USER MOD reduce.3.24.130724 H: found=0, std=0, add=765, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 755 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 15 HIS : no HD1:sc= 0.0157 X(o=0.044,f=-0.2) USER MOD Set 1.2: A 80 TYR OH : rot -156:sc= 0.0284 USER MOD Single : A 0 HIS : no HD1:sc= -0.144 X(o=-0.14,f=-0.0082) USER MOD Single : A 1 HIS : no HD1:sc= 0 X(o=0,f=-0.025) USER MOD Single : A 2 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 HIS : no HE2:sc= -0.258 K(o=-0.26,f=-1.4) USER MOD Single : A 5 HIS : no HD1:sc= -0.343 K(o=-0.34,f=-1.4) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 34:sc= 0.469 USER MOD Single : A -1 SER OG : rot 180:sc= 0 USER MOD Single : A -2 SER OG : rot 180:sc= -0.543 USER MOD Single : A -4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A -4 MET N :NH3+ -113:sc= 0.0169 (180deg=0) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0.023 USER MOD Single : A 24 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0121) USER MOD Single : A 25 CYS SG : rot 180:sc=-0.000812 USER MOD Single : A 26 GLN : amide:sc= -0.0735 K(o=-0.073,f=-0.97) USER MOD Single : A 27 CYS SG : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 ASN : amide:sc= -0.0385 K(o=-0.039,f=-0.92) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ -115:sc= -1.46! (180deg=-3.27!) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 HIS : no HD1:sc= -1.69 K(o=-1.7,f=-3.9) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= -0.481 X(o=-0.48,f=-0.83) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 ASN : amide:sc= -0.963 X(o=-0.96,f=-1) USER MOD Single : A 61 LYS NZ :NH3+ -163:sc= -0.162 (180deg=-0.579) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0.162 USER MOD Single : A 69 THR OG1 : rot -1:sc= 1.04 USER MOD Single : A 73 ASN : amide:sc= 0.0529 X(o=0.053,f=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 LYS NZ :NH3+ -138:sc= 0 (180deg=-0.191) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A -4 25.611 -28.973 4.266 1.00 0.00 N ATOM 2 CA MET A -4 24.584 -28.111 3.693 1.00 0.00 C ATOM 3 C MET A -4 25.210 -26.894 3.020 1.00 0.00 C ATOM 4 O MET A -4 26.202 -26.347 3.502 1.00 0.00 O ATOM 5 CB MET A -4 23.602 -27.661 4.777 1.00 0.00 C ATOM 6 CG MET A -4 22.283 -27.144 4.226 1.00 0.00 C ATOM 7 SD MET A -4 21.074 -28.458 3.975 1.00 0.00 S ATOM 8 CE MET A -4 19.902 -27.638 2.896 1.00 0.00 C ATOM 0 H1 MET A -4 25.635 -29.875 3.749 1.00 0.00 H new ATOM 0 H2 MET A -4 26.537 -28.506 4.192 1.00 0.00 H new ATOM 0 H3 MET A -4 25.394 -29.154 5.267 1.00 0.00 H new ATOM 0 HA MET A -4 24.044 -28.683 2.939 1.00 0.00 H new ATOM 0 HB2 MET A -4 23.404 -28.498 5.446 1.00 0.00 H new ATOM 0 HB3 MET A -4 24.068 -26.878 5.376 1.00 0.00 H new ATOM 0 HG2 MET A -4 21.872 -26.403 4.912 1.00 0.00 H new ATOM 0 HG3 MET A -4 22.463 -26.635 3.279 1.00 0.00 H new ATOM 0 HE1 MET A -4 19.092 -28.324 2.650 1.00 0.00 H new ATOM 0 HE2 MET A -4 19.495 -26.762 3.400 1.00 0.00 H new ATOM 0 HE3 MET A -4 20.406 -27.328 1.980 1.00 0.00 H new ATOM 18 N GLY A -3 24.624 -26.474 1.903 1.00 0.00 N ATOM 19 CA GLY A -3 25.139 -25.324 1.182 1.00 0.00 C ATOM 20 C GLY A -3 24.047 -24.349 0.790 1.00 0.00 C ATOM 21 O GLY A -3 23.706 -23.448 1.557 1.00 0.00 O ATOM 0 H GLY A -3 23.802 -26.909 1.484 1.00 0.00 H new ATOM 0 HA2 GLY A -3 25.875 -24.811 1.801 1.00 0.00 H new ATOM 0 HA3 GLY A -3 25.658 -25.664 0.285 1.00 0.00 H new ATOM 25 N SER A -2 23.499 -24.527 -0.407 1.00 0.00 N ATOM 26 CA SER A -2 22.443 -23.651 -0.902 1.00 0.00 C ATOM 27 C SER A -2 21.615 -24.352 -1.975 1.00 0.00 C ATOM 28 O SER A -2 21.832 -25.526 -2.275 1.00 0.00 O ATOM 29 CB SER A -2 23.042 -22.362 -1.466 1.00 0.00 C ATOM 30 OG SER A -2 24.186 -21.966 -0.728 1.00 0.00 O ATOM 0 H SER A -2 23.768 -25.270 -1.052 1.00 0.00 H new ATOM 0 HA SER A -2 21.789 -23.403 -0.066 1.00 0.00 H new ATOM 0 HB2 SER A -2 23.313 -22.510 -2.511 1.00 0.00 H new ATOM 0 HB3 SER A -2 22.295 -21.568 -1.440 1.00 0.00 H new ATOM 0 HG SER A -2 24.551 -21.140 -1.109 1.00 0.00 H new ATOM 36 N SER A -1 20.664 -23.622 -2.550 1.00 0.00 N ATOM 37 CA SER A -1 19.799 -24.174 -3.587 1.00 0.00 C ATOM 38 C SER A -1 19.073 -23.061 -4.336 1.00 0.00 C ATOM 39 O SER A -1 18.541 -22.131 -3.728 1.00 0.00 O ATOM 40 CB SER A -1 18.783 -25.139 -2.973 1.00 0.00 C ATOM 41 OG SER A -1 18.118 -24.547 -1.871 1.00 0.00 O ATOM 0 H SER A -1 20.473 -22.648 -2.316 1.00 0.00 H new ATOM 0 HA SER A -1 20.423 -24.718 -4.296 1.00 0.00 H new ATOM 0 HB2 SER A -1 18.053 -25.432 -3.728 1.00 0.00 H new ATOM 0 HB3 SER A -1 19.290 -26.048 -2.650 1.00 0.00 H new ATOM 0 HG SER A -1 17.473 -25.183 -1.498 1.00 0.00 H new ATOM 47 N HIS A 0 19.054 -23.163 -5.662 1.00 0.00 N ATOM 48 CA HIS A 0 18.392 -22.167 -6.496 1.00 0.00 C ATOM 49 C HIS A 0 17.256 -22.796 -7.297 1.00 0.00 C ATOM 50 O HIS A 0 17.272 -23.995 -7.580 1.00 0.00 O ATOM 51 CB HIS A 0 19.399 -21.514 -7.443 1.00 0.00 C ATOM 52 CG HIS A 0 19.929 -22.446 -8.489 1.00 0.00 C ATOM 53 ND1 HIS A 0 21.005 -23.282 -8.278 1.00 0.00 N ATOM 54 CD2 HIS A 0 19.523 -22.672 -9.761 1.00 0.00 C ATOM 55 CE1 HIS A 0 21.239 -23.981 -9.374 1.00 0.00 C ATOM 56 NE2 HIS A 0 20.353 -23.630 -10.289 1.00 0.00 N ATOM 0 H HIS A 0 19.490 -23.925 -6.181 1.00 0.00 H new ATOM 0 HA HIS A 0 17.971 -21.403 -5.842 1.00 0.00 H new ATOM 0 HB2 HIS A 0 18.926 -20.663 -7.933 1.00 0.00 H new ATOM 0 HB3 HIS A 0 20.233 -21.123 -6.860 1.00 0.00 H new ATOM 0 HD2 HIS A 0 18.700 -22.189 -10.266 1.00 0.00 H new ATOM 0 HE1 HIS A 0 22.021 -24.715 -9.501 1.00 0.00 H new ATOM 0 HE2 HIS A 0 20.295 -24.009 -11.234 1.00 0.00 H new ATOM 64 N HIS A 1 16.271 -21.980 -7.659 1.00 0.00 N ATOM 65 CA HIS A 1 15.127 -22.458 -8.428 1.00 0.00 C ATOM 66 C HIS A 1 15.059 -21.768 -9.787 1.00 0.00 C ATOM 67 O HIS A 1 14.135 -21.001 -10.060 1.00 0.00 O ATOM 68 CB HIS A 1 13.830 -22.216 -7.655 1.00 0.00 C ATOM 69 CG HIS A 1 13.533 -23.275 -6.637 1.00 0.00 C ATOM 70 ND1 HIS A 1 13.203 -24.570 -6.974 1.00 0.00 N ATOM 71 CD2 HIS A 1 13.520 -23.224 -5.285 1.00 0.00 C ATOM 72 CE1 HIS A 1 12.997 -25.270 -5.872 1.00 0.00 C ATOM 73 NE2 HIS A 1 13.184 -24.476 -4.833 1.00 0.00 N ATOM 0 H HIS A 1 16.242 -20.986 -7.433 1.00 0.00 H new ATOM 0 HA HIS A 1 15.251 -23.529 -8.590 1.00 0.00 H new ATOM 0 HB2 HIS A 1 13.890 -21.249 -7.155 1.00 0.00 H new ATOM 0 HB3 HIS A 1 13.001 -22.159 -8.361 1.00 0.00 H new ATOM 0 HD2 HIS A 1 13.734 -22.359 -4.675 1.00 0.00 H new ATOM 0 HE1 HIS A 1 12.722 -26.314 -5.828 1.00 0.00 H new ATOM 0 HE2 HIS A 1 13.093 -24.749 -3.854 1.00 0.00 H new ATOM 81 N HIS A 2 16.045 -22.044 -10.635 1.00 0.00 N ATOM 82 CA HIS A 2 16.097 -21.449 -11.966 1.00 0.00 C ATOM 83 C HIS A 2 15.693 -22.465 -13.031 1.00 0.00 C ATOM 84 O HIS A 2 16.351 -23.492 -13.205 1.00 0.00 O ATOM 85 CB HIS A 2 17.501 -20.919 -12.256 1.00 0.00 C ATOM 86 CG HIS A 2 17.621 -20.237 -13.584 1.00 0.00 C ATOM 87 ND1 HIS A 2 16.964 -19.064 -13.890 1.00 0.00 N ATOM 88 CD2 HIS A 2 18.329 -20.568 -14.689 1.00 0.00 C ATOM 89 CE1 HIS A 2 17.261 -18.704 -15.126 1.00 0.00 C ATOM 90 NE2 HIS A 2 18.088 -19.600 -15.633 1.00 0.00 N ATOM 0 H HIS A 2 16.818 -22.675 -10.424 1.00 0.00 H new ATOM 0 HA HIS A 2 15.391 -20.619 -11.994 1.00 0.00 H new ATOM 0 HB2 HIS A 2 17.786 -20.219 -11.470 1.00 0.00 H new ATOM 0 HB3 HIS A 2 18.208 -21.747 -12.217 1.00 0.00 H new ATOM 0 HD2 HIS A 2 18.965 -21.433 -14.807 1.00 0.00 H new ATOM 0 HE1 HIS A 2 16.891 -17.826 -15.635 1.00 0.00 H new ATOM 0 HE2 HIS A 2 18.484 -19.577 -16.573 1.00 0.00 H new ATOM 98 N HIS A 3 14.608 -22.172 -13.741 1.00 0.00 N ATOM 99 CA HIS A 3 14.118 -23.059 -14.789 1.00 0.00 C ATOM 100 C HIS A 3 14.291 -22.424 -16.165 1.00 0.00 C ATOM 101 O HIS A 3 14.560 -21.228 -16.278 1.00 0.00 O ATOM 102 CB HIS A 3 12.645 -23.397 -14.552 1.00 0.00 C ATOM 103 CG HIS A 3 12.352 -23.854 -13.156 1.00 0.00 C ATOM 104 ND1 HIS A 3 13.020 -24.898 -12.551 1.00 0.00 N ATOM 105 CD2 HIS A 3 11.458 -23.402 -12.246 1.00 0.00 C ATOM 106 CE1 HIS A 3 12.548 -25.069 -11.329 1.00 0.00 C ATOM 107 NE2 HIS A 3 11.600 -24.173 -11.119 1.00 0.00 N ATOM 0 H HIS A 3 14.052 -21.327 -13.609 1.00 0.00 H new ATOM 0 HA HIS A 3 14.704 -23.977 -14.757 1.00 0.00 H new ATOM 0 HB2 HIS A 3 12.039 -22.518 -14.772 1.00 0.00 H new ATOM 0 HB3 HIS A 3 12.343 -24.176 -15.252 1.00 0.00 H new ATOM 0 HD2 HIS A 3 10.763 -22.587 -12.381 1.00 0.00 H new ATOM 0 HE1 HIS A 3 12.881 -25.815 -10.622 1.00 0.00 H new ATOM 0 HE2 HIS A 3 11.061 -24.071 -10.259 1.00 0.00 H new ATOM 115 N HIS A 4 14.137 -23.232 -17.209 1.00 0.00 N ATOM 116 CA HIS A 4 14.277 -22.749 -18.578 1.00 0.00 C ATOM 117 C HIS A 4 13.907 -23.839 -19.579 1.00 0.00 C ATOM 118 O HIS A 4 14.237 -25.010 -19.388 1.00 0.00 O ATOM 119 CB HIS A 4 15.708 -22.273 -18.829 1.00 0.00 C ATOM 120 CG HIS A 4 16.750 -23.270 -18.425 1.00 0.00 C ATOM 121 ND1 HIS A 4 16.969 -24.448 -19.107 1.00 0.00 N ATOM 122 CD2 HIS A 4 17.638 -23.258 -17.403 1.00 0.00 C ATOM 123 CE1 HIS A 4 17.945 -25.119 -18.521 1.00 0.00 C ATOM 124 NE2 HIS A 4 18.368 -24.418 -17.485 1.00 0.00 N ATOM 0 H HIS A 4 13.915 -24.225 -17.133 1.00 0.00 H new ATOM 0 HA HIS A 4 13.594 -21.910 -18.713 1.00 0.00 H new ATOM 0 HB2 HIS A 4 15.826 -22.045 -19.888 1.00 0.00 H new ATOM 0 HB3 HIS A 4 15.874 -21.344 -18.283 1.00 0.00 H new ATOM 0 HD1 HIS A 4 16.457 -24.754 -19.935 1.00 0.00 H new ATOM 0 HD2 HIS A 4 17.751 -22.481 -16.662 1.00 0.00 H new ATOM 0 HE1 HIS A 4 18.331 -26.077 -18.836 1.00 0.00 H new ATOM 132 N HIS A 5 13.220 -23.446 -20.648 1.00 0.00 N ATOM 133 CA HIS A 5 12.806 -24.390 -21.679 1.00 0.00 C ATOM 134 C HIS A 5 12.706 -23.701 -23.037 1.00 0.00 C ATOM 135 O HIS A 5 12.274 -22.552 -23.131 1.00 0.00 O ATOM 136 CB HIS A 5 11.461 -25.020 -21.314 1.00 0.00 C ATOM 137 CG HIS A 5 11.574 -26.145 -20.332 1.00 0.00 C ATOM 138 ND1 HIS A 5 11.626 -25.950 -18.967 1.00 0.00 N ATOM 139 CD2 HIS A 5 11.644 -27.483 -20.522 1.00 0.00 C ATOM 140 CE1 HIS A 5 11.724 -27.120 -18.362 1.00 0.00 C ATOM 141 NE2 HIS A 5 11.737 -28.067 -19.283 1.00 0.00 N ATOM 0 H HIS A 5 12.939 -22.481 -20.822 1.00 0.00 H new ATOM 0 HA HIS A 5 13.560 -25.174 -21.743 1.00 0.00 H new ATOM 0 HB2 HIS A 5 10.809 -24.251 -20.900 1.00 0.00 H new ATOM 0 HB3 HIS A 5 10.983 -25.388 -22.222 1.00 0.00 H new ATOM 0 HD2 HIS A 5 11.629 -27.996 -21.472 1.00 0.00 H new ATOM 0 HE1 HIS A 5 11.783 -27.276 -17.295 1.00 0.00 H new ATOM 0 HE2 HIS A 5 11.805 -29.069 -19.103 1.00 0.00 H new ATOM 149 N SER A 6 13.109 -24.411 -24.086 1.00 0.00 N ATOM 150 CA SER A 6 13.069 -23.866 -25.438 1.00 0.00 C ATOM 151 C SER A 6 12.113 -24.666 -26.318 1.00 0.00 C ATOM 152 O SER A 6 12.510 -25.636 -26.963 1.00 0.00 O ATOM 153 CB SER A 6 14.470 -23.869 -26.054 1.00 0.00 C ATOM 154 OG SER A 6 15.296 -22.890 -25.448 1.00 0.00 O ATOM 0 H SER A 6 13.467 -25.364 -24.026 1.00 0.00 H new ATOM 0 HA SER A 6 12.708 -22.839 -25.379 1.00 0.00 H new ATOM 0 HB2 SER A 6 14.921 -24.854 -25.935 1.00 0.00 H new ATOM 0 HB3 SER A 6 14.400 -23.678 -27.125 1.00 0.00 H new ATOM 0 HG SER A 6 16.186 -22.913 -25.858 1.00 0.00 H new ATOM 160 N SER A 7 10.851 -24.250 -26.339 1.00 0.00 N ATOM 161 CA SER A 7 9.835 -24.929 -27.136 1.00 0.00 C ATOM 162 C SER A 7 8.663 -23.998 -27.430 1.00 0.00 C ATOM 163 O SER A 7 8.633 -22.856 -26.972 1.00 0.00 O ATOM 164 CB SER A 7 9.338 -26.180 -26.409 1.00 0.00 C ATOM 165 OG SER A 7 10.116 -27.313 -26.754 1.00 0.00 O ATOM 0 H SER A 7 10.507 -23.446 -25.814 1.00 0.00 H new ATOM 0 HA SER A 7 10.288 -25.224 -28.083 1.00 0.00 H new ATOM 0 HB2 SER A 7 9.381 -26.020 -25.332 1.00 0.00 H new ATOM 0 HB3 SER A 7 8.294 -26.361 -26.663 1.00 0.00 H new ATOM 0 HG SER A 7 11.046 -27.039 -26.899 1.00 0.00 H new ATOM 171 N GLY A 8 7.698 -24.495 -28.198 1.00 0.00 N ATOM 172 CA GLY A 8 6.536 -23.696 -28.540 1.00 0.00 C ATOM 173 C GLY A 8 5.495 -23.686 -27.439 1.00 0.00 C ATOM 174 O GLY A 8 4.441 -24.311 -27.566 1.00 0.00 O ATOM 0 H GLY A 8 7.700 -25.437 -28.589 1.00 0.00 H new ATOM 0 HA2 GLY A 8 6.851 -22.673 -28.748 1.00 0.00 H new ATOM 0 HA3 GLY A 8 6.089 -24.084 -29.455 1.00 0.00 H new ATOM 178 N LEU A 9 5.788 -22.976 -26.356 1.00 0.00 N ATOM 179 CA LEU A 9 4.869 -22.888 -25.226 1.00 0.00 C ATOM 180 C LEU A 9 4.397 -21.452 -25.018 1.00 0.00 C ATOM 181 O LEU A 9 5.186 -20.510 -25.102 1.00 0.00 O ATOM 182 CB LEU A 9 5.542 -23.405 -23.954 1.00 0.00 C ATOM 183 CG LEU A 9 4.635 -23.574 -22.735 1.00 0.00 C ATOM 184 CD1 LEU A 9 3.931 -24.921 -22.776 1.00 0.00 C ATOM 185 CD2 LEU A 9 5.435 -23.427 -21.449 1.00 0.00 C ATOM 0 H LEU A 9 6.655 -22.452 -26.236 1.00 0.00 H new ATOM 0 HA LEU A 9 4.000 -23.508 -25.447 1.00 0.00 H new ATOM 0 HB2 LEU A 9 6.002 -24.368 -24.176 1.00 0.00 H new ATOM 0 HB3 LEU A 9 6.348 -22.721 -23.690 1.00 0.00 H new ATOM 0 HG LEU A 9 3.878 -22.790 -22.759 1.00 0.00 H new ATOM 0 HD11 LEU A 9 3.290 -25.023 -21.900 1.00 0.00 H new ATOM 0 HD12 LEU A 9 3.325 -24.987 -23.679 1.00 0.00 H new ATOM 0 HD13 LEU A 9 4.673 -25.719 -22.778 1.00 0.00 H new ATOM 0 HD21 LEU A 9 4.773 -23.550 -20.592 1.00 0.00 H new ATOM 0 HD22 LEU A 9 6.215 -24.187 -21.417 1.00 0.00 H new ATOM 0 HD23 LEU A 9 5.891 -22.438 -21.415 1.00 0.00 H new ATOM 197 N VAL A 10 3.106 -21.292 -24.745 1.00 0.00 N ATOM 198 CA VAL A 10 2.530 -19.972 -24.521 1.00 0.00 C ATOM 199 C VAL A 10 2.898 -19.438 -23.141 1.00 0.00 C ATOM 200 O VAL A 10 2.798 -20.135 -22.132 1.00 0.00 O ATOM 201 CB VAL A 10 0.996 -19.999 -24.656 1.00 0.00 C ATOM 202 CG1 VAL A 10 0.391 -20.994 -23.678 1.00 0.00 C ATOM 203 CG2 VAL A 10 0.418 -18.608 -24.441 1.00 0.00 C ATOM 0 H VAL A 10 2.439 -22.061 -24.674 1.00 0.00 H new ATOM 0 HA VAL A 10 2.943 -19.313 -25.284 1.00 0.00 H new ATOM 0 HB VAL A 10 0.743 -20.320 -25.666 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -0.693 -20.999 -23.788 1.00 0.00 H new ATOM 0 HG12 VAL A 10 0.781 -21.991 -23.885 1.00 0.00 H new ATOM 0 HG13 VAL A 10 0.651 -20.707 -22.659 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -0.667 -18.645 -24.540 1.00 0.00 H new ATOM 0 HG22 VAL A 10 0.679 -18.256 -23.443 1.00 0.00 H new ATOM 0 HG23 VAL A 10 0.827 -17.925 -25.186 1.00 0.00 H new ATOM 213 N PRO A 11 3.335 -18.171 -23.095 1.00 0.00 N ATOM 214 CA PRO A 11 3.726 -17.514 -21.844 1.00 0.00 C ATOM 215 C PRO A 11 2.533 -17.240 -20.935 1.00 0.00 C ATOM 216 O PRO A 11 1.404 -17.622 -21.245 1.00 0.00 O ATOM 217 CB PRO A 11 4.354 -16.200 -22.314 1.00 0.00 C ATOM 218 CG PRO A 11 3.726 -15.934 -23.639 1.00 0.00 C ATOM 219 CD PRO A 11 3.480 -17.281 -24.259 1.00 0.00 C ATOM 0 HA PRO A 11 4.398 -18.135 -21.251 1.00 0.00 H new ATOM 0 HB2 PRO A 11 4.153 -15.391 -21.611 1.00 0.00 H new ATOM 0 HB3 PRO A 11 5.437 -16.287 -22.399 1.00 0.00 H new ATOM 0 HG2 PRO A 11 2.794 -15.381 -23.525 1.00 0.00 H new ATOM 0 HG3 PRO A 11 4.381 -15.329 -24.267 1.00 0.00 H new ATOM 0 HD2 PRO A 11 2.583 -17.280 -24.879 1.00 0.00 H new ATOM 0 HD3 PRO A 11 4.309 -17.587 -24.898 1.00 0.00 H new ATOM 227 N ARG A 12 2.790 -16.575 -19.813 1.00 0.00 N ATOM 228 CA ARG A 12 1.736 -16.250 -18.860 1.00 0.00 C ATOM 229 C ARG A 12 1.671 -14.746 -18.613 1.00 0.00 C ATOM 230 O ARG A 12 2.646 -14.028 -18.831 1.00 0.00 O ATOM 231 CB ARG A 12 1.970 -16.985 -17.538 1.00 0.00 C ATOM 232 CG ARG A 12 3.318 -16.681 -16.904 1.00 0.00 C ATOM 233 CD ARG A 12 3.654 -17.679 -15.806 1.00 0.00 C ATOM 234 NE ARG A 12 4.059 -18.973 -16.348 1.00 0.00 N ATOM 235 CZ ARG A 12 4.712 -19.892 -15.645 1.00 0.00 C ATOM 236 NH1 ARG A 12 5.031 -19.660 -14.379 1.00 0.00 N ATOM 237 NH2 ARG A 12 5.047 -21.046 -16.208 1.00 0.00 N ATOM 0 H ARG A 12 3.719 -16.251 -19.542 1.00 0.00 H new ATOM 0 HA ARG A 12 0.785 -16.573 -19.284 1.00 0.00 H new ATOM 0 HB2 ARG A 12 1.179 -16.716 -16.837 1.00 0.00 H new ATOM 0 HB3 ARG A 12 1.892 -18.059 -17.710 1.00 0.00 H new ATOM 0 HG2 ARG A 12 4.095 -16.704 -17.669 1.00 0.00 H new ATOM 0 HG3 ARG A 12 3.308 -15.673 -16.490 1.00 0.00 H new ATOM 0 HD2 ARG A 12 4.456 -17.279 -15.185 1.00 0.00 H new ATOM 0 HD3 ARG A 12 2.787 -17.812 -15.159 1.00 0.00 H new ATOM 0 HE ARG A 12 3.828 -19.183 -17.319 1.00 0.00 H new ATOM 0 HH11 ARG A 12 4.775 -18.774 -13.943 1.00 0.00 H new ATOM 0 HH12 ARG A 12 5.532 -20.367 -13.842 1.00 0.00 H new ATOM 0 HH21 ARG A 12 4.803 -21.228 -17.182 1.00 0.00 H new ATOM 0 HH22 ARG A 12 5.548 -21.751 -15.667 1.00 0.00 H new ATOM 251 N GLY A 13 0.514 -14.275 -18.156 1.00 0.00 N ATOM 252 CA GLY A 13 0.343 -12.859 -17.888 1.00 0.00 C ATOM 253 C GLY A 13 -0.751 -12.590 -16.874 1.00 0.00 C ATOM 254 O GLY A 13 -0.966 -13.382 -15.957 1.00 0.00 O ATOM 0 H GLY A 13 -0.308 -14.849 -17.967 1.00 0.00 H new ATOM 0 HA2 GLY A 13 1.283 -12.445 -17.523 1.00 0.00 H new ATOM 0 HA3 GLY A 13 0.107 -12.342 -18.818 1.00 0.00 H new ATOM 258 N SER A 14 -1.444 -11.467 -17.038 1.00 0.00 N ATOM 259 CA SER A 14 -2.518 -11.092 -16.126 1.00 0.00 C ATOM 260 C SER A 14 -3.875 -11.511 -16.683 1.00 0.00 C ATOM 261 O SER A 14 -4.888 -10.853 -16.442 1.00 0.00 O ATOM 262 CB SER A 14 -2.500 -9.582 -15.877 1.00 0.00 C ATOM 263 OG SER A 14 -2.836 -9.283 -14.533 1.00 0.00 O ATOM 0 H SER A 14 -1.281 -10.802 -17.794 1.00 0.00 H new ATOM 0 HA SER A 14 -2.357 -11.611 -15.181 1.00 0.00 H new ATOM 0 HB2 SER A 14 -1.511 -9.184 -16.105 1.00 0.00 H new ATOM 0 HB3 SER A 14 -3.204 -9.091 -16.549 1.00 0.00 H new ATOM 0 HG SER A 14 -2.816 -8.312 -14.399 1.00 0.00 H new ATOM 269 N HIS A 15 -3.887 -12.611 -17.430 1.00 0.00 N ATOM 270 CA HIS A 15 -5.120 -13.119 -18.022 1.00 0.00 C ATOM 271 C HIS A 15 -5.695 -12.120 -19.022 1.00 0.00 C ATOM 272 O HIS A 15 -6.847 -11.706 -18.906 1.00 0.00 O ATOM 273 CB HIS A 15 -6.149 -13.417 -16.931 1.00 0.00 C ATOM 274 CG HIS A 15 -7.101 -14.516 -17.291 1.00 0.00 C ATOM 275 ND1 HIS A 15 -7.388 -14.868 -18.593 1.00 0.00 N ATOM 276 CD2 HIS A 15 -7.833 -15.344 -16.509 1.00 0.00 C ATOM 277 CE1 HIS A 15 -8.256 -15.863 -18.597 1.00 0.00 C ATOM 278 NE2 HIS A 15 -8.542 -16.171 -17.344 1.00 0.00 N ATOM 0 H HIS A 15 -3.058 -13.167 -17.639 1.00 0.00 H new ATOM 0 HA HIS A 15 -4.886 -14.042 -18.552 1.00 0.00 H new ATOM 0 HB2 HIS A 15 -5.626 -13.686 -16.013 1.00 0.00 H new ATOM 0 HB3 HIS A 15 -6.716 -12.510 -16.720 1.00 0.00 H new ATOM 0 HD2 HIS A 15 -7.855 -15.352 -15.429 1.00 0.00 H new ATOM 0 HE1 HIS A 15 -8.663 -16.343 -19.475 1.00 0.00 H new ATOM 0 HE2 HIS A 15 -9.185 -16.904 -17.046 1.00 0.00 H new ATOM 286 N MET A 16 -4.883 -11.738 -20.002 1.00 0.00 N ATOM 287 CA MET A 16 -5.312 -10.788 -21.022 1.00 0.00 C ATOM 288 C MET A 16 -5.167 -11.387 -22.418 1.00 0.00 C ATOM 289 O MET A 16 -4.387 -12.316 -22.627 1.00 0.00 O ATOM 290 CB MET A 16 -4.498 -9.497 -20.922 1.00 0.00 C ATOM 291 CG MET A 16 -2.996 -9.718 -21.001 1.00 0.00 C ATOM 292 SD MET A 16 -2.375 -9.671 -22.694 1.00 0.00 S ATOM 293 CE MET A 16 -0.611 -9.786 -22.411 1.00 0.00 C ATOM 0 H MET A 16 -3.925 -12.071 -20.112 1.00 0.00 H new ATOM 0 HA MET A 16 -6.364 -10.560 -20.851 1.00 0.00 H new ATOM 0 HB2 MET A 16 -4.801 -8.823 -21.724 1.00 0.00 H new ATOM 0 HB3 MET A 16 -4.735 -9.000 -19.981 1.00 0.00 H new ATOM 0 HG2 MET A 16 -2.489 -8.955 -20.411 1.00 0.00 H new ATOM 0 HG3 MET A 16 -2.750 -10.682 -20.555 1.00 0.00 H new ATOM 0 HE1 MET A 16 -0.087 -9.769 -23.367 1.00 0.00 H new ATOM 0 HE2 MET A 16 -0.284 -8.942 -21.803 1.00 0.00 H new ATOM 0 HE3 MET A 16 -0.386 -10.717 -21.890 1.00 0.00 H new ATOM 303 N SER A 17 -5.924 -10.849 -23.369 1.00 0.00 N ATOM 304 CA SER A 17 -5.883 -11.334 -24.744 1.00 0.00 C ATOM 305 C SER A 17 -5.964 -10.173 -25.731 1.00 0.00 C ATOM 306 O SER A 17 -5.907 -9.007 -25.342 1.00 0.00 O ATOM 307 CB SER A 17 -7.030 -12.314 -24.996 1.00 0.00 C ATOM 308 OG SER A 17 -6.682 -13.261 -25.991 1.00 0.00 O ATOM 0 H SER A 17 -6.573 -10.078 -23.213 1.00 0.00 H new ATOM 0 HA SER A 17 -4.935 -11.850 -24.894 1.00 0.00 H new ATOM 0 HB2 SER A 17 -7.281 -12.831 -24.070 1.00 0.00 H new ATOM 0 HB3 SER A 17 -7.919 -11.766 -25.306 1.00 0.00 H new ATOM 0 HG SER A 17 -7.431 -13.877 -26.133 1.00 0.00 H new ATOM 314 N VAL A 18 -6.098 -10.503 -27.012 1.00 0.00 N ATOM 315 CA VAL A 18 -6.187 -9.490 -28.057 1.00 0.00 C ATOM 316 C VAL A 18 -7.606 -8.942 -28.170 1.00 0.00 C ATOM 317 O VAL A 18 -7.868 -8.027 -28.951 1.00 0.00 O ATOM 318 CB VAL A 18 -5.756 -10.053 -29.424 1.00 0.00 C ATOM 319 CG1 VAL A 18 -6.776 -11.059 -29.933 1.00 0.00 C ATOM 320 CG2 VAL A 18 -5.560 -8.926 -30.426 1.00 0.00 C ATOM 0 H VAL A 18 -6.147 -11.464 -27.351 1.00 0.00 H new ATOM 0 HA VAL A 18 -5.509 -8.684 -27.775 1.00 0.00 H new ATOM 0 HB VAL A 18 -4.804 -10.569 -29.301 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -6.454 -11.446 -30.900 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -6.861 -11.882 -29.223 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -7.745 -10.572 -30.041 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -5.256 -9.342 -31.386 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -6.496 -8.380 -30.547 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -4.788 -8.247 -30.064 1.00 0.00 H new ATOM 330 N ASP A 19 -8.517 -9.507 -27.386 1.00 0.00 N ATOM 331 CA ASP A 19 -9.909 -9.074 -27.397 1.00 0.00 C ATOM 332 C ASP A 19 -10.019 -7.589 -27.068 1.00 0.00 C ATOM 333 O ASP A 19 -11.013 -6.942 -27.399 1.00 0.00 O ATOM 334 CB ASP A 19 -10.728 -9.893 -26.397 1.00 0.00 C ATOM 335 CG ASP A 19 -12.194 -9.969 -26.774 1.00 0.00 C ATOM 336 OD1 ASP A 19 -12.649 -9.116 -27.566 1.00 0.00 O ATOM 337 OD2 ASP A 19 -12.887 -10.881 -26.277 1.00 0.00 O ATOM 0 H ASP A 19 -8.317 -10.266 -26.735 1.00 0.00 H new ATOM 0 HA ASP A 19 -10.306 -9.236 -28.399 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -10.319 -10.901 -26.336 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -10.633 -9.450 -25.405 1.00 0.00 H new ATOM 342 N ASP A 20 -8.993 -7.055 -26.415 1.00 0.00 N ATOM 343 CA ASP A 20 -8.974 -5.646 -26.041 1.00 0.00 C ATOM 344 C ASP A 20 -8.138 -4.834 -27.025 1.00 0.00 C ATOM 345 O ASP A 20 -7.659 -3.747 -26.699 1.00 0.00 O ATOM 346 CB ASP A 20 -8.422 -5.479 -24.624 1.00 0.00 C ATOM 347 CG ASP A 20 -9.483 -5.683 -23.561 1.00 0.00 C ATOM 348 OD1 ASP A 20 -9.835 -6.851 -23.290 1.00 0.00 O ATOM 349 OD2 ASP A 20 -9.962 -4.676 -23.000 1.00 0.00 O ATOM 0 H ASP A 20 -8.163 -7.577 -26.134 1.00 0.00 H new ATOM 0 HA ASP A 20 -9.998 -5.274 -26.069 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -7.612 -6.192 -24.466 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -7.994 -4.482 -24.519 1.00 0.00 H new ATOM 354 N ILE A 21 -7.966 -5.369 -28.229 1.00 0.00 N ATOM 355 CA ILE A 21 -7.188 -4.694 -29.260 1.00 0.00 C ATOM 356 C ILE A 21 -7.948 -4.648 -30.581 1.00 0.00 C ATOM 357 O ILE A 21 -8.653 -5.594 -30.936 1.00 0.00 O ATOM 358 CB ILE A 21 -5.831 -5.386 -29.486 1.00 0.00 C ATOM 359 CG1 ILE A 21 -5.012 -5.385 -28.193 1.00 0.00 C ATOM 360 CG2 ILE A 21 -5.065 -4.698 -30.605 1.00 0.00 C ATOM 361 CD1 ILE A 21 -3.658 -6.044 -28.335 1.00 0.00 C ATOM 0 H ILE A 21 -8.355 -6.268 -28.514 1.00 0.00 H new ATOM 0 HA ILE A 21 -7.014 -3.677 -28.908 1.00 0.00 H new ATOM 0 HB ILE A 21 -6.012 -6.420 -29.779 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -4.873 -4.356 -27.861 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -5.577 -5.898 -27.414 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -4.108 -5.199 -30.752 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -5.645 -4.746 -31.526 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -4.891 -3.655 -30.339 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -3.133 -6.007 -27.380 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -3.789 -7.083 -28.637 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -3.075 -5.518 -29.090 1.00 0.00 H new ATOM 373 N ILE A 22 -7.799 -3.545 -31.306 1.00 0.00 N ATOM 374 CA ILE A 22 -8.469 -3.377 -32.590 1.00 0.00 C ATOM 375 C ILE A 22 -7.464 -3.105 -33.703 1.00 0.00 C ATOM 376 O ILE A 22 -6.253 -3.163 -33.488 1.00 0.00 O ATOM 377 CB ILE A 22 -9.493 -2.227 -32.545 1.00 0.00 C ATOM 378 CG1 ILE A 22 -8.778 -0.886 -32.371 1.00 0.00 C ATOM 379 CG2 ILE A 22 -10.492 -2.451 -31.419 1.00 0.00 C ATOM 380 CD1 ILE A 22 -9.718 0.299 -32.331 1.00 0.00 C ATOM 0 H ILE A 22 -7.220 -2.753 -31.026 1.00 0.00 H new ATOM 0 HA ILE A 22 -8.993 -4.310 -32.797 1.00 0.00 H new ATOM 0 HB ILE A 22 -10.038 -2.208 -33.489 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.197 -0.910 -31.449 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -8.071 -0.751 -33.190 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -11.209 -1.630 -31.400 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -11.020 -3.390 -31.583 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -9.963 -2.493 -30.467 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -9.142 1.216 -32.206 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -10.281 0.348 -33.263 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -10.409 0.187 -31.495 1.00 0.00 H new ATOM 392 N ILE A 23 -7.974 -2.806 -34.893 1.00 0.00 N ATOM 393 CA ILE A 23 -7.121 -2.522 -36.040 1.00 0.00 C ATOM 394 C ILE A 23 -6.859 -1.025 -36.173 1.00 0.00 C ATOM 395 O ILE A 23 -7.723 -0.203 -35.866 1.00 0.00 O ATOM 396 CB ILE A 23 -7.745 -3.041 -37.349 1.00 0.00 C ATOM 397 CG1 ILE A 23 -8.219 -4.485 -37.175 1.00 0.00 C ATOM 398 CG2 ILE A 23 -6.744 -2.940 -38.490 1.00 0.00 C ATOM 399 CD1 ILE A 23 -7.100 -5.457 -36.876 1.00 0.00 C ATOM 0 H ILE A 23 -8.974 -2.754 -35.088 1.00 0.00 H new ATOM 0 HA ILE A 23 -6.178 -3.040 -35.867 1.00 0.00 H new ATOM 0 HB ILE A 23 -8.608 -2.422 -37.594 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -8.949 -4.524 -36.366 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -8.732 -4.802 -38.083 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -7.200 -3.311 -39.408 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -6.450 -1.899 -38.625 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -5.863 -3.538 -38.255 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -7.510 -6.461 -36.765 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.381 -5.447 -37.695 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -6.601 -5.165 -35.952 1.00 0.00 H new ATOM 411 N LYS A 24 -5.663 -0.678 -36.634 1.00 0.00 N ATOM 412 CA LYS A 24 -5.286 0.720 -36.812 1.00 0.00 C ATOM 413 C LYS A 24 -5.268 1.452 -35.474 1.00 0.00 C ATOM 414 O LYS A 24 -5.588 2.639 -35.401 1.00 0.00 O ATOM 415 CB LYS A 24 -6.257 1.412 -37.771 1.00 0.00 C ATOM 416 CG LYS A 24 -6.521 0.625 -39.043 1.00 0.00 C ATOM 417 CD LYS A 24 -6.981 1.530 -40.173 1.00 0.00 C ATOM 418 CE LYS A 24 -5.822 2.317 -40.764 1.00 0.00 C ATOM 419 NZ LYS A 24 -4.977 1.475 -41.656 1.00 0.00 N ATOM 0 H LYS A 24 -4.937 -1.346 -36.892 1.00 0.00 H new ATOM 0 HA LYS A 24 -4.282 0.750 -37.236 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -7.203 1.583 -37.257 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -5.857 2.391 -38.036 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.614 0.100 -39.342 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -7.280 -0.134 -38.852 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -7.450 0.930 -40.953 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -7.739 2.220 -39.802 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -6.209 3.167 -41.326 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -5.209 2.721 -39.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -4.260 2.070 -42.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -4.506 0.738 -41.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -5.575 1.028 -42.380 1.00 0.00 H new ATOM 433 N CYS A 25 -4.890 0.739 -34.419 1.00 0.00 N ATOM 434 CA CYS A 25 -4.829 1.322 -33.083 1.00 0.00 C ATOM 435 C CYS A 25 -3.385 1.580 -32.668 1.00 0.00 C ATOM 436 O CYS A 25 -2.452 1.047 -33.269 1.00 0.00 O ATOM 437 CB CYS A 25 -5.507 0.398 -32.070 1.00 0.00 C ATOM 438 SG CYS A 25 -6.338 1.268 -30.720 1.00 0.00 S ATOM 0 H CYS A 25 -4.621 -0.244 -34.463 1.00 0.00 H new ATOM 0 HA CYS A 25 -5.357 2.275 -33.104 1.00 0.00 H new ATOM 0 HB2 CYS A 25 -6.236 -0.223 -32.591 1.00 0.00 H new ATOM 0 HB3 CYS A 25 -4.759 -0.274 -31.649 1.00 0.00 H new ATOM 0 HG CYS A 25 -6.883 0.403 -29.917 1.00 0.00 H new ATOM 444 N GLN A 26 -3.208 2.402 -31.639 1.00 0.00 N ATOM 445 CA GLN A 26 -1.876 2.732 -31.145 1.00 0.00 C ATOM 446 C GLN A 26 -1.450 1.768 -30.043 1.00 0.00 C ATOM 447 O GLN A 26 -2.126 1.639 -29.022 1.00 0.00 O ATOM 448 CB GLN A 26 -1.845 4.169 -30.623 1.00 0.00 C ATOM 449 CG GLN A 26 -2.809 4.420 -29.475 1.00 0.00 C ATOM 450 CD GLN A 26 -3.450 5.793 -29.541 1.00 0.00 C ATOM 451 OE1 GLN A 26 -2.924 6.707 -30.176 1.00 0.00 O ATOM 452 NE2 GLN A 26 -4.593 5.945 -28.882 1.00 0.00 N ATOM 0 H GLN A 26 -3.970 2.852 -31.131 1.00 0.00 H new ATOM 0 HA GLN A 26 -1.175 2.639 -31.974 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -0.833 4.406 -30.295 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -2.082 4.849 -31.441 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -3.589 3.658 -29.487 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -2.277 4.317 -28.529 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -4.994 5.160 -28.368 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -5.070 6.847 -28.890 1.00 0.00 H new ATOM 461 N CYS A 27 -0.325 1.095 -30.256 1.00 0.00 N ATOM 462 CA CYS A 27 0.192 0.141 -29.280 1.00 0.00 C ATOM 463 C CYS A 27 1.609 0.511 -28.856 1.00 0.00 C ATOM 464 O CYS A 27 2.475 0.755 -29.696 1.00 0.00 O ATOM 465 CB CYS A 27 0.173 -1.274 -29.860 1.00 0.00 C ATOM 466 SG CYS A 27 -0.913 -2.419 -28.977 1.00 0.00 S ATOM 0 H CYS A 27 0.247 1.192 -31.095 1.00 0.00 H new ATOM 0 HA CYS A 27 -0.451 0.174 -28.400 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -0.141 -1.224 -30.903 1.00 0.00 H new ATOM 0 HB3 CYS A 27 1.188 -1.672 -29.851 1.00 0.00 H new ATOM 0 HG CYS A 27 -0.863 -3.588 -29.543 1.00 0.00 H new ATOM 472 N TRP A 28 1.838 0.553 -27.548 1.00 0.00 N ATOM 473 CA TRP A 28 3.150 0.895 -27.013 1.00 0.00 C ATOM 474 C TRP A 28 4.059 -0.328 -26.975 1.00 0.00 C ATOM 475 O TRP A 28 3.650 -1.404 -26.538 1.00 0.00 O ATOM 476 CB TRP A 28 3.012 1.487 -25.609 1.00 0.00 C ATOM 477 CG TRP A 28 2.798 2.970 -25.608 1.00 0.00 C ATOM 478 CD1 TRP A 28 1.599 3.625 -25.615 1.00 0.00 C ATOM 479 CD2 TRP A 28 3.810 3.982 -25.602 1.00 0.00 C ATOM 480 NE1 TRP A 28 1.806 4.984 -25.613 1.00 0.00 N ATOM 481 CE2 TRP A 28 3.154 5.229 -25.605 1.00 0.00 C ATOM 482 CE3 TRP A 28 5.207 3.958 -25.593 1.00 0.00 C ATOM 483 CZ2 TRP A 28 3.848 6.436 -25.600 1.00 0.00 C ATOM 484 CZ3 TRP A 28 5.895 5.156 -25.588 1.00 0.00 C ATOM 485 CH2 TRP A 28 5.215 6.382 -25.591 1.00 0.00 C ATOM 0 H TRP A 28 1.132 0.354 -26.839 1.00 0.00 H new ATOM 0 HA TRP A 28 3.600 1.638 -27.671 1.00 0.00 H new ATOM 0 HB2 TRP A 28 2.176 1.006 -25.100 1.00 0.00 H new ATOM 0 HB3 TRP A 28 3.910 1.256 -25.035 1.00 0.00 H new ATOM 0 HD1 TRP A 28 0.631 3.146 -25.621 1.00 0.00 H new ATOM 0 HE1 TRP A 28 1.075 5.695 -25.617 1.00 0.00 H new ATOM 0 HE3 TRP A 28 5.740 3.019 -25.590 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 3.326 7.381 -25.603 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 6.975 5.148 -25.582 1.00 0.00 H new ATOM 0 HH2 TRP A 28 5.781 7.302 -25.586 1.00 0.00 H new ATOM 496 N VAL A 29 5.294 -0.157 -27.435 1.00 0.00 N ATOM 497 CA VAL A 29 6.262 -1.248 -27.452 1.00 0.00 C ATOM 498 C VAL A 29 7.223 -1.149 -26.273 1.00 0.00 C ATOM 499 O VAL A 29 8.042 -0.234 -26.204 1.00 0.00 O ATOM 500 CB VAL A 29 7.072 -1.259 -28.761 1.00 0.00 C ATOM 501 CG1 VAL A 29 7.944 -2.503 -28.840 1.00 0.00 C ATOM 502 CG2 VAL A 29 6.144 -1.172 -29.963 1.00 0.00 C ATOM 0 H VAL A 29 5.648 0.727 -27.801 1.00 0.00 H new ATOM 0 HA VAL A 29 5.694 -2.176 -27.377 1.00 0.00 H new ATOM 0 HB VAL A 29 7.725 -0.386 -28.770 1.00 0.00 H new ATOM 0 HG11 VAL A 29 8.509 -2.493 -29.772 1.00 0.00 H new ATOM 0 HG12 VAL A 29 8.635 -2.517 -27.997 1.00 0.00 H new ATOM 0 HG13 VAL A 29 7.314 -3.392 -28.807 1.00 0.00 H new ATOM 0 HG21 VAL A 29 6.734 -1.181 -30.880 1.00 0.00 H new ATOM 0 HG22 VAL A 29 5.464 -2.024 -29.960 1.00 0.00 H new ATOM 0 HG23 VAL A 29 5.568 -0.248 -29.912 1.00 0.00 H new ATOM 512 N GLN A 30 7.116 -2.097 -25.348 1.00 0.00 N ATOM 513 CA GLN A 30 7.976 -2.116 -24.171 1.00 0.00 C ATOM 514 C GLN A 30 9.273 -2.866 -24.456 1.00 0.00 C ATOM 515 O GLN A 30 9.308 -4.097 -24.440 1.00 0.00 O ATOM 516 CB GLN A 30 7.248 -2.763 -22.991 1.00 0.00 C ATOM 517 CG GLN A 30 7.714 -2.255 -21.636 1.00 0.00 C ATOM 518 CD GLN A 30 7.154 -3.066 -20.484 1.00 0.00 C ATOM 519 OE1 GLN A 30 6.159 -3.776 -20.636 1.00 0.00 O ATOM 520 NE2 GLN A 30 7.791 -2.966 -19.324 1.00 0.00 N ATOM 0 H GLN A 30 6.442 -2.862 -25.391 1.00 0.00 H new ATOM 0 HA GLN A 30 8.222 -1.085 -23.916 1.00 0.00 H new ATOM 0 HB2 GLN A 30 6.178 -2.580 -23.090 1.00 0.00 H new ATOM 0 HB3 GLN A 30 7.392 -3.843 -23.034 1.00 0.00 H new ATOM 0 HG2 GLN A 30 8.803 -2.281 -21.598 1.00 0.00 H new ATOM 0 HG3 GLN A 30 7.415 -1.213 -21.521 1.00 0.00 H new ATOM 0 HE21 GLN A 30 8.612 -2.366 -19.243 1.00 0.00 H new ATOM 0 HE22 GLN A 30 7.460 -3.489 -18.514 1.00 0.00 H new ATOM 529 N LYS A 31 10.339 -2.117 -24.717 1.00 0.00 N ATOM 530 CA LYS A 31 11.639 -2.710 -25.006 1.00 0.00 C ATOM 531 C LYS A 31 12.322 -3.174 -23.723 1.00 0.00 C ATOM 532 O LYS A 31 11.922 -2.795 -22.624 1.00 0.00 O ATOM 533 CB LYS A 31 12.531 -1.703 -25.735 1.00 0.00 C ATOM 534 CG LYS A 31 11.847 -1.021 -26.907 1.00 0.00 C ATOM 535 CD LYS A 31 11.496 -2.014 -28.002 1.00 0.00 C ATOM 536 CE LYS A 31 12.702 -2.336 -28.871 1.00 0.00 C ATOM 537 NZ LYS A 31 12.863 -1.357 -29.981 1.00 0.00 N ATOM 0 H LYS A 31 10.328 -1.097 -24.734 1.00 0.00 H new ATOM 0 HA LYS A 31 11.481 -3.577 -25.647 1.00 0.00 H new ATOM 0 HB2 LYS A 31 12.862 -0.944 -25.026 1.00 0.00 H new ATOM 0 HB3 LYS A 31 13.424 -2.215 -26.094 1.00 0.00 H new ATOM 0 HG2 LYS A 31 10.941 -0.524 -26.561 1.00 0.00 H new ATOM 0 HG3 LYS A 31 12.500 -0.248 -27.311 1.00 0.00 H new ATOM 0 HD2 LYS A 31 11.114 -2.931 -27.554 1.00 0.00 H new ATOM 0 HD3 LYS A 31 10.698 -1.606 -28.622 1.00 0.00 H new ATOM 0 HE2 LYS A 31 13.602 -2.339 -28.256 1.00 0.00 H new ATOM 0 HE3 LYS A 31 12.595 -3.339 -29.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 13.696 -1.611 -30.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 12.015 -1.372 -30.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 12.991 -0.403 -29.587 1.00 0.00 H new ATOM 551 N ASN A 32 13.356 -3.996 -23.873 1.00 0.00 N ATOM 552 CA ASN A 32 14.095 -4.511 -22.726 1.00 0.00 C ATOM 553 C ASN A 32 14.531 -3.376 -21.805 1.00 0.00 C ATOM 554 O ASN A 32 14.316 -3.428 -20.594 1.00 0.00 O ATOM 555 CB ASN A 32 15.319 -5.301 -23.194 1.00 0.00 C ATOM 556 CG ASN A 32 16.146 -5.825 -22.037 1.00 0.00 C ATOM 557 OD1 ASN A 32 15.638 -6.016 -20.932 1.00 0.00 O ATOM 558 ND2 ASN A 32 17.429 -6.060 -22.286 1.00 0.00 N ATOM 0 H ASN A 32 13.701 -4.319 -24.777 1.00 0.00 H new ATOM 0 HA ASN A 32 13.434 -5.174 -22.168 1.00 0.00 H new ATOM 0 HB2 ASN A 32 14.993 -6.137 -23.812 1.00 0.00 H new ATOM 0 HB3 ASN A 32 15.941 -4.663 -23.822 1.00 0.00 H new ATOM 0 HD21 ASN A 32 18.036 -6.413 -21.546 1.00 0.00 H new ATOM 0 HD22 ASN A 32 17.808 -5.887 -23.217 1.00 0.00 H new ATOM 565 N ASP A 33 15.143 -2.351 -22.388 1.00 0.00 N ATOM 566 CA ASP A 33 15.608 -1.201 -21.620 1.00 0.00 C ATOM 567 C ASP A 33 15.272 0.102 -22.337 1.00 0.00 C ATOM 568 O ASP A 33 15.912 1.129 -22.111 1.00 0.00 O ATOM 569 CB ASP A 33 17.117 -1.294 -21.385 1.00 0.00 C ATOM 570 CG ASP A 33 17.550 -0.587 -20.116 1.00 0.00 C ATOM 571 OD1 ASP A 33 17.742 0.646 -20.161 1.00 0.00 O ATOM 572 OD2 ASP A 33 17.697 -1.266 -19.079 1.00 0.00 O ATOM 0 H ASP A 33 15.329 -2.293 -23.389 1.00 0.00 H new ATOM 0 HA ASP A 33 15.097 -1.207 -20.657 1.00 0.00 H new ATOM 0 HB2 ASP A 33 17.409 -2.343 -21.331 1.00 0.00 H new ATOM 0 HB3 ASP A 33 17.642 -0.860 -22.236 1.00 0.00 H new ATOM 577 N GLU A 34 14.263 0.053 -23.202 1.00 0.00 N ATOM 578 CA GLU A 34 13.844 1.230 -23.953 1.00 0.00 C ATOM 579 C GLU A 34 12.323 1.298 -24.053 1.00 0.00 C ATOM 580 O GLU A 34 11.619 0.409 -23.575 1.00 0.00 O ATOM 581 CB GLU A 34 14.458 1.215 -25.354 1.00 0.00 C ATOM 582 CG GLU A 34 15.964 1.415 -25.361 1.00 0.00 C ATOM 583 CD GLU A 34 16.365 2.838 -25.022 1.00 0.00 C ATOM 584 OE1 GLU A 34 15.484 3.617 -24.601 1.00 0.00 O ATOM 585 OE2 GLU A 34 17.558 3.172 -25.177 1.00 0.00 O ATOM 0 H GLU A 34 13.722 -0.789 -23.399 1.00 0.00 H new ATOM 0 HA GLU A 34 14.196 2.113 -23.420 1.00 0.00 H new ATOM 0 HB2 GLU A 34 14.224 0.265 -25.834 1.00 0.00 H new ATOM 0 HB3 GLU A 34 13.993 1.998 -25.954 1.00 0.00 H new ATOM 0 HG2 GLU A 34 16.421 0.732 -24.645 1.00 0.00 H new ATOM 0 HG3 GLU A 34 16.357 1.155 -26.344 1.00 0.00 H new ATOM 592 N GLU A 35 11.823 2.360 -24.678 1.00 0.00 N ATOM 593 CA GLU A 35 10.386 2.545 -24.840 1.00 0.00 C ATOM 594 C GLU A 35 10.061 3.098 -26.224 1.00 0.00 C ATOM 595 O GLU A 35 10.496 4.192 -26.585 1.00 0.00 O ATOM 596 CB GLU A 35 9.846 3.487 -23.762 1.00 0.00 C ATOM 597 CG GLU A 35 9.434 2.777 -22.484 1.00 0.00 C ATOM 598 CD GLU A 35 10.527 2.785 -21.433 1.00 0.00 C ATOM 599 OE1 GLU A 35 10.929 3.887 -21.004 1.00 0.00 O ATOM 600 OE2 GLU A 35 10.981 1.690 -21.040 1.00 0.00 O ATOM 0 H GLU A 35 12.392 3.105 -25.080 1.00 0.00 H new ATOM 0 HA GLU A 35 9.906 1.572 -24.735 1.00 0.00 H new ATOM 0 HB2 GLU A 35 10.608 4.230 -23.526 1.00 0.00 H new ATOM 0 HB3 GLU A 35 8.987 4.027 -24.161 1.00 0.00 H new ATOM 0 HG2 GLU A 35 8.542 3.255 -22.079 1.00 0.00 H new ATOM 0 HG3 GLU A 35 9.166 1.746 -22.716 1.00 0.00 H new ATOM 607 N ARG A 36 9.293 2.334 -26.995 1.00 0.00 N ATOM 608 CA ARG A 36 8.911 2.746 -28.340 1.00 0.00 C ATOM 609 C ARG A 36 7.395 2.714 -28.508 1.00 0.00 C ATOM 610 O ARG A 36 6.674 2.217 -27.642 1.00 0.00 O ATOM 611 CB ARG A 36 9.569 1.839 -29.381 1.00 0.00 C ATOM 612 CG ARG A 36 9.854 2.534 -30.702 1.00 0.00 C ATOM 613 CD ARG A 36 11.069 1.938 -31.395 1.00 0.00 C ATOM 614 NE ARG A 36 11.345 2.589 -32.673 1.00 0.00 N ATOM 615 CZ ARG A 36 12.517 2.521 -33.295 1.00 0.00 C ATOM 616 NH1 ARG A 36 13.516 1.835 -32.759 1.00 0.00 N ATOM 617 NH2 ARG A 36 12.690 3.141 -34.455 1.00 0.00 N ATOM 0 H ARG A 36 8.923 1.427 -26.711 1.00 0.00 H new ATOM 0 HA ARG A 36 9.255 3.769 -28.491 1.00 0.00 H new ATOM 0 HB2 ARG A 36 10.504 1.452 -28.975 1.00 0.00 H new ATOM 0 HB3 ARG A 36 8.922 0.981 -29.564 1.00 0.00 H new ATOM 0 HG2 ARG A 36 8.984 2.450 -31.354 1.00 0.00 H new ATOM 0 HG3 ARG A 36 10.019 3.597 -30.527 1.00 0.00 H new ATOM 0 HD2 ARG A 36 11.939 2.032 -30.745 1.00 0.00 H new ATOM 0 HD3 ARG A 36 10.907 0.873 -31.559 1.00 0.00 H new ATOM 0 HE ARG A 36 10.597 3.125 -33.112 1.00 0.00 H new ATOM 0 HH11 ARG A 36 13.386 1.358 -31.867 1.00 0.00 H new ATOM 0 HH12 ARG A 36 14.415 1.784 -33.238 1.00 0.00 H new ATOM 0 HH21 ARG A 36 11.923 3.670 -34.870 1.00 0.00 H new ATOM 0 HH22 ARG A 36 13.590 3.088 -34.932 1.00 0.00 H new ATOM 631 N LEU A 37 6.917 3.249 -29.627 1.00 0.00 N ATOM 632 CA LEU A 37 5.487 3.282 -29.909 1.00 0.00 C ATOM 633 C LEU A 37 5.214 2.980 -31.379 1.00 0.00 C ATOM 634 O LEU A 37 5.816 3.581 -32.268 1.00 0.00 O ATOM 635 CB LEU A 37 4.906 4.649 -29.541 1.00 0.00 C ATOM 636 CG LEU A 37 3.485 4.929 -30.032 1.00 0.00 C ATOM 637 CD1 LEU A 37 2.485 4.046 -29.302 1.00 0.00 C ATOM 638 CD2 LEU A 37 3.137 6.399 -29.847 1.00 0.00 C ATOM 0 H LEU A 37 7.500 3.666 -30.353 1.00 0.00 H new ATOM 0 HA LEU A 37 5.005 2.514 -29.304 1.00 0.00 H new ATOM 0 HB2 LEU A 37 4.920 4.747 -28.455 1.00 0.00 H new ATOM 0 HB3 LEU A 37 5.565 5.421 -29.939 1.00 0.00 H new ATOM 0 HG LEU A 37 3.435 4.696 -31.096 1.00 0.00 H new ATOM 0 HD11 LEU A 37 1.479 4.259 -29.664 1.00 0.00 H new ATOM 0 HD12 LEU A 37 2.723 2.998 -29.486 1.00 0.00 H new ATOM 0 HD13 LEU A 37 2.535 4.247 -28.232 1.00 0.00 H new ATOM 0 HD21 LEU A 37 2.122 6.580 -30.202 1.00 0.00 H new ATOM 0 HD22 LEU A 37 3.204 6.659 -28.790 1.00 0.00 H new ATOM 0 HD23 LEU A 37 3.835 7.013 -30.416 1.00 0.00 H new ATOM 650 N ALA A 38 4.301 2.046 -31.626 1.00 0.00 N ATOM 651 CA ALA A 38 3.946 1.668 -32.988 1.00 0.00 C ATOM 652 C ALA A 38 2.443 1.445 -33.121 1.00 0.00 C ATOM 653 O ALA A 38 1.734 1.323 -32.123 1.00 0.00 O ATOM 654 CB ALA A 38 4.705 0.416 -33.403 1.00 0.00 C ATOM 0 H ALA A 38 3.794 1.538 -30.901 1.00 0.00 H new ATOM 0 HA ALA A 38 4.226 2.487 -33.651 1.00 0.00 H new ATOM 0 HB1 ALA A 38 4.430 0.145 -34.422 1.00 0.00 H new ATOM 0 HB2 ALA A 38 5.777 0.608 -33.355 1.00 0.00 H new ATOM 0 HB3 ALA A 38 4.452 -0.403 -32.729 1.00 0.00 H new ATOM 660 N GLU A 39 1.965 1.396 -34.361 1.00 0.00 N ATOM 661 CA GLU A 39 0.545 1.190 -34.623 1.00 0.00 C ATOM 662 C GLU A 39 0.266 -0.263 -34.999 1.00 0.00 C ATOM 663 O GLU A 39 1.165 -0.988 -35.427 1.00 0.00 O ATOM 664 CB GLU A 39 0.071 2.118 -35.744 1.00 0.00 C ATOM 665 CG GLU A 39 -1.395 2.502 -35.636 1.00 0.00 C ATOM 666 CD GLU A 39 -1.658 3.492 -34.518 1.00 0.00 C ATOM 667 OE1 GLU A 39 -0.683 3.942 -33.881 1.00 0.00 O ATOM 668 OE2 GLU A 39 -2.841 3.817 -34.281 1.00 0.00 O ATOM 0 H GLU A 39 2.539 1.496 -35.198 1.00 0.00 H new ATOM 0 HA GLU A 39 -0.004 1.423 -33.711 1.00 0.00 H new ATOM 0 HB2 GLU A 39 0.677 3.024 -35.735 1.00 0.00 H new ATOM 0 HB3 GLU A 39 0.241 1.631 -36.704 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -1.725 2.932 -36.582 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -1.990 1.604 -35.469 1.00 0.00 H new ATOM 675 N ILE A 40 -0.985 -0.680 -34.835 1.00 0.00 N ATOM 676 CA ILE A 40 -1.382 -2.045 -35.157 1.00 0.00 C ATOM 677 C ILE A 40 -2.066 -2.112 -36.519 1.00 0.00 C ATOM 678 O ILE A 40 -3.007 -1.365 -36.790 1.00 0.00 O ATOM 679 CB ILE A 40 -2.331 -2.622 -34.090 1.00 0.00 C ATOM 680 CG1 ILE A 40 -1.653 -2.619 -32.718 1.00 0.00 C ATOM 681 CG2 ILE A 40 -2.763 -4.030 -34.470 1.00 0.00 C ATOM 682 CD1 ILE A 40 -0.388 -3.446 -32.668 1.00 0.00 C ATOM 0 H ILE A 40 -1.740 -0.093 -34.481 1.00 0.00 H new ATOM 0 HA ILE A 40 -0.470 -2.641 -35.181 1.00 0.00 H new ATOM 0 HB ILE A 40 -3.219 -1.993 -34.037 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -1.417 -1.592 -32.440 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -2.354 -2.997 -31.974 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -3.433 -4.424 -33.706 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -3.281 -4.005 -35.429 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -1.885 -4.671 -34.548 1.00 0.00 H new ATOM 0 HD11 ILE A 40 0.039 -3.398 -31.666 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -0.621 -4.482 -32.914 1.00 0.00 H new ATOM 0 HD13 ILE A 40 0.331 -3.055 -33.388 1.00 0.00 H new ATOM 694 N LEU A 41 -1.588 -3.011 -37.371 1.00 0.00 N ATOM 695 CA LEU A 41 -2.154 -3.178 -38.705 1.00 0.00 C ATOM 696 C LEU A 41 -3.001 -4.444 -38.783 1.00 0.00 C ATOM 697 O LEU A 41 -4.226 -4.378 -38.881 1.00 0.00 O ATOM 698 CB LEU A 41 -1.039 -3.232 -39.751 1.00 0.00 C ATOM 699 CG LEU A 41 -0.294 -1.921 -40.006 1.00 0.00 C ATOM 700 CD1 LEU A 41 0.753 -2.104 -41.094 1.00 0.00 C ATOM 701 CD2 LEU A 41 -1.272 -0.818 -40.385 1.00 0.00 C ATOM 0 H LEU A 41 -0.809 -3.636 -37.162 1.00 0.00 H new ATOM 0 HA LEU A 41 -2.795 -2.321 -38.910 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -0.314 -3.984 -39.441 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -1.468 -3.572 -40.693 1.00 0.00 H new ATOM 0 HG LEU A 41 0.215 -1.630 -39.087 1.00 0.00 H new ATOM 0 HD11 LEU A 41 1.273 -1.161 -41.261 1.00 0.00 H new ATOM 0 HD12 LEU A 41 1.471 -2.864 -40.784 1.00 0.00 H new ATOM 0 HD13 LEU A 41 0.267 -2.419 -42.017 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -0.725 0.108 -40.563 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -1.808 -1.102 -41.290 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -1.984 -0.668 -39.573 1.00 0.00 H new ATOM 713 N SER A 42 -2.340 -5.596 -38.736 1.00 0.00 N ATOM 714 CA SER A 42 -3.032 -6.878 -38.803 1.00 0.00 C ATOM 715 C SER A 42 -2.682 -7.747 -37.599 1.00 0.00 C ATOM 716 O SER A 42 -1.647 -7.555 -36.961 1.00 0.00 O ATOM 717 CB SER A 42 -2.671 -7.609 -40.097 1.00 0.00 C ATOM 718 OG SER A 42 -3.453 -8.781 -40.256 1.00 0.00 O ATOM 0 H SER A 42 -1.326 -5.668 -38.652 1.00 0.00 H new ATOM 0 HA SER A 42 -4.105 -6.686 -38.791 1.00 0.00 H new ATOM 0 HB2 SER A 42 -2.826 -6.946 -40.948 1.00 0.00 H new ATOM 0 HB3 SER A 42 -1.613 -7.872 -40.087 1.00 0.00 H new ATOM 0 HG SER A 42 -3.204 -9.229 -41.091 1.00 0.00 H new ATOM 724 N ILE A 43 -3.553 -8.704 -37.296 1.00 0.00 N ATOM 725 CA ILE A 43 -3.336 -9.605 -36.170 1.00 0.00 C ATOM 726 C ILE A 43 -3.504 -11.061 -36.590 1.00 0.00 C ATOM 727 O ILE A 43 -4.385 -11.390 -37.384 1.00 0.00 O ATOM 728 CB ILE A 43 -4.305 -9.301 -35.012 1.00 0.00 C ATOM 729 CG1 ILE A 43 -4.332 -7.799 -34.722 1.00 0.00 C ATOM 730 CG2 ILE A 43 -3.903 -10.079 -33.768 1.00 0.00 C ATOM 731 CD1 ILE A 43 -2.971 -7.219 -34.408 1.00 0.00 C ATOM 0 H ILE A 43 -4.415 -8.875 -37.814 1.00 0.00 H new ATOM 0 HA ILE A 43 -2.313 -9.444 -35.829 1.00 0.00 H new ATOM 0 HB ILE A 43 -5.307 -9.613 -35.304 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -4.750 -7.278 -35.584 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -5.000 -7.612 -33.882 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -4.597 -9.854 -32.958 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -3.930 -11.147 -33.983 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -2.894 -9.794 -33.471 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -3.067 -6.151 -34.213 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -2.559 -7.713 -33.528 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -2.305 -7.375 -35.256 1.00 0.00 H new ATOM 743 N ASN A 44 -2.655 -11.929 -36.050 1.00 0.00 N ATOM 744 CA ASN A 44 -2.710 -13.351 -36.368 1.00 0.00 C ATOM 745 C ASN A 44 -3.428 -14.127 -35.268 1.00 0.00 C ATOM 746 O ASN A 44 -3.293 -13.816 -34.084 1.00 0.00 O ATOM 747 CB ASN A 44 -1.298 -13.907 -36.561 1.00 0.00 C ATOM 748 CG ASN A 44 -0.912 -14.011 -38.024 1.00 0.00 C ATOM 749 OD1 ASN A 44 -1.622 -14.622 -38.823 1.00 0.00 O ATOM 750 ND2 ASN A 44 0.218 -13.412 -38.382 1.00 0.00 N ATOM 0 H ASN A 44 -1.921 -11.673 -35.390 1.00 0.00 H new ATOM 0 HA ASN A 44 -3.270 -13.469 -37.296 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -0.584 -13.265 -36.045 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -1.232 -14.892 -36.100 1.00 0.00 H new ATOM 0 HD21 ASN A 44 0.529 -13.447 -39.353 1.00 0.00 H new ATOM 0 HD22 ASN A 44 0.775 -12.917 -37.686 1.00 0.00 H new ATOM 757 N THR A 45 -4.192 -15.139 -35.667 1.00 0.00 N ATOM 758 CA THR A 45 -4.932 -15.959 -34.716 1.00 0.00 C ATOM 759 C THR A 45 -4.836 -17.437 -35.074 1.00 0.00 C ATOM 760 O THR A 45 -5.721 -18.226 -34.739 1.00 0.00 O ATOM 761 CB THR A 45 -6.417 -15.552 -34.659 1.00 0.00 C ATOM 762 OG1 THR A 45 -6.962 -15.499 -35.983 1.00 0.00 O ATOM 763 CG2 THR A 45 -6.581 -14.198 -33.984 1.00 0.00 C ATOM 0 H THR A 45 -4.314 -15.410 -36.643 1.00 0.00 H new ATOM 0 HA THR A 45 -4.480 -15.794 -33.738 1.00 0.00 H new ATOM 0 HB THR A 45 -6.954 -16.300 -34.075 1.00 0.00 H new ATOM 0 HG1 THR A 45 -7.906 -15.241 -35.938 1.00 0.00 H new ATOM 0 HG21 THR A 45 -7.637 -13.931 -33.955 1.00 0.00 H new ATOM 0 HG22 THR A 45 -6.192 -14.249 -32.967 1.00 0.00 H new ATOM 0 HG23 THR A 45 -6.031 -13.443 -34.546 1.00 0.00 H new ATOM 771 N ARG A 46 -3.757 -17.807 -35.756 1.00 0.00 N ATOM 772 CA ARG A 46 -3.546 -19.192 -36.159 1.00 0.00 C ATOM 773 C ARG A 46 -2.872 -19.987 -35.045 1.00 0.00 C ATOM 774 O ARG A 46 -3.424 -20.968 -34.545 1.00 0.00 O ATOM 775 CB ARG A 46 -2.695 -19.252 -37.429 1.00 0.00 C ATOM 776 CG ARG A 46 -2.666 -20.625 -38.079 1.00 0.00 C ATOM 777 CD ARG A 46 -1.596 -20.710 -39.156 1.00 0.00 C ATOM 778 NE ARG A 46 -1.116 -22.076 -39.346 1.00 0.00 N ATOM 779 CZ ARG A 46 -0.079 -22.391 -40.113 1.00 0.00 C ATOM 780 NH1 ARG A 46 0.584 -21.442 -40.760 1.00 0.00 N ATOM 781 NH2 ARG A 46 0.298 -23.657 -40.235 1.00 0.00 N ATOM 0 H ARG A 46 -3.016 -17.167 -36.041 1.00 0.00 H new ATOM 0 HA ARG A 46 -4.520 -19.637 -36.361 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -3.078 -18.527 -38.147 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -1.675 -18.952 -37.187 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -2.480 -21.384 -37.319 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -3.641 -20.843 -38.515 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -1.998 -20.333 -40.097 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -0.759 -20.066 -38.886 1.00 0.00 H new ATOM 0 HE ARG A 46 -1.604 -22.830 -38.863 1.00 0.00 H new ATOM 0 HH11 ARG A 46 0.298 -20.467 -40.669 1.00 0.00 H new ATOM 0 HH12 ARG A 46 1.380 -21.687 -41.349 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -0.209 -24.390 -39.739 1.00 0.00 H new ATOM 0 HH22 ARG A 46 1.095 -23.897 -40.825 1.00 0.00 H new ATOM 795 N LYS A 47 -1.676 -19.557 -34.659 1.00 0.00 N ATOM 796 CA LYS A 47 -0.926 -20.227 -33.603 1.00 0.00 C ATOM 797 C LYS A 47 -0.771 -19.320 -32.386 1.00 0.00 C ATOM 798 O LYS A 47 -0.867 -18.098 -32.495 1.00 0.00 O ATOM 799 CB LYS A 47 0.453 -20.648 -34.117 1.00 0.00 C ATOM 800 CG LYS A 47 1.437 -19.496 -34.232 1.00 0.00 C ATOM 801 CD LYS A 47 2.684 -19.903 -34.999 1.00 0.00 C ATOM 802 CE LYS A 47 3.769 -18.842 -34.902 1.00 0.00 C ATOM 803 NZ LYS A 47 5.055 -19.307 -35.491 1.00 0.00 N ATOM 0 H LYS A 47 -1.205 -18.747 -35.062 1.00 0.00 H new ATOM 0 HA LYS A 47 -1.483 -21.115 -33.304 1.00 0.00 H new ATOM 0 HB2 LYS A 47 0.866 -21.402 -33.448 1.00 0.00 H new ATOM 0 HB3 LYS A 47 0.340 -21.117 -35.094 1.00 0.00 H new ATOM 0 HG2 LYS A 47 0.958 -18.656 -34.734 1.00 0.00 H new ATOM 0 HG3 LYS A 47 1.717 -19.154 -33.235 1.00 0.00 H new ATOM 0 HD2 LYS A 47 3.061 -20.848 -34.607 1.00 0.00 H new ATOM 0 HD3 LYS A 47 2.430 -20.071 -36.046 1.00 0.00 H new ATOM 0 HE2 LYS A 47 3.440 -17.939 -35.416 1.00 0.00 H new ATOM 0 HE3 LYS A 47 3.924 -18.576 -33.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 5.768 -18.555 -35.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 5.382 -20.154 -34.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 4.914 -19.537 -36.495 1.00 0.00 H new ATOM 817 N ALA A 48 -0.530 -19.926 -31.228 1.00 0.00 N ATOM 818 CA ALA A 48 -0.358 -19.173 -29.993 1.00 0.00 C ATOM 819 C ALA A 48 1.084 -19.245 -29.501 1.00 0.00 C ATOM 820 O ALA A 48 1.799 -20.218 -29.742 1.00 0.00 O ATOM 821 CB ALA A 48 -1.309 -19.690 -28.923 1.00 0.00 C ATOM 0 H ALA A 48 -0.450 -20.937 -31.120 1.00 0.00 H new ATOM 0 HA ALA A 48 -0.592 -18.128 -30.198 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -1.170 -19.118 -28.005 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -2.338 -19.580 -29.266 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -1.102 -20.743 -28.730 1.00 0.00 H new ATOM 827 N PRO A 49 1.523 -18.191 -28.797 1.00 0.00 N ATOM 828 CA PRO A 49 0.681 -17.027 -28.506 1.00 0.00 C ATOM 829 C PRO A 49 0.388 -16.197 -29.751 1.00 0.00 C ATOM 830 O PRO A 49 1.028 -16.349 -30.792 1.00 0.00 O ATOM 831 CB PRO A 49 1.521 -16.221 -27.512 1.00 0.00 C ATOM 832 CG PRO A 49 2.929 -16.616 -27.799 1.00 0.00 C ATOM 833 CD PRO A 49 2.876 -18.055 -28.232 1.00 0.00 C ATOM 0 HA PRO A 49 -0.297 -17.318 -28.122 1.00 0.00 H new ATOM 0 HB2 PRO A 49 1.375 -15.149 -27.648 1.00 0.00 H new ATOM 0 HB3 PRO A 49 1.247 -16.452 -26.483 1.00 0.00 H new ATOM 0 HG2 PRO A 49 3.359 -15.989 -28.580 1.00 0.00 H new ATOM 0 HG3 PRO A 49 3.555 -16.497 -26.915 1.00 0.00 H new ATOM 0 HD2 PRO A 49 3.645 -18.281 -28.971 1.00 0.00 H new ATOM 0 HD3 PRO A 49 3.031 -18.733 -27.393 1.00 0.00 H new ATOM 841 N PRO A 50 -0.601 -15.298 -29.644 1.00 0.00 N ATOM 842 CA PRO A 50 -1.000 -14.425 -30.752 1.00 0.00 C ATOM 843 C PRO A 50 0.055 -13.371 -31.070 1.00 0.00 C ATOM 844 O PRO A 50 0.784 -12.921 -30.186 1.00 0.00 O ATOM 845 CB PRO A 50 -2.280 -13.761 -30.238 1.00 0.00 C ATOM 846 CG PRO A 50 -2.157 -13.800 -28.754 1.00 0.00 C ATOM 847 CD PRO A 50 -1.406 -15.063 -28.434 1.00 0.00 C ATOM 0 HA PRO A 50 -1.134 -14.981 -31.680 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -2.368 -12.737 -30.601 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -3.167 -14.297 -30.576 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -1.624 -12.924 -28.383 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -3.139 -13.799 -28.281 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -0.778 -14.944 -27.551 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -2.083 -15.893 -28.235 1.00 0.00 H new ATOM 855 N LYS A 51 0.133 -12.982 -32.338 1.00 0.00 N ATOM 856 CA LYS A 51 1.098 -11.980 -32.773 1.00 0.00 C ATOM 857 C LYS A 51 0.396 -10.692 -33.190 1.00 0.00 C ATOM 858 O LYS A 51 -0.831 -10.645 -33.284 1.00 0.00 O ATOM 859 CB LYS A 51 1.933 -12.518 -33.938 1.00 0.00 C ATOM 860 CG LYS A 51 2.400 -13.949 -33.741 1.00 0.00 C ATOM 861 CD LYS A 51 3.343 -14.070 -32.556 1.00 0.00 C ATOM 862 CE LYS A 51 4.158 -15.352 -32.620 1.00 0.00 C ATOM 863 NZ LYS A 51 5.271 -15.254 -33.605 1.00 0.00 N ATOM 0 H LYS A 51 -0.461 -13.346 -33.083 1.00 0.00 H new ATOM 0 HA LYS A 51 1.756 -11.758 -31.933 1.00 0.00 H new ATOM 0 HB2 LYS A 51 1.344 -12.460 -34.853 1.00 0.00 H new ATOM 0 HB3 LYS A 51 2.803 -11.877 -34.077 1.00 0.00 H new ATOM 0 HG2 LYS A 51 1.537 -14.596 -33.588 1.00 0.00 H new ATOM 0 HG3 LYS A 51 2.902 -14.296 -34.644 1.00 0.00 H new ATOM 0 HD2 LYS A 51 4.014 -13.212 -32.535 1.00 0.00 H new ATOM 0 HD3 LYS A 51 2.769 -14.048 -31.630 1.00 0.00 H new ATOM 0 HE2 LYS A 51 4.565 -15.573 -31.633 1.00 0.00 H new ATOM 0 HE3 LYS A 51 3.507 -16.183 -32.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 5.109 -15.928 -34.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 5.311 -14.288 -33.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 6.171 -15.478 -33.135 1.00 0.00 H new ATOM 877 N PHE A 52 1.180 -9.649 -33.439 1.00 0.00 N ATOM 878 CA PHE A 52 0.633 -8.360 -33.846 1.00 0.00 C ATOM 879 C PHE A 52 1.560 -7.664 -34.839 1.00 0.00 C ATOM 880 O PHE A 52 2.782 -7.705 -34.698 1.00 0.00 O ATOM 881 CB PHE A 52 0.414 -7.466 -32.624 1.00 0.00 C ATOM 882 CG PHE A 52 -0.138 -8.200 -31.435 1.00 0.00 C ATOM 883 CD1 PHE A 52 -1.477 -8.555 -31.383 1.00 0.00 C ATOM 884 CD2 PHE A 52 0.682 -8.537 -30.371 1.00 0.00 C ATOM 885 CE1 PHE A 52 -1.987 -9.230 -30.291 1.00 0.00 C ATOM 886 CE2 PHE A 52 0.178 -9.213 -29.275 1.00 0.00 C ATOM 887 CZ PHE A 52 -1.158 -9.560 -29.236 1.00 0.00 C ATOM 0 H PHE A 52 2.197 -9.671 -33.366 1.00 0.00 H new ATOM 0 HA PHE A 52 -0.325 -8.539 -34.334 1.00 0.00 H new ATOM 0 HB2 PHE A 52 1.362 -7.004 -32.348 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -0.268 -6.659 -32.892 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -2.129 -8.301 -32.206 1.00 0.00 H new ATOM 0 HD2 PHE A 52 1.728 -8.269 -30.398 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -3.032 -9.499 -30.262 1.00 0.00 H new ATOM 0 HE2 PHE A 52 0.828 -9.469 -28.451 1.00 0.00 H new ATOM 0 HZ PHE A 52 -1.554 -10.089 -28.382 1.00 0.00 H new ATOM 897 N TYR A 53 0.969 -7.027 -35.844 1.00 0.00 N ATOM 898 CA TYR A 53 1.740 -6.325 -36.863 1.00 0.00 C ATOM 899 C TYR A 53 1.950 -4.864 -36.477 1.00 0.00 C ATOM 900 O TYR A 53 1.010 -4.070 -36.470 1.00 0.00 O ATOM 901 CB TYR A 53 1.033 -6.410 -38.216 1.00 0.00 C ATOM 902 CG TYR A 53 1.958 -6.752 -39.362 1.00 0.00 C ATOM 903 CD1 TYR A 53 3.021 -5.921 -39.694 1.00 0.00 C ATOM 904 CD2 TYR A 53 1.769 -7.905 -40.114 1.00 0.00 C ATOM 905 CE1 TYR A 53 3.869 -6.228 -40.741 1.00 0.00 C ATOM 906 CE2 TYR A 53 2.612 -8.221 -41.161 1.00 0.00 C ATOM 907 CZ TYR A 53 3.660 -7.380 -41.471 1.00 0.00 C ATOM 908 OH TYR A 53 4.502 -7.691 -42.514 1.00 0.00 O ATOM 0 H TYR A 53 -0.042 -6.982 -35.975 1.00 0.00 H new ATOM 0 HA TYR A 53 2.715 -6.806 -36.940 1.00 0.00 H new ATOM 0 HB2 TYR A 53 0.246 -7.162 -38.159 1.00 0.00 H new ATOM 0 HB3 TYR A 53 0.548 -5.456 -38.424 1.00 0.00 H new ATOM 0 HD1 TYR A 53 3.187 -5.019 -39.124 1.00 0.00 H new ATOM 0 HD2 TYR A 53 0.949 -8.566 -39.875 1.00 0.00 H new ATOM 0 HE1 TYR A 53 4.690 -5.571 -40.986 1.00 0.00 H new ATOM 0 HE2 TYR A 53 2.451 -9.122 -41.734 1.00 0.00 H new ATOM 0 HH TYR A 53 4.218 -8.535 -42.923 1.00 0.00 H new ATOM 918 N VAL A 54 3.192 -4.516 -36.155 1.00 0.00 N ATOM 919 CA VAL A 54 3.529 -3.151 -35.770 1.00 0.00 C ATOM 920 C VAL A 54 3.871 -2.304 -36.990 1.00 0.00 C ATOM 921 O VAL A 54 4.471 -2.791 -37.949 1.00 0.00 O ATOM 922 CB VAL A 54 4.715 -3.121 -34.788 1.00 0.00 C ATOM 923 CG1 VAL A 54 4.328 -3.759 -33.463 1.00 0.00 C ATOM 924 CG2 VAL A 54 5.924 -3.819 -35.393 1.00 0.00 C ATOM 0 H VAL A 54 3.982 -5.161 -36.153 1.00 0.00 H new ATOM 0 HA VAL A 54 2.650 -2.735 -35.278 1.00 0.00 H new ATOM 0 HB VAL A 54 4.981 -2.081 -34.598 1.00 0.00 H new ATOM 0 HG11 VAL A 54 5.179 -3.728 -32.782 1.00 0.00 H new ATOM 0 HG12 VAL A 54 3.493 -3.211 -33.025 1.00 0.00 H new ATOM 0 HG13 VAL A 54 4.034 -4.795 -33.630 1.00 0.00 H new ATOM 0 HG21 VAL A 54 6.753 -3.789 -34.686 1.00 0.00 H new ATOM 0 HG22 VAL A 54 5.673 -4.856 -35.613 1.00 0.00 H new ATOM 0 HG23 VAL A 54 6.214 -3.312 -36.314 1.00 0.00 H new ATOM 934 N HIS A 55 3.487 -1.032 -36.948 1.00 0.00 N ATOM 935 CA HIS A 55 3.755 -0.115 -38.050 1.00 0.00 C ATOM 936 C HIS A 55 4.243 1.233 -37.529 1.00 0.00 C ATOM 937 O HIS A 55 3.880 1.654 -36.430 1.00 0.00 O ATOM 938 CB HIS A 55 2.497 0.077 -38.898 1.00 0.00 C ATOM 939 CG HIS A 55 2.673 1.058 -40.016 1.00 0.00 C ATOM 940 ND1 HIS A 55 2.970 0.681 -41.309 1.00 0.00 N ATOM 941 CD2 HIS A 55 2.590 2.409 -40.030 1.00 0.00 C ATOM 942 CE1 HIS A 55 3.064 1.757 -42.069 1.00 0.00 C ATOM 943 NE2 HIS A 55 2.837 2.819 -41.317 1.00 0.00 N ATOM 0 H HIS A 55 2.989 -0.613 -36.163 1.00 0.00 H new ATOM 0 HA HIS A 55 4.539 -0.550 -38.670 1.00 0.00 H new ATOM 0 HB2 HIS A 55 2.198 -0.885 -39.314 1.00 0.00 H new ATOM 0 HB3 HIS A 55 1.683 0.413 -38.255 1.00 0.00 H new ATOM 0 HD2 HIS A 55 2.370 3.046 -39.186 1.00 0.00 H new ATOM 0 HE1 HIS A 55 3.288 1.767 -43.125 1.00 0.00 H new ATOM 0 HE2 HIS A 55 2.844 3.787 -41.640 1.00 0.00 H new ATOM 951 N TYR A 56 5.067 1.906 -38.325 1.00 0.00 N ATOM 952 CA TYR A 56 5.607 3.206 -37.942 1.00 0.00 C ATOM 953 C TYR A 56 4.835 4.336 -38.617 1.00 0.00 C ATOM 954 O TYR A 56 4.765 4.410 -39.843 1.00 0.00 O ATOM 955 CB TYR A 56 7.089 3.294 -38.311 1.00 0.00 C ATOM 956 CG TYR A 56 7.881 4.221 -37.417 1.00 0.00 C ATOM 957 CD1 TYR A 56 7.854 4.076 -36.035 1.00 0.00 C ATOM 958 CD2 TYR A 56 8.656 5.241 -37.954 1.00 0.00 C ATOM 959 CE1 TYR A 56 8.576 4.921 -35.215 1.00 0.00 C ATOM 960 CE2 TYR A 56 9.382 6.090 -37.141 1.00 0.00 C ATOM 961 CZ TYR A 56 9.338 5.927 -35.772 1.00 0.00 C ATOM 962 OH TYR A 56 10.060 6.770 -34.958 1.00 0.00 O ATOM 0 H TYR A 56 5.375 1.573 -39.239 1.00 0.00 H new ATOM 0 HA TYR A 56 5.501 3.312 -36.862 1.00 0.00 H new ATOM 0 HB2 TYR A 56 7.526 2.297 -38.265 1.00 0.00 H new ATOM 0 HB3 TYR A 56 7.178 3.634 -39.343 1.00 0.00 H new ATOM 0 HD1 TYR A 56 7.259 3.290 -35.595 1.00 0.00 H new ATOM 0 HD2 TYR A 56 8.692 5.373 -39.025 1.00 0.00 H new ATOM 0 HE1 TYR A 56 8.544 4.795 -34.143 1.00 0.00 H new ATOM 0 HE2 TYR A 56 9.981 6.877 -37.575 1.00 0.00 H new ATOM 0 HH TYR A 56 10.543 7.422 -35.508 1.00 0.00 H new ATOM 972 N VAL A 57 4.257 5.216 -37.805 1.00 0.00 N ATOM 973 CA VAL A 57 3.492 6.344 -38.321 1.00 0.00 C ATOM 974 C VAL A 57 4.336 7.198 -39.260 1.00 0.00 C ATOM 975 O VAL A 57 3.814 7.842 -40.168 1.00 0.00 O ATOM 976 CB VAL A 57 2.959 7.230 -37.179 1.00 0.00 C ATOM 977 CG1 VAL A 57 1.803 6.546 -36.466 1.00 0.00 C ATOM 978 CG2 VAL A 57 4.075 7.566 -36.201 1.00 0.00 C ATOM 0 H VAL A 57 4.304 5.169 -36.787 1.00 0.00 H new ATOM 0 HA VAL A 57 2.649 5.928 -38.873 1.00 0.00 H new ATOM 0 HB VAL A 57 2.589 8.161 -37.608 1.00 0.00 H new ATOM 0 HG11 VAL A 57 1.440 7.187 -35.663 1.00 0.00 H new ATOM 0 HG12 VAL A 57 0.996 6.361 -37.175 1.00 0.00 H new ATOM 0 HG13 VAL A 57 2.143 5.598 -36.048 1.00 0.00 H new ATOM 0 HG21 VAL A 57 3.681 8.192 -35.401 1.00 0.00 H new ATOM 0 HG22 VAL A 57 4.477 6.646 -35.777 1.00 0.00 H new ATOM 0 HG23 VAL A 57 4.868 8.101 -36.724 1.00 0.00 H new ATOM 988 N ASN A 58 5.646 7.196 -39.035 1.00 0.00 N ATOM 989 CA ASN A 58 6.565 7.971 -39.861 1.00 0.00 C ATOM 990 C ASN A 58 6.899 7.224 -41.149 1.00 0.00 C ATOM 991 O ASN A 58 6.416 6.116 -41.380 1.00 0.00 O ATOM 992 CB ASN A 58 7.848 8.275 -39.087 1.00 0.00 C ATOM 993 CG ASN A 58 8.465 9.602 -39.486 1.00 0.00 C ATOM 994 OD1 ASN A 58 7.776 10.619 -39.567 1.00 0.00 O ATOM 995 ND2 ASN A 58 9.768 9.596 -39.739 1.00 0.00 N ATOM 0 H ASN A 58 6.095 6.666 -38.288 1.00 0.00 H new ATOM 0 HA ASN A 58 6.076 8.910 -40.122 1.00 0.00 H new ATOM 0 HB2 ASN A 58 7.631 8.285 -38.019 1.00 0.00 H new ATOM 0 HB3 ASN A 58 8.570 7.476 -39.258 1.00 0.00 H new ATOM 0 HD21 ASN A 58 10.238 10.459 -40.013 1.00 0.00 H new ATOM 0 HD22 ASN A 58 10.299 8.729 -39.659 1.00 0.00 H new ATOM 1002 N TYR A 59 7.730 7.839 -41.984 1.00 0.00 N ATOM 1003 CA TYR A 59 8.128 7.234 -43.249 1.00 0.00 C ATOM 1004 C TYR A 59 9.262 6.234 -43.042 1.00 0.00 C ATOM 1005 O TYR A 59 10.435 6.566 -43.208 1.00 0.00 O ATOM 1006 CB TYR A 59 8.561 8.314 -44.242 1.00 0.00 C ATOM 1007 CG TYR A 59 8.442 7.891 -45.688 1.00 0.00 C ATOM 1008 CD1 TYR A 59 7.216 7.516 -46.224 1.00 0.00 C ATOM 1009 CD2 TYR A 59 9.555 7.865 -46.519 1.00 0.00 C ATOM 1010 CE1 TYR A 59 7.102 7.128 -47.545 1.00 0.00 C ATOM 1011 CE2 TYR A 59 9.450 7.479 -47.842 1.00 0.00 C ATOM 1012 CZ TYR A 59 8.221 7.112 -48.350 1.00 0.00 C ATOM 1013 OH TYR A 59 8.113 6.726 -49.666 1.00 0.00 O ATOM 0 H TYR A 59 8.141 8.756 -41.807 1.00 0.00 H new ATOM 0 HA TYR A 59 7.267 6.702 -43.654 1.00 0.00 H new ATOM 0 HB2 TYR A 59 7.955 9.206 -44.082 1.00 0.00 H new ATOM 0 HB3 TYR A 59 9.595 8.590 -44.037 1.00 0.00 H new ATOM 0 HD1 TYR A 59 6.337 7.528 -45.597 1.00 0.00 H new ATOM 0 HD2 TYR A 59 10.519 8.151 -46.125 1.00 0.00 H new ATOM 0 HE1 TYR A 59 6.141 6.839 -47.945 1.00 0.00 H new ATOM 0 HE2 TYR A 59 10.325 7.465 -48.475 1.00 0.00 H new ATOM 0 HH TYR A 59 8.994 6.772 -50.094 1.00 0.00 H new ATOM 1023 N ASN A 60 8.901 5.007 -42.679 1.00 0.00 N ATOM 1024 CA ASN A 60 9.887 3.957 -42.449 1.00 0.00 C ATOM 1025 C ASN A 60 9.224 2.584 -42.429 1.00 0.00 C ATOM 1026 O ASN A 60 8.512 2.239 -41.486 1.00 0.00 O ATOM 1027 CB ASN A 60 10.622 4.200 -41.129 1.00 0.00 C ATOM 1028 CG ASN A 60 11.852 5.071 -41.304 1.00 0.00 C ATOM 1029 OD1 ASN A 60 12.771 4.724 -42.045 1.00 0.00 O ATOM 1030 ND2 ASN A 60 11.872 6.209 -40.621 1.00 0.00 N ATOM 0 H ASN A 60 7.934 4.716 -42.538 1.00 0.00 H new ATOM 0 HA ASN A 60 10.606 3.982 -43.268 1.00 0.00 H new ATOM 0 HB2 ASN A 60 9.943 4.673 -40.420 1.00 0.00 H new ATOM 0 HB3 ASN A 60 10.916 3.243 -40.698 1.00 0.00 H new ATOM 0 HD21 ASN A 60 12.672 6.837 -40.699 1.00 0.00 H new ATOM 0 HD22 ASN A 60 11.087 6.456 -40.018 1.00 0.00 H new ATOM 1037 N LYS A 61 9.463 1.802 -43.477 1.00 0.00 N ATOM 1038 CA LYS A 61 8.892 0.465 -43.581 1.00 0.00 C ATOM 1039 C LYS A 61 9.775 -0.560 -42.876 1.00 0.00 C ATOM 1040 O LYS A 61 9.296 -1.604 -42.431 1.00 0.00 O ATOM 1041 CB LYS A 61 8.715 0.076 -45.051 1.00 0.00 C ATOM 1042 CG LYS A 61 7.399 0.542 -45.649 1.00 0.00 C ATOM 1043 CD LYS A 61 7.502 1.959 -46.188 1.00 0.00 C ATOM 1044 CE LYS A 61 6.216 2.388 -46.877 1.00 0.00 C ATOM 1045 NZ LYS A 61 5.792 1.410 -47.917 1.00 0.00 N ATOM 0 H LYS A 61 10.049 2.072 -44.267 1.00 0.00 H new ATOM 0 HA LYS A 61 7.917 0.475 -43.094 1.00 0.00 H new ATOM 0 HB2 LYS A 61 9.537 0.496 -45.631 1.00 0.00 H new ATOM 0 HB3 LYS A 61 8.782 -1.008 -45.142 1.00 0.00 H new ATOM 0 HG2 LYS A 61 7.104 -0.133 -46.452 1.00 0.00 H new ATOM 0 HG3 LYS A 61 6.617 0.496 -44.891 1.00 0.00 H new ATOM 0 HD2 LYS A 61 7.724 2.645 -45.371 1.00 0.00 H new ATOM 0 HD3 LYS A 61 8.332 2.022 -46.892 1.00 0.00 H new ATOM 0 HE2 LYS A 61 5.425 2.495 -46.135 1.00 0.00 H new ATOM 0 HE3 LYS A 61 6.358 3.367 -47.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 5.099 1.856 -48.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 6.621 1.108 -48.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 5.360 0.582 -47.459 1.00 0.00 H new ATOM 1059 N ARG A 62 11.064 -0.256 -42.777 1.00 0.00 N ATOM 1060 CA ARG A 62 12.013 -1.151 -42.125 1.00 0.00 C ATOM 1061 C ARG A 62 11.531 -1.530 -40.728 1.00 0.00 C ATOM 1062 O ARG A 62 11.820 -2.621 -40.235 1.00 0.00 O ATOM 1063 CB ARG A 62 13.391 -0.492 -42.040 1.00 0.00 C ATOM 1064 CG ARG A 62 13.449 0.676 -41.069 1.00 0.00 C ATOM 1065 CD ARG A 62 14.725 1.485 -41.246 1.00 0.00 C ATOM 1066 NE ARG A 62 14.808 2.591 -40.296 1.00 0.00 N ATOM 1067 CZ ARG A 62 15.198 2.448 -39.034 1.00 0.00 C ATOM 1068 NH1 ARG A 62 15.540 1.252 -38.573 1.00 0.00 N ATOM 1069 NH2 ARG A 62 15.247 3.503 -38.230 1.00 0.00 N ATOM 0 H ARG A 62 11.476 0.604 -43.140 1.00 0.00 H new ATOM 0 HA ARG A 62 12.088 -2.059 -42.723 1.00 0.00 H new ATOM 0 HB2 ARG A 62 14.124 -1.240 -41.739 1.00 0.00 H new ATOM 0 HB3 ARG A 62 13.680 -0.144 -43.032 1.00 0.00 H new ATOM 0 HG2 ARG A 62 12.584 1.321 -41.222 1.00 0.00 H new ATOM 0 HG3 ARG A 62 13.392 0.303 -40.046 1.00 0.00 H new ATOM 0 HD2 ARG A 62 15.589 0.832 -41.119 1.00 0.00 H new ATOM 0 HD3 ARG A 62 14.768 1.876 -42.262 1.00 0.00 H new ATOM 0 HE ARG A 62 14.553 3.524 -40.619 1.00 0.00 H new ATOM 0 HH11 ARG A 62 15.504 0.439 -39.188 1.00 0.00 H new ATOM 0 HH12 ARG A 62 15.839 1.145 -37.604 1.00 0.00 H new ATOM 0 HH21 ARG A 62 14.985 4.424 -38.581 1.00 0.00 H new ATOM 0 HH22 ARG A 62 15.546 3.392 -37.261 1.00 0.00 H new ATOM 1083 N LEU A 63 10.795 -0.623 -40.095 1.00 0.00 N ATOM 1084 CA LEU A 63 10.273 -0.862 -38.754 1.00 0.00 C ATOM 1085 C LEU A 63 8.901 -1.526 -38.814 1.00 0.00 C ATOM 1086 O LEU A 63 8.522 -2.273 -37.912 1.00 0.00 O ATOM 1087 CB LEU A 63 10.182 0.454 -37.979 1.00 0.00 C ATOM 1088 CG LEU A 63 10.372 0.355 -36.465 1.00 0.00 C ATOM 1089 CD1 LEU A 63 11.802 -0.043 -36.132 1.00 0.00 C ATOM 1090 CD2 LEU A 63 10.014 1.674 -35.796 1.00 0.00 C ATOM 0 H LEU A 63 10.546 0.284 -40.489 1.00 0.00 H new ATOM 0 HA LEU A 63 10.959 -1.534 -38.238 1.00 0.00 H new ATOM 0 HB2 LEU A 63 10.932 1.139 -38.375 1.00 0.00 H new ATOM 0 HB3 LEU A 63 9.207 0.901 -38.174 1.00 0.00 H new ATOM 0 HG LEU A 63 9.703 -0.417 -36.083 1.00 0.00 H new ATOM 0 HD11 LEU A 63 11.919 -0.109 -35.050 1.00 0.00 H new ATOM 0 HD12 LEU A 63 12.024 -1.011 -36.580 1.00 0.00 H new ATOM 0 HD13 LEU A 63 12.489 0.705 -36.526 1.00 0.00 H new ATOM 0 HD21 LEU A 63 10.155 1.586 -34.719 1.00 0.00 H new ATOM 0 HD22 LEU A 63 10.657 2.464 -36.183 1.00 0.00 H new ATOM 0 HD23 LEU A 63 8.973 1.918 -36.007 1.00 0.00 H new ATOM 1102 N ASP A 64 8.163 -1.250 -39.884 1.00 0.00 N ATOM 1103 CA ASP A 64 6.834 -1.824 -40.064 1.00 0.00 C ATOM 1104 C ASP A 64 6.919 -3.328 -40.302 1.00 0.00 C ATOM 1105 O ASP A 64 6.995 -3.781 -41.443 1.00 0.00 O ATOM 1106 CB ASP A 64 6.119 -1.149 -41.235 1.00 0.00 C ATOM 1107 CG ASP A 64 4.889 -1.915 -41.681 1.00 0.00 C ATOM 1108 OD1 ASP A 64 3.924 -1.999 -40.892 1.00 0.00 O ATOM 1109 OD2 ASP A 64 4.890 -2.428 -42.819 1.00 0.00 O ATOM 0 H ASP A 64 8.462 -0.633 -40.639 1.00 0.00 H new ATOM 0 HA ASP A 64 6.264 -1.651 -39.151 1.00 0.00 H new ATOM 0 HB2 ASP A 64 5.829 -0.139 -40.946 1.00 0.00 H new ATOM 0 HB3 ASP A 64 6.809 -1.056 -42.073 1.00 0.00 H new ATOM 1114 N GLU A 65 6.906 -4.096 -39.217 1.00 0.00 N ATOM 1115 CA GLU A 65 6.984 -5.549 -39.309 1.00 0.00 C ATOM 1116 C GLU A 65 6.037 -6.209 -38.311 1.00 0.00 C ATOM 1117 O GLU A 65 5.260 -5.533 -37.636 1.00 0.00 O ATOM 1118 CB GLU A 65 8.417 -6.022 -39.058 1.00 0.00 C ATOM 1119 CG GLU A 65 8.882 -5.821 -37.625 1.00 0.00 C ATOM 1120 CD GLU A 65 10.391 -5.718 -37.511 1.00 0.00 C ATOM 1121 OE1 GLU A 65 11.061 -6.771 -37.520 1.00 0.00 O ATOM 1122 OE2 GLU A 65 10.901 -4.582 -37.412 1.00 0.00 O ATOM 0 H GLU A 65 6.842 -3.736 -38.265 1.00 0.00 H new ATOM 0 HA GLU A 65 6.684 -5.840 -40.316 1.00 0.00 H new ATOM 0 HB2 GLU A 65 8.491 -7.080 -39.310 1.00 0.00 H new ATOM 0 HB3 GLU A 65 9.090 -5.487 -39.728 1.00 0.00 H new ATOM 0 HG2 GLU A 65 8.428 -4.915 -37.223 1.00 0.00 H new ATOM 0 HG3 GLU A 65 8.531 -6.652 -37.013 1.00 0.00 H new ATOM 1129 N TRP A 66 6.107 -7.532 -38.224 1.00 0.00 N ATOM 1130 CA TRP A 66 5.255 -8.284 -37.309 1.00 0.00 C ATOM 1131 C TRP A 66 6.074 -8.882 -36.171 1.00 0.00 C ATOM 1132 O TRP A 66 7.144 -9.448 -36.395 1.00 0.00 O ATOM 1133 CB TRP A 66 4.519 -9.394 -38.061 1.00 0.00 C ATOM 1134 CG TRP A 66 5.413 -10.520 -38.484 1.00 0.00 C ATOM 1135 CD1 TRP A 66 6.420 -10.465 -39.405 1.00 0.00 C ATOM 1136 CD2 TRP A 66 5.380 -11.868 -38.003 1.00 0.00 C ATOM 1137 NE1 TRP A 66 7.014 -11.698 -39.526 1.00 0.00 N ATOM 1138 CE2 TRP A 66 6.395 -12.575 -38.676 1.00 0.00 C ATOM 1139 CE3 TRP A 66 4.593 -12.545 -37.068 1.00 0.00 C ATOM 1140 CZ2 TRP A 66 6.641 -13.926 -38.442 1.00 0.00 C ATOM 1141 CZ3 TRP A 66 4.837 -13.886 -36.838 1.00 0.00 C ATOM 1142 CH2 TRP A 66 5.855 -14.564 -37.522 1.00 0.00 C ATOM 0 H TRP A 66 6.744 -8.107 -38.775 1.00 0.00 H new ATOM 0 HA TRP A 66 4.524 -7.596 -36.884 1.00 0.00 H new ATOM 0 HB2 TRP A 66 3.726 -9.789 -37.426 1.00 0.00 H new ATOM 0 HB3 TRP A 66 4.040 -8.969 -38.943 1.00 0.00 H new ATOM 0 HD1 TRP A 66 6.707 -9.582 -39.957 1.00 0.00 H new ATOM 0 HE1 TRP A 66 7.790 -11.923 -40.148 1.00 0.00 H new ATOM 0 HE3 TRP A 66 3.808 -12.030 -36.534 1.00 0.00 H new ATOM 0 HZ2 TRP A 66 7.424 -14.451 -38.968 1.00 0.00 H new ATOM 0 HZ3 TRP A 66 4.233 -14.420 -36.119 1.00 0.00 H new ATOM 0 HH2 TRP A 66 6.022 -15.611 -37.319 1.00 0.00 H new ATOM 1153 N ILE A 67 5.566 -8.752 -34.950 1.00 0.00 N ATOM 1154 CA ILE A 67 6.251 -9.281 -33.777 1.00 0.00 C ATOM 1155 C ILE A 67 5.288 -10.049 -32.879 1.00 0.00 C ATOM 1156 O ILE A 67 4.104 -10.184 -33.189 1.00 0.00 O ATOM 1157 CB ILE A 67 6.914 -8.158 -32.958 1.00 0.00 C ATOM 1158 CG1 ILE A 67 5.923 -7.016 -32.721 1.00 0.00 C ATOM 1159 CG2 ILE A 67 8.158 -7.647 -33.670 1.00 0.00 C ATOM 1160 CD1 ILE A 67 6.432 -5.964 -31.761 1.00 0.00 C ATOM 0 H ILE A 67 4.682 -8.285 -34.747 1.00 0.00 H new ATOM 0 HA ILE A 67 7.024 -9.958 -34.141 1.00 0.00 H new ATOM 0 HB ILE A 67 7.212 -8.562 -31.991 1.00 0.00 H new ATOM 0 HG12 ILE A 67 5.691 -6.543 -33.675 1.00 0.00 H new ATOM 0 HG13 ILE A 67 4.991 -7.429 -32.334 1.00 0.00 H new ATOM 0 HG21 ILE A 67 8.615 -6.854 -33.079 1.00 0.00 H new ATOM 0 HG22 ILE A 67 8.869 -8.464 -33.792 1.00 0.00 H new ATOM 0 HG23 ILE A 67 7.882 -7.257 -34.650 1.00 0.00 H new ATOM 0 HD11 ILE A 67 5.678 -5.186 -31.641 1.00 0.00 H new ATOM 0 HD12 ILE A 67 6.638 -6.423 -30.794 1.00 0.00 H new ATOM 0 HD13 ILE A 67 7.348 -5.524 -32.156 1.00 0.00 H new ATOM 1172 N THR A 68 5.803 -10.552 -31.761 1.00 0.00 N ATOM 1173 CA THR A 68 4.990 -11.307 -30.816 1.00 0.00 C ATOM 1174 C THR A 68 4.566 -10.437 -29.638 1.00 0.00 C ATOM 1175 O THR A 68 4.781 -9.224 -29.638 1.00 0.00 O ATOM 1176 CB THR A 68 5.745 -12.539 -30.284 1.00 0.00 C ATOM 1177 OG1 THR A 68 6.753 -12.131 -29.352 1.00 0.00 O ATOM 1178 CG2 THR A 68 6.387 -13.315 -31.424 1.00 0.00 C ATOM 0 H THR A 68 6.780 -10.450 -31.488 1.00 0.00 H new ATOM 0 HA THR A 68 4.104 -11.639 -31.357 1.00 0.00 H new ATOM 0 HB THR A 68 5.027 -13.188 -29.782 1.00 0.00 H new ATOM 0 HG1 THR A 68 7.227 -12.920 -29.017 1.00 0.00 H new ATOM 0 HG21 THR A 68 6.914 -14.181 -31.023 1.00 0.00 H new ATOM 0 HG22 THR A 68 5.615 -13.649 -32.117 1.00 0.00 H new ATOM 0 HG23 THR A 68 7.092 -12.672 -31.950 1.00 0.00 H new ATOM 1186 N THR A 69 3.962 -11.063 -28.633 1.00 0.00 N ATOM 1187 CA THR A 69 3.507 -10.346 -27.448 1.00 0.00 C ATOM 1188 C THR A 69 4.655 -10.114 -26.472 1.00 0.00 C ATOM 1189 O THR A 69 4.530 -9.335 -25.527 1.00 0.00 O ATOM 1190 CB THR A 69 2.381 -11.110 -26.727 1.00 0.00 C ATOM 1191 OG1 THR A 69 1.795 -10.280 -25.718 1.00 0.00 O ATOM 1192 CG2 THR A 69 2.912 -12.387 -26.095 1.00 0.00 C ATOM 0 H THR A 69 3.776 -12.066 -28.616 1.00 0.00 H new ATOM 0 HA THR A 69 3.123 -9.384 -27.788 1.00 0.00 H new ATOM 0 HB THR A 69 1.623 -11.376 -27.464 1.00 0.00 H new ATOM 0 HG1 THR A 69 2.253 -9.414 -25.700 1.00 0.00 H new ATOM 0 HG21 THR A 69 2.098 -12.909 -25.592 1.00 0.00 H new ATOM 0 HG22 THR A 69 3.331 -13.029 -26.870 1.00 0.00 H new ATOM 0 HG23 THR A 69 3.687 -12.139 -25.370 1.00 0.00 H new ATOM 1200 N ASP A 70 5.771 -10.795 -26.706 1.00 0.00 N ATOM 1201 CA ASP A 70 6.942 -10.662 -25.847 1.00 0.00 C ATOM 1202 C ASP A 70 7.377 -9.203 -25.744 1.00 0.00 C ATOM 1203 O ASP A 70 8.004 -8.800 -24.764 1.00 0.00 O ATOM 1204 CB ASP A 70 8.094 -11.514 -26.383 1.00 0.00 C ATOM 1205 CG ASP A 70 9.135 -11.813 -25.323 1.00 0.00 C ATOM 1206 OD1 ASP A 70 8.805 -11.713 -24.123 1.00 0.00 O ATOM 1207 OD2 ASP A 70 10.281 -12.146 -25.693 1.00 0.00 O ATOM 0 H ASP A 70 5.890 -11.445 -27.483 1.00 0.00 H new ATOM 0 HA ASP A 70 6.673 -11.014 -24.851 1.00 0.00 H new ATOM 0 HB2 ASP A 70 7.698 -12.451 -26.773 1.00 0.00 H new ATOM 0 HB3 ASP A 70 8.567 -10.996 -27.217 1.00 0.00 H new ATOM 1212 N ARG A 71 7.042 -8.417 -26.762 1.00 0.00 N ATOM 1213 CA ARG A 71 7.400 -7.004 -26.786 1.00 0.00 C ATOM 1214 C ARG A 71 6.161 -6.127 -26.627 1.00 0.00 C ATOM 1215 O ARG A 71 6.253 -4.982 -26.182 1.00 0.00 O ATOM 1216 CB ARG A 71 8.117 -6.661 -28.093 1.00 0.00 C ATOM 1217 CG ARG A 71 9.314 -7.550 -28.383 1.00 0.00 C ATOM 1218 CD ARG A 71 10.523 -7.145 -27.555 1.00 0.00 C ATOM 1219 NE ARG A 71 10.473 -7.700 -26.205 1.00 0.00 N ATOM 1220 CZ ARG A 71 10.834 -8.944 -25.908 1.00 0.00 C ATOM 1221 NH1 ARG A 71 11.270 -9.756 -26.861 1.00 0.00 N ATOM 1222 NH2 ARG A 71 10.760 -9.376 -24.656 1.00 0.00 N ATOM 0 H ARG A 71 6.523 -8.735 -27.581 1.00 0.00 H new ATOM 0 HA ARG A 71 8.071 -6.810 -25.949 1.00 0.00 H new ATOM 0 HB2 ARG A 71 7.408 -6.740 -28.918 1.00 0.00 H new ATOM 0 HB3 ARG A 71 8.447 -5.623 -28.055 1.00 0.00 H new ATOM 0 HG2 ARG A 71 9.058 -8.588 -28.171 1.00 0.00 H new ATOM 0 HG3 ARG A 71 9.562 -7.493 -29.443 1.00 0.00 H new ATOM 0 HD2 ARG A 71 11.432 -7.483 -28.052 1.00 0.00 H new ATOM 0 HD3 ARG A 71 10.576 -6.058 -27.498 1.00 0.00 H new ATOM 0 HE ARG A 71 10.143 -7.100 -25.449 1.00 0.00 H new ATOM 0 HH11 ARG A 71 11.329 -9.426 -27.824 1.00 0.00 H new ATOM 0 HH12 ARG A 71 11.547 -10.710 -26.631 1.00 0.00 H new ATOM 0 HH21 ARG A 71 10.426 -8.753 -23.921 1.00 0.00 H new ATOM 0 HH22 ARG A 71 11.037 -10.331 -24.429 1.00 0.00 H new ATOM 1236 N ILE A 72 5.006 -6.671 -26.994 1.00 0.00 N ATOM 1237 CA ILE A 72 3.750 -5.938 -26.891 1.00 0.00 C ATOM 1238 C ILE A 72 2.929 -6.419 -25.699 1.00 0.00 C ATOM 1239 O ILE A 72 2.605 -7.600 -25.592 1.00 0.00 O ATOM 1240 CB ILE A 72 2.908 -6.082 -28.172 1.00 0.00 C ATOM 1241 CG1 ILE A 72 3.681 -5.549 -29.380 1.00 0.00 C ATOM 1242 CG2 ILE A 72 1.583 -5.350 -28.019 1.00 0.00 C ATOM 1243 CD1 ILE A 72 3.266 -6.181 -30.690 1.00 0.00 C ATOM 0 H ILE A 72 4.914 -7.617 -27.365 1.00 0.00 H new ATOM 0 HA ILE A 72 4.008 -4.888 -26.752 1.00 0.00 H new ATOM 0 HB ILE A 72 2.700 -7.139 -28.336 1.00 0.00 H new ATOM 0 HG12 ILE A 72 3.538 -4.470 -29.445 1.00 0.00 H new ATOM 0 HG13 ILE A 72 4.746 -5.721 -29.224 1.00 0.00 H new ATOM 0 HG21 ILE A 72 0.999 -5.461 -28.932 1.00 0.00 H new ATOM 0 HG22 ILE A 72 1.029 -5.772 -27.180 1.00 0.00 H new ATOM 0 HG23 ILE A 72 1.771 -4.292 -27.834 1.00 0.00 H new ATOM 0 HD11 ILE A 72 3.855 -5.755 -31.502 1.00 0.00 H new ATOM 0 HD12 ILE A 72 3.435 -7.257 -30.644 1.00 0.00 H new ATOM 0 HD13 ILE A 72 2.208 -5.987 -30.869 1.00 0.00 H new ATOM 1255 N ASN A 73 2.595 -5.493 -24.806 1.00 0.00 N ATOM 1256 CA ASN A 73 1.810 -5.822 -23.621 1.00 0.00 C ATOM 1257 C ASN A 73 0.506 -5.030 -23.596 1.00 0.00 C ATOM 1258 O ASN A 73 0.509 -3.804 -23.714 1.00 0.00 O ATOM 1259 CB ASN A 73 2.618 -5.537 -22.353 1.00 0.00 C ATOM 1260 CG ASN A 73 2.107 -6.313 -21.155 1.00 0.00 C ATOM 1261 OD1 ASN A 73 2.738 -7.270 -20.706 1.00 0.00 O ATOM 1262 ND2 ASN A 73 0.957 -5.904 -20.632 1.00 0.00 N ATOM 0 H ASN A 73 2.855 -4.510 -24.880 1.00 0.00 H new ATOM 0 HA ASN A 73 1.569 -6.884 -23.658 1.00 0.00 H new ATOM 0 HB2 ASN A 73 3.664 -5.790 -22.527 1.00 0.00 H new ATOM 0 HB3 ASN A 73 2.581 -4.470 -22.134 1.00 0.00 H new ATOM 0 HD21 ASN A 73 0.563 -6.388 -19.825 1.00 0.00 H new ATOM 0 HD22 ASN A 73 0.468 -5.106 -21.037 1.00 0.00 H new ATOM 1269 N LEU A 74 -0.606 -5.739 -23.440 1.00 0.00 N ATOM 1270 CA LEU A 74 -1.919 -5.103 -23.399 1.00 0.00 C ATOM 1271 C LEU A 74 -1.942 -3.969 -22.379 1.00 0.00 C ATOM 1272 O LEU A 74 -1.282 -4.039 -21.342 1.00 0.00 O ATOM 1273 CB LEU A 74 -2.996 -6.134 -23.057 1.00 0.00 C ATOM 1274 CG LEU A 74 -3.654 -6.837 -24.245 1.00 0.00 C ATOM 1275 CD1 LEU A 74 -4.590 -5.887 -24.975 1.00 0.00 C ATOM 1276 CD2 LEU A 74 -2.597 -7.382 -25.194 1.00 0.00 C ATOM 0 H LEU A 74 -0.626 -6.754 -23.340 1.00 0.00 H new ATOM 0 HA LEU A 74 -2.125 -4.685 -24.384 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -2.553 -6.892 -22.412 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -3.775 -5.638 -22.477 1.00 0.00 H new ATOM 0 HG LEU A 74 -4.241 -7.674 -23.868 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -5.049 -6.404 -25.817 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -5.367 -5.545 -24.292 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -4.025 -5.029 -25.340 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -3.083 -7.879 -26.033 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -1.983 -6.561 -25.564 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -1.967 -8.097 -24.665 1.00 0.00 H new ATOM 1288 N ASP A 75 -2.708 -2.926 -22.679 1.00 0.00 N ATOM 1289 CA ASP A 75 -2.821 -1.778 -21.788 1.00 0.00 C ATOM 1290 C ASP A 75 -4.104 -1.852 -20.965 1.00 0.00 C ATOM 1291 O ASP A 75 -4.072 -2.147 -19.770 1.00 0.00 O ATOM 1292 CB ASP A 75 -2.790 -0.477 -22.591 1.00 0.00 C ATOM 1293 CG ASP A 75 -3.254 0.716 -21.778 1.00 0.00 C ATOM 1294 OD1 ASP A 75 -2.977 0.749 -20.561 1.00 0.00 O ATOM 1295 OD2 ASP A 75 -3.896 1.617 -22.359 1.00 0.00 O ATOM 0 H ASP A 75 -3.260 -2.852 -23.533 1.00 0.00 H new ATOM 0 HA ASP A 75 -1.972 -1.795 -21.105 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -1.776 -0.298 -22.948 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -3.424 -0.582 -23.472 1.00 0.00 H new ATOM 1300 N LYS A 76 -5.232 -1.583 -21.613 1.00 0.00 N ATOM 1301 CA LYS A 76 -6.527 -1.619 -20.943 1.00 0.00 C ATOM 1302 C LYS A 76 -6.766 -2.980 -20.296 1.00 0.00 C ATOM 1303 O LYS A 76 -6.135 -3.971 -20.662 1.00 0.00 O ATOM 1304 CB LYS A 76 -7.648 -1.312 -21.938 1.00 0.00 C ATOM 1305 CG LYS A 76 -7.814 -2.372 -23.014 1.00 0.00 C ATOM 1306 CD LYS A 76 -8.982 -2.055 -23.933 1.00 0.00 C ATOM 1307 CE LYS A 76 -8.589 -1.057 -25.011 1.00 0.00 C ATOM 1308 NZ LYS A 76 -9.718 -0.768 -25.938 1.00 0.00 N ATOM 0 H LYS A 76 -5.276 -1.337 -22.602 1.00 0.00 H new ATOM 0 HA LYS A 76 -6.525 -0.859 -20.162 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -8.587 -1.208 -21.394 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -7.447 -0.352 -22.414 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -6.898 -2.444 -23.600 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -7.971 -3.344 -22.547 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -9.339 -2.973 -24.399 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -9.808 -1.653 -23.347 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -8.256 -0.130 -24.544 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -7.745 -1.449 -25.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -9.410 -0.084 -26.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -10.019 -1.648 -26.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -10.515 -0.370 -25.401 1.00 0.00 H new ATOM 1322 N GLU A 77 -7.682 -3.019 -19.333 1.00 0.00 N ATOM 1323 CA GLU A 77 -8.004 -4.259 -18.636 1.00 0.00 C ATOM 1324 C GLU A 77 -8.843 -5.178 -19.520 1.00 0.00 C ATOM 1325 O GLU A 77 -9.520 -4.723 -20.442 1.00 0.00 O ATOM 1326 CB GLU A 77 -8.754 -3.959 -17.337 1.00 0.00 C ATOM 1327 CG GLU A 77 -10.138 -3.369 -17.554 1.00 0.00 C ATOM 1328 CD GLU A 77 -10.566 -2.453 -16.424 1.00 0.00 C ATOM 1329 OE1 GLU A 77 -10.254 -2.766 -15.256 1.00 0.00 O ATOM 1330 OE2 GLU A 77 -11.213 -1.424 -16.708 1.00 0.00 O ATOM 0 H GLU A 77 -8.213 -2.207 -19.018 1.00 0.00 H new ATOM 0 HA GLU A 77 -7.069 -4.766 -18.399 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -8.847 -4.879 -16.761 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -8.163 -3.266 -16.738 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -10.149 -2.813 -18.491 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -10.862 -4.178 -17.655 1.00 0.00 H new ATOM 1337 N VAL A 78 -8.792 -6.474 -19.232 1.00 0.00 N ATOM 1338 CA VAL A 78 -9.546 -7.458 -19.999 1.00 0.00 C ATOM 1339 C VAL A 78 -10.979 -7.571 -19.490 1.00 0.00 C ATOM 1340 O VAL A 78 -11.216 -7.666 -18.285 1.00 0.00 O ATOM 1341 CB VAL A 78 -8.881 -8.846 -19.940 1.00 0.00 C ATOM 1342 CG1 VAL A 78 -8.886 -9.380 -18.516 1.00 0.00 C ATOM 1343 CG2 VAL A 78 -9.582 -9.813 -20.883 1.00 0.00 C ATOM 0 H VAL A 78 -8.236 -6.867 -18.473 1.00 0.00 H new ATOM 0 HA VAL A 78 -9.557 -7.112 -21.033 1.00 0.00 H new ATOM 0 HB VAL A 78 -7.844 -8.747 -20.262 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -8.412 -10.361 -18.494 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -8.336 -8.697 -17.869 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -9.914 -9.465 -18.163 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -9.099 -10.789 -20.829 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -10.628 -9.909 -20.594 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -9.521 -9.435 -21.903 1.00 0.00 H new ATOM 1353 N LEU A 79 -11.932 -7.560 -20.415 1.00 0.00 N ATOM 1354 CA LEU A 79 -13.344 -7.662 -20.060 1.00 0.00 C ATOM 1355 C LEU A 79 -13.856 -9.084 -20.267 1.00 0.00 C ATOM 1356 O LEU A 79 -13.882 -9.588 -21.390 1.00 0.00 O ATOM 1357 CB LEU A 79 -14.172 -6.684 -20.895 1.00 0.00 C ATOM 1358 CG LEU A 79 -15.343 -6.013 -20.177 1.00 0.00 C ATOM 1359 CD1 LEU A 79 -15.573 -4.613 -20.722 1.00 0.00 C ATOM 1360 CD2 LEU A 79 -16.604 -6.854 -20.314 1.00 0.00 C ATOM 0 H LEU A 79 -11.753 -7.482 -21.416 1.00 0.00 H new ATOM 0 HA LEU A 79 -13.447 -7.408 -19.005 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -13.508 -5.906 -21.271 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -14.561 -7.217 -21.763 1.00 0.00 H new ATOM 0 HG LEU A 79 -15.096 -5.932 -19.118 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -16.410 -4.152 -20.198 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -14.676 -4.012 -20.572 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -15.798 -4.670 -21.787 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -17.428 -6.362 -19.797 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -16.853 -6.967 -21.369 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -16.435 -7.837 -19.874 1.00 0.00 H new ATOM 1372 N TYR A 80 -14.263 -9.725 -19.177 1.00 0.00 N ATOM 1373 CA TYR A 80 -14.774 -11.089 -19.238 1.00 0.00 C ATOM 1374 C TYR A 80 -16.223 -11.149 -18.766 1.00 0.00 C ATOM 1375 O TYR A 80 -16.512 -11.415 -17.599 1.00 0.00 O ATOM 1376 CB TYR A 80 -13.909 -12.019 -18.386 1.00 0.00 C ATOM 1377 CG TYR A 80 -12.710 -12.574 -19.122 1.00 0.00 C ATOM 1378 CD1 TYR A 80 -12.870 -13.451 -20.188 1.00 0.00 C ATOM 1379 CD2 TYR A 80 -11.418 -12.224 -18.750 1.00 0.00 C ATOM 1380 CE1 TYR A 80 -11.778 -13.961 -20.863 1.00 0.00 C ATOM 1381 CE2 TYR A 80 -10.320 -12.728 -19.420 1.00 0.00 C ATOM 1382 CZ TYR A 80 -10.505 -13.596 -20.475 1.00 0.00 C ATOM 1383 OH TYR A 80 -9.414 -14.102 -21.144 1.00 0.00 O ATOM 0 H TYR A 80 -14.249 -9.322 -18.240 1.00 0.00 H new ATOM 0 HA TYR A 80 -14.735 -11.418 -20.276 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -13.565 -11.476 -17.506 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -14.522 -12.847 -18.031 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -13.865 -13.739 -20.494 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -11.269 -11.546 -17.923 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -11.920 -14.641 -21.690 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -9.322 -12.444 -19.119 1.00 0.00 H new ATOM 0 HH TYR A 80 -8.630 -14.078 -20.556 1.00 0.00 H new ATOM 1393 N PRO A 81 -17.158 -10.897 -19.694 1.00 0.00 N ATOM 1394 CA PRO A 81 -18.593 -10.918 -19.398 1.00 0.00 C ATOM 1395 C PRO A 81 -19.108 -12.326 -19.122 1.00 0.00 C ATOM 1396 O PRO A 81 -18.983 -13.220 -19.959 1.00 0.00 O ATOM 1397 CB PRO A 81 -19.227 -10.358 -20.674 1.00 0.00 C ATOM 1398 CG PRO A 81 -18.241 -10.658 -21.750 1.00 0.00 C ATOM 1399 CD PRO A 81 -16.885 -10.573 -21.105 1.00 0.00 C ATOM 0 HA PRO A 81 -18.832 -10.347 -18.501 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -20.189 -10.828 -20.877 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -19.407 -9.286 -20.589 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -18.412 -11.649 -22.170 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -18.329 -9.945 -22.570 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -16.183 -11.278 -21.551 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -16.450 -9.579 -21.212 1.00 0.00 H new ATOM 1407 N LYS A 82 -19.689 -12.518 -17.942 1.00 0.00 N ATOM 1408 CA LYS A 82 -20.225 -13.817 -17.555 1.00 0.00 C ATOM 1409 C LYS A 82 -21.174 -14.354 -18.622 1.00 0.00 C ATOM 1410 O LYS A 82 -22.007 -13.619 -19.153 1.00 0.00 O ATOM 1411 CB LYS A 82 -20.955 -13.712 -16.214 1.00 0.00 C ATOM 1412 CG LYS A 82 -21.679 -14.985 -15.814 1.00 0.00 C ATOM 1413 CD LYS A 82 -21.749 -15.136 -14.303 1.00 0.00 C ATOM 1414 CE LYS A 82 -22.949 -14.402 -13.725 1.00 0.00 C ATOM 1415 NZ LYS A 82 -22.660 -12.959 -13.498 1.00 0.00 N ATOM 0 H LYS A 82 -19.800 -11.789 -17.237 1.00 0.00 H new ATOM 0 HA LYS A 82 -19.390 -14.511 -17.454 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -20.235 -13.454 -15.437 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -21.675 -12.895 -16.265 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -22.688 -14.976 -16.227 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -21.167 -15.846 -16.243 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -21.808 -16.193 -14.044 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -20.834 -14.749 -13.855 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -23.796 -14.500 -14.404 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -23.240 -14.867 -12.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -23.060 -12.664 -12.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -21.631 -12.808 -13.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -23.086 -12.395 -14.261 1.00 0.00 H new ATOM 1429 N LEU A 83 -21.043 -15.640 -18.930 1.00 0.00 N ATOM 1430 CA LEU A 83 -21.890 -16.276 -19.933 1.00 0.00 C ATOM 1431 C LEU A 83 -22.334 -17.660 -19.472 1.00 0.00 C ATOM 1432 O LEU A 83 -21.539 -18.433 -18.937 1.00 0.00 O ATOM 1433 CB LEU A 83 -21.145 -16.384 -21.265 1.00 0.00 C ATOM 1434 CG LEU A 83 -21.160 -15.134 -22.146 1.00 0.00 C ATOM 1435 CD1 LEU A 83 -19.921 -15.086 -23.026 1.00 0.00 C ATOM 1436 CD2 LEU A 83 -22.422 -15.096 -22.995 1.00 0.00 C ATOM 0 H LEU A 83 -20.359 -16.262 -18.500 1.00 0.00 H new ATOM 0 HA LEU A 83 -22.777 -15.657 -20.069 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -20.107 -16.646 -21.058 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -21.575 -17.209 -21.833 1.00 0.00 H new ATOM 0 HG LEU A 83 -21.154 -14.257 -21.499 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -19.949 -14.190 -23.646 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -19.030 -15.065 -22.399 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -19.894 -15.968 -23.665 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -22.416 -14.200 -23.616 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -22.458 -15.979 -23.633 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -23.297 -15.082 -22.345 1.00 0.00 H new ATOM 1448 N LYS A 84 -23.609 -17.968 -19.684 1.00 0.00 N ATOM 1449 CA LYS A 84 -24.160 -19.261 -19.294 1.00 0.00 C ATOM 1450 C LYS A 84 -23.606 -20.376 -20.175 1.00 0.00 C ATOM 1451 O LYS A 84 -23.798 -20.372 -21.391 1.00 0.00 O ATOM 1452 CB LYS A 84 -25.687 -19.236 -19.384 1.00 0.00 C ATOM 1453 CG LYS A 84 -26.363 -20.313 -18.554 1.00 0.00 C ATOM 1454 CD LYS A 84 -26.649 -19.832 -17.141 1.00 0.00 C ATOM 1455 CE LYS A 84 -27.833 -20.567 -16.531 1.00 0.00 C ATOM 1456 NZ LYS A 84 -28.342 -19.882 -15.311 1.00 0.00 N ATOM 0 H LYS A 84 -24.281 -17.339 -20.124 1.00 0.00 H new ATOM 0 HA LYS A 84 -23.867 -19.457 -18.263 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -26.046 -18.260 -19.058 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -25.983 -19.353 -20.426 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -27.295 -20.611 -19.033 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -25.727 -21.197 -18.516 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -25.767 -19.982 -16.519 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -26.852 -18.761 -17.154 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -28.634 -20.640 -17.267 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -27.538 -21.586 -16.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -29.148 -20.414 -14.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -27.586 -19.835 -14.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -28.648 -18.919 -15.556 1.00 0.00 H new ATOM 1470 N ALA A 85 -22.921 -21.330 -19.554 1.00 0.00 N ATOM 1471 CA ALA A 85 -22.343 -22.453 -20.281 1.00 0.00 C ATOM 1472 C ALA A 85 -23.427 -23.413 -20.759 1.00 0.00 C ATOM 1473 O ALA A 85 -24.394 -23.681 -20.045 1.00 0.00 O ATOM 1474 CB ALA A 85 -21.335 -23.185 -19.408 1.00 0.00 C ATOM 0 H ALA A 85 -22.753 -21.348 -18.548 1.00 0.00 H new ATOM 0 HA ALA A 85 -21.829 -22.060 -21.158 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -20.912 -24.021 -19.964 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -20.538 -22.500 -19.120 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -21.833 -23.559 -18.513 1.00 0.00 H new ATOM 1480 N THR A 86 -23.261 -23.929 -21.973 1.00 0.00 N ATOM 1481 CA THR A 86 -24.227 -24.858 -22.548 1.00 0.00 C ATOM 1482 C THR A 86 -23.527 -25.972 -23.318 1.00 0.00 C ATOM 1483 O THR A 86 -22.380 -25.821 -23.741 1.00 0.00 O ATOM 1484 CB THR A 86 -25.209 -24.137 -23.489 1.00 0.00 C ATOM 1485 OG1 THR A 86 -24.534 -23.086 -24.190 1.00 0.00 O ATOM 1486 CG2 THR A 86 -26.382 -23.562 -22.710 1.00 0.00 C ATOM 0 H THR A 86 -22.466 -23.719 -22.577 1.00 0.00 H new ATOM 0 HA THR A 86 -24.784 -25.289 -21.716 1.00 0.00 H new ATOM 0 HB THR A 86 -25.591 -24.864 -24.206 1.00 0.00 H new ATOM 0 HG1 THR A 86 -25.165 -22.633 -24.788 1.00 0.00 H new ATOM 0 HG21 THR A 86 -27.062 -23.057 -23.396 1.00 0.00 H new ATOM 0 HG22 THR A 86 -26.911 -24.368 -22.202 1.00 0.00 H new ATOM 0 HG23 THR A 86 -26.014 -22.848 -21.973 1.00 0.00 H new ATOM 1494 N ASP A 87 -24.223 -27.088 -23.498 1.00 0.00 N ATOM 1495 CA ASP A 87 -23.668 -28.228 -24.220 1.00 0.00 C ATOM 1496 C ASP A 87 -24.680 -28.783 -25.218 1.00 0.00 C ATOM 1497 O ASP A 87 -25.860 -28.931 -24.902 1.00 0.00 O ATOM 1498 CB ASP A 87 -23.246 -29.323 -23.240 1.00 0.00 C ATOM 1499 CG ASP A 87 -22.092 -28.895 -22.355 1.00 0.00 C ATOM 1500 OD1 ASP A 87 -20.961 -28.781 -22.871 1.00 0.00 O ATOM 1501 OD2 ASP A 87 -22.320 -28.676 -21.147 1.00 0.00 O ATOM 0 H ASP A 87 -25.173 -27.229 -23.154 1.00 0.00 H new ATOM 0 HA ASP A 87 -22.791 -27.887 -24.770 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -24.097 -29.595 -22.616 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -22.961 -30.215 -23.797 1.00 0.00 H new ATOM 1506 N GLU A 88 -24.208 -29.086 -26.424 1.00 0.00 N ATOM 1507 CA GLU A 88 -25.073 -29.623 -27.468 1.00 0.00 C ATOM 1508 C GLU A 88 -25.300 -31.119 -27.271 1.00 0.00 C ATOM 1509 O GLU A 88 -24.711 -31.944 -27.969 1.00 0.00 O ATOM 1510 CB GLU A 88 -24.463 -29.366 -28.848 1.00 0.00 C ATOM 1511 CG GLU A 88 -24.738 -27.972 -29.385 1.00 0.00 C ATOM 1512 CD GLU A 88 -26.199 -27.758 -29.732 1.00 0.00 C ATOM 1513 OE1 GLU A 88 -26.842 -28.715 -30.209 1.00 0.00 O ATOM 1514 OE2 GLU A 88 -26.699 -26.632 -29.524 1.00 0.00 O ATOM 0 H GLU A 88 -23.233 -28.969 -26.701 1.00 0.00 H new ATOM 0 HA GLU A 88 -26.036 -29.116 -27.403 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -23.385 -29.519 -28.794 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -24.854 -30.101 -29.551 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -24.433 -27.234 -28.643 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -24.129 -27.802 -30.273 1.00 0.00 H new ATOM 1521 N ASP A 89 -26.158 -31.460 -26.316 1.00 0.00 N ATOM 1522 CA ASP A 89 -26.464 -32.856 -26.026 1.00 0.00 C ATOM 1523 C ASP A 89 -27.841 -33.233 -26.564 1.00 0.00 C ATOM 1524 O ASP A 89 -27.981 -34.202 -27.311 1.00 0.00 O ATOM 1525 CB ASP A 89 -26.405 -33.111 -24.519 1.00 0.00 C ATOM 1526 CG ASP A 89 -27.556 -32.462 -23.776 1.00 0.00 C ATOM 1527 OD1 ASP A 89 -27.495 -31.237 -23.540 1.00 0.00 O ATOM 1528 OD2 ASP A 89 -28.519 -33.179 -23.432 1.00 0.00 O ATOM 0 H ASP A 89 -26.654 -30.789 -25.729 1.00 0.00 H new ATOM 0 HA ASP A 89 -25.717 -33.477 -26.521 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -26.417 -34.185 -24.335 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -25.462 -32.731 -24.126 1.00 0.00 H new TER 1533 ASP A 89