USER MOD reduce.3.24.130724 H: found=0, std=0, add=938, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 938 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 31 MET CE :methyl -139:sc= -0.494 (180deg=-3.1!) USER MOD Set 1.2: A 105 THR OG1 : rot 160:sc= -0.293 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ -141:sc=-0.00406 (180deg=-0.286) USER MOD Single : A 7 SER OG : rot 151:sc= -1.61! USER MOD Single : A 8 SER OG : rot 180:sc= -0.565 USER MOD Single : A 10 THR OG1 : rot -11:sc= -1.25! USER MOD Single : A 14 SER OG : rot 58:sc= 1.1 USER MOD Single : A 17 SER OG : rot -43:sc= 1.04 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 SER OG : rot 29:sc= -0.0488 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 GLN : amide:sc= -1.3 K(o=-1.3,f=-7.8!) USER MOD Single : A 63 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 ASN : amide:sc= -0.0384 X(o=-0.038,f=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 97:sc= 0.0445 USER MOD Single : A 77 ASN : amide:sc= -0.223 K(o=-0.22,f=-1.2!) USER MOD Single : A 83 ASN :FLIP amide:sc= 0.558 F(o=-0.022,f=0.56) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 TYR OH : rot 145:sc= 0.839 USER MOD Single : A 93 THR OG1 : rot 180:sc= -0.0819 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= -2.37! USER MOD Single : A 100 ASN : amide:sc= -0.815 K(o=-0.82,f=-3) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 8.185 3.316 -4.595 1.00 0.00 N ATOM 2 CA MET A 1 7.810 1.979 -5.139 1.00 0.00 C ATOM 3 C MET A 1 6.656 1.401 -4.317 1.00 0.00 C ATOM 4 O MET A 1 6.787 0.368 -3.689 1.00 0.00 O ATOM 5 CB MET A 1 9.014 1.038 -5.060 1.00 0.00 C ATOM 6 CG MET A 1 8.595 -0.365 -5.502 1.00 0.00 C ATOM 7 SD MET A 1 9.201 -0.675 -7.180 1.00 0.00 S ATOM 8 CE MET A 1 9.406 -2.465 -7.020 1.00 0.00 C ATOM 0 H1 MET A 1 8.969 3.710 -5.153 1.00 0.00 H new ATOM 0 H2 MET A 1 7.366 3.955 -4.649 1.00 0.00 H new ATOM 0 H3 MET A 1 8.481 3.217 -3.603 1.00 0.00 H new ATOM 0 HA MET A 1 7.500 2.084 -6.179 1.00 0.00 H new ATOM 0 HB2 MET A 1 9.819 1.406 -5.696 1.00 0.00 H new ATOM 0 HB3 MET A 1 9.401 1.010 -4.041 1.00 0.00 H new ATOM 0 HG2 MET A 1 8.997 -1.110 -4.815 1.00 0.00 H new ATOM 0 HG3 MET A 1 7.509 -0.458 -5.473 1.00 0.00 H new ATOM 0 HE1 MET A 1 9.779 -2.874 -7.959 1.00 0.00 H new ATOM 0 HE2 MET A 1 10.117 -2.680 -6.223 1.00 0.00 H new ATOM 0 HE3 MET A 1 8.445 -2.921 -6.782 1.00 0.00 H new ATOM 20 N LYS A 2 5.528 2.055 -4.316 1.00 0.00 N ATOM 21 CA LYS A 2 4.369 1.539 -3.534 1.00 0.00 C ATOM 22 C LYS A 2 3.372 0.874 -4.484 1.00 0.00 C ATOM 23 O LYS A 2 3.215 1.281 -5.619 1.00 0.00 O ATOM 24 CB LYS A 2 3.688 2.699 -2.805 1.00 0.00 C ATOM 25 CG LYS A 2 4.487 3.049 -1.548 1.00 0.00 C ATOM 26 CD LYS A 2 4.232 4.510 -1.170 1.00 0.00 C ATOM 27 CE LYS A 2 5.416 5.040 -0.360 1.00 0.00 C ATOM 28 NZ LYS A 2 6.549 5.346 -1.279 1.00 0.00 N ATOM 0 H LYS A 2 5.358 2.924 -4.822 1.00 0.00 H new ATOM 0 HA LYS A 2 4.717 0.809 -2.804 1.00 0.00 H new ATOM 0 HB2 LYS A 2 3.623 3.567 -3.461 1.00 0.00 H new ATOM 0 HB3 LYS A 2 2.668 2.425 -2.536 1.00 0.00 H new ATOM 0 HG2 LYS A 2 4.197 2.394 -0.726 1.00 0.00 H new ATOM 0 HG3 LYS A 2 5.551 2.888 -1.724 1.00 0.00 H new ATOM 0 HD2 LYS A 2 4.094 5.111 -2.069 1.00 0.00 H new ATOM 0 HD3 LYS A 2 3.314 4.592 -0.588 1.00 0.00 H new ATOM 0 HE2 LYS A 2 5.124 5.937 0.186 1.00 0.00 H new ATOM 0 HE3 LYS A 2 5.724 4.302 0.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 7.445 5.066 -0.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 6.427 4.820 -2.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 6.567 6.366 -1.481 1.00 0.00 H new ATOM 42 N ILE A 3 2.703 -0.151 -4.033 1.00 0.00 N ATOM 43 CA ILE A 3 1.723 -0.843 -4.916 1.00 0.00 C ATOM 44 C ILE A 3 0.305 -0.639 -4.381 1.00 0.00 C ATOM 45 O ILE A 3 0.034 -0.836 -3.214 1.00 0.00 O ATOM 46 CB ILE A 3 2.040 -2.338 -4.951 1.00 0.00 C ATOM 47 CG1 ILE A 3 3.445 -2.548 -5.521 1.00 0.00 C ATOM 48 CG2 ILE A 3 1.021 -3.057 -5.836 1.00 0.00 C ATOM 49 CD1 ILE A 3 4.162 -3.638 -4.722 1.00 0.00 C ATOM 0 H ILE A 3 2.792 -0.538 -3.094 1.00 0.00 H new ATOM 0 HA ILE A 3 1.791 -0.428 -5.921 1.00 0.00 H new ATOM 0 HB ILE A 3 1.992 -2.742 -3.940 1.00 0.00 H new ATOM 0 HG12 ILE A 3 3.384 -2.833 -6.571 1.00 0.00 H new ATOM 0 HG13 ILE A 3 4.010 -1.617 -5.475 1.00 0.00 H new ATOM 0 HG21 ILE A 3 1.248 -4.123 -5.860 1.00 0.00 H new ATOM 0 HG22 ILE A 3 0.019 -2.908 -5.432 1.00 0.00 H new ATOM 0 HG23 ILE A 3 1.068 -2.653 -6.847 1.00 0.00 H new ATOM 0 HD11 ILE A 3 5.163 -3.788 -5.128 1.00 0.00 H new ATOM 0 HD12 ILE A 3 4.235 -3.335 -3.678 1.00 0.00 H new ATOM 0 HD13 ILE A 3 3.599 -4.569 -4.791 1.00 0.00 H new ATOM 61 N ALA A 4 -0.603 -0.256 -5.234 1.00 0.00 N ATOM 62 CA ALA A 4 -2.008 -0.047 -4.790 1.00 0.00 C ATOM 63 C ALA A 4 -2.935 -0.882 -5.674 1.00 0.00 C ATOM 64 O ALA A 4 -2.674 -1.080 -6.843 1.00 0.00 O ATOM 65 CB ALA A 4 -2.373 1.433 -4.918 1.00 0.00 C ATOM 0 H ALA A 4 -0.431 -0.078 -6.224 1.00 0.00 H new ATOM 0 HA ALA A 4 -2.116 -0.352 -3.749 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -3.402 1.583 -4.592 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -1.705 2.028 -4.295 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -2.272 1.744 -5.958 1.00 0.00 H new ATOM 71 N ILE A 5 -4.010 -1.380 -5.129 1.00 0.00 N ATOM 72 CA ILE A 5 -4.939 -2.206 -5.950 1.00 0.00 C ATOM 73 C ILE A 5 -6.378 -1.736 -5.731 1.00 0.00 C ATOM 74 O ILE A 5 -6.846 -1.633 -4.614 1.00 0.00 O ATOM 75 CB ILE A 5 -4.811 -3.673 -5.540 1.00 0.00 C ATOM 76 CG1 ILE A 5 -3.342 -3.993 -5.251 1.00 0.00 C ATOM 77 CG2 ILE A 5 -5.314 -4.567 -6.675 1.00 0.00 C ATOM 78 CD1 ILE A 5 -3.063 -3.813 -3.757 1.00 0.00 C ATOM 0 H ILE A 5 -4.285 -1.252 -4.155 1.00 0.00 H new ATOM 0 HA ILE A 5 -4.683 -2.099 -7.004 1.00 0.00 H new ATOM 0 HB ILE A 5 -5.407 -3.854 -4.645 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -3.116 -5.016 -5.553 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -2.695 -3.338 -5.834 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -5.222 -5.613 -6.382 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -6.359 -4.338 -6.882 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -4.719 -4.388 -7.570 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -2.017 -4.041 -3.552 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -3.273 -2.783 -3.469 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -3.700 -4.487 -3.184 1.00 0.00 H new ATOM 90 N ALA A 6 -7.083 -1.452 -6.791 1.00 0.00 N ATOM 91 CA ALA A 6 -8.492 -0.991 -6.648 1.00 0.00 C ATOM 92 C ALA A 6 -9.329 -2.104 -6.017 1.00 0.00 C ATOM 93 O ALA A 6 -9.069 -3.275 -6.208 1.00 0.00 O ATOM 94 CB ALA A 6 -9.057 -0.649 -8.028 1.00 0.00 C ATOM 0 H ALA A 6 -6.744 -1.519 -7.751 1.00 0.00 H new ATOM 0 HA ALA A 6 -8.524 -0.106 -6.012 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -10.088 -0.311 -7.925 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -8.459 0.143 -8.480 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -9.027 -1.534 -8.663 1.00 0.00 H new ATOM 100 N SER A 7 -10.334 -1.750 -5.263 1.00 0.00 N ATOM 101 CA SER A 7 -11.184 -2.790 -4.621 1.00 0.00 C ATOM 102 C SER A 7 -12.639 -2.316 -4.592 1.00 0.00 C ATOM 103 O SER A 7 -12.927 -1.154 -4.793 1.00 0.00 O ATOM 104 CB SER A 7 -10.699 -3.030 -3.191 1.00 0.00 C ATOM 105 OG SER A 7 -9.871 -4.184 -3.164 1.00 0.00 O ATOM 0 H SER A 7 -10.602 -0.786 -5.065 1.00 0.00 H new ATOM 0 HA SER A 7 -11.116 -3.717 -5.190 1.00 0.00 H new ATOM 0 HB2 SER A 7 -10.145 -2.162 -2.832 1.00 0.00 H new ATOM 0 HB3 SER A 7 -11.550 -3.163 -2.523 1.00 0.00 H new ATOM 0 HG SER A 7 -9.214 -4.098 -2.442 1.00 0.00 H new ATOM 111 N SER A 8 -13.557 -3.209 -4.344 1.00 0.00 N ATOM 112 CA SER A 8 -14.992 -2.811 -4.301 1.00 0.00 C ATOM 113 C SER A 8 -15.448 -2.691 -2.845 1.00 0.00 C ATOM 114 O SER A 8 -16.550 -2.264 -2.563 1.00 0.00 O ATOM 115 CB SER A 8 -15.835 -3.867 -5.015 1.00 0.00 C ATOM 116 OG SER A 8 -16.550 -3.255 -6.081 1.00 0.00 O ATOM 0 H SER A 8 -13.375 -4.197 -4.169 1.00 0.00 H new ATOM 0 HA SER A 8 -15.116 -1.849 -4.799 1.00 0.00 H new ATOM 0 HB2 SER A 8 -15.195 -4.661 -5.400 1.00 0.00 H new ATOM 0 HB3 SER A 8 -16.530 -4.329 -4.314 1.00 0.00 H new ATOM 0 HG SER A 8 -17.091 -3.930 -6.542 1.00 0.00 H new ATOM 122 N GLY A 9 -14.609 -3.063 -1.917 1.00 0.00 N ATOM 123 CA GLY A 9 -14.998 -2.967 -0.480 1.00 0.00 C ATOM 124 C GLY A 9 -13.758 -2.676 0.366 1.00 0.00 C ATOM 125 O GLY A 9 -12.856 -1.978 -0.056 1.00 0.00 O ATOM 0 H GLY A 9 -13.673 -3.429 -2.091 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -15.737 -2.178 -0.344 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -15.463 -3.898 -0.155 1.00 0.00 H new ATOM 129 N THR A 10 -13.703 -3.206 1.557 1.00 0.00 N ATOM 130 CA THR A 10 -12.518 -2.958 2.428 1.00 0.00 C ATOM 131 C THR A 10 -12.082 -4.271 3.080 1.00 0.00 C ATOM 132 O THR A 10 -11.372 -4.280 4.066 1.00 0.00 O ATOM 133 CB THR A 10 -12.887 -1.945 3.515 1.00 0.00 C ATOM 134 OG1 THR A 10 -13.281 -0.722 2.908 1.00 0.00 O ATOM 135 CG2 THR A 10 -11.679 -1.702 4.421 1.00 0.00 C ATOM 0 H THR A 10 -14.426 -3.799 1.965 1.00 0.00 H new ATOM 0 HA THR A 10 -11.700 -2.562 1.826 1.00 0.00 H new ATOM 0 HB THR A 10 -13.711 -2.336 4.111 1.00 0.00 H new ATOM 0 HG1 THR A 10 -13.058 -0.744 1.954 1.00 0.00 H new ATOM 0 HG21 THR A 10 -11.943 -0.981 5.194 1.00 0.00 H new ATOM 0 HG22 THR A 10 -11.379 -2.640 4.887 1.00 0.00 H new ATOM 0 HG23 THR A 10 -10.852 -1.311 3.828 1.00 0.00 H new ATOM 143 N ASP A 11 -12.501 -5.383 2.537 1.00 0.00 N ATOM 144 CA ASP A 11 -12.109 -6.695 3.127 1.00 0.00 C ATOM 145 C ASP A 11 -11.838 -7.700 2.005 1.00 0.00 C ATOM 146 O ASP A 11 -11.852 -7.359 0.838 1.00 0.00 O ATOM 147 CB ASP A 11 -13.243 -7.214 4.014 1.00 0.00 C ATOM 148 CG ASP A 11 -12.729 -7.410 5.441 1.00 0.00 C ATOM 149 OD1 ASP A 11 -12.321 -6.429 6.042 1.00 0.00 O ATOM 150 OD2 ASP A 11 -12.754 -8.535 5.910 1.00 0.00 O ATOM 0 H ASP A 11 -13.097 -5.439 1.711 1.00 0.00 H new ATOM 0 HA ASP A 11 -11.207 -6.569 3.726 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -14.074 -6.508 4.010 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -13.623 -8.157 3.621 1.00 0.00 H new ATOM 155 N LEU A 12 -11.589 -8.935 2.346 1.00 0.00 N ATOM 156 CA LEU A 12 -11.318 -9.957 1.296 1.00 0.00 C ATOM 157 C LEU A 12 -12.584 -10.186 0.468 1.00 0.00 C ATOM 158 O LEU A 12 -12.527 -10.646 -0.656 1.00 0.00 O ATOM 159 CB LEU A 12 -10.894 -11.270 1.958 1.00 0.00 C ATOM 160 CG LEU A 12 -9.584 -11.758 1.336 1.00 0.00 C ATOM 161 CD1 LEU A 12 -8.498 -11.816 2.412 1.00 0.00 C ATOM 162 CD2 LEU A 12 -9.788 -13.155 0.745 1.00 0.00 C ATOM 0 H LEU A 12 -11.562 -9.280 3.305 1.00 0.00 H new ATOM 0 HA LEU A 12 -10.518 -9.605 0.645 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -10.767 -11.124 3.031 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -11.672 -12.022 1.829 1.00 0.00 H new ATOM 0 HG LEU A 12 -9.279 -11.070 0.548 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -7.565 -12.164 1.969 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -8.351 -10.822 2.834 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -8.803 -12.504 3.201 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -8.855 -13.502 0.302 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -10.093 -13.843 1.534 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -10.561 -13.116 -0.022 1.00 0.00 H new ATOM 174 N GLY A 13 -13.728 -9.870 1.013 1.00 0.00 N ATOM 175 CA GLY A 13 -14.996 -10.071 0.254 1.00 0.00 C ATOM 176 C GLY A 13 -14.906 -9.349 -1.092 1.00 0.00 C ATOM 177 O GLY A 13 -15.173 -9.920 -2.132 1.00 0.00 O ATOM 0 H GLY A 13 -13.839 -9.482 1.950 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -15.173 -11.135 0.097 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -15.840 -9.689 0.828 1.00 0.00 H new ATOM 181 N SER A 14 -14.530 -8.100 -1.082 1.00 0.00 N ATOM 182 CA SER A 14 -14.420 -7.343 -2.360 1.00 0.00 C ATOM 183 C SER A 14 -13.138 -7.757 -3.082 1.00 0.00 C ATOM 184 O SER A 14 -12.111 -7.119 -2.962 1.00 0.00 O ATOM 185 CB SER A 14 -14.377 -5.843 -2.064 1.00 0.00 C ATOM 186 OG SER A 14 -13.243 -5.556 -1.254 1.00 0.00 O ATOM 0 H SER A 14 -14.294 -7.571 -0.243 1.00 0.00 H new ATOM 0 HA SER A 14 -15.282 -7.562 -2.990 1.00 0.00 H new ATOM 0 HB2 SER A 14 -14.326 -5.278 -2.995 1.00 0.00 H new ATOM 0 HB3 SER A 14 -15.290 -5.535 -1.554 1.00 0.00 H new ATOM 0 HG SER A 14 -12.430 -5.853 -1.713 1.00 0.00 H new ATOM 192 N GLU A 15 -13.190 -8.827 -3.825 1.00 0.00 N ATOM 193 CA GLU A 15 -11.977 -9.295 -4.554 1.00 0.00 C ATOM 194 C GLU A 15 -11.310 -8.112 -5.270 1.00 0.00 C ATOM 195 O GLU A 15 -10.565 -7.359 -4.676 1.00 0.00 O ATOM 196 CB GLU A 15 -12.379 -10.361 -5.578 1.00 0.00 C ATOM 197 CG GLU A 15 -12.554 -11.706 -4.872 1.00 0.00 C ATOM 198 CD GLU A 15 -13.418 -12.627 -5.736 1.00 0.00 C ATOM 199 OE1 GLU A 15 -13.026 -12.894 -6.859 1.00 0.00 O ATOM 200 OE2 GLU A 15 -14.458 -13.050 -5.258 1.00 0.00 O ATOM 0 H GLU A 15 -14.023 -9.400 -3.960 1.00 0.00 H new ATOM 0 HA GLU A 15 -11.270 -9.723 -3.843 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -13.307 -10.074 -6.072 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -11.617 -10.442 -6.353 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -11.581 -12.164 -4.693 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -13.021 -11.560 -3.898 1.00 0.00 H new ATOM 207 N VAL A 16 -11.564 -7.942 -6.541 1.00 0.00 N ATOM 208 CA VAL A 16 -10.933 -6.811 -7.276 1.00 0.00 C ATOM 209 C VAL A 16 -12.017 -5.935 -7.908 1.00 0.00 C ATOM 210 O VAL A 16 -11.834 -5.376 -8.970 1.00 0.00 O ATOM 211 CB VAL A 16 -10.021 -7.364 -8.373 1.00 0.00 C ATOM 212 CG1 VAL A 16 -9.088 -6.258 -8.867 1.00 0.00 C ATOM 213 CG2 VAL A 16 -9.188 -8.517 -7.809 1.00 0.00 C ATOM 0 H VAL A 16 -12.179 -8.535 -7.098 1.00 0.00 H new ATOM 0 HA VAL A 16 -10.347 -6.211 -6.580 1.00 0.00 H new ATOM 0 HB VAL A 16 -10.629 -7.725 -9.203 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -8.438 -6.652 -9.648 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -9.680 -5.435 -9.268 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -8.480 -5.897 -8.037 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -8.538 -8.912 -8.590 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -8.581 -8.155 -6.979 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -9.851 -9.306 -7.456 1.00 0.00 H new ATOM 223 N SER A 17 -13.143 -5.810 -7.262 1.00 0.00 N ATOM 224 CA SER A 17 -14.234 -4.967 -7.827 1.00 0.00 C ATOM 225 C SER A 17 -14.377 -5.251 -9.324 1.00 0.00 C ATOM 226 O SER A 17 -13.900 -6.250 -9.824 1.00 0.00 O ATOM 227 CB SER A 17 -13.896 -3.491 -7.617 1.00 0.00 C ATOM 228 OG SER A 17 -13.071 -3.042 -8.685 1.00 0.00 O ATOM 0 H SER A 17 -13.355 -6.254 -6.369 1.00 0.00 H new ATOM 0 HA SER A 17 -15.172 -5.201 -7.323 1.00 0.00 H new ATOM 0 HB2 SER A 17 -14.810 -2.899 -7.575 1.00 0.00 H new ATOM 0 HB3 SER A 17 -13.384 -3.355 -6.664 1.00 0.00 H new ATOM 0 HG SER A 17 -12.393 -3.721 -8.883 1.00 0.00 H new ATOM 234 N ARG A 18 -15.027 -4.377 -10.042 1.00 0.00 N ATOM 235 CA ARG A 18 -15.199 -4.595 -11.507 1.00 0.00 C ATOM 236 C ARG A 18 -15.037 -3.263 -12.241 1.00 0.00 C ATOM 237 O ARG A 18 -15.344 -3.147 -13.410 1.00 0.00 O ATOM 238 CB ARG A 18 -16.593 -5.163 -11.778 1.00 0.00 C ATOM 239 CG ARG A 18 -17.598 -4.531 -10.812 1.00 0.00 C ATOM 240 CD ARG A 18 -17.718 -5.403 -9.560 1.00 0.00 C ATOM 241 NE ARG A 18 -18.931 -5.005 -8.793 1.00 0.00 N ATOM 242 CZ ARG A 18 -19.683 -5.918 -8.241 1.00 0.00 C ATOM 243 NH1 ARG A 18 -19.913 -7.040 -8.868 1.00 0.00 N ATOM 244 NH2 ARG A 18 -20.204 -5.711 -7.062 1.00 0.00 N ATOM 0 H ARG A 18 -15.447 -3.521 -9.678 1.00 0.00 H new ATOM 0 HA ARG A 18 -14.446 -5.299 -11.862 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -16.886 -4.961 -12.808 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -16.586 -6.246 -11.655 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -17.274 -3.527 -10.539 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -18.570 -4.433 -11.295 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -17.781 -6.454 -9.841 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -16.829 -5.291 -8.939 1.00 0.00 H new ATOM 0 HE ARG A 18 -19.174 -4.019 -8.699 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -19.505 -7.203 -9.789 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -20.501 -7.754 -8.437 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -20.024 -4.835 -6.571 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -20.792 -6.425 -6.632 1.00 0.00 H new ATOM 258 N PHE A 19 -14.558 -2.256 -11.563 1.00 0.00 N ATOM 259 CA PHE A 19 -14.377 -0.932 -12.223 1.00 0.00 C ATOM 260 C PHE A 19 -13.099 -0.273 -11.704 1.00 0.00 C ATOM 261 O PHE A 19 -12.266 -0.907 -11.088 1.00 0.00 O ATOM 262 CB PHE A 19 -15.576 -0.035 -11.904 1.00 0.00 C ATOM 263 CG PHE A 19 -16.853 -0.758 -12.253 1.00 0.00 C ATOM 264 CD1 PHE A 19 -17.066 -1.210 -13.562 1.00 0.00 C ATOM 265 CD2 PHE A 19 -17.825 -0.976 -11.268 1.00 0.00 C ATOM 266 CE1 PHE A 19 -18.252 -1.882 -13.887 1.00 0.00 C ATOM 267 CE2 PHE A 19 -19.011 -1.647 -11.593 1.00 0.00 C ATOM 268 CZ PHE A 19 -19.225 -2.099 -12.902 1.00 0.00 C ATOM 0 H PHE A 19 -14.284 -2.293 -10.581 1.00 0.00 H new ATOM 0 HA PHE A 19 -14.302 -1.072 -13.301 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -15.574 0.231 -10.847 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -15.507 0.896 -12.467 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -16.316 -1.041 -14.321 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -17.660 -0.627 -10.259 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -18.416 -2.232 -14.895 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -19.761 -1.816 -10.834 1.00 0.00 H new ATOM 0 HZ PHE A 19 -20.140 -2.615 -13.152 1.00 0.00 H new ATOM 278 N PHE A 20 -12.940 0.999 -11.947 1.00 0.00 N ATOM 279 CA PHE A 20 -11.718 1.703 -11.468 1.00 0.00 C ATOM 280 C PHE A 20 -12.119 3.027 -10.814 1.00 0.00 C ATOM 281 O PHE A 20 -11.888 3.246 -9.641 1.00 0.00 O ATOM 282 CB PHE A 20 -10.791 1.981 -12.653 1.00 0.00 C ATOM 283 CG PHE A 20 -9.686 2.913 -12.216 1.00 0.00 C ATOM 284 CD1 PHE A 20 -9.080 2.742 -10.965 1.00 0.00 C ATOM 285 CD2 PHE A 20 -9.269 3.950 -13.061 1.00 0.00 C ATOM 286 CE1 PHE A 20 -8.056 3.607 -10.559 1.00 0.00 C ATOM 287 CE2 PHE A 20 -8.246 4.815 -12.654 1.00 0.00 C ATOM 288 CZ PHE A 20 -7.638 4.645 -11.403 1.00 0.00 C ATOM 0 H PHE A 20 -13.604 1.581 -12.457 1.00 0.00 H new ATOM 0 HA PHE A 20 -11.200 1.078 -10.741 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -10.369 1.048 -13.026 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -11.354 2.426 -13.473 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -9.402 1.943 -10.313 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -9.736 4.082 -14.026 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -7.588 3.474 -9.595 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -7.925 5.615 -13.305 1.00 0.00 H new ATOM 0 HZ PHE A 20 -6.849 5.312 -11.090 1.00 0.00 H new ATOM 298 N GLY A 21 -12.720 3.909 -11.564 1.00 0.00 N ATOM 299 CA GLY A 21 -13.138 5.217 -10.986 1.00 0.00 C ATOM 300 C GLY A 21 -14.444 5.040 -10.209 1.00 0.00 C ATOM 301 O GLY A 21 -14.997 5.985 -9.683 1.00 0.00 O ATOM 0 H GLY A 21 -12.940 3.781 -12.552 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -12.359 5.600 -10.326 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -13.272 5.951 -11.781 1.00 0.00 H new ATOM 305 N ARG A 22 -14.943 3.835 -10.131 1.00 0.00 N ATOM 306 CA ARG A 22 -16.212 3.600 -9.387 1.00 0.00 C ATOM 307 C ARG A 22 -15.899 2.955 -8.034 1.00 0.00 C ATOM 308 O ARG A 22 -16.136 3.532 -6.992 1.00 0.00 O ATOM 309 CB ARG A 22 -17.115 2.670 -10.201 1.00 0.00 C ATOM 310 CG ARG A 22 -18.145 3.503 -10.969 1.00 0.00 C ATOM 311 CD ARG A 22 -18.254 2.985 -12.405 1.00 0.00 C ATOM 312 NE ARG A 22 -18.073 4.118 -13.356 1.00 0.00 N ATOM 313 CZ ARG A 22 -18.026 3.890 -14.641 1.00 0.00 C ATOM 314 NH1 ARG A 22 -17.832 2.679 -15.082 1.00 0.00 N ATOM 315 NH2 ARG A 22 -18.172 4.877 -15.483 1.00 0.00 N ATOM 0 H ARG A 22 -14.526 3.004 -10.551 1.00 0.00 H new ATOM 0 HA ARG A 22 -16.721 4.550 -9.226 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -16.517 2.081 -10.896 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -17.621 1.966 -9.540 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -19.115 3.445 -10.476 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -17.851 4.552 -10.971 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -17.499 2.220 -12.586 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -19.226 2.516 -12.561 1.00 0.00 H new ATOM 0 HE ARG A 22 -17.986 5.071 -13.003 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -17.717 1.909 -14.423 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -17.795 2.502 -16.086 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -18.323 5.825 -15.137 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -18.136 4.701 -16.487 1.00 0.00 H new ATOM 329 N ALA A 23 -15.368 1.762 -8.043 1.00 0.00 N ATOM 330 CA ALA A 23 -15.039 1.084 -6.757 1.00 0.00 C ATOM 331 C ALA A 23 -14.359 2.084 -5.813 1.00 0.00 C ATOM 332 O ALA A 23 -13.202 2.409 -5.995 1.00 0.00 O ATOM 333 CB ALA A 23 -14.086 -0.082 -7.030 1.00 0.00 C ATOM 0 H ALA A 23 -15.148 1.229 -8.884 1.00 0.00 H new ATOM 0 HA ALA A 23 -15.954 0.711 -6.296 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -13.843 -0.581 -6.092 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -14.564 -0.792 -7.705 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -13.172 0.295 -7.488 1.00 0.00 H new ATOM 339 N PRO A 24 -15.099 2.547 -4.833 1.00 0.00 N ATOM 340 CA PRO A 24 -14.593 3.516 -3.843 1.00 0.00 C ATOM 341 C PRO A 24 -13.757 2.813 -2.766 1.00 0.00 C ATOM 342 O PRO A 24 -14.088 2.841 -1.597 1.00 0.00 O ATOM 343 CB PRO A 24 -15.869 4.102 -3.232 1.00 0.00 C ATOM 344 CG PRO A 24 -16.986 3.059 -3.473 1.00 0.00 C ATOM 345 CD PRO A 24 -16.508 2.155 -4.624 1.00 0.00 C ATOM 0 HA PRO A 24 -13.943 4.271 -4.286 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -15.738 4.292 -2.167 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -16.120 5.055 -3.697 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -17.169 2.474 -2.572 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -17.924 3.550 -3.731 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -16.593 1.100 -4.363 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -17.102 2.310 -5.525 1.00 0.00 H new ATOM 353 N TYR A 25 -12.677 2.185 -3.145 1.00 0.00 N ATOM 354 CA TYR A 25 -11.828 1.489 -2.139 1.00 0.00 C ATOM 355 C TYR A 25 -10.430 1.266 -2.723 1.00 0.00 C ATOM 356 O TYR A 25 -10.043 0.156 -3.024 1.00 0.00 O ATOM 357 CB TYR A 25 -12.455 0.140 -1.783 1.00 0.00 C ATOM 358 CG TYR A 25 -13.638 0.357 -0.870 1.00 0.00 C ATOM 359 CD1 TYR A 25 -13.435 0.747 0.462 1.00 0.00 C ATOM 360 CD2 TYR A 25 -14.941 0.169 -1.353 1.00 0.00 C ATOM 361 CE1 TYR A 25 -14.533 0.946 1.308 1.00 0.00 C ATOM 362 CE2 TYR A 25 -16.039 0.370 -0.505 1.00 0.00 C ATOM 363 CZ TYR A 25 -15.835 0.758 0.825 1.00 0.00 C ATOM 364 OH TYR A 25 -16.917 0.955 1.660 1.00 0.00 O ATOM 0 H TYR A 25 -12.347 2.124 -4.108 1.00 0.00 H new ATOM 0 HA TYR A 25 -11.755 2.100 -1.240 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -12.772 -0.376 -2.689 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -11.718 -0.498 -1.295 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -12.432 0.894 0.835 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -15.099 -0.131 -2.379 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -14.376 1.245 2.334 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -17.042 0.226 -0.877 1.00 0.00 H new ATOM 0 HH TYR A 25 -17.746 0.783 1.167 1.00 0.00 H new ATOM 374 N PHE A 26 -9.669 2.315 -2.885 1.00 0.00 N ATOM 375 CA PHE A 26 -8.300 2.160 -3.451 1.00 0.00 C ATOM 376 C PHE A 26 -7.349 1.680 -2.352 1.00 0.00 C ATOM 377 O PHE A 26 -7.018 2.412 -1.442 1.00 0.00 O ATOM 378 CB PHE A 26 -7.818 3.505 -3.997 1.00 0.00 C ATOM 379 CG PHE A 26 -8.842 4.048 -4.965 1.00 0.00 C ATOM 380 CD1 PHE A 26 -9.106 3.366 -6.160 1.00 0.00 C ATOM 381 CD2 PHE A 26 -9.530 5.231 -4.666 1.00 0.00 C ATOM 382 CE1 PHE A 26 -10.058 3.868 -7.057 1.00 0.00 C ATOM 383 CE2 PHE A 26 -10.481 5.734 -5.563 1.00 0.00 C ATOM 384 CZ PHE A 26 -10.745 5.052 -6.760 1.00 0.00 C ATOM 0 H PHE A 26 -9.937 3.271 -2.650 1.00 0.00 H new ATOM 0 HA PHE A 26 -8.319 1.429 -4.260 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -7.665 4.209 -3.179 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -6.857 3.384 -4.497 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -8.576 2.454 -6.390 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -9.327 5.755 -3.744 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -10.262 3.342 -7.978 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -11.011 6.647 -5.333 1.00 0.00 H new ATOM 0 HZ PHE A 26 -11.478 5.440 -7.452 1.00 0.00 H new ATOM 394 N MET A 27 -6.912 0.453 -2.429 1.00 0.00 N ATOM 395 CA MET A 27 -5.989 -0.079 -1.386 1.00 0.00 C ATOM 396 C MET A 27 -4.564 0.409 -1.659 1.00 0.00 C ATOM 397 O MET A 27 -4.127 0.483 -2.791 1.00 0.00 O ATOM 398 CB MET A 27 -6.017 -1.608 -1.417 1.00 0.00 C ATOM 399 CG MET A 27 -6.749 -2.133 -0.180 1.00 0.00 C ATOM 400 SD MET A 27 -8.142 -3.167 -0.699 1.00 0.00 S ATOM 401 CE MET A 27 -8.488 -3.909 0.915 1.00 0.00 C ATOM 0 H MET A 27 -7.154 -0.205 -3.170 1.00 0.00 H new ATOM 0 HA MET A 27 -6.309 0.275 -0.406 1.00 0.00 H new ATOM 0 HB2 MET A 27 -6.516 -1.954 -2.322 1.00 0.00 H new ATOM 0 HB3 MET A 27 -5.000 -2.000 -1.444 1.00 0.00 H new ATOM 0 HG2 MET A 27 -6.066 -2.710 0.443 1.00 0.00 H new ATOM 0 HG3 MET A 27 -7.106 -1.300 0.426 1.00 0.00 H new ATOM 0 HE1 MET A 27 -9.329 -4.596 0.827 1.00 0.00 H new ATOM 0 HE2 MET A 27 -7.609 -4.454 1.261 1.00 0.00 H new ATOM 0 HE3 MET A 27 -8.734 -3.125 1.631 1.00 0.00 H new ATOM 411 N ILE A 28 -3.835 0.739 -0.627 1.00 0.00 N ATOM 412 CA ILE A 28 -2.438 1.219 -0.820 1.00 0.00 C ATOM 413 C ILE A 28 -1.488 0.355 0.014 1.00 0.00 C ATOM 414 O ILE A 28 -1.784 0.001 1.138 1.00 0.00 O ATOM 415 CB ILE A 28 -2.330 2.677 -0.370 1.00 0.00 C ATOM 416 CG1 ILE A 28 -3.565 3.448 -0.842 1.00 0.00 C ATOM 417 CG2 ILE A 28 -1.076 3.308 -0.975 1.00 0.00 C ATOM 418 CD1 ILE A 28 -3.533 3.581 -2.365 1.00 0.00 C ATOM 0 H ILE A 28 -4.148 0.696 0.343 1.00 0.00 H new ATOM 0 HA ILE A 28 -2.169 1.146 -1.874 1.00 0.00 H new ATOM 0 HB ILE A 28 -2.268 2.717 0.717 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -4.472 2.929 -0.531 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -3.589 4.435 -0.381 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -1.000 4.347 -0.654 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -0.195 2.760 -0.641 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -1.137 3.268 -2.063 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -4.413 4.130 -2.701 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -2.633 4.119 -2.664 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -3.530 2.589 -2.817 1.00 0.00 H new ATOM 430 N VAL A 29 -0.350 0.014 -0.526 1.00 0.00 N ATOM 431 CA VAL A 29 0.614 -0.826 0.240 1.00 0.00 C ATOM 432 C VAL A 29 2.039 -0.333 -0.019 1.00 0.00 C ATOM 433 O VAL A 29 2.369 0.099 -1.105 1.00 0.00 O ATOM 434 CB VAL A 29 0.487 -2.283 -0.210 1.00 0.00 C ATOM 435 CG1 VAL A 29 1.235 -3.187 0.770 1.00 0.00 C ATOM 436 CG2 VAL A 29 -0.991 -2.678 -0.242 1.00 0.00 C ATOM 0 H VAL A 29 -0.046 0.280 -1.463 1.00 0.00 H new ATOM 0 HA VAL A 29 0.394 -0.754 1.305 1.00 0.00 H new ATOM 0 HB VAL A 29 0.916 -2.395 -1.206 1.00 0.00 H new ATOM 0 HG11 VAL A 29 1.144 -4.225 0.449 1.00 0.00 H new ATOM 0 HG12 VAL A 29 2.288 -2.905 0.794 1.00 0.00 H new ATOM 0 HG13 VAL A 29 0.807 -3.076 1.766 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -1.083 -3.716 -0.562 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.419 -2.566 0.754 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -1.525 -2.034 -0.941 1.00 0.00 H new ATOM 446 N GLU A 30 2.887 -0.393 0.972 1.00 0.00 N ATOM 447 CA GLU A 30 4.288 0.075 0.783 1.00 0.00 C ATOM 448 C GLU A 30 5.258 -1.042 1.174 1.00 0.00 C ATOM 449 O GLU A 30 5.422 -1.356 2.337 1.00 0.00 O ATOM 450 CB GLU A 30 4.537 1.300 1.665 1.00 0.00 C ATOM 451 CG GLU A 30 3.267 2.150 1.727 1.00 0.00 C ATOM 452 CD GLU A 30 3.578 3.488 2.401 1.00 0.00 C ATOM 453 OE1 GLU A 30 3.961 4.409 1.697 1.00 0.00 O ATOM 454 OE2 GLU A 30 3.426 3.571 3.608 1.00 0.00 O ATOM 0 H GLU A 30 2.669 -0.746 1.904 1.00 0.00 H new ATOM 0 HA GLU A 30 4.445 0.340 -0.262 1.00 0.00 H new ATOM 0 HB2 GLU A 30 4.827 0.986 2.668 1.00 0.00 H new ATOM 0 HB3 GLU A 30 5.362 1.889 1.264 1.00 0.00 H new ATOM 0 HG2 GLU A 30 2.881 2.319 0.722 1.00 0.00 H new ATOM 0 HG3 GLU A 30 2.491 1.623 2.282 1.00 0.00 H new ATOM 461 N MET A 31 5.903 -1.647 0.212 1.00 0.00 N ATOM 462 CA MET A 31 6.862 -2.742 0.531 1.00 0.00 C ATOM 463 C MET A 31 8.203 -2.136 0.953 1.00 0.00 C ATOM 464 O MET A 31 8.577 -1.067 0.516 1.00 0.00 O ATOM 465 CB MET A 31 7.066 -3.619 -0.707 1.00 0.00 C ATOM 466 CG MET A 31 5.886 -4.582 -0.853 1.00 0.00 C ATOM 467 SD MET A 31 6.501 -6.225 -1.303 1.00 0.00 S ATOM 468 CE MET A 31 4.927 -6.908 -1.881 1.00 0.00 C ATOM 0 H MET A 31 5.807 -1.430 -0.780 1.00 0.00 H new ATOM 0 HA MET A 31 6.464 -3.349 1.344 1.00 0.00 H new ATOM 0 HB2 MET A 31 7.152 -2.995 -1.597 1.00 0.00 H new ATOM 0 HB3 MET A 31 7.997 -4.179 -0.619 1.00 0.00 H new ATOM 0 HG2 MET A 31 5.327 -4.634 0.082 1.00 0.00 H new ATOM 0 HG3 MET A 31 5.198 -4.218 -1.616 1.00 0.00 H new ATOM 0 HE1 MET A 31 4.829 -7.938 -1.537 1.00 0.00 H new ATOM 0 HE2 MET A 31 4.105 -6.313 -1.484 1.00 0.00 H new ATOM 0 HE3 MET A 31 4.899 -6.885 -2.970 1.00 0.00 H new ATOM 478 N LYS A 32 8.929 -2.810 1.804 1.00 0.00 N ATOM 479 CA LYS A 32 10.243 -2.271 2.252 1.00 0.00 C ATOM 480 C LYS A 32 11.374 -3.074 1.606 1.00 0.00 C ATOM 481 O LYS A 32 12.276 -2.523 1.009 1.00 0.00 O ATOM 482 CB LYS A 32 10.346 -2.381 3.775 1.00 0.00 C ATOM 483 CG LYS A 32 11.748 -1.964 4.224 1.00 0.00 C ATOM 484 CD LYS A 32 11.638 -0.971 5.382 1.00 0.00 C ATOM 485 CE LYS A 32 12.372 0.322 5.019 1.00 0.00 C ATOM 486 NZ LYS A 32 11.625 1.487 5.573 1.00 0.00 N ATOM 0 H LYS A 32 8.668 -3.710 2.207 1.00 0.00 H new ATOM 0 HA LYS A 32 10.326 -1.225 1.955 1.00 0.00 H new ATOM 0 HB2 LYS A 32 9.597 -1.745 4.247 1.00 0.00 H new ATOM 0 HB3 LYS A 32 10.141 -3.404 4.091 1.00 0.00 H new ATOM 0 HG2 LYS A 32 12.317 -2.840 4.535 1.00 0.00 H new ATOM 0 HG3 LYS A 32 12.288 -1.511 3.393 1.00 0.00 H new ATOM 0 HD2 LYS A 32 10.590 -0.759 5.595 1.00 0.00 H new ATOM 0 HD3 LYS A 32 12.066 -1.403 6.287 1.00 0.00 H new ATOM 0 HE2 LYS A 32 13.386 0.302 5.419 1.00 0.00 H new ATOM 0 HE3 LYS A 32 12.458 0.413 3.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 12.122 2.367 5.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 10.666 1.507 5.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 11.565 1.401 6.608 1.00 0.00 H new ATOM 500 N LYS A 33 11.332 -4.374 1.721 1.00 0.00 N ATOM 501 CA LYS A 33 12.407 -5.209 1.113 1.00 0.00 C ATOM 502 C LYS A 33 11.872 -6.618 0.850 1.00 0.00 C ATOM 503 O LYS A 33 12.452 -7.600 1.269 1.00 0.00 O ATOM 504 CB LYS A 33 13.596 -5.287 2.073 1.00 0.00 C ATOM 505 CG LYS A 33 14.824 -4.649 1.419 1.00 0.00 C ATOM 506 CD LYS A 33 15.901 -5.713 1.210 1.00 0.00 C ATOM 507 CE LYS A 33 17.083 -5.434 2.141 1.00 0.00 C ATOM 508 NZ LYS A 33 18.310 -6.079 1.594 1.00 0.00 N ATOM 0 H LYS A 33 10.602 -4.893 2.209 1.00 0.00 H new ATOM 0 HA LYS A 33 12.727 -4.760 0.173 1.00 0.00 H new ATOM 0 HB2 LYS A 33 13.359 -4.773 3.005 1.00 0.00 H new ATOM 0 HB3 LYS A 33 13.805 -6.326 2.326 1.00 0.00 H new ATOM 0 HG2 LYS A 33 14.549 -4.202 0.464 1.00 0.00 H new ATOM 0 HG3 LYS A 33 15.208 -3.846 2.048 1.00 0.00 H new ATOM 0 HD2 LYS A 33 15.492 -6.703 1.411 1.00 0.00 H new ATOM 0 HD3 LYS A 33 16.234 -5.710 0.172 1.00 0.00 H new ATOM 0 HE2 LYS A 33 17.237 -4.359 2.239 1.00 0.00 H new ATOM 0 HE3 LYS A 33 16.872 -5.818 3.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 19.113 -5.889 2.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 18.160 -7.106 1.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 18.514 -5.693 0.650 1.00 0.00 H new ATOM 522 N GLY A 34 10.771 -6.726 0.158 1.00 0.00 N ATOM 523 CA GLY A 34 10.203 -8.073 -0.131 1.00 0.00 C ATOM 524 C GLY A 34 9.347 -8.531 1.051 1.00 0.00 C ATOM 525 O GLY A 34 9.105 -9.708 1.234 1.00 0.00 O ATOM 0 H GLY A 34 10.241 -5.941 -0.219 1.00 0.00 H new ATOM 0 HA2 GLY A 34 9.600 -8.038 -1.038 1.00 0.00 H new ATOM 0 HA3 GLY A 34 11.007 -8.787 -0.310 1.00 0.00 H new ATOM 529 N ASN A 35 8.885 -7.612 1.854 1.00 0.00 N ATOM 530 CA ASN A 35 8.044 -7.998 3.022 1.00 0.00 C ATOM 531 C ASN A 35 7.029 -6.890 3.308 1.00 0.00 C ATOM 532 O ASN A 35 7.320 -5.928 3.991 1.00 0.00 O ATOM 533 CB ASN A 35 8.934 -8.200 4.250 1.00 0.00 C ATOM 534 CG ASN A 35 8.410 -9.378 5.072 1.00 0.00 C ATOM 535 OD1 ASN A 35 8.802 -10.508 4.855 1.00 0.00 O ATOM 536 ND2 ASN A 35 7.533 -9.162 6.014 1.00 0.00 N ATOM 0 H ASN A 35 9.053 -6.611 1.752 1.00 0.00 H new ATOM 0 HA ASN A 35 7.518 -8.926 2.798 1.00 0.00 H new ATOM 0 HB2 ASN A 35 9.962 -8.388 3.940 1.00 0.00 H new ATOM 0 HB3 ASN A 35 8.944 -7.295 4.857 1.00 0.00 H new ATOM 0 HD21 ASN A 35 7.177 -9.941 6.568 1.00 0.00 H new ATOM 0 HD22 ASN A 35 7.204 -8.214 6.197 1.00 0.00 H new ATOM 543 N ILE A 36 5.836 -7.018 2.795 1.00 0.00 N ATOM 544 CA ILE A 36 4.804 -5.973 3.041 1.00 0.00 C ATOM 545 C ILE A 36 4.809 -5.597 4.523 1.00 0.00 C ATOM 546 O ILE A 36 4.480 -6.396 5.378 1.00 0.00 O ATOM 547 CB ILE A 36 3.426 -6.517 2.661 1.00 0.00 C ATOM 548 CG1 ILE A 36 3.255 -7.920 3.248 1.00 0.00 C ATOM 549 CG2 ILE A 36 3.304 -6.583 1.138 1.00 0.00 C ATOM 550 CD1 ILE A 36 1.871 -8.460 2.886 1.00 0.00 C ATOM 0 H ILE A 36 5.532 -7.801 2.216 1.00 0.00 H new ATOM 0 HA ILE A 36 5.026 -5.092 2.438 1.00 0.00 H new ATOM 0 HB ILE A 36 2.653 -5.859 3.057 1.00 0.00 H new ATOM 0 HG12 ILE A 36 4.028 -8.584 2.862 1.00 0.00 H new ATOM 0 HG13 ILE A 36 3.373 -7.889 4.331 1.00 0.00 H new ATOM 0 HG21 ILE A 36 2.322 -6.971 0.868 1.00 0.00 H new ATOM 0 HG22 ILE A 36 3.427 -5.584 0.719 1.00 0.00 H new ATOM 0 HG23 ILE A 36 4.076 -7.241 0.739 1.00 0.00 H new ATOM 0 HD11 ILE A 36 1.750 -9.459 3.304 1.00 0.00 H new ATOM 0 HD12 ILE A 36 1.105 -7.800 3.294 1.00 0.00 H new ATOM 0 HD13 ILE A 36 1.771 -8.506 1.802 1.00 0.00 H new ATOM 562 N GLU A 37 5.178 -4.386 4.836 1.00 0.00 N ATOM 563 CA GLU A 37 5.202 -3.963 6.265 1.00 0.00 C ATOM 564 C GLU A 37 4.141 -2.885 6.494 1.00 0.00 C ATOM 565 O GLU A 37 4.086 -2.268 7.539 1.00 0.00 O ATOM 566 CB GLU A 37 6.584 -3.405 6.609 1.00 0.00 C ATOM 567 CG GLU A 37 6.976 -3.848 8.020 1.00 0.00 C ATOM 568 CD GLU A 37 6.701 -2.713 9.007 1.00 0.00 C ATOM 569 OE1 GLU A 37 7.577 -1.884 9.185 1.00 0.00 O ATOM 570 OE2 GLU A 37 5.617 -2.691 9.568 1.00 0.00 O ATOM 0 H GLU A 37 5.464 -3.672 4.166 1.00 0.00 H new ATOM 0 HA GLU A 37 4.990 -4.821 6.903 1.00 0.00 H new ATOM 0 HB2 GLU A 37 7.321 -3.758 5.888 1.00 0.00 H new ATOM 0 HB3 GLU A 37 6.574 -2.317 6.547 1.00 0.00 H new ATOM 0 HG2 GLU A 37 6.411 -4.736 8.304 1.00 0.00 H new ATOM 0 HG3 GLU A 37 8.031 -4.120 8.047 1.00 0.00 H new ATOM 577 N SER A 38 3.297 -2.654 5.525 1.00 0.00 N ATOM 578 CA SER A 38 2.240 -1.617 5.689 1.00 0.00 C ATOM 579 C SER A 38 1.160 -1.821 4.625 1.00 0.00 C ATOM 580 O SER A 38 1.397 -1.651 3.445 1.00 0.00 O ATOM 581 CB SER A 38 2.859 -0.227 5.529 1.00 0.00 C ATOM 582 OG SER A 38 3.538 -0.155 4.282 1.00 0.00 O ATOM 0 H SER A 38 3.294 -3.139 4.628 1.00 0.00 H new ATOM 0 HA SER A 38 1.795 -1.703 6.681 1.00 0.00 H new ATOM 0 HB2 SER A 38 2.083 0.537 5.578 1.00 0.00 H new ATOM 0 HB3 SER A 38 3.553 -0.029 6.346 1.00 0.00 H new ATOM 0 HG SER A 38 3.107 -0.757 3.640 1.00 0.00 H new ATOM 588 N SER A 39 -0.026 -2.184 5.033 1.00 0.00 N ATOM 589 CA SER A 39 -1.120 -2.400 4.044 1.00 0.00 C ATOM 590 C SER A 39 -2.403 -1.737 4.549 1.00 0.00 C ATOM 591 O SER A 39 -3.062 -2.236 5.438 1.00 0.00 O ATOM 592 CB SER A 39 -1.357 -3.900 3.866 1.00 0.00 C ATOM 593 OG SER A 39 -0.620 -4.613 4.851 1.00 0.00 O ATOM 0 H SER A 39 -0.284 -2.340 6.007 1.00 0.00 H new ATOM 0 HA SER A 39 -0.837 -1.961 3.087 1.00 0.00 H new ATOM 0 HB2 SER A 39 -2.420 -4.125 3.957 1.00 0.00 H new ATOM 0 HB3 SER A 39 -1.049 -4.212 2.868 1.00 0.00 H new ATOM 0 HG SER A 39 -0.771 -5.575 4.740 1.00 0.00 H new ATOM 599 N GLU A 40 -2.763 -0.616 3.985 1.00 0.00 N ATOM 600 CA GLU A 40 -4.005 0.078 4.430 1.00 0.00 C ATOM 601 C GLU A 40 -4.958 0.217 3.242 1.00 0.00 C ATOM 602 O GLU A 40 -4.702 -0.289 2.167 1.00 0.00 O ATOM 603 CB GLU A 40 -3.650 1.467 4.966 1.00 0.00 C ATOM 604 CG GLU A 40 -4.234 1.638 6.370 1.00 0.00 C ATOM 605 CD GLU A 40 -4.937 2.993 6.469 1.00 0.00 C ATOM 606 OE1 GLU A 40 -5.630 3.349 5.531 1.00 0.00 O ATOM 607 OE2 GLU A 40 -4.770 3.652 7.483 1.00 0.00 O ATOM 0 H GLU A 40 -2.251 -0.151 3.235 1.00 0.00 H new ATOM 0 HA GLU A 40 -4.486 -0.501 5.218 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -2.568 1.592 4.993 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.043 2.236 4.301 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -4.939 0.834 6.582 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -3.442 1.572 7.115 1.00 0.00 H new ATOM 614 N VAL A 41 -6.056 0.899 3.421 1.00 0.00 N ATOM 615 CA VAL A 41 -7.018 1.064 2.296 1.00 0.00 C ATOM 616 C VAL A 41 -7.421 2.536 2.175 1.00 0.00 C ATOM 617 O VAL A 41 -7.169 3.335 3.056 1.00 0.00 O ATOM 618 CB VAL A 41 -8.262 0.215 2.559 1.00 0.00 C ATOM 619 CG1 VAL A 41 -8.972 0.719 3.817 1.00 0.00 C ATOM 620 CG2 VAL A 41 -9.212 0.321 1.362 1.00 0.00 C ATOM 0 H VAL A 41 -6.328 1.348 4.296 1.00 0.00 H new ATOM 0 HA VAL A 41 -6.546 0.741 1.368 1.00 0.00 H new ATOM 0 HB VAL A 41 -7.967 -0.825 2.702 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -9.858 0.112 4.002 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -8.297 0.646 4.670 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -9.267 1.759 3.676 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -10.100 -0.284 1.547 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -9.505 1.361 1.221 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -8.709 -0.039 0.465 1.00 0.00 H new ATOM 630 N ILE A 42 -8.042 2.899 1.087 1.00 0.00 N ATOM 631 CA ILE A 42 -8.462 4.315 0.901 1.00 0.00 C ATOM 632 C ILE A 42 -9.935 4.361 0.489 1.00 0.00 C ATOM 633 O ILE A 42 -10.274 4.163 -0.661 1.00 0.00 O ATOM 634 CB ILE A 42 -7.610 4.955 -0.197 1.00 0.00 C ATOM 635 CG1 ILE A 42 -6.138 4.593 0.021 1.00 0.00 C ATOM 636 CG2 ILE A 42 -7.778 6.476 -0.155 1.00 0.00 C ATOM 637 CD1 ILE A 42 -5.574 5.402 1.192 1.00 0.00 C ATOM 0 H ILE A 42 -8.277 2.273 0.317 1.00 0.00 H new ATOM 0 HA ILE A 42 -8.328 4.860 1.835 1.00 0.00 H new ATOM 0 HB ILE A 42 -7.933 4.584 -1.170 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -6.042 3.526 0.224 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -5.566 4.798 -0.884 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -7.171 6.931 -0.938 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -8.826 6.731 -0.315 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -7.457 6.851 0.817 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -4.527 5.141 1.343 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -5.655 6.466 0.971 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -6.139 5.175 2.096 1.00 0.00 H new ATOM 649 N GLU A 43 -10.813 4.621 1.419 1.00 0.00 N ATOM 650 CA GLU A 43 -12.263 4.679 1.078 1.00 0.00 C ATOM 651 C GLU A 43 -12.570 6.016 0.400 1.00 0.00 C ATOM 652 O GLU A 43 -12.266 7.071 0.920 1.00 0.00 O ATOM 653 CB GLU A 43 -13.091 4.552 2.357 1.00 0.00 C ATOM 654 CG GLU A 43 -14.554 4.281 1.997 1.00 0.00 C ATOM 655 CD GLU A 43 -15.395 4.250 3.275 1.00 0.00 C ATOM 656 OE1 GLU A 43 -15.840 5.306 3.693 1.00 0.00 O ATOM 657 OE2 GLU A 43 -15.579 3.171 3.812 1.00 0.00 O ATOM 0 H GLU A 43 -10.590 4.796 2.399 1.00 0.00 H new ATOM 0 HA GLU A 43 -12.514 3.862 0.402 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -12.702 3.743 2.975 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -13.014 5.467 2.944 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -14.924 5.055 1.324 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -14.640 3.331 1.469 1.00 0.00 H new ATOM 664 N ASN A 44 -13.169 5.981 -0.760 1.00 0.00 N ATOM 665 CA ASN A 44 -13.490 7.252 -1.470 1.00 0.00 C ATOM 666 C ASN A 44 -14.977 7.276 -1.836 1.00 0.00 C ATOM 667 O ASN A 44 -15.341 6.995 -2.961 1.00 0.00 O ATOM 668 CB ASN A 44 -12.649 7.350 -2.745 1.00 0.00 C ATOM 669 CG ASN A 44 -11.447 8.263 -2.495 1.00 0.00 C ATOM 670 OD1 ASN A 44 -10.597 7.958 -1.682 1.00 0.00 O ATOM 671 ND2 ASN A 44 -11.340 9.378 -3.164 1.00 0.00 N ATOM 0 H ASN A 44 -13.449 5.129 -1.246 1.00 0.00 H new ATOM 0 HA ASN A 44 -13.265 8.097 -0.819 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -12.310 6.359 -3.047 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -13.253 7.743 -3.563 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -10.543 9.994 -3.005 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -12.054 9.634 -3.846 1.00 0.00 H new ATOM 678 N PRO A 45 -15.794 7.615 -0.871 1.00 0.00 N ATOM 679 CA PRO A 45 -17.254 7.693 -1.055 1.00 0.00 C ATOM 680 C PRO A 45 -17.631 8.988 -1.780 1.00 0.00 C ATOM 681 O PRO A 45 -17.909 9.998 -1.163 1.00 0.00 O ATOM 682 CB PRO A 45 -17.796 7.691 0.377 1.00 0.00 C ATOM 683 CG PRO A 45 -16.640 8.182 1.281 1.00 0.00 C ATOM 684 CD PRO A 45 -15.336 7.954 0.493 1.00 0.00 C ATOM 0 HA PRO A 45 -17.656 6.879 -1.658 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -18.663 8.346 0.465 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -18.120 6.692 0.669 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -16.763 9.236 1.529 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -16.625 7.633 2.222 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -14.709 8.846 0.493 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -14.744 7.148 0.927 1.00 0.00 H new ATOM 692 N SER A 46 -17.643 8.969 -3.085 1.00 0.00 N ATOM 693 CA SER A 46 -18.002 10.200 -3.844 1.00 0.00 C ATOM 694 C SER A 46 -18.019 9.890 -5.342 1.00 0.00 C ATOM 695 O SER A 46 -19.002 10.112 -6.021 1.00 0.00 O ATOM 696 CB SER A 46 -16.968 11.290 -3.561 1.00 0.00 C ATOM 697 OG SER A 46 -15.682 10.695 -3.443 1.00 0.00 O ATOM 0 H SER A 46 -17.420 8.155 -3.658 1.00 0.00 H new ATOM 0 HA SER A 46 -18.989 10.544 -3.534 1.00 0.00 H new ATOM 0 HB2 SER A 46 -16.969 12.026 -4.365 1.00 0.00 H new ATOM 0 HB3 SER A 46 -17.222 11.820 -2.643 1.00 0.00 H new ATOM 0 HG SER A 46 -15.015 11.390 -3.263 1.00 0.00 H new ATOM 703 N ALA A 47 -16.938 9.380 -5.865 1.00 0.00 N ATOM 704 CA ALA A 47 -16.894 9.056 -7.318 1.00 0.00 C ATOM 705 C ALA A 47 -18.128 8.234 -7.692 1.00 0.00 C ATOM 706 O ALA A 47 -18.696 8.397 -8.754 1.00 0.00 O ATOM 707 CB ALA A 47 -15.630 8.250 -7.624 1.00 0.00 C ATOM 0 H ALA A 47 -16.083 9.174 -5.348 1.00 0.00 H new ATOM 0 HA ALA A 47 -16.883 9.979 -7.897 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -15.598 8.013 -8.687 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -14.751 8.836 -7.356 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -15.639 7.326 -7.046 1.00 0.00 H new ATOM 713 N SER A 48 -18.550 7.354 -6.827 1.00 0.00 N ATOM 714 CA SER A 48 -19.749 6.524 -7.131 1.00 0.00 C ATOM 715 C SER A 48 -20.879 6.893 -6.167 1.00 0.00 C ATOM 716 O SER A 48 -21.510 6.038 -5.579 1.00 0.00 O ATOM 717 CB SER A 48 -19.401 5.044 -6.967 1.00 0.00 C ATOM 718 OG SER A 48 -20.029 4.297 -8.002 1.00 0.00 O ATOM 0 H SER A 48 -18.116 7.174 -5.922 1.00 0.00 H new ATOM 0 HA SER A 48 -20.069 6.709 -8.156 1.00 0.00 H new ATOM 0 HB2 SER A 48 -18.321 4.906 -7.007 1.00 0.00 H new ATOM 0 HB3 SER A 48 -19.732 4.686 -5.992 1.00 0.00 H new ATOM 0 HG SER A 48 -19.807 3.348 -7.901 1.00 0.00 H new ATOM 724 N ALA A 49 -21.137 8.162 -6.000 1.00 0.00 N ATOM 725 CA ALA A 49 -22.225 8.584 -5.073 1.00 0.00 C ATOM 726 C ALA A 49 -22.869 9.871 -5.593 1.00 0.00 C ATOM 727 O ALA A 49 -24.078 9.994 -5.649 1.00 0.00 O ATOM 728 CB ALA A 49 -21.640 8.835 -3.682 1.00 0.00 C ATOM 0 H ALA A 49 -20.642 8.923 -6.465 1.00 0.00 H new ATOM 0 HA ALA A 49 -22.978 7.798 -5.016 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -22.435 9.144 -3.003 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -21.180 7.919 -3.310 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -20.887 9.621 -3.740 1.00 0.00 H new ATOM 734 N SER A 50 -22.073 10.833 -5.974 1.00 0.00 N ATOM 735 CA SER A 50 -22.641 12.111 -6.489 1.00 0.00 C ATOM 736 C SER A 50 -21.876 12.541 -7.741 1.00 0.00 C ATOM 737 O SER A 50 -21.828 13.705 -8.083 1.00 0.00 O ATOM 738 CB SER A 50 -22.513 13.193 -5.418 1.00 0.00 C ATOM 739 OG SER A 50 -23.793 13.450 -4.855 1.00 0.00 O ATOM 0 H SER A 50 -21.054 10.789 -5.951 1.00 0.00 H new ATOM 0 HA SER A 50 -23.693 11.967 -6.737 1.00 0.00 H new ATOM 0 HB2 SER A 50 -21.819 12.872 -4.641 1.00 0.00 H new ATOM 0 HB3 SER A 50 -22.104 14.105 -5.853 1.00 0.00 H new ATOM 0 HG SER A 50 -23.714 14.143 -4.166 1.00 0.00 H new ATOM 745 N GLY A 51 -21.276 11.608 -8.429 1.00 0.00 N ATOM 746 CA GLY A 51 -20.514 11.963 -9.660 1.00 0.00 C ATOM 747 C GLY A 51 -19.171 12.580 -9.266 1.00 0.00 C ATOM 748 O GLY A 51 -18.618 13.394 -9.980 1.00 0.00 O ATOM 0 H GLY A 51 -21.281 10.616 -8.192 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -20.353 11.074 -10.270 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -21.086 12.666 -10.265 1.00 0.00 H new ATOM 752 N GLY A 52 -18.641 12.200 -8.137 1.00 0.00 N ATOM 753 CA GLY A 52 -17.333 12.766 -7.699 1.00 0.00 C ATOM 754 C GLY A 52 -16.269 12.480 -8.760 1.00 0.00 C ATOM 755 O GLY A 52 -16.565 11.996 -9.835 1.00 0.00 O ATOM 0 H GLY A 52 -19.056 11.522 -7.498 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -17.425 13.841 -7.542 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -17.037 12.329 -6.746 1.00 0.00 H new ATOM 759 N ALA A 53 -15.033 12.774 -8.468 1.00 0.00 N ATOM 760 CA ALA A 53 -13.951 12.518 -9.459 1.00 0.00 C ATOM 761 C ALA A 53 -13.262 11.192 -9.131 1.00 0.00 C ATOM 762 O ALA A 53 -12.661 11.035 -8.087 1.00 0.00 O ATOM 763 CB ALA A 53 -12.926 13.653 -9.400 1.00 0.00 C ATOM 0 H ALA A 53 -14.725 13.181 -7.585 1.00 0.00 H new ATOM 0 HA ALA A 53 -14.380 12.467 -10.460 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -12.134 13.466 -10.125 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -13.416 14.598 -9.633 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -12.497 13.704 -8.399 1.00 0.00 H new ATOM 769 N GLY A 54 -13.345 10.235 -10.015 1.00 0.00 N ATOM 770 CA GLY A 54 -12.695 8.920 -9.754 1.00 0.00 C ATOM 771 C GLY A 54 -11.522 8.730 -10.716 1.00 0.00 C ATOM 772 O GLY A 54 -10.483 8.220 -10.350 1.00 0.00 O ATOM 0 H GLY A 54 -13.835 10.307 -10.907 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -12.344 8.874 -8.723 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -13.417 8.114 -9.881 1.00 0.00 H new ATOM 776 N ILE A 55 -11.680 9.137 -11.945 1.00 0.00 N ATOM 777 CA ILE A 55 -10.573 8.979 -12.929 1.00 0.00 C ATOM 778 C ILE A 55 -9.510 10.050 -12.678 1.00 0.00 C ATOM 779 O ILE A 55 -8.341 9.854 -12.947 1.00 0.00 O ATOM 780 CB ILE A 55 -11.127 9.131 -14.346 1.00 0.00 C ATOM 781 CG1 ILE A 55 -12.155 8.028 -14.613 1.00 0.00 C ATOM 782 CG2 ILE A 55 -9.985 9.017 -15.357 1.00 0.00 C ATOM 783 CD1 ILE A 55 -11.534 6.665 -14.305 1.00 0.00 C ATOM 0 H ILE A 55 -12.527 9.572 -12.310 1.00 0.00 H new ATOM 0 HA ILE A 55 -10.125 7.991 -12.818 1.00 0.00 H new ATOM 0 HB ILE A 55 -11.604 10.106 -14.446 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -13.040 8.184 -13.996 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -12.481 8.064 -15.652 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -10.381 9.125 -16.367 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -9.252 9.802 -15.168 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -9.507 8.043 -15.257 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -12.266 5.880 -14.495 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -10.663 6.510 -14.941 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -11.230 6.632 -13.259 1.00 0.00 H new ATOM 795 N ARG A 56 -9.904 11.182 -12.162 1.00 0.00 N ATOM 796 CA ARG A 56 -8.916 12.265 -11.895 1.00 0.00 C ATOM 797 C ARG A 56 -8.118 11.932 -10.631 1.00 0.00 C ATOM 798 O ARG A 56 -6.949 12.245 -10.523 1.00 0.00 O ATOM 799 CB ARG A 56 -9.654 13.591 -11.695 1.00 0.00 C ATOM 800 CG ARG A 56 -10.013 14.186 -13.058 1.00 0.00 C ATOM 801 CD ARG A 56 -8.868 15.077 -13.544 1.00 0.00 C ATOM 802 NE ARG A 56 -8.994 16.428 -12.929 1.00 0.00 N ATOM 803 CZ ARG A 56 -8.019 16.909 -12.207 1.00 0.00 C ATOM 804 NH1 ARG A 56 -7.041 17.556 -12.780 1.00 0.00 N ATOM 805 NH2 ARG A 56 -8.022 16.745 -10.913 1.00 0.00 N ATOM 0 H ARG A 56 -10.868 11.404 -11.914 1.00 0.00 H new ATOM 0 HA ARG A 56 -8.235 12.350 -12.742 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -10.558 13.431 -11.107 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -9.028 14.287 -11.136 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -10.198 13.388 -13.778 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -10.933 14.766 -12.982 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -7.909 14.633 -13.278 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -8.891 15.157 -14.631 1.00 0.00 H new ATOM 0 HE ARG A 56 -9.842 16.977 -13.072 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -7.039 17.686 -13.792 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -6.279 17.932 -12.216 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -8.787 16.240 -10.465 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -7.260 17.121 -10.349 1.00 0.00 H new ATOM 819 N THR A 57 -8.741 11.300 -9.674 1.00 0.00 N ATOM 820 CA THR A 57 -8.019 10.951 -8.417 1.00 0.00 C ATOM 821 C THR A 57 -6.687 10.277 -8.756 1.00 0.00 C ATOM 822 O THR A 57 -5.762 10.283 -7.971 1.00 0.00 O ATOM 823 CB THR A 57 -8.877 9.989 -7.592 1.00 0.00 C ATOM 824 OG1 THR A 57 -8.289 9.814 -6.310 1.00 0.00 O ATOM 825 CG2 THR A 57 -8.963 8.639 -8.306 1.00 0.00 C ATOM 0 H THR A 57 -9.718 11.010 -9.708 1.00 0.00 H new ATOM 0 HA THR A 57 -7.829 11.859 -7.845 1.00 0.00 H new ATOM 0 HB THR A 57 -9.880 10.401 -7.479 1.00 0.00 H new ATOM 0 HG1 THR A 57 -8.838 9.199 -5.780 1.00 0.00 H new ATOM 0 HG21 THR A 57 -9.574 7.955 -7.718 1.00 0.00 H new ATOM 0 HG22 THR A 57 -9.414 8.775 -9.289 1.00 0.00 H new ATOM 0 HG23 THR A 57 -7.962 8.224 -8.421 1.00 0.00 H new ATOM 833 N ALA A 58 -6.585 9.693 -9.919 1.00 0.00 N ATOM 834 CA ALA A 58 -5.315 9.016 -10.305 1.00 0.00 C ATOM 835 C ALA A 58 -4.121 9.910 -9.957 1.00 0.00 C ATOM 836 O ALA A 58 -3.148 9.466 -9.380 1.00 0.00 O ATOM 837 CB ALA A 58 -5.323 8.742 -11.811 1.00 0.00 C ATOM 0 H ALA A 58 -7.327 9.656 -10.618 1.00 0.00 H new ATOM 0 HA ALA A 58 -5.230 8.076 -9.760 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -4.395 8.247 -12.096 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -6.168 8.100 -12.059 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -5.412 9.684 -12.352 1.00 0.00 H new ATOM 843 N GLN A 59 -4.184 11.164 -10.308 1.00 0.00 N ATOM 844 CA GLN A 59 -3.051 12.084 -10.004 1.00 0.00 C ATOM 845 C GLN A 59 -2.719 12.027 -8.510 1.00 0.00 C ATOM 846 O GLN A 59 -1.574 11.896 -8.123 1.00 0.00 O ATOM 847 CB GLN A 59 -3.444 13.515 -10.379 1.00 0.00 C ATOM 848 CG GLN A 59 -2.182 14.353 -10.596 1.00 0.00 C ATOM 849 CD GLN A 59 -1.880 15.159 -9.331 1.00 0.00 C ATOM 850 OE1 GLN A 59 -2.153 14.715 -8.233 1.00 0.00 O ATOM 851 NE2 GLN A 59 -1.322 16.333 -9.439 1.00 0.00 N ATOM 0 H GLN A 59 -4.972 11.593 -10.793 1.00 0.00 H new ATOM 0 HA GLN A 59 -2.177 11.778 -10.579 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -4.050 13.511 -11.285 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -4.053 13.954 -9.589 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -1.339 13.705 -10.837 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -2.320 15.024 -11.443 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -1.093 16.706 -10.360 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -1.115 16.878 -8.602 1.00 0.00 H new ATOM 860 N ILE A 60 -3.709 12.132 -7.668 1.00 0.00 N ATOM 861 CA ILE A 60 -3.452 12.093 -6.200 1.00 0.00 C ATOM 862 C ILE A 60 -2.817 10.755 -5.812 1.00 0.00 C ATOM 863 O ILE A 60 -1.971 10.690 -4.944 1.00 0.00 O ATOM 864 CB ILE A 60 -4.776 12.257 -5.452 1.00 0.00 C ATOM 865 CG1 ILE A 60 -5.344 13.653 -5.719 1.00 0.00 C ATOM 866 CG2 ILE A 60 -4.540 12.083 -3.951 1.00 0.00 C ATOM 867 CD1 ILE A 60 -6.820 13.689 -5.320 1.00 0.00 C ATOM 0 H ILE A 60 -4.688 12.243 -7.933 1.00 0.00 H new ATOM 0 HA ILE A 60 -2.771 12.902 -5.935 1.00 0.00 H new ATOM 0 HB ILE A 60 -5.483 11.504 -5.799 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -4.785 14.399 -5.153 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -5.235 13.906 -6.774 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -5.484 12.200 -3.418 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -4.136 11.089 -3.759 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -3.832 12.836 -3.604 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -7.224 14.683 -5.510 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -7.373 12.954 -5.905 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -6.916 13.455 -4.260 1.00 0.00 H new ATOM 879 N ILE A 61 -3.224 9.688 -6.441 1.00 0.00 N ATOM 880 CA ILE A 61 -2.648 8.355 -6.099 1.00 0.00 C ATOM 881 C ILE A 61 -1.150 8.339 -6.408 1.00 0.00 C ATOM 882 O ILE A 61 -0.360 7.802 -5.658 1.00 0.00 O ATOM 883 CB ILE A 61 -3.348 7.273 -6.923 1.00 0.00 C ATOM 884 CG1 ILE A 61 -4.847 7.288 -6.615 1.00 0.00 C ATOM 885 CG2 ILE A 61 -2.770 5.904 -6.561 1.00 0.00 C ATOM 886 CD1 ILE A 61 -5.525 6.114 -7.323 1.00 0.00 C ATOM 0 H ILE A 61 -3.930 9.680 -7.177 1.00 0.00 H new ATOM 0 HA ILE A 61 -2.797 8.163 -5.036 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.192 7.466 -7.984 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.009 7.220 -5.539 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -5.287 8.229 -6.945 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.268 5.132 -7.148 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.702 5.891 -6.777 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -2.928 5.712 -5.500 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -6.593 6.124 -7.104 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -5.375 6.202 -8.399 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -5.092 5.178 -6.971 1.00 0.00 H new ATOM 898 N ALA A 62 -0.751 8.915 -7.509 1.00 0.00 N ATOM 899 CA ALA A 62 0.698 8.921 -7.862 1.00 0.00 C ATOM 900 C ALA A 62 1.455 9.866 -6.927 1.00 0.00 C ATOM 901 O ALA A 62 2.625 9.681 -6.658 1.00 0.00 O ATOM 902 CB ALA A 62 0.867 9.391 -9.307 1.00 0.00 C ATOM 0 H ALA A 62 -1.364 9.381 -8.178 1.00 0.00 H new ATOM 0 HA ALA A 62 1.099 7.913 -7.756 1.00 0.00 H new ATOM 0 HB1 ALA A 62 1.926 9.396 -9.567 1.00 0.00 H new ATOM 0 HB2 ALA A 62 0.333 8.715 -9.974 1.00 0.00 H new ATOM 0 HB3 ALA A 62 0.463 10.398 -9.412 1.00 0.00 H new ATOM 908 N ASN A 63 0.800 10.880 -6.433 1.00 0.00 N ATOM 909 CA ASN A 63 1.488 11.836 -5.520 1.00 0.00 C ATOM 910 C ASN A 63 1.618 11.223 -4.124 1.00 0.00 C ATOM 911 O ASN A 63 2.080 11.861 -3.198 1.00 0.00 O ATOM 912 CB ASN A 63 0.676 13.131 -5.435 1.00 0.00 C ATOM 913 CG ASN A 63 1.439 14.256 -6.136 1.00 0.00 C ATOM 914 OD1 ASN A 63 2.150 15.010 -5.501 1.00 0.00 O ATOM 915 ND2 ASN A 63 1.320 14.404 -7.427 1.00 0.00 N ATOM 0 H ASN A 63 -0.181 11.088 -6.622 1.00 0.00 H new ATOM 0 HA ASN A 63 2.483 12.051 -5.910 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -0.300 12.993 -5.901 1.00 0.00 H new ATOM 0 HB3 ASN A 63 0.497 13.393 -4.392 1.00 0.00 H new ATOM 0 HD21 ASN A 63 1.824 15.152 -7.903 1.00 0.00 H new ATOM 0 HD22 ASN A 63 0.723 13.771 -7.960 1.00 0.00 H new ATOM 922 N ASN A 64 1.218 9.991 -3.959 1.00 0.00 N ATOM 923 CA ASN A 64 1.324 9.350 -2.618 1.00 0.00 C ATOM 924 C ASN A 64 2.464 8.329 -2.624 1.00 0.00 C ATOM 925 O ASN A 64 2.707 7.652 -1.644 1.00 0.00 O ATOM 926 CB ASN A 64 0.009 8.644 -2.282 1.00 0.00 C ATOM 927 CG ASN A 64 -0.625 9.304 -1.056 1.00 0.00 C ATOM 928 OD1 ASN A 64 -0.898 8.648 -0.072 1.00 0.00 O ATOM 929 ND2 ASN A 64 -0.872 10.585 -1.075 1.00 0.00 N ATOM 0 H ASN A 64 0.824 9.403 -4.693 1.00 0.00 H new ATOM 0 HA ASN A 64 1.527 10.115 -1.869 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -0.673 8.698 -3.131 1.00 0.00 H new ATOM 0 HB3 ASN A 64 0.191 7.587 -2.086 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -1.294 11.035 -0.263 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -0.643 11.136 -1.902 1.00 0.00 H new ATOM 936 N GLY A 65 3.169 8.212 -3.715 1.00 0.00 N ATOM 937 CA GLY A 65 4.292 7.234 -3.775 1.00 0.00 C ATOM 938 C GLY A 65 3.828 5.959 -4.480 1.00 0.00 C ATOM 939 O GLY A 65 4.620 5.105 -4.823 1.00 0.00 O ATOM 0 H GLY A 65 3.016 8.751 -4.567 1.00 0.00 H new ATOM 0 HA2 GLY A 65 5.137 7.669 -4.308 1.00 0.00 H new ATOM 0 HA3 GLY A 65 4.637 6.999 -2.768 1.00 0.00 H new ATOM 943 N VAL A 66 2.548 5.823 -4.699 1.00 0.00 N ATOM 944 CA VAL A 66 2.037 4.602 -5.383 1.00 0.00 C ATOM 945 C VAL A 66 2.611 4.528 -6.796 1.00 0.00 C ATOM 946 O VAL A 66 2.017 5.003 -7.745 1.00 0.00 O ATOM 947 CB VAL A 66 0.509 4.655 -5.454 1.00 0.00 C ATOM 948 CG1 VAL A 66 -0.012 3.412 -6.177 1.00 0.00 C ATOM 949 CG2 VAL A 66 -0.067 4.697 -4.037 1.00 0.00 C ATOM 0 H VAL A 66 1.836 6.503 -4.434 1.00 0.00 H new ATOM 0 HA VAL A 66 2.343 3.719 -4.821 1.00 0.00 H new ATOM 0 HB VAL A 66 0.203 5.548 -5.998 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.100 3.450 -6.228 1.00 0.00 H new ATOM 0 HG12 VAL A 66 0.397 3.380 -7.187 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.295 2.519 -5.633 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.155 4.735 -4.088 1.00 0.00 H new ATOM 0 HG22 VAL A 66 0.240 3.804 -3.493 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.303 5.582 -3.520 1.00 0.00 H new ATOM 959 N LYS A 67 3.758 3.927 -6.947 1.00 0.00 N ATOM 960 CA LYS A 67 4.365 3.811 -8.300 1.00 0.00 C ATOM 961 C LYS A 67 3.691 2.661 -9.051 1.00 0.00 C ATOM 962 O LYS A 67 3.982 2.402 -10.202 1.00 0.00 O ATOM 963 CB LYS A 67 5.864 3.527 -8.166 1.00 0.00 C ATOM 964 CG LYS A 67 6.632 4.309 -9.234 1.00 0.00 C ATOM 965 CD LYS A 67 7.608 3.372 -9.949 1.00 0.00 C ATOM 966 CE LYS A 67 9.021 3.956 -9.883 1.00 0.00 C ATOM 967 NZ LYS A 67 9.664 3.555 -8.600 1.00 0.00 N ATOM 0 H LYS A 67 4.301 3.511 -6.190 1.00 0.00 H new ATOM 0 HA LYS A 67 4.224 4.742 -8.849 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.211 3.812 -7.173 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.053 2.459 -8.276 1.00 0.00 H new ATOM 0 HG2 LYS A 67 5.937 4.744 -9.952 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.175 5.135 -8.775 1.00 0.00 H new ATOM 0 HD2 LYS A 67 7.589 2.386 -9.484 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.306 3.240 -10.988 1.00 0.00 H new ATOM 0 HE2 LYS A 67 9.613 3.600 -10.726 1.00 0.00 H new ATOM 0 HE3 LYS A 67 8.981 5.043 -9.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 10.624 3.951 -8.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 9.102 3.916 -7.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.715 2.518 -8.547 1.00 0.00 H new ATOM 981 N ALA A 68 2.788 1.970 -8.406 1.00 0.00 N ATOM 982 CA ALA A 68 2.091 0.839 -9.080 1.00 0.00 C ATOM 983 C ALA A 68 0.580 1.023 -8.936 1.00 0.00 C ATOM 984 O ALA A 68 0.070 1.211 -7.848 1.00 0.00 O ATOM 985 CB ALA A 68 2.511 -0.479 -8.428 1.00 0.00 C ATOM 0 H ALA A 68 2.504 2.141 -7.441 1.00 0.00 H new ATOM 0 HA ALA A 68 2.358 0.820 -10.137 1.00 0.00 H new ATOM 0 HB1 ALA A 68 2.001 -1.307 -8.921 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.589 -0.606 -8.526 1.00 0.00 H new ATOM 0 HB3 ALA A 68 2.242 -0.464 -7.372 1.00 0.00 H new ATOM 991 N VAL A 69 -0.142 0.977 -10.021 1.00 0.00 N ATOM 992 CA VAL A 69 -1.619 1.158 -9.936 1.00 0.00 C ATOM 993 C VAL A 69 -2.325 -0.027 -10.599 1.00 0.00 C ATOM 994 O VAL A 69 -2.264 -0.208 -11.798 1.00 0.00 O ATOM 995 CB VAL A 69 -2.015 2.449 -10.652 1.00 0.00 C ATOM 996 CG1 VAL A 69 -3.539 2.548 -10.719 1.00 0.00 C ATOM 997 CG2 VAL A 69 -1.459 3.649 -9.882 1.00 0.00 C ATOM 0 H VAL A 69 0.225 0.822 -10.960 1.00 0.00 H new ATOM 0 HA VAL A 69 -1.915 1.214 -8.888 1.00 0.00 H new ATOM 0 HB VAL A 69 -1.607 2.444 -11.663 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -3.822 3.469 -11.230 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -3.935 1.693 -11.267 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -3.948 2.553 -9.709 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -1.741 4.570 -10.392 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -1.867 3.654 -8.871 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -0.372 3.579 -9.834 1.00 0.00 H new ATOM 1007 N ILE A 70 -3.005 -0.832 -9.827 1.00 0.00 N ATOM 1008 CA ILE A 70 -3.723 -1.998 -10.413 1.00 0.00 C ATOM 1009 C ILE A 70 -5.203 -1.644 -10.579 1.00 0.00 C ATOM 1010 O ILE A 70 -5.866 -1.259 -9.636 1.00 0.00 O ATOM 1011 CB ILE A 70 -3.588 -3.204 -9.481 1.00 0.00 C ATOM 1012 CG1 ILE A 70 -2.151 -3.728 -9.528 1.00 0.00 C ATOM 1013 CG2 ILE A 70 -4.545 -4.308 -9.933 1.00 0.00 C ATOM 1014 CD1 ILE A 70 -1.609 -3.859 -8.104 1.00 0.00 C ATOM 0 H ILE A 70 -3.094 -0.731 -8.816 1.00 0.00 H new ATOM 0 HA ILE A 70 -3.292 -2.243 -11.384 1.00 0.00 H new ATOM 0 HB ILE A 70 -3.833 -2.903 -8.462 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -2.122 -4.695 -10.030 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -1.524 -3.049 -10.106 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -4.449 -5.167 -9.269 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.569 -3.937 -9.901 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -4.300 -4.608 -10.952 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -0.585 -4.232 -8.137 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -1.624 -2.884 -7.618 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.231 -4.555 -7.541 1.00 0.00 H new ATOM 1026 N ALA A 71 -5.726 -1.764 -11.768 1.00 0.00 N ATOM 1027 CA ALA A 71 -7.161 -1.425 -11.984 1.00 0.00 C ATOM 1028 C ALA A 71 -7.673 -2.122 -13.246 1.00 0.00 C ATOM 1029 O ALA A 71 -6.920 -2.725 -13.985 1.00 0.00 O ATOM 1030 CB ALA A 71 -7.307 0.089 -12.144 1.00 0.00 C ATOM 0 H ALA A 71 -5.224 -2.081 -12.597 1.00 0.00 H new ATOM 0 HA ALA A 71 -7.744 -1.761 -11.126 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -8.356 0.339 -12.302 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -6.947 0.586 -11.243 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -6.722 0.422 -13.001 1.00 0.00 H new ATOM 1036 N SER A 72 -8.951 -2.043 -13.496 1.00 0.00 N ATOM 1037 CA SER A 72 -9.517 -2.699 -14.709 1.00 0.00 C ATOM 1038 C SER A 72 -10.389 -1.699 -15.471 1.00 0.00 C ATOM 1039 O SER A 72 -11.511 -1.990 -15.834 1.00 0.00 O ATOM 1040 CB SER A 72 -10.367 -3.898 -14.290 1.00 0.00 C ATOM 1041 OG SER A 72 -10.267 -4.077 -12.884 1.00 0.00 O ATOM 0 H SER A 72 -9.628 -1.552 -12.912 1.00 0.00 H new ATOM 0 HA SER A 72 -8.704 -3.036 -15.352 1.00 0.00 H new ATOM 0 HB2 SER A 72 -11.407 -3.738 -14.575 1.00 0.00 H new ATOM 0 HB3 SER A 72 -10.029 -4.796 -14.807 1.00 0.00 H new ATOM 0 HG SER A 72 -10.813 -4.844 -12.612 1.00 0.00 H new ATOM 1047 N SER A 73 -9.883 -0.520 -15.716 1.00 0.00 N ATOM 1048 CA SER A 73 -10.687 0.495 -16.455 1.00 0.00 C ATOM 1049 C SER A 73 -11.029 -0.043 -17.850 1.00 0.00 C ATOM 1050 O SER A 73 -10.382 -0.947 -18.339 1.00 0.00 O ATOM 1051 CB SER A 73 -9.881 1.791 -16.582 1.00 0.00 C ATOM 1052 OG SER A 73 -9.454 1.959 -17.928 1.00 0.00 O ATOM 0 H SER A 73 -8.950 -0.217 -15.437 1.00 0.00 H new ATOM 0 HA SER A 73 -11.610 0.698 -15.911 1.00 0.00 H new ATOM 0 HB2 SER A 73 -10.490 2.641 -16.275 1.00 0.00 H new ATOM 0 HB3 SER A 73 -9.018 1.760 -15.917 1.00 0.00 H new ATOM 0 HG SER A 73 -10.072 2.560 -18.395 1.00 0.00 H new ATOM 1058 N PRO A 74 -12.040 0.535 -18.447 1.00 0.00 N ATOM 1059 CA PRO A 74 -12.499 0.140 -19.790 1.00 0.00 C ATOM 1060 C PRO A 74 -11.573 0.724 -20.861 1.00 0.00 C ATOM 1061 O PRO A 74 -10.598 0.113 -21.251 1.00 0.00 O ATOM 1062 CB PRO A 74 -13.900 0.750 -19.883 1.00 0.00 C ATOM 1063 CG PRO A 74 -13.942 1.908 -18.857 1.00 0.00 C ATOM 1064 CD PRO A 74 -12.817 1.635 -17.841 1.00 0.00 C ATOM 0 HA PRO A 74 -12.500 -0.939 -19.946 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -14.098 1.116 -20.890 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -14.664 0.005 -19.659 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -13.794 2.869 -19.350 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -14.911 1.951 -18.360 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -12.199 2.519 -17.684 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -13.219 1.350 -16.869 1.00 0.00 H new ATOM 1072 N GLY A 75 -11.866 1.904 -21.336 1.00 0.00 N ATOM 1073 CA GLY A 75 -10.998 2.523 -22.376 1.00 0.00 C ATOM 1074 C GLY A 75 -9.612 2.791 -21.786 1.00 0.00 C ATOM 1075 O GLY A 75 -9.445 2.797 -20.582 1.00 0.00 O ATOM 0 H GLY A 75 -12.668 2.465 -21.049 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -10.917 1.862 -23.239 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -11.442 3.454 -22.729 1.00 0.00 H new ATOM 1079 N PRO A 76 -8.655 3.004 -22.653 1.00 0.00 N ATOM 1080 CA PRO A 76 -7.263 3.277 -22.255 1.00 0.00 C ATOM 1081 C PRO A 76 -7.082 4.745 -21.842 1.00 0.00 C ATOM 1082 O PRO A 76 -6.008 5.299 -21.962 1.00 0.00 O ATOM 1083 CB PRO A 76 -6.465 2.976 -23.526 1.00 0.00 C ATOM 1084 CG PRO A 76 -7.457 3.111 -24.707 1.00 0.00 C ATOM 1085 CD PRO A 76 -8.873 2.984 -24.114 1.00 0.00 C ATOM 0 HA PRO A 76 -6.947 2.684 -21.396 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -5.633 3.672 -23.636 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -6.039 1.973 -23.489 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -7.333 4.071 -25.209 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -7.279 2.336 -25.452 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -9.514 3.806 -24.433 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -9.357 2.061 -24.432 1.00 0.00 H new ATOM 1093 N ASN A 77 -8.116 5.383 -21.358 1.00 0.00 N ATOM 1094 CA ASN A 77 -7.981 6.808 -20.945 1.00 0.00 C ATOM 1095 C ASN A 77 -7.261 6.881 -19.597 1.00 0.00 C ATOM 1096 O ASN A 77 -6.210 7.478 -19.476 1.00 0.00 O ATOM 1097 CB ASN A 77 -9.370 7.437 -20.816 1.00 0.00 C ATOM 1098 CG ASN A 77 -9.523 8.553 -21.852 1.00 0.00 C ATOM 1099 OD1 ASN A 77 -8.942 8.494 -22.917 1.00 0.00 O ATOM 1100 ND2 ASN A 77 -10.288 9.576 -21.583 1.00 0.00 N ATOM 0 H ASN A 77 -9.044 4.979 -21.232 1.00 0.00 H new ATOM 0 HA ASN A 77 -7.406 7.351 -21.695 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -10.139 6.679 -20.966 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -9.508 7.837 -19.812 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -10.397 10.325 -22.267 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -10.776 9.626 -20.689 1.00 0.00 H new ATOM 1107 N ALA A 78 -7.817 6.276 -18.583 1.00 0.00 N ATOM 1108 CA ALA A 78 -7.161 6.312 -17.245 1.00 0.00 C ATOM 1109 C ALA A 78 -5.732 5.776 -17.365 1.00 0.00 C ATOM 1110 O ALA A 78 -4.802 6.329 -16.811 1.00 0.00 O ATOM 1111 CB ALA A 78 -7.951 5.443 -16.266 1.00 0.00 C ATOM 0 H ALA A 78 -8.696 5.759 -18.623 1.00 0.00 H new ATOM 0 HA ALA A 78 -7.136 7.339 -16.879 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -7.471 5.469 -15.288 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.969 5.823 -16.181 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -7.977 4.416 -16.630 1.00 0.00 H new ATOM 1117 N PHE A 79 -5.550 4.702 -18.086 1.00 0.00 N ATOM 1118 CA PHE A 79 -4.183 4.133 -18.241 1.00 0.00 C ATOM 1119 C PHE A 79 -3.269 5.171 -18.894 1.00 0.00 C ATOM 1120 O PHE A 79 -2.182 5.438 -18.423 1.00 0.00 O ATOM 1121 CB PHE A 79 -4.249 2.883 -19.120 1.00 0.00 C ATOM 1122 CG PHE A 79 -4.616 1.689 -18.272 1.00 0.00 C ATOM 1123 CD1 PHE A 79 -5.413 1.858 -17.132 1.00 0.00 C ATOM 1124 CD2 PHE A 79 -4.160 0.411 -18.624 1.00 0.00 C ATOM 1125 CE1 PHE A 79 -5.755 0.751 -16.344 1.00 0.00 C ATOM 1126 CE2 PHE A 79 -4.501 -0.696 -17.836 1.00 0.00 C ATOM 1127 CZ PHE A 79 -5.298 -0.526 -16.696 1.00 0.00 C ATOM 0 H PHE A 79 -6.289 4.196 -18.573 1.00 0.00 H new ATOM 0 HA PHE A 79 -3.786 3.867 -17.261 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.986 3.021 -19.911 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -3.287 2.716 -19.605 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -5.764 2.843 -16.860 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -3.546 0.280 -19.503 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -6.370 0.882 -15.466 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -4.150 -1.681 -18.107 1.00 0.00 H new ATOM 0 HZ PHE A 79 -5.560 -1.380 -16.088 1.00 0.00 H new ATOM 1137 N GLU A 80 -3.703 5.763 -19.974 1.00 0.00 N ATOM 1138 CA GLU A 80 -2.857 6.786 -20.650 1.00 0.00 C ATOM 1139 C GLU A 80 -2.608 7.951 -19.691 1.00 0.00 C ATOM 1140 O GLU A 80 -1.669 8.707 -19.847 1.00 0.00 O ATOM 1141 CB GLU A 80 -3.577 7.300 -21.900 1.00 0.00 C ATOM 1142 CG GLU A 80 -2.613 7.286 -23.087 1.00 0.00 C ATOM 1143 CD GLU A 80 -2.964 6.122 -24.017 1.00 0.00 C ATOM 1144 OE1 GLU A 80 -4.002 6.191 -24.654 1.00 0.00 O ATOM 1145 OE2 GLU A 80 -2.188 5.182 -24.077 1.00 0.00 O ATOM 0 H GLU A 80 -4.604 5.583 -20.416 1.00 0.00 H new ATOM 0 HA GLU A 80 -1.905 6.339 -20.938 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -4.444 6.676 -22.115 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -3.946 8.311 -21.730 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -2.674 8.230 -23.629 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -1.586 7.187 -22.734 1.00 0.00 H new ATOM 1152 N VAL A 81 -3.440 8.102 -18.697 1.00 0.00 N ATOM 1153 CA VAL A 81 -3.251 9.217 -17.727 1.00 0.00 C ATOM 1154 C VAL A 81 -2.060 8.904 -16.820 1.00 0.00 C ATOM 1155 O VAL A 81 -1.067 9.604 -16.818 1.00 0.00 O ATOM 1156 CB VAL A 81 -4.513 9.372 -16.877 1.00 0.00 C ATOM 1157 CG1 VAL A 81 -4.292 10.462 -15.827 1.00 0.00 C ATOM 1158 CG2 VAL A 81 -5.688 9.763 -17.777 1.00 0.00 C ATOM 0 H VAL A 81 -4.243 7.500 -18.515 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.062 10.144 -18.269 1.00 0.00 H new ATOM 0 HB VAL A 81 -4.733 8.428 -16.379 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -5.192 10.572 -15.222 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -3.455 10.185 -15.186 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -4.072 11.407 -16.324 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -6.588 9.874 -17.172 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -5.467 10.707 -18.275 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -5.847 8.987 -18.526 1.00 0.00 H new ATOM 1168 N LEU A 82 -2.149 7.855 -16.048 1.00 0.00 N ATOM 1169 CA LEU A 82 -1.019 7.500 -15.145 1.00 0.00 C ATOM 1170 C LEU A 82 0.249 7.298 -15.977 1.00 0.00 C ATOM 1171 O LEU A 82 1.351 7.485 -15.501 1.00 0.00 O ATOM 1172 CB LEU A 82 -1.350 6.208 -14.395 1.00 0.00 C ATOM 1173 CG LEU A 82 -2.641 6.398 -13.597 1.00 0.00 C ATOM 1174 CD1 LEU A 82 -3.570 5.207 -13.839 1.00 0.00 C ATOM 1175 CD2 LEU A 82 -2.308 6.489 -12.106 1.00 0.00 C ATOM 0 H LEU A 82 -2.954 7.230 -16.004 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.860 8.304 -14.426 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.464 5.385 -15.100 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -0.532 5.944 -13.725 1.00 0.00 H new ATOM 0 HG LEU A 82 -3.135 7.315 -13.917 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -4.490 5.342 -13.271 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -3.806 5.140 -14.901 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -3.077 4.290 -13.518 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -3.227 6.624 -11.536 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -1.815 5.571 -11.787 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -1.645 7.337 -11.932 1.00 0.00 H new ATOM 1187 N ASN A 83 0.101 6.920 -17.217 1.00 0.00 N ATOM 1188 CA ASN A 83 1.298 6.708 -18.079 1.00 0.00 C ATOM 1189 C ASN A 83 2.059 8.027 -18.222 1.00 0.00 C ATOM 1190 O ASN A 83 3.252 8.095 -18.001 1.00 0.00 O ATOM 1191 CB ASN A 83 0.851 6.223 -19.460 1.00 0.00 C ATOM 1192 CG ASN A 83 1.974 5.409 -20.103 1.00 0.00 C ATOM 1193 OD1 ASN A 83 2.527 5.840 -21.204 1.00 0.00 O flip ATOM 1194 ND2 ASN A 83 2.354 4.372 -19.599 1.00 0.00 N flip ATOM 0 H ASN A 83 -0.797 6.749 -17.670 1.00 0.00 H new ATOM 0 HA ASN A 83 1.948 5.960 -17.625 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -0.048 5.614 -19.370 1.00 0.00 H new ATOM 0 HB3 ASN A 83 0.597 7.074 -20.092 1.00 0.00 H new ATOM 0 HD21 ASN A 83 1.922 4.035 -18.739 1.00 0.00 H new ATOM 0 HD22 ASN A 83 3.105 3.838 -20.036 1.00 0.00 H new ATOM 1201 N GLU A 84 1.377 9.078 -18.590 1.00 0.00 N ATOM 1202 CA GLU A 84 2.060 10.393 -18.747 1.00 0.00 C ATOM 1203 C GLU A 84 2.308 11.004 -17.366 1.00 0.00 C ATOM 1204 O GLU A 84 3.043 11.961 -17.222 1.00 0.00 O ATOM 1205 CB GLU A 84 1.175 11.333 -19.570 1.00 0.00 C ATOM 1206 CG GLU A 84 0.806 10.661 -20.893 1.00 0.00 C ATOM 1207 CD GLU A 84 0.396 11.726 -21.912 1.00 0.00 C ATOM 1208 OE1 GLU A 84 0.255 12.872 -21.517 1.00 0.00 O ATOM 1209 OE2 GLU A 84 0.230 11.378 -23.069 1.00 0.00 O ATOM 0 H GLU A 84 0.377 9.082 -18.789 1.00 0.00 H new ATOM 0 HA GLU A 84 3.012 10.251 -19.259 1.00 0.00 H new ATOM 0 HB2 GLU A 84 0.272 11.581 -19.012 1.00 0.00 H new ATOM 0 HB3 GLU A 84 1.699 12.270 -19.760 1.00 0.00 H new ATOM 0 HG2 GLU A 84 1.653 10.089 -21.271 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -0.011 9.956 -20.739 1.00 0.00 H new ATOM 1216 N LEU A 85 1.701 10.457 -16.347 1.00 0.00 N ATOM 1217 CA LEU A 85 1.903 11.008 -14.976 1.00 0.00 C ATOM 1218 C LEU A 85 3.260 10.546 -14.438 1.00 0.00 C ATOM 1219 O LEU A 85 3.839 11.169 -13.569 1.00 0.00 O ATOM 1220 CB LEU A 85 0.789 10.504 -14.056 1.00 0.00 C ATOM 1221 CG LEU A 85 -0.504 11.263 -14.357 1.00 0.00 C ATOM 1222 CD1 LEU A 85 -1.672 10.593 -13.633 1.00 0.00 C ATOM 1223 CD2 LEU A 85 -0.369 12.709 -13.876 1.00 0.00 C ATOM 0 H LEU A 85 1.075 9.654 -16.405 1.00 0.00 H new ATOM 0 HA LEU A 85 1.878 12.097 -15.012 1.00 0.00 H new ATOM 0 HB2 LEU A 85 0.638 9.435 -14.203 1.00 0.00 H new ATOM 0 HB3 LEU A 85 1.072 10.646 -13.013 1.00 0.00 H new ATOM 0 HG LEU A 85 -0.689 11.251 -15.431 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -2.593 11.135 -13.848 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -1.769 9.563 -13.975 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -1.488 10.603 -12.559 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -1.290 13.251 -14.090 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -0.183 12.719 -12.802 1.00 0.00 H new ATOM 0 HD23 LEU A 85 0.462 13.188 -14.393 1.00 0.00 H new ATOM 1235 N GLY A 86 3.773 9.459 -14.947 1.00 0.00 N ATOM 1236 CA GLY A 86 5.093 8.959 -14.466 1.00 0.00 C ATOM 1237 C GLY A 86 4.878 7.807 -13.484 1.00 0.00 C ATOM 1238 O GLY A 86 5.541 7.709 -12.472 1.00 0.00 O ATOM 0 H GLY A 86 3.335 8.895 -15.675 1.00 0.00 H new ATOM 0 HA2 GLY A 86 5.696 8.623 -15.310 1.00 0.00 H new ATOM 0 HA3 GLY A 86 5.644 9.765 -13.982 1.00 0.00 H new ATOM 1242 N ILE A 87 3.956 6.930 -13.777 1.00 0.00 N ATOM 1243 CA ILE A 87 3.700 5.784 -12.860 1.00 0.00 C ATOM 1244 C ILE A 87 3.505 4.507 -13.680 1.00 0.00 C ATOM 1245 O ILE A 87 3.245 4.554 -14.866 1.00 0.00 O ATOM 1246 CB ILE A 87 2.441 6.063 -12.036 1.00 0.00 C ATOM 1247 CG1 ILE A 87 2.636 7.350 -11.231 1.00 0.00 C ATOM 1248 CG2 ILE A 87 2.188 4.898 -11.079 1.00 0.00 C ATOM 1249 CD1 ILE A 87 2.178 8.547 -12.065 1.00 0.00 C ATOM 0 H ILE A 87 3.370 6.958 -14.611 1.00 0.00 H new ATOM 0 HA ILE A 87 4.550 5.656 -12.190 1.00 0.00 H new ATOM 0 HB ILE A 87 1.587 6.176 -12.704 1.00 0.00 H new ATOM 0 HG12 ILE A 87 2.067 7.301 -10.303 1.00 0.00 H new ATOM 0 HG13 ILE A 87 3.685 7.464 -10.956 1.00 0.00 H new ATOM 0 HG21 ILE A 87 1.291 5.097 -10.492 1.00 0.00 H new ATOM 0 HG22 ILE A 87 2.051 3.980 -11.651 1.00 0.00 H new ATOM 0 HG23 ILE A 87 3.041 4.785 -10.410 1.00 0.00 H new ATOM 0 HD11 ILE A 87 2.317 9.464 -11.492 1.00 0.00 H new ATOM 0 HD12 ILE A 87 2.767 8.599 -12.981 1.00 0.00 H new ATOM 0 HD13 ILE A 87 1.124 8.433 -12.317 1.00 0.00 H new ATOM 1261 N LYS A 88 3.631 3.366 -13.059 1.00 0.00 N ATOM 1262 CA LYS A 88 3.456 2.088 -13.805 1.00 0.00 C ATOM 1263 C LYS A 88 2.002 1.627 -13.700 1.00 0.00 C ATOM 1264 O LYS A 88 1.427 1.588 -12.629 1.00 0.00 O ATOM 1265 CB LYS A 88 4.373 1.019 -13.207 1.00 0.00 C ATOM 1266 CG LYS A 88 5.767 1.609 -12.986 1.00 0.00 C ATOM 1267 CD LYS A 88 6.767 0.922 -13.919 1.00 0.00 C ATOM 1268 CE LYS A 88 8.191 1.307 -13.514 1.00 0.00 C ATOM 1269 NZ LYS A 88 8.821 2.100 -14.607 1.00 0.00 N ATOM 0 H LYS A 88 3.848 3.264 -12.068 1.00 0.00 H new ATOM 0 HA LYS A 88 3.712 2.244 -14.853 1.00 0.00 H new ATOM 0 HB2 LYS A 88 3.964 0.661 -12.262 1.00 0.00 H new ATOM 0 HB3 LYS A 88 4.432 0.160 -13.875 1.00 0.00 H new ATOM 0 HG2 LYS A 88 5.754 2.682 -13.177 1.00 0.00 H new ATOM 0 HG3 LYS A 88 6.070 1.474 -11.948 1.00 0.00 H new ATOM 0 HD2 LYS A 88 6.643 -0.160 -13.869 1.00 0.00 H new ATOM 0 HD3 LYS A 88 6.579 1.217 -14.951 1.00 0.00 H new ATOM 0 HE2 LYS A 88 8.174 1.888 -12.592 1.00 0.00 H new ATOM 0 HE3 LYS A 88 8.779 0.411 -13.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 9.789 2.362 -14.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 8.850 1.530 -15.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 8.264 2.962 -14.776 1.00 0.00 H new ATOM 1283 N ILE A 89 1.401 1.275 -14.805 1.00 0.00 N ATOM 1284 CA ILE A 89 -0.015 0.816 -14.768 1.00 0.00 C ATOM 1285 C ILE A 89 -0.055 -0.707 -14.622 1.00 0.00 C ATOM 1286 O ILE A 89 0.890 -1.397 -14.949 1.00 0.00 O ATOM 1287 CB ILE A 89 -0.717 1.222 -16.064 1.00 0.00 C ATOM 1288 CG1 ILE A 89 -0.511 2.720 -16.307 1.00 0.00 C ATOM 1289 CG2 ILE A 89 -2.213 0.927 -15.951 1.00 0.00 C ATOM 1290 CD1 ILE A 89 -0.992 3.081 -17.713 1.00 0.00 C ATOM 0 H ILE A 89 1.830 1.286 -15.730 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.523 1.276 -13.920 1.00 0.00 H new ATOM 0 HB ILE A 89 -0.298 0.656 -16.896 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -1.060 3.298 -15.564 1.00 0.00 H new ATOM 0 HG13 ILE A 89 0.543 2.976 -16.195 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -2.712 1.217 -16.876 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -2.362 -0.139 -15.777 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -2.633 1.492 -15.119 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -0.845 4.147 -17.885 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -0.423 2.513 -18.449 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -2.051 2.841 -17.808 1.00 0.00 H new ATOM 1302 N TYR A 90 -1.141 -1.234 -14.129 1.00 0.00 N ATOM 1303 CA TYR A 90 -1.245 -2.711 -13.958 1.00 0.00 C ATOM 1304 C TYR A 90 -2.669 -3.163 -14.289 1.00 0.00 C ATOM 1305 O TYR A 90 -3.631 -2.483 -13.991 1.00 0.00 O ATOM 1306 CB TYR A 90 -0.919 -3.078 -12.508 1.00 0.00 C ATOM 1307 CG TYR A 90 0.361 -3.879 -12.462 1.00 0.00 C ATOM 1308 CD1 TYR A 90 0.346 -5.245 -12.774 1.00 0.00 C ATOM 1309 CD2 TYR A 90 1.564 -3.254 -12.107 1.00 0.00 C ATOM 1310 CE1 TYR A 90 1.534 -5.987 -12.729 1.00 0.00 C ATOM 1311 CE2 TYR A 90 2.753 -3.997 -12.063 1.00 0.00 C ATOM 1312 CZ TYR A 90 2.737 -5.362 -12.373 1.00 0.00 C ATOM 1313 OH TYR A 90 3.907 -6.094 -12.329 1.00 0.00 O ATOM 0 H TYR A 90 -1.963 -0.705 -13.837 1.00 0.00 H new ATOM 0 HA TYR A 90 -0.541 -3.206 -14.627 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -0.815 -2.174 -11.908 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -1.737 -3.655 -12.076 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -0.581 -5.726 -13.049 1.00 0.00 H new ATOM 0 HD2 TYR A 90 1.576 -2.201 -11.867 1.00 0.00 H new ATOM 0 HE1 TYR A 90 1.523 -7.040 -12.969 1.00 0.00 H new ATOM 0 HE2 TYR A 90 3.681 -3.516 -11.790 1.00 0.00 H new ATOM 0 HH TYR A 90 4.655 -5.533 -12.622 1.00 0.00 H new ATOM 1323 N ARG A 91 -2.812 -4.307 -14.900 1.00 0.00 N ATOM 1324 CA ARG A 91 -4.176 -4.797 -15.246 1.00 0.00 C ATOM 1325 C ARG A 91 -4.622 -5.834 -14.212 1.00 0.00 C ATOM 1326 O ARG A 91 -3.943 -6.811 -13.966 1.00 0.00 O ATOM 1327 CB ARG A 91 -4.151 -5.440 -16.634 1.00 0.00 C ATOM 1328 CG ARG A 91 -4.243 -4.349 -17.703 1.00 0.00 C ATOM 1329 CD ARG A 91 -5.703 -4.163 -18.121 1.00 0.00 C ATOM 1330 NE ARG A 91 -5.757 -3.463 -19.436 1.00 0.00 N ATOM 1331 CZ ARG A 91 -6.909 -3.157 -19.966 1.00 0.00 C ATOM 1332 NH1 ARG A 91 -7.771 -4.097 -20.242 1.00 0.00 N ATOM 1333 NH2 ARG A 91 -7.200 -1.910 -20.218 1.00 0.00 N ATOM 0 H ARG A 91 -2.046 -4.922 -15.174 1.00 0.00 H new ATOM 0 HA ARG A 91 -4.874 -3.959 -15.246 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -3.234 -6.015 -16.764 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -4.982 -6.138 -16.738 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -3.843 -3.412 -17.316 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -3.638 -4.621 -18.568 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -6.199 -5.131 -18.192 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -6.238 -3.585 -17.367 1.00 0.00 H new ATOM 0 HE ARG A 91 -4.893 -3.223 -19.922 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -7.544 -5.071 -20.043 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -8.672 -3.857 -20.656 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -6.527 -1.175 -20.001 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -8.101 -1.670 -20.632 1.00 0.00 H new ATOM 1347 N ALA A 92 -5.758 -5.629 -13.603 1.00 0.00 N ATOM 1348 CA ALA A 92 -6.244 -6.605 -12.588 1.00 0.00 C ATOM 1349 C ALA A 92 -6.948 -7.766 -13.293 1.00 0.00 C ATOM 1350 O ALA A 92 -7.986 -7.596 -13.902 1.00 0.00 O ATOM 1351 CB ALA A 92 -7.227 -5.911 -11.643 1.00 0.00 C ATOM 0 H ALA A 92 -6.370 -4.829 -13.764 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.398 -6.986 -12.016 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -7.583 -6.625 -10.900 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -6.726 -5.084 -11.140 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -8.073 -5.530 -12.214 1.00 0.00 H new ATOM 1357 N THR A 93 -6.393 -8.944 -13.218 1.00 0.00 N ATOM 1358 CA THR A 93 -7.032 -10.111 -13.887 1.00 0.00 C ATOM 1359 C THR A 93 -6.810 -11.368 -13.044 1.00 0.00 C ATOM 1360 O THR A 93 -7.032 -12.476 -13.493 1.00 0.00 O ATOM 1361 CB THR A 93 -6.411 -10.310 -15.271 1.00 0.00 C ATOM 1362 OG1 THR A 93 -6.230 -9.046 -15.893 1.00 0.00 O ATOM 1363 CG2 THR A 93 -7.335 -11.175 -16.129 1.00 0.00 C ATOM 0 H THR A 93 -5.525 -9.149 -12.723 1.00 0.00 H new ATOM 0 HA THR A 93 -8.101 -9.928 -13.991 1.00 0.00 H new ATOM 0 HB THR A 93 -5.446 -10.807 -15.168 1.00 0.00 H new ATOM 0 HG1 THR A 93 -5.831 -9.172 -16.779 1.00 0.00 H new ATOM 0 HG21 THR A 93 -6.891 -11.315 -17.114 1.00 0.00 H new ATOM 0 HG22 THR A 93 -7.473 -12.145 -15.651 1.00 0.00 H new ATOM 0 HG23 THR A 93 -8.301 -10.682 -16.234 1.00 0.00 H new ATOM 1371 N GLY A 94 -6.373 -11.209 -11.825 1.00 0.00 N ATOM 1372 CA GLY A 94 -6.139 -12.397 -10.957 1.00 0.00 C ATOM 1373 C GLY A 94 -7.473 -12.891 -10.395 1.00 0.00 C ATOM 1374 O GLY A 94 -8.380 -13.227 -11.129 1.00 0.00 O ATOM 0 H GLY A 94 -6.168 -10.308 -11.393 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -5.658 -13.190 -11.530 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -5.463 -12.138 -10.142 1.00 0.00 H new ATOM 1378 N THR A 95 -7.597 -12.938 -9.098 1.00 0.00 N ATOM 1379 CA THR A 95 -8.872 -13.411 -8.489 1.00 0.00 C ATOM 1380 C THR A 95 -9.340 -12.400 -7.442 1.00 0.00 C ATOM 1381 O THR A 95 -10.452 -11.913 -7.487 1.00 0.00 O ATOM 1382 CB THR A 95 -8.644 -14.769 -7.821 1.00 0.00 C ATOM 1383 OG1 THR A 95 -8.466 -15.763 -8.819 1.00 0.00 O ATOM 1384 CG2 THR A 95 -9.853 -15.122 -6.954 1.00 0.00 C ATOM 0 H THR A 95 -6.871 -12.670 -8.433 1.00 0.00 H new ATOM 0 HA THR A 95 -9.632 -13.510 -9.264 1.00 0.00 H new ATOM 0 HB THR A 95 -7.753 -14.721 -7.195 1.00 0.00 H new ATOM 0 HG1 THR A 95 -8.318 -16.633 -8.392 1.00 0.00 H new ATOM 0 HG21 THR A 95 -9.690 -16.089 -6.479 1.00 0.00 H new ATOM 0 HG22 THR A 95 -9.986 -14.359 -6.187 1.00 0.00 H new ATOM 0 HG23 THR A 95 -10.746 -15.170 -7.577 1.00 0.00 H new ATOM 1392 N SER A 96 -8.499 -12.081 -6.498 1.00 0.00 N ATOM 1393 CA SER A 96 -8.893 -11.103 -5.449 1.00 0.00 C ATOM 1394 C SER A 96 -7.716 -10.172 -5.156 1.00 0.00 C ATOM 1395 O SER A 96 -6.572 -10.581 -5.167 1.00 0.00 O ATOM 1396 CB SER A 96 -9.281 -11.852 -4.174 1.00 0.00 C ATOM 1397 OG SER A 96 -9.571 -13.207 -4.495 1.00 0.00 O ATOM 0 H SER A 96 -7.555 -12.456 -6.409 1.00 0.00 H new ATOM 0 HA SER A 96 -9.743 -10.517 -5.798 1.00 0.00 H new ATOM 0 HB2 SER A 96 -8.469 -11.804 -3.449 1.00 0.00 H new ATOM 0 HB3 SER A 96 -10.149 -11.382 -3.712 1.00 0.00 H new ATOM 0 HG SER A 96 -9.819 -13.691 -3.679 1.00 0.00 H new ATOM 1403 N VAL A 97 -7.986 -8.922 -4.894 1.00 0.00 N ATOM 1404 CA VAL A 97 -6.880 -7.968 -4.601 1.00 0.00 C ATOM 1405 C VAL A 97 -5.884 -8.627 -3.647 1.00 0.00 C ATOM 1406 O VAL A 97 -4.714 -8.298 -3.633 1.00 0.00 O ATOM 1407 CB VAL A 97 -7.454 -6.706 -3.953 1.00 0.00 C ATOM 1408 CG1 VAL A 97 -8.243 -5.911 -4.995 1.00 0.00 C ATOM 1409 CG2 VAL A 97 -8.384 -7.100 -2.803 1.00 0.00 C ATOM 0 H VAL A 97 -8.924 -8.521 -4.870 1.00 0.00 H new ATOM 0 HA VAL A 97 -6.373 -7.699 -5.528 1.00 0.00 H new ATOM 0 HB VAL A 97 -6.639 -6.093 -3.568 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -8.652 -5.012 -4.534 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -7.582 -5.630 -5.815 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -9.058 -6.524 -5.380 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -8.793 -6.201 -2.341 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -9.199 -7.713 -3.188 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -7.823 -7.667 -2.060 1.00 0.00 H new ATOM 1419 N GLU A 98 -6.335 -9.560 -2.853 1.00 0.00 N ATOM 1420 CA GLU A 98 -5.410 -10.242 -1.907 1.00 0.00 C ATOM 1421 C GLU A 98 -4.358 -11.019 -2.702 1.00 0.00 C ATOM 1422 O GLU A 98 -3.171 -10.875 -2.486 1.00 0.00 O ATOM 1423 CB GLU A 98 -6.203 -11.210 -1.026 1.00 0.00 C ATOM 1424 CG GLU A 98 -5.589 -11.244 0.374 1.00 0.00 C ATOM 1425 CD GLU A 98 -6.030 -10.004 1.154 1.00 0.00 C ATOM 1426 OE1 GLU A 98 -6.634 -9.133 0.551 1.00 0.00 O ATOM 1427 OE2 GLU A 98 -5.756 -9.947 2.342 1.00 0.00 O ATOM 0 H GLU A 98 -7.303 -9.878 -2.819 1.00 0.00 H new ATOM 0 HA GLU A 98 -4.918 -9.501 -1.277 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -7.246 -10.897 -0.970 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -6.193 -12.208 -1.464 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -5.902 -12.147 0.898 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.502 -11.276 0.305 1.00 0.00 H new ATOM 1434 N GLU A 99 -4.785 -11.836 -3.627 1.00 0.00 N ATOM 1435 CA GLU A 99 -3.809 -12.615 -4.439 1.00 0.00 C ATOM 1436 C GLU A 99 -2.962 -11.647 -5.266 1.00 0.00 C ATOM 1437 O GLU A 99 -1.779 -11.847 -5.456 1.00 0.00 O ATOM 1438 CB GLU A 99 -4.563 -13.562 -5.376 1.00 0.00 C ATOM 1439 CG GLU A 99 -3.759 -14.851 -5.553 1.00 0.00 C ATOM 1440 CD GLU A 99 -3.689 -15.599 -4.220 1.00 0.00 C ATOM 1441 OE1 GLU A 99 -2.812 -15.284 -3.432 1.00 0.00 O ATOM 1442 OE2 GLU A 99 -4.514 -16.473 -4.010 1.00 0.00 O ATOM 0 H GLU A 99 -5.766 -11.997 -3.855 1.00 0.00 H new ATOM 0 HA GLU A 99 -3.165 -13.198 -3.780 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -5.548 -13.788 -4.967 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -4.722 -13.084 -6.343 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -4.225 -15.481 -6.311 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -2.754 -14.619 -5.905 1.00 0.00 H new ATOM 1449 N ASN A 100 -3.560 -10.596 -5.757 1.00 0.00 N ATOM 1450 CA ASN A 100 -2.792 -9.611 -6.570 1.00 0.00 C ATOM 1451 C ASN A 100 -1.720 -8.961 -5.693 1.00 0.00 C ATOM 1452 O ASN A 100 -0.665 -8.584 -6.162 1.00 0.00 O ATOM 1453 CB ASN A 100 -3.743 -8.534 -7.096 1.00 0.00 C ATOM 1454 CG ASN A 100 -4.479 -9.061 -8.328 1.00 0.00 C ATOM 1455 OD1 ASN A 100 -4.743 -10.242 -8.434 1.00 0.00 O ATOM 1456 ND2 ASN A 100 -4.822 -8.229 -9.273 1.00 0.00 N ATOM 0 H ASN A 100 -4.548 -10.377 -5.630 1.00 0.00 H new ATOM 0 HA ASN A 100 -2.319 -10.118 -7.411 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -4.459 -8.257 -6.322 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -3.184 -7.633 -7.351 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -5.312 -8.570 -10.100 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -4.601 -7.237 -9.184 1.00 0.00 H new ATOM 1463 N LEU A 101 -1.983 -8.831 -4.422 1.00 0.00 N ATOM 1464 CA LEU A 101 -0.981 -8.211 -3.512 1.00 0.00 C ATOM 1465 C LEU A 101 0.338 -8.977 -3.619 1.00 0.00 C ATOM 1466 O LEU A 101 1.375 -8.412 -3.909 1.00 0.00 O ATOM 1467 CB LEU A 101 -1.494 -8.273 -2.073 1.00 0.00 C ATOM 1468 CG LEU A 101 -0.509 -7.559 -1.146 1.00 0.00 C ATOM 1469 CD1 LEU A 101 -0.878 -6.077 -1.051 1.00 0.00 C ATOM 1470 CD2 LEU A 101 -0.572 -8.189 0.247 1.00 0.00 C ATOM 0 H LEU A 101 -2.850 -9.128 -3.974 1.00 0.00 H new ATOM 0 HA LEU A 101 -0.822 -7.170 -3.794 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -2.476 -7.805 -2.006 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -1.613 -9.311 -1.763 1.00 0.00 H new ATOM 0 HG LEU A 101 0.500 -7.657 -1.545 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -0.176 -5.569 -0.390 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -0.834 -5.627 -2.043 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -1.888 -5.978 -0.652 1.00 0.00 H new ATOM 0 HD21 LEU A 101 0.130 -7.681 0.908 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -1.582 -8.091 0.645 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -0.309 -9.245 0.181 1.00 0.00 H new ATOM 1482 N LYS A 102 0.307 -10.260 -3.391 1.00 0.00 N ATOM 1483 CA LYS A 102 1.558 -11.065 -3.484 1.00 0.00 C ATOM 1484 C LYS A 102 1.897 -11.302 -4.957 1.00 0.00 C ATOM 1485 O LYS A 102 2.990 -11.712 -5.294 1.00 0.00 O ATOM 1486 CB LYS A 102 1.352 -12.411 -2.786 1.00 0.00 C ATOM 1487 CG LYS A 102 1.454 -12.225 -1.271 1.00 0.00 C ATOM 1488 CD LYS A 102 0.994 -13.505 -0.569 1.00 0.00 C ATOM 1489 CE LYS A 102 0.596 -13.182 0.873 1.00 0.00 C ATOM 1490 NZ LYS A 102 0.723 -14.408 1.710 1.00 0.00 N ATOM 0 H LYS A 102 -0.531 -10.787 -3.144 1.00 0.00 H new ATOM 0 HA LYS A 102 2.375 -10.528 -3.002 1.00 0.00 H new ATOM 0 HB2 LYS A 102 0.377 -12.822 -3.047 1.00 0.00 H new ATOM 0 HB3 LYS A 102 2.101 -13.127 -3.126 1.00 0.00 H new ATOM 0 HG2 LYS A 102 2.481 -11.993 -0.991 1.00 0.00 H new ATOM 0 HG3 LYS A 102 0.839 -11.383 -0.955 1.00 0.00 H new ATOM 0 HD2 LYS A 102 0.149 -13.941 -1.102 1.00 0.00 H new ATOM 0 HD3 LYS A 102 1.794 -14.246 -0.580 1.00 0.00 H new ATOM 0 HE2 LYS A 102 1.233 -12.391 1.269 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -0.429 -12.812 0.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 0.453 -14.189 2.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 0.098 -15.150 1.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 1.708 -14.742 1.689 1.00 0.00 H new ATOM 1504 N LEU A 103 0.968 -11.048 -5.838 1.00 0.00 N ATOM 1505 CA LEU A 103 1.235 -11.261 -7.288 1.00 0.00 C ATOM 1506 C LEU A 103 2.089 -10.110 -7.827 1.00 0.00 C ATOM 1507 O LEU A 103 2.775 -10.248 -8.820 1.00 0.00 O ATOM 1508 CB LEU A 103 -0.091 -11.313 -8.050 1.00 0.00 C ATOM 1509 CG LEU A 103 -0.011 -12.383 -9.140 1.00 0.00 C ATOM 1510 CD1 LEU A 103 0.266 -13.743 -8.500 1.00 0.00 C ATOM 1511 CD2 LEU A 103 -1.339 -12.438 -9.899 1.00 0.00 C ATOM 0 H LEU A 103 0.035 -10.702 -5.615 1.00 0.00 H new ATOM 0 HA LEU A 103 1.769 -12.202 -7.423 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.908 -11.537 -7.364 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.306 -10.341 -8.494 1.00 0.00 H new ATOM 0 HG LEU A 103 0.794 -12.137 -9.832 1.00 0.00 H new ATOM 0 HD11 LEU A 103 0.323 -14.506 -9.277 1.00 0.00 H new ATOM 0 HD12 LEU A 103 1.211 -13.705 -7.959 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -0.539 -13.990 -7.807 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.283 -13.200 -10.676 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -2.144 -12.684 -9.207 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -1.537 -11.468 -10.356 1.00 0.00 H new ATOM 1523 N PHE A 104 2.054 -8.977 -7.181 1.00 0.00 N ATOM 1524 CA PHE A 104 2.868 -7.825 -7.662 1.00 0.00 C ATOM 1525 C PHE A 104 4.334 -8.061 -7.297 1.00 0.00 C ATOM 1526 O PHE A 104 5.233 -7.528 -7.918 1.00 0.00 O ATOM 1527 CB PHE A 104 2.375 -6.537 -6.998 1.00 0.00 C ATOM 1528 CG PHE A 104 3.088 -5.354 -7.607 1.00 0.00 C ATOM 1529 CD1 PHE A 104 4.392 -5.036 -7.200 1.00 0.00 C ATOM 1530 CD2 PHE A 104 2.447 -4.574 -8.579 1.00 0.00 C ATOM 1531 CE1 PHE A 104 5.053 -3.939 -7.767 1.00 0.00 C ATOM 1532 CE2 PHE A 104 3.110 -3.477 -9.146 1.00 0.00 C ATOM 1533 CZ PHE A 104 4.413 -3.160 -8.739 1.00 0.00 C ATOM 0 H PHE A 104 1.499 -8.799 -6.344 1.00 0.00 H new ATOM 0 HA PHE A 104 2.770 -7.732 -8.744 1.00 0.00 H new ATOM 0 HB2 PHE A 104 1.298 -6.435 -7.132 1.00 0.00 H new ATOM 0 HB3 PHE A 104 2.560 -6.574 -5.925 1.00 0.00 H new ATOM 0 HD1 PHE A 104 4.886 -5.636 -6.450 1.00 0.00 H new ATOM 0 HD2 PHE A 104 1.442 -4.818 -8.891 1.00 0.00 H new ATOM 0 HE1 PHE A 104 6.057 -3.694 -7.454 1.00 0.00 H new ATOM 0 HE2 PHE A 104 2.617 -2.876 -9.896 1.00 0.00 H new ATOM 0 HZ PHE A 104 4.924 -2.314 -9.175 1.00 0.00 H new ATOM 1543 N THR A 105 4.582 -8.860 -6.297 1.00 0.00 N ATOM 1544 CA THR A 105 5.988 -9.137 -5.893 1.00 0.00 C ATOM 1545 C THR A 105 6.628 -10.082 -6.910 1.00 0.00 C ATOM 1546 O THR A 105 7.806 -10.000 -7.197 1.00 0.00 O ATOM 1547 CB THR A 105 6.001 -9.793 -4.510 1.00 0.00 C ATOM 1548 OG1 THR A 105 4.962 -9.238 -3.715 1.00 0.00 O ATOM 1549 CG2 THR A 105 7.351 -9.546 -3.837 1.00 0.00 C ATOM 0 H THR A 105 3.870 -9.334 -5.741 1.00 0.00 H new ATOM 0 HA THR A 105 6.549 -8.203 -5.857 1.00 0.00 H new ATOM 0 HB THR A 105 5.844 -10.866 -4.615 1.00 0.00 H new ATOM 0 HG1 THR A 105 4.754 -9.848 -2.976 1.00 0.00 H new ATOM 0 HG21 THR A 105 7.358 -10.014 -2.853 1.00 0.00 H new ATOM 0 HG22 THR A 105 8.146 -9.974 -4.448 1.00 0.00 H new ATOM 0 HG23 THR A 105 7.513 -8.473 -3.730 1.00 0.00 H new ATOM 1557 N GLU A 106 5.857 -10.981 -7.460 1.00 0.00 N ATOM 1558 CA GLU A 106 6.417 -11.933 -8.461 1.00 0.00 C ATOM 1559 C GLU A 106 6.270 -11.342 -9.866 1.00 0.00 C ATOM 1560 O GLU A 106 6.661 -11.945 -10.846 1.00 0.00 O ATOM 1561 CB GLU A 106 5.658 -13.261 -8.387 1.00 0.00 C ATOM 1562 CG GLU A 106 5.180 -13.502 -6.954 1.00 0.00 C ATOM 1563 CD GLU A 106 5.103 -15.006 -6.688 1.00 0.00 C ATOM 1564 OE1 GLU A 106 4.091 -15.597 -7.027 1.00 0.00 O ATOM 1565 OE2 GLU A 106 6.057 -15.542 -6.149 1.00 0.00 O ATOM 0 H GLU A 106 4.864 -11.097 -7.259 1.00 0.00 H new ATOM 0 HA GLU A 106 7.472 -12.105 -8.246 1.00 0.00 H new ATOM 0 HB2 GLU A 106 4.806 -13.242 -9.067 1.00 0.00 H new ATOM 0 HB3 GLU A 106 6.304 -14.078 -8.708 1.00 0.00 H new ATOM 0 HG2 GLU A 106 5.864 -13.032 -6.247 1.00 0.00 H new ATOM 0 HG3 GLU A 106 4.202 -13.045 -6.804 1.00 0.00 H new ATOM 1572 N GLY A 107 5.707 -10.170 -9.974 1.00 0.00 N ATOM 1573 CA GLY A 107 5.537 -9.548 -11.317 1.00 0.00 C ATOM 1574 C GLY A 107 4.786 -10.513 -12.234 1.00 0.00 C ATOM 1575 O GLY A 107 5.075 -10.620 -13.409 1.00 0.00 O ATOM 0 H GLY A 107 5.358 -9.617 -9.191 1.00 0.00 H new ATOM 0 HA2 GLY A 107 4.987 -8.611 -11.229 1.00 0.00 H new ATOM 0 HA3 GLY A 107 6.511 -9.307 -11.744 1.00 0.00 H new ATOM 1579 N ASN A 108 3.824 -11.220 -11.707 1.00 0.00 N ATOM 1580 CA ASN A 108 3.058 -12.180 -12.550 1.00 0.00 C ATOM 1581 C ASN A 108 1.960 -11.430 -13.308 1.00 0.00 C ATOM 1582 O ASN A 108 1.489 -11.876 -14.335 1.00 0.00 O ATOM 1583 CB ASN A 108 2.424 -13.250 -11.659 1.00 0.00 C ATOM 1584 CG ASN A 108 2.828 -14.637 -12.164 1.00 0.00 C ATOM 1585 OD1 ASN A 108 2.000 -15.388 -12.640 1.00 0.00 O ATOM 1586 ND2 ASN A 108 4.076 -15.010 -12.081 1.00 0.00 N ATOM 0 H ASN A 108 3.536 -11.174 -10.730 1.00 0.00 H new ATOM 0 HA ASN A 108 3.732 -12.655 -13.263 1.00 0.00 H new ATOM 0 HB2 ASN A 108 2.748 -13.118 -10.627 1.00 0.00 H new ATOM 0 HB3 ASN A 108 1.339 -13.150 -11.668 1.00 0.00 H new ATOM 0 HD21 ASN A 108 4.356 -15.932 -12.416 1.00 0.00 H new ATOM 0 HD22 ASN A 108 4.771 -14.380 -11.681 1.00 0.00 H new ATOM 1593 N LEU A 109 1.549 -10.295 -12.812 1.00 0.00 N ATOM 1594 CA LEU A 109 0.482 -9.523 -13.511 1.00 0.00 C ATOM 1595 C LEU A 109 1.113 -8.679 -14.620 1.00 0.00 C ATOM 1596 O LEU A 109 2.305 -8.445 -14.633 1.00 0.00 O ATOM 1597 CB LEU A 109 -0.230 -8.611 -12.511 1.00 0.00 C ATOM 1598 CG LEU A 109 -1.508 -9.294 -12.019 1.00 0.00 C ATOM 1599 CD1 LEU A 109 -1.794 -8.872 -10.576 1.00 0.00 C ATOM 1600 CD2 LEU A 109 -2.681 -8.882 -12.911 1.00 0.00 C ATOM 0 H LEU A 109 1.904 -9.870 -11.956 1.00 0.00 H new ATOM 0 HA LEU A 109 -0.242 -10.212 -13.946 1.00 0.00 H new ATOM 0 HB2 LEU A 109 0.427 -8.394 -11.669 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -0.472 -7.657 -12.980 1.00 0.00 H new ATOM 0 HG LEU A 109 -1.379 -10.376 -12.061 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -2.705 -9.360 -10.228 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -0.959 -9.165 -9.939 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -1.922 -7.790 -10.532 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -3.592 -9.368 -12.562 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -2.808 -7.800 -12.869 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -2.480 -9.184 -13.939 1.00 0.00 H new ATOM 1612 N GLU A 110 0.325 -8.224 -15.555 1.00 0.00 N ATOM 1613 CA GLU A 110 0.884 -7.401 -16.665 1.00 0.00 C ATOM 1614 C GLU A 110 0.908 -5.926 -16.259 1.00 0.00 C ATOM 1615 O GLU A 110 0.051 -5.457 -15.537 1.00 0.00 O ATOM 1616 CB GLU A 110 0.015 -7.570 -17.913 1.00 0.00 C ATOM 1617 CG GLU A 110 0.497 -6.612 -19.005 1.00 0.00 C ATOM 1618 CD GLU A 110 -0.493 -6.627 -20.172 1.00 0.00 C ATOM 1619 OE1 GLU A 110 -1.608 -6.172 -19.982 1.00 0.00 O ATOM 1620 OE2 GLU A 110 -0.116 -7.094 -21.234 1.00 0.00 O ATOM 0 H GLU A 110 -0.681 -8.386 -15.599 1.00 0.00 H new ATOM 0 HA GLU A 110 1.901 -7.731 -16.878 1.00 0.00 H new ATOM 0 HB2 GLU A 110 0.067 -8.599 -18.269 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -1.029 -7.368 -17.672 1.00 0.00 H new ATOM 0 HG2 GLU A 110 0.587 -5.603 -18.604 1.00 0.00 H new ATOM 0 HG3 GLU A 110 1.488 -6.907 -19.351 1.00 0.00 H new ATOM 1627 N GLU A 111 1.881 -5.192 -16.726 1.00 0.00 N ATOM 1628 CA GLU A 111 1.964 -3.746 -16.378 1.00 0.00 C ATOM 1629 C GLU A 111 2.294 -2.946 -17.640 1.00 0.00 C ATOM 1630 O GLU A 111 2.449 -3.499 -18.710 1.00 0.00 O ATOM 1631 CB GLU A 111 3.062 -3.531 -15.333 1.00 0.00 C ATOM 1632 CG GLU A 111 4.415 -3.938 -15.923 1.00 0.00 C ATOM 1633 CD GLU A 111 5.432 -4.114 -14.794 1.00 0.00 C ATOM 1634 OE1 GLU A 111 5.159 -4.890 -13.892 1.00 0.00 O ATOM 1635 OE2 GLU A 111 6.467 -3.471 -14.850 1.00 0.00 O ATOM 0 H GLU A 111 2.624 -5.533 -17.336 1.00 0.00 H new ATOM 0 HA GLU A 111 1.010 -3.412 -15.969 1.00 0.00 H new ATOM 0 HB2 GLU A 111 3.087 -2.485 -15.026 1.00 0.00 H new ATOM 0 HB3 GLU A 111 2.850 -4.120 -14.441 1.00 0.00 H new ATOM 0 HG2 GLU A 111 4.314 -4.867 -16.484 1.00 0.00 H new ATOM 0 HG3 GLU A 111 4.761 -3.178 -16.624 1.00 0.00 H new ATOM 1642 N ILE A 112 2.403 -1.651 -17.527 1.00 0.00 N ATOM 1643 CA ILE A 112 2.722 -0.828 -18.728 1.00 0.00 C ATOM 1644 C ILE A 112 3.507 0.417 -18.307 1.00 0.00 C ATOM 1645 O ILE A 112 3.092 1.163 -17.443 1.00 0.00 O ATOM 1646 CB ILE A 112 1.422 -0.400 -19.413 1.00 0.00 C ATOM 1647 CG1 ILE A 112 0.444 -1.578 -19.427 1.00 0.00 C ATOM 1648 CG2 ILE A 112 1.720 0.029 -20.852 1.00 0.00 C ATOM 1649 CD1 ILE A 112 -0.829 -1.175 -20.172 1.00 0.00 C ATOM 0 H ILE A 112 2.286 -1.129 -16.659 1.00 0.00 H new ATOM 0 HA ILE A 112 3.323 -1.418 -19.419 1.00 0.00 H new ATOM 0 HB ILE A 112 0.982 0.435 -18.868 1.00 0.00 H new ATOM 0 HG12 ILE A 112 0.903 -2.440 -19.910 1.00 0.00 H new ATOM 0 HG13 ILE A 112 0.202 -1.876 -18.407 1.00 0.00 H new ATOM 0 HG21 ILE A 112 0.794 0.334 -21.340 1.00 0.00 H new ATOM 0 HG22 ILE A 112 2.419 0.865 -20.845 1.00 0.00 H new ATOM 0 HG23 ILE A 112 2.159 -0.806 -21.397 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -1.525 -2.013 -20.182 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -1.291 -0.325 -19.669 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -0.579 -0.899 -21.196 1.00 0.00 H new ATOM 1661 N ARG A 113 4.638 0.647 -18.918 1.00 0.00 N ATOM 1662 CA ARG A 113 5.450 1.844 -18.558 1.00 0.00 C ATOM 1663 C ARG A 113 5.596 2.746 -19.786 1.00 0.00 C ATOM 1664 O ARG A 113 5.036 3.823 -19.848 1.00 0.00 O ATOM 1665 CB ARG A 113 6.835 1.399 -18.085 1.00 0.00 C ATOM 1666 CG ARG A 113 6.703 0.154 -17.205 1.00 0.00 C ATOM 1667 CD ARG A 113 6.704 -1.096 -18.084 1.00 0.00 C ATOM 1668 NE ARG A 113 7.784 -2.020 -17.633 1.00 0.00 N ATOM 1669 CZ ARG A 113 8.744 -2.351 -18.453 1.00 0.00 C ATOM 1670 NH1 ARG A 113 9.265 -1.454 -19.245 1.00 0.00 N ATOM 1671 NH2 ARG A 113 9.183 -3.579 -18.481 1.00 0.00 N ATOM 0 H ARG A 113 5.034 0.058 -19.650 1.00 0.00 H new ATOM 0 HA ARG A 113 4.953 2.393 -17.758 1.00 0.00 H new ATOM 0 HB2 ARG A 113 7.471 1.184 -18.943 1.00 0.00 H new ATOM 0 HB3 ARG A 113 7.315 2.202 -17.526 1.00 0.00 H new ATOM 0 HG2 ARG A 113 7.527 0.111 -16.492 1.00 0.00 H new ATOM 0 HG3 ARG A 113 5.782 0.202 -16.625 1.00 0.00 H new ATOM 0 HD2 ARG A 113 5.737 -1.595 -18.027 1.00 0.00 H new ATOM 0 HD3 ARG A 113 6.859 -0.820 -19.127 1.00 0.00 H new ATOM 0 HE ARG A 113 7.773 -2.393 -16.684 1.00 0.00 H new ATOM 0 HH11 ARG A 113 8.922 -0.494 -19.223 1.00 0.00 H new ATOM 0 HH12 ARG A 113 10.015 -1.713 -19.886 1.00 0.00 H new ATOM 0 HH21 ARG A 113 8.776 -4.280 -17.862 1.00 0.00 H new ATOM 0 HH22 ARG A 113 9.933 -3.838 -19.122 1.00 0.00 H new ATOM 1685 N SER A 114 6.343 2.314 -20.765 1.00 0.00 N ATOM 1686 CA SER A 114 6.523 3.146 -21.989 1.00 0.00 C ATOM 1687 C SER A 114 7.146 2.291 -23.098 1.00 0.00 C ATOM 1688 O SER A 114 8.288 2.488 -23.463 1.00 0.00 O ATOM 1689 CB SER A 114 7.447 4.323 -21.674 1.00 0.00 C ATOM 1690 OG SER A 114 7.607 5.120 -22.841 1.00 0.00 O ATOM 0 H SER A 114 6.836 1.421 -20.770 1.00 0.00 H new ATOM 0 HA SER A 114 5.555 3.523 -22.319 1.00 0.00 H new ATOM 0 HB2 SER A 114 7.029 4.922 -20.865 1.00 0.00 H new ATOM 0 HB3 SER A 114 8.416 3.958 -21.333 1.00 0.00 H new ATOM 0 HG SER A 114 8.198 5.876 -22.642 1.00 0.00 H new ATOM 1696 N PRO A 115 6.369 1.363 -23.600 1.00 0.00 N ATOM 1697 CA PRO A 115 6.809 0.451 -24.670 1.00 0.00 C ATOM 1698 C PRO A 115 6.750 1.146 -26.036 1.00 0.00 C ATOM 1699 O PRO A 115 6.908 0.521 -27.065 1.00 0.00 O ATOM 1700 CB PRO A 115 5.794 -0.694 -24.601 1.00 0.00 C ATOM 1701 CG PRO A 115 4.534 -0.121 -23.910 1.00 0.00 C ATOM 1702 CD PRO A 115 4.983 1.136 -23.141 1.00 0.00 C ATOM 0 HA PRO A 115 7.839 0.117 -24.547 1.00 0.00 H new ATOM 0 HB2 PRO A 115 5.556 -1.062 -25.599 1.00 0.00 H new ATOM 0 HB3 PRO A 115 6.196 -1.536 -24.038 1.00 0.00 H new ATOM 0 HG2 PRO A 115 3.769 0.128 -24.645 1.00 0.00 H new ATOM 0 HG3 PRO A 115 4.098 -0.854 -23.232 1.00 0.00 H new ATOM 0 HD2 PRO A 115 4.344 1.990 -23.365 1.00 0.00 H new ATOM 0 HD3 PRO A 115 4.940 0.980 -22.063 1.00 0.00 H new ATOM 1710 N GLY A 116 6.525 2.432 -26.056 1.00 0.00 N ATOM 1711 CA GLY A 116 6.459 3.153 -27.358 1.00 0.00 C ATOM 1712 C GLY A 116 5.810 4.523 -27.155 1.00 0.00 C ATOM 1713 O GLY A 116 5.095 4.747 -26.197 1.00 0.00 O ATOM 0 H GLY A 116 6.384 3.013 -25.229 1.00 0.00 H new ATOM 0 HA2 GLY A 116 7.461 3.272 -27.770 1.00 0.00 H new ATOM 0 HA3 GLY A 116 5.885 2.571 -28.079 1.00 0.00 H new ATOM 1717 N SER A 117 6.052 5.442 -28.050 1.00 0.00 N ATOM 1718 CA SER A 117 5.449 6.797 -27.909 1.00 0.00 C ATOM 1719 C SER A 117 3.947 6.662 -27.648 1.00 0.00 C ATOM 1720 O SER A 117 3.446 7.072 -26.621 1.00 0.00 O ATOM 1721 CB SER A 117 5.671 7.591 -29.196 1.00 0.00 C ATOM 1722 OG SER A 117 5.636 8.981 -28.904 1.00 0.00 O ATOM 0 H SER A 117 6.641 5.313 -28.872 1.00 0.00 H new ATOM 0 HA SER A 117 5.919 7.318 -27.075 1.00 0.00 H new ATOM 0 HB2 SER A 117 6.631 7.325 -29.640 1.00 0.00 H new ATOM 0 HB3 SER A 117 4.902 7.342 -29.927 1.00 0.00 H new ATOM 0 HG SER A 117 5.780 9.492 -29.728 1.00 0.00 H new ATOM 1728 N GLY A 118 3.224 6.089 -28.572 1.00 0.00 N ATOM 1729 CA GLY A 118 1.756 5.928 -28.376 1.00 0.00 C ATOM 1730 C GLY A 118 1.017 6.391 -29.633 1.00 0.00 C ATOM 1731 O GLY A 118 1.188 5.842 -30.702 1.00 0.00 O ATOM 0 H GLY A 118 3.587 5.726 -29.453 1.00 0.00 H new ATOM 0 HA2 GLY A 118 1.519 4.885 -28.166 1.00 0.00 H new ATOM 0 HA3 GLY A 118 1.428 6.509 -27.514 1.00 0.00 H new ATOM 1735 N ARG A 119 0.196 7.398 -29.511 1.00 0.00 N ATOM 1736 CA ARG A 119 -0.554 7.894 -30.699 1.00 0.00 C ATOM 1737 C ARG A 119 0.388 7.980 -31.901 1.00 0.00 C ATOM 1738 O ARG A 119 1.558 8.278 -31.766 1.00 0.00 O ATOM 1739 CB ARG A 119 -1.126 9.282 -30.400 1.00 0.00 C ATOM 1740 CG ARG A 119 -2.120 9.672 -31.496 1.00 0.00 C ATOM 1741 CD ARG A 119 -3.540 9.644 -30.930 1.00 0.00 C ATOM 1742 NE ARG A 119 -3.948 11.024 -30.542 1.00 0.00 N ATOM 1743 CZ ARG A 119 -5.077 11.222 -29.920 1.00 0.00 C ATOM 1744 NH1 ARG A 119 -5.328 10.590 -28.806 1.00 0.00 N ATOM 1745 NH2 ARG A 119 -5.958 12.049 -30.414 1.00 0.00 N ATOM 0 H ARG A 119 0.012 7.898 -28.641 1.00 0.00 H new ATOM 0 HA ARG A 119 -1.368 7.206 -30.925 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -1.621 9.281 -29.429 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -0.321 10.015 -30.347 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -1.888 10.667 -31.875 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -2.039 8.984 -32.337 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -4.231 9.244 -31.672 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -3.585 8.983 -30.064 1.00 0.00 H new ATOM 0 HE ARG A 119 -3.343 11.815 -30.763 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -4.641 9.941 -28.422 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -6.211 10.745 -28.320 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -5.763 12.540 -31.286 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -6.841 12.204 -29.928 1.00 0.00 H new ATOM 1759 N GLY A 120 -0.114 7.722 -33.078 1.00 0.00 N ATOM 1760 CA GLY A 120 0.751 7.789 -34.289 1.00 0.00 C ATOM 1761 C GLY A 120 -0.107 8.121 -35.510 1.00 0.00 C ATOM 1762 O GLY A 120 -1.228 8.575 -35.388 1.00 0.00 O ATOM 0 H GLY A 120 -1.086 7.468 -33.253 1.00 0.00 H new ATOM 0 HA2 GLY A 120 1.523 8.547 -34.156 1.00 0.00 H new ATOM 0 HA3 GLY A 120 1.261 6.837 -34.438 1.00 0.00 H new ATOM 1766 N ARG A 121 0.407 7.897 -36.688 1.00 0.00 N ATOM 1767 CA ARG A 121 -0.382 8.201 -37.915 1.00 0.00 C ATOM 1768 C ARG A 121 -0.396 6.973 -38.829 1.00 0.00 C ATOM 1769 O ARG A 121 0.630 6.530 -39.304 1.00 0.00 O ATOM 1770 CB ARG A 121 0.258 9.377 -38.655 1.00 0.00 C ATOM 1771 CG ARG A 121 -0.607 10.626 -38.475 1.00 0.00 C ATOM 1772 CD ARG A 121 -1.538 10.780 -39.678 1.00 0.00 C ATOM 1773 NE ARG A 121 -2.954 10.647 -39.232 1.00 0.00 N ATOM 1774 CZ ARG A 121 -3.816 11.587 -39.506 1.00 0.00 C ATOM 1775 NH1 ARG A 121 -3.700 12.278 -40.606 1.00 0.00 N ATOM 1776 NH2 ARG A 121 -4.794 11.837 -38.680 1.00 0.00 N ATOM 0 H ARG A 121 1.339 7.517 -36.854 1.00 0.00 H new ATOM 0 HA ARG A 121 -1.403 8.459 -37.635 1.00 0.00 H new ATOM 0 HB2 ARG A 121 1.262 9.559 -38.271 1.00 0.00 H new ATOM 0 HB3 ARG A 121 0.359 9.142 -39.714 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -1.191 10.548 -37.558 1.00 0.00 H new ATOM 0 HG3 ARG A 121 0.026 11.508 -38.376 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -1.384 11.751 -40.149 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -1.309 10.022 -40.428 1.00 0.00 H new ATOM 0 HE ARG A 121 -3.249 9.820 -38.712 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -2.935 12.083 -41.252 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -4.374 13.013 -40.820 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -4.885 11.297 -37.819 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -5.468 12.572 -38.895 1.00 0.00 H new ATOM 1790 N ARG A 122 -1.551 6.423 -39.080 1.00 0.00 N ATOM 1791 CA ARG A 122 -1.629 5.227 -39.965 1.00 0.00 C ATOM 1792 C ARG A 122 -3.069 5.039 -40.441 1.00 0.00 C ATOM 1793 O ARG A 122 -3.882 5.938 -40.360 1.00 0.00 O ATOM 1794 CB ARG A 122 -1.181 3.987 -39.188 1.00 0.00 C ATOM 1795 CG ARG A 122 0.015 3.348 -39.896 1.00 0.00 C ATOM 1796 CD ARG A 122 0.978 2.775 -38.856 1.00 0.00 C ATOM 1797 NE ARG A 122 2.056 2.011 -39.544 1.00 0.00 N ATOM 1798 CZ ARG A 122 3.155 1.715 -38.905 1.00 0.00 C ATOM 1799 NH1 ARG A 122 4.012 2.655 -38.612 1.00 0.00 N ATOM 1800 NH2 ARG A 122 3.397 0.480 -38.559 1.00 0.00 N ATOM 0 H ARG A 122 -2.444 6.750 -38.711 1.00 0.00 H new ATOM 0 HA ARG A 122 -0.977 5.369 -40.827 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -0.910 4.261 -38.169 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -2.001 3.272 -39.118 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -0.325 2.558 -40.566 1.00 0.00 H new ATOM 0 HG3 ARG A 122 0.526 4.089 -40.510 1.00 0.00 H new ATOM 0 HD2 ARG A 122 1.411 3.581 -38.263 1.00 0.00 H new ATOM 0 HD3 ARG A 122 0.440 2.125 -38.166 1.00 0.00 H new ATOM 0 HE ARG A 122 1.935 1.719 -40.514 1.00 0.00 H new ATOM 0 HH11 ARG A 122 3.823 3.620 -38.882 1.00 0.00 H new ATOM 0 HH12 ARG A 122 4.871 2.424 -38.113 1.00 0.00 H new ATOM 0 HH21 ARG A 122 2.727 -0.254 -38.788 1.00 0.00 H new ATOM 0 HH22 ARG A 122 4.256 0.249 -38.060 1.00 0.00 H new ATOM 1814 N ARG A 123 -3.393 3.877 -40.941 1.00 0.00 N ATOM 1815 CA ARG A 123 -4.781 3.637 -41.425 1.00 0.00 C ATOM 1816 C ARG A 123 -5.237 2.239 -40.999 1.00 0.00 C ATOM 1817 O ARG A 123 -4.485 1.285 -41.059 1.00 0.00 O ATOM 1818 CB ARG A 123 -4.811 3.743 -42.950 1.00 0.00 C ATOM 1819 CG ARG A 123 -4.729 5.214 -43.362 1.00 0.00 C ATOM 1820 CD ARG A 123 -3.263 5.617 -43.531 1.00 0.00 C ATOM 1821 NE ARG A 123 -3.009 5.988 -44.952 1.00 0.00 N ATOM 1822 CZ ARG A 123 -2.713 5.062 -45.823 1.00 0.00 C ATOM 1823 NH1 ARG A 123 -1.514 4.546 -45.846 1.00 0.00 N ATOM 1824 NH2 ARG A 123 -3.616 4.654 -46.672 1.00 0.00 N ATOM 0 H ARG A 123 -2.757 3.085 -41.035 1.00 0.00 H new ATOM 0 HA ARG A 123 -5.451 4.382 -40.995 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -3.978 3.187 -43.380 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -5.726 3.296 -43.338 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -5.270 5.372 -44.295 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -5.205 5.841 -42.608 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -3.028 6.457 -42.877 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -2.612 4.793 -43.237 1.00 0.00 H new ATOM 0 HE ARG A 123 -3.066 6.964 -45.243 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -0.808 4.866 -45.183 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -1.283 3.822 -46.527 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -4.552 5.059 -46.655 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -3.386 3.930 -47.353 1.00 0.00 H new ATOM 1838 N ARG A 124 -6.464 2.109 -40.571 1.00 0.00 N ATOM 1839 CA ARG A 124 -6.968 0.774 -40.143 1.00 0.00 C ATOM 1840 C ARG A 124 -8.412 0.599 -40.617 1.00 0.00 C ATOM 1841 O ARG A 124 -8.666 -0.351 -41.339 1.00 0.00 O ATOM 1842 CB ARG A 124 -6.918 0.674 -38.616 1.00 0.00 C ATOM 1843 CG ARG A 124 -7.399 -0.711 -38.180 1.00 0.00 C ATOM 1844 CD ARG A 124 -7.444 -0.780 -36.652 1.00 0.00 C ATOM 1845 NE ARG A 124 -8.841 -1.053 -36.210 1.00 0.00 N ATOM 1846 CZ ARG A 124 -9.178 -0.871 -34.961 1.00 0.00 C ATOM 1847 NH1 ARG A 124 -8.777 -1.713 -34.049 1.00 0.00 N ATOM 1848 NH2 ARG A 124 -9.913 0.154 -34.627 1.00 0.00 N ATOM 1849 OXT ARG A 124 -9.238 1.418 -40.251 1.00 0.00 O ATOM 0 H ARG A 124 -7.139 2.871 -40.500 1.00 0.00 H new ATOM 0 HA ARG A 124 -6.344 -0.006 -40.579 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -5.901 0.846 -38.263 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -7.545 1.446 -38.170 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -8.388 -0.910 -38.593 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -6.730 -1.479 -38.569 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -6.777 -1.564 -36.293 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -7.092 0.159 -36.224 1.00 0.00 H new ATOM 0 HE ARG A 124 -9.534 -1.382 -36.883 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -8.201 -2.513 -34.311 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -9.040 -1.572 -33.074 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -10.224 0.813 -35.341 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -10.176 0.297 -33.652 1.00 0.00 H new TER 1863 ARG A 124