109 1.147 10.168 1.00 0.00 H new ATOM 0 HA MET A 4 25.415 3.286 8.248 1.00 0.00 H new ATOM 0 HB2 MET A 4 26.285 0.428 7.691 1.00 0.00 H new ATOM 0 HB3 MET A 4 26.134 1.734 6.532 1.00 0.00 H new ATOM 0 HG2 MET A 4 27.953 2.959 7.827 1.00 0.00 H new ATOM 0 HG3 MET A 4 28.179 1.494 8.761 1.00 0.00 H new ATOM 0 HE1 MET A 4 31.238 0.712 6.951 1.00 0.00 H new ATOM 0 HE2 MET A 4 30.360 1.161 8.433 1.00 0.00 H new ATOM 0 HE3 MET A 4 30.136 -0.454 7.721 1.00 0.00 H new ATOM 72 N ALA A 5 23.704 0.645 9.121 1.00 0.00 N ATOM 73 CA ALA A 5 22.390 0.016 9.059 1.00 0.00 C ATOM 74 C ALA A 5 21.879 -0.329 10.453 1.00 0.00 C ATOM 75 O ALA A 5 22.611 -0.879 11.275 1.00 0.00 O ATOM 76 CB ALA A 5 22.444 -1.233 8.191 1.00 0.00 C ATOM 0 H ALA A 5 24.334 0.237 9.812 1.00 0.00 H new ATOM 0 HA ALA A 5 21.695 0.727 8.612 1.00 0.00 H new ATOM 0 HB1 ALA A 5 21.456 -1.693 8.153 1.00 0.00 H new ATOM 0 HB2 ALA A 5 22.757 -0.962 7.183 1.00 0.00 H new ATOM 0 HB3 ALA A 5 23.157 -1.940 8.615 1.00 0.00 H new ATOM 82 N LEU A 6 20.617 0.000 10.713 1.00 0.00 N ATOM 83 CA LEU A 6 20.007 -0.276 12.009 1.00 0.00 C ATOM 84 C LEU A 6 18.541 -0.660 11.851 1.00 0.00 C ATOM 85 O LEU A 6 18.076 -1.638 12.435 1.00 0.00 O ATOM 86 CB LEU A 6 20.131 0.943 12.925 1.00 0.00 C ATOM 87 CG LEU A 6 21.563 1.418 13.182 1.00 0.00 C ATOM 88 CD1 LEU A 6 21.559 2.758 13.903 1.00 0.00 C ATOM 89 CD2 LEU A 6 22.333 0.378 13.985 1.00 0.00 C ATOM 0 H LEU A 6 19.998 0.458 10.044 1.00 0.00 H new ATOM 0 HA LEU A 6 20.537 -1.116 12.459 1.00 0.00 H new ATOM 0 HB2 LEU A 6 19.565 1.766 12.488 1.00 0.00 H new ATOM 0 HB3 LEU A 6 19.665 0.708 13.882 1.00 0.00 H new ATOM 0 HG LEU A 6 22.062 1.548 12.222 1.00 0.00 H new ATOM 0 HD11 LEU A 6 22.586 3.080 14.077 1.00 0.00 H new ATOM 0 HD12 LEU A 6 21.045 3.499 13.291 1.00 0.00 H new ATOM 0 HD13 LEU A 6 21.044 2.656 14.858 1.00 0.00 H new ATOM 0 HD21 LEU A 6 23.349 0.732 14.159 1.00 0.00 H new ATOM 0 HD22 LEU A 6 21.836 0.216 14.942 1.00 0.00 H new ATOM 0 HD23 LEU A 6 22.365 -0.560 13.430 1.00 0.00 H new ATOM 101 N SER A 7 17.820 0.118 11.054 1.00 0.00 N ATOM 102 CA SER A 7 16.404 -0.135 10.812 1.00 0.00 C ATOM 103 C SER A 7 15.944 0.541 9.525 1.00 0.00 C ATOM 104 O SER A 7 16.353 1.661 9.219 1.00 0.00 O ATOM 105 CB SER A 7 15.567 0.362 11.992 1.00 0.00 C ATOM 106 OG SER A 7 14.499 -0.526 12.270 1.00 0.00 O ATOM 0 H SER A 7 18.192 0.931 10.563 1.00 0.00 H new ATOM 0 HA SER A 7 16.265 -1.211 10.705 1.00 0.00 H new ATOM 0 HB2 SER A 7 16.200 0.462 12.874 1.00 0.00 H new ATOM 0 HB3 SER A 7 15.171 1.353 11.769 1.00 0.00 H new ATOM 0 HG SER A 7 13.981 -0.187 13.029 1.00 0.00 H new ATOM 112 N LYS A 8 15.088 -0.147 8.775 1.00 0.00 N ATOM 113 CA LYS A 8 14.571 0.387 7.520 1.00 0.00 C ATOM 114 C LYS A 8 13.094 0.746 7.649 1.00 0.00 C ATOM 115 O LYS A 8 12.609 1.666 6.992 1.00 0.00 O ATOM 116 CB LYS A 8 14.764 -0.628 6.392 1.00 0.00 C ATOM 117 CG LYS A 8 16.217 -0.828 5.995 1.00 0.00 C ATOM 118 CD LYS A 8 16.765 0.384 5.260 1.00 0.00 C ATOM 119 CE LYS A 8 16.181 0.499 3.862 1.00 0.00 C ATOM 120 NZ LYS A 8 15.916 1.914 3.484 1.00 0.00 N ATOM 0 H LYS A 8 14.738 -1.075 9.015 1.00 0.00 H new ATOM 0 HA LYS A 8 15.128 1.294 7.283 1.00 0.00 H new ATOM 0 HB2 LYS A 8 14.345 -1.586 6.701 1.00 0.00 H new ATOM 0 HB3 LYS A 8 14.199 -0.300 5.519 1.00 0.00 H new ATOM 0 HG2 LYS A 8 16.816 -1.016 6.886 1.00 0.00 H new ATOM 0 HG3 LYS A 8 16.304 -1.710 5.360 1.00 0.00 H new ATOM 0 HD2 LYS A 8 16.537 1.287 5.826 1.00 0.00 H new ATOM 0 HD3 LYS A 8 17.851 0.312 5.197 1.00 0.00 H new ATOM 0 HE2 LYS A 8 16.870 0.055 3.144 1.00 0.00 H new ATOM 0 HE3 LYS A 8 15.253 -0.071 3.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 15.192 1.944 2.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 15.578 2.438 4.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 16.793 2.350 3.133 1.00 0.00 H new ATOM 134 N THR A 9 12.385 0.012 8.501 1.00 0.00 N ATOM 135 CA THR A 9 10.962 0.252 8.715 1.00 0.00 C ATOM 136 C THR A 9 10.733 0.992 10.028 1.00 0.00 C ATOM 137 O THR A 9 11.379 0.702 11.035 1.00 0.00 O ATOM 138 CB THR A 9 10.186 -1.069 8.716 1.00 0.00 C ATOM 139 OG1 THR A 9 10.196 -1.658 10.004 1.00 0.00 O ATOM 140 CG2 THR A 9 10.730 -2.093 7.742 1.00 0.00 C ATOM 0 H THR A 9 12.772 -0.753 9.054 1.00 0.00 H new ATOM 0 HA THR A 9 10.597 0.872 7.896 1.00 0.00 H new ATOM 0 HB THR A 9 9.175 -0.803 8.408 1.00 0.00 H new ATOM 0 HG1 THR A 9 9.694 -2.499 9.983 1.00 0.00 H new ATOM 0 HG21 THR A 9 10.131 -3.002 7.798 1.00 0.00 H new ATOM 0 HG22 THR A 9 10.686 -1.691 6.730 1.00 0.00 H new ATOM 0 HG23 THR A 9 11.764 -2.324 7.997 1.00 0.00 H new ATOM 148 N PHE A 10 9.819 1.956 10.010 1.00 0.00 N ATOM 149 CA PHE A 10 9.520 2.741 11.203 1.00 0.00 C ATOM 150 C PHE A 10 8.018 2.965 11.369 1.00 0.00 C ATOM 151 O PHE A 10 7.350 3.455 10.459 1.00 0.00 O ATOM 152 CB PHE A 10 10.221 4.103 11.132 1.00 0.00 C ATOM 153 CG PHE A 10 11.292 4.185 10.081 1.00 0.00 C ATOM 154 CD1 PHE A 10 12.452 3.436 10.190 1.00 0.00 C ATOM 155 CD2 PHE A 10 11.132 5.009 8.978 1.00 0.00 C ATOM 156 CE1 PHE A 10 13.433 3.507 9.219 1.00 0.00 C ATOM 157 CE2 PHE A 10 12.109 5.085 8.004 1.00 0.00 C ATOM 158 CZ PHE A 10 13.260 4.332 8.124 1.00 0.00 C ATOM 0 H PHE A 10 9.274 2.212 9.187 1.00 0.00 H new ATOM 0 HA PHE A 10 9.885 2.177 12.061 1.00 0.00 H new ATOM 0 HB2 PHE A 10 9.476 4.874 10.937 1.00 0.00 H new ATOM 0 HB3 PHE A 10 10.662 4.324 12.104 1.00 0.00 H new ATOM 0 HD1 PHE A 10 12.592 2.789 11.043 1.00 0.00 H new ATOM 0 HD2 PHE A 10 10.233 5.599 8.879 1.00 0.00 H new ATOM 0 HE1 PHE A 10 14.333 2.919 9.316 1.00 0.00 H new ATOM 0 HE2 PHE A 10 11.973 5.732 7.150 1.00 0.00 H new ATOM 0 HZ PHE A 10 14.024 4.388 7.363 1.00 0.00 H new ATOM 168 N GLY A 11 7.501 2.640 12.549 1.00 0.00 N ATOM 169 CA GLY A 11 6.091 2.855 12.819 1.00 0.00 C ATOM 170 C GLY A 11 5.225 1.613 12.692 1.00 0.00 C ATOM 171 O GLY A 11 5.710 0.515 12.419 1.00 0.00 O ATOM 0 H GLY A 11 8.030 2.233 13.320 1.00 0.00 H new ATOM 0 HA2 GLY A 11 5.985 3.254 13.828 1.00 0.00 H new ATOM 0 HA3 GLY A 11 5.715 3.615 12.134 1.00 0.00 H new ATOM 175 N GLN A 12 3.926 1.819 12.901 1.00 0.00 N ATOM 176 CA GLN A 12 2.918 0.763 12.831 1.00 0.00 C ATOM 177 C GLN A 12 2.709 0.268 11.404 1.00 0.00 C ATOM 178 O GLN A 12 3.033 0.960 10.440 1.00 0.00 O ATOM 179 CB GLN A 12 1.591 1.258 13.414 1.00 0.00 C ATOM 180 CG GLN A 12 0.897 2.305 12.556 1.00 0.00 C ATOM 181 CD GLN A 12 0.944 3.689 13.173 1.00 0.00 C ATOM 182 OE1 GLN A 12 1.937 4.406 13.045 1.00 0.00 O ATOM 183 NE2 GLN A 12 -0.135 4.074 13.847 1.00 0.00 N ATOM 0 H GLN A 12 3.539 2.735 13.127 1.00 0.00 H new ATOM 0 HA GLN A 12 3.283 -0.077 13.422 1.00 0.00 H new ATOM 0 HB2 GLN A 12 0.922 0.407 13.545 1.00 0.00 H new ATOM 0 HB3 GLN A 12 1.773 1.676 14.404 1.00 0.00 H new ATOM 0 HG2 GLN A 12 1.367 2.333 11.573 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -0.142 2.014 12.404 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -0.936 3.448 13.928 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -0.162 4.996 14.283 1.00 0.00 H new ATOM 192 N LYS A 13 2.170 -0.943 11.283 1.00 0.00 N ATOM 193 CA LYS A 13 1.922 -1.543 9.979 1.00 0.00 C ATOM 194 C LYS A 13 0.820 -0.774 9.253 1.00 0.00 C ATOM 195 O LYS A 13 -0.133 -0.304 9.874 1.00 0.00 O ATOM 196 CB LYS A 13 1.516 -3.016 10.159 1.00 0.00 C ATOM 197 CG LYS A 13 0.882 -3.660 8.927 1.00 0.00 C ATOM 198 CD LYS A 13 1.791 -4.717 8.321 1.00 0.00 C ATOM 199 CE LYS A 13 2.126 -5.810 9.324 1.00 0.00 C ATOM 200 NZ LYS A 13 2.542 -7.072 8.653 1.00 0.00 N ATOM 0 H LYS A 13 1.897 -1.526 12.074 1.00 0.00 H new ATOM 0 HA LYS A 13 2.831 -1.496 9.380 1.00 0.00 H new ATOM 0 HB2 LYS A 13 2.399 -3.590 10.438 1.00 0.00 H new ATOM 0 HB3 LYS A 13 0.814 -3.086 10.990 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -0.071 -4.112 9.201 1.00 0.00 H new ATOM 0 HG3 LYS A 13 0.668 -2.892 8.183 1.00 0.00 H new ATOM 0 HD2 LYS A 13 1.307 -5.158 7.450 1.00 0.00 H new ATOM 0 HD3 LYS A 13 2.711 -4.249 7.971 1.00 0.00 H new ATOM 0 HE2 LYS A 13 2.926 -5.467 9.980 1.00 0.00 H new ATOM 0 HE3 LYS A 13 1.258 -6.003 9.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 2.761 -7.791 9.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 1.770 -7.413 8.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 3.386 -6.894 8.072 1.00 0.00 H new ATOM 214 N PRO A 14 0.948 -0.622 7.922 1.00 0.00 N ATOM 215 CA PRO A 14 -0.028 0.112 7.113 1.00 0.00 C ATOM 216 C PRO A 14 -1.396 -0.551 7.118 1.00 0.00 C ATOM 217 O PRO A 14 -1.521 -1.740 7.413 1.00 0.00 O ATOM 218 CB PRO A 14 0.571 0.089 5.699 1.00 0.00 C ATOM 219 CG PRO A 14 2.009 -0.252 5.891 1.00 0.00 C ATOM 220 CD PRO A 14 2.055 -1.139 7.099 1.00 0.00 C ATOM 0 HA PRO A 14 -0.193 1.118 7.499 1.00 0.00 H new ATOM 0 HB2 PRO A 14 0.071 -0.649 5.071 1.00 0.00 H new ATOM 0 HB3 PRO A 14 0.457 1.055 5.207 1.00 0.00 H new ATOM 0 HG2 PRO A 14 2.411 -0.761 5.015 1.00 0.00 H new ATOM 0 HG3 PRO A 14 2.608 0.646 6.041 1.00 0.00 H new ATOM 0 HD2 PRO A 14 1.910 -2.187 6.838 1.00 0.00 H new ATOM 0 HD3 PRO A 14 3.012 -1.069 7.617 1.00 0.00 H new ATOM 228 N VAL A 15 -2.420 0.222 6.782 1.00 0.00 N ATOM 229 CA VAL A 15 -3.775 -0.299 6.743 1.00 0.00 C ATOM 230 C VAL A 15 -3.956 -1.216 5.539 1.00 0.00 C ATOM 231 O VAL A 15 -3.845 -0.782 4.383 1.00 0.00 O ATOM 232 CB VAL A 15 -4.820 0.831 6.704 1.00 0.00 C ATOM 233 CG1 VAL A 15 -4.617 1.784 7.874 1.00 0.00 C ATOM 234 CG2 VAL A 15 -4.762 1.578 5.381 1.00 0.00 C ATOM 0 H VAL A 15 -2.336 1.208 6.534 1.00 0.00 H new ATOM 0 HA VAL A 15 -3.932 -0.869 7.658 1.00 0.00 H new ATOM 0 HB VAL A 15 -5.810 0.385 6.793 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.364 2.577 7.831 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -4.721 1.237 8.811 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -3.620 2.221 7.818 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.510 2.371 5.378 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -3.771 2.013 5.252 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -4.964 0.886 4.563 1.00 0.00 H new ATOM 244 N LYS A 16 -4.220 -2.487 5.822 1.00 0.00 N ATOM 245 CA LYS A 16 -4.410 -3.483 4.778 1.00 0.00 C ATOM 246 C LYS A 16 -5.879 -3.866 4.668 1.00 0.00 C ATOM 247 O LYS A 16 -6.658 -3.658 5.599 1.00 0.00 O ATOM 248 CB LYS A 16 -3.564 -4.725 5.065 1.00 0.00 C ATOM 249 CG LYS A 16 -3.848 -5.363 6.415 1.00 0.00 C ATOM 250 CD LYS A 16 -3.729 -6.878 6.347 1.00 0.00 C ATOM 251 CE LYS A 16 -2.664 -7.399 7.297 1.00 0.00 C ATOM 252 NZ LYS A 16 -2.972 -8.775 7.776 1.00 0.00 N ATOM 0 H LYS A 16 -4.307 -2.851 6.771 1.00 0.00 H new ATOM 0 HA LYS A 16 -4.089 -3.051 3.830 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -3.740 -5.462 4.281 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.509 -4.454 5.017 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -3.151 -4.974 7.157 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -4.850 -5.089 6.745 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -4.690 -7.330 6.593 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -3.487 -7.179 5.328 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -1.697 -7.398 6.794 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -2.580 -6.728 8.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -2.222 -9.094 8.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -3.883 -8.772 8.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -3.027 -9.421 6.963 1.00 0.00 H new ATOM 266 N PHE A 17 -6.256 -4.425 3.525 1.00 0.00 N ATOM 267 CA PHE A 17 -7.636 -4.832 3.301 1.00 0.00 C ATOM 268 C PHE A 17 -7.727 -5.859 2.180 1.00 0.00 C ATOM 269 O PHE A 17 -6.772 -6.063 1.432 1.00 0.00 O ATOM 270 CB PHE A 17 -8.494 -3.614 2.958 1.00 0.00 C ATOM 271 CG PHE A 17 -7.900 -2.746 1.885 1.00 0.00 C ATOM 272 CD1 PHE A 17 -8.048 -3.074 0.547 1.00 0.00 C ATOM 273 CD2 PHE A 17 -7.195 -1.599 2.216 1.00 0.00 C ATOM 274 CE1 PHE A 17 -7.508 -2.275 -0.442 1.00 0.00 C ATOM 275 CE2 PHE A 17 -6.652 -0.796 1.233 1.00 0.00 C ATOM 276 CZ PHE A 17 -6.807 -1.133 -0.097 1.00 0.00 C ATOM 0 H PHE A 17 -5.628 -4.606 2.742 1.00 0.00 H new ATOM 0 HA PHE A 17 -8.008 -5.289 4.218 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -9.479 -3.952 2.637 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -8.640 -3.017 3.858 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -8.593 -3.966 0.274 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -7.069 -1.331 3.255 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -7.633 -2.541 -1.481 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -6.106 0.096 1.504 1.00 0.00 H new ATOM 0 HZ PHE A 17 -6.382 -0.506 -0.867 1.00 0.00 H new ATOM 286 N GLN A 18 -8.885 -6.498 2.063 1.00 0.00 N ATOM 287 CA GLN A 18 -9.103 -7.498 1.028 1.00 0.00 C ATOM 288 C GLN A 18 -9.941 -6.918 -0.106 1.00 0.00 C ATOM 289 O GLN A 18 -11.012 -6.356 0.126 1.00 0.00 O ATOM 290 CB GLN A 18 -9.798 -8.729 1.613 1.00 0.00 C ATOM 291 CG GLN A 18 -9.320 -10.038 1.013 1.00 0.00 C ATOM 292 CD GLN A 18 -10.463 -10.936 0.592 1.00 0.00 C ATOM 293 OE1 GLN A 18 -11.446 -10.478 0.010 1.00 0.00 O ATOM 294 NE2 GLN A 18 -10.341 -12.223 0.885 1.00 0.00 N ATOM 0 H GLN A 18 -9.687 -6.340 2.673 1.00 0.00 H new ATOM 0 HA GLN A 18 -8.133 -7.796 0.631 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -9.634 -8.751 2.690 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -10.873 -8.638 1.456 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -8.690 -9.829 0.149 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -8.700 -10.562 1.740 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -9.508 -12.559 1.369 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -11.080 -12.877 0.627 1.00 0.00 H new ATOM 303 N LEU A 19 -9.449 -7.055 -1.331 1.00 0.00 N ATOM 304 CA LEU A 19 -10.157 -6.539 -2.496 1.00 0.00 C ATOM 305 C LEU A 19 -10.739 -7.673 -3.338 1.00 0.00 C ATOM 306 O LEU A 19 -11.720 -7.481 -4.057 1.00 0.00 O ATOM 307 CB LEU A 19 -9.226 -5.671 -3.349 1.00 0.00 C ATOM 308 CG LEU A 19 -9.465 -4.162 -3.247 1.00 0.00 C ATOM 309 CD1 LEU A 19 -8.643 -3.425 -4.290 1.00 0.00 C ATOM 310 CD2 LEU A 19 -10.943 -3.838 -3.411 1.00 0.00 C ATOM 0 H LEU A 19 -8.565 -7.518 -1.543 1.00 0.00 H new ATOM 0 HA LEU A 19 -10.983 -5.925 -2.138 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -8.196 -5.880 -3.061 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -9.332 -5.970 -4.392 1.00 0.00 H new ATOM 0 HG LEU A 19 -9.150 -3.832 -2.257 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -8.824 -2.353 -4.205 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -7.584 -3.628 -4.129 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -8.930 -3.763 -5.285 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -11.090 -2.761 -3.335 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -11.285 -4.183 -4.387 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -11.514 -4.338 -2.629 1.00 0.00 H new ATOM 322 N GLU A 20 -10.134 -8.853 -3.247 1.00 0.00 N ATOM 323 CA GLU A 20 -10.602 -10.008 -4.005 1.00 0.00 C ATOM 324 C GLU A 20 -10.991 -11.154 -3.077 1.00 0.00 C ATOM 325 O GLU A 20 -10.360 -11.374 -2.045 1.00 0.00 O ATOM 326 CB GLU A 20 -9.526 -10.476 -4.988 1.00 0.00 C ATOM 327 CG GLU A 20 -8.832 -9.338 -5.719 1.00 0.00 C ATOM 328 CD GLU A 20 -9.038 -9.395 -7.221 1.00 0.00 C ATOM 329 OE1 GLU A 20 -8.129 -9.880 -7.927 1.00 0.00 O ATOM 330 OE2 GLU A 20 -10.108 -8.954 -7.691 1.00 0.00 O ATOM 0 H GLU A 20 -9.321 -9.034 -2.658 1.00 0.00 H new ATOM 0 HA GLU A 20 -11.486 -9.703 -4.564 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -8.780 -11.058 -4.447 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -9.980 -11.143 -5.720 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -9.207 -8.387 -5.341 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -7.764 -9.369 -5.501 1.00 0.00 H new ATOM 337 N ASP A 21 -12.036 -11.881 -3.458 1.00 0.00 N ATOM 338 CA ASP A 21 -12.525 -13.010 -2.671 1.00 0.00 C ATOM 339 C ASP A 21 -11.512 -14.156 -2.638 1.00 0.00 C ATOM 340 O ASP A 21 -11.659 -15.098 -1.860 1.00 0.00 O ATOM 341 CB ASP A 21 -13.856 -13.509 -3.238 1.00 0.00 C ATOM 342 CG ASP A 21 -14.877 -13.791 -2.154 1.00 0.00 C ATOM 343 OD1 ASP A 21 -14.480 -14.289 -1.080 1.00 0.00 O ATOM 344 OD2 ASP A 21 -16.073 -13.512 -2.378 1.00 0.00 O ATOM 0 H ASP A 21 -12.565 -11.708 -4.313 1.00 0.00 H new ATOM 0 HA ASP A 21 -12.672 -12.662 -1.648 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -14.257 -12.764 -3.926 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -13.684 -14.417 -3.816 1.00 0.00 H new ATOM 349 N ASP A 22 -10.496 -14.082 -3.494 1.00 0.00 N ATOM 350 CA ASP A 22 -9.480 -15.128 -3.563 1.00 0.00 C ATOM 351 C ASP A 22 -8.423 -14.965 -2.472 1.00 0.00 C ATOM 352 O ASP A 22 -7.494 -15.767 -2.377 1.00 0.00 O ATOM 353 CB ASP A 22 -8.809 -15.119 -4.938 1.00 0.00 C ATOM 354 CG ASP A 22 -9.785 -15.418 -6.059 1.00 0.00 C ATOM 355 OD1 ASP A 22 -9.584 -16.427 -6.768 1.00 0.00 O ATOM 356 OD2 ASP A 22 -10.750 -14.644 -6.229 1.00 0.00 O ATOM 0 H ASP A 22 -10.355 -13.311 -4.147 1.00 0.00 H new ATOM 0 HA ASP A 22 -9.981 -16.083 -3.405 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -8.350 -14.145 -5.109 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -8.006 -15.856 -4.952 1.00 0.00 H new ATOM 361 N GLY A 23 -8.567 -13.935 -1.642 1.00 0.00 N ATOM 362 CA GLY A 23 -7.615 -13.715 -0.569 1.00 0.00 C ATOM 363 C GLY A 23 -6.572 -12.667 -0.905 1.00 0.00 C ATOM 364 O GLY A 23 -5.469 -12.686 -0.360 1.00 0.00 O ATOM 0 H GLY A 23 -9.323 -13.252 -1.694 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -8.153 -13.409 0.329 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.115 -14.655 -0.336 1.00 0.00 H new ATOM 368 N GLU A 24 -6.917 -11.744 -1.799 1.00 0.00 N ATOM 369 CA GLU A 24 -5.992 -10.687 -2.188 1.00 0.00 C ATOM 370 C GLU A 24 -6.022 -9.548 -1.177 1.00 0.00 C ATOM 371 O GLU A 24 -7.050 -8.891 -0.997 1.00 0.00 O ATOM 372 CB GLU A 24 -6.340 -10.157 -3.581 1.00 0.00 C ATOM 373 CG GLU A 24 -6.003 -11.126 -4.702 1.00 0.00 C ATOM 374 CD GLU A 24 -4.533 -11.490 -4.736 1.00 0.00 C ATOM 375 OE1 GLU A 24 -3.696 -10.571 -4.857 1.00 0.00 O ATOM 376 OE2 GLU A 24 -4.217 -12.695 -4.642 1.00 0.00 O ATOM 0 H GLU A 24 -7.824 -11.707 -2.264 1.00 0.00 H new ATOM 0 HA GLU A 24 -4.987 -11.107 -2.211 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -7.405 -9.928 -3.618 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -5.807 -9.221 -3.748 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -6.595 -12.033 -4.583 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -6.286 -10.683 -5.657 1.00 0.00 H new ATOM 383 N PHE A 25 -4.892 -9.319 -0.518 1.00 0.00 N ATOM 384 CA PHE A 25 -4.792 -8.261 0.477 1.00 0.00 C ATOM 385 C PHE A 25 -3.893 -7.132 -0.010 1.00 0.00 C ATOM 386 O PHE A 25 -2.777 -7.366 -0.478 1.00 0.00 O ATOM 387 CB PHE A 25 -4.258 -8.821 1.797 1.00 0.00 C ATOM 388 CG PHE A 25 -5.339 -9.228 2.755 1.00 0.00 C ATOM 389 CD1 PHE A 25 -5.975 -10.452 2.618 1.00 0.00 C ATOM 390 CD2 PHE A 25 -5.723 -8.390 3.792 1.00 0.00 C ATOM 391 CE1 PHE A 25 -6.971 -10.832 3.495 1.00 0.00 C ATOM 392 CE2 PHE A 25 -6.719 -8.766 4.672 1.00 0.00 C ATOM 393 CZ PHE A 25 -7.345 -9.989 4.523 1.00 0.00 C ATOM 0 H PHE A 25 -4.033 -9.852 -0.655 1.00 0.00 H new ATOM 0 HA PHE A 25 -5.792 -7.857 0.638 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -3.626 -9.684 1.587 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -3.626 -8.070 2.272 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -5.688 -11.116 1.816 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -5.238 -7.433 3.912 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -7.458 -11.789 3.377 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -7.008 -8.105 5.476 1.00 0.00 H new ATOM 0 HZ PHE A 25 -8.125 -10.285 5.209 1.00 0.00 H new ATOM 403 N TYR A 26 -4.385 -5.906 0.109 1.00 0.00 N ATOM 404 CA TYR A 26 -3.632 -4.735 -0.310 1.00 0.00 C ATOM 405 C TYR A 26 -3.467 -3.761 0.844 1.00 0.00 C ATOM 406 O TYR A 26 -4.134 -3.876 1.870 1.00 0.00 O ATOM 407 CB TYR A 26 -4.324 -4.035 -1.477 1.00 0.00 C ATOM 408 CG TYR A 26 -4.334 -4.849 -2.751 1.00 0.00 C ATOM 409 CD1 TYR A 26 -3.361 -4.656 -3.723 1.00 0.00 C ATOM 410 CD2 TYR A 26 -5.308 -5.813 -2.979 1.00 0.00 C ATOM 411 CE1 TYR A 26 -3.359 -5.398 -4.889 1.00 0.00 C ATOM 412 CE2 TYR A 26 -5.313 -6.560 -4.143 1.00 0.00 C ATOM 413 CZ TYR A 26 -4.336 -6.348 -5.094 1.00 0.00 C ATOM 414 OH TYR A 26 -4.339 -7.090 -6.253 1.00 0.00 O ATOM 0 H TYR A 26 -5.306 -5.698 0.494 1.00 0.00 H new ATOM 0 HA TYR A 26 -2.647 -5.071 -0.634 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -5.351 -3.805 -1.194 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -3.825 -3.084 -1.667 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -2.593 -3.913 -3.565 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -6.073 -5.982 -2.236 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -2.596 -5.234 -5.635 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -6.077 -7.305 -4.307 1.00 0.00 H new ATOM 0 HH TYR A 26 -5.093 -7.715 -6.239 1.00 0.00 H new ATOM 424 N MET A 27 -2.574 -2.803 0.662 1.00 0.00 N ATOM 425 CA MET A 27 -2.307 -1.794 1.678 1.00 0.00 C ATOM 426 C MET A 27 -2.298 -0.406 1.055 1.00 0.00 C ATOM 427 O MET A 27 -1.947 -0.247 -0.116 1.00 0.00 O ATOM 428 CB MET A 27 -0.963 -2.067 2.359 1.00 0.00 C ATOM 429 CG MET A 27 -1.085 -2.879 3.638 1.00 0.00 C ATOM 430 SD MET A 27 -0.367 -4.527 3.491 1.00 0.00 S ATOM 431 CE MET A 27 0.945 -4.435 4.706 1.00 0.00 C ATOM 0 H MET A 27 -2.017 -2.701 -0.186 1.00 0.00 H new ATOM 0 HA MET A 27 -3.098 -1.841 2.426 1.00 0.00 H new ATOM 0 HB2 MET A 27 -0.313 -2.596 1.663 1.00 0.00 H new ATOM 0 HB3 MET A 27 -0.480 -1.117 2.586 1.00 0.00 H new ATOM 0 HG2 MET A 27 -0.593 -2.344 4.451 1.00 0.00 H new ATOM 0 HG3 MET A 27 -2.137 -2.969 3.907 1.00 0.00 H new ATOM 0 HE1 MET A 27 1.738 -5.133 4.439 1.00 0.00 H new ATOM 0 HE2 MET A 27 1.347 -3.422 4.731 1.00 0.00 H new ATOM 0 HE3 MET A 27 0.550 -4.693 5.688 1.00 0.00 H new ATOM 441 N ILE A 28 -2.689 0.599 1.833 1.00 0.00 N ATOM 442 CA ILE A 28 -2.719 1.967 1.324 1.00 0.00 C ATOM 443 C ILE A 28 -1.316 2.579 1.286 1.00 0.00 C ATOM 444 O ILE A 28 -0.608 2.630 2.300 1.00 0.00 O ATOM 445 CB ILE A 28 -3.661 2.869 2.143 1.00 0.00 C ATOM 446 CG1 ILE A 28 -5.004 2.169 2.357 1.00 0.00 C ATOM 447 CG2 ILE A 28 -3.867 4.194 1.425 1.00 0.00 C ATOM 448 CD1 ILE A 28 -6.033 3.030 3.060 1.00 0.00 C ATOM 0 H ILE A 28 -2.985 0.496 2.804 1.00 0.00 H new ATOM 0 HA ILE A 28 -3.106 1.909 0.307 1.00 0.00 H new ATOM 0 HB ILE A 28 -3.209 3.063 3.116 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -5.401 1.860 1.390 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -4.842 1.262 2.940 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -4.534 4.826 2.011 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -2.907 4.695 1.304 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -4.308 4.012 0.445 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -6.959 2.468 3.177 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -5.657 3.318 4.042 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -6.224 3.925 2.468 1.00 0.00 H new ATOM 460 N GLY A 29 -0.920 3.035 0.099 1.00 0.00 N ATOM 461 CA GLY A 29 0.397 3.621 -0.079 1.00 0.00 C ATOM 462 C GLY A 29 0.671 4.759 0.878 1.00 0.00 C ATOM 463 O GLY A 29 1.796 4.918 1.347 1.00 0.00 O ATOM 0 H GLY A 29 -1.491 3.008 -0.745 1.00 0.00 H new ATOM 0 HA2 GLY A 29 1.154 2.849 0.057 1.00 0.00 H new ATOM 0 HA3 GLY A 29 0.492 3.983 -1.103 1.00 0.00 H new ATOM 467 N SER A 30 -0.352 5.547 1.182 1.00 0.00 N ATOM 468 CA SER A 30 -0.192 6.661 2.107 1.00 0.00 C ATOM 469 C SER A 30 0.314 6.151 3.451 1.00 0.00 C ATOM 470 O SER A 30 1.165 6.777 4.092 1.00 0.00 O ATOM 471 CB SER A 30 -1.520 7.399 2.289 1.00 0.00 C ATOM 472 OG SER A 30 -2.618 6.510 2.185 1.00 0.00 O ATOM 0 H SER A 30 -1.294 5.437 0.805 1.00 0.00 H new ATOM 0 HA SER A 30 0.537 7.358 1.694 1.00 0.00 H new ATOM 0 HB2 SER A 30 -1.536 7.889 3.262 1.00 0.00 H new ATOM 0 HB3 SER A 30 -1.610 8.182 1.536 1.00 0.00 H new ATOM 0 HG SER A 30 -3.454 7.007 2.307 1.00 0.00 H new ATOM 478 N GLU A 31 -0.203 4.995 3.865 1.00 0.00 N ATOM 479 CA GLU A 31 0.208 4.394 5.123 1.00 0.00 C ATOM 480 C GLU A 31 1.650 3.927 5.026 1.00 0.00 C ATOM 481 O GLU A 31 2.459 4.175 5.922 1.00 0.00 O ATOM 482 CB GLU A 31 -0.708 3.228 5.488 1.00 0.00 C ATOM 483 CG GLU A 31 -2.030 3.665 6.095 1.00 0.00 C ATOM 484 CD GLU A 31 -2.033 3.574 7.609 1.00 0.00 C ATOM 485 OE1 GLU A 31 -1.794 2.467 8.137 1.00 0.00 O ATOM 486 OE2 GLU A 31 -2.274 4.609 8.266 1.00 0.00 O ATOM 0 H GLU A 31 -0.903 4.462 3.348 1.00 0.00 H new ATOM 0 HA GLU A 31 0.132 5.144 5.910 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -0.905 2.637 4.594 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -0.191 2.577 6.193 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -2.242 4.691 5.796 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -2.832 3.045 5.695 1.00 0.00 H new ATOM 493 N VAL A 32 1.972 3.272 3.918 1.00 0.00 N ATOM 494 CA VAL A 32 3.330 2.794 3.689 1.00 0.00 C ATOM 495 C VAL A 32 4.303 3.968 3.684 1.00 0.00 C ATOM 496 O VAL A 32 5.406 3.891 4.238 1.00 0.00 O ATOM 497 CB VAL A 32 3.448 2.033 2.354 1.00 0.00 C ATOM 498 CG1 VAL A 32 4.834 1.426 2.204 1.00 0.00 C ATOM 499 CG2 VAL A 32 2.373 0.959 2.255 1.00 0.00 C ATOM 0 H VAL A 32 1.315 3.060 3.167 1.00 0.00 H new ATOM 0 HA VAL A 32 3.577 2.107 4.499 1.00 0.00 H new ATOM 0 HB VAL A 32 3.298 2.741 1.539 1.00 0.00 H new ATOM 0 HG11 VAL A 32 4.897 0.893 1.255 1.00 0.00 H new ATOM 0 HG12 VAL A 32 5.582 2.218 2.226 1.00 0.00 H new ATOM 0 HG13 VAL A 32 5.017 0.731 3.023 1.00 0.00 H new ATOM 0 HG21 VAL A 32 2.472 0.432 1.306 1.00 0.00 H new ATOM 0 HG22 VAL A 32 2.488 0.252 3.077 1.00 0.00 H new ATOM 0 HG23 VAL A 32 1.388 1.423 2.312 1.00 0.00 H new ATOM 509 N GLY A 33 3.875 5.063 3.064 1.00 0.00 N ATOM 510 CA GLY A 33 4.701 6.250 2.998 1.00 0.00 C ATOM 511 C GLY A 33 5.064 6.759 4.375 1.00 0.00 C ATOM 512 O GLY A 33 6.234 6.997 4.662 1.00 0.00 O ATOM 0 H GLY A 33 2.968 5.147 2.605 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.611 6.029 2.441 1.00 0.00 H new ATOM 0 HA3 GLY A 33 4.173 7.030 2.450 1.00 0.00 H new ATOM 516 N ASN A 34 4.064 6.912 5.239 1.00 0.00 N ATOM 517 CA ASN A 34 4.319 7.378 6.597 1.00 0.00 C ATOM 518 C ASN A 34 5.224 6.390 7.332 1.00 0.00 C ATOM 519 O ASN A 34 6.035 6.780 8.171 1.00 0.00 O ATOM 520 CB ASN A 34 3.009 7.608 7.363 1.00 0.00 C ATOM 521 CG ASN A 34 2.268 6.329 7.709 1.00 0.00 C ATOM 522 OD1 ASN A 34 2.870 5.323 8.085 1.00 0.00 O ATOM 523 ND2 ASN A 34 0.947 6.366 7.594 1.00 0.00 N ATOM 0 H ASN A 34 3.084 6.723 5.027 1.00 0.00 H new ATOM 0 HA ASN A 34 4.832 8.338 6.540 1.00 0.00 H new ATOM 0 HB2 ASN A 34 3.228 8.150 8.283 1.00 0.00 H new ATOM 0 HB3 ASN A 34 2.357 8.244 6.765 1.00 0.00 H new ATOM 0 HD21 ASN A 34 0.392 5.541 7.821 1.00 0.00 H new ATOM 0 HD22 ASN A 34 0.486 7.220 7.279 1.00 0.00 H new ATOM 530 N TYR A 35 5.077 5.107 7.003 1.00 0.00 N ATOM 531 CA TYR A 35 5.879 4.055 7.621 1.00 0.00 C ATOM 532 C TYR A 35 7.364 4.292 7.367 1.00 0.00 C ATOM 533 O TYR A 35 8.189 4.168 8.272 1.00 0.00 O ATOM 534 CB TYR A 35 5.462 2.700 7.037 1.00 0.00 C ATOM 535 CG TYR A 35 5.803 1.506 7.901 1.00 0.00 C ATOM 536 CD1 TYR A 35 6.979 1.459 8.630 1.00 0.00 C ATOM 537 CD2 TYR A 35 4.943 0.422 7.977 1.00 0.00 C ATOM 538 CE1 TYR A 35 7.290 0.368 9.413 1.00 0.00 C ATOM 539 CE2 TYR A 35 5.247 -0.676 8.759 1.00 0.00 C ATOM 540 CZ TYR A 35 6.422 -0.697 9.475 1.00 0.00 C ATOM 541 OH TYR A 35 6.730 -1.788 10.256 1.00 0.00 O ATOM 0 H TYR A 35 4.408 4.772 6.310 1.00 0.00 H new ATOM 0 HA TYR A 35 5.710 4.064 8.698 1.00 0.00 H new ATOM 0 HB2 TYR A 35 4.386 2.710 6.864 1.00 0.00 H new ATOM 0 HB3 TYR A 35 5.940 2.576 6.065 1.00 0.00 H new ATOM 0 HD1 TYR A 35 7.665 2.292 8.584 1.00 0.00 H new ATOM 0 HD2 TYR A 35 4.020 0.436 7.416 1.00 0.00 H new ATOM 0 HE1 TYR A 35 8.212 0.350 9.976 1.00 0.00 H new ATOM 0 HE2 TYR A 35 4.566 -1.513 8.808 1.00 0.00 H new ATOM 0 HH TYR A 35 6.012 -2.451 10.189 1.00 0.00 H new ATOM 551 N LEU A 36 7.700 4.648 6.137 1.00 0.00 N ATOM 552 CA LEU A 36 9.092 4.908 5.784 1.00 0.00 C ATOM 553 C LEU A 36 9.406 6.405 5.795 1.00 0.00 C ATOM 554 O LEU A 36 10.530 6.812 5.502 1.00 0.00 O ATOM 555 CB LEU A 36 9.414 4.307 4.417 1.00 0.00 C ATOM 556 CG LEU A 36 9.166 2.799 4.306 1.00 0.00 C ATOM 557 CD1 LEU A 36 7.935 2.515 3.457 1.00 0.00 C ATOM 558 CD2 LEU A 36 10.388 2.096 3.732 1.00 0.00 C ATOM 0 H LEU A 36 7.037 4.763 5.371 1.00 0.00 H new ATOM 0 HA LEU A 36 9.720 4.433 6.538 1.00 0.00 H new ATOM 0 HB2 LEU A 36 8.816 4.816 3.661 1.00 0.00 H new ATOM 0 HB3 LEU A 36 10.460 4.508 4.184 1.00 0.00 H new ATOM 0 HG LEU A 36 8.985 2.409 5.308 1.00 0.00 H new ATOM 0 HD11 LEU A 36 7.778 1.438 3.392 1.00 0.00 H new ATOM 0 HD12 LEU A 36 7.062 2.982 3.914 1.00 0.00 H new ATOM 0 HD13 LEU A 36 8.082 2.921 2.456 1.00 0.00 H new ATOM 0 HD21 LEU A 36 10.192 1.026 3.661 1.00 0.00 H new ATOM 0 HD22 LEU A 36 10.603 2.492 2.740 1.00 0.00 H new ATOM 0 HD23 LEU A 36 11.245 2.266 4.384 1.00 0.00 H new ATOM 570 N ARG A 37 8.409 7.218 6.138 1.00 0.00 N ATOM 571 CA ARG A 37 8.581 8.666 6.192 1.00 0.00 C ATOM 572 C ARG A 37 8.803 9.248 4.801 1.00 0.00 C ATOM 573 O ARG A 37 9.414 10.307 4.652 1.00 0.00 O ATOM 574 CB ARG A 37 9.753 9.035 7.104 1.00 0.00 C ATOM 575 CG ARG A 37 9.549 10.338 7.861 1.00 0.00 C ATOM 576 CD ARG A 37 10.840 11.135 7.964 1.00 0.00 C ATOM 577 NE ARG A 37 11.428 11.056 9.299 1.00 0.00 N ATOM 578 CZ ARG A 37 12.183 10.043 9.720 1.00 0.00 C ATOM 579 NH1 ARG A 37 12.445 9.020 8.915 1.00 0.00 N ATOM 580 NH2 ARG A 37 12.676 10.052 10.950 1.00 0.00 N ATOM 0 H ARG A 37 7.472 6.897 6.383 1.00 0.00 H new ATOM 0 HA ARG A 37 7.665 9.092 6.600 1.00 0.00 H new ATOM 0 HB2 ARG A 37 9.912 8.229 7.821 1.00 0.00 H new ATOM 0 HB3 ARG A 37 10.660 9.111 6.504 1.00 0.00 H new ATOM 0 HG2 ARG A 37 8.790 10.937 7.357 1.00 0.00 H new ATOM 0 HG3 ARG A 37 9.173 10.123 8.861 1.00 0.00 H new ATOM 0 HD2 ARG A 37 11.555 10.763 7.230 1.00 0.00 H new ATOM 0 HD3 ARG A 37 10.643 12.178 7.716 1.00 0.00 H new ATOM 0 HE ARG A 37 11.250 11.823 9.948 1.00 0.00 H new ATOM 0 HH11 ARG A 37 12.067 9.007 7.968 1.00 0.00 H new ATOM 0 HH12 ARG A 37 13.024 8.247 9.244 1.00 0.00 H new ATOM 0 HH21 ARG A 37 12.477 10.834 11.573 1.00 0.00 H new ATOM 0 HH22 ARG A 37 13.254 9.277 11.273 1.00 0.00 H new ATOM 594 N MET A 38 8.300 8.558 3.782 1.00 0.00 N ATOM 595 CA MET A 38 8.443 9.025 2.409 1.00 0.00 C ATOM 596 C MET A 38 7.154 9.687 1.936 1.00 0.00 C ATOM 597 O MET A 38 6.076 9.098 2.014 1.00 0.00 O ATOM 598 CB MET A 38 8.803 7.859 1.487 1.00 0.00 C ATOM 599 CG MET A 38 9.874 6.940 2.058 1.00 0.00 C ATOM 600 SD MET A 38 11.336 6.833 1.008 1.00 0.00 S ATOM 601 CE MET A 38 11.054 5.264 0.192 1.00 0.00 C ATOM 0 H MET A 38 7.793 7.679 3.881 1.00 0.00 H new ATOM 0 HA MET A 38 9.247 9.761 2.376 1.00 0.00 H new ATOM 0 HB2 MET A 38 7.905 7.275 1.285 1.00 0.00 H new ATOM 0 HB3 MET A 38 9.147 8.255 0.532 1.00 0.00 H new ATOM 0 HG2 MET A 38 10.166 7.300 3.045 1.00 0.00 H new ATOM 0 HG3 MET A 38 9.456 5.943 2.193 1.00 0.00 H new ATOM 0 HE1 MET A 38 11.981 4.690 0.176 1.00 0.00 H new ATOM 0 HE2 MET A 38 10.290 4.705 0.733 1.00 0.00 H new ATOM 0 HE3 MET A 38 10.719 5.440 -0.830 1.00 0.00 H new ATOM 611 N PHE A 39 7.272 10.917 1.450 1.00 0.00 N ATOM 612 CA PHE A 39 6.114 11.664 0.971 1.00 0.00 C ATOM 613 C PHE A 39 6.343 12.176 -0.447 1.00 0.00 C ATOM 614 O PHE A 39 7.434 12.036 -1.000 1.00 0.00 O ATOM 615 CB PHE A 39 5.811 12.831 1.916 1.00 0.00 C ATOM 616 CG PHE A 39 6.043 12.500 3.366 1.00 0.00 C ATOM 617 CD1 PHE A 39 5.000 12.066 4.169 1.00 0.00 C ATOM 618 CD2 PHE A 39 7.307 12.618 3.921 1.00 0.00 C ATOM 619 CE1 PHE A 39 5.214 11.757 5.499 1.00 0.00 C ATOM 620 CE2 PHE A 39 7.527 12.310 5.250 1.00 0.00 C ATOM 621 CZ PHE A 39 6.479 11.878 6.040 1.00 0.00 C ATOM 0 H PHE A 39 8.157 11.418 1.377 1.00 0.00 H new ATOM 0 HA PHE A 39 5.257 10.991 0.953 1.00 0.00 H new ATOM 0 HB2 PHE A 39 6.433 13.683 1.641 1.00 0.00 H new ATOM 0 HB3 PHE A 39 4.774 13.138 1.782 1.00 0.00 H new ATOM 0 HD1 PHE A 39 4.009 11.968 3.751 1.00 0.00 H new ATOM 0 HD2 PHE A 39 8.130 12.955 3.308 1.00 0.00 H new ATOM 0 HE1 PHE A 39 4.393 11.421 6.115 1.00 0.00 H new ATOM 0 HE2 PHE A 39 8.517 12.407 5.671 1.00 0.00 H new ATOM 0 HZ PHE A 39 6.649 11.635 7.079 1.00 0.00 H new ATOM 631 N ARG A 40 5.307 12.772 -1.031 1.00 0.00 N ATOM 632 CA ARG A 40 5.395 13.308 -2.385 1.00 0.00 C ATOM 633 C ARG A 40 5.841 12.232 -3.373 1.00 0.00 C ATOM 634 O ARG A 40 6.698 12.471 -4.223 1.00 0.00 O ATOM 635 CB ARG A 40 6.369 14.488 -2.425 1.00 0.00 C ATOM 636 CG ARG A 40 5.785 15.779 -1.873 1.00 0.00 C ATOM 637 CD ARG A 40 5.929 15.856 -0.362 1.00 0.00 C ATOM 638 NE ARG A 40 7.006 16.757 0.041 1.00 0.00 N ATOM 639 CZ ARG A 40 7.211 17.154 1.295 1.00 0.00 C ATOM 640 NH1 ARG A 40 6.416 16.731 2.271 1.00 0.00 N ATOM 641 NH2 ARG A 40 8.214 17.975 1.575 1.00 0.00 N ATOM 0 H ARG A 40 4.397 12.896 -0.587 1.00 0.00 H new ATOM 0 HA ARG A 40 4.403 13.652 -2.677 1.00 0.00 H new ATOM 0 HB2 ARG A 40 7.262 14.230 -1.856 1.00 0.00 H new ATOM 0 HB3 ARG A 40 6.684 14.653 -3.455 1.00 0.00 H new ATOM 0 HG2 ARG A 40 6.287 16.631 -2.331 1.00 0.00 H new ATOM 0 HG3 ARG A 40 4.731 15.847 -2.143 1.00 0.00 H new ATOM 0 HD2 ARG A 40 4.990 16.196 0.075 1.00 0.00 H new ATOM 0 HD3 ARG A 40 6.123 14.859 0.035 1.00 0.00 H new ATOM 0 HE ARG A 40 7.638 17.102 -0.681 1.00 0.00 H new ATOM 0 HH11 ARG A 40 5.644 16.099 2.062 1.00 0.00 H new ATOM 0 HH12 ARG A 40 6.578 17.038 3.230 1.00 0.00 H new ATOM 0 HH21 ARG A 40 8.828 18.302 0.830 1.00 0.00 H new ATOM 0 HH22 ARG A 40 8.371 18.279 2.536 1.00 0.00 H new ATOM 655 N GLY A 41 5.251 11.048 -3.253 1.00 0.00 N ATOM 656 CA GLY A 41 5.599 9.952 -4.140 1.00 0.00 C ATOM 657 C GLY A 41 7.023 9.468 -3.937 1.00 0.00 C ATOM 658 O GLY A 41 7.593 8.816 -4.812 1.00 0.00 O ATOM 0 H GLY A 41 4.538 10.827 -2.558 1.00 0.00 H new ATOM 0 HA2 GLY A 41 4.910 9.123 -3.975 1.00 0.00 H new ATOM 0 HA3 GLY A 41 5.472 10.272 -5.174 1.00 0.00 H new ATOM 662 N SER A 42 7.597 9.783 -2.779 1.00 0.00 N ATOM 663 CA SER A 42 8.961 9.372 -2.467 1.00 0.00 C ATOM 664 C SER A 42 9.055 7.854 -2.341 1.00 0.00 C ATOM 665 O SER A 42 10.069 7.253 -2.697 1.00 0.00 O ATOM 666 CB SER A 42 9.433 10.035 -1.171 1.00 0.00 C ATOM 667 OG SER A 42 9.939 11.335 -1.418 1.00 0.00 O ATOM 0 H SER A 42 7.139 10.321 -2.043 1.00 0.00 H new ATOM 0 HA SER A 42 9.607 9.692 -3.285 1.00 0.00 H new ATOM 0 HB2 SER A 42 8.604 10.092 -0.465 1.00 0.00 H new ATOM 0 HB3 SER A 42 10.206 9.423 -0.706 1.00 0.00 H new ATOM 0 HG SER A 42 9.215 11.990 -1.333 1.00 0.00 H new ATOM 673 N LEU A 43 7.989 7.242 -1.836 1.00 0.00 N ATOM 674 CA LEU A 43 7.948 5.794 -1.664 1.00 0.00 C ATOM 675 C LEU A 43 8.001 5.090 -3.016 1.00 0.00 C ATOM 676 O LEU A 43 8.829 4.205 -3.235 1.00 0.00 O ATOM 677 CB LEU A 43 6.682 5.384 -0.910 1.00 0.00 C ATOM 678 CG LEU A 43 6.551 3.885 -0.631 1.00 0.00 C ATOM 679 CD1 LEU A 43 7.065 3.555 0.763 1.00 0.00 C ATOM 680 CD2 LEU A 43 5.106 3.437 -0.787 1.00 0.00 C ATOM 0 H LEU A 43 7.142 7.726 -1.539 1.00 0.00 H new ATOM 0 HA LEU A 43 8.819 5.494 -1.082 1.00 0.00 H new ATOM 0 HB2 LEU A 43 6.654 5.919 0.039 1.00 0.00 H new ATOM 0 HB3 LEU A 43 5.814 5.708 -1.484 1.00 0.00 H new ATOM 0 HG LEU A 43 7.158 3.346 -1.358 1.00 0.00 H new ATOM 0 HD11 LEU A 43 6.964 2.485 0.944 1.00 0.00 H new ATOM 0 HD12 LEU A 43 8.115 3.839 0.840 1.00 0.00 H new ATOM 0 HD13 LEU A 43 6.485 4.105 1.504 1.00 0.00 H new ATOM 0 HD21 LEU A 43 5.033 2.368 -0.585 1.00 0.00 H new ATOM 0 HD22 LEU A 43 4.478 3.983 -0.084 1.00 0.00 H new ATOM 0 HD23 LEU A 43 4.771 3.638 -1.805 1.00 0.00 H new ATOM 692 N TYR A 44 7.114 5.491 -3.921 1.00 0.00 N ATOM 693 CA TYR A 44 7.063 4.900 -5.253 1.00 0.00 C ATOM 694 C TYR A 44 8.355 5.174 -6.013 1.00 0.00 C ATOM 695 O TYR A 44 8.814 4.345 -6.798 1.00 0.00 O ATOM 696 CB TYR A 44 5.866 5.449 -6.031 1.00 0.00 C ATOM 697 CG TYR A 44 4.554 5.327 -5.288 1.00 0.00 C ATOM 698 CD1 TYR A 44 4.254 4.186 -4.555 1.00 0.00 C ATOM 699 CD2 TYR A 44 3.618 6.353 -5.318 1.00 0.00 C ATOM 700 CE1 TYR A 44 3.057 4.071 -3.872 1.00 0.00 C ATOM 701 CE2 TYR A 44 2.420 6.245 -4.638 1.00 0.00 C ATOM 702 CZ TYR A 44 2.145 5.103 -3.916 1.00 0.00 C ATOM 703 OH TYR A 44 0.952 4.995 -3.237 1.00 0.00 O ATOM 0 H TYR A 44 6.422 6.222 -3.756 1.00 0.00 H new ATOM 0 HA TYR A 44 6.948 3.821 -5.146 1.00 0.00 H new ATOM 0 HB2 TYR A 44 6.045 6.498 -6.265 1.00 0.00 H new ATOM 0 HB3 TYR A 44 5.787 4.920 -6.981 1.00 0.00 H new ATOM 0 HD1 TYR A 44 4.967 3.376 -4.518 1.00 0.00 H new ATOM 0 HD2 TYR A 44 3.830 7.249 -5.882 1.00 0.00 H new ATOM 0 HE1 TYR A 44 2.838 3.177 -3.307 1.00 0.00 H new ATOM 0 HE2 TYR A 44 1.702 7.051 -4.672 1.00 0.00 H new ATOM 0 HH TYR A 44 0.811 5.798 -2.693 1.00 0.00 H new ATOM 713 N LYS A 45 8.941 6.343 -5.769 1.00 0.00 N ATOM 714 CA LYS A 45 10.186 6.723 -6.425 1.00 0.00 C ATOM 715 C LYS A 45 11.324 5.810 -5.982 1.00 0.00 C ATOM 716 O LYS A 45 12.175 5.425 -6.785 1.00 0.00 O ATOM 717 CB LYS A 45 10.531 8.180 -6.106 1.00 0.00 C ATOM 718 CG LYS A 45 10.023 9.167 -7.144 1.00 0.00 C ATOM 719 CD LYS A 45 10.830 10.457 -7.128 1.00 0.00 C ATOM 720 CE LYS A 45 10.105 11.562 -6.376 1.00 0.00 C ATOM 721 NZ LYS A 45 9.605 12.622 -7.295 1.00 0.00 N ATOM 0 H LYS A 45 8.574 7.042 -5.123 1.00 0.00 H new ATOM 0 HA LYS A 45 10.053 6.618 -7.502 1.00 0.00 H new ATOM 0 HB2 LYS A 45 10.111 8.440 -5.134 1.00 0.00 H new ATOM 0 HB3 LYS A 45 11.613 8.278 -6.022 1.00 0.00 H new ATOM 0 HG2 LYS A 45 10.077 8.715 -8.134 1.00 0.00 H new ATOM 0 HG3 LYS A 45 8.974 9.391 -6.952 1.00 0.00 H new ATOM 0 HD2 LYS A 45 11.799 10.275 -6.663 1.00 0.00 H new ATOM 0 HD3 LYS A 45 11.023 10.779 -8.151 1.00 0.00 H new ATOM 0 HE2 LYS A 45 9.268 11.136 -5.823 1.00 0.00 H new ATOM 0 HE3 LYS A 45 10.779 12.005 -5.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 9.117 13.357 -6.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 10.406 13.046 -7.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 8.942 12.204 -7.979 1.00 0.00 H new ATOM 735 N ARG A 46 11.328 5.464 -4.699 1.00 0.00 N ATOM 736 CA ARG A 46 12.355 4.592 -4.142 1.00 0.00 C ATOM 737 C ARG A 46 12.018 3.121 -4.383 1.00 0.00 C ATOM 738 O ARG A 46 12.883 2.252 -4.275 1.00 0.00 O ATOM 739 CB ARG A 46 12.512 4.850 -2.643 1.00 0.00 C ATOM 740 CG ARG A 46 13.879 4.467 -2.100 1.00 0.00 C ATOM 741 CD ARG A 46 14.377 5.478 -1.080 1.00 0.00 C ATOM 742 NE ARG A 46 15.587 5.020 -0.401 1.00 0.00 N ATOM 743 CZ ARG A 46 16.229 5.727 0.526 1.00 0.00 C ATOM 744 NH1 ARG A 46 15.781 6.924 0.886 1.00 0.00 N ATOM 745 NH2 ARG A 46 17.323 5.237 1.094 1.00 0.00 N ATOM 0 H ARG A 46 10.629 5.775 -4.024 1.00 0.00 H new ATOM 0 HA ARG A 46 13.295 4.816 -4.646 1.00 0.00 H new ATOM 0 HB2 ARG A 46 12.334 5.907 -2.444 1.00 0.00 H new ATOM 0 HB3 ARG A 46 11.747 4.291 -2.104 1.00 0.00 H new ATOM 0 HG2 ARG A 46 13.825 3.480 -1.640 1.00 0.00 H new ATOM 0 HG3 ARG A 46 14.591 4.397 -2.922 1.00 0.00 H new ATOM 0 HD2 ARG A 46 14.578 6.427 -1.578 1.00 0.00 H new ATOM 0 HD3 ARG A 46 13.596 5.664 -0.343 1.00 0.00 H new ATOM 0 HE ARG A 46 15.962 4.105 -0.652 1.00 0.00 H new ATOM 0 HH11 ARG A 46 14.941 7.306 0.452 1.00 0.00 H new ATOM 0 HH12 ARG A 46 16.277 7.462 1.597 1.00 0.00 H new ATOM 0 HH21 ARG A 46 17.672 4.319 0.820 1.00 0.00 H new ATOM 0 HH22 ARG A 46 17.815 5.779 1.804 1.00 0.00 H new ATOM 759 N TYR A 47 10.756 2.848 -4.710 1.00 0.00 N ATOM 760 CA TYR A 47 10.311 1.483 -4.966 1.00 0.00 C ATOM 761 C TYR A 47 9.459 1.417 -6.236 1.00 0.00 C ATOM 762 O TYR A 47 8.270 1.104 -6.181 1.00 0.00 O ATOM 763 CB TYR A 47 9.509 0.964 -3.772 1.00 0.00 C ATOM 764 CG TYR A 47 10.350 0.690 -2.548 1.00 0.00 C ATOM 765 CD1 TYR A 47 10.517 1.654 -1.564 1.00 0.00 C ATOM 766 CD2 TYR A 47 10.975 -0.537 -2.377 1.00 0.00 C ATOM 767 CE1 TYR A 47 11.285 1.404 -0.443 1.00 0.00 C ATOM 768 CE2 TYR A 47 11.744 -0.798 -1.261 1.00 0.00 C ATOM 769 CZ TYR A 47 11.896 0.177 -0.295 1.00 0.00 C ATOM 770 OH TYR A 47 12.661 -0.073 0.821 1.00 0.00 O ATOM 0 H TYR A 47 10.026 3.554 -4.803 1.00 0.00 H new ATOM 0 HA TYR A 47 11.191 0.856 -5.110 1.00 0.00 H new ATOM 0 HB2 TYR A 47 8.740 1.693 -3.518 1.00 0.00 H new ATOM 0 HB3 TYR A 47 8.995 0.047 -4.062 1.00 0.00 H new ATOM 0 HD1 TYR A 47 10.039 2.616 -1.676 1.00 0.00 H new ATOM 0 HD2 TYR A 47 10.858 -1.302 -3.131 1.00 0.00 H new ATOM 0 HE1 TYR A 47 11.406 2.166 0.313 1.00 0.00 H new ATOM 0 HE2 TYR A 47 12.224 -1.759 -1.144 1.00 0.00 H new ATOM 0 HH TYR A 47 12.895 -1.024 0.851 1.00 0.00 H new ATOM 780 N PRO A 48 10.059 1.723 -7.403 1.00 0.00 N ATOM 781 CA PRO A 48 9.349 1.709 -8.689 1.00 0.00 C ATOM 782 C PRO A 48 8.816 0.328 -9.064 1.00 0.00 C ATOM 783 O PRO A 48 7.807 0.215 -9.758 1.00 0.00 O ATOM 784 CB PRO A 48 10.415 2.161 -9.697 1.00 0.00 C ATOM 785 CG PRO A 48 11.448 2.850 -8.874 1.00 0.00 C ATOM 786 CD PRO A 48 11.467 2.120 -7.564 1.00 0.00 C ATOM 0 HA PRO A 48 8.467 2.348 -8.660 1.00 0.00 H new ATOM 0 HB2 PRO A 48 10.838 1.311 -10.233 1.00 0.00 H new ATOM 0 HB3 PRO A 48 9.993 2.832 -10.445 1.00 0.00 H new ATOM 0 HG2 PRO A 48 12.424 2.814 -9.358 1.00 0.00 H new ATOM 0 HG3 PRO A 48 11.201 3.902 -8.734 1.00 0.00 H new ATOM 0 HD2 PRO A 48 12.132 1.257 -7.590 1.00 0.00 H new ATOM 0 HD3 PRO A 48 11.805 2.759 -6.748 1.00 0.00 H new ATOM 794 N SER A 49 9.494 -0.721 -8.606 1.00 0.00 N ATOM 795 CA SER A 49 9.070 -2.087 -8.905 1.00 0.00 C ATOM 796 C SER A 49 7.867 -2.490 -8.057 1.00 0.00 C ATOM 797 O SER A 49 7.250 -3.529 -8.293 1.00 0.00 O ATOM 798 CB SER A 49 10.220 -3.067 -8.670 1.00 0.00 C ATOM 799 OG SER A 49 10.289 -4.027 -9.709 1.00 0.00 O ATOM 0 H SER A 49 10.333 -0.653 -8.030 1.00 0.00 H new ATOM 0 HA SER A 49 8.778 -2.121 -9.955 1.00 0.00 H new ATOM 0 HB2 SER A 49 11.162 -2.521 -8.611 1.00 0.00 H new ATOM 0 HB3 SER A 49 10.084 -3.571 -7.713 1.00 0.00 H new ATOM 0 HG SER A 49 9.383 -4.296 -9.967 1.00 0.00 H new ATOM 805 N LEU A 50 7.543 -1.666 -7.067 1.00 0.00 N ATOM 806 CA LEU A 50 6.422 -1.936 -6.180 1.00 0.00 C ATOM 807 C LEU A 50 5.089 -1.781 -6.906 1.00 0.00 C ATOM 808 O LEU A 50 4.881 -0.820 -7.647 1.00 0.00 O ATOM 809 CB LEU A 50 6.483 -0.989 -4.982 1.00 0.00 C ATOM 810 CG LEU A 50 5.828 -1.503 -3.704 1.00 0.00 C ATOM 811 CD1 LEU A 50 6.698 -2.565 -3.052 1.00 0.00 C ATOM 812 CD2 LEU A 50 5.583 -0.351 -2.744 1.00 0.00 C ATOM 0 H LEU A 50 8.044 -0.802 -6.859 1.00 0.00 H new ATOM 0 HA LEU A 50 6.494 -2.968 -5.837 1.00 0.00 H new ATOM 0 HB2 LEU A 50 7.529 -0.767 -4.770 1.00 0.00 H new ATOM 0 HB3 LEU A 50 6.008 -0.048 -5.260 1.00 0.00 H new ATOM 0 HG LEU A 50 4.869 -1.955 -3.958 1.00 0.00 H new ATOM 0 HD11 LEU A 50 6.216 -2.921 -2.141 1.00 0.00 H new ATOM 0 HD12 LEU A 50 6.833 -3.399 -3.741 1.00 0.00 H new ATOM 0 HD13 LEU A 50 7.670 -2.138 -2.805 1.00 0.00 H new ATOM 0 HD21 LEU A 50 5.115 -0.728 -1.835 1.00 0.00 H new ATOM 0 HD22 LEU A 50 6.532 0.122 -2.494 1.00 0.00 H new ATOM 0 HD23 LEU A 50 4.925 0.380 -3.214 1.00 0.00 H new ATOM 824 N TRP A 51 4.192 -2.735 -6.685 1.00 0.00 N ATOM 825 CA TRP A 51 2.874 -2.714 -7.309 1.00 0.00 C ATOM 826 C TRP A 51 2.017 -1.593 -6.732 1.00 0.00 C ATOM 827 O TRP A 51 1.707 -1.592 -5.543 1.00 0.00 O ATOM 828 CB TRP A 51 2.160 -4.052 -7.097 1.00 0.00 C ATOM 829 CG TRP A 51 0.801 -4.099 -7.731 1.00 0.00 C ATOM 830 CD1 TRP A 51 0.482 -4.575 -8.970 1.00 0.00 C ATOM 831 CD2 TRP A 51 -0.423 -3.640 -7.149 1.00 0.00 C ATOM 832 NE1 TRP A 51 -0.869 -4.440 -9.192 1.00 0.00 N ATOM 833 CE2 TRP A 51 -1.445 -3.868 -8.087 1.00 0.00 C ATOM 834 CE3 TRP A 51 -0.750 -3.060 -5.922 1.00 0.00 C ATOM 835 CZ2 TRP A 51 -2.774 -3.533 -7.833 1.00 0.00 C ATOM 836 CZ3 TRP A 51 -2.064 -2.728 -5.671 1.00 0.00 C ATOM 837 CH2 TRP A 51 -3.064 -2.964 -6.622 1.00 0.00 C ATOM 0 H TRP A 51 4.355 -3.536 -6.075 1.00 0.00 H new ATOM 0 HA TRP A 51 3.015 -2.541 -8.376 1.00 0.00 H new ATOM 0 HB2 TRP A 51 2.774 -4.854 -7.507 1.00 0.00 H new ATOM 0 HB3 TRP A 51 2.063 -4.240 -6.028 1.00 0.00 H new ATOM 0 HD1 TRP A 51 1.186 -4.996 -9.672 1.00 0.00 H new ATOM 0 HE1 TRP A 51 -1.362 -4.720 -10.040 1.00 0.00 H new ATOM 0 HE3 TRP A 51 0.014 -2.874 -5.182 1.00 0.00 H new ATOM 0 HZ2 TRP A 51 -3.547 -3.716 -8.565 1.00 0.00 H new ATOM 0 HZ3 TRP A 51 -2.327 -2.278 -4.725 1.00 0.00 H new ATOM 0 HH2 TRP A 51 -4.084 -2.692 -6.396 1.00 0.00 H new ATOM 848 N ARG A 52 1.624 -0.646 -7.578 1.00 0.00 N ATOM 849 CA ARG A 52 0.790 0.466 -7.137 1.00 0.00 C ATOM 850 C ARG A 52 -0.371 0.680 -8.102 1.00 0.00 C ATOM 851 O ARG A 52 -0.196 0.617 -9.319 1.00 0.00 O ATOM 852 CB ARG A 52 1.617 1.750 -7.031 1.00 0.00 C ATOM 853 CG ARG A 52 2.960 1.562 -6.341 1.00 0.00 C ATOM 854 CD ARG A 52 4.106 2.082 -7.194 1.00 0.00 C ATOM 855 NE ARG A 52 4.015 1.619 -8.577 1.00 0.00 N ATOM 856 CZ ARG A 52 4.643 2.200 -9.598 1.00 0.00 C ATOM 857 NH1 ARG A 52 5.411 3.262 -9.395 1.00 0.00 N ATOM 858 NH2 ARG A 52 4.502 1.715 -10.824 1.00 0.00 N ATOM 0 H ARG A 52 1.868 -0.626 -8.568 1.00 0.00 H new ATOM 0 HA ARG A 52 0.391 0.220 -6.153 1.00 0.00 H new ATOM 0 HB2 ARG A 52 1.786 2.145 -8.033 1.00 0.00 H new ATOM 0 HB3 ARG A 52 1.041 2.498 -6.486 1.00 0.00 H new ATOM 0 HG2 ARG A 52 2.953 2.082 -5.383 1.00 0.00 H new ATOM 0 HG3 ARG A 52 3.115 0.504 -6.128 1.00 0.00 H new ATOM 0 HD2 ARG A 52 4.105 3.172 -7.176 1.00 0.00 H new ATOM 0 HD3 ARG A 52 5.054 1.757 -6.765 1.00 0.00 H new ATOM 0 HE ARG A 52 3.436 0.802 -8.772 1.00 0.00 H new ATOM 0 HH11 ARG A 52 5.523 3.638 -8.453 1.00 0.00 H new ATOM 0 HH12 ARG A 52 5.890 3.703 -10.180 1.00 0.00 H new ATOM 0 HH21 ARG A 52 3.913 0.898 -10.985 1.00 0.00 H new ATOM 0 HH22 ARG A 52 4.982 2.159 -11.607 1.00 0.00 H new ATOM 872 N ARG A 53 -1.558 0.938 -7.558 1.00 0.00 N ATOM 873 CA ARG A 53 -2.736 1.164 -8.392 1.00 0.00 C ATOM 874 C ARG A 53 -3.775 2.022 -7.669 1.00 0.00 C ATOM 875 O ARG A 53 -3.968 1.892 -6.463 1.00 0.00 O ATOM 876 CB ARG A 53 -3.342 -0.180 -8.837 1.00 0.00 C ATOM 877 CG ARG A 53 -4.624 -0.578 -8.113 1.00 0.00 C ATOM 878 CD ARG A 53 -5.308 -1.750 -8.800 1.00 0.00 C ATOM 879 NE ARG A 53 -5.886 -2.688 -7.840 1.00 0.00 N ATOM 880 CZ ARG A 53 -6.223 -3.940 -8.139 1.00 0.00 C ATOM 881 NH1 ARG A 53 -6.042 -4.409 -9.367 1.00 0.00 N ATOM 882 NH2 ARG A 53 -6.743 -4.726 -7.206 1.00 0.00 N ATOM 0 H ARG A 53 -1.729 0.995 -6.554 1.00 0.00 H new ATOM 0 HA ARG A 53 -2.422 1.713 -9.280 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -3.546 -0.134 -9.907 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -2.599 -0.964 -8.688 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -4.394 -0.843 -7.081 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -5.304 0.273 -8.079 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -6.092 -1.376 -9.458 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -4.587 -2.273 -9.428 1.00 0.00 H new ATOM 0 HE ARG A 53 -6.040 -2.364 -6.885 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -5.642 -3.809 -10.088 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -6.302 -5.370 -9.590 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -6.884 -4.371 -6.260 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -7.002 -5.686 -7.434 1.00 0.00 H new ATOM 896 N LEU A 54 -4.452 2.885 -8.420 1.00 0.00 N ATOM 897 CA LEU A 54 -5.481 3.748 -7.849 1.00 0.00 C ATOM 898 C LEU A 54 -6.816 3.013 -7.781 1.00 0.00 C ATOM 899 O LEU A 54 -7.221 2.354 -8.739 1.00 0.00 O ATOM 900 CB LEU A 54 -5.627 5.026 -8.677 1.00 0.00 C ATOM 901 CG LEU A 54 -4.762 6.196 -8.210 1.00 0.00 C ATOM 902 CD1 LEU A 54 -3.888 6.709 -9.344 1.00 0.00 C ATOM 903 CD2 LEU A 54 -5.630 7.316 -7.654 1.00 0.00 C ATOM 0 H LEU A 54 -4.307 3.005 -9.422 1.00 0.00 H new ATOM 0 HA LEU A 54 -5.179 4.019 -6.837 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -5.379 4.800 -9.714 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -6.672 5.336 -8.660 1.00 0.00 H new ATOM 0 HG LEU A 54 -4.110 5.839 -7.413 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -3.281 7.542 -8.988 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -3.236 5.908 -9.692 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.519 7.046 -10.166 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -4.996 8.140 -7.327 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -6.311 7.668 -8.429 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -6.206 6.943 -6.807 1.00 0.00 H new ATOM 915 N ALA A 55 -7.492 3.121 -6.643 1.00 0.00 N ATOM 916 CA ALA A 55 -8.777 2.453 -6.455 1.00 0.00 C ATOM 917 C ALA A 55 -9.941 3.338 -6.894 1.00 0.00 C ATOM 918 O ALA A 55 -9.887 4.562 -6.775 1.00 0.00 O ATOM 919 CB ALA A 55 -8.945 2.041 -4.999 1.00 0.00 C ATOM 0 H ALA A 55 -7.174 3.662 -5.839 1.00 0.00 H new ATOM 0 HA ALA A 55 -8.785 1.562 -7.083 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -9.906 1.544 -4.870 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -8.143 1.358 -4.719 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -8.906 2.926 -4.364 1.00 0.00 H new ATOM 925 N THR A 56 -10.998 2.701 -7.390 1.00 0.00 N ATOM 926 CA THR A 56 -12.189 3.417 -7.838 1.00 0.00 C ATOM 927 C THR A 56 -12.956 3.963 -6.643 1.00 0.00 C ATOM 928 O THR A 56 -12.736 3.535 -5.516 1.00 0.00 O ATOM 929 CB THR A 56 -13.093 2.485 -8.644 1.00 0.00 C ATOM 930 OG1 THR A 56 -13.803 1.612 -7.780 1.00 0.00 O ATOM 931 CG2 THR A 56 -12.340 1.632 -9.643 1.00 0.00 C ATOM 0 H THR A 56 -11.054 1.688 -7.492 1.00 0.00 H new ATOM 0 HA THR A 56 -11.875 4.247 -8.471 1.00 0.00 H new ATOM 0 HB THR A 56 -13.770 3.140 -9.193 1.00 0.00 H new ATOM 0 HG1 THR A 56 -14.379 1.023 -8.311 1.00 0.00 H new ATOM 0 HG21 THR A 56 -13.043 0.995 -10.180 1.00 0.00 H new ATOM 0 HG22 THR A 56 -11.819 2.276 -10.352 1.00 0.00 H new ATOM 0 HG23 THR A 56 -11.615 1.010 -9.117 1.00 0.00 H new ATOM 939 N VAL A 57 -13.867 4.899 -6.886 1.00 0.00 N ATOM 940 CA VAL A 57 -14.657 5.479 -5.805 1.00 0.00 C ATOM 941 C VAL A 57 -15.337 4.385 -4.990 1.00 0.00 C ATOM 942 O VAL A 57 -15.484 4.496 -3.771 1.00 0.00 O ATOM 943 CB VAL A 57 -15.730 6.442 -6.347 1.00 0.00 C ATOM 944 CG1 VAL A 57 -16.409 7.184 -5.205 1.00 0.00 C ATOM 945 CG2 VAL A 57 -15.119 7.420 -7.340 1.00 0.00 C ATOM 0 H VAL A 57 -14.076 5.270 -7.813 1.00 0.00 H new ATOM 0 HA VAL A 57 -13.971 6.038 -5.168 1.00 0.00 H new ATOM 0 HB VAL A 57 -16.486 5.856 -6.869 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -17.164 7.859 -5.608 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -16.884 6.466 -4.536 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -15.666 7.759 -4.652 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -15.893 8.092 -7.712 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -14.340 8.001 -6.846 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -14.686 6.868 -8.174 1.00 0.00 H new ATOM 955 N GLU A 58 -15.731 3.317 -5.673 1.00 0.00 N ATOM 956 CA GLU A 58 -16.378 2.189 -5.020 1.00 0.00 C ATOM 957 C GLU A 58 -15.379 1.434 -4.155 1.00 0.00 C ATOM 958 O GLU A 58 -15.625 1.185 -2.975 1.00 0.00 O ATOM 959 CB GLU A 58 -16.989 1.248 -6.060 1.00 0.00 C ATOM 960 CG GLU A 58 -18.204 1.826 -6.766 1.00 0.00 C ATOM 961 CD GLU A 58 -17.852 2.487 -8.084 1.00 0.00 C ATOM 962 OE1 GLU A 58 -17.971 1.819 -9.133 1.00 0.00 O ATOM 963 OE2 GLU A 58 -17.459 3.672 -8.068 1.00 0.00 O ATOM 0 H GLU A 58 -15.613 3.210 -6.680 1.00 0.00 H new ATOM 0 HA GLU A 58 -17.176 2.571 -4.383 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -16.231 1.001 -6.803 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -17.273 0.316 -5.572 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -18.928 1.031 -6.944 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -18.685 2.556 -6.115 1.00 0.00 H new ATOM 970 N GLU A 59 -14.241 1.082 -4.749 1.00 0.00 N ATOM 971 CA GLU A 59 -13.199 0.365 -4.027 1.00 0.00 C ATOM 972 C GLU A 59 -12.735 1.170 -2.818 1.00 0.00 C ATOM 973 O GLU A 59 -12.526 0.623 -1.738 1.00 0.00 O ATOM 974 CB GLU A 59 -12.013 0.075 -4.949 1.00 0.00 C ATOM 975 CG GLU A 59 -12.284 -1.028 -5.960 1.00 0.00 C ATOM 976 CD GLU A 59 -11.415 -0.910 -7.196 1.00 0.00 C ATOM 977 OE1 GLU A 59 -10.365 -0.238 -7.121 1.00 0.00 O ATOM 978 OE2 GLU A 59 -11.785 -1.490 -8.238 1.00 0.00 O ATOM 0 H GLU A 59 -14.020 1.282 -5.724 1.00 0.00 H new ATOM 0 HA GLU A 59 -13.614 -0.581 -3.679 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -11.746 0.988 -5.482 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -11.151 -0.203 -4.342 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -12.112 -1.997 -5.491 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -13.333 -0.997 -6.253 1.00 0.00 H new ATOM 985 N ARG A 60 -12.588 2.478 -3.010 1.00 0.00 N ATOM 986 CA ARG A 60 -12.160 3.364 -1.935 1.00 0.00 C ATOM 987 C ARG A 60 -13.170 3.336 -0.799 1.00 0.00 C ATOM 988 O ARG A 60 -12.798 3.271 0.372 1.00 0.00 O ATOM 989 CB ARG A 60 -11.976 4.791 -2.456 1.00 0.00 C ATOM 990 CG ARG A 60 -11.104 4.872 -3.695 1.00 0.00 C ATOM 991 CD ARG A 60 -11.416 6.109 -4.518 1.00 0.00 C ATOM 992 NE ARG A 60 -10.207 6.695 -5.083 1.00 0.00 N ATOM 993 CZ ARG A 60 -10.185 7.432 -6.191 1.00 0.00 C ATOM 994 NH1 ARG A 60 -11.311 7.714 -6.836 1.00 0.00 N ATOM 995 NH2 ARG A 60 -9.032 7.894 -6.655 1.00 0.00 N ATOM 0 H ARG A 60 -12.759 2.946 -3.900 1.00 0.00 H new ATOM 0 HA ARG A 60 -11.200 3.013 -1.556 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -12.954 5.217 -2.680 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -11.535 5.403 -1.669 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -10.054 4.885 -3.402 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -11.254 3.981 -4.305 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -12.105 5.848 -5.322 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -11.920 6.846 -3.892 1.00 0.00 H new ATOM 0 HE ARG A 60 -9.324 6.530 -4.600 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -12.202 7.365 -6.483 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -11.285 8.280 -7.684 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -8.163 7.684 -6.163 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -9.014 8.459 -7.504 1.00 0.00 H new ATOM 1009 N LYS A 61 -14.455 3.357 -1.148 1.00 0.00 N ATOM 1010 CA LYS A 61 -15.506 3.303 -0.142 1.00 0.00 C ATOM 1011 C LYS A 61 -15.341 2.036 0.691 1.00 0.00 C ATOM 1012 O LYS A 61 -15.439 2.066 1.918 1.00 0.00 O ATOM 1013 CB LYS A 61 -16.886 3.331 -0.803 1.00 0.00 C ATOM 1014 CG LYS A 61 -17.711 4.555 -0.436 1.00 0.00 C ATOM 1015 CD LYS A 61 -17.695 5.594 -1.547 1.00 0.00 C ATOM 1016 CE LYS A 61 -19.068 6.215 -1.747 1.00 0.00 C ATOM 1017 NZ LYS A 61 -18.976 7.635 -2.189 1.00 0.00 N ATOM 0 H LYS A 61 -14.788 3.411 -2.111 1.00 0.00 H new ATOM 0 HA LYS A 61 -15.425 4.175 0.507 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -16.762 3.298 -1.885 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -17.435 2.434 -0.517 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -18.739 4.254 -0.233 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -17.321 4.996 0.481 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -16.973 6.374 -1.307 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -17.365 5.130 -2.476 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -19.622 5.639 -2.488 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -19.630 6.161 -0.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -19.933 8.022 -2.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -18.469 8.190 -1.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -18.462 7.685 -3.091 1.00 0.00 H new ATOM 1031 N LYS A 62 -15.064 0.930 0.006 1.00 0.00 N ATOM 1032 CA LYS A 62 -14.852 -0.349 0.670 1.00 0.00 C ATOM 1033 C LYS A 62 -13.561 -0.313 1.481 1.00 0.00 C ATOM 1034 O LYS A 62 -13.465 -0.920 2.547 1.00 0.00 O ATOM 1035 CB LYS A 62 -14.788 -1.481 -0.358 1.00 0.00 C ATOM 1036 CG LYS A 62 -15.942 -1.474 -1.347 1.00 0.00 C ATOM 1037 CD LYS A 62 -17.193 -2.094 -0.747 1.00 0.00 C ATOM 1038 CE LYS A 62 -17.220 -3.599 -0.950 1.00 0.00 C ATOM 1039 NZ LYS A 62 -18.499 -4.201 -0.478 1.00 0.00 N ATOM 0 H LYS A 62 -14.981 0.896 -1.010 1.00 0.00 H new ATOM 0 HA LYS A 62 -15.690 -0.532 1.342 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -13.850 -1.408 -0.908 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -14.777 -2.436 0.167 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -16.153 -0.450 -1.654 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -15.657 -2.023 -2.244 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -17.237 -1.869 0.319 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -18.076 -1.648 -1.204 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -17.081 -3.825 -2.007 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -16.386 -4.053 -0.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -18.477 -5.229 -0.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -18.620 -4.007 0.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -19.293 -3.787 -1.007 1.00 0.00 H new ATOM 1053 N ILE A 63 -12.568 0.408 0.961 1.00 0.00 N ATOM 1054 CA ILE A 63 -11.278 0.531 1.629 1.00 0.00 C ATOM 1055 C ILE A 63 -11.440 1.148 3.016 1.00 0.00 C ATOM 1056 O ILE A 63 -10.890 0.649 3.996 1.00 0.00 O ATOM 1057 CB ILE A 63 -10.293 1.381 0.793 1.00 0.00 C ATOM 1058 CG1 ILE A 63 -9.824 0.593 -0.430 1.00 0.00 C ATOM 1059 CG2 ILE A 63 -9.095 1.814 1.632 1.00 0.00 C ATOM 1060 CD1 ILE A 63 -9.294 1.465 -1.547 1.00 0.00 C ATOM 0 H ILE A 63 -12.635 0.915 0.079 1.00 0.00 H new ATOM 0 HA ILE A 63 -10.869 -0.474 1.733 1.00 0.00 H new ATOM 0 HB ILE A 63 -10.816 2.278 0.460 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -9.045 -0.105 -0.125 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -10.655 -0.002 -0.808 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -8.418 2.410 1.020 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -9.439 2.410 2.478 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -8.570 0.932 1.999 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -8.980 0.837 -2.381 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -10.077 2.146 -1.880 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -8.442 2.041 -1.186 1.00 0.00 H new ATOM 1072 N VAL A 64 -12.194 2.237 3.089 1.00 0.00 N ATOM 1073 CA VAL A 64 -12.423 2.923 4.354 1.00 0.00 C ATOM 1074 C VAL A 64 -13.104 2.011 5.374 1.00 0.00 C ATOM 1075 O VAL A 64 -12.675 1.921 6.523 1.00 0.00 O ATOM 1076 CB VAL A 64 -13.285 4.186 4.153 1.00 0.00 C ATOM 1077 CG1 VAL A 64 -13.448 4.941 5.465 1.00 0.00 C ATOM 1078 CG2 VAL A 64 -12.674 5.082 3.087 1.00 0.00 C ATOM 0 H VAL A 64 -12.657 2.664 2.287 1.00 0.00 H new ATOM 0 HA VAL A 64 -11.444 3.210 4.737 1.00 0.00 H new ATOM 0 HB VAL A 64 -14.274 3.877 3.816 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -14.059 5.828 5.301 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -13.934 4.296 6.198 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -12.468 5.239 5.837 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -13.295 5.969 2.958 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -11.672 5.382 3.394 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -12.617 4.538 2.144 1.00 0.00 H new ATOM 1088 N ALA A 65 -14.175 1.349 4.949 1.00 0.00 N ATOM 1089 CA ALA A 65 -14.925 0.458 5.829 1.00 0.00 C ATOM 1090 C ALA A 65 -14.164 -0.834 6.125 1.00 0.00 C ATOM 1091 O ALA A 65 -14.116 -1.286 7.268 1.00 0.00 O ATOM 1092 CB ALA A 65 -16.280 0.139 5.217 1.00 0.00 C ATOM 0 H ALA A 65 -14.544 1.412 4.000 1.00 0.00 H new ATOM 0 HA ALA A 65 -15.066 0.977 6.777 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -16.832 -0.526 5.881 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -16.843 1.062 5.078 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -16.138 -0.348 4.252 1.00 0.00 H new ATOM 1098 N SER A 66 -13.587 -1.435 5.088 1.00 0.00 N ATOM 1099 CA SER A 66 -12.851 -2.686 5.243 1.00 0.00 C ATOM 1100 C SER A 66 -11.495 -2.471 5.911 1.00 0.00 C ATOM 1101 O SER A 66 -11.157 -3.154 6.878 1.00 0.00 O ATOM 1102 CB SER A 66 -12.656 -3.354 3.881 1.00 0.00 C ATOM 1103 OG SER A 66 -13.894 -3.775 3.336 1.00 0.00 O ATOM 0 H SER A 66 -13.615 -1.077 4.133 1.00 0.00 H new ATOM 0 HA SER A 66 -13.442 -3.335 5.889 1.00 0.00 H new ATOM 0 HB2 SER A 66 -12.173 -2.657 3.197 1.00 0.00 H new ATOM 0 HB3 SER A 66 -11.991 -4.211 3.985 1.00 0.00 H new ATOM 0 HG SER A 66 -14.310 -3.030 2.854 1.00 0.00 H new ATOM 1109 N SER A 67 -10.717 -1.532 5.386 1.00 0.00 N ATOM 1110 CA SER A 67 -9.394 -1.247 5.931 1.00 0.00 C ATOM 1111 C SER A 67 -9.483 -0.558 7.288 1.00 0.00 C ATOM 1112 O SER A 67 -8.820 -0.960 8.244 1.00 0.00 O ATOM 1113 CB SER A 67 -8.596 -0.371 4.965 1.00 0.00 C ATOM 1114 OG SER A 67 -7.209 -0.430 5.250 1.00 0.00 O ATOM 0 H SER A 67 -10.978 -0.956 4.586 1.00 0.00 H new ATOM 0 HA SER A 67 -8.884 -2.201 6.064 1.00 0.00 H new ATOM 0 HB2 SER A 67 -8.774 -0.698 3.941 1.00 0.00 H new ATOM 0 HB3 SER A 67 -8.941 0.661 5.035 1.00 0.00 H new ATOM 0 HG SER A 67 -6.940 -1.364 5.375 1.00 0.00 H new ATOM 1120 N HIS A 68 -10.294 0.490 7.363 1.00 0.00 N ATOM 1121 CA HIS A 68 -10.452 1.241 8.600 1.00 0.00 C ATOM 1122 C HIS A 68 -11.780 0.934 9.276 1.00 0.00 C ATOM 1123 O HIS A 68 -12.762 0.590 8.619 1.00 0.00 O ATOM 1124 CB HIS A 68 -10.338 2.737 8.317 1.00 0.00 C ATOM 1125 CG HIS A 68 -9.101 3.091 7.561 1.00 0.00 C ATOM 1126 ND1 HIS A 68 -9.111 3.809 6.386 1.00 0.00 N ATOM 1127 CD2 HIS A 68 -7.804 2.805 7.815 1.00 0.00 C ATOM 1128 CE1 HIS A 68 -7.873 3.950 5.948 1.00 0.00 C ATOM 1129 NE2 HIS A 68 -7.058 3.351 6.799 1.00 0.00 N ATOM 0 H HIS A 68 -10.851 0.838 6.583 1.00 0.00 H new ATOM 0 HA HIS A 68 -9.657 0.939 9.281 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -11.210 3.062 7.750 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -10.350 3.282 9.261 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -9.944 4.175 5.926 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -7.425 2.250 8.660 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -7.577 4.467 5.047 1.00 0.00 H new ATOM 1138 N GLY A 69 -11.797 1.065 10.596 1.00 0.00 N ATOM 1139 CA GLY A 69 -13.004 0.801 11.352 1.00 0.00 C ATOM 1140 C GLY A 69 -12.763 -0.138 12.517 1.00 0.00 C ATOM 1141 O GLY A 69 -13.268 0.083 13.617 1.00 0.00 O ATOM 0 H GLY A 69 -10.994 1.350 11.157 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -13.409 1.742 11.725 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -13.756 0.370 10.691 1.00 0.00 H new ATOM 1145 N LYS A 70 -11.987 -1.190 12.273 1.00 0.00 N ATOM 1146 CA LYS A 70 -11.677 -2.168 13.310 1.00 0.00 C ATOM 1147 C LYS A 70 -10.188 -2.150 13.646 1.00 0.00 C ATOM 1148 O LYS A 70 -9.799 -2.350 14.796 1.00 0.00 O ATOM 1149 CB LYS A 70 -12.094 -3.569 12.858 1.00 0.00 C ATOM 1150 CG LYS A 70 -13.439 -4.010 13.411 1.00 0.00 C ATOM 1151 CD LYS A 70 -14.558 -3.773 12.410 1.00 0.00 C ATOM 1152 CE LYS A 70 -15.702 -4.752 12.610 1.00 0.00 C ATOM 1153 NZ LYS A 70 -16.649 -4.294 13.664 1.00 0.00 N ATOM 0 H LYS A 70 -11.562 -1.387 11.367 1.00 0.00 H new ATOM 0 HA LYS A 70 -12.236 -1.902 14.207 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -12.132 -3.594 11.769 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -11.331 -4.284 13.167 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -13.398 -5.068 13.669 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -13.651 -3.466 14.331 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -14.929 -2.753 12.512 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -14.168 -3.870 11.397 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -16.239 -4.879 11.670 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -15.301 -5.728 12.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -17.415 -4.990 13.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -16.143 -4.197 14.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -17.052 -3.374 13.393 1.00 0.00 H new ATOM 1167 N LYS A 71 -9.362 -1.909 12.633 1.00 0.00 N ATOM 1168 CA LYS A 71 -7.917 -1.863 12.819 1.00 0.00 C ATOM 1169 C LYS A 71 -7.402 -0.429 12.746 1.00 0.00 C ATOM 1170 O LYS A 71 -8.034 0.437 12.141 1.00 0.00 O ATOM 1171 CB LYS A 71 -7.218 -2.722 11.763 1.00 0.00 C ATOM 1172 CG LYS A 71 -7.512 -2.287 10.335 1.00 0.00 C ATOM 1173 CD LYS A 71 -7.968 -3.455 9.475 1.00 0.00 C ATOM 1174 CE LYS A 71 -6.832 -3.993 8.620 1.00 0.00 C ATOM 1175 NZ LYS A 71 -6.151 -5.149 9.265 1.00 0.00 N ATOM 0 H LYS A 71 -9.669 -1.743 11.675 1.00 0.00 H new ATOM 0 HA LYS A 71 -7.692 -2.260 13.809 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -6.142 -2.686 11.931 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -7.526 -3.760 11.889 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -8.283 -1.516 10.341 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -6.618 -1.841 9.899 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -8.353 -4.250 10.114 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -8.789 -3.137 8.833 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -7.221 -4.297 7.648 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -6.107 -3.200 8.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -5.194 -5.251 8.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -6.089 -4.987 10.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -6.694 -6.017 9.084 1.00 0.00 H new ATOM 1189 N THR A 72 -6.252 -0.186 13.366 1.00 0.00 N ATOM 1190 CA THR A 72 -5.651 1.143 13.370 1.00 0.00 C ATOM 1191 C THR A 72 -6.586 2.160 14.019 1.00 0.00 C ATOM 1192 O THR A 72 -7.622 2.514 13.455 1.00 0.00 O ATOM 1193 CB THR A 72 -5.315 1.578 11.944 1.00 0.00 C ATOM 1194 OG1 THR A 72 -4.516 0.604 11.297 1.00 0.00 O ATOM 1195 CG2 THR A 72 -4.573 2.896 11.880 1.00 0.00 C ATOM 0 H THR A 72 -5.717 -0.892 13.872 1.00 0.00 H new ATOM 0 HA THR A 72 -4.731 1.098 13.953 1.00 0.00 H new ATOM 0 HB THR A 72 -6.276 1.695 11.444 1.00 0.00 H new ATOM 0 HG1 THR A 72 -3.736 1.037 10.892 1.00 0.00 H new ATOM 0 HG21 THR A 72 -4.365 3.146 10.840 1.00 0.00 H new ATOM 0 HG22 THR A 72 -5.185 3.680 12.327 1.00 0.00 H new ATOM 0 HG23 THR A 72 -3.634 2.812 12.427 1.00 0.00 H new ATOM 1203 N LYS A 73 -6.212 2.628 15.205 1.00 0.00 N ATOM 1204 CA LYS A 73 -7.017 3.604 15.930 1.00 0.00 C ATOM 1205 C LYS A 73 -6.132 4.514 16.780 1.00 0.00 C ATOM 1206 O LYS A 73 -6.060 4.362 17.999 1.00 0.00 O ATOM 1207 CB LYS A 73 -8.044 2.893 16.815 1.00 0.00 C ATOM 1208 CG LYS A 73 -9.455 2.917 16.249 1.00 0.00 C ATOM 1209 CD LYS A 73 -10.324 1.837 16.873 1.00 0.00 C ATOM 1210 CE LYS A 73 -11.701 2.367 17.235 1.00 0.00 C ATOM 1211 NZ LYS A 73 -12.185 1.818 18.531 1.00 0.00 N ATOM 0 H LYS A 73 -5.357 2.347 15.684 1.00 0.00 H new ATOM 0 HA LYS A 73 -7.544 4.220 15.201 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -7.735 1.857 16.955 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -8.048 3.360 17.800 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -9.903 3.894 16.428 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -9.417 2.776 15.169 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -10.425 1.004 16.178 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -9.836 1.448 17.767 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -11.668 3.455 17.292 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -12.408 2.110 16.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -13.127 2.204 18.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -12.242 0.781 18.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -11.525 2.084 19.289 1.00 0.00 H new ATOM 1225 N PRO A 74 -5.446 5.480 16.143 1.00 0.00 N ATOM 1226 CA PRO A 74 -4.565 6.416 16.848 1.00 0.00 C ATOM 1227 C PRO A 74 -5.273 7.119 18.001 1.00 0.00 C ATOM 1228 O PRO A 74 -5.884 8.172 17.817 1.00 0.00 O ATOM 1229 CB PRO A 74 -4.176 7.426 15.765 1.00 0.00 C ATOM 1230 CG PRO A 74 -4.331 6.686 14.482 1.00 0.00 C ATOM 1231 CD PRO A 74 -5.475 5.733 14.691 1.00 0.00 C ATOM 0 HA PRO A 74 -3.713 5.910 17.302 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -4.819 8.305 15.795 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -3.152 7.775 15.899 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -4.538 7.370 13.659 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -3.417 6.149 14.228 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -6.424 6.169 14.378 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -5.342 4.814 14.120 1.00 0.00 H new ATOM 1239 N ASN A 75 -5.189 6.529 19.189 1.00 0.00 N ATOM 1240 CA ASN A 75 -5.823 7.098 20.375 1.00 0.00 C ATOM 1241 C ASN A 75 -7.344 7.092 20.234 1.00 0.00 C ATOM 1242 O ASN A 75 -8.027 6.244 20.808 1.00 0.00 O ATOM 1243 CB ASN A 75 -5.322 8.524 20.618 1.00 0.00 C ATOM 1244 CG ASN A 75 -4.382 8.613 21.803 1.00 0.00 C ATOM 1245 OD1 ASN A 75 -3.403 7.872 21.891 1.00 0.00 O ATOM 1246 ND2 ASN A 75 -4.677 9.521 22.726 1.00 0.00 N ATOM 0 H ASN A 75 -4.688 5.657 19.357 1.00 0.00 H new ATOM 0 HA ASN A 75 -5.554 6.480 21.232 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -4.811 8.884 19.725 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -6.175 9.182 20.784 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -4.082 9.625 23.548 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -5.499 10.115 22.613 1.00 0.00 H new ATOM 1253 N THR A 76 -7.866 8.043 19.467 1.00 0.00 N ATOM 1254 CA THR A 76 -9.305 8.147 19.251 1.00 0.00 C ATOM 1255 C THR A 76 -9.617 8.425 17.784 1.00 0.00 C ATOM 1256 O THR A 76 -8.711 8.621 16.973 1.00 0.00 O ATOM 1257 CB THR A 76 -9.895 9.252 20.129 1.00 0.00 C ATOM 1258 OG1 THR A 76 -9.186 10.465 19.950 1.00 0.00 O ATOM 1259 CG2 THR A 76 -9.873 8.920 21.605 1.00 0.00 C ATOM 0 H THR A 76 -7.315 8.753 18.985 1.00 0.00 H new ATOM 0 HA THR A 76 -9.758 7.194 19.525 1.00 0.00 H new ATOM 0 HB THR A 76 -10.933 9.350 19.812 1.00 0.00 H new ATOM 0 HG1 THR A 76 -9.579 11.160 20.518 1.00 0.00 H new ATOM 0 HG21 THR A 76 -10.306 9.746 22.170 1.00 0.00 H new ATOM 0 HG22 THR A 76 -10.454 8.015 21.783 1.00 0.00 H new ATOM 0 HG23 THR A 76 -8.844 8.760 21.927 1.00 0.00 H new ATOM 1267 N LYS A 77 -10.902 8.440 17.450 1.00 0.00 N ATOM 1268 CA LYS A 77 -11.333 8.695 16.081 1.00 0.00 C ATOM 1269 C LYS A 77 -10.774 7.643 15.130 1.00 0.00 C ATOM 1270 O LYS A 77 -10.067 6.727 15.548 1.00 0.00 O ATOM 1271 CB LYS A 77 -10.888 10.089 15.634 1.00 0.00 C ATOM 1272 CG LYS A 77 -11.894 11.182 15.954 1.00 0.00 C ATOM 1273 CD LYS A 77 -11.553 11.888 17.258 1.00 0.00 C ATOM 1274 CE LYS A 77 -11.696 13.397 17.128 1.00 0.00 C ATOM 1275 NZ LYS A 77 -10.388 14.056 16.858 1.00 0.00 N ATOM 0 H LYS A 77 -11.664 8.279 18.109 1.00 0.00 H new ATOM 0 HA LYS A 77 -12.421 8.642 16.055 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -9.939 10.329 16.113 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -10.708 10.076 14.559 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -11.916 11.908 15.141 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -12.893 10.750 16.023 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -12.208 11.526 18.051 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -10.532 11.642 17.550 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -12.392 13.628 16.322 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -12.124 13.802 18.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -10.527 15.083 16.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -9.731 13.857 17.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -9.991 13.689 15.970 1.00 0.00 H new ATOM 1289 N ASP A 78 -11.097 7.780 13.847 1.00 0.00 N ATOM 1290 CA ASP A 78 -10.628 6.841 12.835 1.00 0.00 C ATOM 1291 C ASP A 78 -9.840 7.564 11.747 1.00 0.00 C ATOM 1292 O ASP A 78 -8.792 7.089 11.306 1.00 0.00 O ATOM 1293 CB ASP A 78 -11.810 6.095 12.214 1.00 0.00 C ATOM 1294 CG ASP A 78 -11.443 4.690 11.780 1.00 0.00 C ATOM 1295 OD1 ASP A 78 -10.442 4.151 12.298 1.00 0.00 O ATOM 1296 OD2 ASP A 78 -12.156 4.128 10.922 1.00 0.00 O ATOM 0 H ASP A 78 -11.682 8.533 13.484 1.00 0.00 H new ATOM 0 HA ASP A 78 -9.968 6.122 13.320 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -12.626 6.048 12.935 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -12.177 6.654 11.353 1.00 0.00 H new ATOM 1301 N HIS A 79 -10.349 8.715 11.320 1.00 0.00 N ATOM 1302 CA HIS A 79 -9.693 9.503 10.283 1.00 0.00 C ATOM 1303 C HIS A 79 -9.583 8.710 8.985 1.00 0.00 C ATOM 1304 O HIS A 79 -9.750 7.491 8.975 1.00 0.00 O ATOM 1305 CB HIS A 79 -8.301 9.938 10.747 1.00 0.00 C ATOM 1306 CG HIS A 79 -8.320 10.806 11.966 1.00 0.00 C ATOM 1307 ND1 HIS A 79 -7.257 10.900 12.841 1.00 0.00 N ATOM 1308 CD2 HIS A 79 -9.281 11.625 12.457 1.00 0.00 C ATOM 1309 CE1 HIS A 79 -7.565 11.737 13.816 1.00 0.00 C ATOM 1310 NE2 HIS A 79 -8.786 12.191 13.606 1.00 0.00 N ATOM 0 H HIS A 79 -11.214 9.123 11.676 1.00 0.00 H new ATOM 0 HA HIS A 79 -10.300 10.389 10.097 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -7.702 9.051 10.952 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -7.808 10.475 9.936 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -10.255 11.800 12.025 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -6.926 12.004 14.644 1.00 0.00 H new ATOM 0 HE2 HIS A 79 -9.282 12.855 14.201 1.00 0.00 H new ATOM 1319 N GLY A 80 -9.301 9.411 7.892 1.00 0.00 N ATOM 1320 CA GLY A 80 -9.174 8.757 6.603 1.00 0.00 C ATOM 1321 C GLY A 80 -10.517 8.407 5.994 1.00 0.00 C ATOM 1322 O GLY A 80 -10.832 7.234 5.800 1.00 0.00 O ATOM 0 H GLY A 80 -9.158 10.421 7.876 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -8.628 9.409 5.921 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -8.583 7.848 6.717 1.00 0.00 H new ATOM 1326 N TYR A 81 -11.310 9.430 5.690 1.00 0.00 N ATOM 1327 CA TYR A 81 -12.627 9.225 5.098 1.00 0.00 C ATOM 1328 C TYR A 81 -13.040 10.426 4.255 1.00 0.00 C ATOM 1329 O TYR A 81 -13.522 10.275 3.132 1.00 0.00 O ATOM 1330 CB TYR A 81 -13.668 8.970 6.190 1.00 0.00 C ATOM 1331 CG TYR A 81 -13.645 9.998 7.300 1.00 0.00 C ATOM 1332 CD1 TYR A 81 -12.883 9.796 8.444 1.00 0.00 C ATOM 1333 CD2 TYR A 81 -14.386 11.168 7.203 1.00 0.00 C ATOM 1334 CE1 TYR A 81 -12.862 10.731 9.460 1.00 0.00 C ATOM 1335 CE2 TYR A 81 -14.369 12.109 8.215 1.00 0.00 C ATOM 1336 CZ TYR A 81 -13.605 11.887 9.340 1.00 0.00 C ATOM 1337 OH TYR A 81 -13.585 12.821 10.350 1.00 0.00 O ATOM 0 H TYR A 81 -11.064 10.408 5.844 1.00 0.00 H new ATOM 0 HA TYR A 81 -12.572 8.352 4.448 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -14.660 8.957 5.739 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -13.499 7.982 6.618 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -12.298 8.893 8.540 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -14.985 11.346 6.322 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -12.267 10.558 10.344 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -14.952 13.014 8.125 1.00 0.00 H new ATOM 0 HH TYR A 81 -14.161 13.576 10.108 1.00 0.00 H new ATOM 1347 N THR A 82 -12.845 11.618 4.805 1.00 0.00 N ATOM 1348 CA THR A 82 -13.195 12.849 4.107 1.00 0.00 C ATOM 1349 C THR A 82 -12.232 13.112 2.954 1.00 0.00 C ATOM 1350 O THR A 82 -12.627 13.621 1.904 1.00 0.00 O ATOM 1351 CB THR A 82 -13.182 14.032 5.077 1.00 0.00 C ATOM 1352 OG1 THR A 82 -12.278 13.796 6.143 1.00 0.00 O ATOM 1353 CG2 THR A 82 -14.537 14.324 5.682 1.00 0.00 C ATOM 0 H THR A 82 -12.446 11.759 5.733 1.00 0.00 H new ATOM 0 HA THR A 82 -14.199 12.733 3.700 1.00 0.00 H new ATOM 0 HB THR A 82 -12.875 14.891 4.481 1.00 0.00 H new ATOM 0 HG1 THR A 82 -12.734 13.301 6.855 1.00 0.00 H new ATOM 0 HG21 THR A 82 -14.457 15.174 6.360 1.00 0.00 H new ATOM 0 HG22 THR A 82 -15.247 14.558 4.889 1.00 0.00 H new ATOM 0 HG23 THR A 82 -14.885 13.451 6.234 1.00 0.00 H new ATOM 1361 N THR A 83 -10.967 12.762 3.157 1.00 0.00 N ATOM 1362 CA THR A 83 -9.944 12.959 2.135 1.00 0.00 C ATOM 1363 C THR A 83 -9.388 11.624 1.638 1.00 0.00 C ATOM 1364 O THR A 83 -8.697 11.574 0.621 1.00 0.00 O ATOM 1365 CB THR A 83 -8.808 13.822 2.686 1.00 0.00 C ATOM 1366 OG1 THR A 83 -9.299 14.751 3.636 1.00 0.00 O ATOM 1367 CG2 THR A 83 -8.078 14.604 1.615 1.00 0.00 C ATOM 0 H THR A 83 -10.624 12.340 4.020 1.00 0.00 H new ATOM 0 HA THR A 83 -10.409 13.468 1.291 1.00 0.00 H new ATOM 0 HB THR A 83 -8.109 13.122 3.143 1.00 0.00 H new ATOM 0 HG1 THR A 83 -8.557 15.292 3.978 1.00 0.00 H new ATOM 0 HG21 THR A 83 -7.285 15.195 2.073 1.00 0.00 H new ATOM 0 HG22 THR A 83 -7.645 13.913 0.892 1.00 0.00 H new ATOM 0 HG23 THR A 83 -8.778 15.268 1.108 1.00 0.00 H new ATOM 1375 N LEU A 84 -9.690 10.546 2.359 1.00 0.00 N ATOM 1376 CA LEU A 84 -9.215 9.222 1.988 1.00 0.00 C ATOM 1377 C LEU A 84 -10.136 8.559 0.963 1.00 0.00 C ATOM 1378 O LEU A 84 -9.976 7.381 0.648 1.00 0.00 O ATOM 1379 CB LEU A 84 -9.097 8.334 3.228 1.00 0.00 C ATOM 1380 CG LEU A 84 -8.313 7.035 3.022 1.00 0.00 C ATOM 1381 CD1 LEU A 84 -7.195 6.915 4.046 1.00 0.00 C ATOM 1382 CD2 LEU A 84 -9.241 5.831 3.100 1.00 0.00 C ATOM 0 H LEU A 84 -10.262 10.567 3.203 1.00 0.00 H new ATOM 0 HA LEU A 84 -8.232 9.342 1.532 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -8.619 8.907 4.022 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -10.100 8.084 3.574 1.00 0.00 H new ATOM 0 HG LEU A 84 -7.866 7.060 2.028 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -6.650 5.985 3.882 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -6.513 7.759 3.941 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -7.620 6.915 5.050 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -8.665 4.918 2.951 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -9.719 5.803 4.079 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -10.004 5.909 2.326 1.00 0.00 H new ATOM 1394 N ALA A 85 -11.099 9.317 0.442 1.00 0.00 N ATOM 1395 CA ALA A 85 -12.033 8.788 -0.545 1.00 0.00 C ATOM 1396 C ALA A 85 -11.806 9.422 -1.914 1.00 0.00 C ATOM 1397 O ALA A 85 -12.159 8.843 -2.941 1.00 0.00 O ATOM 1398 CB ALA A 85 -13.466 9.010 -0.087 1.00 0.00 C ATOM 0 H ALA A 85 -11.251 10.295 0.687 1.00 0.00 H new ATOM 0 HA ALA A 85 -11.856 7.717 -0.639 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -14.153 8.610 -0.833 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -13.627 8.501 0.864 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -13.647 10.078 0.037 1.00 0.00 H new ATOM 1404 N THR A 86 -11.215 10.614 -1.924 1.00 0.00 N ATOM 1405 CA THR A 86 -10.942 11.320 -3.170 1.00 0.00 C ATOM 1406 C THR A 86 -9.808 10.648 -3.936 1.00 0.00 C ATOM 1407 O THR A 86 -9.795 10.640 -5.167 1.00 0.00 O ATOM 1408 CB THR A 86 -10.588 12.781 -2.887 1.00 0.00 C ATOM 1409 OG1 THR A 86 -10.258 13.458 -4.087 1.00 0.00 O ATOM 1410 CG2 THR A 86 -9.423 12.939 -1.935 1.00 0.00 C ATOM 0 H THR A 86 -10.917 11.110 -1.084 1.00 0.00 H new ATOM 0 HA THR A 86 -11.842 11.286 -3.784 1.00 0.00 H new ATOM 0 HB THR A 86 -11.476 13.210 -2.423 1.00 0.00 H new ATOM 0 HG1 THR A 86 -10.036 14.391 -3.886 1.00 0.00 H new ATOM 0 HG21 THR A 86 -9.224 13.999 -1.777 1.00 0.00 H new ATOM 0 HG22 THR A 86 -9.666 12.469 -0.982 1.00 0.00 H new ATOM 0 HG23 THR A 86 -8.539 12.463 -2.360 1.00 0.00 H new ATOM 1418 N SER A 87 -8.856 10.084 -3.199 1.00 0.00 N ATOM 1419 CA SER A 87 -7.717 9.408 -3.808 1.00 0.00 C ATOM 1420 C SER A 87 -7.148 8.347 -2.871 1.00 0.00 C ATOM 1421 O SER A 87 -6.722 8.653 -1.757 1.00 0.00 O ATOM 1422 CB SER A 87 -6.629 10.419 -4.173 1.00 0.00 C ATOM 1423 OG SER A 87 -5.932 10.858 -3.021 1.00 0.00 O ATOM 0 H SER A 87 -8.851 10.082 -2.179 1.00 0.00 H new ATOM 0 HA SER A 87 -8.064 8.916 -4.717 1.00 0.00 H new ATOM 0 HB2 SER A 87 -5.929 9.966 -4.875 1.00 0.00 H new ATOM 0 HB3 SER A 87 -7.078 11.274 -4.678 1.00 0.00 H new ATOM 0 HG SER A 87 -6.226 10.339 -2.243 1.00 0.00 H new ATOM 1429 N VAL A 88 -7.145 7.100 -3.329 1.00 0.00 N ATOM 1430 CA VAL A 88 -6.628 5.993 -2.533 1.00 0.00 C ATOM 1431 C VAL A 88 -5.640 5.155 -3.336 1.00 0.00 C ATOM 1432 O VAL A 88 -5.989 4.588 -4.374 1.00 0.00 O ATOM 1433 CB VAL A 88 -7.764 5.082 -2.029 1.00 0.00 C ATOM 1434 CG1 VAL A 88 -7.228 4.041 -1.057 1.00 0.00 C ATOM 1435 CG2 VAL A 88 -8.862 5.909 -1.380 1.00 0.00 C ATOM 0 H VAL A 88 -7.495 6.830 -4.248 1.00 0.00 H new ATOM 0 HA VAL A 88 -6.118 6.432 -1.676 1.00 0.00 H new ATOM 0 HB VAL A 88 -8.190 4.559 -2.885 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -8.047 3.408 -0.713 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -6.480 3.426 -1.558 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -6.773 4.541 -0.202 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -9.656 5.249 -1.030 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -8.450 6.461 -0.535 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -9.268 6.610 -2.109 1.00 0.00 H new ATOM 1445 N THR A 89 -4.407 5.078 -2.847 1.00 0.00 N ATOM 1446 CA THR A 89 -3.367 4.305 -3.514 1.00 0.00 C ATOM 1447 C THR A 89 -3.322 2.884 -2.967 1.00 0.00 C ATOM 1448 O THR A 89 -3.311 2.676 -1.754 1.00 0.00 O ATOM 1449 CB THR A 89 -2.006 4.978 -3.334 1.00 0.00 C ATOM 1450 OG1 THR A 89 -1.909 5.580 -2.055 1.00 0.00 O ATOM 1451 CG2 THR A 89 -1.726 6.047 -4.367 1.00 0.00 C ATOM 0 H THR A 89 -4.104 5.542 -1.991 1.00 0.00 H new ATOM 0 HA THR A 89 -3.602 4.262 -4.578 1.00 0.00 H new ATOM 0 HB THR A 89 -1.272 4.181 -3.452 1.00 0.00 H new ATOM 0 HG1 THR A 89 -1.031 6.004 -1.959 1.00 0.00 H new ATOM 0 HG21 THR A 89 -0.745 6.484 -4.182 1.00 0.00 H new ATOM 0 HG22 THR A 89 -1.744 5.604 -5.363 1.00 0.00 H new ATOM 0 HG23 THR A 89 -2.487 6.824 -4.302 1.00 0.00 H new ATOM 1459 N LEU A 90 -3.303 1.907 -3.865 1.00 0.00 N ATOM 1460 CA LEU A 90 -3.268 0.507 -3.467 1.00 0.00 C ATOM 1461 C LEU A 90 -1.881 -0.095 -3.663 1.00 0.00 C ATOM 1462 O LEU A 90 -1.177 0.232 -4.621 1.00 0.00 O ATOM 1463 CB LEU A 90 -4.301 -0.293 -4.263 1.00 0.00 C ATOM 1464 CG LEU A 90 -5.553 -0.691 -3.483 1.00 0.00 C ATOM 1465 CD1 LEU A 90 -6.637 0.362 -3.640 1.00 0.00 C ATOM 1466 CD2 LEU A 90 -6.054 -2.050 -3.947 1.00 0.00 C ATOM 0 H LEU A 90 -3.311 2.059 -4.874 1.00 0.00 H new ATOM 0 HA LEU A 90 -3.510 0.457 -2.405 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -4.603 0.294 -5.130 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -3.824 -1.197 -4.641 1.00 0.00 H new ATOM 0 HG LEU A 90 -5.296 -0.760 -2.426 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -7.521 0.061 -3.078 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -6.274 1.317 -3.261 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -6.895 0.464 -4.694 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -6.946 -2.321 -3.383 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -6.296 -2.006 -5.009 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -5.279 -2.799 -3.782 1.00 0.00 H new ATOM 1478 N LEU A 91 -1.509 -0.986 -2.748 1.00 0.00 N ATOM 1479 CA LEU A 91 -0.216 -1.662 -2.794 1.00 0.00 C ATOM 1480 C LEU A 91 -0.390 -3.150 -2.498 1.00 0.00 C ATOM 1481 O LEU A 91 -1.326 -3.542 -1.800 1.00 0.00 O ATOM 1482 CB LEU A 91 0.731 -1.045 -1.765 1.00 0.00 C ATOM 1483 CG LEU A 91 1.465 0.222 -2.212 1.00 0.00 C ATOM 1484 CD1 LEU A 91 2.330 -0.059 -3.431 1.00 0.00 C ATOM 1485 CD2 LEU A 91 0.476 1.342 -2.502 1.00 0.00 C ATOM 0 H LEU A 91 -2.092 -1.259 -1.957 1.00 0.00 H new ATOM 0 HA LEU A 91 0.206 -1.542 -3.792 1.00 0.00 H new ATOM 0 HB2 LEU A 91 0.160 -0.813 -0.866 1.00 0.00 H new ATOM 0 HB3 LEU A 91 1.473 -1.793 -1.487 1.00 0.00 H new ATOM 0 HG LEU A 91 2.116 0.543 -1.399 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.843 0.855 -3.732 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.066 -0.824 -3.186 1.00 0.00 H new ATOM 0 HD13 LEU A 91 1.702 -0.409 -4.250 1.00 0.00 H new ATOM 0 HD21 LEU A 91 1.018 2.233 -2.818 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -0.204 1.031 -3.295 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.095 1.565 -1.601 1.00 0.00 H new ATOM 1497 N LYS A 92 0.509 -3.980 -3.022 1.00 0.00 N ATOM 1498 CA LYS A 92 0.429 -5.420 -2.792 1.00 0.00 C ATOM 1499 C LYS A 92 0.906 -5.768 -1.384 1.00 0.00 C ATOM 1500 O LYS A 92 2.042 -5.471 -1.009 1.00 0.00 O ATOM 1501 CB LYS A 92 1.260 -6.170 -3.836 1.00 0.00 C ATOM 1502 CG LYS A 92 0.646 -6.156 -5.225 1.00 0.00 C ATOM 1503 CD LYS A 92 -0.682 -6.897 -5.263 1.00 0.00 C ATOM 1504 CE LYS A 92 -0.482 -8.402 -5.241 1.00 0.00 C ATOM 1505 NZ LYS A 92 0.590 -8.837 -6.177 1.00 0.00 N ATOM 0 H LYS A 92 1.294 -3.684 -3.603 1.00 0.00 H new ATOM 0 HA LYS A 92 -0.613 -5.727 -2.887 1.00 0.00 H new ATOM 0 HB2 LYS A 92 2.255 -5.727 -3.883 1.00 0.00 H new ATOM 0 HB3 LYS A 92 1.386 -7.204 -3.514 1.00 0.00 H new ATOM 0 HG2 LYS A 92 0.496 -5.125 -5.546 1.00 0.00 H new ATOM 0 HG3 LYS A 92 1.338 -6.613 -5.933 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -1.291 -6.598 -4.410 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -1.231 -6.615 -6.161 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -0.230 -8.719 -4.229 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -1.417 -8.896 -5.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 0.364 -9.781 -6.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 0.658 -8.162 -6.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 1.498 -8.873 -5.672 1.00 0.00 H new ATOM 1519 N ALA A 93 0.028 -6.403 -0.610 1.00 0.00 N ATOM 1520 CA ALA A 93 0.344 -6.789 0.762 1.00 0.00 C ATOM 1521 C ALA A 93 1.686 -7.506 0.855 1.00 0.00 C ATOM 1522 O ALA A 93 2.518 -7.180 1.701 1.00 0.00 O ATOM 1523 CB ALA A 93 -0.760 -7.666 1.331 1.00 0.00 C ATOM 0 H ALA A 93 -0.911 -6.662 -0.912 1.00 0.00 H new ATOM 0 HA ALA A 93 0.417 -5.875 1.351 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -0.511 -7.946 2.354 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -1.701 -7.116 1.324 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -0.860 -8.565 0.723 1.00 0.00 H new ATOM 1529 N SER A 94 1.889 -8.485 -0.016 1.00 0.00 N ATOM 1530 CA SER A 94 3.128 -9.248 -0.026 1.00 0.00 C ATOM 1531 C SER A 94 4.340 -8.335 -0.191 1.00 0.00 C ATOM 1532 O SER A 94 5.388 -8.569 0.411 1.00 0.00 O ATOM 1533 CB SER A 94 3.103 -10.284 -1.151 1.00 0.00 C ATOM 1534 OG SER A 94 2.382 -9.803 -2.272 1.00 0.00 O ATOM 0 H SER A 94 1.212 -8.769 -0.724 1.00 0.00 H new ATOM 0 HA SER A 94 3.213 -9.758 0.933 1.00 0.00 H new ATOM 0 HB2 SER A 94 4.123 -10.527 -1.448 1.00 0.00 H new ATOM 0 HB3 SER A 94 2.647 -11.206 -0.790 1.00 0.00 H new ATOM 0 HG SER A 94 2.382 -10.483 -2.978 1.00 0.00 H new ATOM 1540 N GLU A 95 4.194 -7.296 -1.006 1.00 0.00 N ATOM 1541 CA GLU A 95 5.291 -6.365 -1.243 1.00 0.00 C ATOM 1542 C GLU A 95 5.604 -5.559 0.010 1.00 0.00 C ATOM 1543 O GLU A 95 6.759 -5.465 0.428 1.00 0.00 O ATOM 1544 CB GLU A 95 4.952 -5.430 -2.403 1.00 0.00 C ATOM 1545 CG GLU A 95 5.492 -5.908 -3.739 1.00 0.00 C ATOM 1546 CD GLU A 95 4.531 -5.647 -4.879 1.00 0.00 C ATOM 1547 OE1 GLU A 95 3.826 -4.620 -4.833 1.00 0.00 O ATOM 1548 OE2 GLU A 95 4.483 -6.470 -5.818 1.00 0.00 O ATOM 0 H GLU A 95 3.334 -7.078 -1.510 1.00 0.00 H new ATOM 0 HA GLU A 95 6.177 -6.944 -1.504 1.00 0.00 H new ATOM 0 HB2 GLU A 95 3.869 -5.327 -2.473 1.00 0.00 H new ATOM 0 HB3 GLU A 95 5.353 -4.439 -2.191 1.00 0.00 H new ATOM 0 HG2 GLU A 95 6.439 -5.408 -3.944 1.00 0.00 H new ATOM 0 HG3 GLU A 95 5.701 -6.976 -3.682 1.00 0.00 H new ATOM 1555 N VAL A 96 4.570 -4.987 0.616 1.00 0.00 N ATOM 1556 CA VAL A 96 4.747 -4.201 1.826 1.00 0.00 C ATOM 1557 C VAL A 96 5.325 -5.061 2.939 1.00 0.00 C ATOM 1558 O VAL A 96 6.279 -4.672 3.610 1.00 0.00 O ATOM 1559 CB VAL A 96 3.419 -3.581 2.302 1.00 0.00 C ATOM 1560 CG1 VAL A 96 3.664 -2.614 3.450 1.00 0.00 C ATOM 1561 CG2 VAL A 96 2.707 -2.885 1.151 1.00 0.00 C ATOM 0 H VAL A 96 3.606 -5.053 0.290 1.00 0.00 H new ATOM 0 HA VAL A 96 5.439 -3.394 1.587 1.00 0.00 H new ATOM 0 HB VAL A 96 2.775 -4.383 2.662 1.00 0.00 H new ATOM 0 HG11 VAL A 96 2.715 -2.186 3.774 1.00 0.00 H new ATOM 0 HG12 VAL A 96 4.124 -3.146 4.282 1.00 0.00 H new ATOM 0 HG13 VAL A 96 4.328 -1.816 3.118 1.00 0.00 H new ATOM 0 HG21 VAL A 96 1.772 -2.454 1.509 1.00 0.00 H new ATOM 0 HG22 VAL A 96 3.343 -2.093 0.755 1.00 0.00 H new ATOM 0 HG23 VAL A 96 2.495 -3.608 0.363 1.00 0.00 H new ATOM 1571 N GLU A 97 4.745 -6.240 3.118 1.00 0.00 N ATOM 1572 CA GLU A 97 5.202 -7.170 4.142 1.00 0.00 C ATOM 1573 C GLU A 97 6.690 -7.465 3.986 1.00 0.00 C ATOM 1574 O GLU A 97 7.431 -7.494 4.968 1.00 0.00 O ATOM 1575 CB GLU A 97 4.401 -8.471 4.075 1.00 0.00 C ATOM 1576 CG GLU A 97 3.127 -8.446 4.903 1.00 0.00 C ATOM 1577 CD GLU A 97 2.072 -9.404 4.383 1.00 0.00 C ATOM 1578 OE1 GLU A 97 1.677 -9.269 3.206 1.00 0.00 O ATOM 1579 OE2 GLU A 97 1.643 -10.289 5.153 1.00 0.00 O ATOM 0 H GLU A 97 3.956 -6.576 2.566 1.00 0.00 H new ATOM 0 HA GLU A 97 5.044 -6.705 5.115 1.00 0.00 H new ATOM 0 HB2 GLU A 97 4.145 -8.677 3.036 1.00 0.00 H new ATOM 0 HB3 GLU A 97 5.030 -9.293 4.417 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.365 -8.700 5.936 1.00 0.00 H new ATOM 0 HG3 GLU A 97 2.722 -7.434 4.909 1.00 0.00 H new ATOM 1586 N GLU A 98 7.124 -7.683 2.747 1.00 0.00 N ATOM 1587 CA GLU A 98 8.529 -7.974 2.480 1.00 0.00 C ATOM 1588 C GLU A 98 9.418 -6.808 2.909 1.00 0.00 C ATOM 1589 O GLU A 98 10.420 -6.994 3.611 1.00 0.00 O ATOM 1590 CB GLU A 98 8.734 -8.239 0.986 1.00 0.00 C ATOM 1591 CG GLU A 98 8.284 -9.611 0.520 1.00 0.00 C ATOM 1592 CD GLU A 98 8.776 -10.735 1.411 1.00 0.00 C ATOM 1593 OE1 GLU A 98 9.837 -10.567 2.047 1.00 0.00 O ATOM 1594 OE2 GLU A 98 8.100 -11.783 1.474 1.00 0.00 O ATOM 0 H GLU A 98 6.529 -7.664 1.919 1.00 0.00 H new ATOM 0 HA GLU A 98 8.806 -8.859 3.054 1.00 0.00 H new ATOM 0 HB2 GLU A 98 8.193 -7.482 0.419 1.00 0.00 H new ATOM 0 HB3 GLU A 98 9.792 -8.119 0.751 1.00 0.00 H new ATOM 0 HG2 GLU A 98 7.195 -9.636 0.483 1.00 0.00 H new ATOM 0 HG3 GLU A 98 8.642 -9.778 -0.496 1.00 0.00 H new ATOM 1601 N ILE A 99 9.044 -5.598 2.501 1.00 0.00 N ATOM 1602 CA ILE A 99 9.817 -4.416 2.858 1.00 0.00 C ATOM 1603 C ILE A 99 9.832 -4.246 4.370 1.00 0.00 C ATOM 1604 O ILE A 99 10.859 -3.904 4.957 1.00 0.00 O ATOM 1605 CB ILE A 99 9.277 -3.131 2.191 1.00 0.00 C ATOM 1606 CG1 ILE A 99 8.919 -3.386 0.723 1.00 0.00 C ATOM 1607 CG2 ILE A 99 10.311 -2.017 2.290 1.00 0.00 C ATOM 1608 CD1 ILE A 99 7.642 -2.703 0.287 1.00 0.00 C ATOM 0 H ILE A 99 8.220 -5.413 1.929 1.00 0.00 H new ATOM 0 HA ILE A 99 10.831 -4.570 2.489 1.00 0.00 H new ATOM 0 HB ILE A 99 8.372 -2.827 2.717 1.00 0.00 H new ATOM 0 HG12 ILE A 99 9.739 -3.043 0.092 1.00 0.00 H new ATOM 0 HG13 ILE A 99 8.821 -4.460 0.562 1.00 0.00 H new ATOM 0 HG21 ILE A 99 9.921 -1.116 1.817 1.00 0.00 H new ATOM 0 HG22 ILE A 99 10.526 -1.812 3.339 1.00 0.00 H new ATOM 0 HG23 ILE A 99 11.227 -2.325 1.785 1.00 0.00 H new ATOM 0 HD11 ILE A 99 7.450 -2.927 -0.762 1.00 0.00 H new ATOM 0 HD12 ILE A 99 6.811 -3.064 0.893 1.00 0.00 H new ATOM 0 HD13 ILE A 99 7.744 -1.625 0.416 1.00 0.00 H new ATOM 1620 N LEU A 100 8.691 -4.511 4.997 1.00 0.00 N ATOM 1621 CA LEU A 100 8.578 -4.414 6.445 1.00 0.00 C ATOM 1622 C LEU A 100 9.433 -5.488 7.108 1.00 0.00 C ATOM 1623 O LEU A 100 9.999 -5.275 8.179 1.00 0.00 O ATOM 1624 CB LEU A 100 7.122 -4.561 6.878 1.00 0.00 C ATOM 1625 CG LEU A 100 6.192 -3.434 6.426 1.00 0.00 C ATOM 1626 CD1 LEU A 100 4.876 -3.510 7.175 1.00 0.00 C ATOM 1627 CD2 LEU A 100 6.851 -2.076 6.631 1.00 0.00 C ATOM 0 H LEU A 100 7.833 -4.794 4.524 1.00 0.00 H new ATOM 0 HA LEU A 100 8.935 -3.433 6.757 1.00 0.00 H new ATOM 0 HB2 LEU A 100 6.738 -5.505 6.491 1.00 0.00 H new ATOM 0 HB3 LEU A 100 7.088 -4.625 7.966 1.00 0.00 H new ATOM 0 HG LEU A 100 5.993 -3.554 5.361 1.00 0.00 H new ATOM 0 HD11 LEU A 100 4.222 -2.703 6.845 1.00 0.00 H new ATOM 0 HD12 LEU A 100 4.398 -4.469 6.975 1.00 0.00 H new ATOM 0 HD13 LEU A 100 5.060 -3.413 8.245 1.00 0.00 H new ATOM 0 HD21 LEU A 100 6.172 -1.289 6.303 1.00 0.00 H new ATOM 0 HD22 LEU A 100 7.082 -1.939 7.688 1.00 0.00 H new ATOM 0 HD23 LEU A 100 7.772 -2.027 6.049 1.00 0.00 H new ATOM 1639 N ASP A 101 9.533 -6.639 6.447 1.00 0.00 N ATOM 1640 CA ASP A 101 10.336 -7.746 6.953 1.00 0.00 C ATOM 1641 C ASP A 101 11.816 -7.481 6.691 1.00 0.00 C ATOM 1642 O ASP A 101 12.691 -8.134 7.261 1.00 0.00 O ATOM 1643 CB ASP A 101 9.911 -9.059 6.294 1.00 0.00 C ATOM 1644 CG ASP A 101 8.912 -9.831 7.133 1.00 0.00 C ATOM 1645 OD1 ASP A 101 7.697 -9.708 6.872 1.00 0.00 O ATOM 1646 OD2 ASP A 101 9.344 -10.559 8.051 1.00 0.00 O ATOM 0 H ASP A 101 9.067 -6.828 5.559 1.00 0.00 H new ATOM 0 HA ASP A 101 10.176 -7.830 8.028 1.00 0.00 H new ATOM 0 HB2 ASP A 101 9.475 -8.848 5.318 1.00 0.00 H new ATOM 0 HB3 ASP A 101 10.792 -9.678 6.122 1.00 0.00 H new ATOM 1651 N GLY A 102 12.080 -6.512 5.819 1.00 0.00 N ATOM 1652 CA GLY A 102 13.443 -6.153 5.474 1.00 0.00 C ATOM 1653 C GLY A 102 13.878 -6.729 4.144 1.00 0.00 C ATOM 1654 O GLY A 102 15.017 -6.539 3.720 1.00 0.00 O ATOM 0 H GLY A 102 11.365 -5.964 5.341 1.00 0.00 H new ATOM 0 HA2 GLY A 102 13.532 -5.067 5.442 1.00 0.00 H new ATOM 0 HA3 GLY A 102 14.116 -6.505 6.256 1.00 0.00 H new ATOM 1658 N ASN A 103 12.954 -7.399 3.464 1.00 0.00 N ATOM 1659 CA ASN A 103 13.232 -7.959 2.153 1.00 0.00 C ATOM 1660 C ASN A 103 12.571 -7.092 1.092 1.00 0.00 C ATOM 1661 O ASN A 103 11.348 -7.035 1.012 1.00 0.00 O ATOM 1662 CB ASN A 103 12.717 -9.396 2.059 1.00 0.00 C ATOM 1663 CG ASN A 103 13.455 -10.208 1.012 1.00 0.00 C ATOM 1664 OD1 ASN A 103 14.548 -10.717 1.263 1.00 0.00 O ATOM 1665 ND2 ASN A 103 12.861 -10.332 -0.168 1.00 0.00 N ATOM 0 H ASN A 103 12.006 -7.566 3.802 1.00 0.00 H new ATOM 0 HA ASN A 103 14.310 -7.977 1.992 1.00 0.00 H new ATOM 0 HB2 ASN A 103 12.821 -9.880 3.030 1.00 0.00 H new ATOM 0 HB3 ASN A 103 11.653 -9.383 1.821 1.00 0.00 H new ATOM 0 HD21 ASN A 103 13.310 -10.866 -0.912 1.00 0.00 H new ATOM 0 HD22 ASN A 103 11.955 -9.893 -0.332 1.00 0.00 H new ATOM 1672 N ASP A 104 13.364 -6.398 0.292 1.00 0.00 N ATOM 1673 CA ASP A 104 12.792 -5.530 -0.732 1.00 0.00 C ATOM 1674 C ASP A 104 13.819 -5.085 -1.768 1.00 0.00 C ATOM 1675 O ASP A 104 13.572 -4.147 -2.523 1.00 0.00 O ATOM 1676 CB ASP A 104 12.162 -4.305 -0.071 1.00 0.00 C ATOM 1677 CG ASP A 104 13.086 -3.651 0.938 1.00 0.00 C ATOM 1678 OD1 ASP A 104 13.558 -4.354 1.856 1.00 0.00 O ATOM 1679 OD2 ASP A 104 13.339 -2.436 0.811 1.00 0.00 O ATOM 0 H ASP A 104 14.383 -6.414 0.326 1.00 0.00 H new ATOM 0 HA ASP A 104 12.034 -6.109 -1.260 1.00 0.00 H new ATOM 0 HB2 ASP A 104 11.895 -3.579 -0.839 1.00 0.00 H new ATOM 0 HB3 ASP A 104 11.237 -4.599 0.425 1.00 0.00 H new ATOM 1684 N GLU A 105 14.961 -5.759 -1.811 1.00 0.00 N ATOM 1685 CA GLU A 105 16.014 -5.419 -2.763 1.00 0.00 C ATOM 1686 C GLU A 105 15.482 -5.414 -4.193 1.00 0.00 C ATOM 1687 O GLU A 105 15.886 -4.588 -5.012 1.00 0.00 O ATOM 1688 CB GLU A 105 17.177 -6.406 -2.644 1.00 0.00 C ATOM 1689 CG GLU A 105 17.832 -6.413 -1.272 1.00 0.00 C ATOM 1690 CD GLU A 105 19.347 -6.399 -1.348 1.00 0.00 C ATOM 1691 OE1 GLU A 105 19.930 -7.428 -1.745 1.00 0.00 O ATOM 1692 OE2 GLU A 105 19.947 -5.357 -1.010 1.00 0.00 O ATOM 0 H GLU A 105 15.183 -6.544 -1.199 1.00 0.00 H new ATOM 0 HA GLU A 105 16.369 -4.416 -2.525 1.00 0.00 H new ATOM 0 HB2 GLU A 105 16.816 -7.409 -2.870 1.00 0.00 H new ATOM 0 HB3 GLU A 105 17.928 -6.161 -3.395 1.00 0.00 H new ATOM 0 HG2 GLU A 105 17.492 -5.545 -0.707 1.00 0.00 H new ATOM 0 HG3 GLU A 105 17.508 -7.297 -0.723 1.00 0.00 H new ATOM 1699 N LYS A 106 14.573 -6.336 -4.483 1.00 0.00 N ATOM 1700 CA LYS A 106 13.983 -6.434 -5.812 1.00 0.00 C ATOM 1701 C LYS A 106 13.047 -5.260 -6.077 1.00 0.00 C ATOM 1702 O LYS A 106 12.872 -4.838 -7.220 1.00 0.00 O ATOM 1703 CB LYS A 106 13.222 -7.752 -5.961 1.00 0.00 C ATOM 1704 CG LYS A 106 12.063 -7.899 -4.987 1.00 0.00 C ATOM 1705 CD LYS A 106 12.339 -8.973 -3.946 1.00 0.00 C ATOM 1706 CE LYS A 106 12.179 -10.368 -4.528 1.00 0.00 C ATOM 1707 NZ LYS A 106 13.489 -11.059 -4.682 1.00 0.00 N ATOM 0 H LYS A 106 14.228 -7.026 -3.816 1.00 0.00 H new ATOM 0 HA LYS A 106 14.790 -6.406 -6.544 1.00 0.00 H new ATOM 0 HB2 LYS A 106 12.842 -7.829 -6.980 1.00 0.00 H new ATOM 0 HB3 LYS A 106 13.915 -8.581 -5.816 1.00 0.00 H new ATOM 0 HG2 LYS A 106 11.883 -6.946 -4.489 1.00 0.00 H new ATOM 0 HG3 LYS A 106 11.155 -8.148 -5.536 1.00 0.00 H new ATOM 0 HD2 LYS A 106 13.351 -8.853 -3.558 1.00 0.00 H new ATOM 0 HD3 LYS A 106 11.658 -8.849 -3.104 1.00 0.00 H new ATOM 0 HE2 LYS A 106 11.531 -10.959 -3.881 1.00 0.00 H new ATOM 0 HE3 LYS A 106 11.687 -10.302 -5.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 13.336 -12.086 -4.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 13.952 -10.734 -5.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 14.095 -10.840 -3.866 1.00 0.00 H new ATOM 1721 N TYR A 107 12.444 -4.739 -5.013 1.00 0.00 N ATOM 1722 CA TYR A 107 11.525 -3.621 -5.126 1.00 0.00 C ATOM 1723 C TYR A 107 12.277 -2.303 -5.288 1.00 0.00 C ATOM 1724 O TYR A 107 11.776 -1.365 -5.908 1.00 0.00 O ATOM 1725 CB TYR A 107 10.636 -3.558 -3.886 1.00 0.00 C ATOM 1726 CG TYR A 107 9.904 -4.844 -3.587 1.00 0.00 C ATOM 1727 CD1 TYR A 107 9.169 -5.495 -4.568 1.00 0.00 C ATOM 1728 CD2 TYR A 107 9.944 -5.404 -2.318 1.00 0.00 C ATOM 1729 CE1 TYR A 107 8.494 -6.668 -4.292 1.00 0.00 C ATOM 1730 CE2 TYR A 107 9.274 -6.575 -2.033 1.00 0.00 C ATOM 1731 CZ TYR A 107 8.549 -7.205 -3.022 1.00 0.00 C ATOM 1732 OH TYR A 107 7.881 -8.374 -2.743 1.00 0.00 O ATOM 0 H TYR A 107 12.579 -5.078 -4.060 1.00 0.00 H new ATOM 0 HA TYR A 107 10.910 -3.773 -6.013 1.00 0.00 H new ATOM 0 HB2 TYR A 107 11.250 -3.293 -3.025 1.00 0.00 H new ATOM 0 HB3 TYR A 107 9.906 -2.759 -4.015 1.00 0.00 H new ATOM 0 HD1 TYR A 107 9.124 -5.078 -5.563 1.00 0.00 H new ATOM 0 HD2 TYR A 107 10.510 -4.914 -1.540 1.00 0.00 H new ATOM 0 HE1 TYR A 107 7.926 -7.162 -5.066 1.00 0.00 H new ATOM 0 HE2 TYR A 107 9.317 -6.997 -1.040 1.00 0.00 H new ATOM 0 HH TYR A 107 8.529 -9.096 -2.602 1.00 0.00 H new ATOM 1742 N LYS A 108 13.479 -2.234 -4.723 1.00 0.00 N ATOM 1743 CA LYS A 108 14.292 -1.022 -4.803 1.00 0.00 C ATOM 1744 C LYS A 108 15.157 -1.022 -6.067 1.00 0.00 C ATOM 1745 O LYS A 108 15.847 -0.044 -6.352 1.00 0.00 O ATOM 1746 CB LYS A 108 15.201 -0.882 -3.571 1.00 0.00 C ATOM 1747 CG LYS A 108 14.845 -1.795 -2.410 1.00 0.00 C ATOM 1748 CD LYS A 108 15.520 -1.350 -1.122 1.00 0.00 C ATOM 1749 CE LYS A 108 15.189 0.095 -0.789 1.00 0.00 C ATOM 1750 NZ LYS A 108 15.193 0.346 0.680 1.00 0.00 N ATOM 0 H LYS A 108 13.911 -3.000 -4.206 1.00 0.00 H new ATOM 0 HA LYS A 108 13.605 -0.176 -4.838 1.00 0.00 H new ATOM 0 HB2 LYS A 108 16.229 -1.083 -3.871 1.00 0.00 H new ATOM 0 HB3 LYS A 108 15.166 0.151 -3.226 1.00 0.00 H new ATOM 0 HG2 LYS A 108 13.764 -1.803 -2.271 1.00 0.00 H new ATOM 0 HG3 LYS A 108 15.144 -2.817 -2.644 1.00 0.00 H new ATOM 0 HD2 LYS A 108 15.203 -1.995 -0.302 1.00 0.00 H new ATOM 0 HD3 LYS A 108 16.600 -1.464 -1.218 1.00 0.00 H new ATOM 0 HE2 LYS A 108 15.913 0.753 -1.271 1.00 0.00 H new ATOM 0 HE3 LYS A 108 14.210 0.345 -1.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 15.453 1.336 0.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 14.246 0.160 1.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 15.883 -0.283 1.138 1.00 0.00 H new ATOM 1764 N ALA A 109 15.132 -2.129 -6.806 1.00 0.00 N ATOM 1765 CA ALA A 109 15.933 -2.257 -8.019 1.00 0.00 C ATOM 1766 C ALA A 109 15.109 -2.052 -9.289 1.00 0.00 C ATOM 1767 O ALA A 109 15.634 -2.171 -10.398 1.00 0.00 O ATOM 1768 CB ALA A 109 16.603 -3.620 -8.053 1.00 0.00 C ATOM 0 H ALA A 109 14.566 -2.949 -6.586 1.00 0.00 H new ATOM 0 HA ALA A 109 16.687 -1.470 -7.993 1.00 0.00 H new ATOM 0 HB1 ALA A 109 17.200 -3.710 -8.961 1.00 0.00 H new ATOM 0 HB2 ALA A 109 17.249 -3.730 -7.182 1.00 0.00 H new ATOM 0 HB3 ALA A 109 15.842 -4.400 -8.041 1.00 0.00 H new ATOM 1774 N VAL A 110 13.828 -1.740 -9.135 1.00 0.00 N ATOM 1775 CA VAL A 110 12.962 -1.519 -10.284 1.00 0.00 C ATOM 1776 C VAL A 110 12.911 -2.756 -11.181 1.00 0.00 C ATOM 1777 O VAL A 110 13.062 -2.662 -12.399 1.00 0.00 O ATOM 1778 CB VAL A 110 13.457 -0.318 -11.104 1.00 0.00 C ATOM 1779 CG1 VAL A 110 12.501 -0.006 -12.244 1.00 0.00 C ATOM 1780 CG2 VAL A 110 13.647 0.895 -10.208 1.00 0.00 C ATOM 0 H VAL A 110 13.369 -1.635 -8.230 1.00 0.00 H new ATOM 0 HA VAL A 110 11.959 -1.316 -9.908 1.00 0.00 H new ATOM 0 HB VAL A 110 14.422 -0.577 -11.540 1.00 0.00 H new ATOM 0 HG11 VAL A 110 12.875 0.848 -12.809 1.00 0.00 H new ATOM 0 HG12 VAL A 110 12.425 -0.871 -12.902 1.00 0.00 H new ATOM 0 HG13 VAL A 110 11.517 0.229 -11.839 1.00 0.00 H new ATOM 0 HG21 VAL A 110 13.998 1.737 -10.805 1.00 0.00 H new ATOM 0 HG22 VAL A 110 12.697 1.153 -9.739 1.00 0.00 H new ATOM 0 HG23 VAL A 110 14.382 0.666 -9.436 1.00 0.00 H new ATOM 1790 N SER A 111 12.697 -3.917 -10.569 1.00 0.00 N ATOM 1791 CA SER A 111 12.627 -5.172 -11.311 1.00 0.00 C ATOM 1792 C SER A 111 11.301 -5.293 -12.057 1.00 0.00 C ATOM 1793 O SER A 111 10.299 -5.733 -11.494 1.00 0.00 O ATOM 1794 CB SER A 111 12.801 -6.360 -10.364 1.00 0.00 C ATOM 1795 OG SER A 111 13.552 -7.394 -10.975 1.00 0.00 O ATOM 0 H SER A 111 12.569 -4.015 -9.562 1.00 0.00 H new ATOM 0 HA SER A 111 13.436 -5.176 -12.042 1.00 0.00 H new ATOM 0 HB2 SER A 111 13.302 -6.032 -9.453 1.00 0.00 H new ATOM 0 HB3 SER A 111 11.823 -6.741 -10.071 1.00 0.00 H new ATOM 0 HG SER A 111 13.650 -8.141 -10.348 1.00 0.00 H new ATOM 1801 N ILE A 112 11.303 -4.904 -13.329 1.00 0.00 N ATOM 1802 CA ILE A 112 10.099 -4.973 -14.149 1.00 0.00 C ATOM 1803 C ILE A 112 10.146 -6.170 -15.094 1.00 0.00 C ATOM 1804 O ILE A 112 9.882 -6.043 -16.291 1.00 0.00 O ATOM 1805 CB ILE A 112 9.906 -3.685 -14.975 1.00 0.00 C ATOM 1806 CG1 ILE A 112 10.014 -2.452 -14.076 1.00 0.00 C ATOM 1807 CG2 ILE A 112 8.563 -3.709 -15.689 1.00 0.00 C ATOM 1808 CD1 ILE A 112 10.424 -1.199 -14.816 1.00 0.00 C ATOM 0 H ILE A 112 12.123 -4.539 -13.813 1.00 0.00 H new ATOM 0 HA ILE A 112 9.257 -5.086 -13.466 1.00 0.00 H new ATOM 0 HB ILE A 112 10.695 -3.633 -15.726 1.00 0.00 H new ATOM 0 HG12 ILE A 112 9.053 -2.280 -13.592 1.00 0.00 H new ATOM 0 HG13 ILE A 112 10.738 -2.651 -13.286 1.00 0.00 H new ATOM 0 HG21 ILE A 112 8.442 -2.793 -16.267 1.00 0.00 H new ATOM 0 HG22 ILE A 112 8.522 -4.569 -16.358 1.00 0.00 H new ATOM 0 HG23 ILE A 112 7.761 -3.782 -14.954 1.00 0.00 H new ATOM 0 HD11 ILE A 112 10.480 -0.365 -14.116 1.00 0.00 H new ATOM 0 HD12 ILE A 112 11.399 -1.352 -15.278 1.00 0.00 H new ATOM 0 HD13 ILE A 112 9.688 -0.975 -15.588 1.00 0.00 H new ATOM 1820 N SER A 113 10.481 -7.335 -14.549 1.00 0.00 N ATOM 1821 CA SER A 113 10.561 -8.555 -15.344 1.00 0.00 C ATOM 1822 C SER A 113 9.950 -9.734 -14.596 1.00 0.00 C ATOM 1823 O SER A 113 8.781 -10.071 -14.878 1.00 0.00 O ATOM 1824 CB SER A 113 12.017 -8.861 -15.701 1.00 0.00 C ATOM 1825 OG SER A 113 12.771 -7.669 -15.838 1.00 0.00 O ATOM 1826 OXT SER A 113 10.645 -10.311 -13.733 1.00 0.00 O ATOM 0 H SER A 113 10.701 -7.460 -13.561 1.00 0.00 H new ATOM 0 HA SER A 113 9.994 -8.398 -16.262 1.00 0.00 H new ATOM 0 HB2 SER A 113 12.460 -9.488 -14.927 1.00 0.00 H new ATOM 0 HB3 SER A 113 12.055 -9.428 -16.631 1.00 0.00 H new ATOM 0 HG SER A 113 13.698 -7.892 -16.065 1.00 0.00 H new TER 1832 SER A 113