USER MOD reduce.3.24.130724 H: found=0, std=0, add=719, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 718 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 18 SER OG : rot 180:sc= 0.217 USER MOD Set 1.2: A 44 LYS NZ :NH3+ -166:sc=0.000227 (180deg=-0.352) USER MOD Single : A 0 SER OG : rot -130:sc= -0.968 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 TYR OH : rot 30:sc= -0.0381 USER MOD Single : A -3 SER OG : rot 180:sc= 0 USER MOD Single : A -7 SER OG : rot 180:sc= 0 USER MOD Single : A -8 GLY N :NH3+ 180:sc= -0.0361 (180deg=-0.0361) USER MOD Single : A 10 LYS NZ :NH3+ 154:sc=-0.00852 (180deg=-0.286) USER MOD Single : A 12 THR OG1 : rot -105:sc= 0.924 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ -159:sc= -0.0225 (180deg=-0.253) USER MOD Single : A 29 ASN : amide:sc= -0.0154 X(o=-0.015,f=0) USER MOD Single : A 32 CYS SG : rot 150:sc= 0.0261 USER MOD Single : A 34 GLN : amide:sc= -0.416 K(o=-0.42,f=-2.4!) USER MOD Single : A 35 ASN : amide:sc= -1.11 X(o=-1.1,f=-1.3) USER MOD Single : A 37 TYR OH : rot 180:sc= -0.767 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= -0.205 X(o=-0.2,f=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 ASN : amide:sc= -0.203 X(o=-0.2,f=0) USER MOD Single : A 52 TYR OH : rot -12:sc= -3.05! USER MOD Single : A 55 MET CE :methyl 152:sc= -1.29 (180deg=-3.75!) USER MOD Single : A 56 LYS NZ :NH3+ -158:sc= -0.571 (180deg=-1.95) USER MOD Single : A 58 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 SER N :NH3+ -153:sc= 0 (180deg=-0.335) USER MOD Single : B 1 SER OG : rot 180:sc= 0 USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0341) USER MOD Single : B 11 THR OG1 : rot 54:sc= 0.0703 USER MOD Single : B 12 TYR OH : rot 180:sc= 0 USER MOD Single : B 13 LYS NZ :NH3+ 157:sc= -0.0382 (180deg=-0.346) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -8 8.090 4.968 -45.847 1.00 0.00 N ATOM 2 CA GLY A -8 8.281 5.075 -44.307 1.00 0.00 C ATOM 3 C GLY A -8 7.140 5.417 -43.455 1.00 0.00 C ATOM 4 O GLY A -8 7.239 5.423 -42.241 1.00 0.00 O ATOM 0 H1 GLY A -8 8.996 4.719 -46.293 1.00 0.00 H new ATOM 0 H2 GLY A -8 7.386 4.233 -46.059 1.00 0.00 H new ATOM 0 H3 GLY A -8 7.760 5.881 -46.220 1.00 0.00 H new ATOM 0 HA2 GLY A -8 8.671 4.118 -43.960 1.00 0.00 H new ATOM 0 HA3 GLY A -8 9.057 5.819 -44.126 1.00 0.00 H new ATOM 10 N SER A -7 6.012 5.717 -44.054 1.00 0.00 N ATOM 11 CA SER A -7 4.806 6.077 -43.253 1.00 0.00 C ATOM 12 C SER A -7 3.746 4.985 -43.405 1.00 0.00 C ATOM 13 O SER A -7 3.209 4.491 -42.431 1.00 0.00 O ATOM 14 CB SER A -7 4.242 7.405 -43.756 1.00 0.00 C ATOM 15 OG SER A -7 5.312 8.237 -44.190 1.00 0.00 O ATOM 0 H SER A -7 5.877 5.727 -45.065 1.00 0.00 H new ATOM 0 HA SER A -7 5.082 6.171 -42.203 1.00 0.00 H new ATOM 0 HB2 SER A -7 3.546 7.230 -44.577 1.00 0.00 H new ATOM 0 HB3 SER A -7 3.681 7.899 -42.962 1.00 0.00 H new ATOM 0 HG SER A -7 4.953 9.089 -44.515 1.00 0.00 H new ATOM 21 N ARG A -6 3.437 4.607 -44.624 1.00 0.00 N ATOM 22 CA ARG A -6 2.404 3.544 -44.852 1.00 0.00 C ATOM 23 C ARG A -6 1.063 4.010 -44.268 1.00 0.00 C ATOM 24 O ARG A -6 0.796 3.838 -43.093 1.00 0.00 O ATOM 25 CB ARG A -6 2.849 2.236 -44.167 1.00 0.00 C ATOM 26 CG ARG A -6 2.924 1.107 -45.203 1.00 0.00 C ATOM 27 CD ARG A -6 1.533 0.506 -45.406 1.00 0.00 C ATOM 28 NE ARG A -6 1.657 -0.955 -45.676 1.00 0.00 N ATOM 29 CZ ARG A -6 1.044 -1.484 -46.700 1.00 0.00 C ATOM 30 NH1 ARG A -6 -0.256 -1.410 -46.792 1.00 0.00 N ATOM 31 NH2 ARG A -6 1.730 -2.086 -47.631 1.00 0.00 N ATOM 0 H ARG A -6 3.856 4.989 -45.472 1.00 0.00 H new ATOM 0 HA ARG A -6 2.290 3.364 -45.921 1.00 0.00 H new ATOM 0 HB2 ARG A -6 3.822 2.374 -43.695 1.00 0.00 H new ATOM 0 HB3 ARG A -6 2.146 1.971 -43.377 1.00 0.00 H new ATOM 0 HG2 ARG A -6 3.307 1.492 -46.148 1.00 0.00 H new ATOM 0 HG3 ARG A -6 3.619 0.337 -44.867 1.00 0.00 H new ATOM 0 HD2 ARG A -6 0.921 0.672 -44.520 1.00 0.00 H new ATOM 0 HD3 ARG A -6 1.030 0.999 -46.238 1.00 0.00 H new ATOM 0 HE ARG A -6 2.221 -1.541 -45.061 1.00 0.00 H new ATOM 0 HH11 ARG A -6 -0.793 -0.939 -46.064 1.00 0.00 H new ATOM 0 HH12 ARG A -6 -0.735 -1.823 -47.592 1.00 0.00 H new ATOM 0 HH21 ARG A -6 2.746 -2.144 -47.559 1.00 0.00 H new ATOM 0 HH22 ARG A -6 1.251 -2.499 -48.431 1.00 0.00 H new ATOM 45 N ARG A -5 0.226 4.603 -45.083 1.00 0.00 N ATOM 46 CA ARG A -5 -1.095 5.089 -44.585 1.00 0.00 C ATOM 47 C ARG A -5 -2.072 3.916 -44.482 1.00 0.00 C ATOM 48 O ARG A -5 -2.559 3.413 -45.478 1.00 0.00 O ATOM 49 CB ARG A -5 -1.651 6.135 -45.555 1.00 0.00 C ATOM 50 CG ARG A -5 -0.673 7.311 -45.659 1.00 0.00 C ATOM 51 CD ARG A -5 -0.637 7.823 -47.100 1.00 0.00 C ATOM 52 NE ARG A -5 0.308 6.994 -47.899 1.00 0.00 N ATOM 53 CZ ARG A -5 -0.083 6.461 -49.025 1.00 0.00 C ATOM 54 NH1 ARG A -5 -0.588 7.214 -49.962 1.00 0.00 N ATOM 55 NH2 ARG A -5 0.033 5.175 -49.212 1.00 0.00 N ATOM 0 H ARG A -5 0.402 4.771 -46.073 1.00 0.00 H new ATOM 0 HA ARG A -5 -0.967 5.537 -43.600 1.00 0.00 H new ATOM 0 HB2 ARG A -5 -1.805 5.689 -46.538 1.00 0.00 H new ATOM 0 HB3 ARG A -5 -2.623 6.487 -45.209 1.00 0.00 H new ATOM 0 HG2 ARG A -5 -0.979 8.112 -44.985 1.00 0.00 H new ATOM 0 HG3 ARG A -5 0.324 6.997 -45.349 1.00 0.00 H new ATOM 0 HD2 ARG A -5 -1.634 7.780 -47.537 1.00 0.00 H new ATOM 0 HD3 ARG A -5 -0.326 8.868 -47.118 1.00 0.00 H new ATOM 0 HE ARG A -5 1.260 6.843 -47.567 1.00 0.00 H new ATOM 0 HH11 ARG A -5 -0.678 8.219 -49.815 1.00 0.00 H new ATOM 0 HH12 ARG A -5 -0.893 6.798 -50.842 1.00 0.00 H new ATOM 0 HH21 ARG A -5 0.429 4.587 -48.479 1.00 0.00 H new ATOM 0 HH22 ARG A -5 -0.272 4.758 -50.091 1.00 0.00 H new ATOM 69 N ALA A -4 -2.364 3.480 -43.281 1.00 0.00 N ATOM 70 CA ALA A -4 -3.312 2.341 -43.099 1.00 0.00 C ATOM 71 C ALA A -4 -3.891 2.387 -41.683 1.00 0.00 C ATOM 72 O ALA A -4 -4.148 1.364 -41.074 1.00 0.00 O ATOM 73 CB ALA A -4 -2.569 1.019 -43.305 1.00 0.00 C ATOM 0 H ALA A -4 -1.984 3.867 -42.417 1.00 0.00 H new ATOM 0 HA ALA A -4 -4.120 2.418 -43.827 1.00 0.00 H new ATOM 0 HB1 ALA A -4 -3.262 0.188 -43.172 1.00 0.00 H new ATOM 0 HB2 ALA A -4 -2.154 0.988 -44.312 1.00 0.00 H new ATOM 0 HB3 ALA A -4 -1.761 0.938 -42.577 1.00 0.00 H new ATOM 79 N SER A -3 -4.098 3.572 -41.154 1.00 0.00 N ATOM 80 CA SER A -3 -4.661 3.701 -39.772 1.00 0.00 C ATOM 81 C SER A -3 -3.724 3.026 -38.768 1.00 0.00 C ATOM 82 O SER A -3 -2.782 2.351 -39.141 1.00 0.00 O ATOM 83 CB SER A -3 -6.041 3.036 -39.714 1.00 0.00 C ATOM 84 OG SER A -3 -7.046 4.024 -39.905 1.00 0.00 O ATOM 0 H SER A -3 -3.900 4.456 -41.622 1.00 0.00 H new ATOM 0 HA SER A -3 -4.758 4.757 -39.521 1.00 0.00 H new ATOM 0 HB2 SER A -3 -6.120 2.267 -40.483 1.00 0.00 H new ATOM 0 HB3 SER A -3 -6.179 2.541 -38.753 1.00 0.00 H new ATOM 0 HG SER A -3 -7.930 3.602 -39.870 1.00 0.00 H new ATOM 90 N VAL A -2 -3.978 3.204 -37.495 1.00 0.00 N ATOM 91 CA VAL A -2 -3.109 2.578 -36.455 1.00 0.00 C ATOM 92 C VAL A -2 -3.326 1.062 -36.457 1.00 0.00 C ATOM 93 O VAL A -2 -4.373 0.576 -36.847 1.00 0.00 O ATOM 94 CB VAL A -2 -3.472 3.146 -35.079 1.00 0.00 C ATOM 95 CG1 VAL A -2 -2.507 2.598 -34.026 1.00 0.00 C ATOM 96 CG2 VAL A -2 -3.369 4.672 -35.115 1.00 0.00 C ATOM 0 H VAL A -2 -4.753 3.758 -37.132 1.00 0.00 H new ATOM 0 HA VAL A -2 -2.063 2.796 -36.673 1.00 0.00 H new ATOM 0 HB VAL A -2 -4.491 2.853 -34.825 1.00 0.00 H new ATOM 0 HG11 VAL A -2 -2.767 3.003 -33.048 1.00 0.00 H new ATOM 0 HG12 VAL A -2 -2.578 1.511 -33.999 1.00 0.00 H new ATOM 0 HG13 VAL A -2 -1.488 2.889 -34.280 1.00 0.00 H new ATOM 0 HG21 VAL A -2 -3.627 5.077 -34.137 1.00 0.00 H new ATOM 0 HG22 VAL A -2 -2.350 4.962 -35.371 1.00 0.00 H new ATOM 0 HG23 VAL A -2 -4.057 5.066 -35.864 1.00 0.00 H new ATOM 106 N GLY A -1 -2.343 0.312 -36.021 1.00 0.00 N ATOM 107 CA GLY A -1 -2.482 -1.175 -35.990 1.00 0.00 C ATOM 108 C GLY A -1 -2.275 -1.678 -34.560 1.00 0.00 C ATOM 109 O GLY A -1 -1.310 -2.361 -34.267 1.00 0.00 O ATOM 0 H GLY A -1 -1.448 0.668 -35.685 1.00 0.00 H new ATOM 0 HA2 GLY A -1 -3.469 -1.466 -36.350 1.00 0.00 H new ATOM 0 HA3 GLY A -1 -1.752 -1.633 -36.657 1.00 0.00 H new ATOM 113 N SER A 0 -3.174 -1.342 -33.668 1.00 0.00 N ATOM 114 CA SER A 0 -3.037 -1.795 -32.249 1.00 0.00 C ATOM 115 C SER A 0 -3.961 -2.987 -31.997 1.00 0.00 C ATOM 116 O SER A 0 -4.849 -3.276 -32.777 1.00 0.00 O ATOM 117 CB SER A 0 -3.424 -0.651 -31.304 1.00 0.00 C ATOM 118 OG SER A 0 -4.339 0.214 -31.964 1.00 0.00 O ATOM 0 H SER A 0 -3.998 -0.773 -33.862 1.00 0.00 H new ATOM 0 HA SER A 0 -2.003 -2.089 -32.066 1.00 0.00 H new ATOM 0 HB2 SER A 0 -3.874 -1.051 -30.396 1.00 0.00 H new ATOM 0 HB3 SER A 0 -2.535 -0.097 -31.002 1.00 0.00 H new ATOM 0 HG SER A 0 -4.035 1.141 -31.875 1.00 0.00 H new ATOM 124 N MET A 1 -3.762 -3.669 -30.899 1.00 0.00 N ATOM 125 CA MET A 1 -4.625 -4.835 -30.558 1.00 0.00 C ATOM 126 C MET A 1 -5.410 -4.524 -29.305 1.00 0.00 C ATOM 127 O MET A 1 -5.398 -3.402 -28.826 1.00 0.00 O ATOM 128 CB MET A 1 -3.759 -6.074 -30.326 1.00 0.00 C ATOM 129 CG MET A 1 -3.586 -6.812 -31.641 1.00 0.00 C ATOM 130 SD MET A 1 -2.039 -7.751 -31.618 1.00 0.00 S ATOM 131 CE MET A 1 -1.777 -7.797 -33.407 1.00 0.00 C ATOM 0 H MET A 1 -3.030 -3.464 -30.218 1.00 0.00 H new ATOM 0 HA MET A 1 -5.311 -5.030 -31.382 1.00 0.00 H new ATOM 0 HB2 MET A 1 -2.787 -5.784 -29.927 1.00 0.00 H new ATOM 0 HB3 MET A 1 -4.225 -6.726 -29.587 1.00 0.00 H new ATOM 0 HG2 MET A 1 -4.428 -7.485 -31.805 1.00 0.00 H new ATOM 0 HG3 MET A 1 -3.579 -6.103 -32.469 1.00 0.00 H new ATOM 0 HE1 MET A 1 -0.858 -8.340 -33.626 1.00 0.00 H new ATOM 0 HE2 MET A 1 -2.618 -8.299 -33.885 1.00 0.00 H new ATOM 0 HE3 MET A 1 -1.697 -6.779 -33.789 1.00 0.00 H new ATOM 141 N GLU A 2 -6.092 -5.499 -28.758 1.00 0.00 N ATOM 142 CA GLU A 2 -6.859 -5.265 -27.551 1.00 0.00 C ATOM 143 C GLU A 2 -6.378 -6.253 -26.514 1.00 0.00 C ATOM 144 O GLU A 2 -5.555 -7.106 -26.791 1.00 0.00 O ATOM 145 CB GLU A 2 -8.340 -5.502 -27.852 1.00 0.00 C ATOM 146 CG GLU A 2 -9.164 -4.278 -27.443 1.00 0.00 C ATOM 147 CD GLU A 2 -10.465 -4.245 -28.247 1.00 0.00 C ATOM 148 OE1 GLU A 2 -10.405 -4.473 -29.444 1.00 0.00 O ATOM 149 OE2 GLU A 2 -11.500 -3.995 -27.651 1.00 0.00 O ATOM 0 H GLU A 2 -6.135 -6.452 -29.120 1.00 0.00 H new ATOM 0 HA GLU A 2 -6.732 -4.244 -27.190 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -8.475 -5.702 -28.915 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -8.692 -6.383 -27.315 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -9.385 -4.315 -26.376 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -8.592 -3.367 -27.619 1.00 0.00 H new ATOM 156 N ALA A 3 -6.879 -6.144 -25.343 1.00 0.00 N ATOM 157 CA ALA A 3 -6.469 -7.075 -24.263 1.00 0.00 C ATOM 158 C ALA A 3 -7.548 -7.148 -23.198 1.00 0.00 C ATOM 159 O ALA A 3 -7.908 -6.167 -22.583 1.00 0.00 O ATOM 160 CB ALA A 3 -5.181 -6.599 -23.658 1.00 0.00 C ATOM 0 H ALA A 3 -7.567 -5.443 -25.070 1.00 0.00 H new ATOM 0 HA ALA A 3 -6.326 -8.071 -24.682 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -4.878 -7.282 -22.864 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -4.408 -6.569 -24.426 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -5.321 -5.600 -23.244 1.00 0.00 H new ATOM 166 N ILE A 4 -8.077 -8.313 -23.006 1.00 0.00 N ATOM 167 CA ILE A 4 -9.162 -8.514 -22.022 1.00 0.00 C ATOM 168 C ILE A 4 -8.696 -8.281 -20.609 1.00 0.00 C ATOM 169 O ILE A 4 -7.852 -8.988 -20.092 1.00 0.00 O ATOM 170 CB ILE A 4 -9.686 -9.934 -22.141 1.00 0.00 C ATOM 171 CG1 ILE A 4 -10.769 -10.188 -21.074 1.00 0.00 C ATOM 172 CG2 ILE A 4 -8.554 -10.935 -21.961 1.00 0.00 C ATOM 173 CD1 ILE A 4 -11.918 -10.904 -21.708 1.00 0.00 C ATOM 0 H ILE A 4 -7.795 -9.158 -23.504 1.00 0.00 H new ATOM 0 HA ILE A 4 -9.947 -7.790 -22.240 1.00 0.00 H new ATOM 0 HB ILE A 4 -10.118 -10.060 -23.134 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -10.360 -10.782 -20.256 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -11.104 -9.244 -20.645 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -8.947 -11.948 -22.049 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -7.798 -10.771 -22.729 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -8.106 -10.804 -20.976 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -12.689 -11.088 -20.960 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -12.330 -10.292 -22.511 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -11.574 -11.854 -22.116 1.00 0.00 H new ATOM 185 N ALA A 5 -9.324 -7.352 -19.965 1.00 0.00 N ATOM 186 CA ALA A 5 -9.012 -7.110 -18.521 1.00 0.00 C ATOM 187 C ALA A 5 -9.635 -8.285 -17.756 1.00 0.00 C ATOM 188 O ALA A 5 -10.843 -8.418 -17.709 1.00 0.00 O ATOM 189 CB ALA A 5 -9.653 -5.812 -18.036 1.00 0.00 C ATOM 0 H ALA A 5 -10.040 -6.745 -20.365 1.00 0.00 H new ATOM 0 HA ALA A 5 -7.936 -7.030 -18.367 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -9.412 -5.658 -16.984 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -9.271 -4.976 -18.622 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -10.735 -5.874 -18.155 1.00 0.00 H new ATOM 195 N LYS A 6 -8.839 -9.156 -17.206 1.00 0.00 N ATOM 196 CA LYS A 6 -9.402 -10.347 -16.498 1.00 0.00 C ATOM 197 C LYS A 6 -10.161 -9.937 -15.235 1.00 0.00 C ATOM 198 O LYS A 6 -11.070 -10.624 -14.807 1.00 0.00 O ATOM 199 CB LYS A 6 -8.265 -11.280 -16.112 1.00 0.00 C ATOM 200 CG LYS A 6 -7.530 -11.703 -17.372 1.00 0.00 C ATOM 201 CD LYS A 6 -6.111 -12.136 -17.021 1.00 0.00 C ATOM 202 CE LYS A 6 -6.155 -13.394 -16.148 1.00 0.00 C ATOM 203 NZ LYS A 6 -4.778 -13.943 -15.995 1.00 0.00 N ATOM 0 H LYS A 6 -7.821 -9.098 -17.214 1.00 0.00 H new ATOM 0 HA LYS A 6 -10.099 -10.847 -17.171 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -7.582 -10.779 -15.427 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -8.655 -12.154 -15.591 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -8.061 -12.523 -17.856 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -7.503 -10.877 -18.083 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -5.545 -12.333 -17.931 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -5.596 -11.333 -16.493 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -6.574 -13.156 -15.170 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -6.807 -14.141 -16.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -4.809 -14.797 -15.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -4.395 -14.185 -16.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -4.168 -13.231 -15.545 1.00 0.00 H new ATOM 217 N TYR A 7 -9.788 -8.842 -14.623 1.00 0.00 N ATOM 218 CA TYR A 7 -10.485 -8.413 -13.359 1.00 0.00 C ATOM 219 C TYR A 7 -10.520 -6.910 -13.285 1.00 0.00 C ATOM 220 O TYR A 7 -10.078 -6.213 -14.181 1.00 0.00 O ATOM 221 CB TYR A 7 -9.730 -8.951 -12.121 1.00 0.00 C ATOM 222 CG TYR A 7 -9.173 -10.329 -12.381 1.00 0.00 C ATOM 223 CD1 TYR A 7 -10.025 -11.431 -12.410 1.00 0.00 C ATOM 224 CD2 TYR A 7 -7.803 -10.492 -12.596 1.00 0.00 C ATOM 225 CE1 TYR A 7 -9.506 -12.709 -12.657 1.00 0.00 C ATOM 226 CE2 TYR A 7 -7.278 -11.763 -12.842 1.00 0.00 C ATOM 227 CZ TYR A 7 -8.130 -12.875 -12.874 1.00 0.00 C ATOM 228 OH TYR A 7 -7.615 -14.132 -13.117 1.00 0.00 O ATOM 0 H TYR A 7 -9.037 -8.226 -14.936 1.00 0.00 H new ATOM 0 HA TYR A 7 -11.499 -8.813 -13.370 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -8.919 -8.271 -11.862 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -10.405 -8.983 -11.265 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -11.084 -11.300 -12.242 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -7.148 -9.634 -12.572 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -10.164 -13.565 -12.680 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -6.218 -11.888 -13.007 1.00 0.00 H new ATOM 0 HH TYR A 7 -8.291 -14.681 -13.566 1.00 0.00 H new ATOM 238 N ASP A 8 -11.049 -6.408 -12.214 1.00 0.00 N ATOM 239 CA ASP A 8 -11.136 -4.946 -12.040 1.00 0.00 C ATOM 240 C ASP A 8 -9.800 -4.421 -11.523 1.00 0.00 C ATOM 241 O ASP A 8 -9.005 -5.163 -11.003 1.00 0.00 O ATOM 242 CB ASP A 8 -12.271 -4.634 -11.075 1.00 0.00 C ATOM 243 CG ASP A 8 -11.937 -5.117 -9.650 1.00 0.00 C ATOM 244 OD1 ASP A 8 -11.132 -6.024 -9.523 1.00 0.00 O ATOM 245 OD2 ASP A 8 -12.496 -4.568 -8.716 1.00 0.00 O ATOM 0 H ASP A 8 -11.429 -6.958 -11.443 1.00 0.00 H new ATOM 0 HA ASP A 8 -11.346 -4.455 -12.990 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -12.458 -3.560 -11.064 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -13.187 -5.114 -11.419 1.00 0.00 H new ATOM 250 N PHE A 9 -9.535 -3.152 -11.695 1.00 0.00 N ATOM 251 CA PHE A 9 -8.231 -2.581 -11.257 1.00 0.00 C ATOM 252 C PHE A 9 -8.237 -1.067 -11.577 1.00 0.00 C ATOM 253 O PHE A 9 -9.098 -0.591 -12.291 1.00 0.00 O ATOM 254 CB PHE A 9 -7.127 -3.315 -12.049 1.00 0.00 C ATOM 255 CG PHE A 9 -5.792 -2.659 -11.888 1.00 0.00 C ATOM 256 CD1 PHE A 9 -4.941 -3.045 -10.854 1.00 0.00 C ATOM 257 CD2 PHE A 9 -5.404 -1.690 -12.797 1.00 0.00 C ATOM 258 CE1 PHE A 9 -3.684 -2.447 -10.726 1.00 0.00 C ATOM 259 CE2 PHE A 9 -4.145 -1.090 -12.684 1.00 0.00 C ATOM 260 CZ PHE A 9 -3.284 -1.469 -11.643 1.00 0.00 C ATOM 0 H PHE A 9 -10.174 -2.483 -12.124 1.00 0.00 H new ATOM 0 HA PHE A 9 -8.058 -2.707 -10.188 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -7.066 -4.350 -11.712 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -7.394 -3.340 -13.106 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -5.252 -3.805 -10.153 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -6.073 -1.397 -13.593 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -3.024 -2.739 -9.922 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -3.837 -0.338 -13.395 1.00 0.00 H new ATOM 0 HZ PHE A 9 -2.313 -1.006 -11.550 1.00 0.00 H new ATOM 270 N LYS A 10 -7.295 -0.313 -11.055 1.00 0.00 N ATOM 271 CA LYS A 10 -7.270 1.161 -11.345 1.00 0.00 C ATOM 272 C LYS A 10 -5.838 1.641 -11.506 1.00 0.00 C ATOM 273 O LYS A 10 -4.896 0.975 -11.126 1.00 0.00 O ATOM 274 CB LYS A 10 -8.004 1.931 -10.217 1.00 0.00 C ATOM 275 CG LYS A 10 -7.108 2.094 -8.979 1.00 0.00 C ATOM 276 CD LYS A 10 -7.917 2.723 -7.840 1.00 0.00 C ATOM 277 CE LYS A 10 -8.944 1.711 -7.311 1.00 0.00 C ATOM 278 NZ LYS A 10 -10.310 2.111 -7.754 1.00 0.00 N ATOM 0 H LYS A 10 -6.549 -0.650 -10.446 1.00 0.00 H new ATOM 0 HA LYS A 10 -7.791 1.355 -12.283 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -8.307 2.913 -10.581 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -8.914 1.398 -9.942 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -6.718 1.124 -8.669 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -6.249 2.721 -9.219 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -7.250 3.032 -7.035 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -8.426 3.619 -8.195 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -8.709 0.712 -7.679 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -8.901 1.668 -6.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -10.920 1.270 -7.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -10.709 2.792 -7.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -10.255 2.550 -8.695 1.00 0.00 H new ATOM 292 N ALA A 11 -5.679 2.799 -12.076 1.00 0.00 N ATOM 293 CA ALA A 11 -4.325 3.345 -12.295 1.00 0.00 C ATOM 294 C ALA A 11 -3.645 3.587 -10.939 1.00 0.00 C ATOM 295 O ALA A 11 -4.232 4.162 -10.041 1.00 0.00 O ATOM 296 CB ALA A 11 -4.416 4.658 -13.064 1.00 0.00 C ATOM 0 H ALA A 11 -6.441 3.394 -12.401 1.00 0.00 H new ATOM 0 HA ALA A 11 -3.738 2.632 -12.874 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -3.414 5.057 -13.223 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -4.894 4.483 -14.028 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -5.005 5.375 -12.492 1.00 0.00 H new ATOM 302 N THR A 12 -2.413 3.162 -10.785 1.00 0.00 N ATOM 303 CA THR A 12 -1.703 3.383 -9.481 1.00 0.00 C ATOM 304 C THR A 12 -0.578 4.397 -9.692 1.00 0.00 C ATOM 305 O THR A 12 -0.468 5.374 -8.969 1.00 0.00 O ATOM 306 CB THR A 12 -1.120 2.062 -8.962 1.00 0.00 C ATOM 307 OG1 THR A 12 -0.038 1.662 -9.789 1.00 0.00 O ATOM 308 CG2 THR A 12 -2.204 0.980 -8.969 1.00 0.00 C ATOM 0 H THR A 12 -1.871 2.675 -11.499 1.00 0.00 H new ATOM 0 HA THR A 12 -2.411 3.763 -8.745 1.00 0.00 H new ATOM 0 HB THR A 12 -0.761 2.202 -7.942 1.00 0.00 H new ATOM 0 HG1 THR A 12 -0.324 0.925 -10.368 1.00 0.00 H new ATOM 0 HG21 THR A 12 -1.786 0.044 -8.600 1.00 0.00 H new ATOM 0 HG22 THR A 12 -3.029 1.287 -8.326 1.00 0.00 H new ATOM 0 HG23 THR A 12 -2.570 0.838 -9.986 1.00 0.00 H new ATOM 316 N ALA A 13 0.249 4.181 -10.686 1.00 0.00 N ATOM 317 CA ALA A 13 1.361 5.140 -10.962 1.00 0.00 C ATOM 318 C ALA A 13 0.800 6.380 -11.613 1.00 0.00 C ATOM 319 O ALA A 13 -0.325 6.406 -12.078 1.00 0.00 O ATOM 320 CB ALA A 13 2.390 4.508 -11.899 1.00 0.00 C ATOM 0 H ALA A 13 0.201 3.381 -11.318 1.00 0.00 H new ATOM 0 HA ALA A 13 1.846 5.396 -10.020 1.00 0.00 H new ATOM 0 HB1 ALA A 13 3.193 5.219 -12.090 1.00 0.00 H new ATOM 0 HB2 ALA A 13 2.802 3.611 -11.436 1.00 0.00 H new ATOM 0 HB3 ALA A 13 1.910 4.242 -12.841 1.00 0.00 H new ATOM 326 N ASP A 14 1.583 7.402 -11.640 1.00 0.00 N ATOM 327 CA ASP A 14 1.151 8.677 -12.247 1.00 0.00 C ATOM 328 C ASP A 14 0.883 8.488 -13.747 1.00 0.00 C ATOM 329 O ASP A 14 0.211 9.291 -14.368 1.00 0.00 O ATOM 330 CB ASP A 14 2.259 9.671 -12.032 1.00 0.00 C ATOM 331 CG ASP A 14 1.684 11.089 -11.975 1.00 0.00 C ATOM 332 OD1 ASP A 14 0.750 11.298 -11.217 1.00 0.00 O ATOM 333 OD2 ASP A 14 2.187 11.941 -12.689 1.00 0.00 O ATOM 0 H ASP A 14 2.529 7.411 -11.258 1.00 0.00 H new ATOM 0 HA ASP A 14 0.226 9.029 -11.790 1.00 0.00 H new ATOM 0 HB2 ASP A 14 2.786 9.446 -11.105 1.00 0.00 H new ATOM 0 HB3 ASP A 14 2.987 9.597 -12.839 1.00 0.00 H new ATOM 338 N ASP A 15 1.398 7.426 -14.329 1.00 0.00 N ATOM 339 CA ASP A 15 1.178 7.172 -15.758 1.00 0.00 C ATOM 340 C ASP A 15 0.563 5.783 -15.931 1.00 0.00 C ATOM 341 O ASP A 15 0.869 5.068 -16.874 1.00 0.00 O ATOM 342 CB ASP A 15 2.512 7.245 -16.504 1.00 0.00 C ATOM 343 CG ASP A 15 2.861 8.708 -16.780 1.00 0.00 C ATOM 344 OD1 ASP A 15 2.083 9.366 -17.452 1.00 0.00 O ATOM 345 OD2 ASP A 15 3.900 9.148 -16.314 1.00 0.00 O ATOM 0 H ASP A 15 1.966 6.726 -13.852 1.00 0.00 H new ATOM 0 HA ASP A 15 0.501 7.923 -16.165 1.00 0.00 H new ATOM 0 HB2 ASP A 15 3.299 6.778 -15.911 1.00 0.00 H new ATOM 0 HB3 ASP A 15 2.448 6.692 -17.441 1.00 0.00 H new ATOM 350 N GLU A 16 -0.302 5.388 -15.022 1.00 0.00 N ATOM 351 CA GLU A 16 -0.931 4.050 -15.122 1.00 0.00 C ATOM 352 C GLU A 16 -2.329 4.188 -15.730 1.00 0.00 C ATOM 353 O GLU A 16 -2.808 5.284 -15.960 1.00 0.00 O ATOM 354 CB GLU A 16 -1.007 3.436 -13.722 1.00 0.00 C ATOM 355 CG GLU A 16 -1.191 1.921 -13.830 1.00 0.00 C ATOM 356 CD GLU A 16 -0.303 1.216 -12.803 1.00 0.00 C ATOM 357 OE1 GLU A 16 0.906 1.274 -12.954 1.00 0.00 O ATOM 358 OE2 GLU A 16 -0.848 0.629 -11.886 1.00 0.00 O ATOM 0 H GLU A 16 -0.593 5.944 -14.218 1.00 0.00 H new ATOM 0 HA GLU A 16 -0.339 3.399 -15.765 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -0.097 3.662 -13.166 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -1.837 3.874 -13.167 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -2.236 1.660 -13.661 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -0.937 1.585 -14.835 1.00 0.00 H new ATOM 365 N LEU A 17 -2.973 3.084 -16.018 1.00 0.00 N ATOM 366 CA LEU A 17 -4.325 3.138 -16.642 1.00 0.00 C ATOM 367 C LEU A 17 -5.339 2.365 -15.792 1.00 0.00 C ATOM 368 O LEU A 17 -5.024 1.364 -15.179 1.00 0.00 O ATOM 369 CB LEU A 17 -4.231 2.528 -18.053 1.00 0.00 C ATOM 370 CG LEU A 17 -5.599 2.550 -18.746 1.00 0.00 C ATOM 371 CD1 LEU A 17 -6.055 4.000 -18.954 1.00 0.00 C ATOM 372 CD2 LEU A 17 -5.492 1.839 -20.110 1.00 0.00 C ATOM 0 H LEU A 17 -2.616 2.144 -15.846 1.00 0.00 H new ATOM 0 HA LEU A 17 -4.664 4.172 -16.705 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -3.508 3.085 -18.648 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -3.867 1.502 -17.988 1.00 0.00 H new ATOM 0 HG LEU A 17 -6.329 2.034 -18.122 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -7.027 4.009 -19.447 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -6.133 4.499 -17.988 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -5.329 4.524 -19.575 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -6.463 1.853 -20.605 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -4.760 2.354 -20.732 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -5.177 0.807 -19.958 1.00 0.00 H new ATOM 384 N SER A 18 -6.562 2.845 -15.755 1.00 0.00 N ATOM 385 CA SER A 18 -7.618 2.182 -14.958 1.00 0.00 C ATOM 386 C SER A 18 -8.529 1.355 -15.871 1.00 0.00 C ATOM 387 O SER A 18 -8.636 1.610 -17.056 1.00 0.00 O ATOM 388 CB SER A 18 -8.440 3.242 -14.280 1.00 0.00 C ATOM 389 OG SER A 18 -7.613 4.340 -13.920 1.00 0.00 O ATOM 0 H SER A 18 -6.866 3.681 -16.254 1.00 0.00 H new ATOM 0 HA SER A 18 -7.158 1.522 -14.223 1.00 0.00 H new ATOM 0 HB2 SER A 18 -9.236 3.578 -14.945 1.00 0.00 H new ATOM 0 HB3 SER A 18 -8.919 2.830 -13.392 1.00 0.00 H new ATOM 0 HG SER A 18 -8.155 5.028 -13.480 1.00 0.00 H new ATOM 395 N PHE A 19 -9.201 0.378 -15.316 1.00 0.00 N ATOM 396 CA PHE A 19 -10.129 -0.465 -16.125 1.00 0.00 C ATOM 397 C PHE A 19 -10.880 -1.421 -15.189 1.00 0.00 C ATOM 398 O PHE A 19 -10.492 -1.612 -14.061 1.00 0.00 O ATOM 399 CB PHE A 19 -9.338 -1.255 -17.184 1.00 0.00 C ATOM 400 CG PHE A 19 -8.354 -2.200 -16.527 1.00 0.00 C ATOM 401 CD1 PHE A 19 -8.801 -3.412 -15.994 1.00 0.00 C ATOM 402 CD2 PHE A 19 -6.996 -1.864 -16.467 1.00 0.00 C ATOM 403 CE1 PHE A 19 -7.889 -4.292 -15.399 1.00 0.00 C ATOM 404 CE2 PHE A 19 -6.084 -2.743 -15.871 1.00 0.00 C ATOM 405 CZ PHE A 19 -6.530 -3.957 -15.338 1.00 0.00 C ATOM 0 H PHE A 19 -9.145 0.128 -14.329 1.00 0.00 H new ATOM 0 HA PHE A 19 -10.848 0.171 -16.642 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -10.027 -1.820 -17.812 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -8.805 -0.564 -17.837 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -9.849 -3.670 -16.041 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -6.652 -0.927 -16.880 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -8.233 -5.229 -14.987 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -5.037 -2.484 -15.823 1.00 0.00 H new ATOM 0 HZ PHE A 19 -5.827 -4.636 -14.879 1.00 0.00 H new ATOM 415 N LYS A 20 -11.957 -2.006 -15.647 1.00 0.00 N ATOM 416 CA LYS A 20 -12.742 -2.939 -14.778 1.00 0.00 C ATOM 417 C LYS A 20 -12.703 -4.352 -15.336 1.00 0.00 C ATOM 418 O LYS A 20 -12.070 -4.628 -16.338 1.00 0.00 O ATOM 419 CB LYS A 20 -14.190 -2.477 -14.725 1.00 0.00 C ATOM 420 CG LYS A 20 -14.242 -1.047 -14.216 1.00 0.00 C ATOM 421 CD LYS A 20 -14.019 -1.037 -12.703 1.00 0.00 C ATOM 422 CE LYS A 20 -13.409 0.301 -12.287 1.00 0.00 C ATOM 423 NZ LYS A 20 -13.716 0.560 -10.852 1.00 0.00 N ATOM 0 H LYS A 20 -12.329 -1.878 -16.588 1.00 0.00 H new ATOM 0 HA LYS A 20 -12.302 -2.936 -13.781 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -14.640 -2.539 -15.716 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -14.768 -3.129 -14.071 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -13.480 -0.445 -14.711 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -15.206 -0.599 -14.455 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -14.965 -1.195 -12.184 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -13.358 -1.855 -12.417 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -12.330 0.285 -12.442 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -13.809 1.104 -12.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -13.302 1.470 -10.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -14.747 0.592 -10.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -13.314 -0.201 -10.268 1.00 0.00 H new ATOM 437 N ARG A 21 -13.388 -5.247 -14.681 1.00 0.00 N ATOM 438 CA ARG A 21 -13.433 -6.658 -15.128 1.00 0.00 C ATOM 439 C ARG A 21 -14.277 -6.771 -16.397 1.00 0.00 C ATOM 440 O ARG A 21 -15.480 -6.584 -16.370 1.00 0.00 O ATOM 441 CB ARG A 21 -14.074 -7.473 -14.027 1.00 0.00 C ATOM 442 CG ARG A 21 -13.956 -8.954 -14.332 1.00 0.00 C ATOM 443 CD ARG A 21 -14.286 -9.723 -13.065 1.00 0.00 C ATOM 444 NE ARG A 21 -13.644 -11.067 -13.106 1.00 0.00 N ATOM 445 CZ ARG A 21 -13.794 -11.892 -12.104 1.00 0.00 C ATOM 446 NH1 ARG A 21 -13.140 -11.694 -10.992 1.00 0.00 N ATOM 447 NH2 ARG A 21 -14.597 -12.914 -12.215 1.00 0.00 N ATOM 0 H ARG A 21 -13.928 -5.051 -13.838 1.00 0.00 H new ATOM 0 HA ARG A 21 -12.427 -7.020 -15.340 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -13.593 -7.252 -13.074 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -15.124 -7.198 -13.926 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -14.638 -9.233 -15.135 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -12.948 -9.194 -14.672 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -13.937 -9.170 -12.193 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -15.366 -9.829 -12.965 1.00 0.00 H new ATOM 0 HE ARG A 21 -13.088 -11.343 -13.915 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -12.512 -10.895 -10.905 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -13.257 -12.338 -10.210 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -15.108 -13.069 -13.084 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -14.714 -13.558 -11.433 1.00 0.00 H new ATOM 461 N GLY A 22 -13.656 -7.072 -17.507 1.00 0.00 N ATOM 462 CA GLY A 22 -14.416 -7.195 -18.788 1.00 0.00 C ATOM 463 C GLY A 22 -14.198 -5.942 -19.651 1.00 0.00 C ATOM 464 O GLY A 22 -14.691 -5.857 -20.763 1.00 0.00 O ATOM 0 H GLY A 22 -12.653 -7.239 -17.583 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -14.089 -8.082 -19.331 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -15.478 -7.323 -18.579 1.00 0.00 H new ATOM 468 N ASP A 23 -13.457 -4.969 -19.153 1.00 0.00 N ATOM 469 CA ASP A 23 -13.202 -3.769 -19.904 1.00 0.00 C ATOM 470 C ASP A 23 -11.968 -4.001 -20.743 1.00 0.00 C ATOM 471 O ASP A 23 -10.862 -3.694 -20.333 1.00 0.00 O ATOM 472 CB ASP A 23 -12.950 -2.641 -18.929 1.00 0.00 C ATOM 473 CG ASP A 23 -14.224 -1.810 -18.751 1.00 0.00 C ATOM 474 OD1 ASP A 23 -15.257 -2.395 -18.470 1.00 0.00 O ATOM 475 OD2 ASP A 23 -14.144 -0.601 -18.899 1.00 0.00 O ATOM 0 H ASP A 23 -13.024 -4.993 -18.230 1.00 0.00 H new ATOM 0 HA ASP A 23 -14.047 -3.516 -20.544 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -12.631 -3.044 -17.968 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -12.141 -2.008 -19.293 1.00 0.00 H new ATOM 480 N ILE A 24 -12.136 -4.557 -21.899 1.00 0.00 N ATOM 481 CA ILE A 24 -10.958 -4.834 -22.760 1.00 0.00 C ATOM 482 C ILE A 24 -10.348 -3.509 -23.201 1.00 0.00 C ATOM 483 O ILE A 24 -11.019 -2.630 -23.705 1.00 0.00 O ATOM 484 CB ILE A 24 -11.349 -5.699 -23.961 1.00 0.00 C ATOM 485 CG1 ILE A 24 -12.343 -6.808 -23.488 1.00 0.00 C ATOM 486 CG2 ILE A 24 -10.065 -6.326 -24.518 1.00 0.00 C ATOM 487 CD1 ILE A 24 -12.407 -7.965 -24.487 1.00 0.00 C ATOM 0 H ILE A 24 -13.037 -4.834 -22.289 1.00 0.00 H new ATOM 0 HA ILE A 24 -10.215 -5.396 -22.194 1.00 0.00 H new ATOM 0 HB ILE A 24 -11.837 -5.107 -24.735 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -12.033 -7.184 -22.513 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -13.337 -6.378 -23.363 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -10.308 -6.951 -25.377 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -9.379 -5.537 -24.825 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -9.594 -6.937 -23.747 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -13.108 -8.718 -24.127 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -12.741 -7.592 -25.455 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -11.418 -8.410 -24.592 1.00 0.00 H new ATOM 499 N LEU A 25 -9.081 -3.355 -22.954 1.00 0.00 N ATOM 500 CA LEU A 25 -8.380 -2.080 -23.283 1.00 0.00 C ATOM 501 C LEU A 25 -7.791 -2.130 -24.693 1.00 0.00 C ATOM 502 O LEU A 25 -7.797 -3.164 -25.344 1.00 0.00 O ATOM 503 CB LEU A 25 -7.269 -1.868 -22.252 1.00 0.00 C ATOM 504 CG LEU A 25 -7.880 -1.923 -20.842 1.00 0.00 C ATOM 505 CD1 LEU A 25 -7.772 -3.346 -20.271 1.00 0.00 C ATOM 506 CD2 LEU A 25 -7.137 -0.954 -19.925 1.00 0.00 C ATOM 0 H LEU A 25 -8.488 -4.069 -22.531 1.00 0.00 H new ATOM 0 HA LEU A 25 -9.089 -1.252 -23.252 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -6.503 -2.635 -22.361 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -6.782 -0.906 -22.415 1.00 0.00 H new ATOM 0 HG LEU A 25 -8.931 -1.642 -20.903 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -8.208 -3.371 -19.272 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -8.308 -4.040 -20.919 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -6.723 -3.637 -20.216 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -7.571 -0.994 -18.926 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -6.085 -1.234 -19.875 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -7.224 0.059 -20.319 1.00 0.00 H new ATOM 518 N LYS A 26 -7.288 -1.007 -25.175 1.00 0.00 N ATOM 519 CA LYS A 26 -6.707 -0.979 -26.570 1.00 0.00 C ATOM 520 C LYS A 26 -5.184 -0.845 -26.503 1.00 0.00 C ATOM 521 O LYS A 26 -4.659 0.236 -26.353 1.00 0.00 O ATOM 522 CB LYS A 26 -7.287 0.219 -27.330 1.00 0.00 C ATOM 523 CG LYS A 26 -6.921 0.122 -28.820 1.00 0.00 C ATOM 524 CD LYS A 26 -5.822 1.136 -29.150 1.00 0.00 C ATOM 525 CE LYS A 26 -6.445 2.518 -29.355 1.00 0.00 C ATOM 526 NZ LYS A 26 -7.132 2.561 -30.677 1.00 0.00 N ATOM 0 H LYS A 26 -7.254 -0.120 -24.672 1.00 0.00 H new ATOM 0 HA LYS A 26 -6.960 -1.907 -27.083 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -8.371 0.244 -27.214 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -6.900 1.148 -26.911 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -6.581 -0.886 -29.056 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -7.801 0.313 -29.434 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -5.091 1.171 -28.342 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -5.288 0.829 -30.049 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -7.156 2.731 -28.556 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -5.674 3.287 -29.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -7.241 3.550 -30.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -6.565 2.045 -31.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -8.070 2.118 -30.596 1.00 0.00 H new ATOM 540 N VAL A 27 -4.468 -1.940 -26.614 1.00 0.00 N ATOM 541 CA VAL A 27 -2.976 -1.875 -26.541 1.00 0.00 C ATOM 542 C VAL A 27 -2.422 -0.976 -27.647 1.00 0.00 C ATOM 543 O VAL A 27 -2.365 -1.351 -28.803 1.00 0.00 O ATOM 544 CB VAL A 27 -2.386 -3.287 -26.661 1.00 0.00 C ATOM 545 CG1 VAL A 27 -0.860 -3.228 -26.498 1.00 0.00 C ATOM 546 CG2 VAL A 27 -2.974 -4.175 -25.558 1.00 0.00 C ATOM 0 H VAL A 27 -4.854 -2.874 -26.752 1.00 0.00 H new ATOM 0 HA VAL A 27 -2.692 -1.450 -25.578 1.00 0.00 H new ATOM 0 HB VAL A 27 -2.631 -3.698 -27.640 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -0.446 -4.233 -26.584 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -0.435 -2.593 -27.275 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -0.614 -2.817 -25.519 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.558 -5.179 -25.639 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.725 -3.757 -24.583 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -4.058 -4.221 -25.667 1.00 0.00 H new ATOM 556 N LEU A 28 -1.989 0.204 -27.282 1.00 0.00 N ATOM 557 CA LEU A 28 -1.405 1.142 -28.271 1.00 0.00 C ATOM 558 C LEU A 28 0.074 0.808 -28.419 1.00 0.00 C ATOM 559 O LEU A 28 0.674 1.068 -29.448 1.00 0.00 O ATOM 560 CB LEU A 28 -1.508 2.625 -27.800 1.00 0.00 C ATOM 561 CG LEU A 28 -2.731 2.868 -26.877 1.00 0.00 C ATOM 562 CD1 LEU A 28 -2.241 3.269 -25.467 1.00 0.00 C ATOM 563 CD2 LEU A 28 -3.600 4.002 -27.458 1.00 0.00 C ATOM 0 H LEU A 28 -2.019 0.556 -26.325 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.954 1.035 -29.207 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -0.596 2.899 -27.270 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.579 3.276 -28.671 1.00 0.00 H new ATOM 0 HG LEU A 28 -3.322 1.954 -26.812 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -3.100 3.440 -24.818 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.628 2.468 -25.054 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -1.649 4.182 -25.533 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -4.459 4.172 -26.808 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -3.009 4.916 -27.524 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -3.947 3.721 -28.452 1.00 0.00 H new ATOM 575 N ASN A 29 0.685 0.248 -27.384 1.00 0.00 N ATOM 576 CA ASN A 29 2.140 -0.070 -27.480 1.00 0.00 C ATOM 577 C ASN A 29 2.480 -1.352 -26.716 1.00 0.00 C ATOM 578 O ASN A 29 2.066 -1.557 -25.584 1.00 0.00 O ATOM 579 CB ASN A 29 2.954 1.090 -26.907 1.00 0.00 C ATOM 580 CG ASN A 29 4.386 1.026 -27.439 1.00 0.00 C ATOM 581 OD1 ASN A 29 5.312 0.774 -26.694 1.00 0.00 O ATOM 582 ND2 ASN A 29 4.609 1.250 -28.704 1.00 0.00 N ATOM 0 H ASN A 29 0.239 0.006 -26.499 1.00 0.00 H new ATOM 0 HA ASN A 29 2.387 -0.221 -28.531 1.00 0.00 H new ATOM 0 HB2 ASN A 29 2.495 2.040 -27.182 1.00 0.00 H new ATOM 0 HB3 ASN A 29 2.958 1.042 -25.818 1.00 0.00 H new ATOM 0 HD21 ASN A 29 5.561 1.214 -29.068 1.00 0.00 H new ATOM 0 HD22 ASN A 29 3.831 1.462 -29.329 1.00 0.00 H new ATOM 589 N GLU A 30 3.263 -2.199 -27.334 1.00 0.00 N ATOM 590 CA GLU A 30 3.693 -3.465 -26.684 1.00 0.00 C ATOM 591 C GLU A 30 5.107 -3.274 -26.173 1.00 0.00 C ATOM 592 O GLU A 30 5.609 -2.167 -26.121 1.00 0.00 O ATOM 593 CB GLU A 30 3.668 -4.604 -27.709 1.00 0.00 C ATOM 594 CG GLU A 30 2.278 -4.689 -28.345 1.00 0.00 C ATOM 595 CD GLU A 30 2.177 -5.967 -29.182 1.00 0.00 C ATOM 596 OE1 GLU A 30 2.839 -6.036 -30.204 1.00 0.00 O ATOM 597 OE2 GLU A 30 1.437 -6.853 -28.787 1.00 0.00 O ATOM 0 H GLU A 30 3.626 -2.061 -28.277 1.00 0.00 H new ATOM 0 HA GLU A 30 3.022 -3.716 -25.862 1.00 0.00 H new ATOM 0 HB2 GLU A 30 4.421 -4.432 -28.478 1.00 0.00 H new ATOM 0 HB3 GLU A 30 3.916 -5.549 -27.225 1.00 0.00 H new ATOM 0 HG2 GLU A 30 1.511 -4.687 -27.570 1.00 0.00 H new ATOM 0 HG3 GLU A 30 2.099 -3.816 -28.972 1.00 0.00 H new ATOM 604 N GLU A 31 5.754 -4.336 -25.790 1.00 0.00 N ATOM 605 CA GLU A 31 7.164 -4.225 -25.266 1.00 0.00 C ATOM 606 C GLU A 31 7.132 -3.519 -23.923 1.00 0.00 C ATOM 607 O GLU A 31 6.102 -3.441 -23.283 1.00 0.00 O ATOM 608 CB GLU A 31 8.050 -3.438 -26.263 1.00 0.00 C ATOM 609 CG GLU A 31 7.807 -3.948 -27.688 1.00 0.00 C ATOM 610 CD GLU A 31 8.960 -3.511 -28.594 1.00 0.00 C ATOM 611 OE1 GLU A 31 9.245 -2.325 -28.626 1.00 0.00 O ATOM 612 OE2 GLU A 31 9.539 -4.369 -29.240 1.00 0.00 O ATOM 0 H GLU A 31 5.376 -5.283 -25.813 1.00 0.00 H new ATOM 0 HA GLU A 31 7.589 -5.222 -25.148 1.00 0.00 H new ATOM 0 HB2 GLU A 31 7.822 -2.374 -26.204 1.00 0.00 H new ATOM 0 HB3 GLU A 31 9.101 -3.554 -26.000 1.00 0.00 H new ATOM 0 HG2 GLU A 31 7.724 -5.035 -27.687 1.00 0.00 H new ATOM 0 HG3 GLU A 31 6.864 -3.557 -28.069 1.00 0.00 H new ATOM 619 N CYS A 32 8.261 -3.026 -23.479 1.00 0.00 N ATOM 620 CA CYS A 32 8.337 -2.326 -22.142 1.00 0.00 C ATOM 621 C CYS A 32 8.347 -3.383 -21.046 1.00 0.00 C ATOM 622 O CYS A 32 8.720 -4.512 -21.287 1.00 0.00 O ATOM 623 CB CYS A 32 7.136 -1.350 -21.961 1.00 0.00 C ATOM 624 SG CYS A 32 7.700 0.185 -21.175 1.00 0.00 S ATOM 0 H CYS A 32 9.146 -3.075 -23.984 1.00 0.00 H new ATOM 0 HA CYS A 32 9.249 -1.731 -22.087 1.00 0.00 H new ATOM 0 HB2 CYS A 32 6.687 -1.129 -22.929 1.00 0.00 H new ATOM 0 HB3 CYS A 32 6.364 -1.819 -21.351 1.00 0.00 H new ATOM 0 HG CYS A 32 6.959 1.175 -21.576 1.00 0.00 H new ATOM 630 N ASP A 33 7.972 -3.001 -19.841 1.00 0.00 N ATOM 631 CA ASP A 33 7.952 -3.932 -18.643 1.00 0.00 C ATOM 632 C ASP A 33 7.672 -5.373 -19.021 1.00 0.00 C ATOM 633 O ASP A 33 7.011 -5.663 -20.003 1.00 0.00 O ATOM 634 CB ASP A 33 6.875 -3.473 -17.667 1.00 0.00 C ATOM 635 CG ASP A 33 7.168 -4.033 -16.275 1.00 0.00 C ATOM 636 OD1 ASP A 33 7.089 -5.240 -16.114 1.00 0.00 O ATOM 637 OD2 ASP A 33 7.463 -3.245 -15.392 1.00 0.00 O ATOM 0 H ASP A 33 7.668 -2.051 -19.627 1.00 0.00 H new ATOM 0 HA ASP A 33 8.944 -3.891 -18.193 1.00 0.00 H new ATOM 0 HB2 ASP A 33 6.843 -2.384 -17.632 1.00 0.00 H new ATOM 0 HB3 ASP A 33 5.896 -3.810 -18.006 1.00 0.00 H new ATOM 642 N GLN A 34 8.183 -6.279 -18.236 1.00 0.00 N ATOM 643 CA GLN A 34 7.980 -7.706 -18.536 1.00 0.00 C ATOM 644 C GLN A 34 6.619 -8.202 -18.023 1.00 0.00 C ATOM 645 O GLN A 34 6.373 -9.394 -17.977 1.00 0.00 O ATOM 646 CB GLN A 34 9.104 -8.530 -17.896 1.00 0.00 C ATOM 647 CG GLN A 34 10.470 -7.987 -18.346 1.00 0.00 C ATOM 648 CD GLN A 34 11.086 -8.922 -19.394 1.00 0.00 C ATOM 649 OE1 GLN A 34 10.786 -10.098 -19.430 1.00 0.00 O ATOM 650 NE2 GLN A 34 11.944 -8.442 -20.252 1.00 0.00 N ATOM 0 H GLN A 34 8.733 -6.084 -17.399 1.00 0.00 H new ATOM 0 HA GLN A 34 7.997 -7.830 -19.619 1.00 0.00 H new ATOM 0 HB2 GLN A 34 9.025 -8.487 -16.810 1.00 0.00 H new ATOM 0 HB3 GLN A 34 9.007 -9.578 -18.181 1.00 0.00 H new ATOM 0 HG2 GLN A 34 10.354 -6.987 -18.763 1.00 0.00 H new ATOM 0 HG3 GLN A 34 11.137 -7.899 -17.488 1.00 0.00 H new ATOM 0 HE21 GLN A 34 12.197 -7.454 -20.222 1.00 0.00 H new ATOM 0 HE22 GLN A 34 12.362 -9.055 -20.952 1.00 0.00 H new ATOM 659 N ASN A 35 5.733 -7.310 -17.642 1.00 0.00 N ATOM 660 CA ASN A 35 4.399 -7.758 -17.144 1.00 0.00 C ATOM 661 C ASN A 35 3.350 -6.643 -17.225 1.00 0.00 C ATOM 662 O ASN A 35 2.327 -6.738 -16.603 1.00 0.00 O ATOM 663 CB ASN A 35 4.525 -8.210 -15.705 1.00 0.00 C ATOM 664 CG ASN A 35 4.852 -9.704 -15.661 1.00 0.00 C ATOM 665 OD1 ASN A 35 4.150 -10.509 -16.241 1.00 0.00 O ATOM 666 ND2 ASN A 35 5.893 -10.112 -14.991 1.00 0.00 N ATOM 0 H ASN A 35 5.877 -6.300 -17.655 1.00 0.00 H new ATOM 0 HA ASN A 35 4.069 -8.579 -17.780 1.00 0.00 H new ATOM 0 HB2 ASN A 35 5.307 -7.642 -15.202 1.00 0.00 H new ATOM 0 HB3 ASN A 35 3.596 -8.015 -15.170 1.00 0.00 H new ATOM 0 HD21 ASN A 35 6.118 -11.106 -14.954 1.00 0.00 H new ATOM 0 HD22 ASN A 35 6.483 -9.437 -14.504 1.00 0.00 H new ATOM 673 N TRP A 36 3.589 -5.609 -17.992 1.00 0.00 N ATOM 674 CA TRP A 36 2.566 -4.499 -18.134 1.00 0.00 C ATOM 675 C TRP A 36 2.579 -3.999 -19.600 1.00 0.00 C ATOM 676 O TRP A 36 3.623 -3.867 -20.210 1.00 0.00 O ATOM 677 CB TRP A 36 2.871 -3.287 -17.213 1.00 0.00 C ATOM 678 CG TRP A 36 3.087 -3.687 -15.768 1.00 0.00 C ATOM 679 CD1 TRP A 36 4.056 -4.525 -15.319 1.00 0.00 C ATOM 680 CD2 TRP A 36 2.370 -3.225 -14.565 1.00 0.00 C ATOM 681 NE1 TRP A 36 3.965 -4.621 -13.943 1.00 0.00 N ATOM 682 CE2 TRP A 36 2.960 -3.838 -13.433 1.00 0.00 C ATOM 683 CE3 TRP A 36 1.276 -2.347 -14.338 1.00 0.00 C ATOM 684 CZ2 TRP A 36 2.502 -3.595 -12.139 1.00 0.00 C ATOM 685 CZ3 TRP A 36 0.821 -2.105 -13.024 1.00 0.00 C ATOM 686 CH2 TRP A 36 1.436 -2.724 -11.934 1.00 0.00 C ATOM 0 H TRP A 36 4.445 -5.475 -18.530 1.00 0.00 H new ATOM 0 HA TRP A 36 1.597 -4.908 -17.848 1.00 0.00 H new ATOM 0 HB2 TRP A 36 3.759 -2.773 -17.579 1.00 0.00 H new ATOM 0 HB3 TRP A 36 2.046 -2.577 -17.269 1.00 0.00 H new ATOM 0 HD1 TRP A 36 4.781 -5.034 -15.937 1.00 0.00 H new ATOM 0 HE1 TRP A 36 4.575 -5.207 -13.372 1.00 0.00 H new ATOM 0 HE3 TRP A 36 0.791 -1.863 -15.173 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 2.973 -4.081 -11.298 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 -0.010 -1.435 -12.860 1.00 0.00 H new ATOM 0 HH2 TRP A 36 1.085 -2.527 -10.932 1.00 0.00 H new ATOM 697 N TYR A 37 1.423 -3.715 -20.157 1.00 0.00 N ATOM 698 CA TYR A 37 1.340 -3.219 -21.571 1.00 0.00 C ATOM 699 C TYR A 37 1.011 -1.726 -21.579 1.00 0.00 C ATOM 700 O TYR A 37 0.805 -1.123 -20.563 1.00 0.00 O ATOM 701 CB TYR A 37 0.159 -3.882 -22.285 1.00 0.00 C ATOM 702 CG TYR A 37 0.316 -5.373 -22.411 1.00 0.00 C ATOM 703 CD1 TYR A 37 1.519 -5.936 -22.845 1.00 0.00 C ATOM 704 CD2 TYR A 37 -0.781 -6.194 -22.120 1.00 0.00 C ATOM 705 CE1 TYR A 37 1.626 -7.329 -22.984 1.00 0.00 C ATOM 706 CE2 TYR A 37 -0.684 -7.575 -22.264 1.00 0.00 C ATOM 707 CZ TYR A 37 0.524 -8.151 -22.696 1.00 0.00 C ATOM 708 OH TYR A 37 0.627 -9.524 -22.854 1.00 0.00 O ATOM 0 H TYR A 37 0.523 -3.807 -19.686 1.00 0.00 H new ATOM 0 HA TYR A 37 2.293 -3.437 -22.053 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -0.759 -3.663 -21.740 1.00 0.00 H new ATOM 0 HB3 TYR A 37 0.051 -3.447 -23.279 1.00 0.00 H new ATOM 0 HD1 TYR A 37 2.363 -5.302 -23.073 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -1.707 -5.753 -21.782 1.00 0.00 H new ATOM 0 HE1 TYR A 37 2.556 -7.769 -23.313 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -1.535 -8.203 -22.044 1.00 0.00 H new ATOM 0 HH TYR A 37 -0.224 -9.946 -22.611 1.00 0.00 H new ATOM 718 N LYS A 38 0.872 -1.164 -22.752 1.00 0.00 N ATOM 719 CA LYS A 38 0.447 0.253 -22.880 1.00 0.00 C ATOM 720 C LYS A 38 -0.872 0.200 -23.643 1.00 0.00 C ATOM 721 O LYS A 38 -0.947 -0.437 -24.674 1.00 0.00 O ATOM 722 CB LYS A 38 1.471 1.052 -23.682 1.00 0.00 C ATOM 723 CG LYS A 38 1.254 2.545 -23.420 1.00 0.00 C ATOM 724 CD LYS A 38 1.338 3.329 -24.740 1.00 0.00 C ATOM 725 CE LYS A 38 2.391 4.430 -24.615 1.00 0.00 C ATOM 726 NZ LYS A 38 2.371 5.284 -25.836 1.00 0.00 N ATOM 0 H LYS A 38 1.039 -1.639 -23.639 1.00 0.00 H new ATOM 0 HA LYS A 38 0.352 0.735 -21.907 1.00 0.00 H new ATOM 0 HB2 LYS A 38 2.482 0.763 -23.396 1.00 0.00 H new ATOM 0 HB3 LYS A 38 1.367 0.837 -24.746 1.00 0.00 H new ATOM 0 HG2 LYS A 38 0.281 2.703 -22.955 1.00 0.00 H new ATOM 0 HG3 LYS A 38 2.005 2.913 -22.721 1.00 0.00 H new ATOM 0 HD2 LYS A 38 1.595 2.657 -25.558 1.00 0.00 H new ATOM 0 HD3 LYS A 38 0.368 3.765 -24.978 1.00 0.00 H new ATOM 0 HE2 LYS A 38 2.193 5.037 -23.731 1.00 0.00 H new ATOM 0 HE3 LYS A 38 3.379 3.989 -24.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 3.088 6.032 -25.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 2.580 4.701 -26.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 1.431 5.716 -25.942 1.00 0.00 H new ATOM 740 N ALA A 39 -1.923 0.805 -23.140 1.00 0.00 N ATOM 741 CA ALA A 39 -3.238 0.707 -23.858 1.00 0.00 C ATOM 742 C ALA A 39 -4.130 1.849 -23.538 1.00 0.00 C ATOM 743 O ALA A 39 -3.732 2.805 -22.908 1.00 0.00 O ATOM 744 CB ALA A 39 -3.903 -0.599 -23.485 1.00 0.00 C ATOM 0 H ALA A 39 -1.931 1.353 -22.280 1.00 0.00 H new ATOM 0 HA ALA A 39 -3.050 0.740 -24.931 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -4.860 -0.681 -24.001 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -3.261 -1.430 -23.777 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -4.068 -0.629 -22.408 1.00 0.00 H new ATOM 750 N GLU A 40 -5.335 1.791 -24.038 1.00 0.00 N ATOM 751 CA GLU A 40 -6.238 2.910 -23.835 1.00 0.00 C ATOM 752 C GLU A 40 -7.709 2.490 -23.862 1.00 0.00 C ATOM 753 O GLU A 40 -8.177 1.791 -24.737 1.00 0.00 O ATOM 754 CB GLU A 40 -5.897 3.953 -24.918 1.00 0.00 C ATOM 755 CG GLU A 40 -7.024 4.134 -25.961 1.00 0.00 C ATOM 756 CD GLU A 40 -6.656 5.263 -26.926 1.00 0.00 C ATOM 757 OE1 GLU A 40 -6.577 6.395 -26.481 1.00 0.00 O ATOM 758 OE2 GLU A 40 -6.461 4.975 -28.097 1.00 0.00 O ATOM 0 H GLU A 40 -5.713 1.010 -24.574 1.00 0.00 H new ATOM 0 HA GLU A 40 -6.101 3.336 -22.841 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -5.695 4.912 -24.440 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.982 3.652 -25.429 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -7.175 3.206 -26.512 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -7.964 4.363 -25.459 1.00 0.00 H new ATOM 765 N LEU A 41 -8.416 2.977 -22.917 1.00 0.00 N ATOM 766 CA LEU A 41 -9.878 2.702 -22.816 1.00 0.00 C ATOM 767 C LEU A 41 -10.686 3.856 -23.304 1.00 0.00 C ATOM 768 O LEU A 41 -10.974 4.800 -22.598 1.00 0.00 O ATOM 769 CB LEU A 41 -10.277 2.376 -21.395 1.00 0.00 C ATOM 770 CG LEU A 41 -10.167 0.894 -21.204 1.00 0.00 C ATOM 771 CD1 LEU A 41 -10.013 0.594 -19.718 1.00 0.00 C ATOM 772 CD2 LEU A 41 -11.436 0.242 -21.749 1.00 0.00 C ATOM 0 H LEU A 41 -8.047 3.575 -22.178 1.00 0.00 H new ATOM 0 HA LEU A 41 -10.081 1.839 -23.450 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -9.631 2.899 -20.690 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -11.296 2.709 -21.201 1.00 0.00 H new ATOM 0 HG LEU A 41 -9.300 0.500 -21.734 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -9.932 -0.483 -19.571 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -9.114 1.080 -19.340 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -10.883 0.970 -19.179 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -11.375 -0.838 -21.619 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -12.302 0.624 -21.209 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -11.538 0.474 -22.809 1.00 0.00 H new ATOM 784 N ASN A 42 -11.099 3.734 -24.506 1.00 0.00 N ATOM 785 CA ASN A 42 -11.972 4.754 -25.150 1.00 0.00 C ATOM 786 C ASN A 42 -11.560 6.222 -24.855 1.00 0.00 C ATOM 787 O ASN A 42 -12.377 7.119 -24.978 1.00 0.00 O ATOM 788 CB ASN A 42 -13.376 4.549 -24.631 1.00 0.00 C ATOM 789 CG ASN A 42 -14.129 3.570 -25.532 1.00 0.00 C ATOM 790 OD1 ASN A 42 -15.223 3.853 -25.975 1.00 0.00 O ATOM 791 ND2 ASN A 42 -13.583 2.421 -25.822 1.00 0.00 N ATOM 0 H ASN A 42 -10.867 2.943 -25.107 1.00 0.00 H new ATOM 0 HA ASN A 42 -11.885 4.615 -26.228 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -13.343 4.166 -23.611 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -13.903 5.503 -24.596 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -14.076 1.759 -26.422 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -12.664 2.185 -25.449 1.00 0.00 H new ATOM 798 N GLY A 43 -10.339 6.478 -24.476 1.00 0.00 N ATOM 799 CA GLY A 43 -9.931 7.897 -24.188 1.00 0.00 C ATOM 800 C GLY A 43 -8.796 7.929 -23.162 1.00 0.00 C ATOM 801 O GLY A 43 -7.891 8.741 -23.259 1.00 0.00 O ATOM 0 H GLY A 43 -9.607 5.779 -24.352 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -9.611 8.384 -25.109 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -10.786 8.458 -23.811 1.00 0.00 H new ATOM 805 N LYS A 44 -8.820 7.042 -22.193 1.00 0.00 N ATOM 806 CA LYS A 44 -7.753 7.004 -21.199 1.00 0.00 C ATOM 807 C LYS A 44 -6.700 6.084 -21.702 1.00 0.00 C ATOM 808 O LYS A 44 -6.891 5.391 -22.677 1.00 0.00 O ATOM 809 CB LYS A 44 -8.272 6.500 -19.866 1.00 0.00 C ATOM 810 CG LYS A 44 -8.747 7.692 -19.047 1.00 0.00 C ATOM 811 CD LYS A 44 -9.735 7.231 -17.973 1.00 0.00 C ATOM 812 CE LYS A 44 -9.029 6.277 -17.014 1.00 0.00 C ATOM 813 NZ LYS A 44 -9.797 6.196 -15.738 1.00 0.00 N ATOM 0 H LYS A 44 -9.552 6.343 -22.066 1.00 0.00 H new ATOM 0 HA LYS A 44 -7.357 8.008 -21.046 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -9.090 5.797 -20.020 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -7.487 5.964 -19.333 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -7.895 8.186 -18.580 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -9.222 8.425 -19.699 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -10.124 8.091 -17.428 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -10.588 6.734 -18.436 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -8.946 5.288 -17.464 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -8.015 6.625 -16.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -9.210 5.746 -15.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -10.060 7.154 -15.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -10.658 5.632 -15.886 1.00 0.00 H new ATOM 827 N ASP A 45 -5.586 6.080 -21.068 1.00 0.00 N ATOM 828 CA ASP A 45 -4.493 5.215 -21.512 1.00 0.00 C ATOM 829 C ASP A 45 -3.353 5.137 -20.468 1.00 0.00 C ATOM 830 O ASP A 45 -3.384 5.780 -19.436 1.00 0.00 O ATOM 831 CB ASP A 45 -3.995 5.769 -22.865 1.00 0.00 C ATOM 832 CG ASP A 45 -2.784 6.723 -22.713 1.00 0.00 C ATOM 833 OD1 ASP A 45 -1.682 6.228 -22.540 1.00 0.00 O ATOM 834 OD2 ASP A 45 -2.991 7.924 -22.774 1.00 0.00 O ATOM 0 H ASP A 45 -5.382 6.649 -20.246 1.00 0.00 H new ATOM 0 HA ASP A 45 -4.848 4.191 -21.628 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -3.718 4.938 -23.513 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -4.810 6.299 -23.358 1.00 0.00 H new ATOM 839 N GLY A 46 -2.335 4.370 -20.778 1.00 0.00 N ATOM 840 CA GLY A 46 -1.161 4.251 -19.864 1.00 0.00 C ATOM 841 C GLY A 46 -0.791 2.788 -19.632 1.00 0.00 C ATOM 842 O GLY A 46 -1.272 1.899 -20.299 1.00 0.00 O ATOM 0 H GLY A 46 -2.269 3.818 -21.633 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -0.309 4.782 -20.290 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -1.389 4.727 -18.910 1.00 0.00 H new ATOM 846 N PHE A 47 0.094 2.540 -18.694 1.00 0.00 N ATOM 847 CA PHE A 47 0.541 1.139 -18.423 1.00 0.00 C ATOM 848 C PHE A 47 -0.588 0.317 -17.796 1.00 0.00 C ATOM 849 O PHE A 47 -1.450 0.844 -17.127 1.00 0.00 O ATOM 850 CB PHE A 47 1.734 1.167 -17.469 1.00 0.00 C ATOM 851 CG PHE A 47 2.885 1.888 -18.125 1.00 0.00 C ATOM 852 CD1 PHE A 47 3.594 1.274 -19.163 1.00 0.00 C ATOM 853 CD2 PHE A 47 3.243 3.171 -17.695 1.00 0.00 C ATOM 854 CE1 PHE A 47 4.662 1.942 -19.771 1.00 0.00 C ATOM 855 CE2 PHE A 47 4.312 3.840 -18.303 1.00 0.00 C ATOM 856 CZ PHE A 47 5.022 3.226 -19.341 1.00 0.00 C ATOM 0 H PHE A 47 0.526 3.251 -18.104 1.00 0.00 H new ATOM 0 HA PHE A 47 0.824 0.675 -19.368 1.00 0.00 H new ATOM 0 HB2 PHE A 47 1.459 1.667 -16.540 1.00 0.00 H new ATOM 0 HB3 PHE A 47 2.029 0.151 -17.208 1.00 0.00 H new ATOM 0 HD1 PHE A 47 3.317 0.284 -19.495 1.00 0.00 H new ATOM 0 HD2 PHE A 47 2.695 3.645 -16.894 1.00 0.00 H new ATOM 0 HE1 PHE A 47 5.209 1.468 -20.572 1.00 0.00 H new ATOM 0 HE2 PHE A 47 4.589 4.830 -17.971 1.00 0.00 H new ATOM 0 HZ PHE A 47 5.847 3.742 -19.810 1.00 0.00 H new ATOM 866 N ILE A 48 -0.574 -0.982 -17.998 1.00 0.00 N ATOM 867 CA ILE A 48 -1.624 -1.851 -17.405 1.00 0.00 C ATOM 868 C ILE A 48 -0.967 -3.193 -17.007 1.00 0.00 C ATOM 869 O ILE A 48 -0.446 -3.869 -17.853 1.00 0.00 O ATOM 870 CB ILE A 48 -2.745 -2.116 -18.434 1.00 0.00 C ATOM 871 CG1 ILE A 48 -2.147 -2.397 -19.825 1.00 0.00 C ATOM 872 CG2 ILE A 48 -3.662 -0.900 -18.520 1.00 0.00 C ATOM 873 CD1 ILE A 48 -3.171 -3.139 -20.689 1.00 0.00 C ATOM 0 H ILE A 48 0.127 -1.473 -18.553 1.00 0.00 H new ATOM 0 HA ILE A 48 -2.061 -1.361 -16.535 1.00 0.00 H new ATOM 0 HB ILE A 48 -3.313 -2.987 -18.109 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -1.863 -1.460 -20.305 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -1.240 -2.993 -19.727 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -4.452 -1.090 -19.247 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -4.106 -0.710 -17.543 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -3.084 -0.030 -18.832 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -2.743 -3.336 -21.672 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -3.433 -4.083 -20.212 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -4.066 -2.527 -20.799 1.00 0.00 H new ATOM 885 N PRO A 49 -1.001 -3.563 -15.735 1.00 0.00 N ATOM 886 CA PRO A 49 -0.392 -4.820 -15.309 1.00 0.00 C ATOM 887 C PRO A 49 -1.109 -6.010 -15.933 1.00 0.00 C ATOM 888 O PRO A 49 -2.208 -6.338 -15.592 1.00 0.00 O ATOM 889 CB PRO A 49 -0.492 -4.808 -13.784 1.00 0.00 C ATOM 890 CG PRO A 49 -1.604 -3.779 -13.443 1.00 0.00 C ATOM 891 CD PRO A 49 -1.655 -2.810 -14.653 1.00 0.00 C ATOM 0 HA PRO A 49 0.645 -4.915 -15.631 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -0.743 -5.797 -13.400 1.00 0.00 H new ATOM 0 HB3 PRO A 49 0.458 -4.522 -13.332 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -2.564 -4.273 -13.295 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -1.375 -3.244 -12.521 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -2.681 -2.547 -14.912 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -1.131 -1.878 -14.441 1.00 0.00 H new ATOM 899 N LYS A 50 -0.457 -6.626 -16.871 1.00 0.00 N ATOM 900 CA LYS A 50 -0.999 -7.805 -17.603 1.00 0.00 C ATOM 901 C LYS A 50 -1.623 -8.876 -16.673 1.00 0.00 C ATOM 902 O LYS A 50 -2.350 -9.724 -17.143 1.00 0.00 O ATOM 903 CB LYS A 50 0.167 -8.423 -18.337 1.00 0.00 C ATOM 904 CG LYS A 50 -0.307 -9.497 -19.286 1.00 0.00 C ATOM 905 CD LYS A 50 0.927 -10.130 -19.913 1.00 0.00 C ATOM 906 CE LYS A 50 0.595 -11.539 -20.405 1.00 0.00 C ATOM 907 NZ LYS A 50 0.960 -12.532 -19.354 1.00 0.00 N ATOM 0 H LYS A 50 0.476 -6.348 -17.177 1.00 0.00 H new ATOM 0 HA LYS A 50 -1.798 -7.468 -18.263 1.00 0.00 H new ATOM 0 HB2 LYS A 50 0.704 -7.653 -18.891 1.00 0.00 H new ATOM 0 HB3 LYS A 50 0.870 -8.848 -17.620 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -0.894 -10.246 -18.755 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -0.953 -9.072 -20.055 1.00 0.00 H new ATOM 0 HD2 LYS A 50 1.278 -9.518 -20.744 1.00 0.00 H new ATOM 0 HD3 LYS A 50 1.736 -10.171 -19.184 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -0.467 -11.614 -20.637 1.00 0.00 H new ATOM 0 HE3 LYS A 50 1.138 -11.752 -21.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 0.734 -13.490 -19.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 1.978 -12.466 -19.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 0.422 -12.333 -18.486 1.00 0.00 H new ATOM 921 N ASN A 51 -1.334 -8.879 -15.380 1.00 0.00 N ATOM 922 CA ASN A 51 -1.911 -9.896 -14.489 1.00 0.00 C ATOM 923 C ASN A 51 -3.435 -9.757 -14.467 1.00 0.00 C ATOM 924 O ASN A 51 -4.165 -10.728 -14.405 1.00 0.00 O ATOM 925 CB ASN A 51 -1.343 -9.697 -13.123 1.00 0.00 C ATOM 926 CG ASN A 51 -0.064 -10.525 -12.962 1.00 0.00 C ATOM 927 OD1 ASN A 51 0.079 -11.265 -12.010 1.00 0.00 O ATOM 928 ND2 ASN A 51 0.878 -10.431 -13.862 1.00 0.00 N ATOM 0 H ASN A 51 -0.717 -8.207 -14.924 1.00 0.00 H new ATOM 0 HA ASN A 51 -1.667 -10.898 -14.843 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -1.126 -8.641 -12.961 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -2.074 -9.991 -12.370 1.00 0.00 H new ATOM 0 HD21 ASN A 51 1.733 -10.979 -13.765 1.00 0.00 H new ATOM 0 HD22 ASN A 51 0.759 -9.810 -14.662 1.00 0.00 H new ATOM 935 N TYR A 52 -3.904 -8.550 -14.567 1.00 0.00 N ATOM 936 CA TYR A 52 -5.364 -8.278 -14.611 1.00 0.00 C ATOM 937 C TYR A 52 -5.766 -8.153 -16.065 1.00 0.00 C ATOM 938 O TYR A 52 -6.667 -7.401 -16.406 1.00 0.00 O ATOM 939 CB TYR A 52 -5.635 -6.926 -13.933 1.00 0.00 C ATOM 940 CG TYR A 52 -5.708 -7.039 -12.475 1.00 0.00 C ATOM 941 CD1 TYR A 52 -4.557 -7.227 -11.722 1.00 0.00 C ATOM 942 CD2 TYR A 52 -6.930 -6.898 -11.865 1.00 0.00 C ATOM 943 CE1 TYR A 52 -4.648 -7.273 -10.346 1.00 0.00 C ATOM 944 CE2 TYR A 52 -7.029 -6.952 -10.501 1.00 0.00 C ATOM 945 CZ TYR A 52 -5.897 -7.137 -9.728 1.00 0.00 C ATOM 946 OH TYR A 52 -6.010 -7.170 -8.361 1.00 0.00 O ATOM 0 H TYR A 52 -3.319 -7.716 -14.622 1.00 0.00 H new ATOM 0 HA TYR A 52 -5.916 -9.074 -14.111 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -4.846 -6.223 -14.201 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -6.571 -6.514 -14.310 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -3.599 -7.336 -12.209 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -7.816 -6.744 -12.463 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -3.760 -7.413 -9.748 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -7.994 -6.850 -10.027 1.00 0.00 H new ATOM 0 HH TYR A 52 -5.170 -7.491 -7.971 1.00 0.00 H new ATOM 956 N ILE A 53 -5.080 -8.844 -16.949 1.00 0.00 N ATOM 957 CA ILE A 53 -5.402 -8.709 -18.378 1.00 0.00 C ATOM 958 C ILE A 53 -4.893 -9.899 -19.198 1.00 0.00 C ATOM 959 O ILE A 53 -4.204 -10.777 -18.719 1.00 0.00 O ATOM 960 CB ILE A 53 -4.738 -7.442 -18.978 1.00 0.00 C ATOM 961 CG1 ILE A 53 -4.189 -6.502 -17.897 1.00 0.00 C ATOM 962 CG2 ILE A 53 -5.743 -6.673 -19.827 1.00 0.00 C ATOM 963 CD1 ILE A 53 -3.401 -5.407 -18.569 1.00 0.00 C ATOM 0 H ILE A 53 -4.319 -9.487 -16.729 1.00 0.00 H new ATOM 0 HA ILE A 53 -6.489 -8.652 -18.433 1.00 0.00 H new ATOM 0 HB ILE A 53 -3.903 -7.786 -19.589 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -5.006 -6.077 -17.314 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -3.555 -7.053 -17.202 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -5.265 -5.786 -20.243 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -6.096 -7.309 -20.639 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -6.588 -6.373 -19.208 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -3.003 -4.729 -17.814 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -2.578 -5.845 -19.133 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -4.051 -4.854 -19.247 1.00 0.00 H new ATOM 975 N GLU A 54 -5.187 -9.852 -20.468 1.00 0.00 N ATOM 976 CA GLU A 54 -4.720 -10.852 -21.418 1.00 0.00 C ATOM 977 C GLU A 54 -4.701 -10.176 -22.786 1.00 0.00 C ATOM 978 O GLU A 54 -5.432 -9.233 -23.017 1.00 0.00 O ATOM 979 CB GLU A 54 -5.636 -12.050 -21.437 1.00 0.00 C ATOM 980 CG GLU A 54 -4.961 -13.236 -20.733 1.00 0.00 C ATOM 981 CD GLU A 54 -5.327 -14.536 -21.452 1.00 0.00 C ATOM 982 OE1 GLU A 54 -4.868 -14.724 -22.566 1.00 0.00 O ATOM 983 OE2 GLU A 54 -6.060 -15.322 -20.874 1.00 0.00 O ATOM 0 H GLU A 54 -5.760 -9.119 -20.886 1.00 0.00 H new ATOM 0 HA GLU A 54 -3.730 -11.215 -21.141 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -6.576 -11.808 -20.940 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -5.879 -12.317 -22.466 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -3.879 -13.102 -20.730 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -5.279 -13.283 -19.692 1.00 0.00 H new ATOM 990 N MET A 55 -3.870 -10.626 -23.671 1.00 0.00 N ATOM 991 CA MET A 55 -3.769 -9.964 -25.020 1.00 0.00 C ATOM 992 C MET A 55 -4.592 -10.698 -26.068 1.00 0.00 C ATOM 993 O MET A 55 -4.275 -11.812 -26.451 1.00 0.00 O ATOM 994 CB MET A 55 -2.303 -9.943 -25.459 1.00 0.00 C ATOM 995 CG MET A 55 -2.038 -8.704 -26.340 1.00 0.00 C ATOM 996 SD MET A 55 -1.462 -9.214 -27.985 1.00 0.00 S ATOM 997 CE MET A 55 -3.081 -9.647 -28.667 1.00 0.00 C ATOM 0 H MET A 55 -3.249 -11.424 -23.533 1.00 0.00 H new ATOM 0 HA MET A 55 -4.159 -8.950 -24.931 1.00 0.00 H new ATOM 0 HB2 MET A 55 -1.652 -9.925 -24.585 1.00 0.00 H new ATOM 0 HB3 MET A 55 -2.067 -10.852 -26.013 1.00 0.00 H new ATOM 0 HG2 MET A 55 -2.949 -8.113 -26.433 1.00 0.00 H new ATOM 0 HG3 MET A 55 -1.292 -8.066 -25.867 1.00 0.00 H new ATOM 0 HE1 MET A 55 -3.068 -9.511 -29.748 1.00 0.00 H new ATOM 0 HE2 MET A 55 -3.307 -10.688 -28.434 1.00 0.00 H new ATOM 0 HE3 MET A 55 -3.844 -9.003 -28.230 1.00 0.00 H new ATOM 1007 N LYS A 56 -5.658 -10.083 -26.538 1.00 0.00 N ATOM 1008 CA LYS A 56 -6.499 -10.718 -27.535 1.00 0.00 C ATOM 1009 C LYS A 56 -6.576 -9.906 -28.832 1.00 0.00 C ATOM 1010 O LYS A 56 -6.352 -8.699 -28.836 1.00 0.00 O ATOM 1011 CB LYS A 56 -7.868 -10.857 -26.952 1.00 0.00 C ATOM 1012 CG LYS A 56 -7.957 -12.187 -26.249 1.00 0.00 C ATOM 1013 CD LYS A 56 -9.420 -12.623 -26.132 1.00 0.00 C ATOM 1014 CE LYS A 56 -10.153 -11.693 -25.173 1.00 0.00 C ATOM 1015 NZ LYS A 56 -11.270 -12.435 -24.521 1.00 0.00 N ATOM 0 H LYS A 56 -5.962 -9.153 -26.250 1.00 0.00 H new ATOM 0 HA LYS A 56 -6.071 -11.687 -27.791 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -8.066 -10.045 -26.252 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -8.622 -10.792 -27.737 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -7.389 -12.937 -26.799 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -7.511 -12.114 -25.257 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -9.896 -12.601 -27.112 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -9.477 -13.651 -25.773 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -9.464 -11.314 -24.418 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -10.541 -10.829 -25.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -11.980 -11.759 -24.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -11.711 -13.076 -25.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -10.900 -12.989 -23.722 1.00 0.00 H new ATOM 1029 N PRO A 57 -6.907 -10.612 -29.921 1.00 0.00 N ATOM 1030 CA PRO A 57 -7.032 -10.003 -31.220 1.00 0.00 C ATOM 1031 C PRO A 57 -8.404 -9.329 -31.361 1.00 0.00 C ATOM 1032 O PRO A 57 -9.100 -9.116 -30.383 1.00 0.00 O ATOM 1033 CB PRO A 57 -6.902 -11.165 -32.193 1.00 0.00 C ATOM 1034 CG PRO A 57 -7.277 -12.426 -31.398 1.00 0.00 C ATOM 1035 CD PRO A 57 -7.169 -12.068 -29.923 1.00 0.00 C ATOM 0 HA PRO A 57 -6.285 -9.229 -31.397 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -7.563 -11.033 -33.050 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -5.886 -11.237 -32.582 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -8.288 -12.751 -31.643 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -6.609 -13.251 -31.645 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -8.087 -12.308 -29.387 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -6.363 -12.618 -29.438 1.00 0.00 H new ATOM 1043 N HIS A 58 -8.807 -9.009 -32.570 1.00 0.00 N ATOM 1044 CA HIS A 58 -10.144 -8.370 -32.772 1.00 0.00 C ATOM 1045 C HIS A 58 -11.197 -9.478 -33.007 1.00 0.00 C ATOM 1046 O HIS A 58 -10.840 -10.584 -33.359 1.00 0.00 O ATOM 1047 CB HIS A 58 -10.093 -7.443 -33.988 1.00 0.00 C ATOM 1048 CG HIS A 58 -9.620 -6.080 -33.560 1.00 0.00 C ATOM 1049 ND1 HIS A 58 -10.480 -5.129 -33.034 1.00 0.00 N ATOM 1050 CD2 HIS A 58 -8.378 -5.496 -33.572 1.00 0.00 C ATOM 1051 CE1 HIS A 58 -9.750 -4.033 -32.753 1.00 0.00 C ATOM 1052 NE2 HIS A 58 -8.461 -4.205 -33.060 1.00 0.00 N ATOM 0 H HIS A 58 -8.268 -9.163 -33.422 1.00 0.00 H new ATOM 0 HA HIS A 58 -10.411 -7.786 -31.891 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -9.422 -7.852 -34.743 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -11.080 -7.370 -34.445 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -7.473 -5.967 -33.926 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -10.157 -3.126 -32.331 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -7.701 -3.534 -32.944 1.00 0.00 H new ATOM 1060 N PRO A 59 -12.475 -9.159 -32.799 1.00 0.00 N ATOM 1061 CA PRO A 59 -13.555 -10.138 -32.987 1.00 0.00 C ATOM 1062 C PRO A 59 -13.868 -10.326 -34.477 1.00 0.00 C ATOM 1063 O PRO A 59 -13.506 -11.325 -35.073 1.00 0.00 O ATOM 1064 CB PRO A 59 -14.747 -9.520 -32.246 1.00 0.00 C ATOM 1065 CG PRO A 59 -14.466 -7.993 -32.164 1.00 0.00 C ATOM 1066 CD PRO A 59 -12.944 -7.818 -32.370 1.00 0.00 C ATOM 0 HA PRO A 59 -13.297 -11.128 -32.610 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -15.679 -9.716 -32.777 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -14.851 -9.950 -31.250 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -15.026 -7.453 -32.928 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -14.776 -7.592 -31.199 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -12.729 -7.061 -33.125 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -12.452 -7.500 -31.451 1.00 0.00 H new ATOM 1074 N GLU A 60 -14.542 -9.376 -35.081 1.00 0.00 N ATOM 1075 CA GLU A 60 -14.883 -9.498 -36.530 1.00 0.00 C ATOM 1076 C GLU A 60 -14.805 -8.119 -37.190 1.00 0.00 C ATOM 1077 O GLU A 60 -14.290 -7.175 -36.615 1.00 0.00 O ATOM 1078 CB GLU A 60 -16.310 -10.059 -36.671 1.00 0.00 C ATOM 1079 CG GLU A 60 -16.255 -11.491 -37.215 1.00 0.00 C ATOM 1080 CD GLU A 60 -17.445 -11.733 -38.146 1.00 0.00 C ATOM 1081 OE1 GLU A 60 -17.356 -11.348 -39.299 1.00 0.00 O ATOM 1082 OE2 GLU A 60 -18.425 -12.297 -37.688 1.00 0.00 O ATOM 0 H GLU A 60 -14.870 -8.522 -34.631 1.00 0.00 H new ATOM 0 HA GLU A 60 -14.178 -10.171 -37.017 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -16.812 -10.047 -35.704 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -16.894 -9.428 -37.341 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -15.321 -11.650 -37.754 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -16.274 -12.205 -36.391 1.00 0.00 H new ATOM 1089 N PHE A 61 -15.311 -7.998 -38.393 1.00 0.00 N ATOM 1090 CA PHE A 61 -15.272 -6.683 -39.096 1.00 0.00 C ATOM 1091 C PHE A 61 -16.498 -6.551 -40.006 1.00 0.00 C ATOM 1092 O PHE A 61 -16.412 -6.712 -41.210 1.00 0.00 O ATOM 1093 CB PHE A 61 -13.993 -6.590 -39.936 1.00 0.00 C ATOM 1094 CG PHE A 61 -13.506 -5.162 -39.953 1.00 0.00 C ATOM 1095 CD1 PHE A 61 -14.240 -4.180 -40.628 1.00 0.00 C ATOM 1096 CD2 PHE A 61 -12.321 -4.819 -39.291 1.00 0.00 C ATOM 1097 CE1 PHE A 61 -13.791 -2.855 -40.641 1.00 0.00 C ATOM 1098 CE2 PHE A 61 -11.871 -3.493 -39.304 1.00 0.00 C ATOM 1099 CZ PHE A 61 -12.605 -2.512 -39.980 1.00 0.00 C ATOM 0 H PHE A 61 -15.749 -8.755 -38.917 1.00 0.00 H new ATOM 0 HA PHE A 61 -15.281 -5.878 -38.361 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -13.225 -7.243 -39.522 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -14.187 -6.932 -40.953 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -15.154 -4.445 -41.139 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -11.754 -5.577 -38.771 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -14.359 -2.097 -41.160 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -10.958 -3.228 -38.792 1.00 0.00 H new ATOM 0 HZ PHE A 61 -12.257 -1.490 -39.992 1.00 0.00 H new ATOM 1109 N ILE A 62 -17.639 -6.249 -39.434 1.00 0.00 N ATOM 1110 CA ILE A 62 -18.877 -6.095 -40.256 1.00 0.00 C ATOM 1111 C ILE A 62 -19.247 -4.607 -40.321 1.00 0.00 C ATOM 1112 O ILE A 62 -19.674 -4.107 -41.345 1.00 0.00 O ATOM 1113 CB ILE A 62 -20.024 -6.910 -39.623 1.00 0.00 C ATOM 1114 CG1 ILE A 62 -21.298 -6.752 -40.464 1.00 0.00 C ATOM 1115 CG2 ILE A 62 -20.293 -6.426 -38.195 1.00 0.00 C ATOM 1116 CD1 ILE A 62 -22.171 -7.998 -40.306 1.00 0.00 C ATOM 0 H ILE A 62 -17.765 -6.103 -38.432 1.00 0.00 H new ATOM 0 HA ILE A 62 -18.706 -6.467 -41.266 1.00 0.00 H new ATOM 0 HB ILE A 62 -19.733 -7.960 -39.594 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -21.849 -5.866 -40.147 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -21.039 -6.607 -41.513 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -21.105 -7.009 -37.760 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -19.393 -6.551 -37.593 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -20.573 -5.373 -38.215 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -23.076 -7.886 -40.903 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -21.619 -8.875 -40.645 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -22.441 -8.122 -39.257 1.00 0.00 H new ATOM 1128 N VAL A 63 -19.076 -3.896 -39.229 1.00 0.00 N ATOM 1129 CA VAL A 63 -19.404 -2.434 -39.210 1.00 0.00 C ATOM 1130 C VAL A 63 -20.887 -2.229 -39.542 1.00 0.00 C ATOM 1131 O VAL A 63 -21.546 -3.114 -40.057 1.00 0.00 O ATOM 1132 CB VAL A 63 -18.542 -1.702 -40.247 1.00 0.00 C ATOM 1133 CG1 VAL A 63 -18.720 -0.192 -40.083 1.00 0.00 C ATOM 1134 CG2 VAL A 63 -17.069 -2.064 -40.037 1.00 0.00 C ATOM 0 H VAL A 63 -18.722 -4.268 -38.348 1.00 0.00 H new ATOM 0 HA VAL A 63 -19.199 -2.034 -38.217 1.00 0.00 H new ATOM 0 HB VAL A 63 -18.851 -2.000 -41.249 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -18.108 0.329 -40.819 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -19.768 0.069 -40.232 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -18.411 0.104 -39.080 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -16.458 -1.543 -40.774 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -16.761 -1.767 -39.035 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -16.939 -3.140 -40.152 1.00 0.00 H new ATOM 1144 N THR A 64 -21.414 -1.063 -39.250 1.00 0.00 N ATOM 1145 CA THR A 64 -22.851 -0.788 -39.545 1.00 0.00 C ATOM 1146 C THR A 64 -23.024 0.691 -39.902 1.00 0.00 C ATOM 1147 O THR A 64 -23.631 1.029 -40.901 1.00 0.00 O ATOM 1148 CB THR A 64 -23.701 -1.124 -38.317 1.00 0.00 C ATOM 1149 OG1 THR A 64 -22.940 -0.899 -37.139 1.00 0.00 O ATOM 1150 CG2 THR A 64 -24.130 -2.592 -38.377 1.00 0.00 C ATOM 0 H THR A 64 -20.907 -0.290 -38.819 1.00 0.00 H new ATOM 0 HA THR A 64 -23.174 -1.404 -40.385 1.00 0.00 H new ATOM 0 HB THR A 64 -24.587 -0.489 -38.304 1.00 0.00 H new ATOM 0 HG1 THR A 64 -23.484 -1.112 -36.352 1.00 0.00 H new ATOM 0 HG21 THR A 64 -24.735 -2.830 -37.502 1.00 0.00 H new ATOM 0 HG22 THR A 64 -24.715 -2.763 -39.281 1.00 0.00 H new ATOM 0 HG23 THR A 64 -23.246 -3.229 -38.391 1.00 0.00 H new ATOM 1158 N ASP A 65 -22.493 1.575 -39.089 1.00 0.00 N ATOM 1159 CA ASP A 65 -22.622 3.036 -39.375 1.00 0.00 C ATOM 1160 C ASP A 65 -21.233 3.677 -39.412 1.00 0.00 C ATOM 1161 O ASP A 65 -20.319 3.095 -38.850 1.00 0.00 O ATOM 1162 CB ASP A 65 -23.459 3.700 -38.279 1.00 0.00 C ATOM 1163 CG ASP A 65 -23.803 5.132 -38.695 1.00 0.00 C ATOM 1164 OD1 ASP A 65 -24.030 5.347 -39.875 1.00 0.00 O ATOM 1165 OD2 ASP A 65 -23.834 5.989 -37.828 1.00 0.00 O ATOM 1166 OXT ASP A 65 -21.107 4.737 -40.002 1.00 0.00 O ATOM 0 H ASP A 65 -21.976 1.345 -38.240 1.00 0.00 H new ATOM 0 HA ASP A 65 -23.110 3.173 -40.340 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -24.373 3.130 -38.109 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -22.907 3.706 -37.339 1.00 0.00 H new TER 1171 ASP A 65 ATOM 1172 N SER B 1 -7.710 -14.798 2.901 1.00 0.00 N ATOM 1173 CA SER B 1 -6.575 -14.614 1.953 1.00 0.00 C ATOM 1174 C SER B 1 -7.118 -14.167 0.576 1.00 0.00 C ATOM 1175 O SER B 1 -7.285 -14.987 -0.307 1.00 0.00 O ATOM 1176 CB SER B 1 -5.818 -15.935 1.802 1.00 0.00 C ATOM 1177 OG SER B 1 -4.442 -15.663 1.570 1.00 0.00 O ATOM 0 H1 SER B 1 -7.378 -14.645 3.874 1.00 0.00 H new ATOM 0 H2 SER B 1 -8.461 -14.114 2.680 1.00 0.00 H new ATOM 0 H3 SER B 1 -8.084 -15.764 2.811 1.00 0.00 H new ATOM 0 HA SER B 1 -5.899 -13.851 2.339 1.00 0.00 H new ATOM 0 HB2 SER B 1 -5.935 -16.539 2.702 1.00 0.00 H new ATOM 0 HB3 SER B 1 -6.231 -16.512 0.975 1.00 0.00 H new ATOM 0 HG SER B 1 -3.953 -16.507 1.474 1.00 0.00 H new ATOM 1185 N PRO B 2 -7.380 -12.870 0.422 1.00 0.00 N ATOM 1186 CA PRO B 2 -7.897 -12.333 -0.841 1.00 0.00 C ATOM 1187 C PRO B 2 -6.762 -12.201 -1.863 1.00 0.00 C ATOM 1188 O PRO B 2 -6.023 -11.234 -1.859 1.00 0.00 O ATOM 1189 CB PRO B 2 -8.451 -10.957 -0.459 1.00 0.00 C ATOM 1190 CG PRO B 2 -7.725 -10.545 0.851 1.00 0.00 C ATOM 1191 CD PRO B 2 -7.186 -11.848 1.478 1.00 0.00 C ATOM 0 HA PRO B 2 -8.652 -12.972 -1.299 1.00 0.00 H new ATOM 0 HB2 PRO B 2 -8.268 -10.230 -1.250 1.00 0.00 H new ATOM 0 HB3 PRO B 2 -9.530 -11.000 -0.309 1.00 0.00 H new ATOM 0 HG2 PRO B 2 -6.912 -9.849 0.642 1.00 0.00 H new ATOM 0 HG3 PRO B 2 -8.410 -10.040 1.532 1.00 0.00 H new ATOM 0 HD2 PRO B 2 -6.135 -11.753 1.751 1.00 0.00 H new ATOM 0 HD3 PRO B 2 -7.730 -12.107 2.387 1.00 0.00 H new ATOM 1199 N LEU B 3 -6.621 -13.172 -2.733 1.00 0.00 N ATOM 1200 CA LEU B 3 -5.533 -13.115 -3.756 1.00 0.00 C ATOM 1201 C LEU B 3 -6.061 -12.455 -5.032 1.00 0.00 C ATOM 1202 O LEU B 3 -6.959 -12.956 -5.674 1.00 0.00 O ATOM 1203 CB LEU B 3 -5.057 -14.532 -4.073 1.00 0.00 C ATOM 1204 CG LEU B 3 -3.815 -14.465 -4.963 1.00 0.00 C ATOM 1205 CD1 LEU B 3 -2.558 -14.476 -4.090 1.00 0.00 C ATOM 1206 CD2 LEU B 3 -3.795 -15.673 -5.899 1.00 0.00 C ATOM 0 H LEU B 3 -7.213 -14.001 -2.778 1.00 0.00 H new ATOM 0 HA LEU B 3 -4.700 -12.530 -3.366 1.00 0.00 H new ATOM 0 HB2 LEU B 3 -4.828 -15.065 -3.150 1.00 0.00 H new ATOM 0 HB3 LEU B 3 -5.848 -15.089 -4.575 1.00 0.00 H new ATOM 0 HG LEU B 3 -3.839 -13.548 -5.552 1.00 0.00 H new ATOM 0 HD11 LEU B 3 -1.673 -14.428 -4.725 1.00 0.00 H new ATOM 0 HD12 LEU B 3 -2.572 -13.615 -3.422 1.00 0.00 H new ATOM 0 HD13 LEU B 3 -2.532 -15.393 -3.501 1.00 0.00 H new ATOM 0 HD21 LEU B 3 -2.910 -15.627 -6.534 1.00 0.00 H new ATOM 0 HD22 LEU B 3 -3.771 -16.590 -5.310 1.00 0.00 H new ATOM 0 HD23 LEU B 3 -4.689 -15.666 -6.522 1.00 0.00 H new ATOM 1218 N LEU B 4 -5.493 -11.333 -5.402 1.00 0.00 N ATOM 1219 CA LEU B 4 -5.935 -10.611 -6.643 1.00 0.00 C ATOM 1220 C LEU B 4 -5.212 -9.247 -6.713 1.00 0.00 C ATOM 1221 O LEU B 4 -4.544 -8.976 -7.691 1.00 0.00 O ATOM 1222 CB LEU B 4 -7.470 -10.385 -6.632 1.00 0.00 C ATOM 1223 CG LEU B 4 -8.104 -10.839 -7.971 1.00 0.00 C ATOM 1224 CD1 LEU B 4 -7.480 -10.068 -9.144 1.00 0.00 C ATOM 1225 CD2 LEU B 4 -7.894 -12.349 -8.174 1.00 0.00 C ATOM 0 H LEU B 4 -4.734 -10.880 -4.894 1.00 0.00 H new ATOM 0 HA LEU B 4 -5.684 -11.216 -7.514 1.00 0.00 H new ATOM 0 HB2 LEU B 4 -7.917 -10.939 -5.807 1.00 0.00 H new ATOM 0 HB3 LEU B 4 -7.685 -9.330 -6.462 1.00 0.00 H new ATOM 0 HG LEU B 4 -9.173 -10.629 -7.936 1.00 0.00 H new ATOM 0 HD11 LEU B 4 -7.935 -10.397 -10.078 1.00 0.00 H new ATOM 0 HD12 LEU B 4 -7.655 -9.000 -9.012 1.00 0.00 H new ATOM 0 HD13 LEU B 4 -6.407 -10.259 -9.175 1.00 0.00 H new ATOM 0 HD21 LEU B 4 -8.344 -12.655 -9.118 1.00 0.00 H new ATOM 0 HD22 LEU B 4 -6.827 -12.569 -8.193 1.00 0.00 H new ATOM 0 HD23 LEU B 4 -8.362 -12.895 -7.355 1.00 0.00 H new ATOM 1237 N PRO B 5 -5.356 -8.410 -5.669 1.00 0.00 N ATOM 1238 CA PRO B 5 -4.715 -7.085 -5.650 1.00 0.00 C ATOM 1239 C PRO B 5 -3.207 -7.202 -5.438 1.00 0.00 C ATOM 1240 O PRO B 5 -2.666 -8.286 -5.337 1.00 0.00 O ATOM 1241 CB PRO B 5 -5.392 -6.354 -4.486 1.00 0.00 C ATOM 1242 CG PRO B 5 -5.976 -7.452 -3.561 1.00 0.00 C ATOM 1243 CD PRO B 5 -6.138 -8.713 -4.435 1.00 0.00 C ATOM 0 HA PRO B 5 -4.832 -6.553 -6.594 1.00 0.00 H new ATOM 0 HB2 PRO B 5 -4.676 -5.733 -3.948 1.00 0.00 H new ATOM 0 HB3 PRO B 5 -6.179 -5.692 -4.848 1.00 0.00 H new ATOM 0 HG2 PRO B 5 -5.311 -7.645 -2.719 1.00 0.00 H new ATOM 0 HG3 PRO B 5 -6.935 -7.141 -3.145 1.00 0.00 H new ATOM 0 HD2 PRO B 5 -5.755 -9.599 -3.929 1.00 0.00 H new ATOM 0 HD3 PRO B 5 -7.186 -8.905 -4.665 1.00 0.00 H new ATOM 1251 N LYS B 6 -2.524 -6.080 -5.393 1.00 0.00 N ATOM 1252 CA LYS B 6 -1.040 -6.093 -5.212 1.00 0.00 C ATOM 1253 C LYS B 6 -0.398 -6.782 -6.418 1.00 0.00 C ATOM 1254 O LYS B 6 -1.001 -7.627 -7.056 1.00 0.00 O ATOM 1255 CB LYS B 6 -0.669 -6.839 -3.921 1.00 0.00 C ATOM 1256 CG LYS B 6 -0.402 -5.824 -2.803 1.00 0.00 C ATOM 1257 CD LYS B 6 0.999 -5.220 -2.976 1.00 0.00 C ATOM 1258 CE LYS B 6 0.892 -3.849 -3.653 1.00 0.00 C ATOM 1259 NZ LYS B 6 1.883 -2.917 -3.046 1.00 0.00 N ATOM 0 H LYS B 6 -2.937 -5.151 -5.475 1.00 0.00 H new ATOM 0 HA LYS B 6 -0.674 -5.069 -5.136 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -1.477 -7.511 -3.632 1.00 0.00 H new ATOM 0 HB3 LYS B 6 0.215 -7.456 -4.086 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -1.154 -5.035 -2.827 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -0.481 -6.310 -1.831 1.00 0.00 H new ATOM 0 HD2 LYS B 6 1.484 -5.120 -2.005 1.00 0.00 H new ATOM 0 HD3 LYS B 6 1.620 -5.885 -3.576 1.00 0.00 H new ATOM 0 HE2 LYS B 6 1.075 -3.945 -4.723 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -0.116 -3.451 -3.536 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 1.811 -1.987 -3.505 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 1.688 -2.818 -2.029 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 2.842 -3.295 -3.179 1.00 0.00 H new ATOM 1273 N LEU B 7 0.815 -6.415 -6.745 1.00 0.00 N ATOM 1274 CA LEU B 7 1.500 -7.032 -7.921 1.00 0.00 C ATOM 1275 C LEU B 7 2.714 -7.859 -7.430 1.00 0.00 C ATOM 1276 O LEU B 7 3.801 -7.327 -7.314 1.00 0.00 O ATOM 1277 CB LEU B 7 1.969 -5.916 -8.863 1.00 0.00 C ATOM 1278 CG LEU B 7 0.794 -5.428 -9.743 1.00 0.00 C ATOM 1279 CD1 LEU B 7 0.301 -6.569 -10.653 1.00 0.00 C ATOM 1280 CD2 LEU B 7 -0.363 -4.936 -8.855 1.00 0.00 C ATOM 0 H LEU B 7 1.362 -5.713 -6.247 1.00 0.00 H new ATOM 0 HA LEU B 7 0.814 -7.691 -8.453 1.00 0.00 H new ATOM 0 HB2 LEU B 7 2.368 -5.084 -8.282 1.00 0.00 H new ATOM 0 HB3 LEU B 7 2.779 -6.280 -9.495 1.00 0.00 H new ATOM 0 HG LEU B 7 1.143 -4.603 -10.364 1.00 0.00 H new ATOM 0 HD11 LEU B 7 -0.526 -6.213 -11.267 1.00 0.00 H new ATOM 0 HD12 LEU B 7 1.116 -6.898 -11.297 1.00 0.00 H new ATOM 0 HD13 LEU B 7 -0.036 -7.404 -10.039 1.00 0.00 H new ATOM 0 HD21 LEU B 7 -1.185 -4.595 -9.484 1.00 0.00 H new ATOM 0 HD22 LEU B 7 -0.707 -5.753 -8.220 1.00 0.00 H new ATOM 0 HD23 LEU B 7 -0.018 -4.112 -8.231 1.00 0.00 H new ATOM 1292 N PRO B 8 2.495 -9.148 -7.141 1.00 0.00 N ATOM 1293 CA PRO B 8 3.568 -10.029 -6.653 1.00 0.00 C ATOM 1294 C PRO B 8 4.489 -10.475 -7.814 1.00 0.00 C ATOM 1295 O PRO B 8 4.203 -10.188 -8.959 1.00 0.00 O ATOM 1296 CB PRO B 8 2.818 -11.228 -6.060 1.00 0.00 C ATOM 1297 CG PRO B 8 1.418 -11.246 -6.735 1.00 0.00 C ATOM 1298 CD PRO B 8 1.180 -9.822 -7.278 1.00 0.00 C ATOM 0 HA PRO B 8 4.217 -9.538 -5.928 1.00 0.00 H new ATOM 0 HB2 PRO B 8 3.355 -12.157 -6.254 1.00 0.00 H new ATOM 0 HB3 PRO B 8 2.727 -11.133 -4.978 1.00 0.00 H new ATOM 0 HG2 PRO B 8 1.384 -11.980 -7.540 1.00 0.00 H new ATOM 0 HG3 PRO B 8 0.645 -11.523 -6.019 1.00 0.00 H new ATOM 0 HD2 PRO B 8 0.851 -9.843 -8.317 1.00 0.00 H new ATOM 0 HD3 PRO B 8 0.407 -9.304 -6.710 1.00 0.00 H new ATOM 1306 N PRO B 9 5.586 -11.166 -7.481 1.00 0.00 N ATOM 1307 CA PRO B 9 6.545 -11.641 -8.488 1.00 0.00 C ATOM 1308 C PRO B 9 6.043 -12.931 -9.159 1.00 0.00 C ATOM 1309 O PRO B 9 6.540 -14.010 -8.893 1.00 0.00 O ATOM 1310 CB PRO B 9 7.817 -11.919 -7.678 1.00 0.00 C ATOM 1311 CG PRO B 9 7.359 -12.147 -6.210 1.00 0.00 C ATOM 1312 CD PRO B 9 5.956 -11.517 -6.086 1.00 0.00 C ATOM 0 HA PRO B 9 6.699 -10.921 -9.292 1.00 0.00 H new ATOM 0 HB2 PRO B 9 8.339 -12.795 -8.063 1.00 0.00 H new ATOM 0 HB3 PRO B 9 8.510 -11.080 -7.743 1.00 0.00 H new ATOM 0 HG2 PRO B 9 7.329 -13.211 -5.974 1.00 0.00 H new ATOM 0 HG3 PRO B 9 8.055 -11.685 -5.510 1.00 0.00 H new ATOM 0 HD2 PRO B 9 5.243 -12.217 -5.650 1.00 0.00 H new ATOM 0 HD3 PRO B 9 5.971 -10.636 -5.445 1.00 0.00 H new ATOM 1320 N LYS B 10 5.073 -12.821 -10.036 1.00 0.00 N ATOM 1321 CA LYS B 10 4.540 -14.034 -10.740 1.00 0.00 C ATOM 1322 C LYS B 10 3.976 -15.033 -9.725 1.00 0.00 C ATOM 1323 O LYS B 10 4.708 -15.667 -8.986 1.00 0.00 O ATOM 1324 CB LYS B 10 5.667 -14.703 -11.535 1.00 0.00 C ATOM 1325 CG LYS B 10 5.089 -15.327 -12.808 1.00 0.00 C ATOM 1326 CD LYS B 10 5.948 -16.520 -13.231 1.00 0.00 C ATOM 1327 CE LYS B 10 5.762 -16.776 -14.727 1.00 0.00 C ATOM 1328 NZ LYS B 10 4.376 -17.269 -14.980 1.00 0.00 N ATOM 0 H LYS B 10 4.626 -11.942 -10.296 1.00 0.00 H new ATOM 0 HA LYS B 10 3.743 -13.725 -11.417 1.00 0.00 H new ATOM 0 HB2 LYS B 10 6.432 -13.970 -11.791 1.00 0.00 H new ATOM 0 HB3 LYS B 10 6.150 -15.469 -10.928 1.00 0.00 H new ATOM 0 HG2 LYS B 10 4.062 -15.649 -12.633 1.00 0.00 H new ATOM 0 HG3 LYS B 10 5.059 -14.586 -13.607 1.00 0.00 H new ATOM 0 HD2 LYS B 10 6.997 -16.322 -13.013 1.00 0.00 H new ATOM 0 HD3 LYS B 10 5.665 -17.405 -12.662 1.00 0.00 H new ATOM 0 HE2 LYS B 10 5.941 -15.859 -15.289 1.00 0.00 H new ATOM 0 HE3 LYS B 10 6.489 -17.510 -15.074 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 4.271 -17.507 -15.987 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 4.198 -18.116 -14.403 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 3.692 -16.528 -14.726 1.00 0.00 H new ATOM 1342 N THR B 11 2.675 -15.190 -9.699 1.00 0.00 N ATOM 1343 CA THR B 11 2.049 -16.159 -8.750 1.00 0.00 C ATOM 1344 C THR B 11 1.254 -17.191 -9.551 1.00 0.00 C ATOM 1345 O THR B 11 0.061 -17.053 -9.747 1.00 0.00 O ATOM 1346 CB THR B 11 1.111 -15.414 -7.797 1.00 0.00 C ATOM 1347 OG1 THR B 11 0.387 -14.428 -8.521 1.00 0.00 O ATOM 1348 CG2 THR B 11 1.929 -14.743 -6.694 1.00 0.00 C ATOM 0 H THR B 11 2.019 -14.687 -10.296 1.00 0.00 H new ATOM 0 HA THR B 11 2.823 -16.659 -8.168 1.00 0.00 H new ATOM 0 HB THR B 11 0.413 -16.120 -7.348 1.00 0.00 H new ATOM 0 HG1 THR B 11 -0.066 -14.848 -9.282 1.00 0.00 H new ATOM 0 HG21 THR B 11 1.260 -14.213 -6.016 1.00 0.00 H new ATOM 0 HG22 THR B 11 2.482 -15.501 -6.139 1.00 0.00 H new ATOM 0 HG23 THR B 11 2.629 -14.036 -7.139 1.00 0.00 H new ATOM 1356 N TYR B 12 1.914 -18.220 -10.026 1.00 0.00 N ATOM 1357 CA TYR B 12 1.209 -19.262 -10.830 1.00 0.00 C ATOM 1358 C TYR B 12 1.194 -20.585 -10.064 1.00 0.00 C ATOM 1359 O TYR B 12 1.982 -20.802 -9.161 1.00 0.00 O ATOM 1360 CB TYR B 12 1.940 -19.451 -12.160 1.00 0.00 C ATOM 1361 CG TYR B 12 1.133 -20.355 -13.058 1.00 0.00 C ATOM 1362 CD1 TYR B 12 -0.188 -20.022 -13.383 1.00 0.00 C ATOM 1363 CD2 TYR B 12 1.705 -21.525 -13.569 1.00 0.00 C ATOM 1364 CE1 TYR B 12 -0.935 -20.859 -14.219 1.00 0.00 C ATOM 1365 CE2 TYR B 12 0.958 -22.363 -14.404 1.00 0.00 C ATOM 1366 CZ TYR B 12 -0.363 -22.031 -14.730 1.00 0.00 C ATOM 1367 OH TYR B 12 -1.100 -22.855 -15.555 1.00 0.00 O ATOM 0 H TYR B 12 2.912 -18.381 -9.890 1.00 0.00 H new ATOM 0 HA TYR B 12 0.183 -18.944 -11.015 1.00 0.00 H new ATOM 0 HB2 TYR B 12 2.093 -18.486 -12.642 1.00 0.00 H new ATOM 0 HB3 TYR B 12 2.926 -19.881 -11.986 1.00 0.00 H new ATOM 0 HD1 TYR B 12 -0.630 -19.119 -12.988 1.00 0.00 H new ATOM 0 HD2 TYR B 12 2.724 -21.781 -13.319 1.00 0.00 H new ATOM 0 HE1 TYR B 12 -1.953 -20.601 -14.470 1.00 0.00 H new ATOM 0 HE2 TYR B 12 1.400 -23.266 -14.797 1.00 0.00 H new ATOM 0 HH TYR B 12 -0.554 -23.624 -15.822 1.00 0.00 H new ATOM 1377 N LYS B 13 0.299 -21.472 -10.424 1.00 0.00 N ATOM 1378 CA LYS B 13 0.217 -22.790 -9.730 1.00 0.00 C ATOM 1379 C LYS B 13 -0.303 -23.846 -10.708 1.00 0.00 C ATOM 1380 O LYS B 13 -1.200 -23.588 -11.491 1.00 0.00 O ATOM 1381 CB LYS B 13 -0.738 -22.678 -8.540 1.00 0.00 C ATOM 1382 CG LYS B 13 0.037 -22.204 -7.309 1.00 0.00 C ATOM 1383 CD LYS B 13 -0.743 -22.563 -6.044 1.00 0.00 C ATOM 1384 CE LYS B 13 -0.224 -21.733 -4.870 1.00 0.00 C ATOM 1385 NZ LYS B 13 -0.691 -20.325 -5.012 1.00 0.00 N ATOM 0 H LYS B 13 -0.381 -21.337 -11.173 1.00 0.00 H new ATOM 0 HA LYS B 13 1.206 -23.080 -9.375 1.00 0.00 H new ATOM 0 HB2 LYS B 13 -1.542 -21.978 -8.769 1.00 0.00 H new ATOM 0 HB3 LYS B 13 -1.203 -23.643 -8.341 1.00 0.00 H new ATOM 0 HG2 LYS B 13 1.022 -22.669 -7.285 1.00 0.00 H new ATOM 0 HG3 LYS B 13 0.194 -21.127 -7.358 1.00 0.00 H new ATOM 0 HD2 LYS B 13 -1.806 -22.375 -6.194 1.00 0.00 H new ATOM 0 HD3 LYS B 13 -0.635 -23.626 -5.827 1.00 0.00 H new ATOM 0 HE2 LYS B 13 -0.580 -22.152 -3.929 1.00 0.00 H new ATOM 0 HE3 LYS B 13 0.865 -21.765 -4.842 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 -0.691 -19.863 -4.080 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 -0.054 -19.811 -5.653 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 -1.655 -20.317 -5.402 1.00 0.00 H new ATOM 1399 N ARG B 14 0.255 -25.032 -10.672 1.00 0.00 N ATOM 1400 CA ARG B 14 -0.200 -26.111 -11.602 1.00 0.00 C ATOM 1401 C ARG B 14 -1.635 -26.518 -11.253 1.00 0.00 C ATOM 1402 O ARG B 14 -2.021 -26.534 -10.099 1.00 0.00 O ATOM 1403 CB ARG B 14 0.724 -27.326 -11.469 1.00 0.00 C ATOM 1404 CG ARG B 14 0.779 -27.772 -10.005 1.00 0.00 C ATOM 1405 CD ARG B 14 1.371 -29.180 -9.924 1.00 0.00 C ATOM 1406 NE ARG B 14 1.008 -29.796 -8.617 1.00 0.00 N ATOM 1407 CZ ARG B 14 1.924 -29.983 -7.706 1.00 0.00 C ATOM 1408 NH1 ARG B 14 2.683 -31.043 -7.753 1.00 0.00 N ATOM 1409 NH2 ARG B 14 2.080 -29.111 -6.749 1.00 0.00 N ATOM 0 H ARG B 14 1.007 -25.299 -10.037 1.00 0.00 H new ATOM 0 HA ARG B 14 -0.168 -25.742 -12.627 1.00 0.00 H new ATOM 0 HB2 ARG B 14 0.361 -28.142 -12.095 1.00 0.00 H new ATOM 0 HB3 ARG B 14 1.725 -27.075 -11.821 1.00 0.00 H new ATOM 0 HG2 ARG B 14 1.385 -27.077 -9.424 1.00 0.00 H new ATOM 0 HG3 ARG B 14 -0.221 -27.761 -9.572 1.00 0.00 H new ATOM 0 HD2 ARG B 14 0.995 -29.792 -10.744 1.00 0.00 H new ATOM 0 HD3 ARG B 14 2.455 -29.137 -10.030 1.00 0.00 H new ATOM 0 HE ARG B 14 0.043 -30.072 -8.434 1.00 0.00 H new ATOM 0 HH11 ARG B 14 2.561 -31.725 -8.501 1.00 0.00 H new ATOM 0 HH12 ARG B 14 3.399 -31.190 -7.041 1.00 0.00 H new ATOM 0 HH21 ARG B 14 1.486 -28.283 -6.712 1.00 0.00 H new ATOM 0 HH22 ARG B 14 2.796 -29.257 -6.037 1.00 0.00 H new ATOM 1423 N GLU B 15 -2.427 -26.848 -12.246 1.00 0.00 N ATOM 1424 CA GLU B 15 -3.839 -27.257 -11.981 1.00 0.00 C ATOM 1425 C GLU B 15 -3.913 -28.780 -11.852 1.00 0.00 C ATOM 1426 O GLU B 15 -2.895 -29.422 -12.055 1.00 0.00 O ATOM 1427 CB GLU B 15 -4.732 -26.799 -13.138 1.00 0.00 C ATOM 1428 CG GLU B 15 -4.169 -27.324 -14.460 1.00 0.00 C ATOM 1429 CD GLU B 15 -5.316 -27.577 -15.440 1.00 0.00 C ATOM 1430 OE1 GLU B 15 -5.889 -28.653 -15.383 1.00 0.00 O ATOM 1431 OE2 GLU B 15 -5.601 -26.692 -16.228 1.00 0.00 O ATOM 1432 OXT GLU B 15 -4.986 -29.279 -11.554 1.00 0.00 O ATOM 0 H GLU B 15 -2.154 -26.851 -13.229 1.00 0.00 H new ATOM 0 HA GLU B 15 -4.182 -26.796 -11.055 1.00 0.00 H new ATOM 0 HB2 GLU B 15 -5.748 -27.165 -12.993 1.00 0.00 H new ATOM 0 HB3 GLU B 15 -4.785 -25.711 -13.161 1.00 0.00 H new ATOM 0 HG2 GLU B 15 -3.469 -26.602 -14.881 1.00 0.00 H new ATOM 0 HG3 GLU B 15 -3.612 -28.246 -14.290 1.00 0.00 H new TER 1439 GLU B 15