USER MOD reduce.3.24.130724 H: found=0, std=0, add=924, rem=0, adj=33 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 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 107 TYR OH : rot 180:sc= -0.0663 USER MOD Set 2.1: A 44 TYR OH : rot 180:sc= -0.205 USER MOD Set 2.2: A 89 THR OG1 : rot 44:sc= 0.0473 USER MOD Set 3.1: A 75 ASN : amide:sc= 1.03 X(o=1.9,f=1.8) USER MOD Set 3.2: A 81 TYR OH : rot -39:sc= 0.896 USER MOD Set 4.1: A 70 LYS NZ :NH3+ -112:sc= -0.2 (180deg=-0.977) USER MOD Set 4.2: A 77 LYS NZ :NH3+ 151:sc= 0 (180deg=0) USER MOD Set 5.1: A 9 THR OG1 : rot 122:sc= 0.122 USER MOD Set 5.2: A 35 TYR OH : rot 180:sc= 0.113 USER MOD Set 6.1: A 26 TYR OH : rot 129:sc= 1.18 USER MOD Set 6.2: A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 0 GLY N :NH3+ 180:sc= 0 (180deg=0) 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 169:sc= 0 (180deg=-0.0383) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= -0.0497 K(o=-0.05,f=-1.5!) USER MOD Single : A 13 LYS NZ :NH3+ -162:sc=-0.00788 (180deg=-0.173) USER MOD Single : A 16 LYS NZ :NH3+ 145:sc= -0.262 (180deg=-1.18!) USER MOD Single : A 18 GLN : amide:sc= -2.38! C(o=-2.4!,f=-2.4!) USER MOD Single : A 27 MET CE :methyl 142:sc= -1.09 (180deg=-4.26!) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= -5.71! C(o=-5.7!,f=-13!) USER MOD Single : A 38 MET CE :methyl -131:sc= -0.827 (180deg=-2.43!) USER MOD Single : A 42 SER OG : rot 92:sc= 0.0511 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 TYR OH : rot 171:sc= 0.0159 USER MOD Single : A 49 SER OG : rot 37:sc= 0.323 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.307 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 -65:sc= 0.721 USER MOD Single : A 67 SER OG : rot 50:sc= -0.606 USER MOD Single : A 68 HIS : no HE2:sc= -4.45! C(o=-4.5!,f=-8.2!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 81:sc= 0.717 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 93:sc= 0.0436 USER MOD Single : A 103 ASN : amide:sc= -0.32 X(o=-0.32,f=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0.00421 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 0 33.326 -6.787 24.236 1.00 0.00 N ATOM 2 CA GLY A 0 32.745 -7.998 23.594 1.00 0.00 C ATOM 3 C GLY A 0 31.235 -7.925 23.479 1.00 0.00 C ATOM 4 O GLY A 0 30.524 -8.791 23.987 1.00 0.00 O ATOM 0 H1 GLY A 0 34.360 -6.886 24.291 1.00 0.00 H new ATOM 0 H2 GLY A 0 33.088 -5.947 23.671 1.00 0.00 H new ATOM 0 H3 GLY A 0 32.937 -6.682 25.195 1.00 0.00 H new ATOM 0 HA2 GLY A 0 33.176 -8.121 22.601 1.00 0.00 H new ATOM 0 HA3 GLY A 0 33.020 -8.880 24.173 1.00 0.00 H new ATOM 10 N SER A 1 30.743 -6.887 22.810 1.00 0.00 N ATOM 11 CA SER A 1 29.308 -6.703 22.629 1.00 0.00 C ATOM 12 C SER A 1 28.929 -6.795 21.155 1.00 0.00 C ATOM 13 O SER A 1 29.372 -5.988 20.338 1.00 0.00 O ATOM 14 CB SER A 1 28.871 -5.351 23.197 1.00 0.00 C ATOM 15 OG SER A 1 27.600 -5.446 23.816 1.00 0.00 O ATOM 0 H SER A 1 31.318 -6.160 22.384 1.00 0.00 H new ATOM 0 HA SER A 1 28.794 -7.499 23.167 1.00 0.00 H new ATOM 0 HB2 SER A 1 29.607 -5.002 23.921 1.00 0.00 H new ATOM 0 HB3 SER A 1 28.835 -4.611 22.397 1.00 0.00 H new ATOM 0 HG SER A 1 27.343 -4.570 24.173 1.00 0.00 H new ATOM 21 N MET A 2 28.105 -7.784 20.821 1.00 0.00 N ATOM 22 CA MET A 2 27.666 -7.982 19.444 1.00 0.00 C ATOM 23 C MET A 2 26.639 -6.927 19.044 1.00 0.00 C ATOM 24 O MET A 2 25.508 -6.933 19.528 1.00 0.00 O ATOM 25 CB MET A 2 27.070 -9.380 19.274 1.00 0.00 C ATOM 26 CG MET A 2 25.958 -9.693 20.263 1.00 0.00 C ATOM 27 SD MET A 2 24.340 -9.818 19.477 1.00 0.00 S ATOM 28 CE MET A 2 23.956 -11.544 19.764 1.00 0.00 C ATOM 0 H MET A 2 27.728 -8.460 21.485 1.00 0.00 H new ATOM 0 HA MET A 2 28.535 -7.883 18.793 1.00 0.00 H new ATOM 0 HB2 MET A 2 26.682 -9.479 18.260 1.00 0.00 H new ATOM 0 HB3 MET A 2 27.863 -10.120 19.386 1.00 0.00 H new ATOM 0 HG2 MET A 2 26.183 -10.630 20.772 1.00 0.00 H new ATOM 0 HG3 MET A 2 25.927 -8.916 21.026 1.00 0.00 H new ATOM 0 HE1 MET A 2 22.982 -11.776 19.334 1.00 0.00 H new ATOM 0 HE2 MET A 2 24.717 -12.169 19.296 1.00 0.00 H new ATOM 0 HE3 MET A 2 23.936 -11.739 20.836 1.00 0.00 H new ATOM 38 N MET A 3 27.044 -6.023 18.158 1.00 0.00 N ATOM 39 CA MET A 3 26.159 -4.962 17.691 1.00 0.00 C ATOM 40 C MET A 3 25.492 -5.347 16.375 1.00 0.00 C ATOM 41 O MET A 3 26.167 -5.655 15.392 1.00 0.00 O ATOM 42 CB MET A 3 26.940 -3.657 17.519 1.00 0.00 C ATOM 43 CG MET A 3 28.077 -3.758 16.514 1.00 0.00 C ATOM 44 SD MET A 3 27.744 -2.849 14.992 1.00 0.00 S ATOM 45 CE MET A 3 27.902 -1.160 15.565 1.00 0.00 C ATOM 0 H MET A 3 27.978 -6.004 17.749 1.00 0.00 H new ATOM 0 HA MET A 3 25.381 -4.816 18.441 1.00 0.00 H new ATOM 0 HB2 MET A 3 26.254 -2.872 17.202 1.00 0.00 H new ATOM 0 HB3 MET A 3 27.345 -3.355 18.485 1.00 0.00 H new ATOM 0 HG2 MET A 3 28.992 -3.377 16.967 1.00 0.00 H new ATOM 0 HG3 MET A 3 28.253 -4.807 16.275 1.00 0.00 H new ATOM 0 HE1 MET A 3 27.918 -0.485 14.709 1.00 0.00 H new ATOM 0 HE2 MET A 3 27.056 -0.913 16.206 1.00 0.00 H new ATOM 0 HE3 MET A 3 28.828 -1.052 16.130 1.00 0.00 H new ATOM 55 N MET A 4 24.163 -5.328 16.362 1.00 0.00 N ATOM 56 CA MET A 4 23.404 -5.676 15.167 1.00 0.00 C ATOM 57 C MET A 4 21.916 -5.407 15.373 1.00 0.00 C ATOM 58 O MET A 4 21.258 -6.081 16.166 1.00 0.00 O ATOM 59 CB MET A 4 23.624 -7.147 14.807 1.00 0.00 C ATOM 60 CG MET A 4 23.392 -7.455 13.336 1.00 0.00 C ATOM 61 SD MET A 4 22.458 -8.977 13.083 1.00 0.00 S ATOM 62 CE MET A 4 23.680 -9.990 12.253 1.00 0.00 C ATOM 0 H MET A 4 23.589 -5.075 17.167 1.00 0.00 H new ATOM 0 HA MET A 4 23.758 -5.053 14.346 1.00 0.00 H new ATOM 0 HB2 MET A 4 24.643 -7.429 15.072 1.00 0.00 H new ATOM 0 HB3 MET A 4 22.956 -7.763 15.408 1.00 0.00 H new ATOM 0 HG2 MET A 4 22.857 -6.624 12.875 1.00 0.00 H new ATOM 0 HG3 MET A 4 24.354 -7.535 12.830 1.00 0.00 H new ATOM 0 HE1 MET A 4 23.251 -10.967 12.029 1.00 0.00 H new ATOM 0 HE2 MET A 4 23.984 -9.506 11.325 1.00 0.00 H new ATOM 0 HE3 MET A 4 24.549 -10.114 12.899 1.00 0.00 H new ATOM 72 N ALA A 5 21.392 -4.420 14.654 1.00 0.00 N ATOM 73 CA ALA A 5 19.982 -4.063 14.760 1.00 0.00 C ATOM 74 C ALA A 5 19.503 -3.338 13.508 1.00 0.00 C ATOM 75 O ALA A 5 20.131 -2.381 13.054 1.00 0.00 O ATOM 76 CB ALA A 5 19.748 -3.204 15.993 1.00 0.00 C ATOM 0 H ALA A 5 21.922 -3.853 13.992 1.00 0.00 H new ATOM 0 HA ALA A 5 19.405 -4.983 14.856 1.00 0.00 H new ATOM 0 HB1 ALA A 5 18.692 -2.944 16.060 1.00 0.00 H new ATOM 0 HB2 ALA A 5 20.043 -3.758 16.884 1.00 0.00 H new ATOM 0 HB3 ALA A 5 20.342 -2.293 15.920 1.00 0.00 H new ATOM 82 N LEU A 6 18.385 -3.797 12.957 1.00 0.00 N ATOM 83 CA LEU A 6 17.818 -3.191 11.756 1.00 0.00 C ATOM 84 C LEU A 6 16.481 -2.525 12.066 1.00 0.00 C ATOM 85 O LEU A 6 15.632 -3.102 12.746 1.00 0.00 O ATOM 86 CB LEU A 6 17.634 -4.247 10.665 1.00 0.00 C ATOM 87 CG LEU A 6 18.886 -5.058 10.330 1.00 0.00 C ATOM 88 CD1 LEU A 6 18.535 -6.240 9.440 1.00 0.00 C ATOM 89 CD2 LEU A 6 19.928 -4.175 9.660 1.00 0.00 C ATOM 0 H LEU A 6 17.853 -4.587 13.322 1.00 0.00 H new ATOM 0 HA LEU A 6 18.511 -2.429 11.400 1.00 0.00 H new ATOM 0 HB2 LEU A 6 16.847 -4.934 10.975 1.00 0.00 H new ATOM 0 HB3 LEU A 6 17.286 -3.753 9.758 1.00 0.00 H new ATOM 0 HG LEU A 6 19.306 -5.442 11.259 1.00 0.00 H new ATOM 0 HD11 LEU A 6 19.439 -6.805 9.212 1.00 0.00 H new ATOM 0 HD12 LEU A 6 17.824 -6.885 9.956 1.00 0.00 H new ATOM 0 HD13 LEU A 6 18.090 -5.878 8.513 1.00 0.00 H new ATOM 0 HD21 LEU A 6 20.813 -4.768 9.428 1.00 0.00 H new ATOM 0 HD22 LEU A 6 19.517 -3.762 8.739 1.00 0.00 H new ATOM 0 HD23 LEU A 6 20.202 -3.362 10.332 1.00 0.00 H new ATOM 101 N SER A 7 16.300 -1.308 11.563 1.00 0.00 N ATOM 102 CA SER A 7 15.066 -0.565 11.789 1.00 0.00 C ATOM 103 C SER A 7 14.636 0.175 10.526 1.00 0.00 C ATOM 104 O SER A 7 15.126 1.268 10.238 1.00 0.00 O ATOM 105 CB SER A 7 15.245 0.426 12.939 1.00 0.00 C ATOM 106 OG SER A 7 16.542 0.998 12.923 1.00 0.00 O ATOM 0 H SER A 7 16.991 -0.816 10.997 1.00 0.00 H new ATOM 0 HA SER A 7 14.286 -1.279 12.053 1.00 0.00 H new ATOM 0 HB2 SER A 7 14.496 1.214 12.864 1.00 0.00 H new ATOM 0 HB3 SER A 7 15.080 -0.081 13.889 1.00 0.00 H new ATOM 0 HG SER A 7 16.630 1.629 13.667 1.00 0.00 H new ATOM 112 N LYS A 8 13.717 -0.426 9.778 1.00 0.00 N ATOM 113 CA LYS A 8 13.219 0.175 8.545 1.00 0.00 C ATOM 114 C LYS A 8 11.767 0.619 8.704 1.00 0.00 C ATOM 115 O LYS A 8 11.326 1.573 8.065 1.00 0.00 O ATOM 116 CB LYS A 8 13.338 -0.815 7.385 1.00 0.00 C ATOM 117 CG LYS A 8 14.671 -1.546 7.343 1.00 0.00 C ATOM 118 CD LYS A 8 15.800 -0.623 6.915 1.00 0.00 C ATOM 119 CE LYS A 8 17.160 -1.261 7.147 1.00 0.00 C ATOM 120 NZ LYS A 8 18.145 -0.867 6.104 1.00 0.00 N ATOM 0 H LYS A 8 13.301 -1.330 10.004 1.00 0.00 H new ATOM 0 HA LYS A 8 13.827 1.053 8.327 1.00 0.00 H new ATOM 0 HB2 LYS A 8 12.534 -1.547 7.459 1.00 0.00 H new ATOM 0 HB3 LYS A 8 13.197 -0.280 6.446 1.00 0.00 H new ATOM 0 HG2 LYS A 8 14.891 -1.960 8.327 1.00 0.00 H new ATOM 0 HG3 LYS A 8 14.605 -2.386 6.652 1.00 0.00 H new ATOM 0 HD2 LYS A 8 15.688 -0.375 5.859 1.00 0.00 H new ATOM 0 HD3 LYS A 8 15.737 0.313 7.470 1.00 0.00 H new ATOM 0 HE2 LYS A 8 17.535 -0.970 8.128 1.00 0.00 H new ATOM 0 HE3 LYS A 8 17.055 -2.346 7.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 19.059 -1.324 6.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 17.800 -1.168 5.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 18.265 0.166 6.113 1.00 0.00 H new ATOM 134 N THR A 9 11.029 -0.084 9.558 1.00 0.00 N ATOM 135 CA THR A 9 9.625 0.235 9.800 1.00 0.00 C ATOM 136 C THR A 9 9.467 1.024 11.098 1.00 0.00 C ATOM 137 O THR A 9 10.161 0.761 12.079 1.00 0.00 O ATOM 138 CB THR A 9 8.790 -1.049 9.860 1.00 0.00 C ATOM 139 OG1 THR A 9 8.769 -1.577 11.175 1.00 0.00 O ATOM 140 CG2 THR A 9 9.293 -2.140 8.938 1.00 0.00 C ATOM 0 H THR A 9 11.379 -0.878 10.094 1.00 0.00 H new ATOM 0 HA THR A 9 9.267 0.851 8.975 1.00 0.00 H new ATOM 0 HB THR A 9 7.792 -0.753 9.536 1.00 0.00 H new ATOM 0 HG1 THR A 9 7.842 -1.639 11.488 1.00 0.00 H new ATOM 0 HG21 THR A 9 8.655 -3.019 9.032 1.00 0.00 H new ATOM 0 HG22 THR A 9 9.271 -1.785 7.908 1.00 0.00 H new ATOM 0 HG23 THR A 9 10.315 -2.403 9.209 1.00 0.00 H new ATOM 148 N PHE A 10 8.557 1.994 11.098 1.00 0.00 N ATOM 149 CA PHE A 10 8.329 2.816 12.284 1.00 0.00 C ATOM 150 C PHE A 10 6.843 3.058 12.518 1.00 0.00 C ATOM 151 O PHE A 10 6.147 3.554 11.635 1.00 0.00 O ATOM 152 CB PHE A 10 9.026 4.170 12.122 1.00 0.00 C ATOM 153 CG PHE A 10 10.130 4.172 11.100 1.00 0.00 C ATOM 154 CD1 PHE A 10 11.301 3.465 11.321 1.00 0.00 C ATOM 155 CD2 PHE A 10 9.990 4.877 9.916 1.00 0.00 C ATOM 156 CE1 PHE A 10 12.312 3.462 10.378 1.00 0.00 C ATOM 157 CE2 PHE A 10 10.997 4.878 8.970 1.00 0.00 C ATOM 158 CZ PHE A 10 12.159 4.169 9.201 1.00 0.00 C ATOM 0 H PHE A 10 7.970 2.229 10.298 1.00 0.00 H new ATOM 0 HA PHE A 10 8.737 2.278 13.140 1.00 0.00 H new ATOM 0 HB2 PHE A 10 8.284 4.918 11.842 1.00 0.00 H new ATOM 0 HB3 PHE A 10 9.436 4.473 13.085 1.00 0.00 H new ATOM 0 HD1 PHE A 10 11.425 2.911 12.239 1.00 0.00 H new ATOM 0 HD2 PHE A 10 9.083 5.433 9.730 1.00 0.00 H new ATOM 0 HE1 PHE A 10 13.220 2.908 10.561 1.00 0.00 H new ATOM 0 HE2 PHE A 10 10.875 5.433 8.051 1.00 0.00 H new ATOM 0 HZ PHE A 10 12.947 4.167 8.463 1.00 0.00 H new ATOM 168 N GLY A 11 6.364 2.742 13.718 1.00 0.00 N ATOM 169 CA GLY A 11 4.966 2.977 14.025 1.00 0.00 C ATOM 170 C GLY A 11 4.100 1.753 13.810 1.00 0.00 C ATOM 171 O GLY A 11 4.601 0.658 13.555 1.00 0.00 O ATOM 0 H GLY A 11 6.912 2.332 14.474 1.00 0.00 H new ATOM 0 HA2 GLY A 11 4.877 3.301 15.062 1.00 0.00 H new ATOM 0 HA3 GLY A 11 4.595 3.792 13.403 1.00 0.00 H new ATOM 175 N GLN A 12 2.790 1.953 13.891 1.00 0.00 N ATOM 176 CA GLN A 12 1.831 0.879 13.677 1.00 0.00 C ATOM 177 C GLN A 12 1.864 0.446 12.213 1.00 0.00 C ATOM 178 O GLN A 12 2.285 1.210 11.346 1.00 0.00 O ATOM 179 CB GLN A 12 0.421 1.332 14.065 1.00 0.00 C ATOM 180 CG GLN A 12 -0.159 2.389 13.139 1.00 0.00 C ATOM 181 CD GLN A 12 -1.288 3.171 13.783 1.00 0.00 C ATOM 182 OE1 GLN A 12 -1.648 2.930 14.934 1.00 0.00 O ATOM 183 NE2 GLN A 12 -1.854 4.115 13.037 1.00 0.00 N ATOM 0 H GLN A 12 2.367 2.856 14.105 1.00 0.00 H new ATOM 0 HA GLN A 12 2.103 0.032 14.307 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -0.240 0.465 14.072 1.00 0.00 H new ATOM 0 HB3 GLN A 12 0.442 1.725 15.082 1.00 0.00 H new ATOM 0 HG2 GLN A 12 0.631 3.078 12.840 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -0.525 1.910 12.231 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -1.523 4.281 12.087 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -2.619 4.673 13.415 1.00 0.00 H new ATOM 192 N LYS A 13 1.433 -0.779 11.939 1.00 0.00 N ATOM 193 CA LYS A 13 1.437 -1.289 10.572 1.00 0.00 C ATOM 194 C LYS A 13 0.400 -0.550 9.731 1.00 0.00 C ATOM 195 O LYS A 13 -0.666 -0.184 10.227 1.00 0.00 O ATOM 196 CB LYS A 13 1.140 -2.796 10.569 1.00 0.00 C ATOM 197 CG LYS A 13 0.967 -3.395 9.179 1.00 0.00 C ATOM 198 CD LYS A 13 2.282 -3.938 8.637 1.00 0.00 C ATOM 199 CE LYS A 13 2.307 -5.456 8.645 1.00 0.00 C ATOM 200 NZ LYS A 13 2.027 -6.012 9.998 1.00 0.00 N ATOM 0 H LYS A 13 1.079 -1.433 12.637 1.00 0.00 H new ATOM 0 HA LYS A 13 2.424 -1.123 10.139 1.00 0.00 H new ATOM 0 HB2 LYS A 13 1.951 -3.316 11.078 1.00 0.00 H new ATOM 0 HB3 LYS A 13 0.233 -2.978 11.146 1.00 0.00 H new ATOM 0 HG2 LYS A 13 0.229 -4.196 9.216 1.00 0.00 H new ATOM 0 HG3 LYS A 13 0.579 -2.636 8.500 1.00 0.00 H new ATOM 0 HD2 LYS A 13 2.434 -3.577 7.620 1.00 0.00 H new ATOM 0 HD3 LYS A 13 3.108 -3.557 9.237 1.00 0.00 H new ATOM 0 HE2 LYS A 13 1.569 -5.834 7.938 1.00 0.00 H new ATOM 0 HE3 LYS A 13 3.282 -5.804 8.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 2.345 -7.001 10.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 2.535 -5.454 10.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 1.005 -5.969 10.186 1.00 0.00 H new ATOM 214 N PRO A 14 0.704 -0.303 8.442 1.00 0.00 N ATOM 215 CA PRO A 14 -0.205 0.414 7.544 1.00 0.00 C ATOM 216 C PRO A 14 -1.542 -0.298 7.399 1.00 0.00 C ATOM 217 O PRO A 14 -1.662 -1.485 7.702 1.00 0.00 O ATOM 218 CB PRO A 14 0.539 0.429 6.203 1.00 0.00 C ATOM 219 CG PRO A 14 1.969 0.200 6.552 1.00 0.00 C ATOM 220 CD PRO A 14 1.960 -0.680 7.767 1.00 0.00 C ATOM 0 HA PRO A 14 -0.443 1.409 7.919 1.00 0.00 H new ATOM 0 HB2 PRO A 14 0.166 -0.349 5.536 1.00 0.00 H new ATOM 0 HB3 PRO A 14 0.406 1.381 5.689 1.00 0.00 H new ATOM 0 HG2 PRO A 14 2.501 -0.277 5.728 1.00 0.00 H new ATOM 0 HG3 PRO A 14 2.477 1.143 6.756 1.00 0.00 H new ATOM 0 HD2 PRO A 14 1.973 -1.737 7.500 1.00 0.00 H new ATOM 0 HD3 PRO A 14 2.828 -0.501 8.401 1.00 0.00 H new ATOM 228 N VAL A 15 -2.549 0.439 6.949 1.00 0.00 N ATOM 229 CA VAL A 15 -3.882 -0.116 6.781 1.00 0.00 C ATOM 230 C VAL A 15 -3.955 -1.058 5.581 1.00 0.00 C ATOM 231 O VAL A 15 -3.756 -0.647 4.430 1.00 0.00 O ATOM 232 CB VAL A 15 -4.939 0.994 6.632 1.00 0.00 C ATOM 233 CG1 VAL A 15 -4.876 1.952 7.813 1.00 0.00 C ATOM 234 CG2 VAL A 15 -4.759 1.739 5.317 1.00 0.00 C ATOM 0 H VAL A 15 -2.466 1.423 6.694 1.00 0.00 H new ATOM 0 HA VAL A 15 -4.097 -0.688 7.684 1.00 0.00 H new ATOM 0 HB VAL A 15 -5.925 0.530 6.622 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.630 2.730 7.691 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.066 1.404 8.736 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -3.887 2.409 7.859 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.517 2.518 5.234 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -3.768 2.192 5.288 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -4.863 1.041 4.486 1.00 0.00 H new ATOM 244 N LYS A 16 -4.253 -2.323 5.870 1.00 0.00 N ATOM 245 CA LYS A 16 -4.376 -3.348 4.843 1.00 0.00 C ATOM 246 C LYS A 16 -5.832 -3.787 4.718 1.00 0.00 C ATOM 247 O LYS A 16 -6.585 -3.739 5.692 1.00 0.00 O ATOM 248 CB LYS A 16 -3.495 -4.556 5.178 1.00 0.00 C ATOM 249 CG LYS A 16 -3.734 -5.124 6.568 1.00 0.00 C ATOM 250 CD LYS A 16 -3.510 -6.628 6.600 1.00 0.00 C ATOM 251 CE LYS A 16 -2.343 -7.001 7.502 1.00 0.00 C ATOM 252 NZ LYS A 16 -2.453 -6.367 8.844 1.00 0.00 N ATOM 0 H LYS A 16 -4.415 -2.662 6.818 1.00 0.00 H new ATOM 0 HA LYS A 16 -4.044 -2.928 3.894 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -3.672 -5.339 4.441 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.448 -4.266 5.089 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -3.066 -4.640 7.280 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -4.753 -4.900 6.884 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -4.415 -7.124 6.951 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -3.320 -6.990 5.590 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -2.303 -8.084 7.615 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -1.409 -6.695 7.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -2.078 -7.015 9.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -1.907 -5.482 8.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -3.451 -6.160 9.050 1.00 0.00 H new ATOM 266 N PHE A 17 -6.229 -4.207 3.524 1.00 0.00 N ATOM 267 CA PHE A 17 -7.602 -4.643 3.296 1.00 0.00 C ATOM 268 C PHE A 17 -7.668 -5.707 2.210 1.00 0.00 C ATOM 269 O PHE A 17 -6.696 -5.940 1.493 1.00 0.00 O ATOM 270 CB PHE A 17 -8.478 -3.452 2.905 1.00 0.00 C ATOM 271 CG PHE A 17 -7.878 -2.593 1.828 1.00 0.00 C ATOM 272 CD1 PHE A 17 -7.208 -1.424 2.150 1.00 0.00 C ATOM 273 CD2 PHE A 17 -7.981 -2.955 0.494 1.00 0.00 C ATOM 274 CE1 PHE A 17 -6.654 -0.632 1.164 1.00 0.00 C ATOM 275 CE2 PHE A 17 -7.429 -2.167 -0.498 1.00 0.00 C ATOM 276 CZ PHE A 17 -6.762 -1.001 -0.161 1.00 0.00 C ATOM 0 H PHE A 17 -5.625 -4.255 2.703 1.00 0.00 H new ATOM 0 HA PHE A 17 -7.974 -5.076 4.225 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -9.447 -3.820 2.568 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -8.659 -2.839 3.788 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -7.118 -1.129 3.185 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -8.499 -3.864 0.227 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -6.136 0.277 1.430 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -7.518 -2.460 -1.534 1.00 0.00 H new ATOM 0 HZ PHE A 17 -6.328 -0.383 -0.933 1.00 0.00 H new ATOM 286 N GLN A 18 -8.826 -6.345 2.089 1.00 0.00 N ATOM 287 CA GLN A 18 -9.026 -7.378 1.083 1.00 0.00 C ATOM 288 C GLN A 18 -9.833 -6.827 -0.086 1.00 0.00 C ATOM 289 O GLN A 18 -10.902 -6.247 0.107 1.00 0.00 O ATOM 290 CB GLN A 18 -9.742 -8.584 1.691 1.00 0.00 C ATOM 291 CG GLN A 18 -9.357 -9.904 1.046 1.00 0.00 C ATOM 292 CD GLN A 18 -10.558 -10.765 0.713 1.00 0.00 C ATOM 293 OE1 GLN A 18 -11.557 -10.280 0.183 1.00 0.00 O ATOM 294 NE2 GLN A 18 -10.465 -12.051 1.025 1.00 0.00 N ATOM 0 H GLN A 18 -9.640 -6.164 2.676 1.00 0.00 H new ATOM 0 HA GLN A 18 -8.050 -7.698 0.718 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -9.518 -8.630 2.757 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -10.819 -8.443 1.597 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -8.792 -9.707 0.135 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -8.697 -10.453 1.718 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -9.617 -12.409 1.464 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -11.242 -12.681 0.826 1.00 0.00 H new ATOM 303 N LEU A 19 -9.317 -7.003 -1.296 1.00 0.00 N ATOM 304 CA LEU A 19 -9.998 -6.510 -2.487 1.00 0.00 C ATOM 305 C LEU A 19 -10.582 -7.656 -3.310 1.00 0.00 C ATOM 306 O LEU A 19 -11.498 -7.453 -4.107 1.00 0.00 O ATOM 307 CB LEU A 19 -9.037 -5.676 -3.341 1.00 0.00 C ATOM 308 CG LEU A 19 -9.261 -4.162 -3.279 1.00 0.00 C ATOM 309 CD1 LEU A 19 -8.381 -3.452 -4.296 1.00 0.00 C ATOM 310 CD2 LEU A 19 -10.725 -3.825 -3.518 1.00 0.00 C ATOM 0 H LEU A 19 -8.434 -7.481 -1.478 1.00 0.00 H new ATOM 0 HA LEU A 19 -10.825 -5.878 -2.163 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -8.016 -5.890 -3.025 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -9.124 -5.999 -4.379 1.00 0.00 H new ATOM 0 HG LEU A 19 -8.988 -3.817 -2.282 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -8.553 -2.377 -4.238 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -7.334 -3.664 -4.082 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -8.625 -3.805 -5.298 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -10.862 -2.745 -3.470 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -11.025 -4.185 -4.502 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -11.338 -4.303 -2.754 1.00 0.00 H new ATOM 322 N GLU A 20 -10.051 -8.861 -3.116 1.00 0.00 N ATOM 323 CA GLU A 20 -10.531 -10.028 -3.846 1.00 0.00 C ATOM 324 C GLU A 20 -10.872 -11.171 -2.895 1.00 0.00 C ATOM 325 O GLU A 20 -10.205 -11.372 -1.881 1.00 0.00 O ATOM 326 CB GLU A 20 -9.485 -10.485 -4.861 1.00 0.00 C ATOM 327 CG GLU A 20 -9.628 -9.820 -6.219 1.00 0.00 C ATOM 328 CD GLU A 20 -9.518 -10.803 -7.368 1.00 0.00 C ATOM 329 OE1 GLU A 20 -10.560 -11.117 -7.982 1.00 0.00 O ATOM 330 OE2 GLU A 20 -8.392 -11.261 -7.653 1.00 0.00 O ATOM 0 H GLU A 20 -9.292 -9.053 -2.462 1.00 0.00 H new ATOM 0 HA GLU A 20 -11.440 -9.743 -4.375 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -8.491 -10.276 -4.466 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -9.558 -11.565 -4.985 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -10.592 -9.314 -6.271 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -8.859 -9.055 -6.327 1.00 0.00 H new ATOM 337 N ASP A 21 -11.918 -11.915 -3.235 1.00 0.00 N ATOM 338 CA ASP A 21 -12.370 -13.045 -2.425 1.00 0.00 C ATOM 339 C ASP A 21 -11.315 -14.151 -2.347 1.00 0.00 C ATOM 340 O ASP A 21 -11.440 -15.077 -1.547 1.00 0.00 O ATOM 341 CB ASP A 21 -13.674 -13.610 -2.991 1.00 0.00 C ATOM 342 CG ASP A 21 -14.789 -13.631 -1.964 1.00 0.00 C ATOM 343 OD1 ASP A 21 -15.629 -14.554 -2.019 1.00 0.00 O ATOM 344 OD2 ASP A 21 -14.822 -12.725 -1.106 1.00 0.00 O ATOM 0 H ASP A 21 -12.475 -11.755 -4.074 1.00 0.00 H new ATOM 0 HA ASP A 21 -12.539 -12.675 -1.414 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -13.984 -13.012 -3.848 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -13.500 -14.623 -3.355 1.00 0.00 H new ATOM 349 N ASP A 22 -10.287 -14.065 -3.189 1.00 0.00 N ATOM 350 CA ASP A 22 -9.235 -15.077 -3.212 1.00 0.00 C ATOM 351 C ASP A 22 -8.203 -14.852 -2.105 1.00 0.00 C ATOM 352 O ASP A 22 -7.230 -15.599 -1.998 1.00 0.00 O ATOM 353 CB ASP A 22 -8.541 -15.083 -4.576 1.00 0.00 C ATOM 354 CG ASP A 22 -9.012 -16.223 -5.459 1.00 0.00 C ATOM 355 OD1 ASP A 22 -9.848 -15.975 -6.352 1.00 0.00 O ATOM 356 OD2 ASP A 22 -8.544 -17.362 -5.256 1.00 0.00 O ATOM 0 H ASP A 22 -10.161 -13.308 -3.861 1.00 0.00 H new ATOM 0 HA ASP A 22 -9.706 -16.044 -3.036 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -8.728 -14.135 -5.080 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -7.463 -15.160 -4.432 1.00 0.00 H new ATOM 361 N GLY A 23 -8.422 -13.836 -1.274 1.00 0.00 N ATOM 362 CA GLY A 23 -7.500 -13.562 -0.186 1.00 0.00 C ATOM 363 C GLY A 23 -6.482 -12.486 -0.515 1.00 0.00 C ATOM 364 O GLY A 23 -5.528 -12.283 0.237 1.00 0.00 O ATOM 0 H GLY A 23 -9.218 -13.201 -1.334 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -8.068 -13.258 0.693 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -6.975 -14.481 0.075 1.00 0.00 H new ATOM 368 N GLU A 24 -6.676 -11.792 -1.632 1.00 0.00 N ATOM 369 CA GLU A 24 -5.756 -10.736 -2.032 1.00 0.00 C ATOM 370 C GLU A 24 -5.871 -9.541 -1.094 1.00 0.00 C ATOM 371 O GLU A 24 -6.921 -8.900 -1.006 1.00 0.00 O ATOM 372 CB GLU A 24 -6.032 -10.311 -3.475 1.00 0.00 C ATOM 373 CG GLU A 24 -4.845 -10.511 -4.401 1.00 0.00 C ATOM 374 CD GLU A 24 -5.232 -10.447 -5.866 1.00 0.00 C ATOM 375 OE1 GLU A 24 -4.829 -9.479 -6.544 1.00 0.00 O ATOM 376 OE2 GLU A 24 -5.935 -11.367 -6.335 1.00 0.00 O ATOM 0 H GLU A 24 -7.457 -11.941 -2.271 1.00 0.00 H new ATOM 0 HA GLU A 24 -4.739 -11.123 -1.971 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -6.881 -10.878 -3.857 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -6.320 -9.260 -3.487 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -4.094 -9.748 -4.194 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -4.385 -11.477 -4.192 1.00 0.00 H new ATOM 383 N PHE A 25 -4.780 -9.250 -0.391 1.00 0.00 N ATOM 384 CA PHE A 25 -4.749 -8.138 0.548 1.00 0.00 C ATOM 385 C PHE A 25 -3.844 -7.020 0.046 1.00 0.00 C ATOM 386 O PHE A 25 -2.730 -7.264 -0.414 1.00 0.00 O ATOM 387 CB PHE A 25 -4.265 -8.616 1.920 1.00 0.00 C ATOM 388 CG PHE A 25 -5.380 -8.974 2.860 1.00 0.00 C ATOM 389 CD1 PHE A 25 -6.079 -10.159 2.704 1.00 0.00 C ATOM 390 CD2 PHE A 25 -5.729 -8.125 3.900 1.00 0.00 C ATOM 391 CE1 PHE A 25 -7.106 -10.493 3.565 1.00 0.00 C ATOM 392 CE2 PHE A 25 -6.756 -8.455 4.765 1.00 0.00 C ATOM 393 CZ PHE A 25 -7.445 -9.640 4.597 1.00 0.00 C ATOM 0 H PHE A 25 -3.906 -9.771 -0.456 1.00 0.00 H new ATOM 0 HA PHE A 25 -5.763 -7.748 0.638 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -3.621 -9.485 1.786 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -3.656 -7.834 2.374 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -5.818 -10.830 1.899 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -5.193 -7.197 4.035 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -7.643 -11.420 3.431 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -7.019 -7.787 5.571 1.00 0.00 H new ATOM 0 HZ PHE A 25 -8.248 -9.899 5.272 1.00 0.00 H new ATOM 403 N TYR A 26 -4.334 -5.792 0.149 1.00 0.00 N ATOM 404 CA TYR A 26 -3.575 -4.625 -0.279 1.00 0.00 C ATOM 405 C TYR A 26 -3.436 -3.632 0.865 1.00 0.00 C ATOM 406 O TYR A 26 -4.121 -3.739 1.882 1.00 0.00 O ATOM 407 CB TYR A 26 -4.243 -3.943 -1.470 1.00 0.00 C ATOM 408 CG TYR A 26 -4.250 -4.782 -2.726 1.00 0.00 C ATOM 409 CD1 TYR A 26 -3.318 -4.562 -3.732 1.00 0.00 C ATOM 410 CD2 TYR A 26 -5.184 -5.794 -2.908 1.00 0.00 C ATOM 411 CE1 TYR A 26 -3.317 -5.324 -4.884 1.00 0.00 C ATOM 412 CE2 TYR A 26 -5.189 -6.561 -4.057 1.00 0.00 C ATOM 413 CZ TYR A 26 -4.253 -6.324 -5.041 1.00 0.00 C ATOM 414 OH TYR A 26 -4.255 -7.085 -6.186 1.00 0.00 O ATOM 0 H TYR A 26 -5.257 -5.578 0.527 1.00 0.00 H new ATOM 0 HA TYR A 26 -2.585 -4.965 -0.582 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -5.270 -3.693 -1.205 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -3.729 -3.004 -1.674 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -2.581 -3.782 -3.611 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -5.918 -5.984 -2.139 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -2.587 -5.137 -5.658 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -5.923 -7.343 -4.184 1.00 0.00 H new ATOM 0 HH TYR A 26 -4.265 -8.035 -5.947 1.00 0.00 H new ATOM 424 N MET A 27 -2.546 -2.669 0.690 1.00 0.00 N ATOM 425 CA MET A 27 -2.309 -1.650 1.703 1.00 0.00 C ATOM 426 C MET A 27 -2.297 -0.265 1.071 1.00 0.00 C ATOM 427 O MET A 27 -1.887 -0.106 -0.079 1.00 0.00 O ATOM 428 CB MET A 27 -0.981 -1.908 2.414 1.00 0.00 C ATOM 429 CG MET A 27 -0.984 -3.162 3.271 1.00 0.00 C ATOM 430 SD MET A 27 -0.245 -2.898 4.893 1.00 0.00 S ATOM 431 CE MET A 27 1.131 -4.040 4.822 1.00 0.00 C ATOM 0 H MET A 27 -1.973 -2.570 -0.148 1.00 0.00 H new ATOM 0 HA MET A 27 -3.117 -1.697 2.433 1.00 0.00 H new ATOM 0 HB2 MET A 27 -0.189 -1.989 1.669 1.00 0.00 H new ATOM 0 HB3 MET A 27 -0.742 -1.050 3.042 1.00 0.00 H new ATOM 0 HG2 MET A 27 -2.010 -3.509 3.396 1.00 0.00 H new ATOM 0 HG3 MET A 27 -0.441 -3.952 2.753 1.00 0.00 H new ATOM 0 HE1 MET A 27 1.997 -3.597 5.314 1.00 0.00 H new ATOM 0 HE2 MET A 27 0.861 -4.967 5.327 1.00 0.00 H new ATOM 0 HE3 MET A 27 1.375 -4.252 3.781 1.00 0.00 H new ATOM 441 N ILE A 28 -2.747 0.738 1.821 1.00 0.00 N ATOM 442 CA ILE A 28 -2.772 2.102 1.300 1.00 0.00 C ATOM 443 C ILE A 28 -1.371 2.711 1.297 1.00 0.00 C ATOM 444 O ILE A 28 -0.720 2.820 2.340 1.00 0.00 O ATOM 445 CB ILE A 28 -3.731 3.012 2.091 1.00 0.00 C ATOM 446 CG1 ILE A 28 -5.083 2.323 2.277 1.00 0.00 C ATOM 447 CG2 ILE A 28 -3.913 4.333 1.362 1.00 0.00 C ATOM 448 CD1 ILE A 28 -6.107 3.174 2.998 1.00 0.00 C ATOM 0 H ILE A 28 -3.094 0.636 2.775 1.00 0.00 H new ATOM 0 HA ILE A 28 -3.140 2.037 0.276 1.00 0.00 H new ATOM 0 HB ILE A 28 -3.301 3.206 3.074 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -5.477 2.047 1.299 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -4.936 1.398 2.834 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -4.592 4.970 1.928 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -2.948 4.830 1.262 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -4.329 4.148 0.372 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -7.040 2.619 3.093 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -5.734 3.429 3.990 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -6.285 4.088 2.431 1.00 0.00 H new ATOM 460 N GLY A 29 -0.909 3.095 0.107 1.00 0.00 N ATOM 461 CA GLY A 29 0.419 3.668 -0.031 1.00 0.00 C ATOM 462 C GLY A 29 0.644 4.860 0.874 1.00 0.00 C ATOM 463 O GLY A 29 1.771 5.119 1.293 1.00 0.00 O ATOM 0 H GLY A 29 -1.433 3.019 -0.765 1.00 0.00 H new ATOM 0 HA2 GLY A 29 1.164 2.904 0.192 1.00 0.00 H new ATOM 0 HA3 GLY A 29 0.573 3.971 -1.067 1.00 0.00 H new ATOM 467 N SER A 30 -0.424 5.578 1.190 1.00 0.00 N ATOM 468 CA SER A 30 -0.320 6.734 2.069 1.00 0.00 C ATOM 469 C SER A 30 0.188 6.298 3.439 1.00 0.00 C ATOM 470 O SER A 30 1.049 6.953 4.039 1.00 0.00 O ATOM 471 CB SER A 30 -1.677 7.427 2.207 1.00 0.00 C ATOM 472 OG SER A 30 -2.247 7.688 0.936 1.00 0.00 O ATOM 0 H SER A 30 -1.367 5.383 0.854 1.00 0.00 H new ATOM 0 HA SER A 30 0.386 7.442 1.634 1.00 0.00 H new ATOM 0 HB2 SER A 30 -2.352 6.800 2.790 1.00 0.00 H new ATOM 0 HB3 SER A 30 -1.558 8.362 2.755 1.00 0.00 H new ATOM 0 HG SER A 30 -3.114 8.130 1.051 1.00 0.00 H new ATOM 478 N GLU A 31 -0.337 5.175 3.922 1.00 0.00 N ATOM 479 CA GLU A 31 0.073 4.640 5.211 1.00 0.00 C ATOM 480 C GLU A 31 1.496 4.115 5.126 1.00 0.00 C ATOM 481 O GLU A 31 2.309 4.339 6.022 1.00 0.00 O ATOM 482 CB GLU A 31 -0.877 3.530 5.660 1.00 0.00 C ATOM 483 CG GLU A 31 -2.228 4.043 6.131 1.00 0.00 C ATOM 484 CD GLU A 31 -2.393 3.953 7.635 1.00 0.00 C ATOM 485 OE1 GLU A 31 -2.132 2.870 8.198 1.00 0.00 O ATOM 486 OE2 GLU A 31 -2.785 4.967 8.250 1.00 0.00 O ATOM 0 H GLU A 31 -1.045 4.621 3.440 1.00 0.00 H new ATOM 0 HA GLU A 31 0.035 5.441 5.949 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -1.029 2.836 4.833 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -0.409 2.967 6.468 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -2.348 5.080 5.817 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -3.019 3.470 5.647 1.00 0.00 H new ATOM 493 N VAL A 32 1.790 3.429 4.030 1.00 0.00 N ATOM 494 CA VAL A 32 3.121 2.884 3.809 1.00 0.00 C ATOM 495 C VAL A 32 4.150 4.007 3.754 1.00 0.00 C ATOM 496 O VAL A 32 5.248 3.890 4.301 1.00 0.00 O ATOM 497 CB VAL A 32 3.187 2.072 2.502 1.00 0.00 C ATOM 498 CG1 VAL A 32 4.541 1.393 2.361 1.00 0.00 C ATOM 499 CG2 VAL A 32 2.062 1.049 2.452 1.00 0.00 C ATOM 0 H VAL A 32 1.125 3.237 3.281 1.00 0.00 H new ATOM 0 HA VAL A 32 3.345 2.219 4.643 1.00 0.00 H new ATOM 0 HB VAL A 32 3.062 2.758 1.664 1.00 0.00 H new ATOM 0 HG11 VAL A 32 4.568 0.824 1.431 1.00 0.00 H new ATOM 0 HG12 VAL A 32 5.327 2.148 2.347 1.00 0.00 H new ATOM 0 HG13 VAL A 32 4.700 0.719 3.203 1.00 0.00 H new ATOM 0 HG21 VAL A 32 2.124 0.485 1.522 1.00 0.00 H new ATOM 0 HG22 VAL A 32 2.153 0.367 3.297 1.00 0.00 H new ATOM 0 HG23 VAL A 32 1.101 1.562 2.501 1.00 0.00 H new ATOM 509 N GLY A 33 3.779 5.098 3.094 1.00 0.00 N ATOM 510 CA GLY A 33 4.670 6.235 2.980 1.00 0.00 C ATOM 511 C GLY A 33 5.000 6.841 4.328 1.00 0.00 C ATOM 512 O GLY A 33 6.171 7.033 4.657 1.00 0.00 O ATOM 0 H GLY A 33 2.875 5.215 2.635 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.592 5.924 2.488 1.00 0.00 H new ATOM 0 HA3 GLY A 33 4.210 6.993 2.346 1.00 0.00 H new ATOM 516 N ASN A 34 3.974 7.127 5.125 1.00 0.00 N ATOM 517 CA ASN A 34 4.197 7.696 6.447 1.00 0.00 C ATOM 518 C ASN A 34 4.913 6.688 7.341 1.00 0.00 C ATOM 519 O ASN A 34 5.711 7.059 8.202 1.00 0.00 O ATOM 520 CB ASN A 34 2.881 8.164 7.085 1.00 0.00 C ATOM 521 CG ASN A 34 1.940 7.030 7.449 1.00 0.00 C ATOM 522 OD1 ASN A 34 2.365 5.968 7.903 1.00 0.00 O ATOM 523 ND2 ASN A 34 0.646 7.257 7.262 1.00 0.00 N ATOM 0 H ASN A 34 2.995 6.976 4.882 1.00 0.00 H new ATOM 0 HA ASN A 34 4.833 8.574 6.337 1.00 0.00 H new ATOM 0 HB2 ASN A 34 3.108 8.738 7.983 1.00 0.00 H new ATOM 0 HB3 ASN A 34 2.373 8.838 6.395 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -0.037 6.537 7.497 1.00 0.00 H new ATOM 0 HD22 ASN A 34 0.335 8.151 6.883 1.00 0.00 H new ATOM 530 N TYR A 35 4.622 5.409 7.121 1.00 0.00 N ATOM 531 CA TYR A 35 5.234 4.333 7.893 1.00 0.00 C ATOM 532 C TYR A 35 6.749 4.349 7.735 1.00 0.00 C ATOM 533 O TYR A 35 7.487 4.201 8.709 1.00 0.00 O ATOM 534 CB TYR A 35 4.673 2.990 7.421 1.00 0.00 C ATOM 535 CG TYR A 35 4.950 1.848 8.362 1.00 0.00 C ATOM 536 CD1 TYR A 35 4.959 2.047 9.732 1.00 0.00 C ATOM 537 CD2 TYR A 35 5.207 0.571 7.881 1.00 0.00 C ATOM 538 CE1 TYR A 35 5.214 1.011 10.600 1.00 0.00 C ATOM 539 CE2 TYR A 35 5.461 -0.474 8.745 1.00 0.00 C ATOM 540 CZ TYR A 35 5.464 -0.250 10.105 1.00 0.00 C ATOM 541 OH TYR A 35 5.718 -1.290 10.970 1.00 0.00 O ATOM 0 H TYR A 35 3.963 5.092 6.410 1.00 0.00 H new ATOM 0 HA TYR A 35 5.001 4.478 8.948 1.00 0.00 H new ATOM 0 HB2 TYR A 35 3.595 3.084 7.287 1.00 0.00 H new ATOM 0 HB3 TYR A 35 5.096 2.754 6.444 1.00 0.00 H new ATOM 0 HD1 TYR A 35 4.762 3.033 10.126 1.00 0.00 H new ATOM 0 HD2 TYR A 35 5.208 0.393 6.816 1.00 0.00 H new ATOM 0 HE1 TYR A 35 5.218 1.186 11.666 1.00 0.00 H new ATOM 0 HE2 TYR A 35 5.657 -1.463 8.358 1.00 0.00 H new ATOM 0 HH TYR A 35 5.873 -2.111 10.458 1.00 0.00 H new ATOM 551 N LEU A 36 7.205 4.550 6.507 1.00 0.00 N ATOM 552 CA LEU A 36 8.635 4.608 6.226 1.00 0.00 C ATOM 553 C LEU A 36 9.130 6.056 6.220 1.00 0.00 C ATOM 554 O LEU A 36 10.325 6.313 6.078 1.00 0.00 O ATOM 555 CB LEU A 36 8.951 3.940 4.887 1.00 0.00 C ATOM 556 CG LEU A 36 8.582 2.458 4.803 1.00 0.00 C ATOM 557 CD1 LEU A 36 7.639 2.202 3.639 1.00 0.00 C ATOM 558 CD2 LEU A 36 9.833 1.602 4.674 1.00 0.00 C ATOM 0 H LEU A 36 6.608 4.676 5.690 1.00 0.00 H new ATOM 0 HA LEU A 36 9.154 4.067 7.017 1.00 0.00 H new ATOM 0 HB2 LEU A 36 8.424 4.476 4.097 1.00 0.00 H new ATOM 0 HB3 LEU A 36 10.017 4.046 4.688 1.00 0.00 H new ATOM 0 HG LEU A 36 8.069 2.183 5.724 1.00 0.00 H new ATOM 0 HD11 LEU A 36 7.390 1.142 3.599 1.00 0.00 H new ATOM 0 HD12 LEU A 36 6.727 2.784 3.775 1.00 0.00 H new ATOM 0 HD13 LEU A 36 8.122 2.497 2.708 1.00 0.00 H new ATOM 0 HD21 LEU A 36 9.550 0.551 4.616 1.00 0.00 H new ATOM 0 HD22 LEU A 36 10.374 1.883 3.771 1.00 0.00 H new ATOM 0 HD23 LEU A 36 10.472 1.758 5.543 1.00 0.00 H new ATOM 570 N ARG A 37 8.201 6.999 6.380 1.00 0.00 N ATOM 571 CA ARG A 37 8.533 8.420 6.399 1.00 0.00 C ATOM 572 C ARG A 37 8.995 8.902 5.029 1.00 0.00 C ATOM 573 O ARG A 37 9.818 9.813 4.926 1.00 0.00 O ATOM 574 CB ARG A 37 9.611 8.707 7.446 1.00 0.00 C ATOM 575 CG ARG A 37 9.721 10.176 7.819 1.00 0.00 C ATOM 576 CD ARG A 37 8.638 10.584 8.804 1.00 0.00 C ATOM 577 NE ARG A 37 9.024 10.315 10.188 1.00 0.00 N ATOM 578 CZ ARG A 37 8.335 10.735 11.246 1.00 0.00 C ATOM 579 NH1 ARG A 37 7.224 11.445 11.085 1.00 0.00 N ATOM 580 NH2 ARG A 37 8.756 10.445 12.469 1.00 0.00 N ATOM 0 H ARG A 37 7.208 6.800 6.499 1.00 0.00 H new ATOM 0 HA ARG A 37 7.627 8.966 6.663 1.00 0.00 H new ATOM 0 HB2 ARG A 37 9.397 8.128 8.344 1.00 0.00 H new ATOM 0 HB3 ARG A 37 10.574 8.364 7.068 1.00 0.00 H new ATOM 0 HG2 ARG A 37 10.701 10.369 8.254 1.00 0.00 H new ATOM 0 HG3 ARG A 37 9.645 10.787 6.920 1.00 0.00 H new ATOM 0 HD2 ARG A 37 8.424 11.647 8.688 1.00 0.00 H new ATOM 0 HD3 ARG A 37 7.718 10.047 8.574 1.00 0.00 H new ATOM 0 HE ARG A 37 9.872 9.773 10.353 1.00 0.00 H new ATOM 0 HH11 ARG A 37 6.895 11.671 10.146 1.00 0.00 H new ATOM 0 HH12 ARG A 37 6.700 11.764 11.900 1.00 0.00 H new ATOM 0 HH21 ARG A 37 9.608 9.900 12.599 1.00 0.00 H new ATOM 0 HH22 ARG A 37 8.228 10.767 13.280 1.00 0.00 H new ATOM 594 N MET A 38 8.448 8.304 3.976 1.00 0.00 N ATOM 595 CA MET A 38 8.796 8.695 2.617 1.00 0.00 C ATOM 596 C MET A 38 7.704 9.588 2.040 1.00 0.00 C ATOM 597 O MET A 38 6.529 9.226 2.042 1.00 0.00 O ATOM 598 CB MET A 38 8.984 7.458 1.736 1.00 0.00 C ATOM 599 CG MET A 38 10.064 6.512 2.238 1.00 0.00 C ATOM 600 SD MET A 38 11.497 6.444 1.145 1.00 0.00 S ATOM 601 CE MET A 38 11.278 4.830 0.401 1.00 0.00 C ATOM 0 H MET A 38 7.764 7.550 4.038 1.00 0.00 H new ATOM 0 HA MET A 38 9.735 9.248 2.641 1.00 0.00 H new ATOM 0 HB2 MET A 38 8.039 6.918 1.676 1.00 0.00 H new ATOM 0 HB3 MET A 38 9.234 7.777 0.724 1.00 0.00 H new ATOM 0 HG2 MET A 38 10.385 6.828 3.231 1.00 0.00 H new ATOM 0 HG3 MET A 38 9.644 5.511 2.342 1.00 0.00 H new ATOM 0 HE1 MET A 38 12.214 4.274 0.457 1.00 0.00 H new ATOM 0 HE2 MET A 38 10.500 4.286 0.936 1.00 0.00 H new ATOM 0 HE3 MET A 38 10.987 4.947 -0.643 1.00 0.00 H new ATOM 611 N PHE A 39 8.097 10.761 1.557 1.00 0.00 N ATOM 612 CA PHE A 39 7.143 11.709 0.991 1.00 0.00 C ATOM 613 C PHE A 39 7.558 12.133 -0.414 1.00 0.00 C ATOM 614 O PHE A 39 8.626 11.757 -0.897 1.00 0.00 O ATOM 615 CB PHE A 39 7.016 12.934 1.901 1.00 0.00 C ATOM 616 CG PHE A 39 7.057 12.597 3.367 1.00 0.00 C ATOM 617 CD1 PHE A 39 7.830 13.344 4.243 1.00 0.00 C ATOM 618 CD2 PHE A 39 6.329 11.528 3.866 1.00 0.00 C ATOM 619 CE1 PHE A 39 7.874 13.030 5.589 1.00 0.00 C ATOM 620 CE2 PHE A 39 6.369 11.211 5.211 1.00 0.00 C ATOM 621 CZ PHE A 39 7.142 11.962 6.073 1.00 0.00 C ATOM 0 H PHE A 39 9.066 11.078 1.546 1.00 0.00 H new ATOM 0 HA PHE A 39 6.173 11.216 0.921 1.00 0.00 H new ATOM 0 HB2 PHE A 39 7.822 13.631 1.674 1.00 0.00 H new ATOM 0 HB3 PHE A 39 6.080 13.446 1.680 1.00 0.00 H new ATOM 0 HD1 PHE A 39 8.404 14.180 3.870 1.00 0.00 H new ATOM 0 HD2 PHE A 39 5.723 10.936 3.196 1.00 0.00 H new ATOM 0 HE1 PHE A 39 8.480 13.619 6.262 1.00 0.00 H new ATOM 0 HE2 PHE A 39 5.796 10.376 5.587 1.00 0.00 H new ATOM 0 HZ PHE A 39 7.175 11.716 7.124 1.00 0.00 H new ATOM 631 N ARG A 40 6.704 12.917 -1.064 1.00 0.00 N ATOM 632 CA ARG A 40 6.980 13.391 -2.416 1.00 0.00 C ATOM 633 C ARG A 40 7.131 12.219 -3.379 1.00 0.00 C ATOM 634 O ARG A 40 7.957 12.253 -4.291 1.00 0.00 O ATOM 635 CB ARG A 40 8.249 14.245 -2.429 1.00 0.00 C ATOM 636 CG ARG A 40 8.182 15.452 -1.506 1.00 0.00 C ATOM 637 CD ARG A 40 9.417 16.328 -1.644 1.00 0.00 C ATOM 638 NE ARG A 40 9.440 17.043 -2.919 1.00 0.00 N ATOM 639 CZ ARG A 40 8.736 18.145 -3.164 1.00 0.00 C ATOM 640 NH1 ARG A 40 7.952 18.663 -2.227 1.00 0.00 N ATOM 641 NH2 ARG A 40 8.815 18.731 -4.351 1.00 0.00 N ATOM 0 H ARG A 40 5.816 13.237 -0.677 1.00 0.00 H new ATOM 0 HA ARG A 40 6.138 14.001 -2.742 1.00 0.00 H new ATOM 0 HB2 ARG A 40 9.097 13.624 -2.140 1.00 0.00 H new ATOM 0 HB3 ARG A 40 8.436 14.587 -3.447 1.00 0.00 H new ATOM 0 HG2 ARG A 40 7.292 16.038 -1.735 1.00 0.00 H new ATOM 0 HG3 ARG A 40 8.086 15.117 -0.473 1.00 0.00 H new ATOM 0 HD2 ARG A 40 9.446 17.046 -0.825 1.00 0.00 H new ATOM 0 HD3 ARG A 40 10.311 15.711 -1.558 1.00 0.00 H new ATOM 0 HE ARG A 40 10.031 16.675 -3.665 1.00 0.00 H new ATOM 0 HH11 ARG A 40 7.887 18.216 -1.312 1.00 0.00 H new ATOM 0 HH12 ARG A 40 7.415 19.508 -2.421 1.00 0.00 H new ATOM 0 HH21 ARG A 40 9.415 18.337 -5.075 1.00 0.00 H new ATOM 0 HH22 ARG A 40 8.276 19.576 -4.540 1.00 0.00 H new ATOM 655 N GLY A 41 6.328 11.182 -3.167 1.00 0.00 N ATOM 656 CA GLY A 41 6.389 10.010 -4.022 1.00 0.00 C ATOM 657 C GLY A 41 7.706 9.269 -3.896 1.00 0.00 C ATOM 658 O GLY A 41 8.071 8.488 -4.775 1.00 0.00 O ATOM 0 H GLY A 41 5.636 11.132 -2.419 1.00 0.00 H new ATOM 0 HA2 GLY A 41 5.571 9.336 -3.769 1.00 0.00 H new ATOM 0 HA3 GLY A 41 6.243 10.312 -5.059 1.00 0.00 H new ATOM 662 N SER A 42 8.421 9.512 -2.801 1.00 0.00 N ATOM 663 CA SER A 42 9.704 8.861 -2.563 1.00 0.00 C ATOM 664 C SER A 42 9.551 7.344 -2.543 1.00 0.00 C ATOM 665 O SER A 42 10.447 6.615 -2.965 1.00 0.00 O ATOM 666 CB SER A 42 10.307 9.344 -1.243 1.00 0.00 C ATOM 667 OG SER A 42 11.245 10.383 -1.459 1.00 0.00 O ATOM 0 H SER A 42 8.133 10.156 -2.064 1.00 0.00 H new ATOM 0 HA SER A 42 10.375 9.127 -3.380 1.00 0.00 H new ATOM 0 HB2 SER A 42 9.513 9.698 -0.585 1.00 0.00 H new ATOM 0 HB3 SER A 42 10.793 8.511 -0.736 1.00 0.00 H new ATOM 0 HG SER A 42 10.792 11.250 -1.403 1.00 0.00 H new ATOM 673 N LEU A 43 8.411 6.876 -2.047 1.00 0.00 N ATOM 674 CA LEU A 43 8.143 5.445 -1.970 1.00 0.00 C ATOM 675 C LEU A 43 8.057 4.830 -3.363 1.00 0.00 C ATOM 676 O LEU A 43 8.675 3.803 -3.637 1.00 0.00 O ATOM 677 CB LEU A 43 6.841 5.190 -1.207 1.00 0.00 C ATOM 678 CG LEU A 43 6.748 3.823 -0.524 1.00 0.00 C ATOM 679 CD1 LEU A 43 7.157 3.928 0.937 1.00 0.00 C ATOM 680 CD2 LEU A 43 5.340 3.260 -0.645 1.00 0.00 C ATOM 0 H LEU A 43 7.658 7.466 -1.693 1.00 0.00 H new ATOM 0 HA LEU A 43 8.969 4.975 -1.436 1.00 0.00 H new ATOM 0 HB2 LEU A 43 6.723 5.966 -0.451 1.00 0.00 H new ATOM 0 HB3 LEU A 43 6.006 5.291 -1.900 1.00 0.00 H new ATOM 0 HG LEU A 43 7.435 3.141 -1.025 1.00 0.00 H new ATOM 0 HD11 LEU A 43 7.085 2.947 1.406 1.00 0.00 H new ATOM 0 HD12 LEU A 43 8.184 4.287 1.002 1.00 0.00 H new ATOM 0 HD13 LEU A 43 6.496 4.626 1.451 1.00 0.00 H new ATOM 0 HD21 LEU A 43 5.293 2.288 -0.154 1.00 0.00 H new ATOM 0 HD22 LEU A 43 4.634 3.941 -0.170 1.00 0.00 H new ATOM 0 HD23 LEU A 43 5.083 3.147 -1.698 1.00 0.00 H new ATOM 692 N TYR A 44 7.284 5.464 -4.239 1.00 0.00 N ATOM 693 CA TYR A 44 7.117 4.974 -5.603 1.00 0.00 C ATOM 694 C TYR A 44 8.380 5.202 -6.427 1.00 0.00 C ATOM 695 O TYR A 44 8.768 4.354 -7.231 1.00 0.00 O ATOM 696 CB TYR A 44 5.927 5.665 -6.271 1.00 0.00 C ATOM 697 CG TYR A 44 4.611 5.419 -5.568 1.00 0.00 C ATOM 698 CD1 TYR A 44 4.210 4.131 -5.238 1.00 0.00 C ATOM 699 CD2 TYR A 44 3.772 6.474 -5.232 1.00 0.00 C ATOM 700 CE1 TYR A 44 3.008 3.900 -4.594 1.00 0.00 C ATOM 701 CE2 TYR A 44 2.569 6.251 -4.588 1.00 0.00 C ATOM 702 CZ TYR A 44 2.193 4.964 -4.272 1.00 0.00 C ATOM 703 OH TYR A 44 0.997 4.738 -3.630 1.00 0.00 O ATOM 0 H TYR A 44 6.764 6.316 -4.030 1.00 0.00 H new ATOM 0 HA TYR A 44 6.929 3.901 -5.555 1.00 0.00 H new ATOM 0 HB2 TYR A 44 6.115 6.738 -6.308 1.00 0.00 H new ATOM 0 HB3 TYR A 44 5.849 5.320 -7.302 1.00 0.00 H new ATOM 0 HD1 TYR A 44 4.847 3.296 -5.488 1.00 0.00 H new ATOM 0 HD2 TYR A 44 4.064 7.484 -5.478 1.00 0.00 H new ATOM 0 HE1 TYR A 44 2.710 2.892 -4.345 1.00 0.00 H new ATOM 0 HE2 TYR A 44 1.927 7.082 -4.334 1.00 0.00 H new ATOM 0 HH TYR A 44 0.543 5.592 -3.474 1.00 0.00 H new ATOM 713 N LYS A 45 9.020 6.348 -6.221 1.00 0.00 N ATOM 714 CA LYS A 45 10.241 6.681 -6.946 1.00 0.00 C ATOM 715 C LYS A 45 11.404 5.816 -6.472 1.00 0.00 C ATOM 716 O LYS A 45 12.322 5.517 -7.238 1.00 0.00 O ATOM 717 CB LYS A 45 10.580 8.164 -6.764 1.00 0.00 C ATOM 718 CG LYS A 45 10.536 8.960 -8.058 1.00 0.00 C ATOM 719 CD LYS A 45 10.054 10.382 -7.820 1.00 0.00 C ATOM 720 CE LYS A 45 9.129 10.851 -8.933 1.00 0.00 C ATOM 721 NZ LYS A 45 7.695 10.724 -8.553 1.00 0.00 N ATOM 0 H LYS A 45 8.714 7.061 -5.559 1.00 0.00 H new ATOM 0 HA LYS A 45 10.073 6.484 -8.005 1.00 0.00 H new ATOM 0 HB2 LYS A 45 9.881 8.604 -6.053 1.00 0.00 H new ATOM 0 HB3 LYS A 45 11.575 8.250 -6.328 1.00 0.00 H new ATOM 0 HG2 LYS A 45 11.529 8.981 -8.507 1.00 0.00 H new ATOM 0 HG3 LYS A 45 9.875 8.465 -8.769 1.00 0.00 H new ATOM 0 HD2 LYS A 45 9.532 10.435 -6.865 1.00 0.00 H new ATOM 0 HD3 LYS A 45 10.912 11.051 -7.752 1.00 0.00 H new ATOM 0 HE2 LYS A 45 9.350 11.891 -9.175 1.00 0.00 H new ATOM 0 HE3 LYS A 45 9.319 10.267 -9.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 7.097 11.054 -9.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 7.477 9.728 -8.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 7.507 11.301 -7.709 1.00 0.00 H new ATOM 735 N ARG A 46 11.361 5.418 -5.205 1.00 0.00 N ATOM 736 CA ARG A 46 12.410 4.586 -4.627 1.00 0.00 C ATOM 737 C ARG A 46 12.136 3.105 -4.871 1.00 0.00 C ATOM 738 O ARG A 46 13.056 2.289 -4.867 1.00 0.00 O ATOM 739 CB ARG A 46 12.529 4.852 -3.125 1.00 0.00 C ATOM 740 CG ARG A 46 13.689 4.120 -2.469 1.00 0.00 C ATOM 741 CD ARG A 46 14.851 5.058 -2.181 1.00 0.00 C ATOM 742 NE ARG A 46 15.535 4.716 -0.936 1.00 0.00 N ATOM 743 CZ ARG A 46 16.733 5.185 -0.595 1.00 0.00 C ATOM 744 NH1 ARG A 46 17.381 6.017 -1.400 1.00 0.00 N ATOM 745 NH2 ARG A 46 17.283 4.822 0.556 1.00 0.00 N ATOM 0 H ARG A 46 10.610 5.659 -4.558 1.00 0.00 H new ATOM 0 HA ARG A 46 13.350 4.845 -5.114 1.00 0.00 H new ATOM 0 HB2 ARG A 46 12.647 5.923 -2.962 1.00 0.00 H new ATOM 0 HB3 ARG A 46 11.600 4.556 -2.637 1.00 0.00 H new ATOM 0 HG2 ARG A 46 13.352 3.661 -1.539 1.00 0.00 H new ATOM 0 HG3 ARG A 46 14.025 3.312 -3.119 1.00 0.00 H new ATOM 0 HD2 ARG A 46 15.561 5.020 -3.007 1.00 0.00 H new ATOM 0 HD3 ARG A 46 14.484 6.083 -2.123 1.00 0.00 H new ATOM 0 HE ARG A 46 15.067 4.080 -0.290 1.00 0.00 H new ATOM 0 HH11 ARG A 46 16.961 6.300 -2.285 1.00 0.00 H new ATOM 0 HH12 ARG A 46 18.299 6.373 -1.133 1.00 0.00 H new ATOM 0 HH21 ARG A 46 16.788 4.184 1.179 1.00 0.00 H new ATOM 0 HH22 ARG A 46 18.201 5.181 0.818 1.00 0.00 H new ATOM 759 N TYR A 47 10.868 2.764 -5.078 1.00 0.00 N ATOM 760 CA TYR A 47 10.479 1.378 -5.317 1.00 0.00 C ATOM 761 C TYR A 47 9.746 1.233 -6.651 1.00 0.00 C ATOM 762 O TYR A 47 8.527 1.059 -6.688 1.00 0.00 O ATOM 763 CB TYR A 47 9.598 0.878 -4.175 1.00 0.00 C ATOM 764 CG TYR A 47 10.358 0.606 -2.901 1.00 0.00 C ATOM 765 CD1 TYR A 47 10.414 1.546 -1.881 1.00 0.00 C ATOM 766 CD2 TYR A 47 11.023 -0.596 -2.722 1.00 0.00 C ATOM 767 CE1 TYR A 47 11.111 1.292 -0.715 1.00 0.00 C ATOM 768 CE2 TYR A 47 11.722 -0.861 -1.564 1.00 0.00 C ATOM 769 CZ TYR A 47 11.764 0.086 -0.560 1.00 0.00 C ATOM 770 OH TYR A 47 12.460 -0.171 0.601 1.00 0.00 O ATOM 0 H TYR A 47 10.093 3.427 -5.085 1.00 0.00 H new ATOM 0 HA TYR A 47 11.385 0.773 -5.362 1.00 0.00 H new ATOM 0 HB2 TYR A 47 8.823 1.617 -3.975 1.00 0.00 H new ATOM 0 HB3 TYR A 47 9.094 -0.036 -4.490 1.00 0.00 H new ATOM 0 HD1 TYR A 47 9.905 2.491 -2.001 1.00 0.00 H new ATOM 0 HD2 TYR A 47 10.993 -1.340 -3.505 1.00 0.00 H new ATOM 0 HE1 TYR A 47 11.145 2.033 0.070 1.00 0.00 H new ATOM 0 HE2 TYR A 47 12.234 -1.804 -1.443 1.00 0.00 H new ATOM 0 HH TYR A 47 12.736 -1.111 0.616 1.00 0.00 H new ATOM 780 N PRO A 48 10.488 1.308 -7.769 1.00 0.00 N ATOM 781 CA PRO A 48 9.916 1.194 -9.116 1.00 0.00 C ATOM 782 C PRO A 48 9.223 -0.145 -9.369 1.00 0.00 C ATOM 783 O PRO A 48 8.257 -0.213 -10.131 1.00 0.00 O ATOM 784 CB PRO A 48 11.132 1.340 -10.041 1.00 0.00 C ATOM 785 CG PRO A 48 12.314 1.050 -9.182 1.00 0.00 C ATOM 786 CD PRO A 48 11.944 1.517 -7.807 1.00 0.00 C ATOM 0 HA PRO A 48 9.140 1.943 -9.275 1.00 0.00 H new ATOM 0 HB2 PRO A 48 11.075 0.646 -10.879 1.00 0.00 H new ATOM 0 HB3 PRO A 48 11.188 2.344 -10.462 1.00 0.00 H new ATOM 0 HG2 PRO A 48 12.547 -0.015 -9.184 1.00 0.00 H new ATOM 0 HG3 PRO A 48 13.200 1.571 -9.547 1.00 0.00 H new ATOM 0 HD2 PRO A 48 12.455 0.943 -7.034 1.00 0.00 H new ATOM 0 HD3 PRO A 48 12.206 2.564 -7.652 1.00 0.00 H new ATOM 794 N SER A 49 9.722 -1.209 -8.747 1.00 0.00 N ATOM 795 CA SER A 49 9.143 -2.538 -8.935 1.00 0.00 C ATOM 796 C SER A 49 8.000 -2.810 -7.955 1.00 0.00 C ATOM 797 O SER A 49 7.491 -3.928 -7.886 1.00 0.00 O ATOM 798 CB SER A 49 10.231 -3.608 -8.798 1.00 0.00 C ATOM 799 OG SER A 49 9.759 -4.752 -8.106 1.00 0.00 O ATOM 0 H SER A 49 10.520 -1.179 -8.113 1.00 0.00 H new ATOM 0 HA SER A 49 8.723 -2.577 -9.940 1.00 0.00 H new ATOM 0 HB2 SER A 49 10.580 -3.900 -9.788 1.00 0.00 H new ATOM 0 HB3 SER A 49 11.087 -3.190 -8.269 1.00 0.00 H new ATOM 0 HG SER A 49 8.827 -4.925 -8.357 1.00 0.00 H new ATOM 805 N LEU A 50 7.595 -1.794 -7.202 1.00 0.00 N ATOM 806 CA LEU A 50 6.512 -1.955 -6.239 1.00 0.00 C ATOM 807 C LEU A 50 5.151 -1.794 -6.908 1.00 0.00 C ATOM 808 O LEU A 50 4.908 -0.818 -7.619 1.00 0.00 O ATOM 809 CB LEU A 50 6.664 -0.941 -5.110 1.00 0.00 C ATOM 810 CG LEU A 50 6.062 -1.361 -3.771 1.00 0.00 C ATOM 811 CD1 LEU A 50 6.921 -2.434 -3.121 1.00 0.00 C ATOM 812 CD2 LEU A 50 5.924 -0.159 -2.851 1.00 0.00 C ATOM 0 H LEU A 50 7.996 -0.857 -7.239 1.00 0.00 H new ATOM 0 HA LEU A 50 6.569 -2.963 -5.828 1.00 0.00 H new ATOM 0 HB2 LEU A 50 7.725 -0.739 -4.965 1.00 0.00 H new ATOM 0 HB3 LEU A 50 6.201 -0.004 -5.420 1.00 0.00 H new ATOM 0 HG LEU A 50 5.069 -1.773 -3.949 1.00 0.00 H new ATOM 0 HD11 LEU A 50 6.481 -2.724 -2.167 1.00 0.00 H new ATOM 0 HD12 LEU A 50 6.974 -3.304 -3.776 1.00 0.00 H new ATOM 0 HD13 LEU A 50 7.925 -2.044 -2.953 1.00 0.00 H new ATOM 0 HD21 LEU A 50 5.493 -0.475 -1.901 1.00 0.00 H new ATOM 0 HD22 LEU A 50 6.906 0.280 -2.676 1.00 0.00 H new ATOM 0 HD23 LEU A 50 5.273 0.582 -3.315 1.00 0.00 H new ATOM 824 N TRP A 51 4.267 -2.759 -6.675 1.00 0.00 N ATOM 825 CA TRP A 51 2.928 -2.728 -7.251 1.00 0.00 C ATOM 826 C TRP A 51 2.089 -1.624 -6.615 1.00 0.00 C ATOM 827 O TRP A 51 1.805 -1.663 -5.419 1.00 0.00 O ATOM 828 CB TRP A 51 2.235 -4.079 -7.056 1.00 0.00 C ATOM 829 CG TRP A 51 0.889 -4.160 -7.713 1.00 0.00 C ATOM 830 CD1 TRP A 51 0.598 -4.708 -8.928 1.00 0.00 C ATOM 831 CD2 TRP A 51 -0.350 -3.677 -7.184 1.00 0.00 C ATOM 832 NE1 TRP A 51 -0.746 -4.588 -9.189 1.00 0.00 N ATOM 833 CE2 TRP A 51 -1.350 -3.959 -8.131 1.00 0.00 C ATOM 834 CE3 TRP A 51 -0.707 -3.034 -5.999 1.00 0.00 C ATOM 835 CZ2 TRP A 51 -2.684 -3.617 -7.928 1.00 0.00 C ATOM 836 CZ3 TRP A 51 -2.028 -2.694 -5.795 1.00 0.00 C ATOM 837 CH2 TRP A 51 -3.005 -2.985 -6.757 1.00 0.00 C ATOM 0 H TRP A 51 4.455 -3.573 -6.090 1.00 0.00 H new ATOM 0 HA TRP A 51 3.024 -2.524 -8.317 1.00 0.00 H new ATOM 0 HB2 TRP A 51 2.874 -4.867 -7.455 1.00 0.00 H new ATOM 0 HB3 TRP A 51 2.122 -4.270 -5.989 1.00 0.00 H new ATOM 0 HD1 TRP A 51 1.318 -5.169 -9.588 1.00 0.00 H new ATOM 0 HE1 TRP A 51 -1.218 -4.914 -10.033 1.00 0.00 H new ATOM 0 HE3 TRP A 51 0.039 -2.806 -5.253 1.00 0.00 H new ATOM 0 HZ2 TRP A 51 -3.438 -3.842 -8.667 1.00 0.00 H new ATOM 0 HZ3 TRP A 51 -2.314 -2.196 -4.880 1.00 0.00 H new ATOM 0 HH2 TRP A 51 -4.031 -2.705 -6.571 1.00 0.00 H new ATOM 848 N ARG A 52 1.692 -0.644 -7.420 1.00 0.00 N ATOM 849 CA ARG A 52 0.877 0.461 -6.928 1.00 0.00 C ATOM 850 C ARG A 52 -0.201 0.828 -7.941 1.00 0.00 C ATOM 851 O ARG A 52 0.056 0.874 -9.144 1.00 0.00 O ATOM 852 CB ARG A 52 1.755 1.680 -6.632 1.00 0.00 C ATOM 853 CG ARG A 52 2.433 2.256 -7.865 1.00 0.00 C ATOM 854 CD ARG A 52 1.755 3.537 -8.328 1.00 0.00 C ATOM 855 NE ARG A 52 2.118 3.884 -9.700 1.00 0.00 N ATOM 856 CZ ARG A 52 1.930 5.088 -10.234 1.00 0.00 C ATOM 857 NH1 ARG A 52 1.386 6.063 -9.516 1.00 0.00 N ATOM 858 NH2 ARG A 52 2.287 5.319 -11.489 1.00 0.00 N ATOM 0 H ARG A 52 1.920 -0.592 -8.413 1.00 0.00 H new ATOM 0 HA ARG A 52 0.392 0.142 -6.005 1.00 0.00 H new ATOM 0 HB2 ARG A 52 1.143 2.454 -6.169 1.00 0.00 H new ATOM 0 HB3 ARG A 52 2.518 1.400 -5.906 1.00 0.00 H new ATOM 0 HG2 ARG A 52 3.481 2.457 -7.644 1.00 0.00 H new ATOM 0 HG3 ARG A 52 2.412 1.521 -8.670 1.00 0.00 H new ATOM 0 HD2 ARG A 52 0.674 3.420 -8.258 1.00 0.00 H new ATOM 0 HD3 ARG A 52 2.031 4.354 -7.662 1.00 0.00 H new ATOM 0 HE ARG A 52 2.540 3.161 -10.283 1.00 0.00 H new ATOM 0 HH11 ARG A 52 1.110 5.891 -8.549 1.00 0.00 H new ATOM 0 HH12 ARG A 52 1.244 6.984 -9.931 1.00 0.00 H new ATOM 0 HH21 ARG A 52 2.706 4.574 -12.045 1.00 0.00 H new ATOM 0 HH22 ARG A 52 2.143 6.242 -11.899 1.00 0.00 H new ATOM 872 N ARG A 53 -1.408 1.096 -7.452 1.00 0.00 N ATOM 873 CA ARG A 53 -2.516 1.465 -8.327 1.00 0.00 C ATOM 874 C ARG A 53 -3.555 2.301 -7.582 1.00 0.00 C ATOM 875 O ARG A 53 -3.546 2.369 -6.354 1.00 0.00 O ATOM 876 CB ARG A 53 -3.159 0.208 -8.936 1.00 0.00 C ATOM 877 CG ARG A 53 -4.342 -0.347 -8.152 1.00 0.00 C ATOM 878 CD ARG A 53 -5.049 -1.446 -8.928 1.00 0.00 C ATOM 879 NE ARG A 53 -6.115 -2.072 -8.149 1.00 0.00 N ATOM 880 CZ ARG A 53 -7.101 -2.787 -8.686 1.00 0.00 C ATOM 881 NH1 ARG A 53 -7.159 -2.971 -9.998 1.00 0.00 N ATOM 882 NH2 ARG A 53 -8.033 -3.320 -7.906 1.00 0.00 N ATOM 0 H ARG A 53 -1.643 1.065 -6.460 1.00 0.00 H new ATOM 0 HA ARG A 53 -2.119 2.078 -9.136 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -3.489 0.440 -9.949 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -2.399 -0.569 -9.018 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -3.996 -0.739 -7.195 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -5.045 0.456 -7.932 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -5.467 -1.030 -9.845 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -4.324 -2.204 -9.224 1.00 0.00 H new ATOM 0 HE ARG A 53 -6.103 -1.954 -7.136 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -6.445 -2.564 -10.602 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -7.917 -3.520 -10.403 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -7.993 -3.182 -6.896 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -8.789 -3.868 -8.316 1.00 0.00 H new ATOM 896 N LEU A 54 -4.451 2.928 -8.336 1.00 0.00 N ATOM 897 CA LEU A 54 -5.501 3.752 -7.750 1.00 0.00 C ATOM 898 C LEU A 54 -6.776 2.936 -7.556 1.00 0.00 C ATOM 899 O LEU A 54 -7.061 2.021 -8.329 1.00 0.00 O ATOM 900 CB LEU A 54 -5.785 4.963 -8.640 1.00 0.00 C ATOM 901 CG LEU A 54 -4.884 6.170 -8.391 1.00 0.00 C ATOM 902 CD1 LEU A 54 -4.144 6.561 -9.662 1.00 0.00 C ATOM 903 CD2 LEU A 54 -5.693 7.345 -7.860 1.00 0.00 C ATOM 0 H LEU A 54 -4.471 2.881 -9.355 1.00 0.00 H new ATOM 0 HA LEU A 54 -5.159 4.102 -6.776 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -5.683 4.661 -9.682 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -6.822 5.266 -8.496 1.00 0.00 H new ATOM 0 HG LEU A 54 -4.147 5.894 -7.637 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -3.508 7.423 -9.462 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -3.529 5.726 -9.996 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.865 6.815 -10.439 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -5.032 8.195 -7.689 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -6.456 7.620 -8.588 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -6.171 7.063 -6.922 1.00 0.00 H new ATOM 915 N ALA A 55 -7.535 3.268 -6.518 1.00 0.00 N ATOM 916 CA ALA A 55 -8.776 2.560 -6.225 1.00 0.00 C ATOM 917 C ALA A 55 -9.989 3.328 -6.739 1.00 0.00 C ATOM 918 O ALA A 55 -10.036 4.556 -6.662 1.00 0.00 O ATOM 919 CB ALA A 55 -8.901 2.317 -4.727 1.00 0.00 C ATOM 0 H ALA A 55 -7.314 4.021 -5.867 1.00 0.00 H new ATOM 0 HA ALA A 55 -8.745 1.600 -6.741 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -9.831 1.788 -4.521 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -8.058 1.717 -4.384 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -8.903 3.272 -4.202 1.00 0.00 H new ATOM 925 N THR A 56 -10.972 2.596 -7.251 1.00 0.00 N ATOM 926 CA THR A 56 -12.191 3.208 -7.765 1.00 0.00 C ATOM 927 C THR A 56 -13.040 3.730 -6.616 1.00 0.00 C ATOM 928 O THR A 56 -12.792 3.400 -5.458 1.00 0.00 O ATOM 929 CB THR A 56 -12.995 2.189 -8.576 1.00 0.00 C ATOM 930 OG1 THR A 56 -13.680 1.297 -7.714 1.00 0.00 O ATOM 931 CG2 THR A 56 -12.144 1.361 -9.515 1.00 0.00 C ATOM 0 H THR A 56 -10.948 1.579 -7.321 1.00 0.00 H new ATOM 0 HA THR A 56 -11.914 4.040 -8.413 1.00 0.00 H new ATOM 0 HB THR A 56 -13.691 2.778 -9.173 1.00 0.00 H new ATOM 0 HG1 THR A 56 -14.190 0.653 -8.248 1.00 0.00 H new ATOM 0 HG21 THR A 56 -12.778 0.660 -10.058 1.00 0.00 H new ATOM 0 HG22 THR A 56 -11.640 2.018 -10.224 1.00 0.00 H new ATOM 0 HG23 THR A 56 -11.401 0.808 -8.940 1.00 0.00 H new ATOM 939 N VAL A 57 -14.050 4.534 -6.933 1.00 0.00 N ATOM 940 CA VAL A 57 -14.929 5.082 -5.906 1.00 0.00 C ATOM 941 C VAL A 57 -15.497 3.961 -5.042 1.00 0.00 C ATOM 942 O VAL A 57 -15.585 4.084 -3.818 1.00 0.00 O ATOM 943 CB VAL A 57 -16.091 5.882 -6.522 1.00 0.00 C ATOM 944 CG1 VAL A 57 -16.876 6.607 -5.439 1.00 0.00 C ATOM 945 CG2 VAL A 57 -15.570 6.865 -7.560 1.00 0.00 C ATOM 0 H VAL A 57 -14.279 4.819 -7.885 1.00 0.00 H new ATOM 0 HA VAL A 57 -14.331 5.756 -5.293 1.00 0.00 H new ATOM 0 HB VAL A 57 -16.764 5.184 -7.020 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -17.693 7.167 -5.895 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -17.282 5.880 -4.736 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -16.216 7.294 -4.910 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -16.405 7.422 -7.985 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -14.874 7.558 -7.087 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -15.057 6.320 -8.352 1.00 0.00 H new ATOM 955 N GLU A 58 -15.859 2.860 -5.690 1.00 0.00 N ATOM 956 CA GLU A 58 -16.398 1.705 -4.988 1.00 0.00 C ATOM 957 C GLU A 58 -15.314 1.065 -4.131 1.00 0.00 C ATOM 958 O GLU A 58 -15.558 0.680 -2.987 1.00 0.00 O ATOM 959 CB GLU A 58 -16.950 0.684 -5.984 1.00 0.00 C ATOM 960 CG GLU A 58 -18.326 1.043 -6.523 1.00 0.00 C ATOM 961 CD GLU A 58 -19.421 0.154 -5.967 1.00 0.00 C ATOM 962 OE1 GLU A 58 -20.291 -0.279 -6.752 1.00 0.00 O ATOM 963 OE2 GLU A 58 -19.409 -0.109 -4.746 1.00 0.00 O ATOM 0 H GLU A 58 -15.788 2.744 -6.701 1.00 0.00 H new ATOM 0 HA GLU A 58 -17.212 2.037 -4.344 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -16.255 0.590 -6.818 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -17.001 -0.292 -5.501 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -18.548 2.082 -6.279 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -18.318 0.966 -7.610 1.00 0.00 H new ATOM 970 N GLU A 59 -14.112 0.964 -4.691 1.00 0.00 N ATOM 971 CA GLU A 59 -12.986 0.381 -3.976 1.00 0.00 C ATOM 972 C GLU A 59 -12.671 1.192 -2.723 1.00 0.00 C ATOM 973 O GLU A 59 -12.466 0.632 -1.648 1.00 0.00 O ATOM 974 CB GLU A 59 -11.754 0.315 -4.880 1.00 0.00 C ATOM 975 CG GLU A 59 -11.769 -0.863 -5.841 1.00 0.00 C ATOM 976 CD GLU A 59 -10.485 -0.983 -6.637 1.00 0.00 C ATOM 977 OE1 GLU A 59 -10.142 -0.023 -7.360 1.00 0.00 O ATOM 978 OE2 GLU A 59 -9.822 -2.038 -6.540 1.00 0.00 O ATOM 0 H GLU A 59 -13.895 1.278 -5.637 1.00 0.00 H new ATOM 0 HA GLU A 59 -13.258 -0.632 -3.679 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -11.683 1.240 -5.453 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -10.860 0.256 -4.259 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -11.931 -1.783 -5.279 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -12.609 -0.756 -6.527 1.00 0.00 H new ATOM 985 N ARG A 60 -12.643 2.514 -2.866 1.00 0.00 N ATOM 986 CA ARG A 60 -12.362 3.396 -1.739 1.00 0.00 C ATOM 987 C ARG A 60 -13.412 3.219 -0.653 1.00 0.00 C ATOM 988 O ARG A 60 -13.088 3.164 0.533 1.00 0.00 O ATOM 989 CB ARG A 60 -12.322 4.858 -2.190 1.00 0.00 C ATOM 990 CG ARG A 60 -11.419 5.108 -3.388 1.00 0.00 C ATOM 991 CD ARG A 60 -10.837 6.513 -3.360 1.00 0.00 C ATOM 992 NE ARG A 60 -11.487 7.395 -4.329 1.00 0.00 N ATOM 993 CZ ARG A 60 -11.029 7.621 -5.560 1.00 0.00 C ATOM 994 NH1 ARG A 60 -9.916 7.033 -5.986 1.00 0.00 N ATOM 995 NH2 ARG A 60 -11.688 8.438 -6.370 1.00 0.00 N ATOM 0 H ARG A 60 -12.811 2.996 -3.749 1.00 0.00 H new ATOM 0 HA ARG A 60 -11.385 3.129 -1.336 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -13.334 5.180 -2.436 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -11.985 5.476 -1.358 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -10.610 4.377 -3.395 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -11.985 4.965 -4.308 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -10.946 6.931 -2.359 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -9.769 6.467 -3.571 1.00 0.00 H new ATOM 0 HE ARG A 60 -12.345 7.867 -4.045 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -9.404 6.402 -5.369 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -9.574 7.212 -6.930 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -12.544 8.892 -6.051 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -11.339 8.612 -7.313 1.00 0.00 H new ATOM 1009 N LYS A 61 -14.675 3.118 -1.063 1.00 0.00 N ATOM 1010 CA LYS A 61 -15.761 2.931 -0.110 1.00 0.00 C ATOM 1011 C LYS A 61 -15.512 1.673 0.713 1.00 0.00 C ATOM 1012 O LYS A 61 -15.628 1.684 1.938 1.00 0.00 O ATOM 1013 CB LYS A 61 -17.102 2.828 -0.838 1.00 0.00 C ATOM 1014 CG LYS A 61 -17.814 4.163 -0.993 1.00 0.00 C ATOM 1015 CD LYS A 61 -18.422 4.316 -2.377 1.00 0.00 C ATOM 1016 CE LYS A 61 -19.906 3.986 -2.374 1.00 0.00 C ATOM 1017 NZ LYS A 61 -20.670 4.854 -3.313 1.00 0.00 N ATOM 0 H LYS A 61 -14.967 3.162 -2.039 1.00 0.00 H new ATOM 0 HA LYS A 61 -15.797 3.793 0.556 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -16.938 2.396 -1.825 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -17.750 2.141 -0.293 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -18.597 4.248 -0.240 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -17.109 4.975 -0.813 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -18.276 5.337 -2.729 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -17.904 3.661 -3.077 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -20.046 2.941 -2.650 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -20.302 4.105 -1.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -21.677 4.597 -3.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -20.558 5.850 -3.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -20.309 4.722 -4.279 1.00 0.00 H new ATOM 1031 N LYS A 62 -15.142 0.596 0.027 1.00 0.00 N ATOM 1032 CA LYS A 62 -14.844 -0.665 0.689 1.00 0.00 C ATOM 1033 C LYS A 62 -13.570 -0.533 1.517 1.00 0.00 C ATOM 1034 O LYS A 62 -13.443 -1.132 2.584 1.00 0.00 O ATOM 1035 CB LYS A 62 -14.687 -1.787 -0.340 1.00 0.00 C ATOM 1036 CG LYS A 62 -15.911 -1.981 -1.219 1.00 0.00 C ATOM 1037 CD LYS A 62 -15.527 -2.453 -2.613 1.00 0.00 C ATOM 1038 CE LYS A 62 -16.642 -2.199 -3.614 1.00 0.00 C ATOM 1039 NZ LYS A 62 -17.692 -3.252 -3.555 1.00 0.00 N ATOM 0 H LYS A 62 -15.042 0.573 -0.988 1.00 0.00 H new ATOM 0 HA LYS A 62 -15.674 -0.914 1.350 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -13.826 -1.571 -0.973 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -14.473 -2.720 0.182 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -16.579 -2.709 -0.759 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -16.462 -1.043 -1.290 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -14.622 -1.938 -2.936 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -15.296 -3.518 -2.587 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -17.092 -1.226 -3.417 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -16.224 -2.159 -4.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -18.434 -3.042 -4.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -17.268 -4.177 -3.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -18.109 -3.274 -2.602 1.00 0.00 H new ATOM 1053 N ILE A 63 -12.629 0.261 1.011 1.00 0.00 N ATOM 1054 CA ILE A 63 -11.360 0.484 1.694 1.00 0.00 C ATOM 1055 C ILE A 63 -11.579 1.104 3.072 1.00 0.00 C ATOM 1056 O ILE A 63 -11.039 0.631 4.071 1.00 0.00 O ATOM 1057 CB ILE A 63 -10.424 1.391 0.859 1.00 0.00 C ATOM 1058 CG1 ILE A 63 -9.881 0.620 -0.345 1.00 0.00 C ATOM 1059 CG2 ILE A 63 -9.273 1.919 1.708 1.00 0.00 C ATOM 1060 CD1 ILE A 63 -9.508 1.507 -1.514 1.00 0.00 C ATOM 0 H ILE A 63 -12.723 0.762 0.127 1.00 0.00 H new ATOM 0 HA ILE A 63 -10.885 -0.490 1.816 1.00 0.00 H new ATOM 0 HB ILE A 63 -11.003 2.244 0.505 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -9.004 0.052 -0.036 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -10.630 -0.102 -0.672 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -8.631 2.553 1.097 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -9.671 2.500 2.540 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -8.693 1.082 2.095 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -9.131 0.892 -2.331 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -10.388 2.056 -1.849 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -8.736 2.212 -1.204 1.00 0.00 H new ATOM 1072 N VAL A 64 -12.369 2.170 3.115 1.00 0.00 N ATOM 1073 CA VAL A 64 -12.652 2.863 4.367 1.00 0.00 C ATOM 1074 C VAL A 64 -13.402 1.969 5.352 1.00 0.00 C ATOM 1075 O VAL A 64 -13.046 1.892 6.527 1.00 0.00 O ATOM 1076 CB VAL A 64 -13.481 4.140 4.123 1.00 0.00 C ATOM 1077 CG1 VAL A 64 -13.610 4.948 5.404 1.00 0.00 C ATOM 1078 CG2 VAL A 64 -12.857 4.977 3.017 1.00 0.00 C ATOM 0 H VAL A 64 -12.825 2.574 2.297 1.00 0.00 H new ATOM 0 HA VAL A 64 -11.687 3.132 4.797 1.00 0.00 H new ATOM 0 HB VAL A 64 -14.481 3.846 3.806 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -14.198 5.845 5.211 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -14.106 4.346 6.166 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -12.618 5.233 5.756 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -13.455 5.874 2.858 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -11.845 5.262 3.303 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -12.823 4.396 2.096 1.00 0.00 H new ATOM 1088 N ALA A 65 -14.450 1.309 4.871 1.00 0.00 N ATOM 1089 CA ALA A 65 -15.258 0.435 5.715 1.00 0.00 C ATOM 1090 C ALA A 65 -14.526 -0.855 6.076 1.00 0.00 C ATOM 1091 O ALA A 65 -14.588 -1.314 7.216 1.00 0.00 O ATOM 1092 CB ALA A 65 -16.576 0.117 5.026 1.00 0.00 C ATOM 0 H ALA A 65 -14.760 1.362 3.901 1.00 0.00 H new ATOM 0 HA ALA A 65 -15.453 0.968 6.646 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -17.172 -0.536 5.664 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -17.123 1.042 4.842 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -16.379 -0.383 4.078 1.00 0.00 H new ATOM 1098 N SER A 66 -13.847 -1.446 5.099 1.00 0.00 N ATOM 1099 CA SER A 66 -13.124 -2.696 5.319 1.00 0.00 C ATOM 1100 C SER A 66 -11.788 -2.463 6.022 1.00 0.00 C ATOM 1101 O SER A 66 -11.484 -3.114 7.022 1.00 0.00 O ATOM 1102 CB SER A 66 -12.889 -3.412 3.988 1.00 0.00 C ATOM 1103 OG SER A 66 -11.785 -2.855 3.295 1.00 0.00 O ATOM 0 H SER A 66 -13.781 -1.082 4.149 1.00 0.00 H new ATOM 0 HA SER A 66 -13.740 -3.320 5.967 1.00 0.00 H new ATOM 0 HB2 SER A 66 -12.711 -4.472 4.169 1.00 0.00 H new ATOM 0 HB3 SER A 66 -13.784 -3.340 3.370 1.00 0.00 H new ATOM 0 HG SER A 66 -11.992 -1.932 3.038 1.00 0.00 H new ATOM 1109 N SER A 67 -10.987 -1.545 5.492 1.00 0.00 N ATOM 1110 CA SER A 67 -9.682 -1.248 6.071 1.00 0.00 C ATOM 1111 C SER A 67 -9.812 -0.402 7.333 1.00 0.00 C ATOM 1112 O SER A 67 -9.242 -0.731 8.374 1.00 0.00 O ATOM 1113 CB SER A 67 -8.797 -0.528 5.053 1.00 0.00 C ATOM 1114 OG SER A 67 -7.424 -0.711 5.350 1.00 0.00 O ATOM 0 H SER A 67 -11.218 -0.995 4.665 1.00 0.00 H new ATOM 0 HA SER A 67 -9.219 -2.197 6.342 1.00 0.00 H new ATOM 0 HB2 SER A 67 -9.009 -0.904 4.052 1.00 0.00 H new ATOM 0 HB3 SER A 67 -9.033 0.536 5.050 1.00 0.00 H new ATOM 0 HG SER A 67 -7.244 -1.664 5.491 1.00 0.00 H new ATOM 1120 N HIS A 68 -10.555 0.694 7.232 1.00 0.00 N ATOM 1121 CA HIS A 68 -10.746 1.590 8.366 1.00 0.00 C ATOM 1122 C HIS A 68 -12.093 1.359 9.037 1.00 0.00 C ATOM 1123 O HIS A 68 -12.885 0.524 8.597 1.00 0.00 O ATOM 1124 CB HIS A 68 -10.633 3.044 7.911 1.00 0.00 C ATOM 1125 CG HIS A 68 -9.353 3.336 7.195 1.00 0.00 C ATOM 1126 ND1 HIS A 68 -9.287 4.099 6.049 1.00 0.00 N ATOM 1127 CD2 HIS A 68 -8.085 2.956 7.469 1.00 0.00 C ATOM 1128 CE1 HIS A 68 -8.031 4.175 5.647 1.00 0.00 C ATOM 1129 NE2 HIS A 68 -7.280 3.491 6.493 1.00 0.00 N ATOM 0 H HIS A 68 -11.034 0.983 6.379 1.00 0.00 H new ATOM 0 HA HIS A 68 -9.965 1.377 9.096 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -11.471 3.280 7.255 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -10.714 3.698 8.779 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -10.083 4.536 5.584 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -7.765 2.346 8.300 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -7.678 4.706 4.775 1.00 0.00 H new ATOM 1138 N GLY A 69 -12.344 2.104 10.107 1.00 0.00 N ATOM 1139 CA GLY A 69 -13.593 1.970 10.827 1.00 0.00 C ATOM 1140 C GLY A 69 -13.995 3.252 11.531 1.00 0.00 C ATOM 1141 O GLY A 69 -14.866 3.982 11.058 1.00 0.00 O ATOM 0 H GLY A 69 -11.703 2.799 10.488 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -14.380 1.678 10.132 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -13.502 1.169 11.561 1.00 0.00 H new ATOM 1145 N LYS A 70 -13.357 3.527 12.664 1.00 0.00 N ATOM 1146 CA LYS A 70 -13.651 4.729 13.435 1.00 0.00 C ATOM 1147 C LYS A 70 -12.472 5.698 13.400 1.00 0.00 C ATOM 1148 O LYS A 70 -12.655 6.915 13.428 1.00 0.00 O ATOM 1149 CB LYS A 70 -13.987 4.363 14.882 1.00 0.00 C ATOM 1150 CG LYS A 70 -15.371 4.815 15.317 1.00 0.00 C ATOM 1151 CD LYS A 70 -16.461 4.129 14.510 1.00 0.00 C ATOM 1152 CE LYS A 70 -16.996 5.036 13.412 1.00 0.00 C ATOM 1153 NZ LYS A 70 -18.431 4.767 13.115 1.00 0.00 N ATOM 0 H LYS A 70 -12.633 2.933 13.068 1.00 0.00 H new ATOM 0 HA LYS A 70 -14.514 5.220 12.984 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -13.912 3.282 15.001 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -13.244 4.809 15.543 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -15.510 4.598 16.376 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -15.456 5.895 15.200 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -16.067 3.214 14.068 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -17.276 3.837 15.172 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -16.877 6.077 13.712 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -16.406 4.896 12.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -18.517 4.354 12.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -18.812 4.101 13.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -18.967 5.657 13.156 1.00 0.00 H new ATOM 1167 N LYS A 71 -11.263 5.149 13.337 1.00 0.00 N ATOM 1168 CA LYS A 71 -10.054 5.964 13.298 1.00 0.00 C ATOM 1169 C LYS A 71 -9.929 6.818 14.555 1.00 0.00 C ATOM 1170 O LYS A 71 -10.857 6.893 15.361 1.00 0.00 O ATOM 1171 CB LYS A 71 -10.057 6.858 12.057 1.00 0.00 C ATOM 1172 CG LYS A 71 -9.536 6.168 10.808 1.00 0.00 C ATOM 1173 CD LYS A 71 -8.852 7.151 9.871 1.00 0.00 C ATOM 1174 CE LYS A 71 -8.451 6.488 8.564 1.00 0.00 C ATOM 1175 NZ LYS A 71 -8.296 7.479 7.463 1.00 0.00 N ATOM 0 H LYS A 71 -11.095 4.143 13.312 1.00 0.00 H new ATOM 0 HA LYS A 71 -9.196 5.293 13.252 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -11.074 7.206 11.873 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -9.449 7.741 12.254 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -8.833 5.384 11.091 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -10.362 5.683 10.288 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -9.522 7.986 9.666 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -7.968 7.564 10.357 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -7.513 5.950 8.703 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -9.204 5.750 8.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -8.022 6.987 6.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -9.198 7.975 7.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -7.560 8.168 7.717 1.00 0.00 H new ATOM 1189 N THR A 72 -8.777 7.461 14.715 1.00 0.00 N ATOM 1190 CA THR A 72 -8.529 8.311 15.874 1.00 0.00 C ATOM 1191 C THR A 72 -9.097 9.708 15.654 1.00 0.00 C ATOM 1192 O THR A 72 -9.852 9.941 14.710 1.00 0.00 O ATOM 1193 CB THR A 72 -7.029 8.395 16.158 1.00 0.00 C ATOM 1194 OG1 THR A 72 -6.386 9.231 15.213 1.00 0.00 O ATOM 1195 CG2 THR A 72 -6.336 7.049 16.125 1.00 0.00 C ATOM 0 H THR A 72 -8.000 7.410 14.056 1.00 0.00 H new ATOM 0 HA THR A 72 -9.030 7.867 16.734 1.00 0.00 H new ATOM 0 HB THR A 72 -6.949 8.802 17.166 1.00 0.00 H new ATOM 0 HG1 THR A 72 -5.427 9.273 15.413 1.00 0.00 H new ATOM 0 HG21 THR A 72 -5.275 7.181 16.335 1.00 0.00 H new ATOM 0 HG22 THR A 72 -6.776 6.395 16.878 1.00 0.00 H new ATOM 0 HG23 THR A 72 -6.458 6.601 15.139 1.00 0.00 H new ATOM 1203 N LYS A 73 -8.730 10.637 16.531 1.00 0.00 N ATOM 1204 CA LYS A 73 -9.203 12.013 16.433 1.00 0.00 C ATOM 1205 C LYS A 73 -10.723 12.076 16.558 1.00 0.00 C ATOM 1206 O LYS A 73 -11.405 11.055 16.472 1.00 0.00 O ATOM 1207 CB LYS A 73 -8.762 12.633 15.105 1.00 0.00 C ATOM 1208 CG LYS A 73 -7.424 13.351 15.185 1.00 0.00 C ATOM 1209 CD LYS A 73 -7.437 14.646 14.389 1.00 0.00 C ATOM 1210 CE LYS A 73 -7.517 14.380 12.894 1.00 0.00 C ATOM 1211 NZ LYS A 73 -8.374 15.379 12.198 1.00 0.00 N ATOM 0 H LYS A 73 -8.106 10.461 17.318 1.00 0.00 H new ATOM 0 HA LYS A 73 -8.765 12.581 17.254 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -8.700 11.849 14.350 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -9.524 13.337 14.771 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -7.187 13.566 16.227 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -6.637 12.699 14.807 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -8.287 15.255 14.697 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -6.537 15.219 14.610 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -6.514 14.402 12.467 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -7.914 13.379 12.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -8.403 15.163 11.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -9.338 15.341 12.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -7.981 16.332 12.339 1.00 0.00 H new ATOM 1225 N PRO A 74 -11.277 13.285 16.762 1.00 0.00 N ATOM 1226 CA PRO A 74 -12.724 13.477 16.899 1.00 0.00 C ATOM 1227 C PRO A 74 -13.505 12.841 15.753 1.00 0.00 C ATOM 1228 O PRO A 74 -13.435 13.300 14.612 1.00 0.00 O ATOM 1229 CB PRO A 74 -12.885 14.999 16.875 1.00 0.00 C ATOM 1230 CG PRO A 74 -11.578 15.525 17.361 1.00 0.00 C ATOM 1231 CD PRO A 74 -10.535 14.555 16.877 1.00 0.00 C ATOM 0 HA PRO A 74 -13.113 13.008 17.803 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -13.107 15.358 15.870 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -13.705 15.321 17.517 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -11.391 16.526 16.971 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -11.567 15.599 18.448 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -10.114 14.862 15.920 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -9.705 14.474 17.579 1.00 0.00 H new ATOM 1239 N ASN A 75 -14.249 11.785 16.065 1.00 0.00 N ATOM 1240 CA ASN A 75 -15.043 11.087 15.062 1.00 0.00 C ATOM 1241 C ASN A 75 -16.469 10.862 15.557 1.00 0.00 C ATOM 1242 O ASN A 75 -16.713 10.791 16.762 1.00 0.00 O ATOM 1243 CB ASN A 75 -14.392 9.746 14.708 1.00 0.00 C ATOM 1244 CG ASN A 75 -13.867 9.715 13.286 1.00 0.00 C ATOM 1245 OD1 ASN A 75 -12.707 10.040 13.032 1.00 0.00 O ATOM 1246 ND2 ASN A 75 -14.722 9.322 12.349 1.00 0.00 N ATOM 0 H ASN A 75 -14.318 11.394 17.005 1.00 0.00 H new ATOM 0 HA ASN A 75 -15.083 11.709 14.168 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -13.572 9.550 15.399 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -15.120 8.946 14.841 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -14.426 9.281 11.374 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -15.674 9.062 12.605 1.00 0.00 H new ATOM 1253 N THR A 76 -17.406 10.750 14.621 1.00 0.00 N ATOM 1254 CA THR A 76 -18.807 10.532 14.964 1.00 0.00 C ATOM 1255 C THR A 76 -19.266 9.149 14.517 1.00 0.00 C ATOM 1256 O THR A 76 -18.609 8.497 13.706 1.00 0.00 O ATOM 1257 CB THR A 76 -19.684 11.606 14.318 1.00 0.00 C ATOM 1258 OG1 THR A 76 -19.269 11.859 12.987 1.00 0.00 O ATOM 1259 CG2 THR A 76 -19.661 12.924 15.063 1.00 0.00 C ATOM 0 H THR A 76 -17.221 10.807 13.620 1.00 0.00 H new ATOM 0 HA THR A 76 -18.905 10.596 16.048 1.00 0.00 H new ATOM 0 HB THR A 76 -20.698 11.207 14.347 1.00 0.00 H new ATOM 0 HG1 THR A 76 -19.843 12.547 12.591 1.00 0.00 H new ATOM 0 HG21 THR A 76 -20.303 13.642 14.553 1.00 0.00 H new ATOM 0 HG22 THR A 76 -20.022 12.773 16.080 1.00 0.00 H new ATOM 0 HG23 THR A 76 -18.641 13.307 15.093 1.00 0.00 H new ATOM 1267 N LYS A 77 -20.399 8.706 15.053 1.00 0.00 N ATOM 1268 CA LYS A 77 -20.946 7.398 14.711 1.00 0.00 C ATOM 1269 C LYS A 77 -21.897 7.500 13.522 1.00 0.00 C ATOM 1270 O LYS A 77 -22.009 6.570 12.722 1.00 0.00 O ATOM 1271 CB LYS A 77 -21.675 6.796 15.914 1.00 0.00 C ATOM 1272 CG LYS A 77 -20.835 5.800 16.698 1.00 0.00 C ATOM 1273 CD LYS A 77 -20.743 4.464 15.979 1.00 0.00 C ATOM 1274 CE LYS A 77 -19.688 3.566 16.605 1.00 0.00 C ATOM 1275 NZ LYS A 77 -19.459 2.334 15.801 1.00 0.00 N ATOM 0 H LYS A 77 -20.956 9.233 15.726 1.00 0.00 H new ATOM 0 HA LYS A 77 -20.117 6.746 14.435 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -21.985 7.601 16.580 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -22.582 6.301 15.568 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -19.834 6.204 16.847 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -21.270 5.654 17.687 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -21.712 3.965 16.010 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -20.504 4.631 14.929 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -18.752 4.117 16.700 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -19.998 3.289 17.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -18.479 2.011 15.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -20.114 1.589 16.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -19.623 2.540 14.795 1.00 0.00 H new ATOM 1289 N ASP A 78 -22.580 8.634 13.412 1.00 0.00 N ATOM 1290 CA ASP A 78 -23.520 8.857 12.320 1.00 0.00 C ATOM 1291 C ASP A 78 -22.785 9.016 10.993 1.00 0.00 C ATOM 1292 O ASP A 78 -23.299 8.640 9.939 1.00 0.00 O ATOM 1293 CB ASP A 78 -24.374 10.097 12.598 1.00 0.00 C ATOM 1294 CG ASP A 78 -25.742 9.744 13.150 1.00 0.00 C ATOM 1295 OD1 ASP A 78 -26.065 10.195 14.269 1.00 0.00 O ATOM 1296 OD2 ASP A 78 -26.490 9.017 12.463 1.00 0.00 O ATOM 0 H ASP A 78 -22.500 9.413 14.066 1.00 0.00 H new ATOM 0 HA ASP A 78 -24.171 7.986 12.251 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -23.854 10.741 13.307 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -24.493 10.667 11.677 1.00 0.00 H new ATOM 1301 N HIS A 79 -21.582 9.576 11.053 1.00 0.00 N ATOM 1302 CA HIS A 79 -20.775 9.784 9.856 1.00 0.00 C ATOM 1303 C HIS A 79 -19.471 8.998 9.935 1.00 0.00 C ATOM 1304 O HIS A 79 -19.051 8.579 11.015 1.00 0.00 O ATOM 1305 CB HIS A 79 -20.476 11.273 9.669 1.00 0.00 C ATOM 1306 CG HIS A 79 -21.705 12.126 9.604 1.00 0.00 C ATOM 1307 ND1 HIS A 79 -21.850 13.294 10.322 1.00 0.00 N ATOM 1308 CD2 HIS A 79 -22.851 11.976 8.898 1.00 0.00 C ATOM 1309 CE1 HIS A 79 -23.031 13.825 10.063 1.00 0.00 C ATOM 1310 NE2 HIS A 79 -23.657 13.045 9.202 1.00 0.00 N ATOM 0 H HIS A 79 -21.144 9.894 11.917 1.00 0.00 H new ATOM 0 HA HIS A 79 -21.343 9.424 8.998 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -19.849 11.616 10.492 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -19.901 11.408 8.753 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -23.087 11.167 8.222 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -23.418 14.741 10.484 1.00 0.00 H new ATOM 0 HE2 HIS A 79 -24.590 13.210 8.823 1.00 0.00 H new ATOM 1319 N GLY A 80 -18.833 8.801 8.786 1.00 0.00 N ATOM 1320 CA GLY A 80 -17.583 8.065 8.748 1.00 0.00 C ATOM 1321 C GLY A 80 -16.424 8.912 8.257 1.00 0.00 C ATOM 1322 O GLY A 80 -15.922 9.769 8.985 1.00 0.00 O ATOM 0 H GLY A 80 -19.159 9.138 7.880 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -17.356 7.688 9.746 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -17.696 7.197 8.098 1.00 0.00 H new ATOM 1326 N TYR A 81 -16.001 8.672 7.021 1.00 0.00 N ATOM 1327 CA TYR A 81 -14.894 9.419 6.434 1.00 0.00 C ATOM 1328 C TYR A 81 -15.165 9.728 4.965 1.00 0.00 C ATOM 1329 O TYR A 81 -15.574 8.853 4.201 1.00 0.00 O ATOM 1330 CB TYR A 81 -13.590 8.631 6.570 1.00 0.00 C ATOM 1331 CG TYR A 81 -12.787 8.997 7.799 1.00 0.00 C ATOM 1332 CD1 TYR A 81 -13.059 8.413 9.030 1.00 0.00 C ATOM 1333 CD2 TYR A 81 -11.758 9.928 7.727 1.00 0.00 C ATOM 1334 CE1 TYR A 81 -12.328 8.745 10.154 1.00 0.00 C ATOM 1335 CE2 TYR A 81 -11.022 10.264 8.848 1.00 0.00 C ATOM 1336 CZ TYR A 81 -11.311 9.670 10.058 1.00 0.00 C ATOM 1337 OH TYR A 81 -10.580 10.004 11.175 1.00 0.00 O ATOM 0 H TYR A 81 -16.407 7.967 6.406 1.00 0.00 H new ATOM 0 HA TYR A 81 -14.798 10.361 6.973 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -13.820 7.566 6.600 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -12.979 8.800 5.683 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -13.855 7.688 9.109 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -11.530 10.396 6.781 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -12.552 8.282 11.104 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -10.224 10.989 8.776 1.00 0.00 H new ATOM 0 HH TYR A 81 -11.174 10.050 11.953 1.00 0.00 H new ATOM 1347 N THR A 82 -14.935 10.978 4.576 1.00 0.00 N ATOM 1348 CA THR A 82 -15.155 11.402 3.197 1.00 0.00 C ATOM 1349 C THR A 82 -14.024 12.306 2.718 1.00 0.00 C ATOM 1350 O THR A 82 -14.227 13.172 1.866 1.00 0.00 O ATOM 1351 CB THR A 82 -16.493 12.131 3.074 1.00 0.00 C ATOM 1352 OG1 THR A 82 -17.485 11.497 3.863 1.00 0.00 O ATOM 1353 CG2 THR A 82 -17.010 12.195 1.652 1.00 0.00 C ATOM 0 H THR A 82 -14.597 11.715 5.195 1.00 0.00 H new ATOM 0 HA THR A 82 -15.175 10.512 2.568 1.00 0.00 H new ATOM 0 HB THR A 82 -16.302 13.146 3.421 1.00 0.00 H new ATOM 0 HG1 THR A 82 -18.333 11.979 3.772 1.00 0.00 H new ATOM 0 HG21 THR A 82 -17.962 12.725 1.635 1.00 0.00 H new ATOM 0 HG22 THR A 82 -16.290 12.722 1.026 1.00 0.00 H new ATOM 0 HG23 THR A 82 -17.150 11.184 1.270 1.00 0.00 H new ATOM 1361 N THR A 83 -12.832 12.101 3.270 1.00 0.00 N ATOM 1362 CA THR A 83 -11.669 12.897 2.896 1.00 0.00 C ATOM 1363 C THR A 83 -10.673 12.062 2.102 1.00 0.00 C ATOM 1364 O THR A 83 -10.233 12.459 1.023 1.00 0.00 O ATOM 1365 CB THR A 83 -10.993 13.468 4.144 1.00 0.00 C ATOM 1366 OG1 THR A 83 -11.935 13.646 5.187 1.00 0.00 O ATOM 1367 CG2 THR A 83 -10.318 14.800 3.903 1.00 0.00 C ATOM 0 H THR A 83 -12.647 11.390 3.978 1.00 0.00 H new ATOM 0 HA THR A 83 -12.009 13.720 2.267 1.00 0.00 H new ATOM 0 HB THR A 83 -10.232 12.738 4.419 1.00 0.00 H new ATOM 0 HG1 THR A 83 -11.484 14.010 5.977 1.00 0.00 H new ATOM 0 HG21 THR A 83 -9.859 15.148 4.828 1.00 0.00 H new ATOM 0 HG22 THR A 83 -9.550 14.686 3.138 1.00 0.00 H new ATOM 0 HG23 THR A 83 -11.058 15.528 3.569 1.00 0.00 H new ATOM 1375 N LEU A 84 -10.323 10.905 2.646 1.00 0.00 N ATOM 1376 CA LEU A 84 -9.377 10.007 1.997 1.00 0.00 C ATOM 1377 C LEU A 84 -10.037 9.216 0.864 1.00 0.00 C ATOM 1378 O LEU A 84 -9.382 8.409 0.202 1.00 0.00 O ATOM 1379 CB LEU A 84 -8.753 9.051 3.026 1.00 0.00 C ATOM 1380 CG LEU A 84 -9.613 7.848 3.444 1.00 0.00 C ATOM 1381 CD1 LEU A 84 -11.049 8.268 3.716 1.00 0.00 C ATOM 1382 CD2 LEU A 84 -9.564 6.759 2.381 1.00 0.00 C ATOM 0 H LEU A 84 -10.681 10.565 3.538 1.00 0.00 H new ATOM 0 HA LEU A 84 -8.588 10.618 1.558 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -7.814 8.676 2.619 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -8.507 9.624 3.920 1.00 0.00 H new ATOM 0 HG LEU A 84 -9.201 7.446 4.369 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -11.634 7.396 4.010 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -11.067 9.004 4.520 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -11.477 8.705 2.814 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -10.179 5.916 2.695 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -9.943 7.153 1.438 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -8.534 6.427 2.247 1.00 0.00 H new ATOM 1394 N ALA A 85 -11.330 9.445 0.644 1.00 0.00 N ATOM 1395 CA ALA A 85 -12.060 8.744 -0.408 1.00 0.00 C ATOM 1396 C ALA A 85 -11.923 9.449 -1.757 1.00 0.00 C ATOM 1397 O ALA A 85 -12.595 9.086 -2.723 1.00 0.00 O ATOM 1398 CB ALA A 85 -13.527 8.612 -0.029 1.00 0.00 C ATOM 0 H ALA A 85 -11.891 10.108 1.178 1.00 0.00 H new ATOM 0 HA ALA A 85 -11.624 7.750 -0.509 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -14.062 8.088 -0.821 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -13.613 8.050 0.901 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -13.959 9.604 0.105 1.00 0.00 H new ATOM 1404 N THR A 86 -11.052 10.454 -1.824 1.00 0.00 N ATOM 1405 CA THR A 86 -10.838 11.194 -3.062 1.00 0.00 C ATOM 1406 C THR A 86 -9.796 10.498 -3.932 1.00 0.00 C ATOM 1407 O THR A 86 -9.898 10.496 -5.158 1.00 0.00 O ATOM 1408 CB THR A 86 -10.393 12.625 -2.757 1.00 0.00 C ATOM 1409 OG1 THR A 86 -11.103 13.145 -1.646 1.00 0.00 O ATOM 1410 CG2 THR A 86 -10.596 13.575 -3.917 1.00 0.00 C ATOM 0 H THR A 86 -10.486 10.772 -1.038 1.00 0.00 H new ATOM 0 HA THR A 86 -11.781 11.226 -3.607 1.00 0.00 H new ATOM 0 HB THR A 86 -9.326 12.557 -2.547 1.00 0.00 H new ATOM 0 HG1 THR A 86 -10.692 12.824 -0.816 1.00 0.00 H new ATOM 0 HG21 THR A 86 -10.260 14.572 -3.634 1.00 0.00 H new ATOM 0 HG22 THR A 86 -10.021 13.229 -4.776 1.00 0.00 H new ATOM 0 HG23 THR A 86 -11.654 13.609 -4.178 1.00 0.00 H new ATOM 1418 N SER A 87 -8.799 9.906 -3.285 1.00 0.00 N ATOM 1419 CA SER A 87 -7.737 9.202 -3.994 1.00 0.00 C ATOM 1420 C SER A 87 -7.038 8.211 -3.069 1.00 0.00 C ATOM 1421 O SER A 87 -6.306 8.603 -2.161 1.00 0.00 O ATOM 1422 CB SER A 87 -6.721 10.196 -4.557 1.00 0.00 C ATOM 1423 OG SER A 87 -6.637 11.355 -3.746 1.00 0.00 O ATOM 0 H SER A 87 -8.704 9.899 -2.269 1.00 0.00 H new ATOM 0 HA SER A 87 -8.187 8.651 -4.820 1.00 0.00 H new ATOM 0 HB2 SER A 87 -5.742 9.722 -4.622 1.00 0.00 H new ATOM 0 HB3 SER A 87 -7.006 10.478 -5.571 1.00 0.00 H new ATOM 0 HG SER A 87 -5.979 11.974 -4.127 1.00 0.00 H new ATOM 1429 N VAL A 88 -7.271 6.924 -3.305 1.00 0.00 N ATOM 1430 CA VAL A 88 -6.667 5.876 -2.491 1.00 0.00 C ATOM 1431 C VAL A 88 -5.714 5.018 -3.317 1.00 0.00 C ATOM 1432 O VAL A 88 -6.118 4.387 -4.293 1.00 0.00 O ATOM 1433 CB VAL A 88 -7.738 4.968 -1.857 1.00 0.00 C ATOM 1434 CG1 VAL A 88 -7.102 3.975 -0.895 1.00 0.00 C ATOM 1435 CG2 VAL A 88 -8.794 5.803 -1.148 1.00 0.00 C ATOM 0 H VAL A 88 -7.874 6.582 -4.053 1.00 0.00 H new ATOM 0 HA VAL A 88 -6.109 6.375 -1.699 1.00 0.00 H new ATOM 0 HB VAL A 88 -8.224 4.405 -2.653 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -7.876 3.344 -0.459 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -6.388 3.353 -1.434 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -6.586 4.516 -0.102 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -9.542 5.145 -0.706 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -8.323 6.395 -0.363 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -9.274 6.468 -1.866 1.00 0.00 H new ATOM 1445 N THR A 89 -4.447 4.998 -2.914 1.00 0.00 N ATOM 1446 CA THR A 89 -3.436 4.213 -3.612 1.00 0.00 C ATOM 1447 C THR A 89 -3.267 2.852 -2.950 1.00 0.00 C ATOM 1448 O THR A 89 -2.920 2.763 -1.772 1.00 0.00 O ATOM 1449 CB THR A 89 -2.101 4.958 -3.626 1.00 0.00 C ATOM 1450 OG1 THR A 89 -1.843 5.550 -2.364 1.00 0.00 O ATOM 1451 CG2 THR A 89 -2.037 6.054 -4.668 1.00 0.00 C ATOM 0 H THR A 89 -4.097 5.516 -2.108 1.00 0.00 H new ATOM 0 HA THR A 89 -3.766 4.063 -4.640 1.00 0.00 H new ATOM 0 HB THR A 89 -1.353 4.204 -3.869 1.00 0.00 H new ATOM 0 HG1 THR A 89 -2.062 4.912 -1.653 1.00 0.00 H new ATOM 0 HG21 THR A 89 -1.063 6.542 -4.624 1.00 0.00 H new ATOM 0 HG22 THR A 89 -2.182 5.623 -5.659 1.00 0.00 H new ATOM 0 HG23 THR A 89 -2.819 6.787 -4.473 1.00 0.00 H new ATOM 1459 N LEU A 90 -3.521 1.792 -3.709 1.00 0.00 N ATOM 1460 CA LEU A 90 -3.404 0.435 -3.187 1.00 0.00 C ATOM 1461 C LEU A 90 -2.055 -0.178 -3.538 1.00 0.00 C ATOM 1462 O LEU A 90 -1.468 0.130 -4.577 1.00 0.00 O ATOM 1463 CB LEU A 90 -4.529 -0.443 -3.736 1.00 0.00 C ATOM 1464 CG LEU A 90 -5.921 0.193 -3.706 1.00 0.00 C ATOM 1465 CD1 LEU A 90 -6.255 0.807 -5.057 1.00 0.00 C ATOM 1466 CD2 LEU A 90 -6.971 -0.834 -3.308 1.00 0.00 C ATOM 0 H LEU A 90 -3.809 1.846 -4.686 1.00 0.00 H new ATOM 0 HA LEU A 90 -3.484 0.488 -2.101 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -4.291 -0.711 -4.765 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -4.558 -1.370 -3.164 1.00 0.00 H new ATOM 0 HG LEU A 90 -5.921 0.987 -2.959 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -7.248 1.255 -5.018 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -5.520 1.575 -5.299 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -6.236 0.032 -5.823 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -7.954 -0.362 -3.292 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -6.972 -1.651 -4.029 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -6.740 -1.225 -2.317 1.00 0.00 H new ATOM 1478 N LEU A 91 -1.574 -1.054 -2.662 1.00 0.00 N ATOM 1479 CA LEU A 91 -0.297 -1.726 -2.865 1.00 0.00 C ATOM 1480 C LEU A 91 -0.414 -3.211 -2.531 1.00 0.00 C ATOM 1481 O LEU A 91 -1.296 -3.613 -1.774 1.00 0.00 O ATOM 1482 CB LEU A 91 0.774 -1.076 -1.993 1.00 0.00 C ATOM 1483 CG LEU A 91 1.604 0.007 -2.682 1.00 0.00 C ATOM 1484 CD1 LEU A 91 0.953 1.370 -2.505 1.00 0.00 C ATOM 1485 CD2 LEU A 91 3.024 0.018 -2.134 1.00 0.00 C ATOM 0 H LEU A 91 -2.053 -1.316 -1.800 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.014 -1.629 -3.913 1.00 0.00 H new ATOM 0 HB2 LEU A 91 0.292 -0.640 -1.118 1.00 0.00 H new ATOM 0 HB3 LEU A 91 1.448 -1.853 -1.632 1.00 0.00 H new ATOM 0 HG LEU A 91 1.648 -0.217 -3.748 1.00 0.00 H new ATOM 0 HD11 LEU A 91 1.557 2.129 -3.002 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -0.045 1.356 -2.943 1.00 0.00 H new ATOM 0 HD13 LEU A 91 0.879 1.603 -1.443 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.601 0.795 -2.635 1.00 0.00 H new ATOM 0 HD22 LEU A 91 2.999 0.219 -1.063 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.490 -0.951 -2.311 1.00 0.00 H new ATOM 1497 N LYS A 92 0.475 -4.026 -3.096 1.00 0.00 N ATOM 1498 CA LYS A 92 0.451 -5.464 -2.842 1.00 0.00 C ATOM 1499 C LYS A 92 0.932 -5.770 -1.426 1.00 0.00 C ATOM 1500 O LYS A 92 2.053 -5.421 -1.050 1.00 0.00 O ATOM 1501 CB LYS A 92 1.329 -6.197 -3.860 1.00 0.00 C ATOM 1502 CG LYS A 92 0.784 -6.156 -5.277 1.00 0.00 C ATOM 1503 CD LYS A 92 -0.353 -7.146 -5.475 1.00 0.00 C ATOM 1504 CE LYS A 92 -0.198 -7.922 -6.772 1.00 0.00 C ATOM 1505 NZ LYS A 92 -1.179 -9.037 -6.874 1.00 0.00 N ATOM 0 H LYS A 92 1.215 -3.718 -3.727 1.00 0.00 H new ATOM 0 HA LYS A 92 -0.577 -5.811 -2.943 1.00 0.00 H new ATOM 0 HB2 LYS A 92 2.326 -5.757 -3.851 1.00 0.00 H new ATOM 0 HB3 LYS A 92 1.437 -7.237 -3.552 1.00 0.00 H new ATOM 0 HG2 LYS A 92 0.432 -5.149 -5.502 1.00 0.00 H new ATOM 0 HG3 LYS A 92 1.586 -6.378 -5.981 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -0.382 -7.841 -4.636 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -1.304 -6.613 -5.480 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -0.328 -7.246 -7.617 1.00 0.00 H new ATOM 0 HE3 LYS A 92 0.814 -8.322 -6.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -1.040 -9.541 -7.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -1.039 -9.696 -6.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -2.145 -8.654 -6.838 1.00 0.00 H new ATOM 1519 N ALA A 93 0.080 -6.431 -0.646 1.00 0.00 N ATOM 1520 CA ALA A 93 0.415 -6.787 0.729 1.00 0.00 C ATOM 1521 C ALA A 93 1.742 -7.533 0.796 1.00 0.00 C ATOM 1522 O ALA A 93 2.538 -7.327 1.712 1.00 0.00 O ATOM 1523 CB ALA A 93 -0.694 -7.627 1.343 1.00 0.00 C ATOM 0 H ALA A 93 -0.848 -6.731 -0.944 1.00 0.00 H new ATOM 0 HA ALA A 93 0.517 -5.865 1.301 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -0.430 -7.885 2.369 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -1.625 -7.059 1.340 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -0.824 -8.540 0.761 1.00 0.00 H new ATOM 1529 N SER A 94 1.971 -8.403 -0.181 1.00 0.00 N ATOM 1530 CA SER A 94 3.199 -9.183 -0.235 1.00 0.00 C ATOM 1531 C SER A 94 4.409 -8.279 -0.447 1.00 0.00 C ATOM 1532 O SER A 94 5.490 -8.539 0.081 1.00 0.00 O ATOM 1533 CB SER A 94 3.122 -10.219 -1.357 1.00 0.00 C ATOM 1534 OG SER A 94 1.778 -10.577 -1.629 1.00 0.00 O ATOM 0 H SER A 94 1.321 -8.585 -0.946 1.00 0.00 H new ATOM 0 HA SER A 94 3.314 -9.698 0.719 1.00 0.00 H new ATOM 0 HB2 SER A 94 3.585 -9.818 -2.259 1.00 0.00 H new ATOM 0 HB3 SER A 94 3.688 -11.107 -1.076 1.00 0.00 H new ATOM 0 HG SER A 94 1.428 -10.010 -2.348 1.00 0.00 H new ATOM 1540 N GLU A 95 4.222 -7.213 -1.219 1.00 0.00 N ATOM 1541 CA GLU A 95 5.307 -6.279 -1.492 1.00 0.00 C ATOM 1542 C GLU A 95 5.692 -5.522 -0.227 1.00 0.00 C ATOM 1543 O GLU A 95 6.868 -5.448 0.136 1.00 0.00 O ATOM 1544 CB GLU A 95 4.895 -5.296 -2.590 1.00 0.00 C ATOM 1545 CG GLU A 95 5.503 -5.614 -3.946 1.00 0.00 C ATOM 1546 CD GLU A 95 4.492 -6.179 -4.924 1.00 0.00 C ATOM 1547 OE1 GLU A 95 4.348 -5.607 -6.025 1.00 0.00 O ATOM 1548 OE2 GLU A 95 3.846 -7.195 -4.590 1.00 0.00 O ATOM 0 H GLU A 95 3.335 -6.976 -1.664 1.00 0.00 H new ATOM 0 HA GLU A 95 6.173 -6.846 -1.833 1.00 0.00 H new ATOM 0 HB2 GLU A 95 3.809 -5.296 -2.678 1.00 0.00 H new ATOM 0 HB3 GLU A 95 5.190 -4.289 -2.295 1.00 0.00 H new ATOM 0 HG2 GLU A 95 5.940 -4.708 -4.365 1.00 0.00 H new ATOM 0 HG3 GLU A 95 6.315 -6.329 -3.816 1.00 0.00 H new ATOM 1555 N VAL A 96 4.690 -4.976 0.452 1.00 0.00 N ATOM 1556 CA VAL A 96 4.923 -4.239 1.684 1.00 0.00 C ATOM 1557 C VAL A 96 5.504 -5.156 2.750 1.00 0.00 C ATOM 1558 O VAL A 96 6.443 -4.792 3.455 1.00 0.00 O ATOM 1559 CB VAL A 96 3.626 -3.605 2.219 1.00 0.00 C ATOM 1560 CG1 VAL A 96 3.921 -2.705 3.410 1.00 0.00 C ATOM 1561 CG2 VAL A 96 2.911 -2.830 1.122 1.00 0.00 C ATOM 0 H VAL A 96 3.711 -5.030 0.170 1.00 0.00 H new ATOM 0 HA VAL A 96 5.631 -3.443 1.455 1.00 0.00 H new ATOM 0 HB VAL A 96 2.967 -4.407 2.552 1.00 0.00 H new ATOM 0 HG11 VAL A 96 2.992 -2.266 3.774 1.00 0.00 H new ATOM 0 HG12 VAL A 96 4.380 -3.292 4.205 1.00 0.00 H new ATOM 0 HG13 VAL A 96 4.602 -1.911 3.106 1.00 0.00 H new ATOM 0 HG21 VAL A 96 1.997 -2.391 1.523 1.00 0.00 H new ATOM 0 HG22 VAL A 96 3.562 -2.038 0.752 1.00 0.00 H new ATOM 0 HG23 VAL A 96 2.660 -3.505 0.304 1.00 0.00 H new ATOM 1571 N GLU A 97 4.938 -6.352 2.855 1.00 0.00 N ATOM 1572 CA GLU A 97 5.393 -7.334 3.831 1.00 0.00 C ATOM 1573 C GLU A 97 6.879 -7.621 3.656 1.00 0.00 C ATOM 1574 O GLU A 97 7.629 -7.682 4.630 1.00 0.00 O ATOM 1575 CB GLU A 97 4.588 -8.628 3.699 1.00 0.00 C ATOM 1576 CG GLU A 97 3.447 -8.736 4.697 1.00 0.00 C ATOM 1577 CD GLU A 97 3.900 -9.254 6.047 1.00 0.00 C ATOM 1578 OE1 GLU A 97 3.631 -8.579 7.063 1.00 0.00 O ATOM 1579 OE2 GLU A 97 4.526 -10.333 6.090 1.00 0.00 O ATOM 0 H GLU A 97 4.161 -6.666 2.274 1.00 0.00 H new ATOM 0 HA GLU A 97 5.236 -6.921 4.828 1.00 0.00 H new ATOM 0 HB2 GLU A 97 4.184 -8.694 2.689 1.00 0.00 H new ATOM 0 HB3 GLU A 97 5.257 -9.478 3.831 1.00 0.00 H new ATOM 0 HG2 GLU A 97 2.986 -7.756 4.824 1.00 0.00 H new ATOM 0 HG3 GLU A 97 2.680 -9.399 4.296 1.00 0.00 H new ATOM 1586 N GLU A 98 7.301 -7.797 2.408 1.00 0.00 N ATOM 1587 CA GLU A 98 8.700 -8.075 2.116 1.00 0.00 C ATOM 1588 C GLU A 98 9.585 -6.914 2.556 1.00 0.00 C ATOM 1589 O GLU A 98 10.592 -7.106 3.244 1.00 0.00 O ATOM 1590 CB GLU A 98 8.880 -8.312 0.618 1.00 0.00 C ATOM 1591 CG GLU A 98 8.070 -9.473 0.073 1.00 0.00 C ATOM 1592 CD GLU A 98 8.883 -10.747 -0.040 1.00 0.00 C ATOM 1593 OE1 GLU A 98 9.295 -11.284 1.009 1.00 0.00 O ATOM 1594 OE2 GLU A 98 9.108 -11.209 -1.180 1.00 0.00 O ATOM 0 H GLU A 98 6.697 -7.752 1.587 1.00 0.00 H new ATOM 0 HA GLU A 98 8.994 -8.968 2.667 1.00 0.00 H new ATOM 0 HB2 GLU A 98 8.601 -7.405 0.081 1.00 0.00 H new ATOM 0 HB3 GLU A 98 9.935 -8.492 0.414 1.00 0.00 H new ATOM 0 HG2 GLU A 98 7.212 -9.650 0.722 1.00 0.00 H new ATOM 0 HG3 GLU A 98 7.677 -9.208 -0.909 1.00 0.00 H new ATOM 1601 N ILE A 99 9.195 -5.699 2.180 1.00 0.00 N ATOM 1602 CA ILE A 99 9.959 -4.519 2.558 1.00 0.00 C ATOM 1603 C ILE A 99 9.988 -4.397 4.072 1.00 0.00 C ATOM 1604 O ILE A 99 11.012 -4.054 4.664 1.00 0.00 O ATOM 1605 CB ILE A 99 9.391 -3.221 1.947 1.00 0.00 C ATOM 1606 CG1 ILE A 99 9.048 -3.416 0.469 1.00 0.00 C ATOM 1607 CG2 ILE A 99 10.393 -2.086 2.106 1.00 0.00 C ATOM 1608 CD1 ILE A 99 7.836 -2.627 0.024 1.00 0.00 C ATOM 0 H ILE A 99 8.364 -5.509 1.620 1.00 0.00 H new ATOM 0 HA ILE A 99 10.967 -4.647 2.165 1.00 0.00 H new ATOM 0 HB ILE A 99 8.475 -2.966 2.479 1.00 0.00 H new ATOM 0 HG12 ILE A 99 9.905 -3.123 -0.137 1.00 0.00 H new ATOM 0 HG13 ILE A 99 8.872 -4.475 0.281 1.00 0.00 H new ATOM 0 HG21 ILE A 99 9.982 -1.175 1.671 1.00 0.00 H new ATOM 0 HG22 ILE A 99 10.595 -1.924 3.165 1.00 0.00 H new ATOM 0 HG23 ILE A 99 11.321 -2.345 1.596 1.00 0.00 H new ATOM 0 HD11 ILE A 99 7.650 -2.812 -1.034 1.00 0.00 H new ATOM 0 HD12 ILE A 99 6.967 -2.936 0.605 1.00 0.00 H new ATOM 0 HD13 ILE A 99 8.017 -1.563 0.180 1.00 0.00 H new ATOM 1620 N LEU A 100 8.857 -4.707 4.694 1.00 0.00 N ATOM 1621 CA LEU A 100 8.750 -4.661 6.147 1.00 0.00 C ATOM 1622 C LEU A 100 9.655 -5.719 6.766 1.00 0.00 C ATOM 1623 O LEU A 100 10.257 -5.502 7.818 1.00 0.00 O ATOM 1624 CB LEU A 100 7.302 -4.886 6.590 1.00 0.00 C ATOM 1625 CG LEU A 100 6.327 -3.745 6.279 1.00 0.00 C ATOM 1626 CD1 LEU A 100 5.060 -3.898 7.106 1.00 0.00 C ATOM 1627 CD2 LEU A 100 6.970 -2.390 6.536 1.00 0.00 C ATOM 0 H LEU A 100 8.002 -4.992 4.216 1.00 0.00 H new ATOM 0 HA LEU A 100 9.065 -3.674 6.487 1.00 0.00 H new ATOM 0 HB2 LEU A 100 6.933 -5.795 6.114 1.00 0.00 H new ATOM 0 HB3 LEU A 100 7.294 -5.063 7.665 1.00 0.00 H new ATOM 0 HG LEU A 100 6.067 -3.797 5.222 1.00 0.00 H new ATOM 0 HD11 LEU A 100 4.375 -3.082 6.877 1.00 0.00 H new ATOM 0 HD12 LEU A 100 4.583 -4.849 6.869 1.00 0.00 H new ATOM 0 HD13 LEU A 100 5.312 -3.873 8.166 1.00 0.00 H new ATOM 0 HD21 LEU A 100 6.256 -1.599 6.307 1.00 0.00 H new ATOM 0 HD22 LEU A 100 7.266 -2.320 7.583 1.00 0.00 H new ATOM 0 HD23 LEU A 100 7.850 -2.279 5.902 1.00 0.00 H new ATOM 1639 N ASP A 101 9.759 -6.861 6.091 1.00 0.00 N ATOM 1640 CA ASP A 101 10.607 -7.953 6.554 1.00 0.00 C ATOM 1641 C ASP A 101 12.072 -7.657 6.236 1.00 0.00 C ATOM 1642 O ASP A 101 12.978 -8.317 6.743 1.00 0.00 O ATOM 1643 CB ASP A 101 10.182 -9.272 5.904 1.00 0.00 C ATOM 1644 CG ASP A 101 9.850 -10.340 6.929 1.00 0.00 C ATOM 1645 OD1 ASP A 101 10.410 -11.453 6.829 1.00 0.00 O ATOM 1646 OD2 ASP A 101 9.032 -10.064 7.831 1.00 0.00 O ATOM 0 H ASP A 101 9.265 -7.053 5.220 1.00 0.00 H new ATOM 0 HA ASP A 101 10.494 -8.045 7.634 1.00 0.00 H new ATOM 0 HB2 ASP A 101 9.313 -9.098 5.270 1.00 0.00 H new ATOM 0 HB3 ASP A 101 10.983 -9.630 5.257 1.00 0.00 H new ATOM 1651 N GLY A 102 12.287 -6.655 5.388 1.00 0.00 N ATOM 1652 CA GLY A 102 13.631 -6.268 5.001 1.00 0.00 C ATOM 1653 C GLY A 102 14.018 -6.795 3.634 1.00 0.00 C ATOM 1654 O GLY A 102 15.141 -6.582 3.175 1.00 0.00 O ATOM 0 H GLY A 102 11.546 -6.100 4.959 1.00 0.00 H new ATOM 0 HA2 GLY A 102 13.707 -5.181 5.002 1.00 0.00 H new ATOM 0 HA3 GLY A 102 14.339 -6.637 5.743 1.00 0.00 H new ATOM 1658 N ASN A 103 13.076 -7.449 2.966 1.00 0.00 N ATOM 1659 CA ASN A 103 13.311 -7.965 1.627 1.00 0.00 C ATOM 1660 C ASN A 103 12.615 -7.071 0.610 1.00 0.00 C ATOM 1661 O ASN A 103 11.388 -7.025 0.557 1.00 0.00 O ATOM 1662 CB ASN A 103 12.800 -9.402 1.505 1.00 0.00 C ATOM 1663 CG ASN A 103 13.135 -10.021 0.163 1.00 0.00 C ATOM 1664 OD1 ASN A 103 14.233 -10.544 -0.036 1.00 0.00 O ATOM 1665 ND2 ASN A 103 12.190 -9.966 -0.768 1.00 0.00 N ATOM 0 H ASN A 103 12.142 -7.634 3.332 1.00 0.00 H new ATOM 0 HA ASN A 103 14.383 -7.968 1.432 1.00 0.00 H new ATOM 0 HB2 ASN A 103 13.234 -10.008 2.300 1.00 0.00 H new ATOM 0 HB3 ASN A 103 11.720 -9.414 1.648 1.00 0.00 H new ATOM 0 HD21 ASN A 103 12.359 -10.366 -1.691 1.00 0.00 H new ATOM 0 HD22 ASN A 103 11.295 -9.523 -0.560 1.00 0.00 H new ATOM 1672 N ASP A 104 13.387 -6.350 -0.187 1.00 0.00 N ATOM 1673 CA ASP A 104 12.798 -5.458 -1.179 1.00 0.00 C ATOM 1674 C ASP A 104 13.829 -4.940 -2.177 1.00 0.00 C ATOM 1675 O ASP A 104 13.597 -3.940 -2.852 1.00 0.00 O ATOM 1676 CB ASP A 104 12.123 -4.282 -0.472 1.00 0.00 C ATOM 1677 CG ASP A 104 13.053 -3.575 0.495 1.00 0.00 C ATOM 1678 OD1 ASP A 104 13.608 -2.520 0.124 1.00 0.00 O ATOM 1679 OD2 ASP A 104 13.227 -4.079 1.625 1.00 0.00 O ATOM 0 H ASP A 104 14.407 -6.362 -0.170 1.00 0.00 H new ATOM 0 HA ASP A 104 12.062 -6.031 -1.742 1.00 0.00 H new ATOM 0 HB2 ASP A 104 11.768 -3.569 -1.217 1.00 0.00 H new ATOM 0 HB3 ASP A 104 11.247 -4.641 0.068 1.00 0.00 H new ATOM 1684 N GLU A 105 14.961 -5.626 -2.272 1.00 0.00 N ATOM 1685 CA GLU A 105 16.022 -5.228 -3.192 1.00 0.00 C ATOM 1686 C GLU A 105 15.511 -5.170 -4.627 1.00 0.00 C ATOM 1687 O GLU A 105 15.894 -4.290 -5.399 1.00 0.00 O ATOM 1688 CB GLU A 105 17.199 -6.201 -3.096 1.00 0.00 C ATOM 1689 CG GLU A 105 18.155 -5.888 -1.956 1.00 0.00 C ATOM 1690 CD GLU A 105 19.606 -6.114 -2.335 1.00 0.00 C ATOM 1691 OE1 GLU A 105 20.398 -6.492 -1.448 1.00 0.00 O ATOM 1692 OE2 GLU A 105 19.948 -5.914 -3.520 1.00 0.00 O ATOM 0 H GLU A 105 15.169 -6.461 -1.724 1.00 0.00 H new ATOM 0 HA GLU A 105 16.358 -4.231 -2.908 1.00 0.00 H new ATOM 0 HB2 GLU A 105 16.814 -7.213 -2.969 1.00 0.00 H new ATOM 0 HB3 GLU A 105 17.750 -6.185 -4.036 1.00 0.00 H new ATOM 0 HG2 GLU A 105 18.021 -4.851 -1.648 1.00 0.00 H new ATOM 0 HG3 GLU A 105 17.906 -6.510 -1.096 1.00 0.00 H new ATOM 1699 N LYS A 106 14.645 -6.113 -4.978 1.00 0.00 N ATOM 1700 CA LYS A 106 14.081 -6.172 -6.321 1.00 0.00 C ATOM 1701 C LYS A 106 13.038 -5.077 -6.531 1.00 0.00 C ATOM 1702 O LYS A 106 12.728 -4.715 -7.666 1.00 0.00 O ATOM 1703 CB LYS A 106 13.453 -7.544 -6.571 1.00 0.00 C ATOM 1704 CG LYS A 106 12.356 -7.900 -5.581 1.00 0.00 C ATOM 1705 CD LYS A 106 11.632 -9.176 -5.985 1.00 0.00 C ATOM 1706 CE LYS A 106 11.349 -10.061 -4.782 1.00 0.00 C ATOM 1707 NZ LYS A 106 9.995 -10.677 -4.853 1.00 0.00 N ATOM 0 H LYS A 106 14.318 -6.848 -4.351 1.00 0.00 H new ATOM 0 HA LYS A 106 14.891 -6.012 -7.032 1.00 0.00 H new ATOM 0 HB2 LYS A 106 13.042 -7.568 -7.580 1.00 0.00 H new ATOM 0 HB3 LYS A 106 14.232 -8.305 -6.526 1.00 0.00 H new ATOM 0 HG2 LYS A 106 12.787 -8.024 -4.588 1.00 0.00 H new ATOM 0 HG3 LYS A 106 11.641 -7.079 -5.518 1.00 0.00 H new ATOM 0 HD2 LYS A 106 10.695 -8.922 -6.480 1.00 0.00 H new ATOM 0 HD3 LYS A 106 12.236 -9.725 -6.708 1.00 0.00 H new ATOM 0 HE2 LYS A 106 12.103 -10.846 -4.724 1.00 0.00 H new ATOM 0 HE3 LYS A 106 11.432 -9.471 -3.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 9.840 -11.273 -4.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 9.274 -9.928 -4.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 9.924 -11.261 -5.711 1.00 0.00 H new ATOM 1721 N TYR A 107 12.492 -4.557 -5.435 1.00 0.00 N ATOM 1722 CA TYR A 107 11.483 -3.515 -5.505 1.00 0.00 C ATOM 1723 C TYR A 107 12.115 -2.134 -5.651 1.00 0.00 C ATOM 1724 O TYR A 107 11.543 -1.242 -6.276 1.00 0.00 O ATOM 1725 CB TYR A 107 10.627 -3.534 -4.243 1.00 0.00 C ATOM 1726 CG TYR A 107 9.910 -4.836 -3.988 1.00 0.00 C ATOM 1727 CD1 TYR A 107 9.919 -5.407 -2.725 1.00 0.00 C ATOM 1728 CD2 TYR A 107 9.217 -5.487 -4.998 1.00 0.00 C ATOM 1729 CE1 TYR A 107 9.259 -6.591 -2.472 1.00 0.00 C ATOM 1730 CE2 TYR A 107 8.554 -6.673 -4.756 1.00 0.00 C ATOM 1731 CZ TYR A 107 8.577 -7.222 -3.490 1.00 0.00 C ATOM 1732 OH TYR A 107 7.916 -8.404 -3.244 1.00 0.00 O ATOM 0 H TYR A 107 12.735 -4.844 -4.487 1.00 0.00 H new ATOM 0 HA TYR A 107 10.867 -3.712 -6.382 1.00 0.00 H new ATOM 0 HB2 TYR A 107 11.262 -3.311 -3.386 1.00 0.00 H new ATOM 0 HB3 TYR A 107 9.889 -2.735 -4.309 1.00 0.00 H new ATOM 0 HD1 TYR A 107 10.453 -4.916 -1.925 1.00 0.00 H new ATOM 0 HD2 TYR A 107 9.196 -5.059 -5.989 1.00 0.00 H new ATOM 0 HE1 TYR A 107 9.276 -7.021 -1.482 1.00 0.00 H new ATOM 0 HE2 TYR A 107 8.020 -7.169 -5.553 1.00 0.00 H new ATOM 0 HH TYR A 107 7.486 -8.716 -4.067 1.00 0.00 H new ATOM 1742 N LYS A 108 13.284 -1.955 -5.045 1.00 0.00 N ATOM 1743 CA LYS A 108 13.973 -0.667 -5.084 1.00 0.00 C ATOM 1744 C LYS A 108 14.692 -0.450 -6.415 1.00 0.00 C ATOM 1745 O LYS A 108 14.825 0.683 -6.876 1.00 0.00 O ATOM 1746 CB LYS A 108 14.984 -0.538 -3.932 1.00 0.00 C ATOM 1747 CG LYS A 108 14.827 -1.570 -2.828 1.00 0.00 C ATOM 1748 CD LYS A 108 15.557 -1.145 -1.563 1.00 0.00 C ATOM 1749 CE LYS A 108 14.925 0.090 -0.942 1.00 0.00 C ATOM 1750 NZ LYS A 108 15.869 1.242 -0.916 1.00 0.00 N ATOM 0 H LYS A 108 13.774 -2.681 -4.523 1.00 0.00 H new ATOM 0 HA LYS A 108 13.206 0.099 -4.973 1.00 0.00 H new ATOM 0 HB2 LYS A 108 15.991 -0.615 -4.341 1.00 0.00 H new ATOM 0 HB3 LYS A 108 14.892 0.457 -3.496 1.00 0.00 H new ATOM 0 HG2 LYS A 108 13.769 -1.712 -2.609 1.00 0.00 H new ATOM 0 HG3 LYS A 108 15.214 -2.531 -3.168 1.00 0.00 H new ATOM 0 HD2 LYS A 108 15.544 -1.963 -0.842 1.00 0.00 H new ATOM 0 HD3 LYS A 108 16.602 -0.942 -1.796 1.00 0.00 H new ATOM 0 HE2 LYS A 108 14.033 0.364 -1.505 1.00 0.00 H new ATOM 0 HE3 LYS A 108 14.603 -0.139 0.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 15.401 2.065 -0.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 16.709 0.990 -0.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 16.157 1.477 -1.887 1.00 0.00 H new ATOM 1764 N ALA A 109 15.172 -1.533 -7.019 1.00 0.00 N ATOM 1765 CA ALA A 109 15.897 -1.435 -8.283 1.00 0.00 C ATOM 1766 C ALA A 109 15.172 -2.143 -9.423 1.00 0.00 C ATOM 1767 O ALA A 109 15.806 -2.625 -10.360 1.00 0.00 O ATOM 1768 CB ALA A 109 17.295 -2.009 -8.123 1.00 0.00 C ATOM 0 H ALA A 109 15.074 -2.482 -6.658 1.00 0.00 H new ATOM 0 HA ALA A 109 15.957 -0.378 -8.543 1.00 0.00 H new ATOM 0 HB1 ALA A 109 17.830 -1.933 -9.070 1.00 0.00 H new ATOM 0 HB2 ALA A 109 17.832 -1.450 -7.356 1.00 0.00 H new ATOM 0 HB3 ALA A 109 17.227 -3.056 -7.828 1.00 0.00 H new ATOM 1774 N VAL A 110 13.846 -2.200 -9.342 1.00 0.00 N ATOM 1775 CA VAL A 110 13.033 -2.844 -10.369 1.00 0.00 C ATOM 1776 C VAL A 110 13.224 -4.360 -10.360 1.00 0.00 C ATOM 1777 O VAL A 110 12.265 -5.120 -10.239 1.00 0.00 O ATOM 1778 CB VAL A 110 13.364 -2.294 -11.769 1.00 0.00 C ATOM 1779 CG1 VAL A 110 12.564 -3.015 -12.845 1.00 0.00 C ATOM 1780 CG2 VAL A 110 13.112 -0.796 -11.828 1.00 0.00 C ATOM 0 H VAL A 110 13.309 -1.805 -8.570 1.00 0.00 H new ATOM 0 HA VAL A 110 11.992 -2.619 -10.137 1.00 0.00 H new ATOM 0 HB VAL A 110 14.422 -2.475 -11.960 1.00 0.00 H new ATOM 0 HG11 VAL A 110 12.818 -2.606 -13.823 1.00 0.00 H new ATOM 0 HG12 VAL A 110 12.802 -4.079 -12.824 1.00 0.00 H new ATOM 0 HG13 VAL A 110 11.499 -2.877 -12.660 1.00 0.00 H new ATOM 0 HG21 VAL A 110 13.352 -0.426 -12.825 1.00 0.00 H new ATOM 0 HG22 VAL A 110 12.064 -0.594 -11.608 1.00 0.00 H new ATOM 0 HG23 VAL A 110 13.740 -0.292 -11.093 1.00 0.00 H new ATOM 1790 N SER A 111 14.470 -4.787 -10.492 1.00 0.00 N ATOM 1791 CA SER A 111 14.795 -6.209 -10.501 1.00 0.00 C ATOM 1792 C SER A 111 16.265 -6.444 -10.159 1.00 0.00 C ATOM 1793 O SER A 111 16.600 -7.401 -9.460 1.00 0.00 O ATOM 1794 CB SER A 111 14.477 -6.817 -11.868 1.00 0.00 C ATOM 1795 OG SER A 111 14.335 -8.225 -11.778 1.00 0.00 O ATOM 0 H SER A 111 15.276 -4.170 -10.595 1.00 0.00 H new ATOM 0 HA SER A 111 14.185 -6.695 -9.740 1.00 0.00 H new ATOM 0 HB2 SER A 111 13.559 -6.380 -12.260 1.00 0.00 H new ATOM 0 HB3 SER A 111 15.272 -6.572 -12.572 1.00 0.00 H new ATOM 0 HG SER A 111 14.131 -8.590 -12.664 1.00 0.00 H new ATOM 1801 N ILE A 112 17.134 -5.569 -10.659 1.00 0.00 N ATOM 1802 CA ILE A 112 18.572 -5.675 -10.415 1.00 0.00 C ATOM 1803 C ILE A 112 19.065 -7.111 -10.590 1.00 0.00 C ATOM 1804 O ILE A 112 19.865 -7.608 -9.797 1.00 0.00 O ATOM 1805 CB ILE A 112 18.947 -5.168 -9.003 1.00 0.00 C ATOM 1806 CG1 ILE A 112 20.470 -5.140 -8.833 1.00 0.00 C ATOM 1807 CG2 ILE A 112 18.304 -6.032 -7.929 1.00 0.00 C ATOM 1808 CD1 ILE A 112 21.039 -3.742 -8.723 1.00 0.00 C ATOM 0 H ILE A 112 16.866 -4.774 -11.239 1.00 0.00 H new ATOM 0 HA ILE A 112 19.062 -5.043 -11.155 1.00 0.00 H new ATOM 0 HB ILE A 112 18.567 -4.152 -8.892 1.00 0.00 H new ATOM 0 HG12 ILE A 112 20.738 -5.704 -7.940 1.00 0.00 H new ATOM 0 HG13 ILE A 112 20.932 -5.646 -9.681 1.00 0.00 H new ATOM 0 HG21 ILE A 112 18.582 -5.656 -6.945 1.00 0.00 H new ATOM 0 HG22 ILE A 112 17.220 -6.000 -8.037 1.00 0.00 H new ATOM 0 HG23 ILE A 112 18.648 -7.061 -8.035 1.00 0.00 H new ATOM 0 HD11 ILE A 112 22.121 -3.798 -8.605 1.00 0.00 H new ATOM 0 HD12 ILE A 112 20.801 -3.180 -9.626 1.00 0.00 H new ATOM 0 HD13 ILE A 112 20.605 -3.240 -7.859 1.00 0.00 H new ATOM 1820 N SER A 113 18.579 -7.771 -11.637 1.00 0.00 N ATOM 1821 CA SER A 113 18.968 -9.148 -11.920 1.00 0.00 C ATOM 1822 C SER A 113 20.461 -9.242 -12.222 1.00 0.00 C ATOM 1823 O SER A 113 21.214 -8.363 -11.754 1.00 0.00 O ATOM 1824 CB SER A 113 18.162 -9.693 -13.101 1.00 0.00 C ATOM 1825 OG SER A 113 18.166 -8.782 -14.186 1.00 0.00 O ATOM 1826 OXT SER A 113 20.863 -10.194 -12.923 1.00 0.00 O ATOM 0 H SER A 113 17.916 -7.375 -12.303 1.00 0.00 H new ATOM 0 HA SER A 113 18.757 -9.748 -11.035 1.00 0.00 H new ATOM 0 HB2 SER A 113 18.581 -10.647 -13.422 1.00 0.00 H new ATOM 0 HB3 SER A 113 17.136 -9.885 -12.787 1.00 0.00 H new ATOM 0 HG SER A 113 17.646 -9.155 -14.928 1.00 0.00 H new TER 1832 SER A 113