USER MOD reduce.3.24.130724 H: found=0, std=0, add=671, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 669 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 66 THR OG1 : rot -160:sc= 0 USER MOD Set 1.2: A 86 THR OG1 : rot 180:sc= 0.0599 USER MOD Set 2.1: A 65 ASN : amide:sc= 0.742 K(o=1.5,f=-1.3!) USER MOD Set 2.2: A 68 ASN : amide:sc= 0.803 K(o=1.5,f=-2) USER MOD Single : A 1 ALA N :NH3+ -108:sc= 0.0792 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot -82:sc= 0.00899 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot -142:sc= -1.17 USER MOD Single : A 19 GLN : amide:sc= 0.0421 X(o=0.042,f=-0.4) USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 78:sc= 0.0548 USER MOD Single : A 43 THR OG1 : rot -170:sc= -1.58 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -3 K(o=-3,f=-9.4!) USER MOD Single : A 52 ASN : amide:sc= -0.438 X(o=-0.44,f=-0.076) USER MOD Single : A 55 LYS NZ :NH3+ -167:sc= 0.813 (180deg=0.614) USER MOD Single : A 56 SER OG : rot 9:sc= 0.00601 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 ASN : amide:sc= -0.395 X(o=-0.39,f=0.0018) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 180:sc= -0.0448 USER MOD Single : A 82 TYR OH : rot 180:sc= -0.49 USER MOD Single : A 83 LYS NZ :NH3+ 157:sc= 0 (180deg=-0.463) USER MOD Single : A 85 SER OG : rot 29:sc= 0.129 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot -100:sc= -0.0534 USER MOD Single : A 89 ASN : amide:sc= -0.632 K(o=-0.63,f=-4.1!) USER MOD Single : A 91 ASN : amide:sc= -0.0932 K(o=-0.093,f=-1.6!) USER MOD Single : A 92 THR OG1 : rot -93:sc= 1.24 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 3.579 -0.059 -0.821 1.00 0.00 N ATOM 2 CA ALA A 1 3.557 0.228 -2.250 1.00 0.00 C ATOM 3 C ALA A 1 3.022 -0.961 -3.040 1.00 0.00 C ATOM 4 O ALA A 1 2.977 -2.085 -2.538 1.00 0.00 O ATOM 5 CB ALA A 1 4.950 0.602 -2.734 1.00 0.00 C ATOM 0 H1 ALA A 1 2.830 0.485 -0.346 1.00 0.00 H new ATOM 0 H2 ALA A 1 3.419 -1.075 -0.668 1.00 0.00 H new ATOM 0 H3 ALA A 1 4.504 0.208 -0.427 1.00 0.00 H new ATOM 0 HA ALA A 1 2.888 1.072 -2.416 1.00 0.00 H new ATOM 0 HB1 ALA A 1 4.919 0.814 -3.803 1.00 0.00 H new ATOM 0 HB2 ALA A 1 5.296 1.486 -2.199 1.00 0.00 H new ATOM 0 HB3 ALA A 1 5.634 -0.226 -2.548 1.00 0.00 H new ATOM 11 N LEU A 2 2.615 -0.707 -4.279 1.00 0.00 N ATOM 12 CA LEU A 2 2.081 -1.757 -5.140 1.00 0.00 C ATOM 13 C LEU A 2 3.205 -2.495 -5.860 1.00 0.00 C ATOM 14 O LEU A 2 4.016 -1.884 -6.556 1.00 0.00 O ATOM 15 CB LEU A 2 1.110 -1.162 -6.161 1.00 0.00 C ATOM 16 CG LEU A 2 0.777 -2.045 -7.364 1.00 0.00 C ATOM 17 CD1 LEU A 2 0.051 -3.305 -6.918 1.00 0.00 C ATOM 18 CD2 LEU A 2 -0.059 -1.275 -8.376 1.00 0.00 C ATOM 0 H LEU A 2 2.645 0.217 -4.710 1.00 0.00 H new ATOM 0 HA LEU A 2 1.547 -2.470 -4.513 1.00 0.00 H new ATOM 0 HB2 LEU A 2 0.180 -0.916 -5.648 1.00 0.00 H new ATOM 0 HB3 LEU A 2 1.529 -0.225 -6.528 1.00 0.00 H new ATOM 0 HG LEU A 2 1.711 -2.339 -7.843 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -0.178 -3.921 -7.788 1.00 0.00 H new ATOM 0 HD12 LEU A 2 0.685 -3.867 -6.232 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -0.876 -3.032 -6.413 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -0.286 -1.919 -9.225 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -0.988 -0.950 -7.908 1.00 0.00 H new ATOM 0 HD23 LEU A 2 0.498 -0.404 -8.720 1.00 0.00 H new ATOM 30 N SER A 3 3.246 -3.812 -5.689 1.00 0.00 N ATOM 31 CA SER A 3 4.272 -4.634 -6.321 1.00 0.00 C ATOM 32 C SER A 3 3.668 -5.509 -7.415 1.00 0.00 C ATOM 33 O SER A 3 2.589 -6.078 -7.247 1.00 0.00 O ATOM 34 CB SER A 3 4.969 -5.509 -5.278 1.00 0.00 C ATOM 35 OG SER A 3 5.917 -6.370 -5.885 1.00 0.00 O ATOM 0 H SER A 3 2.581 -4.333 -5.118 1.00 0.00 H new ATOM 0 HA SER A 3 5.007 -3.969 -6.775 1.00 0.00 H new ATOM 0 HB2 SER A 3 5.466 -4.877 -4.542 1.00 0.00 H new ATOM 0 HB3 SER A 3 4.227 -6.100 -4.741 1.00 0.00 H new ATOM 0 HG SER A 3 6.350 -6.917 -5.197 1.00 0.00 H new ATOM 41 N CYS A 4 4.373 -5.613 -8.537 1.00 0.00 N ATOM 42 CA CYS A 4 3.909 -6.418 -9.661 1.00 0.00 C ATOM 43 C CYS A 4 3.555 -7.831 -9.207 1.00 0.00 C ATOM 44 O CYS A 4 2.641 -8.456 -9.744 1.00 0.00 O ATOM 45 CB CYS A 4 4.980 -6.473 -10.752 1.00 0.00 C ATOM 46 SG CYS A 4 5.179 -4.917 -11.678 1.00 0.00 S ATOM 0 H CYS A 4 5.268 -5.150 -8.692 1.00 0.00 H new ATOM 0 HA CYS A 4 3.012 -5.950 -10.066 1.00 0.00 H new ATOM 0 HB2 CYS A 4 5.934 -6.737 -10.296 1.00 0.00 H new ATOM 0 HB3 CYS A 4 4.730 -7.270 -11.452 1.00 0.00 H new ATOM 51 N GLY A 5 4.287 -8.329 -8.215 1.00 0.00 N ATOM 52 CA GLY A 5 4.035 -9.665 -7.706 1.00 0.00 C ATOM 53 C GLY A 5 2.581 -9.881 -7.339 1.00 0.00 C ATOM 54 O GLY A 5 2.080 -11.005 -7.388 1.00 0.00 O ATOM 0 H GLY A 5 5.050 -7.832 -7.755 1.00 0.00 H new ATOM 0 HA2 GLY A 5 4.330 -10.398 -8.457 1.00 0.00 H new ATOM 0 HA3 GLY A 5 4.658 -9.840 -6.829 1.00 0.00 H new ATOM 58 N THR A 6 1.899 -8.802 -6.967 1.00 0.00 N ATOM 59 CA THR A 6 0.494 -8.879 -6.587 1.00 0.00 C ATOM 60 C THR A 6 -0.414 -8.615 -7.783 1.00 0.00 C ATOM 61 O THR A 6 -1.522 -9.146 -7.863 1.00 0.00 O ATOM 62 CB THR A 6 0.158 -7.873 -5.470 1.00 0.00 C ATOM 63 OG1 THR A 6 0.946 -8.152 -4.307 1.00 0.00 O ATOM 64 CG2 THR A 6 -1.319 -7.933 -5.114 1.00 0.00 C ATOM 0 H THR A 6 2.297 -7.864 -6.921 1.00 0.00 H new ATOM 0 HA THR A 6 0.321 -9.890 -6.219 1.00 0.00 H new ATOM 0 HB THR A 6 0.387 -6.871 -5.832 1.00 0.00 H new ATOM 0 HG1 THR A 6 0.728 -7.507 -3.602 1.00 0.00 H new ATOM 0 HG21 THR A 6 -1.532 -7.214 -4.323 1.00 0.00 H new ATOM 0 HG22 THR A 6 -1.915 -7.692 -5.994 1.00 0.00 H new ATOM 0 HG23 THR A 6 -1.570 -8.936 -4.769 1.00 0.00 H new ATOM 72 N VAL A 7 0.062 -7.790 -8.711 1.00 0.00 N ATOM 73 CA VAL A 7 -0.707 -7.457 -9.904 1.00 0.00 C ATOM 74 C VAL A 7 -0.975 -8.697 -10.749 1.00 0.00 C ATOM 75 O VAL A 7 -2.000 -8.791 -11.425 1.00 0.00 O ATOM 76 CB VAL A 7 0.021 -6.408 -10.766 1.00 0.00 C ATOM 77 CG1 VAL A 7 -0.773 -6.111 -12.029 1.00 0.00 C ATOM 78 CG2 VAL A 7 0.262 -5.137 -9.967 1.00 0.00 C ATOM 0 H VAL A 7 0.976 -7.340 -8.659 1.00 0.00 H new ATOM 0 HA VAL A 7 -1.656 -7.042 -9.564 1.00 0.00 H new ATOM 0 HB VAL A 7 0.989 -6.813 -11.061 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -0.243 -5.368 -12.625 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -0.889 -7.026 -12.609 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -1.756 -5.726 -11.759 1.00 0.00 H new ATOM 0 HG21 VAL A 7 0.777 -4.407 -10.591 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -0.693 -4.726 -9.641 1.00 0.00 H new ATOM 0 HG23 VAL A 7 0.875 -5.366 -9.095 1.00 0.00 H new ATOM 88 N SER A 8 -0.047 -9.647 -10.707 1.00 0.00 N ATOM 89 CA SER A 8 -0.181 -10.881 -11.472 1.00 0.00 C ATOM 90 C SER A 8 -1.381 -11.691 -10.991 1.00 0.00 C ATOM 91 O SER A 8 -2.031 -12.382 -11.774 1.00 0.00 O ATOM 92 CB SER A 8 1.094 -11.720 -11.355 1.00 0.00 C ATOM 93 OG SER A 8 1.085 -12.499 -10.172 1.00 0.00 O ATOM 0 H SER A 8 0.806 -9.586 -10.151 1.00 0.00 H new ATOM 0 HA SER A 8 -0.339 -10.616 -12.517 1.00 0.00 H new ATOM 0 HB2 SER A 8 1.184 -12.373 -12.223 1.00 0.00 H new ATOM 0 HB3 SER A 8 1.965 -11.065 -11.356 1.00 0.00 H new ATOM 0 HG SER A 8 1.383 -11.950 -9.417 1.00 0.00 H new ATOM 99 N ALA A 9 -1.669 -11.599 -9.697 1.00 0.00 N ATOM 100 CA ALA A 9 -2.791 -12.321 -9.110 1.00 0.00 C ATOM 101 C ALA A 9 -4.095 -11.980 -9.824 1.00 0.00 C ATOM 102 O ALA A 9 -5.043 -12.767 -9.815 1.00 0.00 O ATOM 103 CB ALA A 9 -2.903 -12.007 -7.626 1.00 0.00 C ATOM 0 H ALA A 9 -1.140 -11.031 -9.035 1.00 0.00 H new ATOM 0 HA ALA A 9 -2.608 -13.389 -9.231 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -3.745 -12.553 -7.201 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -1.985 -12.306 -7.121 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -3.060 -10.937 -7.491 1.00 0.00 H new ATOM 109 N ASP A 10 -4.137 -10.804 -10.441 1.00 0.00 N ATOM 110 CA ASP A 10 -5.326 -10.360 -11.160 1.00 0.00 C ATOM 111 C ASP A 10 -5.395 -11.001 -12.542 1.00 0.00 C ATOM 112 O ASP A 10 -6.472 -11.368 -13.015 1.00 0.00 O ATOM 113 CB ASP A 10 -5.329 -8.836 -11.290 1.00 0.00 C ATOM 114 CG ASP A 10 -5.112 -8.141 -9.960 1.00 0.00 C ATOM 115 OD1 ASP A 10 -5.976 -8.283 -9.068 1.00 0.00 O ATOM 116 OD2 ASP A 10 -4.079 -7.457 -9.810 1.00 0.00 O ATOM 0 H ASP A 10 -3.362 -10.141 -10.458 1.00 0.00 H new ATOM 0 HA ASP A 10 -6.203 -10.670 -10.591 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -4.548 -8.532 -11.987 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -6.279 -8.512 -11.715 1.00 0.00 H new ATOM 121 N LEU A 11 -4.241 -11.132 -13.187 1.00 0.00 N ATOM 122 CA LEU A 11 -4.171 -11.728 -14.517 1.00 0.00 C ATOM 123 C LEU A 11 -4.200 -13.251 -14.433 1.00 0.00 C ATOM 124 O LEU A 11 -4.373 -13.934 -15.442 1.00 0.00 O ATOM 125 CB LEU A 11 -2.901 -11.270 -15.236 1.00 0.00 C ATOM 126 CG LEU A 11 -1.654 -12.123 -15.004 1.00 0.00 C ATOM 127 CD1 LEU A 11 -1.558 -13.223 -16.050 1.00 0.00 C ATOM 128 CD2 LEU A 11 -0.403 -11.256 -15.024 1.00 0.00 C ATOM 0 H LEU A 11 -3.341 -10.834 -12.811 1.00 0.00 H new ATOM 0 HA LEU A 11 -5.042 -11.397 -15.083 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -3.104 -11.242 -16.307 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -2.681 -10.248 -14.927 1.00 0.00 H new ATOM 0 HG LEU A 11 -1.734 -12.589 -14.022 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -0.664 -13.820 -15.869 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -2.439 -13.861 -15.989 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -1.501 -12.777 -17.043 1.00 0.00 H new ATOM 0 HD21 LEU A 11 0.475 -11.880 -14.857 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -0.318 -10.762 -15.992 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -0.469 -10.504 -14.237 1.00 0.00 H new ATOM 140 N ALA A 12 -4.033 -13.775 -13.224 1.00 0.00 N ATOM 141 CA ALA A 12 -4.045 -15.217 -13.008 1.00 0.00 C ATOM 142 C ALA A 12 -5.275 -15.857 -13.641 1.00 0.00 C ATOM 143 O ALA A 12 -5.177 -16.713 -14.520 1.00 0.00 O ATOM 144 CB ALA A 12 -3.992 -15.528 -11.519 1.00 0.00 C ATOM 0 H ALA A 12 -3.888 -13.223 -12.379 1.00 0.00 H new ATOM 0 HA ALA A 12 -3.162 -15.639 -13.488 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -4.002 -16.608 -11.372 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -3.079 -15.112 -11.093 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -4.857 -15.087 -11.024 1.00 0.00 H new ATOM 150 N PRO A 13 -6.464 -15.434 -13.185 1.00 0.00 N ATOM 151 CA PRO A 13 -7.737 -15.953 -13.693 1.00 0.00 C ATOM 152 C PRO A 13 -8.016 -15.505 -15.124 1.00 0.00 C ATOM 153 O PRO A 13 -8.973 -15.958 -15.752 1.00 0.00 O ATOM 154 CB PRO A 13 -8.771 -15.358 -12.735 1.00 0.00 C ATOM 155 CG PRO A 13 -8.129 -14.122 -12.206 1.00 0.00 C ATOM 156 CD PRO A 13 -6.656 -14.416 -12.138 1.00 0.00 C ATOM 0 HA PRO A 13 -7.747 -17.042 -13.729 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -9.704 -15.130 -13.251 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -9.013 -16.054 -11.931 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -8.327 -13.270 -12.857 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -8.522 -13.869 -11.221 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -6.059 -13.525 -12.330 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -6.365 -14.789 -11.156 1.00 0.00 H new ATOM 164 N CYS A 14 -7.174 -14.613 -15.634 1.00 0.00 N ATOM 165 CA CYS A 14 -7.330 -14.102 -16.991 1.00 0.00 C ATOM 166 C CYS A 14 -6.456 -14.883 -17.969 1.00 0.00 C ATOM 167 O CYS A 14 -6.598 -14.753 -19.185 1.00 0.00 O ATOM 168 CB CYS A 14 -6.970 -12.616 -17.044 1.00 0.00 C ATOM 169 SG CYS A 14 -8.359 -11.501 -16.660 1.00 0.00 S ATOM 0 H CYS A 14 -6.376 -14.229 -15.128 1.00 0.00 H new ATOM 0 HA CYS A 14 -8.373 -14.227 -17.282 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -6.159 -12.424 -16.341 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -6.592 -12.380 -18.039 1.00 0.00 H new ATOM 174 N VAL A 15 -5.553 -15.695 -17.429 1.00 0.00 N ATOM 175 CA VAL A 15 -4.658 -16.498 -18.253 1.00 0.00 C ATOM 176 C VAL A 15 -5.432 -17.272 -19.314 1.00 0.00 C ATOM 177 O VAL A 15 -5.006 -17.366 -20.466 1.00 0.00 O ATOM 178 CB VAL A 15 -3.848 -17.492 -17.398 1.00 0.00 C ATOM 179 CG1 VAL A 15 -3.005 -18.396 -18.285 1.00 0.00 C ATOM 180 CG2 VAL A 15 -2.975 -16.746 -16.400 1.00 0.00 C ATOM 0 H VAL A 15 -5.422 -15.814 -16.424 1.00 0.00 H new ATOM 0 HA VAL A 15 -3.972 -15.806 -18.741 1.00 0.00 H new ATOM 0 HB VAL A 15 -4.545 -18.118 -16.841 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -2.440 -19.091 -17.664 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -3.656 -18.956 -18.957 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -2.314 -17.789 -18.871 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -2.410 -17.463 -15.804 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -2.284 -16.095 -16.936 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -3.605 -16.145 -15.744 1.00 0.00 H new ATOM 190 N THR A 16 -6.575 -17.826 -18.919 1.00 0.00 N ATOM 191 CA THR A 16 -7.410 -18.592 -19.835 1.00 0.00 C ATOM 192 C THR A 16 -7.739 -17.784 -21.085 1.00 0.00 C ATOM 193 O THR A 16 -7.663 -18.294 -22.203 1.00 0.00 O ATOM 194 CB THR A 16 -8.723 -19.034 -19.162 1.00 0.00 C ATOM 195 OG1 THR A 16 -9.579 -19.662 -20.123 1.00 0.00 O ATOM 196 CG2 THR A 16 -9.439 -17.845 -18.539 1.00 0.00 C ATOM 0 H THR A 16 -6.943 -17.758 -17.970 1.00 0.00 H new ATOM 0 HA THR A 16 -6.840 -19.477 -20.118 1.00 0.00 H new ATOM 0 HB THR A 16 -8.479 -19.745 -18.373 1.00 0.00 H new ATOM 0 HG1 THR A 16 -10.411 -19.941 -19.687 1.00 0.00 H new ATOM 0 HG21 THR A 16 -10.363 -18.182 -18.070 1.00 0.00 H new ATOM 0 HG22 THR A 16 -8.797 -17.387 -17.787 1.00 0.00 H new ATOM 0 HG23 THR A 16 -9.671 -17.113 -19.313 1.00 0.00 H new ATOM 204 N TYR A 17 -8.105 -16.522 -20.889 1.00 0.00 N ATOM 205 CA TYR A 17 -8.448 -15.644 -22.001 1.00 0.00 C ATOM 206 C TYR A 17 -7.198 -15.219 -22.765 1.00 0.00 C ATOM 207 O TYR A 17 -7.229 -15.050 -23.985 1.00 0.00 O ATOM 208 CB TYR A 17 -9.193 -14.409 -21.492 1.00 0.00 C ATOM 209 CG TYR A 17 -9.179 -13.250 -22.463 1.00 0.00 C ATOM 210 CD1 TYR A 17 -10.158 -13.127 -23.442 1.00 0.00 C ATOM 211 CD2 TYR A 17 -8.187 -12.279 -22.402 1.00 0.00 C ATOM 212 CE1 TYR A 17 -10.149 -12.070 -24.332 1.00 0.00 C ATOM 213 CE2 TYR A 17 -8.171 -11.218 -23.288 1.00 0.00 C ATOM 214 CZ TYR A 17 -9.153 -11.119 -24.251 1.00 0.00 C ATOM 215 OH TYR A 17 -9.142 -10.064 -25.135 1.00 0.00 O ATOM 0 H TYR A 17 -8.172 -16.084 -19.970 1.00 0.00 H new ATOM 0 HA TYR A 17 -9.097 -16.197 -22.681 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -10.227 -14.681 -21.279 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -8.747 -14.089 -20.550 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -10.939 -13.870 -23.508 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -7.416 -12.354 -21.650 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -10.917 -11.989 -25.087 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -7.394 -10.471 -23.226 1.00 0.00 H new ATOM 0 HH TYR A 17 -8.218 -9.858 -25.387 1.00 0.00 H new ATOM 225 N LEU A 18 -6.098 -15.049 -22.039 1.00 0.00 N ATOM 226 CA LEU A 18 -4.836 -14.644 -22.647 1.00 0.00 C ATOM 227 C LEU A 18 -4.252 -15.772 -23.492 1.00 0.00 C ATOM 228 O LEU A 18 -3.355 -15.550 -24.305 1.00 0.00 O ATOM 229 CB LEU A 18 -3.836 -14.232 -21.566 1.00 0.00 C ATOM 230 CG LEU A 18 -4.269 -13.084 -20.653 1.00 0.00 C ATOM 231 CD1 LEU A 18 -3.394 -13.030 -19.411 1.00 0.00 C ATOM 232 CD2 LEU A 18 -4.218 -11.760 -21.401 1.00 0.00 C ATOM 0 H LEU A 18 -6.055 -15.185 -21.029 1.00 0.00 H new ATOM 0 HA LEU A 18 -5.031 -13.791 -23.297 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -3.623 -15.103 -20.946 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -2.902 -13.951 -22.052 1.00 0.00 H new ATOM 0 HG LEU A 18 -5.298 -13.263 -20.340 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -3.717 -12.207 -18.774 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -3.481 -13.969 -18.864 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -2.356 -12.876 -19.704 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -4.529 -10.954 -20.736 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -3.200 -11.575 -21.744 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.888 -11.801 -22.260 1.00 0.00 H new ATOM 244 N GLN A 19 -4.768 -16.981 -23.294 1.00 0.00 N ATOM 245 CA GLN A 19 -4.298 -18.143 -24.039 1.00 0.00 C ATOM 246 C GLN A 19 -5.323 -18.570 -25.085 1.00 0.00 C ATOM 247 O GLN A 19 -5.060 -19.450 -25.903 1.00 0.00 O ATOM 248 CB GLN A 19 -4.011 -19.304 -23.086 1.00 0.00 C ATOM 249 CG GLN A 19 -2.962 -18.982 -22.034 1.00 0.00 C ATOM 250 CD GLN A 19 -1.554 -19.304 -22.495 1.00 0.00 C ATOM 251 OE1 GLN A 19 -0.975 -18.582 -23.308 1.00 0.00 O ATOM 252 NE2 GLN A 19 -0.995 -20.391 -21.978 1.00 0.00 N ATOM 0 H GLN A 19 -5.511 -17.181 -22.624 1.00 0.00 H new ATOM 0 HA GLN A 19 -3.377 -17.866 -24.551 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -4.937 -19.592 -22.588 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -3.680 -20.166 -23.666 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -3.023 -17.924 -21.777 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -3.180 -19.543 -21.126 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -1.511 -20.960 -21.307 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -0.049 -20.657 -22.251 1.00 0.00 H new ATOM 261 N ALA A 20 -6.493 -17.940 -25.051 1.00 0.00 N ATOM 262 CA ALA A 20 -7.557 -18.254 -25.996 1.00 0.00 C ATOM 263 C ALA A 20 -7.387 -17.472 -27.294 1.00 0.00 C ATOM 264 O ALA A 20 -6.670 -16.472 -27.355 1.00 0.00 O ATOM 265 CB ALA A 20 -8.916 -17.963 -25.377 1.00 0.00 C ATOM 0 H ALA A 20 -6.728 -17.209 -24.379 1.00 0.00 H new ATOM 0 HA ALA A 20 -7.497 -19.317 -26.232 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -9.701 -18.202 -26.094 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -9.045 -18.570 -24.481 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -8.976 -16.908 -25.111 1.00 0.00 H new ATOM 271 N PRO A 21 -8.059 -17.935 -28.358 1.00 0.00 N ATOM 272 CA PRO A 21 -7.998 -17.293 -29.674 1.00 0.00 C ATOM 273 C PRO A 21 -8.703 -15.942 -29.694 1.00 0.00 C ATOM 274 O PRO A 21 -9.153 -15.451 -28.660 1.00 0.00 O ATOM 275 CB PRO A 21 -8.720 -18.287 -30.588 1.00 0.00 C ATOM 276 CG PRO A 21 -9.637 -19.035 -29.683 1.00 0.00 C ATOM 277 CD PRO A 21 -8.932 -19.121 -28.358 1.00 0.00 C ATOM 0 HA PRO A 21 -6.972 -17.082 -29.977 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -9.272 -17.773 -31.375 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -8.015 -18.957 -31.080 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -10.593 -18.520 -29.584 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -9.849 -20.029 -30.077 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -9.636 -19.102 -27.526 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -8.357 -20.043 -28.268 1.00 0.00 H new ATOM 285 N ASN A 22 -8.796 -15.345 -30.878 1.00 0.00 N ATOM 286 CA ASN A 22 -9.448 -14.050 -31.032 1.00 0.00 C ATOM 287 C ASN A 22 -10.923 -14.133 -30.651 1.00 0.00 C ATOM 288 O ASN A 22 -11.571 -13.116 -30.411 1.00 0.00 O ATOM 289 CB ASN A 22 -9.310 -13.554 -32.473 1.00 0.00 C ATOM 290 CG ASN A 22 -8.059 -12.723 -32.681 1.00 0.00 C ATOM 291 OD1 ASN A 22 -6.941 -13.214 -32.526 1.00 0.00 O ATOM 292 ND2 ASN A 22 -8.242 -11.456 -33.034 1.00 0.00 N ATOM 0 H ASN A 22 -8.428 -15.738 -31.745 1.00 0.00 H new ATOM 0 HA ASN A 22 -8.958 -13.344 -30.362 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -9.291 -14.409 -33.149 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -10.185 -12.960 -32.735 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -7.437 -10.848 -33.188 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -9.187 -11.091 -33.151 1.00 0.00 H new ATOM 299 N ASN A 23 -11.446 -15.354 -30.596 1.00 0.00 N ATOM 300 CA ASN A 23 -12.844 -15.572 -30.243 1.00 0.00 C ATOM 301 C ASN A 23 -12.989 -15.876 -28.755 1.00 0.00 C ATOM 302 O ASN A 23 -13.924 -16.558 -28.339 1.00 0.00 O ATOM 303 CB ASN A 23 -13.427 -16.720 -31.069 1.00 0.00 C ATOM 304 CG ASN A 23 -13.940 -16.259 -32.419 1.00 0.00 C ATOM 305 OD1 ASN A 23 -15.042 -15.719 -32.526 1.00 0.00 O ATOM 306 ND2 ASN A 23 -13.142 -16.471 -33.459 1.00 0.00 N ATOM 0 H ASN A 23 -10.922 -16.207 -30.791 1.00 0.00 H new ATOM 0 HA ASN A 23 -13.395 -14.658 -30.464 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -12.663 -17.483 -31.215 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -14.241 -17.186 -30.514 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -13.434 -16.183 -34.393 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -12.237 -16.922 -33.324 1.00 0.00 H new ATOM 313 N ALA A 24 -12.056 -15.364 -27.959 1.00 0.00 N ATOM 314 CA ALA A 24 -12.081 -15.578 -26.517 1.00 0.00 C ATOM 315 C ALA A 24 -13.299 -14.913 -25.884 1.00 0.00 C ATOM 316 O ALA A 24 -13.987 -14.118 -26.524 1.00 0.00 O ATOM 317 CB ALA A 24 -10.802 -15.052 -25.883 1.00 0.00 C ATOM 0 H ALA A 24 -11.274 -14.798 -28.288 1.00 0.00 H new ATOM 0 HA ALA A 24 -12.150 -16.651 -26.335 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -10.835 -15.218 -24.806 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -9.944 -15.576 -26.305 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -10.709 -13.984 -26.082 1.00 0.00 H new ATOM 323 N SER A 25 -13.561 -15.246 -24.624 1.00 0.00 N ATOM 324 CA SER A 25 -14.699 -14.684 -23.906 1.00 0.00 C ATOM 325 C SER A 25 -14.333 -14.386 -22.456 1.00 0.00 C ATOM 326 O SER A 25 -14.588 -15.178 -21.549 1.00 0.00 O ATOM 327 CB SER A 25 -15.886 -15.648 -23.957 1.00 0.00 C ATOM 328 OG SER A 25 -16.709 -15.386 -25.081 1.00 0.00 O ATOM 0 H SER A 25 -13.001 -15.902 -24.080 1.00 0.00 H new ATOM 0 HA SER A 25 -14.978 -13.749 -24.391 1.00 0.00 H new ATOM 0 HB2 SER A 25 -15.523 -16.675 -24.000 1.00 0.00 H new ATOM 0 HB3 SER A 25 -16.473 -15.555 -23.043 1.00 0.00 H new ATOM 0 HG SER A 25 -17.459 -16.017 -25.091 1.00 0.00 H new ATOM 334 N PRO A 26 -13.720 -13.214 -22.230 1.00 0.00 N ATOM 335 CA PRO A 26 -13.305 -12.782 -20.892 1.00 0.00 C ATOM 336 C PRO A 26 -14.361 -13.083 -19.833 1.00 0.00 C ATOM 337 O PRO A 26 -15.373 -12.392 -19.717 1.00 0.00 O ATOM 338 CB PRO A 26 -13.121 -11.271 -21.049 1.00 0.00 C ATOM 339 CG PRO A 26 -12.826 -11.073 -22.496 1.00 0.00 C ATOM 340 CD PRO A 26 -13.384 -12.221 -23.264 1.00 0.00 C ATOM 0 HA PRO A 26 -12.408 -13.302 -20.555 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -14.019 -10.730 -20.750 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -12.306 -10.905 -20.425 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -13.263 -10.138 -22.845 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -11.750 -11.001 -22.655 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -14.264 -11.928 -23.836 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -12.658 -12.616 -23.975 1.00 0.00 H new ATOM 348 N PRO A 27 -14.121 -14.138 -19.041 1.00 0.00 N ATOM 349 CA PRO A 27 -15.039 -14.553 -17.976 1.00 0.00 C ATOM 350 C PRO A 27 -15.211 -13.480 -16.907 1.00 0.00 C ATOM 351 O PRO A 27 -14.306 -12.690 -16.635 1.00 0.00 O ATOM 352 CB PRO A 27 -14.360 -15.792 -17.386 1.00 0.00 C ATOM 353 CG PRO A 27 -12.938 -15.686 -17.816 1.00 0.00 C ATOM 354 CD PRO A 27 -12.934 -15.006 -19.122 1.00 0.00 C ATOM 0 HA PRO A 27 -16.044 -14.740 -18.354 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -14.445 -15.810 -16.299 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -14.818 -16.709 -17.757 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -12.355 -15.124 -17.086 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -12.484 -16.674 -17.894 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -12.021 -14.430 -19.275 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -13.006 -15.714 -19.947 1.00 0.00 H new ATOM 362 N PRO A 28 -16.399 -13.448 -16.285 1.00 0.00 N ATOM 363 CA PRO A 28 -16.716 -12.476 -15.235 1.00 0.00 C ATOM 364 C PRO A 28 -15.563 -12.282 -14.256 1.00 0.00 C ATOM 365 O PRO A 28 -15.115 -11.164 -14.001 1.00 0.00 O ATOM 366 CB PRO A 28 -17.920 -13.100 -14.525 1.00 0.00 C ATOM 367 CG PRO A 28 -18.259 -14.300 -15.341 1.00 0.00 C ATOM 368 CD PRO A 28 -17.523 -14.358 -16.558 1.00 0.00 C ATOM 0 HA PRO A 28 -16.911 -11.485 -15.644 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -17.676 -13.375 -13.499 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -18.757 -12.403 -14.478 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -18.062 -15.199 -14.758 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -19.326 -14.293 -15.565 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -17.183 -15.369 -16.781 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -18.117 -14.027 -17.410 1.00 0.00 H new ATOM 376 N PRO A 29 -15.069 -13.395 -13.694 1.00 0.00 N ATOM 377 CA PRO A 29 -13.961 -13.374 -12.735 1.00 0.00 C ATOM 378 C PRO A 29 -12.717 -12.698 -13.303 1.00 0.00 C ATOM 379 O PRO A 29 -11.974 -12.034 -12.579 1.00 0.00 O ATOM 380 CB PRO A 29 -13.691 -14.857 -12.472 1.00 0.00 C ATOM 381 CG PRO A 29 -14.371 -15.570 -13.589 1.00 0.00 C ATOM 382 CD PRO A 29 -15.555 -14.761 -13.952 1.00 0.00 C ATOM 0 HA PRO A 29 -14.209 -12.807 -11.838 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -12.622 -15.069 -12.460 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -14.088 -15.166 -11.505 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -13.701 -15.680 -14.442 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -14.667 -16.574 -13.284 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -15.845 -14.903 -14.993 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -16.424 -15.009 -13.342 1.00 0.00 H new ATOM 390 N CYS A 30 -12.495 -12.872 -14.601 1.00 0.00 N ATOM 391 CA CYS A 30 -11.341 -12.280 -15.266 1.00 0.00 C ATOM 392 C CYS A 30 -11.521 -10.774 -15.431 1.00 0.00 C ATOM 393 O CYS A 30 -10.654 -9.988 -15.049 1.00 0.00 O ATOM 394 CB CYS A 30 -11.124 -12.931 -16.634 1.00 0.00 C ATOM 395 SG CYS A 30 -9.964 -12.030 -17.711 1.00 0.00 S ATOM 0 H CYS A 30 -13.100 -13.419 -15.214 1.00 0.00 H new ATOM 0 HA CYS A 30 -10.464 -12.458 -14.643 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -10.753 -13.945 -16.487 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -12.085 -13.013 -17.142 1.00 0.00 H new ATOM 400 N CYS A 31 -12.654 -10.378 -16.002 1.00 0.00 N ATOM 401 CA CYS A 31 -12.950 -8.967 -16.217 1.00 0.00 C ATOM 402 C CYS A 31 -12.873 -8.188 -14.907 1.00 0.00 C ATOM 403 O CYS A 31 -12.323 -7.089 -14.858 1.00 0.00 O ATOM 404 CB CYS A 31 -14.339 -8.805 -16.839 1.00 0.00 C ATOM 405 SG CYS A 31 -14.347 -8.837 -18.660 1.00 0.00 S ATOM 0 H CYS A 31 -13.382 -11.015 -16.324 1.00 0.00 H new ATOM 0 HA CYS A 31 -12.203 -8.565 -16.902 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -14.986 -9.601 -16.470 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -14.769 -7.862 -16.501 1.00 0.00 H new ATOM 410 N ALA A 32 -13.428 -8.767 -13.848 1.00 0.00 N ATOM 411 CA ALA A 32 -13.421 -8.130 -12.537 1.00 0.00 C ATOM 412 C ALA A 32 -12.006 -7.732 -12.129 1.00 0.00 C ATOM 413 O ALA A 32 -11.788 -6.652 -11.582 1.00 0.00 O ATOM 414 CB ALA A 32 -14.032 -9.056 -11.496 1.00 0.00 C ATOM 0 H ALA A 32 -13.889 -9.677 -13.872 1.00 0.00 H new ATOM 0 HA ALA A 32 -14.023 -7.223 -12.597 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -14.020 -8.567 -10.522 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -15.061 -9.287 -11.773 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -13.454 -9.979 -11.446 1.00 0.00 H new ATOM 420 N GLY A 33 -11.047 -8.613 -12.398 1.00 0.00 N ATOM 421 CA GLY A 33 -9.666 -8.335 -12.050 1.00 0.00 C ATOM 422 C GLY A 33 -9.217 -6.962 -12.511 1.00 0.00 C ATOM 423 O GLY A 33 -8.573 -6.228 -11.761 1.00 0.00 O ATOM 0 H GLY A 33 -11.202 -9.514 -12.851 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -9.545 -8.410 -10.969 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -9.022 -9.093 -12.496 1.00 0.00 H new ATOM 427 N VAL A 34 -9.557 -6.614 -13.748 1.00 0.00 N ATOM 428 CA VAL A 34 -9.184 -5.321 -14.308 1.00 0.00 C ATOM 429 C VAL A 34 -9.684 -4.178 -13.431 1.00 0.00 C ATOM 430 O VAL A 34 -8.942 -3.244 -13.127 1.00 0.00 O ATOM 431 CB VAL A 34 -9.743 -5.144 -15.732 1.00 0.00 C ATOM 432 CG1 VAL A 34 -9.507 -3.724 -16.225 1.00 0.00 C ATOM 433 CG2 VAL A 34 -9.118 -6.157 -16.679 1.00 0.00 C ATOM 0 H VAL A 34 -10.090 -7.210 -14.381 1.00 0.00 H new ATOM 0 HA VAL A 34 -8.095 -5.295 -14.348 1.00 0.00 H new ATOM 0 HB VAL A 34 -10.818 -5.320 -15.707 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -9.908 -3.617 -17.233 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -10.006 -3.020 -15.559 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -8.437 -3.516 -16.237 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -9.524 -6.018 -17.681 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -8.038 -6.015 -16.703 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -9.344 -7.166 -16.333 1.00 0.00 H new ATOM 443 N LYS A 35 -10.947 -4.259 -13.028 1.00 0.00 N ATOM 444 CA LYS A 35 -11.548 -3.233 -12.184 1.00 0.00 C ATOM 445 C LYS A 35 -10.912 -3.226 -10.798 1.00 0.00 C ATOM 446 O LYS A 35 -10.867 -2.194 -10.128 1.00 0.00 O ATOM 447 CB LYS A 35 -13.057 -3.462 -12.063 1.00 0.00 C ATOM 448 CG LYS A 35 -13.763 -3.583 -13.402 1.00 0.00 C ATOM 449 CD LYS A 35 -14.972 -4.499 -13.314 1.00 0.00 C ATOM 450 CE LYS A 35 -16.227 -3.731 -12.930 1.00 0.00 C ATOM 451 NZ LYS A 35 -17.381 -4.640 -12.686 1.00 0.00 N ATOM 0 H LYS A 35 -11.575 -5.025 -13.272 1.00 0.00 H new ATOM 0 HA LYS A 35 -11.370 -2.264 -12.651 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -13.233 -4.370 -11.486 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -13.497 -2.637 -11.503 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -14.077 -2.595 -13.739 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -13.067 -3.968 -14.148 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -15.126 -4.993 -14.273 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -14.784 -5.282 -12.579 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -16.032 -3.142 -12.033 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -16.480 -3.028 -13.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -18.217 -4.078 -12.427 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -17.583 -5.184 -13.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -17.150 -5.294 -11.911 1.00 0.00 H new ATOM 465 N LYS A 36 -10.419 -4.385 -10.373 1.00 0.00 N ATOM 466 CA LYS A 36 -9.781 -4.513 -9.068 1.00 0.00 C ATOM 467 C LYS A 36 -8.466 -3.741 -9.026 1.00 0.00 C ATOM 468 O LYS A 36 -8.064 -3.235 -7.977 1.00 0.00 O ATOM 469 CB LYS A 36 -9.530 -5.987 -8.742 1.00 0.00 C ATOM 470 CG LYS A 36 -10.676 -6.649 -7.997 1.00 0.00 C ATOM 471 CD LYS A 36 -10.544 -6.465 -6.495 1.00 0.00 C ATOM 472 CE LYS A 36 -11.185 -5.165 -6.034 1.00 0.00 C ATOM 473 NZ LYS A 36 -11.602 -5.228 -4.606 1.00 0.00 N ATOM 0 H LYS A 36 -10.449 -5.249 -10.914 1.00 0.00 H new ATOM 0 HA LYS A 36 -10.453 -4.091 -8.321 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -9.349 -6.530 -9.670 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -8.623 -6.069 -8.143 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -11.623 -6.227 -8.334 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -10.699 -7.713 -8.234 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -11.013 -7.305 -5.982 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -9.490 -6.470 -6.218 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -10.481 -4.344 -6.171 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -12.053 -4.947 -6.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -12.034 -4.323 -4.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -12.293 -5.995 -4.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -10.770 -5.410 -4.009 1.00 0.00 H new ATOM 487 N LEU A 37 -7.801 -3.652 -10.173 1.00 0.00 N ATOM 488 CA LEU A 37 -6.532 -2.940 -10.268 1.00 0.00 C ATOM 489 C LEU A 37 -6.689 -1.487 -9.832 1.00 0.00 C ATOM 490 O LEU A 37 -5.720 -0.839 -9.433 1.00 0.00 O ATOM 491 CB LEU A 37 -5.997 -3.000 -11.700 1.00 0.00 C ATOM 492 CG LEU A 37 -5.070 -4.173 -12.021 1.00 0.00 C ATOM 493 CD1 LEU A 37 -3.800 -4.094 -11.189 1.00 0.00 C ATOM 494 CD2 LEU A 37 -5.784 -5.496 -11.785 1.00 0.00 C ATOM 0 H LEU A 37 -8.120 -4.064 -11.050 1.00 0.00 H new ATOM 0 HA LEU A 37 -5.820 -3.425 -9.600 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.846 -3.036 -12.383 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -5.462 -2.073 -11.906 1.00 0.00 H new ATOM 0 HG LEU A 37 -4.793 -4.115 -13.074 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -3.153 -4.937 -11.432 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -3.279 -3.162 -11.408 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -4.056 -4.126 -10.130 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -5.110 -6.320 -12.018 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -6.091 -5.563 -10.741 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -6.664 -5.554 -12.426 1.00 0.00 H new ATOM 506 N LEU A 38 -7.915 -0.981 -9.908 1.00 0.00 N ATOM 507 CA LEU A 38 -8.200 0.396 -9.519 1.00 0.00 C ATOM 508 C LEU A 38 -7.731 0.667 -8.093 1.00 0.00 C ATOM 509 O LEU A 38 -7.083 1.678 -7.824 1.00 0.00 O ATOM 510 CB LEU A 38 -9.698 0.680 -9.638 1.00 0.00 C ATOM 511 CG LEU A 38 -10.222 0.941 -11.051 1.00 0.00 C ATOM 512 CD1 LEU A 38 -11.733 0.772 -11.099 1.00 0.00 C ATOM 513 CD2 LEU A 38 -9.824 2.333 -11.519 1.00 0.00 C ATOM 0 H LEU A 38 -8.728 -1.503 -10.235 1.00 0.00 H new ATOM 0 HA LEU A 38 -7.656 1.058 -10.193 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -10.242 -0.167 -9.221 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -9.934 1.546 -9.019 1.00 0.00 H new ATOM 0 HG LEU A 38 -9.773 0.211 -11.725 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -12.088 0.962 -12.112 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -11.995 -0.245 -10.807 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -12.200 1.478 -10.413 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -10.205 2.501 -12.526 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -10.244 3.078 -10.843 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -8.737 2.418 -11.524 1.00 0.00 H new ATOM 525 N ALA A 39 -8.061 -0.244 -7.184 1.00 0.00 N ATOM 526 CA ALA A 39 -7.670 -0.105 -5.786 1.00 0.00 C ATOM 527 C ALA A 39 -6.269 -0.658 -5.551 1.00 0.00 C ATOM 528 O ALA A 39 -5.660 -0.411 -4.510 1.00 0.00 O ATOM 529 CB ALA A 39 -8.675 -0.806 -4.885 1.00 0.00 C ATOM 0 H ALA A 39 -8.598 -1.086 -7.390 1.00 0.00 H new ATOM 0 HA ALA A 39 -7.659 0.957 -5.541 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -8.371 -0.694 -3.844 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -9.661 -0.362 -5.025 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -8.715 -1.865 -5.139 1.00 0.00 H new ATOM 535 N ALA A 40 -5.763 -1.409 -6.524 1.00 0.00 N ATOM 536 CA ALA A 40 -4.432 -1.996 -6.423 1.00 0.00 C ATOM 537 C ALA A 40 -3.357 -0.916 -6.384 1.00 0.00 C ATOM 538 O ALA A 40 -2.329 -1.073 -5.726 1.00 0.00 O ATOM 539 CB ALA A 40 -4.186 -2.948 -7.584 1.00 0.00 C ATOM 0 H ALA A 40 -6.255 -1.625 -7.391 1.00 0.00 H new ATOM 0 HA ALA A 40 -4.379 -2.557 -5.490 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -3.189 -3.379 -7.496 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -4.929 -3.745 -7.564 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -4.264 -2.403 -8.525 1.00 0.00 H new ATOM 545 N ALA A 41 -3.601 0.181 -7.094 1.00 0.00 N ATOM 546 CA ALA A 41 -2.654 1.288 -7.139 1.00 0.00 C ATOM 547 C ALA A 41 -2.684 2.091 -5.843 1.00 0.00 C ATOM 548 O ALA A 41 -3.733 2.236 -5.215 1.00 0.00 O ATOM 549 CB ALA A 41 -2.952 2.190 -8.328 1.00 0.00 C ATOM 0 H ALA A 41 -4.446 0.326 -7.646 1.00 0.00 H new ATOM 0 HA ALA A 41 -1.653 0.872 -7.254 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -2.237 3.012 -8.349 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -2.871 1.615 -9.250 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -3.962 2.590 -8.237 1.00 0.00 H new ATOM 555 N THR A 42 -1.526 2.610 -5.446 1.00 0.00 N ATOM 556 CA THR A 42 -1.420 3.396 -4.223 1.00 0.00 C ATOM 557 C THR A 42 -1.538 4.887 -4.517 1.00 0.00 C ATOM 558 O THR A 42 -2.367 5.583 -3.928 1.00 0.00 O ATOM 559 CB THR A 42 -0.087 3.131 -3.499 1.00 0.00 C ATOM 560 OG1 THR A 42 0.945 2.862 -4.455 1.00 0.00 O ATOM 561 CG2 THR A 42 -0.216 1.956 -2.541 1.00 0.00 C ATOM 0 H THR A 42 -0.648 2.500 -5.954 1.00 0.00 H new ATOM 0 HA THR A 42 -2.243 3.089 -3.577 1.00 0.00 H new ATOM 0 HB THR A 42 0.173 4.021 -2.925 1.00 0.00 H new ATOM 0 HG1 THR A 42 1.250 3.704 -4.853 1.00 0.00 H new ATOM 0 HG21 THR A 42 0.738 1.788 -2.041 1.00 0.00 H new ATOM 0 HG22 THR A 42 -0.982 2.176 -1.797 1.00 0.00 H new ATOM 0 HG23 THR A 42 -0.497 1.062 -3.098 1.00 0.00 H new ATOM 569 N THR A 43 -0.705 5.374 -5.431 1.00 0.00 N ATOM 570 CA THR A 43 -0.716 6.783 -5.802 1.00 0.00 C ATOM 571 C THR A 43 -1.381 6.989 -7.159 1.00 0.00 C ATOM 572 O THR A 43 -1.852 6.038 -7.782 1.00 0.00 O ATOM 573 CB THR A 43 0.710 7.363 -5.849 1.00 0.00 C ATOM 574 OG1 THR A 43 1.349 6.995 -7.077 1.00 0.00 O ATOM 575 CG2 THR A 43 1.536 6.863 -4.673 1.00 0.00 C ATOM 0 H THR A 43 -0.014 4.813 -5.928 1.00 0.00 H new ATOM 0 HA THR A 43 -1.288 7.307 -5.036 1.00 0.00 H new ATOM 0 HB THR A 43 0.639 8.449 -5.788 1.00 0.00 H new ATOM 0 HG1 THR A 43 2.300 7.229 -7.034 1.00 0.00 H new ATOM 0 HG21 THR A 43 2.539 7.286 -4.727 1.00 0.00 H new ATOM 0 HG22 THR A 43 1.063 7.169 -3.740 1.00 0.00 H new ATOM 0 HG23 THR A 43 1.598 5.775 -4.708 1.00 0.00 H new ATOM 583 N THR A 44 -1.415 8.239 -7.612 1.00 0.00 N ATOM 584 CA THR A 44 -2.023 8.570 -8.894 1.00 0.00 C ATOM 585 C THR A 44 -1.196 8.022 -10.052 1.00 0.00 C ATOM 586 O THR A 44 -1.680 7.251 -10.881 1.00 0.00 O ATOM 587 CB THR A 44 -2.178 10.093 -9.066 1.00 0.00 C ATOM 588 OG1 THR A 44 -3.438 10.519 -8.536 1.00 0.00 O ATOM 589 CG2 THR A 44 -2.080 10.485 -10.532 1.00 0.00 C ATOM 0 H THR A 44 -1.028 9.038 -7.110 1.00 0.00 H new ATOM 0 HA THR A 44 -3.010 8.108 -8.904 1.00 0.00 H new ATOM 0 HB THR A 44 -1.371 10.582 -8.521 1.00 0.00 H new ATOM 0 HG1 THR A 44 -3.529 11.488 -8.647 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.192 11.565 -10.628 1.00 0.00 H new ATOM 0 HG22 THR A 44 -1.108 10.185 -10.925 1.00 0.00 H new ATOM 0 HG23 THR A 44 -2.869 9.987 -11.095 1.00 0.00 H new ATOM 597 N PRO A 45 0.081 8.427 -10.112 1.00 0.00 N ATOM 598 CA PRO A 45 1.002 7.986 -11.164 1.00 0.00 C ATOM 599 C PRO A 45 1.373 6.513 -11.031 1.00 0.00 C ATOM 600 O PRO A 45 1.776 5.874 -12.003 1.00 0.00 O ATOM 601 CB PRO A 45 2.234 8.869 -10.950 1.00 0.00 C ATOM 602 CG PRO A 45 2.183 9.246 -9.509 1.00 0.00 C ATOM 603 CD PRO A 45 0.725 9.345 -9.158 1.00 0.00 C ATOM 0 HA PRO A 45 0.561 8.079 -12.156 1.00 0.00 H new ATOM 0 HB2 PRO A 45 3.152 8.332 -11.187 1.00 0.00 H new ATOM 0 HB3 PRO A 45 2.206 9.750 -11.591 1.00 0.00 H new ATOM 0 HG2 PRO A 45 2.683 8.499 -8.892 1.00 0.00 H new ATOM 0 HG3 PRO A 45 2.691 10.194 -9.336 1.00 0.00 H new ATOM 0 HD2 PRO A 45 0.539 9.047 -8.126 1.00 0.00 H new ATOM 0 HD3 PRO A 45 0.354 10.364 -9.268 1.00 0.00 H new ATOM 611 N ASP A 46 1.234 5.980 -9.822 1.00 0.00 N ATOM 612 CA ASP A 46 1.553 4.581 -9.563 1.00 0.00 C ATOM 613 C ASP A 46 0.619 3.658 -10.340 1.00 0.00 C ATOM 614 O ASP A 46 0.936 2.491 -10.571 1.00 0.00 O ATOM 615 CB ASP A 46 1.455 4.283 -8.066 1.00 0.00 C ATOM 616 CG ASP A 46 2.745 4.588 -7.329 1.00 0.00 C ATOM 617 OD1 ASP A 46 3.500 5.468 -7.794 1.00 0.00 O ATOM 618 OD2 ASP A 46 2.998 3.948 -6.288 1.00 0.00 O ATOM 0 H ASP A 46 0.903 6.495 -9.006 1.00 0.00 H new ATOM 0 HA ASP A 46 2.575 4.399 -9.896 1.00 0.00 H new ATOM 0 HB2 ASP A 46 0.645 4.871 -7.634 1.00 0.00 H new ATOM 0 HB3 ASP A 46 1.198 3.233 -7.924 1.00 0.00 H new ATOM 623 N ARG A 47 -0.532 4.188 -10.738 1.00 0.00 N ATOM 624 CA ARG A 47 -1.513 3.411 -11.487 1.00 0.00 C ATOM 625 C ARG A 47 -0.901 2.855 -12.770 1.00 0.00 C ATOM 626 O ARG A 47 -1.217 1.741 -13.187 1.00 0.00 O ATOM 627 CB ARG A 47 -2.730 4.273 -11.822 1.00 0.00 C ATOM 628 CG ARG A 47 -2.477 5.279 -12.934 1.00 0.00 C ATOM 629 CD ARG A 47 -3.654 6.226 -13.107 1.00 0.00 C ATOM 630 NE ARG A 47 -3.255 7.488 -13.725 1.00 0.00 N ATOM 631 CZ ARG A 47 -4.076 8.520 -13.884 1.00 0.00 C ATOM 632 NH1 ARG A 47 -5.334 8.440 -13.473 1.00 0.00 N ATOM 633 NH2 ARG A 47 -3.639 9.635 -14.455 1.00 0.00 N ATOM 0 H ARG A 47 -0.809 5.152 -10.555 1.00 0.00 H new ATOM 0 HA ARG A 47 -1.830 2.575 -10.864 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -3.556 3.623 -12.112 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -3.044 4.807 -10.925 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -1.577 5.852 -12.710 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -2.293 4.750 -13.869 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -4.417 5.747 -13.721 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -4.105 6.425 -12.135 1.00 0.00 H new ATOM 0 HE ARG A 47 -2.294 7.582 -14.052 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -5.673 7.584 -13.033 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -5.962 9.234 -13.596 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -2.672 9.700 -14.772 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -4.270 10.427 -14.577 1.00 0.00 H new ATOM 647 N GLN A 48 -0.024 3.638 -13.389 1.00 0.00 N ATOM 648 CA GLN A 48 0.631 3.225 -14.624 1.00 0.00 C ATOM 649 C GLN A 48 1.442 1.951 -14.410 1.00 0.00 C ATOM 650 O GLN A 48 1.474 1.072 -15.270 1.00 0.00 O ATOM 651 CB GLN A 48 1.539 4.340 -15.144 1.00 0.00 C ATOM 652 CG GLN A 48 0.813 5.369 -15.996 1.00 0.00 C ATOM 653 CD GLN A 48 -0.211 6.162 -15.207 1.00 0.00 C ATOM 654 OE1 GLN A 48 -1.373 6.265 -15.604 1.00 0.00 O ATOM 655 NE2 GLN A 48 0.215 6.727 -14.084 1.00 0.00 N ATOM 0 H GLN A 48 0.249 4.562 -13.055 1.00 0.00 H new ATOM 0 HA GLN A 48 -0.143 3.022 -15.365 1.00 0.00 H new ATOM 0 HB2 GLN A 48 2.003 4.845 -14.296 1.00 0.00 H new ATOM 0 HB3 GLN A 48 2.344 3.898 -15.731 1.00 0.00 H new ATOM 0 HG2 GLN A 48 1.541 6.054 -16.431 1.00 0.00 H new ATOM 0 HG3 GLN A 48 0.316 4.864 -16.824 1.00 0.00 H new ATOM 0 HE21 GLN A 48 1.186 6.615 -13.794 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -0.429 7.273 -13.511 1.00 0.00 H new ATOM 664 N ALA A 49 2.097 1.859 -13.257 1.00 0.00 N ATOM 665 CA ALA A 49 2.907 0.693 -12.930 1.00 0.00 C ATOM 666 C ALA A 49 2.143 -0.599 -13.199 1.00 0.00 C ATOM 667 O ALA A 49 2.715 -1.583 -13.669 1.00 0.00 O ATOM 668 CB ALA A 49 3.353 0.751 -11.476 1.00 0.00 C ATOM 0 H ALA A 49 2.082 2.578 -12.534 1.00 0.00 H new ATOM 0 HA ALA A 49 3.789 0.703 -13.570 1.00 0.00 H new ATOM 0 HB1 ALA A 49 3.957 -0.126 -11.246 1.00 0.00 H new ATOM 0 HB2 ALA A 49 3.944 1.652 -11.312 1.00 0.00 H new ATOM 0 HB3 ALA A 49 2.477 0.769 -10.827 1.00 0.00 H new ATOM 674 N ALA A 50 0.849 -0.590 -12.898 1.00 0.00 N ATOM 675 CA ALA A 50 0.007 -1.761 -13.110 1.00 0.00 C ATOM 676 C ALA A 50 0.031 -2.198 -14.570 1.00 0.00 C ATOM 677 O ALA A 50 0.277 -3.365 -14.876 1.00 0.00 O ATOM 678 CB ALA A 50 -1.420 -1.471 -12.667 1.00 0.00 C ATOM 0 H ALA A 50 0.361 0.215 -12.506 1.00 0.00 H new ATOM 0 HA ALA A 50 0.405 -2.578 -12.508 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -2.038 -2.354 -12.831 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -1.427 -1.214 -11.608 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -1.818 -0.637 -13.245 1.00 0.00 H new ATOM 684 N CYS A 51 -0.227 -1.254 -15.470 1.00 0.00 N ATOM 685 CA CYS A 51 -0.236 -1.542 -16.899 1.00 0.00 C ATOM 686 C CYS A 51 1.127 -2.050 -17.360 1.00 0.00 C ATOM 687 O CYS A 51 1.230 -2.758 -18.361 1.00 0.00 O ATOM 688 CB CYS A 51 -0.620 -0.289 -17.690 1.00 0.00 C ATOM 689 SG CYS A 51 -0.446 -0.467 -19.495 1.00 0.00 S ATOM 0 H CYS A 51 -0.433 -0.283 -15.234 1.00 0.00 H new ATOM 0 HA CYS A 51 -0.976 -2.321 -17.083 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -1.653 -0.029 -17.459 1.00 0.00 H new ATOM 0 HB3 CYS A 51 0.000 0.543 -17.356 1.00 0.00 H new ATOM 694 N ASN A 52 2.170 -1.683 -16.623 1.00 0.00 N ATOM 695 CA ASN A 52 3.527 -2.102 -16.956 1.00 0.00 C ATOM 696 C ASN A 52 3.773 -3.544 -16.522 1.00 0.00 C ATOM 697 O ASN A 52 4.480 -4.294 -17.195 1.00 0.00 O ATOM 698 CB ASN A 52 4.546 -1.176 -16.290 1.00 0.00 C ATOM 699 CG ASN A 52 4.727 0.125 -17.048 1.00 0.00 C ATOM 700 OD1 ASN A 52 5.034 0.124 -18.240 1.00 0.00 O ATOM 701 ND2 ASN A 52 4.537 1.243 -16.357 1.00 0.00 N ATOM 0 H ASN A 52 2.102 -1.096 -15.791 1.00 0.00 H new ATOM 0 HA ASN A 52 3.644 -2.042 -18.038 1.00 0.00 H new ATOM 0 HB2 ASN A 52 4.224 -0.958 -15.272 1.00 0.00 H new ATOM 0 HB3 ASN A 52 5.506 -1.688 -16.218 1.00 0.00 H new ATOM 0 HD21 ASN A 52 4.645 2.149 -16.813 1.00 0.00 H new ATOM 0 HD22 ASN A 52 4.283 1.196 -15.370 1.00 0.00 H new ATOM 708 N CYS A 53 3.184 -3.925 -15.394 1.00 0.00 N ATOM 709 CA CYS A 53 3.338 -5.277 -14.869 1.00 0.00 C ATOM 710 C CYS A 53 2.717 -6.301 -15.814 1.00 0.00 C ATOM 711 O CYS A 53 3.278 -7.375 -16.038 1.00 0.00 O ATOM 712 CB CYS A 53 2.693 -5.386 -13.486 1.00 0.00 C ATOM 713 SG CYS A 53 3.395 -4.250 -12.246 1.00 0.00 S ATOM 0 H CYS A 53 2.595 -3.317 -14.825 1.00 0.00 H new ATOM 0 HA CYS A 53 4.404 -5.488 -14.783 1.00 0.00 H new ATOM 0 HB2 CYS A 53 1.625 -5.190 -13.579 1.00 0.00 H new ATOM 0 HB3 CYS A 53 2.800 -6.410 -13.127 1.00 0.00 H new ATOM 718 N LEU A 54 1.557 -5.963 -16.364 1.00 0.00 N ATOM 719 CA LEU A 54 0.859 -6.853 -17.286 1.00 0.00 C ATOM 720 C LEU A 54 1.768 -7.264 -18.439 1.00 0.00 C ATOM 721 O LEU A 54 1.605 -8.337 -19.021 1.00 0.00 O ATOM 722 CB LEU A 54 -0.398 -6.172 -17.830 1.00 0.00 C ATOM 723 CG LEU A 54 -1.503 -5.889 -16.811 1.00 0.00 C ATOM 724 CD1 LEU A 54 -2.456 -4.827 -17.338 1.00 0.00 C ATOM 725 CD2 LEU A 54 -2.258 -7.166 -16.475 1.00 0.00 C ATOM 0 H LEU A 54 1.079 -5.079 -16.188 1.00 0.00 H new ATOM 0 HA LEU A 54 0.570 -7.750 -16.738 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -0.105 -5.228 -18.290 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -0.812 -6.797 -18.621 1.00 0.00 H new ATOM 0 HG LEU A 54 -1.041 -5.513 -15.898 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -3.235 -4.639 -16.600 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -1.905 -3.906 -17.527 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -2.911 -5.175 -18.265 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.040 -6.946 -15.749 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -2.708 -7.572 -17.381 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.568 -7.897 -16.054 1.00 0.00 H new ATOM 737 N LYS A 55 2.728 -6.405 -18.765 1.00 0.00 N ATOM 738 CA LYS A 55 3.666 -6.679 -19.846 1.00 0.00 C ATOM 739 C LYS A 55 4.711 -7.703 -19.414 1.00 0.00 C ATOM 740 O LYS A 55 5.055 -8.610 -20.172 1.00 0.00 O ATOM 741 CB LYS A 55 4.357 -5.387 -20.290 1.00 0.00 C ATOM 742 CG LYS A 55 3.629 -4.662 -21.408 1.00 0.00 C ATOM 743 CD LYS A 55 2.540 -3.752 -20.866 1.00 0.00 C ATOM 744 CE LYS A 55 1.623 -3.258 -21.975 1.00 0.00 C ATOM 745 NZ LYS A 55 0.240 -3.011 -21.482 1.00 0.00 N ATOM 0 H LYS A 55 2.876 -5.512 -18.295 1.00 0.00 H new ATOM 0 HA LYS A 55 3.104 -7.090 -20.684 1.00 0.00 H new ATOM 0 HB2 LYS A 55 4.446 -4.719 -19.433 1.00 0.00 H new ATOM 0 HB3 LYS A 55 5.370 -5.621 -20.619 1.00 0.00 H new ATOM 0 HG2 LYS A 55 4.342 -4.074 -21.986 1.00 0.00 H new ATOM 0 HG3 LYS A 55 3.190 -5.390 -22.090 1.00 0.00 H new ATOM 0 HD2 LYS A 55 1.954 -4.289 -20.120 1.00 0.00 H new ATOM 0 HD3 LYS A 55 2.995 -2.899 -20.361 1.00 0.00 H new ATOM 0 HE2 LYS A 55 2.027 -2.338 -22.398 1.00 0.00 H new ATOM 0 HE3 LYS A 55 1.596 -3.994 -22.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -0.401 -2.891 -22.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -0.074 -3.820 -20.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 0.228 -2.149 -20.900 1.00 0.00 H new ATOM 759 N SER A 56 5.209 -7.553 -18.191 1.00 0.00 N ATOM 760 CA SER A 56 6.216 -8.464 -17.659 1.00 0.00 C ATOM 761 C SER A 56 5.589 -9.799 -17.268 1.00 0.00 C ATOM 762 O SER A 56 6.001 -10.855 -17.747 1.00 0.00 O ATOM 763 CB SER A 56 6.910 -7.839 -16.447 1.00 0.00 C ATOM 764 OG SER A 56 5.981 -7.155 -15.624 1.00 0.00 O ATOM 0 H SER A 56 4.932 -6.810 -17.550 1.00 0.00 H new ATOM 0 HA SER A 56 6.955 -8.645 -18.439 1.00 0.00 H new ATOM 0 HB2 SER A 56 7.409 -8.617 -15.869 1.00 0.00 H new ATOM 0 HB3 SER A 56 7.682 -7.146 -16.783 1.00 0.00 H new ATOM 0 HG SER A 56 5.070 -7.341 -15.934 1.00 0.00 H new ATOM 770 N ALA A 57 4.589 -9.742 -16.394 1.00 0.00 N ATOM 771 CA ALA A 57 3.903 -10.945 -15.939 1.00 0.00 C ATOM 772 C ALA A 57 3.440 -11.792 -17.120 1.00 0.00 C ATOM 773 O ALA A 57 3.411 -13.020 -17.040 1.00 0.00 O ATOM 774 CB ALA A 57 2.719 -10.575 -15.057 1.00 0.00 C ATOM 0 H ALA A 57 4.236 -8.876 -15.987 1.00 0.00 H new ATOM 0 HA ALA A 57 4.607 -11.537 -15.354 1.00 0.00 H new ATOM 0 HB1 ALA A 57 2.216 -11.483 -14.724 1.00 0.00 H new ATOM 0 HB2 ALA A 57 3.072 -10.017 -14.190 1.00 0.00 H new ATOM 0 HB3 ALA A 57 2.021 -9.960 -15.625 1.00 0.00 H new ATOM 780 N ALA A 58 3.080 -11.129 -18.213 1.00 0.00 N ATOM 781 CA ALA A 58 2.620 -11.822 -19.411 1.00 0.00 C ATOM 782 C ALA A 58 3.676 -12.798 -19.919 1.00 0.00 C ATOM 783 O ALA A 58 3.363 -13.928 -20.291 1.00 0.00 O ATOM 784 CB ALA A 58 2.260 -10.819 -20.496 1.00 0.00 C ATOM 0 H ALA A 58 3.098 -10.112 -18.295 1.00 0.00 H new ATOM 0 HA ALA A 58 1.729 -12.394 -19.151 1.00 0.00 H new ATOM 0 HB1 ALA A 58 1.918 -11.351 -21.384 1.00 0.00 H new ATOM 0 HB2 ALA A 58 1.466 -10.164 -20.137 1.00 0.00 H new ATOM 0 HB3 ALA A 58 3.137 -10.222 -20.745 1.00 0.00 H new ATOM 790 N GLY A 59 4.929 -12.353 -19.934 1.00 0.00 N ATOM 791 CA GLY A 59 6.012 -13.199 -20.400 1.00 0.00 C ATOM 792 C GLY A 59 6.160 -14.460 -19.571 1.00 0.00 C ATOM 793 O GLY A 59 6.867 -15.388 -19.962 1.00 0.00 O ATOM 0 H GLY A 59 5.213 -11.421 -19.632 1.00 0.00 H new ATOM 0 HA2 GLY A 59 5.835 -13.471 -21.441 1.00 0.00 H new ATOM 0 HA3 GLY A 59 6.946 -12.637 -20.372 1.00 0.00 H new ATOM 797 N SER A 60 5.492 -14.493 -18.422 1.00 0.00 N ATOM 798 CA SER A 60 5.557 -15.647 -17.533 1.00 0.00 C ATOM 799 C SER A 60 4.687 -16.786 -18.056 1.00 0.00 C ATOM 800 O SER A 60 4.917 -17.953 -17.740 1.00 0.00 O ATOM 801 CB SER A 60 5.112 -15.256 -16.122 1.00 0.00 C ATOM 802 OG SER A 60 5.792 -14.096 -15.676 1.00 0.00 O ATOM 0 H SER A 60 4.900 -13.734 -18.085 1.00 0.00 H new ATOM 0 HA SER A 60 6.591 -15.990 -17.498 1.00 0.00 H new ATOM 0 HB2 SER A 60 4.037 -15.077 -16.113 1.00 0.00 H new ATOM 0 HB3 SER A 60 5.304 -16.080 -15.435 1.00 0.00 H new ATOM 0 HG SER A 60 5.489 -13.866 -14.773 1.00 0.00 H new ATOM 808 N ILE A 61 3.686 -16.437 -18.858 1.00 0.00 N ATOM 809 CA ILE A 61 2.782 -17.428 -19.426 1.00 0.00 C ATOM 810 C ILE A 61 3.371 -18.052 -20.686 1.00 0.00 C ATOM 811 O ILE A 61 3.882 -17.363 -21.570 1.00 0.00 O ATOM 812 CB ILE A 61 1.411 -16.812 -19.765 1.00 0.00 C ATOM 813 CG1 ILE A 61 0.775 -16.208 -18.511 1.00 0.00 C ATOM 814 CG2 ILE A 61 0.495 -17.861 -20.377 1.00 0.00 C ATOM 815 CD1 ILE A 61 1.126 -14.752 -18.297 1.00 0.00 C ATOM 0 H ILE A 61 3.481 -15.475 -19.129 1.00 0.00 H new ATOM 0 HA ILE A 61 2.647 -18.201 -18.669 1.00 0.00 H new ATOM 0 HB ILE A 61 1.558 -16.016 -20.495 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -0.308 -16.306 -18.580 1.00 0.00 H new ATOM 0 HG13 ILE A 61 1.092 -16.782 -17.640 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -0.469 -17.410 -20.611 1.00 0.00 H new ATOM 0 HG22 ILE A 61 0.945 -18.249 -21.291 1.00 0.00 H new ATOM 0 HG23 ILE A 61 0.352 -18.677 -19.669 1.00 0.00 H new ATOM 0 HD11 ILE A 61 0.641 -14.390 -17.390 1.00 0.00 H new ATOM 0 HD12 ILE A 61 2.206 -14.649 -18.196 1.00 0.00 H new ATOM 0 HD13 ILE A 61 0.784 -14.166 -19.150 1.00 0.00 H new ATOM 827 N PRO A 62 3.299 -19.389 -20.775 1.00 0.00 N ATOM 828 CA PRO A 62 3.819 -20.135 -21.924 1.00 0.00 C ATOM 829 C PRO A 62 2.990 -19.909 -23.184 1.00 0.00 C ATOM 830 O PRO A 62 1.811 -20.260 -23.236 1.00 0.00 O ATOM 831 CB PRO A 62 3.719 -21.595 -21.473 1.00 0.00 C ATOM 832 CG PRO A 62 2.630 -21.604 -20.456 1.00 0.00 C ATOM 833 CD PRO A 62 2.704 -20.274 -19.759 1.00 0.00 C ATOM 0 HA PRO A 62 4.830 -19.824 -22.189 1.00 0.00 H new ATOM 0 HB2 PRO A 62 3.484 -22.253 -22.310 1.00 0.00 H new ATOM 0 HB3 PRO A 62 4.660 -21.943 -21.048 1.00 0.00 H new ATOM 0 HG2 PRO A 62 1.657 -21.744 -20.927 1.00 0.00 H new ATOM 0 HG3 PRO A 62 2.763 -22.423 -19.749 1.00 0.00 H new ATOM 0 HD2 PRO A 62 1.718 -19.926 -19.451 1.00 0.00 H new ATOM 0 HD3 PRO A 62 3.319 -20.325 -18.861 1.00 0.00 H new ATOM 841 N LYS A 63 3.615 -19.322 -24.199 1.00 0.00 N ATOM 842 CA LYS A 63 2.936 -19.050 -25.461 1.00 0.00 C ATOM 843 C LYS A 63 1.895 -17.949 -25.293 1.00 0.00 C ATOM 844 O LYS A 63 0.899 -17.906 -26.017 1.00 0.00 O ATOM 845 CB LYS A 63 2.269 -20.322 -25.989 1.00 0.00 C ATOM 846 CG LYS A 63 3.136 -21.562 -25.860 1.00 0.00 C ATOM 847 CD LYS A 63 4.469 -21.388 -26.568 1.00 0.00 C ATOM 848 CE LYS A 63 5.367 -22.600 -26.373 1.00 0.00 C ATOM 849 NZ LYS A 63 6.208 -22.475 -25.151 1.00 0.00 N ATOM 0 H LYS A 63 4.591 -19.025 -24.173 1.00 0.00 H new ATOM 0 HA LYS A 63 3.682 -18.713 -26.181 1.00 0.00 H new ATOM 0 HB2 LYS A 63 1.336 -20.484 -25.449 1.00 0.00 H new ATOM 0 HB3 LYS A 63 2.010 -20.178 -27.038 1.00 0.00 H new ATOM 0 HG2 LYS A 63 3.309 -21.778 -24.806 1.00 0.00 H new ATOM 0 HG3 LYS A 63 2.610 -22.420 -26.279 1.00 0.00 H new ATOM 0 HD2 LYS A 63 4.298 -21.228 -27.633 1.00 0.00 H new ATOM 0 HD3 LYS A 63 4.970 -20.498 -26.188 1.00 0.00 H new ATOM 0 HE2 LYS A 63 4.754 -23.499 -26.302 1.00 0.00 H new ATOM 0 HE3 LYS A 63 6.009 -22.720 -27.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 6.806 -23.320 -25.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 6.811 -21.632 -25.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 5.595 -22.386 -24.315 1.00 0.00 H new ATOM 863 N LEU A 64 2.131 -17.059 -24.335 1.00 0.00 N ATOM 864 CA LEU A 64 1.213 -15.955 -24.073 1.00 0.00 C ATOM 865 C LEU A 64 0.888 -15.200 -25.358 1.00 0.00 C ATOM 866 O LEU A 64 1.681 -15.185 -26.298 1.00 0.00 O ATOM 867 CB LEU A 64 1.816 -14.998 -23.044 1.00 0.00 C ATOM 868 CG LEU A 64 0.833 -14.059 -22.343 1.00 0.00 C ATOM 869 CD1 LEU A 64 0.517 -12.862 -23.226 1.00 0.00 C ATOM 870 CD2 LEU A 64 -0.442 -14.803 -21.972 1.00 0.00 C ATOM 0 H LEU A 64 2.950 -17.080 -23.727 1.00 0.00 H new ATOM 0 HA LEU A 64 0.288 -16.371 -23.674 1.00 0.00 H new ATOM 0 HB2 LEU A 64 2.328 -15.589 -22.284 1.00 0.00 H new ATOM 0 HB3 LEU A 64 2.574 -14.393 -23.541 1.00 0.00 H new ATOM 0 HG LEU A 64 1.297 -13.695 -21.426 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -0.184 -12.205 -22.711 1.00 0.00 H new ATOM 0 HD12 LEU A 64 1.436 -12.316 -23.441 1.00 0.00 H new ATOM 0 HD13 LEU A 64 0.072 -13.206 -24.160 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -1.130 -14.120 -21.474 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -0.910 -15.196 -22.875 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -0.200 -15.627 -21.301 1.00 0.00 H new ATOM 882 N ASN A 65 -0.284 -14.574 -25.390 1.00 0.00 N ATOM 883 CA ASN A 65 -0.713 -13.815 -26.559 1.00 0.00 C ATOM 884 C ASN A 65 -0.969 -12.355 -26.196 1.00 0.00 C ATOM 885 O ASN A 65 -2.052 -12.001 -25.727 1.00 0.00 O ATOM 886 CB ASN A 65 -1.978 -14.433 -27.157 1.00 0.00 C ATOM 887 CG ASN A 65 -2.071 -14.222 -28.656 1.00 0.00 C ATOM 888 OD1 ASN A 65 -1.058 -14.196 -29.355 1.00 0.00 O ATOM 889 ND2 ASN A 65 -3.291 -14.069 -29.158 1.00 0.00 N ATOM 0 H ASN A 65 -0.953 -14.577 -24.620 1.00 0.00 H new ATOM 0 HA ASN A 65 0.086 -13.852 -27.299 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -1.994 -15.501 -26.941 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -2.854 -13.998 -26.676 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -3.416 -13.923 -30.160 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -4.103 -14.098 -28.542 1.00 0.00 H new ATOM 896 N THR A 66 0.034 -11.511 -26.416 1.00 0.00 N ATOM 897 CA THR A 66 -0.082 -10.090 -26.112 1.00 0.00 C ATOM 898 C THR A 66 -1.209 -9.447 -26.911 1.00 0.00 C ATOM 899 O THR A 66 -1.783 -8.442 -26.493 1.00 0.00 O ATOM 900 CB THR A 66 1.233 -9.344 -26.408 1.00 0.00 C ATOM 901 OG1 THR A 66 1.549 -9.442 -27.801 1.00 0.00 O ATOM 902 CG2 THR A 66 2.376 -9.913 -25.582 1.00 0.00 C ATOM 0 H THR A 66 0.936 -11.787 -26.804 1.00 0.00 H new ATOM 0 HA THR A 66 -0.305 -10.011 -25.048 1.00 0.00 H new ATOM 0 HB THR A 66 1.099 -8.296 -26.139 1.00 0.00 H new ATOM 0 HG1 THR A 66 2.502 -9.259 -27.934 1.00 0.00 H new ATOM 0 HG21 THR A 66 3.294 -9.370 -25.808 1.00 0.00 H new ATOM 0 HG22 THR A 66 2.145 -9.810 -24.522 1.00 0.00 H new ATOM 0 HG23 THR A 66 2.509 -10.968 -25.823 1.00 0.00 H new ATOM 910 N ASN A 67 -1.522 -10.033 -28.062 1.00 0.00 N ATOM 911 CA ASN A 67 -2.582 -9.516 -28.920 1.00 0.00 C ATOM 912 C ASN A 67 -3.931 -9.567 -28.209 1.00 0.00 C ATOM 913 O ASN A 67 -4.740 -8.648 -28.325 1.00 0.00 O ATOM 914 CB ASN A 67 -2.648 -10.317 -30.222 1.00 0.00 C ATOM 915 CG ASN A 67 -1.353 -10.252 -31.008 1.00 0.00 C ATOM 916 OD1 ASN A 67 -1.200 -9.425 -31.907 1.00 0.00 O ATOM 917 ND2 ASN A 67 -0.412 -11.127 -30.671 1.00 0.00 N ATOM 0 H ASN A 67 -1.057 -10.866 -28.422 1.00 0.00 H new ATOM 0 HA ASN A 67 -2.353 -8.476 -29.152 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -2.879 -11.357 -29.994 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -3.463 -9.937 -30.838 1.00 0.00 H new ATOM 0 HD21 ASN A 67 0.481 -11.131 -31.164 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -0.582 -11.795 -29.919 1.00 0.00 H new ATOM 924 N ASN A 68 -4.165 -10.648 -27.472 1.00 0.00 N ATOM 925 CA ASN A 68 -5.415 -10.820 -26.742 1.00 0.00 C ATOM 926 C ASN A 68 -5.527 -9.805 -25.608 1.00 0.00 C ATOM 927 O ASN A 68 -6.626 -9.421 -25.211 1.00 0.00 O ATOM 928 CB ASN A 68 -5.512 -12.240 -26.181 1.00 0.00 C ATOM 929 CG ASN A 68 -6.191 -13.196 -27.143 1.00 0.00 C ATOM 930 OD1 ASN A 68 -5.793 -13.315 -28.302 1.00 0.00 O ATOM 931 ND2 ASN A 68 -7.223 -13.882 -26.666 1.00 0.00 N ATOM 0 H ASN A 68 -3.505 -11.418 -27.365 1.00 0.00 H new ATOM 0 HA ASN A 68 -6.238 -10.654 -27.437 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -4.511 -12.607 -25.954 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -6.065 -12.220 -25.242 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -7.720 -14.539 -27.267 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -7.519 -13.752 -25.699 1.00 0.00 H new ATOM 938 N ALA A 69 -4.380 -9.374 -25.092 1.00 0.00 N ATOM 939 CA ALA A 69 -4.348 -8.402 -24.007 1.00 0.00 C ATOM 940 C ALA A 69 -4.979 -7.081 -24.434 1.00 0.00 C ATOM 941 O ALA A 69 -5.476 -6.322 -23.602 1.00 0.00 O ATOM 942 CB ALA A 69 -2.917 -8.179 -23.539 1.00 0.00 C ATOM 0 H ALA A 69 -3.461 -9.683 -25.408 1.00 0.00 H new ATOM 0 HA ALA A 69 -4.931 -8.802 -23.178 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -2.909 -7.450 -22.728 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -2.499 -9.121 -23.184 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -2.317 -7.805 -24.369 1.00 0.00 H new ATOM 948 N ALA A 70 -4.955 -6.812 -25.735 1.00 0.00 N ATOM 949 CA ALA A 70 -5.526 -5.583 -26.272 1.00 0.00 C ATOM 950 C ALA A 70 -7.050 -5.640 -26.272 1.00 0.00 C ATOM 951 O ALA A 70 -7.718 -4.628 -26.067 1.00 0.00 O ATOM 952 CB ALA A 70 -5.005 -5.330 -27.679 1.00 0.00 C ATOM 0 H ALA A 70 -4.546 -7.429 -26.437 1.00 0.00 H new ATOM 0 HA ALA A 70 -5.220 -4.758 -25.629 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -5.440 -4.409 -28.068 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -3.919 -5.236 -27.654 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -5.282 -6.163 -28.325 1.00 0.00 H new ATOM 958 N ALA A 71 -7.593 -6.831 -26.506 1.00 0.00 N ATOM 959 CA ALA A 71 -9.038 -7.019 -26.531 1.00 0.00 C ATOM 960 C ALA A 71 -9.583 -7.276 -25.131 1.00 0.00 C ATOM 961 O ALA A 71 -10.795 -7.248 -24.910 1.00 0.00 O ATOM 962 CB ALA A 71 -9.404 -8.166 -27.461 1.00 0.00 C ATOM 0 H ALA A 71 -7.054 -7.679 -26.681 1.00 0.00 H new ATOM 0 HA ALA A 71 -9.493 -6.102 -26.906 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -10.486 -8.296 -27.470 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -9.057 -7.942 -28.470 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -8.932 -9.084 -27.110 1.00 0.00 H new ATOM 968 N LEU A 72 -8.682 -7.527 -24.187 1.00 0.00 N ATOM 969 CA LEU A 72 -9.073 -7.790 -22.807 1.00 0.00 C ATOM 970 C LEU A 72 -10.015 -6.707 -22.292 1.00 0.00 C ATOM 971 O LEU A 72 -11.097 -6.985 -21.774 1.00 0.00 O ATOM 972 CB LEU A 72 -7.835 -7.872 -21.912 1.00 0.00 C ATOM 973 CG LEU A 72 -8.085 -7.763 -20.408 1.00 0.00 C ATOM 974 CD1 LEU A 72 -7.069 -8.590 -19.636 1.00 0.00 C ATOM 975 CD2 LEU A 72 -8.039 -6.308 -19.964 1.00 0.00 C ATOM 0 H LEU A 72 -7.676 -7.554 -24.353 1.00 0.00 H new ATOM 0 HA LEU A 72 -9.598 -8.745 -22.780 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -7.332 -8.819 -22.109 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -7.147 -7.078 -22.204 1.00 0.00 H new ATOM 0 HG LEU A 72 -9.079 -8.156 -20.195 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -7.263 -8.500 -18.567 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -7.150 -9.636 -19.933 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -6.064 -8.228 -19.854 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -8.219 -6.249 -18.891 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -7.059 -5.889 -20.191 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -8.806 -5.742 -20.492 1.00 0.00 H new ATOM 987 N PRO A 73 -9.598 -5.440 -22.438 1.00 0.00 N ATOM 988 CA PRO A 73 -10.391 -4.289 -21.996 1.00 0.00 C ATOM 989 C PRO A 73 -11.636 -4.081 -22.851 1.00 0.00 C ATOM 990 O PRO A 73 -12.742 -3.942 -22.331 1.00 0.00 O ATOM 991 CB PRO A 73 -9.427 -3.111 -22.159 1.00 0.00 C ATOM 992 CG PRO A 73 -8.469 -3.548 -23.213 1.00 0.00 C ATOM 993 CD PRO A 73 -8.319 -5.035 -23.046 1.00 0.00 C ATOM 0 HA PRO A 73 -10.763 -4.416 -20.979 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -9.956 -2.205 -22.456 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -8.913 -2.888 -21.224 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -8.844 -3.303 -24.207 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -7.509 -3.044 -23.101 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -8.153 -5.532 -24.002 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -7.473 -5.284 -22.406 1.00 0.00 H new ATOM 1001 N GLY A 74 -11.448 -4.061 -24.168 1.00 0.00 N ATOM 1002 CA GLY A 74 -12.565 -3.869 -25.074 1.00 0.00 C ATOM 1003 C GLY A 74 -13.665 -4.891 -24.862 1.00 0.00 C ATOM 1004 O GLY A 74 -14.816 -4.533 -24.610 1.00 0.00 O ATOM 0 H GLY A 74 -10.542 -4.174 -24.623 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -12.972 -2.867 -24.937 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -12.209 -3.930 -26.103 1.00 0.00 H new ATOM 1008 N LYS A 75 -13.312 -6.167 -24.966 1.00 0.00 N ATOM 1009 CA LYS A 75 -14.277 -7.245 -24.786 1.00 0.00 C ATOM 1010 C LYS A 75 -14.935 -7.162 -23.412 1.00 0.00 C ATOM 1011 O LYS A 75 -16.039 -7.668 -23.209 1.00 0.00 O ATOM 1012 CB LYS A 75 -13.593 -8.604 -24.954 1.00 0.00 C ATOM 1013 CG LYS A 75 -13.064 -8.849 -26.356 1.00 0.00 C ATOM 1014 CD LYS A 75 -14.108 -9.512 -27.238 1.00 0.00 C ATOM 1015 CE LYS A 75 -14.968 -8.483 -27.955 1.00 0.00 C ATOM 1016 NZ LYS A 75 -15.603 -9.045 -29.179 1.00 0.00 N ATOM 0 H LYS A 75 -12.364 -6.480 -25.174 1.00 0.00 H new ATOM 0 HA LYS A 75 -15.050 -7.138 -25.547 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -12.768 -8.676 -24.246 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -14.302 -9.392 -24.699 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -12.759 -7.902 -26.801 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -12.176 -9.479 -26.306 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -13.614 -10.149 -27.972 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -14.742 -10.158 -26.630 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -15.742 -8.122 -27.278 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -14.355 -7.623 -28.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -16.180 -8.312 -29.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -14.864 -9.367 -29.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -16.208 -9.849 -28.918 1.00 0.00 H new ATOM 1030 N CYS A 76 -14.250 -6.520 -22.471 1.00 0.00 N ATOM 1031 CA CYS A 76 -14.768 -6.369 -21.116 1.00 0.00 C ATOM 1032 C CYS A 76 -15.746 -5.201 -21.035 1.00 0.00 C ATOM 1033 O CYS A 76 -16.653 -5.194 -20.204 1.00 0.00 O ATOM 1034 CB CYS A 76 -13.618 -6.156 -20.130 1.00 0.00 C ATOM 1035 SG CYS A 76 -12.953 -7.696 -19.419 1.00 0.00 S ATOM 0 H CYS A 76 -13.335 -6.096 -22.622 1.00 0.00 H new ATOM 0 HA CYS A 76 -15.300 -7.283 -20.852 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -12.812 -5.625 -20.637 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -13.963 -5.513 -19.320 1.00 0.00 H new ATOM 1040 N GLY A 77 -15.554 -4.214 -21.905 1.00 0.00 N ATOM 1041 CA GLY A 77 -16.427 -3.054 -21.915 1.00 0.00 C ATOM 1042 C GLY A 77 -15.854 -1.891 -21.129 1.00 0.00 C ATOM 1043 O GLY A 77 -16.513 -0.866 -20.954 1.00 0.00 O ATOM 0 H GLY A 77 -14.810 -4.197 -22.603 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -16.600 -2.742 -22.945 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -17.396 -3.328 -21.498 1.00 0.00 H new ATOM 1047 N VAL A 78 -14.624 -2.051 -20.651 1.00 0.00 N ATOM 1048 CA VAL A 78 -13.963 -1.006 -19.878 1.00 0.00 C ATOM 1049 C VAL A 78 -13.194 -0.053 -20.786 1.00 0.00 C ATOM 1050 O VAL A 78 -12.545 -0.479 -21.741 1.00 0.00 O ATOM 1051 CB VAL A 78 -12.993 -1.604 -18.841 1.00 0.00 C ATOM 1052 CG1 VAL A 78 -13.762 -2.335 -17.751 1.00 0.00 C ATOM 1053 CG2 VAL A 78 -11.997 -2.533 -19.517 1.00 0.00 C ATOM 0 H VAL A 78 -14.065 -2.894 -20.785 1.00 0.00 H new ATOM 0 HA VAL A 78 -14.746 -0.454 -19.357 1.00 0.00 H new ATOM 0 HB VAL A 78 -12.437 -0.790 -18.377 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -13.061 -2.751 -17.027 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -14.432 -1.637 -17.248 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -14.345 -3.141 -18.196 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -11.320 -2.946 -18.770 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -12.533 -3.345 -20.009 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -11.424 -1.975 -20.257 1.00 0.00 H new ATOM 1063 N SER A 79 -13.272 1.238 -20.482 1.00 0.00 N ATOM 1064 CA SER A 79 -12.586 2.253 -21.273 1.00 0.00 C ATOM 1065 C SER A 79 -11.328 2.740 -20.559 1.00 0.00 C ATOM 1066 O SER A 79 -11.239 2.689 -19.332 1.00 0.00 O ATOM 1067 CB SER A 79 -13.520 3.433 -21.547 1.00 0.00 C ATOM 1068 OG SER A 79 -12.795 4.561 -22.006 1.00 0.00 O ATOM 0 H SER A 79 -13.804 1.606 -19.693 1.00 0.00 H new ATOM 0 HA SER A 79 -12.293 1.803 -22.221 1.00 0.00 H new ATOM 0 HB2 SER A 79 -14.264 3.147 -22.291 1.00 0.00 H new ATOM 0 HB3 SER A 79 -14.062 3.691 -20.637 1.00 0.00 H new ATOM 0 HG SER A 79 -13.414 5.301 -22.176 1.00 0.00 H new ATOM 1074 N ILE A 80 -10.360 3.211 -21.337 1.00 0.00 N ATOM 1075 CA ILE A 80 -9.108 3.708 -20.780 1.00 0.00 C ATOM 1076 C ILE A 80 -8.448 4.712 -21.719 1.00 0.00 C ATOM 1077 O ILE A 80 -8.696 4.727 -22.925 1.00 0.00 O ATOM 1078 CB ILE A 80 -8.121 2.559 -20.500 1.00 0.00 C ATOM 1079 CG1 ILE A 80 -8.163 1.534 -21.635 1.00 0.00 C ATOM 1080 CG2 ILE A 80 -8.442 1.897 -19.169 1.00 0.00 C ATOM 1081 CD1 ILE A 80 -7.030 0.532 -21.587 1.00 0.00 C ATOM 0 H ILE A 80 -10.418 3.259 -22.354 1.00 0.00 H new ATOM 0 HA ILE A 80 -9.355 4.201 -19.840 1.00 0.00 H new ATOM 0 HB ILE A 80 -7.113 2.971 -20.444 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -9.112 0.999 -21.596 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -8.132 2.059 -22.590 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -7.736 1.087 -18.986 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -8.366 2.633 -18.369 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -9.455 1.495 -19.197 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -7.124 -0.163 -22.421 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -6.077 1.057 -21.657 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -7.072 -0.020 -20.648 1.00 0.00 H new ATOM 1093 N PRO A 81 -7.586 5.572 -21.156 1.00 0.00 N ATOM 1094 CA PRO A 81 -6.871 6.594 -21.926 1.00 0.00 C ATOM 1095 C PRO A 81 -5.819 5.992 -22.851 1.00 0.00 C ATOM 1096 O PRO A 81 -5.379 6.633 -23.806 1.00 0.00 O ATOM 1097 CB PRO A 81 -6.206 7.451 -20.845 1.00 0.00 C ATOM 1098 CG PRO A 81 -6.061 6.540 -19.676 1.00 0.00 C ATOM 1099 CD PRO A 81 -7.243 5.611 -19.725 1.00 0.00 C ATOM 0 HA PRO A 81 -7.539 7.153 -22.581 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -5.238 7.826 -21.177 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -6.816 8.319 -20.597 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -5.125 5.984 -19.729 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -6.045 7.103 -18.743 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -6.992 4.621 -19.345 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -8.072 5.983 -19.123 1.00 0.00 H new ATOM 1107 N TYR A 82 -5.420 4.759 -22.562 1.00 0.00 N ATOM 1108 CA TYR A 82 -4.417 4.072 -23.368 1.00 0.00 C ATOM 1109 C TYR A 82 -4.926 2.707 -23.822 1.00 0.00 C ATOM 1110 O TYR A 82 -6.092 2.367 -23.623 1.00 0.00 O ATOM 1111 CB TYR A 82 -3.120 3.907 -22.574 1.00 0.00 C ATOM 1112 CG TYR A 82 -3.289 3.118 -21.295 1.00 0.00 C ATOM 1113 CD1 TYR A 82 -3.297 1.729 -21.308 1.00 0.00 C ATOM 1114 CD2 TYR A 82 -3.440 3.762 -20.073 1.00 0.00 C ATOM 1115 CE1 TYR A 82 -3.452 1.004 -20.142 1.00 0.00 C ATOM 1116 CE2 TYR A 82 -3.594 3.046 -18.902 1.00 0.00 C ATOM 1117 CZ TYR A 82 -3.600 1.667 -18.942 1.00 0.00 C ATOM 1118 OH TYR A 82 -3.753 0.949 -17.778 1.00 0.00 O ATOM 0 H TYR A 82 -5.775 4.214 -21.776 1.00 0.00 H new ATOM 0 HA TYR A 82 -4.219 4.679 -24.252 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -2.380 3.411 -23.202 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -2.724 4.893 -22.333 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -3.180 1.207 -22.246 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -3.437 4.841 -20.038 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -3.457 -0.076 -20.170 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -3.709 3.563 -17.961 1.00 0.00 H new ATOM 0 HH TYR A 82 -3.844 1.566 -17.022 1.00 0.00 H new ATOM 1128 N LYS A 83 -4.041 1.928 -24.435 1.00 0.00 N ATOM 1129 CA LYS A 83 -4.396 0.598 -24.918 1.00 0.00 C ATOM 1130 C LYS A 83 -3.357 -0.432 -24.488 1.00 0.00 C ATOM 1131 O LYS A 83 -2.177 -0.112 -24.338 1.00 0.00 O ATOM 1132 CB LYS A 83 -4.524 0.604 -26.443 1.00 0.00 C ATOM 1133 CG LYS A 83 -3.194 0.736 -27.164 1.00 0.00 C ATOM 1134 CD LYS A 83 -3.356 1.417 -28.513 1.00 0.00 C ATOM 1135 CE LYS A 83 -3.669 0.411 -29.610 1.00 0.00 C ATOM 1136 NZ LYS A 83 -5.099 -0.005 -29.591 1.00 0.00 N ATOM 0 H LYS A 83 -3.072 2.195 -24.609 1.00 0.00 H new ATOM 0 HA LYS A 83 -5.356 0.324 -24.480 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -5.011 -0.318 -26.762 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -5.173 1.427 -26.742 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -2.500 1.308 -26.548 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -2.756 -0.252 -27.304 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -4.156 2.155 -28.456 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -2.442 1.956 -28.762 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -3.430 0.846 -30.580 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -3.034 -0.467 -29.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -5.371 -0.357 -30.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -5.232 -0.759 -28.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -5.694 0.810 -29.341 1.00 0.00 H new ATOM 1150 N ILE A 84 -3.802 -1.669 -24.292 1.00 0.00 N ATOM 1151 CA ILE A 84 -2.910 -2.746 -23.882 1.00 0.00 C ATOM 1152 C ILE A 84 -2.220 -3.376 -25.087 1.00 0.00 C ATOM 1153 O ILE A 84 -2.798 -4.216 -25.778 1.00 0.00 O ATOM 1154 CB ILE A 84 -3.667 -3.840 -23.108 1.00 0.00 C ATOM 1155 CG1 ILE A 84 -4.532 -3.214 -22.012 1.00 0.00 C ATOM 1156 CG2 ILE A 84 -2.688 -4.840 -22.511 1.00 0.00 C ATOM 1157 CD1 ILE A 84 -5.311 -4.229 -21.204 1.00 0.00 C ATOM 0 H ILE A 84 -4.775 -1.950 -24.411 1.00 0.00 H new ATOM 0 HA ILE A 84 -2.160 -2.303 -23.227 1.00 0.00 H new ATOM 0 HB ILE A 84 -4.320 -4.370 -23.802 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -3.894 -2.639 -21.341 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -5.230 -2.511 -22.468 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -3.238 -5.607 -21.967 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -2.111 -5.305 -23.310 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -2.013 -4.325 -21.828 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -5.902 -3.715 -20.446 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -5.975 -4.787 -21.864 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -4.618 -4.917 -20.719 1.00 0.00 H new ATOM 1169 N SER A 85 -0.979 -2.967 -25.333 1.00 0.00 N ATOM 1170 CA SER A 85 -0.210 -3.490 -26.456 1.00 0.00 C ATOM 1171 C SER A 85 1.283 -3.484 -26.141 1.00 0.00 C ATOM 1172 O SER A 85 1.805 -2.530 -25.564 1.00 0.00 O ATOM 1173 CB SER A 85 -0.481 -2.666 -27.715 1.00 0.00 C ATOM 1174 OG SER A 85 -1.585 -3.184 -28.436 1.00 0.00 O ATOM 0 H SER A 85 -0.485 -2.275 -24.770 1.00 0.00 H new ATOM 0 HA SER A 85 -0.523 -4.519 -26.631 1.00 0.00 H new ATOM 0 HB2 SER A 85 -0.676 -1.630 -27.440 1.00 0.00 H new ATOM 0 HB3 SER A 85 0.404 -2.666 -28.351 1.00 0.00 H new ATOM 0 HG SER A 85 -2.208 -3.616 -27.815 1.00 0.00 H new ATOM 1180 N THR A 86 1.967 -4.558 -26.526 1.00 0.00 N ATOM 1181 CA THR A 86 3.399 -4.678 -26.284 1.00 0.00 C ATOM 1182 C THR A 86 4.177 -3.617 -27.053 1.00 0.00 C ATOM 1183 O THR A 86 5.322 -3.309 -26.720 1.00 0.00 O ATOM 1184 CB THR A 86 3.921 -6.071 -26.684 1.00 0.00 C ATOM 1185 OG1 THR A 86 3.188 -6.564 -27.812 1.00 0.00 O ATOM 1186 CG2 THR A 86 3.796 -7.049 -25.525 1.00 0.00 C ATOM 0 H THR A 86 1.552 -5.356 -27.006 1.00 0.00 H new ATOM 0 HA THR A 86 3.552 -4.533 -25.215 1.00 0.00 H new ATOM 0 HB THR A 86 4.974 -5.978 -26.948 1.00 0.00 H new ATOM 0 HG1 THR A 86 3.527 -7.449 -28.061 1.00 0.00 H new ATOM 0 HG21 THR A 86 4.171 -8.026 -25.831 1.00 0.00 H new ATOM 0 HG22 THR A 86 4.378 -6.686 -24.678 1.00 0.00 H new ATOM 0 HG23 THR A 86 2.749 -7.137 -25.234 1.00 0.00 H new ATOM 1194 N SER A 87 3.549 -3.059 -28.084 1.00 0.00 N ATOM 1195 CA SER A 87 4.185 -2.034 -28.902 1.00 0.00 C ATOM 1196 C SER A 87 3.853 -0.639 -28.380 1.00 0.00 C ATOM 1197 O SER A 87 4.592 0.318 -28.616 1.00 0.00 O ATOM 1198 CB SER A 87 3.738 -2.165 -30.360 1.00 0.00 C ATOM 1199 OG SER A 87 4.135 -3.411 -30.905 1.00 0.00 O ATOM 0 H SER A 87 2.601 -3.300 -28.372 1.00 0.00 H new ATOM 0 HA SER A 87 5.264 -2.177 -28.846 1.00 0.00 H new ATOM 0 HB2 SER A 87 2.654 -2.066 -30.422 1.00 0.00 H new ATOM 0 HB3 SER A 87 4.166 -1.354 -30.949 1.00 0.00 H new ATOM 0 HG SER A 87 3.836 -3.471 -31.836 1.00 0.00 H new ATOM 1205 N THR A 88 2.736 -0.531 -27.668 1.00 0.00 N ATOM 1206 CA THR A 88 2.304 0.746 -27.113 1.00 0.00 C ATOM 1207 C THR A 88 3.056 1.068 -25.827 1.00 0.00 C ATOM 1208 O THR A 88 3.235 0.205 -24.969 1.00 0.00 O ATOM 1209 CB THR A 88 0.791 0.749 -26.824 1.00 0.00 C ATOM 1210 OG1 THR A 88 0.057 0.673 -28.052 1.00 0.00 O ATOM 1211 CG2 THR A 88 0.388 2.004 -26.065 1.00 0.00 C ATOM 0 H THR A 88 2.114 -1.313 -27.462 1.00 0.00 H new ATOM 0 HA THR A 88 2.525 1.508 -27.861 1.00 0.00 H new ATOM 0 HB THR A 88 0.560 -0.120 -26.208 1.00 0.00 H new ATOM 0 HG1 THR A 88 -0.258 1.567 -28.301 1.00 0.00 H new ATOM 0 HG21 THR A 88 -0.685 1.984 -25.872 1.00 0.00 H new ATOM 0 HG22 THR A 88 0.926 2.045 -25.118 1.00 0.00 H new ATOM 0 HG23 THR A 88 0.633 2.884 -26.660 1.00 0.00 H new ATOM 1219 N ASN A 89 3.493 2.317 -25.700 1.00 0.00 N ATOM 1220 CA ASN A 89 4.226 2.754 -24.518 1.00 0.00 C ATOM 1221 C ASN A 89 3.272 3.274 -23.447 1.00 0.00 C ATOM 1222 O ASN A 89 2.913 4.452 -23.440 1.00 0.00 O ATOM 1223 CB ASN A 89 5.235 3.842 -24.890 1.00 0.00 C ATOM 1224 CG ASN A 89 6.369 3.947 -23.888 1.00 0.00 C ATOM 1225 OD1 ASN A 89 6.639 5.021 -23.351 1.00 0.00 O ATOM 1226 ND2 ASN A 89 7.038 2.829 -23.632 1.00 0.00 N ATOM 0 H ASN A 89 3.352 3.044 -26.401 1.00 0.00 H new ATOM 0 HA ASN A 89 4.762 1.894 -24.116 1.00 0.00 H new ATOM 0 HB2 ASN A 89 5.645 3.631 -25.878 1.00 0.00 H new ATOM 0 HB3 ASN A 89 4.722 4.802 -24.956 1.00 0.00 H new ATOM 0 HD21 ASN A 89 7.811 2.838 -22.966 1.00 0.00 H new ATOM 0 HD22 ASN A 89 6.779 1.961 -24.101 1.00 0.00 H new ATOM 1233 N CYS A 90 2.865 2.389 -22.544 1.00 0.00 N ATOM 1234 CA CYS A 90 1.952 2.758 -21.469 1.00 0.00 C ATOM 1235 C CYS A 90 2.589 3.793 -20.546 1.00 0.00 C ATOM 1236 O CYS A 90 1.904 4.434 -19.749 1.00 0.00 O ATOM 1237 CB CYS A 90 1.552 1.519 -20.664 1.00 0.00 C ATOM 1238 SG CYS A 90 -0.119 1.608 -19.945 1.00 0.00 S ATOM 0 H CYS A 90 3.153 1.411 -22.535 1.00 0.00 H new ATOM 0 HA CYS A 90 1.060 3.196 -21.917 1.00 0.00 H new ATOM 0 HB2 CYS A 90 1.612 0.644 -21.311 1.00 0.00 H new ATOM 0 HB3 CYS A 90 2.274 1.372 -19.861 1.00 0.00 H new ATOM 1243 N ASN A 91 3.903 3.952 -20.662 1.00 0.00 N ATOM 1244 CA ASN A 91 4.633 4.910 -19.839 1.00 0.00 C ATOM 1245 C ASN A 91 4.357 6.340 -20.294 1.00 0.00 C ATOM 1246 O ASN A 91 4.762 7.301 -19.640 1.00 0.00 O ATOM 1247 CB ASN A 91 6.135 4.624 -19.897 1.00 0.00 C ATOM 1248 CG ASN A 91 6.867 5.124 -18.667 1.00 0.00 C ATOM 1249 OD1 ASN A 91 6.285 5.236 -17.587 1.00 0.00 O ATOM 1250 ND2 ASN A 91 8.150 5.428 -18.825 1.00 0.00 N ATOM 0 H ASN A 91 4.484 3.430 -21.318 1.00 0.00 H new ATOM 0 HA ASN A 91 4.290 4.803 -18.810 1.00 0.00 H new ATOM 0 HB2 ASN A 91 6.294 3.551 -20.000 1.00 0.00 H new ATOM 0 HB3 ASN A 91 6.558 5.095 -20.784 1.00 0.00 H new ATOM 0 HD21 ASN A 91 8.694 5.770 -18.033 1.00 0.00 H new ATOM 0 HD22 ASN A 91 8.591 5.320 -19.738 1.00 0.00 H new ATOM 1257 N THR A 92 3.665 6.473 -21.421 1.00 0.00 N ATOM 1258 CA THR A 92 3.335 7.784 -21.965 1.00 0.00 C ATOM 1259 C THR A 92 2.062 8.336 -21.335 1.00 0.00 C ATOM 1260 O THR A 92 1.742 9.515 -21.488 1.00 0.00 O ATOM 1261 CB THR A 92 3.157 7.729 -23.494 1.00 0.00 C ATOM 1262 OG1 THR A 92 2.069 6.860 -23.829 1.00 0.00 O ATOM 1263 CG2 THR A 92 4.429 7.243 -24.170 1.00 0.00 C ATOM 0 H THR A 92 3.322 5.688 -21.975 1.00 0.00 H new ATOM 0 HA THR A 92 4.169 8.444 -21.728 1.00 0.00 H new ATOM 0 HB THR A 92 2.939 8.736 -23.849 1.00 0.00 H new ATOM 0 HG1 THR A 92 2.411 5.956 -23.994 1.00 0.00 H new ATOM 0 HG21 THR A 92 4.279 7.213 -25.249 1.00 0.00 H new ATOM 0 HG22 THR A 92 5.248 7.924 -23.937 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.674 6.244 -23.809 1.00 0.00 H new ATOM 1271 N VAL A 93 1.337 7.477 -20.626 1.00 0.00 N ATOM 1272 CA VAL A 93 0.098 7.880 -19.971 1.00 0.00 C ATOM 1273 C VAL A 93 0.324 9.081 -19.059 1.00 0.00 C ATOM 1274 O VAL A 93 1.374 9.206 -18.428 1.00 0.00 O ATOM 1275 CB VAL A 93 -0.500 6.726 -19.144 1.00 0.00 C ATOM 1276 CG1 VAL A 93 -1.777 7.174 -18.449 1.00 0.00 C ATOM 1277 CG2 VAL A 93 -0.761 5.516 -20.028 1.00 0.00 C ATOM 0 H VAL A 93 1.586 6.497 -20.490 1.00 0.00 H new ATOM 0 HA VAL A 93 -0.603 8.153 -20.760 1.00 0.00 H new ATOM 0 HB VAL A 93 0.221 6.439 -18.379 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -2.186 6.346 -17.870 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -1.556 8.008 -17.783 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -2.506 7.489 -19.195 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -1.183 4.711 -19.427 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -1.463 5.786 -20.817 1.00 0.00 H new ATOM 0 HG23 VAL A 93 0.176 5.183 -20.474 1.00 0.00 H new ATOM 1287 N ARG A 94 -0.669 9.962 -18.994 1.00 0.00 N ATOM 1288 CA ARG A 94 -0.579 11.154 -18.159 1.00 0.00 C ATOM 1289 C ARG A 94 -0.752 10.800 -16.685 1.00 0.00 C ATOM 1290 O ARG A 94 -1.582 9.963 -16.330 1.00 0.00 O ATOM 1291 CB ARG A 94 -1.637 12.176 -18.577 1.00 0.00 C ATOM 1292 CG ARG A 94 -1.298 12.914 -19.862 1.00 0.00 C ATOM 1293 CD ARG A 94 -1.220 14.416 -19.637 1.00 0.00 C ATOM 1294 NE ARG A 94 -1.304 15.161 -20.891 1.00 0.00 N ATOM 1295 CZ ARG A 94 -0.995 16.448 -21.002 1.00 0.00 C ATOM 1296 NH1 ARG A 94 -0.583 17.129 -19.941 1.00 0.00 N ATOM 1297 NH2 ARG A 94 -1.096 17.057 -22.177 1.00 0.00 N ATOM 0 H ARG A 94 -1.545 9.873 -19.509 1.00 0.00 H new ATOM 0 HA ARG A 94 0.411 11.589 -18.296 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -2.592 11.667 -18.702 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -1.766 12.902 -17.774 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -0.345 12.553 -20.250 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -2.053 12.697 -20.618 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -2.029 14.726 -18.976 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -0.285 14.659 -19.132 1.00 0.00 H new ATOM 0 HE ARG A 94 -1.617 14.666 -21.726 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -0.503 16.664 -19.036 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -0.346 18.117 -20.030 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -1.411 16.537 -22.996 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -0.858 18.045 -22.261 1.00 0.00 H new ATOM 1311 N PHE A 95 0.038 11.442 -15.831 1.00 0.00 N ATOM 1312 CA PHE A 95 -0.026 11.194 -14.395 1.00 0.00 C ATOM 1313 C PHE A 95 0.015 9.698 -14.100 1.00 0.00 C ATOM 1314 O PHE A 95 -0.996 9.138 -13.679 1.00 0.00 O ATOM 1315 CB PHE A 95 -1.298 11.807 -13.807 1.00 0.00 C ATOM 1316 CG PHE A 95 -1.121 13.224 -13.341 1.00 0.00 C ATOM 1317 CD1 PHE A 95 -1.216 14.278 -14.236 1.00 0.00 C ATOM 1318 CD2 PHE A 95 -0.860 13.502 -12.009 1.00 0.00 C ATOM 1319 CE1 PHE A 95 -1.054 15.583 -13.811 1.00 0.00 C ATOM 1320 CE2 PHE A 95 -0.697 14.805 -11.578 1.00 0.00 C ATOM 1321 CZ PHE A 95 -0.793 15.847 -12.480 1.00 0.00 C ATOM 0 H PHE A 95 0.730 12.138 -16.108 1.00 0.00 H new ATOM 0 HA PHE A 95 0.842 11.662 -13.931 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -2.087 11.776 -14.558 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -1.632 11.196 -12.968 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -1.419 14.077 -15.278 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -0.783 12.691 -11.300 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -1.131 16.395 -14.518 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -0.495 15.008 -10.537 1.00 0.00 H new ATOM 0 HZ PHE A 95 -0.664 16.866 -12.146 1.00 0.00 H new TER 1331 PHE A 95