USER MOD reduce.3.24.130724 H: found=0, std=0, add=1098, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1100 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 NoAdj-H: A 7 LYS HZ2 : A 7 LYS NZ : A 5 ILE CG2 :(NH2R) USER MOD NoAdj-H: A 7 LYS HZ3 : A 7 LYS NZ : A 5 ILE CG2 :(NH2R) USER MOD Set 1.1: A 15 ASN : amide:sc= -3.57! C(o=-14!,f=-16!) USER MOD Set 1.2: A 107 ASN :FLIP amide:sc= -10.8! C(o=-16!,f=-14!) USER MOD Set 2.1: A 41 GLN :FLIP amide:sc= -6! C(o=-25!,f=-17!) USER MOD Set 2.2: A 47 HIS :FLIP no HD1:sc= 0.00081 F(o=-20!,f=-17) USER MOD Set 2.3: A 51 GLN : amide:sc= -11.1! C(o=-17!,f=-22!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -159:sc= 0 (180deg=-0.357) USER MOD Single : A 3 THR OG1 : rot 83:sc= -0.62! USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 CYS SG : rot -51:sc= -3.81! USER MOD Single : A 14 TYR OH : rot 63:sc= -1.79 USER MOD Single : A 22 SER OG : rot 180:sc= -0.0487 USER MOD Single : A 28 THR OG1 : rot -171:sc= -1.32 USER MOD Single : A 31 TYR OH : rot -27:sc= -9.43! USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.0502 USER MOD Single : A 45 TYR OH : rot -167:sc= 0.862 USER MOD Single : A 46 GLN :FLIP amide:sc= -0.141 F(o=-0.77,f=-0.14) USER MOD Single : A 50 GLN :FLIP amide:sc= -2! C(o=-2.5!,f=-2!) USER MOD Single : A 52 CYS SG : rot -52:sc= 0.168 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.0534 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 9:sc= -0.52 USER MOD Single : A 70 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot -150:sc= 0.00417 USER MOD Single : A 72 LYS NZ :NH3+ -147:sc= -0.117 (180deg=-0.715) USER MOD Single : A 74 SER OG : rot -54:sc= -0.21 USER MOD Single : A 75 LYS NZ :NH3+ 139:sc= -1.05 (180deg=-2.02!) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -4.32! C(o=-4.3!,f=-9.8!) USER MOD Single : A 93 LYS NZ :NH3+ -147:sc= -0.0704 (180deg=-0.712) USER MOD Single : A 94 THR OG1 : rot 111:sc= -1.81! USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 82:sc= -0.0377 USER MOD Single : A 102 LYS NZ :NH3+ 155:sc= -0.663 (180deg=-2.29) USER MOD Single : A 106 GLN : amide:sc= -2.75! C(o=-2.8!,f=-2.6!) USER MOD Single : A 110 LYS NZ :NH3+ -154:sc= -0.31 (180deg=-1.52!) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ -129:sc= 0.414 (180deg=-3.69!) USER MOD Single : A 131 LYS NZ :NH3+ 156:sc= 0 (180deg=-0.55) USER MOD Single : A 136 ASN : amide:sc= -0.12 K(o=-0.12,f=-2!) USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 140 GLN :FLIP amide:sc= 0 F(o=-1.4!,f=0) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -14.846 -16.314 9.687 1.00 0.00 N ATOM 2 CA MET A 1 -14.256 -17.679 9.779 1.00 0.00 C ATOM 3 C MET A 1 -13.247 -17.876 8.645 1.00 0.00 C ATOM 4 O MET A 1 -12.054 -17.940 8.865 1.00 0.00 O ATOM 5 CB MET A 1 -15.367 -18.724 9.662 1.00 0.00 C ATOM 6 CG MET A 1 -16.465 -18.418 10.682 1.00 0.00 C ATOM 7 SD MET A 1 -17.247 -19.964 11.209 1.00 0.00 S ATOM 8 CE MET A 1 -18.406 -19.239 12.394 1.00 0.00 C ATOM 0 H1 MET A 1 -15.239 -16.043 10.611 1.00 0.00 H new ATOM 0 H2 MET A 1 -14.108 -15.635 9.412 1.00 0.00 H new ATOM 0 H3 MET A 1 -15.603 -16.310 8.974 1.00 0.00 H new ATOM 0 HA MET A 1 -13.751 -17.793 10.738 1.00 0.00 H new ATOM 0 HB2 MET A 1 -15.781 -18.719 8.654 1.00 0.00 H new ATOM 0 HB3 MET A 1 -14.963 -19.721 9.835 1.00 0.00 H new ATOM 0 HG2 MET A 1 -16.042 -17.900 11.543 1.00 0.00 H new ATOM 0 HG3 MET A 1 -17.209 -17.753 10.243 1.00 0.00 H new ATOM 0 HE1 MET A 1 -19.003 -20.029 12.849 1.00 0.00 H new ATOM 0 HE2 MET A 1 -17.851 -18.712 13.170 1.00 0.00 H new ATOM 0 HE3 MET A 1 -19.063 -18.539 11.878 1.00 0.00 H new ATOM 20 N ALA A 2 -13.717 -17.973 7.431 1.00 0.00 N ATOM 21 CA ALA A 2 -12.785 -18.166 6.285 1.00 0.00 C ATOM 22 C ALA A 2 -11.999 -16.876 6.044 1.00 0.00 C ATOM 23 O ALA A 2 -12.533 -15.788 6.131 1.00 0.00 O ATOM 24 CB ALA A 2 -13.586 -18.518 5.029 1.00 0.00 C ATOM 0 H ALA A 2 -14.706 -17.927 7.184 1.00 0.00 H new ATOM 0 HA ALA A 2 -12.092 -18.976 6.513 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -12.904 -18.659 4.190 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -14.146 -19.437 5.200 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -14.279 -17.708 4.801 1.00 0.00 H new ATOM 30 N THR A 3 -10.735 -16.988 5.740 1.00 0.00 N ATOM 31 CA THR A 3 -9.917 -15.767 5.494 1.00 0.00 C ATOM 32 C THR A 3 -9.912 -14.893 6.751 1.00 0.00 C ATOM 33 O THR A 3 -10.922 -14.724 7.404 1.00 0.00 O ATOM 34 CB THR A 3 -10.515 -14.978 4.327 1.00 0.00 C ATOM 35 OG1 THR A 3 -11.641 -15.674 3.813 1.00 0.00 O ATOM 36 CG2 THR A 3 -9.466 -14.818 3.226 1.00 0.00 C ATOM 0 H THR A 3 -10.234 -17.872 5.651 1.00 0.00 H new ATOM 0 HA THR A 3 -8.895 -16.058 5.250 1.00 0.00 H new ATOM 0 HB THR A 3 -10.825 -13.993 4.676 1.00 0.00 H new ATOM 0 HG1 THR A 3 -12.429 -15.470 4.359 1.00 0.00 H new ATOM 0 HG21 THR A 3 -9.893 -14.256 2.395 1.00 0.00 H new ATOM 0 HG22 THR A 3 -8.603 -14.282 3.621 1.00 0.00 H new ATOM 0 HG23 THR A 3 -9.153 -15.802 2.876 1.00 0.00 H new ATOM 44 N LYS A 4 -8.784 -14.336 7.092 1.00 0.00 N ATOM 45 CA LYS A 4 -8.716 -13.471 8.303 1.00 0.00 C ATOM 46 C LYS A 4 -7.808 -12.274 8.020 1.00 0.00 C ATOM 47 O LYS A 4 -6.634 -12.425 7.745 1.00 0.00 O ATOM 48 CB LYS A 4 -8.147 -14.278 9.474 1.00 0.00 C ATOM 49 CG LYS A 4 -8.685 -13.715 10.791 1.00 0.00 C ATOM 50 CD LYS A 4 -7.684 -13.997 11.913 1.00 0.00 C ATOM 51 CE LYS A 4 -7.539 -15.508 12.100 1.00 0.00 C ATOM 52 NZ LYS A 4 -7.466 -15.823 13.554 1.00 0.00 N ATOM 0 H LYS A 4 -7.906 -14.442 6.584 1.00 0.00 H new ATOM 0 HA LYS A 4 -9.716 -13.118 8.557 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -8.424 -15.328 9.375 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -7.058 -14.233 9.465 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -8.852 -12.642 10.699 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -9.648 -14.168 11.026 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -6.717 -13.555 11.672 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -8.022 -13.536 12.841 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -8.385 -16.024 11.647 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -6.641 -15.863 11.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -7.367 -16.850 13.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -6.645 -15.341 13.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -8.335 -15.497 14.024 1.00 0.00 H new ATOM 66 N ILE A 5 -8.343 -11.084 8.082 1.00 0.00 N ATOM 67 CA ILE A 5 -7.516 -9.875 7.813 1.00 0.00 C ATOM 68 C ILE A 5 -7.253 -9.127 9.128 1.00 0.00 C ATOM 69 O ILE A 5 -8.071 -9.126 10.027 1.00 0.00 O ATOM 70 CB ILE A 5 -8.257 -8.976 6.823 1.00 0.00 C ATOM 71 CG1 ILE A 5 -7.422 -7.730 6.540 1.00 0.00 C ATOM 72 CG2 ILE A 5 -9.617 -8.569 7.396 1.00 0.00 C ATOM 73 CD1 ILE A 5 -7.956 -7.045 5.287 1.00 0.00 C ATOM 0 H ILE A 5 -9.320 -10.898 8.308 1.00 0.00 H new ATOM 0 HA ILE A 5 -6.557 -10.166 7.383 1.00 0.00 H new ATOM 0 HB ILE A 5 -8.416 -9.524 5.895 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -7.465 -7.048 7.389 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -6.375 -8.002 6.403 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -10.136 -7.929 6.682 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -10.214 -9.461 7.584 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -9.471 -8.027 8.330 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -7.364 -6.154 5.079 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -7.890 -7.730 4.442 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -8.997 -6.761 5.443 1.00 0.00 H new ATOM 85 N ASP A 6 -6.106 -8.512 9.258 1.00 0.00 N ATOM 86 CA ASP A 6 -5.780 -7.790 10.525 1.00 0.00 C ATOM 87 C ASP A 6 -6.538 -6.460 10.605 1.00 0.00 C ATOM 88 O ASP A 6 -7.191 -6.174 11.588 1.00 0.00 O ATOM 89 CB ASP A 6 -4.275 -7.516 10.575 1.00 0.00 C ATOM 90 CG ASP A 6 -3.910 -6.479 9.512 1.00 0.00 C ATOM 91 OD1 ASP A 6 -3.977 -5.298 9.816 1.00 0.00 O ATOM 92 OD2 ASP A 6 -3.568 -6.881 8.412 1.00 0.00 O ATOM 0 H ASP A 6 -5.381 -8.478 8.542 1.00 0.00 H new ATOM 0 HA ASP A 6 -6.079 -8.413 11.368 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -3.993 -7.154 11.564 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -3.721 -8.439 10.404 1.00 0.00 H new ATOM 97 N LYS A 7 -6.448 -5.643 9.588 1.00 0.00 N ATOM 98 CA LYS A 7 -7.155 -4.323 9.607 1.00 0.00 C ATOM 99 C LYS A 7 -6.578 -3.441 10.720 1.00 0.00 C ATOM 100 O LYS A 7 -6.356 -2.261 10.533 1.00 0.00 O ATOM 101 CB LYS A 7 -8.655 -4.526 9.857 1.00 0.00 C ATOM 102 CG LYS A 7 -9.178 -5.665 8.982 1.00 0.00 C ATOM 103 CD LYS A 7 -10.683 -5.826 9.199 1.00 0.00 C ATOM 104 CE LYS A 7 -10.980 -7.245 9.690 1.00 0.00 C ATOM 105 NZ LYS A 7 -10.623 -8.223 8.623 1.00 0.00 N ATOM 0 H LYS A 7 -5.913 -5.832 8.740 1.00 0.00 H new ATOM 0 HA LYS A 7 -7.013 -3.840 8.641 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -8.830 -4.754 10.909 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -9.197 -3.607 9.635 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -8.972 -5.456 7.932 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -8.663 -6.593 9.229 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -11.036 -5.096 9.928 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -11.218 -5.632 8.269 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -10.411 -7.455 10.596 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -12.035 -7.339 9.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -10.824 -9.188 8.955 1.00 0.00 H new ATOM 119 N GLU A 8 -6.342 -3.998 11.875 1.00 0.00 N ATOM 120 CA GLU A 8 -5.788 -3.187 12.998 1.00 0.00 C ATOM 121 C GLU A 8 -4.622 -2.333 12.496 1.00 0.00 C ATOM 122 O GLU A 8 -4.461 -1.196 12.891 1.00 0.00 O ATOM 123 CB GLU A 8 -5.294 -4.122 14.104 1.00 0.00 C ATOM 124 CG GLU A 8 -5.923 -3.712 15.437 1.00 0.00 C ATOM 125 CD GLU A 8 -5.502 -2.282 15.782 1.00 0.00 C ATOM 126 OE1 GLU A 8 -4.350 -1.953 15.554 1.00 0.00 O ATOM 127 OE2 GLU A 8 -6.340 -1.541 16.269 1.00 0.00 O ATOM 0 H GLU A 8 -6.509 -4.981 12.091 1.00 0.00 H new ATOM 0 HA GLU A 8 -6.568 -2.535 13.390 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -5.557 -5.153 13.868 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -4.207 -4.078 14.174 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -7.009 -3.777 15.374 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -5.608 -4.395 16.225 1.00 0.00 H new ATOM 134 N ALA A 9 -3.807 -2.869 11.630 1.00 0.00 N ATOM 135 CA ALA A 9 -2.654 -2.081 11.110 1.00 0.00 C ATOM 136 C ALA A 9 -3.157 -1.044 10.103 1.00 0.00 C ATOM 137 O ALA A 9 -2.984 0.145 10.282 1.00 0.00 O ATOM 138 CB ALA A 9 -1.663 -3.022 10.422 1.00 0.00 C ATOM 0 H ALA A 9 -3.889 -3.816 11.261 1.00 0.00 H new ATOM 0 HA ALA A 9 -2.158 -1.573 11.937 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -0.819 -2.447 10.041 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -1.305 -3.760 11.139 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -2.158 -3.530 9.595 1.00 0.00 H new ATOM 144 N CYS A 10 -3.777 -1.488 9.046 1.00 0.00 N ATOM 145 CA CYS A 10 -4.291 -0.538 8.022 1.00 0.00 C ATOM 146 C CYS A 10 -5.002 0.636 8.701 1.00 0.00 C ATOM 147 O CYS A 10 -4.530 1.753 8.677 1.00 0.00 O ATOM 148 CB CYS A 10 -5.285 -1.271 7.120 1.00 0.00 C ATOM 149 SG CYS A 10 -4.985 -0.826 5.396 1.00 0.00 S ATOM 0 H CYS A 10 -3.950 -2.473 8.847 1.00 0.00 H new ATOM 0 HA CYS A 10 -3.456 -0.157 7.434 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -5.183 -2.348 7.251 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -6.306 -1.011 7.400 1.00 0.00 H new ATOM 0 HG CYS A 10 -4.956 0.469 5.281 1.00 0.00 H new ATOM 155 N ARG A 11 -6.139 0.395 9.293 1.00 0.00 N ATOM 156 CA ARG A 11 -6.887 1.502 9.956 1.00 0.00 C ATOM 157 C ARG A 11 -5.932 2.353 10.797 1.00 0.00 C ATOM 158 O ARG A 11 -5.842 3.553 10.628 1.00 0.00 O ATOM 159 CB ARG A 11 -7.970 0.911 10.861 1.00 0.00 C ATOM 160 CG ARG A 11 -8.665 2.037 11.628 1.00 0.00 C ATOM 161 CD ARG A 11 -8.221 2.007 13.092 1.00 0.00 C ATOM 162 NE ARG A 11 -8.914 3.091 13.842 1.00 0.00 N ATOM 163 CZ ARG A 11 -8.925 3.078 15.147 1.00 0.00 C ATOM 164 NH1 ARG A 11 -8.328 2.114 15.795 1.00 0.00 N ATOM 165 NH2 ARG A 11 -9.533 4.027 15.805 1.00 0.00 N ATOM 0 H ARG A 11 -6.584 -0.521 9.347 1.00 0.00 H new ATOM 0 HA ARG A 11 -7.345 2.130 9.192 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -8.697 0.361 10.264 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -7.528 0.200 11.559 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -8.419 3.001 11.182 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -9.747 1.922 11.563 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -8.453 1.038 13.534 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -7.141 2.137 13.159 1.00 0.00 H new ATOM 0 HE ARG A 11 -9.380 3.844 13.336 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -7.853 1.372 15.281 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -8.336 2.103 16.815 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -10.000 4.780 15.299 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -9.541 4.016 16.825 1.00 0.00 H new ATOM 179 N ALA A 12 -5.230 1.746 11.711 1.00 0.00 N ATOM 180 CA ALA A 12 -4.292 2.520 12.574 1.00 0.00 C ATOM 181 C ALA A 12 -3.329 3.339 11.709 1.00 0.00 C ATOM 182 O ALA A 12 -3.060 4.489 11.990 1.00 0.00 O ATOM 183 CB ALA A 12 -3.492 1.554 13.448 1.00 0.00 C ATOM 0 H ALA A 12 -5.264 0.744 11.899 1.00 0.00 H new ATOM 0 HA ALA A 12 -4.868 3.199 13.203 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -2.806 2.118 14.080 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -4.174 0.981 14.075 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -2.925 0.874 12.813 1.00 0.00 H new ATOM 189 N ALA A 13 -2.794 2.758 10.670 1.00 0.00 N ATOM 190 CA ALA A 13 -1.835 3.513 9.811 1.00 0.00 C ATOM 191 C ALA A 13 -2.590 4.468 8.881 1.00 0.00 C ATOM 192 O ALA A 13 -2.221 5.614 8.724 1.00 0.00 O ATOM 193 CB ALA A 13 -1.023 2.526 8.971 1.00 0.00 C ATOM 0 H ALA A 13 -2.978 1.798 10.379 1.00 0.00 H new ATOM 0 HA ALA A 13 -1.170 4.094 10.450 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -0.321 3.074 8.342 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -0.472 1.855 9.630 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -1.696 1.944 8.341 1.00 0.00 H new ATOM 199 N TYR A 14 -3.634 4.002 8.257 1.00 0.00 N ATOM 200 CA TYR A 14 -4.403 4.876 7.325 1.00 0.00 C ATOM 201 C TYR A 14 -4.641 6.247 7.960 1.00 0.00 C ATOM 202 O TYR A 14 -4.308 7.268 7.392 1.00 0.00 O ATOM 203 CB TYR A 14 -5.748 4.217 7.011 1.00 0.00 C ATOM 204 CG TYR A 14 -5.603 3.306 5.814 1.00 0.00 C ATOM 205 CD1 TYR A 14 -4.397 2.627 5.582 1.00 0.00 C ATOM 206 CD2 TYR A 14 -6.677 3.141 4.931 1.00 0.00 C ATOM 207 CE1 TYR A 14 -4.271 1.787 4.472 1.00 0.00 C ATOM 208 CE2 TYR A 14 -6.550 2.298 3.821 1.00 0.00 C ATOM 209 CZ TYR A 14 -5.346 1.621 3.592 1.00 0.00 C ATOM 210 OH TYR A 14 -5.220 0.788 2.501 1.00 0.00 O ATOM 0 H TYR A 14 -3.990 3.051 8.351 1.00 0.00 H new ATOM 0 HA TYR A 14 -3.832 5.008 6.406 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -6.095 3.648 7.873 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -6.500 4.980 6.810 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -3.567 2.753 6.261 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -7.605 3.665 5.107 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -3.342 1.265 4.293 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -7.380 2.170 3.142 1.00 0.00 H new ATOM 0 HH TYR A 14 -5.067 -0.130 2.807 1.00 0.00 H new ATOM 220 N ASN A 15 -5.222 6.285 9.125 1.00 0.00 N ATOM 221 CA ASN A 15 -5.485 7.598 9.780 1.00 0.00 C ATOM 222 C ASN A 15 -4.165 8.214 10.257 1.00 0.00 C ATOM 223 O ASN A 15 -4.067 9.408 10.460 1.00 0.00 O ATOM 224 CB ASN A 15 -6.416 7.391 10.975 1.00 0.00 C ATOM 225 CG ASN A 15 -7.729 8.138 10.732 1.00 0.00 C ATOM 226 OD1 ASN A 15 -8.235 8.804 11.613 1.00 0.00 O ATOM 227 ND2 ASN A 15 -8.307 8.053 9.564 1.00 0.00 N ATOM 0 H ASN A 15 -5.526 5.467 9.652 1.00 0.00 H new ATOM 0 HA ASN A 15 -5.955 8.272 9.064 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -6.611 6.328 11.118 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -5.942 7.754 11.887 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -9.183 8.546 9.392 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -7.882 7.494 8.824 1.00 0.00 H new ATOM 234 N LEU A 16 -3.153 7.412 10.440 1.00 0.00 N ATOM 235 CA LEU A 16 -1.847 7.962 10.908 1.00 0.00 C ATOM 236 C LEU A 16 -1.179 8.749 9.778 1.00 0.00 C ATOM 237 O LEU A 16 -0.611 9.801 9.996 1.00 0.00 O ATOM 238 CB LEU A 16 -0.928 6.818 11.339 1.00 0.00 C ATOM 239 CG LEU A 16 0.268 7.386 12.106 1.00 0.00 C ATOM 240 CD1 LEU A 16 -0.207 7.997 13.428 1.00 0.00 C ATOM 241 CD2 LEU A 16 1.268 6.265 12.394 1.00 0.00 C ATOM 0 H LEU A 16 -3.172 6.404 10.287 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.025 8.624 11.755 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -1.475 6.114 11.966 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.584 6.265 10.465 1.00 0.00 H new ATOM 0 HG LEU A 16 0.747 8.158 11.504 1.00 0.00 H new ATOM 0 HD11 LEU A 16 0.648 8.400 13.971 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -0.918 8.798 13.224 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -0.690 7.228 14.031 1.00 0.00 H new ATOM 0 HD21 LEU A 16 2.120 6.669 12.940 1.00 0.00 H new ATOM 0 HD22 LEU A 16 0.786 5.493 12.993 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.611 5.833 11.454 1.00 0.00 H new ATOM 253 N VAL A 17 -1.234 8.250 8.572 1.00 0.00 N ATOM 254 CA VAL A 17 -0.592 8.980 7.441 1.00 0.00 C ATOM 255 C VAL A 17 -1.382 10.256 7.144 1.00 0.00 C ATOM 256 O VAL A 17 -0.949 11.105 6.391 1.00 0.00 O ATOM 257 CB VAL A 17 -0.569 8.091 6.194 1.00 0.00 C ATOM 258 CG1 VAL A 17 -0.436 6.623 6.605 1.00 0.00 C ATOM 259 CG2 VAL A 17 -1.867 8.281 5.407 1.00 0.00 C ATOM 0 H VAL A 17 -1.693 7.374 8.322 1.00 0.00 H new ATOM 0 HA VAL A 17 0.431 9.239 7.715 1.00 0.00 H new ATOM 0 HB VAL A 17 0.281 8.370 5.572 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -0.420 5.996 5.714 1.00 0.00 H new ATOM 0 HG12 VAL A 17 0.490 6.484 7.163 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -1.283 6.342 7.231 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -1.850 7.648 4.520 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -2.716 8.006 6.033 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -1.961 9.325 5.107 1.00 0.00 H new ATOM 269 N ARG A 18 -2.538 10.399 7.732 1.00 0.00 N ATOM 270 CA ARG A 18 -3.354 11.620 7.485 1.00 0.00 C ATOM 271 C ARG A 18 -2.770 12.788 8.281 1.00 0.00 C ATOM 272 O ARG A 18 -2.935 13.939 7.927 1.00 0.00 O ATOM 273 CB ARG A 18 -4.796 11.369 7.931 1.00 0.00 C ATOM 274 CG ARG A 18 -5.661 12.578 7.569 1.00 0.00 C ATOM 275 CD ARG A 18 -6.379 13.086 8.821 1.00 0.00 C ATOM 276 NE ARG A 18 -7.272 12.018 9.350 1.00 0.00 N ATOM 277 CZ ARG A 18 -7.753 12.109 10.559 1.00 0.00 C ATOM 278 NH1 ARG A 18 -7.453 13.137 11.305 1.00 0.00 N ATOM 279 NH2 ARG A 18 -8.534 11.172 11.024 1.00 0.00 N ATOM 0 H ARG A 18 -2.952 9.722 8.373 1.00 0.00 H new ATOM 0 HA ARG A 18 -3.340 11.859 6.422 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -5.186 10.472 7.449 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -4.830 11.193 9.006 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -5.041 13.369 7.147 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -6.389 12.302 6.806 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -5.651 13.374 9.579 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -6.961 13.976 8.583 1.00 0.00 H new ATOM 0 HE ARG A 18 -7.508 11.215 8.767 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -6.842 13.869 10.943 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -7.829 13.208 12.250 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -8.768 10.368 10.442 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -8.910 11.244 11.970 1.00 0.00 H new ATOM 293 N ASP A 19 -2.090 12.501 9.356 1.00 0.00 N ATOM 294 CA ASP A 19 -1.495 13.593 10.176 1.00 0.00 C ATOM 295 C ASP A 19 -0.414 14.310 9.365 1.00 0.00 C ATOM 296 O ASP A 19 0.754 14.277 9.701 1.00 0.00 O ATOM 297 CB ASP A 19 -0.873 13.000 11.442 1.00 0.00 C ATOM 298 CG ASP A 19 -0.651 14.109 12.471 1.00 0.00 C ATOM 299 OD1 ASP A 19 0.084 15.034 12.167 1.00 0.00 O ATOM 300 OD2 ASP A 19 -1.220 14.015 13.546 1.00 0.00 O ATOM 0 H ASP A 19 -1.920 11.557 9.702 1.00 0.00 H new ATOM 0 HA ASP A 19 -2.273 14.304 10.452 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -1.527 12.232 11.855 1.00 0.00 H new ATOM 0 HB3 ASP A 19 0.074 12.517 11.202 1.00 0.00 H new ATOM 305 N ASP A 20 -0.792 14.961 8.299 1.00 0.00 N ATOM 306 CA ASP A 20 0.212 15.681 7.467 1.00 0.00 C ATOM 307 C ASP A 20 1.356 14.731 7.103 1.00 0.00 C ATOM 308 O ASP A 20 2.465 15.152 6.843 1.00 0.00 O ATOM 309 CB ASP A 20 0.769 16.868 8.255 1.00 0.00 C ATOM 310 CG ASP A 20 -0.386 17.699 8.814 1.00 0.00 C ATOM 311 OD1 ASP A 20 -1.308 17.974 8.063 1.00 0.00 O ATOM 312 OD2 ASP A 20 -0.332 18.046 9.983 1.00 0.00 O ATOM 0 H ASP A 20 -1.755 15.025 7.968 1.00 0.00 H new ATOM 0 HA ASP A 20 -0.265 16.039 6.555 1.00 0.00 H new ATOM 0 HB2 ASP A 20 1.402 16.513 9.068 1.00 0.00 H new ATOM 0 HB3 ASP A 20 1.395 17.484 7.610 1.00 0.00 H new ATOM 317 N GLY A 21 1.096 13.452 7.079 1.00 0.00 N ATOM 318 CA GLY A 21 2.171 12.480 6.730 1.00 0.00 C ATOM 319 C GLY A 21 3.240 12.483 7.824 1.00 0.00 C ATOM 320 O GLY A 21 4.410 12.670 7.562 1.00 0.00 O ATOM 0 H GLY A 21 0.187 13.039 7.286 1.00 0.00 H new ATOM 0 HA2 GLY A 21 1.750 11.480 6.621 1.00 0.00 H new ATOM 0 HA3 GLY A 21 2.617 12.744 5.771 1.00 0.00 H new ATOM 324 N SER A 22 2.844 12.282 9.051 1.00 0.00 N ATOM 325 CA SER A 22 3.836 12.277 10.163 1.00 0.00 C ATOM 326 C SER A 22 4.321 10.848 10.414 1.00 0.00 C ATOM 327 O SER A 22 5.066 10.590 11.338 1.00 0.00 O ATOM 328 CB SER A 22 3.179 12.818 11.432 1.00 0.00 C ATOM 329 OG SER A 22 2.960 11.747 12.341 1.00 0.00 O ATOM 0 H SER A 22 1.877 12.121 9.331 1.00 0.00 H new ATOM 0 HA SER A 22 4.684 12.905 9.892 1.00 0.00 H new ATOM 0 HB2 SER A 22 3.815 13.575 11.890 1.00 0.00 H new ATOM 0 HB3 SER A 22 2.233 13.302 11.188 1.00 0.00 H new ATOM 0 HG SER A 22 2.540 12.091 13.157 1.00 0.00 H new ATOM 335 N ALA A 23 3.901 9.914 9.604 1.00 0.00 N ATOM 336 CA ALA A 23 4.340 8.505 9.810 1.00 0.00 C ATOM 337 C ALA A 23 4.609 7.838 8.459 1.00 0.00 C ATOM 338 O ALA A 23 5.227 8.409 7.583 1.00 0.00 O ATOM 339 CB ALA A 23 3.244 7.735 10.548 1.00 0.00 C ATOM 0 H ALA A 23 3.276 10.065 8.812 1.00 0.00 H new ATOM 0 HA ALA A 23 5.256 8.498 10.400 1.00 0.00 H new ATOM 0 HB1 ALA A 23 3.563 6.704 10.700 1.00 0.00 H new ATOM 0 HB2 ALA A 23 3.058 8.203 11.515 1.00 0.00 H new ATOM 0 HB3 ALA A 23 2.329 7.748 9.956 1.00 0.00 H new ATOM 345 N VAL A 24 4.153 6.627 8.291 1.00 0.00 N ATOM 346 CA VAL A 24 4.383 5.908 7.006 1.00 0.00 C ATOM 347 C VAL A 24 3.550 6.549 5.894 1.00 0.00 C ATOM 348 O VAL A 24 2.358 6.740 6.031 1.00 0.00 O ATOM 349 CB VAL A 24 3.973 4.443 7.172 1.00 0.00 C ATOM 350 CG1 VAL A 24 2.749 4.353 8.086 1.00 0.00 C ATOM 351 CG2 VAL A 24 3.627 3.851 5.804 1.00 0.00 C ATOM 0 H VAL A 24 3.629 6.103 8.991 1.00 0.00 H new ATOM 0 HA VAL A 24 5.438 5.969 6.740 1.00 0.00 H new ATOM 0 HB VAL A 24 4.799 3.885 7.614 1.00 0.00 H new ATOM 0 HG11 VAL A 24 2.458 3.309 8.203 1.00 0.00 H new ATOM 0 HG12 VAL A 24 2.992 4.774 9.062 1.00 0.00 H new ATOM 0 HG13 VAL A 24 1.924 4.912 7.645 1.00 0.00 H new ATOM 0 HG21 VAL A 24 3.335 2.808 5.922 1.00 0.00 H new ATOM 0 HG22 VAL A 24 2.802 4.411 5.363 1.00 0.00 H new ATOM 0 HG23 VAL A 24 4.497 3.912 5.150 1.00 0.00 H new ATOM 361 N ILE A 25 4.165 6.882 4.789 1.00 0.00 N ATOM 362 CA ILE A 25 3.398 7.508 3.676 1.00 0.00 C ATOM 363 C ILE A 25 2.324 6.514 3.194 1.00 0.00 C ATOM 364 O ILE A 25 1.229 6.896 2.833 1.00 0.00 O ATOM 365 CB ILE A 25 4.371 7.901 2.549 1.00 0.00 C ATOM 366 CG1 ILE A 25 3.604 8.546 1.394 1.00 0.00 C ATOM 367 CG2 ILE A 25 5.139 6.672 2.050 1.00 0.00 C ATOM 368 CD1 ILE A 25 4.590 8.994 0.309 1.00 0.00 C ATOM 0 H ILE A 25 5.160 6.748 4.611 1.00 0.00 H new ATOM 0 HA ILE A 25 2.894 8.415 4.009 1.00 0.00 H new ATOM 0 HB ILE A 25 5.088 8.621 2.944 1.00 0.00 H new ATOM 0 HG12 ILE A 25 2.888 7.837 0.979 1.00 0.00 H new ATOM 0 HG13 ILE A 25 3.033 9.401 1.756 1.00 0.00 H new ATOM 0 HG21 ILE A 25 5.822 6.968 1.254 1.00 0.00 H new ATOM 0 HG22 ILE A 25 5.707 6.239 2.873 1.00 0.00 H new ATOM 0 HG23 ILE A 25 4.435 5.933 1.668 1.00 0.00 H new ATOM 0 HD11 ILE A 25 4.042 9.453 -0.514 1.00 0.00 H new ATOM 0 HD12 ILE A 25 5.289 9.718 0.729 1.00 0.00 H new ATOM 0 HD13 ILE A 25 5.142 8.130 -0.061 1.00 0.00 H new ATOM 380 N TRP A 26 2.622 5.238 3.229 1.00 0.00 N ATOM 381 CA TRP A 26 1.622 4.203 2.825 1.00 0.00 C ATOM 382 C TRP A 26 2.028 2.850 3.409 1.00 0.00 C ATOM 383 O TRP A 26 3.194 2.587 3.623 1.00 0.00 O ATOM 384 CB TRP A 26 1.545 4.086 1.304 1.00 0.00 C ATOM 385 CG TRP A 26 2.914 3.916 0.717 1.00 0.00 C ATOM 386 CD1 TRP A 26 3.607 4.882 0.068 1.00 0.00 C ATOM 387 CD2 TRP A 26 3.762 2.729 0.697 1.00 0.00 C ATOM 388 NE1 TRP A 26 4.827 4.374 -0.329 1.00 0.00 N ATOM 389 CE2 TRP A 26 4.969 3.052 0.030 1.00 0.00 C ATOM 390 CE3 TRP A 26 3.610 1.420 1.190 1.00 0.00 C ATOM 391 CZ2 TRP A 26 5.984 2.114 -0.138 1.00 0.00 C ATOM 392 CZ3 TRP A 26 4.630 0.475 1.017 1.00 0.00 C ATOM 393 CH2 TRP A 26 5.814 0.821 0.356 1.00 0.00 C ATOM 0 H TRP A 26 3.525 4.867 3.523 1.00 0.00 H new ATOM 0 HA TRP A 26 0.645 4.501 3.205 1.00 0.00 H new ATOM 0 HB2 TRP A 26 0.918 3.237 1.031 1.00 0.00 H new ATOM 0 HB3 TRP A 26 1.074 4.977 0.889 1.00 0.00 H new ATOM 0 HD1 TRP A 26 3.260 5.889 -0.110 1.00 0.00 H new ATOM 0 HE1 TRP A 26 5.536 4.912 -0.827 1.00 0.00 H new ATOM 0 HE3 TRP A 26 2.702 1.142 1.705 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 6.897 2.386 -0.647 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 4.502 -0.528 1.397 1.00 0.00 H new ATOM 0 HH2 TRP A 26 6.596 0.087 0.229 1.00 0.00 H new ATOM 404 N VAL A 27 1.078 1.988 3.658 1.00 0.00 N ATOM 405 CA VAL A 27 1.411 0.646 4.219 1.00 0.00 C ATOM 406 C VAL A 27 0.952 -0.439 3.244 1.00 0.00 C ATOM 407 O VAL A 27 -0.093 -0.331 2.633 1.00 0.00 O ATOM 408 CB VAL A 27 0.700 0.459 5.561 1.00 0.00 C ATOM 409 CG1 VAL A 27 1.246 1.465 6.574 1.00 0.00 C ATOM 410 CG2 VAL A 27 -0.802 0.684 5.378 1.00 0.00 C ATOM 0 H VAL A 27 0.085 2.156 3.497 1.00 0.00 H new ATOM 0 HA VAL A 27 2.488 0.572 4.368 1.00 0.00 H new ATOM 0 HB VAL A 27 0.875 -0.553 5.925 1.00 0.00 H new ATOM 0 HG11 VAL A 27 0.739 1.331 7.529 1.00 0.00 H new ATOM 0 HG12 VAL A 27 2.316 1.305 6.705 1.00 0.00 H new ATOM 0 HG13 VAL A 27 1.073 2.478 6.210 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.309 0.551 6.334 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -0.976 1.696 5.013 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -1.192 -0.034 4.657 1.00 0.00 H new ATOM 420 N THR A 28 1.719 -1.485 3.097 1.00 0.00 N ATOM 421 CA THR A 28 1.321 -2.579 2.164 1.00 0.00 C ATOM 422 C THR A 28 1.470 -3.928 2.865 1.00 0.00 C ATOM 423 O THR A 28 2.455 -4.190 3.526 1.00 0.00 O ATOM 424 CB THR A 28 2.217 -2.556 0.923 1.00 0.00 C ATOM 425 OG1 THR A 28 3.579 -2.608 1.323 1.00 0.00 O ATOM 426 CG2 THR A 28 1.962 -1.277 0.124 1.00 0.00 C ATOM 0 H THR A 28 2.604 -1.630 3.583 1.00 0.00 H new ATOM 0 HA THR A 28 0.283 -2.432 1.865 1.00 0.00 H new ATOM 0 HB THR A 28 1.990 -3.419 0.297 1.00 0.00 H new ATOM 0 HG1 THR A 28 4.155 -2.451 0.546 1.00 0.00 H new ATOM 0 HG21 THR A 28 2.602 -1.265 -0.758 1.00 0.00 H new ATOM 0 HG22 THR A 28 0.917 -1.243 -0.185 1.00 0.00 H new ATOM 0 HG23 THR A 28 2.185 -0.409 0.745 1.00 0.00 H new ATOM 434 N PHE A 29 0.505 -4.792 2.706 1.00 0.00 N ATOM 435 CA PHE A 29 0.585 -6.132 3.339 1.00 0.00 C ATOM 436 C PHE A 29 0.604 -7.171 2.240 1.00 0.00 C ATOM 437 O PHE A 29 0.282 -6.897 1.101 1.00 0.00 O ATOM 438 CB PHE A 29 -0.629 -6.380 4.236 1.00 0.00 C ATOM 439 CG PHE A 29 -1.650 -5.293 4.034 1.00 0.00 C ATOM 440 CD1 PHE A 29 -1.432 -4.021 4.573 1.00 0.00 C ATOM 441 CD2 PHE A 29 -2.819 -5.561 3.315 1.00 0.00 C ATOM 442 CE1 PHE A 29 -2.386 -3.014 4.391 1.00 0.00 C ATOM 443 CE2 PHE A 29 -3.772 -4.556 3.136 1.00 0.00 C ATOM 444 CZ PHE A 29 -3.556 -3.284 3.674 1.00 0.00 C ATOM 0 H PHE A 29 -0.340 -4.623 2.160 1.00 0.00 H new ATOM 0 HA PHE A 29 1.486 -6.190 3.950 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -1.069 -7.350 4.006 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -0.319 -6.410 5.281 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -0.529 -3.816 5.129 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -2.985 -6.544 2.899 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -2.219 -2.030 4.803 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -4.676 -4.762 2.582 1.00 0.00 H new ATOM 0 HZ PHE A 29 -4.294 -2.508 3.536 1.00 0.00 H new ATOM 454 N ARG A 30 0.989 -8.357 2.568 1.00 0.00 N ATOM 455 CA ARG A 30 1.042 -9.416 1.538 1.00 0.00 C ATOM 456 C ARG A 30 0.560 -10.734 2.139 1.00 0.00 C ATOM 457 O ARG A 30 0.731 -10.994 3.313 1.00 0.00 O ATOM 458 CB ARG A 30 2.478 -9.549 1.046 1.00 0.00 C ATOM 459 CG ARG A 30 3.408 -9.779 2.237 1.00 0.00 C ATOM 460 CD ARG A 30 4.820 -9.310 1.884 1.00 0.00 C ATOM 461 NE ARG A 30 5.355 -10.140 0.769 1.00 0.00 N ATOM 462 CZ ARG A 30 6.404 -9.742 0.102 1.00 0.00 C ATOM 463 NH1 ARG A 30 6.985 -8.615 0.413 1.00 0.00 N ATOM 464 NH2 ARG A 30 6.873 -10.469 -0.874 1.00 0.00 N ATOM 0 H ARG A 30 1.271 -8.643 3.506 1.00 0.00 H new ATOM 0 HA ARG A 30 0.396 -9.160 0.698 1.00 0.00 H new ATOM 0 HB2 ARG A 30 2.557 -10.379 0.344 1.00 0.00 H new ATOM 0 HB3 ARG A 30 2.774 -8.648 0.509 1.00 0.00 H new ATOM 0 HG2 ARG A 30 3.041 -9.236 3.108 1.00 0.00 H new ATOM 0 HG3 ARG A 30 3.421 -10.836 2.502 1.00 0.00 H new ATOM 0 HD2 ARG A 30 4.804 -8.259 1.594 1.00 0.00 H new ATOM 0 HD3 ARG A 30 5.470 -9.390 2.755 1.00 0.00 H new ATOM 0 HE ARG A 30 4.901 -11.021 0.526 1.00 0.00 H new ATOM 0 HH11 ARG A 30 6.619 -8.046 1.177 1.00 0.00 H new ATOM 0 HH12 ARG A 30 7.805 -8.303 -0.108 1.00 0.00 H new ATOM 0 HH21 ARG A 30 6.420 -11.350 -1.117 1.00 0.00 H new ATOM 0 HH22 ARG A 30 7.693 -10.157 -1.394 1.00 0.00 H new ATOM 478 N TYR A 31 -0.059 -11.553 1.340 1.00 0.00 N ATOM 479 CA TYR A 31 -0.581 -12.846 1.845 1.00 0.00 C ATOM 480 C TYR A 31 0.409 -13.469 2.821 1.00 0.00 C ATOM 481 O TYR A 31 1.360 -14.116 2.429 1.00 0.00 O ATOM 482 CB TYR A 31 -0.792 -13.796 0.668 1.00 0.00 C ATOM 483 CG TYR A 31 -2.227 -13.719 0.217 1.00 0.00 C ATOM 484 CD1 TYR A 31 -3.258 -14.064 1.097 1.00 0.00 C ATOM 485 CD2 TYR A 31 -2.526 -13.298 -1.083 1.00 0.00 C ATOM 486 CE1 TYR A 31 -4.589 -13.987 0.678 1.00 0.00 C ATOM 487 CE2 TYR A 31 -3.857 -13.222 -1.503 1.00 0.00 C ATOM 488 CZ TYR A 31 -4.890 -13.566 -0.622 1.00 0.00 C ATOM 489 OH TYR A 31 -6.203 -13.489 -1.034 1.00 0.00 O ATOM 0 H TYR A 31 -0.226 -11.379 0.349 1.00 0.00 H new ATOM 0 HA TYR A 31 -1.526 -12.672 2.360 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -0.126 -13.530 -0.153 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -0.545 -14.817 0.961 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -3.026 -14.390 2.100 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -1.729 -13.032 -1.762 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -5.385 -14.252 1.358 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -4.089 -12.898 -2.507 1.00 0.00 H new ATOM 0 HH TYR A 31 -6.744 -14.127 -0.523 1.00 0.00 H new ATOM 499 N ASP A 32 0.181 -13.306 4.092 1.00 0.00 N ATOM 500 CA ASP A 32 1.097 -13.920 5.082 1.00 0.00 C ATOM 501 C ASP A 32 0.480 -15.240 5.529 1.00 0.00 C ATOM 502 O ASP A 32 -0.436 -15.272 6.325 1.00 0.00 O ATOM 503 CB ASP A 32 1.257 -12.988 6.286 1.00 0.00 C ATOM 504 CG ASP A 32 0.427 -11.723 6.066 1.00 0.00 C ATOM 505 OD1 ASP A 32 -0.768 -11.771 6.312 1.00 0.00 O ATOM 506 OD2 ASP A 32 0.999 -10.726 5.657 1.00 0.00 O ATOM 0 H ASP A 32 -0.597 -12.776 4.485 1.00 0.00 H new ATOM 0 HA ASP A 32 2.080 -14.088 4.641 1.00 0.00 H new ATOM 0 HB2 ASP A 32 0.934 -13.494 7.196 1.00 0.00 H new ATOM 0 HB3 ASP A 32 2.307 -12.728 6.421 1.00 0.00 H new ATOM 511 N GLY A 33 0.961 -16.330 5.006 1.00 0.00 N ATOM 512 CA GLY A 33 0.381 -17.647 5.388 1.00 0.00 C ATOM 513 C GLY A 33 -1.138 -17.584 5.210 1.00 0.00 C ATOM 514 O GLY A 33 -1.633 -17.367 4.122 1.00 0.00 O ATOM 0 H GLY A 33 1.727 -16.368 4.334 1.00 0.00 H new ATOM 0 HA2 GLY A 33 0.802 -18.439 4.769 1.00 0.00 H new ATOM 0 HA3 GLY A 33 0.631 -17.884 6.422 1.00 0.00 H new ATOM 518 N ALA A 34 -1.879 -17.788 6.265 1.00 0.00 N ATOM 519 CA ALA A 34 -3.367 -17.757 6.147 1.00 0.00 C ATOM 520 C ALA A 34 -3.919 -16.476 6.782 1.00 0.00 C ATOM 521 O ALA A 34 -5.076 -16.401 7.145 1.00 0.00 O ATOM 522 CB ALA A 34 -3.956 -18.972 6.866 1.00 0.00 C ATOM 0 H ALA A 34 -1.521 -17.974 7.202 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.642 -17.780 5.093 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -5.043 -18.953 6.782 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -3.573 -19.885 6.411 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -3.673 -18.945 7.918 1.00 0.00 H new ATOM 528 N THR A 35 -3.101 -15.467 6.911 1.00 0.00 N ATOM 529 CA THR A 35 -3.583 -14.191 7.515 1.00 0.00 C ATOM 530 C THR A 35 -2.946 -13.001 6.790 1.00 0.00 C ATOM 531 O THR A 35 -1.753 -12.970 6.558 1.00 0.00 O ATOM 532 CB THR A 35 -3.201 -14.149 8.997 1.00 0.00 C ATOM 533 OG1 THR A 35 -3.273 -15.460 9.539 1.00 0.00 O ATOM 534 CG2 THR A 35 -4.168 -13.230 9.746 1.00 0.00 C ATOM 0 H THR A 35 -2.122 -15.470 6.625 1.00 0.00 H new ATOM 0 HA THR A 35 -4.667 -14.135 7.416 1.00 0.00 H new ATOM 0 HB THR A 35 -2.185 -13.768 9.103 1.00 0.00 H new ATOM 0 HG1 THR A 35 -3.027 -15.436 10.487 1.00 0.00 H new ATOM 0 HG21 THR A 35 -3.897 -13.199 10.801 1.00 0.00 H new ATOM 0 HG22 THR A 35 -4.113 -12.225 9.328 1.00 0.00 H new ATOM 0 HG23 THR A 35 -5.184 -13.610 9.643 1.00 0.00 H new ATOM 542 N ILE A 36 -3.732 -12.019 6.434 1.00 0.00 N ATOM 543 CA ILE A 36 -3.173 -10.830 5.730 1.00 0.00 C ATOM 544 C ILE A 36 -2.542 -9.885 6.754 1.00 0.00 C ATOM 545 O ILE A 36 -3.227 -9.272 7.548 1.00 0.00 O ATOM 546 CB ILE A 36 -4.297 -10.100 4.987 1.00 0.00 C ATOM 547 CG1 ILE A 36 -4.449 -10.696 3.585 1.00 0.00 C ATOM 548 CG2 ILE A 36 -3.959 -8.611 4.873 1.00 0.00 C ATOM 549 CD1 ILE A 36 -4.678 -12.205 3.694 1.00 0.00 C ATOM 0 H ILE A 36 -4.738 -11.990 6.601 1.00 0.00 H new ATOM 0 HA ILE A 36 -2.416 -11.153 5.015 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.230 -10.217 5.538 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -5.286 -10.227 3.068 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -3.556 -10.495 2.994 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -4.761 -8.095 4.344 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -3.850 -8.185 5.870 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -3.026 -8.491 4.323 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -4.786 -12.630 2.696 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -3.827 -12.667 4.195 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -5.584 -12.395 4.269 1.00 0.00 H new ATOM 561 N VAL A 37 -1.241 -9.769 6.747 1.00 0.00 N ATOM 562 CA VAL A 37 -0.568 -8.868 7.726 1.00 0.00 C ATOM 563 C VAL A 37 0.509 -8.043 7.011 1.00 0.00 C ATOM 564 O VAL A 37 1.054 -8.462 6.009 1.00 0.00 O ATOM 565 CB VAL A 37 0.068 -9.717 8.834 1.00 0.00 C ATOM 566 CG1 VAL A 37 -0.574 -11.105 8.837 1.00 0.00 C ATOM 567 CG2 VAL A 37 1.576 -9.861 8.596 1.00 0.00 C ATOM 0 H VAL A 37 -0.616 -10.259 6.106 1.00 0.00 H new ATOM 0 HA VAL A 37 -1.298 -8.188 8.165 1.00 0.00 H new ATOM 0 HB VAL A 37 -0.095 -9.226 9.793 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -0.125 -11.712 9.623 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -1.645 -11.010 9.019 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -0.411 -11.583 7.871 1.00 0.00 H new ATOM 0 HG21 VAL A 37 2.014 -10.466 9.390 1.00 0.00 H new ATOM 0 HG22 VAL A 37 1.748 -10.345 7.635 1.00 0.00 H new ATOM 0 HG23 VAL A 37 2.040 -8.875 8.594 1.00 0.00 H new ATOM 577 N PRO A 38 0.820 -6.882 7.528 1.00 0.00 N ATOM 578 CA PRO A 38 1.850 -5.987 6.944 1.00 0.00 C ATOM 579 C PRO A 38 3.002 -6.766 6.305 1.00 0.00 C ATOM 580 O PRO A 38 3.374 -7.829 6.762 1.00 0.00 O ATOM 581 CB PRO A 38 2.338 -5.193 8.154 1.00 0.00 C ATOM 582 CG PRO A 38 1.172 -5.133 9.094 1.00 0.00 C ATOM 583 CD PRO A 38 0.223 -6.286 8.732 1.00 0.00 C ATOM 0 HA PRO A 38 1.454 -5.367 6.140 1.00 0.00 H new ATOM 0 HB2 PRO A 38 3.194 -5.679 8.622 1.00 0.00 H new ATOM 0 HB3 PRO A 38 2.659 -4.193 7.863 1.00 0.00 H new ATOM 0 HG2 PRO A 38 1.508 -5.224 10.127 1.00 0.00 H new ATOM 0 HG3 PRO A 38 0.660 -4.175 9.008 1.00 0.00 H new ATOM 0 HD2 PRO A 38 0.152 -7.012 9.542 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -0.787 -5.924 8.538 1.00 0.00 H new ATOM 591 N GLY A 39 3.570 -6.247 5.251 1.00 0.00 N ATOM 592 CA GLY A 39 4.698 -6.960 4.586 1.00 0.00 C ATOM 593 C GLY A 39 5.729 -5.953 4.082 1.00 0.00 C ATOM 594 O GLY A 39 6.896 -6.261 3.940 1.00 0.00 O ATOM 0 H GLY A 39 3.302 -5.361 4.822 1.00 0.00 H new ATOM 0 HA2 GLY A 39 5.166 -7.651 5.287 1.00 0.00 H new ATOM 0 HA3 GLY A 39 4.322 -7.555 3.754 1.00 0.00 H new ATOM 598 N ASP A 40 5.306 -4.758 3.804 1.00 0.00 N ATOM 599 CA ASP A 40 6.249 -3.729 3.298 1.00 0.00 C ATOM 600 C ASP A 40 5.880 -2.370 3.883 1.00 0.00 C ATOM 601 O ASP A 40 4.969 -2.245 4.679 1.00 0.00 O ATOM 602 CB ASP A 40 6.162 -3.651 1.782 1.00 0.00 C ATOM 603 CG ASP A 40 7.450 -4.197 1.166 1.00 0.00 C ATOM 604 OD1 ASP A 40 8.513 -3.833 1.643 1.00 0.00 O ATOM 605 OD2 ASP A 40 7.354 -4.971 0.227 1.00 0.00 O ATOM 0 H ASP A 40 4.340 -4.446 3.906 1.00 0.00 H new ATOM 0 HA ASP A 40 7.263 -4.000 3.594 1.00 0.00 H new ATOM 0 HB2 ASP A 40 5.306 -4.224 1.427 1.00 0.00 H new ATOM 0 HB3 ASP A 40 6.006 -2.619 1.469 1.00 0.00 H new ATOM 610 N GLN A 41 6.602 -1.355 3.508 1.00 0.00 N ATOM 611 CA GLN A 41 6.316 -0.001 4.059 1.00 0.00 C ATOM 612 C GLN A 41 6.917 1.084 3.167 1.00 0.00 C ATOM 613 O GLN A 41 7.578 0.811 2.187 1.00 0.00 O ATOM 614 CB GLN A 41 6.953 0.098 5.438 1.00 0.00 C ATOM 615 CG GLN A 41 8.296 -0.644 5.424 1.00 0.00 C ATOM 616 CD GLN A 41 9.188 -0.089 4.302 1.00 0.00 C ATOM 617 OE1 GLN A 41 9.150 -0.632 3.108 1.00 0.00 O flip ATOM 618 NE2 GLN A 41 9.928 0.851 4.513 1.00 0.00 N flip ATOM 0 H GLN A 41 7.376 -1.402 2.846 1.00 0.00 H new ATOM 0 HA GLN A 41 5.237 0.143 4.110 1.00 0.00 H new ATOM 0 HB2 GLN A 41 7.103 1.143 5.709 1.00 0.00 H new ATOM 0 HB3 GLN A 41 6.292 -0.334 6.190 1.00 0.00 H new ATOM 0 HG2 GLN A 41 8.794 -0.530 6.387 1.00 0.00 H new ATOM 0 HG3 GLN A 41 8.130 -1.711 5.275 1.00 0.00 H new ATOM 0 HE21 GLN A 41 9.961 1.276 5.440 1.00 0.00 H new ATOM 0 HE22 GLN A 41 10.516 1.215 3.764 1.00 0.00 H new ATOM 627 N GLY A 42 6.696 2.322 3.515 1.00 0.00 N ATOM 628 CA GLY A 42 7.260 3.434 2.706 1.00 0.00 C ATOM 629 C GLY A 42 7.218 4.731 3.509 1.00 0.00 C ATOM 630 O GLY A 42 6.228 5.064 4.130 1.00 0.00 O ATOM 0 H GLY A 42 6.148 2.610 4.326 1.00 0.00 H new ATOM 0 HA2 GLY A 42 8.287 3.205 2.422 1.00 0.00 H new ATOM 0 HA3 GLY A 42 6.692 3.549 1.783 1.00 0.00 H new ATOM 634 N ALA A 43 8.285 5.478 3.472 1.00 0.00 N ATOM 635 CA ALA A 43 8.326 6.776 4.196 1.00 0.00 C ATOM 636 C ALA A 43 8.271 7.878 3.146 1.00 0.00 C ATOM 637 O ALA A 43 8.181 9.052 3.444 1.00 0.00 O ATOM 638 CB ALA A 43 9.626 6.885 4.997 1.00 0.00 C ATOM 0 H ALA A 43 9.138 5.241 2.966 1.00 0.00 H new ATOM 0 HA ALA A 43 7.490 6.859 4.891 1.00 0.00 H new ATOM 0 HB1 ALA A 43 9.649 7.838 5.525 1.00 0.00 H new ATOM 0 HB2 ALA A 43 9.678 6.069 5.718 1.00 0.00 H new ATOM 0 HB3 ALA A 43 10.477 6.825 4.319 1.00 0.00 H new ATOM 644 N ASP A 44 8.315 7.479 1.905 1.00 0.00 N ATOM 645 CA ASP A 44 8.257 8.447 0.784 1.00 0.00 C ATOM 646 C ASP A 44 7.805 7.699 -0.473 1.00 0.00 C ATOM 647 O ASP A 44 7.642 6.496 -0.462 1.00 0.00 O ATOM 648 CB ASP A 44 9.644 9.053 0.552 1.00 0.00 C ATOM 649 CG ASP A 44 9.496 10.493 0.057 1.00 0.00 C ATOM 650 OD1 ASP A 44 8.687 11.212 0.620 1.00 0.00 O ATOM 651 OD2 ASP A 44 10.195 10.851 -0.877 1.00 0.00 O ATOM 0 H ASP A 44 8.390 6.503 1.620 1.00 0.00 H new ATOM 0 HA ASP A 44 7.558 9.250 1.017 1.00 0.00 H new ATOM 0 HB2 ASP A 44 10.221 9.033 1.477 1.00 0.00 H new ATOM 0 HB3 ASP A 44 10.194 8.461 -0.179 1.00 0.00 H new ATOM 656 N TYR A 45 7.603 8.395 -1.551 1.00 0.00 N ATOM 657 CA TYR A 45 7.162 7.721 -2.805 1.00 0.00 C ATOM 658 C TYR A 45 8.348 6.983 -3.434 1.00 0.00 C ATOM 659 O TYR A 45 8.194 6.209 -4.354 1.00 0.00 O ATOM 660 CB TYR A 45 6.648 8.781 -3.777 1.00 0.00 C ATOM 661 CG TYR A 45 5.395 8.296 -4.465 1.00 0.00 C ATOM 662 CD1 TYR A 45 4.273 7.939 -3.711 1.00 0.00 C ATOM 663 CD2 TYR A 45 5.356 8.215 -5.862 1.00 0.00 C ATOM 664 CE1 TYR A 45 3.111 7.497 -4.355 1.00 0.00 C ATOM 665 CE2 TYR A 45 4.194 7.775 -6.504 1.00 0.00 C ATOM 666 CZ TYR A 45 3.072 7.415 -5.752 1.00 0.00 C ATOM 667 OH TYR A 45 1.926 6.981 -6.385 1.00 0.00 O ATOM 0 H TYR A 45 7.724 9.405 -1.622 1.00 0.00 H new ATOM 0 HA TYR A 45 6.371 7.004 -2.583 1.00 0.00 H new ATOM 0 HB2 TYR A 45 6.441 9.707 -3.240 1.00 0.00 H new ATOM 0 HB3 TYR A 45 7.414 9.007 -4.519 1.00 0.00 H new ATOM 0 HD1 TYR A 45 4.303 8.004 -2.633 1.00 0.00 H new ATOM 0 HD2 TYR A 45 6.223 8.492 -6.444 1.00 0.00 H new ATOM 0 HE1 TYR A 45 2.244 7.219 -3.774 1.00 0.00 H new ATOM 0 HE2 TYR A 45 4.164 7.713 -7.582 1.00 0.00 H new ATOM 0 HH TYR A 45 2.125 6.786 -7.324 1.00 0.00 H new ATOM 677 N GLN A 46 9.536 7.226 -2.954 1.00 0.00 N ATOM 678 CA GLN A 46 10.725 6.546 -3.535 1.00 0.00 C ATOM 679 C GLN A 46 10.817 5.108 -3.015 1.00 0.00 C ATOM 680 O GLN A 46 11.287 4.221 -3.701 1.00 0.00 O ATOM 681 CB GLN A 46 11.980 7.320 -3.137 1.00 0.00 C ATOM 682 CG GLN A 46 11.797 8.800 -3.485 1.00 0.00 C ATOM 683 CD GLN A 46 11.404 8.936 -4.957 1.00 0.00 C ATOM 684 OE1 GLN A 46 10.142 9.043 -5.278 1.00 0.00 O flip ATOM 685 NE2 GLN A 46 12.254 8.945 -5.826 1.00 0.00 N flip ATOM 0 H GLN A 46 9.734 7.866 -2.185 1.00 0.00 H new ATOM 0 HA GLN A 46 10.634 6.518 -4.621 1.00 0.00 H new ATOM 0 HB2 GLN A 46 12.167 7.207 -2.069 1.00 0.00 H new ATOM 0 HB3 GLN A 46 12.849 6.918 -3.657 1.00 0.00 H new ATOM 0 HG2 GLN A 46 11.028 9.241 -2.851 1.00 0.00 H new ATOM 0 HG3 GLN A 46 12.721 9.346 -3.293 1.00 0.00 H new ATOM 0 HE21 GLN A 46 13.239 8.862 -5.576 1.00 0.00 H new ATOM 0 HE22 GLN A 46 11.982 9.036 -6.805 1.00 0.00 H new ATOM 694 N HIS A 47 10.378 4.865 -1.810 1.00 0.00 N ATOM 695 CA HIS A 47 10.451 3.479 -1.258 1.00 0.00 C ATOM 696 C HIS A 47 9.531 2.558 -2.063 1.00 0.00 C ATOM 697 O HIS A 47 9.886 1.443 -2.390 1.00 0.00 O ATOM 698 CB HIS A 47 10.008 3.483 0.207 1.00 0.00 C ATOM 699 CG HIS A 47 11.020 2.743 1.038 1.00 0.00 C ATOM 700 ND1 HIS A 47 11.776 1.625 0.782 1.00 0.00 N flip ATOM 701 CD2 HIS A 47 11.357 3.144 2.324 1.00 0.00 C flip ATOM 702 CE1 HIS A 47 12.567 1.339 1.889 1.00 0.00 C flip ATOM 703 NE2 HIS A 47 12.279 2.281 2.789 1.00 0.00 N flip ATOM 0 H HIS A 47 9.973 5.562 -1.185 1.00 0.00 H new ATOM 0 HA HIS A 47 11.478 3.120 -1.325 1.00 0.00 H new ATOM 0 HB2 HIS A 47 9.907 4.508 0.565 1.00 0.00 H new ATOM 0 HB3 HIS A 47 9.029 3.014 0.303 1.00 0.00 H new ATOM 0 HD2 HIS A 47 10.953 3.994 2.854 1.00 0.00 H new ATOM 0 HE1 HIS A 47 13.268 0.525 1.998 1.00 0.00 H new ATOM 0 HE2 HIS A 47 12.705 2.340 3.714 1.00 0.00 H new ATOM 712 N PHE A 48 8.351 3.014 -2.379 1.00 0.00 N ATOM 713 CA PHE A 48 7.406 2.166 -3.159 1.00 0.00 C ATOM 714 C PHE A 48 8.078 1.724 -4.461 1.00 0.00 C ATOM 715 O PHE A 48 7.824 0.651 -4.966 1.00 0.00 O ATOM 716 CB PHE A 48 6.120 2.974 -3.425 1.00 0.00 C ATOM 717 CG PHE A 48 5.928 3.256 -4.900 1.00 0.00 C ATOM 718 CD1 PHE A 48 5.711 2.209 -5.807 1.00 0.00 C ATOM 719 CD2 PHE A 48 5.952 4.579 -5.356 1.00 0.00 C ATOM 720 CE1 PHE A 48 5.527 2.489 -7.166 1.00 0.00 C ATOM 721 CE2 PHE A 48 5.767 4.858 -6.714 1.00 0.00 C ATOM 722 CZ PHE A 48 5.557 3.814 -7.620 1.00 0.00 C ATOM 0 H PHE A 48 7.999 3.939 -2.131 1.00 0.00 H new ATOM 0 HA PHE A 48 7.139 1.268 -2.601 1.00 0.00 H new ATOM 0 HB2 PHE A 48 5.260 2.423 -3.045 1.00 0.00 H new ATOM 0 HB3 PHE A 48 6.163 3.916 -2.877 1.00 0.00 H new ATOM 0 HD1 PHE A 48 5.686 1.187 -5.457 1.00 0.00 H new ATOM 0 HD2 PHE A 48 6.114 5.387 -4.657 1.00 0.00 H new ATOM 0 HE1 PHE A 48 5.362 1.683 -7.865 1.00 0.00 H new ATOM 0 HE2 PHE A 48 5.786 5.880 -7.063 1.00 0.00 H new ATOM 0 HZ PHE A 48 5.418 4.029 -8.669 1.00 0.00 H new ATOM 732 N ILE A 49 8.946 2.528 -4.998 1.00 0.00 N ATOM 733 CA ILE A 49 9.640 2.137 -6.261 1.00 0.00 C ATOM 734 C ILE A 49 10.840 1.237 -5.943 1.00 0.00 C ATOM 735 O ILE A 49 11.393 0.598 -6.815 1.00 0.00 O ATOM 736 CB ILE A 49 10.112 3.403 -6.983 1.00 0.00 C ATOM 737 CG1 ILE A 49 8.945 4.386 -7.041 1.00 0.00 C ATOM 738 CG2 ILE A 49 10.563 3.057 -8.408 1.00 0.00 C ATOM 739 CD1 ILE A 49 9.003 5.202 -8.335 1.00 0.00 C ATOM 0 H ILE A 49 9.208 3.439 -4.621 1.00 0.00 H new ATOM 0 HA ILE A 49 8.951 1.586 -6.901 1.00 0.00 H new ATOM 0 HB ILE A 49 10.953 3.844 -6.448 1.00 0.00 H new ATOM 0 HG12 ILE A 49 8.001 3.844 -6.987 1.00 0.00 H new ATOM 0 HG13 ILE A 49 8.979 5.054 -6.180 1.00 0.00 H new ATOM 0 HG21 ILE A 49 10.897 3.963 -8.914 1.00 0.00 H new ATOM 0 HG22 ILE A 49 11.384 2.341 -8.366 1.00 0.00 H new ATOM 0 HG23 ILE A 49 9.729 2.621 -8.958 1.00 0.00 H new ATOM 0 HD11 ILE A 49 8.165 5.899 -8.364 1.00 0.00 H new ATOM 0 HD12 ILE A 49 9.939 5.759 -8.373 1.00 0.00 H new ATOM 0 HD13 ILE A 49 8.946 4.530 -9.192 1.00 0.00 H new ATOM 751 N GLN A 50 11.253 1.170 -4.706 1.00 0.00 N ATOM 752 CA GLN A 50 12.418 0.304 -4.373 1.00 0.00 C ATOM 753 C GLN A 50 11.940 -1.118 -4.089 1.00 0.00 C ATOM 754 O GLN A 50 12.441 -2.080 -4.636 1.00 0.00 O ATOM 755 CB GLN A 50 13.128 0.859 -3.137 1.00 0.00 C ATOM 756 CG GLN A 50 14.579 0.374 -3.121 1.00 0.00 C ATOM 757 CD GLN A 50 14.607 -1.147 -2.973 1.00 0.00 C ATOM 758 OE1 GLN A 50 15.012 -1.881 -3.975 1.00 0.00 O flip ATOM 759 NE2 GLN A 50 14.259 -1.676 -1.936 1.00 0.00 N flip ATOM 0 H GLN A 50 10.839 1.672 -3.920 1.00 0.00 H new ATOM 0 HA GLN A 50 13.109 0.290 -5.216 1.00 0.00 H new ATOM 0 HB2 GLN A 50 13.098 1.949 -3.146 1.00 0.00 H new ATOM 0 HB3 GLN A 50 12.614 0.533 -2.232 1.00 0.00 H new ATOM 0 HG2 GLN A 50 15.083 0.670 -4.041 1.00 0.00 H new ATOM 0 HG3 GLN A 50 15.120 0.840 -2.298 1.00 0.00 H new ATOM 0 HE21 GLN A 50 13.943 -1.104 -1.153 1.00 0.00 H new ATOM 0 HE22 GLN A 50 14.283 -2.692 -1.849 1.00 0.00 H new ATOM 768 N GLN A 51 10.993 -1.252 -3.210 1.00 0.00 N ATOM 769 CA GLN A 51 10.487 -2.601 -2.842 1.00 0.00 C ATOM 770 C GLN A 51 9.168 -2.904 -3.559 1.00 0.00 C ATOM 771 O GLN A 51 8.178 -3.231 -2.935 1.00 0.00 O ATOM 772 CB GLN A 51 10.254 -2.628 -1.336 1.00 0.00 C ATOM 773 CG GLN A 51 9.520 -1.351 -0.921 1.00 0.00 C ATOM 774 CD GLN A 51 8.305 -1.739 -0.089 1.00 0.00 C ATOM 775 OE1 GLN A 51 8.246 -1.472 1.095 1.00 0.00 O ATOM 776 NE2 GLN A 51 7.324 -2.368 -0.675 1.00 0.00 N ATOM 0 H GLN A 51 10.542 -0.477 -2.724 1.00 0.00 H new ATOM 0 HA GLN A 51 11.219 -3.352 -3.138 1.00 0.00 H new ATOM 0 HB2 GLN A 51 9.668 -3.505 -1.062 1.00 0.00 H new ATOM 0 HB3 GLN A 51 11.205 -2.703 -0.809 1.00 0.00 H new ATOM 0 HG2 GLN A 51 10.182 -0.704 -0.345 1.00 0.00 H new ATOM 0 HG3 GLN A 51 9.211 -0.788 -1.802 1.00 0.00 H new ATOM 0 HE21 GLN A 51 7.381 -2.588 -1.669 1.00 0.00 H new ATOM 0 HE22 GLN A 51 6.500 -2.639 -0.139 1.00 0.00 H new ATOM 785 N CYS A 52 9.142 -2.811 -4.858 1.00 0.00 N ATOM 786 CA CYS A 52 7.878 -3.111 -5.594 1.00 0.00 C ATOM 787 C CYS A 52 8.207 -3.566 -7.016 1.00 0.00 C ATOM 788 O CYS A 52 7.912 -2.885 -7.978 1.00 0.00 O ATOM 789 CB CYS A 52 7.004 -1.859 -5.650 1.00 0.00 C ATOM 790 SG CYS A 52 5.351 -2.304 -6.237 1.00 0.00 S ATOM 0 H CYS A 52 9.934 -2.542 -5.441 1.00 0.00 H new ATOM 0 HA CYS A 52 7.341 -3.904 -5.074 1.00 0.00 H new ATOM 0 HB2 CYS A 52 6.940 -1.402 -4.662 1.00 0.00 H new ATOM 0 HB3 CYS A 52 7.451 -1.120 -6.315 1.00 0.00 H new ATOM 0 HG CYS A 52 5.450 -2.970 -7.349 1.00 0.00 H new ATOM 796 N THR A 53 8.820 -4.707 -7.158 1.00 0.00 N ATOM 797 CA THR A 53 9.172 -5.199 -8.520 1.00 0.00 C ATOM 798 C THR A 53 7.975 -5.926 -9.140 1.00 0.00 C ATOM 799 O THR A 53 7.115 -6.434 -8.449 1.00 0.00 O ATOM 800 CB THR A 53 10.358 -6.163 -8.422 1.00 0.00 C ATOM 801 OG1 THR A 53 10.165 -7.038 -7.320 1.00 0.00 O ATOM 802 CG2 THR A 53 11.650 -5.369 -8.226 1.00 0.00 C ATOM 0 H THR A 53 9.093 -5.321 -6.390 1.00 0.00 H new ATOM 0 HA THR A 53 9.439 -4.350 -9.149 1.00 0.00 H new ATOM 0 HB THR A 53 10.429 -6.745 -9.341 1.00 0.00 H new ATOM 0 HG1 THR A 53 10.922 -7.657 -7.257 1.00 0.00 H new ATOM 0 HG21 THR A 53 12.493 -6.057 -8.156 1.00 0.00 H new ATOM 0 HG22 THR A 53 11.797 -4.699 -9.073 1.00 0.00 H new ATOM 0 HG23 THR A 53 11.582 -4.784 -7.309 1.00 0.00 H new ATOM 810 N ASP A 54 7.917 -5.971 -10.444 1.00 0.00 N ATOM 811 CA ASP A 54 6.780 -6.654 -11.130 1.00 0.00 C ATOM 812 C ASP A 54 6.693 -8.121 -10.693 1.00 0.00 C ATOM 813 O ASP A 54 5.936 -8.891 -11.249 1.00 0.00 O ATOM 814 CB ASP A 54 6.991 -6.589 -12.643 1.00 0.00 C ATOM 815 CG ASP A 54 5.990 -5.610 -13.259 1.00 0.00 C ATOM 816 OD1 ASP A 54 4.829 -5.969 -13.364 1.00 0.00 O ATOM 817 OD2 ASP A 54 6.402 -4.518 -13.613 1.00 0.00 O ATOM 0 H ASP A 54 8.612 -5.562 -11.068 1.00 0.00 H new ATOM 0 HA ASP A 54 5.852 -6.151 -10.860 1.00 0.00 H new ATOM 0 HB2 ASP A 54 8.010 -6.271 -12.865 1.00 0.00 H new ATOM 0 HB3 ASP A 54 6.864 -7.579 -13.081 1.00 0.00 H new ATOM 822 N ASP A 55 7.452 -8.516 -9.704 1.00 0.00 N ATOM 823 CA ASP A 55 7.399 -9.932 -9.242 1.00 0.00 C ATOM 824 C ASP A 55 6.742 -9.991 -7.862 1.00 0.00 C ATOM 825 O ASP A 55 6.998 -10.885 -7.080 1.00 0.00 O ATOM 826 CB ASP A 55 8.820 -10.493 -9.154 1.00 0.00 C ATOM 827 CG ASP A 55 9.332 -10.810 -10.560 1.00 0.00 C ATOM 828 OD1 ASP A 55 9.015 -10.058 -11.468 1.00 0.00 O ATOM 829 OD2 ASP A 55 10.031 -11.799 -10.706 1.00 0.00 O ATOM 0 H ASP A 55 8.105 -7.919 -9.198 1.00 0.00 H new ATOM 0 HA ASP A 55 6.818 -10.524 -9.948 1.00 0.00 H new ATOM 0 HB2 ASP A 55 9.478 -9.771 -8.670 1.00 0.00 H new ATOM 0 HB3 ASP A 55 8.829 -11.394 -8.540 1.00 0.00 H new ATOM 834 N VAL A 56 5.898 -9.043 -7.554 1.00 0.00 N ATOM 835 CA VAL A 56 5.231 -9.049 -6.223 1.00 0.00 C ATOM 836 C VAL A 56 3.823 -8.457 -6.350 1.00 0.00 C ATOM 837 O VAL A 56 3.577 -7.587 -7.160 1.00 0.00 O ATOM 838 CB VAL A 56 6.057 -8.221 -5.233 1.00 0.00 C ATOM 839 CG1 VAL A 56 7.523 -8.218 -5.667 1.00 0.00 C ATOM 840 CG2 VAL A 56 5.537 -6.783 -5.195 1.00 0.00 C ATOM 0 H VAL A 56 5.643 -8.267 -8.165 1.00 0.00 H new ATOM 0 HA VAL A 56 5.156 -10.074 -5.859 1.00 0.00 H new ATOM 0 HB VAL A 56 5.969 -8.662 -4.240 1.00 0.00 H new ATOM 0 HG11 VAL A 56 8.110 -7.629 -4.962 1.00 0.00 H new ATOM 0 HG12 VAL A 56 7.899 -9.241 -5.686 1.00 0.00 H new ATOM 0 HG13 VAL A 56 7.607 -7.782 -6.663 1.00 0.00 H new ATOM 0 HG21 VAL A 56 6.129 -6.201 -4.489 1.00 0.00 H new ATOM 0 HG22 VAL A 56 5.618 -6.341 -6.188 1.00 0.00 H new ATOM 0 HG23 VAL A 56 4.493 -6.782 -4.881 1.00 0.00 H new ATOM 850 N ARG A 57 2.900 -8.926 -5.551 1.00 0.00 N ATOM 851 CA ARG A 57 1.506 -8.392 -5.623 1.00 0.00 C ATOM 852 C ARG A 57 1.007 -8.019 -4.226 1.00 0.00 C ATOM 853 O ARG A 57 1.159 -8.762 -3.277 1.00 0.00 O ATOM 854 CB ARG A 57 0.557 -9.419 -6.258 1.00 0.00 C ATOM 855 CG ARG A 57 0.859 -10.843 -5.770 1.00 0.00 C ATOM 856 CD ARG A 57 0.443 -11.831 -6.859 1.00 0.00 C ATOM 857 NE ARG A 57 1.201 -11.525 -8.107 1.00 0.00 N ATOM 858 CZ ARG A 57 1.172 -12.356 -9.112 1.00 0.00 C ATOM 859 NH1 ARG A 57 0.472 -13.454 -9.031 1.00 0.00 N ATOM 860 NH2 ARG A 57 1.845 -12.090 -10.198 1.00 0.00 N ATOM 0 H ARG A 57 3.050 -9.654 -4.853 1.00 0.00 H new ATOM 0 HA ARG A 57 1.519 -7.499 -6.248 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -0.474 -9.161 -6.016 1.00 0.00 H new ATOM 0 HB3 ARG A 57 0.649 -9.378 -7.343 1.00 0.00 H new ATOM 0 HG2 ARG A 57 1.921 -10.950 -5.548 1.00 0.00 H new ATOM 0 HG3 ARG A 57 0.318 -11.049 -4.846 1.00 0.00 H new ATOM 0 HD2 ARG A 57 0.644 -12.853 -6.537 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -0.629 -11.760 -7.043 1.00 0.00 H new ATOM 0 HE ARG A 57 1.743 -10.664 -8.175 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -0.053 -13.663 -8.182 1.00 0.00 H new ATOM 0 HH12 ARG A 57 0.449 -14.104 -9.817 1.00 0.00 H new ATOM 0 HH21 ARG A 57 2.394 -11.232 -10.261 1.00 0.00 H new ATOM 0 HH22 ARG A 57 1.822 -12.740 -10.984 1.00 0.00 H new ATOM 874 N LEU A 58 0.415 -6.858 -4.100 1.00 0.00 N ATOM 875 CA LEU A 58 -0.095 -6.414 -2.772 1.00 0.00 C ATOM 876 C LEU A 58 -0.897 -5.118 -2.945 1.00 0.00 C ATOM 877 O LEU A 58 -1.030 -4.607 -4.038 1.00 0.00 O ATOM 878 CB LEU A 58 1.100 -6.176 -1.842 1.00 0.00 C ATOM 879 CG LEU A 58 2.048 -5.141 -2.466 1.00 0.00 C ATOM 880 CD1 LEU A 58 1.459 -3.731 -2.355 1.00 0.00 C ATOM 881 CD2 LEU A 58 3.392 -5.184 -1.735 1.00 0.00 C ATOM 0 H LEU A 58 0.264 -6.198 -4.863 1.00 0.00 H new ATOM 0 HA LEU A 58 -0.745 -7.176 -2.341 1.00 0.00 H new ATOM 0 HB2 LEU A 58 0.752 -5.825 -0.871 1.00 0.00 H new ATOM 0 HB3 LEU A 58 1.631 -7.112 -1.671 1.00 0.00 H new ATOM 0 HG LEU A 58 2.184 -5.382 -3.520 1.00 0.00 H new ATOM 0 HD11 LEU A 58 2.146 -3.013 -2.803 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.503 -3.694 -2.878 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.308 -3.482 -1.305 1.00 0.00 H new ATOM 0 HD21 LEU A 58 4.069 -4.451 -2.174 1.00 0.00 H new ATOM 0 HD22 LEU A 58 3.240 -4.952 -0.681 1.00 0.00 H new ATOM 0 HD23 LEU A 58 3.825 -6.180 -1.829 1.00 0.00 H new ATOM 893 N PHE A 59 -1.434 -4.581 -1.879 1.00 0.00 N ATOM 894 CA PHE A 59 -2.222 -3.316 -1.991 1.00 0.00 C ATOM 895 C PHE A 59 -1.483 -2.197 -1.254 1.00 0.00 C ATOM 896 O PHE A 59 -0.727 -2.445 -0.336 1.00 0.00 O ATOM 897 CB PHE A 59 -3.605 -3.512 -1.369 1.00 0.00 C ATOM 898 CG PHE A 59 -4.074 -4.928 -1.608 1.00 0.00 C ATOM 899 CD1 PHE A 59 -3.853 -5.542 -2.847 1.00 0.00 C ATOM 900 CD2 PHE A 59 -4.732 -5.626 -0.590 1.00 0.00 C ATOM 901 CE1 PHE A 59 -4.289 -6.855 -3.064 1.00 0.00 C ATOM 902 CE2 PHE A 59 -5.169 -6.938 -0.807 1.00 0.00 C ATOM 903 CZ PHE A 59 -4.947 -7.552 -2.044 1.00 0.00 C ATOM 0 H PHE A 59 -1.361 -4.964 -0.936 1.00 0.00 H new ATOM 0 HA PHE A 59 -2.337 -3.051 -3.042 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -3.566 -3.307 -0.299 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -4.313 -2.806 -1.803 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -3.347 -5.003 -3.634 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -4.903 -5.152 0.365 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -4.117 -7.330 -4.019 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -5.677 -7.476 -0.020 1.00 0.00 H new ATOM 0 HZ PHE A 59 -5.283 -8.564 -2.212 1.00 0.00 H new ATOM 913 N ALA A 60 -1.696 -0.966 -1.637 1.00 0.00 N ATOM 914 CA ALA A 60 -1.000 0.157 -0.947 1.00 0.00 C ATOM 915 C ALA A 60 -1.976 1.321 -0.765 1.00 0.00 C ATOM 916 O ALA A 60 -2.978 1.416 -1.446 1.00 0.00 O ATOM 917 CB ALA A 60 0.189 0.616 -1.793 1.00 0.00 C ATOM 0 H ALA A 60 -2.320 -0.691 -2.396 1.00 0.00 H new ATOM 0 HA ALA A 60 -0.644 -0.177 0.028 1.00 0.00 H new ATOM 0 HB1 ALA A 60 0.699 1.437 -1.289 1.00 0.00 H new ATOM 0 HB2 ALA A 60 0.883 -0.214 -1.926 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -0.166 0.952 -2.767 1.00 0.00 H new ATOM 923 N PHE A 61 -1.698 2.201 0.157 1.00 0.00 N ATOM 924 CA PHE A 61 -2.619 3.350 0.391 1.00 0.00 C ATOM 925 C PHE A 61 -1.816 4.566 0.858 1.00 0.00 C ATOM 926 O PHE A 61 -1.330 4.610 1.970 1.00 0.00 O ATOM 927 CB PHE A 61 -3.636 2.947 1.460 1.00 0.00 C ATOM 928 CG PHE A 61 -4.307 4.163 2.046 1.00 0.00 C ATOM 929 CD1 PHE A 61 -5.478 4.660 1.468 1.00 0.00 C ATOM 930 CD2 PHE A 61 -3.767 4.784 3.181 1.00 0.00 C ATOM 931 CE1 PHE A 61 -6.109 5.778 2.019 1.00 0.00 C ATOM 932 CE2 PHE A 61 -4.399 5.903 3.732 1.00 0.00 C ATOM 933 CZ PHE A 61 -5.569 6.400 3.152 1.00 0.00 C ATOM 0 H PHE A 61 -0.874 2.175 0.758 1.00 0.00 H new ATOM 0 HA PHE A 61 -3.139 3.611 -0.531 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -4.386 2.287 1.024 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -3.137 2.385 2.250 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -5.895 4.180 0.595 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -2.863 4.398 3.630 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -7.013 6.163 1.571 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -3.983 6.383 4.606 1.00 0.00 H new ATOM 0 HZ PHE A 61 -6.057 7.264 3.577 1.00 0.00 H new ATOM 943 N VAL A 62 -1.665 5.552 0.009 1.00 0.00 N ATOM 944 CA VAL A 62 -0.889 6.765 0.400 1.00 0.00 C ATOM 945 C VAL A 62 -1.774 8.000 0.280 1.00 0.00 C ATOM 946 O VAL A 62 -2.701 8.045 -0.503 1.00 0.00 O ATOM 947 CB VAL A 62 0.343 6.911 -0.509 1.00 0.00 C ATOM 948 CG1 VAL A 62 0.289 5.868 -1.625 1.00 0.00 C ATOM 949 CG2 VAL A 62 0.412 8.307 -1.123 1.00 0.00 C ATOM 0 H VAL A 62 -2.046 5.568 -0.937 1.00 0.00 H new ATOM 0 HA VAL A 62 -0.557 6.663 1.433 1.00 0.00 H new ATOM 0 HB VAL A 62 1.234 6.757 0.100 1.00 0.00 H new ATOM 0 HG11 VAL A 62 1.164 5.976 -2.266 1.00 0.00 H new ATOM 0 HG12 VAL A 62 0.279 4.869 -1.189 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -0.615 6.015 -2.217 1.00 0.00 H new ATOM 0 HG21 VAL A 62 1.293 8.381 -1.761 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -0.483 8.487 -1.718 1.00 0.00 H new ATOM 0 HG23 VAL A 62 0.475 9.051 -0.329 1.00 0.00 H new ATOM 959 N ARG A 63 -1.480 9.009 1.044 1.00 0.00 N ATOM 960 CA ARG A 63 -2.285 10.260 0.975 1.00 0.00 C ATOM 961 C ARG A 63 -1.706 11.157 -0.121 1.00 0.00 C ATOM 962 O ARG A 63 -0.636 11.712 0.020 1.00 0.00 O ATOM 963 CB ARG A 63 -2.219 10.983 2.322 1.00 0.00 C ATOM 964 CG ARG A 63 -2.984 12.306 2.238 1.00 0.00 C ATOM 965 CD ARG A 63 -2.923 13.016 3.592 1.00 0.00 C ATOM 966 NE ARG A 63 -2.022 14.199 3.493 1.00 0.00 N ATOM 967 CZ ARG A 63 -2.046 15.116 4.421 1.00 0.00 C ATOM 968 NH1 ARG A 63 -2.859 14.998 5.434 1.00 0.00 N ATOM 969 NH2 ARG A 63 -1.257 16.152 4.334 1.00 0.00 N ATOM 0 H ARG A 63 -0.714 9.024 1.717 1.00 0.00 H new ATOM 0 HA ARG A 63 -3.325 10.024 0.748 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -2.646 10.355 3.104 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -1.180 11.170 2.595 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -2.552 12.940 1.463 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -4.021 12.122 1.958 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -3.922 13.331 3.895 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -2.559 12.331 4.358 1.00 0.00 H new ATOM 0 HE ARG A 63 -1.387 14.292 2.700 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -3.476 14.189 5.501 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -2.878 15.715 6.159 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -0.622 16.244 3.541 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -1.275 16.869 5.059 1.00 0.00 H new ATOM 983 N PHE A 64 -2.400 11.292 -1.218 1.00 0.00 N ATOM 984 CA PHE A 64 -1.881 12.142 -2.328 1.00 0.00 C ATOM 985 C PHE A 64 -2.371 13.580 -2.156 1.00 0.00 C ATOM 986 O PHE A 64 -3.389 13.832 -1.542 1.00 0.00 O ATOM 987 CB PHE A 64 -2.381 11.594 -3.665 1.00 0.00 C ATOM 988 CG PHE A 64 -1.825 10.207 -3.883 1.00 0.00 C ATOM 989 CD1 PHE A 64 -0.568 10.043 -4.476 1.00 0.00 C ATOM 990 CD2 PHE A 64 -2.567 9.086 -3.491 1.00 0.00 C ATOM 991 CE1 PHE A 64 -0.052 8.758 -4.678 1.00 0.00 C ATOM 992 CE2 PHE A 64 -2.051 7.800 -3.693 1.00 0.00 C ATOM 993 CZ PHE A 64 -0.793 7.636 -4.287 1.00 0.00 C ATOM 0 H PHE A 64 -3.303 10.851 -1.394 1.00 0.00 H new ATOM 0 HA PHE A 64 -0.791 12.129 -2.309 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -3.471 11.566 -3.673 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -2.073 12.252 -4.477 1.00 0.00 H new ATOM 0 HD1 PHE A 64 0.004 10.908 -4.778 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -3.537 9.213 -3.033 1.00 0.00 H new ATOM 0 HE1 PHE A 64 0.918 8.632 -5.136 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -2.623 6.935 -3.391 1.00 0.00 H new ATOM 0 HZ PHE A 64 -0.395 6.644 -4.443 1.00 0.00 H new ATOM 1003 N THR A 65 -1.659 14.525 -2.706 1.00 0.00 N ATOM 1004 CA THR A 65 -2.090 15.947 -2.588 1.00 0.00 C ATOM 1005 C THR A 65 -3.176 16.221 -3.629 1.00 0.00 C ATOM 1006 O THR A 65 -3.107 15.758 -4.750 1.00 0.00 O ATOM 1007 CB THR A 65 -0.894 16.868 -2.840 1.00 0.00 C ATOM 1008 OG1 THR A 65 -1.358 18.192 -3.068 1.00 0.00 O ATOM 1009 CG2 THR A 65 -0.119 16.378 -4.064 1.00 0.00 C ATOM 0 H THR A 65 -0.798 14.374 -3.232 1.00 0.00 H new ATOM 0 HA THR A 65 -2.480 16.134 -1.588 1.00 0.00 H new ATOM 0 HB THR A 65 -0.237 16.858 -1.970 1.00 0.00 H new ATOM 0 HG1 THR A 65 -0.593 18.784 -3.228 1.00 0.00 H new ATOM 0 HG21 THR A 65 0.732 17.035 -4.242 1.00 0.00 H new ATOM 0 HG22 THR A 65 0.236 15.363 -3.887 1.00 0.00 H new ATOM 0 HG23 THR A 65 -0.773 16.387 -4.936 1.00 0.00 H new ATOM 1017 N THR A 66 -4.182 16.970 -3.269 1.00 0.00 N ATOM 1018 CA THR A 66 -5.271 17.269 -4.240 1.00 0.00 C ATOM 1019 C THR A 66 -5.817 18.674 -3.980 1.00 0.00 C ATOM 1020 O THR A 66 -6.457 18.927 -2.979 1.00 0.00 O ATOM 1021 CB THR A 66 -6.395 16.245 -4.075 1.00 0.00 C ATOM 1022 OG1 THR A 66 -6.023 15.031 -4.714 1.00 0.00 O ATOM 1023 CG2 THR A 66 -7.679 16.782 -4.707 1.00 0.00 C ATOM 0 H THR A 66 -4.296 17.387 -2.345 1.00 0.00 H new ATOM 0 HA THR A 66 -4.877 17.216 -5.255 1.00 0.00 H new ATOM 0 HB THR A 66 -6.566 16.063 -3.014 1.00 0.00 H new ATOM 0 HG1 THR A 66 -5.081 15.077 -4.981 1.00 0.00 H new ATOM 0 HG21 THR A 66 -8.477 16.050 -4.587 1.00 0.00 H new ATOM 0 HG22 THR A 66 -7.964 17.713 -4.217 1.00 0.00 H new ATOM 0 HG23 THR A 66 -7.512 16.967 -5.768 1.00 0.00 H new ATOM 1031 N GLY A 67 -5.570 19.592 -4.875 1.00 0.00 N ATOM 1032 CA GLY A 67 -6.076 20.980 -4.678 1.00 0.00 C ATOM 1033 C GLY A 67 -5.255 21.673 -3.589 1.00 0.00 C ATOM 1034 O GLY A 67 -5.777 22.084 -2.572 1.00 0.00 O ATOM 0 H GLY A 67 -5.040 19.441 -5.733 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -6.008 21.539 -5.611 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -7.129 20.958 -4.396 1.00 0.00 H new ATOM 1038 N ASP A 68 -3.973 21.807 -3.795 1.00 0.00 N ATOM 1039 CA ASP A 68 -3.121 22.474 -2.771 1.00 0.00 C ATOM 1040 C ASP A 68 -3.439 23.971 -2.739 1.00 0.00 C ATOM 1041 O ASP A 68 -2.563 24.798 -2.582 1.00 0.00 O ATOM 1042 CB ASP A 68 -1.646 22.274 -3.127 1.00 0.00 C ATOM 1043 CG ASP A 68 -1.332 23.004 -4.435 1.00 0.00 C ATOM 1044 OD1 ASP A 68 -2.232 23.625 -4.974 1.00 0.00 O ATOM 1045 OD2 ASP A 68 -0.197 22.928 -4.874 1.00 0.00 O ATOM 0 H ASP A 68 -3.480 21.484 -4.627 1.00 0.00 H new ATOM 0 HA ASP A 68 -3.321 22.039 -1.792 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -1.013 22.654 -2.325 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -1.427 21.211 -3.230 1.00 0.00 H new ATOM 1050 N ALA A 69 -4.687 24.324 -2.886 1.00 0.00 N ATOM 1051 CA ALA A 69 -5.059 25.767 -2.862 1.00 0.00 C ATOM 1052 C ALA A 69 -5.622 26.125 -1.486 1.00 0.00 C ATOM 1053 O ALA A 69 -6.054 25.271 -0.739 1.00 0.00 O ATOM 1054 CB ALA A 69 -6.118 26.037 -3.933 1.00 0.00 C ATOM 0 H ALA A 69 -5.464 23.677 -3.021 1.00 0.00 H new ATOM 0 HA ALA A 69 -4.176 26.374 -3.062 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -6.391 27.092 -3.917 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -5.717 25.781 -4.914 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -7.001 25.430 -3.732 1.00 0.00 H new ATOM 1060 N MET A 70 -5.622 27.386 -1.145 1.00 0.00 N ATOM 1061 CA MET A 70 -6.157 27.797 0.184 1.00 0.00 C ATOM 1062 C MET A 70 -5.647 26.837 1.259 1.00 0.00 C ATOM 1063 O MET A 70 -4.500 26.887 1.656 1.00 0.00 O ATOM 1064 CB MET A 70 -7.687 27.760 0.151 1.00 0.00 C ATOM 1065 CG MET A 70 -8.199 28.745 -0.902 1.00 0.00 C ATOM 1066 SD MET A 70 -9.955 29.077 -0.614 1.00 0.00 S ATOM 1067 CE MET A 70 -10.395 29.468 -2.324 1.00 0.00 C ATOM 0 H MET A 70 -5.275 28.147 -1.728 1.00 0.00 H new ATOM 0 HA MET A 70 -5.822 28.809 0.413 1.00 0.00 H new ATOM 0 HB2 MET A 70 -8.032 26.752 -0.080 1.00 0.00 H new ATOM 0 HB3 MET A 70 -8.089 28.017 1.131 1.00 0.00 H new ATOM 0 HG2 MET A 70 -7.630 29.673 -0.854 1.00 0.00 H new ATOM 0 HG3 MET A 70 -8.055 28.334 -1.901 1.00 0.00 H new ATOM 0 HE1 MET A 70 -11.457 29.709 -2.381 1.00 0.00 H new ATOM 0 HE2 MET A 70 -9.811 30.323 -2.664 1.00 0.00 H new ATOM 0 HE3 MET A 70 -10.183 28.608 -2.960 1.00 0.00 H new ATOM 1077 N SER A 71 -6.490 25.962 1.735 1.00 0.00 N ATOM 1078 CA SER A 71 -6.052 25.000 2.785 1.00 0.00 C ATOM 1079 C SER A 71 -5.284 23.848 2.133 1.00 0.00 C ATOM 1080 O SER A 71 -5.593 23.425 1.037 1.00 0.00 O ATOM 1081 CB SER A 71 -7.278 24.446 3.512 1.00 0.00 C ATOM 1082 OG SER A 71 -8.395 25.288 3.257 1.00 0.00 O ATOM 0 H SER A 71 -7.463 25.872 1.442 1.00 0.00 H new ATOM 0 HA SER A 71 -5.405 25.511 3.498 1.00 0.00 H new ATOM 0 HB2 SER A 71 -7.488 23.431 3.174 1.00 0.00 H new ATOM 0 HB3 SER A 71 -7.086 24.392 4.584 1.00 0.00 H new ATOM 0 HG SER A 71 -9.007 25.261 4.022 1.00 0.00 H new ATOM 1088 N LYS A 72 -4.284 23.338 2.798 1.00 0.00 N ATOM 1089 CA LYS A 72 -3.498 22.215 2.216 1.00 0.00 C ATOM 1090 C LYS A 72 -4.276 20.908 2.381 1.00 0.00 C ATOM 1091 O LYS A 72 -3.939 20.072 3.195 1.00 0.00 O ATOM 1092 CB LYS A 72 -2.154 22.103 2.939 1.00 0.00 C ATOM 1093 CG LYS A 72 -1.532 23.494 3.080 1.00 0.00 C ATOM 1094 CD LYS A 72 -0.207 23.386 3.836 1.00 0.00 C ATOM 1095 CE LYS A 72 0.862 24.212 3.117 1.00 0.00 C ATOM 1096 NZ LYS A 72 1.122 23.624 1.772 1.00 0.00 N ATOM 0 H LYS A 72 -3.978 23.651 3.719 1.00 0.00 H new ATOM 0 HA LYS A 72 -3.326 22.404 1.156 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -2.294 21.655 3.923 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -1.483 21.448 2.383 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -1.367 23.932 2.095 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -2.214 24.157 3.613 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -0.330 23.743 4.859 1.00 0.00 H new ATOM 0 HD3 LYS A 72 0.105 22.343 3.897 1.00 0.00 H new ATOM 0 HE2 LYS A 72 0.531 25.246 3.016 1.00 0.00 H new ATOM 0 HE3 LYS A 72 1.781 24.227 3.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 2.122 23.762 1.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 0.906 22.607 1.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 0.520 24.093 1.066 1.00 0.00 H new ATOM 1110 N ARG A 73 -5.316 20.725 1.615 1.00 0.00 N ATOM 1111 CA ARG A 73 -6.116 19.473 1.730 1.00 0.00 C ATOM 1112 C ARG A 73 -5.341 18.313 1.100 1.00 0.00 C ATOM 1113 O ARG A 73 -4.298 18.500 0.507 1.00 0.00 O ATOM 1114 CB ARG A 73 -7.449 19.651 1.000 1.00 0.00 C ATOM 1115 CG ARG A 73 -8.401 20.473 1.870 1.00 0.00 C ATOM 1116 CD ARG A 73 -9.792 20.483 1.230 1.00 0.00 C ATOM 1117 NE ARG A 73 -10.325 21.881 1.171 1.00 0.00 N ATOM 1118 CZ ARG A 73 -10.237 22.682 2.201 1.00 0.00 C ATOM 1119 NH1 ARG A 73 -9.752 22.251 3.333 1.00 0.00 N ATOM 1120 NH2 ARG A 73 -10.658 23.913 2.104 1.00 0.00 N ATOM 0 H ARG A 73 -5.647 21.388 0.914 1.00 0.00 H new ATOM 0 HA ARG A 73 -6.303 19.257 2.782 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -7.289 20.151 0.045 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -7.888 18.678 0.781 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -8.453 20.049 2.873 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -8.029 21.492 1.974 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -9.741 20.063 0.225 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -10.469 19.852 1.805 1.00 0.00 H new ATOM 0 HE ARG A 73 -10.764 22.214 0.313 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -9.439 21.284 3.418 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -9.686 22.881 4.132 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -11.055 24.249 1.226 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -10.591 24.540 2.906 1.00 0.00 H new ATOM 1134 N SER A 74 -5.845 17.116 1.224 1.00 0.00 N ATOM 1135 CA SER A 74 -5.139 15.945 0.633 1.00 0.00 C ATOM 1136 C SER A 74 -6.163 14.878 0.239 1.00 0.00 C ATOM 1137 O SER A 74 -7.261 14.839 0.757 1.00 0.00 O ATOM 1138 CB SER A 74 -4.167 15.365 1.660 1.00 0.00 C ATOM 1139 OG SER A 74 -2.853 15.370 1.119 1.00 0.00 O ATOM 0 H SER A 74 -6.715 16.898 1.709 1.00 0.00 H new ATOM 0 HA SER A 74 -4.586 16.262 -0.251 1.00 0.00 H new ATOM 0 HB2 SER A 74 -4.197 15.952 2.578 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.461 14.349 1.922 1.00 0.00 H new ATOM 0 HG SER A 74 -2.853 14.908 0.255 1.00 0.00 H new ATOM 1145 N LYS A 75 -5.814 14.016 -0.678 1.00 0.00 N ATOM 1146 CA LYS A 75 -6.771 12.957 -1.110 1.00 0.00 C ATOM 1147 C LYS A 75 -6.352 11.608 -0.518 1.00 0.00 C ATOM 1148 O LYS A 75 -5.196 11.383 -0.219 1.00 0.00 O ATOM 1149 CB LYS A 75 -6.776 12.871 -2.639 1.00 0.00 C ATOM 1150 CG LYS A 75 -7.793 11.821 -3.094 1.00 0.00 C ATOM 1151 CD LYS A 75 -9.192 12.227 -2.623 1.00 0.00 C ATOM 1152 CE LYS A 75 -10.229 11.786 -3.657 1.00 0.00 C ATOM 1153 NZ LYS A 75 -10.094 12.622 -4.883 1.00 0.00 N ATOM 0 H LYS A 75 -4.908 13.999 -1.146 1.00 0.00 H new ATOM 0 HA LYS A 75 -7.772 13.206 -0.756 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -7.026 13.842 -3.067 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -5.782 12.609 -3.001 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -7.776 11.729 -4.180 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.530 10.844 -2.687 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -9.409 11.770 -1.658 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -9.240 13.307 -2.482 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -10.087 10.734 -3.904 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -11.233 11.885 -3.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -10.198 12.022 -5.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -10.832 13.354 -4.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -9.158 13.074 -4.893 1.00 0.00 H new ATOM 1167 N PHE A 76 -7.289 10.716 -0.339 1.00 0.00 N ATOM 1168 CA PHE A 76 -6.960 9.381 0.241 1.00 0.00 C ATOM 1169 C PHE A 76 -7.491 8.279 -0.685 1.00 0.00 C ATOM 1170 O PHE A 76 -8.672 8.209 -0.963 1.00 0.00 O ATOM 1171 CB PHE A 76 -7.620 9.265 1.616 1.00 0.00 C ATOM 1172 CG PHE A 76 -7.171 10.410 2.493 1.00 0.00 C ATOM 1173 CD1 PHE A 76 -5.979 10.309 3.219 1.00 0.00 C ATOM 1174 CD2 PHE A 76 -7.949 11.571 2.582 1.00 0.00 C ATOM 1175 CE1 PHE A 76 -5.563 11.369 4.035 1.00 0.00 C ATOM 1176 CE2 PHE A 76 -7.534 12.630 3.398 1.00 0.00 C ATOM 1177 CZ PHE A 76 -6.342 12.529 4.124 1.00 0.00 C ATOM 0 H PHE A 76 -8.273 10.855 -0.571 1.00 0.00 H new ATOM 0 HA PHE A 76 -5.880 9.272 0.342 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -8.705 9.278 1.512 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -7.355 8.314 2.078 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -5.379 9.413 3.150 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -8.869 11.649 2.021 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -4.643 11.292 4.595 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -8.134 13.525 3.467 1.00 0.00 H new ATOM 0 HZ PHE A 76 -6.023 13.346 4.753 1.00 0.00 H new ATOM 1187 N ALA A 77 -6.627 7.429 -1.183 1.00 0.00 N ATOM 1188 CA ALA A 77 -7.095 6.354 -2.108 1.00 0.00 C ATOM 1189 C ALA A 77 -6.280 5.076 -1.900 1.00 0.00 C ATOM 1190 O ALA A 77 -5.185 5.098 -1.374 1.00 0.00 O ATOM 1191 CB ALA A 77 -6.930 6.827 -3.553 1.00 0.00 C ATOM 0 H ALA A 77 -5.625 7.433 -0.990 1.00 0.00 H new ATOM 0 HA ALA A 77 -8.144 6.141 -1.900 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -7.270 6.046 -4.233 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -7.522 7.728 -3.711 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -5.880 7.044 -3.747 1.00 0.00 H new ATOM 1197 N LEU A 78 -6.807 3.960 -2.332 1.00 0.00 N ATOM 1198 CA LEU A 78 -6.076 2.670 -2.189 1.00 0.00 C ATOM 1199 C LEU A 78 -5.603 2.220 -3.574 1.00 0.00 C ATOM 1200 O LEU A 78 -6.148 2.626 -4.581 1.00 0.00 O ATOM 1201 CB LEU A 78 -7.021 1.615 -1.604 1.00 0.00 C ATOM 1202 CG LEU A 78 -6.300 0.268 -1.509 1.00 0.00 C ATOM 1203 CD1 LEU A 78 -6.662 -0.414 -0.189 1.00 0.00 C ATOM 1204 CD2 LEU A 78 -6.733 -0.628 -2.674 1.00 0.00 C ATOM 0 H LEU A 78 -7.720 3.889 -2.781 1.00 0.00 H new ATOM 0 HA LEU A 78 -5.220 2.795 -1.526 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -7.361 1.926 -0.616 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -7.907 1.520 -2.231 1.00 0.00 H new ATOM 0 HG LEU A 78 -5.223 0.432 -1.553 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -6.148 -1.373 -0.122 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -6.357 0.220 0.644 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -7.739 -0.576 -0.146 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -6.219 -1.587 -2.606 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -7.810 -0.789 -2.628 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -6.478 -0.146 -3.618 1.00 0.00 H new ATOM 1216 N ILE A 79 -4.601 1.384 -3.643 1.00 0.00 N ATOM 1217 CA ILE A 79 -4.112 0.918 -4.972 1.00 0.00 C ATOM 1218 C ILE A 79 -3.812 -0.581 -4.893 1.00 0.00 C ATOM 1219 O ILE A 79 -3.346 -1.075 -3.886 1.00 0.00 O ATOM 1220 CB ILE A 79 -2.845 1.690 -5.345 1.00 0.00 C ATOM 1221 CG1 ILE A 79 -3.159 3.188 -5.343 1.00 0.00 C ATOM 1222 CG2 ILE A 79 -2.371 1.275 -6.741 1.00 0.00 C ATOM 1223 CD1 ILE A 79 -1.941 3.966 -5.836 1.00 0.00 C ATOM 0 H ILE A 79 -4.102 1.005 -2.838 1.00 0.00 H new ATOM 0 HA ILE A 79 -4.871 1.095 -5.734 1.00 0.00 H new ATOM 0 HB ILE A 79 -2.060 1.470 -4.622 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -4.017 3.391 -5.984 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -3.428 3.512 -4.338 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -1.469 1.829 -6.999 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -2.155 0.207 -6.749 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -3.151 1.493 -7.470 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -2.165 5.033 -5.834 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -1.094 3.772 -5.177 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -1.692 3.649 -6.849 1.00 0.00 H new ATOM 1235 N THR A 80 -4.077 -1.310 -5.944 1.00 0.00 N ATOM 1236 CA THR A 80 -3.808 -2.777 -5.922 1.00 0.00 C ATOM 1237 C THR A 80 -2.573 -3.088 -6.772 1.00 0.00 C ATOM 1238 O THR A 80 -2.541 -2.814 -7.955 1.00 0.00 O ATOM 1239 CB THR A 80 -5.018 -3.523 -6.491 1.00 0.00 C ATOM 1240 OG1 THR A 80 -6.183 -2.727 -6.326 1.00 0.00 O ATOM 1241 CG2 THR A 80 -5.194 -4.850 -5.752 1.00 0.00 C ATOM 0 H THR A 80 -4.468 -0.953 -6.816 1.00 0.00 H new ATOM 0 HA THR A 80 -3.629 -3.097 -4.895 1.00 0.00 H new ATOM 0 HB THR A 80 -4.860 -3.719 -7.551 1.00 0.00 H new ATOM 0 HG1 THR A 80 -6.958 -3.202 -6.691 1.00 0.00 H new ATOM 0 HG21 THR A 80 -6.055 -5.381 -6.157 1.00 0.00 H new ATOM 0 HG22 THR A 80 -4.299 -5.459 -5.880 1.00 0.00 H new ATOM 0 HG23 THR A 80 -5.353 -4.657 -4.691 1.00 0.00 H new ATOM 1249 N TRP A 81 -1.556 -3.659 -6.183 1.00 0.00 N ATOM 1250 CA TRP A 81 -0.332 -3.980 -6.972 1.00 0.00 C ATOM 1251 C TRP A 81 -0.420 -5.414 -7.495 1.00 0.00 C ATOM 1252 O TRP A 81 -0.367 -6.361 -6.740 1.00 0.00 O ATOM 1253 CB TRP A 81 0.914 -3.848 -6.087 1.00 0.00 C ATOM 1254 CG TRP A 81 2.135 -4.120 -6.909 1.00 0.00 C ATOM 1255 CD1 TRP A 81 3.016 -5.114 -6.663 1.00 0.00 C ATOM 1256 CD2 TRP A 81 2.626 -3.421 -8.093 1.00 0.00 C ATOM 1257 NE1 TRP A 81 4.007 -5.084 -7.626 1.00 0.00 N ATOM 1258 CE2 TRP A 81 3.814 -4.060 -8.527 1.00 0.00 C ATOM 1259 CE3 TRP A 81 2.165 -2.314 -8.829 1.00 0.00 C ATOM 1260 CZ2 TRP A 81 4.516 -3.618 -9.648 1.00 0.00 C ATOM 1261 CZ3 TRP A 81 2.872 -1.866 -9.958 1.00 0.00 C ATOM 1262 CH2 TRP A 81 4.043 -2.518 -10.366 1.00 0.00 C ATOM 0 H TRP A 81 -1.520 -3.915 -5.196 1.00 0.00 H new ATOM 0 HA TRP A 81 -0.260 -3.284 -7.808 1.00 0.00 H new ATOM 0 HB2 TRP A 81 0.966 -2.847 -5.658 1.00 0.00 H new ATOM 0 HB3 TRP A 81 0.859 -4.549 -5.254 1.00 0.00 H new ATOM 0 HD1 TRP A 81 2.956 -5.818 -5.846 1.00 0.00 H new ATOM 0 HE1 TRP A 81 4.787 -5.740 -7.665 1.00 0.00 H new ATOM 0 HE3 TRP A 81 1.262 -1.805 -8.524 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 5.419 -4.123 -9.958 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 2.510 -1.014 -10.514 1.00 0.00 H new ATOM 0 HH2 TRP A 81 4.580 -2.170 -11.236 1.00 0.00 H new ATOM 1273 N ILE A 82 -0.549 -5.580 -8.783 1.00 0.00 N ATOM 1274 CA ILE A 82 -0.628 -6.955 -9.354 1.00 0.00 C ATOM 1275 C ILE A 82 0.708 -7.288 -10.027 1.00 0.00 C ATOM 1276 O ILE A 82 0.929 -6.973 -11.178 1.00 0.00 O ATOM 1277 CB ILE A 82 -1.753 -7.018 -10.390 1.00 0.00 C ATOM 1278 CG1 ILE A 82 -3.069 -6.562 -9.748 1.00 0.00 C ATOM 1279 CG2 ILE A 82 -1.902 -8.454 -10.898 1.00 0.00 C ATOM 1280 CD1 ILE A 82 -3.334 -7.368 -8.474 1.00 0.00 C ATOM 0 H ILE A 82 -0.603 -4.823 -9.465 1.00 0.00 H new ATOM 0 HA ILE A 82 -0.833 -7.674 -8.561 1.00 0.00 H new ATOM 0 HB ILE A 82 -1.512 -6.361 -11.226 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -3.020 -5.499 -9.512 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -3.892 -6.695 -10.451 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -2.703 -8.498 -11.636 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -0.968 -8.776 -11.358 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -2.141 -9.112 -10.063 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -4.270 -7.039 -8.023 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -3.403 -8.427 -8.721 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -2.518 -7.213 -7.769 1.00 0.00 H new ATOM 1292 N GLY A 83 1.603 -7.914 -9.312 1.00 0.00 N ATOM 1293 CA GLY A 83 2.928 -8.258 -9.905 1.00 0.00 C ATOM 1294 C GLY A 83 2.744 -9.258 -11.044 1.00 0.00 C ATOM 1295 O GLY A 83 1.734 -9.927 -11.139 1.00 0.00 O ATOM 0 H GLY A 83 1.474 -8.202 -8.342 1.00 0.00 H new ATOM 0 HA2 GLY A 83 3.415 -7.356 -10.276 1.00 0.00 H new ATOM 0 HA3 GLY A 83 3.580 -8.681 -9.140 1.00 0.00 H new ATOM 1299 N GLU A 84 3.718 -9.362 -11.908 1.00 0.00 N ATOM 1300 CA GLU A 84 3.612 -10.318 -13.049 1.00 0.00 C ATOM 1301 C GLU A 84 4.767 -11.321 -12.993 1.00 0.00 C ATOM 1302 O GLU A 84 5.673 -11.282 -13.802 1.00 0.00 O ATOM 1303 CB GLU A 84 3.676 -9.544 -14.368 1.00 0.00 C ATOM 1304 CG GLU A 84 2.264 -9.133 -14.788 1.00 0.00 C ATOM 1305 CD GLU A 84 1.639 -10.243 -15.633 1.00 0.00 C ATOM 1306 OE1 GLU A 84 1.690 -11.385 -15.207 1.00 0.00 O ATOM 1307 OE2 GLU A 84 1.119 -9.933 -16.693 1.00 0.00 O ATOM 0 H GLU A 84 4.585 -8.825 -11.873 1.00 0.00 H new ATOM 0 HA GLU A 84 2.665 -10.854 -12.983 1.00 0.00 H new ATOM 0 HB2 GLU A 84 4.304 -8.661 -14.253 1.00 0.00 H new ATOM 0 HB3 GLU A 84 4.132 -10.161 -15.142 1.00 0.00 H new ATOM 0 HG2 GLU A 84 1.652 -8.944 -13.906 1.00 0.00 H new ATOM 0 HG3 GLU A 84 2.298 -8.204 -15.357 1.00 0.00 H new ATOM 1314 N ASP A 85 4.744 -12.226 -12.049 1.00 0.00 N ATOM 1315 CA ASP A 85 5.842 -13.233 -11.953 1.00 0.00 C ATOM 1316 C ASP A 85 5.565 -14.203 -10.805 1.00 0.00 C ATOM 1317 O ASP A 85 6.042 -15.320 -10.804 1.00 0.00 O ATOM 1318 CB ASP A 85 7.177 -12.524 -11.710 1.00 0.00 C ATOM 1319 CG ASP A 85 8.269 -13.190 -12.550 1.00 0.00 C ATOM 1320 OD1 ASP A 85 8.357 -12.878 -13.726 1.00 0.00 O ATOM 1321 OD2 ASP A 85 8.997 -14.001 -12.003 1.00 0.00 O ATOM 0 H ASP A 85 4.014 -12.311 -11.342 1.00 0.00 H new ATOM 0 HA ASP A 85 5.892 -13.790 -12.889 1.00 0.00 H new ATOM 0 HB2 ASP A 85 7.094 -11.469 -11.973 1.00 0.00 H new ATOM 0 HB3 ASP A 85 7.438 -12.570 -10.653 1.00 0.00 H new ATOM 1326 N VAL A 86 4.809 -13.794 -9.826 1.00 0.00 N ATOM 1327 CA VAL A 86 4.520 -14.707 -8.686 1.00 0.00 C ATOM 1328 C VAL A 86 3.826 -15.969 -9.197 1.00 0.00 C ATOM 1329 O VAL A 86 4.229 -16.563 -10.178 1.00 0.00 O ATOM 1330 CB VAL A 86 3.616 -13.999 -7.677 1.00 0.00 C ATOM 1331 CG1 VAL A 86 3.816 -14.614 -6.291 1.00 0.00 C ATOM 1332 CG2 VAL A 86 3.978 -12.513 -7.629 1.00 0.00 C ATOM 0 H VAL A 86 4.380 -12.871 -9.765 1.00 0.00 H new ATOM 0 HA VAL A 86 5.457 -14.983 -8.202 1.00 0.00 H new ATOM 0 HB VAL A 86 2.575 -14.114 -7.978 1.00 0.00 H new ATOM 0 HG11 VAL A 86 3.171 -14.109 -5.572 1.00 0.00 H new ATOM 0 HG12 VAL A 86 3.563 -15.674 -6.323 1.00 0.00 H new ATOM 0 HG13 VAL A 86 4.857 -14.499 -5.988 1.00 0.00 H new ATOM 0 HG21 VAL A 86 3.335 -12.005 -6.910 1.00 0.00 H new ATOM 0 HG22 VAL A 86 5.019 -12.402 -7.327 1.00 0.00 H new ATOM 0 HG23 VAL A 86 3.838 -12.072 -8.616 1.00 0.00 H new ATOM 1342 N SER A 87 2.791 -16.385 -8.528 1.00 0.00 N ATOM 1343 CA SER A 87 2.062 -17.616 -8.953 1.00 0.00 C ATOM 1344 C SER A 87 0.572 -17.310 -9.134 1.00 0.00 C ATOM 1345 O SER A 87 0.133 -16.188 -8.983 1.00 0.00 O ATOM 1346 CB SER A 87 2.229 -18.696 -7.884 1.00 0.00 C ATOM 1347 OG SER A 87 3.588 -19.113 -7.846 1.00 0.00 O ATOM 0 H SER A 87 2.414 -15.925 -7.700 1.00 0.00 H new ATOM 0 HA SER A 87 2.472 -17.964 -9.901 1.00 0.00 H new ATOM 0 HB2 SER A 87 1.928 -18.310 -6.910 1.00 0.00 H new ATOM 0 HB3 SER A 87 1.582 -19.545 -8.104 1.00 0.00 H new ATOM 0 HG SER A 87 3.699 -19.804 -7.160 1.00 0.00 H new ATOM 1353 N GLY A 88 -0.203 -18.308 -9.462 1.00 0.00 N ATOM 1354 CA GLY A 88 -1.665 -18.091 -9.661 1.00 0.00 C ATOM 1355 C GLY A 88 -2.389 -18.150 -8.313 1.00 0.00 C ATOM 1356 O GLY A 88 -3.509 -17.697 -8.179 1.00 0.00 O ATOM 0 H GLY A 88 0.114 -19.267 -9.601 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -1.837 -17.124 -10.134 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -2.066 -18.850 -10.333 1.00 0.00 H new ATOM 1360 N LEU A 89 -1.764 -18.711 -7.316 1.00 0.00 N ATOM 1361 CA LEU A 89 -2.420 -18.806 -5.981 1.00 0.00 C ATOM 1362 C LEU A 89 -3.019 -17.450 -5.598 1.00 0.00 C ATOM 1363 O LEU A 89 -4.198 -17.336 -5.332 1.00 0.00 O ATOM 1364 CB LEU A 89 -1.384 -19.219 -4.933 1.00 0.00 C ATOM 1365 CG LEU A 89 -1.623 -20.673 -4.525 1.00 0.00 C ATOM 1366 CD1 LEU A 89 -1.581 -21.567 -5.766 1.00 0.00 C ATOM 1367 CD2 LEU A 89 -0.534 -21.112 -3.543 1.00 0.00 C ATOM 0 H LEU A 89 -0.826 -19.109 -7.367 1.00 0.00 H new ATOM 0 HA LEU A 89 -3.215 -19.550 -6.024 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -0.378 -19.104 -5.336 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -1.454 -18.569 -4.061 1.00 0.00 H new ATOM 0 HG LEU A 89 -2.600 -20.760 -4.049 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -1.751 -22.603 -5.474 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -2.356 -21.255 -6.466 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -0.605 -21.481 -6.244 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -0.703 -22.149 -3.251 1.00 0.00 H new ATOM 0 HD22 LEU A 89 0.442 -21.024 -4.019 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -0.564 -20.477 -2.658 1.00 0.00 H new ATOM 1379 N GLN A 90 -2.215 -16.422 -5.561 1.00 0.00 N ATOM 1380 CA GLN A 90 -2.741 -15.077 -5.188 1.00 0.00 C ATOM 1381 C GLN A 90 -3.787 -14.629 -6.212 1.00 0.00 C ATOM 1382 O GLN A 90 -4.710 -13.912 -5.889 1.00 0.00 O ATOM 1383 CB GLN A 90 -1.586 -14.073 -5.161 1.00 0.00 C ATOM 1384 CG GLN A 90 -0.315 -14.770 -4.669 1.00 0.00 C ATOM 1385 CD GLN A 90 0.511 -13.798 -3.824 1.00 0.00 C ATOM 1386 OE1 GLN A 90 1.305 -13.042 -4.348 1.00 0.00 O ATOM 1387 NE2 GLN A 90 0.359 -13.787 -2.529 1.00 0.00 N ATOM 0 H GLN A 90 -1.218 -16.455 -5.773 1.00 0.00 H new ATOM 0 HA GLN A 90 -3.204 -15.128 -4.203 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -1.425 -13.661 -6.157 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -1.832 -13.237 -4.506 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -0.576 -15.649 -4.079 1.00 0.00 H new ATOM 0 HG3 GLN A 90 0.272 -15.119 -5.518 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -0.307 -14.421 -2.088 1.00 0.00 H new ATOM 0 HE22 GLN A 90 0.906 -13.144 -1.957 1.00 0.00 H new ATOM 1396 N ARG A 91 -3.652 -15.026 -7.445 1.00 0.00 N ATOM 1397 CA ARG A 91 -4.644 -14.595 -8.472 1.00 0.00 C ATOM 1398 C ARG A 91 -6.067 -14.742 -7.922 1.00 0.00 C ATOM 1399 O ARG A 91 -6.775 -13.771 -7.738 1.00 0.00 O ATOM 1400 CB ARG A 91 -4.492 -15.460 -9.725 1.00 0.00 C ATOM 1401 CG ARG A 91 -5.273 -14.829 -10.879 1.00 0.00 C ATOM 1402 CD ARG A 91 -4.299 -14.384 -11.971 1.00 0.00 C ATOM 1403 NE ARG A 91 -5.039 -13.626 -13.019 1.00 0.00 N ATOM 1404 CZ ARG A 91 -4.385 -12.902 -13.886 1.00 0.00 C ATOM 1405 NH1 ARG A 91 -3.082 -12.842 -13.834 1.00 0.00 N ATOM 1406 NH2 ARG A 91 -5.034 -12.238 -14.803 1.00 0.00 N ATOM 0 H ARG A 91 -2.902 -15.627 -7.787 1.00 0.00 H new ATOM 0 HA ARG A 91 -4.464 -13.550 -8.723 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -3.439 -15.551 -9.991 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -4.860 -16.468 -9.531 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -5.987 -15.546 -11.284 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -5.848 -13.975 -10.519 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -3.515 -13.760 -11.542 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -3.810 -15.252 -12.412 1.00 0.00 H new ATOM 0 HE ARG A 91 -6.057 -13.673 -13.059 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -2.576 -13.361 -13.116 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -2.570 -12.276 -14.511 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -6.052 -12.285 -14.842 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -4.523 -11.672 -15.481 1.00 0.00 H new ATOM 1420 N ALA A 92 -6.496 -15.948 -7.668 1.00 0.00 N ATOM 1421 CA ALA A 92 -7.878 -16.154 -7.144 1.00 0.00 C ATOM 1422 C ALA A 92 -7.964 -15.700 -5.683 1.00 0.00 C ATOM 1423 O ALA A 92 -8.984 -15.215 -5.234 1.00 0.00 O ATOM 1424 CB ALA A 92 -8.238 -17.638 -7.236 1.00 0.00 C ATOM 0 H ALA A 92 -5.950 -16.800 -7.800 1.00 0.00 H new ATOM 0 HA ALA A 92 -8.575 -15.565 -7.740 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -9.247 -17.792 -6.854 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -8.191 -17.960 -8.276 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -7.533 -18.221 -6.643 1.00 0.00 H new ATOM 1430 N LYS A 93 -6.907 -15.858 -4.936 1.00 0.00 N ATOM 1431 CA LYS A 93 -6.939 -15.442 -3.505 1.00 0.00 C ATOM 1432 C LYS A 93 -6.999 -13.913 -3.408 1.00 0.00 C ATOM 1433 O LYS A 93 -7.916 -13.354 -2.839 1.00 0.00 O ATOM 1434 CB LYS A 93 -5.680 -15.952 -2.801 1.00 0.00 C ATOM 1435 CG LYS A 93 -6.043 -16.450 -1.400 1.00 0.00 C ATOM 1436 CD LYS A 93 -6.770 -17.792 -1.506 1.00 0.00 C ATOM 1437 CE LYS A 93 -8.077 -17.729 -0.714 1.00 0.00 C ATOM 1438 NZ LYS A 93 -7.786 -17.346 0.696 1.00 0.00 N ATOM 0 H LYS A 93 -6.023 -16.257 -5.253 1.00 0.00 H new ATOM 0 HA LYS A 93 -7.822 -15.864 -3.026 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -5.229 -16.758 -3.379 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -4.940 -15.155 -2.734 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -5.142 -16.560 -0.797 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -6.677 -15.720 -0.896 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -6.977 -18.024 -2.551 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -6.137 -18.592 -1.121 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -8.754 -17.004 -1.166 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -8.579 -18.696 -0.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -8.467 -17.811 1.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -6.821 -17.645 0.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -7.866 -16.314 0.799 1.00 0.00 H new ATOM 1452 N THR A 94 -6.032 -13.233 -3.958 1.00 0.00 N ATOM 1453 CA THR A 94 -6.031 -11.743 -3.897 1.00 0.00 C ATOM 1454 C THR A 94 -7.433 -11.221 -4.220 1.00 0.00 C ATOM 1455 O THR A 94 -7.889 -10.247 -3.657 1.00 0.00 O ATOM 1456 CB THR A 94 -5.033 -11.201 -4.924 1.00 0.00 C ATOM 1457 OG1 THR A 94 -3.862 -12.005 -4.912 1.00 0.00 O ATOM 1458 CG2 THR A 94 -4.662 -9.759 -4.579 1.00 0.00 C ATOM 0 H THR A 94 -5.239 -13.646 -4.449 1.00 0.00 H new ATOM 0 HA THR A 94 -5.744 -11.414 -2.898 1.00 0.00 H new ATOM 0 HB THR A 94 -5.488 -11.227 -5.914 1.00 0.00 H new ATOM 0 HG1 THR A 94 -3.804 -12.511 -5.749 1.00 0.00 H new ATOM 0 HG21 THR A 94 -3.952 -9.380 -5.314 1.00 0.00 H new ATOM 0 HG22 THR A 94 -5.559 -9.140 -4.589 1.00 0.00 H new ATOM 0 HG23 THR A 94 -4.210 -9.727 -3.588 1.00 0.00 H new ATOM 1466 N GLY A 95 -8.115 -11.865 -5.121 1.00 0.00 N ATOM 1467 CA GLY A 95 -9.487 -11.413 -5.487 1.00 0.00 C ATOM 1468 C GLY A 95 -10.381 -11.390 -4.243 1.00 0.00 C ATOM 1469 O GLY A 95 -10.978 -10.388 -3.909 1.00 0.00 O ATOM 0 H GLY A 95 -7.782 -12.688 -5.623 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -9.444 -10.419 -5.933 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -9.911 -12.081 -6.237 1.00 0.00 H new ATOM 1473 N THR A 96 -10.508 -12.498 -3.575 1.00 0.00 N ATOM 1474 CA THR A 96 -11.392 -12.543 -2.376 1.00 0.00 C ATOM 1475 C THR A 96 -10.837 -11.666 -1.246 1.00 0.00 C ATOM 1476 O THR A 96 -11.566 -10.920 -0.619 1.00 0.00 O ATOM 1477 CB THR A 96 -11.496 -13.989 -1.885 1.00 0.00 C ATOM 1478 OG1 THR A 96 -11.758 -14.844 -2.989 1.00 0.00 O ATOM 1479 CG2 THR A 96 -12.632 -14.103 -0.867 1.00 0.00 C ATOM 0 H THR A 96 -10.040 -13.375 -3.804 1.00 0.00 H new ATOM 0 HA THR A 96 -12.375 -12.163 -2.656 1.00 0.00 H new ATOM 0 HB THR A 96 -10.558 -14.282 -1.413 1.00 0.00 H new ATOM 0 HG1 THR A 96 -11.823 -15.771 -2.677 1.00 0.00 H new ATOM 0 HG21 THR A 96 -12.706 -15.133 -0.518 1.00 0.00 H new ATOM 0 HG22 THR A 96 -12.430 -13.446 -0.021 1.00 0.00 H new ATOM 0 HG23 THR A 96 -13.572 -13.811 -1.336 1.00 0.00 H new ATOM 1487 N ASP A 97 -9.572 -11.773 -0.943 1.00 0.00 N ATOM 1488 CA ASP A 97 -9.007 -10.977 0.186 1.00 0.00 C ATOM 1489 C ASP A 97 -8.966 -9.488 -0.147 1.00 0.00 C ATOM 1490 O ASP A 97 -9.297 -8.659 0.676 1.00 0.00 O ATOM 1491 CB ASP A 97 -7.587 -11.464 0.483 1.00 0.00 C ATOM 1492 CG ASP A 97 -7.639 -12.902 1.000 1.00 0.00 C ATOM 1493 OD1 ASP A 97 -7.905 -13.788 0.204 1.00 0.00 O ATOM 1494 OD2 ASP A 97 -7.412 -13.094 2.183 1.00 0.00 O ATOM 0 H ASP A 97 -8.906 -12.375 -1.427 1.00 0.00 H new ATOM 0 HA ASP A 97 -9.649 -11.115 1.056 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -6.977 -11.412 -0.419 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -7.117 -10.817 1.223 1.00 0.00 H new ATOM 1499 N LYS A 98 -8.560 -9.125 -1.329 1.00 0.00 N ATOM 1500 CA LYS A 98 -8.511 -7.674 -1.653 1.00 0.00 C ATOM 1501 C LYS A 98 -9.891 -7.067 -1.395 1.00 0.00 C ATOM 1502 O LYS A 98 -10.021 -5.891 -1.113 1.00 0.00 O ATOM 1503 CB LYS A 98 -8.101 -7.480 -3.113 1.00 0.00 C ATOM 1504 CG LYS A 98 -9.238 -7.912 -4.037 1.00 0.00 C ATOM 1505 CD LYS A 98 -9.923 -6.678 -4.632 1.00 0.00 C ATOM 1506 CE LYS A 98 -11.333 -7.049 -5.091 1.00 0.00 C ATOM 1507 NZ LYS A 98 -11.620 -6.394 -6.399 1.00 0.00 N ATOM 0 H LYS A 98 -8.265 -9.757 -2.073 1.00 0.00 H new ATOM 0 HA LYS A 98 -7.774 -7.175 -1.025 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -7.852 -6.434 -3.293 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -7.205 -8.063 -3.328 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -8.849 -8.544 -4.836 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -9.962 -8.509 -3.483 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -9.969 -5.881 -3.890 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -9.344 -6.297 -5.473 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -11.422 -8.131 -5.187 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -12.064 -6.734 -4.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -12.579 -6.647 -6.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -11.551 -5.362 -6.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -10.930 -6.716 -7.107 1.00 0.00 H new ATOM 1521 N THR A 99 -10.923 -7.864 -1.476 1.00 0.00 N ATOM 1522 CA THR A 99 -12.292 -7.337 -1.220 1.00 0.00 C ATOM 1523 C THR A 99 -12.477 -7.148 0.287 1.00 0.00 C ATOM 1524 O THR A 99 -13.213 -6.289 0.730 1.00 0.00 O ATOM 1525 CB THR A 99 -13.329 -8.334 -1.742 1.00 0.00 C ATOM 1526 OG1 THR A 99 -13.217 -8.435 -3.155 1.00 0.00 O ATOM 1527 CG2 THR A 99 -14.733 -7.853 -1.373 1.00 0.00 C ATOM 0 H THR A 99 -10.876 -8.856 -1.708 1.00 0.00 H new ATOM 0 HA THR A 99 -12.423 -6.383 -1.731 1.00 0.00 H new ATOM 0 HB THR A 99 -13.153 -9.311 -1.292 1.00 0.00 H new ATOM 0 HG1 THR A 99 -12.487 -9.048 -3.382 1.00 0.00 H new ATOM 0 HG21 THR A 99 -15.471 -8.564 -1.745 1.00 0.00 H new ATOM 0 HG22 THR A 99 -14.818 -7.776 -0.289 1.00 0.00 H new ATOM 0 HG23 THR A 99 -14.912 -6.876 -1.821 1.00 0.00 H new ATOM 1535 N LEU A 100 -11.813 -7.948 1.078 1.00 0.00 N ATOM 1536 CA LEU A 100 -11.949 -7.819 2.559 1.00 0.00 C ATOM 1537 C LEU A 100 -11.352 -6.487 3.021 1.00 0.00 C ATOM 1538 O LEU A 100 -12.020 -5.677 3.633 1.00 0.00 O ATOM 1539 CB LEU A 100 -11.205 -8.971 3.245 1.00 0.00 C ATOM 1540 CG LEU A 100 -11.877 -10.298 2.887 1.00 0.00 C ATOM 1541 CD1 LEU A 100 -11.084 -11.454 3.500 1.00 0.00 C ATOM 1542 CD2 LEU A 100 -13.304 -10.311 3.438 1.00 0.00 C ATOM 0 H LEU A 100 -11.182 -8.685 0.763 1.00 0.00 H new ATOM 0 HA LEU A 100 -13.006 -7.854 2.825 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -10.162 -8.983 2.930 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -11.210 -8.829 4.326 1.00 0.00 H new ATOM 0 HG LEU A 100 -11.904 -10.411 1.803 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -11.563 -12.399 3.245 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -10.067 -11.445 3.109 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -11.057 -11.342 4.584 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -13.784 -11.256 3.183 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -13.277 -10.198 4.522 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -13.870 -9.488 3.002 1.00 0.00 H new ATOM 1554 N VAL A 101 -10.096 -6.259 2.751 1.00 0.00 N ATOM 1555 CA VAL A 101 -9.451 -4.993 3.191 1.00 0.00 C ATOM 1556 C VAL A 101 -10.070 -3.797 2.464 1.00 0.00 C ATOM 1557 O VAL A 101 -10.053 -2.686 2.954 1.00 0.00 O ATOM 1558 CB VAL A 101 -7.960 -5.061 2.869 1.00 0.00 C ATOM 1559 CG1 VAL A 101 -7.172 -5.379 4.143 1.00 0.00 C ATOM 1560 CG2 VAL A 101 -7.714 -6.157 1.830 1.00 0.00 C ATOM 0 H VAL A 101 -9.487 -6.900 2.242 1.00 0.00 H new ATOM 0 HA VAL A 101 -9.602 -4.868 4.263 1.00 0.00 H new ATOM 0 HB VAL A 101 -7.631 -4.101 2.472 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -6.108 -5.427 3.910 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -7.347 -4.598 4.883 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -7.499 -6.338 4.543 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -6.650 -6.207 1.599 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -8.044 -7.116 2.228 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -8.272 -5.929 0.922 1.00 0.00 H new ATOM 1570 N LYS A 102 -10.610 -4.009 1.297 1.00 0.00 N ATOM 1571 CA LYS A 102 -11.218 -2.874 0.545 1.00 0.00 C ATOM 1572 C LYS A 102 -12.510 -2.424 1.233 1.00 0.00 C ATOM 1573 O LYS A 102 -12.816 -1.250 1.284 1.00 0.00 O ATOM 1574 CB LYS A 102 -11.531 -3.321 -0.884 1.00 0.00 C ATOM 1575 CG LYS A 102 -12.655 -2.454 -1.454 1.00 0.00 C ATOM 1576 CD LYS A 102 -12.602 -2.490 -2.983 1.00 0.00 C ATOM 1577 CE LYS A 102 -13.746 -1.650 -3.554 1.00 0.00 C ATOM 1578 NZ LYS A 102 -13.864 -0.381 -2.782 1.00 0.00 N ATOM 0 H LYS A 102 -10.657 -4.915 0.832 1.00 0.00 H new ATOM 0 HA LYS A 102 -10.515 -2.041 0.524 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -10.640 -3.236 -1.506 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -11.827 -4.370 -0.892 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -13.622 -2.817 -1.104 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -12.553 -1.428 -1.100 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -11.644 -2.105 -3.333 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -12.681 -3.518 -3.336 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -13.562 -1.432 -4.606 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -14.681 -2.207 -3.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -14.307 0.348 -3.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -14.450 -0.541 -1.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -12.918 -0.062 -2.491 1.00 0.00 H new ATOM 1592 N GLU A 103 -13.278 -3.345 1.748 1.00 0.00 N ATOM 1593 CA GLU A 103 -14.557 -2.962 2.412 1.00 0.00 C ATOM 1594 C GLU A 103 -14.292 -2.442 3.830 1.00 0.00 C ATOM 1595 O GLU A 103 -14.945 -1.529 4.293 1.00 0.00 O ATOM 1596 CB GLU A 103 -15.475 -4.184 2.485 1.00 0.00 C ATOM 1597 CG GLU A 103 -16.869 -3.751 2.941 1.00 0.00 C ATOM 1598 CD GLU A 103 -17.697 -4.987 3.298 1.00 0.00 C ATOM 1599 OE1 GLU A 103 -17.251 -5.751 4.140 1.00 0.00 O ATOM 1600 OE2 GLU A 103 -18.761 -5.151 2.724 1.00 0.00 O ATOM 0 H GLU A 103 -13.076 -4.345 1.738 1.00 0.00 H new ATOM 0 HA GLU A 103 -15.032 -2.172 1.831 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -15.534 -4.666 1.509 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -15.066 -4.918 3.179 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -16.792 -3.090 3.805 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -17.362 -3.186 2.150 1.00 0.00 H new ATOM 1607 N VAL A 104 -13.352 -3.019 4.529 1.00 0.00 N ATOM 1608 CA VAL A 104 -13.071 -2.552 5.919 1.00 0.00 C ATOM 1609 C VAL A 104 -12.355 -1.200 5.883 1.00 0.00 C ATOM 1610 O VAL A 104 -11.741 -0.789 6.849 1.00 0.00 O ATOM 1611 CB VAL A 104 -12.186 -3.574 6.634 1.00 0.00 C ATOM 1612 CG1 VAL A 104 -10.730 -3.366 6.218 1.00 0.00 C ATOM 1613 CG2 VAL A 104 -12.311 -3.386 8.149 1.00 0.00 C ATOM 0 H VAL A 104 -12.769 -3.789 4.201 1.00 0.00 H new ATOM 0 HA VAL A 104 -14.014 -2.445 6.454 1.00 0.00 H new ATOM 0 HB VAL A 104 -12.503 -4.581 6.363 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -10.099 -4.094 6.727 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -10.637 -3.497 5.140 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -10.414 -2.359 6.490 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -11.680 -4.114 8.659 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -11.993 -2.379 8.418 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -13.349 -3.531 8.449 1.00 0.00 H new ATOM 1623 N VAL A 105 -12.427 -0.503 4.785 1.00 0.00 N ATOM 1624 CA VAL A 105 -11.749 0.821 4.701 1.00 0.00 C ATOM 1625 C VAL A 105 -12.763 1.934 4.957 1.00 0.00 C ATOM 1626 O VAL A 105 -13.845 1.945 4.403 1.00 0.00 O ATOM 1627 CB VAL A 105 -11.141 0.998 3.310 1.00 0.00 C ATOM 1628 CG1 VAL A 105 -12.245 1.352 2.315 1.00 0.00 C ATOM 1629 CG2 VAL A 105 -10.109 2.130 3.349 1.00 0.00 C ATOM 0 H VAL A 105 -12.925 -0.791 3.943 1.00 0.00 H new ATOM 0 HA VAL A 105 -10.960 0.869 5.452 1.00 0.00 H new ATOM 0 HB VAL A 105 -10.657 0.072 3.002 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -11.813 1.479 1.322 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -12.983 0.550 2.290 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -12.728 2.280 2.622 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -9.673 2.259 2.358 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -10.596 3.056 3.655 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -9.323 1.881 4.062 1.00 0.00 H new ATOM 1639 N GLN A 106 -12.413 2.876 5.783 1.00 0.00 N ATOM 1640 CA GLN A 106 -13.340 4.001 6.073 1.00 0.00 C ATOM 1641 C GLN A 106 -12.529 5.293 6.120 1.00 0.00 C ATOM 1642 O GLN A 106 -12.850 6.218 6.841 1.00 0.00 O ATOM 1643 CB GLN A 106 -14.025 3.771 7.422 1.00 0.00 C ATOM 1644 CG GLN A 106 -13.028 3.150 8.402 1.00 0.00 C ATOM 1645 CD GLN A 106 -13.241 1.636 8.458 1.00 0.00 C ATOM 1646 OE1 GLN A 106 -12.297 0.874 8.397 1.00 0.00 O ATOM 1647 NE2 GLN A 106 -14.453 1.165 8.572 1.00 0.00 N ATOM 0 H GLN A 106 -11.519 2.915 6.273 1.00 0.00 H new ATOM 0 HA GLN A 106 -14.104 4.067 5.298 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -14.399 4.715 7.817 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -14.886 3.114 7.297 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -12.008 3.373 8.089 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -13.159 3.583 9.394 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -15.246 1.805 8.623 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -14.607 0.157 8.610 1.00 0.00 H new ATOM 1656 N ASN A 107 -11.475 5.357 5.354 1.00 0.00 N ATOM 1657 CA ASN A 107 -10.630 6.587 5.347 1.00 0.00 C ATOM 1658 C ASN A 107 -10.261 6.965 3.908 1.00 0.00 C ATOM 1659 O ASN A 107 -9.940 8.101 3.622 1.00 0.00 O ATOM 1660 CB ASN A 107 -9.349 6.331 6.147 1.00 0.00 C ATOM 1661 CG ASN A 107 -9.701 6.037 7.608 1.00 0.00 C ATOM 1662 OD1 ASN A 107 -8.744 5.937 8.491 1.00 0.00 O flip ATOM 1663 ND2 ASN A 107 -10.856 5.897 7.950 1.00 0.00 N flip ATOM 0 H ASN A 107 -11.161 4.612 4.732 1.00 0.00 H new ATOM 0 HA ASN A 107 -11.191 7.405 5.799 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -8.803 5.490 5.718 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -8.693 7.200 6.089 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -11.605 5.975 7.262 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -11.079 5.701 8.926 1.00 0.00 H new ATOM 1670 N PHE A 108 -10.290 6.026 3.000 1.00 0.00 N ATOM 1671 CA PHE A 108 -9.927 6.348 1.589 1.00 0.00 C ATOM 1672 C PHE A 108 -11.122 6.965 0.862 1.00 0.00 C ATOM 1673 O PHE A 108 -12.236 6.943 1.347 1.00 0.00 O ATOM 1674 CB PHE A 108 -9.487 5.072 0.865 1.00 0.00 C ATOM 1675 CG PHE A 108 -10.687 4.394 0.239 1.00 0.00 C ATOM 1676 CD1 PHE A 108 -11.895 4.303 0.943 1.00 0.00 C ATOM 1677 CD2 PHE A 108 -10.589 3.856 -1.051 1.00 0.00 C ATOM 1678 CE1 PHE A 108 -13.002 3.677 0.357 1.00 0.00 C ATOM 1679 CE2 PHE A 108 -11.697 3.230 -1.635 1.00 0.00 C ATOM 1680 CZ PHE A 108 -12.902 3.141 -0.932 1.00 0.00 C ATOM 0 H PHE A 108 -10.548 5.054 3.173 1.00 0.00 H new ATOM 0 HA PHE A 108 -9.107 7.066 1.592 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -8.753 5.314 0.096 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -9.001 4.395 1.567 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -11.972 4.716 1.938 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -9.659 3.924 -1.595 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -13.933 3.608 0.900 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -11.621 2.816 -2.629 1.00 0.00 H new ATOM 0 HZ PHE A 108 -13.756 2.658 -1.384 1.00 0.00 H new ATOM 1690 N ALA A 109 -10.894 7.511 -0.301 1.00 0.00 N ATOM 1691 CA ALA A 109 -12.008 8.128 -1.074 1.00 0.00 C ATOM 1692 C ALA A 109 -12.322 7.252 -2.289 1.00 0.00 C ATOM 1693 O ALA A 109 -13.440 7.204 -2.762 1.00 0.00 O ATOM 1694 CB ALA A 109 -11.591 9.523 -1.545 1.00 0.00 C ATOM 0 H ALA A 109 -9.980 7.556 -0.751 1.00 0.00 H new ATOM 0 HA ALA A 109 -12.892 8.209 -0.442 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -12.406 9.975 -2.111 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -11.361 10.145 -0.680 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -10.709 9.444 -2.180 1.00 0.00 H new ATOM 1700 N LYS A 110 -11.339 6.557 -2.797 1.00 0.00 N ATOM 1701 CA LYS A 110 -11.575 5.681 -3.979 1.00 0.00 C ATOM 1702 C LYS A 110 -10.431 4.671 -4.100 1.00 0.00 C ATOM 1703 O LYS A 110 -9.318 4.929 -3.685 1.00 0.00 O ATOM 1704 CB LYS A 110 -11.633 6.540 -5.246 1.00 0.00 C ATOM 1705 CG LYS A 110 -12.171 5.701 -6.408 1.00 0.00 C ATOM 1706 CD LYS A 110 -11.909 6.426 -7.731 1.00 0.00 C ATOM 1707 CE LYS A 110 -12.855 7.622 -7.860 1.00 0.00 C ATOM 1708 NZ LYS A 110 -14.259 7.171 -7.646 1.00 0.00 N ATOM 0 H LYS A 110 -10.382 6.559 -2.443 1.00 0.00 H new ATOM 0 HA LYS A 110 -12.519 5.149 -3.856 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -12.274 7.406 -5.082 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -10.640 6.919 -5.487 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -11.690 4.723 -6.416 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -13.240 5.530 -6.281 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -10.873 6.763 -7.773 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -12.056 5.742 -8.567 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -12.592 8.387 -7.130 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -12.754 8.075 -8.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -14.909 7.814 -8.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -14.375 6.207 -8.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -14.474 7.177 -6.629 1.00 0.00 H new ATOM 1722 N GLU A 111 -10.697 3.522 -4.661 1.00 0.00 N ATOM 1723 CA GLU A 111 -9.625 2.495 -4.806 1.00 0.00 C ATOM 1724 C GLU A 111 -9.167 2.447 -6.264 1.00 0.00 C ATOM 1725 O GLU A 111 -9.905 2.793 -7.166 1.00 0.00 O ATOM 1726 CB GLU A 111 -10.172 1.125 -4.397 1.00 0.00 C ATOM 1727 CG GLU A 111 -11.531 0.898 -5.063 1.00 0.00 C ATOM 1728 CD GLU A 111 -11.504 -0.421 -5.838 1.00 0.00 C ATOM 1729 OE1 GLU A 111 -10.879 -1.353 -5.362 1.00 0.00 O ATOM 1730 OE2 GLU A 111 -12.111 -0.475 -6.896 1.00 0.00 O ATOM 0 H GLU A 111 -11.610 3.250 -5.025 1.00 0.00 H new ATOM 0 HA GLU A 111 -8.781 2.753 -4.166 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -9.475 0.341 -4.692 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -10.273 1.071 -3.313 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -12.318 0.873 -4.309 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -11.760 1.724 -5.737 1.00 0.00 H new ATOM 1737 N PHE A 112 -7.953 2.028 -6.504 1.00 0.00 N ATOM 1738 CA PHE A 112 -7.453 1.970 -7.905 1.00 0.00 C ATOM 1739 C PHE A 112 -6.698 0.658 -8.135 1.00 0.00 C ATOM 1740 O PHE A 112 -6.240 0.023 -7.207 1.00 0.00 O ATOM 1741 CB PHE A 112 -6.515 3.152 -8.152 1.00 0.00 C ATOM 1742 CG PHE A 112 -7.323 4.328 -8.647 1.00 0.00 C ATOM 1743 CD1 PHE A 112 -7.752 4.371 -9.980 1.00 0.00 C ATOM 1744 CD2 PHE A 112 -7.648 5.370 -7.772 1.00 0.00 C ATOM 1745 CE1 PHE A 112 -8.508 5.457 -10.436 1.00 0.00 C ATOM 1746 CE2 PHE A 112 -8.402 6.457 -8.229 1.00 0.00 C ATOM 1747 CZ PHE A 112 -8.832 6.500 -9.561 1.00 0.00 C ATOM 0 H PHE A 112 -7.289 1.725 -5.792 1.00 0.00 H new ATOM 0 HA PHE A 112 -8.296 2.019 -8.594 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -5.992 3.415 -7.233 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -5.755 2.882 -8.885 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -7.500 3.567 -10.655 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -7.317 5.336 -6.744 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -8.841 5.490 -11.463 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -8.652 7.262 -7.554 1.00 0.00 H new ATOM 0 HZ PHE A 112 -9.414 7.339 -9.913 1.00 0.00 H new ATOM 1757 N VAL A 113 -6.562 0.256 -9.371 1.00 0.00 N ATOM 1758 CA VAL A 113 -5.830 -1.005 -9.680 1.00 0.00 C ATOM 1759 C VAL A 113 -4.665 -0.678 -10.613 1.00 0.00 C ATOM 1760 O VAL A 113 -4.770 0.185 -11.462 1.00 0.00 O ATOM 1761 CB VAL A 113 -6.775 -1.992 -10.367 1.00 0.00 C ATOM 1762 CG1 VAL A 113 -7.494 -1.291 -11.521 1.00 0.00 C ATOM 1763 CG2 VAL A 113 -5.970 -3.174 -10.912 1.00 0.00 C ATOM 0 H VAL A 113 -6.929 0.751 -10.184 1.00 0.00 H new ATOM 0 HA VAL A 113 -5.456 -1.453 -8.759 1.00 0.00 H new ATOM 0 HB VAL A 113 -7.509 -2.353 -9.647 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -8.168 -1.994 -12.011 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -8.067 -0.449 -11.134 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -6.760 -0.930 -12.241 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -6.643 -3.878 -11.402 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -5.236 -2.813 -11.632 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -5.457 -3.674 -10.091 1.00 0.00 H new ATOM 1773 N ILE A 114 -3.553 -1.350 -10.465 1.00 0.00 N ATOM 1774 CA ILE A 114 -2.386 -1.060 -11.348 1.00 0.00 C ATOM 1775 C ILE A 114 -1.855 -2.355 -11.962 1.00 0.00 C ATOM 1776 O ILE A 114 -2.070 -3.437 -11.452 1.00 0.00 O ATOM 1777 CB ILE A 114 -1.272 -0.402 -10.532 1.00 0.00 C ATOM 1778 CG1 ILE A 114 -1.792 0.885 -9.882 1.00 0.00 C ATOM 1779 CG2 ILE A 114 -0.102 -0.069 -11.455 1.00 0.00 C ATOM 1780 CD1 ILE A 114 -1.668 2.054 -10.865 1.00 0.00 C ATOM 0 H ILE A 114 -3.403 -2.084 -9.773 1.00 0.00 H new ATOM 0 HA ILE A 114 -2.709 -0.388 -12.143 1.00 0.00 H new ATOM 0 HB ILE A 114 -0.943 -1.088 -9.752 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -2.833 0.758 -9.585 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -1.226 1.099 -8.976 1.00 0.00 H new ATOM 0 HG21 ILE A 114 0.695 0.400 -10.878 1.00 0.00 H new ATOM 0 HG22 ILE A 114 0.272 -0.985 -11.913 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -0.437 0.615 -12.234 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -2.040 2.965 -10.396 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -0.622 2.188 -11.140 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -2.254 1.841 -11.759 1.00 0.00 H new ATOM 1792 N SER A 115 -1.149 -2.243 -13.054 1.00 0.00 N ATOM 1793 CA SER A 115 -0.579 -3.450 -13.714 1.00 0.00 C ATOM 1794 C SER A 115 0.844 -3.133 -14.184 1.00 0.00 C ATOM 1795 O SER A 115 1.505 -3.954 -14.790 1.00 0.00 O ATOM 1796 CB SER A 115 -1.442 -3.832 -14.917 1.00 0.00 C ATOM 1797 OG SER A 115 -1.426 -2.770 -15.862 1.00 0.00 O ATOM 0 H SER A 115 -0.942 -1.360 -13.520 1.00 0.00 H new ATOM 0 HA SER A 115 -0.559 -4.282 -13.010 1.00 0.00 H new ATOM 0 HB2 SER A 115 -1.065 -4.747 -15.374 1.00 0.00 H new ATOM 0 HB3 SER A 115 -2.464 -4.034 -14.597 1.00 0.00 H new ATOM 0 HG SER A 115 -1.977 -3.012 -16.636 1.00 0.00 H new ATOM 1803 N ASP A 116 1.320 -1.948 -13.909 1.00 0.00 N ATOM 1804 CA ASP A 116 2.697 -1.575 -14.338 1.00 0.00 C ATOM 1805 C ASP A 116 3.328 -0.658 -13.286 1.00 0.00 C ATOM 1806 O ASP A 116 2.640 0.027 -12.555 1.00 0.00 O ATOM 1807 CB ASP A 116 2.635 -0.845 -15.680 1.00 0.00 C ATOM 1808 CG ASP A 116 2.753 -1.858 -16.820 1.00 0.00 C ATOM 1809 OD1 ASP A 116 3.666 -2.666 -16.776 1.00 0.00 O ATOM 1810 OD2 ASP A 116 1.928 -1.809 -17.718 1.00 0.00 O ATOM 0 H ASP A 116 0.812 -1.221 -13.404 1.00 0.00 H new ATOM 0 HA ASP A 116 3.301 -2.476 -14.444 1.00 0.00 H new ATOM 0 HB2 ASP A 116 1.697 -0.295 -15.764 1.00 0.00 H new ATOM 0 HB3 ASP A 116 3.440 -0.113 -15.745 1.00 0.00 H new ATOM 1815 N ARG A 117 4.630 -0.643 -13.199 1.00 0.00 N ATOM 1816 CA ARG A 117 5.301 0.224 -12.189 1.00 0.00 C ATOM 1817 C ARG A 117 5.221 1.689 -12.626 1.00 0.00 C ATOM 1818 O ARG A 117 5.163 2.586 -11.808 1.00 0.00 O ATOM 1819 CB ARG A 117 6.769 -0.188 -12.060 1.00 0.00 C ATOM 1820 CG ARG A 117 7.301 0.237 -10.689 1.00 0.00 C ATOM 1821 CD ARG A 117 8.787 -0.116 -10.587 1.00 0.00 C ATOM 1822 NE ARG A 117 9.593 0.923 -11.288 1.00 0.00 N ATOM 1823 CZ ARG A 117 10.880 0.998 -11.084 1.00 0.00 C ATOM 1824 NH1 ARG A 117 11.460 0.164 -10.264 1.00 0.00 N ATOM 1825 NH2 ARG A 117 11.585 1.907 -11.698 1.00 0.00 N ATOM 0 H ARG A 117 5.258 -1.194 -13.784 1.00 0.00 H new ATOM 0 HA ARG A 117 4.801 0.108 -11.227 1.00 0.00 H new ATOM 0 HB2 ARG A 117 6.867 -1.267 -12.181 1.00 0.00 H new ATOM 0 HB3 ARG A 117 7.359 0.276 -12.850 1.00 0.00 H new ATOM 0 HG2 ARG A 117 7.160 1.309 -10.549 1.00 0.00 H new ATOM 0 HG3 ARG A 117 6.742 -0.264 -9.899 1.00 0.00 H new ATOM 0 HD2 ARG A 117 9.086 -0.179 -9.541 1.00 0.00 H new ATOM 0 HD3 ARG A 117 8.971 -1.095 -11.030 1.00 0.00 H new ATOM 0 HE ARG A 117 9.139 1.575 -11.927 1.00 0.00 H new ATOM 0 HH11 ARG A 117 10.907 -0.546 -9.783 1.00 0.00 H new ATOM 0 HH12 ARG A 117 12.466 0.222 -10.104 1.00 0.00 H new ATOM 0 HH21 ARG A 117 11.131 2.559 -12.337 1.00 0.00 H new ATOM 0 HH22 ARG A 117 12.591 1.966 -11.539 1.00 0.00 H new ATOM 1839 N LYS A 118 5.219 1.942 -13.905 1.00 0.00 N ATOM 1840 CA LYS A 118 5.144 3.351 -14.386 1.00 0.00 C ATOM 1841 C LYS A 118 3.708 3.860 -14.252 1.00 0.00 C ATOM 1842 O LYS A 118 3.430 5.024 -14.466 1.00 0.00 O ATOM 1843 CB LYS A 118 5.571 3.413 -15.853 1.00 0.00 C ATOM 1844 CG LYS A 118 6.975 2.823 -16.002 1.00 0.00 C ATOM 1845 CD LYS A 118 7.404 2.890 -17.469 1.00 0.00 C ATOM 1846 CE LYS A 118 8.814 2.316 -17.615 1.00 0.00 C ATOM 1847 NZ LYS A 118 9.393 2.746 -18.920 1.00 0.00 N ATOM 0 H LYS A 118 5.266 1.235 -14.638 1.00 0.00 H new ATOM 0 HA LYS A 118 5.808 3.974 -13.787 1.00 0.00 H new ATOM 0 HB2 LYS A 118 4.865 2.859 -16.472 1.00 0.00 H new ATOM 0 HB3 LYS A 118 5.560 4.445 -16.203 1.00 0.00 H new ATOM 0 HG2 LYS A 118 7.680 3.374 -15.380 1.00 0.00 H new ATOM 0 HG3 LYS A 118 6.985 1.789 -15.656 1.00 0.00 H new ATOM 0 HD2 LYS A 118 6.705 2.329 -18.089 1.00 0.00 H new ATOM 0 HD3 LYS A 118 7.382 3.922 -17.819 1.00 0.00 H new ATOM 0 HE2 LYS A 118 9.445 2.659 -16.795 1.00 0.00 H new ATOM 0 HE3 LYS A 118 8.783 1.228 -17.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 10.352 2.356 -19.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 8.795 2.398 -19.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 9.436 3.784 -18.955 1.00 0.00 H new ATOM 1861 N GLU A 119 2.791 3.002 -13.901 1.00 0.00 N ATOM 1862 CA GLU A 119 1.375 3.442 -13.759 1.00 0.00 C ATOM 1863 C GLU A 119 1.142 3.992 -12.348 1.00 0.00 C ATOM 1864 O GLU A 119 0.040 4.353 -11.989 1.00 0.00 O ATOM 1865 CB GLU A 119 0.445 2.254 -14.006 1.00 0.00 C ATOM 1866 CG GLU A 119 -0.011 2.257 -15.467 1.00 0.00 C ATOM 1867 CD GLU A 119 -1.033 3.375 -15.680 1.00 0.00 C ATOM 1868 OE1 GLU A 119 -0.617 4.483 -15.972 1.00 0.00 O ATOM 1869 OE2 GLU A 119 -2.215 3.103 -15.548 1.00 0.00 O ATOM 0 H GLU A 119 2.961 2.015 -13.706 1.00 0.00 H new ATOM 0 HA GLU A 119 1.166 4.225 -14.488 1.00 0.00 H new ATOM 0 HB2 GLU A 119 0.961 1.321 -13.777 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -0.419 2.311 -13.344 1.00 0.00 H new ATOM 0 HG2 GLU A 119 0.845 2.402 -16.126 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -0.451 1.293 -15.724 1.00 0.00 H new ATOM 1876 N LEU A 120 2.172 4.061 -11.548 1.00 0.00 N ATOM 1877 CA LEU A 120 2.011 4.592 -10.163 1.00 0.00 C ATOM 1878 C LEU A 120 2.616 5.993 -10.094 1.00 0.00 C ATOM 1879 O LEU A 120 2.835 6.536 -9.030 1.00 0.00 O ATOM 1880 CB LEU A 120 2.730 3.672 -9.174 1.00 0.00 C ATOM 1881 CG LEU A 120 1.730 2.677 -8.583 1.00 0.00 C ATOM 1882 CD1 LEU A 120 2.464 1.404 -8.155 1.00 0.00 C ATOM 1883 CD2 LEU A 120 1.048 3.303 -7.366 1.00 0.00 C ATOM 0 H LEU A 120 3.119 3.772 -11.794 1.00 0.00 H new ATOM 0 HA LEU A 120 0.953 4.635 -9.906 1.00 0.00 H new ATOM 0 HB2 LEU A 120 3.536 3.138 -9.678 1.00 0.00 H new ATOM 0 HB3 LEU A 120 3.186 4.261 -8.379 1.00 0.00 H new ATOM 0 HG LEU A 120 0.981 2.428 -9.334 1.00 0.00 H new ATOM 0 HD11 LEU A 120 1.750 0.696 -7.734 1.00 0.00 H new ATOM 0 HD12 LEU A 120 2.951 0.956 -9.021 1.00 0.00 H new ATOM 0 HD13 LEU A 120 3.215 1.652 -7.404 1.00 0.00 H new ATOM 0 HD21 LEU A 120 0.335 2.595 -6.944 1.00 0.00 H new ATOM 0 HD22 LEU A 120 1.799 3.552 -6.616 1.00 0.00 H new ATOM 0 HD23 LEU A 120 0.523 4.209 -7.669 1.00 0.00 H new ATOM 1895 N GLU A 121 2.886 6.579 -11.226 1.00 0.00 N ATOM 1896 CA GLU A 121 3.477 7.942 -11.246 1.00 0.00 C ATOM 1897 C GLU A 121 2.486 8.945 -10.653 1.00 0.00 C ATOM 1898 O GLU A 121 1.288 8.790 -10.764 1.00 0.00 O ATOM 1899 CB GLU A 121 3.786 8.321 -12.692 1.00 0.00 C ATOM 1900 CG GLU A 121 4.792 7.329 -13.277 1.00 0.00 C ATOM 1901 CD GLU A 121 4.710 7.358 -14.804 1.00 0.00 C ATOM 1902 OE1 GLU A 121 3.913 8.124 -15.320 1.00 0.00 O ATOM 1903 OE2 GLU A 121 5.445 6.613 -15.432 1.00 0.00 O ATOM 0 H GLU A 121 2.721 6.168 -12.145 1.00 0.00 H new ATOM 0 HA GLU A 121 4.392 7.957 -10.653 1.00 0.00 H new ATOM 0 HB2 GLU A 121 2.870 8.318 -13.283 1.00 0.00 H new ATOM 0 HB3 GLU A 121 4.190 9.333 -12.735 1.00 0.00 H new ATOM 0 HG2 GLU A 121 5.801 7.584 -12.952 1.00 0.00 H new ATOM 0 HG3 GLU A 121 4.583 6.324 -12.910 1.00 0.00 H new ATOM 1910 N GLU A 122 2.978 9.975 -10.023 1.00 0.00 N ATOM 1911 CA GLU A 122 2.063 10.985 -9.424 1.00 0.00 C ATOM 1912 C GLU A 122 1.181 11.590 -10.518 1.00 0.00 C ATOM 1913 O GLU A 122 -0.027 11.636 -10.400 1.00 0.00 O ATOM 1914 CB GLU A 122 2.886 12.095 -8.764 1.00 0.00 C ATOM 1915 CG GLU A 122 4.226 11.528 -8.290 1.00 0.00 C ATOM 1916 CD GLU A 122 4.709 12.312 -7.069 1.00 0.00 C ATOM 1917 OE1 GLU A 122 4.034 12.264 -6.053 1.00 0.00 O ATOM 1918 OE2 GLU A 122 5.746 12.947 -7.169 1.00 0.00 O ATOM 0 H GLU A 122 3.973 10.161 -9.897 1.00 0.00 H new ATOM 0 HA GLU A 122 1.435 10.503 -8.675 1.00 0.00 H new ATOM 0 HB2 GLU A 122 3.053 12.907 -9.471 1.00 0.00 H new ATOM 0 HB3 GLU A 122 2.338 12.515 -7.920 1.00 0.00 H new ATOM 0 HG2 GLU A 122 4.118 10.473 -8.038 1.00 0.00 H new ATOM 0 HG3 GLU A 122 4.963 11.591 -9.091 1.00 0.00 H new ATOM 1925 N ASP A 123 1.777 12.061 -11.579 1.00 0.00 N ATOM 1926 CA ASP A 123 0.975 12.674 -12.679 1.00 0.00 C ATOM 1927 C ASP A 123 -0.085 11.681 -13.161 1.00 0.00 C ATOM 1928 O ASP A 123 -1.087 12.056 -13.739 1.00 0.00 O ATOM 1929 CB ASP A 123 1.899 13.035 -13.843 1.00 0.00 C ATOM 1930 CG ASP A 123 1.081 13.674 -14.967 1.00 0.00 C ATOM 1931 OD1 ASP A 123 0.573 12.936 -15.796 1.00 0.00 O ATOM 1932 OD2 ASP A 123 0.975 14.889 -14.979 1.00 0.00 O ATOM 0 H ASP A 123 2.785 12.048 -11.733 1.00 0.00 H new ATOM 0 HA ASP A 123 0.485 13.574 -12.308 1.00 0.00 H new ATOM 0 HB2 ASP A 123 2.673 13.724 -13.506 1.00 0.00 H new ATOM 0 HB3 ASP A 123 2.405 12.142 -14.210 1.00 0.00 H new ATOM 1937 N PHE A 124 0.125 10.418 -12.921 1.00 0.00 N ATOM 1938 CA PHE A 124 -0.872 9.401 -13.359 1.00 0.00 C ATOM 1939 C PHE A 124 -1.958 9.280 -12.302 1.00 0.00 C ATOM 1940 O PHE A 124 -3.138 9.313 -12.588 1.00 0.00 O ATOM 1941 CB PHE A 124 -0.195 8.044 -13.504 1.00 0.00 C ATOM 1942 CG PHE A 124 -1.257 6.987 -13.688 1.00 0.00 C ATOM 1943 CD1 PHE A 124 -1.881 6.823 -14.930 1.00 0.00 C ATOM 1944 CD2 PHE A 124 -1.628 6.180 -12.607 1.00 0.00 C ATOM 1945 CE1 PHE A 124 -2.874 5.849 -15.090 1.00 0.00 C ATOM 1946 CE2 PHE A 124 -2.622 5.210 -12.765 1.00 0.00 C ATOM 1947 CZ PHE A 124 -3.245 5.044 -14.006 1.00 0.00 C ATOM 0 H PHE A 124 0.944 10.045 -12.440 1.00 0.00 H new ATOM 0 HA PHE A 124 -1.298 9.708 -14.314 1.00 0.00 H new ATOM 0 HB2 PHE A 124 0.483 8.050 -14.357 1.00 0.00 H new ATOM 0 HB3 PHE A 124 0.406 7.826 -12.621 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -1.597 7.447 -15.764 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -1.146 6.307 -11.649 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -3.354 5.719 -16.049 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -2.909 4.589 -11.929 1.00 0.00 H new ATOM 0 HZ PHE A 124 -4.013 4.294 -14.128 1.00 0.00 H new ATOM 1957 N ILE A 125 -1.553 9.136 -11.080 1.00 0.00 N ATOM 1958 CA ILE A 125 -2.541 9.004 -9.976 1.00 0.00 C ATOM 1959 C ILE A 125 -3.259 10.339 -9.779 1.00 0.00 C ATOM 1960 O ILE A 125 -4.259 10.423 -9.095 1.00 0.00 O ATOM 1961 CB ILE A 125 -1.830 8.616 -8.674 1.00 0.00 C ATOM 1962 CG1 ILE A 125 -0.880 7.437 -8.919 1.00 0.00 C ATOM 1963 CG2 ILE A 125 -2.873 8.211 -7.631 1.00 0.00 C ATOM 1964 CD1 ILE A 125 -1.667 6.126 -8.857 1.00 0.00 C ATOM 0 H ILE A 125 -0.575 9.103 -10.792 1.00 0.00 H new ATOM 0 HA ILE A 125 -3.261 8.228 -10.234 1.00 0.00 H new ATOM 0 HB ILE A 125 -1.254 9.470 -8.316 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -0.400 7.539 -9.892 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -0.087 7.433 -8.171 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -2.372 7.934 -6.704 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -3.545 9.049 -7.444 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -3.447 7.361 -8.001 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -0.992 5.288 -9.031 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -2.127 6.024 -7.874 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -2.444 6.131 -9.622 1.00 0.00 H new ATOM 1976 N ARG A 126 -2.759 11.386 -10.374 1.00 0.00 N ATOM 1977 CA ARG A 126 -3.418 12.713 -10.222 1.00 0.00 C ATOM 1978 C ARG A 126 -4.585 12.824 -11.207 1.00 0.00 C ATOM 1979 O ARG A 126 -5.687 13.186 -10.843 1.00 0.00 O ATOM 1980 CB ARG A 126 -2.403 13.822 -10.508 1.00 0.00 C ATOM 1981 CG ARG A 126 -3.036 15.182 -10.213 1.00 0.00 C ATOM 1982 CD ARG A 126 -2.043 16.293 -10.561 1.00 0.00 C ATOM 1983 NE ARG A 126 -2.768 17.590 -10.672 1.00 0.00 N ATOM 1984 CZ ARG A 126 -2.102 18.713 -10.666 1.00 0.00 C ATOM 1985 NH1 ARG A 126 -0.801 18.699 -10.565 1.00 0.00 N ATOM 1986 NH2 ARG A 126 -2.736 19.848 -10.763 1.00 0.00 N ATOM 0 H ARG A 126 -1.923 11.380 -10.959 1.00 0.00 H new ATOM 0 HA ARG A 126 -3.793 12.815 -9.204 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -1.513 13.682 -9.894 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -2.082 13.776 -11.549 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -3.951 15.303 -10.793 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -3.315 15.245 -9.161 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -1.272 16.360 -9.794 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -1.539 16.064 -11.500 1.00 0.00 H new ATOM 0 HE ARG A 126 -3.785 17.601 -10.753 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -0.305 17.811 -10.491 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -0.280 19.576 -10.560 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -3.753 19.859 -10.844 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -2.215 20.725 -10.758 1.00 0.00 H new ATOM 2000 N SER A 127 -4.348 12.530 -12.456 1.00 0.00 N ATOM 2001 CA SER A 127 -5.435 12.633 -13.473 1.00 0.00 C ATOM 2002 C SER A 127 -6.554 11.633 -13.164 1.00 0.00 C ATOM 2003 O SER A 127 -7.687 11.820 -13.563 1.00 0.00 O ATOM 2004 CB SER A 127 -4.861 12.337 -14.858 1.00 0.00 C ATOM 2005 OG SER A 127 -5.425 13.236 -15.803 1.00 0.00 O ATOM 0 H SER A 127 -3.446 12.222 -12.818 1.00 0.00 H new ATOM 0 HA SER A 127 -5.847 13.642 -13.448 1.00 0.00 H new ATOM 0 HB2 SER A 127 -3.776 12.440 -14.844 1.00 0.00 H new ATOM 0 HB3 SER A 127 -5.080 11.308 -15.143 1.00 0.00 H new ATOM 0 HG SER A 127 -5.057 13.049 -16.692 1.00 0.00 H new ATOM 2011 N GLU A 128 -6.256 10.575 -12.461 1.00 0.00 N ATOM 2012 CA GLU A 128 -7.323 9.581 -12.144 1.00 0.00 C ATOM 2013 C GLU A 128 -8.077 10.017 -10.889 1.00 0.00 C ATOM 2014 O GLU A 128 -9.282 9.890 -10.804 1.00 0.00 O ATOM 2015 CB GLU A 128 -6.706 8.192 -11.936 1.00 0.00 C ATOM 2016 CG GLU A 128 -6.094 8.089 -10.537 1.00 0.00 C ATOM 2017 CD GLU A 128 -5.312 6.778 -10.423 1.00 0.00 C ATOM 2018 OE1 GLU A 128 -4.769 6.346 -11.426 1.00 0.00 O ATOM 2019 OE2 GLU A 128 -5.270 6.230 -9.334 1.00 0.00 O ATOM 0 H GLU A 128 -5.330 10.356 -12.095 1.00 0.00 H new ATOM 0 HA GLU A 128 -8.022 9.529 -12.979 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -7.469 7.424 -12.064 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -5.940 8.010 -12.690 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -5.434 8.937 -10.353 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -6.878 8.125 -9.781 1.00 0.00 H new ATOM 2026 N LEU A 129 -7.383 10.530 -9.912 1.00 0.00 N ATOM 2027 CA LEU A 129 -8.077 10.970 -8.672 1.00 0.00 C ATOM 2028 C LEU A 129 -8.795 12.281 -8.955 1.00 0.00 C ATOM 2029 O LEU A 129 -9.889 12.516 -8.479 1.00 0.00 O ATOM 2030 CB LEU A 129 -7.061 11.166 -7.543 1.00 0.00 C ATOM 2031 CG LEU A 129 -7.099 9.962 -6.599 1.00 0.00 C ATOM 2032 CD1 LEU A 129 -5.991 10.099 -5.554 1.00 0.00 C ATOM 2033 CD2 LEU A 129 -8.457 9.905 -5.892 1.00 0.00 C ATOM 0 H LEU A 129 -6.372 10.663 -9.918 1.00 0.00 H new ATOM 0 HA LEU A 129 -8.796 10.211 -8.363 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -6.060 11.283 -7.958 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -7.287 12.079 -6.992 1.00 0.00 H new ATOM 0 HG LEU A 129 -6.950 9.048 -7.174 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -6.017 9.242 -4.881 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -5.023 10.139 -6.053 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -6.142 11.014 -4.982 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -8.482 9.047 -5.220 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -8.607 10.819 -5.318 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -9.250 9.808 -6.634 1.00 0.00 H new ATOM 2045 N LYS A 130 -8.213 13.127 -9.755 1.00 0.00 N ATOM 2046 CA LYS A 130 -8.884 14.399 -10.097 1.00 0.00 C ATOM 2047 C LYS A 130 -10.283 14.048 -10.616 1.00 0.00 C ATOM 2048 O LYS A 130 -11.136 14.893 -10.800 1.00 0.00 O ATOM 2049 CB LYS A 130 -8.028 15.098 -11.167 1.00 0.00 C ATOM 2050 CG LYS A 130 -8.857 16.060 -12.021 1.00 0.00 C ATOM 2051 CD LYS A 130 -9.323 15.347 -13.296 1.00 0.00 C ATOM 2052 CE LYS A 130 -10.011 16.354 -14.221 1.00 0.00 C ATOM 2053 NZ LYS A 130 -11.468 16.049 -14.292 1.00 0.00 N ATOM 0 H LYS A 130 -7.299 12.988 -10.186 1.00 0.00 H new ATOM 0 HA LYS A 130 -8.988 15.072 -9.246 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -7.219 15.646 -10.684 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -7.566 14.348 -11.809 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -9.719 16.414 -11.455 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -8.263 16.937 -12.279 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -8.472 14.893 -13.804 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -10.011 14.540 -13.044 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -9.858 17.368 -13.850 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -9.570 16.309 -15.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -11.763 15.993 -15.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -11.656 15.140 -13.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -12.004 16.801 -13.814 1.00 0.00 H new ATOM 2067 N LYS A 131 -10.516 12.777 -10.840 1.00 0.00 N ATOM 2068 CA LYS A 131 -11.842 12.316 -11.336 1.00 0.00 C ATOM 2069 C LYS A 131 -12.115 12.937 -12.698 1.00 0.00 C ATOM 2070 O LYS A 131 -12.409 14.109 -12.820 1.00 0.00 O ATOM 2071 CB LYS A 131 -12.943 12.699 -10.339 1.00 0.00 C ATOM 2072 CG LYS A 131 -14.260 12.969 -11.075 1.00 0.00 C ATOM 2073 CD LYS A 131 -15.423 12.857 -10.089 1.00 0.00 C ATOM 2074 CE LYS A 131 -16.491 13.897 -10.437 1.00 0.00 C ATOM 2075 NZ LYS A 131 -16.826 13.798 -11.886 1.00 0.00 N ATOM 0 H LYS A 131 -9.832 12.034 -10.697 1.00 0.00 H new ATOM 0 HA LYS A 131 -11.835 11.231 -11.435 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -13.082 11.896 -9.615 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -12.643 13.585 -9.779 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -14.242 13.963 -11.523 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -14.388 12.255 -11.889 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -15.850 11.855 -10.127 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -15.067 13.013 -9.071 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -17.384 13.733 -9.834 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -16.129 14.898 -10.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -17.781 14.176 -12.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -16.138 14.347 -12.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -16.793 12.802 -12.183 1.00 0.00 H new ATOM 2089 N ALA A 132 -12.015 12.150 -13.727 1.00 0.00 N ATOM 2090 CA ALA A 132 -12.269 12.681 -15.092 1.00 0.00 C ATOM 2091 C ALA A 132 -12.874 11.580 -15.964 1.00 0.00 C ATOM 2092 O ALA A 132 -12.557 11.453 -17.130 1.00 0.00 O ATOM 2093 CB ALA A 132 -10.952 13.158 -15.709 1.00 0.00 C ATOM 0 H ALA A 132 -11.768 11.161 -13.683 1.00 0.00 H new ATOM 0 HA ALA A 132 -12.964 13.518 -15.032 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -11.139 13.547 -16.710 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -10.523 13.945 -15.088 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -10.255 12.322 -15.769 1.00 0.00 H new ATOM 2099 N GLY A 133 -13.746 10.783 -15.409 1.00 0.00 N ATOM 2100 CA GLY A 133 -14.372 9.691 -16.207 1.00 0.00 C ATOM 2101 C GLY A 133 -13.284 8.900 -16.936 1.00 0.00 C ATOM 2102 O GLY A 133 -12.127 8.935 -16.568 1.00 0.00 O ATOM 0 H GLY A 133 -14.052 10.841 -14.438 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -14.941 9.029 -15.554 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -15.075 10.110 -16.927 1.00 0.00 H new ATOM 2106 N GLY A 134 -13.647 8.186 -17.967 1.00 0.00 N ATOM 2107 CA GLY A 134 -12.633 7.394 -18.718 1.00 0.00 C ATOM 2108 C GLY A 134 -13.296 6.152 -19.318 1.00 0.00 C ATOM 2109 O GLY A 134 -12.673 5.122 -19.482 1.00 0.00 O ATOM 0 H GLY A 134 -14.601 8.117 -18.321 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -12.194 8.002 -19.509 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -11.821 7.100 -18.053 1.00 0.00 H new ATOM 2113 N ALA A 135 -14.555 6.242 -19.646 1.00 0.00 N ATOM 2114 CA ALA A 135 -15.258 5.067 -20.235 1.00 0.00 C ATOM 2115 C ALA A 135 -16.480 5.544 -21.022 1.00 0.00 C ATOM 2116 O ALA A 135 -16.533 5.438 -22.230 1.00 0.00 O ATOM 2117 CB ALA A 135 -15.706 4.127 -19.115 1.00 0.00 C ATOM 0 H ALA A 135 -15.128 7.078 -19.532 1.00 0.00 H new ATOM 0 HA ALA A 135 -14.581 4.537 -20.905 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -16.220 3.268 -19.545 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -14.835 3.786 -18.556 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -16.383 4.657 -18.445 1.00 0.00 H new ATOM 2123 N ASN A 136 -17.465 6.069 -20.344 1.00 0.00 N ATOM 2124 CA ASN A 136 -18.682 6.552 -21.053 1.00 0.00 C ATOM 2125 C ASN A 136 -18.390 7.904 -21.707 1.00 0.00 C ATOM 2126 O ASN A 136 -19.049 8.306 -22.645 1.00 0.00 O ATOM 2127 CB ASN A 136 -19.829 6.707 -20.052 1.00 0.00 C ATOM 2128 CG ASN A 136 -21.159 6.766 -20.803 1.00 0.00 C ATOM 2129 OD1 ASN A 136 -21.186 6.763 -22.018 1.00 0.00 O ATOM 2130 ND2 ASN A 136 -22.275 6.817 -20.127 1.00 0.00 N ATOM 0 H ASN A 136 -17.478 6.184 -19.331 1.00 0.00 H new ATOM 0 HA ASN A 136 -18.964 5.831 -21.820 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -19.831 5.871 -19.353 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -19.691 7.614 -19.463 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -23.168 6.854 -20.619 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -22.254 6.820 -19.107 1.00 0.00 H new ATOM 2137 N TYR A 137 -17.407 8.609 -21.218 1.00 0.00 N ATOM 2138 CA TYR A 137 -17.074 9.935 -21.811 1.00 0.00 C ATOM 2139 C TYR A 137 -16.422 9.731 -23.180 1.00 0.00 C ATOM 2140 O TYR A 137 -16.448 10.603 -24.027 1.00 0.00 O ATOM 2141 CB TYR A 137 -16.103 10.677 -20.890 1.00 0.00 C ATOM 2142 CG TYR A 137 -16.689 12.019 -20.518 1.00 0.00 C ATOM 2143 CD1 TYR A 137 -17.650 12.106 -19.504 1.00 0.00 C ATOM 2144 CD2 TYR A 137 -16.268 13.175 -21.186 1.00 0.00 C ATOM 2145 CE1 TYR A 137 -18.193 13.349 -19.159 1.00 0.00 C ATOM 2146 CE2 TYR A 137 -16.811 14.419 -20.841 1.00 0.00 C ATOM 2147 CZ TYR A 137 -17.773 14.505 -19.827 1.00 0.00 C ATOM 2148 OH TYR A 137 -18.307 15.732 -19.486 1.00 0.00 O ATOM 0 H TYR A 137 -16.820 8.324 -20.434 1.00 0.00 H new ATOM 0 HA TYR A 137 -17.986 10.521 -21.925 1.00 0.00 H new ATOM 0 HB2 TYR A 137 -15.915 10.089 -19.992 1.00 0.00 H new ATOM 0 HB3 TYR A 137 -15.143 10.813 -21.389 1.00 0.00 H new ATOM 0 HD1 TYR A 137 -17.973 11.214 -18.988 1.00 0.00 H new ATOM 0 HD2 TYR A 137 -15.525 13.108 -21.967 1.00 0.00 H new ATOM 0 HE1 TYR A 137 -18.936 13.416 -18.378 1.00 0.00 H new ATOM 0 HE2 TYR A 137 -16.488 15.311 -21.357 1.00 0.00 H new ATOM 0 HH TYR A 137 -17.906 16.430 -20.045 1.00 0.00 H new ATOM 2158 N ASP A 138 -15.836 8.587 -23.405 1.00 0.00 N ATOM 2159 CA ASP A 138 -15.184 8.328 -24.720 1.00 0.00 C ATOM 2160 C ASP A 138 -15.183 6.825 -25.002 1.00 0.00 C ATOM 2161 O ASP A 138 -14.153 6.180 -24.979 1.00 0.00 O ATOM 2162 CB ASP A 138 -13.743 8.842 -24.683 1.00 0.00 C ATOM 2163 CG ASP A 138 -13.182 8.690 -23.268 1.00 0.00 C ATOM 2164 OD1 ASP A 138 -13.785 9.224 -22.353 1.00 0.00 O ATOM 2165 OD2 ASP A 138 -12.159 8.041 -23.124 1.00 0.00 O ATOM 0 H ASP A 138 -15.780 7.820 -22.735 1.00 0.00 H new ATOM 0 HA ASP A 138 -15.734 8.844 -25.507 1.00 0.00 H new ATOM 0 HB2 ASP A 138 -13.129 8.285 -25.391 1.00 0.00 H new ATOM 0 HB3 ASP A 138 -13.711 9.888 -24.988 1.00 0.00 H new ATOM 2170 N ALA A 139 -16.329 6.260 -25.268 1.00 0.00 N ATOM 2171 CA ALA A 139 -16.392 4.799 -25.550 1.00 0.00 C ATOM 2172 C ALA A 139 -15.934 4.538 -26.987 1.00 0.00 C ATOM 2173 O ALA A 139 -15.016 3.780 -27.227 1.00 0.00 O ATOM 2174 CB ALA A 139 -17.831 4.308 -25.377 1.00 0.00 C ATOM 0 H ALA A 139 -17.224 6.748 -25.302 1.00 0.00 H new ATOM 0 HA ALA A 139 -15.740 4.266 -24.857 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -17.878 3.239 -25.583 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -18.159 4.495 -24.354 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -18.483 4.840 -26.070 1.00 0.00 H new ATOM 2180 N GLN A 140 -16.568 5.159 -27.944 1.00 0.00 N ATOM 2181 CA GLN A 140 -16.167 4.946 -29.363 1.00 0.00 C ATOM 2182 C GLN A 140 -15.045 5.919 -29.729 1.00 0.00 C ATOM 2183 O GLN A 140 -14.148 6.168 -28.948 1.00 0.00 O ATOM 2184 CB GLN A 140 -17.372 5.191 -30.275 1.00 0.00 C ATOM 2185 CG GLN A 140 -18.553 4.343 -29.800 1.00 0.00 C ATOM 2186 CD GLN A 140 -19.786 4.664 -30.647 1.00 0.00 C ATOM 2187 OE1 GLN A 140 -19.745 5.665 -31.483 1.00 0.00 O flip ATOM 2188 NE2 GLN A 140 -20.797 3.998 -30.546 1.00 0.00 N flip ATOM 0 H GLN A 140 -17.346 5.804 -27.804 1.00 0.00 H new ATOM 0 HA GLN A 140 -15.815 3.922 -29.491 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -17.641 6.247 -30.264 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -17.120 4.938 -31.305 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -18.309 3.284 -29.881 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -18.759 4.544 -28.749 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -20.829 3.215 -29.893 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -21.614 4.221 -31.115 1.00 0.00 H new ATOM 2197 N SER A 141 -15.086 6.471 -30.910 1.00 0.00 N ATOM 2198 CA SER A 141 -14.022 7.427 -31.325 1.00 0.00 C ATOM 2199 C SER A 141 -14.637 8.539 -32.176 1.00 0.00 C ATOM 2200 O SER A 141 -14.798 8.401 -33.371 1.00 0.00 O ATOM 2201 CB SER A 141 -12.962 6.687 -32.141 1.00 0.00 C ATOM 2202 OG SER A 141 -13.546 5.533 -32.732 1.00 0.00 O ATOM 0 H SER A 141 -15.812 6.301 -31.606 1.00 0.00 H new ATOM 0 HA SER A 141 -13.560 7.862 -30.439 1.00 0.00 H new ATOM 0 HB2 SER A 141 -12.559 7.341 -32.914 1.00 0.00 H new ATOM 0 HB3 SER A 141 -12.128 6.399 -31.500 1.00 0.00 H new ATOM 0 HG SER A 141 -12.870 5.057 -33.258 1.00 0.00 H new ATOM 2208 N GLU A 142 -14.982 9.641 -31.567 1.00 0.00 N ATOM 2209 CA GLU A 142 -15.587 10.760 -32.342 1.00 0.00 C ATOM 2210 C GLU A 142 -14.488 11.729 -32.783 1.00 0.00 C ATOM 2211 O GLU A 142 -13.620 12.016 -31.974 1.00 0.00 O ATOM 2212 CB GLU A 142 -16.598 11.502 -31.465 1.00 0.00 C ATOM 2213 CG GLU A 142 -17.234 12.640 -32.266 1.00 0.00 C ATOM 2214 CD GLU A 142 -18.305 13.326 -31.417 1.00 0.00 C ATOM 2215 OE1 GLU A 142 -17.942 13.976 -30.451 1.00 0.00 O ATOM 2216 OE2 GLU A 142 -19.473 13.189 -31.746 1.00 0.00 O ATOM 2217 OXT GLU A 142 -14.532 12.168 -33.920 1.00 0.00 O ATOM 0 H GLU A 142 -14.871 9.814 -30.568 1.00 0.00 H new ATOM 0 HA GLU A 142 -16.093 10.360 -33.221 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -17.368 10.813 -31.118 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -16.103 11.900 -30.579 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -16.472 13.361 -32.561 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -17.676 12.250 -33.183 1.00 0.00 H new TER 2224 GLU A 142