USER MOD reduce.3.24.130724 H: found=0, std=0, add=719, rem=0, adj=16 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 Single : A 0 SER OG : rot 180:sc= 0.00474 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.109) USER MOD Single : A 7 TYR OH : rot 180:sc= 0 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 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 150:sc= 0 USER MOD Single : A 18 SER OG : rot 180:sc= -0.567 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= 0 K(o=0,f=-2.9!) USER MOD Single : A 32 CYS SG : rot 180:sc= -0.023 USER MOD Single : A 34 GLN : amide:sc= -0.202 X(o=-0.2,f=-0.0083) USER MOD Single : A 35 ASN : amide:sc= -0.808 K(o=-0.81,f=-1.7) USER MOD Single : A 37 TYR OH : rot 180:sc= -0.274 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= -0.0499 X(o=-0.05,f=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 ASN : amide:sc= -0.0695 X(o=-0.07,f=-0.33) USER MOD Single : A 52 TYR OH : rot 165:sc= -0.412 USER MOD Single : A 55 MET CE :methyl -178:sc= 0 (180deg=-0.00958) USER MOD Single : A 56 LYS NZ :NH3+ -130:sc= -1.32 (180deg=-3.59!) 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+ 180:sc= 0 (180deg=0) 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+ 180:sc= 0 (180deg=0) USER MOD Single : B 11 THR OG1 : rot 180:sc= 0 USER MOD Single : B 12 TYR OH : rot 59:sc= 0.0375 USER MOD Single : B 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -8 4.402 -11.093 -42.550 1.00 0.00 N ATOM 2 CA GLY A -8 4.693 -9.774 -41.822 1.00 0.00 C ATOM 3 C GLY A -8 4.472 -8.485 -42.519 1.00 0.00 C ATOM 4 O GLY A -8 3.474 -7.817 -42.340 1.00 0.00 O ATOM 0 H1 GLY A -8 4.611 -11.892 -41.918 1.00 0.00 H new ATOM 0 H2 GLY A -8 3.400 -11.123 -42.827 1.00 0.00 H new ATOM 0 H3 GLY A -8 4.998 -11.159 -43.400 1.00 0.00 H new ATOM 0 HA2 GLY A -8 4.087 -9.762 -40.916 1.00 0.00 H new ATOM 0 HA3 GLY A -8 5.736 -9.799 -41.508 1.00 0.00 H new ATOM 10 N SER A -7 5.434 -8.053 -43.364 1.00 0.00 N ATOM 11 CA SER A -7 5.270 -6.725 -44.084 1.00 0.00 C ATOM 12 C SER A -7 5.173 -5.631 -43.007 1.00 0.00 C ATOM 13 O SER A -7 4.096 -5.223 -42.597 1.00 0.00 O ATOM 14 CB SER A -7 4.011 -6.752 -44.934 1.00 0.00 C ATOM 15 OG SER A -7 4.377 -6.841 -46.300 1.00 0.00 O ATOM 0 H SER A -7 6.296 -8.557 -43.572 1.00 0.00 H new ATOM 0 HA SER A -7 6.114 -6.531 -44.746 1.00 0.00 H new ATOM 0 HB2 SER A -7 3.387 -7.601 -44.656 1.00 0.00 H new ATOM 0 HB3 SER A -7 3.421 -5.852 -44.761 1.00 0.00 H new ATOM 0 HG SER A -7 3.569 -6.861 -46.854 1.00 0.00 H new ATOM 21 N ARG A -6 6.299 -5.204 -42.515 1.00 0.00 N ATOM 22 CA ARG A -6 6.322 -4.194 -41.425 1.00 0.00 C ATOM 23 C ARG A -6 5.905 -2.816 -41.926 1.00 0.00 C ATOM 24 O ARG A -6 5.447 -2.650 -43.036 1.00 0.00 O ATOM 25 CB ARG A -6 7.727 -4.141 -40.838 1.00 0.00 C ATOM 26 CG ARG A -6 7.777 -4.985 -39.561 1.00 0.00 C ATOM 27 CD ARG A -6 8.212 -6.417 -39.894 1.00 0.00 C ATOM 28 NE ARG A -6 9.379 -6.788 -39.048 1.00 0.00 N ATOM 29 CZ ARG A -6 9.195 -7.389 -37.899 1.00 0.00 C ATOM 30 NH1 ARG A -6 8.792 -6.710 -36.864 1.00 0.00 N ATOM 31 NH2 ARG A -6 9.402 -8.672 -37.790 1.00 0.00 N ATOM 0 H ARG A -6 7.218 -5.517 -42.827 1.00 0.00 H new ATOM 0 HA ARG A -6 5.605 -4.488 -40.658 1.00 0.00 H new ATOM 0 HB2 ARG A -6 8.450 -4.515 -41.563 1.00 0.00 H new ATOM 0 HB3 ARG A -6 8.002 -3.110 -40.616 1.00 0.00 H new ATOM 0 HG2 ARG A -6 8.473 -4.541 -38.849 1.00 0.00 H new ATOM 0 HG3 ARG A -6 6.797 -4.996 -39.084 1.00 0.00 H new ATOM 0 HD2 ARG A -6 7.388 -7.109 -39.720 1.00 0.00 H new ATOM 0 HD3 ARG A -6 8.475 -6.493 -40.949 1.00 0.00 H new ATOM 0 HE ARG A -6 10.325 -6.574 -39.364 1.00 0.00 H new ATOM 0 HH11 ARG A -6 8.619 -5.708 -36.947 1.00 0.00 H new ATOM 0 HH12 ARG A -6 8.649 -7.180 -35.970 1.00 0.00 H new ATOM 0 HH21 ARG A -6 9.708 -9.210 -38.601 1.00 0.00 H new ATOM 0 HH22 ARG A -6 9.258 -9.138 -36.894 1.00 0.00 H new ATOM 45 N ARG A -5 6.037 -1.830 -41.071 1.00 0.00 N ATOM 46 CA ARG A -5 5.622 -0.434 -41.416 1.00 0.00 C ATOM 47 C ARG A -5 4.099 -0.395 -41.525 1.00 0.00 C ATOM 48 O ARG A -5 3.507 -0.967 -42.423 1.00 0.00 O ATOM 49 CB ARG A -5 6.265 0.033 -42.728 1.00 0.00 C ATOM 50 CG ARG A -5 7.008 1.361 -42.484 1.00 0.00 C ATOM 51 CD ARG A -5 8.485 1.078 -42.174 1.00 0.00 C ATOM 52 NE ARG A -5 9.338 1.886 -43.099 1.00 0.00 N ATOM 53 CZ ARG A -5 9.938 1.326 -44.133 1.00 0.00 C ATOM 54 NH1 ARG A -5 9.463 0.227 -44.671 1.00 0.00 N ATOM 55 NH2 ARG A -5 11.005 1.885 -44.640 1.00 0.00 N ATOM 0 H ARG A -5 6.422 -1.937 -40.132 1.00 0.00 H new ATOM 0 HA ARG A -5 5.960 0.244 -40.633 1.00 0.00 H new ATOM 0 HB2 ARG A -5 6.958 -0.723 -43.096 1.00 0.00 H new ATOM 0 HB3 ARG A -5 5.501 0.165 -43.494 1.00 0.00 H new ATOM 0 HG2 ARG A -5 6.927 2.001 -43.363 1.00 0.00 H new ATOM 0 HG3 ARG A -5 6.549 1.899 -41.654 1.00 0.00 H new ATOM 0 HD2 ARG A -5 8.708 1.332 -41.138 1.00 0.00 H new ATOM 0 HD3 ARG A -5 8.699 0.016 -42.295 1.00 0.00 H new ATOM 0 HE ARG A -5 9.458 2.884 -42.929 1.00 0.00 H new ATOM 0 HH11 ARG A -5 8.621 -0.204 -44.290 1.00 0.00 H new ATOM 0 HH12 ARG A -5 9.936 -0.196 -45.470 1.00 0.00 H new ATOM 0 HH21 ARG A -5 11.369 2.748 -44.237 1.00 0.00 H new ATOM 0 HH22 ARG A -5 11.474 1.458 -45.439 1.00 0.00 H new ATOM 69 N ALA A -4 3.468 0.269 -40.596 1.00 0.00 N ATOM 70 CA ALA A -4 1.980 0.349 -40.591 1.00 0.00 C ATOM 71 C ALA A -4 1.556 1.673 -39.963 1.00 0.00 C ATOM 72 O ALA A -4 2.137 2.111 -38.985 1.00 0.00 O ATOM 73 CB ALA A -4 1.423 -0.811 -39.754 1.00 0.00 C ATOM 0 H ALA A -4 3.926 0.765 -39.831 1.00 0.00 H new ATOM 0 HA ALA A -4 1.598 0.286 -41.610 1.00 0.00 H new ATOM 0 HB1 ALA A -4 0.334 -0.762 -39.744 1.00 0.00 H new ATOM 0 HB2 ALA A -4 1.740 -1.759 -40.190 1.00 0.00 H new ATOM 0 HB3 ALA A -4 1.799 -0.737 -38.734 1.00 0.00 H new ATOM 79 N SER A -3 0.555 2.323 -40.510 1.00 0.00 N ATOM 80 CA SER A -3 0.103 3.618 -39.917 1.00 0.00 C ATOM 81 C SER A -3 -0.637 3.331 -38.606 1.00 0.00 C ATOM 82 O SER A -3 -0.086 3.495 -37.530 1.00 0.00 O ATOM 83 CB SER A -3 -0.813 4.353 -40.899 1.00 0.00 C ATOM 84 OG SER A -3 -0.090 4.647 -42.091 1.00 0.00 O ATOM 0 H SER A -3 0.037 2.015 -41.333 1.00 0.00 H new ATOM 0 HA SER A -3 0.965 4.253 -39.715 1.00 0.00 H new ATOM 0 HB2 SER A -3 -1.683 3.739 -41.131 1.00 0.00 H new ATOM 0 HB3 SER A -3 -1.183 5.274 -40.449 1.00 0.00 H new ATOM 0 HG SER A -3 -0.676 5.116 -42.721 1.00 0.00 H new ATOM 90 N VAL A -2 -1.876 2.891 -38.672 1.00 0.00 N ATOM 91 CA VAL A -2 -2.624 2.575 -37.402 1.00 0.00 C ATOM 92 C VAL A -2 -3.206 1.164 -37.483 1.00 0.00 C ATOM 93 O VAL A -2 -4.016 0.858 -38.337 1.00 0.00 O ATOM 94 CB VAL A -2 -3.786 3.601 -37.115 1.00 0.00 C ATOM 95 CG1 VAL A -2 -3.499 4.333 -35.800 1.00 0.00 C ATOM 96 CG2 VAL A -2 -3.920 4.641 -38.245 1.00 0.00 C ATOM 0 H VAL A -2 -2.397 2.738 -39.535 1.00 0.00 H new ATOM 0 HA VAL A -2 -1.910 2.647 -36.582 1.00 0.00 H new ATOM 0 HB VAL A -2 -4.720 3.042 -37.052 1.00 0.00 H new ATOM 0 HG11 VAL A -2 -4.300 5.044 -35.597 1.00 0.00 H new ATOM 0 HG12 VAL A -2 -3.441 3.610 -34.986 1.00 0.00 H new ATOM 0 HG13 VAL A -2 -2.552 4.867 -35.880 1.00 0.00 H new ATOM 0 HG21 VAL A -2 -4.731 5.330 -38.011 1.00 0.00 H new ATOM 0 HG22 VAL A -2 -2.987 5.197 -38.340 1.00 0.00 H new ATOM 0 HG23 VAL A -2 -4.136 4.132 -39.184 1.00 0.00 H new ATOM 106 N GLY A -1 -2.804 0.315 -36.574 1.00 0.00 N ATOM 107 CA GLY A -1 -3.324 -1.077 -36.543 1.00 0.00 C ATOM 108 C GLY A -1 -3.025 -1.660 -35.171 1.00 0.00 C ATOM 109 O GLY A -1 -1.992 -2.266 -34.962 1.00 0.00 O ATOM 0 H GLY A -1 -2.127 0.534 -35.843 1.00 0.00 H new ATOM 0 HA2 GLY A -1 -4.397 -1.087 -36.736 1.00 0.00 H new ATOM 0 HA3 GLY A -1 -2.854 -1.677 -37.323 1.00 0.00 H new ATOM 113 N SER A 0 -3.907 -1.456 -34.221 1.00 0.00 N ATOM 114 CA SER A 0 -3.662 -1.974 -32.844 1.00 0.00 C ATOM 115 C SER A 0 -4.703 -3.041 -32.486 1.00 0.00 C ATOM 116 O SER A 0 -5.691 -3.216 -33.174 1.00 0.00 O ATOM 117 CB SER A 0 -3.784 -0.815 -31.848 1.00 0.00 C ATOM 118 OG SER A 0 -4.730 0.133 -32.345 1.00 0.00 O ATOM 0 H SER A 0 -4.786 -0.952 -34.343 1.00 0.00 H new ATOM 0 HA SER A 0 -2.666 -2.414 -32.801 1.00 0.00 H new ATOM 0 HB2 SER A 0 -4.102 -1.188 -30.875 1.00 0.00 H new ATOM 0 HB3 SER A 0 -2.814 -0.339 -31.705 1.00 0.00 H new ATOM 0 HG SER A 0 -4.813 0.876 -31.711 1.00 0.00 H new ATOM 124 N MET A 1 -4.499 -3.738 -31.397 1.00 0.00 N ATOM 125 CA MET A 1 -5.478 -4.768 -30.955 1.00 0.00 C ATOM 126 C MET A 1 -5.957 -4.440 -29.554 1.00 0.00 C ATOM 127 O MET A 1 -5.730 -3.345 -29.054 1.00 0.00 O ATOM 128 CB MET A 1 -4.847 -6.155 -31.017 1.00 0.00 C ATOM 129 CG MET A 1 -5.116 -6.762 -32.391 1.00 0.00 C ATOM 130 SD MET A 1 -3.759 -6.381 -33.529 1.00 0.00 S ATOM 131 CE MET A 1 -4.689 -6.608 -35.070 1.00 0.00 C ATOM 0 H MET A 1 -3.685 -3.633 -30.791 1.00 0.00 H new ATOM 0 HA MET A 1 -6.339 -4.767 -31.623 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.774 -6.089 -30.838 1.00 0.00 H new ATOM 0 HB3 MET A 1 -5.261 -6.792 -30.236 1.00 0.00 H new ATOM 0 HG2 MET A 1 -5.231 -7.842 -32.302 1.00 0.00 H new ATOM 0 HG3 MET A 1 -6.053 -6.373 -32.790 1.00 0.00 H new ATOM 0 HE1 MET A 1 -4.034 -6.420 -35.921 1.00 0.00 H new ATOM 0 HE2 MET A 1 -5.065 -7.630 -35.121 1.00 0.00 H new ATOM 0 HE3 MET A 1 -5.527 -5.911 -35.095 1.00 0.00 H new ATOM 141 N GLU A 2 -6.662 -5.351 -28.923 1.00 0.00 N ATOM 142 CA GLU A 2 -7.201 -5.084 -27.603 1.00 0.00 C ATOM 143 C GLU A 2 -6.693 -6.141 -26.639 1.00 0.00 C ATOM 144 O GLU A 2 -5.920 -7.010 -27.002 1.00 0.00 O ATOM 145 CB GLU A 2 -8.741 -5.172 -27.713 1.00 0.00 C ATOM 146 CG GLU A 2 -9.381 -3.833 -27.354 1.00 0.00 C ATOM 147 CD GLU A 2 -10.762 -3.739 -28.007 1.00 0.00 C ATOM 148 OE1 GLU A 2 -10.911 -4.228 -29.116 1.00 0.00 O ATOM 149 OE2 GLU A 2 -11.646 -3.174 -27.387 1.00 0.00 O ATOM 0 H GLU A 2 -6.876 -6.276 -29.295 1.00 0.00 H new ATOM 0 HA GLU A 2 -6.898 -4.102 -27.240 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -9.023 -5.456 -28.727 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -9.115 -5.950 -27.048 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -9.471 -3.739 -26.272 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -8.749 -3.012 -27.694 1.00 0.00 H new ATOM 156 N ALA A 3 -7.122 -6.058 -25.422 1.00 0.00 N ATOM 157 CA ALA A 3 -6.709 -7.045 -24.392 1.00 0.00 C ATOM 158 C ALA A 3 -7.717 -7.055 -23.234 1.00 0.00 C ATOM 159 O ALA A 3 -7.935 -6.079 -22.556 1.00 0.00 O ATOM 160 CB ALA A 3 -5.344 -6.681 -23.891 1.00 0.00 C ATOM 0 H ALA A 3 -7.756 -5.333 -25.086 1.00 0.00 H new ATOM 0 HA ALA A 3 -6.682 -8.043 -24.830 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -5.031 -7.400 -23.134 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -4.636 -6.696 -24.720 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -5.371 -5.683 -23.455 1.00 0.00 H new ATOM 166 N ILE A 4 -8.334 -8.167 -23.033 1.00 0.00 N ATOM 167 CA ILE A 4 -9.359 -8.310 -21.964 1.00 0.00 C ATOM 168 C ILE A 4 -8.809 -8.006 -20.596 1.00 0.00 C ATOM 169 O ILE A 4 -7.842 -8.577 -20.165 1.00 0.00 O ATOM 170 CB ILE A 4 -9.878 -9.736 -21.969 1.00 0.00 C ATOM 171 CG1 ILE A 4 -10.837 -9.982 -20.765 1.00 0.00 C ATOM 172 CG2 ILE A 4 -8.710 -10.718 -21.889 1.00 0.00 C ATOM 173 CD1 ILE A 4 -12.076 -10.654 -21.269 1.00 0.00 C ATOM 0 H ILE A 4 -8.172 -9.014 -23.577 1.00 0.00 H new ATOM 0 HA ILE A 4 -10.154 -7.594 -22.173 1.00 0.00 H new ATOM 0 HB ILE A 4 -10.428 -9.892 -22.897 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -10.349 -10.603 -20.014 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -11.089 -9.037 -20.283 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -9.092 -11.739 -21.893 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -8.053 -10.573 -22.747 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -8.150 -10.544 -20.970 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -12.757 -10.833 -20.437 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -12.563 -10.015 -22.006 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -11.812 -11.605 -21.732 1.00 0.00 H new ATOM 185 N ALA A 5 -9.484 -7.150 -19.894 1.00 0.00 N ATOM 186 CA ALA A 5 -9.064 -6.849 -18.472 1.00 0.00 C ATOM 187 C ALA A 5 -9.562 -8.002 -17.572 1.00 0.00 C ATOM 188 O ALA A 5 -10.687 -8.032 -17.122 1.00 0.00 O ATOM 189 CB ALA A 5 -9.672 -5.540 -17.985 1.00 0.00 C ATOM 0 H ALA A 5 -10.304 -6.641 -20.224 1.00 0.00 H new ATOM 0 HA ALA A 5 -7.979 -6.756 -18.431 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -9.353 -5.350 -16.960 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -9.340 -4.724 -18.626 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -10.759 -5.609 -18.020 1.00 0.00 H new ATOM 195 N LYS A 6 -8.722 -8.946 -17.345 1.00 0.00 N ATOM 196 CA LYS A 6 -9.065 -10.155 -16.538 1.00 0.00 C ATOM 197 C LYS A 6 -9.805 -9.816 -15.233 1.00 0.00 C ATOM 198 O LYS A 6 -10.624 -10.584 -14.776 1.00 0.00 O ATOM 199 CB LYS A 6 -7.747 -10.866 -16.220 1.00 0.00 C ATOM 200 CG LYS A 6 -7.929 -12.368 -16.201 1.00 0.00 C ATOM 201 CD LYS A 6 -6.687 -13.043 -16.819 1.00 0.00 C ATOM 202 CE LYS A 6 -6.721 -14.552 -16.518 1.00 0.00 C ATOM 203 NZ LYS A 6 -7.911 -15.184 -17.145 1.00 0.00 N ATOM 0 H LYS A 6 -7.764 -8.942 -17.696 1.00 0.00 H new ATOM 0 HA LYS A 6 -9.744 -10.785 -17.113 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -6.997 -10.597 -16.963 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -7.373 -10.530 -15.253 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -8.074 -12.715 -15.178 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -8.823 -12.644 -16.761 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -6.667 -12.876 -17.896 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -5.778 -12.600 -16.411 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -5.812 -15.024 -16.893 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -6.743 -14.713 -15.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -7.822 -16.219 -17.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -8.770 -14.884 -16.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -7.975 -14.892 -18.141 1.00 0.00 H new ATOM 217 N TYR A 7 -9.526 -8.697 -14.636 1.00 0.00 N ATOM 218 CA TYR A 7 -10.225 -8.321 -13.365 1.00 0.00 C ATOM 219 C TYR A 7 -10.296 -6.814 -13.270 1.00 0.00 C ATOM 220 O TYR A 7 -9.912 -6.107 -14.179 1.00 0.00 O ATOM 221 CB TYR A 7 -9.449 -8.829 -12.138 1.00 0.00 C ATOM 222 CG TYR A 7 -8.925 -10.228 -12.324 1.00 0.00 C ATOM 223 CD1 TYR A 7 -9.724 -11.332 -12.004 1.00 0.00 C ATOM 224 CD2 TYR A 7 -7.625 -10.417 -12.782 1.00 0.00 C ATOM 225 CE1 TYR A 7 -9.216 -12.629 -12.152 1.00 0.00 C ATOM 226 CE2 TYR A 7 -7.113 -11.709 -12.932 1.00 0.00 C ATOM 227 CZ TYR A 7 -7.909 -12.816 -12.617 1.00 0.00 C ATOM 228 OH TYR A 7 -7.405 -14.084 -12.763 1.00 0.00 O ATOM 0 H TYR A 7 -8.842 -8.018 -14.969 1.00 0.00 H new ATOM 0 HA TYR A 7 -11.219 -8.768 -13.378 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -8.615 -8.156 -11.936 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -10.100 -8.802 -11.264 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -10.731 -11.184 -11.643 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -7.009 -9.563 -13.022 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -9.831 -13.482 -11.908 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -6.104 -11.853 -13.291 1.00 0.00 H new ATOM 0 HH TYR A 7 -6.485 -14.034 -13.097 1.00 0.00 H new ATOM 238 N ASP A 8 -10.762 -6.332 -12.160 1.00 0.00 N ATOM 239 CA ASP A 8 -10.859 -4.874 -11.935 1.00 0.00 C ATOM 240 C ASP A 8 -9.476 -4.330 -11.614 1.00 0.00 C ATOM 241 O ASP A 8 -8.533 -5.066 -11.393 1.00 0.00 O ATOM 242 CB ASP A 8 -11.785 -4.641 -10.747 1.00 0.00 C ATOM 243 CG ASP A 8 -12.995 -3.807 -11.157 1.00 0.00 C ATOM 244 OD1 ASP A 8 -13.930 -4.378 -11.685 1.00 0.00 O ATOM 245 OD2 ASP A 8 -12.970 -2.609 -10.921 1.00 0.00 O ATOM 0 H ASP A 8 -11.088 -6.904 -11.380 1.00 0.00 H new ATOM 0 HA ASP A 8 -11.248 -4.372 -12.821 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -12.117 -5.599 -10.346 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -11.241 -4.133 -9.951 1.00 0.00 H new ATOM 250 N PHE A 9 -9.370 -3.040 -11.568 1.00 0.00 N ATOM 251 CA PHE A 9 -8.075 -2.375 -11.257 1.00 0.00 C ATOM 252 C PHE A 9 -8.239 -0.858 -11.441 1.00 0.00 C ATOM 253 O PHE A 9 -9.224 -0.376 -11.994 1.00 0.00 O ATOM 254 CB PHE A 9 -6.958 -2.868 -12.222 1.00 0.00 C ATOM 255 CG PHE A 9 -5.705 -3.169 -11.422 1.00 0.00 C ATOM 256 CD1 PHE A 9 -5.771 -4.073 -10.365 1.00 0.00 C ATOM 257 CD2 PHE A 9 -4.493 -2.531 -11.719 1.00 0.00 C ATOM 258 CE1 PHE A 9 -4.632 -4.359 -9.604 1.00 0.00 C ATOM 259 CE2 PHE A 9 -3.355 -2.815 -10.949 1.00 0.00 C ATOM 260 CZ PHE A 9 -3.428 -3.733 -9.897 1.00 0.00 C ATOM 0 H PHE A 9 -10.144 -2.398 -11.737 1.00 0.00 H new ATOM 0 HA PHE A 9 -7.795 -2.617 -10.232 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -7.288 -3.761 -12.753 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -6.749 -2.108 -12.975 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -6.708 -4.557 -10.131 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -4.435 -1.826 -12.535 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -4.690 -5.066 -8.790 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -2.419 -2.323 -11.170 1.00 0.00 H new ATOM 0 HZ PHE A 9 -2.548 -3.955 -9.312 1.00 0.00 H new ATOM 270 N LYS A 10 -7.270 -0.121 -11.013 1.00 0.00 N ATOM 271 CA LYS A 10 -7.312 1.337 -11.191 1.00 0.00 C ATOM 272 C LYS A 10 -5.959 1.797 -11.618 1.00 0.00 C ATOM 273 O LYS A 10 -5.005 1.022 -11.617 1.00 0.00 O ATOM 274 CB LYS A 10 -7.802 2.052 -9.890 1.00 0.00 C ATOM 275 CG LYS A 10 -6.689 2.154 -8.807 1.00 0.00 C ATOM 276 CD LYS A 10 -6.633 3.573 -8.224 1.00 0.00 C ATOM 277 CE LYS A 10 -7.723 3.756 -7.154 1.00 0.00 C ATOM 278 NZ LYS A 10 -8.669 4.832 -7.597 1.00 0.00 N ATOM 0 H LYS A 10 -6.438 -0.474 -10.540 1.00 0.00 H new ATOM 0 HA LYS A 10 -8.034 1.600 -11.965 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -8.153 3.053 -10.140 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -8.654 1.509 -9.480 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -6.881 1.435 -8.011 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -5.724 1.896 -9.243 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -5.651 3.755 -7.787 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -6.769 4.306 -9.020 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -8.262 2.821 -7.002 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -7.271 4.022 -6.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -9.409 4.961 -6.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -8.148 5.723 -7.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -9.107 4.559 -8.500 1.00 0.00 H new ATOM 292 N ALA A 11 -5.837 3.019 -11.955 1.00 0.00 N ATOM 293 CA ALA A 11 -4.528 3.489 -12.342 1.00 0.00 C ATOM 294 C ALA A 11 -3.776 3.696 -11.030 1.00 0.00 C ATOM 295 O ALA A 11 -4.187 4.546 -10.265 1.00 0.00 O ATOM 296 CB ALA A 11 -4.593 4.822 -13.033 1.00 0.00 C ATOM 0 H ALA A 11 -6.587 3.710 -11.978 1.00 0.00 H new ATOM 0 HA ALA A 11 -4.061 2.778 -13.024 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -3.587 5.139 -13.307 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -5.204 4.737 -13.931 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -5.035 5.558 -12.362 1.00 0.00 H new ATOM 302 N THR A 12 -2.704 2.994 -10.731 1.00 0.00 N ATOM 303 CA THR A 12 -2.048 3.311 -9.394 1.00 0.00 C ATOM 304 C THR A 12 -0.704 4.095 -9.749 1.00 0.00 C ATOM 305 O THR A 12 -0.259 4.945 -9.023 1.00 0.00 O ATOM 306 CB THR A 12 -1.759 2.010 -8.373 1.00 0.00 C ATOM 307 OG1 THR A 12 -0.534 1.272 -8.108 1.00 0.00 O ATOM 308 CG2 THR A 12 -2.520 0.847 -8.861 1.00 0.00 C ATOM 0 H THR A 12 -2.272 2.265 -11.299 1.00 0.00 H new ATOM 0 HA THR A 12 -2.748 3.901 -8.803 1.00 0.00 H new ATOM 0 HB THR A 12 -1.938 2.620 -7.488 1.00 0.00 H new ATOM 0 HG1 THR A 12 -0.550 0.931 -7.189 1.00 0.00 H new ATOM 0 HG21 THR A 12 -2.341 -0.006 -8.206 1.00 0.00 H new ATOM 0 HG22 THR A 12 -3.584 1.084 -8.865 1.00 0.00 H new ATOM 0 HG23 THR A 12 -2.199 0.601 -9.873 1.00 0.00 H new ATOM 316 N ALA A 13 -0.097 3.866 -10.953 1.00 0.00 N ATOM 317 CA ALA A 13 1.109 4.704 -11.317 1.00 0.00 C ATOM 318 C ALA A 13 0.575 6.018 -11.837 1.00 0.00 C ATOM 319 O ALA A 13 -0.600 6.151 -12.125 1.00 0.00 O ATOM 320 CB ALA A 13 2.013 4.071 -12.381 1.00 0.00 C ATOM 0 H ALA A 13 -0.384 3.171 -11.642 1.00 0.00 H new ATOM 0 HA ALA A 13 1.733 4.812 -10.430 1.00 0.00 H new ATOM 0 HB1 ALA A 13 2.854 4.734 -12.585 1.00 0.00 H new ATOM 0 HB2 ALA A 13 2.386 3.113 -12.018 1.00 0.00 H new ATOM 0 HB3 ALA A 13 1.443 3.915 -13.297 1.00 0.00 H new ATOM 326 N ASP A 14 1.413 6.985 -11.965 1.00 0.00 N ATOM 327 CA ASP A 14 0.951 8.303 -12.473 1.00 0.00 C ATOM 328 C ASP A 14 0.669 8.226 -13.976 1.00 0.00 C ATOM 329 O ASP A 14 -0.004 9.078 -14.537 1.00 0.00 O ATOM 330 CB ASP A 14 2.028 9.284 -12.163 1.00 0.00 C ATOM 331 CG ASP A 14 1.415 10.686 -12.000 1.00 0.00 C ATOM 332 OD1 ASP A 14 0.863 11.192 -12.971 1.00 0.00 O ATOM 333 OD2 ASP A 14 1.493 11.221 -10.908 1.00 0.00 O ATOM 0 H ASP A 14 2.407 6.929 -11.741 1.00 0.00 H new ATOM 0 HA ASP A 14 0.018 8.609 -11.999 1.00 0.00 H new ATOM 0 HB2 ASP A 14 2.547 8.994 -11.249 1.00 0.00 H new ATOM 0 HB3 ASP A 14 2.769 9.290 -12.962 1.00 0.00 H new ATOM 338 N ASP A 15 1.153 7.194 -14.622 1.00 0.00 N ATOM 339 CA ASP A 15 0.916 7.010 -16.047 1.00 0.00 C ATOM 340 C ASP A 15 0.159 5.690 -16.258 1.00 0.00 C ATOM 341 O ASP A 15 0.317 5.040 -17.272 1.00 0.00 O ATOM 342 CB ASP A 15 2.277 6.965 -16.769 1.00 0.00 C ATOM 343 CG ASP A 15 3.001 5.605 -16.556 1.00 0.00 C ATOM 344 OD1 ASP A 15 3.713 5.475 -15.570 1.00 0.00 O ATOM 345 OD2 ASP A 15 2.828 4.724 -17.388 1.00 0.00 O ATOM 0 H ASP A 15 1.716 6.462 -14.189 1.00 0.00 H new ATOM 0 HA ASP A 15 0.321 7.830 -16.448 1.00 0.00 H new ATOM 0 HB2 ASP A 15 2.128 7.134 -17.835 1.00 0.00 H new ATOM 0 HB3 ASP A 15 2.909 7.774 -16.403 1.00 0.00 H new ATOM 350 N GLU A 16 -0.616 5.269 -15.282 1.00 0.00 N ATOM 351 CA GLU A 16 -1.325 3.975 -15.395 1.00 0.00 C ATOM 352 C GLU A 16 -2.750 4.161 -15.895 1.00 0.00 C ATOM 353 O GLU A 16 -3.293 5.254 -15.915 1.00 0.00 O ATOM 354 CB GLU A 16 -1.344 3.315 -14.012 1.00 0.00 C ATOM 355 CG GLU A 16 -1.680 1.843 -14.152 1.00 0.00 C ATOM 356 CD GLU A 16 -0.829 1.027 -13.193 1.00 0.00 C ATOM 357 OE1 GLU A 16 0.362 0.917 -13.438 1.00 0.00 O ATOM 358 OE2 GLU A 16 -1.373 0.524 -12.229 1.00 0.00 O ATOM 0 H GLU A 16 -0.781 5.777 -14.413 1.00 0.00 H new ATOM 0 HA GLU A 16 -0.803 3.347 -16.117 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -0.374 3.432 -13.529 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -2.079 3.806 -13.374 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -2.737 1.680 -13.943 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -1.504 1.516 -15.177 1.00 0.00 H new ATOM 365 N LEU A 17 -3.349 3.085 -16.318 1.00 0.00 N ATOM 366 CA LEU A 17 -4.722 3.134 -16.842 1.00 0.00 C ATOM 367 C LEU A 17 -5.672 2.384 -15.889 1.00 0.00 C ATOM 368 O LEU A 17 -5.504 1.211 -15.601 1.00 0.00 O ATOM 369 CB LEU A 17 -4.692 2.476 -18.244 1.00 0.00 C ATOM 370 CG LEU A 17 -6.093 2.334 -18.829 1.00 0.00 C ATOM 371 CD1 LEU A 17 -6.544 3.670 -19.421 1.00 0.00 C ATOM 372 CD2 LEU A 17 -6.077 1.252 -19.942 1.00 0.00 C ATOM 0 H LEU A 17 -2.927 2.157 -16.319 1.00 0.00 H new ATOM 0 HA LEU A 17 -5.087 4.158 -16.918 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -4.076 3.076 -18.915 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -4.225 1.494 -18.175 1.00 0.00 H new ATOM 0 HG LEU A 17 -6.786 2.039 -18.041 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -7.546 3.564 -19.838 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -6.555 4.429 -18.639 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -5.853 3.971 -20.209 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -7.077 1.148 -20.363 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -5.382 1.548 -20.728 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -5.760 0.299 -19.518 1.00 0.00 H new ATOM 384 N SER A 18 -6.682 3.068 -15.414 1.00 0.00 N ATOM 385 CA SER A 18 -7.664 2.455 -14.506 1.00 0.00 C ATOM 386 C SER A 18 -8.696 1.705 -15.345 1.00 0.00 C ATOM 387 O SER A 18 -9.133 2.197 -16.373 1.00 0.00 O ATOM 388 CB SER A 18 -8.346 3.565 -13.728 1.00 0.00 C ATOM 389 OG SER A 18 -7.472 4.694 -13.611 1.00 0.00 O ATOM 0 H SER A 18 -6.860 4.049 -15.630 1.00 0.00 H new ATOM 0 HA SER A 18 -7.181 1.762 -13.817 1.00 0.00 H new ATOM 0 HB2 SER A 18 -9.267 3.859 -14.231 1.00 0.00 H new ATOM 0 HB3 SER A 18 -8.624 3.207 -12.737 1.00 0.00 H new ATOM 0 HG SER A 18 -7.922 5.405 -13.109 1.00 0.00 H new ATOM 395 N PHE A 19 -9.117 0.531 -14.916 1.00 0.00 N ATOM 396 CA PHE A 19 -10.153 -0.209 -15.710 1.00 0.00 C ATOM 397 C PHE A 19 -10.934 -1.237 -14.849 1.00 0.00 C ATOM 398 O PHE A 19 -10.679 -1.436 -13.675 1.00 0.00 O ATOM 399 CB PHE A 19 -9.516 -0.909 -16.907 1.00 0.00 C ATOM 400 CG PHE A 19 -8.436 -1.857 -16.455 1.00 0.00 C ATOM 401 CD1 PHE A 19 -8.763 -3.173 -16.082 1.00 0.00 C ATOM 402 CD2 PHE A 19 -7.107 -1.427 -16.419 1.00 0.00 C ATOM 403 CE1 PHE A 19 -7.755 -4.059 -15.685 1.00 0.00 C ATOM 404 CE2 PHE A 19 -6.095 -2.310 -16.019 1.00 0.00 C ATOM 405 CZ PHE A 19 -6.418 -3.628 -15.650 1.00 0.00 C ATOM 0 H PHE A 19 -8.795 0.064 -14.069 1.00 0.00 H new ATOM 0 HA PHE A 19 -10.868 0.534 -16.064 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -10.278 -1.456 -17.463 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -9.096 -0.168 -17.587 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -9.792 -3.500 -16.102 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -6.860 -0.414 -16.700 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -8.004 -5.072 -15.406 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -5.067 -1.978 -15.994 1.00 0.00 H new ATOM 0 HZ PHE A 19 -5.639 -4.309 -15.340 1.00 0.00 H new ATOM 415 N LYS A 20 -11.928 -1.824 -15.445 1.00 0.00 N ATOM 416 CA LYS A 20 -12.810 -2.789 -14.735 1.00 0.00 C ATOM 417 C LYS A 20 -12.613 -4.236 -15.230 1.00 0.00 C ATOM 418 O LYS A 20 -11.872 -4.504 -16.157 1.00 0.00 O ATOM 419 CB LYS A 20 -14.250 -2.375 -15.031 1.00 0.00 C ATOM 420 CG LYS A 20 -14.478 -0.932 -14.577 1.00 0.00 C ATOM 421 CD LYS A 20 -15.666 -0.890 -13.632 1.00 0.00 C ATOM 422 CE LYS A 20 -16.966 -1.158 -14.425 1.00 0.00 C ATOM 423 NZ LYS A 20 -17.844 0.053 -14.348 1.00 0.00 N ATOM 0 H LYS A 20 -12.174 -1.671 -16.423 1.00 0.00 H new ATOM 0 HA LYS A 20 -12.572 -2.769 -13.672 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -14.452 -2.466 -16.098 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -14.943 -3.041 -14.517 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -13.587 -0.550 -14.078 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -14.661 -0.291 -15.439 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -15.546 -1.636 -12.847 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -15.720 0.082 -13.142 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -16.732 -1.388 -15.465 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -17.484 -2.025 -14.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -18.721 -0.120 -14.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -18.075 0.252 -13.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -17.346 0.869 -14.757 1.00 0.00 H new ATOM 437 N ARG A 21 -13.317 -5.162 -14.607 1.00 0.00 N ATOM 438 CA ARG A 21 -13.248 -6.597 -14.994 1.00 0.00 C ATOM 439 C ARG A 21 -14.081 -6.789 -16.261 1.00 0.00 C ATOM 440 O ARG A 21 -15.295 -6.820 -16.211 1.00 0.00 O ATOM 441 CB ARG A 21 -13.852 -7.409 -13.863 1.00 0.00 C ATOM 442 CG ARG A 21 -13.671 -8.901 -14.110 1.00 0.00 C ATOM 443 CD ARG A 21 -13.708 -9.595 -12.760 1.00 0.00 C ATOM 444 NE ARG A 21 -12.959 -10.878 -12.834 1.00 0.00 N ATOM 445 CZ ARG A 21 -13.557 -12.014 -12.567 1.00 0.00 C ATOM 446 NH1 ARG A 21 -14.399 -12.103 -11.574 1.00 0.00 N ATOM 447 NH2 ARG A 21 -13.295 -13.062 -13.281 1.00 0.00 N ATOM 0 H ARG A 21 -13.948 -4.967 -13.830 1.00 0.00 H new ATOM 0 HA ARG A 21 -12.221 -6.912 -15.177 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -13.381 -7.133 -12.920 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -14.913 -7.178 -13.770 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -14.461 -9.281 -14.758 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -12.724 -9.094 -14.614 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -13.270 -8.951 -11.997 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -14.740 -9.782 -12.465 1.00 0.00 H new ATOM 0 HE ARG A 21 -11.973 -10.874 -13.094 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -14.597 -11.285 -10.998 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -14.859 -12.991 -11.374 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -12.625 -13.002 -14.048 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -13.758 -13.947 -13.076 1.00 0.00 H new ATOM 461 N GLY A 22 -13.442 -6.866 -17.389 1.00 0.00 N ATOM 462 CA GLY A 22 -14.180 -7.012 -18.692 1.00 0.00 C ATOM 463 C GLY A 22 -13.990 -5.724 -19.514 1.00 0.00 C ATOM 464 O GLY A 22 -14.358 -5.662 -20.673 1.00 0.00 O ATOM 0 H GLY A 22 -12.426 -6.835 -17.476 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -13.803 -7.872 -19.245 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -15.240 -7.190 -18.508 1.00 0.00 H new ATOM 468 N ASP A 23 -13.373 -4.714 -18.924 1.00 0.00 N ATOM 469 CA ASP A 23 -13.108 -3.475 -19.627 1.00 0.00 C ATOM 470 C ASP A 23 -11.893 -3.749 -20.510 1.00 0.00 C ATOM 471 O ASP A 23 -10.765 -3.725 -20.048 1.00 0.00 O ATOM 472 CB ASP A 23 -12.783 -2.388 -18.603 1.00 0.00 C ATOM 473 CG ASP A 23 -13.718 -1.193 -18.807 1.00 0.00 C ATOM 474 OD1 ASP A 23 -14.088 -0.944 -19.945 1.00 0.00 O ATOM 475 OD2 ASP A 23 -14.059 -0.545 -17.827 1.00 0.00 O ATOM 0 H ASP A 23 -13.047 -4.730 -17.958 1.00 0.00 H new ATOM 0 HA ASP A 23 -13.959 -3.142 -20.221 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -12.895 -2.781 -17.593 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -11.745 -2.073 -18.710 1.00 0.00 H new ATOM 480 N ILE A 24 -12.115 -4.065 -21.737 1.00 0.00 N ATOM 481 CA ILE A 24 -10.981 -4.427 -22.624 1.00 0.00 C ATOM 482 C ILE A 24 -10.241 -3.171 -23.061 1.00 0.00 C ATOM 483 O ILE A 24 -10.827 -2.180 -23.448 1.00 0.00 O ATOM 484 CB ILE A 24 -11.476 -5.292 -23.780 1.00 0.00 C ATOM 485 CG1 ILE A 24 -12.495 -6.337 -23.205 1.00 0.00 C ATOM 486 CG2 ILE A 24 -10.271 -6.010 -24.369 1.00 0.00 C ATOM 487 CD1 ILE A 24 -12.847 -7.384 -24.235 1.00 0.00 C ATOM 0 H ILE A 24 -13.036 -4.091 -22.175 1.00 0.00 H new ATOM 0 HA ILE A 24 -10.254 -5.034 -22.084 1.00 0.00 H new ATOM 0 HB ILE A 24 -11.964 -4.695 -24.550 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -12.068 -6.818 -22.325 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -13.400 -5.824 -22.880 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -10.592 -6.638 -25.200 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -9.549 -5.276 -24.727 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -9.807 -6.631 -23.603 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -13.555 -8.093 -23.806 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -13.297 -6.903 -25.104 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -11.944 -7.912 -24.540 1.00 0.00 H new ATOM 499 N LEU A 25 -8.944 -3.199 -22.907 1.00 0.00 N ATOM 500 CA LEU A 25 -8.111 -2.009 -23.189 1.00 0.00 C ATOM 501 C LEU A 25 -7.622 -2.017 -24.635 1.00 0.00 C ATOM 502 O LEU A 25 -7.641 -3.032 -25.301 1.00 0.00 O ATOM 503 CB LEU A 25 -6.881 -2.013 -22.260 1.00 0.00 C ATOM 504 CG LEU A 25 -7.215 -2.382 -20.754 1.00 0.00 C ATOM 505 CD1 LEU A 25 -8.604 -1.864 -20.300 1.00 0.00 C ATOM 506 CD2 LEU A 25 -7.144 -3.917 -20.550 1.00 0.00 C ATOM 0 H LEU A 25 -8.423 -4.017 -22.591 1.00 0.00 H new ATOM 0 HA LEU A 25 -8.719 -1.120 -23.020 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -6.150 -2.724 -22.644 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -6.414 -1.029 -22.288 1.00 0.00 H new ATOM 0 HG LEU A 25 -6.465 -1.885 -20.138 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -8.776 -2.147 -19.262 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -8.635 -0.778 -20.390 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -9.379 -2.302 -20.929 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -7.375 -4.157 -19.512 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -7.866 -4.405 -21.205 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -6.141 -4.270 -20.789 1.00 0.00 H new ATOM 518 N LYS A 26 -7.140 -0.884 -25.109 1.00 0.00 N ATOM 519 CA LYS A 26 -6.603 -0.799 -26.528 1.00 0.00 C ATOM 520 C LYS A 26 -5.092 -0.730 -26.437 1.00 0.00 C ATOM 521 O LYS A 26 -4.558 0.283 -26.055 1.00 0.00 O ATOM 522 CB LYS A 26 -7.122 0.476 -27.195 1.00 0.00 C ATOM 523 CG LYS A 26 -8.644 0.357 -27.432 1.00 0.00 C ATOM 524 CD LYS A 26 -8.952 0.316 -28.946 1.00 0.00 C ATOM 525 CE LYS A 26 -10.000 1.378 -29.300 1.00 0.00 C ATOM 526 NZ LYS A 26 -9.307 2.630 -29.727 1.00 0.00 N ATOM 0 H LYS A 26 -7.093 -0.013 -24.581 1.00 0.00 H new ATOM 0 HA LYS A 26 -6.922 -1.662 -27.113 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -6.909 1.340 -26.566 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -6.608 0.637 -28.143 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -9.024 -0.545 -26.953 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -9.157 1.202 -26.973 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -8.039 0.491 -29.515 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -9.317 -0.673 -29.224 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -10.647 1.016 -30.099 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -10.638 1.577 -28.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -10.014 3.353 -29.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -8.708 2.977 -28.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -8.716 2.433 -30.560 1.00 0.00 H new ATOM 540 N VAL A 27 -4.388 -1.791 -26.744 1.00 0.00 N ATOM 541 CA VAL A 27 -2.895 -1.732 -26.571 1.00 0.00 C ATOM 542 C VAL A 27 -2.261 -0.640 -27.438 1.00 0.00 C ATOM 543 O VAL A 27 -2.280 -0.673 -28.650 1.00 0.00 O ATOM 544 CB VAL A 27 -2.229 -3.083 -26.835 1.00 0.00 C ATOM 545 CG1 VAL A 27 -0.871 -3.079 -26.143 1.00 0.00 C ATOM 546 CG2 VAL A 27 -3.091 -4.215 -26.253 1.00 0.00 C ATOM 0 H VAL A 27 -4.763 -2.672 -27.096 1.00 0.00 H new ATOM 0 HA VAL A 27 -2.720 -1.475 -25.526 1.00 0.00 H new ATOM 0 HB VAL A 27 -2.117 -3.243 -27.907 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -0.372 -4.033 -26.315 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -0.259 -2.272 -26.546 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -1.009 -2.929 -25.072 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.610 -5.174 -26.445 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -3.201 -4.073 -25.178 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -4.074 -4.202 -26.723 1.00 0.00 H new ATOM 556 N LEU A 28 -1.681 0.323 -26.774 1.00 0.00 N ATOM 557 CA LEU A 28 -1.003 1.451 -27.443 1.00 0.00 C ATOM 558 C LEU A 28 0.445 1.056 -27.702 1.00 0.00 C ATOM 559 O LEU A 28 1.042 1.424 -28.702 1.00 0.00 O ATOM 560 CB LEU A 28 -1.018 2.654 -26.470 1.00 0.00 C ATOM 561 CG LEU A 28 -2.016 3.737 -26.906 1.00 0.00 C ATOM 562 CD1 LEU A 28 -3.395 3.115 -27.200 1.00 0.00 C ATOM 563 CD2 LEU A 28 -2.150 4.760 -25.754 1.00 0.00 C ATOM 0 H LEU A 28 -1.653 0.367 -25.755 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.498 1.704 -28.380 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.275 2.307 -25.469 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -0.019 3.085 -26.412 1.00 0.00 H new ATOM 0 HG LEU A 28 -1.657 4.222 -27.814 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -4.089 3.897 -27.507 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -3.300 2.380 -27.999 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.773 2.627 -26.302 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -2.855 5.540 -26.041 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.512 4.255 -24.859 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -1.177 5.207 -25.549 1.00 0.00 H new ATOM 575 N ASN A 29 1.026 0.329 -26.773 1.00 0.00 N ATOM 576 CA ASN A 29 2.458 -0.075 -26.927 1.00 0.00 C ATOM 577 C ASN A 29 2.698 -1.504 -26.406 1.00 0.00 C ATOM 578 O ASN A 29 2.394 -1.828 -25.269 1.00 0.00 O ATOM 579 CB ASN A 29 3.331 0.904 -26.144 1.00 0.00 C ATOM 580 CG ASN A 29 4.717 0.997 -26.792 1.00 0.00 C ATOM 581 OD1 ASN A 29 5.192 0.049 -27.385 1.00 0.00 O ATOM 582 ND2 ASN A 29 5.375 2.115 -26.728 1.00 0.00 N ATOM 0 H ASN A 29 0.571 0.001 -25.921 1.00 0.00 H new ATOM 0 HA ASN A 29 2.713 -0.056 -27.986 1.00 0.00 H new ATOM 0 HB2 ASN A 29 2.862 1.888 -26.124 1.00 0.00 H new ATOM 0 HB3 ASN A 29 3.425 0.575 -25.109 1.00 0.00 H new ATOM 0 HD21 ASN A 29 6.288 2.196 -27.175 1.00 0.00 H new ATOM 0 HD22 ASN A 29 4.978 2.912 -26.231 1.00 0.00 H new ATOM 589 N GLU A 30 3.279 -2.351 -27.231 1.00 0.00 N ATOM 590 CA GLU A 30 3.588 -3.745 -26.796 1.00 0.00 C ATOM 591 C GLU A 30 5.027 -3.779 -26.298 1.00 0.00 C ATOM 592 O GLU A 30 5.709 -2.773 -26.298 1.00 0.00 O ATOM 593 CB GLU A 30 3.450 -4.718 -27.975 1.00 0.00 C ATOM 594 CG GLU A 30 1.970 -5.045 -28.225 1.00 0.00 C ATOM 595 CD GLU A 30 1.859 -6.438 -28.842 1.00 0.00 C ATOM 596 OE1 GLU A 30 2.272 -7.385 -28.189 1.00 0.00 O ATOM 597 OE2 GLU A 30 1.365 -6.541 -29.952 1.00 0.00 O ATOM 0 H GLU A 30 3.551 -2.130 -28.189 1.00 0.00 H new ATOM 0 HA GLU A 30 2.893 -4.043 -26.011 1.00 0.00 H new ATOM 0 HB2 GLU A 30 3.889 -4.279 -28.871 1.00 0.00 H new ATOM 0 HB3 GLU A 30 4.002 -5.634 -27.766 1.00 0.00 H new ATOM 0 HG2 GLU A 30 1.413 -5.004 -27.289 1.00 0.00 H new ATOM 0 HG3 GLU A 30 1.529 -4.303 -28.891 1.00 0.00 H new ATOM 604 N GLU A 31 5.499 -4.930 -25.886 1.00 0.00 N ATOM 605 CA GLU A 31 6.922 -5.036 -25.396 1.00 0.00 C ATOM 606 C GLU A 31 7.159 -4.097 -24.217 1.00 0.00 C ATOM 607 O GLU A 31 6.254 -3.479 -23.699 1.00 0.00 O ATOM 608 CB GLU A 31 7.880 -4.635 -26.532 1.00 0.00 C ATOM 609 CG GLU A 31 7.608 -5.477 -27.777 1.00 0.00 C ATOM 610 CD GLU A 31 7.923 -6.946 -27.485 1.00 0.00 C ATOM 611 OE1 GLU A 31 8.968 -7.208 -26.914 1.00 0.00 O ATOM 612 OE2 GLU A 31 7.111 -7.788 -27.842 1.00 0.00 O ATOM 0 H GLU A 31 4.968 -5.801 -25.865 1.00 0.00 H new ATOM 0 HA GLU A 31 7.102 -6.064 -25.081 1.00 0.00 H new ATOM 0 HB2 GLU A 31 7.756 -3.578 -26.766 1.00 0.00 H new ATOM 0 HB3 GLU A 31 8.913 -4.771 -26.211 1.00 0.00 H new ATOM 0 HG2 GLU A 31 6.566 -5.372 -28.079 1.00 0.00 H new ATOM 0 HG3 GLU A 31 8.218 -5.122 -28.608 1.00 0.00 H new ATOM 619 N CYS A 32 8.393 -3.978 -23.817 1.00 0.00 N ATOM 620 CA CYS A 32 8.765 -3.063 -22.688 1.00 0.00 C ATOM 621 C CYS A 32 8.167 -3.529 -21.361 1.00 0.00 C ATOM 622 O CYS A 32 7.268 -4.345 -21.318 1.00 0.00 O ATOM 623 CB CYS A 32 8.274 -1.639 -22.973 1.00 0.00 C ATOM 624 SG CYS A 32 8.816 -1.113 -24.622 1.00 0.00 S ATOM 0 H CYS A 32 9.178 -4.483 -24.229 1.00 0.00 H new ATOM 0 HA CYS A 32 9.852 -3.079 -22.608 1.00 0.00 H new ATOM 0 HB2 CYS A 32 7.187 -1.601 -22.910 1.00 0.00 H new ATOM 0 HB3 CYS A 32 8.661 -0.954 -22.218 1.00 0.00 H new ATOM 0 HG CYS A 32 8.392 0.094 -24.854 1.00 0.00 H new ATOM 630 N ASP A 33 8.649 -2.959 -20.278 1.00 0.00 N ATOM 631 CA ASP A 33 8.146 -3.290 -18.924 1.00 0.00 C ATOM 632 C ASP A 33 8.261 -4.789 -18.659 1.00 0.00 C ATOM 633 O ASP A 33 8.401 -5.589 -19.566 1.00 0.00 O ATOM 634 CB ASP A 33 6.738 -2.803 -18.854 1.00 0.00 C ATOM 635 CG ASP A 33 6.238 -2.783 -17.407 1.00 0.00 C ATOM 636 OD1 ASP A 33 6.123 -3.833 -16.820 1.00 0.00 O ATOM 637 OD2 ASP A 33 5.971 -1.699 -16.913 1.00 0.00 O ATOM 0 H ASP A 33 9.391 -2.259 -20.289 1.00 0.00 H new ATOM 0 HA ASP A 33 8.739 -2.806 -18.148 1.00 0.00 H new ATOM 0 HB2 ASP A 33 6.674 -1.801 -19.279 1.00 0.00 H new ATOM 0 HB3 ASP A 33 6.096 -3.446 -19.456 1.00 0.00 H new ATOM 642 N GLN A 34 8.272 -5.168 -17.409 1.00 0.00 N ATOM 643 CA GLN A 34 8.460 -6.600 -17.071 1.00 0.00 C ATOM 644 C GLN A 34 7.238 -7.421 -17.374 1.00 0.00 C ATOM 645 O GLN A 34 7.329 -8.557 -17.804 1.00 0.00 O ATOM 646 CB GLN A 34 8.780 -6.753 -15.576 1.00 0.00 C ATOM 647 CG GLN A 34 10.127 -6.113 -15.264 1.00 0.00 C ATOM 648 CD GLN A 34 10.251 -5.970 -13.751 1.00 0.00 C ATOM 649 OE1 GLN A 34 11.192 -6.461 -13.160 1.00 0.00 O ATOM 650 NE2 GLN A 34 9.336 -5.310 -13.096 1.00 0.00 N ATOM 0 H GLN A 34 8.158 -4.544 -16.610 1.00 0.00 H new ATOM 0 HA GLN A 34 9.286 -6.961 -17.684 1.00 0.00 H new ATOM 0 HB2 GLN A 34 7.998 -6.284 -14.978 1.00 0.00 H new ATOM 0 HB3 GLN A 34 8.798 -7.809 -15.306 1.00 0.00 H new ATOM 0 HG2 GLN A 34 10.938 -6.727 -15.655 1.00 0.00 H new ATOM 0 HG3 GLN A 34 10.204 -5.138 -15.745 1.00 0.00 H new ATOM 0 HE21 GLN A 34 8.547 -4.899 -13.596 1.00 0.00 H new ATOM 0 HE22 GLN A 34 9.409 -5.205 -12.084 1.00 0.00 H new ATOM 659 N ASN A 35 6.111 -6.876 -17.101 1.00 0.00 N ATOM 660 CA ASN A 35 4.835 -7.626 -17.296 1.00 0.00 C ATOM 661 C ASN A 35 3.659 -6.684 -17.458 1.00 0.00 C ATOM 662 O ASN A 35 2.546 -7.079 -17.246 1.00 0.00 O ATOM 663 CB ASN A 35 4.599 -8.478 -16.062 1.00 0.00 C ATOM 664 CG ASN A 35 5.309 -9.825 -16.225 1.00 0.00 C ATOM 665 OD1 ASN A 35 5.283 -10.421 -17.279 1.00 0.00 O ATOM 666 ND2 ASN A 35 5.951 -10.336 -15.216 1.00 0.00 N ATOM 0 H ASN A 35 6.000 -5.927 -16.744 1.00 0.00 H new ATOM 0 HA ASN A 35 4.918 -8.233 -18.198 1.00 0.00 H new ATOM 0 HB2 ASN A 35 4.972 -7.964 -15.176 1.00 0.00 H new ATOM 0 HB3 ASN A 35 3.530 -8.634 -15.914 1.00 0.00 H new ATOM 0 HD21 ASN A 35 6.428 -11.232 -15.316 1.00 0.00 H new ATOM 0 HD22 ASN A 35 5.978 -9.841 -14.325 1.00 0.00 H new ATOM 673 N TRP A 36 3.881 -5.466 -17.839 1.00 0.00 N ATOM 674 CA TRP A 36 2.728 -4.520 -18.022 1.00 0.00 C ATOM 675 C TRP A 36 2.845 -3.873 -19.423 1.00 0.00 C ATOM 676 O TRP A 36 3.920 -3.496 -19.850 1.00 0.00 O ATOM 677 CB TRP A 36 2.741 -3.395 -16.945 1.00 0.00 C ATOM 678 CG TRP A 36 2.844 -3.929 -15.532 1.00 0.00 C ATOM 679 CD1 TRP A 36 3.805 -4.771 -15.088 1.00 0.00 C ATOM 680 CD2 TRP A 36 2.043 -3.576 -14.344 1.00 0.00 C ATOM 681 NE1 TRP A 36 3.605 -5.014 -13.742 1.00 0.00 N ATOM 682 CE2 TRP A 36 2.556 -4.284 -13.232 1.00 0.00 C ATOM 683 CE3 TRP A 36 0.936 -2.726 -14.124 1.00 0.00 C ATOM 684 CZ2 TRP A 36 1.996 -4.161 -11.948 1.00 0.00 C ATOM 685 CZ3 TRP A 36 0.381 -2.589 -12.831 1.00 0.00 C ATOM 686 CH2 TRP A 36 0.919 -3.296 -11.747 1.00 0.00 C ATOM 0 H TRP A 36 4.802 -5.074 -18.034 1.00 0.00 H new ATOM 0 HA TRP A 36 1.797 -5.078 -17.921 1.00 0.00 H new ATOM 0 HB2 TRP A 36 3.580 -2.726 -17.137 1.00 0.00 H new ATOM 0 HB3 TRP A 36 1.832 -2.801 -17.037 1.00 0.00 H new ATOM 0 HD1 TRP A 36 4.601 -5.187 -15.689 1.00 0.00 H new ATOM 0 HE1 TRP A 36 4.170 -5.660 -13.190 1.00 0.00 H new ATOM 0 HE3 TRP A 36 0.510 -2.176 -14.950 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 2.396 -4.732 -11.123 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 -0.464 -1.934 -12.677 1.00 0.00 H new ATOM 0 HH2 TRP A 36 0.501 -3.172 -10.759 1.00 0.00 H new ATOM 697 N TYR A 37 1.745 -3.730 -20.130 1.00 0.00 N ATOM 698 CA TYR A 37 1.791 -3.084 -21.503 1.00 0.00 C ATOM 699 C TYR A 37 1.375 -1.618 -21.372 1.00 0.00 C ATOM 700 O TYR A 37 1.116 -1.145 -20.313 1.00 0.00 O ATOM 701 CB TYR A 37 0.702 -3.668 -22.441 1.00 0.00 C ATOM 702 CG TYR A 37 0.692 -5.158 -22.551 1.00 0.00 C ATOM 703 CD1 TYR A 37 -0.120 -5.904 -21.702 1.00 0.00 C ATOM 704 CD2 TYR A 37 1.399 -5.783 -23.576 1.00 0.00 C ATOM 705 CE1 TYR A 37 -0.236 -7.284 -21.878 1.00 0.00 C ATOM 706 CE2 TYR A 37 1.308 -7.163 -23.745 1.00 0.00 C ATOM 707 CZ TYR A 37 0.486 -7.920 -22.909 1.00 0.00 C ATOM 708 OH TYR A 37 0.365 -9.288 -23.125 1.00 0.00 O ATOM 0 H TYR A 37 0.818 -4.028 -19.825 1.00 0.00 H new ATOM 0 HA TYR A 37 2.798 -3.241 -21.890 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -0.275 -3.339 -22.087 1.00 0.00 H new ATOM 0 HB3 TYR A 37 0.839 -3.247 -23.437 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -0.661 -5.415 -20.906 1.00 0.00 H new ATOM 0 HD2 TYR A 37 2.018 -5.198 -24.240 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -0.876 -7.862 -21.228 1.00 0.00 H new ATOM 0 HE2 TYR A 37 1.875 -7.648 -24.525 1.00 0.00 H new ATOM 0 HH TYR A 37 0.935 -9.552 -23.878 1.00 0.00 H new ATOM 718 N LYS A 38 1.184 -0.964 -22.500 1.00 0.00 N ATOM 719 CA LYS A 38 0.616 0.399 -22.540 1.00 0.00 C ATOM 720 C LYS A 38 -0.728 0.188 -23.259 1.00 0.00 C ATOM 721 O LYS A 38 -0.825 -0.675 -24.114 1.00 0.00 O ATOM 722 CB LYS A 38 1.486 1.331 -23.366 1.00 0.00 C ATOM 723 CG LYS A 38 1.033 2.759 -23.106 1.00 0.00 C ATOM 724 CD LYS A 38 1.541 3.691 -24.216 1.00 0.00 C ATOM 725 CE LYS A 38 2.380 4.841 -23.597 1.00 0.00 C ATOM 726 NZ LYS A 38 1.514 6.036 -23.400 1.00 0.00 N ATOM 0 H LYS A 38 1.412 -1.346 -23.418 1.00 0.00 H new ATOM 0 HA LYS A 38 0.532 0.848 -21.550 1.00 0.00 H new ATOM 0 HB2 LYS A 38 2.535 1.210 -23.096 1.00 0.00 H new ATOM 0 HB3 LYS A 38 1.400 1.092 -24.426 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -0.055 2.799 -23.058 1.00 0.00 H new ATOM 0 HG3 LYS A 38 1.407 3.096 -22.139 1.00 0.00 H new ATOM 0 HD2 LYS A 38 2.147 3.128 -24.926 1.00 0.00 H new ATOM 0 HD3 LYS A 38 0.698 4.102 -24.772 1.00 0.00 H new ATOM 0 HE2 LYS A 38 2.804 4.524 -22.644 1.00 0.00 H new ATOM 0 HE3 LYS A 38 3.216 5.088 -24.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 2.075 6.807 -22.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 1.130 6.342 -24.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 0.731 5.795 -22.760 1.00 0.00 H new ATOM 740 N ALA A 39 -1.759 0.929 -22.921 1.00 0.00 N ATOM 741 CA ALA A 39 -3.088 0.732 -23.593 1.00 0.00 C ATOM 742 C ALA A 39 -4.015 1.845 -23.281 1.00 0.00 C ATOM 743 O ALA A 39 -3.635 2.833 -22.681 1.00 0.00 O ATOM 744 CB ALA A 39 -3.682 -0.603 -23.201 1.00 0.00 C ATOM 0 H ALA A 39 -1.739 1.660 -22.210 1.00 0.00 H new ATOM 0 HA ALA A 39 -2.931 0.732 -24.672 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -4.645 -0.732 -23.695 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -3.008 -1.404 -23.504 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -3.822 -0.636 -22.120 1.00 0.00 H new ATOM 750 N GLU A 40 -5.213 1.748 -23.766 1.00 0.00 N ATOM 751 CA GLU A 40 -6.129 2.869 -23.591 1.00 0.00 C ATOM 752 C GLU A 40 -7.599 2.475 -23.692 1.00 0.00 C ATOM 753 O GLU A 40 -8.041 1.769 -24.572 1.00 0.00 O ATOM 754 CB GLU A 40 -5.712 3.929 -24.652 1.00 0.00 C ATOM 755 CG GLU A 40 -6.828 4.273 -25.659 1.00 0.00 C ATOM 756 CD GLU A 40 -6.371 5.420 -26.554 1.00 0.00 C ATOM 757 OE1 GLU A 40 -6.228 6.521 -26.046 1.00 0.00 O ATOM 758 OE2 GLU A 40 -6.173 5.173 -27.724 1.00 0.00 O ATOM 0 H GLU A 40 -5.585 0.943 -24.270 1.00 0.00 H new ATOM 0 HA GLU A 40 -6.050 3.272 -22.581 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -5.404 4.840 -24.140 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.843 3.561 -25.198 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -7.068 3.399 -26.264 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -7.738 4.553 -25.128 1.00 0.00 H new ATOM 765 N LEU A 41 -8.338 3.013 -22.790 1.00 0.00 N ATOM 766 CA LEU A 41 -9.822 2.789 -22.740 1.00 0.00 C ATOM 767 C LEU A 41 -10.609 3.845 -23.417 1.00 0.00 C ATOM 768 O LEU A 41 -11.041 4.817 -22.834 1.00 0.00 O ATOM 769 CB LEU A 41 -10.332 2.635 -21.311 1.00 0.00 C ATOM 770 CG LEU A 41 -10.305 1.177 -20.969 1.00 0.00 C ATOM 771 CD1 LEU A 41 -10.275 0.995 -19.459 1.00 0.00 C ATOM 772 CD2 LEU A 41 -11.562 0.521 -21.555 1.00 0.00 C ATOM 0 H LEU A 41 -7.981 3.621 -22.053 1.00 0.00 H new ATOM 0 HA LEU A 41 -9.972 1.858 -23.286 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -9.708 3.201 -20.620 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -11.344 3.029 -21.222 1.00 0.00 H new ATOM 0 HG LEU A 41 -9.412 0.712 -21.387 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -10.256 -0.069 -19.221 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -9.384 1.474 -19.052 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -11.164 1.449 -19.020 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -11.562 -0.543 -21.317 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -12.449 0.988 -21.128 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -11.569 0.651 -22.637 1.00 0.00 H new ATOM 784 N ASN A 42 -10.900 3.581 -24.628 1.00 0.00 N ATOM 785 CA ASN A 42 -11.773 4.466 -25.429 1.00 0.00 C ATOM 786 C ASN A 42 -11.392 5.955 -25.314 1.00 0.00 C ATOM 787 O ASN A 42 -12.224 6.820 -25.521 1.00 0.00 O ATOM 788 CB ASN A 42 -13.174 4.294 -24.905 1.00 0.00 C ATOM 789 CG ASN A 42 -13.838 3.089 -25.607 1.00 0.00 C ATOM 790 OD1 ASN A 42 -14.234 2.129 -24.965 1.00 0.00 O ATOM 791 ND2 ASN A 42 -13.973 3.098 -26.906 1.00 0.00 N ATOM 0 H ASN A 42 -10.562 2.759 -25.128 1.00 0.00 H new ATOM 0 HA ASN A 42 -11.672 4.190 -26.479 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -13.154 4.136 -23.827 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -13.755 5.199 -25.084 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -14.407 2.306 -27.379 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -13.644 3.897 -27.447 1.00 0.00 H new ATOM 798 N GLY A 43 -10.176 6.252 -24.981 1.00 0.00 N ATOM 799 CA GLY A 43 -9.760 7.692 -24.847 1.00 0.00 C ATOM 800 C GLY A 43 -8.782 7.848 -23.676 1.00 0.00 C ATOM 801 O GLY A 43 -7.840 8.619 -23.748 1.00 0.00 O ATOM 0 H GLY A 43 -9.442 5.570 -24.793 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -9.291 8.031 -25.771 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -10.637 8.319 -24.685 1.00 0.00 H new ATOM 805 N LYS A 44 -8.963 7.087 -22.615 1.00 0.00 N ATOM 806 CA LYS A 44 -8.037 7.145 -21.495 1.00 0.00 C ATOM 807 C LYS A 44 -6.897 6.256 -21.852 1.00 0.00 C ATOM 808 O LYS A 44 -6.961 5.509 -22.815 1.00 0.00 O ATOM 809 CB LYS A 44 -8.694 6.684 -20.213 1.00 0.00 C ATOM 810 CG LYS A 44 -9.317 7.887 -19.516 1.00 0.00 C ATOM 811 CD LYS A 44 -10.658 8.265 -20.175 1.00 0.00 C ATOM 812 CE LYS A 44 -11.656 7.121 -20.027 1.00 0.00 C ATOM 813 NZ LYS A 44 -13.008 7.584 -20.456 1.00 0.00 N ATOM 0 H LYS A 44 -9.733 6.427 -22.502 1.00 0.00 H new ATOM 0 HA LYS A 44 -7.705 8.168 -21.319 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -9.457 5.936 -20.429 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -7.959 6.210 -19.562 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -9.475 7.661 -18.462 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -8.633 8.734 -19.561 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -11.057 9.168 -19.713 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -10.503 8.488 -21.231 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -11.342 6.270 -20.631 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -11.687 6.783 -18.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -13.690 6.805 -20.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -13.306 8.384 -19.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -12.972 7.887 -21.450 1.00 0.00 H new ATOM 827 N ASP A 45 -5.840 6.358 -21.134 1.00 0.00 N ATOM 828 CA ASP A 45 -4.650 5.569 -21.483 1.00 0.00 C ATOM 829 C ASP A 45 -3.661 5.305 -20.309 1.00 0.00 C ATOM 830 O ASP A 45 -3.831 5.767 -19.198 1.00 0.00 O ATOM 831 CB ASP A 45 -3.979 6.328 -22.635 1.00 0.00 C ATOM 832 CG ASP A 45 -2.800 7.219 -22.177 1.00 0.00 C ATOM 833 OD1 ASP A 45 -2.933 7.881 -21.157 1.00 0.00 O ATOM 834 OD2 ASP A 45 -1.794 7.222 -22.862 1.00 0.00 O ATOM 0 H ASP A 45 -5.744 6.957 -20.314 1.00 0.00 H new ATOM 0 HA ASP A 45 -4.957 4.562 -21.764 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -3.618 5.611 -23.372 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -4.723 6.950 -23.133 1.00 0.00 H new ATOM 839 N GLY A 46 -2.598 4.585 -20.621 1.00 0.00 N ATOM 840 CA GLY A 46 -1.532 4.282 -19.623 1.00 0.00 C ATOM 841 C GLY A 46 -1.287 2.751 -19.474 1.00 0.00 C ATOM 842 O GLY A 46 -1.943 1.943 -20.095 1.00 0.00 O ATOM 0 H GLY A 46 -2.430 4.191 -21.547 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -0.605 4.769 -19.924 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -1.812 4.700 -18.656 1.00 0.00 H new ATOM 846 N PHE A 47 -0.293 2.376 -18.693 1.00 0.00 N ATOM 847 CA PHE A 47 0.090 0.930 -18.542 1.00 0.00 C ATOM 848 C PHE A 47 -1.022 0.038 -17.957 1.00 0.00 C ATOM 849 O PHE A 47 -1.988 0.500 -17.381 1.00 0.00 O ATOM 850 CB PHE A 47 1.331 0.838 -17.612 1.00 0.00 C ATOM 851 CG PHE A 47 2.585 1.419 -18.250 1.00 0.00 C ATOM 852 CD1 PHE A 47 2.753 1.455 -19.644 1.00 0.00 C ATOM 853 CD2 PHE A 47 3.598 1.911 -17.415 1.00 0.00 C ATOM 854 CE1 PHE A 47 3.922 1.987 -20.190 1.00 0.00 C ATOM 855 CE2 PHE A 47 4.763 2.445 -17.968 1.00 0.00 C ATOM 856 CZ PHE A 47 4.925 2.481 -19.354 1.00 0.00 C ATOM 0 H PHE A 47 0.277 3.022 -18.146 1.00 0.00 H new ATOM 0 HA PHE A 47 0.293 0.560 -19.547 1.00 0.00 H new ATOM 0 HB2 PHE A 47 1.123 1.366 -16.682 1.00 0.00 H new ATOM 0 HB3 PHE A 47 1.510 -0.206 -17.353 1.00 0.00 H new ATOM 0 HD1 PHE A 47 1.979 1.072 -20.292 1.00 0.00 H new ATOM 0 HD2 PHE A 47 3.477 1.877 -16.342 1.00 0.00 H new ATOM 0 HE1 PHE A 47 4.051 2.017 -21.262 1.00 0.00 H new ATOM 0 HE2 PHE A 47 5.539 2.830 -17.323 1.00 0.00 H new ATOM 0 HZ PHE A 47 5.828 2.892 -19.780 1.00 0.00 H new ATOM 866 N ILE A 48 -0.844 -1.275 -18.095 1.00 0.00 N ATOM 867 CA ILE A 48 -1.817 -2.255 -17.555 1.00 0.00 C ATOM 868 C ILE A 48 -1.050 -3.552 -17.106 1.00 0.00 C ATOM 869 O ILE A 48 -0.401 -4.175 -17.925 1.00 0.00 O ATOM 870 CB ILE A 48 -2.827 -2.629 -18.647 1.00 0.00 C ATOM 871 CG1 ILE A 48 -2.057 -3.042 -19.935 1.00 0.00 C ATOM 872 CG2 ILE A 48 -3.741 -1.415 -18.899 1.00 0.00 C ATOM 873 CD1 ILE A 48 -2.993 -3.165 -21.146 1.00 0.00 C ATOM 0 H ILE A 48 -0.045 -1.694 -18.571 1.00 0.00 H new ATOM 0 HA ILE A 48 -2.339 -1.816 -16.705 1.00 0.00 H new ATOM 0 HB ILE A 48 -3.444 -3.473 -18.339 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -1.283 -2.305 -20.148 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -1.553 -3.994 -19.767 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -4.467 -1.661 -19.674 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -4.265 -1.157 -17.979 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -3.138 -0.567 -19.223 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -2.416 -3.455 -22.024 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -3.751 -3.921 -20.944 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -3.477 -2.206 -21.331 1.00 0.00 H new ATOM 885 N PRO A 49 -1.166 -3.963 -15.839 1.00 0.00 N ATOM 886 CA PRO A 49 -0.517 -5.197 -15.373 1.00 0.00 C ATOM 887 C PRO A 49 -1.116 -6.395 -16.069 1.00 0.00 C ATOM 888 O PRO A 49 -2.220 -6.773 -15.823 1.00 0.00 O ATOM 889 CB PRO A 49 -0.777 -5.246 -13.866 1.00 0.00 C ATOM 890 CG PRO A 49 -1.966 -4.282 -13.619 1.00 0.00 C ATOM 891 CD PRO A 49 -1.931 -3.269 -14.802 1.00 0.00 C ATOM 0 HA PRO A 49 0.551 -5.212 -15.592 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -1.019 -6.258 -13.542 1.00 0.00 H new ATOM 0 HB3 PRO A 49 0.104 -4.934 -13.305 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -2.912 -4.823 -13.593 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -1.865 -3.771 -12.661 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -2.935 -3.021 -15.145 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -1.453 -2.333 -14.512 1.00 0.00 H new ATOM 899 N LYS A 50 -0.354 -6.956 -16.960 1.00 0.00 N ATOM 900 CA LYS A 50 -0.752 -8.155 -17.771 1.00 0.00 C ATOM 901 C LYS A 50 -1.497 -9.264 -16.982 1.00 0.00 C ATOM 902 O LYS A 50 -2.334 -9.918 -17.540 1.00 0.00 O ATOM 903 CB LYS A 50 0.527 -8.748 -18.287 1.00 0.00 C ATOM 904 CG LYS A 50 0.220 -9.781 -19.340 1.00 0.00 C ATOM 905 CD LYS A 50 1.534 -10.102 -20.075 1.00 0.00 C ATOM 906 CE LYS A 50 1.712 -11.629 -20.200 1.00 0.00 C ATOM 907 NZ LYS A 50 2.694 -11.955 -21.275 1.00 0.00 N ATOM 0 H LYS A 50 0.583 -6.617 -17.176 1.00 0.00 H new ATOM 0 HA LYS A 50 -1.446 -7.816 -18.540 1.00 0.00 H new ATOM 0 HB2 LYS A 50 1.159 -7.965 -18.706 1.00 0.00 H new ATOM 0 HB3 LYS A 50 1.084 -9.204 -17.468 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -0.193 -10.681 -18.884 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -0.527 -9.405 -20.039 1.00 0.00 H new ATOM 0 HD2 LYS A 50 1.526 -9.647 -21.065 1.00 0.00 H new ATOM 0 HD3 LYS A 50 2.377 -9.673 -19.533 1.00 0.00 H new ATOM 0 HE2 LYS A 50 2.054 -12.040 -19.250 1.00 0.00 H new ATOM 0 HE3 LYS A 50 0.752 -12.096 -20.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 2.802 -12.987 -21.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 2.352 -11.580 -22.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 3.613 -11.526 -21.047 1.00 0.00 H new ATOM 921 N ASN A 51 -1.147 -9.538 -15.743 1.00 0.00 N ATOM 922 CA ASN A 51 -1.812 -10.641 -15.015 1.00 0.00 C ATOM 923 C ASN A 51 -3.330 -10.357 -14.843 1.00 0.00 C ATOM 924 O ASN A 51 -4.143 -11.267 -14.761 1.00 0.00 O ATOM 925 CB ASN A 51 -1.123 -10.831 -13.705 1.00 0.00 C ATOM 926 CG ASN A 51 0.412 -10.908 -13.923 1.00 0.00 C ATOM 927 OD1 ASN A 51 1.115 -9.924 -13.758 1.00 0.00 O ATOM 928 ND2 ASN A 51 0.956 -12.052 -14.285 1.00 0.00 N ATOM 0 H ASN A 51 -0.430 -9.039 -15.216 1.00 0.00 H new ATOM 0 HA ASN A 51 -1.736 -11.565 -15.588 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -1.363 -10.006 -13.035 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -1.478 -11.744 -13.226 1.00 0.00 H new ATOM 0 HD21 ASN A 51 1.964 -12.115 -14.427 1.00 0.00 H new ATOM 0 HD22 ASN A 51 0.369 -12.875 -14.423 1.00 0.00 H new ATOM 935 N TYR A 52 -3.718 -9.109 -14.878 1.00 0.00 N ATOM 936 CA TYR A 52 -5.162 -8.756 -14.827 1.00 0.00 C ATOM 937 C TYR A 52 -5.577 -8.529 -16.269 1.00 0.00 C ATOM 938 O TYR A 52 -6.396 -7.673 -16.554 1.00 0.00 O ATOM 939 CB TYR A 52 -5.378 -7.429 -14.055 1.00 0.00 C ATOM 940 CG TYR A 52 -5.360 -7.588 -12.590 1.00 0.00 C ATOM 941 CD1 TYR A 52 -4.290 -8.192 -11.954 1.00 0.00 C ATOM 942 CD2 TYR A 52 -6.403 -7.053 -11.863 1.00 0.00 C ATOM 943 CE1 TYR A 52 -4.265 -8.268 -10.573 1.00 0.00 C ATOM 944 CE2 TYR A 52 -6.391 -7.115 -10.495 1.00 0.00 C ATOM 945 CZ TYR A 52 -5.317 -7.732 -9.828 1.00 0.00 C ATOM 946 OH TYR A 52 -5.309 -7.807 -8.446 1.00 0.00 O ATOM 0 H TYR A 52 -3.085 -8.311 -14.941 1.00 0.00 H new ATOM 0 HA TYR A 52 -5.732 -9.541 -14.330 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -4.603 -6.720 -14.344 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -6.333 -6.996 -14.353 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -3.477 -8.603 -12.534 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -7.231 -6.584 -12.374 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -3.433 -8.741 -10.072 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -7.206 -6.690 -9.928 1.00 0.00 H new ATOM 0 HH TYR A 52 -5.977 -7.190 -8.081 1.00 0.00 H new ATOM 956 N ILE A 53 -4.994 -9.258 -17.207 1.00 0.00 N ATOM 957 CA ILE A 53 -5.347 -9.022 -18.613 1.00 0.00 C ATOM 958 C ILE A 53 -5.057 -10.222 -19.485 1.00 0.00 C ATOM 959 O ILE A 53 -4.393 -11.162 -19.097 1.00 0.00 O ATOM 960 CB ILE A 53 -4.551 -7.847 -19.224 1.00 0.00 C ATOM 961 CG1 ILE A 53 -3.928 -6.966 -18.145 1.00 0.00 C ATOM 962 CG2 ILE A 53 -5.487 -6.984 -20.096 1.00 0.00 C ATOM 963 CD1 ILE A 53 -3.074 -5.912 -18.815 1.00 0.00 C ATOM 0 H ILE A 53 -4.303 -9.989 -17.041 1.00 0.00 H new ATOM 0 HA ILE A 53 -6.415 -8.803 -18.596 1.00 0.00 H new ATOM 0 HB ILE A 53 -3.749 -8.270 -19.828 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -4.707 -6.496 -17.544 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -3.323 -7.569 -17.468 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -4.923 -6.156 -20.526 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -5.903 -7.594 -20.898 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -6.297 -6.591 -19.482 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -2.622 -5.274 -18.056 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -2.290 -6.395 -19.397 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -3.695 -5.306 -19.475 1.00 0.00 H new ATOM 975 N GLU A 54 -5.461 -10.100 -20.723 1.00 0.00 N ATOM 976 CA GLU A 54 -5.163 -11.101 -21.727 1.00 0.00 C ATOM 977 C GLU A 54 -5.189 -10.386 -23.080 1.00 0.00 C ATOM 978 O GLU A 54 -5.810 -9.349 -23.242 1.00 0.00 O ATOM 979 CB GLU A 54 -6.146 -12.235 -21.718 1.00 0.00 C ATOM 980 CG GLU A 54 -5.406 -13.575 -21.494 1.00 0.00 C ATOM 981 CD GLU A 54 -6.204 -14.492 -20.560 1.00 0.00 C ATOM 982 OE1 GLU A 54 -7.411 -14.330 -20.486 1.00 0.00 O ATOM 983 OE2 GLU A 54 -5.596 -15.352 -19.933 1.00 0.00 O ATOM 0 H GLU A 54 -6.004 -9.309 -21.068 1.00 0.00 H new ATOM 0 HA GLU A 54 -4.190 -11.547 -21.522 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -6.884 -12.081 -20.930 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -6.689 -12.264 -22.662 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -5.249 -14.072 -22.451 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -4.421 -13.384 -21.068 1.00 0.00 H new ATOM 990 N MET A 55 -4.484 -10.904 -24.018 1.00 0.00 N ATOM 991 CA MET A 55 -4.376 -10.231 -25.346 1.00 0.00 C ATOM 992 C MET A 55 -5.358 -10.789 -26.357 1.00 0.00 C ATOM 993 O MET A 55 -5.264 -11.931 -26.757 1.00 0.00 O ATOM 994 CB MET A 55 -2.929 -10.424 -25.831 1.00 0.00 C ATOM 995 CG MET A 55 -2.718 -9.812 -27.226 1.00 0.00 C ATOM 996 SD MET A 55 -1.106 -10.347 -27.870 1.00 0.00 S ATOM 997 CE MET A 55 -0.611 -8.760 -28.579 1.00 0.00 C ATOM 0 H MET A 55 -3.964 -11.778 -23.935 1.00 0.00 H new ATOM 0 HA MET A 55 -4.623 -9.174 -25.242 1.00 0.00 H new ATOM 0 HB2 MET A 55 -2.242 -9.963 -25.122 1.00 0.00 H new ATOM 0 HB3 MET A 55 -2.692 -11.488 -25.859 1.00 0.00 H new ATOM 0 HG2 MET A 55 -3.515 -10.126 -27.899 1.00 0.00 H new ATOM 0 HG3 MET A 55 -2.759 -8.724 -27.170 1.00 0.00 H new ATOM 0 HE1 MET A 55 0.356 -8.867 -29.070 1.00 0.00 H new ATOM 0 HE2 MET A 55 -1.355 -8.440 -29.309 1.00 0.00 H new ATOM 0 HE3 MET A 55 -0.536 -8.015 -27.787 1.00 0.00 H new ATOM 1007 N LYS A 56 -6.294 -9.969 -26.795 1.00 0.00 N ATOM 1008 CA LYS A 56 -7.250 -10.410 -27.784 1.00 0.00 C ATOM 1009 C LYS A 56 -7.032 -9.669 -29.100 1.00 0.00 C ATOM 1010 O LYS A 56 -6.473 -8.575 -29.120 1.00 0.00 O ATOM 1011 CB LYS A 56 -8.613 -10.156 -27.264 1.00 0.00 C ATOM 1012 CG LYS A 56 -9.066 -11.390 -26.497 1.00 0.00 C ATOM 1013 CD LYS A 56 -10.595 -11.344 -26.215 1.00 0.00 C ATOM 1014 CE LYS A 56 -10.973 -10.032 -25.513 1.00 0.00 C ATOM 1015 NZ LYS A 56 -11.581 -9.091 -26.527 1.00 0.00 N ATOM 0 H LYS A 56 -6.410 -9.005 -26.484 1.00 0.00 H new ATOM 0 HA LYS A 56 -7.122 -11.475 -27.976 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -8.615 -9.282 -26.613 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -9.300 -9.944 -28.084 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -8.825 -12.286 -27.069 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -8.521 -11.457 -25.555 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -11.146 -11.434 -27.151 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -10.882 -12.192 -25.593 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -11.681 -10.226 -24.707 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -10.091 -9.579 -25.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -11.116 -8.163 -26.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -11.448 -9.478 -27.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -12.597 -8.983 -26.335 1.00 0.00 H new ATOM 1029 N PRO A 57 -7.457 -10.303 -30.191 1.00 0.00 N ATOM 1030 CA PRO A 57 -7.250 -9.763 -31.500 1.00 0.00 C ATOM 1031 C PRO A 57 -8.408 -8.826 -31.917 1.00 0.00 C ATOM 1032 O PRO A 57 -9.312 -8.563 -31.156 1.00 0.00 O ATOM 1033 CB PRO A 57 -7.224 -11.004 -32.388 1.00 0.00 C ATOM 1034 CG PRO A 57 -7.942 -12.115 -31.616 1.00 0.00 C ATOM 1035 CD PRO A 57 -8.161 -11.606 -30.207 1.00 0.00 C ATOM 0 HA PRO A 57 -6.345 -9.159 -31.565 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -7.721 -10.810 -33.338 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -6.199 -11.293 -32.618 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -8.893 -12.361 -32.089 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -7.345 -13.027 -31.608 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -9.222 -11.491 -29.983 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -7.751 -12.292 -29.465 1.00 0.00 H new ATOM 1043 N HIS A 58 -8.390 -8.365 -33.146 1.00 0.00 N ATOM 1044 CA HIS A 58 -9.498 -7.505 -33.663 1.00 0.00 C ATOM 1045 C HIS A 58 -10.185 -8.350 -34.772 1.00 0.00 C ATOM 1046 O HIS A 58 -9.725 -8.376 -35.896 1.00 0.00 O ATOM 1047 CB HIS A 58 -8.917 -6.206 -34.226 1.00 0.00 C ATOM 1048 CG HIS A 58 -9.861 -5.068 -33.964 1.00 0.00 C ATOM 1049 ND1 HIS A 58 -10.816 -4.685 -34.881 1.00 0.00 N ATOM 1050 CD2 HIS A 58 -10.008 -4.221 -32.893 1.00 0.00 C ATOM 1051 CE1 HIS A 58 -11.498 -3.652 -34.350 1.00 0.00 C ATOM 1052 NE2 HIS A 58 -11.041 -3.328 -33.139 1.00 0.00 N ATOM 0 H HIS A 58 -7.646 -8.551 -33.818 1.00 0.00 H new ATOM 0 HA HIS A 58 -10.212 -7.221 -32.890 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -7.950 -6.001 -33.767 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -8.746 -6.308 -35.298 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -9.409 -4.246 -31.994 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -12.315 -3.147 -34.844 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -11.378 -2.585 -32.527 1.00 0.00 H new ATOM 1060 N PRO A 59 -11.202 -9.127 -34.387 1.00 0.00 N ATOM 1061 CA PRO A 59 -11.847 -10.076 -35.305 1.00 0.00 C ATOM 1062 C PRO A 59 -12.937 -9.472 -36.192 1.00 0.00 C ATOM 1063 O PRO A 59 -13.199 -8.289 -36.191 1.00 0.00 O ATOM 1064 CB PRO A 59 -12.508 -11.073 -34.348 1.00 0.00 C ATOM 1065 CG PRO A 59 -12.722 -10.327 -33.003 1.00 0.00 C ATOM 1066 CD PRO A 59 -11.795 -9.117 -33.025 1.00 0.00 C ATOM 0 HA PRO A 59 -11.113 -10.482 -36.002 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -13.458 -11.424 -34.751 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -11.877 -11.951 -34.207 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -13.761 -10.017 -32.893 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -12.492 -10.977 -32.159 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -12.343 -8.194 -32.838 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -11.026 -9.192 -32.257 1.00 0.00 H new ATOM 1074 N GLU A 60 -13.601 -10.338 -36.925 1.00 0.00 N ATOM 1075 CA GLU A 60 -14.731 -9.925 -37.797 1.00 0.00 C ATOM 1076 C GLU A 60 -16.026 -10.193 -37.028 1.00 0.00 C ATOM 1077 O GLU A 60 -16.030 -10.942 -36.061 1.00 0.00 O ATOM 1078 CB GLU A 60 -14.686 -10.770 -39.072 1.00 0.00 C ATOM 1079 CG GLU A 60 -14.745 -9.865 -40.311 1.00 0.00 C ATOM 1080 CD GLU A 60 -14.225 -10.635 -41.524 1.00 0.00 C ATOM 1081 OE1 GLU A 60 -14.558 -11.801 -41.653 1.00 0.00 O ATOM 1082 OE2 GLU A 60 -13.502 -10.042 -42.309 1.00 0.00 O ATOM 0 H GLU A 60 -13.395 -11.337 -36.950 1.00 0.00 H new ATOM 0 HA GLU A 60 -14.672 -8.870 -38.066 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -13.773 -11.365 -39.091 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -15.522 -11.469 -39.083 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -15.769 -9.536 -40.487 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -14.145 -8.969 -40.150 1.00 0.00 H new ATOM 1089 N PHE A 61 -17.121 -9.596 -37.425 1.00 0.00 N ATOM 1090 CA PHE A 61 -18.392 -9.828 -36.680 1.00 0.00 C ATOM 1091 C PHE A 61 -19.536 -10.244 -37.651 1.00 0.00 C ATOM 1092 O PHE A 61 -19.462 -11.288 -38.265 1.00 0.00 O ATOM 1093 CB PHE A 61 -18.727 -8.563 -35.864 1.00 0.00 C ATOM 1094 CG PHE A 61 -17.780 -8.461 -34.681 1.00 0.00 C ATOM 1095 CD1 PHE A 61 -17.571 -9.571 -33.843 1.00 0.00 C ATOM 1096 CD2 PHE A 61 -17.116 -7.262 -34.420 1.00 0.00 C ATOM 1097 CE1 PHE A 61 -16.701 -9.473 -32.757 1.00 0.00 C ATOM 1098 CE2 PHE A 61 -16.247 -7.168 -33.327 1.00 0.00 C ATOM 1099 CZ PHE A 61 -16.040 -8.276 -32.500 1.00 0.00 C ATOM 0 H PHE A 61 -17.189 -8.965 -38.224 1.00 0.00 H new ATOM 0 HA PHE A 61 -18.275 -10.659 -35.984 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -18.638 -7.677 -36.493 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -19.759 -8.604 -35.515 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -18.085 -10.500 -34.041 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -17.273 -6.407 -35.061 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -16.540 -10.327 -32.115 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -15.736 -6.239 -33.122 1.00 0.00 H new ATOM 0 HZ PHE A 61 -15.365 -8.203 -31.660 1.00 0.00 H new ATOM 1109 N ILE A 62 -20.601 -9.469 -37.764 1.00 0.00 N ATOM 1110 CA ILE A 62 -21.755 -9.860 -38.652 1.00 0.00 C ATOM 1111 C ILE A 62 -22.829 -8.771 -38.509 1.00 0.00 C ATOM 1112 O ILE A 62 -23.512 -8.682 -37.507 1.00 0.00 O ATOM 1113 CB ILE A 62 -22.289 -11.258 -38.211 1.00 0.00 C ATOM 1114 CG1 ILE A 62 -23.687 -11.532 -38.801 1.00 0.00 C ATOM 1115 CG2 ILE A 62 -22.363 -11.339 -36.675 1.00 0.00 C ATOM 1116 CD1 ILE A 62 -23.617 -11.570 -40.329 1.00 0.00 C ATOM 0 H ILE A 62 -20.719 -8.580 -37.277 1.00 0.00 H new ATOM 0 HA ILE A 62 -21.456 -9.938 -39.697 1.00 0.00 H new ATOM 0 HB ILE A 62 -21.596 -12.011 -38.587 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -24.070 -12.480 -38.423 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -24.383 -10.757 -38.481 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -22.737 -12.319 -36.380 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -21.369 -11.188 -36.254 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -23.036 -10.567 -36.302 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -24.610 -11.764 -40.734 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -23.255 -10.611 -40.701 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -22.936 -12.361 -40.642 1.00 0.00 H new ATOM 1128 N VAL A 63 -22.939 -7.929 -39.498 1.00 0.00 N ATOM 1129 CA VAL A 63 -23.916 -6.798 -39.447 1.00 0.00 C ATOM 1130 C VAL A 63 -25.346 -7.289 -39.196 1.00 0.00 C ATOM 1131 O VAL A 63 -25.724 -8.374 -39.580 1.00 0.00 O ATOM 1132 CB VAL A 63 -23.880 -6.045 -40.784 1.00 0.00 C ATOM 1133 CG1 VAL A 63 -24.752 -4.783 -40.696 1.00 0.00 C ATOM 1134 CG2 VAL A 63 -22.439 -5.644 -41.104 1.00 0.00 C ATOM 0 H VAL A 63 -22.386 -7.975 -40.354 1.00 0.00 H new ATOM 0 HA VAL A 63 -23.631 -6.146 -38.622 1.00 0.00 H new ATOM 0 HB VAL A 63 -24.264 -6.694 -41.571 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -24.722 -4.253 -41.648 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -25.780 -5.066 -40.470 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -24.373 -4.133 -39.907 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -22.412 -5.109 -42.053 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -22.057 -4.999 -40.313 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -21.819 -6.538 -41.174 1.00 0.00 H new ATOM 1144 N THR A 64 -26.150 -6.452 -38.575 1.00 0.00 N ATOM 1145 CA THR A 64 -27.578 -6.809 -38.312 1.00 0.00 C ATOM 1146 C THR A 64 -28.446 -5.602 -38.679 1.00 0.00 C ATOM 1147 O THR A 64 -29.329 -5.684 -39.514 1.00 0.00 O ATOM 1148 CB THR A 64 -27.783 -7.145 -36.834 1.00 0.00 C ATOM 1149 OG1 THR A 64 -26.808 -8.083 -36.417 1.00 0.00 O ATOM 1150 CG2 THR A 64 -29.180 -7.728 -36.639 1.00 0.00 C ATOM 0 H THR A 64 -25.871 -5.530 -38.238 1.00 0.00 H new ATOM 0 HA THR A 64 -27.852 -7.680 -38.907 1.00 0.00 H new ATOM 0 HB THR A 64 -27.681 -6.239 -36.236 1.00 0.00 H new ATOM 0 HG1 THR A 64 -26.942 -8.294 -35.469 1.00 0.00 H new ATOM 0 HG21 THR A 64 -29.330 -7.969 -35.587 1.00 0.00 H new ATOM 0 HG22 THR A 64 -29.926 -6.998 -36.954 1.00 0.00 H new ATOM 0 HG23 THR A 64 -29.283 -8.634 -37.237 1.00 0.00 H new ATOM 1158 N ASP A 65 -28.183 -4.473 -38.066 1.00 0.00 N ATOM 1159 CA ASP A 65 -28.970 -3.241 -38.374 1.00 0.00 C ATOM 1160 C ASP A 65 -28.053 -2.017 -38.303 1.00 0.00 C ATOM 1161 O ASP A 65 -27.456 -1.806 -37.259 1.00 0.00 O ATOM 1162 CB ASP A 65 -30.104 -3.083 -37.365 1.00 0.00 C ATOM 1163 CG ASP A 65 -31.091 -2.021 -37.869 1.00 0.00 C ATOM 1164 OD1 ASP A 65 -31.840 -2.318 -38.785 1.00 0.00 O ATOM 1165 OD2 ASP A 65 -31.078 -0.925 -37.328 1.00 0.00 O ATOM 1166 OXT ASP A 65 -27.964 -1.311 -39.294 1.00 0.00 O ATOM 0 H ASP A 65 -27.454 -4.353 -37.363 1.00 0.00 H new ATOM 0 HA ASP A 65 -29.390 -3.327 -39.376 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -30.617 -4.035 -37.226 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -29.704 -2.791 -36.394 1.00 0.00 H new TER 1171 ASP A 65 ATOM 1172 N SER B 1 -8.783 -21.692 -4.209 1.00 0.00 N ATOM 1173 CA SER B 1 -9.765 -20.560 -4.283 1.00 0.00 C ATOM 1174 C SER B 1 -9.077 -19.327 -4.919 1.00 0.00 C ATOM 1175 O SER B 1 -8.091 -18.852 -4.391 1.00 0.00 O ATOM 1176 CB SER B 1 -10.246 -20.213 -2.878 1.00 0.00 C ATOM 1177 OG SER B 1 -11.281 -19.240 -2.962 1.00 0.00 O ATOM 0 H1 SER B 1 -9.242 -22.522 -3.782 1.00 0.00 H new ATOM 0 H2 SER B 1 -8.456 -21.931 -5.167 1.00 0.00 H new ATOM 0 H3 SER B 1 -7.969 -21.408 -3.626 1.00 0.00 H new ATOM 0 HA SER B 1 -10.619 -20.854 -4.893 1.00 0.00 H new ATOM 0 HB2 SER B 1 -10.613 -21.108 -2.375 1.00 0.00 H new ATOM 0 HB3 SER B 1 -9.418 -19.829 -2.282 1.00 0.00 H new ATOM 0 HG SER B 1 -11.593 -19.016 -2.061 1.00 0.00 H new ATOM 1185 N PRO B 2 -9.589 -18.840 -6.052 1.00 0.00 N ATOM 1186 CA PRO B 2 -8.966 -17.714 -6.742 1.00 0.00 C ATOM 1187 C PRO B 2 -9.317 -16.368 -6.093 1.00 0.00 C ATOM 1188 O PRO B 2 -10.466 -16.037 -5.869 1.00 0.00 O ATOM 1189 CB PRO B 2 -9.537 -17.787 -8.160 1.00 0.00 C ATOM 1190 CG PRO B 2 -10.853 -18.592 -8.068 1.00 0.00 C ATOM 1191 CD PRO B 2 -10.809 -19.355 -6.733 1.00 0.00 C ATOM 0 HA PRO B 2 -7.878 -17.775 -6.709 1.00 0.00 H new ATOM 0 HB2 PRO B 2 -9.721 -16.788 -8.555 1.00 0.00 H new ATOM 0 HB3 PRO B 2 -8.833 -18.272 -8.836 1.00 0.00 H new ATOM 0 HG2 PRO B 2 -11.717 -17.928 -8.107 1.00 0.00 H new ATOM 0 HG3 PRO B 2 -10.944 -19.283 -8.906 1.00 0.00 H new ATOM 0 HD2 PRO B 2 -11.704 -19.169 -6.139 1.00 0.00 H new ATOM 0 HD3 PRO B 2 -10.750 -20.432 -6.892 1.00 0.00 H new ATOM 1199 N LEU B 3 -8.311 -15.581 -5.842 1.00 0.00 N ATOM 1200 CA LEU B 3 -8.510 -14.228 -5.268 1.00 0.00 C ATOM 1201 C LEU B 3 -7.433 -13.322 -5.866 1.00 0.00 C ATOM 1202 O LEU B 3 -6.591 -13.780 -6.616 1.00 0.00 O ATOM 1203 CB LEU B 3 -8.391 -14.238 -3.733 1.00 0.00 C ATOM 1204 CG LEU B 3 -7.220 -15.151 -3.268 1.00 0.00 C ATOM 1205 CD1 LEU B 3 -6.165 -14.321 -2.534 1.00 0.00 C ATOM 1206 CD2 LEU B 3 -7.755 -16.243 -2.321 1.00 0.00 C ATOM 0 H LEU B 3 -7.337 -15.827 -6.016 1.00 0.00 H new ATOM 0 HA LEU B 3 -9.512 -13.871 -5.507 1.00 0.00 H new ATOM 0 HB2 LEU B 3 -8.230 -13.223 -3.371 1.00 0.00 H new ATOM 0 HB3 LEU B 3 -9.326 -14.588 -3.295 1.00 0.00 H new ATOM 0 HG LEU B 3 -6.768 -15.615 -4.145 1.00 0.00 H new ATOM 0 HD11 LEU B 3 -5.350 -14.970 -2.213 1.00 0.00 H new ATOM 0 HD12 LEU B 3 -5.776 -13.554 -3.203 1.00 0.00 H new ATOM 0 HD13 LEU B 3 -6.616 -13.847 -1.662 1.00 0.00 H new ATOM 0 HD21 LEU B 3 -6.931 -16.880 -1.998 1.00 0.00 H new ATOM 0 HD22 LEU B 3 -8.216 -15.776 -1.450 1.00 0.00 H new ATOM 0 HD23 LEU B 3 -8.497 -16.847 -2.844 1.00 0.00 H new ATOM 1218 N LEU B 4 -7.448 -12.057 -5.554 1.00 0.00 N ATOM 1219 CA LEU B 4 -6.422 -11.134 -6.110 1.00 0.00 C ATOM 1220 C LEU B 4 -6.380 -9.874 -5.204 1.00 0.00 C ATOM 1221 O LEU B 4 -7.209 -8.999 -5.342 1.00 0.00 O ATOM 1222 CB LEU B 4 -6.791 -10.769 -7.568 1.00 0.00 C ATOM 1223 CG LEU B 4 -8.294 -10.427 -7.679 1.00 0.00 C ATOM 1224 CD1 LEU B 4 -8.466 -9.103 -8.436 1.00 0.00 C ATOM 1225 CD2 LEU B 4 -9.021 -11.550 -8.440 1.00 0.00 C ATOM 0 H LEU B 4 -8.131 -11.621 -4.934 1.00 0.00 H new ATOM 0 HA LEU B 4 -5.437 -11.601 -6.127 1.00 0.00 H new ATOM 0 HB2 LEU B 4 -6.194 -9.919 -7.898 1.00 0.00 H new ATOM 0 HB3 LEU B 4 -6.552 -11.602 -8.229 1.00 0.00 H new ATOM 0 HG LEU B 4 -8.718 -10.331 -6.679 1.00 0.00 H new ATOM 0 HD11 LEU B 4 -9.526 -8.863 -8.513 1.00 0.00 H new ATOM 0 HD12 LEU B 4 -7.952 -8.307 -7.898 1.00 0.00 H new ATOM 0 HD13 LEU B 4 -8.041 -9.198 -9.435 1.00 0.00 H new ATOM 0 HD21 LEU B 4 -10.081 -11.309 -8.518 1.00 0.00 H new ATOM 0 HD22 LEU B 4 -8.596 -11.647 -9.439 1.00 0.00 H new ATOM 0 HD23 LEU B 4 -8.901 -12.490 -7.902 1.00 0.00 H new ATOM 1237 N PRO B 5 -5.444 -9.844 -4.244 1.00 0.00 N ATOM 1238 CA PRO B 5 -5.339 -8.735 -3.297 1.00 0.00 C ATOM 1239 C PRO B 5 -4.477 -7.591 -3.845 1.00 0.00 C ATOM 1240 O PRO B 5 -4.872 -6.437 -3.804 1.00 0.00 O ATOM 1241 CB PRO B 5 -4.658 -9.371 -2.079 1.00 0.00 C ATOM 1242 CG PRO B 5 -3.894 -10.617 -2.608 1.00 0.00 C ATOM 1243 CD PRO B 5 -4.443 -10.905 -4.018 1.00 0.00 C ATOM 0 HA PRO B 5 -6.310 -8.291 -3.078 1.00 0.00 H new ATOM 0 HB2 PRO B 5 -3.974 -8.668 -1.605 1.00 0.00 H new ATOM 0 HB3 PRO B 5 -5.394 -9.656 -1.327 1.00 0.00 H new ATOM 0 HG2 PRO B 5 -2.821 -10.428 -2.641 1.00 0.00 H new ATOM 0 HG3 PRO B 5 -4.047 -11.473 -1.951 1.00 0.00 H new ATOM 0 HD2 PRO B 5 -3.652 -10.872 -4.767 1.00 0.00 H new ATOM 0 HD3 PRO B 5 -4.894 -11.896 -4.075 1.00 0.00 H new ATOM 1251 N LYS B 6 -3.287 -7.895 -4.319 1.00 0.00 N ATOM 1252 CA LYS B 6 -2.390 -6.814 -4.825 1.00 0.00 C ATOM 1253 C LYS B 6 -1.373 -7.375 -5.838 1.00 0.00 C ATOM 1254 O LYS B 6 -1.248 -8.571 -6.026 1.00 0.00 O ATOM 1255 CB LYS B 6 -1.628 -6.212 -3.627 1.00 0.00 C ATOM 1256 CG LYS B 6 -2.093 -4.773 -3.377 1.00 0.00 C ATOM 1257 CD LYS B 6 -0.959 -3.980 -2.699 1.00 0.00 C ATOM 1258 CE LYS B 6 -1.160 -2.475 -2.951 1.00 0.00 C ATOM 1259 NZ LYS B 6 0.173 -1.832 -3.167 1.00 0.00 N ATOM 0 H LYS B 6 -2.905 -8.839 -4.375 1.00 0.00 H new ATOM 0 HA LYS B 6 -2.992 -6.055 -5.324 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -1.798 -6.817 -2.737 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -0.556 -6.227 -3.823 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -2.370 -4.300 -4.319 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -2.981 -4.771 -2.746 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -0.950 -4.182 -1.628 1.00 0.00 H new ATOM 0 HD3 LYS B 6 0.007 -4.299 -3.091 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -1.797 -2.322 -3.822 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -1.666 -2.016 -2.102 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 0.044 -0.814 -3.338 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 0.765 -1.969 -2.323 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 0.638 -2.265 -3.990 1.00 0.00 H new ATOM 1273 N LEU B 7 -0.633 -6.496 -6.466 1.00 0.00 N ATOM 1274 CA LEU B 7 0.406 -6.919 -7.445 1.00 0.00 C ATOM 1275 C LEU B 7 1.745 -7.014 -6.691 1.00 0.00 C ATOM 1276 O LEU B 7 1.843 -6.496 -5.601 1.00 0.00 O ATOM 1277 CB LEU B 7 0.515 -5.840 -8.546 1.00 0.00 C ATOM 1278 CG LEU B 7 -0.418 -6.166 -9.729 1.00 0.00 C ATOM 1279 CD1 LEU B 7 0.101 -7.391 -10.483 1.00 0.00 C ATOM 1280 CD2 LEU B 7 -1.859 -6.441 -9.239 1.00 0.00 C ATOM 0 H LEU B 7 -0.709 -5.487 -6.337 1.00 0.00 H new ATOM 0 HA LEU B 7 0.154 -7.878 -7.898 1.00 0.00 H new ATOM 0 HB2 LEU B 7 0.257 -4.865 -8.132 1.00 0.00 H new ATOM 0 HB3 LEU B 7 1.545 -5.775 -8.897 1.00 0.00 H new ATOM 0 HG LEU B 7 -0.433 -5.303 -10.394 1.00 0.00 H new ATOM 0 HD11 LEU B 7 -0.564 -7.614 -11.317 1.00 0.00 H new ATOM 0 HD12 LEU B 7 1.102 -7.188 -10.862 1.00 0.00 H new ATOM 0 HD13 LEU B 7 0.135 -8.246 -9.808 1.00 0.00 H new ATOM 0 HD21 LEU B 7 -2.497 -6.668 -10.093 1.00 0.00 H new ATOM 0 HD22 LEU B 7 -1.855 -7.289 -8.554 1.00 0.00 H new ATOM 0 HD23 LEU B 7 -2.243 -5.560 -8.724 1.00 0.00 H new ATOM 1292 N PRO B 8 2.759 -7.637 -7.284 1.00 0.00 N ATOM 1293 CA PRO B 8 4.065 -7.725 -6.631 1.00 0.00 C ATOM 1294 C PRO B 8 4.695 -6.296 -6.631 1.00 0.00 C ATOM 1295 O PRO B 8 4.887 -5.725 -7.679 1.00 0.00 O ATOM 1296 CB PRO B 8 4.833 -8.749 -7.477 1.00 0.00 C ATOM 1297 CG PRO B 8 4.123 -8.812 -8.847 1.00 0.00 C ATOM 1298 CD PRO B 8 2.696 -8.277 -8.619 1.00 0.00 C ATOM 0 HA PRO B 8 4.053 -8.046 -5.589 1.00 0.00 H new ATOM 0 HB2 PRO B 8 5.875 -8.451 -7.594 1.00 0.00 H new ATOM 0 HB3 PRO B 8 4.833 -9.727 -6.996 1.00 0.00 H new ATOM 0 HG2 PRO B 8 4.651 -8.210 -9.587 1.00 0.00 H new ATOM 0 HG3 PRO B 8 4.099 -9.834 -9.226 1.00 0.00 H new ATOM 0 HD2 PRO B 8 2.410 -7.562 -9.391 1.00 0.00 H new ATOM 0 HD3 PRO B 8 1.960 -9.081 -8.641 1.00 0.00 H new ATOM 1306 N PRO B 9 4.917 -5.723 -5.445 1.00 0.00 N ATOM 1307 CA PRO B 9 5.401 -4.335 -5.331 1.00 0.00 C ATOM 1308 C PRO B 9 6.886 -4.177 -5.670 1.00 0.00 C ATOM 1309 O PRO B 9 7.555 -5.107 -6.077 1.00 0.00 O ATOM 1310 CB PRO B 9 5.131 -3.979 -3.866 1.00 0.00 C ATOM 1311 CG PRO B 9 5.023 -5.315 -3.094 1.00 0.00 C ATOM 1312 CD PRO B 9 4.743 -6.402 -4.137 1.00 0.00 C ATOM 0 HA PRO B 9 4.898 -3.680 -6.042 1.00 0.00 H new ATOM 0 HB2 PRO B 9 5.935 -3.364 -3.463 1.00 0.00 H new ATOM 0 HB3 PRO B 9 4.211 -3.402 -3.772 1.00 0.00 H new ATOM 0 HG2 PRO B 9 5.946 -5.526 -2.553 1.00 0.00 H new ATOM 0 HG3 PRO B 9 4.223 -5.272 -2.355 1.00 0.00 H new ATOM 0 HD2 PRO B 9 5.432 -7.240 -4.031 1.00 0.00 H new ATOM 0 HD3 PRO B 9 3.735 -6.803 -4.030 1.00 0.00 H new ATOM 1320 N LYS B 10 7.398 -2.972 -5.506 1.00 0.00 N ATOM 1321 CA LYS B 10 8.832 -2.696 -5.815 1.00 0.00 C ATOM 1322 C LYS B 10 9.719 -3.070 -4.615 1.00 0.00 C ATOM 1323 O LYS B 10 9.268 -3.128 -3.481 1.00 0.00 O ATOM 1324 CB LYS B 10 9.005 -1.192 -6.139 1.00 0.00 C ATOM 1325 CG LYS B 10 8.805 -0.318 -4.876 1.00 0.00 C ATOM 1326 CD LYS B 10 8.436 1.119 -5.287 1.00 0.00 C ATOM 1327 CE LYS B 10 8.885 2.097 -4.199 1.00 0.00 C ATOM 1328 NZ LYS B 10 8.808 3.492 -4.713 1.00 0.00 N ATOM 0 H LYS B 10 6.872 -2.166 -5.168 1.00 0.00 H new ATOM 0 HA LYS B 10 9.133 -3.296 -6.674 1.00 0.00 H new ATOM 0 HB2 LYS B 10 9.999 -1.018 -6.550 1.00 0.00 H new ATOM 0 HB3 LYS B 10 8.287 -0.898 -6.905 1.00 0.00 H new ATOM 0 HG2 LYS B 10 8.018 -0.741 -4.252 1.00 0.00 H new ATOM 0 HG3 LYS B 10 9.717 -0.312 -4.279 1.00 0.00 H new ATOM 0 HD2 LYS B 10 8.912 1.370 -6.235 1.00 0.00 H new ATOM 0 HD3 LYS B 10 7.360 1.199 -5.440 1.00 0.00 H new ATOM 0 HE2 LYS B 10 8.254 1.989 -3.317 1.00 0.00 H new ATOM 0 HE3 LYS B 10 9.905 1.869 -3.891 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 9.114 4.153 -3.971 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 9.428 3.591 -5.542 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 7.828 3.708 -4.986 1.00 0.00 H new ATOM 1342 N THR B 11 10.978 -3.293 -4.865 1.00 0.00 N ATOM 1343 CA THR B 11 11.916 -3.626 -3.775 1.00 0.00 C ATOM 1344 C THR B 11 13.218 -2.880 -4.037 1.00 0.00 C ATOM 1345 O THR B 11 13.449 -2.392 -5.130 1.00 0.00 O ATOM 1346 CB THR B 11 12.164 -5.141 -3.750 1.00 0.00 C ATOM 1347 OG1 THR B 11 10.922 -5.865 -3.859 1.00 0.00 O ATOM 1348 CG2 THR B 11 12.854 -5.508 -2.446 1.00 0.00 C ATOM 0 H THR B 11 11.397 -3.256 -5.794 1.00 0.00 H new ATOM 0 HA THR B 11 11.505 -3.333 -2.809 1.00 0.00 H new ATOM 0 HB THR B 11 12.794 -5.410 -4.598 1.00 0.00 H new ATOM 0 HG1 THR B 11 11.102 -6.828 -3.843 1.00 0.00 H new ATOM 0 HG21 THR B 11 13.034 -6.583 -2.420 1.00 0.00 H new ATOM 0 HG22 THR B 11 13.804 -4.979 -2.376 1.00 0.00 H new ATOM 0 HG23 THR B 11 12.219 -5.226 -1.606 1.00 0.00 H new ATOM 1356 N TYR B 12 14.064 -2.766 -3.050 1.00 0.00 N ATOM 1357 CA TYR B 12 15.347 -2.027 -3.253 1.00 0.00 C ATOM 1358 C TYR B 12 16.199 -2.756 -4.302 1.00 0.00 C ATOM 1359 O TYR B 12 16.951 -3.662 -3.988 1.00 0.00 O ATOM 1360 CB TYR B 12 16.104 -1.953 -1.932 1.00 0.00 C ATOM 1361 CG TYR B 12 16.884 -0.664 -1.854 1.00 0.00 C ATOM 1362 CD1 TYR B 12 17.870 -0.390 -2.803 1.00 0.00 C ATOM 1363 CD2 TYR B 12 16.628 0.256 -0.826 1.00 0.00 C ATOM 1364 CE1 TYR B 12 18.594 0.798 -2.731 1.00 0.00 C ATOM 1365 CE2 TYR B 12 17.361 1.442 -0.758 1.00 0.00 C ATOM 1366 CZ TYR B 12 18.340 1.709 -1.711 1.00 0.00 C ATOM 1367 OH TYR B 12 19.043 2.885 -1.656 1.00 0.00 O ATOM 0 H TYR B 12 13.925 -3.150 -2.115 1.00 0.00 H new ATOM 0 HA TYR B 12 15.135 -1.017 -3.603 1.00 0.00 H new ATOM 0 HB2 TYR B 12 15.404 -2.015 -1.099 1.00 0.00 H new ATOM 0 HB3 TYR B 12 16.781 -2.803 -1.843 1.00 0.00 H new ATOM 0 HD1 TYR B 12 18.072 -1.099 -3.593 1.00 0.00 H new ATOM 0 HD2 TYR B 12 15.866 0.047 -0.090 1.00 0.00 H new ATOM 0 HE1 TYR B 12 19.354 1.012 -3.468 1.00 0.00 H new ATOM 0 HE2 TYR B 12 17.169 2.152 0.033 1.00 0.00 H new ATOM 0 HH TYR B 12 18.901 3.390 -2.484 1.00 0.00 H new ATOM 1377 N LYS B 13 16.077 -2.363 -5.545 1.00 0.00 N ATOM 1378 CA LYS B 13 16.865 -3.017 -6.639 1.00 0.00 C ATOM 1379 C LYS B 13 17.511 -1.942 -7.521 1.00 0.00 C ATOM 1380 O LYS B 13 18.675 -2.022 -7.865 1.00 0.00 O ATOM 1381 CB LYS B 13 15.920 -3.868 -7.494 1.00 0.00 C ATOM 1382 CG LYS B 13 16.731 -4.723 -8.480 1.00 0.00 C ATOM 1383 CD LYS B 13 16.016 -6.065 -8.702 1.00 0.00 C ATOM 1384 CE LYS B 13 16.720 -7.164 -7.900 1.00 0.00 C ATOM 1385 NZ LYS B 13 16.254 -7.145 -6.480 1.00 0.00 N ATOM 0 H LYS B 13 15.461 -1.611 -5.853 1.00 0.00 H new ATOM 0 HA LYS B 13 17.643 -3.645 -6.204 1.00 0.00 H new ATOM 0 HB2 LYS B 13 15.316 -4.511 -6.853 1.00 0.00 H new ATOM 0 HB3 LYS B 13 15.231 -3.224 -8.040 1.00 0.00 H new ATOM 0 HG2 LYS B 13 16.842 -4.197 -9.428 1.00 0.00 H new ATOM 0 HG3 LYS B 13 17.735 -4.893 -8.090 1.00 0.00 H new ATOM 0 HD2 LYS B 13 14.973 -5.988 -8.394 1.00 0.00 H new ATOM 0 HD3 LYS B 13 16.017 -6.318 -9.762 1.00 0.00 H new ATOM 0 HE2 LYS B 13 16.514 -8.138 -8.345 1.00 0.00 H new ATOM 0 HE3 LYS B 13 17.799 -7.018 -7.938 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 16.738 -7.895 -5.946 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 16.472 -6.221 -6.055 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 15.227 -7.306 -6.449 1.00 0.00 H new ATOM 1399 N ARG B 14 16.755 -0.942 -7.889 1.00 0.00 N ATOM 1400 CA ARG B 14 17.297 0.143 -8.759 1.00 0.00 C ATOM 1401 C ARG B 14 17.518 1.408 -7.920 1.00 0.00 C ATOM 1402 O ARG B 14 18.615 1.936 -7.842 1.00 0.00 O ATOM 1403 CB ARG B 14 16.270 0.430 -9.867 1.00 0.00 C ATOM 1404 CG ARG B 14 16.880 1.322 -10.944 1.00 0.00 C ATOM 1405 CD ARG B 14 16.291 0.953 -12.307 1.00 0.00 C ATOM 1406 NE ARG B 14 17.184 -0.035 -12.982 1.00 0.00 N ATOM 1407 CZ ARG B 14 16.915 -0.433 -14.197 1.00 0.00 C ATOM 1408 NH1 ARG B 14 17.359 0.249 -15.220 1.00 0.00 N ATOM 1409 NH2 ARG B 14 16.205 -1.514 -14.387 1.00 0.00 N ATOM 0 H ARG B 14 15.777 -0.829 -7.622 1.00 0.00 H new ATOM 0 HA ARG B 14 18.247 -0.162 -9.198 1.00 0.00 H new ATOM 0 HB2 ARG B 14 15.933 -0.507 -10.310 1.00 0.00 H new ATOM 0 HB3 ARG B 14 15.392 0.914 -9.440 1.00 0.00 H new ATOM 0 HG2 ARG B 14 16.678 2.370 -10.721 1.00 0.00 H new ATOM 0 HG3 ARG B 14 17.963 1.202 -10.960 1.00 0.00 H new ATOM 0 HD2 ARG B 14 15.293 0.532 -12.182 1.00 0.00 H new ATOM 0 HD3 ARG B 14 16.186 1.846 -12.924 1.00 0.00 H new ATOM 0 HE ARG B 14 18.003 -0.399 -12.495 1.00 0.00 H new ATOM 0 HH11 ARG B 14 17.915 1.091 -15.069 1.00 0.00 H new ATOM 0 HH12 ARG B 14 17.150 -0.061 -16.169 1.00 0.00 H new ATOM 0 HH21 ARG B 14 15.862 -2.046 -13.587 1.00 0.00 H new ATOM 0 HH22 ARG B 14 15.994 -1.826 -15.335 1.00 0.00 H new ATOM 1423 N GLU B 15 16.475 1.891 -7.294 1.00 0.00 N ATOM 1424 CA GLU B 15 16.592 3.122 -6.457 1.00 0.00 C ATOM 1425 C GLU B 15 17.128 2.747 -5.076 1.00 0.00 C ATOM 1426 O GLU B 15 16.676 1.750 -4.537 1.00 0.00 O ATOM 1427 CB GLU B 15 15.206 3.777 -6.319 1.00 0.00 C ATOM 1428 CG GLU B 15 15.336 5.292 -6.415 1.00 0.00 C ATOM 1429 CD GLU B 15 14.048 5.942 -5.890 1.00 0.00 C ATOM 1430 OE1 GLU B 15 13.689 5.666 -4.755 1.00 0.00 O ATOM 1431 OE2 GLU B 15 13.438 6.697 -6.632 1.00 0.00 O ATOM 1432 OXT GLU B 15 17.984 3.461 -4.581 1.00 0.00 O ATOM 0 H GLU B 15 15.541 1.482 -7.328 1.00 0.00 H new ATOM 0 HA GLU B 15 17.278 3.825 -6.930 1.00 0.00 H new ATOM 0 HB2 GLU B 15 14.541 3.410 -7.101 1.00 0.00 H new ATOM 0 HB3 GLU B 15 14.757 3.502 -5.364 1.00 0.00 H new ATOM 0 HG2 GLU B 15 16.193 5.633 -5.834 1.00 0.00 H new ATOM 0 HG3 GLU B 15 15.513 5.589 -7.449 1.00 0.00 H new TER 1439 GLU B 15