USER MOD reduce.3.24.130724 H: found=0, std=0, add=1038, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1029 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 60 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 91 SER OG : rot -21:sc= 0.00515 USER MOD Set 2.1: A 32 ASN : amide:sc= 0.943 K(o=1,f=-3.3!) USER MOD Set 2.2: A 35 ASN : amide:sc= 0.0528 K(o=1,f=0.24) USER MOD Set 3.1: A 7 HIS : no HE2:sc= -0.979! C(o=-0.77!,f=-4.6!) USER MOD Set 3.2: A 8 HIS : no HE2:sc= 0.206 K(o=-0.77,f=-8.3!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -148:sc= 1.43 (180deg=-0.246) USER MOD Single : A 3 SER OG : rot 49:sc= 0.18 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 HIS : no HD1:sc= 0 X(o=0,f=-0.00075) USER MOD Single : A 10 HIS : no HD1:sc=-0.00724 X(o=-0.0072,f=-0.12) USER MOD Single : A 11 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 12 HIS : no HE2:sc= 0.0181 X(o=0.018,f=-0.15) USER MOD Single : A 13 MET CE :methyl -166:sc= 0 (180deg=-0.126) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl -156:sc= -0.999 (180deg=-3.75!) USER MOD Single : A 28 ASN : amide:sc= -0.573 K(o=-0.57,f=-0.073) USER MOD Single : A 29 LYS NZ :NH3+ -175:sc= 0.124 (180deg=0.118) USER MOD Single : A 37 HIS : no HD1:sc= -0.557 K(o=-0.56,f=-0.026) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ -167:sc= 1.21 (180deg=1.08) USER MOD Single : A 49 ASN : amide:sc= 0.227 X(o=0.23,f=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= -0.415 X(o=-0.41,f=0) USER MOD Single : A 54 LYS NZ :NH3+ -128:sc= 1.26 (180deg=-0.791) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot -168:sc= 0.469 USER MOD Single : A 75 ASN : amide:sc= -1.22 K(o=-1.2,f=-2.6!) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 142:sc= 0.201 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 82:sc= 0.0734 USER MOD Single : A 83 SER OG : rot 74:sc= 0.253 USER MOD Single : A 93 ASN : amide:sc= -0.0395 X(o=-0.04,f=-0.07) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -37:sc= 0 USER MOD Single : A 104 ASN : amide:sc= 0.428 X(o=0.43,f=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 TYR OH : rot 180:sc=-0.00707 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0.163 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 MET CE :methyl -170:sc= -0.335 (180deg=-0.452) USER MOD Single : A 125 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0237) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -10.897 -1.305 12.670 1.00 0.00 N ATOM 2 CA MET A 1 -9.928 -2.146 11.958 1.00 0.00 C ATOM 3 C MET A 1 -9.359 -1.379 10.778 1.00 0.00 C ATOM 4 O MET A 1 -10.085 -0.674 10.076 1.00 0.00 O ATOM 5 CB MET A 1 -10.498 -3.508 11.516 1.00 0.00 C ATOM 6 CG MET A 1 -11.722 -3.448 10.594 1.00 0.00 C ATOM 7 SD MET A 1 -13.231 -2.830 11.382 1.00 0.00 S ATOM 8 CE MET A 1 -14.347 -2.930 9.966 1.00 0.00 C ATOM 0 H1 MET A 1 -10.881 -1.539 13.683 1.00 0.00 H new ATOM 0 H2 MET A 1 -10.648 -0.303 12.541 1.00 0.00 H new ATOM 0 H3 MET A 1 -11.850 -1.476 12.291 1.00 0.00 H new ATOM 0 HA MET A 1 -9.131 -2.383 12.662 1.00 0.00 H new ATOM 0 HB2 MET A 1 -9.710 -4.063 11.008 1.00 0.00 H new ATOM 0 HB3 MET A 1 -10.765 -4.076 12.407 1.00 0.00 H new ATOM 0 HG2 MET A 1 -11.487 -2.812 9.741 1.00 0.00 H new ATOM 0 HG3 MET A 1 -11.915 -4.447 10.203 1.00 0.00 H new ATOM 0 HE1 MET A 1 -15.339 -2.586 10.260 1.00 0.00 H new ATOM 0 HE2 MET A 1 -13.969 -2.301 9.160 1.00 0.00 H new ATOM 0 HE3 MET A 1 -14.408 -3.963 9.623 1.00 0.00 H new ATOM 18 N GLY A 2 -8.059 -1.532 10.542 1.00 0.00 N ATOM 19 CA GLY A 2 -7.372 -0.863 9.449 1.00 0.00 C ATOM 20 C GLY A 2 -6.923 0.542 9.841 1.00 0.00 C ATOM 21 O GLY A 2 -7.405 1.110 10.825 1.00 0.00 O ATOM 0 H GLY A 2 -7.453 -2.126 11.107 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -6.505 -1.452 9.149 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -8.033 -0.806 8.584 1.00 0.00 H new ATOM 25 N SER A 3 -5.990 1.088 9.065 1.00 0.00 N ATOM 26 CA SER A 3 -5.423 2.409 9.260 1.00 0.00 C ATOM 27 C SER A 3 -6.446 3.464 8.835 1.00 0.00 C ATOM 28 O SER A 3 -6.617 3.713 7.638 1.00 0.00 O ATOM 29 CB SER A 3 -4.110 2.508 8.473 1.00 0.00 C ATOM 30 OG SER A 3 -4.319 2.182 7.111 1.00 0.00 O ATOM 0 H SER A 3 -5.599 0.602 8.258 1.00 0.00 H new ATOM 0 HA SER A 3 -5.192 2.587 10.310 1.00 0.00 H new ATOM 0 HB2 SER A 3 -3.707 3.518 8.553 1.00 0.00 H new ATOM 0 HB3 SER A 3 -3.370 1.834 8.904 1.00 0.00 H new ATOM 0 HG SER A 3 -5.092 2.679 6.770 1.00 0.00 H new ATOM 36 N ASP A 4 -7.136 4.062 9.801 1.00 0.00 N ATOM 37 CA ASP A 4 -8.226 5.018 9.619 1.00 0.00 C ATOM 38 C ASP A 4 -9.409 4.427 8.835 1.00 0.00 C ATOM 39 O ASP A 4 -10.348 3.908 9.451 1.00 0.00 O ATOM 40 CB ASP A 4 -7.724 6.364 9.064 1.00 0.00 C ATOM 41 CG ASP A 4 -8.819 7.436 9.046 1.00 0.00 C ATOM 42 OD1 ASP A 4 -9.902 7.246 9.639 1.00 0.00 O ATOM 43 OD2 ASP A 4 -8.595 8.518 8.460 1.00 0.00 O ATOM 0 H ASP A 4 -6.940 3.884 10.786 1.00 0.00 H new ATOM 0 HA ASP A 4 -8.627 5.237 10.609 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -6.888 6.714 9.669 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -7.346 6.218 8.052 1.00 0.00 H new ATOM 48 N LYS A 5 -9.372 4.464 7.498 1.00 0.00 N ATOM 49 CA LYS A 5 -10.539 4.453 6.600 1.00 0.00 C ATOM 50 C LYS A 5 -10.342 3.572 5.350 1.00 0.00 C ATOM 51 O LYS A 5 -10.944 3.830 4.301 1.00 0.00 O ATOM 52 CB LYS A 5 -10.889 5.920 6.258 1.00 0.00 C ATOM 53 CG LYS A 5 -9.744 6.661 5.541 1.00 0.00 C ATOM 54 CD LYS A 5 -9.907 8.188 5.512 1.00 0.00 C ATOM 55 CE LYS A 5 -8.515 8.820 5.370 1.00 0.00 C ATOM 56 NZ LYS A 5 -8.558 10.290 5.260 1.00 0.00 N ATOM 0 H LYS A 5 -8.490 4.504 6.987 1.00 0.00 H new ATOM 0 HA LYS A 5 -11.381 3.986 7.112 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -11.777 5.938 5.627 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -11.139 6.451 7.176 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -8.803 6.416 6.033 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -9.673 6.294 4.517 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -10.546 8.486 4.680 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -10.390 8.535 6.425 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -7.907 8.543 6.231 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -8.024 8.409 4.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -7.590 10.660 5.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -9.114 10.559 4.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -9.000 10.689 6.112 1.00 0.00 H new ATOM 70 N ILE A 6 -9.472 2.561 5.427 1.00 0.00 N ATOM 71 CA ILE A 6 -9.106 1.716 4.288 1.00 0.00 C ATOM 72 C ILE A 6 -10.346 1.047 3.695 1.00 0.00 C ATOM 73 O ILE A 6 -11.187 0.533 4.439 1.00 0.00 O ATOM 74 CB ILE A 6 -8.054 0.666 4.721 1.00 0.00 C ATOM 75 CG1 ILE A 6 -6.761 1.322 5.239 1.00 0.00 C ATOM 76 CG2 ILE A 6 -7.706 -0.359 3.622 1.00 0.00 C ATOM 77 CD1 ILE A 6 -6.150 2.390 4.316 1.00 0.00 C ATOM 0 H ILE A 6 -8.997 2.304 6.292 1.00 0.00 H new ATOM 0 HA ILE A 6 -8.664 2.341 3.512 1.00 0.00 H new ATOM 0 HB ILE A 6 -8.533 0.120 5.534 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -6.967 1.777 6.208 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -6.019 0.541 5.405 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -6.963 -1.061 4.001 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -8.605 -0.903 3.334 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -7.303 0.162 2.753 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -5.244 2.790 4.772 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -5.905 1.942 3.353 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -6.868 3.197 4.168 1.00 0.00 H new ATOM 89 N HIS A 7 -10.415 1.034 2.361 1.00 0.00 N ATOM 90 CA HIS A 7 -11.251 0.160 1.550 1.00 0.00 C ATOM 91 C HIS A 7 -10.744 0.218 0.096 1.00 0.00 C ATOM 92 O HIS A 7 -10.023 -0.678 -0.333 1.00 0.00 O ATOM 93 CB HIS A 7 -12.752 0.483 1.711 1.00 0.00 C ATOM 94 CG HIS A 7 -13.167 1.900 1.392 1.00 0.00 C ATOM 95 ND1 HIS A 7 -12.676 3.068 1.949 1.00 0.00 N ATOM 96 CD2 HIS A 7 -14.072 2.246 0.427 1.00 0.00 C ATOM 97 CE1 HIS A 7 -13.255 4.093 1.299 1.00 0.00 C ATOM 98 NE2 HIS A 7 -14.090 3.640 0.348 1.00 0.00 N ATOM 0 H HIS A 7 -9.856 1.670 1.792 1.00 0.00 H new ATOM 0 HA HIS A 7 -11.167 -0.871 1.894 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -13.319 -0.192 1.070 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -13.041 0.264 2.739 1.00 0.00 H new ATOM 0 HD1 HIS A 7 -12.001 3.138 2.710 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -14.665 1.565 -0.166 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -13.074 5.136 1.512 1.00 0.00 H new ATOM 106 N HIS A 8 -11.068 1.277 -0.658 1.00 0.00 N ATOM 107 CA HIS A 8 -10.657 1.462 -2.051 1.00 0.00 C ATOM 108 C HIS A 8 -9.129 1.494 -2.157 1.00 0.00 C ATOM 109 O HIS A 8 -8.490 2.390 -1.588 1.00 0.00 O ATOM 110 CB HIS A 8 -11.270 2.756 -2.616 1.00 0.00 C ATOM 111 CG HIS A 8 -12.657 2.565 -3.178 1.00 0.00 C ATOM 112 ND1 HIS A 8 -13.848 2.907 -2.574 1.00 0.00 N ATOM 113 CD2 HIS A 8 -12.951 2.033 -4.406 1.00 0.00 C ATOM 114 CE1 HIS A 8 -14.842 2.543 -3.403 1.00 0.00 C ATOM 115 NE2 HIS A 8 -14.342 2.023 -4.539 1.00 0.00 N ATOM 0 H HIS A 8 -11.637 2.046 -0.305 1.00 0.00 H new ATOM 0 HA HIS A 8 -11.021 0.621 -2.641 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -11.306 3.507 -1.827 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -10.619 3.146 -3.399 1.00 0.00 H new ATOM 0 HD1 HIS A 8 -13.956 3.355 -1.664 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -12.237 1.685 -5.138 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -15.895 2.653 -3.187 1.00 0.00 H new ATOM 123 N HIS A 9 -8.531 0.520 -2.853 1.00 0.00 N ATOM 124 CA HIS A 9 -7.077 0.418 -2.981 1.00 0.00 C ATOM 125 C HIS A 9 -6.602 -0.092 -4.354 1.00 0.00 C ATOM 126 O HIS A 9 -5.447 -0.512 -4.478 1.00 0.00 O ATOM 127 CB HIS A 9 -6.498 -0.367 -1.785 1.00 0.00 C ATOM 128 CG HIS A 9 -6.628 -1.872 -1.817 1.00 0.00 C ATOM 129 ND1 HIS A 9 -5.602 -2.755 -1.559 1.00 0.00 N ATOM 130 CD2 HIS A 9 -7.758 -2.608 -2.056 1.00 0.00 C ATOM 131 CE1 HIS A 9 -6.092 -4.000 -1.689 1.00 0.00 C ATOM 132 NE2 HIS A 9 -7.397 -3.959 -1.995 1.00 0.00 N ATOM 0 H HIS A 9 -9.041 -0.216 -3.341 1.00 0.00 H new ATOM 0 HA HIS A 9 -6.670 1.428 -2.943 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -5.439 -0.121 -1.701 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -6.982 -0.006 -0.878 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -8.745 -2.218 -2.255 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -5.516 -4.905 -1.565 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -8.009 -4.759 -2.153 1.00 0.00 H new ATOM 140 N HIS A 10 -7.460 -0.060 -5.381 1.00 0.00 N ATOM 141 CA HIS A 10 -7.053 -0.298 -6.765 1.00 0.00 C ATOM 142 C HIS A 10 -6.424 0.967 -7.365 1.00 0.00 C ATOM 143 O HIS A 10 -6.970 2.057 -7.168 1.00 0.00 O ATOM 144 CB HIS A 10 -8.261 -0.690 -7.632 1.00 0.00 C ATOM 145 CG HIS A 10 -8.568 -2.163 -7.700 1.00 0.00 C ATOM 146 ND1 HIS A 10 -7.645 -3.173 -7.856 1.00 0.00 N ATOM 147 CD2 HIS A 10 -9.812 -2.721 -7.828 1.00 0.00 C ATOM 148 CE1 HIS A 10 -8.308 -4.319 -8.055 1.00 0.00 C ATOM 149 NE2 HIS A 10 -9.629 -4.095 -8.037 1.00 0.00 N ATOM 0 H HIS A 10 -8.456 0.132 -5.272 1.00 0.00 H new ATOM 0 HA HIS A 10 -6.327 -1.111 -6.756 1.00 0.00 H new ATOM 0 HB2 HIS A 10 -9.141 -0.172 -7.251 1.00 0.00 H new ATOM 0 HB3 HIS A 10 -8.090 -0.326 -8.645 1.00 0.00 H new ATOM 0 HD2 HIS A 10 -10.757 -2.200 -7.777 1.00 0.00 H new ATOM 0 HE1 HIS A 10 -7.846 -5.283 -8.208 1.00 0.00 H new ATOM 0 HE2 HIS A 10 -10.363 -4.793 -8.153 1.00 0.00 H new ATOM 157 N HIS A 11 -5.372 0.782 -8.175 1.00 0.00 N ATOM 158 CA HIS A 11 -4.675 1.745 -9.034 1.00 0.00 C ATOM 159 C HIS A 11 -4.688 3.176 -8.487 1.00 0.00 C ATOM 160 O HIS A 11 -5.512 4.007 -8.880 1.00 0.00 O ATOM 161 CB HIS A 11 -5.187 1.666 -10.485 1.00 0.00 C ATOM 162 CG HIS A 11 -4.561 0.552 -11.290 1.00 0.00 C ATOM 163 ND1 HIS A 11 -5.193 -0.575 -11.761 1.00 0.00 N ATOM 164 CD2 HIS A 11 -3.273 0.524 -11.752 1.00 0.00 C ATOM 165 CE1 HIS A 11 -4.300 -1.274 -12.486 1.00 0.00 C ATOM 166 NE2 HIS A 11 -3.108 -0.646 -12.500 1.00 0.00 N ATOM 0 H HIS A 11 -4.946 -0.142 -8.251 1.00 0.00 H new ATOM 0 HA HIS A 11 -3.625 1.454 -9.035 1.00 0.00 H new ATOM 0 HB2 HIS A 11 -6.268 1.530 -10.472 1.00 0.00 H new ATOM 0 HB3 HIS A 11 -4.991 2.616 -10.982 1.00 0.00 H new ATOM 0 HD2 HIS A 11 -2.517 1.274 -11.571 1.00 0.00 H new ATOM 0 HE1 HIS A 11 -4.510 -2.208 -12.987 1.00 0.00 H new ATOM 0 HE2 HIS A 11 -2.256 -0.961 -12.963 1.00 0.00 H new ATOM 174 N HIS A 12 -3.738 3.460 -7.597 1.00 0.00 N ATOM 175 CA HIS A 12 -3.603 4.733 -6.902 1.00 0.00 C ATOM 176 C HIS A 12 -2.200 5.340 -7.064 1.00 0.00 C ATOM 177 O HIS A 12 -1.800 6.186 -6.263 1.00 0.00 O ATOM 178 CB HIS A 12 -4.014 4.543 -5.435 1.00 0.00 C ATOM 179 CG HIS A 12 -4.773 5.734 -4.923 1.00 0.00 C ATOM 180 ND1 HIS A 12 -4.281 7.009 -4.749 1.00 0.00 N ATOM 181 CD2 HIS A 12 -6.101 5.746 -4.600 1.00 0.00 C ATOM 182 CE1 HIS A 12 -5.296 7.780 -4.329 1.00 0.00 C ATOM 183 NE2 HIS A 12 -6.420 7.050 -4.209 1.00 0.00 N ATOM 0 H HIS A 12 -3.019 2.786 -7.333 1.00 0.00 H new ATOM 0 HA HIS A 12 -4.273 5.464 -7.354 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -4.630 3.648 -5.340 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -3.126 4.385 -4.824 1.00 0.00 H new ATOM 0 HD1 HIS A 12 -3.320 7.312 -4.910 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -6.778 4.905 -4.639 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -5.221 8.836 -4.117 1.00 0.00 H new ATOM 191 N MET A 13 -1.472 4.920 -8.104 1.00 0.00 N ATOM 192 CA MET A 13 -0.100 5.249 -8.503 1.00 0.00 C ATOM 193 C MET A 13 0.880 4.252 -7.894 1.00 0.00 C ATOM 194 O MET A 13 0.685 3.761 -6.780 1.00 0.00 O ATOM 195 CB MET A 13 0.295 6.711 -8.227 1.00 0.00 C ATOM 196 CG MET A 13 1.574 7.161 -8.946 1.00 0.00 C ATOM 197 SD MET A 13 3.072 7.255 -7.930 1.00 0.00 S ATOM 198 CE MET A 13 2.644 8.639 -6.830 1.00 0.00 C ATOM 0 H MET A 13 -1.881 4.261 -8.766 1.00 0.00 H new ATOM 0 HA MET A 13 -0.053 5.158 -9.588 1.00 0.00 H new ATOM 0 HB2 MET A 13 -0.526 7.361 -8.528 1.00 0.00 H new ATOM 0 HB3 MET A 13 0.429 6.843 -7.153 1.00 0.00 H new ATOM 0 HG2 MET A 13 1.762 6.475 -9.772 1.00 0.00 H new ATOM 0 HG3 MET A 13 1.394 8.143 -9.383 1.00 0.00 H new ATOM 0 HE1 MET A 13 3.541 8.986 -6.316 1.00 0.00 H new ATOM 0 HE2 MET A 13 2.224 9.455 -7.418 1.00 0.00 H new ATOM 0 HE3 MET A 13 1.911 8.306 -6.095 1.00 0.00 H new ATOM 208 N PHE A 14 1.923 3.937 -8.660 1.00 0.00 N ATOM 209 CA PHE A 14 2.836 2.836 -8.427 1.00 0.00 C ATOM 210 C PHE A 14 4.259 3.290 -8.800 1.00 0.00 C ATOM 211 O PHE A 14 4.669 3.081 -9.941 1.00 0.00 O ATOM 212 CB PHE A 14 2.366 1.642 -9.281 1.00 0.00 C ATOM 213 CG PHE A 14 1.167 0.847 -8.777 1.00 0.00 C ATOM 214 CD1 PHE A 14 1.106 0.397 -7.441 1.00 0.00 C ATOM 215 CD2 PHE A 14 0.167 0.437 -9.682 1.00 0.00 C ATOM 216 CE1 PHE A 14 0.123 -0.527 -7.048 1.00 0.00 C ATOM 217 CE2 PHE A 14 -0.842 -0.456 -9.279 1.00 0.00 C ATOM 218 CZ PHE A 14 -0.835 -0.970 -7.974 1.00 0.00 C ATOM 0 H PHE A 14 2.159 4.471 -9.496 1.00 0.00 H new ATOM 0 HA PHE A 14 2.848 2.530 -7.381 1.00 0.00 H new ATOM 0 HB2 PHE A 14 2.129 2.014 -10.278 1.00 0.00 H new ATOM 0 HB3 PHE A 14 3.205 0.954 -9.389 1.00 0.00 H new ATOM 0 HD1 PHE A 14 1.818 0.765 -6.717 1.00 0.00 H new ATOM 0 HD2 PHE A 14 0.176 0.812 -10.695 1.00 0.00 H new ATOM 0 HE1 PHE A 14 0.104 -0.897 -6.033 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -1.619 -0.745 -9.971 1.00 0.00 H new ATOM 0 HZ PHE A 14 -1.568 -1.708 -7.681 1.00 0.00 H new ATOM 228 N PRO A 15 5.012 3.926 -7.884 1.00 0.00 N ATOM 229 CA PRO A 15 6.362 4.417 -8.151 1.00 0.00 C ATOM 230 C PRO A 15 7.378 3.267 -8.035 1.00 0.00 C ATOM 231 O PRO A 15 8.156 3.193 -7.078 1.00 0.00 O ATOM 232 CB PRO A 15 6.565 5.531 -7.115 1.00 0.00 C ATOM 233 CG PRO A 15 5.781 5.029 -5.902 1.00 0.00 C ATOM 234 CD PRO A 15 4.608 4.269 -6.524 1.00 0.00 C ATOM 0 HA PRO A 15 6.504 4.804 -9.160 1.00 0.00 H new ATOM 0 HB2 PRO A 15 7.620 5.675 -6.881 1.00 0.00 H new ATOM 0 HB3 PRO A 15 6.184 6.488 -7.473 1.00 0.00 H new ATOM 0 HG2 PRO A 15 6.389 4.381 -5.271 1.00 0.00 H new ATOM 0 HG3 PRO A 15 5.439 5.853 -5.276 1.00 0.00 H new ATOM 0 HD2 PRO A 15 4.379 3.372 -5.949 1.00 0.00 H new ATOM 0 HD3 PRO A 15 3.707 4.883 -6.530 1.00 0.00 H new ATOM 242 N TYR A 16 7.336 2.301 -8.959 1.00 0.00 N ATOM 243 CA TYR A 16 8.224 1.143 -8.929 1.00 0.00 C ATOM 244 C TYR A 16 8.327 0.488 -10.318 1.00 0.00 C ATOM 245 O TYR A 16 7.462 0.697 -11.172 1.00 0.00 O ATOM 246 CB TYR A 16 7.706 0.165 -7.848 1.00 0.00 C ATOM 247 CG TYR A 16 6.546 -0.711 -8.262 1.00 0.00 C ATOM 248 CD1 TYR A 16 6.790 -1.926 -8.922 1.00 0.00 C ATOM 249 CD2 TYR A 16 5.231 -0.349 -7.929 1.00 0.00 C ATOM 250 CE1 TYR A 16 5.724 -2.751 -9.304 1.00 0.00 C ATOM 251 CE2 TYR A 16 4.167 -1.215 -8.235 1.00 0.00 C ATOM 252 CZ TYR A 16 4.405 -2.407 -8.960 1.00 0.00 C ATOM 253 OH TYR A 16 3.420 -3.282 -9.295 1.00 0.00 O ATOM 0 H TYR A 16 6.686 2.303 -9.745 1.00 0.00 H new ATOM 0 HA TYR A 16 9.238 1.449 -8.670 1.00 0.00 H new ATOM 0 HB2 TYR A 16 8.531 -0.477 -7.539 1.00 0.00 H new ATOM 0 HB3 TYR A 16 7.407 0.743 -6.974 1.00 0.00 H new ATOM 0 HD1 TYR A 16 7.805 -2.226 -9.136 1.00 0.00 H new ATOM 0 HD2 TYR A 16 5.037 0.593 -7.438 1.00 0.00 H new ATOM 0 HE1 TYR A 16 5.916 -3.654 -9.864 1.00 0.00 H new ATOM 0 HE2 TYR A 16 3.165 -0.970 -7.916 1.00 0.00 H new ATOM 0 HH TYR A 16 2.555 -2.928 -9.001 1.00 0.00 H new ATOM 263 N LYS A 17 9.329 -0.379 -10.532 1.00 0.00 N ATOM 264 CA LYS A 17 9.388 -1.322 -11.660 1.00 0.00 C ATOM 265 C LYS A 17 9.619 -2.747 -11.147 1.00 0.00 C ATOM 266 O LYS A 17 9.934 -2.933 -9.971 1.00 0.00 O ATOM 267 CB LYS A 17 10.424 -0.902 -12.724 1.00 0.00 C ATOM 268 CG LYS A 17 11.869 -1.267 -12.352 1.00 0.00 C ATOM 269 CD LYS A 17 12.867 -1.279 -13.506 1.00 0.00 C ATOM 270 CE LYS A 17 13.182 0.143 -13.947 1.00 0.00 C ATOM 271 NZ LYS A 17 12.728 0.439 -15.318 1.00 0.00 N ATOM 0 H LYS A 17 10.137 -0.445 -9.913 1.00 0.00 H new ATOM 0 HA LYS A 17 8.424 -1.301 -12.168 1.00 0.00 H new ATOM 0 HB2 LYS A 17 10.171 -1.376 -13.672 1.00 0.00 H new ATOM 0 HB3 LYS A 17 10.358 0.175 -12.878 1.00 0.00 H new ATOM 0 HG2 LYS A 17 12.220 -0.561 -11.600 1.00 0.00 H new ATOM 0 HG3 LYS A 17 11.867 -2.253 -11.887 1.00 0.00 H new ATOM 0 HD2 LYS A 17 13.783 -1.783 -13.198 1.00 0.00 H new ATOM 0 HD3 LYS A 17 12.458 -1.845 -14.343 1.00 0.00 H new ATOM 0 HE2 LYS A 17 12.712 0.843 -13.256 1.00 0.00 H new ATOM 0 HE3 LYS A 17 14.258 0.306 -13.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 12.971 1.421 -15.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 13.195 -0.208 -15.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 11.697 0.313 -15.377 1.00 0.00 H new ATOM 285 N ILE A 18 9.569 -3.738 -12.035 1.00 0.00 N ATOM 286 CA ILE A 18 9.974 -5.115 -11.762 1.00 0.00 C ATOM 287 C ILE A 18 11.068 -5.444 -12.771 1.00 0.00 C ATOM 288 O ILE A 18 10.924 -5.128 -13.955 1.00 0.00 O ATOM 289 CB ILE A 18 8.754 -6.055 -11.896 1.00 0.00 C ATOM 290 CG1 ILE A 18 7.673 -5.772 -10.832 1.00 0.00 C ATOM 291 CG2 ILE A 18 9.151 -7.539 -11.849 1.00 0.00 C ATOM 292 CD1 ILE A 18 7.952 -6.354 -9.468 1.00 0.00 C ATOM 0 H ILE A 18 9.237 -3.601 -12.990 1.00 0.00 H new ATOM 0 HA ILE A 18 10.352 -5.244 -10.748 1.00 0.00 H new ATOM 0 HB ILE A 18 8.332 -5.843 -12.878 1.00 0.00 H new ATOM 0 HG12 ILE A 18 7.556 -4.693 -10.733 1.00 0.00 H new ATOM 0 HG13 ILE A 18 6.721 -6.164 -11.190 1.00 0.00 H new ATOM 0 HG21 ILE A 18 8.259 -8.158 -11.947 1.00 0.00 H new ATOM 0 HG22 ILE A 18 9.836 -7.758 -12.668 1.00 0.00 H new ATOM 0 HG23 ILE A 18 9.640 -7.755 -10.899 1.00 0.00 H new ATOM 0 HD11 ILE A 18 7.136 -6.101 -8.791 1.00 0.00 H new ATOM 0 HD12 ILE A 18 8.037 -7.438 -9.545 1.00 0.00 H new ATOM 0 HD13 ILE A 18 8.885 -5.944 -9.081 1.00 0.00 H new ATOM 304 N VAL A 19 12.151 -6.074 -12.334 1.00 0.00 N ATOM 305 CA VAL A 19 13.176 -6.680 -13.155 1.00 0.00 C ATOM 306 C VAL A 19 13.164 -8.196 -12.891 1.00 0.00 C ATOM 307 O VAL A 19 12.270 -8.672 -12.192 1.00 0.00 O ATOM 308 CB VAL A 19 14.518 -6.000 -12.835 1.00 0.00 C ATOM 309 CG1 VAL A 19 14.522 -4.501 -13.175 1.00 0.00 C ATOM 310 CG2 VAL A 19 14.947 -6.161 -11.373 1.00 0.00 C ATOM 0 H VAL A 19 12.343 -6.178 -11.338 1.00 0.00 H new ATOM 0 HA VAL A 19 13.000 -6.540 -14.222 1.00 0.00 H new ATOM 0 HB VAL A 19 15.234 -6.519 -13.472 1.00 0.00 H new ATOM 0 HG11 VAL A 19 15.494 -4.075 -12.928 1.00 0.00 H new ATOM 0 HG12 VAL A 19 14.327 -4.369 -14.239 1.00 0.00 H new ATOM 0 HG13 VAL A 19 13.747 -3.995 -12.599 1.00 0.00 H new ATOM 0 HG21 VAL A 19 15.901 -5.658 -11.216 1.00 0.00 H new ATOM 0 HG22 VAL A 19 14.193 -5.719 -10.722 1.00 0.00 H new ATOM 0 HG23 VAL A 19 15.053 -7.220 -11.139 1.00 0.00 H new ATOM 320 N ASP A 20 14.184 -8.911 -13.386 1.00 0.00 N ATOM 321 CA ASP A 20 14.355 -10.368 -13.453 1.00 0.00 C ATOM 322 C ASP A 20 13.545 -11.133 -12.408 1.00 0.00 C ATOM 323 O ASP A 20 12.651 -11.894 -12.773 1.00 0.00 O ATOM 324 CB ASP A 20 15.853 -10.673 -13.312 1.00 0.00 C ATOM 325 CG ASP A 20 16.149 -12.167 -13.235 1.00 0.00 C ATOM 326 OD1 ASP A 20 16.396 -12.781 -14.296 1.00 0.00 O ATOM 327 OD2 ASP A 20 16.241 -12.714 -12.113 1.00 0.00 O ATOM 0 H ASP A 20 14.990 -8.435 -13.790 1.00 0.00 H new ATOM 0 HA ASP A 20 13.970 -10.710 -14.414 1.00 0.00 H new ATOM 0 HB2 ASP A 20 16.387 -10.245 -14.160 1.00 0.00 H new ATOM 0 HB3 ASP A 20 16.235 -10.185 -12.415 1.00 0.00 H new ATOM 332 N ASP A 21 13.802 -10.890 -11.121 1.00 0.00 N ATOM 333 CA ASP A 21 12.865 -11.241 -10.055 1.00 0.00 C ATOM 334 C ASP A 21 12.901 -10.220 -8.908 1.00 0.00 C ATOM 335 O ASP A 21 12.456 -10.503 -7.797 1.00 0.00 O ATOM 336 CB ASP A 21 13.040 -12.712 -9.627 1.00 0.00 C ATOM 337 CG ASP A 21 13.731 -12.951 -8.284 1.00 0.00 C ATOM 338 OD1 ASP A 21 14.926 -12.605 -8.124 1.00 0.00 O ATOM 339 OD2 ASP A 21 13.077 -13.556 -7.400 1.00 0.00 O ATOM 0 H ASP A 21 14.660 -10.447 -10.791 1.00 0.00 H new ATOM 0 HA ASP A 21 11.848 -11.177 -10.441 1.00 0.00 H new ATOM 0 HB2 ASP A 21 12.055 -13.177 -9.592 1.00 0.00 H new ATOM 0 HB3 ASP A 21 13.609 -13.228 -10.401 1.00 0.00 H new ATOM 344 N VAL A 22 13.403 -9.007 -9.156 1.00 0.00 N ATOM 345 CA VAL A 22 13.570 -7.993 -8.112 1.00 0.00 C ATOM 346 C VAL A 22 12.567 -6.868 -8.341 1.00 0.00 C ATOM 347 O VAL A 22 12.363 -6.409 -9.466 1.00 0.00 O ATOM 348 CB VAL A 22 15.040 -7.513 -7.957 1.00 0.00 C ATOM 349 CG1 VAL A 22 15.158 -6.714 -6.653 1.00 0.00 C ATOM 350 CG2 VAL A 22 16.031 -8.688 -7.948 1.00 0.00 C ATOM 0 H VAL A 22 13.704 -8.702 -10.082 1.00 0.00 H new ATOM 0 HA VAL A 22 13.349 -8.443 -7.144 1.00 0.00 H new ATOM 0 HB VAL A 22 15.294 -6.888 -8.813 1.00 0.00 H new ATOM 0 HG11 VAL A 22 16.185 -6.370 -6.529 1.00 0.00 H new ATOM 0 HG12 VAL A 22 14.489 -5.854 -6.691 1.00 0.00 H new ATOM 0 HG13 VAL A 22 14.884 -7.350 -5.811 1.00 0.00 H new ATOM 0 HG21 VAL A 22 17.046 -8.307 -7.838 1.00 0.00 H new ATOM 0 HG22 VAL A 22 15.800 -9.352 -7.115 1.00 0.00 H new ATOM 0 HG23 VAL A 22 15.950 -9.239 -8.885 1.00 0.00 H new ATOM 360 N VAL A 23 11.930 -6.417 -7.266 1.00 0.00 N ATOM 361 CA VAL A 23 11.069 -5.245 -7.267 1.00 0.00 C ATOM 362 C VAL A 23 11.969 -4.036 -7.059 1.00 0.00 C ATOM 363 O VAL A 23 12.718 -4.007 -6.086 1.00 0.00 O ATOM 364 CB VAL A 23 10.030 -5.386 -6.139 1.00 0.00 C ATOM 365 CG1 VAL A 23 9.101 -4.168 -6.094 1.00 0.00 C ATOM 366 CG2 VAL A 23 9.192 -6.663 -6.282 1.00 0.00 C ATOM 0 H VAL A 23 12.001 -6.866 -6.353 1.00 0.00 H new ATOM 0 HA VAL A 23 10.521 -5.134 -8.203 1.00 0.00 H new ATOM 0 HB VAL A 23 10.590 -5.449 -5.206 1.00 0.00 H new ATOM 0 HG11 VAL A 23 8.377 -4.292 -5.289 1.00 0.00 H new ATOM 0 HG12 VAL A 23 9.690 -3.268 -5.917 1.00 0.00 H new ATOM 0 HG13 VAL A 23 8.575 -4.076 -7.044 1.00 0.00 H new ATOM 0 HG21 VAL A 23 8.473 -6.720 -5.465 1.00 0.00 H new ATOM 0 HG22 VAL A 23 8.660 -6.644 -7.233 1.00 0.00 H new ATOM 0 HG23 VAL A 23 9.847 -7.534 -6.250 1.00 0.00 H new ATOM 376 N ILE A 24 11.923 -3.038 -7.941 1.00 0.00 N ATOM 377 CA ILE A 24 12.651 -1.793 -7.741 1.00 0.00 C ATOM 378 C ILE A 24 11.637 -0.757 -7.302 1.00 0.00 C ATOM 379 O ILE A 24 10.851 -0.276 -8.113 1.00 0.00 O ATOM 380 CB ILE A 24 13.407 -1.304 -8.988 1.00 0.00 C ATOM 381 CG1 ILE A 24 14.036 -2.387 -9.881 1.00 0.00 C ATOM 382 CG2 ILE A 24 14.456 -0.289 -8.510 1.00 0.00 C ATOM 383 CD1 ILE A 24 14.895 -3.415 -9.168 1.00 0.00 C ATOM 0 H ILE A 24 11.384 -3.072 -8.806 1.00 0.00 H new ATOM 0 HA ILE A 24 13.424 -1.960 -6.991 1.00 0.00 H new ATOM 0 HB ILE A 24 12.668 -0.859 -9.654 1.00 0.00 H new ATOM 0 HG12 ILE A 24 13.235 -2.910 -10.404 1.00 0.00 H new ATOM 0 HG13 ILE A 24 14.645 -1.896 -10.640 1.00 0.00 H new ATOM 0 HG21 ILE A 24 15.017 0.085 -9.366 1.00 0.00 H new ATOM 0 HG22 ILE A 24 13.957 0.543 -8.012 1.00 0.00 H new ATOM 0 HG23 ILE A 24 15.139 -0.773 -7.812 1.00 0.00 H new ATOM 0 HD11 ILE A 24 15.286 -4.128 -9.893 1.00 0.00 H new ATOM 0 HD12 ILE A 24 15.724 -2.913 -8.669 1.00 0.00 H new ATOM 0 HD13 ILE A 24 14.293 -3.943 -8.429 1.00 0.00 H new ATOM 395 N LEU A 25 11.632 -0.434 -6.020 1.00 0.00 N ATOM 396 CA LEU A 25 10.835 0.639 -5.457 1.00 0.00 C ATOM 397 C LEU A 25 11.602 1.921 -5.811 1.00 0.00 C ATOM 398 O LEU A 25 12.801 2.015 -5.524 1.00 0.00 O ATOM 399 CB LEU A 25 10.651 0.399 -3.946 1.00 0.00 C ATOM 400 CG LEU A 25 10.110 -1.021 -3.632 1.00 0.00 C ATOM 401 CD1 LEU A 25 10.217 -1.349 -2.148 1.00 0.00 C ATOM 402 CD2 LEU A 25 8.658 -1.239 -4.066 1.00 0.00 C ATOM 0 H LEU A 25 12.197 -0.924 -5.326 1.00 0.00 H new ATOM 0 HA LEU A 25 9.821 0.705 -5.852 1.00 0.00 H new ATOM 0 HB2 LEU A 25 11.606 0.541 -3.440 1.00 0.00 H new ATOM 0 HB3 LEU A 25 9.964 1.143 -3.544 1.00 0.00 H new ATOM 0 HG LEU A 25 10.744 -1.688 -4.216 1.00 0.00 H new ATOM 0 HD11 LEU A 25 9.828 -2.351 -1.968 1.00 0.00 H new ATOM 0 HD12 LEU A 25 11.262 -1.304 -1.840 1.00 0.00 H new ATOM 0 HD13 LEU A 25 9.638 -0.627 -1.573 1.00 0.00 H new ATOM 0 HD21 LEU A 25 8.351 -2.254 -3.813 1.00 0.00 H new ATOM 0 HD22 LEU A 25 8.014 -0.526 -3.551 1.00 0.00 H new ATOM 0 HD23 LEU A 25 8.574 -1.092 -5.143 1.00 0.00 H new ATOM 414 N MET A 26 10.965 2.866 -6.503 1.00 0.00 N ATOM 415 CA MET A 26 11.619 4.017 -7.126 1.00 0.00 C ATOM 416 C MET A 26 10.952 5.307 -6.633 1.00 0.00 C ATOM 417 O MET A 26 10.171 5.908 -7.369 1.00 0.00 O ATOM 418 CB MET A 26 11.573 3.889 -8.660 1.00 0.00 C ATOM 419 CG MET A 26 12.488 2.782 -9.192 1.00 0.00 C ATOM 420 SD MET A 26 12.519 2.703 -11.003 1.00 0.00 S ATOM 421 CE MET A 26 14.112 1.900 -11.316 1.00 0.00 C ATOM 0 H MET A 26 9.956 2.852 -6.649 1.00 0.00 H new ATOM 0 HA MET A 26 12.670 4.050 -6.839 1.00 0.00 H new ATOM 0 HB2 MET A 26 10.548 3.688 -8.972 1.00 0.00 H new ATOM 0 HB3 MET A 26 11.862 4.840 -9.108 1.00 0.00 H new ATOM 0 HG2 MET A 26 13.500 2.946 -8.823 1.00 0.00 H new ATOM 0 HG3 MET A 26 12.156 1.822 -8.797 1.00 0.00 H new ATOM 0 HE1 MET A 26 14.460 2.159 -12.316 1.00 0.00 H new ATOM 0 HE2 MET A 26 14.841 2.238 -10.579 1.00 0.00 H new ATOM 0 HE3 MET A 26 13.995 0.819 -11.241 1.00 0.00 H new ATOM 431 N PRO A 27 11.233 5.745 -5.394 1.00 0.00 N ATOM 432 CA PRO A 27 10.612 6.929 -4.831 1.00 0.00 C ATOM 433 C PRO A 27 11.063 8.185 -5.573 1.00 0.00 C ATOM 434 O PRO A 27 12.246 8.359 -5.890 1.00 0.00 O ATOM 435 CB PRO A 27 11.043 6.959 -3.364 1.00 0.00 C ATOM 436 CG PRO A 27 12.381 6.235 -3.372 1.00 0.00 C ATOM 437 CD PRO A 27 12.122 5.149 -4.412 1.00 0.00 C ATOM 0 HA PRO A 27 9.526 6.901 -4.923 1.00 0.00 H new ATOM 0 HB2 PRO A 27 11.141 7.980 -2.995 1.00 0.00 H new ATOM 0 HB3 PRO A 27 10.319 6.457 -2.723 1.00 0.00 H new ATOM 0 HG2 PRO A 27 13.203 6.892 -3.658 1.00 0.00 H new ATOM 0 HG3 PRO A 27 12.630 5.819 -2.396 1.00 0.00 H new ATOM 0 HD2 PRO A 27 13.053 4.821 -4.875 1.00 0.00 H new ATOM 0 HD3 PRO A 27 11.667 4.270 -3.955 1.00 0.00 H new ATOM 445 N ASN A 28 10.108 9.082 -5.769 1.00 0.00 N ATOM 446 CA ASN A 28 10.225 10.434 -6.272 1.00 0.00 C ATOM 447 C ASN A 28 9.480 11.395 -5.337 1.00 0.00 C ATOM 448 O ASN A 28 8.510 12.038 -5.734 1.00 0.00 O ATOM 449 CB ASN A 28 9.801 10.539 -7.754 1.00 0.00 C ATOM 450 CG ASN A 28 8.432 9.991 -8.182 1.00 0.00 C ATOM 451 OD1 ASN A 28 8.223 9.741 -9.366 1.00 0.00 O ATOM 452 ND2 ASN A 28 7.448 9.833 -7.321 1.00 0.00 N ATOM 0 H ASN A 28 9.137 8.853 -5.557 1.00 0.00 H new ATOM 0 HA ASN A 28 11.273 10.733 -6.269 1.00 0.00 H new ATOM 0 HB2 ASN A 28 9.834 11.593 -8.031 1.00 0.00 H new ATOM 0 HB3 ASN A 28 10.559 10.030 -8.349 1.00 0.00 H new ATOM 0 HD21 ASN A 28 6.536 9.509 -7.643 1.00 0.00 H new ATOM 0 HD22 ASN A 28 7.598 10.034 -6.332 1.00 0.00 H new ATOM 459 N LYS A 29 9.980 11.544 -4.102 1.00 0.00 N ATOM 460 CA LYS A 29 9.617 12.583 -3.116 1.00 0.00 C ATOM 461 C LYS A 29 8.207 12.413 -2.537 1.00 0.00 C ATOM 462 O LYS A 29 7.749 13.252 -1.766 1.00 0.00 O ATOM 463 CB LYS A 29 9.829 14.016 -3.668 1.00 0.00 C ATOM 464 CG LYS A 29 11.292 14.456 -3.819 1.00 0.00 C ATOM 465 CD LYS A 29 12.135 13.698 -4.852 1.00 0.00 C ATOM 466 CE LYS A 29 11.635 13.833 -6.296 1.00 0.00 C ATOM 467 NZ LYS A 29 12.435 14.822 -7.041 1.00 0.00 N ATOM 0 H LYS A 29 10.690 10.908 -3.739 1.00 0.00 H new ATOM 0 HA LYS A 29 10.308 12.441 -2.285 1.00 0.00 H new ATOM 0 HB2 LYS A 29 9.344 14.087 -4.642 1.00 0.00 H new ATOM 0 HB3 LYS A 29 9.322 14.720 -3.007 1.00 0.00 H new ATOM 0 HG2 LYS A 29 11.304 15.514 -4.080 1.00 0.00 H new ATOM 0 HG3 LYS A 29 11.778 14.362 -2.848 1.00 0.00 H new ATOM 0 HD2 LYS A 29 13.162 14.059 -4.800 1.00 0.00 H new ATOM 0 HD3 LYS A 29 12.154 12.642 -4.584 1.00 0.00 H new ATOM 0 HE2 LYS A 29 11.689 12.866 -6.795 1.00 0.00 H new ATOM 0 HE3 LYS A 29 10.587 14.133 -6.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 12.026 14.958 -7.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 12.432 15.727 -6.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 13.413 14.480 -7.133 1.00 0.00 H new ATOM 481 N GLU A 30 7.533 11.314 -2.844 1.00 0.00 N ATOM 482 CA GLU A 30 6.174 10.996 -2.433 1.00 0.00 C ATOM 483 C GLU A 30 6.032 10.612 -0.958 1.00 0.00 C ATOM 484 O GLU A 30 4.910 10.351 -0.547 1.00 0.00 O ATOM 485 CB GLU A 30 5.588 9.918 -3.333 1.00 0.00 C ATOM 486 CG GLU A 30 6.237 8.551 -3.190 1.00 0.00 C ATOM 487 CD GLU A 30 7.562 8.489 -3.916 1.00 0.00 C ATOM 488 OE1 GLU A 30 7.531 8.228 -5.131 1.00 0.00 O ATOM 489 OE2 GLU A 30 8.605 8.840 -3.330 1.00 0.00 O ATOM 0 H GLU A 30 7.944 10.579 -3.419 1.00 0.00 H new ATOM 0 HA GLU A 30 5.605 11.919 -2.545 1.00 0.00 H new ATOM 0 HB2 GLU A 30 4.523 9.824 -3.119 1.00 0.00 H new ATOM 0 HB3 GLU A 30 5.677 10.241 -4.370 1.00 0.00 H new ATOM 0 HG2 GLU A 30 6.389 8.328 -2.134 1.00 0.00 H new ATOM 0 HG3 GLU A 30 5.568 7.786 -3.585 1.00 0.00 H new ATOM 496 N LEU A 31 7.130 10.530 -0.196 1.00 0.00 N ATOM 497 CA LEU A 31 7.324 9.808 1.076 1.00 0.00 C ATOM 498 C LEU A 31 6.582 10.400 2.297 1.00 0.00 C ATOM 499 O LEU A 31 7.086 10.342 3.428 1.00 0.00 O ATOM 500 CB LEU A 31 8.847 9.691 1.337 1.00 0.00 C ATOM 501 CG LEU A 31 9.660 9.045 0.191 1.00 0.00 C ATOM 502 CD1 LEU A 31 11.143 8.913 0.557 1.00 0.00 C ATOM 503 CD2 LEU A 31 9.121 7.653 -0.141 1.00 0.00 C ATOM 0 H LEU A 31 7.985 11.010 -0.476 1.00 0.00 H new ATOM 0 HA LEU A 31 6.866 8.826 0.958 1.00 0.00 H new ATOM 0 HB2 LEU A 31 9.245 10.688 1.527 1.00 0.00 H new ATOM 0 HB3 LEU A 31 9.001 9.108 2.245 1.00 0.00 H new ATOM 0 HG LEU A 31 9.559 9.701 -0.674 1.00 0.00 H new ATOM 0 HD11 LEU A 31 11.683 8.455 -0.272 1.00 0.00 H new ATOM 0 HD12 LEU A 31 11.557 9.901 0.758 1.00 0.00 H new ATOM 0 HD13 LEU A 31 11.244 8.289 1.445 1.00 0.00 H new ATOM 0 HD21 LEU A 31 9.709 7.219 -0.950 1.00 0.00 H new ATOM 0 HD22 LEU A 31 9.191 7.016 0.741 1.00 0.00 H new ATOM 0 HD23 LEU A 31 8.079 7.731 -0.451 1.00 0.00 H new ATOM 515 N ASN A 32 5.418 11.002 2.069 1.00 0.00 N ATOM 516 CA ASN A 32 4.527 11.650 3.022 1.00 0.00 C ATOM 517 C ASN A 32 3.987 10.684 4.069 1.00 0.00 C ATOM 518 O ASN A 32 3.773 9.514 3.787 1.00 0.00 O ATOM 519 CB ASN A 32 3.360 12.313 2.278 1.00 0.00 C ATOM 520 CG ASN A 32 2.274 11.358 1.787 1.00 0.00 C ATOM 521 OD1 ASN A 32 1.237 11.217 2.421 1.00 0.00 O ATOM 522 ND2 ASN A 32 2.436 10.723 0.644 1.00 0.00 N ATOM 0 H ASN A 32 5.041 11.052 1.123 1.00 0.00 H new ATOM 0 HA ASN A 32 5.113 12.403 3.548 1.00 0.00 H new ATOM 0 HB2 ASN A 32 2.902 13.050 2.937 1.00 0.00 H new ATOM 0 HB3 ASN A 32 3.758 12.856 1.421 1.00 0.00 H new ATOM 0 HD21 ASN A 32 1.698 10.115 0.289 1.00 0.00 H new ATOM 0 HD22 ASN A 32 3.300 10.839 0.114 1.00 0.00 H new ATOM 529 N ILE A 33 3.679 11.186 5.265 1.00 0.00 N ATOM 530 CA ILE A 33 3.200 10.387 6.396 1.00 0.00 C ATOM 531 C ILE A 33 1.981 9.529 6.025 1.00 0.00 C ATOM 532 O ILE A 33 1.859 8.376 6.460 1.00 0.00 O ATOM 533 CB ILE A 33 2.926 11.337 7.586 1.00 0.00 C ATOM 534 CG1 ILE A 33 4.299 11.715 8.187 1.00 0.00 C ATOM 535 CG2 ILE A 33 1.954 10.720 8.605 1.00 0.00 C ATOM 536 CD1 ILE A 33 4.227 12.476 9.507 1.00 0.00 C ATOM 0 H ILE A 33 3.757 12.180 5.480 1.00 0.00 H new ATOM 0 HA ILE A 33 3.968 9.670 6.687 1.00 0.00 H new ATOM 0 HB ILE A 33 2.417 12.242 7.254 1.00 0.00 H new ATOM 0 HG12 ILE A 33 4.877 10.804 8.339 1.00 0.00 H new ATOM 0 HG13 ILE A 33 4.843 12.321 7.463 1.00 0.00 H new ATOM 0 HG21 ILE A 33 1.791 11.422 9.423 1.00 0.00 H new ATOM 0 HG22 ILE A 33 1.004 10.504 8.117 1.00 0.00 H new ATOM 0 HG23 ILE A 33 2.378 9.796 8.999 1.00 0.00 H new ATOM 0 HD11 ILE A 33 5.236 12.699 9.854 1.00 0.00 H new ATOM 0 HD12 ILE A 33 3.679 13.407 9.361 1.00 0.00 H new ATOM 0 HD13 ILE A 33 3.714 11.866 10.251 1.00 0.00 H new ATOM 548 N GLU A 34 1.064 10.095 5.243 1.00 0.00 N ATOM 549 CA GLU A 34 -0.211 9.473 4.927 1.00 0.00 C ATOM 550 C GLU A 34 0.013 8.209 4.094 1.00 0.00 C ATOM 551 O GLU A 34 -0.734 7.243 4.256 1.00 0.00 O ATOM 552 CB GLU A 34 -1.172 10.464 4.242 1.00 0.00 C ATOM 553 CG GLU A 34 -1.030 11.941 4.673 1.00 0.00 C ATOM 554 CD GLU A 34 -1.983 12.869 3.907 1.00 0.00 C ATOM 555 OE1 GLU A 34 -1.704 13.198 2.723 1.00 0.00 O ATOM 556 OE2 GLU A 34 -2.998 13.289 4.509 1.00 0.00 O ATOM 0 H GLU A 34 1.191 11.009 4.808 1.00 0.00 H new ATOM 0 HA GLU A 34 -0.694 9.177 5.858 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -1.020 10.403 3.164 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -2.195 10.144 4.438 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -1.227 12.025 5.742 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -0.002 12.267 4.511 1.00 0.00 H new ATOM 563 N ASN A 35 1.078 8.166 3.279 1.00 0.00 N ATOM 564 CA ASN A 35 1.416 6.953 2.527 1.00 0.00 C ATOM 565 C ASN A 35 2.459 6.151 3.314 1.00 0.00 C ATOM 566 O ASN A 35 2.489 4.927 3.231 1.00 0.00 O ATOM 567 CB ASN A 35 1.859 7.208 1.079 1.00 0.00 C ATOM 568 CG ASN A 35 3.364 7.230 0.902 1.00 0.00 C ATOM 569 OD1 ASN A 35 4.079 8.136 1.291 1.00 0.00 O ATOM 570 ND2 ASN A 35 3.895 6.148 0.369 1.00 0.00 N ATOM 0 H ASN A 35 1.713 8.950 3.126 1.00 0.00 H new ATOM 0 HA ASN A 35 0.501 6.370 2.424 1.00 0.00 H new ATOM 0 HB2 ASN A 35 1.437 6.435 0.437 1.00 0.00 H new ATOM 0 HB3 ASN A 35 1.448 8.160 0.744 1.00 0.00 H new ATOM 0 HD21 ASN A 35 4.908 6.067 0.281 1.00 0.00 H new ATOM 0 HD22 ASN A 35 3.293 5.391 0.044 1.00 0.00 H new ATOM 577 N ALA A 36 3.293 6.806 4.122 1.00 0.00 N ATOM 578 CA ALA A 36 4.373 6.172 4.853 1.00 0.00 C ATOM 579 C ALA A 36 3.858 5.101 5.811 1.00 0.00 C ATOM 580 O ALA A 36 4.538 4.091 5.963 1.00 0.00 O ATOM 581 CB ALA A 36 5.210 7.214 5.592 1.00 0.00 C ATOM 0 H ALA A 36 3.230 7.811 4.285 1.00 0.00 H new ATOM 0 HA ALA A 36 5.013 5.672 4.126 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.015 6.717 6.134 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.635 7.915 4.874 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.578 7.755 6.297 1.00 0.00 H new ATOM 587 N HIS A 37 2.680 5.276 6.428 1.00 0.00 N ATOM 588 CA HIS A 37 2.073 4.235 7.262 1.00 0.00 C ATOM 589 C HIS A 37 1.835 2.976 6.421 1.00 0.00 C ATOM 590 O HIS A 37 2.411 1.923 6.701 1.00 0.00 O ATOM 591 CB HIS A 37 0.781 4.742 7.936 1.00 0.00 C ATOM 592 CG HIS A 37 0.086 3.785 8.897 1.00 0.00 C ATOM 593 ND1 HIS A 37 -1.091 4.054 9.560 1.00 0.00 N ATOM 594 CD2 HIS A 37 0.492 2.536 9.301 1.00 0.00 C ATOM 595 CE1 HIS A 37 -1.381 3.006 10.351 1.00 0.00 C ATOM 596 NE2 HIS A 37 -0.444 2.046 10.227 1.00 0.00 N ATOM 0 H HIS A 37 2.129 6.132 6.363 1.00 0.00 H new ATOM 0 HA HIS A 37 2.759 3.977 8.069 1.00 0.00 H new ATOM 0 HB2 HIS A 37 1.018 5.657 8.480 1.00 0.00 H new ATOM 0 HB3 HIS A 37 0.072 5.011 7.153 1.00 0.00 H new ATOM 0 HD2 HIS A 37 1.379 2.019 8.964 1.00 0.00 H new ATOM 0 HE1 HIS A 37 -2.245 2.943 10.996 1.00 0.00 H new ATOM 0 HE2 HIS A 37 -0.419 1.147 10.708 1.00 0.00 H new ATOM 604 N LEU A 38 0.966 3.056 5.406 1.00 0.00 N ATOM 605 CA LEU A 38 0.570 1.872 4.657 1.00 0.00 C ATOM 606 C LEU A 38 1.654 1.387 3.698 1.00 0.00 C ATOM 607 O LEU A 38 1.528 0.278 3.205 1.00 0.00 O ATOM 608 CB LEU A 38 -0.839 2.018 4.060 1.00 0.00 C ATOM 609 CG LEU A 38 -1.028 2.513 2.618 1.00 0.00 C ATOM 610 CD1 LEU A 38 -0.292 3.806 2.302 1.00 0.00 C ATOM 611 CD2 LEU A 38 -0.698 1.439 1.583 1.00 0.00 C ATOM 0 H LEU A 38 0.531 3.923 5.092 1.00 0.00 H new ATOM 0 HA LEU A 38 0.478 1.045 5.361 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -1.321 1.043 4.131 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -1.394 2.696 4.708 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.092 2.739 2.549 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -0.478 4.086 1.265 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -0.648 4.598 2.961 1.00 0.00 H new ATOM 0 HD13 LEU A 38 0.778 3.662 2.453 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -0.848 1.841 0.581 1.00 0.00 H new ATOM 0 HD22 LEU A 38 0.341 1.130 1.698 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -1.351 0.579 1.730 1.00 0.00 H new ATOM 623 N PHE A 39 2.746 2.130 3.497 1.00 0.00 N ATOM 624 CA PHE A 39 3.940 1.747 2.732 1.00 0.00 C ATOM 625 C PHE A 39 4.354 0.300 3.003 1.00 0.00 C ATOM 626 O PHE A 39 4.688 -0.420 2.065 1.00 0.00 O ATOM 627 CB PHE A 39 5.102 2.673 3.116 1.00 0.00 C ATOM 628 CG PHE A 39 6.153 2.987 2.068 1.00 0.00 C ATOM 629 CD1 PHE A 39 7.118 2.041 1.666 1.00 0.00 C ATOM 630 CD2 PHE A 39 6.252 4.306 1.599 1.00 0.00 C ATOM 631 CE1 PHE A 39 8.215 2.439 0.881 1.00 0.00 C ATOM 632 CE2 PHE A 39 7.290 4.682 0.735 1.00 0.00 C ATOM 633 CZ PHE A 39 8.294 3.758 0.397 1.00 0.00 C ATOM 0 H PHE A 39 2.827 3.070 3.886 1.00 0.00 H new ATOM 0 HA PHE A 39 3.700 1.839 1.673 1.00 0.00 H new ATOM 0 HB2 PHE A 39 4.676 3.618 3.452 1.00 0.00 H new ATOM 0 HB3 PHE A 39 5.610 2.230 3.973 1.00 0.00 H new ATOM 0 HD1 PHE A 39 7.014 1.007 1.962 1.00 0.00 H new ATOM 0 HD2 PHE A 39 5.521 5.039 1.907 1.00 0.00 H new ATOM 0 HE1 PHE A 39 8.998 1.732 0.649 1.00 0.00 H new ATOM 0 HE2 PHE A 39 7.318 5.682 0.329 1.00 0.00 H new ATOM 0 HZ PHE A 39 9.120 4.058 -0.230 1.00 0.00 H new ATOM 643 N LYS A 40 4.319 -0.123 4.277 1.00 0.00 N ATOM 644 CA LYS A 40 4.493 -1.520 4.671 1.00 0.00 C ATOM 645 C LYS A 40 3.495 -2.372 3.887 1.00 0.00 C ATOM 646 O LYS A 40 3.894 -3.164 3.043 1.00 0.00 O ATOM 647 CB LYS A 40 4.299 -1.678 6.198 1.00 0.00 C ATOM 648 CG LYS A 40 4.415 -3.156 6.621 1.00 0.00 C ATOM 649 CD LYS A 40 3.601 -3.567 7.856 1.00 0.00 C ATOM 650 CE LYS A 40 4.449 -3.506 9.126 1.00 0.00 C ATOM 651 NZ LYS A 40 4.101 -4.580 10.077 1.00 0.00 N ATOM 0 H LYS A 40 4.167 0.506 5.066 1.00 0.00 H new ATOM 0 HA LYS A 40 5.505 -1.854 4.441 1.00 0.00 H new ATOM 0 HB2 LYS A 40 5.046 -1.085 6.726 1.00 0.00 H new ATOM 0 HB3 LYS A 40 3.322 -1.289 6.486 1.00 0.00 H new ATOM 0 HG2 LYS A 40 4.105 -3.779 5.782 1.00 0.00 H new ATOM 0 HG3 LYS A 40 5.465 -3.378 6.812 1.00 0.00 H new ATOM 0 HD2 LYS A 40 2.738 -2.909 7.961 1.00 0.00 H new ATOM 0 HD3 LYS A 40 3.217 -4.578 7.721 1.00 0.00 H new ATOM 0 HE2 LYS A 40 5.504 -3.584 8.862 1.00 0.00 H new ATOM 0 HE3 LYS A 40 4.312 -2.538 9.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 4.700 -4.501 10.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 3.101 -4.491 10.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 4.256 -5.505 9.628 1.00 0.00 H new ATOM 665 N LYS A 41 2.210 -2.213 4.194 1.00 0.00 N ATOM 666 CA LYS A 41 1.112 -2.998 3.661 1.00 0.00 C ATOM 667 C LYS A 41 1.127 -3.031 2.142 1.00 0.00 C ATOM 668 O LYS A 41 0.925 -4.093 1.575 1.00 0.00 O ATOM 669 CB LYS A 41 -0.206 -2.442 4.211 1.00 0.00 C ATOM 670 CG LYS A 41 -1.336 -3.455 4.030 1.00 0.00 C ATOM 671 CD LYS A 41 -2.593 -2.989 4.771 1.00 0.00 C ATOM 672 CE LYS A 41 -3.610 -4.123 4.875 1.00 0.00 C ATOM 673 NZ LYS A 41 -4.082 -4.577 3.553 1.00 0.00 N ATOM 0 H LYS A 41 1.897 -1.499 4.852 1.00 0.00 H new ATOM 0 HA LYS A 41 1.222 -4.034 3.982 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -0.092 -2.201 5.268 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -0.457 -1.514 3.698 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -1.556 -3.579 2.970 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -1.024 -4.429 4.407 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -2.325 -2.642 5.769 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -3.037 -2.143 4.247 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -3.161 -4.963 5.406 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -4.462 -3.790 5.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -4.919 -5.182 3.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -4.332 -3.752 2.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -3.328 -5.117 3.082 1.00 0.00 H new ATOM 687 N TRP A 42 1.386 -1.904 1.482 1.00 0.00 N ATOM 688 CA TRP A 42 1.579 -1.835 0.044 1.00 0.00 C ATOM 689 C TRP A 42 2.697 -2.792 -0.368 1.00 0.00 C ATOM 690 O TRP A 42 2.429 -3.724 -1.119 1.00 0.00 O ATOM 691 CB TRP A 42 1.822 -0.382 -0.383 1.00 0.00 C ATOM 692 CG TRP A 42 2.451 -0.180 -1.725 1.00 0.00 C ATOM 693 CD1 TRP A 42 1.932 -0.551 -2.913 1.00 0.00 C ATOM 694 CD2 TRP A 42 3.756 0.384 -2.029 1.00 0.00 C ATOM 695 NE1 TRP A 42 2.823 -0.263 -3.925 1.00 0.00 N ATOM 696 CE2 TRP A 42 3.979 0.300 -3.434 1.00 0.00 C ATOM 697 CE3 TRP A 42 4.793 0.908 -1.240 1.00 0.00 C ATOM 698 CZ2 TRP A 42 5.178 0.710 -4.031 1.00 0.00 C ATOM 699 CZ3 TRP A 42 6.015 1.300 -1.806 1.00 0.00 C ATOM 700 CH2 TRP A 42 6.202 1.224 -3.209 1.00 0.00 C ATOM 0 H TRP A 42 1.468 -0.999 1.945 1.00 0.00 H new ATOM 0 HA TRP A 42 0.680 -2.160 -0.481 1.00 0.00 H new ATOM 0 HB2 TRP A 42 0.866 0.142 -0.371 1.00 0.00 H new ATOM 0 HB3 TRP A 42 2.455 0.093 0.366 1.00 0.00 H new ATOM 0 HD1 TRP A 42 0.962 -1.006 -3.051 1.00 0.00 H new ATOM 0 HE1 TRP A 42 2.648 -0.444 -4.913 1.00 0.00 H new ATOM 0 HE3 TRP A 42 4.646 1.011 -0.175 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 5.315 0.634 -5.100 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 6.813 1.660 -1.173 1.00 0.00 H new ATOM 0 HH2 TRP A 42 7.129 1.560 -3.649 1.00 0.00 H new ATOM 711 N VAL A 43 3.930 -2.627 0.121 1.00 0.00 N ATOM 712 CA VAL A 43 5.007 -3.537 -0.267 1.00 0.00 C ATOM 713 C VAL A 43 4.652 -5.005 0.041 1.00 0.00 C ATOM 714 O VAL A 43 4.995 -5.915 -0.719 1.00 0.00 O ATOM 715 CB VAL A 43 6.346 -3.076 0.344 1.00 0.00 C ATOM 716 CG1 VAL A 43 7.482 -4.093 0.179 1.00 0.00 C ATOM 717 CG2 VAL A 43 6.782 -1.777 -0.346 1.00 0.00 C ATOM 0 H VAL A 43 4.202 -1.889 0.771 1.00 0.00 H new ATOM 0 HA VAL A 43 5.131 -3.498 -1.349 1.00 0.00 H new ATOM 0 HB VAL A 43 6.170 -2.947 1.412 1.00 0.00 H new ATOM 0 HG11 VAL A 43 8.391 -3.699 0.633 1.00 0.00 H new ATOM 0 HG12 VAL A 43 7.207 -5.028 0.668 1.00 0.00 H new ATOM 0 HG13 VAL A 43 7.656 -4.276 -0.881 1.00 0.00 H new ATOM 0 HG21 VAL A 43 7.728 -1.440 0.077 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.905 -1.956 -1.414 1.00 0.00 H new ATOM 0 HG23 VAL A 43 6.022 -1.011 -0.192 1.00 0.00 H new ATOM 727 N PHE A 44 3.947 -5.252 1.140 1.00 0.00 N ATOM 728 CA PHE A 44 3.576 -6.575 1.574 1.00 0.00 C ATOM 729 C PHE A 44 2.517 -7.189 0.636 1.00 0.00 C ATOM 730 O PHE A 44 2.568 -8.378 0.319 1.00 0.00 O ATOM 731 CB PHE A 44 3.087 -6.470 3.020 1.00 0.00 C ATOM 732 CG PHE A 44 4.119 -6.289 4.135 1.00 0.00 C ATOM 733 CD1 PHE A 44 5.368 -5.649 3.950 1.00 0.00 C ATOM 734 CD2 PHE A 44 3.795 -6.775 5.416 1.00 0.00 C ATOM 735 CE1 PHE A 44 6.274 -5.534 5.019 1.00 0.00 C ATOM 736 CE2 PHE A 44 4.700 -6.662 6.483 1.00 0.00 C ATOM 737 CZ PHE A 44 5.943 -6.042 6.287 1.00 0.00 C ATOM 0 H PHE A 44 3.615 -4.514 1.761 1.00 0.00 H new ATOM 0 HA PHE A 44 4.432 -7.248 1.533 1.00 0.00 H new ATOM 0 HB2 PHE A 44 2.393 -5.632 3.074 1.00 0.00 H new ATOM 0 HB3 PHE A 44 2.516 -7.372 3.242 1.00 0.00 H new ATOM 0 HD1 PHE A 44 5.627 -5.247 2.982 1.00 0.00 H new ATOM 0 HD2 PHE A 44 2.835 -7.242 5.580 1.00 0.00 H new ATOM 0 HE1 PHE A 44 7.229 -5.053 4.865 1.00 0.00 H new ATOM 0 HE2 PHE A 44 4.439 -7.053 7.456 1.00 0.00 H new ATOM 0 HZ PHE A 44 6.642 -5.955 7.106 1.00 0.00 H new ATOM 747 N ASP A 45 1.574 -6.395 0.139 1.00 0.00 N ATOM 748 CA ASP A 45 0.360 -6.855 -0.541 1.00 0.00 C ATOM 749 C ASP A 45 0.429 -6.648 -2.058 1.00 0.00 C ATOM 750 O ASP A 45 -0.421 -7.189 -2.767 1.00 0.00 O ATOM 751 CB ASP A 45 -0.902 -6.186 0.036 1.00 0.00 C ATOM 752 CG ASP A 45 -1.323 -6.645 1.439 1.00 0.00 C ATOM 753 OD1 ASP A 45 -0.738 -7.595 2.010 1.00 0.00 O ATOM 754 OD2 ASP A 45 -2.303 -6.070 1.975 1.00 0.00 O ATOM 0 H ASP A 45 1.632 -5.378 0.199 1.00 0.00 H new ATOM 0 HA ASP A 45 0.294 -7.927 -0.357 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -0.739 -5.109 0.061 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -1.731 -6.367 -0.648 1.00 0.00 H new ATOM 759 N GLU A 46 1.431 -5.937 -2.590 1.00 0.00 N ATOM 760 CA GLU A 46 1.732 -5.946 -4.025 1.00 0.00 C ATOM 761 C GLU A 46 2.899 -6.890 -4.367 1.00 0.00 C ATOM 762 O GLU A 46 3.018 -7.264 -5.538 1.00 0.00 O ATOM 763 CB GLU A 46 2.059 -4.544 -4.576 1.00 0.00 C ATOM 764 CG GLU A 46 1.159 -3.371 -4.209 1.00 0.00 C ATOM 765 CD GLU A 46 -0.349 -3.491 -4.429 1.00 0.00 C ATOM 766 OE1 GLU A 46 -0.795 -4.321 -5.251 1.00 0.00 O ATOM 767 OE2 GLU A 46 -1.091 -2.670 -3.829 1.00 0.00 O ATOM 0 H GLU A 46 2.052 -5.343 -2.041 1.00 0.00 H new ATOM 0 HA GLU A 46 0.820 -6.307 -4.501 1.00 0.00 H new ATOM 0 HB2 GLU A 46 3.070 -4.294 -4.256 1.00 0.00 H new ATOM 0 HB3 GLU A 46 2.077 -4.615 -5.664 1.00 0.00 H new ATOM 0 HG2 GLU A 46 1.320 -3.151 -3.154 1.00 0.00 H new ATOM 0 HG3 GLU A 46 1.505 -2.504 -4.771 1.00 0.00 H new ATOM 774 N PHE A 47 3.764 -7.263 -3.401 1.00 0.00 N ATOM 775 CA PHE A 47 4.964 -8.053 -3.676 1.00 0.00 C ATOM 776 C PHE A 47 5.241 -9.207 -2.705 1.00 0.00 C ATOM 777 O PHE A 47 5.587 -10.297 -3.163 1.00 0.00 O ATOM 778 CB PHE A 47 6.191 -7.147 -3.729 1.00 0.00 C ATOM 779 CG PHE A 47 5.989 -5.861 -4.499 1.00 0.00 C ATOM 780 CD1 PHE A 47 5.988 -5.865 -5.901 1.00 0.00 C ATOM 781 CD2 PHE A 47 5.730 -4.664 -3.811 1.00 0.00 C ATOM 782 CE1 PHE A 47 5.778 -4.665 -6.594 1.00 0.00 C ATOM 783 CE2 PHE A 47 5.580 -3.451 -4.496 1.00 0.00 C ATOM 784 CZ PHE A 47 5.611 -3.457 -5.895 1.00 0.00 C ATOM 0 H PHE A 47 3.644 -7.023 -2.417 1.00 0.00 H new ATOM 0 HA PHE A 47 4.763 -8.520 -4.640 1.00 0.00 H new ATOM 0 HB2 PHE A 47 6.490 -6.902 -2.710 1.00 0.00 H new ATOM 0 HB3 PHE A 47 7.016 -7.700 -4.179 1.00 0.00 H new ATOM 0 HD1 PHE A 47 6.148 -6.786 -6.443 1.00 0.00 H new ATOM 0 HD2 PHE A 47 5.645 -4.679 -2.734 1.00 0.00 H new ATOM 0 HE1 PHE A 47 5.744 -4.669 -7.673 1.00 0.00 H new ATOM 0 HE2 PHE A 47 5.443 -2.527 -3.954 1.00 0.00 H new ATOM 0 HZ PHE A 47 5.506 -2.530 -6.440 1.00 0.00 H new ATOM 794 N LEU A 48 5.215 -8.992 -1.383 1.00 0.00 N ATOM 795 CA LEU A 48 5.695 -10.038 -0.468 1.00 0.00 C ATOM 796 C LEU A 48 4.791 -11.261 -0.464 1.00 0.00 C ATOM 797 O LEU A 48 5.283 -12.387 -0.477 1.00 0.00 O ATOM 798 CB LEU A 48 5.851 -9.552 0.975 1.00 0.00 C ATOM 799 CG LEU A 48 6.905 -8.456 1.163 1.00 0.00 C ATOM 800 CD1 LEU A 48 7.137 -8.230 2.659 1.00 0.00 C ATOM 801 CD2 LEU A 48 8.260 -8.781 0.521 1.00 0.00 C ATOM 0 H LEU A 48 4.881 -8.139 -0.935 1.00 0.00 H new ATOM 0 HA LEU A 48 6.677 -10.308 -0.856 1.00 0.00 H new ATOM 0 HB2 LEU A 48 4.889 -9.178 1.326 1.00 0.00 H new ATOM 0 HB3 LEU A 48 6.112 -10.402 1.606 1.00 0.00 H new ATOM 0 HG LEU A 48 6.510 -7.569 0.667 1.00 0.00 H new ATOM 0 HD11 LEU A 48 7.886 -7.451 2.797 1.00 0.00 H new ATOM 0 HD12 LEU A 48 6.203 -7.923 3.130 1.00 0.00 H new ATOM 0 HD13 LEU A 48 7.487 -9.155 3.117 1.00 0.00 H new ATOM 0 HD21 LEU A 48 8.953 -7.958 0.697 1.00 0.00 H new ATOM 0 HD22 LEU A 48 8.662 -9.694 0.961 1.00 0.00 H new ATOM 0 HD23 LEU A 48 8.130 -8.923 -0.552 1.00 0.00 H new ATOM 813 N ASN A 49 3.480 -11.051 -0.416 1.00 0.00 N ATOM 814 CA ASN A 49 2.485 -12.121 -0.536 1.00 0.00 C ATOM 815 C ASN A 49 2.445 -12.706 -1.951 1.00 0.00 C ATOM 816 O ASN A 49 2.118 -13.878 -2.105 1.00 0.00 O ATOM 817 CB ASN A 49 1.091 -11.646 -0.110 1.00 0.00 C ATOM 818 CG ASN A 49 0.996 -11.481 1.394 1.00 0.00 C ATOM 819 OD1 ASN A 49 0.980 -12.464 2.132 1.00 0.00 O ATOM 820 ND2 ASN A 49 0.964 -10.258 1.885 1.00 0.00 N ATOM 0 H ASN A 49 3.070 -10.125 -0.292 1.00 0.00 H new ATOM 0 HA ASN A 49 2.795 -12.914 0.144 1.00 0.00 H new ATOM 0 HB2 ASN A 49 0.864 -10.697 -0.596 1.00 0.00 H new ATOM 0 HB3 ASN A 49 0.342 -12.363 -0.446 1.00 0.00 H new ATOM 0 HD21 ASN A 49 0.925 -10.114 2.894 1.00 0.00 H new ATOM 0 HD22 ASN A 49 0.978 -9.455 1.256 1.00 0.00 H new ATOM 827 N LYS A 50 2.858 -11.952 -2.974 1.00 0.00 N ATOM 828 CA LYS A 50 3.176 -12.456 -4.315 1.00 0.00 C ATOM 829 C LYS A 50 4.403 -13.370 -4.326 1.00 0.00 C ATOM 830 O LYS A 50 4.737 -13.942 -5.362 1.00 0.00 O ATOM 831 CB LYS A 50 3.403 -11.268 -5.266 1.00 0.00 C ATOM 832 CG LYS A 50 2.165 -10.956 -6.095 1.00 0.00 C ATOM 833 CD LYS A 50 2.576 -10.104 -7.300 1.00 0.00 C ATOM 834 CE LYS A 50 1.363 -9.476 -7.980 1.00 0.00 C ATOM 835 NZ LYS A 50 1.773 -8.432 -8.942 1.00 0.00 N ATOM 0 H LYS A 50 2.984 -10.943 -2.890 1.00 0.00 H new ATOM 0 HA LYS A 50 2.329 -13.055 -4.649 1.00 0.00 H new ATOM 0 HB2 LYS A 50 3.682 -10.388 -4.687 1.00 0.00 H new ATOM 0 HB3 LYS A 50 4.238 -11.490 -5.931 1.00 0.00 H new ATOM 0 HG2 LYS A 50 1.693 -11.880 -6.430 1.00 0.00 H new ATOM 0 HG3 LYS A 50 1.431 -10.424 -5.490 1.00 0.00 H new ATOM 0 HD2 LYS A 50 3.260 -9.319 -6.976 1.00 0.00 H new ATOM 0 HD3 LYS A 50 3.117 -10.722 -8.017 1.00 0.00 H new ATOM 0 HE2 LYS A 50 0.792 -10.247 -8.497 1.00 0.00 H new ATOM 0 HE3 LYS A 50 0.704 -9.043 -7.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 0.929 -8.022 -9.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 2.297 -7.686 -8.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 2.382 -8.853 -9.672 1.00 0.00 H new ATOM 849 N GLY A 51 5.104 -13.492 -3.206 1.00 0.00 N ATOM 850 CA GLY A 51 6.261 -14.353 -3.074 1.00 0.00 C ATOM 851 C GLY A 51 7.510 -13.757 -3.712 1.00 0.00 C ATOM 852 O GLY A 51 8.424 -14.511 -4.052 1.00 0.00 O ATOM 0 H GLY A 51 4.876 -12.984 -2.351 1.00 0.00 H new ATOM 0 HA2 GLY A 51 6.451 -14.540 -2.017 1.00 0.00 H new ATOM 0 HA3 GLY A 51 6.047 -15.317 -3.535 1.00 0.00 H new ATOM 856 N TYR A 52 7.588 -12.434 -3.909 1.00 0.00 N ATOM 857 CA TYR A 52 8.876 -11.797 -4.166 1.00 0.00 C ATOM 858 C TYR A 52 9.654 -11.779 -2.849 1.00 0.00 C ATOM 859 O TYR A 52 9.086 -11.507 -1.786 1.00 0.00 O ATOM 860 CB TYR A 52 8.711 -10.367 -4.697 1.00 0.00 C ATOM 861 CG TYR A 52 8.207 -10.259 -6.123 1.00 0.00 C ATOM 862 CD1 TYR A 52 9.117 -10.293 -7.196 1.00 0.00 C ATOM 863 CD2 TYR A 52 6.838 -10.096 -6.383 1.00 0.00 C ATOM 864 CE1 TYR A 52 8.679 -10.158 -8.526 1.00 0.00 C ATOM 865 CE2 TYR A 52 6.381 -9.953 -7.701 1.00 0.00 C ATOM 866 CZ TYR A 52 7.297 -9.979 -8.775 1.00 0.00 C ATOM 867 OH TYR A 52 6.805 -9.854 -10.038 1.00 0.00 O ATOM 0 H TYR A 52 6.790 -11.799 -3.895 1.00 0.00 H new ATOM 0 HA TYR A 52 9.410 -12.360 -4.932 1.00 0.00 H new ATOM 0 HB2 TYR A 52 8.021 -9.832 -4.044 1.00 0.00 H new ATOM 0 HB3 TYR A 52 9.673 -9.859 -4.630 1.00 0.00 H new ATOM 0 HD1 TYR A 52 10.170 -10.425 -6.995 1.00 0.00 H new ATOM 0 HD2 TYR A 52 6.133 -10.081 -5.565 1.00 0.00 H new ATOM 0 HE1 TYR A 52 9.385 -10.190 -9.343 1.00 0.00 H new ATOM 0 HE2 TYR A 52 5.327 -9.823 -7.895 1.00 0.00 H new ATOM 0 HH TYR A 52 5.832 -9.740 -10.000 1.00 0.00 H new ATOM 877 N ASN A 53 10.969 -11.977 -2.920 1.00 0.00 N ATOM 878 CA ASN A 53 11.898 -11.951 -1.787 1.00 0.00 C ATOM 879 C ASN A 53 13.091 -11.014 -2.019 1.00 0.00 C ATOM 880 O ASN A 53 13.955 -10.903 -1.152 1.00 0.00 O ATOM 881 CB ASN A 53 12.367 -13.384 -1.484 1.00 0.00 C ATOM 882 CG ASN A 53 11.412 -14.151 -0.582 1.00 0.00 C ATOM 883 OD1 ASN A 53 10.403 -14.691 -1.029 1.00 0.00 O ATOM 884 ND2 ASN A 53 11.687 -14.209 0.709 1.00 0.00 N ATOM 0 H ASN A 53 11.438 -12.168 -3.805 1.00 0.00 H new ATOM 0 HA ASN A 53 11.366 -11.549 -0.925 1.00 0.00 H new ATOM 0 HB2 ASN A 53 12.485 -13.926 -2.422 1.00 0.00 H new ATOM 0 HB3 ASN A 53 13.349 -13.346 -1.013 1.00 0.00 H new ATOM 0 HD21 ASN A 53 11.060 -14.705 1.342 1.00 0.00 H new ATOM 0 HD22 ASN A 53 12.527 -13.758 1.072 1.00 0.00 H new ATOM 891 N LYS A 54 13.176 -10.325 -3.153 1.00 0.00 N ATOM 892 CA LYS A 54 14.186 -9.307 -3.399 1.00 0.00 C ATOM 893 C LYS A 54 13.416 -8.035 -3.741 1.00 0.00 C ATOM 894 O LYS A 54 12.593 -8.006 -4.661 1.00 0.00 O ATOM 895 CB LYS A 54 15.161 -9.785 -4.485 1.00 0.00 C ATOM 896 CG LYS A 54 16.156 -10.842 -3.948 1.00 0.00 C ATOM 897 CD LYS A 54 16.166 -12.163 -4.728 1.00 0.00 C ATOM 898 CE LYS A 54 14.807 -12.853 -4.599 1.00 0.00 C ATOM 899 NZ LYS A 54 14.726 -14.114 -5.365 1.00 0.00 N ATOM 0 H LYS A 54 12.536 -10.462 -3.935 1.00 0.00 H new ATOM 0 HA LYS A 54 14.823 -9.107 -2.538 1.00 0.00 H new ATOM 0 HB2 LYS A 54 14.598 -10.207 -5.317 1.00 0.00 H new ATOM 0 HB3 LYS A 54 15.715 -8.931 -4.876 1.00 0.00 H new ATOM 0 HG2 LYS A 54 17.160 -10.418 -3.964 1.00 0.00 H new ATOM 0 HG3 LYS A 54 15.915 -11.052 -2.906 1.00 0.00 H new ATOM 0 HD2 LYS A 54 16.390 -11.974 -5.778 1.00 0.00 H new ATOM 0 HD3 LYS A 54 16.952 -12.815 -4.347 1.00 0.00 H new ATOM 0 HE2 LYS A 54 14.609 -13.060 -3.547 1.00 0.00 H new ATOM 0 HE3 LYS A 54 14.027 -12.174 -4.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 13.882 -14.097 -5.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 15.576 -14.217 -5.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 14.663 -14.917 -4.707 1.00 0.00 H new ATOM 913 N ILE A 55 13.697 -6.978 -2.993 1.00 0.00 N ATOM 914 CA ILE A 55 13.216 -5.607 -3.141 1.00 0.00 C ATOM 915 C ILE A 55 14.477 -4.772 -3.210 1.00 0.00 C ATOM 916 O ILE A 55 15.444 -5.091 -2.516 1.00 0.00 O ATOM 917 CB ILE A 55 12.322 -5.270 -1.937 1.00 0.00 C ATOM 918 CG1 ILE A 55 10.890 -5.736 -2.281 1.00 0.00 C ATOM 919 CG2 ILE A 55 12.266 -3.774 -1.628 1.00 0.00 C ATOM 920 CD1 ILE A 55 10.043 -6.207 -1.100 1.00 0.00 C ATOM 0 H ILE A 55 14.325 -7.063 -2.193 1.00 0.00 H new ATOM 0 HA ILE A 55 12.604 -5.430 -4.025 1.00 0.00 H new ATOM 0 HB ILE A 55 12.738 -5.769 -1.062 1.00 0.00 H new ATOM 0 HG12 ILE A 55 10.369 -4.915 -2.773 1.00 0.00 H new ATOM 0 HG13 ILE A 55 10.956 -6.549 -3.004 1.00 0.00 H new ATOM 0 HG21 ILE A 55 11.618 -3.604 -0.768 1.00 0.00 H new ATOM 0 HG22 ILE A 55 13.269 -3.411 -1.404 1.00 0.00 H new ATOM 0 HG23 ILE A 55 11.870 -3.239 -2.491 1.00 0.00 H new ATOM 0 HD11 ILE A 55 9.059 -6.510 -1.456 1.00 0.00 H new ATOM 0 HD12 ILE A 55 10.531 -7.054 -0.617 1.00 0.00 H new ATOM 0 HD13 ILE A 55 9.934 -5.393 -0.383 1.00 0.00 H new ATOM 932 N PHE A 56 14.429 -3.682 -3.971 1.00 0.00 N ATOM 933 CA PHE A 56 15.407 -2.618 -3.967 1.00 0.00 C ATOM 934 C PHE A 56 14.733 -1.280 -3.749 1.00 0.00 C ATOM 935 O PHE A 56 13.544 -1.124 -4.026 1.00 0.00 O ATOM 936 CB PHE A 56 16.228 -2.618 -5.266 1.00 0.00 C ATOM 937 CG PHE A 56 17.179 -3.785 -5.444 1.00 0.00 C ATOM 938 CD1 PHE A 56 17.686 -4.510 -4.343 1.00 0.00 C ATOM 939 CD2 PHE A 56 17.514 -4.182 -6.750 1.00 0.00 C ATOM 940 CE1 PHE A 56 18.455 -5.663 -4.572 1.00 0.00 C ATOM 941 CE2 PHE A 56 18.238 -5.356 -6.978 1.00 0.00 C ATOM 942 CZ PHE A 56 18.706 -6.101 -5.884 1.00 0.00 C ATOM 0 H PHE A 56 13.671 -3.517 -4.633 1.00 0.00 H new ATOM 0 HA PHE A 56 16.097 -2.791 -3.141 1.00 0.00 H new ATOM 0 HB2 PHE A 56 15.538 -2.604 -6.110 1.00 0.00 H new ATOM 0 HB3 PHE A 56 16.804 -1.694 -5.310 1.00 0.00 H new ATOM 0 HD1 PHE A 56 17.484 -4.181 -3.334 1.00 0.00 H new ATOM 0 HD2 PHE A 56 17.208 -3.573 -7.588 1.00 0.00 H new ATOM 0 HE1 PHE A 56 18.856 -6.216 -3.735 1.00 0.00 H new ATOM 0 HE2 PHE A 56 18.436 -5.687 -7.987 1.00 0.00 H new ATOM 0 HZ PHE A 56 19.260 -7.013 -6.051 1.00 0.00 H new ATOM 952 N LEU A 57 15.515 -0.308 -3.284 1.00 0.00 N ATOM 953 CA LEU A 57 15.110 1.084 -3.147 1.00 0.00 C ATOM 954 C LEU A 57 16.145 1.936 -3.870 1.00 0.00 C ATOM 955 O LEU A 57 17.302 1.953 -3.465 1.00 0.00 O ATOM 956 CB LEU A 57 14.992 1.445 -1.656 1.00 0.00 C ATOM 957 CG LEU A 57 14.344 2.813 -1.378 1.00 0.00 C ATOM 958 CD1 LEU A 57 12.883 2.830 -1.844 1.00 0.00 C ATOM 959 CD2 LEU A 57 14.373 3.086 0.131 1.00 0.00 C ATOM 0 H LEU A 57 16.476 -0.475 -2.984 1.00 0.00 H new ATOM 0 HA LEU A 57 14.131 1.264 -3.592 1.00 0.00 H new ATOM 0 HB2 LEU A 57 14.409 0.673 -1.154 1.00 0.00 H new ATOM 0 HB3 LEU A 57 15.988 1.432 -1.213 1.00 0.00 H new ATOM 0 HG LEU A 57 14.902 3.575 -1.922 1.00 0.00 H new ATOM 0 HD11 LEU A 57 12.446 3.807 -1.637 1.00 0.00 H new ATOM 0 HD12 LEU A 57 12.840 2.633 -2.915 1.00 0.00 H new ATOM 0 HD13 LEU A 57 12.322 2.062 -1.311 1.00 0.00 H new ATOM 0 HD21 LEU A 57 13.915 4.054 0.334 1.00 0.00 H new ATOM 0 HD22 LEU A 57 13.819 2.306 0.653 1.00 0.00 H new ATOM 0 HD23 LEU A 57 15.406 3.093 0.480 1.00 0.00 H new ATOM 971 N VAL A 58 15.781 2.572 -4.979 1.00 0.00 N ATOM 972 CA VAL A 58 16.634 3.559 -5.630 1.00 0.00 C ATOM 973 C VAL A 58 16.509 4.865 -4.846 1.00 0.00 C ATOM 974 O VAL A 58 15.394 5.285 -4.528 1.00 0.00 O ATOM 975 CB VAL A 58 16.209 3.702 -7.104 1.00 0.00 C ATOM 976 CG1 VAL A 58 16.924 4.847 -7.828 1.00 0.00 C ATOM 977 CG2 VAL A 58 16.522 2.402 -7.854 1.00 0.00 C ATOM 0 H VAL A 58 14.889 2.418 -5.450 1.00 0.00 H new ATOM 0 HA VAL A 58 17.682 3.259 -5.633 1.00 0.00 H new ATOM 0 HB VAL A 58 15.141 3.920 -7.098 1.00 0.00 H new ATOM 0 HG11 VAL A 58 16.581 4.895 -8.861 1.00 0.00 H new ATOM 0 HG12 VAL A 58 16.701 5.789 -7.328 1.00 0.00 H new ATOM 0 HG13 VAL A 58 18.000 4.673 -7.811 1.00 0.00 H new ATOM 0 HG21 VAL A 58 16.222 2.502 -8.897 1.00 0.00 H new ATOM 0 HG22 VAL A 58 17.592 2.201 -7.802 1.00 0.00 H new ATOM 0 HG23 VAL A 58 15.975 1.577 -7.397 1.00 0.00 H new ATOM 987 N LEU A 59 17.635 5.526 -4.572 1.00 0.00 N ATOM 988 CA LEU A 59 17.683 6.824 -3.906 1.00 0.00 C ATOM 989 C LEU A 59 18.291 7.908 -4.815 1.00 0.00 C ATOM 990 O LEU A 59 18.709 8.957 -4.334 1.00 0.00 O ATOM 991 CB LEU A 59 18.307 6.718 -2.495 1.00 0.00 C ATOM 992 CG LEU A 59 17.396 5.965 -1.505 1.00 0.00 C ATOM 993 CD1 LEU A 59 17.785 4.500 -1.341 1.00 0.00 C ATOM 994 CD2 LEU A 59 17.446 6.590 -0.111 1.00 0.00 C ATOM 0 H LEU A 59 18.558 5.164 -4.813 1.00 0.00 H new ATOM 0 HA LEU A 59 16.662 7.162 -3.727 1.00 0.00 H new ATOM 0 HB2 LEU A 59 19.267 6.206 -2.563 1.00 0.00 H new ATOM 0 HB3 LEU A 59 18.506 7.719 -2.112 1.00 0.00 H new ATOM 0 HG LEU A 59 16.397 6.037 -1.934 1.00 0.00 H new ATOM 0 HD11 LEU A 59 17.109 4.021 -0.633 1.00 0.00 H new ATOM 0 HD12 LEU A 59 17.717 3.996 -2.305 1.00 0.00 H new ATOM 0 HD13 LEU A 59 18.807 4.435 -0.968 1.00 0.00 H new ATOM 0 HD21 LEU A 59 16.792 6.034 0.561 1.00 0.00 H new ATOM 0 HD22 LEU A 59 18.468 6.556 0.267 1.00 0.00 H new ATOM 0 HD23 LEU A 59 17.114 7.627 -0.165 1.00 0.00 H new ATOM 1006 N SER A 60 18.303 7.680 -6.133 1.00 0.00 N ATOM 1007 CA SER A 60 18.693 8.662 -7.140 1.00 0.00 C ATOM 1008 C SER A 60 17.775 9.889 -7.160 1.00 0.00 C ATOM 1009 O SER A 60 18.272 11.011 -7.221 1.00 0.00 O ATOM 1010 CB SER A 60 18.659 8.026 -8.539 1.00 0.00 C ATOM 1011 OG SER A 60 19.950 7.684 -8.993 1.00 0.00 O ATOM 0 H SER A 60 18.034 6.782 -6.535 1.00 0.00 H new ATOM 0 HA SER A 60 19.700 8.986 -6.876 1.00 0.00 H new ATOM 0 HB2 SER A 60 18.034 7.133 -8.517 1.00 0.00 H new ATOM 0 HB3 SER A 60 18.199 8.720 -9.242 1.00 0.00 H new ATOM 0 HG SER A 60 19.887 7.281 -9.884 1.00 0.00 H new ATOM 1017 N ASP A 61 16.453 9.714 -7.240 1.00 0.00 N ATOM 1018 CA ASP A 61 15.543 10.817 -7.591 1.00 0.00 C ATOM 1019 C ASP A 61 15.126 11.625 -6.354 1.00 0.00 C ATOM 1020 O ASP A 61 14.545 12.701 -6.476 1.00 0.00 O ATOM 1021 CB ASP A 61 14.320 10.274 -8.354 1.00 0.00 C ATOM 1022 CG ASP A 61 13.694 11.340 -9.264 1.00 0.00 C ATOM 1023 OD1 ASP A 61 14.120 11.471 -10.439 1.00 0.00 O ATOM 1024 OD2 ASP A 61 12.797 12.101 -8.841 1.00 0.00 O ATOM 0 H ASP A 61 15.986 8.823 -7.068 1.00 0.00 H new ATOM 0 HA ASP A 61 16.078 11.504 -8.247 1.00 0.00 H new ATOM 0 HB2 ASP A 61 14.619 9.414 -8.954 1.00 0.00 H new ATOM 0 HB3 ASP A 61 13.574 9.922 -7.641 1.00 0.00 H new ATOM 1029 N VAL A 62 15.455 11.125 -5.162 1.00 0.00 N ATOM 1030 CA VAL A 62 15.141 11.685 -3.855 1.00 0.00 C ATOM 1031 C VAL A 62 16.427 12.247 -3.237 1.00 0.00 C ATOM 1032 O VAL A 62 17.524 11.809 -3.584 1.00 0.00 O ATOM 1033 CB VAL A 62 14.422 10.583 -3.034 1.00 0.00 C ATOM 1034 CG1 VAL A 62 15.268 9.323 -2.812 1.00 0.00 C ATOM 1035 CG2 VAL A 62 13.883 11.068 -1.690 1.00 0.00 C ATOM 0 H VAL A 62 15.985 10.257 -5.084 1.00 0.00 H new ATOM 0 HA VAL A 62 14.455 12.531 -3.895 1.00 0.00 H new ATOM 0 HB VAL A 62 13.575 10.319 -3.668 1.00 0.00 H new ATOM 0 HG11 VAL A 62 14.697 8.599 -2.230 1.00 0.00 H new ATOM 0 HG12 VAL A 62 15.531 8.887 -3.776 1.00 0.00 H new ATOM 0 HG13 VAL A 62 16.178 9.586 -2.272 1.00 0.00 H new ATOM 0 HG21 VAL A 62 13.394 10.241 -1.174 1.00 0.00 H new ATOM 0 HG22 VAL A 62 14.707 11.440 -1.080 1.00 0.00 H new ATOM 0 HG23 VAL A 62 13.163 11.870 -1.855 1.00 0.00 H new ATOM 1045 N GLU A 63 16.290 13.219 -2.331 1.00 0.00 N ATOM 1046 CA GLU A 63 17.391 13.754 -1.546 1.00 0.00 C ATOM 1047 C GLU A 63 17.340 13.156 -0.150 1.00 0.00 C ATOM 1048 O GLU A 63 18.376 12.761 0.384 1.00 0.00 O ATOM 1049 CB GLU A 63 17.324 15.290 -1.472 1.00 0.00 C ATOM 1050 CG GLU A 63 18.476 15.891 -0.635 1.00 0.00 C ATOM 1051 CD GLU A 63 18.899 17.285 -1.129 1.00 0.00 C ATOM 1052 OE1 GLU A 63 19.516 17.376 -2.218 1.00 0.00 O ATOM 1053 OE2 GLU A 63 18.634 18.298 -0.440 1.00 0.00 O ATOM 0 H GLU A 63 15.394 13.659 -2.124 1.00 0.00 H new ATOM 0 HA GLU A 63 18.332 13.487 -2.028 1.00 0.00 H new ATOM 0 HB2 GLU A 63 17.359 15.701 -2.481 1.00 0.00 H new ATOM 0 HB3 GLU A 63 16.370 15.589 -1.039 1.00 0.00 H new ATOM 0 HG2 GLU A 63 18.167 15.957 0.408 1.00 0.00 H new ATOM 0 HG3 GLU A 63 19.335 15.221 -0.671 1.00 0.00 H new ATOM 1060 N SER A 64 16.160 13.139 0.468 1.00 0.00 N ATOM 1061 CA SER A 64 16.051 12.863 1.878 1.00 0.00 C ATOM 1062 C SER A 64 14.683 12.309 2.264 1.00 0.00 C ATOM 1063 O SER A 64 13.706 12.304 1.508 1.00 0.00 O ATOM 1064 CB SER A 64 16.401 14.150 2.643 1.00 0.00 C ATOM 1065 OG SER A 64 15.626 15.255 2.209 1.00 0.00 O ATOM 0 H SER A 64 15.270 13.315 0.002 1.00 0.00 H new ATOM 0 HA SER A 64 16.754 12.075 2.148 1.00 0.00 H new ATOM 0 HB2 SER A 64 16.241 13.992 3.710 1.00 0.00 H new ATOM 0 HB3 SER A 64 17.459 14.375 2.509 1.00 0.00 H new ATOM 0 HG SER A 64 15.878 16.052 2.721 1.00 0.00 H new ATOM 1071 N ILE A 65 14.641 11.870 3.510 1.00 0.00 N ATOM 1072 CA ILE A 65 13.564 11.219 4.211 1.00 0.00 C ATOM 1073 C ILE A 65 13.539 11.854 5.612 1.00 0.00 C ATOM 1074 O ILE A 65 14.395 12.692 5.931 1.00 0.00 O ATOM 1075 CB ILE A 65 13.869 9.702 4.164 1.00 0.00 C ATOM 1076 CG1 ILE A 65 12.700 8.865 4.708 1.00 0.00 C ATOM 1077 CG2 ILE A 65 15.222 9.388 4.843 1.00 0.00 C ATOM 1078 CD1 ILE A 65 12.778 7.390 4.288 1.00 0.00 C ATOM 0 H ILE A 65 15.455 11.976 4.116 1.00 0.00 H new ATOM 0 HA ILE A 65 12.567 11.343 3.788 1.00 0.00 H new ATOM 0 HB ILE A 65 13.973 9.407 3.120 1.00 0.00 H new ATOM 0 HG12 ILE A 65 12.689 8.928 5.796 1.00 0.00 H new ATOM 0 HG13 ILE A 65 11.760 9.289 4.355 1.00 0.00 H new ATOM 0 HG21 ILE A 65 15.412 8.316 4.796 1.00 0.00 H new ATOM 0 HG22 ILE A 65 16.020 9.921 4.327 1.00 0.00 H new ATOM 0 HG23 ILE A 65 15.188 9.705 5.885 1.00 0.00 H new ATOM 0 HD11 ILE A 65 11.927 6.849 4.701 1.00 0.00 H new ATOM 0 HD12 ILE A 65 12.759 7.320 3.200 1.00 0.00 H new ATOM 0 HD13 ILE A 65 13.703 6.953 4.664 1.00 0.00 H new ATOM 1090 N ASP A 66 12.594 11.467 6.465 1.00 0.00 N ATOM 1091 CA ASP A 66 12.461 12.001 7.817 1.00 0.00 C ATOM 1092 C ASP A 66 12.315 10.872 8.830 1.00 0.00 C ATOM 1093 O ASP A 66 12.081 9.716 8.453 1.00 0.00 O ATOM 1094 CB ASP A 66 11.244 12.939 7.886 1.00 0.00 C ATOM 1095 CG ASP A 66 11.252 13.834 9.134 1.00 0.00 C ATOM 1096 OD1 ASP A 66 12.316 13.994 9.773 1.00 0.00 O ATOM 1097 OD2 ASP A 66 10.159 14.301 9.512 1.00 0.00 O ATOM 0 H ASP A 66 11.891 10.765 6.234 1.00 0.00 H new ATOM 0 HA ASP A 66 13.362 12.563 8.062 1.00 0.00 H new ATOM 0 HB2 ASP A 66 11.224 13.566 6.995 1.00 0.00 H new ATOM 0 HB3 ASP A 66 10.331 12.343 7.878 1.00 0.00 H new ATOM 1102 N SER A 67 12.383 11.230 10.112 1.00 0.00 N ATOM 1103 CA SER A 67 12.038 10.449 11.292 1.00 0.00 C ATOM 1104 C SER A 67 10.520 10.186 11.356 1.00 0.00 C ATOM 1105 O SER A 67 9.844 10.443 12.355 1.00 0.00 O ATOM 1106 CB SER A 67 12.570 11.187 12.532 1.00 0.00 C ATOM 1107 OG SER A 67 13.963 11.449 12.397 1.00 0.00 O ATOM 0 H SER A 67 12.712 12.160 10.371 1.00 0.00 H new ATOM 0 HA SER A 67 12.505 9.465 11.248 1.00 0.00 H new ATOM 0 HB2 SER A 67 12.029 12.124 12.665 1.00 0.00 H new ATOM 0 HB3 SER A 67 12.392 10.587 13.424 1.00 0.00 H new ATOM 0 HG SER A 67 14.286 11.920 13.193 1.00 0.00 H new ATOM 1113 N PHE A 68 9.962 9.693 10.255 1.00 0.00 N ATOM 1114 CA PHE A 68 8.745 8.919 10.189 1.00 0.00 C ATOM 1115 C PHE A 68 9.104 7.745 9.289 1.00 0.00 C ATOM 1116 O PHE A 68 9.343 6.631 9.758 1.00 0.00 O ATOM 1117 CB PHE A 68 7.559 9.746 9.660 1.00 0.00 C ATOM 1118 CG PHE A 68 6.238 9.024 9.803 1.00 0.00 C ATOM 1119 CD1 PHE A 68 5.896 7.976 8.929 1.00 0.00 C ATOM 1120 CD2 PHE A 68 5.349 9.393 10.827 1.00 0.00 C ATOM 1121 CE1 PHE A 68 4.675 7.296 9.077 1.00 0.00 C ATOM 1122 CE2 PHE A 68 4.129 8.716 10.966 1.00 0.00 C ATOM 1123 CZ PHE A 68 3.781 7.678 10.088 1.00 0.00 C ATOM 0 H PHE A 68 10.378 9.836 9.335 1.00 0.00 H new ATOM 0 HA PHE A 68 8.405 8.586 11.170 1.00 0.00 H new ATOM 0 HB2 PHE A 68 7.512 10.693 10.198 1.00 0.00 H new ATOM 0 HB3 PHE A 68 7.727 9.985 8.610 1.00 0.00 H new ATOM 0 HD1 PHE A 68 6.576 7.692 8.139 1.00 0.00 H new ATOM 0 HD2 PHE A 68 5.604 10.195 11.504 1.00 0.00 H new ATOM 0 HE1 PHE A 68 4.426 6.481 8.414 1.00 0.00 H new ATOM 0 HE2 PHE A 68 3.450 8.996 11.757 1.00 0.00 H new ATOM 0 HZ PHE A 68 2.830 7.176 10.190 1.00 0.00 H new ATOM 1133 N SER A 69 9.238 8.030 7.994 1.00 0.00 N ATOM 1134 CA SER A 69 9.323 7.041 6.946 1.00 0.00 C ATOM 1135 C SER A 69 10.603 6.200 7.054 1.00 0.00 C ATOM 1136 O SER A 69 10.583 5.028 6.687 1.00 0.00 O ATOM 1137 CB SER A 69 9.171 7.767 5.601 1.00 0.00 C ATOM 1138 OG SER A 69 8.241 8.846 5.701 1.00 0.00 O ATOM 0 H SER A 69 9.291 8.987 7.646 1.00 0.00 H new ATOM 0 HA SER A 69 8.517 6.313 7.041 1.00 0.00 H new ATOM 0 HB2 SER A 69 10.140 8.147 5.278 1.00 0.00 H new ATOM 0 HB3 SER A 69 8.835 7.063 4.840 1.00 0.00 H new ATOM 0 HG SER A 69 8.017 9.169 4.803 1.00 0.00 H new ATOM 1144 N LEU A 70 11.691 6.735 7.632 1.00 0.00 N ATOM 1145 CA LEU A 70 12.953 6.013 7.845 1.00 0.00 C ATOM 1146 C LEU A 70 12.748 4.666 8.547 1.00 0.00 C ATOM 1147 O LEU A 70 13.471 3.709 8.263 1.00 0.00 O ATOM 1148 CB LEU A 70 13.902 6.866 8.721 1.00 0.00 C ATOM 1149 CG LEU A 70 14.875 7.746 7.926 1.00 0.00 C ATOM 1150 CD1 LEU A 70 15.573 8.777 8.819 1.00 0.00 C ATOM 1151 CD2 LEU A 70 15.954 6.892 7.248 1.00 0.00 C ATOM 0 H LEU A 70 11.717 7.697 7.969 1.00 0.00 H new ATOM 0 HA LEU A 70 13.379 5.829 6.859 1.00 0.00 H new ATOM 0 HB2 LEU A 70 13.303 7.503 9.371 1.00 0.00 H new ATOM 0 HB3 LEU A 70 14.476 6.202 9.367 1.00 0.00 H new ATOM 0 HG LEU A 70 14.278 8.266 7.177 1.00 0.00 H new ATOM 0 HD11 LEU A 70 16.253 9.379 8.216 1.00 0.00 H new ATOM 0 HD12 LEU A 70 14.827 9.424 9.280 1.00 0.00 H new ATOM 0 HD13 LEU A 70 16.137 8.262 9.597 1.00 0.00 H new ATOM 0 HD21 LEU A 70 16.632 7.538 6.690 1.00 0.00 H new ATOM 0 HD22 LEU A 70 16.515 6.345 8.006 1.00 0.00 H new ATOM 0 HD23 LEU A 70 15.483 6.185 6.565 1.00 0.00 H new ATOM 1163 N GLY A 71 11.785 4.586 9.465 1.00 0.00 N ATOM 1164 CA GLY A 71 11.504 3.350 10.187 1.00 0.00 C ATOM 1165 C GLY A 71 10.833 2.319 9.282 1.00 0.00 C ATOM 1166 O GLY A 71 11.069 1.119 9.409 1.00 0.00 O ATOM 0 H GLY A 71 11.185 5.368 9.726 1.00 0.00 H new ATOM 0 HA2 GLY A 71 12.432 2.939 10.584 1.00 0.00 H new ATOM 0 HA3 GLY A 71 10.859 3.563 11.040 1.00 0.00 H new ATOM 1170 N VAL A 72 10.003 2.769 8.346 1.00 0.00 N ATOM 1171 CA VAL A 72 9.200 1.894 7.508 1.00 0.00 C ATOM 1172 C VAL A 72 10.070 1.239 6.433 1.00 0.00 C ATOM 1173 O VAL A 72 9.866 0.066 6.117 1.00 0.00 O ATOM 1174 CB VAL A 72 8.004 2.660 6.919 1.00 0.00 C ATOM 1175 CG1 VAL A 72 6.997 1.641 6.358 1.00 0.00 C ATOM 1176 CG2 VAL A 72 7.327 3.569 7.966 1.00 0.00 C ATOM 0 H VAL A 72 9.870 3.761 8.148 1.00 0.00 H new ATOM 0 HA VAL A 72 8.789 1.089 8.118 1.00 0.00 H new ATOM 0 HB VAL A 72 8.364 3.312 6.123 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.142 2.169 5.936 1.00 0.00 H new ATOM 0 HG12 VAL A 72 7.476 1.046 5.580 1.00 0.00 H new ATOM 0 HG13 VAL A 72 6.659 0.985 7.160 1.00 0.00 H new ATOM 0 HG21 VAL A 72 6.488 4.091 7.506 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.966 2.962 8.796 1.00 0.00 H new ATOM 0 HG23 VAL A 72 8.048 4.298 8.336 1.00 0.00 H new ATOM 1186 N ILE A 73 11.081 1.957 5.936 1.00 0.00 N ATOM 1187 CA ILE A 73 12.108 1.407 5.057 1.00 0.00 C ATOM 1188 C ILE A 73 12.766 0.203 5.768 1.00 0.00 C ATOM 1189 O ILE A 73 12.927 -0.858 5.167 1.00 0.00 O ATOM 1190 CB ILE A 73 13.092 2.543 4.667 1.00 0.00 C ATOM 1191 CG1 ILE A 73 12.604 3.448 3.508 1.00 0.00 C ATOM 1192 CG2 ILE A 73 14.456 1.998 4.207 1.00 0.00 C ATOM 1193 CD1 ILE A 73 11.169 3.980 3.529 1.00 0.00 C ATOM 0 H ILE A 73 11.208 2.949 6.137 1.00 0.00 H new ATOM 0 HA ILE A 73 11.698 1.027 4.121 1.00 0.00 H new ATOM 0 HB ILE A 73 13.164 3.123 5.587 1.00 0.00 H new ATOM 0 HG12 ILE A 73 13.272 4.308 3.460 1.00 0.00 H new ATOM 0 HG13 ILE A 73 12.734 2.891 2.580 1.00 0.00 H new ATOM 0 HG21 ILE A 73 15.110 2.829 3.945 1.00 0.00 H new ATOM 0 HG22 ILE A 73 14.908 1.421 5.014 1.00 0.00 H new ATOM 0 HG23 ILE A 73 14.317 1.357 3.336 1.00 0.00 H new ATOM 0 HD11 ILE A 73 10.996 4.594 2.645 1.00 0.00 H new ATOM 0 HD12 ILE A 73 10.471 3.143 3.532 1.00 0.00 H new ATOM 0 HD13 ILE A 73 11.017 4.582 4.425 1.00 0.00 H new ATOM 1205 N VAL A 74 13.119 0.329 7.055 1.00 0.00 N ATOM 1206 CA VAL A 74 13.653 -0.790 7.833 1.00 0.00 C ATOM 1207 C VAL A 74 12.599 -1.887 7.963 1.00 0.00 C ATOM 1208 O VAL A 74 12.923 -3.048 7.749 1.00 0.00 O ATOM 1209 CB VAL A 74 14.170 -0.309 9.204 1.00 0.00 C ATOM 1210 CG1 VAL A 74 14.531 -1.481 10.123 1.00 0.00 C ATOM 1211 CG2 VAL A 74 15.392 0.590 9.006 1.00 0.00 C ATOM 0 H VAL A 74 13.042 1.201 7.579 1.00 0.00 H new ATOM 0 HA VAL A 74 14.508 -1.215 7.307 1.00 0.00 H new ATOM 0 HB VAL A 74 13.368 0.252 9.684 1.00 0.00 H new ATOM 0 HG11 VAL A 74 14.891 -1.097 11.078 1.00 0.00 H new ATOM 0 HG12 VAL A 74 13.648 -2.098 10.289 1.00 0.00 H new ATOM 0 HG13 VAL A 74 15.311 -2.082 9.656 1.00 0.00 H new ATOM 0 HG21 VAL A 74 15.756 0.929 9.976 1.00 0.00 H new ATOM 0 HG22 VAL A 74 16.178 0.030 8.499 1.00 0.00 H new ATOM 0 HG23 VAL A 74 15.114 1.453 8.401 1.00 0.00 H new ATOM 1221 N ASN A 75 11.346 -1.569 8.289 1.00 0.00 N ATOM 1222 CA ASN A 75 10.276 -2.543 8.453 1.00 0.00 C ATOM 1223 C ASN A 75 10.158 -3.515 7.276 1.00 0.00 C ATOM 1224 O ASN A 75 9.923 -4.709 7.480 1.00 0.00 O ATOM 1225 CB ASN A 75 8.972 -1.760 8.576 1.00 0.00 C ATOM 1226 CG ASN A 75 7.963 -2.488 9.426 1.00 0.00 C ATOM 1227 OD1 ASN A 75 7.667 -3.659 9.235 1.00 0.00 O ATOM 1228 ND2 ASN A 75 7.420 -1.790 10.397 1.00 0.00 N ATOM 0 H ASN A 75 11.044 -0.608 8.449 1.00 0.00 H new ATOM 0 HA ASN A 75 10.493 -3.146 9.335 1.00 0.00 H new ATOM 0 HB2 ASN A 75 9.175 -0.781 9.010 1.00 0.00 H new ATOM 0 HB3 ASN A 75 8.556 -1.588 7.583 1.00 0.00 H new ATOM 0 HD21 ASN A 75 6.733 -2.223 11.014 1.00 0.00 H new ATOM 0 HD22 ASN A 75 7.685 -0.815 10.534 1.00 0.00 H new ATOM 1235 N ILE A 76 10.330 -3.001 6.055 1.00 0.00 N ATOM 1236 CA ILE A 76 10.358 -3.790 4.831 1.00 0.00 C ATOM 1237 C ILE A 76 11.516 -4.794 4.889 1.00 0.00 C ATOM 1238 O ILE A 76 11.294 -5.978 4.634 1.00 0.00 O ATOM 1239 CB ILE A 76 10.404 -2.847 3.602 1.00 0.00 C ATOM 1240 CG1 ILE A 76 9.011 -2.184 3.428 1.00 0.00 C ATOM 1241 CG2 ILE A 76 10.791 -3.622 2.325 1.00 0.00 C ATOM 1242 CD1 ILE A 76 8.979 -1.039 2.432 1.00 0.00 C ATOM 0 H ILE A 76 10.456 -2.002 5.892 1.00 0.00 H new ATOM 0 HA ILE A 76 9.447 -4.380 4.730 1.00 0.00 H new ATOM 0 HB ILE A 76 11.162 -2.081 3.766 1.00 0.00 H new ATOM 0 HG12 ILE A 76 8.298 -2.945 3.111 1.00 0.00 H new ATOM 0 HG13 ILE A 76 8.674 -1.815 4.397 1.00 0.00 H new ATOM 0 HG21 ILE A 76 10.816 -2.937 1.477 1.00 0.00 H new ATOM 0 HG22 ILE A 76 11.775 -4.072 2.457 1.00 0.00 H new ATOM 0 HG23 ILE A 76 10.056 -4.405 2.138 1.00 0.00 H new ATOM 0 HD11 ILE A 76 7.968 -0.635 2.374 1.00 0.00 H new ATOM 0 HD12 ILE A 76 9.664 -0.256 2.756 1.00 0.00 H new ATOM 0 HD13 ILE A 76 9.282 -1.402 1.450 1.00 0.00 H new ATOM 1254 N LEU A 77 12.728 -4.359 5.262 1.00 0.00 N ATOM 1255 CA LEU A 77 13.884 -5.246 5.367 1.00 0.00 C ATOM 1256 C LEU A 77 13.562 -6.324 6.379 1.00 0.00 C ATOM 1257 O LEU A 77 13.809 -7.495 6.122 1.00 0.00 O ATOM 1258 CB LEU A 77 15.143 -4.457 5.777 1.00 0.00 C ATOM 1259 CG LEU A 77 16.392 -5.254 6.221 1.00 0.00 C ATOM 1260 CD1 LEU A 77 16.310 -5.891 7.589 1.00 0.00 C ATOM 1261 CD2 LEU A 77 16.936 -6.264 5.211 1.00 0.00 C ATOM 0 H LEU A 77 12.929 -3.387 5.497 1.00 0.00 H new ATOM 0 HA LEU A 77 14.094 -5.702 4.399 1.00 0.00 H new ATOM 0 HB2 LEU A 77 15.431 -3.828 4.934 1.00 0.00 H new ATOM 0 HB3 LEU A 77 14.867 -3.789 6.593 1.00 0.00 H new ATOM 0 HG LEU A 77 17.116 -4.442 6.282 1.00 0.00 H new ATOM 0 HD11 LEU A 77 17.238 -6.424 7.799 1.00 0.00 H new ATOM 0 HD12 LEU A 77 16.158 -5.118 8.342 1.00 0.00 H new ATOM 0 HD13 LEU A 77 15.476 -6.592 7.615 1.00 0.00 H new ATOM 0 HD21 LEU A 77 17.810 -6.762 5.630 1.00 0.00 H new ATOM 0 HD22 LEU A 77 16.168 -7.005 4.988 1.00 0.00 H new ATOM 0 HD23 LEU A 77 17.218 -5.746 4.294 1.00 0.00 H new ATOM 1273 N LYS A 78 13.028 -5.934 7.536 1.00 0.00 N ATOM 1274 CA LYS A 78 12.769 -6.858 8.627 1.00 0.00 C ATOM 1275 C LYS A 78 11.870 -7.990 8.168 1.00 0.00 C ATOM 1276 O LYS A 78 12.193 -9.147 8.419 1.00 0.00 O ATOM 1277 CB LYS A 78 12.162 -6.120 9.817 1.00 0.00 C ATOM 1278 CG LYS A 78 13.172 -5.146 10.427 1.00 0.00 C ATOM 1279 CD LYS A 78 12.648 -4.672 11.784 1.00 0.00 C ATOM 1280 CE LYS A 78 13.762 -4.094 12.653 1.00 0.00 C ATOM 1281 NZ LYS A 78 13.462 -4.313 14.080 1.00 0.00 N ATOM 0 H LYS A 78 12.765 -4.969 7.738 1.00 0.00 H new ATOM 0 HA LYS A 78 13.716 -7.293 8.946 1.00 0.00 H new ATOM 0 HB2 LYS A 78 11.273 -5.576 9.498 1.00 0.00 H new ATOM 0 HB3 LYS A 78 11.842 -6.839 10.571 1.00 0.00 H new ATOM 0 HG2 LYS A 78 14.140 -5.633 10.546 1.00 0.00 H new ATOM 0 HG3 LYS A 78 13.323 -4.295 9.763 1.00 0.00 H new ATOM 0 HD2 LYS A 78 11.877 -3.917 11.632 1.00 0.00 H new ATOM 0 HD3 LYS A 78 12.178 -5.507 12.304 1.00 0.00 H new ATOM 0 HE2 LYS A 78 14.712 -4.563 12.398 1.00 0.00 H new ATOM 0 HE3 LYS A 78 13.870 -3.027 12.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 14.228 -3.915 14.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 12.565 -3.845 14.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 13.381 -5.333 14.265 1.00 0.00 H new ATOM 1295 N SER A 79 10.792 -7.654 7.456 1.00 0.00 N ATOM 1296 CA SER A 79 9.914 -8.642 6.865 1.00 0.00 C ATOM 1297 C SER A 79 10.748 -9.578 6.003 1.00 0.00 C ATOM 1298 O SER A 79 10.773 -10.772 6.260 1.00 0.00 O ATOM 1299 CB SER A 79 8.814 -7.949 6.060 1.00 0.00 C ATOM 1300 OG SER A 79 7.738 -8.835 5.839 1.00 0.00 O ATOM 0 H SER A 79 10.512 -6.689 7.279 1.00 0.00 H new ATOM 0 HA SER A 79 9.422 -9.230 7.639 1.00 0.00 H new ATOM 0 HB2 SER A 79 8.463 -7.066 6.595 1.00 0.00 H new ATOM 0 HB3 SER A 79 9.213 -7.606 5.106 1.00 0.00 H new ATOM 0 HG SER A 79 6.892 -8.346 5.910 1.00 0.00 H new ATOM 1306 N ILE A 80 11.452 -9.041 5.010 1.00 0.00 N ATOM 1307 CA ILE A 80 12.205 -9.802 4.025 1.00 0.00 C ATOM 1308 C ILE A 80 13.215 -10.743 4.690 1.00 0.00 C ATOM 1309 O ILE A 80 13.291 -11.920 4.329 1.00 0.00 O ATOM 1310 CB ILE A 80 12.860 -8.797 3.062 1.00 0.00 C ATOM 1311 CG1 ILE A 80 11.783 -8.126 2.187 1.00 0.00 C ATOM 1312 CG2 ILE A 80 13.911 -9.454 2.170 1.00 0.00 C ATOM 1313 CD1 ILE A 80 12.389 -6.985 1.379 1.00 0.00 C ATOM 0 H ILE A 80 11.514 -8.033 4.867 1.00 0.00 H new ATOM 0 HA ILE A 80 11.543 -10.458 3.459 1.00 0.00 H new ATOM 0 HB ILE A 80 13.365 -8.047 3.671 1.00 0.00 H new ATOM 0 HG12 ILE A 80 11.342 -8.862 1.515 1.00 0.00 H new ATOM 0 HG13 ILE A 80 10.978 -7.747 2.817 1.00 0.00 H new ATOM 0 HG21 ILE A 80 14.345 -8.705 1.508 1.00 0.00 H new ATOM 0 HG22 ILE A 80 14.695 -9.888 2.791 1.00 0.00 H new ATOM 0 HG23 ILE A 80 13.444 -10.238 1.574 1.00 0.00 H new ATOM 0 HD11 ILE A 80 11.615 -6.522 0.767 1.00 0.00 H new ATOM 0 HD12 ILE A 80 12.808 -6.242 2.057 1.00 0.00 H new ATOM 0 HD13 ILE A 80 13.177 -7.374 0.735 1.00 0.00 H new ATOM 1325 N SER A 81 14.001 -10.243 5.642 1.00 0.00 N ATOM 1326 CA SER A 81 15.018 -11.014 6.331 1.00 0.00 C ATOM 1327 C SER A 81 14.432 -12.086 7.252 1.00 0.00 C ATOM 1328 O SER A 81 15.184 -12.987 7.633 1.00 0.00 O ATOM 1329 CB SER A 81 15.943 -10.069 7.101 1.00 0.00 C ATOM 1330 OG SER A 81 16.772 -9.365 6.195 1.00 0.00 O ATOM 0 H SER A 81 13.943 -9.274 5.957 1.00 0.00 H new ATOM 0 HA SER A 81 15.593 -11.551 5.576 1.00 0.00 H new ATOM 0 HB2 SER A 81 15.352 -9.366 7.689 1.00 0.00 H new ATOM 0 HB3 SER A 81 16.555 -10.636 7.803 1.00 0.00 H new ATOM 0 HG SER A 81 17.361 -8.760 6.693 1.00 0.00 H new ATOM 1336 N SER A 82 13.138 -12.041 7.571 1.00 0.00 N ATOM 1337 CA SER A 82 12.409 -13.165 8.136 1.00 0.00 C ATOM 1338 C SER A 82 11.851 -14.061 7.019 1.00 0.00 C ATOM 1339 O SER A 82 11.990 -15.279 7.102 1.00 0.00 O ATOM 1340 CB SER A 82 11.299 -12.629 9.046 1.00 0.00 C ATOM 1341 OG SER A 82 11.851 -11.848 10.097 1.00 0.00 O ATOM 0 H SER A 82 12.563 -11.208 7.440 1.00 0.00 H new ATOM 0 HA SER A 82 13.080 -13.783 8.733 1.00 0.00 H new ATOM 0 HB2 SER A 82 10.603 -12.026 8.464 1.00 0.00 H new ATOM 0 HB3 SER A 82 10.729 -13.460 9.463 1.00 0.00 H new ATOM 0 HG SER A 82 12.037 -10.943 9.769 1.00 0.00 H new ATOM 1347 N SER A 83 11.250 -13.489 5.973 1.00 0.00 N ATOM 1348 CA SER A 83 10.580 -14.185 4.880 1.00 0.00 C ATOM 1349 C SER A 83 11.494 -15.017 3.990 1.00 0.00 C ATOM 1350 O SER A 83 10.970 -15.803 3.196 1.00 0.00 O ATOM 1351 CB SER A 83 9.934 -13.162 3.948 1.00 0.00 C ATOM 1352 OG SER A 83 8.874 -12.442 4.562 1.00 0.00 O ATOM 0 H SER A 83 11.218 -12.475 5.863 1.00 0.00 H new ATOM 0 HA SER A 83 9.874 -14.852 5.374 1.00 0.00 H new ATOM 0 HB2 SER A 83 10.694 -12.459 3.607 1.00 0.00 H new ATOM 0 HB3 SER A 83 9.554 -13.674 3.064 1.00 0.00 H new ATOM 0 HG SER A 83 9.244 -11.795 5.199 1.00 0.00 H new ATOM 1358 N GLY A 84 12.811 -14.794 4.013 1.00 0.00 N ATOM 1359 CA GLY A 84 13.718 -15.565 3.180 1.00 0.00 C ATOM 1360 C GLY A 84 14.597 -14.771 2.227 1.00 0.00 C ATOM 1361 O GLY A 84 15.330 -15.395 1.456 1.00 0.00 O ATOM 0 H GLY A 84 13.263 -14.090 4.597 1.00 0.00 H new ATOM 0 HA2 GLY A 84 14.364 -16.153 3.831 1.00 0.00 H new ATOM 0 HA3 GLY A 84 13.128 -16.270 2.594 1.00 0.00 H new ATOM 1365 N GLY A 85 14.509 -13.441 2.195 1.00 0.00 N ATOM 1366 CA GLY A 85 15.039 -12.643 1.106 1.00 0.00 C ATOM 1367 C GLY A 85 16.171 -11.713 1.523 1.00 0.00 C ATOM 1368 O GLY A 85 16.722 -11.828 2.622 1.00 0.00 O ATOM 0 H GLY A 85 14.065 -12.891 2.930 1.00 0.00 H new ATOM 0 HA2 GLY A 85 15.398 -13.308 0.321 1.00 0.00 H new ATOM 0 HA3 GLY A 85 14.232 -12.049 0.676 1.00 0.00 H new ATOM 1372 N PHE A 86 16.476 -10.759 0.647 1.00 0.00 N ATOM 1373 CA PHE A 86 17.417 -9.666 0.866 1.00 0.00 C ATOM 1374 C PHE A 86 16.758 -8.356 0.444 1.00 0.00 C ATOM 1375 O PHE A 86 15.894 -8.334 -0.437 1.00 0.00 O ATOM 1376 CB PHE A 86 18.697 -9.879 0.044 1.00 0.00 C ATOM 1377 CG PHE A 86 19.923 -10.310 0.830 1.00 0.00 C ATOM 1378 CD1 PHE A 86 19.926 -11.593 1.409 1.00 0.00 C ATOM 1379 CD2 PHE A 86 21.059 -9.472 0.978 1.00 0.00 C ATOM 1380 CE1 PHE A 86 21.030 -12.042 2.150 1.00 0.00 C ATOM 1381 CE2 PHE A 86 22.155 -9.935 1.722 1.00 0.00 C ATOM 1382 CZ PHE A 86 22.149 -11.211 2.307 1.00 0.00 C ATOM 0 H PHE A 86 16.052 -10.727 -0.280 1.00 0.00 H new ATOM 0 HA PHE A 86 17.685 -9.634 1.922 1.00 0.00 H new ATOM 0 HB2 PHE A 86 18.495 -10.631 -0.719 1.00 0.00 H new ATOM 0 HB3 PHE A 86 18.931 -8.950 -0.477 1.00 0.00 H new ATOM 0 HD1 PHE A 86 19.070 -12.239 1.282 1.00 0.00 H new ATOM 0 HD2 PHE A 86 21.080 -8.492 0.524 1.00 0.00 H new ATOM 0 HE1 PHE A 86 21.018 -13.025 2.598 1.00 0.00 H new ATOM 0 HE2 PHE A 86 23.018 -9.298 1.847 1.00 0.00 H new ATOM 0 HZ PHE A 86 23.002 -11.551 2.875 1.00 0.00 H new ATOM 1392 N PHE A 87 17.213 -7.254 1.031 1.00 0.00 N ATOM 1393 CA PHE A 87 16.891 -5.909 0.585 1.00 0.00 C ATOM 1394 C PHE A 87 18.192 -5.205 0.317 1.00 0.00 C ATOM 1395 O PHE A 87 19.134 -5.323 1.109 1.00 0.00 O ATOM 1396 CB PHE A 87 16.155 -5.146 1.678 1.00 0.00 C ATOM 1397 CG PHE A 87 15.912 -3.658 1.468 1.00 0.00 C ATOM 1398 CD1 PHE A 87 15.408 -3.164 0.247 1.00 0.00 C ATOM 1399 CD2 PHE A 87 16.069 -2.776 2.559 1.00 0.00 C ATOM 1400 CE1 PHE A 87 14.862 -1.869 0.201 1.00 0.00 C ATOM 1401 CE2 PHE A 87 15.407 -1.538 2.547 1.00 0.00 C ATOM 1402 CZ PHE A 87 14.781 -1.089 1.370 1.00 0.00 C ATOM 0 H PHE A 87 17.827 -7.274 1.845 1.00 0.00 H new ATOM 0 HA PHE A 87 16.259 -5.955 -0.302 1.00 0.00 H new ATOM 0 HB2 PHE A 87 15.187 -5.625 1.827 1.00 0.00 H new ATOM 0 HB3 PHE A 87 16.716 -5.266 2.605 1.00 0.00 H new ATOM 0 HD1 PHE A 87 15.441 -3.774 -0.644 1.00 0.00 H new ATOM 0 HD2 PHE A 87 16.693 -3.051 3.396 1.00 0.00 H new ATOM 0 HE1 PHE A 87 14.503 -1.471 -0.736 1.00 0.00 H new ATOM 0 HE2 PHE A 87 15.378 -0.931 3.440 1.00 0.00 H new ATOM 0 HZ PHE A 87 14.242 -0.153 1.363 1.00 0.00 H new ATOM 1412 N ALA A 88 18.209 -4.402 -0.739 1.00 0.00 N ATOM 1413 CA ALA A 88 19.317 -3.493 -0.923 1.00 0.00 C ATOM 1414 C ALA A 88 18.882 -2.180 -1.526 1.00 0.00 C ATOM 1415 O ALA A 88 17.746 -2.046 -1.972 1.00 0.00 O ATOM 1416 CB ALA A 88 20.392 -4.137 -1.772 1.00 0.00 C ATOM 0 H ALA A 88 17.487 -4.365 -1.459 1.00 0.00 H new ATOM 0 HA ALA A 88 19.725 -3.275 0.064 1.00 0.00 H new ATOM 0 HB1 ALA A 88 21.220 -3.440 -1.902 1.00 0.00 H new ATOM 0 HB2 ALA A 88 20.752 -5.040 -1.280 1.00 0.00 H new ATOM 0 HB3 ALA A 88 19.979 -4.395 -2.747 1.00 0.00 H new ATOM 1422 N LEU A 89 19.769 -1.196 -1.489 1.00 0.00 N ATOM 1423 CA LEU A 89 19.466 0.147 -1.941 1.00 0.00 C ATOM 1424 C LEU A 89 20.442 0.474 -3.051 1.00 0.00 C ATOM 1425 O LEU A 89 21.481 -0.173 -3.166 1.00 0.00 O ATOM 1426 CB LEU A 89 19.512 1.182 -0.802 1.00 0.00 C ATOM 1427 CG LEU A 89 19.059 0.716 0.591 1.00 0.00 C ATOM 1428 CD1 LEU A 89 18.735 1.873 1.535 1.00 0.00 C ATOM 1429 CD2 LEU A 89 17.861 -0.223 0.615 1.00 0.00 C ATOM 0 H LEU A 89 20.722 -1.311 -1.143 1.00 0.00 H new ATOM 0 HA LEU A 89 18.441 0.192 -2.310 1.00 0.00 H new ATOM 0 HB2 LEU A 89 20.535 1.548 -0.719 1.00 0.00 H new ATOM 0 HB3 LEU A 89 18.893 2.031 -1.092 1.00 0.00 H new ATOM 0 HG LEU A 89 19.936 0.164 0.930 1.00 0.00 H new ATOM 0 HD11 LEU A 89 18.422 1.477 2.501 1.00 0.00 H new ATOM 0 HD12 LEU A 89 19.621 2.494 1.667 1.00 0.00 H new ATOM 0 HD13 LEU A 89 17.931 2.474 1.111 1.00 0.00 H new ATOM 0 HD21 LEU A 89 17.627 -0.488 1.646 1.00 0.00 H new ATOM 0 HD22 LEU A 89 17.001 0.273 0.164 1.00 0.00 H new ATOM 0 HD23 LEU A 89 18.095 -1.126 0.052 1.00 0.00 H new ATOM 1441 N VAL A 90 20.100 1.457 -3.868 1.00 0.00 N ATOM 1442 CA VAL A 90 20.826 1.790 -5.074 1.00 0.00 C ATOM 1443 C VAL A 90 21.004 3.296 -5.116 1.00 0.00 C ATOM 1444 O VAL A 90 20.055 4.033 -4.819 1.00 0.00 O ATOM 1445 CB VAL A 90 20.054 1.226 -6.276 1.00 0.00 C ATOM 1446 CG1 VAL A 90 20.521 1.835 -7.604 1.00 0.00 C ATOM 1447 CG2 VAL A 90 20.175 -0.305 -6.289 1.00 0.00 C ATOM 0 H VAL A 90 19.291 2.056 -3.704 1.00 0.00 H new ATOM 0 HA VAL A 90 21.821 1.347 -5.100 1.00 0.00 H new ATOM 0 HB VAL A 90 19.005 1.501 -6.167 1.00 0.00 H new ATOM 0 HG11 VAL A 90 19.946 1.405 -8.424 1.00 0.00 H new ATOM 0 HG12 VAL A 90 20.370 2.914 -7.582 1.00 0.00 H new ATOM 0 HG13 VAL A 90 21.579 1.619 -7.751 1.00 0.00 H new ATOM 0 HG21 VAL A 90 19.627 -0.706 -7.142 1.00 0.00 H new ATOM 0 HG22 VAL A 90 21.225 -0.586 -6.367 1.00 0.00 H new ATOM 0 HG23 VAL A 90 19.759 -0.711 -5.367 1.00 0.00 H new ATOM 1457 N SER A 91 22.195 3.736 -5.513 1.00 0.00 N ATOM 1458 CA SER A 91 22.578 5.134 -5.609 1.00 0.00 C ATOM 1459 C SER A 91 22.445 5.862 -4.257 1.00 0.00 C ATOM 1460 O SER A 91 21.621 6.771 -4.132 1.00 0.00 O ATOM 1461 CB SER A 91 21.769 5.776 -6.746 1.00 0.00 C ATOM 1462 OG SER A 91 21.867 5.005 -7.928 1.00 0.00 O ATOM 0 H SER A 91 22.945 3.101 -5.786 1.00 0.00 H new ATOM 0 HA SER A 91 23.636 5.221 -5.854 1.00 0.00 H new ATOM 0 HB2 SER A 91 20.724 5.865 -6.450 1.00 0.00 H new ATOM 0 HB3 SER A 91 22.134 6.786 -6.933 1.00 0.00 H new ATOM 0 HG SER A 91 22.667 4.441 -7.885 1.00 0.00 H new ATOM 1468 N PRO A 92 23.163 5.435 -3.198 1.00 0.00 N ATOM 1469 CA PRO A 92 23.154 6.106 -1.908 1.00 0.00 C ATOM 1470 C PRO A 92 24.133 7.287 -1.924 1.00 0.00 C ATOM 1471 O PRO A 92 25.352 7.117 -1.802 1.00 0.00 O ATOM 1472 CB PRO A 92 23.513 5.021 -0.899 1.00 0.00 C ATOM 1473 CG PRO A 92 24.474 4.122 -1.680 1.00 0.00 C ATOM 1474 CD PRO A 92 24.038 4.268 -3.137 1.00 0.00 C ATOM 0 HA PRO A 92 22.191 6.547 -1.650 1.00 0.00 H new ATOM 0 HB2 PRO A 92 23.985 5.438 -0.010 1.00 0.00 H new ATOM 0 HB3 PRO A 92 22.631 4.474 -0.565 1.00 0.00 H new ATOM 0 HG2 PRO A 92 25.509 4.434 -1.543 1.00 0.00 H new ATOM 0 HG3 PRO A 92 24.407 3.086 -1.348 1.00 0.00 H new ATOM 0 HD2 PRO A 92 24.902 4.398 -3.788 1.00 0.00 H new ATOM 0 HD3 PRO A 92 23.515 3.374 -3.476 1.00 0.00 H new ATOM 1482 N ASN A 93 23.579 8.487 -2.088 1.00 0.00 N ATOM 1483 CA ASN A 93 24.300 9.749 -2.045 1.00 0.00 C ATOM 1484 C ASN A 93 24.836 9.963 -0.636 1.00 0.00 C ATOM 1485 O ASN A 93 24.400 9.329 0.327 1.00 0.00 O ATOM 1486 CB ASN A 93 23.375 10.937 -2.345 1.00 0.00 C ATOM 1487 CG ASN A 93 22.504 10.796 -3.581 1.00 0.00 C ATOM 1488 OD1 ASN A 93 22.853 10.173 -4.577 1.00 0.00 O ATOM 1489 ND2 ASN A 93 21.330 11.375 -3.489 1.00 0.00 N ATOM 0 H ASN A 93 22.581 8.607 -2.260 1.00 0.00 H new ATOM 0 HA ASN A 93 25.094 9.700 -2.790 1.00 0.00 H new ATOM 0 HB2 ASN A 93 22.728 11.097 -1.483 1.00 0.00 H new ATOM 0 HB3 ASN A 93 23.987 11.832 -2.454 1.00 0.00 H new ATOM 0 HD21 ASN A 93 20.670 11.316 -4.264 1.00 0.00 H new ATOM 0 HD22 ASN A 93 21.078 11.884 -2.642 1.00 0.00 H new ATOM 1496 N GLU A 94 25.683 10.972 -0.468 1.00 0.00 N ATOM 1497 CA GLU A 94 26.317 11.187 0.823 1.00 0.00 C ATOM 1498 C GLU A 94 25.318 11.728 1.856 1.00 0.00 C ATOM 1499 O GLU A 94 25.406 11.427 3.045 1.00 0.00 O ATOM 1500 CB GLU A 94 27.548 12.082 0.654 1.00 0.00 C ATOM 1501 CG GLU A 94 28.265 12.109 2.000 1.00 0.00 C ATOM 1502 CD GLU A 94 29.687 12.638 1.937 1.00 0.00 C ATOM 1503 OE1 GLU A 94 30.591 11.914 1.457 1.00 0.00 O ATOM 1504 OE2 GLU A 94 29.922 13.757 2.447 1.00 0.00 O ATOM 0 H GLU A 94 25.942 11.640 -1.194 1.00 0.00 H new ATOM 0 HA GLU A 94 26.660 10.230 1.217 1.00 0.00 H new ATOM 0 HB2 GLU A 94 28.204 11.693 -0.125 1.00 0.00 H new ATOM 0 HB3 GLU A 94 27.256 13.088 0.352 1.00 0.00 H new ATOM 0 HG2 GLU A 94 27.691 12.724 2.693 1.00 0.00 H new ATOM 0 HG3 GLU A 94 28.283 11.099 2.410 1.00 0.00 H new ATOM 1511 N LYS A 95 24.307 12.480 1.414 1.00 0.00 N ATOM 1512 CA LYS A 95 23.262 12.996 2.281 1.00 0.00 C ATOM 1513 C LYS A 95 22.572 11.831 2.966 1.00 0.00 C ATOM 1514 O LYS A 95 22.340 11.918 4.171 1.00 0.00 O ATOM 1515 CB LYS A 95 22.328 13.912 1.467 1.00 0.00 C ATOM 1516 CG LYS A 95 20.854 13.920 1.901 1.00 0.00 C ATOM 1517 CD LYS A 95 20.608 14.566 3.267 1.00 0.00 C ATOM 1518 CE LYS A 95 19.789 13.652 4.196 1.00 0.00 C ATOM 1519 NZ LYS A 95 19.289 14.381 5.378 1.00 0.00 N ATOM 0 H LYS A 95 24.196 12.746 0.436 1.00 0.00 H new ATOM 0 HA LYS A 95 23.666 13.621 3.078 1.00 0.00 H new ATOM 0 HB2 LYS A 95 22.710 14.931 1.524 1.00 0.00 H new ATOM 0 HB3 LYS A 95 22.377 13.612 0.420 1.00 0.00 H new ATOM 0 HG2 LYS A 95 20.268 14.450 1.150 1.00 0.00 H new ATOM 0 HG3 LYS A 95 20.488 12.894 1.925 1.00 0.00 H new ATOM 0 HD2 LYS A 95 21.564 14.797 3.736 1.00 0.00 H new ATOM 0 HD3 LYS A 95 20.082 15.511 3.132 1.00 0.00 H new ATOM 0 HE2 LYS A 95 18.948 13.233 3.644 1.00 0.00 H new ATOM 0 HE3 LYS A 95 20.407 12.815 4.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 18.742 13.733 5.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 20.093 14.760 5.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 18.679 15.165 5.070 1.00 0.00 H new ATOM 1533 N VAL A 96 22.214 10.762 2.252 1.00 0.00 N ATOM 1534 CA VAL A 96 21.587 9.662 2.899 1.00 0.00 C ATOM 1535 C VAL A 96 22.604 8.793 3.617 1.00 0.00 C ATOM 1536 O VAL A 96 22.288 8.344 4.707 1.00 0.00 O ATOM 1537 CB VAL A 96 20.772 8.855 1.896 1.00 0.00 C ATOM 1538 CG1 VAL A 96 19.581 9.617 1.308 1.00 0.00 C ATOM 1539 CG2 VAL A 96 21.546 8.183 0.774 1.00 0.00 C ATOM 0 H VAL A 96 22.353 10.656 1.247 1.00 0.00 H new ATOM 0 HA VAL A 96 20.906 10.050 3.656 1.00 0.00 H new ATOM 0 HB VAL A 96 20.406 8.051 2.534 1.00 0.00 H new ATOM 0 HG11 VAL A 96 19.051 8.976 0.603 1.00 0.00 H new ATOM 0 HG12 VAL A 96 18.905 9.911 2.111 1.00 0.00 H new ATOM 0 HG13 VAL A 96 19.938 10.507 0.791 1.00 0.00 H new ATOM 0 HG21 VAL A 96 20.855 7.641 0.129 1.00 0.00 H new ATOM 0 HG22 VAL A 96 22.070 8.939 0.190 1.00 0.00 H new ATOM 0 HG23 VAL A 96 22.269 7.486 1.197 1.00 0.00 H new ATOM 1549 N GLU A 97 23.810 8.568 3.099 1.00 0.00 N ATOM 1550 CA GLU A 97 24.805 7.728 3.768 1.00 0.00 C ATOM 1551 C GLU A 97 25.062 8.269 5.168 1.00 0.00 C ATOM 1552 O GLU A 97 25.250 7.485 6.106 1.00 0.00 O ATOM 1553 CB GLU A 97 26.116 7.632 2.970 1.00 0.00 C ATOM 1554 CG GLU A 97 26.044 6.593 1.840 1.00 0.00 C ATOM 1555 CD GLU A 97 26.245 5.155 2.345 1.00 0.00 C ATOM 1556 OE1 GLU A 97 25.441 4.691 3.187 1.00 0.00 O ATOM 1557 OE2 GLU A 97 27.251 4.515 1.951 1.00 0.00 O ATOM 0 H GLU A 97 24.125 8.959 2.211 1.00 0.00 H new ATOM 0 HA GLU A 97 24.406 6.716 3.834 1.00 0.00 H new ATOM 0 HB2 GLU A 97 26.352 8.608 2.547 1.00 0.00 H new ATOM 0 HB3 GLU A 97 26.931 7.372 3.646 1.00 0.00 H new ATOM 0 HG2 GLU A 97 25.076 6.668 1.344 1.00 0.00 H new ATOM 0 HG3 GLU A 97 26.804 6.821 1.093 1.00 0.00 H new ATOM 1564 N ARG A 98 24.935 9.591 5.361 1.00 0.00 N ATOM 1565 CA ARG A 98 25.117 10.150 6.681 1.00 0.00 C ATOM 1566 C ARG A 98 24.081 9.621 7.664 1.00 0.00 C ATOM 1567 O ARG A 98 24.397 9.411 8.834 1.00 0.00 O ATOM 1568 CB ARG A 98 25.230 11.683 6.622 1.00 0.00 C ATOM 1569 CG ARG A 98 23.929 12.440 6.866 1.00 0.00 C ATOM 1570 CD ARG A 98 23.764 12.773 8.355 1.00 0.00 C ATOM 1571 NE ARG A 98 22.408 13.262 8.649 1.00 0.00 N ATOM 1572 CZ ARG A 98 21.610 12.871 9.647 1.00 0.00 C ATOM 1573 NH1 ARG A 98 22.039 11.976 10.534 1.00 0.00 N ATOM 1574 NH2 ARG A 98 20.383 13.373 9.742 1.00 0.00 N ATOM 0 H ARG A 98 24.712 10.267 4.630 1.00 0.00 H new ATOM 0 HA ARG A 98 26.072 9.808 7.080 1.00 0.00 H new ATOM 0 HB2 ARG A 98 25.964 12.006 7.361 1.00 0.00 H new ATOM 0 HB3 ARG A 98 25.618 11.965 5.643 1.00 0.00 H new ATOM 0 HG2 ARG A 98 23.922 13.359 6.280 1.00 0.00 H new ATOM 0 HG3 ARG A 98 23.085 11.840 6.527 1.00 0.00 H new ATOM 0 HD2 ARG A 98 23.970 11.885 8.953 1.00 0.00 H new ATOM 0 HD3 ARG A 98 24.495 13.528 8.644 1.00 0.00 H new ATOM 0 HE ARG A 98 22.037 13.977 8.023 1.00 0.00 H new ATOM 0 HH11 ARG A 98 22.979 11.587 10.453 1.00 0.00 H new ATOM 0 HH12 ARG A 98 21.428 11.679 11.295 1.00 0.00 H new ATOM 0 HH21 ARG A 98 20.055 14.053 9.055 1.00 0.00 H new ATOM 0 HH22 ARG A 98 19.769 13.079 10.501 1.00 0.00 H new ATOM 1588 N VAL A 99 22.834 9.443 7.233 1.00 0.00 N ATOM 1589 CA VAL A 99 21.720 9.130 8.106 1.00 0.00 C ATOM 1590 C VAL A 99 21.521 7.622 8.108 1.00 0.00 C ATOM 1591 O VAL A 99 21.126 7.077 9.133 1.00 0.00 O ATOM 1592 CB VAL A 99 20.478 9.954 7.676 1.00 0.00 C ATOM 1593 CG1 VAL A 99 19.753 9.512 6.413 1.00 0.00 C ATOM 1594 CG2 VAL A 99 19.438 9.998 8.800 1.00 0.00 C ATOM 0 H VAL A 99 22.572 9.515 6.250 1.00 0.00 H new ATOM 0 HA VAL A 99 21.912 9.418 9.140 1.00 0.00 H new ATOM 0 HB VAL A 99 20.914 10.928 7.454 1.00 0.00 H new ATOM 0 HG11 VAL A 99 18.906 10.173 6.229 1.00 0.00 H new ATOM 0 HG12 VAL A 99 20.438 9.555 5.566 1.00 0.00 H new ATOM 0 HG13 VAL A 99 19.395 8.490 6.538 1.00 0.00 H new ATOM 0 HG21 VAL A 99 18.576 10.581 8.476 1.00 0.00 H new ATOM 0 HG22 VAL A 99 19.120 8.984 9.041 1.00 0.00 H new ATOM 0 HG23 VAL A 99 19.877 10.460 9.684 1.00 0.00 H new ATOM 1604 N LEU A 100 21.880 6.936 7.018 1.00 0.00 N ATOM 1605 CA LEU A 100 21.799 5.498 6.879 1.00 0.00 C ATOM 1606 C LEU A 100 22.777 4.817 7.841 1.00 0.00 C ATOM 1607 O LEU A 100 22.595 3.625 8.097 1.00 0.00 O ATOM 1608 CB LEU A 100 22.065 5.020 5.429 1.00 0.00 C ATOM 1609 CG LEU A 100 21.117 5.466 4.278 1.00 0.00 C ATOM 1610 CD1 LEU A 100 20.609 4.263 3.491 1.00 0.00 C ATOM 1611 CD2 LEU A 100 19.853 6.264 4.638 1.00 0.00 C ATOM 0 H LEU A 100 22.247 7.394 6.184 1.00 0.00 H new ATOM 0 HA LEU A 100 20.777 5.214 7.129 1.00 0.00 H new ATOM 0 HB2 LEU A 100 23.072 5.339 5.162 1.00 0.00 H new ATOM 0 HB3 LEU A 100 22.069 3.930 5.442 1.00 0.00 H new ATOM 0 HG LEU A 100 21.775 6.137 3.726 1.00 0.00 H new ATOM 0 HD11 LEU A 100 19.949 4.603 2.693 1.00 0.00 H new ATOM 0 HD12 LEU A 100 21.454 3.727 3.059 1.00 0.00 H new ATOM 0 HD13 LEU A 100 20.060 3.598 4.157 1.00 0.00 H new ATOM 0 HD21 LEU A 100 19.300 6.499 3.729 1.00 0.00 H new ATOM 0 HD22 LEU A 100 19.225 5.670 5.302 1.00 0.00 H new ATOM 0 HD23 LEU A 100 20.137 7.189 5.139 1.00 0.00 H new ATOM 1623 N SER A 101 23.756 5.530 8.421 1.00 0.00 N ATOM 1624 CA SER A 101 24.532 4.977 9.515 1.00 0.00 C ATOM 1625 C SER A 101 23.712 5.128 10.795 1.00 0.00 C ATOM 1626 O SER A 101 23.411 4.160 11.493 1.00 0.00 O ATOM 1627 CB SER A 101 25.876 5.706 9.616 1.00 0.00 C ATOM 1628 OG SER A 101 26.886 4.885 9.080 1.00 0.00 O ATOM 0 H SER A 101 24.018 6.477 8.147 1.00 0.00 H new ATOM 0 HA SER A 101 24.747 3.921 9.350 1.00 0.00 H new ATOM 0 HB2 SER A 101 25.833 6.651 9.075 1.00 0.00 H new ATOM 0 HB3 SER A 101 26.097 5.944 10.656 1.00 0.00 H new ATOM 0 HG SER A 101 27.749 5.346 9.140 1.00 0.00 H new ATOM 1634 N LEU A 102 23.317 6.370 11.063 1.00 0.00 N ATOM 1635 CA LEU A 102 22.835 6.878 12.336 1.00 0.00 C ATOM 1636 C LEU A 102 21.507 6.254 12.738 1.00 0.00 C ATOM 1637 O LEU A 102 21.313 5.889 13.890 1.00 0.00 O ATOM 1638 CB LEU A 102 22.662 8.398 12.202 1.00 0.00 C ATOM 1639 CG LEU A 102 23.907 9.298 12.084 1.00 0.00 C ATOM 1640 CD1 LEU A 102 24.069 10.119 13.352 1.00 0.00 C ATOM 1641 CD2 LEU A 102 25.211 8.552 11.873 1.00 0.00 C ATOM 0 H LEU A 102 23.328 7.094 10.345 1.00 0.00 H new ATOM 0 HA LEU A 102 23.559 6.623 13.110 1.00 0.00 H new ATOM 0 HB2 LEU A 102 22.044 8.580 11.323 1.00 0.00 H new ATOM 0 HB3 LEU A 102 22.094 8.739 13.067 1.00 0.00 H new ATOM 0 HG LEU A 102 23.726 9.911 11.201 1.00 0.00 H new ATOM 0 HD11 LEU A 102 24.951 10.754 13.264 1.00 0.00 H new ATOM 0 HD12 LEU A 102 23.186 10.742 13.497 1.00 0.00 H new ATOM 0 HD13 LEU A 102 24.186 9.451 14.205 1.00 0.00 H new ATOM 0 HD21 LEU A 102 26.031 9.266 11.801 1.00 0.00 H new ATOM 0 HD22 LEU A 102 25.386 7.881 12.714 1.00 0.00 H new ATOM 0 HD23 LEU A 102 25.154 7.972 10.952 1.00 0.00 H new ATOM 1653 N THR A 103 20.589 6.132 11.784 1.00 0.00 N ATOM 1654 CA THR A 103 19.294 5.503 11.990 1.00 0.00 C ATOM 1655 C THR A 103 19.426 3.969 12.026 1.00 0.00 C ATOM 1656 O THR A 103 18.449 3.288 12.344 1.00 0.00 O ATOM 1657 CB THR A 103 18.357 6.058 10.897 1.00 0.00 C ATOM 1658 OG1 THR A 103 16.980 5.963 11.225 1.00 0.00 O ATOM 1659 CG2 THR A 103 18.614 5.467 9.510 1.00 0.00 C ATOM 0 H THR A 103 20.729 6.473 10.833 1.00 0.00 H new ATOM 0 HA THR A 103 18.861 5.742 12.961 1.00 0.00 H new ATOM 0 HB THR A 103 18.611 7.117 10.854 1.00 0.00 H new ATOM 0 HG1 THR A 103 16.814 5.123 11.701 1.00 0.00 H new ATOM 0 HG21 THR A 103 17.918 5.904 8.794 1.00 0.00 H new ATOM 0 HG22 THR A 103 19.636 5.688 9.204 1.00 0.00 H new ATOM 0 HG23 THR A 103 18.471 4.387 9.542 1.00 0.00 H new ATOM 1667 N ASN A 104 20.633 3.447 11.740 1.00 0.00 N ATOM 1668 CA ASN A 104 20.988 2.078 11.381 1.00 0.00 C ATOM 1669 C ASN A 104 20.095 1.652 10.208 1.00 0.00 C ATOM 1670 O ASN A 104 19.043 1.049 10.412 1.00 0.00 O ATOM 1671 CB ASN A 104 20.894 1.112 12.579 1.00 0.00 C ATOM 1672 CG ASN A 104 21.803 1.382 13.771 1.00 0.00 C ATOM 1673 OD1 ASN A 104 21.670 0.706 14.789 1.00 0.00 O ATOM 1674 ND2 ASN A 104 22.769 2.285 13.681 1.00 0.00 N ATOM 0 H ASN A 104 21.462 4.041 11.759 1.00 0.00 H new ATOM 0 HA ASN A 104 22.034 2.038 11.076 1.00 0.00 H new ATOM 0 HB2 ASN A 104 19.863 1.115 12.934 1.00 0.00 H new ATOM 0 HB3 ASN A 104 21.103 0.105 12.217 1.00 0.00 H new ATOM 0 HD21 ASN A 104 23.411 2.424 14.461 1.00 0.00 H new ATOM 0 HD22 ASN A 104 22.870 2.841 12.832 1.00 0.00 H new ATOM 1681 N LEU A 105 20.481 2.008 8.976 1.00 0.00 N ATOM 1682 CA LEU A 105 19.781 1.630 7.749 1.00 0.00 C ATOM 1683 C LEU A 105 20.696 0.709 6.957 1.00 0.00 C ATOM 1684 O LEU A 105 20.504 -0.495 6.960 1.00 0.00 O ATOM 1685 CB LEU A 105 19.365 2.873 6.925 1.00 0.00 C ATOM 1686 CG LEU A 105 18.086 2.743 6.083 1.00 0.00 C ATOM 1687 CD1 LEU A 105 17.943 1.386 5.398 1.00 0.00 C ATOM 1688 CD2 LEU A 105 16.893 3.082 6.962 1.00 0.00 C ATOM 0 H LEU A 105 21.308 2.580 8.805 1.00 0.00 H new ATOM 0 HA LEU A 105 18.855 1.110 7.993 1.00 0.00 H new ATOM 0 HB2 LEU A 105 19.237 3.710 7.612 1.00 0.00 H new ATOM 0 HB3 LEU A 105 20.188 3.131 6.258 1.00 0.00 H new ATOM 0 HG LEU A 105 18.142 3.452 5.257 1.00 0.00 H new ATOM 0 HD11 LEU A 105 17.018 1.365 4.821 1.00 0.00 H new ATOM 0 HD12 LEU A 105 18.790 1.224 4.731 1.00 0.00 H new ATOM 0 HD13 LEU A 105 17.919 0.599 6.152 1.00 0.00 H new ATOM 0 HD21 LEU A 105 15.976 2.995 6.380 1.00 0.00 H new ATOM 0 HD22 LEU A 105 16.855 2.392 7.805 1.00 0.00 H new ATOM 0 HD23 LEU A 105 16.992 4.102 7.332 1.00 0.00 H new ATOM 1700 N ASP A 106 21.753 1.239 6.350 1.00 0.00 N ATOM 1701 CA ASP A 106 22.785 0.472 5.648 1.00 0.00 C ATOM 1702 C ASP A 106 23.503 -0.479 6.611 1.00 0.00 C ATOM 1703 O ASP A 106 24.007 -1.535 6.241 1.00 0.00 O ATOM 1704 CB ASP A 106 23.817 1.491 5.146 1.00 0.00 C ATOM 1705 CG ASP A 106 25.073 0.819 4.593 1.00 0.00 C ATOM 1706 OD1 ASP A 106 24.976 -0.038 3.695 1.00 0.00 O ATOM 1707 OD2 ASP A 106 26.163 1.128 5.123 1.00 0.00 O ATOM 0 H ASP A 106 21.923 2.244 6.330 1.00 0.00 H new ATOM 0 HA ASP A 106 22.336 -0.111 4.844 1.00 0.00 H new ATOM 0 HB2 ASP A 106 23.366 2.109 4.369 1.00 0.00 H new ATOM 0 HB3 ASP A 106 24.094 2.157 5.963 1.00 0.00 H new ATOM 1712 N ARG A 107 23.489 -0.145 7.902 1.00 0.00 N ATOM 1713 CA ARG A 107 24.057 -0.986 8.949 1.00 0.00 C ATOM 1714 C ARG A 107 23.156 -2.187 9.248 1.00 0.00 C ATOM 1715 O ARG A 107 23.384 -2.899 10.229 1.00 0.00 O ATOM 1716 CB ARG A 107 24.339 -0.165 10.206 1.00 0.00 C ATOM 1717 CG ARG A 107 24.883 1.238 9.884 1.00 0.00 C ATOM 1718 CD ARG A 107 25.795 1.735 10.995 1.00 0.00 C ATOM 1719 NE ARG A 107 27.149 1.158 10.824 1.00 0.00 N ATOM 1720 CZ ARG A 107 28.163 1.147 11.697 1.00 0.00 C ATOM 1721 NH1 ARG A 107 27.993 1.536 12.951 1.00 0.00 N ATOM 1722 NH2 ARG A 107 29.357 0.731 11.300 1.00 0.00 N ATOM 0 H ARG A 107 23.080 0.722 8.250 1.00 0.00 H new ATOM 0 HA ARG A 107 25.007 -1.381 8.590 1.00 0.00 H new ATOM 0 HB2 ARG A 107 23.422 -0.071 10.788 1.00 0.00 H new ATOM 0 HB3 ARG A 107 25.059 -0.696 10.829 1.00 0.00 H new ATOM 0 HG2 ARG A 107 25.431 1.212 8.942 1.00 0.00 H new ATOM 0 HG3 ARG A 107 24.053 1.932 9.751 1.00 0.00 H new ATOM 0 HD2 ARG A 107 25.848 2.824 10.976 1.00 0.00 H new ATOM 0 HD3 ARG A 107 25.389 1.453 11.966 1.00 0.00 H new ATOM 0 HE ARG A 107 27.332 0.712 9.925 1.00 0.00 H new ATOM 0 HH11 ARG A 107 27.076 1.852 13.267 1.00 0.00 H new ATOM 0 HH12 ARG A 107 28.779 1.520 13.601 1.00 0.00 H new ATOM 0 HH21 ARG A 107 29.496 0.423 10.337 1.00 0.00 H new ATOM 0 HH22 ARG A 107 30.137 0.718 11.957 1.00 0.00 H new ATOM 1736 N ILE A 108 22.096 -2.356 8.462 1.00 0.00 N ATOM 1737 CA ILE A 108 21.133 -3.428 8.496 1.00 0.00 C ATOM 1738 C ILE A 108 20.995 -3.984 7.065 1.00 0.00 C ATOM 1739 O ILE A 108 20.976 -5.205 6.899 1.00 0.00 O ATOM 1740 CB ILE A 108 19.809 -2.893 9.096 1.00 0.00 C ATOM 1741 CG1 ILE A 108 20.075 -2.164 10.434 1.00 0.00 C ATOM 1742 CG2 ILE A 108 18.798 -4.031 9.258 1.00 0.00 C ATOM 1743 CD1 ILE A 108 18.823 -1.887 11.272 1.00 0.00 C ATOM 0 H ILE A 108 21.880 -1.684 7.726 1.00 0.00 H new ATOM 0 HA ILE A 108 21.446 -4.253 9.136 1.00 0.00 H new ATOM 0 HB ILE A 108 19.377 -2.166 8.409 1.00 0.00 H new ATOM 0 HG12 ILE A 108 20.767 -2.762 11.027 1.00 0.00 H new ATOM 0 HG13 ILE A 108 20.572 -1.217 10.224 1.00 0.00 H new ATOM 0 HG21 ILE A 108 17.873 -3.639 9.681 1.00 0.00 H new ATOM 0 HG22 ILE A 108 18.592 -4.476 8.285 1.00 0.00 H new ATOM 0 HG23 ILE A 108 19.208 -4.790 9.924 1.00 0.00 H new ATOM 0 HD11 ILE A 108 19.106 -1.374 12.191 1.00 0.00 H new ATOM 0 HD12 ILE A 108 18.136 -1.260 10.703 1.00 0.00 H new ATOM 0 HD13 ILE A 108 18.335 -2.830 11.519 1.00 0.00 H new ATOM 1755 N VAL A 109 20.918 -3.136 6.031 1.00 0.00 N ATOM 1756 CA VAL A 109 20.629 -3.466 4.652 1.00 0.00 C ATOM 1757 C VAL A 109 21.890 -3.582 3.782 1.00 0.00 C ATOM 1758 O VAL A 109 23.013 -3.435 4.269 1.00 0.00 O ATOM 1759 CB VAL A 109 19.576 -2.455 4.152 1.00 0.00 C ATOM 1760 CG1 VAL A 109 18.400 -2.209 5.114 1.00 0.00 C ATOM 1761 CG2 VAL A 109 19.896 -1.150 3.494 1.00 0.00 C ATOM 0 H VAL A 109 21.068 -2.135 6.158 1.00 0.00 H new ATOM 0 HA VAL A 109 20.209 -4.469 4.574 1.00 0.00 H new ATOM 0 HB VAL A 109 19.353 -3.090 3.294 1.00 0.00 H new ATOM 0 HG11 VAL A 109 17.715 -1.484 4.674 1.00 0.00 H new ATOM 0 HG12 VAL A 109 17.872 -3.146 5.291 1.00 0.00 H new ATOM 0 HG13 VAL A 109 18.779 -1.822 6.060 1.00 0.00 H new ATOM 0 HG21 VAL A 109 18.970 -0.633 3.241 1.00 0.00 H new ATOM 0 HG22 VAL A 109 20.482 -0.533 4.175 1.00 0.00 H new ATOM 0 HG23 VAL A 109 20.470 -1.332 2.585 1.00 0.00 H new ATOM 1771 N LYS A 110 21.725 -3.910 2.500 1.00 0.00 N ATOM 1772 CA LYS A 110 22.788 -3.860 1.498 1.00 0.00 C ATOM 1773 C LYS A 110 22.673 -2.589 0.680 1.00 0.00 C ATOM 1774 O LYS A 110 21.599 -1.992 0.624 1.00 0.00 O ATOM 1775 CB LYS A 110 22.636 -5.059 0.566 1.00 0.00 C ATOM 1776 CG LYS A 110 23.330 -6.300 1.092 1.00 0.00 C ATOM 1777 CD LYS A 110 24.800 -6.244 0.725 1.00 0.00 C ATOM 1778 CE LYS A 110 25.550 -7.507 1.081 1.00 0.00 C ATOM 1779 NZ LYS A 110 25.695 -7.734 2.537 1.00 0.00 N ATOM 0 H LYS A 110 20.831 -4.224 2.123 1.00 0.00 H new ATOM 0 HA LYS A 110 23.757 -3.880 1.997 1.00 0.00 H new ATOM 0 HB2 LYS A 110 21.576 -5.272 0.425 1.00 0.00 H new ATOM 0 HB3 LYS A 110 23.044 -4.807 -0.413 1.00 0.00 H new ATOM 0 HG2 LYS A 110 23.215 -6.364 2.174 1.00 0.00 H new ATOM 0 HG3 LYS A 110 22.871 -7.194 0.670 1.00 0.00 H new ATOM 0 HD2 LYS A 110 24.894 -6.063 -0.346 1.00 0.00 H new ATOM 0 HD3 LYS A 110 25.263 -5.398 1.233 1.00 0.00 H new ATOM 0 HE2 LYS A 110 25.033 -8.360 0.641 1.00 0.00 H new ATOM 0 HE3 LYS A 110 26.541 -7.467 0.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 26.219 -8.617 2.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 26.215 -6.940 2.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 24.753 -7.805 2.973 1.00 0.00 H new ATOM 1793 N ILE A 111 23.734 -2.222 -0.021 1.00 0.00 N ATOM 1794 CA ILE A 111 23.789 -0.927 -0.700 1.00 0.00 C ATOM 1795 C ILE A 111 24.692 -1.049 -1.930 1.00 0.00 C ATOM 1796 O ILE A 111 25.745 -1.673 -1.825 1.00 0.00 O ATOM 1797 CB ILE A 111 24.228 0.143 0.348 1.00 0.00 C ATOM 1798 CG1 ILE A 111 23.253 1.329 0.447 1.00 0.00 C ATOM 1799 CG2 ILE A 111 25.660 0.673 0.201 1.00 0.00 C ATOM 1800 CD1 ILE A 111 22.344 1.211 1.673 1.00 0.00 C ATOM 0 H ILE A 111 24.569 -2.797 -0.137 1.00 0.00 H new ATOM 0 HA ILE A 111 22.822 -0.603 -1.085 1.00 0.00 H new ATOM 0 HB ILE A 111 24.204 -0.426 1.277 1.00 0.00 H new ATOM 0 HG12 ILE A 111 23.817 2.261 0.500 1.00 0.00 H new ATOM 0 HG13 ILE A 111 22.643 1.376 -0.455 1.00 0.00 H new ATOM 0 HG21 ILE A 111 25.857 1.410 0.980 1.00 0.00 H new ATOM 0 HG22 ILE A 111 26.365 -0.153 0.296 1.00 0.00 H new ATOM 0 HG23 ILE A 111 25.777 1.139 -0.777 1.00 0.00 H new ATOM 0 HD11 ILE A 111 21.669 2.066 1.709 1.00 0.00 H new ATOM 0 HD12 ILE A 111 21.762 0.292 1.607 1.00 0.00 H new ATOM 0 HD13 ILE A 111 22.953 1.191 2.577 1.00 0.00 H new ATOM 1812 N TYR A 112 24.288 -0.487 -3.075 1.00 0.00 N ATOM 1813 CA TYR A 112 24.930 -0.700 -4.372 1.00 0.00 C ATOM 1814 C TYR A 112 24.905 0.553 -5.257 1.00 0.00 C ATOM 1815 O TYR A 112 24.149 1.494 -4.999 1.00 0.00 O ATOM 1816 CB TYR A 112 24.180 -1.839 -5.067 1.00 0.00 C ATOM 1817 CG TYR A 112 24.292 -3.162 -4.339 1.00 0.00 C ATOM 1818 CD1 TYR A 112 25.514 -3.851 -4.393 1.00 0.00 C ATOM 1819 CD2 TYR A 112 23.212 -3.689 -3.604 1.00 0.00 C ATOM 1820 CE1 TYR A 112 25.643 -5.116 -3.798 1.00 0.00 C ATOM 1821 CE2 TYR A 112 23.318 -4.995 -3.070 1.00 0.00 C ATOM 1822 CZ TYR A 112 24.525 -5.714 -3.192 1.00 0.00 C ATOM 1823 OH TYR A 112 24.609 -6.985 -2.715 1.00 0.00 O ATOM 0 H TYR A 112 23.487 0.143 -3.124 1.00 0.00 H new ATOM 0 HA TYR A 112 25.981 -0.942 -4.212 1.00 0.00 H new ATOM 0 HB2 TYR A 112 23.128 -1.570 -5.157 1.00 0.00 H new ATOM 0 HB3 TYR A 112 24.567 -1.955 -6.079 1.00 0.00 H new ATOM 0 HD1 TYR A 112 26.360 -3.405 -4.895 1.00 0.00 H new ATOM 0 HD2 TYR A 112 22.317 -3.105 -3.450 1.00 0.00 H new ATOM 0 HE1 TYR A 112 26.595 -5.626 -3.806 1.00 0.00 H new ATOM 0 HE2 TYR A 112 22.473 -5.442 -2.568 1.00 0.00 H new ATOM 0 HH TYR A 112 23.748 -7.246 -2.326 1.00 0.00 H new ATOM 1833 N ASP A 113 25.687 0.552 -6.343 1.00 0.00 N ATOM 1834 CA ASP A 113 25.840 1.724 -7.215 1.00 0.00 C ATOM 1835 C ASP A 113 24.747 1.770 -8.270 1.00 0.00 C ATOM 1836 O ASP A 113 24.248 2.846 -8.606 1.00 0.00 O ATOM 1837 CB ASP A 113 27.193 1.729 -7.947 1.00 0.00 C ATOM 1838 CG ASP A 113 27.896 3.082 -7.835 1.00 0.00 C ATOM 1839 OD1 ASP A 113 27.273 4.137 -8.120 1.00 0.00 O ATOM 1840 OD2 ASP A 113 29.077 3.080 -7.425 1.00 0.00 O ATOM 0 H ASP A 113 26.230 -0.258 -6.642 1.00 0.00 H new ATOM 0 HA ASP A 113 25.776 2.593 -6.560 1.00 0.00 H new ATOM 0 HB2 ASP A 113 27.834 0.951 -7.531 1.00 0.00 H new ATOM 0 HB3 ASP A 113 27.038 1.486 -8.998 1.00 0.00 H new ATOM 1845 N THR A 114 24.376 0.606 -8.808 1.00 0.00 N ATOM 1846 CA THR A 114 23.373 0.500 -9.855 1.00 0.00 C ATOM 1847 C THR A 114 22.423 -0.632 -9.513 1.00 0.00 C ATOM 1848 O THR A 114 22.584 -1.331 -8.512 1.00 0.00 O ATOM 1849 CB THR A 114 23.985 0.370 -11.270 1.00 0.00 C ATOM 1850 OG1 THR A 114 24.327 -0.957 -11.632 1.00 0.00 O ATOM 1851 CG2 THR A 114 25.156 1.308 -11.533 1.00 0.00 C ATOM 0 H THR A 114 24.769 -0.291 -8.524 1.00 0.00 H new ATOM 0 HA THR A 114 22.808 1.431 -9.893 1.00 0.00 H new ATOM 0 HB THR A 114 23.167 0.685 -11.918 1.00 0.00 H new ATOM 0 HG1 THR A 114 24.705 -0.962 -12.536 1.00 0.00 H new ATOM 0 HG21 THR A 114 25.526 1.153 -12.546 1.00 0.00 H new ATOM 0 HG22 THR A 114 24.827 2.341 -11.421 1.00 0.00 H new ATOM 0 HG23 THR A 114 25.954 1.102 -10.820 1.00 0.00 H new ATOM 1859 N ILE A 115 21.414 -0.807 -10.360 1.00 0.00 N ATOM 1860 CA ILE A 115 20.494 -1.913 -10.232 1.00 0.00 C ATOM 1861 C ILE A 115 21.203 -3.201 -10.610 1.00 0.00 C ATOM 1862 O ILE A 115 20.986 -4.207 -9.948 1.00 0.00 O ATOM 1863 CB ILE A 115 19.238 -1.640 -11.079 1.00 0.00 C ATOM 1864 CG1 ILE A 115 18.379 -0.554 -10.407 1.00 0.00 C ATOM 1865 CG2 ILE A 115 18.415 -2.913 -11.336 1.00 0.00 C ATOM 1866 CD1 ILE A 115 17.681 -1.012 -9.125 1.00 0.00 C ATOM 0 H ILE A 115 21.218 -0.187 -11.146 1.00 0.00 H new ATOM 0 HA ILE A 115 20.159 -2.023 -9.200 1.00 0.00 H new ATOM 0 HB ILE A 115 19.568 -1.283 -12.055 1.00 0.00 H new ATOM 0 HG12 ILE A 115 19.012 0.303 -10.177 1.00 0.00 H new ATOM 0 HG13 ILE A 115 17.625 -0.212 -11.116 1.00 0.00 H new ATOM 0 HG21 ILE A 115 17.540 -2.666 -11.938 1.00 0.00 H new ATOM 0 HG22 ILE A 115 19.027 -3.641 -11.868 1.00 0.00 H new ATOM 0 HG23 ILE A 115 18.093 -3.336 -10.385 1.00 0.00 H new ATOM 0 HD11 ILE A 115 17.097 -0.188 -8.715 1.00 0.00 H new ATOM 0 HD12 ILE A 115 17.020 -1.849 -9.350 1.00 0.00 H new ATOM 0 HD13 ILE A 115 18.428 -1.325 -8.396 1.00 0.00 H new ATOM 1878 N SER A 116 22.034 -3.209 -11.649 1.00 0.00 N ATOM 1879 CA SER A 116 22.701 -4.427 -12.067 1.00 0.00 C ATOM 1880 C SER A 116 23.756 -4.828 -11.039 1.00 0.00 C ATOM 1881 O SER A 116 23.932 -6.023 -10.798 1.00 0.00 O ATOM 1882 CB SER A 116 23.312 -4.217 -13.450 1.00 0.00 C ATOM 1883 OG SER A 116 23.470 -5.441 -14.130 1.00 0.00 O ATOM 0 H SER A 116 22.257 -2.388 -12.211 1.00 0.00 H new ATOM 0 HA SER A 116 21.981 -5.243 -12.130 1.00 0.00 H new ATOM 0 HB2 SER A 116 22.675 -3.553 -14.035 1.00 0.00 H new ATOM 0 HB3 SER A 116 24.280 -3.725 -13.352 1.00 0.00 H new ATOM 0 HG SER A 116 23.862 -5.276 -15.013 1.00 0.00 H new ATOM 1889 N GLU A 117 24.395 -3.859 -10.372 1.00 0.00 N ATOM 1890 CA GLU A 117 25.287 -4.140 -9.262 1.00 0.00 C ATOM 1891 C GLU A 117 24.521 -4.614 -8.032 1.00 0.00 C ATOM 1892 O GLU A 117 25.158 -4.919 -7.036 1.00 0.00 O ATOM 1893 CB GLU A 117 26.171 -2.918 -8.959 1.00 0.00 C ATOM 1894 CG GLU A 117 27.620 -3.278 -9.308 1.00 0.00 C ATOM 1895 CD GLU A 117 28.571 -2.120 -9.043 1.00 0.00 C ATOM 1896 OE1 GLU A 117 28.596 -1.170 -9.861 1.00 0.00 O ATOM 1897 OE2 GLU A 117 29.321 -2.190 -8.039 1.00 0.00 O ATOM 0 H GLU A 117 24.303 -2.867 -10.592 1.00 0.00 H new ATOM 0 HA GLU A 117 25.944 -4.960 -9.552 1.00 0.00 H new ATOM 0 HB2 GLU A 117 25.842 -2.057 -9.541 1.00 0.00 H new ATOM 0 HB3 GLU A 117 26.090 -2.642 -7.908 1.00 0.00 H new ATOM 0 HG2 GLU A 117 27.930 -4.144 -8.723 1.00 0.00 H new ATOM 0 HG3 GLU A 117 27.680 -3.565 -10.358 1.00 0.00 H new ATOM 1904 N ALA A 118 23.189 -4.729 -8.095 1.00 0.00 N ATOM 1905 CA ALA A 118 22.374 -5.248 -7.022 1.00 0.00 C ATOM 1906 C ALA A 118 21.685 -6.537 -7.480 1.00 0.00 C ATOM 1907 O ALA A 118 21.564 -7.466 -6.694 1.00 0.00 O ATOM 1908 CB ALA A 118 21.387 -4.158 -6.588 1.00 0.00 C ATOM 0 H ALA A 118 22.649 -4.455 -8.916 1.00 0.00 H new ATOM 0 HA ALA A 118 22.979 -5.510 -6.154 1.00 0.00 H new ATOM 0 HB1 ALA A 118 20.763 -4.534 -5.777 1.00 0.00 H new ATOM 0 HB2 ALA A 118 21.939 -3.283 -6.245 1.00 0.00 H new ATOM 0 HB3 ALA A 118 20.756 -3.881 -7.433 1.00 0.00 H new ATOM 1914 N MET A 119 21.251 -6.643 -8.739 1.00 0.00 N ATOM 1915 CA MET A 119 20.260 -7.598 -9.200 1.00 0.00 C ATOM 1916 C MET A 119 20.741 -9.027 -9.045 1.00 0.00 C ATOM 1917 O MET A 119 20.063 -9.857 -8.438 1.00 0.00 O ATOM 1918 CB MET A 119 19.902 -7.304 -10.670 1.00 0.00 C ATOM 1919 CG MET A 119 18.453 -7.709 -10.888 1.00 0.00 C ATOM 1920 SD MET A 119 17.888 -7.790 -12.607 1.00 0.00 S ATOM 1921 CE MET A 119 18.151 -6.077 -13.122 1.00 0.00 C ATOM 0 H MET A 119 21.597 -6.041 -9.486 1.00 0.00 H new ATOM 0 HA MET A 119 19.370 -7.489 -8.581 1.00 0.00 H new ATOM 0 HB2 MET A 119 20.040 -6.246 -10.892 1.00 0.00 H new ATOM 0 HB3 MET A 119 20.558 -7.859 -11.341 1.00 0.00 H new ATOM 0 HG2 MET A 119 18.299 -8.687 -10.432 1.00 0.00 H new ATOM 0 HG3 MET A 119 17.817 -7.004 -10.352 1.00 0.00 H new ATOM 0 HE1 MET A 119 17.690 -5.915 -14.096 1.00 0.00 H new ATOM 0 HE2 MET A 119 17.701 -5.404 -12.392 1.00 0.00 H new ATOM 0 HE3 MET A 119 19.220 -5.877 -13.189 1.00 0.00 H new ATOM 1931 N GLU A 120 21.897 -9.325 -9.622 1.00 0.00 N ATOM 1932 CA GLU A 120 22.542 -10.614 -9.444 1.00 0.00 C ATOM 1933 C GLU A 120 23.311 -10.642 -8.130 1.00 0.00 C ATOM 1934 O GLU A 120 23.633 -11.705 -7.607 1.00 0.00 O ATOM 1935 CB GLU A 120 23.464 -10.884 -10.633 1.00 0.00 C ATOM 1936 CG GLU A 120 24.503 -9.788 -10.929 1.00 0.00 C ATOM 1937 CD GLU A 120 25.476 -10.298 -11.992 1.00 0.00 C ATOM 1938 OE1 GLU A 120 24.991 -10.660 -13.091 1.00 0.00 O ATOM 1939 OE2 GLU A 120 26.681 -10.487 -11.697 1.00 0.00 O ATOM 0 H GLU A 120 22.411 -8.681 -10.224 1.00 0.00 H new ATOM 0 HA GLU A 120 21.788 -11.400 -9.401 1.00 0.00 H new ATOM 0 HB2 GLU A 120 23.991 -11.821 -10.456 1.00 0.00 H new ATOM 0 HB3 GLU A 120 22.849 -11.027 -11.522 1.00 0.00 H new ATOM 0 HG2 GLU A 120 24.006 -8.882 -11.277 1.00 0.00 H new ATOM 0 HG3 GLU A 120 25.043 -9.526 -10.019 1.00 0.00 H new ATOM 1946 N GLU A 121 23.603 -9.471 -7.580 1.00 0.00 N ATOM 1947 CA GLU A 121 24.614 -9.318 -6.570 1.00 0.00 C ATOM 1948 C GLU A 121 24.048 -9.729 -5.228 1.00 0.00 C ATOM 1949 O GLU A 121 24.626 -10.561 -4.547 1.00 0.00 O ATOM 1950 CB GLU A 121 25.075 -7.866 -6.564 1.00 0.00 C ATOM 1951 CG GLU A 121 26.545 -7.802 -6.164 1.00 0.00 C ATOM 1952 CD GLU A 121 27.526 -7.896 -7.342 1.00 0.00 C ATOM 1953 OE1 GLU A 121 27.126 -8.111 -8.514 1.00 0.00 O ATOM 1954 OE2 GLU A 121 28.739 -7.758 -7.067 1.00 0.00 O ATOM 0 H GLU A 121 23.135 -8.600 -7.832 1.00 0.00 H new ATOM 0 HA GLU A 121 25.473 -9.956 -6.778 1.00 0.00 H new ATOM 0 HB2 GLU A 121 24.936 -7.425 -7.551 1.00 0.00 H new ATOM 0 HB3 GLU A 121 24.472 -7.284 -5.867 1.00 0.00 H new ATOM 0 HG2 GLU A 121 26.724 -6.868 -5.631 1.00 0.00 H new ATOM 0 HG3 GLU A 121 26.755 -8.612 -5.466 1.00 0.00 H new ATOM 1961 N VAL A 122 22.869 -9.210 -4.892 1.00 0.00 N ATOM 1962 CA VAL A 122 22.059 -9.519 -3.728 1.00 0.00 C ATOM 1963 C VAL A 122 22.027 -11.027 -3.451 1.00 0.00 C ATOM 1964 O VAL A 122 22.155 -11.455 -2.305 1.00 0.00 O ATOM 1965 CB VAL A 122 20.700 -8.855 -3.987 1.00 0.00 C ATOM 1966 CG1 VAL A 122 19.747 -9.574 -4.946 1.00 0.00 C ATOM 1967 CG2 VAL A 122 20.046 -8.637 -2.649 1.00 0.00 C ATOM 0 H VAL A 122 22.424 -8.505 -5.479 1.00 0.00 H new ATOM 0 HA VAL A 122 22.469 -9.122 -2.799 1.00 0.00 H new ATOM 0 HB VAL A 122 20.910 -7.926 -4.516 1.00 0.00 H new ATOM 0 HG11 VAL A 122 18.825 -9.000 -5.041 1.00 0.00 H new ATOM 0 HG12 VAL A 122 20.218 -9.668 -5.924 1.00 0.00 H new ATOM 0 HG13 VAL A 122 19.519 -10.566 -4.556 1.00 0.00 H new ATOM 0 HG21 VAL A 122 19.074 -8.165 -2.792 1.00 0.00 H new ATOM 0 HG22 VAL A 122 19.914 -9.596 -2.148 1.00 0.00 H new ATOM 0 HG23 VAL A 122 20.676 -7.992 -2.037 1.00 0.00 H new ATOM 1977 N ARG A 123 21.927 -11.833 -4.511 1.00 0.00 N ATOM 1978 CA ARG A 123 21.934 -13.291 -4.460 1.00 0.00 C ATOM 1979 C ARG A 123 23.191 -13.870 -3.813 1.00 0.00 C ATOM 1980 O ARG A 123 23.096 -14.799 -3.011 1.00 0.00 O ATOM 1981 CB ARG A 123 21.811 -13.826 -5.893 1.00 0.00 C ATOM 1982 CG ARG A 123 20.711 -13.102 -6.668 1.00 0.00 C ATOM 1983 CD ARG A 123 20.426 -13.778 -7.997 1.00 0.00 C ATOM 1984 NE ARG A 123 19.012 -13.576 -8.279 1.00 0.00 N ATOM 1985 CZ ARG A 123 18.229 -14.438 -8.941 1.00 0.00 C ATOM 1986 NH1 ARG A 123 18.764 -15.452 -9.615 1.00 0.00 N ATOM 1987 NH2 ARG A 123 16.910 -14.319 -8.911 1.00 0.00 N ATOM 0 H ARG A 123 21.836 -11.472 -5.461 1.00 0.00 H new ATOM 0 HA ARG A 123 21.093 -13.601 -3.839 1.00 0.00 H new ATOM 0 HB2 ARG A 123 22.763 -13.705 -6.411 1.00 0.00 H new ATOM 0 HB3 ARG A 123 21.596 -14.894 -5.867 1.00 0.00 H new ATOM 0 HG2 ARG A 123 19.800 -13.076 -6.070 1.00 0.00 H new ATOM 0 HG3 ARG A 123 21.008 -12.068 -6.842 1.00 0.00 H new ATOM 0 HD2 ARG A 123 21.042 -13.351 -8.788 1.00 0.00 H new ATOM 0 HD3 ARG A 123 20.662 -14.841 -7.948 1.00 0.00 H new ATOM 0 HE ARG A 123 18.585 -12.711 -7.947 1.00 0.00 H new ATOM 0 HH11 ARG A 123 19.776 -15.577 -9.630 1.00 0.00 H new ATOM 0 HH12 ARG A 123 18.162 -16.105 -10.117 1.00 0.00 H new ATOM 0 HH21 ARG A 123 16.478 -13.564 -8.379 1.00 0.00 H new ATOM 0 HH22 ARG A 123 16.326 -14.983 -9.420 1.00 0.00 H new ATOM 2001 N ARG A 124 24.364 -13.365 -4.192 1.00 0.00 N ATOM 2002 CA ARG A 124 25.681 -13.943 -3.932 1.00 0.00 C ATOM 2003 C ARG A 124 26.662 -12.868 -3.461 1.00 0.00 C ATOM 2004 O ARG A 124 27.837 -12.844 -3.838 1.00 0.00 O ATOM 2005 CB ARG A 124 26.138 -14.720 -5.175 1.00 0.00 C ATOM 2006 CG ARG A 124 26.386 -13.834 -6.413 1.00 0.00 C ATOM 2007 CD ARG A 124 25.666 -14.335 -7.666 1.00 0.00 C ATOM 2008 NE ARG A 124 26.430 -14.180 -8.919 1.00 0.00 N ATOM 2009 CZ ARG A 124 26.911 -13.054 -9.465 1.00 0.00 C ATOM 2010 NH1 ARG A 124 26.950 -11.904 -8.800 1.00 0.00 N ATOM 2011 NH2 ARG A 124 27.343 -13.069 -10.719 1.00 0.00 N ATOM 0 H ARG A 124 24.424 -12.493 -4.718 1.00 0.00 H new ATOM 0 HA ARG A 124 25.635 -14.659 -3.111 1.00 0.00 H new ATOM 0 HB2 ARG A 124 27.055 -15.259 -4.937 1.00 0.00 H new ATOM 0 HB3 ARG A 124 25.384 -15.467 -5.421 1.00 0.00 H new ATOM 0 HG2 ARG A 124 26.059 -12.817 -6.196 1.00 0.00 H new ATOM 0 HG3 ARG A 124 27.457 -13.789 -6.611 1.00 0.00 H new ATOM 0 HD2 ARG A 124 25.423 -15.389 -7.532 1.00 0.00 H new ATOM 0 HD3 ARG A 124 24.721 -13.800 -7.764 1.00 0.00 H new ATOM 0 HE ARG A 124 26.616 -15.040 -9.436 1.00 0.00 H new ATOM 0 HH11 ARG A 124 26.607 -11.858 -7.841 1.00 0.00 H new ATOM 0 HH12 ARG A 124 27.323 -11.068 -9.249 1.00 0.00 H new ATOM 0 HH21 ARG A 124 27.308 -13.933 -11.260 1.00 0.00 H new ATOM 0 HH22 ARG A 124 27.710 -12.217 -11.142 1.00 0.00 H new ATOM 2025 N LYS A 125 26.128 -11.911 -2.713 1.00 0.00 N ATOM 2026 CA LYS A 125 26.798 -10.735 -2.186 1.00 0.00 C ATOM 2027 C LYS A 125 28.022 -11.107 -1.365 1.00 0.00 C ATOM 2028 O LYS A 125 28.829 -10.203 -1.079 1.00 0.00 O ATOM 2029 CB LYS A 125 25.759 -9.853 -1.463 1.00 0.00 C ATOM 2030 CG LYS A 125 24.922 -10.573 -0.393 1.00 0.00 C ATOM 2031 CD LYS A 125 25.681 -10.962 0.890 1.00 0.00 C ATOM 2032 CE LYS A 125 25.782 -12.487 1.025 1.00 0.00 C ATOM 2033 NZ LYS A 125 27.110 -12.932 1.481 1.00 0.00 N ATOM 0 H LYS A 125 25.145 -11.941 -2.441 1.00 0.00 H new ATOM 0 HA LYS A 125 27.210 -10.131 -2.994 1.00 0.00 H new ATOM 0 HB2 LYS A 125 26.279 -9.018 -0.994 1.00 0.00 H new ATOM 0 HB3 LYS A 125 25.083 -9.431 -2.207 1.00 0.00 H new ATOM 0 HG2 LYS A 125 24.085 -9.931 -0.119 1.00 0.00 H new ATOM 0 HG3 LYS A 125 24.500 -11.477 -0.833 1.00 0.00 H new ATOM 0 HD2 LYS A 125 26.680 -10.527 0.872 1.00 0.00 H new ATOM 0 HD3 LYS A 125 25.169 -10.549 1.759 1.00 0.00 H new ATOM 0 HE2 LYS A 125 25.026 -12.836 1.728 1.00 0.00 H new ATOM 0 HE3 LYS A 125 25.560 -12.948 0.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 27.071 -13.940 1.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 27.804 -12.793 0.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 27.395 -12.378 2.314 1.00 0.00 H new TER 2047 LYS A 125