USER MOD reduce.3.24.130724 H: found=0, std=0, add=732, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 738 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: B 58 SER OG : rot 180:sc= 0.507 USER MOD Set 1.2: B 61 ASN : amide:sc= 0.556 X(o=1.1,f=0.79) USER MOD Set 2.1: A 58 SER OG : rot 180:sc= 0.507 USER MOD Set 2.2: A 61 ASN : amide:sc= 0.556 X(o=1.1,f=0.78) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl -173:sc= 0 (180deg=-0.0978) USER MOD Single : A 52 SER OG : rot -26:sc= 1.22 USER MOD Single : A 53 LYS NZ :NH3+ 132:sc= 1.23 (180deg=0.693) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 ASN : amide:sc= -0.0956 K(o=-0.096,f=-1.1) USER MOD Single : A 65 SER OG : rot 36:sc= 0.363 USER MOD Single : A 66 GLN : amide:sc= -0.0317 K(o=-0.032,f=-5.3!) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= 1.05 K(o=1.1,f=-1.1) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= 0.651 K(o=0.65,f=0) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : B 39 TYR OH : rot 180:sc= 0 USER MOD Single : B 42 THR OG1 : rot 180:sc= 0 USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 MET CE :methyl -173:sc= 0 (180deg=-0.104) USER MOD Single : B 52 SER OG : rot -27:sc= 1.25 USER MOD Single : B 53 LYS NZ :NH3+ 152:sc= 1.31 (180deg=0.674) USER MOD Single : B 54 TYR OH : rot 180:sc= 0 USER MOD Single : B 56 ASN : amide:sc= -0.175 K(o=-0.17,f=-1.2) USER MOD Single : B 65 SER OG : rot 180:sc= 0.416 USER MOD Single : B 66 GLN : amide:sc= -0.0643 K(o=-0.064,f=-5.3!) USER MOD Single : B 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 69 GLN : amide:sc= 1.05 K(o=1,f=-0.98) USER MOD Single : B 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 78 ASN : amide:sc= 0.65 K(o=0.65,f=0) USER MOD Single : B 80 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 38 -8.562 -16.244 -93.895 1.00 0.00 N ATOM 2 CA ASP A 38 -7.434 -16.662 -94.720 1.00 0.00 C ATOM 3 C ASP A 38 -6.947 -15.523 -95.605 1.00 0.00 C ATOM 4 O ASP A 38 -5.875 -15.605 -96.205 1.00 0.00 O ATOM 5 CB ASP A 38 -7.822 -17.862 -95.589 1.00 0.00 C ATOM 6 CG ASP A 38 -8.142 -19.106 -94.773 1.00 0.00 C ATOM 7 OD1 ASP A 38 -7.486 -19.329 -93.783 1.00 0.00 O ATOM 8 OD2 ASP A 38 -9.040 -19.822 -95.147 1.00 0.00 O ATOM 0 HA ASP A 38 -6.623 -16.950 -94.051 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -8.688 -17.599 -96.196 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -7.006 -18.085 -96.277 1.00 0.00 H new ATOM 13 N TYR A 39 -7.739 -14.459 -95.681 1.00 0.00 N ATOM 14 CA TYR A 39 -7.416 -13.323 -96.536 1.00 0.00 C ATOM 15 C TYR A 39 -6.578 -12.293 -95.791 1.00 0.00 C ATOM 16 O TYR A 39 -5.608 -11.761 -96.329 1.00 0.00 O ATOM 17 CB TYR A 39 -8.696 -12.678 -97.074 1.00 0.00 C ATOM 18 CG TYR A 39 -8.452 -11.643 -98.151 1.00 0.00 C ATOM 19 CD1 TYR A 39 -7.937 -12.031 -99.380 1.00 0.00 C ATOM 20 CD2 TYR A 39 -8.743 -10.309 -97.910 1.00 0.00 C ATOM 21 CE1 TYR A 39 -7.714 -11.087-100.364 1.00 0.00 C ATOM 22 CE2 TYR A 39 -8.520 -9.365 -98.894 1.00 0.00 C ATOM 23 CZ TYR A 39 -8.008 -9.750-100.116 1.00 0.00 C ATOM 24 OH TYR A 39 -7.786 -8.810-101.096 1.00 0.00 O ATOM 0 H TYR A 39 -8.610 -14.360 -95.160 1.00 0.00 H new ATOM 0 HA TYR A 39 -6.828 -13.693 -97.376 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -9.345 -13.458 -97.473 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -9.231 -12.210 -96.248 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -7.711 -13.070 -99.567 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -9.144 -10.008 -96.953 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -7.313 -11.386-101.321 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -8.746 -8.326 -98.707 1.00 0.00 H new ATOM 0 HH TYR A 39 -8.044 -7.925-100.765 1.00 0.00 H new ATOM 34 N LEU A 40 -6.960 -12.015 -94.549 1.00 0.00 N ATOM 35 CA LEU A 40 -6.296 -10.986 -93.756 1.00 0.00 C ATOM 36 C LEU A 40 -4.805 -11.270 -93.621 1.00 0.00 C ATOM 37 O LEU A 40 -3.975 -10.377 -93.789 1.00 0.00 O ATOM 38 CB LEU A 40 -6.933 -10.897 -92.364 1.00 0.00 C ATOM 39 CG LEU A 40 -6.254 -9.934 -91.381 1.00 0.00 C ATOM 40 CD1 LEU A 40 -6.310 -8.517 -91.938 1.00 0.00 C ATOM 41 CD2 LEU A 40 -6.944 -10.018 -90.028 1.00 0.00 C ATOM 0 H LEU A 40 -7.726 -12.488 -94.069 1.00 0.00 H new ATOM 0 HA LEU A 40 -6.419 -10.034 -94.273 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -7.974 -10.595 -92.480 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -6.938 -11.894 -91.923 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.208 -10.211 -91.250 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.828 -7.832 -91.240 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -5.792 -8.482 -92.897 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -7.350 -8.221 -92.076 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -6.461 -9.334 -89.330 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -7.993 -9.744 -90.137 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -6.872 -11.036 -89.646 1.00 0.00 H new ATOM 53 N PRO A 41 -4.472 -12.520 -93.318 1.00 0.00 N ATOM 54 CA PRO A 41 -3.078 -12.939 -93.220 1.00 0.00 C ATOM 55 C PRO A 41 -2.276 -12.471 -94.427 1.00 0.00 C ATOM 56 O PRO A 41 -1.125 -12.055 -94.296 1.00 0.00 O ATOM 57 CB PRO A 41 -3.181 -14.466 -93.167 1.00 0.00 C ATOM 58 CG PRO A 41 -4.468 -14.723 -92.462 1.00 0.00 C ATOM 59 CD PRO A 41 -5.407 -13.678 -93.004 1.00 0.00 C ATOM 0 HA PRO A 41 -2.560 -12.518 -92.358 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -3.182 -14.900 -94.167 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -2.339 -14.903 -92.630 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -4.836 -15.730 -92.661 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -4.354 -14.633 -91.382 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -5.932 -14.027 -93.893 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -6.167 -13.399 -92.274 1.00 0.00 H new ATOM 67 N THR A 42 -2.891 -12.541 -95.603 1.00 0.00 N ATOM 68 CA THR A 42 -2.259 -12.063 -96.827 1.00 0.00 C ATOM 69 C THR A 42 -2.164 -10.543 -96.841 1.00 0.00 C ATOM 70 O THR A 42 -1.148 -9.979 -97.251 1.00 0.00 O ATOM 71 CB THR A 42 -3.028 -12.545 -98.071 1.00 0.00 C ATOM 72 OG1 THR A 42 -3.037 -13.978 -98.106 1.00 0.00 O ATOM 73 CG2 THR A 42 -2.376 -12.016 -99.339 1.00 0.00 C ATOM 0 H THR A 42 -3.827 -12.924 -95.734 1.00 0.00 H new ATOM 0 HA THR A 42 -1.251 -12.477 -96.853 1.00 0.00 H new ATOM 0 HB THR A 42 -4.050 -12.169 -98.015 1.00 0.00 H new ATOM 0 HG1 THR A 42 -3.528 -14.283 -98.897 1.00 0.00 H new ATOM 0 HG21 THR A 42 -2.933 -12.367-100.208 1.00 0.00 H new ATOM 0 HG22 THR A 42 -2.379 -10.926 -99.322 1.00 0.00 H new ATOM 0 HG23 THR A 42 -1.349 -12.376 -99.397 1.00 0.00 H new ATOM 81 N LEU A 43 -3.226 -9.884 -96.392 1.00 0.00 N ATOM 82 CA LEU A 43 -3.243 -8.429 -96.300 1.00 0.00 C ATOM 83 C LEU A 43 -2.133 -7.922 -95.389 1.00 0.00 C ATOM 84 O LEU A 43 -1.571 -6.850 -95.617 1.00 0.00 O ATOM 85 CB LEU A 43 -4.602 -7.947 -95.778 1.00 0.00 C ATOM 86 CG LEU A 43 -5.791 -8.154 -96.725 1.00 0.00 C ATOM 87 CD1 LEU A 43 -7.071 -7.689 -96.044 1.00 0.00 C ATOM 88 CD2 LEU A 43 -5.550 -7.389 -98.018 1.00 0.00 C ATOM 0 H LEU A 43 -4.088 -10.335 -96.085 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.077 -8.028 -97.300 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -4.814 -8.462 -94.841 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.526 -6.884 -95.548 1.00 0.00 H new ATOM 0 HG LEU A 43 -5.895 -9.212 -96.966 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -7.915 -7.836 -96.717 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.229 -8.266 -95.133 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -6.987 -6.631 -95.794 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -6.395 -7.536 -98.691 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -5.442 -6.327 -97.798 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -4.640 -7.755 -98.493 1.00 0.00 H new ATOM 100 N ARG A 44 -1.820 -8.698 -94.357 1.00 0.00 N ATOM 101 CA ARG A 44 -0.774 -8.330 -93.412 1.00 0.00 C ATOM 102 C ARG A 44 0.592 -8.298 -94.087 1.00 0.00 C ATOM 103 O ARG A 44 1.354 -7.344 -93.925 1.00 0.00 O ATOM 104 CB ARG A 44 -0.736 -9.308 -92.246 1.00 0.00 C ATOM 105 CG ARG A 44 -1.922 -9.218 -91.299 1.00 0.00 C ATOM 106 CD ARG A 44 -1.844 -10.240 -90.224 1.00 0.00 C ATOM 107 NE ARG A 44 -2.962 -10.141 -89.300 1.00 0.00 N ATOM 108 CZ ARG A 44 -3.209 -11.011 -88.301 1.00 0.00 C ATOM 109 NH1 ARG A 44 -2.409 -12.037 -88.110 1.00 0.00 N ATOM 110 NH2 ARG A 44 -4.255 -10.834 -87.513 1.00 0.00 N ATOM 0 H ARG A 44 -2.277 -9.587 -94.154 1.00 0.00 H new ATOM 0 HA ARG A 44 -1.006 -7.332 -93.040 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -0.682 -10.322 -92.642 1.00 0.00 H new ATOM 0 HB3 ARG A 44 0.178 -9.138 -91.678 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -1.958 -8.224 -90.854 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -2.847 -9.350 -91.860 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -1.828 -11.235 -90.669 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -0.909 -10.121 -89.677 1.00 0.00 H new ATOM 0 HE ARG A 44 -3.605 -9.358 -89.416 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -1.602 -12.174 -88.718 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -2.596 -12.696 -87.354 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -4.876 -10.038 -87.661 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -4.441 -11.493 -86.757 1.00 0.00 H new ATOM 124 N LYS A 45 0.897 -9.346 -94.844 1.00 0.00 N ATOM 125 CA LYS A 45 2.128 -9.397 -95.623 1.00 0.00 C ATOM 126 C LYS A 45 2.158 -8.299 -96.678 1.00 0.00 C ATOM 127 O LYS A 45 3.207 -7.710 -96.946 1.00 0.00 O ATOM 128 CB LYS A 45 2.287 -10.767 -96.285 1.00 0.00 C ATOM 129 CG LYS A 45 2.577 -11.905 -95.316 1.00 0.00 C ATOM 130 CD LYS A 45 2.688 -13.236 -96.043 1.00 0.00 C ATOM 131 CE LYS A 45 2.962 -14.376 -95.074 1.00 0.00 C ATOM 132 NZ LYS A 45 3.038 -15.690 -95.768 1.00 0.00 N ATOM 0 H LYS A 45 0.307 -10.173 -94.935 1.00 0.00 H new ATOM 0 HA LYS A 45 2.962 -9.236 -94.940 1.00 0.00 H new ATOM 0 HB2 LYS A 45 1.375 -10.999 -96.836 1.00 0.00 H new ATOM 0 HB3 LYS A 45 3.095 -10.713 -97.015 1.00 0.00 H new ATOM 0 HG2 LYS A 45 3.505 -11.702 -94.781 1.00 0.00 H new ATOM 0 HG3 LYS A 45 1.784 -11.961 -94.570 1.00 0.00 H new ATOM 0 HD2 LYS A 45 1.765 -13.433 -96.587 1.00 0.00 H new ATOM 0 HD3 LYS A 45 3.488 -13.184 -96.781 1.00 0.00 H new ATOM 0 HE2 LYS A 45 3.899 -14.188 -94.549 1.00 0.00 H new ATOM 0 HE3 LYS A 45 2.175 -14.409 -94.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 3.226 -16.440 -95.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 2.136 -15.882 -96.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 3.806 -15.668 -96.469 1.00 0.00 H new ATOM 146 N GLU A 46 1.003 -8.025 -97.274 1.00 0.00 N ATOM 147 CA GLU A 46 0.871 -6.928 -98.225 1.00 0.00 C ATOM 148 C GLU A 46 1.226 -5.595 -97.579 1.00 0.00 C ATOM 149 O GLU A 46 1.881 -4.752 -98.191 1.00 0.00 O ATOM 150 CB GLU A 46 -0.541 -6.882 -98.790 1.00 0.00 C ATOM 0 H GLU A 46 0.143 -8.549 -97.115 1.00 0.00 H new ATOM 0 HA GLU A 46 1.571 -7.105 -99.042 1.00 0.00 H new ATOM 155 N LEU A 47 0.789 -5.410 -96.337 1.00 0.00 N ATOM 156 CA LEU A 47 1.080 -4.189 -95.597 1.00 0.00 C ATOM 157 C LEU A 47 2.565 -4.080 -95.275 1.00 0.00 C ATOM 158 O LEU A 47 3.135 -2.989 -95.286 1.00 0.00 O ATOM 159 CB LEU A 47 0.265 -4.149 -94.298 1.00 0.00 C ATOM 160 CG LEU A 47 -1.239 -3.905 -94.464 1.00 0.00 C ATOM 161 CD1 LEU A 47 -1.943 -4.146 -93.135 1.00 0.00 C ATOM 162 CD2 LEU A 47 -1.473 -2.484 -94.956 1.00 0.00 C ATOM 0 H LEU A 47 0.231 -6.092 -95.822 1.00 0.00 H new ATOM 0 HA LEU A 47 0.801 -3.343 -96.226 1.00 0.00 H new ATOM 0 HB2 LEU A 47 0.405 -5.094 -93.774 1.00 0.00 H new ATOM 0 HB3 LEU A 47 0.673 -3.366 -93.659 1.00 0.00 H new ATOM 0 HG LEU A 47 -1.648 -4.596 -95.201 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.013 -3.972 -93.253 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -1.775 -5.175 -92.816 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -1.546 -3.464 -92.384 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -2.543 -2.311 -95.074 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -1.069 -1.777 -94.232 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -0.975 -2.345 -95.916 1.00 0.00 H new ATOM 174 N MET A 48 3.188 -5.218 -94.988 1.00 0.00 N ATOM 175 CA MET A 48 4.632 -5.274 -94.794 1.00 0.00 C ATOM 176 C MET A 48 5.372 -4.746 -96.016 1.00 0.00 C ATOM 177 O MET A 48 6.276 -3.919 -95.896 1.00 0.00 O ATOM 178 CB MET A 48 5.067 -6.705 -94.484 1.00 0.00 C ATOM 179 CG MET A 48 4.591 -7.231 -93.138 1.00 0.00 C ATOM 180 SD MET A 48 5.056 -8.952 -92.859 1.00 0.00 S ATOM 181 CE MET A 48 4.201 -9.288 -91.322 1.00 0.00 C ATOM 0 H MET A 48 2.714 -6.115 -94.884 1.00 0.00 H new ATOM 0 HA MET A 48 4.886 -4.636 -93.947 1.00 0.00 H new ATOM 0 HB2 MET A 48 4.695 -7.363 -95.269 1.00 0.00 H new ATOM 0 HB3 MET A 48 6.155 -6.755 -94.515 1.00 0.00 H new ATOM 0 HG2 MET A 48 5.008 -6.613 -92.343 1.00 0.00 H new ATOM 0 HG3 MET A 48 3.507 -7.138 -93.079 1.00 0.00 H new ATOM 0 HE1 MET A 48 4.489 -10.272 -90.953 1.00 0.00 H new ATOM 0 HE2 MET A 48 4.468 -8.531 -90.584 1.00 0.00 H new ATOM 0 HE3 MET A 48 3.125 -9.265 -91.492 1.00 0.00 H new ATOM 191 N GLU A 49 4.984 -5.228 -97.191 1.00 0.00 N ATOM 192 CA GLU A 49 5.532 -4.724 -98.445 1.00 0.00 C ATOM 193 C GLU A 49 5.384 -3.211 -98.542 1.00 0.00 C ATOM 194 O GLU A 49 6.335 -2.504 -98.875 1.00 0.00 O ATOM 195 CB GLU A 49 4.840 -5.391 -99.636 1.00 0.00 C ATOM 196 CG GLU A 49 5.322 -4.904-100.996 1.00 0.00 C ATOM 197 CD GLU A 49 4.577 -5.536-102.140 1.00 0.00 C ATOM 198 OE1 GLU A 49 4.107 -6.636-101.982 1.00 0.00 O ATOM 199 OE2 GLU A 49 4.478 -4.915-103.172 1.00 0.00 O ATOM 0 H GLU A 49 4.291 -5.968 -97.302 1.00 0.00 H new ATOM 0 HA GLU A 49 6.594 -4.967 -98.466 1.00 0.00 H new ATOM 0 HB2 GLU A 49 4.994 -6.468 -99.574 1.00 0.00 H new ATOM 0 HB3 GLU A 49 3.766 -5.218 -99.561 1.00 0.00 H new ATOM 0 HG2 GLU A 49 5.210 -3.821-101.050 1.00 0.00 H new ATOM 0 HG3 GLU A 49 6.386 -5.120-101.098 1.00 0.00 H new ATOM 206 N VAL A 50 4.184 -2.720 -98.249 1.00 0.00 N ATOM 207 CA VAL A 50 3.889 -1.297 -98.370 1.00 0.00 C ATOM 208 C VAL A 50 4.801 -0.467 -97.474 1.00 0.00 C ATOM 209 O VAL A 50 5.293 0.586 -97.879 1.00 0.00 O ATOM 210 CB VAL A 50 2.420 -1.022 -97.996 1.00 0.00 C ATOM 211 CG1 VAL A 50 2.177 0.473 -97.857 1.00 0.00 C ATOM 212 CG2 VAL A 50 1.499 -1.623 -99.046 1.00 0.00 C ATOM 0 H VAL A 50 3.400 -3.287 -97.926 1.00 0.00 H new ATOM 0 HA VAL A 50 4.063 -1.010 -99.407 1.00 0.00 H new ATOM 0 HB VAL A 50 2.205 -1.489 -97.035 1.00 0.00 H new ATOM 0 HG11 VAL A 50 1.134 0.649 -97.593 1.00 0.00 H new ATOM 0 HG12 VAL A 50 2.822 0.875 -97.076 1.00 0.00 H new ATOM 0 HG13 VAL A 50 2.400 0.967 -98.803 1.00 0.00 H new ATOM 0 HG21 VAL A 50 0.462 -1.425 -98.776 1.00 0.00 H new ATOM 0 HG22 VAL A 50 1.713 -1.176-100.017 1.00 0.00 H new ATOM 0 HG23 VAL A 50 1.661 -2.700 -99.099 1.00 0.00 H new ATOM 222 N LEU A 51 5.022 -0.948 -96.256 1.00 0.00 N ATOM 223 CA LEU A 51 5.820 -0.219 -95.277 1.00 0.00 C ATOM 224 C LEU A 51 7.302 -0.273 -95.624 1.00 0.00 C ATOM 225 O LEU A 51 8.031 0.700 -95.429 1.00 0.00 O ATOM 226 CB LEU A 51 5.595 -0.796 -93.874 1.00 0.00 C ATOM 227 CG LEU A 51 4.190 -0.600 -93.292 1.00 0.00 C ATOM 228 CD1 LEU A 51 4.032 -1.459 -92.044 1.00 0.00 C ATOM 229 CD2 LEU A 51 3.971 0.872 -92.974 1.00 0.00 C ATOM 0 H LEU A 51 4.659 -1.841 -95.922 1.00 0.00 H new ATOM 0 HA LEU A 51 5.501 0.823 -95.295 1.00 0.00 H new ATOM 0 HB2 LEU A 51 5.811 -1.864 -93.901 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.316 -0.342 -93.194 1.00 0.00 H new ATOM 0 HG LEU A 51 3.440 -0.909 -94.020 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.033 -1.320 -91.630 1.00 0.00 H new ATOM 0 HD12 LEU A 51 4.174 -2.508 -92.304 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.776 -1.165 -91.303 1.00 0.00 H new ATOM 0 HD21 LEU A 51 2.972 1.010 -92.560 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.713 1.202 -92.247 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.070 1.460 -93.886 1.00 0.00 H new ATOM 241 N SER A 52 7.743 -1.416 -96.139 1.00 0.00 N ATOM 242 CA SER A 52 9.130 -1.585 -96.554 1.00 0.00 C ATOM 243 C SER A 52 9.457 -0.707 -97.756 1.00 0.00 C ATOM 244 O SER A 52 10.619 -0.391 -98.007 1.00 0.00 O ATOM 245 CB SER A 52 9.401 -3.039 -96.889 1.00 0.00 C ATOM 246 OG SER A 52 8.731 -3.417 -98.060 1.00 0.00 O ATOM 0 H SER A 52 7.158 -2.240 -96.279 1.00 0.00 H new ATOM 0 HA SER A 52 9.769 -1.280 -95.725 1.00 0.00 H new ATOM 0 HB2 SER A 52 10.473 -3.194 -97.013 1.00 0.00 H new ATOM 0 HB3 SER A 52 9.081 -3.672 -96.062 1.00 0.00 H new ATOM 0 HG SER A 52 7.943 -2.848 -98.184 1.00 0.00 H new ATOM 252 N LYS A 53 8.424 -0.318 -98.495 1.00 0.00 N ATOM 253 CA LYS A 53 8.593 0.568 -99.641 1.00 0.00 C ATOM 254 C LYS A 53 8.421 2.027 -99.239 1.00 0.00 C ATOM 255 O LYS A 53 9.040 2.918 -99.821 1.00 0.00 O ATOM 256 CB LYS A 53 7.602 0.206-100.748 1.00 0.00 C ATOM 257 CG LYS A 53 7.898 -1.111-101.452 1.00 0.00 C ATOM 258 CD LYS A 53 6.837 -1.432-102.494 1.00 0.00 C ATOM 259 CE LYS A 53 7.222 -2.649-103.322 1.00 0.00 C ATOM 260 NZ LYS A 53 6.138 -3.050-104.259 1.00 0.00 N ATOM 0 H LYS A 53 7.460 -0.602 -98.321 1.00 0.00 H new ATOM 0 HA LYS A 53 9.607 0.437-100.018 1.00 0.00 H new ATOM 0 HB2 LYS A 53 6.600 0.158-100.321 1.00 0.00 H new ATOM 0 HB3 LYS A 53 7.595 1.006-101.488 1.00 0.00 H new ATOM 0 HG2 LYS A 53 8.876 -1.058-101.930 1.00 0.00 H new ATOM 0 HG3 LYS A 53 7.945 -1.916-100.718 1.00 0.00 H new ATOM 0 HD2 LYS A 53 5.883 -1.614-102.000 1.00 0.00 H new ATOM 0 HD3 LYS A 53 6.698 -0.573-103.150 1.00 0.00 H new ATOM 0 HE2 LYS A 53 8.128 -2.431-103.887 1.00 0.00 H new ATOM 0 HE3 LYS A 53 7.453 -3.481-102.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 6.537 -3.201-105.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 5.698 -3.931-103.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 5.420 -2.299-104.302 1.00 0.00 H new ATOM 274 N TYR A 54 7.576 2.266 -98.242 1.00 0.00 N ATOM 275 CA TYR A 54 7.294 3.621 -97.784 1.00 0.00 C ATOM 276 C TYR A 54 8.425 4.154 -96.914 1.00 0.00 C ATOM 277 O TYR A 54 9.049 5.164 -97.240 1.00 0.00 O ATOM 278 CB TYR A 54 5.970 3.662 -97.017 1.00 0.00 C ATOM 279 CG TYR A 54 4.749 3.674 -97.909 1.00 0.00 C ATOM 280 CD1 TYR A 54 4.875 3.397 -99.263 1.00 0.00 C ATOM 281 CD2 TYR A 54 3.503 3.963 -97.374 1.00 0.00 C ATOM 282 CE1 TYR A 54 3.760 3.407-100.077 1.00 0.00 C ATOM 283 CE2 TYR A 54 2.387 3.975 -98.189 1.00 0.00 C ATOM 284 CZ TYR A 54 2.512 3.698 -99.535 1.00 0.00 C ATOM 285 OH TYR A 54 1.402 3.709-100.346 1.00 0.00 O ATOM 0 H TYR A 54 7.074 1.537 -97.735 1.00 0.00 H new ATOM 0 HA TYR A 54 7.212 4.261 -98.662 1.00 0.00 H new ATOM 0 HB2 TYR A 54 5.917 2.797 -96.356 1.00 0.00 H new ATOM 0 HB3 TYR A 54 5.955 4.549 -96.384 1.00 0.00 H new ATOM 0 HD1 TYR A 54 5.846 3.173 -99.680 1.00 0.00 H new ATOM 0 HD2 TYR A 54 3.405 4.179 -96.320 1.00 0.00 H new ATOM 0 HE1 TYR A 54 3.856 3.190-101.131 1.00 0.00 H new ATOM 0 HE2 TYR A 54 1.417 4.201 -97.772 1.00 0.00 H new ATOM 0 HH TYR A 54 0.610 3.929 -99.813 1.00 0.00 H new ATOM 295 N VAL A 55 8.685 3.470 -95.805 1.00 0.00 N ATOM 296 CA VAL A 55 9.646 3.947 -94.818 1.00 0.00 C ATOM 297 C VAL A 55 11.016 3.315 -95.032 1.00 0.00 C ATOM 298 O VAL A 55 11.960 3.591 -94.293 1.00 0.00 O ATOM 299 CB VAL A 55 9.153 3.627 -93.394 1.00 0.00 C ATOM 300 CG1 VAL A 55 10.165 4.101 -92.361 1.00 0.00 C ATOM 301 CG2 VAL A 55 7.798 4.275 -93.158 1.00 0.00 C ATOM 0 H VAL A 55 8.243 2.582 -95.567 1.00 0.00 H new ATOM 0 HA VAL A 55 9.737 5.026 -94.939 1.00 0.00 H new ATOM 0 HB VAL A 55 9.046 2.547 -93.291 1.00 0.00 H new ATOM 0 HG11 VAL A 55 9.801 3.867 -91.361 1.00 0.00 H new ATOM 0 HG12 VAL A 55 11.118 3.598 -92.527 1.00 0.00 H new ATOM 0 HG13 VAL A 55 10.303 5.178 -92.454 1.00 0.00 H new ATOM 0 HG21 VAL A 55 7.455 4.045 -92.149 1.00 0.00 H new ATOM 0 HG22 VAL A 55 7.886 5.355 -93.273 1.00 0.00 H new ATOM 0 HG23 VAL A 55 7.080 3.890 -93.882 1.00 0.00 H new ATOM 311 N ASN A 56 11.116 2.464 -96.048 1.00 0.00 N ATOM 312 CA ASN A 56 12.390 1.857 -96.415 1.00 0.00 C ATOM 313 C ASN A 56 12.915 0.962 -95.299 1.00 0.00 C ATOM 314 O ASN A 56 14.124 0.787 -95.148 1.00 0.00 O ATOM 315 CB ASN A 56 13.409 2.924 -96.768 1.00 0.00 C ATOM 316 CG ASN A 56 14.507 2.405 -97.654 1.00 0.00 C ATOM 317 OD1 ASN A 56 14.267 1.575 -98.539 1.00 0.00 O ATOM 318 ND2 ASN A 56 15.708 2.876 -97.434 1.00 0.00 N ATOM 0 H ASN A 56 10.330 2.179 -96.632 1.00 0.00 H new ATOM 0 HA ASN A 56 12.223 1.234 -97.294 1.00 0.00 H new ATOM 0 HB2 ASN A 56 12.905 3.751 -97.267 1.00 0.00 H new ATOM 0 HB3 ASN A 56 13.844 3.322 -95.852 1.00 0.00 H new ATOM 0 HD21 ASN A 56 16.492 2.559 -98.004 1.00 0.00 H new ATOM 0 HD22 ASN A 56 15.860 3.560 -96.693 1.00 0.00 H new ATOM 325 N VAL A 57 11.999 0.397 -94.520 1.00 0.00 N ATOM 326 CA VAL A 57 12.359 -0.578 -93.497 1.00 0.00 C ATOM 327 C VAL A 57 12.322 -1.995 -94.051 1.00 0.00 C ATOM 328 O VAL A 57 11.824 -2.229 -95.152 1.00 0.00 O ATOM 329 CB VAL A 57 11.398 -0.474 -92.298 1.00 0.00 C ATOM 330 CG1 VAL A 57 11.512 0.894 -91.641 1.00 0.00 C ATOM 331 CG2 VAL A 57 9.971 -0.736 -92.753 1.00 0.00 C ATOM 0 H VAL A 57 11.001 0.598 -94.578 1.00 0.00 H new ATOM 0 HA VAL A 57 13.375 -0.357 -93.171 1.00 0.00 H new ATOM 0 HB VAL A 57 11.672 -1.227 -91.559 1.00 0.00 H new ATOM 0 HG11 VAL A 57 10.826 0.950 -90.796 1.00 0.00 H new ATOM 0 HG12 VAL A 57 12.533 1.045 -91.290 1.00 0.00 H new ATOM 0 HG13 VAL A 57 11.259 1.668 -92.366 1.00 0.00 H new ATOM 0 HG21 VAL A 57 9.297 -0.661 -91.899 1.00 0.00 H new ATOM 0 HG22 VAL A 57 9.688 0.001 -93.505 1.00 0.00 H new ATOM 0 HG23 VAL A 57 9.903 -1.736 -93.181 1.00 0.00 H new ATOM 341 N SER A 58 12.854 -2.940 -93.282 1.00 0.00 N ATOM 342 CA SER A 58 12.815 -4.348 -93.660 1.00 0.00 C ATOM 343 C SER A 58 11.739 -5.097 -92.884 1.00 0.00 C ATOM 344 O SER A 58 11.109 -4.542 -91.983 1.00 0.00 O ATOM 345 CB SER A 58 14.166 -4.991 -93.417 1.00 0.00 C ATOM 346 OG SER A 58 14.424 -5.116 -92.045 1.00 0.00 O ATOM 0 H SER A 58 13.318 -2.756 -92.392 1.00 0.00 H new ATOM 0 HA SER A 58 12.573 -4.405 -94.721 1.00 0.00 H new ATOM 0 HB2 SER A 58 14.194 -5.974 -93.887 1.00 0.00 H new ATOM 0 HB3 SER A 58 14.947 -4.392 -93.884 1.00 0.00 H new ATOM 0 HG SER A 58 15.300 -5.534 -91.914 1.00 0.00 H new ATOM 352 N LEU A 59 11.533 -6.360 -93.238 1.00 0.00 N ATOM 353 CA LEU A 59 10.522 -7.185 -92.585 1.00 0.00 C ATOM 354 C LEU A 59 10.813 -7.334 -91.097 1.00 0.00 C ATOM 355 O LEU A 59 9.894 -7.422 -90.282 1.00 0.00 O ATOM 356 CB LEU A 59 10.462 -8.569 -93.243 1.00 0.00 C ATOM 357 CG LEU A 59 9.935 -8.598 -94.683 1.00 0.00 C ATOM 358 CD1 LEU A 59 10.076 -10.005 -95.247 1.00 0.00 C ATOM 359 CD2 LEU A 59 8.482 -8.145 -94.702 1.00 0.00 C ATOM 0 H LEU A 59 12.053 -6.836 -93.975 1.00 0.00 H new ATOM 0 HA LEU A 59 9.558 -6.689 -92.699 1.00 0.00 H new ATOM 0 HB2 LEU A 59 11.463 -8.999 -93.233 1.00 0.00 H new ATOM 0 HB3 LEU A 59 9.832 -9.215 -92.632 1.00 0.00 H new ATOM 0 HG LEU A 59 10.516 -7.917 -95.306 1.00 0.00 H new ATOM 0 HD11 LEU A 59 9.702 -10.026 -96.270 1.00 0.00 H new ATOM 0 HD12 LEU A 59 11.126 -10.297 -95.239 1.00 0.00 H new ATOM 0 HD13 LEU A 59 9.501 -10.701 -94.636 1.00 0.00 H new ATOM 0 HD21 LEU A 59 8.108 -8.166 -95.726 1.00 0.00 H new ATOM 0 HD22 LEU A 59 7.884 -8.814 -94.083 1.00 0.00 H new ATOM 0 HD23 LEU A 59 8.412 -7.130 -94.311 1.00 0.00 H new ATOM 371 N ASP A 60 12.095 -7.365 -90.749 1.00 0.00 N ATOM 372 CA ASP A 60 12.508 -7.517 -89.359 1.00 0.00 C ATOM 373 C ASP A 60 12.143 -6.286 -88.539 1.00 0.00 C ATOM 374 O ASP A 60 12.117 -6.333 -87.309 1.00 0.00 O ATOM 375 CB ASP A 60 14.015 -7.766 -89.272 1.00 0.00 C ATOM 376 CG ASP A 60 14.418 -9.144 -89.780 1.00 0.00 C ATOM 377 OD1 ASP A 60 13.559 -9.985 -89.904 1.00 0.00 O ATOM 378 OD2 ASP A 60 15.580 -9.343 -90.039 1.00 0.00 O ATOM 0 H ASP A 60 12.867 -7.287 -91.411 1.00 0.00 H new ATOM 0 HA ASP A 60 11.978 -8.376 -88.948 1.00 0.00 H new ATOM 0 HB2 ASP A 60 14.538 -7.004 -89.850 1.00 0.00 H new ATOM 0 HB3 ASP A 60 14.337 -7.658 -88.236 1.00 0.00 H new ATOM 383 N ASN A 61 11.861 -5.184 -89.227 1.00 0.00 N ATOM 384 CA ASN A 61 11.547 -3.925 -88.562 1.00 0.00 C ATOM 385 C ASN A 61 10.052 -3.641 -88.599 1.00 0.00 C ATOM 386 O ASN A 61 9.611 -2.540 -88.267 1.00 0.00 O ATOM 387 CB ASN A 61 12.324 -2.783 -89.191 1.00 0.00 C ATOM 388 CG ASN A 61 13.794 -2.844 -88.882 1.00 0.00 C ATOM 389 OD1 ASN A 61 14.234 -2.424 -87.806 1.00 0.00 O ATOM 390 ND2 ASN A 61 14.563 -3.362 -89.807 1.00 0.00 N ATOM 0 H ASN A 61 11.844 -5.138 -90.246 1.00 0.00 H new ATOM 0 HA ASN A 61 11.845 -4.013 -87.517 1.00 0.00 H new ATOM 0 HB2 ASN A 61 12.183 -2.804 -90.272 1.00 0.00 H new ATOM 0 HB3 ASN A 61 11.921 -1.835 -88.835 1.00 0.00 H new ATOM 0 HD21 ASN A 61 15.569 -3.431 -89.654 1.00 0.00 H new ATOM 0 HD22 ASN A 61 14.156 -3.696 -90.680 1.00 0.00 H new ATOM 397 N ILE A 62 9.274 -4.639 -89.004 1.00 0.00 N ATOM 398 CA ILE A 62 7.825 -4.500 -89.079 1.00 0.00 C ATOM 399 C ILE A 62 7.126 -5.530 -88.201 1.00 0.00 C ATOM 400 O ILE A 62 7.377 -6.730 -88.316 1.00 0.00 O ATOM 401 CB ILE A 62 7.333 -4.643 -90.531 1.00 0.00 C ATOM 402 CG1 ILE A 62 7.965 -3.567 -91.417 1.00 0.00 C ATOM 403 CG2 ILE A 62 5.815 -4.562 -90.589 1.00 0.00 C ATOM 404 CD1 ILE A 62 7.748 -3.790 -92.897 1.00 0.00 C ATOM 0 H ILE A 62 9.624 -5.555 -89.286 1.00 0.00 H new ATOM 0 HA ILE A 62 7.576 -3.503 -88.715 1.00 0.00 H new ATOM 0 HB ILE A 62 7.638 -5.620 -90.906 1.00 0.00 H new ATOM 0 HG12 ILE A 62 7.555 -2.596 -91.141 1.00 0.00 H new ATOM 0 HG13 ILE A 62 9.036 -3.529 -91.218 1.00 0.00 H new ATOM 0 HG21 ILE A 62 5.484 -4.665 -91.623 1.00 0.00 H new ATOM 0 HG22 ILE A 62 5.385 -5.364 -89.989 1.00 0.00 H new ATOM 0 HG23 ILE A 62 5.487 -3.599 -90.197 1.00 0.00 H new ATOM 0 HD11 ILE A 62 8.225 -2.987 -93.460 1.00 0.00 H new ATOM 0 HD12 ILE A 62 8.184 -4.746 -93.189 1.00 0.00 H new ATOM 0 HD13 ILE A 62 6.679 -3.798 -93.111 1.00 0.00 H new ATOM 416 N ARG A 63 6.248 -5.054 -87.324 1.00 0.00 N ATOM 417 CA ARG A 63 5.444 -5.939 -86.488 1.00 0.00 C ATOM 418 C ARG A 63 3.956 -5.675 -86.680 1.00 0.00 C ATOM 419 O ARG A 63 3.494 -4.543 -86.543 1.00 0.00 O ATOM 420 CB ARG A 63 5.803 -5.761 -85.020 1.00 0.00 C ATOM 421 CG ARG A 63 7.232 -6.136 -84.661 1.00 0.00 C ATOM 422 CD ARG A 63 7.458 -7.601 -84.764 1.00 0.00 C ATOM 423 NE ARG A 63 8.828 -7.962 -84.439 1.00 0.00 N ATOM 424 CZ ARG A 63 9.836 -8.024 -85.331 1.00 0.00 C ATOM 425 NH1 ARG A 63 9.611 -7.746 -86.596 1.00 0.00 N ATOM 426 NH2 ARG A 63 11.050 -8.363 -84.935 1.00 0.00 N ATOM 0 H ARG A 63 6.075 -4.060 -87.174 1.00 0.00 H new ATOM 0 HA ARG A 63 5.661 -6.963 -86.791 1.00 0.00 H new ATOM 0 HB2 ARG A 63 5.636 -4.720 -84.744 1.00 0.00 H new ATOM 0 HB3 ARG A 63 5.122 -6.364 -84.419 1.00 0.00 H new ATOM 0 HG2 ARG A 63 7.923 -5.614 -85.323 1.00 0.00 H new ATOM 0 HG3 ARG A 63 7.451 -5.804 -83.646 1.00 0.00 H new ATOM 0 HD2 ARG A 63 6.776 -8.122 -84.092 1.00 0.00 H new ATOM 0 HD3 ARG A 63 7.225 -7.934 -85.775 1.00 0.00 H new ATOM 0 HE ARG A 63 9.041 -8.184 -83.467 1.00 0.00 H new ATOM 0 HH11 ARG A 63 8.674 -7.484 -86.902 1.00 0.00 H new ATOM 0 HH12 ARG A 63 10.374 -7.793 -87.272 1.00 0.00 H new ATOM 0 HH21 ARG A 63 11.225 -8.578 -83.953 1.00 0.00 H new ATOM 0 HH22 ARG A 63 11.812 -8.410 -85.611 1.00 0.00 H new ATOM 440 N ILE A 64 3.209 -6.727 -86.997 1.00 0.00 N ATOM 441 CA ILE A 64 1.768 -6.617 -87.179 1.00 0.00 C ATOM 442 C ILE A 64 1.022 -7.590 -86.274 1.00 0.00 C ATOM 443 O ILE A 64 1.316 -8.786 -86.257 1.00 0.00 O ATOM 444 CB ILE A 64 1.377 -6.877 -88.645 1.00 0.00 C ATOM 445 CG1 ILE A 64 2.090 -5.889 -89.571 1.00 0.00 C ATOM 446 CG2 ILE A 64 -0.130 -6.782 -88.819 1.00 0.00 C ATOM 447 CD1 ILE A 64 1.834 -6.133 -91.041 1.00 0.00 C ATOM 0 H ILE A 64 3.580 -7.667 -87.133 1.00 0.00 H new ATOM 0 HA ILE A 64 1.485 -5.599 -86.910 1.00 0.00 H new ATOM 0 HB ILE A 64 1.690 -7.886 -88.913 1.00 0.00 H new ATOM 0 HG12 ILE A 64 1.772 -4.877 -89.320 1.00 0.00 H new ATOM 0 HG13 ILE A 64 3.163 -5.942 -89.385 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -0.388 -6.969 -89.861 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -0.617 -7.524 -88.186 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -0.467 -5.785 -88.534 1.00 0.00 H new ATOM 0 HD11 ILE A 64 2.373 -5.393 -91.632 1.00 0.00 H new ATOM 0 HD12 ILE A 64 2.178 -7.132 -91.309 1.00 0.00 H new ATOM 0 HD13 ILE A 64 0.766 -6.051 -91.243 1.00 0.00 H new ATOM 459 N SER A 65 0.058 -7.071 -85.523 1.00 0.00 N ATOM 460 CA SER A 65 -0.678 -7.877 -84.556 1.00 0.00 C ATOM 461 C SER A 65 -2.162 -7.528 -84.563 1.00 0.00 C ATOM 462 O SER A 65 -2.644 -6.847 -85.468 1.00 0.00 O ATOM 463 CB SER A 65 -0.109 -7.674 -83.165 1.00 0.00 C ATOM 464 OG SER A 65 -0.657 -8.590 -82.259 1.00 0.00 O ATOM 0 H SER A 65 -0.233 -6.094 -85.565 1.00 0.00 H new ATOM 0 HA SER A 65 -0.571 -8.924 -84.841 1.00 0.00 H new ATOM 0 HB2 SER A 65 0.975 -7.788 -83.192 1.00 0.00 H new ATOM 0 HB3 SER A 65 -0.315 -6.658 -82.829 1.00 0.00 H new ATOM 0 HG SER A 65 -0.800 -9.449 -82.709 1.00 0.00 H new ATOM 470 N GLN A 66 -2.880 -8.000 -83.550 1.00 0.00 N ATOM 471 CA GLN A 66 -4.322 -7.802 -83.476 1.00 0.00 C ATOM 472 C GLN A 66 -4.858 -8.158 -82.095 1.00 0.00 C ATOM 473 O GLN A 66 -4.470 -9.172 -81.512 1.00 0.00 O ATOM 474 CB GLN A 66 -5.033 -8.638 -84.544 1.00 0.00 C ATOM 475 CG GLN A 66 -6.542 -8.462 -84.569 1.00 0.00 C ATOM 476 CD GLN A 66 -7.203 -9.286 -85.658 1.00 0.00 C ATOM 477 OE1 GLN A 66 -6.553 -9.699 -86.623 1.00 0.00 O ATOM 478 NE2 GLN A 66 -8.500 -9.530 -85.510 1.00 0.00 N ATOM 0 H GLN A 66 -2.486 -8.523 -82.768 1.00 0.00 H new ATOM 0 HA GLN A 66 -4.522 -6.746 -83.659 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -4.631 -8.375 -85.523 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -4.804 -9.691 -84.378 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -6.954 -8.747 -83.601 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -6.780 -7.409 -84.719 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -8.997 -9.169 -84.696 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -8.999 -10.079 -86.210 1.00 0.00 H new ATOM 487 N GLU A 67 -5.749 -7.321 -81.577 1.00 0.00 N ATOM 488 CA GLU A 67 -6.367 -7.566 -80.279 1.00 0.00 C ATOM 489 C GLU A 67 -7.831 -7.149 -80.279 1.00 0.00 C ATOM 490 O GLU A 67 -8.250 -6.315 -81.082 1.00 0.00 O ATOM 491 CB GLU A 67 -5.612 -6.815 -79.179 1.00 0.00 C ATOM 492 CG GLU A 67 -5.724 -5.299 -79.263 1.00 0.00 C ATOM 493 CD GLU A 67 -4.976 -4.597 -78.165 1.00 0.00 C ATOM 494 OE1 GLU A 67 -4.180 -5.231 -77.514 1.00 0.00 O ATOM 495 OE2 GLU A 67 -5.199 -3.424 -77.977 1.00 0.00 O ATOM 0 H GLU A 67 -6.060 -6.465 -82.037 1.00 0.00 H new ATOM 0 HA GLU A 67 -6.316 -8.637 -80.082 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -5.987 -7.142 -78.209 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -4.559 -7.093 -79.223 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -5.343 -4.964 -80.228 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -6.775 -5.014 -79.220 1.00 0.00 H new ATOM 502 N LYS A 68 -8.608 -7.735 -79.374 1.00 0.00 N ATOM 503 CA LYS A 68 -10.031 -7.434 -79.275 1.00 0.00 C ATOM 504 C LYS A 68 -10.292 -6.332 -78.257 1.00 0.00 C ATOM 505 O LYS A 68 -10.050 -6.508 -77.063 1.00 0.00 O ATOM 506 CB LYS A 68 -10.820 -8.691 -78.904 1.00 0.00 C ATOM 507 CG LYS A 68 -12.331 -8.502 -78.878 1.00 0.00 C ATOM 508 CD LYS A 68 -13.050 -9.823 -78.655 1.00 0.00 C ATOM 509 CE LYS A 68 -14.561 -9.639 -78.654 1.00 0.00 C ATOM 510 NZ LYS A 68 -15.279 -10.935 -78.521 1.00 0.00 N ATOM 0 H LYS A 68 -8.275 -8.422 -78.698 1.00 0.00 H new ATOM 0 HA LYS A 68 -10.365 -7.082 -80.251 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -10.577 -9.480 -79.615 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -10.492 -9.034 -77.923 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -12.598 -7.802 -78.086 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -12.661 -8.061 -79.819 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -12.768 -10.529 -79.436 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -12.734 -10.255 -77.706 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -14.846 -8.981 -77.833 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -14.867 -9.148 -79.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -16.305 -10.765 -78.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -15.028 -11.554 -79.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -15.007 -11.393 -77.628 1.00 0.00 H new ATOM 524 N GLN A 69 -10.789 -5.196 -78.736 1.00 0.00 N ATOM 525 CA GLN A 69 -11.145 -4.087 -77.860 1.00 0.00 C ATOM 526 C GLN A 69 -12.656 -3.906 -77.788 1.00 0.00 C ATOM 527 O GLN A 69 -13.277 -3.410 -78.728 1.00 0.00 O ATOM 528 CB GLN A 69 -10.486 -2.791 -78.341 1.00 0.00 C ATOM 529 CG GLN A 69 -8.969 -2.801 -78.272 1.00 0.00 C ATOM 530 CD GLN A 69 -8.362 -1.471 -78.674 1.00 0.00 C ATOM 531 OE1 GLN A 69 -9.078 -0.496 -78.923 1.00 0.00 O ATOM 532 NE2 GLN A 69 -7.037 -1.421 -78.740 1.00 0.00 N ATOM 0 H GLN A 69 -10.954 -5.020 -79.727 1.00 0.00 H new ATOM 0 HA GLN A 69 -10.780 -4.322 -76.860 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -10.790 -2.602 -79.370 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -10.860 -1.962 -77.741 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -8.656 -3.048 -77.258 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -8.584 -3.585 -78.924 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -6.484 -2.251 -78.526 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -6.572 -0.553 -79.005 1.00 0.00 H new ATOM 541 N ASP A 70 -13.243 -4.311 -76.667 1.00 0.00 N ATOM 542 CA ASP A 70 -14.692 -4.413 -76.554 1.00 0.00 C ATOM 543 C ASP A 70 -15.252 -5.428 -77.541 1.00 0.00 C ATOM 544 O ASP A 70 -14.750 -6.547 -77.647 1.00 0.00 O ATOM 545 CB ASP A 70 -15.346 -3.049 -76.790 1.00 0.00 C ATOM 546 CG ASP A 70 -14.848 -1.978 -75.828 1.00 0.00 C ATOM 547 OD1 ASP A 70 -14.567 -2.306 -74.699 1.00 0.00 O ATOM 548 OD2 ASP A 70 -14.753 -0.844 -76.231 1.00 0.00 O ATOM 0 H ASP A 70 -12.736 -4.574 -75.822 1.00 0.00 H new ATOM 0 HA ASP A 70 -14.921 -4.751 -75.543 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -15.150 -2.730 -77.814 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -16.427 -3.147 -76.688 1.00 0.00 H new ATOM 553 N GLY A 71 -16.295 -5.032 -78.263 1.00 0.00 N ATOM 554 CA GLY A 71 -16.931 -5.910 -79.237 1.00 0.00 C ATOM 555 C GLY A 71 -16.336 -5.715 -80.626 1.00 0.00 C ATOM 556 O GLY A 71 -16.861 -6.226 -81.615 1.00 0.00 O ATOM 0 H GLY A 71 -16.718 -4.107 -78.191 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -16.809 -6.948 -78.929 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -18.002 -5.710 -79.266 1.00 0.00 H new ATOM 560 N MET A 72 -15.237 -4.970 -80.694 1.00 0.00 N ATOM 561 CA MET A 72 -14.547 -4.738 -81.957 1.00 0.00 C ATOM 562 C MET A 72 -13.124 -5.281 -81.914 1.00 0.00 C ATOM 563 O MET A 72 -12.546 -5.454 -80.841 1.00 0.00 O ATOM 564 CB MET A 72 -14.538 -3.248 -82.287 1.00 0.00 C ATOM 565 CG MET A 72 -15.918 -2.612 -82.368 1.00 0.00 C ATOM 566 SD MET A 72 -15.861 -0.886 -82.887 1.00 0.00 S ATOM 567 CE MET A 72 -17.605 -0.483 -82.918 1.00 0.00 C ATOM 0 H MET A 72 -14.805 -4.517 -79.889 1.00 0.00 H new ATOM 0 HA MET A 72 -15.086 -5.270 -82.741 1.00 0.00 H new ATOM 0 HB2 MET A 72 -13.954 -2.724 -81.530 1.00 0.00 H new ATOM 0 HB3 MET A 72 -14.028 -3.103 -83.239 1.00 0.00 H new ATOM 0 HG2 MET A 72 -16.533 -3.177 -83.068 1.00 0.00 H new ATOM 0 HG3 MET A 72 -16.402 -2.678 -81.393 1.00 0.00 H new ATOM 0 HE1 MET A 72 -17.733 0.556 -83.222 1.00 0.00 H new ATOM 0 HE2 MET A 72 -18.116 -1.134 -83.627 1.00 0.00 H new ATOM 0 HE3 MET A 72 -18.029 -0.625 -81.924 1.00 0.00 H new ATOM 577 N ASP A 73 -12.563 -5.551 -83.089 1.00 0.00 N ATOM 578 CA ASP A 73 -11.172 -5.972 -83.195 1.00 0.00 C ATOM 579 C ASP A 73 -10.311 -4.878 -83.813 1.00 0.00 C ATOM 580 O ASP A 73 -10.745 -4.174 -84.725 1.00 0.00 O ATOM 581 CB ASP A 73 -11.059 -7.250 -84.029 1.00 0.00 C ATOM 582 CG ASP A 73 -11.682 -8.460 -83.346 1.00 0.00 C ATOM 583 OD1 ASP A 73 -11.852 -8.421 -82.150 1.00 0.00 O ATOM 584 OD2 ASP A 73 -11.979 -9.413 -84.026 1.00 0.00 O ATOM 0 H ASP A 73 -13.052 -5.485 -83.982 1.00 0.00 H new ATOM 0 HA ASP A 73 -10.810 -6.170 -82.186 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -11.544 -7.093 -84.992 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -10.008 -7.454 -84.231 1.00 0.00 H new ATOM 589 N VAL A 74 -9.088 -4.739 -83.311 1.00 0.00 N ATOM 590 CA VAL A 74 -8.178 -3.702 -83.784 1.00 0.00 C ATOM 591 C VAL A 74 -6.863 -4.302 -84.267 1.00 0.00 C ATOM 592 O VAL A 74 -6.173 -4.992 -83.518 1.00 0.00 O ATOM 593 CB VAL A 74 -7.895 -2.687 -82.661 1.00 0.00 C ATOM 594 CG1 VAL A 74 -6.906 -1.632 -83.134 1.00 0.00 C ATOM 595 CG2 VAL A 74 -9.195 -2.042 -82.205 1.00 0.00 C ATOM 0 H VAL A 74 -8.704 -5.332 -82.576 1.00 0.00 H new ATOM 0 HA VAL A 74 -8.658 -3.196 -84.621 1.00 0.00 H new ATOM 0 HB VAL A 74 -7.451 -3.211 -81.815 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -6.717 -0.923 -82.328 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -5.971 -2.113 -83.421 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -7.321 -1.104 -83.993 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -8.987 -1.325 -81.411 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -9.660 -1.527 -83.046 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -9.871 -2.811 -81.832 1.00 0.00 H new ATOM 605 N LEU A 75 -6.524 -4.034 -85.523 1.00 0.00 N ATOM 606 CA LEU A 75 -5.202 -4.362 -86.045 1.00 0.00 C ATOM 607 C LEU A 75 -4.160 -3.353 -85.581 1.00 0.00 C ATOM 608 O LEU A 75 -4.462 -2.173 -85.398 1.00 0.00 O ATOM 609 CB LEU A 75 -5.234 -4.405 -87.578 1.00 0.00 C ATOM 610 CG LEU A 75 -6.168 -5.454 -88.195 1.00 0.00 C ATOM 611 CD1 LEU A 75 -6.248 -5.241 -89.700 1.00 0.00 C ATOM 612 CD2 LEU A 75 -5.653 -6.848 -87.866 1.00 0.00 C ATOM 0 H LEU A 75 -7.146 -3.591 -86.199 1.00 0.00 H new ATOM 0 HA LEU A 75 -4.925 -5.343 -85.660 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -5.529 -3.422 -87.945 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -4.222 -4.589 -87.939 1.00 0.00 H new ATOM 0 HG LEU A 75 -7.171 -5.351 -87.780 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -6.912 -5.986 -90.138 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -6.636 -4.244 -89.906 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -5.253 -5.340 -90.135 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -6.316 -7.594 -88.304 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -4.650 -6.971 -88.274 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -5.624 -6.979 -86.784 1.00 0.00 H new ATOM 624 N GLU A 76 -2.932 -3.823 -85.391 1.00 0.00 N ATOM 625 CA GLU A 76 -1.845 -2.964 -84.938 1.00 0.00 C ATOM 626 C GLU A 76 -0.585 -3.186 -85.766 1.00 0.00 C ATOM 627 O GLU A 76 -0.142 -4.320 -85.948 1.00 0.00 O ATOM 628 CB GLU A 76 -1.545 -3.219 -83.458 1.00 0.00 C ATOM 629 CG GLU A 76 -0.410 -2.377 -82.893 1.00 0.00 C ATOM 630 CD GLU A 76 -0.135 -2.665 -81.443 1.00 0.00 C ATOM 631 OE1 GLU A 76 -1.060 -2.976 -80.733 1.00 0.00 O ATOM 632 OE2 GLU A 76 1.003 -2.572 -81.046 1.00 0.00 O ATOM 0 H GLU A 76 -2.665 -4.795 -85.544 1.00 0.00 H new ATOM 0 HA GLU A 76 -2.163 -1.929 -85.067 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -2.448 -3.026 -82.878 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -1.300 -4.273 -83.326 1.00 0.00 H new ATOM 0 HG2 GLU A 76 0.495 -2.560 -83.473 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -0.655 -1.321 -83.009 1.00 0.00 H new ATOM 639 N LEU A 77 -0.011 -2.097 -86.265 1.00 0.00 N ATOM 640 CA LEU A 77 1.259 -2.157 -86.977 1.00 0.00 C ATOM 641 C LEU A 77 2.310 -1.283 -86.304 1.00 0.00 C ATOM 642 O LEU A 77 2.025 -0.158 -85.894 1.00 0.00 O ATOM 643 CB LEU A 77 1.073 -1.714 -88.433 1.00 0.00 C ATOM 644 CG LEU A 77 0.203 -2.632 -89.302 1.00 0.00 C ATOM 645 CD1 LEU A 77 -1.242 -2.152 -89.259 1.00 0.00 C ATOM 646 CD2 LEU A 77 0.735 -2.637 -90.727 1.00 0.00 C ATOM 0 H LEU A 77 -0.407 -1.160 -86.189 1.00 0.00 H new ATOM 0 HA LEU A 77 1.605 -3.190 -86.955 1.00 0.00 H new ATOM 0 HB2 LEU A 77 0.633 -0.717 -88.437 1.00 0.00 H new ATOM 0 HB3 LEU A 77 2.056 -1.630 -88.896 1.00 0.00 H new ATOM 0 HG LEU A 77 0.239 -3.652 -88.918 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.860 -2.804 -89.876 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -1.603 -2.176 -88.231 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.298 -1.132 -89.639 1.00 0.00 H new ATOM 0 HD21 LEU A 77 0.117 -3.289 -91.344 1.00 0.00 H new ATOM 0 HD22 LEU A 77 0.708 -1.624 -91.129 1.00 0.00 H new ATOM 0 HD23 LEU A 77 1.762 -3.001 -90.731 1.00 0.00 H new ATOM 658 N ASN A 78 3.526 -1.808 -86.194 1.00 0.00 N ATOM 659 CA ASN A 78 4.637 -1.054 -85.625 1.00 0.00 C ATOM 660 C ASN A 78 5.828 -1.027 -86.574 1.00 0.00 C ATOM 661 O ASN A 78 6.263 -2.067 -87.067 1.00 0.00 O ATOM 662 CB ASN A 78 5.038 -1.628 -84.279 1.00 0.00 C ATOM 663 CG ASN A 78 3.962 -1.472 -83.240 1.00 0.00 C ATOM 664 OD1 ASN A 78 3.704 -0.363 -82.759 1.00 0.00 O ATOM 665 ND2 ASN A 78 3.331 -2.561 -82.885 1.00 0.00 N ATOM 0 H ASN A 78 3.767 -2.753 -86.492 1.00 0.00 H new ATOM 0 HA ASN A 78 4.304 -0.027 -85.477 1.00 0.00 H new ATOM 0 HB2 ASN A 78 5.275 -2.686 -84.395 1.00 0.00 H new ATOM 0 HB3 ASN A 78 5.946 -1.134 -83.933 1.00 0.00 H new ATOM 0 HD21 ASN A 78 2.592 -2.516 -82.184 1.00 0.00 H new ATOM 0 HD22 ASN A 78 3.578 -3.455 -83.309 1.00 0.00 H new ATOM 672 N ILE A 79 6.352 0.168 -86.825 1.00 0.00 N ATOM 673 CA ILE A 79 7.487 0.333 -87.725 1.00 0.00 C ATOM 674 C ILE A 79 8.664 0.985 -87.012 1.00 0.00 C ATOM 675 O ILE A 79 8.584 2.136 -86.584 1.00 0.00 O ATOM 676 CB ILE A 79 7.096 1.178 -88.952 1.00 0.00 C ATOM 677 CG1 ILE A 79 5.913 0.540 -89.685 1.00 0.00 C ATOM 678 CG2 ILE A 79 8.285 1.335 -89.889 1.00 0.00 C ATOM 679 CD1 ILE A 79 4.568 1.082 -89.258 1.00 0.00 C ATOM 0 H ILE A 79 6.008 1.037 -86.417 1.00 0.00 H new ATOM 0 HA ILE A 79 7.786 -0.661 -88.058 1.00 0.00 H new ATOM 0 HB ILE A 79 6.795 2.168 -88.610 1.00 0.00 H new ATOM 0 HG12 ILE A 79 6.034 0.697 -90.757 1.00 0.00 H new ATOM 0 HG13 ILE A 79 5.931 -0.537 -89.516 1.00 0.00 H new ATOM 0 HG21 ILE A 79 7.992 1.935 -90.751 1.00 0.00 H new ATOM 0 HG22 ILE A 79 9.100 1.831 -89.362 1.00 0.00 H new ATOM 0 HG23 ILE A 79 8.615 0.352 -90.226 1.00 0.00 H new ATOM 0 HD11 ILE A 79 3.779 0.582 -89.820 1.00 0.00 H new ATOM 0 HD12 ILE A 79 4.424 0.901 -88.193 1.00 0.00 H new ATOM 0 HD13 ILE A 79 4.529 2.154 -89.452 1.00 0.00 H new ATOM 691 N THR A 80 9.758 0.242 -86.888 1.00 0.00 N ATOM 692 CA THR A 80 10.925 0.714 -86.150 1.00 0.00 C ATOM 693 C THR A 80 11.890 1.459 -87.063 1.00 0.00 C ATOM 694 O THR A 80 12.402 0.898 -88.032 1.00 0.00 O ATOM 695 CB THR A 80 11.658 -0.455 -85.467 1.00 0.00 C ATOM 696 OG1 THR A 80 10.778 -1.093 -84.532 1.00 0.00 O ATOM 697 CG2 THR A 80 12.893 0.046 -84.734 1.00 0.00 C ATOM 0 H THR A 80 9.862 -0.690 -87.289 1.00 0.00 H new ATOM 0 HA THR A 80 10.566 1.401 -85.384 1.00 0.00 H new ATOM 0 HB THR A 80 11.966 -1.168 -86.232 1.00 0.00 H new ATOM 0 HG1 THR A 80 11.245 -1.838 -84.099 1.00 0.00 H new ATOM 0 HG21 THR A 80 13.399 -0.794 -84.257 1.00 0.00 H new ATOM 0 HG22 THR A 80 13.570 0.521 -85.444 1.00 0.00 H new ATOM 0 HG23 THR A 80 12.597 0.770 -83.975 1.00 0.00 H new ATOM 705 N LEU A 81 12.135 2.726 -86.749 1.00 0.00 N ATOM 706 CA LEU A 81 13.141 3.510 -87.454 1.00 0.00 C ATOM 707 C LEU A 81 13.998 4.311 -86.482 1.00 0.00 C ATOM 708 O LEU A 81 13.505 5.210 -85.801 1.00 0.00 O ATOM 709 CB LEU A 81 12.469 4.460 -88.454 1.00 0.00 C ATOM 710 CG LEU A 81 13.417 5.363 -89.254 1.00 0.00 C ATOM 711 CD1 LEU A 81 14.290 4.506 -90.161 1.00 0.00 C ATOM 712 CD2 LEU A 81 12.603 6.362 -90.064 1.00 0.00 C ATOM 0 H LEU A 81 11.649 3.233 -86.009 1.00 0.00 H new ATOM 0 HA LEU A 81 13.788 2.816 -87.991 1.00 0.00 H new ATOM 0 HB2 LEU A 81 11.885 3.865 -89.156 1.00 0.00 H new ATOM 0 HB3 LEU A 81 11.767 5.092 -87.911 1.00 0.00 H new ATOM 0 HG LEU A 81 14.066 5.917 -88.575 1.00 0.00 H new ATOM 0 HD11 LEU A 81 14.964 5.147 -90.729 1.00 0.00 H new ATOM 0 HD12 LEU A 81 14.874 3.813 -89.555 1.00 0.00 H new ATOM 0 HD13 LEU A 81 13.658 3.943 -90.848 1.00 0.00 H new ATOM 0 HD21 LEU A 81 13.276 7.004 -90.633 1.00 0.00 H new ATOM 0 HD22 LEU A 81 11.947 5.826 -90.750 1.00 0.00 H new ATOM 0 HD23 LEU A 81 12.002 6.973 -89.390 1.00 0.00 H new TER 724 LEU A 81 ATOM 725 N ASP B 38 8.562 16.244 -93.895 1.00 0.00 N ATOM 726 CA ASP B 38 7.434 16.662 -94.720 1.00 0.00 C ATOM 727 C ASP B 38 6.947 15.523 -95.605 1.00 0.00 C ATOM 728 O ASP B 38 5.875 15.605 -96.205 1.00 0.00 O ATOM 729 CB ASP B 38 7.822 17.862 -95.589 1.00 0.00 C ATOM 730 CG ASP B 38 8.142 19.106 -94.773 1.00 0.00 C ATOM 731 OD1 ASP B 38 7.486 19.329 -93.783 1.00 0.00 O ATOM 732 OD2 ASP B 38 9.040 19.822 -95.147 1.00 0.00 O ATOM 0 HA ASP B 38 6.623 16.950 -94.051 1.00 0.00 H new ATOM 0 HB2 ASP B 38 8.688 17.599 -96.196 1.00 0.00 H new ATOM 0 HB3 ASP B 38 7.006 18.085 -96.277 1.00 0.00 H new ATOM 737 N TYR B 39 7.739 14.459 -95.681 1.00 0.00 N ATOM 738 CA TYR B 39 7.416 13.323 -96.536 1.00 0.00 C ATOM 739 C TYR B 39 6.578 12.293 -95.791 1.00 0.00 C ATOM 740 O TYR B 39 5.608 11.761 -96.329 1.00 0.00 O ATOM 741 CB TYR B 39 8.696 12.678 -97.074 1.00 0.00 C ATOM 742 CG TYR B 39 8.452 11.643 -98.151 1.00 0.00 C ATOM 743 CD1 TYR B 39 7.937 12.031 -99.380 1.00 0.00 C ATOM 744 CD2 TYR B 39 8.743 10.309 -97.910 1.00 0.00 C ATOM 745 CE1 TYR B 39 7.714 11.087-100.364 1.00 0.00 C ATOM 746 CE2 TYR B 39 8.520 9.365 -98.894 1.00 0.00 C ATOM 747 CZ TYR B 39 8.008 9.750-100.116 1.00 0.00 C ATOM 748 OH TYR B 39 7.786 8.810-101.096 1.00 0.00 O ATOM 0 H TYR B 39 8.610 14.360 -95.160 1.00 0.00 H new ATOM 0 HA TYR B 39 6.828 13.693 -97.376 1.00 0.00 H new ATOM 0 HB2 TYR B 39 9.345 13.458 -97.473 1.00 0.00 H new ATOM 0 HB3 TYR B 39 9.231 12.210 -96.248 1.00 0.00 H new ATOM 0 HD1 TYR B 39 7.711 13.070 -99.567 1.00 0.00 H new ATOM 0 HD2 TYR B 39 9.144 10.008 -96.953 1.00 0.00 H new ATOM 0 HE1 TYR B 39 7.313 11.386-101.321 1.00 0.00 H new ATOM 0 HE2 TYR B 39 8.746 8.326 -98.707 1.00 0.00 H new ATOM 0 HH TYR B 39 8.044 7.925-100.765 1.00 0.00 H new ATOM 758 N LEU B 40 6.960 12.015 -94.549 1.00 0.00 N ATOM 759 CA LEU B 40 6.296 10.986 -93.756 1.00 0.00 C ATOM 760 C LEU B 40 4.805 11.270 -93.621 1.00 0.00 C ATOM 761 O LEU B 40 3.975 10.377 -93.789 1.00 0.00 O ATOM 762 CB LEU B 40 6.933 10.897 -92.364 1.00 0.00 C ATOM 763 CG LEU B 40 6.254 9.934 -91.381 1.00 0.00 C ATOM 764 CD1 LEU B 40 6.310 8.517 -91.938 1.00 0.00 C ATOM 765 CD2 LEU B 40 6.944 10.018 -90.028 1.00 0.00 C ATOM 0 H LEU B 40 7.726 12.488 -94.069 1.00 0.00 H new ATOM 0 HA LEU B 40 6.419 10.034 -94.273 1.00 0.00 H new ATOM 0 HB2 LEU B 40 7.974 10.595 -92.480 1.00 0.00 H new ATOM 0 HB3 LEU B 40 6.938 11.894 -91.923 1.00 0.00 H new ATOM 0 HG LEU B 40 5.208 10.211 -91.250 1.00 0.00 H new ATOM 0 HD11 LEU B 40 5.828 7.832 -91.240 1.00 0.00 H new ATOM 0 HD12 LEU B 40 5.792 8.482 -92.897 1.00 0.00 H new ATOM 0 HD13 LEU B 40 7.350 8.221 -92.076 1.00 0.00 H new ATOM 0 HD21 LEU B 40 6.461 9.334 -89.330 1.00 0.00 H new ATOM 0 HD22 LEU B 40 7.993 9.744 -90.137 1.00 0.00 H new ATOM 0 HD23 LEU B 40 6.872 11.036 -89.646 1.00 0.00 H new ATOM 777 N PRO B 41 4.472 12.520 -93.318 1.00 0.00 N ATOM 778 CA PRO B 41 3.078 12.939 -93.220 1.00 0.00 C ATOM 779 C PRO B 41 2.276 12.471 -94.427 1.00 0.00 C ATOM 780 O PRO B 41 1.125 12.055 -94.296 1.00 0.00 O ATOM 781 CB PRO B 41 3.181 14.466 -93.167 1.00 0.00 C ATOM 782 CG PRO B 41 4.468 14.723 -92.462 1.00 0.00 C ATOM 783 CD PRO B 41 5.407 13.678 -93.004 1.00 0.00 C ATOM 0 HA PRO B 41 2.560 12.518 -92.358 1.00 0.00 H new ATOM 0 HB2 PRO B 41 3.182 14.900 -94.167 1.00 0.00 H new ATOM 0 HB3 PRO B 41 2.339 14.903 -92.630 1.00 0.00 H new ATOM 0 HG2 PRO B 41 4.836 15.730 -92.661 1.00 0.00 H new ATOM 0 HG3 PRO B 41 4.354 14.633 -91.382 1.00 0.00 H new ATOM 0 HD2 PRO B 41 5.932 14.027 -93.893 1.00 0.00 H new ATOM 0 HD3 PRO B 41 6.167 13.399 -92.274 1.00 0.00 H new ATOM 791 N THR B 42 2.891 12.541 -95.603 1.00 0.00 N ATOM 792 CA THR B 42 2.259 12.063 -96.827 1.00 0.00 C ATOM 793 C THR B 42 2.164 10.543 -96.841 1.00 0.00 C ATOM 794 O THR B 42 1.148 9.979 -97.251 1.00 0.00 O ATOM 795 CB THR B 42 3.028 12.545 -98.071 1.00 0.00 C ATOM 796 OG1 THR B 42 3.037 13.978 -98.106 1.00 0.00 O ATOM 797 CG2 THR B 42 2.376 12.016 -99.339 1.00 0.00 C ATOM 0 H THR B 42 3.827 12.924 -95.734 1.00 0.00 H new ATOM 0 HA THR B 42 1.251 12.477 -96.853 1.00 0.00 H new ATOM 0 HB THR B 42 4.050 12.169 -98.015 1.00 0.00 H new ATOM 0 HG1 THR B 42 3.528 14.283 -98.897 1.00 0.00 H new ATOM 0 HG21 THR B 42 2.933 12.367-100.208 1.00 0.00 H new ATOM 0 HG22 THR B 42 2.379 10.926 -99.322 1.00 0.00 H new ATOM 0 HG23 THR B 42 1.349 12.376 -99.397 1.00 0.00 H new ATOM 805 N LEU B 43 3.226 9.884 -96.392 1.00 0.00 N ATOM 806 CA LEU B 43 3.243 8.429 -96.300 1.00 0.00 C ATOM 807 C LEU B 43 2.133 7.922 -95.389 1.00 0.00 C ATOM 808 O LEU B 43 1.571 6.850 -95.617 1.00 0.00 O ATOM 809 CB LEU B 43 4.602 7.947 -95.778 1.00 0.00 C ATOM 810 CG LEU B 43 5.791 8.154 -96.725 1.00 0.00 C ATOM 811 CD1 LEU B 43 7.071 7.689 -96.044 1.00 0.00 C ATOM 812 CD2 LEU B 43 5.550 7.389 -98.018 1.00 0.00 C ATOM 0 H LEU B 43 4.088 10.335 -96.085 1.00 0.00 H new ATOM 0 HA LEU B 43 3.077 8.028 -97.300 1.00 0.00 H new ATOM 0 HB2 LEU B 43 4.814 8.462 -94.841 1.00 0.00 H new ATOM 0 HB3 LEU B 43 4.526 6.884 -95.548 1.00 0.00 H new ATOM 0 HG LEU B 43 5.895 9.212 -96.966 1.00 0.00 H new ATOM 0 HD11 LEU B 43 7.915 7.836 -96.717 1.00 0.00 H new ATOM 0 HD12 LEU B 43 7.229 8.266 -95.133 1.00 0.00 H new ATOM 0 HD13 LEU B 43 6.987 6.631 -95.794 1.00 0.00 H new ATOM 0 HD21 LEU B 43 6.395 7.536 -98.691 1.00 0.00 H new ATOM 0 HD22 LEU B 43 5.442 6.327 -97.798 1.00 0.00 H new ATOM 0 HD23 LEU B 43 4.640 7.755 -98.493 1.00 0.00 H new ATOM 824 N ARG B 44 1.820 8.698 -94.357 1.00 0.00 N ATOM 825 CA ARG B 44 0.774 8.330 -93.412 1.00 0.00 C ATOM 826 C ARG B 44 -0.592 8.298 -94.087 1.00 0.00 C ATOM 827 O ARG B 44 -1.354 7.344 -93.925 1.00 0.00 O ATOM 828 CB ARG B 44 0.736 9.308 -92.246 1.00 0.00 C ATOM 829 CG ARG B 44 1.922 9.218 -91.299 1.00 0.00 C ATOM 830 CD ARG B 44 1.844 10.240 -90.224 1.00 0.00 C ATOM 831 NE ARG B 44 2.962 10.141 -89.300 1.00 0.00 N ATOM 832 CZ ARG B 44 3.209 11.011 -88.301 1.00 0.00 C ATOM 833 NH1 ARG B 44 2.409 12.037 -88.110 1.00 0.00 N ATOM 834 NH2 ARG B 44 4.255 10.834 -87.513 1.00 0.00 N ATOM 0 H ARG B 44 2.277 9.587 -94.154 1.00 0.00 H new ATOM 0 HA ARG B 44 1.006 7.332 -93.040 1.00 0.00 H new ATOM 0 HB2 ARG B 44 0.682 10.322 -92.642 1.00 0.00 H new ATOM 0 HB3 ARG B 44 -0.178 9.138 -91.678 1.00 0.00 H new ATOM 0 HG2 ARG B 44 1.958 8.224 -90.854 1.00 0.00 H new ATOM 0 HG3 ARG B 44 2.847 9.350 -91.860 1.00 0.00 H new ATOM 0 HD2 ARG B 44 1.828 11.235 -90.669 1.00 0.00 H new ATOM 0 HD3 ARG B 44 0.909 10.121 -89.677 1.00 0.00 H new ATOM 0 HE ARG B 44 3.605 9.358 -89.416 1.00 0.00 H new ATOM 0 HH11 ARG B 44 1.602 12.174 -88.718 1.00 0.00 H new ATOM 0 HH12 ARG B 44 2.596 12.696 -87.354 1.00 0.00 H new ATOM 0 HH21 ARG B 44 4.876 10.038 -87.661 1.00 0.00 H new ATOM 0 HH22 ARG B 44 4.441 11.493 -86.757 1.00 0.00 H new ATOM 848 N LYS B 45 -0.897 9.346 -94.844 1.00 0.00 N ATOM 849 CA LYS B 45 -2.128 9.397 -95.623 1.00 0.00 C ATOM 850 C LYS B 45 -2.158 8.299 -96.678 1.00 0.00 C ATOM 851 O LYS B 45 -3.207 7.710 -96.946 1.00 0.00 O ATOM 852 CB LYS B 45 -2.287 10.767 -96.285 1.00 0.00 C ATOM 853 CG LYS B 45 -2.577 11.905 -95.316 1.00 0.00 C ATOM 854 CD LYS B 45 -2.688 13.236 -96.043 1.00 0.00 C ATOM 855 CE LYS B 45 -2.962 14.376 -95.074 1.00 0.00 C ATOM 856 NZ LYS B 45 -3.038 15.690 -95.768 1.00 0.00 N ATOM 0 H LYS B 45 -0.307 10.173 -94.935 1.00 0.00 H new ATOM 0 HA LYS B 45 -2.962 9.236 -94.940 1.00 0.00 H new ATOM 0 HB2 LYS B 45 -1.375 10.999 -96.836 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -3.095 10.713 -97.015 1.00 0.00 H new ATOM 0 HG2 LYS B 45 -3.505 11.702 -94.781 1.00 0.00 H new ATOM 0 HG3 LYS B 45 -1.784 11.961 -94.570 1.00 0.00 H new ATOM 0 HD2 LYS B 45 -1.765 13.433 -96.587 1.00 0.00 H new ATOM 0 HD3 LYS B 45 -3.488 13.184 -96.781 1.00 0.00 H new ATOM 0 HE2 LYS B 45 -3.899 14.188 -94.549 1.00 0.00 H new ATOM 0 HE3 LYS B 45 -2.175 14.409 -94.321 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 -3.226 16.440 -95.072 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 -2.136 15.882 -96.248 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 -3.806 15.668 -96.469 1.00 0.00 H new ATOM 870 N GLU B 46 -1.003 8.025 -97.274 1.00 0.00 N ATOM 871 CA GLU B 46 -0.871 6.928 -98.225 1.00 0.00 C ATOM 872 C GLU B 46 -1.226 5.595 -97.579 1.00 0.00 C ATOM 873 O GLU B 46 -1.881 4.752 -98.191 1.00 0.00 O ATOM 874 CB GLU B 46 0.541 6.882 -98.790 1.00 0.00 C ATOM 0 H GLU B 46 -0.143 8.549 -97.115 1.00 0.00 H new ATOM 0 HA GLU B 46 -1.571 7.105 -99.042 1.00 0.00 H new ATOM 879 N LEU B 47 -0.789 5.410 -96.337 1.00 0.00 N ATOM 880 CA LEU B 47 -1.080 4.189 -95.597 1.00 0.00 C ATOM 881 C LEU B 47 -2.565 4.080 -95.275 1.00 0.00 C ATOM 882 O LEU B 47 -3.135 2.989 -95.286 1.00 0.00 O ATOM 883 CB LEU B 47 -0.265 4.149 -94.298 1.00 0.00 C ATOM 884 CG LEU B 47 1.239 3.905 -94.464 1.00 0.00 C ATOM 885 CD1 LEU B 47 1.943 4.146 -93.135 1.00 0.00 C ATOM 886 CD2 LEU B 47 1.473 2.484 -94.956 1.00 0.00 C ATOM 0 H LEU B 47 -0.231 6.092 -95.822 1.00 0.00 H new ATOM 0 HA LEU B 47 -0.801 3.343 -96.226 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -0.405 5.094 -93.774 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -0.673 3.366 -93.659 1.00 0.00 H new ATOM 0 HG LEU B 47 1.648 4.596 -95.201 1.00 0.00 H new ATOM 0 HD11 LEU B 47 3.013 3.972 -93.253 1.00 0.00 H new ATOM 0 HD12 LEU B 47 1.775 5.175 -92.816 1.00 0.00 H new ATOM 0 HD13 LEU B 47 1.546 3.464 -92.384 1.00 0.00 H new ATOM 0 HD21 LEU B 47 2.543 2.311 -95.074 1.00 0.00 H new ATOM 0 HD22 LEU B 47 1.069 1.777 -94.232 1.00 0.00 H new ATOM 0 HD23 LEU B 47 0.975 2.345 -95.916 1.00 0.00 H new ATOM 898 N MET B 48 -3.188 5.218 -94.988 1.00 0.00 N ATOM 899 CA MET B 48 -4.632 5.274 -94.794 1.00 0.00 C ATOM 900 C MET B 48 -5.372 4.746 -96.016 1.00 0.00 C ATOM 901 O MET B 48 -6.276 3.919 -95.896 1.00 0.00 O ATOM 902 CB MET B 48 -5.067 6.705 -94.484 1.00 0.00 C ATOM 903 CG MET B 48 -4.591 7.231 -93.138 1.00 0.00 C ATOM 904 SD MET B 48 -5.056 8.952 -92.859 1.00 0.00 S ATOM 905 CE MET B 48 -4.201 9.288 -91.322 1.00 0.00 C ATOM 0 H MET B 48 -2.714 6.115 -94.884 1.00 0.00 H new ATOM 0 HA MET B 48 -4.886 4.636 -93.947 1.00 0.00 H new ATOM 0 HB2 MET B 48 -4.695 7.363 -95.269 1.00 0.00 H new ATOM 0 HB3 MET B 48 -6.155 6.755 -94.515 1.00 0.00 H new ATOM 0 HG2 MET B 48 -5.008 6.613 -92.343 1.00 0.00 H new ATOM 0 HG3 MET B 48 -3.507 7.138 -93.079 1.00 0.00 H new ATOM 0 HE1 MET B 48 -4.489 10.272 -90.953 1.00 0.00 H new ATOM 0 HE2 MET B 48 -4.468 8.531 -90.584 1.00 0.00 H new ATOM 0 HE3 MET B 48 -3.125 9.265 -91.492 1.00 0.00 H new ATOM 915 N GLU B 49 -4.984 5.228 -97.191 1.00 0.00 N ATOM 916 CA GLU B 49 -5.532 4.724 -98.445 1.00 0.00 C ATOM 917 C GLU B 49 -5.384 3.211 -98.542 1.00 0.00 C ATOM 918 O GLU B 49 -6.335 2.504 -98.875 1.00 0.00 O ATOM 919 CB GLU B 49 -4.840 5.391 -99.636 1.00 0.00 C ATOM 920 CG GLU B 49 -5.322 4.904-100.996 1.00 0.00 C ATOM 921 CD GLU B 49 -4.577 5.536-102.140 1.00 0.00 C ATOM 922 OE1 GLU B 49 -4.107 6.636-101.982 1.00 0.00 O ATOM 923 OE2 GLU B 49 -4.478 4.915-103.172 1.00 0.00 O ATOM 0 H GLU B 49 -4.291 5.968 -97.302 1.00 0.00 H new ATOM 0 HA GLU B 49 -6.594 4.967 -98.466 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -4.994 6.468 -99.574 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -3.766 5.218 -99.561 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -5.210 3.821-101.050 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -6.386 5.120-101.098 1.00 0.00 H new ATOM 930 N VAL B 50 -4.184 2.720 -98.249 1.00 0.00 N ATOM 931 CA VAL B 50 -3.889 1.297 -98.370 1.00 0.00 C ATOM 932 C VAL B 50 -4.801 0.467 -97.474 1.00 0.00 C ATOM 933 O VAL B 50 -5.293 -0.586 -97.879 1.00 0.00 O ATOM 934 CB VAL B 50 -2.420 1.022 -97.996 1.00 0.00 C ATOM 935 CG1 VAL B 50 -2.177 -0.473 -97.857 1.00 0.00 C ATOM 936 CG2 VAL B 50 -1.499 1.623 -99.046 1.00 0.00 C ATOM 0 H VAL B 50 -3.400 3.287 -97.926 1.00 0.00 H new ATOM 0 HA VAL B 50 -4.063 1.010 -99.407 1.00 0.00 H new ATOM 0 HB VAL B 50 -2.205 1.489 -97.035 1.00 0.00 H new ATOM 0 HG11 VAL B 50 -1.134 -0.649 -97.593 1.00 0.00 H new ATOM 0 HG12 VAL B 50 -2.822 -0.875 -97.076 1.00 0.00 H new ATOM 0 HG13 VAL B 50 -2.400 -0.967 -98.803 1.00 0.00 H new ATOM 0 HG21 VAL B 50 -0.462 1.425 -98.776 1.00 0.00 H new ATOM 0 HG22 VAL B 50 -1.713 1.176-100.017 1.00 0.00 H new ATOM 0 HG23 VAL B 50 -1.661 2.700 -99.099 1.00 0.00 H new ATOM 946 N LEU B 51 -5.022 0.948 -96.256 1.00 0.00 N ATOM 947 CA LEU B 51 -5.820 0.219 -95.277 1.00 0.00 C ATOM 948 C LEU B 51 -7.302 0.273 -95.624 1.00 0.00 C ATOM 949 O LEU B 51 -8.031 -0.700 -95.429 1.00 0.00 O ATOM 950 CB LEU B 51 -5.595 0.796 -93.874 1.00 0.00 C ATOM 951 CG LEU B 51 -4.190 0.600 -93.292 1.00 0.00 C ATOM 952 CD1 LEU B 51 -4.032 1.459 -92.044 1.00 0.00 C ATOM 953 CD2 LEU B 51 -3.971 -0.872 -92.974 1.00 0.00 C ATOM 0 H LEU B 51 -4.659 1.841 -95.922 1.00 0.00 H new ATOM 0 HA LEU B 51 -5.501 -0.823 -95.295 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -5.811 1.864 -93.901 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -6.316 0.342 -93.194 1.00 0.00 H new ATOM 0 HG LEU B 51 -3.440 0.909 -94.020 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -3.033 1.320 -91.630 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -4.174 2.508 -92.304 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -4.776 1.165 -91.303 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -2.972 -1.010 -92.560 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -4.713 -1.202 -92.247 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -4.070 -1.460 -93.886 1.00 0.00 H new ATOM 965 N SER B 52 -7.743 1.416 -96.139 1.00 0.00 N ATOM 966 CA SER B 52 -9.130 1.585 -96.554 1.00 0.00 C ATOM 967 C SER B 52 -9.457 0.707 -97.756 1.00 0.00 C ATOM 968 O SER B 52 -10.619 0.391 -98.007 1.00 0.00 O ATOM 969 CB SER B 52 -9.401 3.039 -96.889 1.00 0.00 C ATOM 970 OG SER B 52 -8.731 3.417 -98.060 1.00 0.00 O ATOM 0 H SER B 52 -7.158 2.240 -96.279 1.00 0.00 H new ATOM 0 HA SER B 52 -9.769 1.280 -95.725 1.00 0.00 H new ATOM 0 HB2 SER B 52 -10.473 3.194 -97.013 1.00 0.00 H new ATOM 0 HB3 SER B 52 -9.081 3.672 -96.062 1.00 0.00 H new ATOM 0 HG SER B 52 -7.934 2.858 -98.176 1.00 0.00 H new ATOM 976 N LYS B 53 -8.424 0.318 -98.495 1.00 0.00 N ATOM 977 CA LYS B 53 -8.593 -0.568 -99.641 1.00 0.00 C ATOM 978 C LYS B 53 -8.421 -2.027 -99.239 1.00 0.00 C ATOM 979 O LYS B 53 -9.040 -2.918 -99.821 1.00 0.00 O ATOM 980 CB LYS B 53 -7.602 -0.206-100.748 1.00 0.00 C ATOM 981 CG LYS B 53 -7.898 1.111-101.452 1.00 0.00 C ATOM 982 CD LYS B 53 -6.837 1.432-102.494 1.00 0.00 C ATOM 983 CE LYS B 53 -7.222 2.649-103.322 1.00 0.00 C ATOM 984 NZ LYS B 53 -6.138 3.050-104.259 1.00 0.00 N ATOM 0 H LYS B 53 -7.460 0.602 -98.321 1.00 0.00 H new ATOM 0 HA LYS B 53 -9.607 -0.437-100.018 1.00 0.00 H new ATOM 0 HB2 LYS B 53 -6.600 -0.158-100.321 1.00 0.00 H new ATOM 0 HB3 LYS B 53 -7.595 -1.006-101.488 1.00 0.00 H new ATOM 0 HG2 LYS B 53 -8.876 1.058-101.930 1.00 0.00 H new ATOM 0 HG3 LYS B 53 -7.945 1.916-100.718 1.00 0.00 H new ATOM 0 HD2 LYS B 53 -5.883 1.614-102.000 1.00 0.00 H new ATOM 0 HD3 LYS B 53 -6.698 0.573-103.150 1.00 0.00 H new ATOM 0 HE2 LYS B 53 -8.128 2.431-103.887 1.00 0.00 H new ATOM 0 HE3 LYS B 53 -7.453 3.481-102.657 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 -6.553 3.520-105.089 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 -5.488 3.705-103.779 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 -5.614 2.206-104.566 1.00 0.00 H new ATOM 998 N TYR B 54 -7.576 -2.266 -98.242 1.00 0.00 N ATOM 999 CA TYR B 54 -7.294 -3.621 -97.784 1.00 0.00 C ATOM 1000 C TYR B 54 -8.425 -4.154 -96.914 1.00 0.00 C ATOM 1001 O TYR B 54 -9.049 -5.164 -97.240 1.00 0.00 O ATOM 1002 CB TYR B 54 -5.970 -3.662 -97.017 1.00 0.00 C ATOM 1003 CG TYR B 54 -4.749 -3.674 -97.909 1.00 0.00 C ATOM 1004 CD1 TYR B 54 -4.875 -3.397 -99.263 1.00 0.00 C ATOM 1005 CD2 TYR B 54 -3.503 -3.963 -97.374 1.00 0.00 C ATOM 1006 CE1 TYR B 54 -3.760 -3.407-100.077 1.00 0.00 C ATOM 1007 CE2 TYR B 54 -2.387 -3.975 -98.189 1.00 0.00 C ATOM 1008 CZ TYR B 54 -2.512 -3.698 -99.535 1.00 0.00 C ATOM 1009 OH TYR B 54 -1.402 -3.709-100.346 1.00 0.00 O ATOM 0 H TYR B 54 -7.074 -1.537 -97.735 1.00 0.00 H new ATOM 0 HA TYR B 54 -7.212 -4.261 -98.662 1.00 0.00 H new ATOM 0 HB2 TYR B 54 -5.917 -2.797 -96.356 1.00 0.00 H new ATOM 0 HB3 TYR B 54 -5.955 -4.549 -96.384 1.00 0.00 H new ATOM 0 HD1 TYR B 54 -5.846 -3.173 -99.680 1.00 0.00 H new ATOM 0 HD2 TYR B 54 -3.405 -4.179 -96.320 1.00 0.00 H new ATOM 0 HE1 TYR B 54 -3.856 -3.190-101.131 1.00 0.00 H new ATOM 0 HE2 TYR B 54 -1.417 -4.201 -97.772 1.00 0.00 H new ATOM 0 HH TYR B 54 -0.610 -3.929 -99.813 1.00 0.00 H new ATOM 1019 N VAL B 55 -8.685 -3.470 -95.805 1.00 0.00 N ATOM 1020 CA VAL B 55 -9.646 -3.947 -94.818 1.00 0.00 C ATOM 1021 C VAL B 55 -11.016 -3.315 -95.032 1.00 0.00 C ATOM 1022 O VAL B 55 -11.960 -3.591 -94.293 1.00 0.00 O ATOM 1023 CB VAL B 55 -9.153 -3.627 -93.394 1.00 0.00 C ATOM 1024 CG1 VAL B 55 -10.165 -4.101 -92.361 1.00 0.00 C ATOM 1025 CG2 VAL B 55 -7.798 -4.275 -93.158 1.00 0.00 C ATOM 0 H VAL B 55 -8.243 -2.582 -95.567 1.00 0.00 H new ATOM 0 HA VAL B 55 -9.737 -5.026 -94.939 1.00 0.00 H new ATOM 0 HB VAL B 55 -9.046 -2.547 -93.291 1.00 0.00 H new ATOM 0 HG11 VAL B 55 -9.801 -3.867 -91.361 1.00 0.00 H new ATOM 0 HG12 VAL B 55 -11.118 -3.598 -92.527 1.00 0.00 H new ATOM 0 HG13 VAL B 55 -10.303 -5.178 -92.454 1.00 0.00 H new ATOM 0 HG21 VAL B 55 -7.455 -4.045 -92.149 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -7.886 -5.355 -93.273 1.00 0.00 H new ATOM 0 HG23 VAL B 55 -7.080 -3.890 -93.882 1.00 0.00 H new ATOM 1035 N ASN B 56 -11.116 -2.464 -96.048 1.00 0.00 N ATOM 1036 CA ASN B 56 -12.390 -1.857 -96.415 1.00 0.00 C ATOM 1037 C ASN B 56 -12.915 -0.962 -95.299 1.00 0.00 C ATOM 1038 O ASN B 56 -14.124 -0.787 -95.148 1.00 0.00 O ATOM 1039 CB ASN B 56 -13.409 -2.924 -96.768 1.00 0.00 C ATOM 1040 CG ASN B 56 -14.507 -2.405 -97.654 1.00 0.00 C ATOM 1041 OD1 ASN B 56 -14.267 -1.575 -98.539 1.00 0.00 O ATOM 1042 ND2 ASN B 56 -15.708 -2.876 -97.434 1.00 0.00 N ATOM 0 H ASN B 56 -10.330 -2.179 -96.632 1.00 0.00 H new ATOM 0 HA ASN B 56 -12.223 -1.234 -97.294 1.00 0.00 H new ATOM 0 HB2 ASN B 56 -12.905 -3.751 -97.267 1.00 0.00 H new ATOM 0 HB3 ASN B 56 -13.844 -3.322 -95.852 1.00 0.00 H new ATOM 0 HD21 ASN B 56 -16.492 -2.559 -98.004 1.00 0.00 H new ATOM 0 HD22 ASN B 56 -15.860 -3.560 -96.693 1.00 0.00 H new ATOM 1049 N VAL B 57 -11.999 -0.397 -94.520 1.00 0.00 N ATOM 1050 CA VAL B 57 -12.359 0.578 -93.497 1.00 0.00 C ATOM 1051 C VAL B 57 -12.322 1.995 -94.051 1.00 0.00 C ATOM 1052 O VAL B 57 -11.824 2.229 -95.152 1.00 0.00 O ATOM 1053 CB VAL B 57 -11.398 0.474 -92.298 1.00 0.00 C ATOM 1054 CG1 VAL B 57 -11.512 -0.894 -91.641 1.00 0.00 C ATOM 1055 CG2 VAL B 57 -9.971 0.736 -92.753 1.00 0.00 C ATOM 0 H VAL B 57 -11.001 -0.598 -94.578 1.00 0.00 H new ATOM 0 HA VAL B 57 -13.375 0.357 -93.171 1.00 0.00 H new ATOM 0 HB VAL B 57 -11.672 1.227 -91.559 1.00 0.00 H new ATOM 0 HG11 VAL B 57 -10.826 -0.950 -90.796 1.00 0.00 H new ATOM 0 HG12 VAL B 57 -12.533 -1.045 -91.290 1.00 0.00 H new ATOM 0 HG13 VAL B 57 -11.259 -1.668 -92.366 1.00 0.00 H new ATOM 0 HG21 VAL B 57 -9.297 0.661 -91.899 1.00 0.00 H new ATOM 0 HG22 VAL B 57 -9.688 -0.001 -93.505 1.00 0.00 H new ATOM 0 HG23 VAL B 57 -9.903 1.736 -93.181 1.00 0.00 H new ATOM 1065 N SER B 58 -12.854 2.940 -93.282 1.00 0.00 N ATOM 1066 CA SER B 58 -12.815 4.348 -93.660 1.00 0.00 C ATOM 1067 C SER B 58 -11.739 5.097 -92.884 1.00 0.00 C ATOM 1068 O SER B 58 -11.109 4.542 -91.983 1.00 0.00 O ATOM 1069 CB SER B 58 -14.166 4.991 -93.417 1.00 0.00 C ATOM 1070 OG SER B 58 -14.424 5.116 -92.045 1.00 0.00 O ATOM 0 H SER B 58 -13.318 2.756 -92.392 1.00 0.00 H new ATOM 0 HA SER B 58 -12.573 4.405 -94.721 1.00 0.00 H new ATOM 0 HB2 SER B 58 -14.194 5.974 -93.887 1.00 0.00 H new ATOM 0 HB3 SER B 58 -14.947 4.392 -93.884 1.00 0.00 H new ATOM 0 HG SER B 58 -15.300 5.534 -91.914 1.00 0.00 H new ATOM 1076 N LEU B 59 -11.533 6.360 -93.238 1.00 0.00 N ATOM 1077 CA LEU B 59 -10.522 7.185 -92.585 1.00 0.00 C ATOM 1078 C LEU B 59 -10.813 7.334 -91.097 1.00 0.00 C ATOM 1079 O LEU B 59 -9.894 7.422 -90.282 1.00 0.00 O ATOM 1080 CB LEU B 59 -10.462 8.569 -93.243 1.00 0.00 C ATOM 1081 CG LEU B 59 -9.935 8.598 -94.683 1.00 0.00 C ATOM 1082 CD1 LEU B 59 -10.076 10.005 -95.247 1.00 0.00 C ATOM 1083 CD2 LEU B 59 -8.482 8.145 -94.702 1.00 0.00 C ATOM 0 H LEU B 59 -12.053 6.836 -93.975 1.00 0.00 H new ATOM 0 HA LEU B 59 -9.558 6.689 -92.699 1.00 0.00 H new ATOM 0 HB2 LEU B 59 -11.463 8.999 -93.233 1.00 0.00 H new ATOM 0 HB3 LEU B 59 -9.832 9.215 -92.632 1.00 0.00 H new ATOM 0 HG LEU B 59 -10.516 7.917 -95.306 1.00 0.00 H new ATOM 0 HD11 LEU B 59 -9.702 10.026 -96.270 1.00 0.00 H new ATOM 0 HD12 LEU B 59 -11.126 10.297 -95.239 1.00 0.00 H new ATOM 0 HD13 LEU B 59 -9.501 10.701 -94.636 1.00 0.00 H new ATOM 0 HD21 LEU B 59 -8.108 8.166 -95.726 1.00 0.00 H new ATOM 0 HD22 LEU B 59 -7.884 8.814 -94.083 1.00 0.00 H new ATOM 0 HD23 LEU B 59 -8.412 7.130 -94.311 1.00 0.00 H new ATOM 1095 N ASP B 60 -12.095 7.365 -90.749 1.00 0.00 N ATOM 1096 CA ASP B 60 -12.508 7.517 -89.359 1.00 0.00 C ATOM 1097 C ASP B 60 -12.143 6.286 -88.539 1.00 0.00 C ATOM 1098 O ASP B 60 -12.117 6.333 -87.309 1.00 0.00 O ATOM 1099 CB ASP B 60 -14.015 7.766 -89.272 1.00 0.00 C ATOM 1100 CG ASP B 60 -14.418 9.144 -89.780 1.00 0.00 C ATOM 1101 OD1 ASP B 60 -13.559 9.985 -89.904 1.00 0.00 O ATOM 1102 OD2 ASP B 60 -15.580 9.343 -90.039 1.00 0.00 O ATOM 0 H ASP B 60 -12.867 7.287 -91.411 1.00 0.00 H new ATOM 0 HA ASP B 60 -11.978 8.376 -88.948 1.00 0.00 H new ATOM 0 HB2 ASP B 60 -14.538 7.004 -89.850 1.00 0.00 H new ATOM 0 HB3 ASP B 60 -14.337 7.658 -88.236 1.00 0.00 H new ATOM 1107 N ASN B 61 -11.861 5.184 -89.227 1.00 0.00 N ATOM 1108 CA ASN B 61 -11.547 3.925 -88.562 1.00 0.00 C ATOM 1109 C ASN B 61 -10.052 3.641 -88.599 1.00 0.00 C ATOM 1110 O ASN B 61 -9.611 2.540 -88.267 1.00 0.00 O ATOM 1111 CB ASN B 61 -12.324 2.783 -89.191 1.00 0.00 C ATOM 1112 CG ASN B 61 -13.794 2.844 -88.882 1.00 0.00 C ATOM 1113 OD1 ASN B 61 -14.234 2.424 -87.806 1.00 0.00 O ATOM 1114 ND2 ASN B 61 -14.563 3.362 -89.807 1.00 0.00 N ATOM 0 H ASN B 61 -11.844 5.138 -90.246 1.00 0.00 H new ATOM 0 HA ASN B 61 -11.845 4.013 -87.517 1.00 0.00 H new ATOM 0 HB2 ASN B 61 -12.183 2.804 -90.272 1.00 0.00 H new ATOM 0 HB3 ASN B 61 -11.921 1.835 -88.835 1.00 0.00 H new ATOM 0 HD21 ASN B 61 -15.569 3.431 -89.654 1.00 0.00 H new ATOM 0 HD22 ASN B 61 -14.156 3.696 -90.680 1.00 0.00 H new ATOM 1121 N ILE B 62 -9.274 4.639 -89.004 1.00 0.00 N ATOM 1122 CA ILE B 62 -7.825 4.500 -89.079 1.00 0.00 C ATOM 1123 C ILE B 62 -7.126 5.530 -88.201 1.00 0.00 C ATOM 1124 O ILE B 62 -7.377 6.730 -88.316 1.00 0.00 O ATOM 1125 CB ILE B 62 -7.333 4.643 -90.531 1.00 0.00 C ATOM 1126 CG1 ILE B 62 -7.965 3.567 -91.417 1.00 0.00 C ATOM 1127 CG2 ILE B 62 -5.815 4.562 -90.589 1.00 0.00 C ATOM 1128 CD1 ILE B 62 -7.748 3.790 -92.897 1.00 0.00 C ATOM 0 H ILE B 62 -9.624 5.555 -89.286 1.00 0.00 H new ATOM 0 HA ILE B 62 -7.576 3.503 -88.715 1.00 0.00 H new ATOM 0 HB ILE B 62 -7.638 5.620 -90.906 1.00 0.00 H new ATOM 0 HG12 ILE B 62 -7.555 2.596 -91.141 1.00 0.00 H new ATOM 0 HG13 ILE B 62 -9.036 3.529 -91.218 1.00 0.00 H new ATOM 0 HG21 ILE B 62 -5.484 4.665 -91.623 1.00 0.00 H new ATOM 0 HG22 ILE B 62 -5.385 5.364 -89.989 1.00 0.00 H new ATOM 0 HG23 ILE B 62 -5.487 3.599 -90.197 1.00 0.00 H new ATOM 0 HD11 ILE B 62 -8.225 2.987 -93.460 1.00 0.00 H new ATOM 0 HD12 ILE B 62 -8.184 4.746 -93.189 1.00 0.00 H new ATOM 0 HD13 ILE B 62 -6.679 3.798 -93.111 1.00 0.00 H new ATOM 1140 N ARG B 63 -6.248 5.054 -87.324 1.00 0.00 N ATOM 1141 CA ARG B 63 -5.444 5.939 -86.488 1.00 0.00 C ATOM 1142 C ARG B 63 -3.956 5.675 -86.680 1.00 0.00 C ATOM 1143 O ARG B 63 -3.494 4.543 -86.543 1.00 0.00 O ATOM 1144 CB ARG B 63 -5.803 5.761 -85.020 1.00 0.00 C ATOM 1145 CG ARG B 63 -7.232 6.136 -84.661 1.00 0.00 C ATOM 1146 CD ARG B 63 -7.458 7.601 -84.764 1.00 0.00 C ATOM 1147 NE ARG B 63 -8.828 7.962 -84.439 1.00 0.00 N ATOM 1148 CZ ARG B 63 -9.836 8.024 -85.331 1.00 0.00 C ATOM 1149 NH1 ARG B 63 -9.611 7.746 -86.596 1.00 0.00 N ATOM 1150 NH2 ARG B 63 -11.050 8.363 -84.935 1.00 0.00 N ATOM 0 H ARG B 63 -6.075 4.060 -87.174 1.00 0.00 H new ATOM 0 HA ARG B 63 -5.661 6.963 -86.791 1.00 0.00 H new ATOM 0 HB2 ARG B 63 -5.636 4.720 -84.744 1.00 0.00 H new ATOM 0 HB3 ARG B 63 -5.122 6.364 -84.419 1.00 0.00 H new ATOM 0 HG2 ARG B 63 -7.923 5.614 -85.323 1.00 0.00 H new ATOM 0 HG3 ARG B 63 -7.451 5.804 -83.646 1.00 0.00 H new ATOM 0 HD2 ARG B 63 -6.776 8.122 -84.092 1.00 0.00 H new ATOM 0 HD3 ARG B 63 -7.225 7.934 -85.775 1.00 0.00 H new ATOM 0 HE ARG B 63 -9.041 8.184 -83.467 1.00 0.00 H new ATOM 0 HH11 ARG B 63 -8.674 7.484 -86.902 1.00 0.00 H new ATOM 0 HH12 ARG B 63 -10.374 7.793 -87.272 1.00 0.00 H new ATOM 0 HH21 ARG B 63 -11.225 8.578 -83.953 1.00 0.00 H new ATOM 0 HH22 ARG B 63 -11.812 8.410 -85.611 1.00 0.00 H new ATOM 1164 N ILE B 64 -3.209 6.727 -86.997 1.00 0.00 N ATOM 1165 CA ILE B 64 -1.768 6.617 -87.179 1.00 0.00 C ATOM 1166 C ILE B 64 -1.022 7.590 -86.274 1.00 0.00 C ATOM 1167 O ILE B 64 -1.316 8.786 -86.257 1.00 0.00 O ATOM 1168 CB ILE B 64 -1.377 6.877 -88.645 1.00 0.00 C ATOM 1169 CG1 ILE B 64 -2.090 5.889 -89.571 1.00 0.00 C ATOM 1170 CG2 ILE B 64 0.130 6.782 -88.819 1.00 0.00 C ATOM 1171 CD1 ILE B 64 -1.834 6.133 -91.041 1.00 0.00 C ATOM 0 H ILE B 64 -3.580 7.667 -87.133 1.00 0.00 H new ATOM 0 HA ILE B 64 -1.485 5.599 -86.910 1.00 0.00 H new ATOM 0 HB ILE B 64 -1.690 7.886 -88.913 1.00 0.00 H new ATOM 0 HG12 ILE B 64 -1.772 4.877 -89.320 1.00 0.00 H new ATOM 0 HG13 ILE B 64 -3.163 5.942 -89.385 1.00 0.00 H new ATOM 0 HG21 ILE B 64 0.388 6.969 -89.861 1.00 0.00 H new ATOM 0 HG22 ILE B 64 0.617 7.524 -88.186 1.00 0.00 H new ATOM 0 HG23 ILE B 64 0.467 5.785 -88.534 1.00 0.00 H new ATOM 0 HD11 ILE B 64 -2.373 5.393 -91.632 1.00 0.00 H new ATOM 0 HD12 ILE B 64 -2.178 7.132 -91.309 1.00 0.00 H new ATOM 0 HD13 ILE B 64 -0.766 6.051 -91.243 1.00 0.00 H new ATOM 1183 N SER B 65 -0.058 7.071 -85.523 1.00 0.00 N ATOM 1184 CA SER B 65 0.678 7.877 -84.556 1.00 0.00 C ATOM 1185 C SER B 65 2.162 7.528 -84.563 1.00 0.00 C ATOM 1186 O SER B 65 2.644 6.847 -85.468 1.00 0.00 O ATOM 1187 CB SER B 65 0.109 7.674 -83.165 1.00 0.00 C ATOM 1188 OG SER B 65 0.657 8.590 -82.259 1.00 0.00 O ATOM 0 H SER B 65 0.233 6.094 -85.565 1.00 0.00 H new ATOM 0 HA SER B 65 0.571 8.924 -84.841 1.00 0.00 H new ATOM 0 HB2 SER B 65 -0.975 7.788 -83.192 1.00 0.00 H new ATOM 0 HB3 SER B 65 0.315 6.658 -82.829 1.00 0.00 H new ATOM 0 HG SER B 65 0.273 8.440 -81.370 1.00 0.00 H new ATOM 1194 N GLN B 66 2.880 8.000 -83.550 1.00 0.00 N ATOM 1195 CA GLN B 66 4.322 7.802 -83.476 1.00 0.00 C ATOM 1196 C GLN B 66 4.858 8.158 -82.095 1.00 0.00 C ATOM 1197 O GLN B 66 4.470 9.172 -81.512 1.00 0.00 O ATOM 1198 CB GLN B 66 5.033 8.638 -84.544 1.00 0.00 C ATOM 1199 CG GLN B 66 6.542 8.462 -84.569 1.00 0.00 C ATOM 1200 CD GLN B 66 7.203 9.286 -85.658 1.00 0.00 C ATOM 1201 OE1 GLN B 66 6.553 9.699 -86.623 1.00 0.00 O ATOM 1202 NE2 GLN B 66 8.500 9.530 -85.510 1.00 0.00 N ATOM 0 H GLN B 66 2.486 8.523 -82.768 1.00 0.00 H new ATOM 0 HA GLN B 66 4.522 6.746 -83.659 1.00 0.00 H new ATOM 0 HB2 GLN B 66 4.631 8.375 -85.523 1.00 0.00 H new ATOM 0 HB3 GLN B 66 4.804 9.691 -84.378 1.00 0.00 H new ATOM 0 HG2 GLN B 66 6.954 8.747 -83.601 1.00 0.00 H new ATOM 0 HG3 GLN B 66 6.780 7.409 -84.719 1.00 0.00 H new ATOM 0 HE21 GLN B 66 8.997 9.169 -84.696 1.00 0.00 H new ATOM 0 HE22 GLN B 66 8.999 10.079 -86.210 1.00 0.00 H new ATOM 1211 N GLU B 67 5.749 7.321 -81.577 1.00 0.00 N ATOM 1212 CA GLU B 67 6.367 7.566 -80.279 1.00 0.00 C ATOM 1213 C GLU B 67 7.831 7.149 -80.279 1.00 0.00 C ATOM 1214 O GLU B 67 8.250 6.315 -81.082 1.00 0.00 O ATOM 1215 CB GLU B 67 5.612 6.815 -79.179 1.00 0.00 C ATOM 1216 CG GLU B 67 5.724 5.299 -79.263 1.00 0.00 C ATOM 1217 CD GLU B 67 4.976 4.597 -78.165 1.00 0.00 C ATOM 1218 OE1 GLU B 67 4.180 5.231 -77.514 1.00 0.00 O ATOM 1219 OE2 GLU B 67 5.199 3.424 -77.977 1.00 0.00 O ATOM 0 H GLU B 67 6.060 6.465 -82.037 1.00 0.00 H new ATOM 0 HA GLU B 67 6.316 8.637 -80.082 1.00 0.00 H new ATOM 0 HB2 GLU B 67 5.987 7.142 -78.209 1.00 0.00 H new ATOM 0 HB3 GLU B 67 4.559 7.093 -79.223 1.00 0.00 H new ATOM 0 HG2 GLU B 67 5.343 4.964 -80.228 1.00 0.00 H new ATOM 0 HG3 GLU B 67 6.775 5.014 -79.220 1.00 0.00 H new ATOM 1226 N LYS B 68 8.608 7.735 -79.374 1.00 0.00 N ATOM 1227 CA LYS B 68 10.031 7.434 -79.275 1.00 0.00 C ATOM 1228 C LYS B 68 10.292 6.332 -78.257 1.00 0.00 C ATOM 1229 O LYS B 68 10.050 6.508 -77.063 1.00 0.00 O ATOM 1230 CB LYS B 68 10.820 8.691 -78.904 1.00 0.00 C ATOM 1231 CG LYS B 68 12.331 8.502 -78.878 1.00 0.00 C ATOM 1232 CD LYS B 68 13.050 9.823 -78.655 1.00 0.00 C ATOM 1233 CE LYS B 68 14.561 9.639 -78.654 1.00 0.00 C ATOM 1234 NZ LYS B 68 15.279 10.935 -78.521 1.00 0.00 N ATOM 0 H LYS B 68 8.275 8.422 -78.698 1.00 0.00 H new ATOM 0 HA LYS B 68 10.365 7.082 -80.251 1.00 0.00 H new ATOM 0 HB2 LYS B 68 10.577 9.480 -79.615 1.00 0.00 H new ATOM 0 HB3 LYS B 68 10.492 9.034 -77.923 1.00 0.00 H new ATOM 0 HG2 LYS B 68 12.598 7.802 -78.086 1.00 0.00 H new ATOM 0 HG3 LYS B 68 12.661 8.061 -79.819 1.00 0.00 H new ATOM 0 HD2 LYS B 68 12.768 10.529 -79.436 1.00 0.00 H new ATOM 0 HD3 LYS B 68 12.734 10.255 -77.706 1.00 0.00 H new ATOM 0 HE2 LYS B 68 14.846 8.981 -77.833 1.00 0.00 H new ATOM 0 HE3 LYS B 68 14.867 9.148 -79.578 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 16.305 10.765 -78.525 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 15.028 11.554 -79.318 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 15.007 11.393 -77.628 1.00 0.00 H new ATOM 1248 N GLN B 69 10.789 5.196 -78.736 1.00 0.00 N ATOM 1249 CA GLN B 69 11.145 4.087 -77.860 1.00 0.00 C ATOM 1250 C GLN B 69 12.656 3.906 -77.788 1.00 0.00 C ATOM 1251 O GLN B 69 13.277 3.410 -78.728 1.00 0.00 O ATOM 1252 CB GLN B 69 10.486 2.791 -78.341 1.00 0.00 C ATOM 1253 CG GLN B 69 8.969 2.801 -78.272 1.00 0.00 C ATOM 1254 CD GLN B 69 8.362 1.471 -78.674 1.00 0.00 C ATOM 1255 OE1 GLN B 69 9.078 0.496 -78.923 1.00 0.00 O ATOM 1256 NE2 GLN B 69 7.037 1.421 -78.740 1.00 0.00 N ATOM 0 H GLN B 69 10.954 5.020 -79.727 1.00 0.00 H new ATOM 0 HA GLN B 69 10.780 4.322 -76.860 1.00 0.00 H new ATOM 0 HB2 GLN B 69 10.790 2.602 -79.370 1.00 0.00 H new ATOM 0 HB3 GLN B 69 10.860 1.962 -77.741 1.00 0.00 H new ATOM 0 HG2 GLN B 69 8.656 3.048 -77.258 1.00 0.00 H new ATOM 0 HG3 GLN B 69 8.584 3.585 -78.924 1.00 0.00 H new ATOM 0 HE21 GLN B 69 6.484 2.251 -78.526 1.00 0.00 H new ATOM 0 HE22 GLN B 69 6.572 0.553 -79.005 1.00 0.00 H new ATOM 1265 N ASP B 70 13.243 4.311 -76.667 1.00 0.00 N ATOM 1266 CA ASP B 70 14.692 4.413 -76.554 1.00 0.00 C ATOM 1267 C ASP B 70 15.252 5.428 -77.541 1.00 0.00 C ATOM 1268 O ASP B 70 14.750 6.547 -77.647 1.00 0.00 O ATOM 1269 CB ASP B 70 15.346 3.049 -76.790 1.00 0.00 C ATOM 1270 CG ASP B 70 14.848 1.978 -75.828 1.00 0.00 C ATOM 1271 OD1 ASP B 70 14.567 2.306 -74.699 1.00 0.00 O ATOM 1272 OD2 ASP B 70 14.753 0.844 -76.231 1.00 0.00 O ATOM 0 H ASP B 70 12.736 4.574 -75.822 1.00 0.00 H new ATOM 0 HA ASP B 70 14.921 4.751 -75.543 1.00 0.00 H new ATOM 0 HB2 ASP B 70 15.150 2.730 -77.814 1.00 0.00 H new ATOM 0 HB3 ASP B 70 16.427 3.147 -76.688 1.00 0.00 H new ATOM 1277 N GLY B 71 16.295 5.032 -78.263 1.00 0.00 N ATOM 1278 CA GLY B 71 16.931 5.910 -79.237 1.00 0.00 C ATOM 1279 C GLY B 71 16.336 5.715 -80.626 1.00 0.00 C ATOM 1280 O GLY B 71 16.861 6.226 -81.615 1.00 0.00 O ATOM 0 H GLY B 71 16.718 4.107 -78.191 1.00 0.00 H new ATOM 0 HA2 GLY B 71 16.809 6.948 -78.929 1.00 0.00 H new ATOM 0 HA3 GLY B 71 18.002 5.710 -79.266 1.00 0.00 H new ATOM 1284 N MET B 72 15.237 4.970 -80.694 1.00 0.00 N ATOM 1285 CA MET B 72 14.547 4.738 -81.957 1.00 0.00 C ATOM 1286 C MET B 72 13.124 5.281 -81.914 1.00 0.00 C ATOM 1287 O MET B 72 12.546 5.454 -80.841 1.00 0.00 O ATOM 1288 CB MET B 72 14.538 3.248 -82.287 1.00 0.00 C ATOM 1289 CG MET B 72 15.918 2.612 -82.368 1.00 0.00 C ATOM 1290 SD MET B 72 15.861 0.886 -82.887 1.00 0.00 S ATOM 1291 CE MET B 72 17.605 0.483 -82.918 1.00 0.00 C ATOM 0 H MET B 72 14.805 4.517 -79.889 1.00 0.00 H new ATOM 0 HA MET B 72 15.086 5.270 -82.741 1.00 0.00 H new ATOM 0 HB2 MET B 72 13.954 2.724 -81.530 1.00 0.00 H new ATOM 0 HB3 MET B 72 14.028 3.103 -83.239 1.00 0.00 H new ATOM 0 HG2 MET B 72 16.533 3.177 -83.068 1.00 0.00 H new ATOM 0 HG3 MET B 72 16.402 2.678 -81.393 1.00 0.00 H new ATOM 0 HE1 MET B 72 17.733 -0.556 -83.222 1.00 0.00 H new ATOM 0 HE2 MET B 72 18.116 1.134 -83.627 1.00 0.00 H new ATOM 0 HE3 MET B 72 18.029 0.625 -81.924 1.00 0.00 H new ATOM 1301 N ASP B 73 12.563 5.551 -83.089 1.00 0.00 N ATOM 1302 CA ASP B 73 11.172 5.972 -83.195 1.00 0.00 C ATOM 1303 C ASP B 73 10.311 4.878 -83.813 1.00 0.00 C ATOM 1304 O ASP B 73 10.745 4.174 -84.725 1.00 0.00 O ATOM 1305 CB ASP B 73 11.059 7.250 -84.029 1.00 0.00 C ATOM 1306 CG ASP B 73 11.682 8.460 -83.346 1.00 0.00 C ATOM 1307 OD1 ASP B 73 11.852 8.421 -82.150 1.00 0.00 O ATOM 1308 OD2 ASP B 73 11.979 9.413 -84.026 1.00 0.00 O ATOM 0 H ASP B 73 13.052 5.485 -83.982 1.00 0.00 H new ATOM 0 HA ASP B 73 10.810 6.170 -82.186 1.00 0.00 H new ATOM 0 HB2 ASP B 73 11.544 7.093 -84.992 1.00 0.00 H new ATOM 0 HB3 ASP B 73 10.008 7.454 -84.231 1.00 0.00 H new ATOM 1313 N VAL B 74 9.088 4.739 -83.311 1.00 0.00 N ATOM 1314 CA VAL B 74 8.178 3.702 -83.784 1.00 0.00 C ATOM 1315 C VAL B 74 6.863 4.302 -84.267 1.00 0.00 C ATOM 1316 O VAL B 74 6.173 4.992 -83.518 1.00 0.00 O ATOM 1317 CB VAL B 74 7.895 2.687 -82.661 1.00 0.00 C ATOM 1318 CG1 VAL B 74 6.906 1.632 -83.134 1.00 0.00 C ATOM 1319 CG2 VAL B 74 9.195 2.042 -82.205 1.00 0.00 C ATOM 0 H VAL B 74 8.704 5.332 -82.576 1.00 0.00 H new ATOM 0 HA VAL B 74 8.658 3.196 -84.621 1.00 0.00 H new ATOM 0 HB VAL B 74 7.451 3.211 -81.815 1.00 0.00 H new ATOM 0 HG11 VAL B 74 6.717 0.923 -82.328 1.00 0.00 H new ATOM 0 HG12 VAL B 74 5.971 2.113 -83.421 1.00 0.00 H new ATOM 0 HG13 VAL B 74 7.321 1.104 -83.993 1.00 0.00 H new ATOM 0 HG21 VAL B 74 8.987 1.325 -81.411 1.00 0.00 H new ATOM 0 HG22 VAL B 74 9.660 1.527 -83.046 1.00 0.00 H new ATOM 0 HG23 VAL B 74 9.871 2.811 -81.832 1.00 0.00 H new ATOM 1329 N LEU B 75 6.524 4.034 -85.523 1.00 0.00 N ATOM 1330 CA LEU B 75 5.202 4.362 -86.045 1.00 0.00 C ATOM 1331 C LEU B 75 4.160 3.353 -85.581 1.00 0.00 C ATOM 1332 O LEU B 75 4.462 2.173 -85.398 1.00 0.00 O ATOM 1333 CB LEU B 75 5.234 4.405 -87.578 1.00 0.00 C ATOM 1334 CG LEU B 75 6.168 5.454 -88.195 1.00 0.00 C ATOM 1335 CD1 LEU B 75 6.248 5.241 -89.700 1.00 0.00 C ATOM 1336 CD2 LEU B 75 5.653 6.848 -87.866 1.00 0.00 C ATOM 0 H LEU B 75 7.146 3.591 -86.199 1.00 0.00 H new ATOM 0 HA LEU B 75 4.925 5.343 -85.660 1.00 0.00 H new ATOM 0 HB2 LEU B 75 5.529 3.422 -87.945 1.00 0.00 H new ATOM 0 HB3 LEU B 75 4.222 4.589 -87.939 1.00 0.00 H new ATOM 0 HG LEU B 75 7.171 5.351 -87.780 1.00 0.00 H new ATOM 0 HD11 LEU B 75 6.912 5.986 -90.138 1.00 0.00 H new ATOM 0 HD12 LEU B 75 6.636 4.244 -89.906 1.00 0.00 H new ATOM 0 HD13 LEU B 75 5.253 5.340 -90.135 1.00 0.00 H new ATOM 0 HD21 LEU B 75 6.316 7.594 -88.304 1.00 0.00 H new ATOM 0 HD22 LEU B 75 4.650 6.971 -88.274 1.00 0.00 H new ATOM 0 HD23 LEU B 75 5.624 6.979 -86.784 1.00 0.00 H new ATOM 1348 N GLU B 76 2.932 3.823 -85.391 1.00 0.00 N ATOM 1349 CA GLU B 76 1.845 2.964 -84.938 1.00 0.00 C ATOM 1350 C GLU B 76 0.585 3.186 -85.766 1.00 0.00 C ATOM 1351 O GLU B 76 0.142 4.320 -85.948 1.00 0.00 O ATOM 1352 CB GLU B 76 1.545 3.219 -83.458 1.00 0.00 C ATOM 1353 CG GLU B 76 0.410 2.377 -82.893 1.00 0.00 C ATOM 1354 CD GLU B 76 0.135 2.665 -81.443 1.00 0.00 C ATOM 1355 OE1 GLU B 76 1.060 2.976 -80.733 1.00 0.00 O ATOM 1356 OE2 GLU B 76 -1.003 2.572 -81.046 1.00 0.00 O ATOM 0 H GLU B 76 2.665 4.795 -85.544 1.00 0.00 H new ATOM 0 HA GLU B 76 2.163 1.929 -85.067 1.00 0.00 H new ATOM 0 HB2 GLU B 76 2.448 3.026 -82.878 1.00 0.00 H new ATOM 0 HB3 GLU B 76 1.300 4.273 -83.326 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -0.495 2.560 -83.473 1.00 0.00 H new ATOM 0 HG3 GLU B 76 0.655 1.321 -83.009 1.00 0.00 H new ATOM 1363 N LEU B 77 0.011 2.097 -86.265 1.00 0.00 N ATOM 1364 CA LEU B 77 -1.259 2.157 -86.977 1.00 0.00 C ATOM 1365 C LEU B 77 -2.310 1.283 -86.304 1.00 0.00 C ATOM 1366 O LEU B 77 -2.025 0.158 -85.894 1.00 0.00 O ATOM 1367 CB LEU B 77 -1.073 1.714 -88.433 1.00 0.00 C ATOM 1368 CG LEU B 77 -0.203 2.632 -89.302 1.00 0.00 C ATOM 1369 CD1 LEU B 77 1.242 2.152 -89.259 1.00 0.00 C ATOM 1370 CD2 LEU B 77 -0.735 2.637 -90.727 1.00 0.00 C ATOM 0 H LEU B 77 0.407 1.160 -86.189 1.00 0.00 H new ATOM 0 HA LEU B 77 -1.605 3.190 -86.955 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -0.633 0.717 -88.437 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -2.056 1.630 -88.896 1.00 0.00 H new ATOM 0 HG LEU B 77 -0.239 3.652 -88.918 1.00 0.00 H new ATOM 0 HD11 LEU B 77 1.860 2.804 -89.876 1.00 0.00 H new ATOM 0 HD12 LEU B 77 1.603 2.176 -88.231 1.00 0.00 H new ATOM 0 HD13 LEU B 77 1.298 1.132 -89.639 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -0.117 3.289 -91.344 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -0.708 1.624 -91.129 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -1.762 3.001 -90.731 1.00 0.00 H new ATOM 1382 N ASN B 78 -3.526 1.808 -86.194 1.00 0.00 N ATOM 1383 CA ASN B 78 -4.637 1.054 -85.625 1.00 0.00 C ATOM 1384 C ASN B 78 -5.828 1.027 -86.574 1.00 0.00 C ATOM 1385 O ASN B 78 -6.263 2.067 -87.067 1.00 0.00 O ATOM 1386 CB ASN B 78 -5.038 1.628 -84.279 1.00 0.00 C ATOM 1387 CG ASN B 78 -3.962 1.472 -83.240 1.00 0.00 C ATOM 1388 OD1 ASN B 78 -3.704 0.363 -82.759 1.00 0.00 O ATOM 1389 ND2 ASN B 78 -3.331 2.561 -82.885 1.00 0.00 N ATOM 0 H ASN B 78 -3.767 2.753 -86.492 1.00 0.00 H new ATOM 0 HA ASN B 78 -4.304 0.027 -85.477 1.00 0.00 H new ATOM 0 HB2 ASN B 78 -5.275 2.686 -84.395 1.00 0.00 H new ATOM 0 HB3 ASN B 78 -5.946 1.134 -83.933 1.00 0.00 H new ATOM 0 HD21 ASN B 78 -2.592 2.516 -82.184 1.00 0.00 H new ATOM 0 HD22 ASN B 78 -3.578 3.455 -83.309 1.00 0.00 H new ATOM 1396 N ILE B 79 -6.352 -0.168 -86.825 1.00 0.00 N ATOM 1397 CA ILE B 79 -7.487 -0.333 -87.725 1.00 0.00 C ATOM 1398 C ILE B 79 -8.664 -0.985 -87.012 1.00 0.00 C ATOM 1399 O ILE B 79 -8.584 -2.136 -86.584 1.00 0.00 O ATOM 1400 CB ILE B 79 -7.096 -1.178 -88.952 1.00 0.00 C ATOM 1401 CG1 ILE B 79 -5.913 -0.540 -89.685 1.00 0.00 C ATOM 1402 CG2 ILE B 79 -8.285 -1.335 -89.889 1.00 0.00 C ATOM 1403 CD1 ILE B 79 -4.568 -1.082 -89.258 1.00 0.00 C ATOM 0 H ILE B 79 -6.008 -1.037 -86.417 1.00 0.00 H new ATOM 0 HA ILE B 79 -7.786 0.661 -88.058 1.00 0.00 H new ATOM 0 HB ILE B 79 -6.795 -2.168 -88.610 1.00 0.00 H new ATOM 0 HG12 ILE B 79 -6.034 -0.697 -90.757 1.00 0.00 H new ATOM 0 HG13 ILE B 79 -5.931 0.537 -89.516 1.00 0.00 H new ATOM 0 HG21 ILE B 79 -7.992 -1.935 -90.751 1.00 0.00 H new ATOM 0 HG22 ILE B 79 -9.100 -1.831 -89.362 1.00 0.00 H new ATOM 0 HG23 ILE B 79 -8.615 -0.352 -90.226 1.00 0.00 H new ATOM 0 HD11 ILE B 79 -3.779 -0.582 -89.820 1.00 0.00 H new ATOM 0 HD12 ILE B 79 -4.424 -0.901 -88.193 1.00 0.00 H new ATOM 0 HD13 ILE B 79 -4.529 -2.154 -89.452 1.00 0.00 H new ATOM 1415 N THR B 80 -9.758 -0.242 -86.888 1.00 0.00 N ATOM 1416 CA THR B 80 -10.925 -0.714 -86.150 1.00 0.00 C ATOM 1417 C THR B 80 -11.890 -1.459 -87.063 1.00 0.00 C ATOM 1418 O THR B 80 -12.402 -0.898 -88.032 1.00 0.00 O ATOM 1419 CB THR B 80 -11.658 0.455 -85.467 1.00 0.00 C ATOM 1420 OG1 THR B 80 -10.778 1.093 -84.532 1.00 0.00 O ATOM 1421 CG2 THR B 80 -12.893 -0.046 -84.734 1.00 0.00 C ATOM 0 H THR B 80 -9.862 0.690 -87.289 1.00 0.00 H new ATOM 0 HA THR B 80 -10.566 -1.401 -85.384 1.00 0.00 H new ATOM 0 HB THR B 80 -11.966 1.168 -86.232 1.00 0.00 H new ATOM 0 HG1 THR B 80 -11.245 1.838 -84.099 1.00 0.00 H new ATOM 0 HG21 THR B 80 -13.399 0.794 -84.257 1.00 0.00 H new ATOM 0 HG22 THR B 80 -13.570 -0.521 -85.444 1.00 0.00 H new ATOM 0 HG23 THR B 80 -12.597 -0.770 -83.975 1.00 0.00 H new ATOM 1429 N LEU B 81 -12.135 -2.726 -86.749 1.00 0.00 N ATOM 1430 CA LEU B 81 -13.141 -3.510 -87.454 1.00 0.00 C ATOM 1431 C LEU B 81 -13.998 -4.311 -86.482 1.00 0.00 C ATOM 1432 O LEU B 81 -13.505 -5.210 -85.801 1.00 0.00 O ATOM 1433 CB LEU B 81 -12.469 -4.460 -88.454 1.00 0.00 C ATOM 1434 CG LEU B 81 -13.417 -5.363 -89.254 1.00 0.00 C ATOM 1435 CD1 LEU B 81 -14.290 -4.506 -90.161 1.00 0.00 C ATOM 1436 CD2 LEU B 81 -12.603 -6.362 -90.064 1.00 0.00 C ATOM 0 H LEU B 81 -11.649 -3.233 -86.009 1.00 0.00 H new ATOM 0 HA LEU B 81 -13.788 -2.816 -87.991 1.00 0.00 H new ATOM 0 HB2 LEU B 81 -11.885 -3.865 -89.156 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -11.767 -5.092 -87.911 1.00 0.00 H new ATOM 0 HG LEU B 81 -14.066 -5.917 -88.575 1.00 0.00 H new ATOM 0 HD11 LEU B 81 -14.964 -5.147 -90.729 1.00 0.00 H new ATOM 0 HD12 LEU B 81 -14.874 -3.813 -89.555 1.00 0.00 H new ATOM 0 HD13 LEU B 81 -13.658 -3.943 -90.848 1.00 0.00 H new ATOM 0 HD21 LEU B 81 -13.276 -7.004 -90.633 1.00 0.00 H new ATOM 0 HD22 LEU B 81 -11.947 -5.826 -90.750 1.00 0.00 H new ATOM 0 HD23 LEU B 81 -12.002 -6.973 -89.390 1.00 0.00 H new TER 1448 LEU B 81