USER MOD reduce.3.24.130724 H: found=0, std=0, add=778, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 761 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 47 THR OG1 : rot 23:sc= 0.899 USER MOD Set 1.2: A 50 GLN : amide:sc= -1.14! C(o=-0.24!,f=-9.2!) USER MOD Set 2.1: A 26 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 29 MET CE :methyl -161:sc= -0.531 (180deg=-1.75!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -154:sc= 0.0185 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 0:sc= 0.698 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ -160:sc= -0.0152 (180deg=-0.168) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 ASN : amide:sc= -1.25! C(o=-1.2!,f=-1.9!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 146:sc= -0.173 USER MOD Single : A 33 ASN : amide:sc= -0.872! X(o=-0.87!,f=-0.93) USER MOD Single : A 35 ASN :FLIP amide:sc= -1.63! C(o=-3.7!,f=-1.6!) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 43 ASN :FLIP amide:sc= -8.38! C(o=-11!,f=-8.4!) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot -126:sc= -4.38! USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= 0.798 K(o=0.8,f=0) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 GLN : amide:sc= -0.0359 X(o=-0.036,f=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 ASN :FLIP amide:sc= -0.439 F(o=-1.3!,f=-0.44) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -48.577 -5.077 -5.470 1.00 0.00 N ATOM 2 CA MET A 1 -48.453 -4.031 -6.471 1.00 0.00 C ATOM 3 C MET A 1 -47.239 -4.274 -7.370 1.00 0.00 C ATOM 4 O MET A 1 -46.566 -5.296 -7.248 1.00 0.00 O ATOM 5 CB MET A 1 -48.313 -2.675 -5.778 1.00 0.00 C ATOM 6 CG MET A 1 -49.446 -1.731 -6.184 1.00 0.00 C ATOM 7 SD MET A 1 -50.805 -1.880 -5.035 1.00 0.00 S ATOM 8 CE MET A 1 -52.154 -2.115 -6.181 1.00 0.00 C ATOM 0 H1 MET A 1 -49.572 -5.162 -5.178 1.00 0.00 H new ATOM 0 H2 MET A 1 -48.255 -5.981 -5.871 1.00 0.00 H new ATOM 0 H3 MET A 1 -47.993 -4.837 -4.643 1.00 0.00 H new ATOM 0 HA MET A 1 -49.349 -4.040 -7.092 1.00 0.00 H new ATOM 0 HB2 MET A 1 -48.320 -2.813 -4.697 1.00 0.00 H new ATOM 0 HB3 MET A 1 -47.353 -2.228 -6.036 1.00 0.00 H new ATOM 0 HG2 MET A 1 -49.085 -0.703 -6.202 1.00 0.00 H new ATOM 0 HG3 MET A 1 -49.784 -1.968 -7.193 1.00 0.00 H new ATOM 0 HE1 MET A 1 -53.086 -2.226 -5.628 1.00 0.00 H new ATOM 0 HE2 MET A 1 -52.225 -1.251 -6.842 1.00 0.00 H new ATOM 0 HE3 MET A 1 -51.975 -3.012 -6.774 1.00 0.00 H new ATOM 18 N VAL A 2 -46.996 -3.317 -8.253 1.00 0.00 N ATOM 19 CA VAL A 2 -45.876 -3.413 -9.173 1.00 0.00 C ATOM 20 C VAL A 2 -44.979 -2.184 -9.008 1.00 0.00 C ATOM 21 O VAL A 2 -45.273 -1.300 -8.204 1.00 0.00 O ATOM 22 CB VAL A 2 -46.386 -3.593 -10.603 1.00 0.00 C ATOM 23 CG1 VAL A 2 -47.408 -4.730 -10.682 1.00 0.00 C ATOM 24 CG2 VAL A 2 -46.974 -2.289 -11.144 1.00 0.00 C ATOM 0 H VAL A 2 -47.556 -2.470 -8.351 1.00 0.00 H new ATOM 0 HA VAL A 2 -45.270 -4.290 -8.946 1.00 0.00 H new ATOM 0 HB VAL A 2 -45.536 -3.862 -11.230 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -47.755 -4.837 -11.710 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -46.943 -5.661 -10.357 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -48.255 -4.503 -10.035 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -47.329 -2.445 -12.163 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -47.806 -1.976 -10.513 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -46.206 -1.515 -11.142 1.00 0.00 H new ATOM 34 N THR A 3 -43.904 -2.168 -9.782 1.00 0.00 N ATOM 35 CA THR A 3 -42.963 -1.061 -9.732 1.00 0.00 C ATOM 36 C THR A 3 -42.244 -0.912 -11.075 1.00 0.00 C ATOM 37 O THR A 3 -41.810 -1.901 -11.664 1.00 0.00 O ATOM 38 CB THR A 3 -42.012 -1.303 -8.558 1.00 0.00 C ATOM 39 OG1 THR A 3 -42.796 -0.995 -7.408 1.00 0.00 O ATOM 40 CG2 THR A 3 -40.869 -0.287 -8.511 1.00 0.00 C ATOM 0 H THR A 3 -43.663 -2.903 -10.447 1.00 0.00 H new ATOM 0 HA THR A 3 -43.475 -0.113 -9.565 1.00 0.00 H new ATOM 0 HB THR A 3 -41.600 -2.310 -8.626 1.00 0.00 H new ATOM 0 HG1 THR A 3 -43.696 -0.726 -7.688 1.00 0.00 H new ATOM 0 HG21 THR A 3 -40.224 -0.504 -7.660 1.00 0.00 H new ATOM 0 HG22 THR A 3 -40.288 -0.350 -9.431 1.00 0.00 H new ATOM 0 HG23 THR A 3 -41.279 0.718 -8.409 1.00 0.00 H new ATOM 48 N PRO A 4 -42.138 0.365 -11.530 1.00 0.00 N ATOM 49 CA PRO A 4 -41.480 0.657 -12.793 1.00 0.00 C ATOM 50 C PRO A 4 -39.960 0.542 -12.657 1.00 0.00 C ATOM 51 O PRO A 4 -39.456 0.120 -11.618 1.00 0.00 O ATOM 52 CB PRO A 4 -41.940 2.058 -13.161 1.00 0.00 C ATOM 53 CG PRO A 4 -42.463 2.677 -11.876 1.00 0.00 C ATOM 54 CD PRO A 4 -42.641 1.560 -10.859 1.00 0.00 C ATOM 0 HA PRO A 4 -41.741 -0.052 -13.579 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -41.117 2.644 -13.570 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -42.718 2.026 -13.924 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -41.765 3.426 -11.502 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -43.411 3.185 -12.055 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -42.084 1.765 -9.944 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -43.687 1.445 -10.576 1.00 0.00 H new ATOM 62 N ARG A 5 -39.273 0.926 -13.723 1.00 0.00 N ATOM 63 CA ARG A 5 -37.821 0.872 -13.736 1.00 0.00 C ATOM 64 C ARG A 5 -37.248 2.129 -14.393 1.00 0.00 C ATOM 65 O ARG A 5 -37.996 3.027 -14.780 1.00 0.00 O ATOM 66 CB ARG A 5 -37.323 -0.362 -14.491 1.00 0.00 C ATOM 67 CG ARG A 5 -37.753 -0.317 -15.959 1.00 0.00 C ATOM 68 CD ARG A 5 -37.178 -1.503 -16.735 1.00 0.00 C ATOM 69 NE ARG A 5 -38.054 -2.686 -16.575 1.00 0.00 N ATOM 70 CZ ARG A 5 -37.938 -3.582 -15.571 1.00 0.00 C ATOM 71 NH1 ARG A 5 -36.982 -3.438 -14.630 1.00 0.00 N ATOM 72 NH2 ARG A 5 -38.775 -4.602 -15.525 1.00 0.00 N ATOM 0 H ARG A 5 -39.695 1.276 -14.583 1.00 0.00 H new ATOM 0 HA ARG A 5 -37.482 0.813 -12.702 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -36.236 -0.417 -14.428 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -37.716 -1.264 -14.021 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -38.841 -0.329 -16.023 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -37.417 0.616 -16.412 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -37.087 -1.248 -17.791 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -36.175 -1.732 -16.375 1.00 0.00 H new ATOM 0 HE ARG A 5 -38.790 -2.833 -17.265 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -36.339 -2.647 -14.673 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -36.902 -4.120 -13.876 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -39.495 -4.704 -16.241 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -38.702 -5.288 -14.774 1.00 0.00 H new ATOM 86 N GLU A 6 -35.928 2.154 -14.501 1.00 0.00 N ATOM 87 CA GLU A 6 -35.247 3.287 -15.104 1.00 0.00 C ATOM 88 C GLU A 6 -33.951 2.830 -15.777 1.00 0.00 C ATOM 89 O GLU A 6 -33.086 2.242 -15.129 1.00 0.00 O ATOM 90 CB GLU A 6 -34.973 4.378 -14.068 1.00 0.00 C ATOM 91 CG GLU A 6 -33.967 3.898 -13.020 1.00 0.00 C ATOM 92 CD GLU A 6 -34.448 4.227 -11.606 1.00 0.00 C ATOM 93 OE1 GLU A 6 -35.656 4.172 -11.334 1.00 0.00 O ATOM 94 OE2 GLU A 6 -33.517 4.548 -10.773 1.00 0.00 O ATOM 0 H GLU A 6 -35.311 1.407 -14.181 1.00 0.00 H new ATOM 0 HA GLU A 6 -35.898 3.714 -15.867 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -34.589 5.269 -14.565 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -35.905 4.663 -13.579 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -33.821 2.822 -13.117 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -33.000 4.368 -13.197 1.00 0.00 H new ATOM 101 N PRO A 7 -33.854 3.126 -17.100 1.00 0.00 N ATOM 102 CA PRO A 7 -32.678 2.753 -17.867 1.00 0.00 C ATOM 103 C PRO A 7 -31.496 3.669 -17.540 1.00 0.00 C ATOM 104 O PRO A 7 -31.555 4.449 -16.592 1.00 0.00 O ATOM 105 CB PRO A 7 -33.113 2.838 -19.320 1.00 0.00 C ATOM 106 CG PRO A 7 -34.364 3.700 -19.332 1.00 0.00 C ATOM 107 CD PRO A 7 -34.859 3.822 -17.899 1.00 0.00 C ATOM 0 HA PRO A 7 -32.322 1.750 -17.631 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -32.330 3.278 -19.937 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -33.318 1.847 -19.725 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -34.145 4.684 -19.746 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -35.131 3.252 -19.964 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -34.950 4.866 -17.599 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -35.843 3.369 -17.780 1.00 0.00 H new ATOM 115 N LYS A 8 -30.452 3.543 -18.345 1.00 0.00 N ATOM 116 CA LYS A 8 -29.259 4.350 -18.153 1.00 0.00 C ATOM 117 C LYS A 8 -28.543 4.520 -19.495 1.00 0.00 C ATOM 118 O LYS A 8 -28.965 3.958 -20.504 1.00 0.00 O ATOM 119 CB LYS A 8 -28.376 3.749 -17.058 1.00 0.00 C ATOM 120 CG LYS A 8 -28.599 4.461 -15.722 1.00 0.00 C ATOM 121 CD LYS A 8 -27.351 5.239 -15.298 1.00 0.00 C ATOM 122 CE LYS A 8 -27.730 6.495 -14.511 1.00 0.00 C ATOM 123 NZ LYS A 8 -27.541 6.274 -13.060 1.00 0.00 N ATOM 0 H LYS A 8 -30.407 2.895 -19.131 1.00 0.00 H new ATOM 0 HA LYS A 8 -29.526 5.347 -17.804 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -28.597 2.687 -16.950 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -27.328 3.829 -17.346 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -29.445 5.143 -15.806 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -28.854 3.730 -14.955 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -26.711 4.602 -14.687 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -26.775 5.518 -16.180 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -27.119 7.335 -14.840 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -28.768 6.758 -14.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -27.803 7.136 -12.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -28.143 5.485 -12.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -26.544 6.045 -12.871 1.00 0.00 H new ATOM 136 N LYS A 9 -27.471 5.299 -19.462 1.00 0.00 N ATOM 137 CA LYS A 9 -26.693 5.551 -20.663 1.00 0.00 C ATOM 138 C LYS A 9 -25.248 5.868 -20.272 1.00 0.00 C ATOM 139 O LYS A 9 -24.906 5.865 -19.091 1.00 0.00 O ATOM 140 CB LYS A 9 -27.353 6.641 -21.511 1.00 0.00 C ATOM 141 CG LYS A 9 -27.386 7.974 -20.761 1.00 0.00 C ATOM 142 CD LYS A 9 -28.695 8.720 -21.027 1.00 0.00 C ATOM 143 CE LYS A 9 -28.521 9.752 -22.142 1.00 0.00 C ATOM 144 NZ LYS A 9 -27.728 10.905 -21.661 1.00 0.00 N ATOM 0 H LYS A 9 -27.123 5.763 -18.623 1.00 0.00 H new ATOM 0 HA LYS A 9 -26.666 4.662 -21.293 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -26.807 6.760 -22.447 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -28.368 6.340 -21.770 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -27.275 7.796 -19.691 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -26.542 8.591 -21.071 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -29.473 8.009 -21.303 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -29.026 9.217 -20.115 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -28.024 9.293 -22.997 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -29.498 10.093 -22.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -27.896 11.724 -22.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -28.012 11.141 -20.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -26.717 10.662 -21.676 1.00 0.00 H new ATOM 157 N ARG A 10 -24.438 6.131 -21.287 1.00 0.00 N ATOM 158 CA ARG A 10 -23.038 6.448 -21.065 1.00 0.00 C ATOM 159 C ARG A 10 -22.474 7.226 -22.255 1.00 0.00 C ATOM 160 O ARG A 10 -23.178 7.464 -23.236 1.00 0.00 O ATOM 161 CB ARG A 10 -22.211 5.177 -20.857 1.00 0.00 C ATOM 162 CG ARG A 10 -22.367 4.223 -22.043 1.00 0.00 C ATOM 163 CD ARG A 10 -23.189 2.993 -21.652 1.00 0.00 C ATOM 164 NE ARG A 10 -22.934 1.890 -22.605 1.00 0.00 N ATOM 165 CZ ARG A 10 -21.871 1.060 -22.537 1.00 0.00 C ATOM 166 NH1 ARG A 10 -20.954 1.202 -21.557 1.00 0.00 N ATOM 167 NH2 ARG A 10 -21.743 0.108 -23.443 1.00 0.00 N ATOM 0 H ARG A 10 -24.725 6.131 -22.266 1.00 0.00 H new ATOM 0 HA ARG A 10 -22.976 7.059 -20.165 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -21.160 5.439 -20.732 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -22.527 4.679 -19.941 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -22.852 4.741 -22.870 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -21.384 3.911 -22.395 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -22.930 2.678 -20.641 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -24.250 3.241 -21.646 1.00 0.00 H new ATOM 0 HE ARG A 10 -23.604 1.748 -23.361 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -21.061 1.940 -20.861 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -20.154 0.571 -21.512 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -22.441 0.008 -24.180 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -20.946 -0.527 -23.406 1.00 0.00 H new ATOM 181 N THR A 11 -21.209 7.603 -22.130 1.00 0.00 N ATOM 182 CA THR A 11 -20.543 8.350 -23.183 1.00 0.00 C ATOM 183 C THR A 11 -19.083 7.910 -23.306 1.00 0.00 C ATOM 184 O THR A 11 -18.429 7.628 -22.304 1.00 0.00 O ATOM 185 CB THR A 11 -20.706 9.841 -22.880 1.00 0.00 C ATOM 186 OG1 THR A 11 -20.070 10.489 -23.979 1.00 0.00 O ATOM 187 CG2 THR A 11 -19.890 10.283 -21.663 1.00 0.00 C ATOM 0 H THR A 11 -20.628 7.405 -21.315 1.00 0.00 H new ATOM 0 HA THR A 11 -20.993 8.151 -24.156 1.00 0.00 H new ATOM 0 HB THR A 11 -21.759 10.065 -22.711 1.00 0.00 H new ATOM 0 HG1 THR A 11 -20.130 11.461 -23.865 1.00 0.00 H new ATOM 0 HG21 THR A 11 -20.041 11.349 -21.491 1.00 0.00 H new ATOM 0 HG22 THR A 11 -20.215 9.724 -20.785 1.00 0.00 H new ATOM 0 HG23 THR A 11 -18.833 10.091 -21.845 1.00 0.00 H new ATOM 195 N THR A 12 -18.614 7.866 -24.545 1.00 0.00 N ATOM 196 CA THR A 12 -17.244 7.466 -24.813 1.00 0.00 C ATOM 197 C THR A 12 -16.428 8.659 -25.316 1.00 0.00 C ATOM 198 O THR A 12 -16.859 9.373 -26.220 1.00 0.00 O ATOM 199 CB THR A 12 -17.277 6.295 -25.796 1.00 0.00 C ATOM 200 OG1 THR A 12 -15.914 5.892 -25.903 1.00 0.00 O ATOM 201 CG2 THR A 12 -17.648 6.732 -27.215 1.00 0.00 C ATOM 0 H THR A 12 -19.159 8.101 -25.374 1.00 0.00 H new ATOM 0 HA THR A 12 -16.745 7.132 -23.903 1.00 0.00 H new ATOM 0 HB THR A 12 -17.991 5.549 -25.447 1.00 0.00 H new ATOM 0 HG1 THR A 12 -15.844 5.135 -26.521 1.00 0.00 H new ATOM 0 HG21 THR A 12 -17.657 5.863 -27.873 1.00 0.00 H new ATOM 0 HG22 THR A 12 -18.636 7.192 -27.207 1.00 0.00 H new ATOM 0 HG23 THR A 12 -16.915 7.453 -27.577 1.00 0.00 H new ATOM 209 N ARG A 13 -15.264 8.838 -24.708 1.00 0.00 N ATOM 210 CA ARG A 13 -14.385 9.932 -25.083 1.00 0.00 C ATOM 211 C ARG A 13 -13.207 9.408 -25.908 1.00 0.00 C ATOM 212 O ARG A 13 -12.804 8.257 -25.757 1.00 0.00 O ATOM 213 CB ARG A 13 -13.850 10.658 -23.847 1.00 0.00 C ATOM 214 CG ARG A 13 -14.244 12.136 -23.866 1.00 0.00 C ATOM 215 CD ARG A 13 -13.593 12.890 -22.705 1.00 0.00 C ATOM 216 NE ARG A 13 -12.325 13.509 -23.151 1.00 0.00 N ATOM 217 CZ ARG A 13 -11.292 13.797 -22.329 1.00 0.00 C ATOM 218 NH1 ARG A 13 -11.371 13.525 -21.010 1.00 0.00 N ATOM 219 NH2 ARG A 13 -10.206 14.350 -22.836 1.00 0.00 N ATOM 0 H ARG A 13 -14.910 8.244 -23.959 1.00 0.00 H new ATOM 0 HA ARG A 13 -14.967 10.635 -25.679 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -14.241 10.185 -22.946 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -12.764 10.568 -23.809 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -13.941 12.585 -24.812 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -15.328 12.228 -23.802 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -14.271 13.658 -22.334 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -13.402 12.206 -21.878 1.00 0.00 H new ATOM 0 HE ARG A 13 -12.224 13.732 -24.141 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -12.215 13.099 -20.627 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -10.587 13.745 -20.396 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -10.156 14.553 -23.834 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -9.417 14.574 -22.230 1.00 0.00 H new ATOM 233 N LYS A 14 -12.691 10.279 -26.762 1.00 0.00 N ATOM 234 CA LYS A 14 -11.567 9.918 -27.611 1.00 0.00 C ATOM 235 C LYS A 14 -10.416 10.896 -27.369 1.00 0.00 C ATOM 236 O LYS A 14 -10.588 11.905 -26.687 1.00 0.00 O ATOM 237 CB LYS A 14 -12.008 9.834 -29.074 1.00 0.00 C ATOM 238 CG LYS A 14 -12.942 8.644 -29.299 1.00 0.00 C ATOM 239 CD LYS A 14 -13.996 8.966 -30.360 1.00 0.00 C ATOM 240 CE LYS A 14 -14.358 7.721 -31.171 1.00 0.00 C ATOM 241 NZ LYS A 14 -15.251 6.835 -30.390 1.00 0.00 N ATOM 0 H LYS A 14 -13.030 11.233 -26.885 1.00 0.00 H new ATOM 0 HA LYS A 14 -11.199 8.924 -27.356 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -12.514 10.757 -29.358 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -11.132 9.740 -29.716 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -12.361 7.775 -29.610 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -13.433 8.380 -28.362 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -14.890 9.364 -29.880 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -13.620 9.742 -31.027 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -14.848 8.014 -32.099 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -13.451 7.182 -31.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -15.487 5.995 -30.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -14.770 6.541 -29.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -16.124 7.347 -30.149 1.00 0.00 H new ATOM 254 N LYS A 15 -9.270 10.565 -27.944 1.00 0.00 N ATOM 255 CA LYS A 15 -8.091 11.401 -27.800 1.00 0.00 C ATOM 256 C LYS A 15 -7.028 10.956 -28.808 1.00 0.00 C ATOM 257 O LYS A 15 -7.159 9.903 -29.428 1.00 0.00 O ATOM 258 CB LYS A 15 -7.604 11.395 -26.350 1.00 0.00 C ATOM 259 CG LYS A 15 -7.069 10.016 -25.957 1.00 0.00 C ATOM 260 CD LYS A 15 -6.340 10.074 -24.612 1.00 0.00 C ATOM 261 CE LYS A 15 -5.520 8.803 -24.379 1.00 0.00 C ATOM 262 NZ LYS A 15 -5.305 8.584 -22.931 1.00 0.00 N ATOM 0 H LYS A 15 -9.133 9.728 -28.511 1.00 0.00 H new ATOM 0 HA LYS A 15 -8.331 12.440 -28.027 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -6.821 12.143 -26.222 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -8.423 11.674 -25.687 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -7.893 9.305 -25.898 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -6.389 9.652 -26.728 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -5.684 10.944 -24.587 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -7.064 10.197 -23.807 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -6.037 7.945 -24.810 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -4.559 8.885 -24.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -4.747 7.718 -22.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -4.793 9.395 -22.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -6.224 8.485 -22.455 1.00 0.00 H new ATOM 275 N LYS A 16 -6.000 11.782 -28.939 1.00 0.00 N ATOM 276 CA LYS A 16 -4.916 11.487 -29.860 1.00 0.00 C ATOM 277 C LYS A 16 -3.794 12.509 -29.664 1.00 0.00 C ATOM 278 O LYS A 16 -3.907 13.407 -28.832 1.00 0.00 O ATOM 279 CB LYS A 16 -5.438 11.414 -31.296 1.00 0.00 C ATOM 280 CG LYS A 16 -4.840 10.218 -32.038 1.00 0.00 C ATOM 281 CD LYS A 16 -5.590 9.952 -33.345 1.00 0.00 C ATOM 282 CE LYS A 16 -6.544 8.765 -33.197 1.00 0.00 C ATOM 283 NZ LYS A 16 -6.665 8.035 -34.479 1.00 0.00 N ATOM 0 H LYS A 16 -5.895 12.655 -28.423 1.00 0.00 H new ATOM 0 HA LYS A 16 -4.493 10.505 -29.649 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -6.525 11.334 -31.288 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -5.190 12.335 -31.824 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -3.788 10.407 -32.250 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -4.883 9.333 -31.403 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -6.151 10.841 -33.634 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -4.876 9.752 -34.144 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -6.179 8.092 -32.421 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -7.525 9.117 -32.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -7.316 7.232 -34.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -7.034 8.676 -35.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -5.730 7.683 -34.768 1.00 0.00 H new ATOM 296 N ASP A 17 -2.738 12.336 -30.445 1.00 0.00 N ATOM 297 CA ASP A 17 -1.596 13.231 -30.368 1.00 0.00 C ATOM 298 C ASP A 17 -1.458 13.989 -31.690 1.00 0.00 C ATOM 299 O ASP A 17 -2.013 13.576 -32.707 1.00 0.00 O ATOM 300 CB ASP A 17 -0.300 12.454 -30.131 1.00 0.00 C ATOM 301 CG ASP A 17 0.140 12.363 -28.668 1.00 0.00 C ATOM 302 OD1 ASP A 17 -0.477 12.964 -27.776 1.00 0.00 O ATOM 303 OD2 ASP A 17 1.181 11.630 -28.457 1.00 0.00 O ATOM 0 H ASP A 17 -2.649 11.589 -31.134 1.00 0.00 H new ATOM 0 HA ASP A 17 -1.761 13.917 -29.537 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -0.423 11.444 -30.521 1.00 0.00 H new ATOM 0 HB3 ASP A 17 0.498 12.923 -30.706 1.00 0.00 H new ATOM 308 N PRO A 18 -0.693 15.112 -31.633 1.00 0.00 N ATOM 309 CA PRO A 18 -0.475 15.931 -32.813 1.00 0.00 C ATOM 310 C PRO A 18 0.518 15.263 -33.766 1.00 0.00 C ATOM 311 O PRO A 18 0.734 14.054 -33.697 1.00 0.00 O ATOM 312 CB PRO A 18 0.019 17.266 -32.280 1.00 0.00 C ATOM 313 CG PRO A 18 0.501 16.997 -30.863 1.00 0.00 C ATOM 314 CD PRO A 18 -0.020 15.631 -30.445 1.00 0.00 C ATOM 0 HA PRO A 18 -1.380 16.065 -33.406 1.00 0.00 H new ATOM 0 HB2 PRO A 18 0.826 17.659 -32.899 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -0.779 18.009 -32.287 1.00 0.00 H new ATOM 0 HG2 PRO A 18 1.590 17.020 -30.819 1.00 0.00 H new ATOM 0 HG3 PRO A 18 0.138 17.768 -30.183 1.00 0.00 H new ATOM 0 HD2 PRO A 18 0.793 14.976 -30.132 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -0.708 15.710 -29.603 1.00 0.00 H new ATOM 322 N ASN A 19 1.096 16.080 -34.634 1.00 0.00 N ATOM 323 CA ASN A 19 2.062 15.584 -35.601 1.00 0.00 C ATOM 324 C ASN A 19 3.336 15.155 -34.869 1.00 0.00 C ATOM 325 O ASN A 19 4.336 15.871 -34.887 1.00 0.00 O ATOM 326 CB ASN A 19 2.439 16.670 -36.610 1.00 0.00 C ATOM 327 CG ASN A 19 2.675 18.010 -35.911 1.00 0.00 C ATOM 328 OD1 ASN A 19 1.760 18.777 -35.658 1.00 0.00 O ATOM 329 ND2 ASN A 19 3.949 18.248 -35.615 1.00 0.00 N ATOM 0 H ASN A 19 0.914 17.082 -34.688 1.00 0.00 H new ATOM 0 HA ASN A 19 1.610 14.744 -36.128 1.00 0.00 H new ATOM 0 HB2 ASN A 19 3.339 16.374 -37.149 1.00 0.00 H new ATOM 0 HB3 ASN A 19 1.645 16.776 -37.349 1.00 0.00 H new ATOM 0 HD21 ASN A 19 4.210 19.116 -35.148 1.00 0.00 H new ATOM 0 HD22 ASN A 19 4.665 17.562 -35.855 1.00 0.00 H new ATOM 336 N ALA A 20 3.257 13.991 -34.243 1.00 0.00 N ATOM 337 CA ALA A 20 4.391 13.459 -33.506 1.00 0.00 C ATOM 338 C ALA A 20 4.463 11.944 -33.711 1.00 0.00 C ATOM 339 O ALA A 20 3.433 11.273 -33.771 1.00 0.00 O ATOM 340 CB ALA A 20 4.267 13.843 -32.029 1.00 0.00 C ATOM 0 H ALA A 20 2.425 13.401 -34.231 1.00 0.00 H new ATOM 0 HA ALA A 20 5.323 13.886 -33.876 1.00 0.00 H new ATOM 0 HB1 ALA A 20 5.118 13.444 -31.477 1.00 0.00 H new ATOM 0 HB2 ALA A 20 4.251 14.929 -31.935 1.00 0.00 H new ATOM 0 HB3 ALA A 20 3.344 13.430 -31.622 1.00 0.00 H new ATOM 346 N PRO A 21 5.720 11.437 -33.816 1.00 0.00 N ATOM 347 CA PRO A 21 5.938 10.014 -34.013 1.00 0.00 C ATOM 348 C PRO A 21 5.695 9.238 -32.718 1.00 0.00 C ATOM 349 O PRO A 21 6.497 9.310 -31.787 1.00 0.00 O ATOM 350 CB PRO A 21 7.370 9.902 -34.514 1.00 0.00 C ATOM 351 CG PRO A 21 8.047 11.210 -34.137 1.00 0.00 C ATOM 352 CD PRO A 21 6.962 12.202 -33.749 1.00 0.00 C ATOM 0 HA PRO A 21 5.243 9.577 -34.730 1.00 0.00 H new ATOM 0 HB2 PRO A 21 7.878 9.053 -34.057 1.00 0.00 H new ATOM 0 HB3 PRO A 21 7.395 9.746 -35.592 1.00 0.00 H new ATOM 0 HG2 PRO A 21 8.738 11.057 -33.308 1.00 0.00 H new ATOM 0 HG3 PRO A 21 8.632 11.592 -34.974 1.00 0.00 H new ATOM 0 HD2 PRO A 21 7.129 12.600 -32.748 1.00 0.00 H new ATOM 0 HD3 PRO A 21 6.941 13.052 -34.431 1.00 0.00 H new ATOM 360 N LYS A 22 4.587 8.512 -32.699 1.00 0.00 N ATOM 361 CA LYS A 22 4.229 7.722 -31.533 1.00 0.00 C ATOM 362 C LYS A 22 5.367 6.753 -31.209 1.00 0.00 C ATOM 363 O LYS A 22 5.379 5.622 -31.691 1.00 0.00 O ATOM 364 CB LYS A 22 2.878 7.035 -31.746 1.00 0.00 C ATOM 365 CG LYS A 22 2.911 6.130 -32.979 1.00 0.00 C ATOM 366 CD LYS A 22 2.075 6.720 -34.116 1.00 0.00 C ATOM 367 CE LYS A 22 1.061 5.700 -34.637 1.00 0.00 C ATOM 368 NZ LYS A 22 -0.278 6.319 -34.763 1.00 0.00 N ATOM 0 H LYS A 22 3.925 8.454 -33.473 1.00 0.00 H new ATOM 0 HA LYS A 22 4.100 8.365 -30.662 1.00 0.00 H new ATOM 0 HB2 LYS A 22 2.623 6.446 -30.865 1.00 0.00 H new ATOM 0 HB3 LYS A 22 2.098 7.787 -31.864 1.00 0.00 H new ATOM 0 HG2 LYS A 22 3.941 5.999 -33.311 1.00 0.00 H new ATOM 0 HG3 LYS A 22 2.532 5.142 -32.719 1.00 0.00 H new ATOM 0 HD2 LYS A 22 1.553 7.610 -33.764 1.00 0.00 H new ATOM 0 HD3 LYS A 22 2.730 7.035 -34.928 1.00 0.00 H new ATOM 0 HE2 LYS A 22 1.385 5.319 -35.605 1.00 0.00 H new ATOM 0 HE3 LYS A 22 1.012 4.848 -33.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -0.955 5.613 -35.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -0.591 6.662 -33.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -0.230 7.118 -35.428 1.00 0.00 H new ATOM 381 N ARG A 23 6.297 7.233 -30.396 1.00 0.00 N ATOM 382 CA ARG A 23 7.437 6.423 -30.003 1.00 0.00 C ATOM 383 C ARG A 23 8.005 5.681 -31.214 1.00 0.00 C ATOM 384 O ARG A 23 8.245 4.477 -31.153 1.00 0.00 O ATOM 385 CB ARG A 23 7.045 5.405 -28.929 1.00 0.00 C ATOM 386 CG ARG A 23 8.170 5.226 -27.908 1.00 0.00 C ATOM 387 CD ARG A 23 7.787 5.835 -26.558 1.00 0.00 C ATOM 388 NE ARG A 23 8.856 6.750 -26.095 1.00 0.00 N ATOM 389 CZ ARG A 23 8.857 7.364 -24.893 1.00 0.00 C ATOM 390 NH1 ARG A 23 7.845 7.168 -24.021 1.00 0.00 N ATOM 391 NH2 ARG A 23 9.863 8.161 -24.582 1.00 0.00 N ATOM 0 H ARG A 23 6.284 8.172 -29.999 1.00 0.00 H new ATOM 0 HA ARG A 23 8.194 7.093 -29.595 1.00 0.00 H new ATOM 0 HB2 ARG A 23 6.138 5.736 -28.422 1.00 0.00 H new ATOM 0 HB3 ARG A 23 6.817 4.447 -29.396 1.00 0.00 H new ATOM 0 HG2 ARG A 23 8.388 4.165 -27.784 1.00 0.00 H new ATOM 0 HG3 ARG A 23 9.080 5.697 -28.278 1.00 0.00 H new ATOM 0 HD2 ARG A 23 6.846 6.378 -26.648 1.00 0.00 H new ATOM 0 HD3 ARG A 23 7.630 5.044 -25.824 1.00 0.00 H new ATOM 0 HE ARG A 23 9.640 6.927 -26.723 1.00 0.00 H new ATOM 0 HH11 ARG A 23 7.071 6.552 -24.268 1.00 0.00 H new ATOM 0 HH12 ARG A 23 7.855 7.636 -23.115 1.00 0.00 H new ATOM 0 HH21 ARG A 23 10.624 8.305 -25.246 1.00 0.00 H new ATOM 0 HH22 ARG A 23 9.879 8.633 -23.678 1.00 0.00 H new ATOM 405 N ALA A 24 8.205 6.433 -32.287 1.00 0.00 N ATOM 406 CA ALA A 24 8.740 5.862 -33.512 1.00 0.00 C ATOM 407 C ALA A 24 8.073 4.511 -33.773 1.00 0.00 C ATOM 408 O ALA A 24 8.719 3.579 -34.252 1.00 0.00 O ATOM 409 CB ALA A 24 10.262 5.750 -33.399 1.00 0.00 C ATOM 0 H ALA A 24 8.006 7.432 -32.333 1.00 0.00 H new ATOM 0 HA ALA A 24 8.523 6.506 -34.364 1.00 0.00 H new ATOM 0 HB1 ALA A 24 10.664 5.322 -34.317 1.00 0.00 H new ATOM 0 HB2 ALA A 24 10.689 6.741 -33.243 1.00 0.00 H new ATOM 0 HB3 ALA A 24 10.518 5.108 -32.556 1.00 0.00 H new ATOM 415 N LEU A 25 6.791 4.447 -33.448 1.00 0.00 N ATOM 416 CA LEU A 25 6.029 3.224 -33.642 1.00 0.00 C ATOM 417 C LEU A 25 6.754 2.064 -32.957 1.00 0.00 C ATOM 418 O LEU A 25 7.877 2.222 -32.482 1.00 0.00 O ATOM 419 CB LEU A 25 5.763 2.990 -35.130 1.00 0.00 C ATOM 420 CG LEU A 25 4.730 3.912 -35.781 1.00 0.00 C ATOM 421 CD1 LEU A 25 4.910 3.955 -37.299 1.00 0.00 C ATOM 422 CD2 LEU A 25 3.308 3.511 -35.384 1.00 0.00 C ATOM 0 H LEU A 25 6.260 5.222 -33.051 1.00 0.00 H new ATOM 0 HA LEU A 25 5.047 3.307 -33.176 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.705 3.096 -35.668 1.00 0.00 H new ATOM 0 HB3 LEU A 25 5.435 1.959 -35.262 1.00 0.00 H new ATOM 0 HG LEU A 25 4.895 4.923 -35.409 1.00 0.00 H new ATOM 0 HD11 LEU A 25 4.163 4.618 -37.735 1.00 0.00 H new ATOM 0 HD12 LEU A 25 5.907 4.326 -37.537 1.00 0.00 H new ATOM 0 HD13 LEU A 25 4.789 2.952 -37.708 1.00 0.00 H new ATOM 0 HD21 LEU A 25 2.594 4.183 -35.861 1.00 0.00 H new ATOM 0 HD22 LEU A 25 3.115 2.488 -35.707 1.00 0.00 H new ATOM 0 HD23 LEU A 25 3.200 3.576 -34.301 1.00 0.00 H new ATOM 434 N SER A 26 6.081 0.922 -32.929 1.00 0.00 N ATOM 435 CA SER A 26 6.646 -0.264 -32.310 1.00 0.00 C ATOM 436 C SER A 26 6.422 -1.480 -33.210 1.00 0.00 C ATOM 437 O SER A 26 5.436 -1.543 -33.942 1.00 0.00 O ATOM 438 CB SER A 26 6.036 -0.508 -30.928 1.00 0.00 C ATOM 439 OG SER A 26 5.114 0.515 -30.563 1.00 0.00 O ATOM 0 H SER A 26 5.150 0.794 -33.325 1.00 0.00 H new ATOM 0 HA SER A 26 7.717 -0.106 -32.182 1.00 0.00 H new ATOM 0 HB2 SER A 26 5.529 -1.473 -30.921 1.00 0.00 H new ATOM 0 HB3 SER A 26 6.832 -0.561 -30.185 1.00 0.00 H new ATOM 0 HG SER A 26 4.746 0.322 -29.676 1.00 0.00 H new ATOM 445 N ALA A 27 7.356 -2.418 -33.126 1.00 0.00 N ATOM 446 CA ALA A 27 7.273 -3.629 -33.925 1.00 0.00 C ATOM 447 C ALA A 27 5.858 -4.201 -33.829 1.00 0.00 C ATOM 448 O ALA A 27 5.377 -4.836 -34.767 1.00 0.00 O ATOM 449 CB ALA A 27 8.337 -4.624 -33.455 1.00 0.00 C ATOM 0 H ALA A 27 8.173 -2.363 -32.517 1.00 0.00 H new ATOM 0 HA ALA A 27 7.471 -3.411 -34.975 1.00 0.00 H new ATOM 0 HB1 ALA A 27 8.275 -5.533 -34.054 1.00 0.00 H new ATOM 0 HB2 ALA A 27 9.326 -4.180 -33.570 1.00 0.00 H new ATOM 0 HB3 ALA A 27 8.168 -4.869 -32.406 1.00 0.00 H new ATOM 455 N TYR A 28 5.231 -3.958 -32.689 1.00 0.00 N ATOM 456 CA TYR A 28 3.880 -4.442 -32.460 1.00 0.00 C ATOM 457 C TYR A 28 2.877 -3.716 -33.359 1.00 0.00 C ATOM 458 O TYR A 28 1.924 -4.322 -33.847 1.00 0.00 O ATOM 459 CB TYR A 28 3.560 -4.122 -30.998 1.00 0.00 C ATOM 460 CG TYR A 28 2.072 -4.208 -30.653 1.00 0.00 C ATOM 461 CD1 TYR A 28 1.490 -5.435 -30.407 1.00 0.00 C ATOM 462 CD2 TYR A 28 1.310 -3.058 -30.590 1.00 0.00 C ATOM 463 CE1 TYR A 28 0.090 -5.516 -30.083 1.00 0.00 C ATOM 464 CE2 TYR A 28 -0.090 -3.140 -30.265 1.00 0.00 C ATOM 465 CZ TYR A 28 -0.632 -4.364 -30.027 1.00 0.00 C ATOM 466 OH TYR A 28 -1.954 -4.441 -29.721 1.00 0.00 O ATOM 0 H TYR A 28 5.633 -3.432 -31.913 1.00 0.00 H new ATOM 0 HA TYR A 28 3.812 -5.507 -32.680 1.00 0.00 H new ATOM 0 HB2 TYR A 28 4.111 -4.810 -30.357 1.00 0.00 H new ATOM 0 HB3 TYR A 28 3.918 -3.118 -30.770 1.00 0.00 H new ATOM 0 HD1 TYR A 28 2.085 -6.335 -30.458 1.00 0.00 H new ATOM 0 HD2 TYR A 28 1.764 -2.098 -30.784 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -0.377 -6.470 -29.889 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -0.697 -2.248 -30.211 1.00 0.00 H new ATOM 0 HH TYR A 28 -2.215 -3.655 -29.198 1.00 0.00 H new ATOM 476 N MET A 29 3.127 -2.430 -33.552 1.00 0.00 N ATOM 477 CA MET A 29 2.258 -1.615 -34.385 1.00 0.00 C ATOM 478 C MET A 29 2.521 -1.875 -35.869 1.00 0.00 C ATOM 479 O MET A 29 1.679 -1.573 -36.714 1.00 0.00 O ATOM 480 CB MET A 29 2.495 -0.136 -34.075 1.00 0.00 C ATOM 481 CG MET A 29 1.187 0.560 -33.690 1.00 0.00 C ATOM 482 SD MET A 29 1.510 2.254 -33.229 1.00 0.00 S ATOM 483 CE MET A 29 2.643 1.996 -31.873 1.00 0.00 C ATOM 0 H MET A 29 3.919 -1.931 -33.146 1.00 0.00 H new ATOM 0 HA MET A 29 1.223 -1.879 -34.167 1.00 0.00 H new ATOM 0 HB2 MET A 29 3.214 -0.042 -33.261 1.00 0.00 H new ATOM 0 HB3 MET A 29 2.931 0.356 -34.944 1.00 0.00 H new ATOM 0 HG2 MET A 29 0.489 0.529 -34.527 1.00 0.00 H new ATOM 0 HG3 MET A 29 0.715 0.032 -32.861 1.00 0.00 H new ATOM 0 HE1 MET A 29 2.686 2.895 -31.259 1.00 0.00 H new ATOM 0 HE2 MET A 29 2.299 1.158 -31.266 1.00 0.00 H new ATOM 0 HE3 MET A 29 3.636 1.777 -32.265 1.00 0.00 H new ATOM 493 N PHE A 30 3.692 -2.432 -36.142 1.00 0.00 N ATOM 494 CA PHE A 30 4.076 -2.735 -37.510 1.00 0.00 C ATOM 495 C PHE A 30 3.281 -3.925 -38.051 1.00 0.00 C ATOM 496 O PHE A 30 2.749 -3.869 -39.159 1.00 0.00 O ATOM 497 CB PHE A 30 5.562 -3.096 -37.488 1.00 0.00 C ATOM 498 CG PHE A 30 6.498 -1.889 -37.570 1.00 0.00 C ATOM 499 CD1 PHE A 30 6.311 -0.826 -36.742 1.00 0.00 C ATOM 500 CD2 PHE A 30 7.517 -1.878 -38.470 1.00 0.00 C ATOM 501 CE1 PHE A 30 7.179 0.295 -36.817 1.00 0.00 C ATOM 502 CE2 PHE A 30 8.385 -0.757 -38.546 1.00 0.00 C ATOM 503 CZ PHE A 30 8.198 0.306 -37.719 1.00 0.00 C ATOM 0 H PHE A 30 4.387 -2.681 -35.439 1.00 0.00 H new ATOM 0 HA PHE A 30 3.876 -1.877 -38.152 1.00 0.00 H new ATOM 0 HB2 PHE A 30 5.777 -3.648 -36.573 1.00 0.00 H new ATOM 0 HB3 PHE A 30 5.775 -3.765 -38.322 1.00 0.00 H new ATOM 0 HD1 PHE A 30 5.502 -0.835 -36.027 1.00 0.00 H new ATOM 0 HD2 PHE A 30 7.666 -2.722 -39.127 1.00 0.00 H new ATOM 0 HE1 PHE A 30 7.031 1.138 -36.159 1.00 0.00 H new ATOM 0 HE2 PHE A 30 9.194 -0.749 -39.261 1.00 0.00 H new ATOM 0 HZ PHE A 30 8.858 1.159 -37.778 1.00 0.00 H new ATOM 513 N PHE A 31 3.226 -4.975 -37.244 1.00 0.00 N ATOM 514 CA PHE A 31 2.506 -6.177 -37.628 1.00 0.00 C ATOM 515 C PHE A 31 1.014 -6.045 -37.317 1.00 0.00 C ATOM 516 O PHE A 31 0.191 -6.759 -37.888 1.00 0.00 O ATOM 517 CB PHE A 31 3.087 -7.328 -36.806 1.00 0.00 C ATOM 518 CG PHE A 31 2.251 -7.702 -35.581 1.00 0.00 C ATOM 519 CD1 PHE A 31 2.358 -6.975 -34.436 1.00 0.00 C ATOM 520 CD2 PHE A 31 1.399 -8.761 -35.635 1.00 0.00 C ATOM 521 CE1 PHE A 31 1.582 -7.322 -33.299 1.00 0.00 C ATOM 522 CE2 PHE A 31 0.622 -9.108 -34.498 1.00 0.00 C ATOM 523 CZ PHE A 31 0.731 -8.380 -33.353 1.00 0.00 C ATOM 0 H PHE A 31 3.668 -5.018 -36.326 1.00 0.00 H new ATOM 0 HA PHE A 31 2.612 -6.348 -38.699 1.00 0.00 H new ATOM 0 HB2 PHE A 31 3.186 -8.204 -37.447 1.00 0.00 H new ATOM 0 HB3 PHE A 31 4.091 -7.057 -36.479 1.00 0.00 H new ATOM 0 HD1 PHE A 31 3.034 -6.134 -34.392 1.00 0.00 H new ATOM 0 HD2 PHE A 31 1.313 -9.339 -36.544 1.00 0.00 H new ATOM 0 HE1 PHE A 31 1.668 -6.745 -32.390 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -0.055 -9.949 -34.542 1.00 0.00 H new ATOM 0 HZ PHE A 31 0.141 -8.643 -32.487 1.00 0.00 H new ATOM 533 N ALA A 32 0.710 -5.126 -36.411 1.00 0.00 N ATOM 534 CA ALA A 32 -0.669 -4.892 -36.016 1.00 0.00 C ATOM 535 C ALA A 32 -1.366 -4.056 -37.091 1.00 0.00 C ATOM 536 O ALA A 32 -2.491 -4.361 -37.486 1.00 0.00 O ATOM 537 CB ALA A 32 -0.698 -4.219 -34.642 1.00 0.00 C ATOM 0 H ALA A 32 1.395 -4.535 -35.940 1.00 0.00 H new ATOM 0 HA ALA A 32 -1.210 -5.834 -35.929 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -1.732 -4.043 -34.345 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -0.215 -4.866 -33.910 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -0.168 -3.268 -34.691 1.00 0.00 H new ATOM 543 N ASN A 33 -0.671 -3.018 -37.531 1.00 0.00 N ATOM 544 CA ASN A 33 -1.211 -2.136 -38.552 1.00 0.00 C ATOM 545 C ASN A 33 -1.877 -2.973 -39.645 1.00 0.00 C ATOM 546 O ASN A 33 -2.816 -2.517 -40.296 1.00 0.00 O ATOM 547 CB ASN A 33 -0.103 -1.304 -39.203 1.00 0.00 C ATOM 548 CG ASN A 33 -0.072 0.113 -38.629 1.00 0.00 C ATOM 549 OD1 ASN A 33 -0.092 1.101 -39.345 1.00 0.00 O ATOM 550 ND2 ASN A 33 -0.020 0.158 -37.301 1.00 0.00 N ATOM 0 H ASN A 33 0.261 -2.768 -37.200 1.00 0.00 H new ATOM 0 HA ASN A 33 -1.930 -1.470 -38.075 1.00 0.00 H new ATOM 0 HB2 ASN A 33 0.861 -1.786 -39.042 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -0.262 -1.260 -40.281 1.00 0.00 H new ATOM 0 HD21 ASN A 33 0.006 1.058 -36.822 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -0.006 -0.708 -36.762 1.00 0.00 H new ATOM 557 N GLU A 34 -1.367 -4.185 -39.810 1.00 0.00 N ATOM 558 CA GLU A 34 -1.901 -5.091 -40.813 1.00 0.00 C ATOM 559 C GLU A 34 -2.850 -6.101 -40.163 1.00 0.00 C ATOM 560 O GLU A 34 -3.845 -6.501 -40.766 1.00 0.00 O ATOM 561 CB GLU A 34 -0.775 -5.803 -41.565 1.00 0.00 C ATOM 562 CG GLU A 34 -0.314 -4.978 -42.769 1.00 0.00 C ATOM 563 CD GLU A 34 -0.310 -5.825 -44.044 1.00 0.00 C ATOM 564 OE1 GLU A 34 -1.036 -6.827 -44.125 1.00 0.00 O ATOM 565 OE2 GLU A 34 0.482 -5.408 -44.972 1.00 0.00 O ATOM 0 H GLU A 34 -0.590 -4.561 -39.266 1.00 0.00 H new ATOM 0 HA GLU A 34 -2.465 -4.506 -41.540 1.00 0.00 H new ATOM 0 HB2 GLU A 34 0.066 -5.973 -40.893 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -1.118 -6.782 -41.900 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -0.973 -4.120 -42.900 1.00 0.00 H new ATOM 0 HG3 GLU A 34 0.686 -4.587 -42.585 1.00 0.00 H new ATOM 572 N ASN A 35 -2.509 -6.484 -38.941 1.00 0.00 N ATOM 573 CA ASN A 35 -3.317 -7.439 -38.204 1.00 0.00 C ATOM 574 C ASN A 35 -4.347 -6.686 -37.359 1.00 0.00 C ATOM 575 O ASN A 35 -4.798 -7.187 -36.331 1.00 0.00 O ATOM 576 CB ASN A 35 -2.455 -8.279 -37.260 1.00 0.00 C ATOM 577 CG ASN A 35 -1.700 -9.366 -38.027 1.00 0.00 C ATOM 578 OD1 ASN A 35 -1.020 -8.914 -39.077 1.00 0.00 O flip ATOM 579 ND2 ASN A 35 -1.732 -10.538 -37.689 1.00 0.00 N flip ATOM 0 H ASN A 35 -1.684 -6.150 -38.443 1.00 0.00 H new ATOM 0 HA ASN A 35 -3.805 -8.094 -38.926 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -1.745 -7.635 -36.741 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -3.085 -8.738 -36.498 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -2.274 -10.818 -36.872 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -1.217 -11.237 -38.224 1.00 0.00 H new ATOM 586 N ARG A 36 -4.687 -5.492 -37.825 1.00 0.00 N ATOM 587 CA ARG A 36 -5.654 -4.664 -37.125 1.00 0.00 C ATOM 588 C ARG A 36 -7.063 -4.924 -37.662 1.00 0.00 C ATOM 589 O ARG A 36 -8.051 -4.585 -37.013 1.00 0.00 O ATOM 590 CB ARG A 36 -5.322 -3.179 -37.280 1.00 0.00 C ATOM 591 CG ARG A 36 -5.010 -2.542 -35.924 1.00 0.00 C ATOM 592 CD ARG A 36 -6.271 -2.436 -35.065 1.00 0.00 C ATOM 593 NE ARG A 36 -6.913 -1.118 -35.269 1.00 0.00 N ATOM 594 CZ ARG A 36 -7.869 -0.876 -36.190 1.00 0.00 C ATOM 595 NH1 ARG A 36 -8.303 -1.863 -37.003 1.00 0.00 N ATOM 596 NH2 ARG A 36 -8.374 0.340 -36.285 1.00 0.00 N ATOM 0 H ARG A 36 -4.310 -5.079 -38.678 1.00 0.00 H new ATOM 0 HA ARG A 36 -5.611 -4.925 -36.068 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -4.467 -3.061 -37.946 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -6.162 -2.662 -37.744 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -4.260 -3.137 -35.403 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -4.583 -1.550 -36.074 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -6.967 -3.233 -35.326 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -6.017 -2.567 -34.013 1.00 0.00 H new ATOM 0 HE ARG A 36 -6.614 -0.344 -34.676 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -7.908 -2.800 -36.924 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -9.026 -1.672 -37.697 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -8.041 1.080 -35.667 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -9.097 0.539 -36.976 1.00 0.00 H new ATOM 610 N ASP A 37 -7.110 -5.524 -38.842 1.00 0.00 N ATOM 611 CA ASP A 37 -8.381 -5.832 -39.475 1.00 0.00 C ATOM 612 C ASP A 37 -8.549 -7.351 -39.557 1.00 0.00 C ATOM 613 O ASP A 37 -9.646 -7.845 -39.816 1.00 0.00 O ATOM 614 CB ASP A 37 -8.439 -5.274 -40.897 1.00 0.00 C ATOM 615 CG ASP A 37 -9.020 -3.862 -41.014 1.00 0.00 C ATOM 616 OD1 ASP A 37 -8.785 -3.002 -40.152 1.00 0.00 O ATOM 617 OD2 ASP A 37 -9.750 -3.657 -42.058 1.00 0.00 O ATOM 0 H ASP A 37 -6.288 -5.805 -39.377 1.00 0.00 H new ATOM 0 HA ASP A 37 -9.173 -5.379 -38.878 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -7.431 -5.272 -41.312 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -9.035 -5.948 -41.512 1.00 0.00 H new ATOM 622 N ILE A 38 -7.447 -8.050 -39.329 1.00 0.00 N ATOM 623 CA ILE A 38 -7.458 -9.502 -39.374 1.00 0.00 C ATOM 624 C ILE A 38 -8.304 -10.037 -38.217 1.00 0.00 C ATOM 625 O ILE A 38 -8.984 -11.051 -38.359 1.00 0.00 O ATOM 626 CB ILE A 38 -6.029 -10.049 -39.396 1.00 0.00 C ATOM 627 CG1 ILE A 38 -5.322 -9.684 -40.702 1.00 0.00 C ATOM 628 CG2 ILE A 38 -6.015 -11.557 -39.138 1.00 0.00 C ATOM 629 CD1 ILE A 38 -3.817 -9.940 -40.600 1.00 0.00 C ATOM 0 H ILE A 38 -6.540 -7.637 -39.112 1.00 0.00 H new ATOM 0 HA ILE A 38 -7.922 -9.851 -40.297 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.471 -9.579 -38.586 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -5.739 -10.269 -41.522 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -5.501 -8.635 -40.936 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -4.988 -11.920 -39.159 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -6.453 -11.763 -38.161 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -6.595 -12.064 -39.910 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -3.338 -9.672 -41.542 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -3.399 -9.335 -39.795 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -3.641 -10.995 -40.390 1.00 0.00 H new ATOM 641 N VAL A 39 -8.234 -9.330 -37.099 1.00 0.00 N ATOM 642 CA VAL A 39 -8.985 -9.722 -35.918 1.00 0.00 C ATOM 643 C VAL A 39 -10.411 -9.178 -36.023 1.00 0.00 C ATOM 644 O VAL A 39 -11.373 -9.883 -35.719 1.00 0.00 O ATOM 645 CB VAL A 39 -8.258 -9.253 -34.656 1.00 0.00 C ATOM 646 CG1 VAL A 39 -8.444 -10.252 -33.513 1.00 0.00 C ATOM 647 CG2 VAL A 39 -6.773 -9.011 -34.937 1.00 0.00 C ATOM 0 H VAL A 39 -7.669 -8.488 -36.986 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.055 -10.808 -35.852 1.00 0.00 H new ATOM 0 HB VAL A 39 -8.699 -8.305 -34.347 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -7.917 -9.895 -32.628 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -9.506 -10.353 -33.287 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -8.042 -11.221 -33.808 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -6.279 -8.678 -34.024 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -6.312 -9.937 -35.282 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -6.668 -8.245 -35.706 1.00 0.00 H new ATOM 657 N ARG A 40 -10.504 -7.928 -36.455 1.00 0.00 N ATOM 658 CA ARG A 40 -11.797 -7.282 -36.603 1.00 0.00 C ATOM 659 C ARG A 40 -12.690 -8.092 -37.543 1.00 0.00 C ATOM 660 O ARG A 40 -13.897 -8.188 -37.329 1.00 0.00 O ATOM 661 CB ARG A 40 -11.642 -5.862 -37.154 1.00 0.00 C ATOM 662 CG ARG A 40 -11.438 -4.853 -36.021 1.00 0.00 C ATOM 663 CD ARG A 40 -10.698 -3.611 -36.522 1.00 0.00 C ATOM 664 NE ARG A 40 -11.509 -2.401 -36.262 1.00 0.00 N ATOM 665 CZ ARG A 40 -11.494 -1.713 -35.101 1.00 0.00 C ATOM 666 NH1 ARG A 40 -10.706 -2.113 -34.079 1.00 0.00 N ATOM 667 NH2 ARG A 40 -12.260 -0.646 -34.978 1.00 0.00 N ATOM 0 H ARG A 40 -9.705 -7.346 -36.707 1.00 0.00 H new ATOM 0 HA ARG A 40 -12.257 -7.229 -35.616 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -10.793 -5.824 -37.837 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -12.527 -5.593 -37.730 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -12.404 -4.564 -35.608 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -10.872 -5.317 -35.213 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -9.733 -3.526 -36.023 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -10.498 -3.702 -37.590 1.00 0.00 H new ATOM 0 HE ARG A 40 -12.118 -2.065 -37.008 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -10.117 -2.940 -34.182 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -10.700 -1.588 -33.204 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -12.853 -0.351 -35.754 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -12.260 -0.116 -34.107 1.00 0.00 H new ATOM 681 N SER A 41 -12.063 -8.654 -38.566 1.00 0.00 N ATOM 682 CA SER A 41 -12.786 -9.453 -39.541 1.00 0.00 C ATOM 683 C SER A 41 -13.375 -10.694 -38.867 1.00 0.00 C ATOM 684 O SER A 41 -14.423 -11.190 -39.277 1.00 0.00 O ATOM 685 CB SER A 41 -11.878 -9.860 -40.703 1.00 0.00 C ATOM 686 OG SER A 41 -12.611 -10.065 -41.907 1.00 0.00 O ATOM 0 H SER A 41 -11.061 -8.572 -38.741 1.00 0.00 H new ATOM 0 HA SER A 41 -13.597 -8.847 -39.945 1.00 0.00 H new ATOM 0 HB2 SER A 41 -11.126 -9.087 -40.863 1.00 0.00 H new ATOM 0 HB3 SER A 41 -11.345 -10.774 -40.443 1.00 0.00 H new ATOM 0 HG SER A 41 -11.995 -10.322 -42.625 1.00 0.00 H new ATOM 692 N GLU A 42 -12.674 -11.161 -37.843 1.00 0.00 N ATOM 693 CA GLU A 42 -13.114 -12.335 -37.108 1.00 0.00 C ATOM 694 C GLU A 42 -13.894 -11.917 -35.860 1.00 0.00 C ATOM 695 O GLU A 42 -14.440 -12.763 -35.153 1.00 0.00 O ATOM 696 CB GLU A 42 -11.927 -13.227 -36.740 1.00 0.00 C ATOM 697 CG GLU A 42 -11.486 -14.073 -37.937 1.00 0.00 C ATOM 698 CD GLU A 42 -12.000 -15.508 -37.813 1.00 0.00 C ATOM 699 OE1 GLU A 42 -12.119 -16.030 -36.694 1.00 0.00 O ATOM 700 OE2 GLU A 42 -12.282 -16.085 -38.931 1.00 0.00 O ATOM 0 H GLU A 42 -11.805 -10.747 -37.505 1.00 0.00 H new ATOM 0 HA GLU A 42 -13.777 -12.915 -37.750 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -11.095 -12.610 -36.400 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -12.201 -13.879 -35.910 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -11.860 -13.628 -38.859 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -10.398 -14.077 -38.003 1.00 0.00 H new ATOM 707 N ASN A 43 -13.922 -10.613 -35.627 1.00 0.00 N ATOM 708 CA ASN A 43 -14.626 -10.073 -34.475 1.00 0.00 C ATOM 709 C ASN A 43 -15.081 -8.646 -34.785 1.00 0.00 C ATOM 710 O ASN A 43 -14.672 -7.701 -34.114 1.00 0.00 O ATOM 711 CB ASN A 43 -13.715 -10.024 -33.247 1.00 0.00 C ATOM 712 CG ASN A 43 -12.609 -11.076 -33.341 1.00 0.00 C ATOM 713 OD1 ASN A 43 -11.379 -10.570 -33.327 1.00 0.00 O flip ATOM 714 ND2 ASN A 43 -12.855 -12.268 -33.421 1.00 0.00 N flip ATOM 0 H ASN A 43 -13.469 -9.914 -36.216 1.00 0.00 H new ATOM 0 HA ASN A 43 -15.478 -10.720 -34.266 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -13.272 -9.032 -33.158 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -14.305 -10.191 -32.346 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -13.823 -12.590 -33.427 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -12.093 -12.943 -33.482 1.00 0.00 H new ATOM 721 N PRO A 44 -15.946 -8.532 -35.829 1.00 0.00 N ATOM 722 CA PRO A 44 -16.461 -7.236 -36.236 1.00 0.00 C ATOM 723 C PRO A 44 -17.525 -6.737 -35.256 1.00 0.00 C ATOM 724 O PRO A 44 -18.075 -5.650 -35.430 1.00 0.00 O ATOM 725 CB PRO A 44 -17.001 -7.450 -37.640 1.00 0.00 C ATOM 726 CG PRO A 44 -17.190 -8.950 -37.789 1.00 0.00 C ATOM 727 CD PRO A 44 -16.453 -9.630 -36.647 1.00 0.00 C ATOM 0 HA PRO A 44 -15.696 -6.459 -36.232 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -17.944 -6.922 -37.781 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -16.307 -7.068 -38.388 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -18.249 -9.205 -37.765 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -16.802 -9.290 -38.749 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -17.119 -10.276 -36.075 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -15.641 -10.256 -37.017 1.00 0.00 H new ATOM 735 N ASP A 45 -17.782 -7.555 -34.245 1.00 0.00 N ATOM 736 CA ASP A 45 -18.771 -7.210 -33.238 1.00 0.00 C ATOM 737 C ASP A 45 -18.088 -6.450 -32.097 1.00 0.00 C ATOM 738 O ASP A 45 -18.751 -5.786 -31.304 1.00 0.00 O ATOM 739 CB ASP A 45 -19.417 -8.465 -32.648 1.00 0.00 C ATOM 740 CG ASP A 45 -20.907 -8.335 -32.326 1.00 0.00 C ATOM 741 OD1 ASP A 45 -21.606 -7.470 -32.876 1.00 0.00 O ATOM 742 OD2 ASP A 45 -21.354 -9.180 -31.460 1.00 0.00 O ATOM 0 H ASP A 45 -17.323 -8.455 -34.102 1.00 0.00 H new ATOM 0 HA ASP A 45 -19.538 -6.599 -33.714 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -19.283 -9.288 -33.349 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -18.886 -8.734 -31.735 1.00 0.00 H new ATOM 747 N ILE A 46 -16.769 -6.574 -32.054 1.00 0.00 N ATOM 748 CA ILE A 46 -15.989 -5.908 -31.025 1.00 0.00 C ATOM 749 C ILE A 46 -15.248 -4.720 -31.643 1.00 0.00 C ATOM 750 O ILE A 46 -15.520 -4.338 -32.779 1.00 0.00 O ATOM 751 CB ILE A 46 -15.069 -6.907 -30.320 1.00 0.00 C ATOM 752 CG1 ILE A 46 -14.102 -7.558 -31.311 1.00 0.00 C ATOM 753 CG2 ILE A 46 -15.880 -7.947 -29.544 1.00 0.00 C ATOM 754 CD1 ILE A 46 -12.979 -8.294 -30.579 1.00 0.00 C ATOM 0 H ILE A 46 -16.222 -7.125 -32.715 1.00 0.00 H new ATOM 0 HA ILE A 46 -16.642 -5.509 -30.249 1.00 0.00 H new ATOM 0 HB ILE A 46 -14.466 -6.361 -29.594 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -14.644 -8.257 -31.948 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -13.677 -6.796 -31.964 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -15.202 -8.645 -29.053 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -16.491 -7.446 -28.794 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -16.525 -8.493 -30.232 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -12.306 -8.747 -31.307 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -12.423 -7.588 -29.962 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -13.406 -9.072 -29.946 1.00 0.00 H new ATOM 766 N THR A 47 -14.328 -4.169 -30.865 1.00 0.00 N ATOM 767 CA THR A 47 -13.546 -3.032 -31.320 1.00 0.00 C ATOM 768 C THR A 47 -12.115 -3.120 -30.788 1.00 0.00 C ATOM 769 O THR A 47 -11.749 -4.101 -30.141 1.00 0.00 O ATOM 770 CB THR A 47 -14.275 -1.756 -30.895 1.00 0.00 C ATOM 771 OG1 THR A 47 -14.388 -1.878 -29.479 1.00 0.00 O ATOM 772 CG2 THR A 47 -15.725 -1.718 -31.383 1.00 0.00 C ATOM 0 H THR A 47 -14.107 -4.489 -29.922 1.00 0.00 H new ATOM 0 HA THR A 47 -13.455 -3.025 -32.406 1.00 0.00 H new ATOM 0 HB THR A 47 -13.741 -0.887 -31.280 1.00 0.00 H new ATOM 0 HG1 THR A 47 -13.698 -2.490 -29.147 1.00 0.00 H new ATOM 0 HG21 THR A 47 -16.196 -0.792 -31.054 1.00 0.00 H new ATOM 0 HG22 THR A 47 -15.744 -1.768 -32.472 1.00 0.00 H new ATOM 0 HG23 THR A 47 -16.270 -2.568 -30.972 1.00 0.00 H new ATOM 780 N PHE A 48 -11.343 -2.085 -31.081 1.00 0.00 N ATOM 781 CA PHE A 48 -9.959 -2.033 -30.641 1.00 0.00 C ATOM 782 C PHE A 48 -9.861 -2.212 -29.124 1.00 0.00 C ATOM 783 O PHE A 48 -8.862 -2.723 -28.620 1.00 0.00 O ATOM 784 CB PHE A 48 -9.422 -0.651 -31.015 1.00 0.00 C ATOM 785 CG PHE A 48 -7.894 -0.572 -31.072 1.00 0.00 C ATOM 786 CD1 PHE A 48 -7.183 -0.318 -29.941 1.00 0.00 C ATOM 787 CD2 PHE A 48 -7.247 -0.757 -32.255 1.00 0.00 C ATOM 788 CE1 PHE A 48 -5.767 -0.244 -29.994 1.00 0.00 C ATOM 789 CE2 PHE A 48 -5.831 -0.684 -32.308 1.00 0.00 C ATOM 790 CZ PHE A 48 -5.120 -0.429 -31.177 1.00 0.00 C ATOM 0 H PHE A 48 -11.650 -1.274 -31.619 1.00 0.00 H new ATOM 0 HA PHE A 48 -9.387 -2.832 -31.113 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -9.827 -0.366 -31.986 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -9.787 0.078 -30.291 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -7.696 -0.173 -29.002 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -7.811 -0.959 -33.153 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -5.203 -0.041 -29.096 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -5.318 -0.831 -33.247 1.00 0.00 H new ATOM 0 HZ PHE A 48 -4.042 -0.373 -31.218 1.00 0.00 H new ATOM 800 N GLY A 49 -10.909 -1.780 -28.439 1.00 0.00 N ATOM 801 CA GLY A 49 -10.953 -1.886 -26.992 1.00 0.00 C ATOM 802 C GLY A 49 -10.610 -3.305 -26.535 1.00 0.00 C ATOM 803 O GLY A 49 -10.076 -3.498 -25.443 1.00 0.00 O ATOM 0 H GLY A 49 -11.735 -1.355 -28.860 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -10.251 -1.178 -26.551 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -11.946 -1.615 -26.634 1.00 0.00 H new ATOM 807 N GLN A 50 -10.928 -4.262 -27.393 1.00 0.00 N ATOM 808 CA GLN A 50 -10.660 -5.658 -27.092 1.00 0.00 C ATOM 809 C GLN A 50 -9.955 -6.331 -28.272 1.00 0.00 C ATOM 810 O GLN A 50 -9.719 -7.537 -28.253 1.00 0.00 O ATOM 811 CB GLN A 50 -11.949 -6.398 -26.729 1.00 0.00 C ATOM 812 CG GLN A 50 -13.073 -6.052 -27.707 1.00 0.00 C ATOM 813 CD GLN A 50 -13.661 -4.674 -27.401 1.00 0.00 C ATOM 814 OE1 GLN A 50 -13.270 -3.664 -27.965 1.00 0.00 O ATOM 815 NE2 GLN A 50 -14.620 -4.686 -26.480 1.00 0.00 N ATOM 0 H GLN A 50 -11.369 -4.098 -28.298 1.00 0.00 H new ATOM 0 HA GLN A 50 -9.999 -5.702 -26.227 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -11.771 -7.473 -26.740 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -12.250 -6.135 -25.715 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -12.690 -6.069 -28.727 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -13.857 -6.807 -27.648 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -14.900 -5.566 -26.047 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -15.076 -3.815 -26.207 1.00 0.00 H new ATOM 824 N VAL A 51 -9.639 -5.519 -29.271 1.00 0.00 N ATOM 825 CA VAL A 51 -8.967 -6.020 -30.457 1.00 0.00 C ATOM 826 C VAL A 51 -7.526 -5.505 -30.478 1.00 0.00 C ATOM 827 O VAL A 51 -6.607 -6.235 -30.846 1.00 0.00 O ATOM 828 CB VAL A 51 -9.758 -5.635 -31.710 1.00 0.00 C ATOM 829 CG1 VAL A 51 -8.846 -5.581 -32.938 1.00 0.00 C ATOM 830 CG2 VAL A 51 -10.927 -6.594 -31.936 1.00 0.00 C ATOM 0 H VAL A 51 -9.836 -4.518 -29.283 1.00 0.00 H new ATOM 0 HA VAL A 51 -8.923 -7.109 -30.439 1.00 0.00 H new ATOM 0 HB VAL A 51 -10.169 -4.638 -31.554 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -9.432 -5.305 -33.815 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -8.063 -4.840 -32.777 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -8.392 -6.559 -33.098 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -11.472 -6.298 -32.832 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -10.547 -7.608 -32.061 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -11.596 -6.561 -31.076 1.00 0.00 H new ATOM 840 N GLY A 52 -7.375 -4.250 -30.077 1.00 0.00 N ATOM 841 CA GLY A 52 -6.062 -3.629 -30.045 1.00 0.00 C ATOM 842 C GLY A 52 -5.304 -4.014 -28.772 1.00 0.00 C ATOM 843 O GLY A 52 -4.093 -3.823 -28.685 1.00 0.00 O ATOM 0 H GLY A 52 -8.140 -3.648 -29.772 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -5.489 -3.936 -30.920 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -6.167 -2.545 -30.096 1.00 0.00 H new ATOM 847 N LYS A 53 -6.050 -4.550 -27.816 1.00 0.00 N ATOM 848 CA LYS A 53 -5.464 -4.963 -26.553 1.00 0.00 C ATOM 849 C LYS A 53 -5.379 -6.489 -26.510 1.00 0.00 C ATOM 850 O LYS A 53 -5.157 -7.073 -25.450 1.00 0.00 O ATOM 851 CB LYS A 53 -6.238 -4.356 -25.380 1.00 0.00 C ATOM 852 CG LYS A 53 -5.416 -4.420 -24.091 1.00 0.00 C ATOM 853 CD LYS A 53 -6.243 -3.956 -22.890 1.00 0.00 C ATOM 854 CE LYS A 53 -5.495 -4.206 -21.580 1.00 0.00 C ATOM 855 NZ LYS A 53 -5.900 -3.217 -20.555 1.00 0.00 N ATOM 0 H LYS A 53 -7.055 -4.707 -27.892 1.00 0.00 H new ATOM 0 HA LYS A 53 -4.446 -4.585 -26.463 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -6.491 -3.320 -25.604 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -7.178 -4.891 -25.244 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -5.070 -5.440 -23.926 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -4.529 -3.795 -24.190 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -6.468 -2.894 -22.987 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -7.197 -4.484 -22.875 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -5.702 -5.215 -21.223 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -4.420 -4.143 -21.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -5.383 -3.401 -19.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -5.680 -2.258 -20.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -6.922 -3.297 -20.381 1.00 0.00 H new ATOM 868 N LYS A 54 -5.561 -7.094 -27.676 1.00 0.00 N ATOM 869 CA LYS A 54 -5.508 -8.542 -27.785 1.00 0.00 C ATOM 870 C LYS A 54 -4.336 -8.937 -28.687 1.00 0.00 C ATOM 871 O LYS A 54 -3.665 -9.936 -28.434 1.00 0.00 O ATOM 872 CB LYS A 54 -6.856 -9.093 -28.250 1.00 0.00 C ATOM 873 CG LYS A 54 -7.719 -9.509 -27.057 1.00 0.00 C ATOM 874 CD LYS A 54 -8.356 -10.880 -27.291 1.00 0.00 C ATOM 875 CE LYS A 54 -9.597 -11.065 -26.417 1.00 0.00 C ATOM 876 NZ LYS A 54 -10.811 -10.617 -27.138 1.00 0.00 N ATOM 0 H LYS A 54 -5.745 -6.607 -28.553 1.00 0.00 H new ATOM 0 HA LYS A 54 -5.326 -8.993 -26.809 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -7.379 -8.337 -28.836 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -6.696 -9.950 -28.904 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -7.108 -9.537 -26.155 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -8.499 -8.766 -26.891 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -8.628 -10.984 -28.341 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -7.631 -11.664 -27.070 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -9.699 -12.114 -26.137 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -9.486 -10.498 -25.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -11.644 -10.750 -26.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -10.718 -9.611 -27.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -10.924 -11.176 -28.008 1.00 0.00 H new ATOM 889 N LEU A 55 -4.128 -8.134 -29.719 1.00 0.00 N ATOM 890 CA LEU A 55 -3.050 -8.389 -30.660 1.00 0.00 C ATOM 891 C LEU A 55 -1.746 -8.599 -29.889 1.00 0.00 C ATOM 892 O LEU A 55 -0.849 -9.297 -30.359 1.00 0.00 O ATOM 893 CB LEU A 55 -2.976 -7.272 -31.704 1.00 0.00 C ATOM 894 CG LEU A 55 -3.861 -7.448 -32.939 1.00 0.00 C ATOM 895 CD1 LEU A 55 -3.574 -6.364 -33.979 1.00 0.00 C ATOM 896 CD2 LEU A 55 -3.717 -8.855 -33.522 1.00 0.00 C ATOM 0 H LEU A 55 -4.687 -7.306 -29.925 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.240 -9.305 -31.220 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -3.243 -6.332 -31.221 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -1.941 -7.178 -32.034 1.00 0.00 H new ATOM 0 HG LEU A 55 -4.901 -7.332 -32.633 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -4.217 -6.513 -34.847 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -3.770 -5.383 -33.546 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -2.530 -6.422 -34.287 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -4.357 -8.953 -34.399 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -2.679 -9.025 -33.809 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -4.012 -9.591 -32.774 1.00 0.00 H new ATOM 908 N GLY A 56 -1.682 -7.981 -28.719 1.00 0.00 N ATOM 909 CA GLY A 56 -0.501 -8.091 -27.878 1.00 0.00 C ATOM 910 C GLY A 56 -0.187 -9.555 -27.564 1.00 0.00 C ATOM 911 O GLY A 56 0.963 -9.905 -27.306 1.00 0.00 O ATOM 0 H GLY A 56 -2.428 -7.402 -28.333 1.00 0.00 H new ATOM 0 HA2 GLY A 56 0.351 -7.632 -28.379 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -0.659 -7.542 -26.950 1.00 0.00 H new ATOM 915 N GLU A 57 -1.231 -10.370 -27.596 1.00 0.00 N ATOM 916 CA GLU A 57 -1.080 -11.789 -27.317 1.00 0.00 C ATOM 917 C GLU A 57 -0.523 -12.515 -28.544 1.00 0.00 C ATOM 918 O GLU A 57 0.173 -13.520 -28.411 1.00 0.00 O ATOM 919 CB GLU A 57 -2.408 -12.405 -26.873 1.00 0.00 C ATOM 920 CG GLU A 57 -2.999 -11.638 -25.687 1.00 0.00 C ATOM 921 CD GLU A 57 -3.525 -12.600 -24.620 1.00 0.00 C ATOM 922 OE1 GLU A 57 -4.195 -13.588 -24.953 1.00 0.00 O ATOM 923 OE2 GLU A 57 -3.213 -12.290 -23.406 1.00 0.00 O ATOM 0 H GLU A 57 -2.184 -10.076 -27.811 1.00 0.00 H new ATOM 0 HA GLU A 57 -0.371 -11.904 -26.497 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -3.113 -12.396 -27.704 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -2.255 -13.448 -26.596 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -2.238 -10.989 -25.253 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -3.808 -10.994 -26.032 1.00 0.00 H new ATOM 930 N LYS A 58 -0.851 -11.977 -29.710 1.00 0.00 N ATOM 931 CA LYS A 58 -0.392 -12.561 -30.958 1.00 0.00 C ATOM 932 C LYS A 58 1.065 -12.158 -31.200 1.00 0.00 C ATOM 933 O LYS A 58 1.859 -12.955 -31.696 1.00 0.00 O ATOM 934 CB LYS A 58 -1.333 -12.183 -32.104 1.00 0.00 C ATOM 935 CG LYS A 58 -2.626 -12.998 -32.043 1.00 0.00 C ATOM 936 CD LYS A 58 -3.694 -12.402 -32.962 1.00 0.00 C ATOM 937 CE LYS A 58 -5.036 -12.280 -32.236 1.00 0.00 C ATOM 938 NZ LYS A 58 -6.049 -13.150 -32.873 1.00 0.00 N ATOM 0 H LYS A 58 -1.429 -11.143 -29.816 1.00 0.00 H new ATOM 0 HA LYS A 58 -0.417 -13.649 -30.901 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -1.566 -11.120 -32.052 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -0.836 -12.354 -33.059 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -2.424 -14.029 -32.335 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -2.996 -13.023 -31.018 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -3.373 -11.420 -33.309 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -3.810 -13.030 -33.846 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -4.916 -12.557 -31.189 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -5.374 -11.244 -32.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -6.954 -13.056 -32.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -6.175 -12.867 -33.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -5.732 -14.140 -32.833 1.00 0.00 H new ATOM 951 N TRP A 59 1.370 -10.920 -30.838 1.00 0.00 N ATOM 952 CA TRP A 59 2.716 -10.401 -31.010 1.00 0.00 C ATOM 953 C TRP A 59 3.673 -11.303 -30.227 1.00 0.00 C ATOM 954 O TRP A 59 4.633 -11.829 -30.787 1.00 0.00 O ATOM 955 CB TRP A 59 2.797 -8.933 -30.586 1.00 0.00 C ATOM 956 CG TRP A 59 4.207 -8.344 -30.646 1.00 0.00 C ATOM 957 CD1 TRP A 59 4.901 -7.766 -29.657 1.00 0.00 C ATOM 958 CD2 TRP A 59 5.073 -8.301 -31.800 1.00 0.00 C ATOM 959 NE1 TRP A 59 6.147 -7.354 -30.087 1.00 0.00 N ATOM 960 CE2 TRP A 59 6.255 -7.691 -31.432 1.00 0.00 C ATOM 961 CE3 TRP A 59 4.866 -8.765 -33.111 1.00 0.00 C ATOM 962 CZ2 TRP A 59 7.319 -7.485 -32.316 1.00 0.00 C ATOM 963 CZ3 TRP A 59 5.940 -8.552 -33.983 1.00 0.00 C ATOM 964 CH2 TRP A 59 7.136 -7.938 -33.628 1.00 0.00 C ATOM 0 H TRP A 59 0.708 -10.262 -30.427 1.00 0.00 H new ATOM 0 HA TRP A 59 3.004 -10.416 -32.061 1.00 0.00 H new ATOM 0 HB2 TRP A 59 2.141 -8.344 -31.227 1.00 0.00 H new ATOM 0 HB3 TRP A 59 2.418 -8.838 -29.568 1.00 0.00 H new ATOM 0 HD1 TRP A 59 4.533 -7.638 -28.650 1.00 0.00 H new ATOM 0 HE1 TRP A 59 6.857 -6.888 -29.522 1.00 0.00 H new ATOM 0 HE3 TRP A 59 3.951 -9.248 -33.421 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 8.233 -7.002 -32.003 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 5.832 -8.888 -35.004 1.00 0.00 H new ATOM 0 HH2 TRP A 59 7.920 -7.811 -34.360 1.00 0.00 H new ATOM 975 N LYS A 60 3.378 -11.452 -28.943 1.00 0.00 N ATOM 976 CA LYS A 60 4.201 -12.279 -28.078 1.00 0.00 C ATOM 977 C LYS A 60 4.162 -13.726 -28.575 1.00 0.00 C ATOM 978 O LYS A 60 5.113 -14.480 -28.378 1.00 0.00 O ATOM 979 CB LYS A 60 3.772 -12.120 -26.619 1.00 0.00 C ATOM 980 CG LYS A 60 2.390 -12.734 -26.383 1.00 0.00 C ATOM 981 CD LYS A 60 2.346 -13.488 -25.051 1.00 0.00 C ATOM 982 CE LYS A 60 0.924 -13.951 -24.732 1.00 0.00 C ATOM 983 NZ LYS A 60 0.778 -15.399 -25.001 1.00 0.00 N ATOM 0 H LYS A 60 2.581 -11.014 -28.482 1.00 0.00 H new ATOM 0 HA LYS A 60 5.241 -11.955 -28.118 1.00 0.00 H new ATOM 0 HB2 LYS A 60 4.503 -12.599 -25.967 1.00 0.00 H new ATOM 0 HB3 LYS A 60 3.754 -11.063 -26.355 1.00 0.00 H new ATOM 0 HG2 LYS A 60 1.634 -11.949 -26.386 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.146 -13.415 -27.199 1.00 0.00 H new ATOM 0 HD2 LYS A 60 3.012 -14.350 -25.094 1.00 0.00 H new ATOM 0 HD3 LYS A 60 2.711 -12.843 -24.251 1.00 0.00 H new ATOM 0 HE2 LYS A 60 0.694 -13.744 -23.687 1.00 0.00 H new ATOM 0 HE3 LYS A 60 0.209 -13.389 -25.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -0.193 -15.697 -24.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 0.978 -15.588 -26.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 1.447 -15.931 -24.409 1.00 0.00 H new ATOM 996 N ALA A 61 3.051 -14.069 -29.211 1.00 0.00 N ATOM 997 CA ALA A 61 2.875 -15.412 -29.739 1.00 0.00 C ATOM 998 C ALA A 61 3.326 -15.444 -31.201 1.00 0.00 C ATOM 999 O ALA A 61 3.135 -16.444 -31.891 1.00 0.00 O ATOM 1000 CB ALA A 61 1.416 -15.840 -29.569 1.00 0.00 C ATOM 0 H ALA A 61 2.264 -13.441 -29.373 1.00 0.00 H new ATOM 0 HA ALA A 61 3.490 -16.124 -29.189 1.00 0.00 H new ATOM 0 HB1 ALA A 61 1.284 -16.847 -29.965 1.00 0.00 H new ATOM 0 HB2 ALA A 61 1.154 -15.829 -28.511 1.00 0.00 H new ATOM 0 HB3 ALA A 61 0.769 -15.150 -30.110 1.00 0.00 H new ATOM 1006 N LEU A 62 3.915 -14.337 -31.630 1.00 0.00 N ATOM 1007 CA LEU A 62 4.394 -14.226 -32.997 1.00 0.00 C ATOM 1008 C LEU A 62 5.800 -14.822 -33.089 1.00 0.00 C ATOM 1009 O LEU A 62 6.462 -14.702 -34.119 1.00 0.00 O ATOM 1010 CB LEU A 62 4.307 -12.776 -33.479 1.00 0.00 C ATOM 1011 CG LEU A 62 3.675 -12.565 -34.856 1.00 0.00 C ATOM 1012 CD1 LEU A 62 2.369 -13.351 -34.986 1.00 0.00 C ATOM 1013 CD2 LEU A 62 3.479 -11.075 -35.147 1.00 0.00 C ATOM 0 H LEU A 62 4.071 -13.509 -31.055 1.00 0.00 H new ATOM 0 HA LEU A 62 3.759 -14.800 -33.672 1.00 0.00 H new ATOM 0 HB2 LEU A 62 3.736 -12.204 -32.747 1.00 0.00 H new ATOM 0 HB3 LEU A 62 5.314 -12.358 -33.495 1.00 0.00 H new ATOM 0 HG LEU A 62 4.360 -12.953 -35.610 1.00 0.00 H new ATOM 0 HD11 LEU A 62 1.940 -13.183 -35.974 1.00 0.00 H new ATOM 0 HD12 LEU A 62 2.569 -14.414 -34.853 1.00 0.00 H new ATOM 0 HD13 LEU A 62 1.665 -13.016 -34.224 1.00 0.00 H new ATOM 0 HD21 LEU A 62 3.028 -10.953 -36.132 1.00 0.00 H new ATOM 0 HD22 LEU A 62 2.824 -10.640 -34.392 1.00 0.00 H new ATOM 0 HD23 LEU A 62 4.445 -10.570 -35.125 1.00 0.00 H new ATOM 1025 N THR A 63 6.215 -15.450 -32.000 1.00 0.00 N ATOM 1026 CA THR A 63 7.532 -16.064 -31.945 1.00 0.00 C ATOM 1027 C THR A 63 8.611 -15.046 -32.320 1.00 0.00 C ATOM 1028 O THR A 63 8.326 -14.051 -32.983 1.00 0.00 O ATOM 1029 CB THR A 63 7.516 -17.296 -32.852 1.00 0.00 C ATOM 1030 OG1 THR A 63 8.547 -18.127 -32.327 1.00 0.00 O ATOM 1031 CG2 THR A 63 7.980 -16.981 -34.276 1.00 0.00 C ATOM 0 H THR A 63 5.663 -15.548 -31.148 1.00 0.00 H new ATOM 0 HA THR A 63 7.776 -16.390 -30.934 1.00 0.00 H new ATOM 0 HB THR A 63 6.509 -17.711 -32.882 1.00 0.00 H new ATOM 0 HG1 THR A 63 9.173 -18.363 -33.043 1.00 0.00 H new ATOM 0 HG21 THR A 63 7.950 -17.889 -34.878 1.00 0.00 H new ATOM 0 HG22 THR A 63 7.322 -16.232 -34.716 1.00 0.00 H new ATOM 0 HG23 THR A 63 9.000 -16.597 -34.250 1.00 0.00 H new ATOM 1039 N PRO A 64 9.858 -15.339 -31.866 1.00 0.00 N ATOM 1040 CA PRO A 64 10.982 -14.462 -32.146 1.00 0.00 C ATOM 1041 C PRO A 64 11.439 -14.605 -33.600 1.00 0.00 C ATOM 1042 O PRO A 64 12.400 -13.959 -34.018 1.00 0.00 O ATOM 1043 CB PRO A 64 12.053 -14.861 -31.145 1.00 0.00 C ATOM 1044 CG PRO A 64 11.668 -16.247 -30.652 1.00 0.00 C ATOM 1045 CD PRO A 64 10.232 -16.510 -31.077 1.00 0.00 C ATOM 0 HA PRO A 64 10.729 -13.407 -32.038 1.00 0.00 H new ATOM 0 HB2 PRO A 64 13.038 -14.872 -31.611 1.00 0.00 H new ATOM 0 HB3 PRO A 64 12.099 -14.152 -30.319 1.00 0.00 H new ATOM 0 HG2 PRO A 64 12.335 -17.000 -31.072 1.00 0.00 H new ATOM 0 HG3 PRO A 64 11.762 -16.306 -29.568 1.00 0.00 H new ATOM 0 HD2 PRO A 64 10.154 -17.425 -31.665 1.00 0.00 H new ATOM 0 HD3 PRO A 64 9.579 -16.630 -30.213 1.00 0.00 H new ATOM 1053 N GLU A 65 10.731 -15.454 -34.328 1.00 0.00 N ATOM 1054 CA GLU A 65 11.052 -15.689 -35.726 1.00 0.00 C ATOM 1055 C GLU A 65 10.291 -14.706 -36.618 1.00 0.00 C ATOM 1056 O GLU A 65 10.715 -14.423 -37.739 1.00 0.00 O ATOM 1057 CB GLU A 65 10.751 -17.135 -36.122 1.00 0.00 C ATOM 1058 CG GLU A 65 11.227 -18.110 -35.043 1.00 0.00 C ATOM 1059 CD GLU A 65 12.436 -18.914 -35.525 1.00 0.00 C ATOM 1060 OE1 GLU A 65 13.491 -18.333 -35.818 1.00 0.00 O ATOM 1061 OE2 GLU A 65 12.251 -20.189 -35.592 1.00 0.00 O ATOM 0 H GLU A 65 9.936 -15.988 -33.977 1.00 0.00 H new ATOM 0 HA GLU A 65 12.120 -15.524 -35.866 1.00 0.00 H new ATOM 0 HB2 GLU A 65 9.679 -17.257 -36.280 1.00 0.00 H new ATOM 0 HB3 GLU A 65 11.241 -17.366 -37.068 1.00 0.00 H new ATOM 0 HG2 GLU A 65 11.489 -17.559 -34.140 1.00 0.00 H new ATOM 0 HG3 GLU A 65 10.416 -18.789 -34.778 1.00 0.00 H new ATOM 1068 N GLU A 66 9.182 -14.212 -36.088 1.00 0.00 N ATOM 1069 CA GLU A 66 8.357 -13.268 -36.823 1.00 0.00 C ATOM 1070 C GLU A 66 8.650 -11.838 -36.362 1.00 0.00 C ATOM 1071 O GLU A 66 8.507 -10.891 -37.134 1.00 0.00 O ATOM 1072 CB GLU A 66 6.872 -13.601 -36.670 1.00 0.00 C ATOM 1073 CG GLU A 66 6.634 -15.108 -36.782 1.00 0.00 C ATOM 1074 CD GLU A 66 6.684 -15.563 -38.243 1.00 0.00 C ATOM 1075 OE1 GLU A 66 5.715 -15.356 -38.990 1.00 0.00 O ATOM 1076 OE2 GLU A 66 7.776 -16.151 -38.593 1.00 0.00 O ATOM 0 H GLU A 66 8.835 -14.448 -35.158 1.00 0.00 H new ATOM 0 HA GLU A 66 8.604 -13.346 -37.882 1.00 0.00 H new ATOM 0 HB2 GLU A 66 6.513 -13.243 -35.705 1.00 0.00 H new ATOM 0 HB3 GLU A 66 6.298 -13.081 -37.437 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.388 -15.643 -36.205 1.00 0.00 H new ATOM 0 HG3 GLU A 66 5.665 -15.360 -36.352 1.00 0.00 H new ATOM 1083 N LYS A 67 9.054 -11.727 -35.105 1.00 0.00 N ATOM 1084 CA LYS A 67 9.368 -10.430 -34.531 1.00 0.00 C ATOM 1085 C LYS A 67 10.797 -10.039 -34.915 1.00 0.00 C ATOM 1086 O LYS A 67 11.092 -8.859 -35.100 1.00 0.00 O ATOM 1087 CB LYS A 67 9.116 -10.436 -33.022 1.00 0.00 C ATOM 1088 CG LYS A 67 10.142 -9.566 -32.293 1.00 0.00 C ATOM 1089 CD LYS A 67 9.948 -9.646 -30.776 1.00 0.00 C ATOM 1090 CE LYS A 67 11.014 -10.537 -30.135 1.00 0.00 C ATOM 1091 NZ LYS A 67 12.176 -9.728 -29.704 1.00 0.00 N ATOM 0 H LYS A 67 9.171 -12.515 -34.468 1.00 0.00 H new ATOM 0 HA LYS A 67 8.708 -9.664 -34.937 1.00 0.00 H new ATOM 0 HB2 LYS A 67 8.110 -10.069 -32.816 1.00 0.00 H new ATOM 0 HB3 LYS A 67 9.166 -11.458 -32.645 1.00 0.00 H new ATOM 0 HG2 LYS A 67 11.150 -9.891 -32.552 1.00 0.00 H new ATOM 0 HG3 LYS A 67 10.046 -8.531 -32.622 1.00 0.00 H new ATOM 0 HD2 LYS A 67 9.998 -8.646 -30.346 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.957 -10.040 -30.552 1.00 0.00 H new ATOM 0 HE2 LYS A 67 10.591 -11.061 -29.278 1.00 0.00 H new ATOM 0 HE3 LYS A 67 11.337 -11.297 -30.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 12.890 -10.349 -29.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 12.589 -9.247 -30.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 11.867 -9.019 -29.009 1.00 0.00 H new ATOM 1104 N GLN A 68 11.644 -11.052 -35.024 1.00 0.00 N ATOM 1105 CA GLN A 68 13.034 -10.828 -35.383 1.00 0.00 C ATOM 1106 C GLN A 68 13.132 -9.816 -36.527 1.00 0.00 C ATOM 1107 O GLN A 68 13.815 -8.801 -36.404 1.00 0.00 O ATOM 1108 CB GLN A 68 13.723 -12.143 -35.755 1.00 0.00 C ATOM 1109 CG GLN A 68 14.737 -12.553 -34.685 1.00 0.00 C ATOM 1110 CD GLN A 68 15.532 -13.784 -35.125 1.00 0.00 C ATOM 1111 OE1 GLN A 68 16.654 -13.695 -35.593 1.00 0.00 O ATOM 1112 NE2 GLN A 68 14.887 -14.934 -34.948 1.00 0.00 N ATOM 0 H GLN A 68 11.395 -12.029 -34.870 1.00 0.00 H new ATOM 0 HA GLN A 68 13.550 -10.417 -34.515 1.00 0.00 H new ATOM 0 HB2 GLN A 68 12.976 -12.928 -35.873 1.00 0.00 H new ATOM 0 HB3 GLN A 68 14.226 -12.035 -36.716 1.00 0.00 H new ATOM 0 HG2 GLN A 68 15.419 -11.726 -34.490 1.00 0.00 H new ATOM 0 HG3 GLN A 68 14.218 -12.766 -33.750 1.00 0.00 H new ATOM 0 HE21 GLN A 68 13.948 -14.936 -34.550 1.00 0.00 H new ATOM 0 HE22 GLN A 68 15.332 -15.814 -35.210 1.00 0.00 H new ATOM 1121 N PRO A 69 12.420 -10.138 -37.640 1.00 0.00 N ATOM 1122 CA PRO A 69 12.420 -9.267 -38.804 1.00 0.00 C ATOM 1123 C PRO A 69 11.552 -8.030 -38.565 1.00 0.00 C ATOM 1124 O PRO A 69 12.011 -6.903 -38.743 1.00 0.00 O ATOM 1125 CB PRO A 69 11.913 -10.136 -39.944 1.00 0.00 C ATOM 1126 CG PRO A 69 11.211 -11.315 -39.289 1.00 0.00 C ATOM 1127 CD PRO A 69 11.600 -11.331 -37.820 1.00 0.00 C ATOM 0 HA PRO A 69 13.409 -8.869 -39.031 1.00 0.00 H new ATOM 0 HB2 PRO A 69 11.228 -9.580 -40.584 1.00 0.00 H new ATOM 0 HB3 PRO A 69 12.736 -10.473 -40.574 1.00 0.00 H new ATOM 0 HG2 PRO A 69 10.130 -11.224 -39.397 1.00 0.00 H new ATOM 0 HG3 PRO A 69 11.502 -12.248 -39.771 1.00 0.00 H new ATOM 0 HD2 PRO A 69 10.720 -11.307 -37.177 1.00 0.00 H new ATOM 0 HD3 PRO A 69 12.155 -12.235 -37.567 1.00 0.00 H new ATOM 1135 N TYR A 70 10.316 -8.283 -38.164 1.00 0.00 N ATOM 1136 CA TYR A 70 9.381 -7.203 -37.897 1.00 0.00 C ATOM 1137 C TYR A 70 10.032 -6.110 -37.046 1.00 0.00 C ATOM 1138 O TYR A 70 10.045 -4.943 -37.434 1.00 0.00 O ATOM 1139 CB TYR A 70 8.228 -7.829 -37.108 1.00 0.00 C ATOM 1140 CG TYR A 70 6.961 -8.059 -37.935 1.00 0.00 C ATOM 1141 CD1 TYR A 70 6.573 -7.128 -38.877 1.00 0.00 C ATOM 1142 CD2 TYR A 70 6.207 -9.198 -37.738 1.00 0.00 C ATOM 1143 CE1 TYR A 70 5.380 -7.346 -39.654 1.00 0.00 C ATOM 1144 CE2 TYR A 70 5.015 -9.416 -38.516 1.00 0.00 C ATOM 1145 CZ TYR A 70 4.660 -8.479 -39.435 1.00 0.00 C ATOM 1146 OH TYR A 70 3.534 -8.683 -40.170 1.00 0.00 O ATOM 0 H TYR A 70 9.940 -9.220 -38.017 1.00 0.00 H new ATOM 0 HA TYR A 70 9.050 -6.744 -38.828 1.00 0.00 H new ATOM 0 HB2 TYR A 70 8.559 -8.782 -36.696 1.00 0.00 H new ATOM 0 HB3 TYR A 70 7.986 -7.183 -36.264 1.00 0.00 H new ATOM 0 HD1 TYR A 70 7.163 -6.237 -39.031 1.00 0.00 H new ATOM 0 HD2 TYR A 70 6.511 -9.926 -37.000 1.00 0.00 H new ATOM 0 HE1 TYR A 70 5.064 -6.626 -40.394 1.00 0.00 H new ATOM 0 HE2 TYR A 70 4.417 -10.304 -38.373 1.00 0.00 H new ATOM 0 HH TYR A 70 3.122 -9.533 -39.908 1.00 0.00 H new ATOM 1156 N GLU A 71 10.555 -6.529 -35.903 1.00 0.00 N ATOM 1157 CA GLU A 71 11.206 -5.600 -34.995 1.00 0.00 C ATOM 1158 C GLU A 71 12.431 -4.973 -35.664 1.00 0.00 C ATOM 1159 O GLU A 71 12.742 -3.807 -35.430 1.00 0.00 O ATOM 1160 CB GLU A 71 11.591 -6.293 -33.686 1.00 0.00 C ATOM 1161 CG GLU A 71 12.205 -5.298 -32.700 1.00 0.00 C ATOM 1162 CD GLU A 71 12.135 -5.831 -31.267 1.00 0.00 C ATOM 1163 OE1 GLU A 71 10.997 -5.669 -30.680 1.00 0.00 O ATOM 1164 OE2 GLU A 71 13.128 -6.371 -30.757 1.00 0.00 O ATOM 0 H GLU A 71 10.541 -7.498 -35.585 1.00 0.00 H new ATOM 0 HA GLU A 71 10.501 -4.804 -34.754 1.00 0.00 H new ATOM 0 HB2 GLU A 71 10.709 -6.754 -33.241 1.00 0.00 H new ATOM 0 HB3 GLU A 71 12.301 -7.094 -33.890 1.00 0.00 H new ATOM 0 HG2 GLU A 71 13.244 -5.107 -32.970 1.00 0.00 H new ATOM 0 HG3 GLU A 71 11.679 -4.346 -32.764 1.00 0.00 H new ATOM 1171 N ALA A 72 13.093 -5.777 -36.484 1.00 0.00 N ATOM 1172 CA ALA A 72 14.277 -5.315 -37.189 1.00 0.00 C ATOM 1173 C ALA A 72 13.902 -4.136 -38.089 1.00 0.00 C ATOM 1174 O ALA A 72 14.731 -3.268 -38.359 1.00 0.00 O ATOM 1175 CB ALA A 72 14.889 -6.476 -37.973 1.00 0.00 C ATOM 0 H ALA A 72 12.832 -6.744 -36.676 1.00 0.00 H new ATOM 0 HA ALA A 72 15.031 -4.964 -36.484 1.00 0.00 H new ATOM 0 HB1 ALA A 72 15.777 -6.130 -38.502 1.00 0.00 H new ATOM 0 HB2 ALA A 72 15.165 -7.275 -37.284 1.00 0.00 H new ATOM 0 HB3 ALA A 72 14.162 -6.853 -38.693 1.00 0.00 H new ATOM 1181 N LYS A 73 12.652 -4.144 -38.530 1.00 0.00 N ATOM 1182 CA LYS A 73 12.157 -3.085 -39.395 1.00 0.00 C ATOM 1183 C LYS A 73 11.913 -1.825 -38.562 1.00 0.00 C ATOM 1184 O LYS A 73 12.202 -0.717 -39.009 1.00 0.00 O ATOM 1185 CB LYS A 73 10.927 -3.559 -40.170 1.00 0.00 C ATOM 1186 CG LYS A 73 10.542 -2.553 -41.256 1.00 0.00 C ATOM 1187 CD LYS A 73 11.189 -2.918 -42.594 1.00 0.00 C ATOM 1188 CE LYS A 73 11.233 -1.708 -43.530 1.00 0.00 C ATOM 1189 NZ LYS A 73 12.632 -1.298 -43.782 1.00 0.00 N ATOM 0 H LYS A 73 11.968 -4.866 -38.305 1.00 0.00 H new ATOM 0 HA LYS A 73 12.901 -2.829 -40.149 1.00 0.00 H new ATOM 0 HB2 LYS A 73 11.130 -4.529 -40.624 1.00 0.00 H new ATOM 0 HB3 LYS A 73 10.091 -3.697 -39.484 1.00 0.00 H new ATOM 0 HG2 LYS A 73 9.458 -2.529 -41.367 1.00 0.00 H new ATOM 0 HG3 LYS A 73 10.855 -1.552 -40.957 1.00 0.00 H new ATOM 0 HD2 LYS A 73 12.200 -3.288 -42.424 1.00 0.00 H new ATOM 0 HD3 LYS A 73 10.629 -3.726 -43.064 1.00 0.00 H new ATOM 0 HE2 LYS A 73 10.744 -1.952 -44.473 1.00 0.00 H new ATOM 0 HE3 LYS A 73 10.679 -0.879 -43.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 12.643 -0.476 -44.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 13.087 -1.045 -42.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 13.150 -2.085 -44.223 1.00 0.00 H new ATOM 1202 N ALA A 74 11.382 -2.038 -37.367 1.00 0.00 N ATOM 1203 CA ALA A 74 11.096 -0.932 -36.469 1.00 0.00 C ATOM 1204 C ALA A 74 12.409 -0.279 -36.035 1.00 0.00 C ATOM 1205 O ALA A 74 12.411 0.845 -35.536 1.00 0.00 O ATOM 1206 CB ALA A 74 10.277 -1.441 -35.279 1.00 0.00 C ATOM 0 H ALA A 74 11.143 -2.959 -37.000 1.00 0.00 H new ATOM 0 HA ALA A 74 10.501 -0.171 -36.975 1.00 0.00 H new ATOM 0 HB1 ALA A 74 10.062 -0.612 -34.604 1.00 0.00 H new ATOM 0 HB2 ALA A 74 9.341 -1.869 -35.638 1.00 0.00 H new ATOM 0 HB3 ALA A 74 10.845 -2.204 -34.747 1.00 0.00 H new ATOM 1212 N GLN A 75 13.493 -1.011 -36.240 1.00 0.00 N ATOM 1213 CA GLN A 75 14.810 -0.517 -35.878 1.00 0.00 C ATOM 1214 C GLN A 75 15.287 0.520 -36.896 1.00 0.00 C ATOM 1215 O GLN A 75 16.243 1.253 -36.641 1.00 0.00 O ATOM 1216 CB GLN A 75 15.813 -1.666 -35.755 1.00 0.00 C ATOM 1217 CG GLN A 75 16.820 -1.399 -34.635 1.00 0.00 C ATOM 1218 CD GLN A 75 16.621 -2.375 -33.473 1.00 0.00 C ATOM 1219 OE1 GLN A 75 17.527 -3.076 -33.055 1.00 0.00 O ATOM 1220 NE2 GLN A 75 15.386 -2.382 -32.979 1.00 0.00 N ATOM 0 H GLN A 75 13.486 -1.944 -36.653 1.00 0.00 H new ATOM 0 HA GLN A 75 14.739 -0.035 -34.903 1.00 0.00 H new ATOM 0 HB2 GLN A 75 15.282 -2.597 -35.557 1.00 0.00 H new ATOM 0 HB3 GLN A 75 16.341 -1.795 -36.700 1.00 0.00 H new ATOM 0 HG2 GLN A 75 17.834 -1.493 -35.023 1.00 0.00 H new ATOM 0 HG3 GLN A 75 16.709 -0.375 -34.278 1.00 0.00 H new ATOM 0 HE21 GLN A 75 14.674 -1.769 -33.376 1.00 0.00 H new ATOM 0 HE22 GLN A 75 15.151 -3.000 -32.203 1.00 0.00 H new ATOM 1229 N ALA A 76 14.600 0.551 -38.028 1.00 0.00 N ATOM 1230 CA ALA A 76 14.941 1.486 -39.086 1.00 0.00 C ATOM 1231 C ALA A 76 14.212 2.810 -38.845 1.00 0.00 C ATOM 1232 O ALA A 76 14.807 3.881 -38.959 1.00 0.00 O ATOM 1233 CB ALA A 76 14.598 0.870 -40.443 1.00 0.00 C ATOM 0 H ALA A 76 13.808 -0.057 -38.236 1.00 0.00 H new ATOM 0 HA ALA A 76 16.011 1.694 -39.084 1.00 0.00 H new ATOM 0 HB1 ALA A 76 14.854 1.572 -41.236 1.00 0.00 H new ATOM 0 HB2 ALA A 76 15.164 -0.052 -40.578 1.00 0.00 H new ATOM 0 HB3 ALA A 76 13.531 0.650 -40.484 1.00 0.00 H new ATOM 1239 N ASP A 77 12.933 2.693 -38.518 1.00 0.00 N ATOM 1240 CA ASP A 77 12.117 3.867 -38.260 1.00 0.00 C ATOM 1241 C ASP A 77 12.801 4.737 -37.204 1.00 0.00 C ATOM 1242 O ASP A 77 12.519 5.930 -37.100 1.00 0.00 O ATOM 1243 CB ASP A 77 10.738 3.472 -37.726 1.00 0.00 C ATOM 1244 CG ASP A 77 9.555 4.087 -38.475 1.00 0.00 C ATOM 1245 OD1 ASP A 77 9.104 3.558 -39.502 1.00 0.00 O ATOM 1246 OD2 ASP A 77 9.084 5.170 -37.956 1.00 0.00 O ATOM 0 H ASP A 77 12.442 1.804 -38.426 1.00 0.00 H new ATOM 0 HA ASP A 77 11.999 4.409 -39.198 1.00 0.00 H new ATOM 0 HB2 ASP A 77 10.648 2.386 -37.763 1.00 0.00 H new ATOM 0 HB3 ASP A 77 10.675 3.761 -36.677 1.00 0.00 H new ATOM 1251 N LYS A 78 13.688 4.108 -36.448 1.00 0.00 N ATOM 1252 CA LYS A 78 14.415 4.809 -35.404 1.00 0.00 C ATOM 1253 C LYS A 78 15.021 6.088 -35.983 1.00 0.00 C ATOM 1254 O LYS A 78 15.284 7.042 -35.251 1.00 0.00 O ATOM 1255 CB LYS A 78 15.442 3.883 -34.751 1.00 0.00 C ATOM 1256 CG LYS A 78 16.018 4.513 -33.481 1.00 0.00 C ATOM 1257 CD LYS A 78 15.826 3.591 -32.275 1.00 0.00 C ATOM 1258 CE LYS A 78 17.087 3.551 -31.408 1.00 0.00 C ATOM 1259 NZ LYS A 78 16.789 4.025 -30.038 1.00 0.00 N ATOM 0 H LYS A 78 13.920 3.119 -36.538 1.00 0.00 H new ATOM 0 HA LYS A 78 13.738 5.109 -34.604 1.00 0.00 H new ATOM 0 HB2 LYS A 78 14.974 2.929 -34.508 1.00 0.00 H new ATOM 0 HB3 LYS A 78 16.247 3.673 -35.455 1.00 0.00 H new ATOM 0 HG2 LYS A 78 17.079 4.717 -33.621 1.00 0.00 H new ATOM 0 HG3 LYS A 78 15.531 5.470 -33.293 1.00 0.00 H new ATOM 0 HD2 LYS A 78 14.982 3.937 -31.679 1.00 0.00 H new ATOM 0 HD3 LYS A 78 15.584 2.585 -32.617 1.00 0.00 H new ATOM 0 HE2 LYS A 78 17.478 2.534 -31.370 1.00 0.00 H new ATOM 0 HE3 LYS A 78 17.862 4.174 -31.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 17.655 3.992 -29.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 16.437 5.003 -30.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 16.065 3.414 -29.609 1.00 0.00 H new ATOM 1272 N LYS A 79 15.226 6.069 -37.292 1.00 0.00 N ATOM 1273 CA LYS A 79 15.797 7.216 -37.978 1.00 0.00 C ATOM 1274 C LYS A 79 14.673 8.170 -38.387 1.00 0.00 C ATOM 1275 O LYS A 79 14.744 9.369 -38.117 1.00 0.00 O ATOM 1276 CB LYS A 79 16.672 6.759 -39.147 1.00 0.00 C ATOM 1277 CG LYS A 79 18.138 6.645 -38.722 1.00 0.00 C ATOM 1278 CD LYS A 79 19.047 6.453 -39.938 1.00 0.00 C ATOM 1279 CE LYS A 79 20.512 6.699 -39.571 1.00 0.00 C ATOM 1280 NZ LYS A 79 21.329 5.503 -39.870 1.00 0.00 N ATOM 0 H LYS A 79 15.007 5.277 -37.896 1.00 0.00 H new ATOM 0 HA LYS A 79 16.459 7.769 -37.312 1.00 0.00 H new ATOM 0 HB2 LYS A 79 16.320 5.795 -39.514 1.00 0.00 H new ATOM 0 HB3 LYS A 79 16.582 7.466 -39.971 1.00 0.00 H new ATOM 0 HG2 LYS A 79 18.434 7.543 -38.180 1.00 0.00 H new ATOM 0 HG3 LYS A 79 18.258 5.805 -38.037 1.00 0.00 H new ATOM 0 HD2 LYS A 79 18.931 5.442 -40.327 1.00 0.00 H new ATOM 0 HD3 LYS A 79 18.747 7.137 -40.732 1.00 0.00 H new ATOM 0 HE2 LYS A 79 20.893 7.555 -40.127 1.00 0.00 H new ATOM 0 HE3 LYS A 79 20.591 6.945 -38.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 22.320 5.687 -39.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 20.975 4.694 -39.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 21.267 5.285 -40.885 1.00 0.00 H new ATOM 1293 N ARG A 80 13.664 7.604 -39.031 1.00 0.00 N ATOM 1294 CA ARG A 80 12.527 8.390 -39.480 1.00 0.00 C ATOM 1295 C ARG A 80 11.967 9.221 -38.324 1.00 0.00 C ATOM 1296 O ARG A 80 11.542 10.358 -38.521 1.00 0.00 O ATOM 1297 CB ARG A 80 11.422 7.492 -40.036 1.00 0.00 C ATOM 1298 CG ARG A 80 10.690 8.175 -41.194 1.00 0.00 C ATOM 1299 CD ARG A 80 9.377 7.459 -41.512 1.00 0.00 C ATOM 1300 NE ARG A 80 9.654 6.157 -42.160 1.00 0.00 N ATOM 1301 CZ ARG A 80 8.737 5.445 -42.849 1.00 0.00 C ATOM 1302 NH1 ARG A 80 7.475 5.902 -42.985 1.00 0.00 N ATOM 1303 NH2 ARG A 80 9.094 4.294 -43.387 1.00 0.00 N ATOM 0 H ARG A 80 13.610 6.610 -39.253 1.00 0.00 H new ATOM 0 HA ARG A 80 12.874 9.052 -40.273 1.00 0.00 H new ATOM 0 HB2 ARG A 80 11.851 6.550 -40.378 1.00 0.00 H new ATOM 0 HB3 ARG A 80 10.712 7.250 -39.245 1.00 0.00 H new ATOM 0 HG2 ARG A 80 10.488 9.215 -40.938 1.00 0.00 H new ATOM 0 HG3 ARG A 80 11.328 8.182 -42.078 1.00 0.00 H new ATOM 0 HD2 ARG A 80 8.806 7.305 -40.596 1.00 0.00 H new ATOM 0 HD3 ARG A 80 8.765 8.078 -42.168 1.00 0.00 H new ATOM 0 HE ARG A 80 10.596 5.774 -42.081 1.00 0.00 H new ATOM 0 HH11 ARG A 80 7.207 6.792 -42.566 1.00 0.00 H new ATOM 0 HH12 ARG A 80 6.789 5.357 -43.507 1.00 0.00 H new ATOM 0 HH21 ARG A 80 10.050 3.955 -43.279 1.00 0.00 H new ATOM 0 HH22 ARG A 80 8.414 3.743 -43.911 1.00 0.00 H new ATOM 1317 N TYR A 81 11.986 8.621 -37.142 1.00 0.00 N ATOM 1318 CA TYR A 81 11.485 9.292 -35.955 1.00 0.00 C ATOM 1319 C TYR A 81 12.289 10.559 -35.660 1.00 0.00 C ATOM 1320 O TYR A 81 11.883 11.380 -34.839 1.00 0.00 O ATOM 1321 CB TYR A 81 11.672 8.303 -34.803 1.00 0.00 C ATOM 1322 CG TYR A 81 11.653 8.952 -33.417 1.00 0.00 C ATOM 1323 CD1 TYR A 81 12.809 9.492 -32.893 1.00 0.00 C ATOM 1324 CD2 TYR A 81 10.479 8.996 -32.691 1.00 0.00 C ATOM 1325 CE1 TYR A 81 12.791 10.103 -31.588 1.00 0.00 C ATOM 1326 CE2 TYR A 81 10.462 9.606 -31.387 1.00 0.00 C ATOM 1327 CZ TYR A 81 11.618 10.130 -30.900 1.00 0.00 C ATOM 1328 OH TYR A 81 11.601 10.707 -29.669 1.00 0.00 O ATOM 0 H TYR A 81 12.340 7.678 -36.982 1.00 0.00 H new ATOM 0 HA TYR A 81 10.444 9.586 -36.090 1.00 0.00 H new ATOM 0 HB2 TYR A 81 10.884 7.551 -34.852 1.00 0.00 H new ATOM 0 HB3 TYR A 81 12.620 7.781 -34.936 1.00 0.00 H new ATOM 0 HD1 TYR A 81 13.727 9.457 -33.460 1.00 0.00 H new ATOM 0 HD2 TYR A 81 9.574 8.573 -33.101 1.00 0.00 H new ATOM 0 HE1 TYR A 81 13.689 10.530 -31.166 1.00 0.00 H new ATOM 0 HE2 TYR A 81 9.551 9.646 -30.808 1.00 0.00 H new ATOM 0 HH TYR A 81 10.696 10.655 -29.296 1.00 0.00 H new ATOM 1338 N GLU A 82 13.418 10.678 -36.344 1.00 0.00 N ATOM 1339 CA GLU A 82 14.283 11.831 -36.166 1.00 0.00 C ATOM 1340 C GLU A 82 13.868 12.958 -37.114 1.00 0.00 C ATOM 1341 O GLU A 82 14.220 14.117 -36.897 1.00 0.00 O ATOM 1342 CB GLU A 82 15.751 11.453 -36.375 1.00 0.00 C ATOM 1343 CG GLU A 82 16.165 10.318 -35.434 1.00 0.00 C ATOM 1344 CD GLU A 82 17.496 10.632 -34.749 1.00 0.00 C ATOM 1345 OE1 GLU A 82 18.373 11.261 -35.359 1.00 0.00 O ATOM 1346 OE2 GLU A 82 17.602 10.199 -33.539 1.00 0.00 O ATOM 0 H GLU A 82 13.753 9.994 -37.023 1.00 0.00 H new ATOM 0 HA GLU A 82 14.175 12.186 -35.141 1.00 0.00 H new ATOM 0 HB2 GLU A 82 15.908 11.148 -37.410 1.00 0.00 H new ATOM 0 HB3 GLU A 82 16.383 12.324 -36.200 1.00 0.00 H new ATOM 0 HG2 GLU A 82 15.392 10.165 -34.681 1.00 0.00 H new ATOM 0 HG3 GLU A 82 16.252 9.388 -35.996 1.00 0.00 H new ATOM 1353 N SER A 83 13.124 12.579 -38.142 1.00 0.00 N ATOM 1354 CA SER A 83 12.657 13.544 -39.123 1.00 0.00 C ATOM 1355 C SER A 83 11.336 14.162 -38.661 1.00 0.00 C ATOM 1356 O SER A 83 11.150 15.375 -38.750 1.00 0.00 O ATOM 1357 CB SER A 83 12.485 12.893 -40.497 1.00 0.00 C ATOM 1358 OG SER A 83 13.732 12.486 -41.055 1.00 0.00 O ATOM 0 H SER A 83 12.833 11.617 -38.317 1.00 0.00 H new ATOM 0 HA SER A 83 13.407 14.330 -39.214 1.00 0.00 H new ATOM 0 HB2 SER A 83 11.828 12.028 -40.409 1.00 0.00 H new ATOM 0 HB3 SER A 83 11.998 13.596 -41.173 1.00 0.00 H new ATOM 0 HG SER A 83 13.579 12.074 -41.931 1.00 0.00 H new ATOM 1364 N GLU A 84 10.454 13.302 -38.177 1.00 0.00 N ATOM 1365 CA GLU A 84 9.157 13.749 -37.699 1.00 0.00 C ATOM 1366 C GLU A 84 9.319 14.604 -36.441 1.00 0.00 C ATOM 1367 O GLU A 84 8.551 15.540 -36.219 1.00 0.00 O ATOM 1368 CB GLU A 84 8.229 12.560 -37.438 1.00 0.00 C ATOM 1369 CG GLU A 84 7.385 12.241 -38.673 1.00 0.00 C ATOM 1370 CD GLU A 84 5.914 12.045 -38.296 1.00 0.00 C ATOM 1371 OE1 GLU A 84 5.617 10.872 -37.852 1.00 0.00 O ATOM 1372 OE2 GLU A 84 5.111 12.980 -38.430 1.00 0.00 O ATOM 0 H GLU A 84 10.612 12.297 -38.105 1.00 0.00 H new ATOM 0 HA GLU A 84 8.699 14.363 -38.474 1.00 0.00 H new ATOM 0 HB2 GLU A 84 8.820 11.687 -37.162 1.00 0.00 H new ATOM 0 HB3 GLU A 84 7.576 12.783 -36.594 1.00 0.00 H new ATOM 0 HG2 GLU A 84 7.474 13.050 -39.398 1.00 0.00 H new ATOM 0 HG3 GLU A 84 7.764 11.339 -39.154 1.00 0.00 H new ATOM 1379 N LYS A 85 10.324 14.254 -35.652 1.00 0.00 N ATOM 1380 CA LYS A 85 10.596 14.978 -34.423 1.00 0.00 C ATOM 1381 C LYS A 85 10.854 16.450 -34.749 1.00 0.00 C ATOM 1382 O LYS A 85 10.561 17.330 -33.941 1.00 0.00 O ATOM 1383 CB LYS A 85 11.737 14.312 -33.650 1.00 0.00 C ATOM 1384 CG LYS A 85 11.773 14.797 -32.199 1.00 0.00 C ATOM 1385 CD LYS A 85 13.206 14.823 -31.665 1.00 0.00 C ATOM 1386 CE LYS A 85 13.400 15.971 -30.672 1.00 0.00 C ATOM 1387 NZ LYS A 85 13.862 15.452 -29.365 1.00 0.00 N ATOM 0 H LYS A 85 10.959 13.479 -35.840 1.00 0.00 H new ATOM 0 HA LYS A 85 9.730 14.944 -33.762 1.00 0.00 H new ATOM 0 HB2 LYS A 85 11.613 13.229 -33.672 1.00 0.00 H new ATOM 0 HB3 LYS A 85 12.688 14.534 -34.135 1.00 0.00 H new ATOM 0 HG2 LYS A 85 11.339 15.795 -32.134 1.00 0.00 H new ATOM 0 HG3 LYS A 85 11.161 14.143 -31.578 1.00 0.00 H new ATOM 0 HD2 LYS A 85 13.434 13.874 -31.179 1.00 0.00 H new ATOM 0 HD3 LYS A 85 13.905 14.932 -32.494 1.00 0.00 H new ATOM 0 HE2 LYS A 85 14.127 16.681 -31.066 1.00 0.00 H new ATOM 0 HE3 LYS A 85 12.462 16.512 -30.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 13.989 16.243 -28.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 13.155 14.792 -28.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 14.768 14.956 -29.489 1.00 0.00 H new ATOM 1400 N GLU A 86 11.398 16.674 -35.936 1.00 0.00 N ATOM 1401 CA GLU A 86 11.697 18.025 -36.381 1.00 0.00 C ATOM 1402 C GLU A 86 10.411 18.846 -36.488 1.00 0.00 C ATOM 1403 O GLU A 86 10.317 19.937 -35.928 1.00 0.00 O ATOM 1404 CB GLU A 86 12.451 18.009 -37.712 1.00 0.00 C ATOM 1405 CG GLU A 86 13.461 19.157 -37.783 1.00 0.00 C ATOM 1406 CD GLU A 86 14.487 18.916 -38.892 1.00 0.00 C ATOM 1407 OE1 GLU A 86 14.199 19.177 -40.070 1.00 0.00 O ATOM 1408 OE2 GLU A 86 15.619 18.440 -38.495 1.00 0.00 O ATOM 0 H GLU A 86 11.640 15.942 -36.604 1.00 0.00 H new ATOM 0 HA GLU A 86 12.344 18.496 -35.641 1.00 0.00 H new ATOM 0 HB2 GLU A 86 12.968 17.057 -37.830 1.00 0.00 H new ATOM 0 HB3 GLU A 86 11.743 18.091 -38.536 1.00 0.00 H new ATOM 0 HG2 GLU A 86 12.938 20.096 -37.964 1.00 0.00 H new ATOM 0 HG3 GLU A 86 13.972 19.257 -36.825 1.00 0.00 H new ATOM 1415 N LEU A 87 9.451 18.290 -37.213 1.00 0.00 N ATOM 1416 CA LEU A 87 8.175 18.957 -37.402 1.00 0.00 C ATOM 1417 C LEU A 87 7.506 19.165 -36.040 1.00 0.00 C ATOM 1418 O LEU A 87 7.016 20.253 -35.745 1.00 0.00 O ATOM 1419 CB LEU A 87 7.309 18.186 -38.400 1.00 0.00 C ATOM 1420 CG LEU A 87 7.138 18.830 -39.778 1.00 0.00 C ATOM 1421 CD1 LEU A 87 6.483 20.208 -39.661 1.00 0.00 C ATOM 1422 CD2 LEU A 87 8.472 18.891 -40.524 1.00 0.00 C ATOM 0 H LEU A 87 9.532 17.385 -37.676 1.00 0.00 H new ATOM 0 HA LEU A 87 8.323 19.944 -37.840 1.00 0.00 H new ATOM 0 HB2 LEU A 87 7.741 17.194 -38.535 1.00 0.00 H new ATOM 0 HB3 LEU A 87 6.321 18.046 -37.961 1.00 0.00 H new ATOM 0 HG LEU A 87 6.468 18.204 -40.367 1.00 0.00 H new ATOM 0 HD11 LEU A 87 6.373 20.644 -40.654 1.00 0.00 H new ATOM 0 HD12 LEU A 87 5.501 20.106 -39.199 1.00 0.00 H new ATOM 0 HD13 LEU A 87 7.108 20.857 -39.047 1.00 0.00 H new ATOM 0 HD21 LEU A 87 8.322 19.353 -41.500 1.00 0.00 H new ATOM 0 HD22 LEU A 87 9.184 19.482 -39.948 1.00 0.00 H new ATOM 0 HD23 LEU A 87 8.861 17.882 -40.656 1.00 0.00 H new ATOM 1434 N TYR A 88 7.508 18.102 -35.249 1.00 0.00 N ATOM 1435 CA TYR A 88 6.908 18.155 -33.925 1.00 0.00 C ATOM 1436 C TYR A 88 7.585 19.218 -33.059 1.00 0.00 C ATOM 1437 O TYR A 88 6.924 20.122 -32.550 1.00 0.00 O ATOM 1438 CB TYR A 88 7.145 16.778 -33.301 1.00 0.00 C ATOM 1439 CG TYR A 88 6.413 16.562 -31.975 1.00 0.00 C ATOM 1440 CD1 TYR A 88 5.171 17.129 -31.772 1.00 0.00 C ATOM 1441 CD2 TYR A 88 6.994 15.800 -30.982 1.00 0.00 C ATOM 1442 CE1 TYR A 88 4.483 16.926 -30.524 1.00 0.00 C ATOM 1443 CE2 TYR A 88 6.305 15.597 -29.735 1.00 0.00 C ATOM 1444 CZ TYR A 88 5.083 16.170 -29.567 1.00 0.00 C ATOM 1445 OH TYR A 88 4.432 15.978 -28.388 1.00 0.00 O ATOM 0 H TYR A 88 7.915 17.200 -35.498 1.00 0.00 H new ATOM 0 HA TYR A 88 5.850 18.408 -33.992 1.00 0.00 H new ATOM 0 HB2 TYR A 88 6.829 16.011 -34.008 1.00 0.00 H new ATOM 0 HB3 TYR A 88 8.215 16.642 -33.140 1.00 0.00 H new ATOM 0 HD1 TYR A 88 4.716 17.725 -32.549 1.00 0.00 H new ATOM 0 HD2 TYR A 88 7.966 15.356 -31.141 1.00 0.00 H new ATOM 0 HE1 TYR A 88 3.511 17.365 -30.352 1.00 0.00 H new ATOM 0 HE2 TYR A 88 6.749 15.003 -28.950 1.00 0.00 H new ATOM 0 HH TYR A 88 4.979 15.417 -27.800 1.00 0.00 H new ATOM 1455 N ASN A 89 8.894 19.075 -32.916 1.00 0.00 N ATOM 1456 CA ASN A 89 9.668 20.012 -32.119 1.00 0.00 C ATOM 1457 C ASN A 89 9.452 21.429 -32.654 1.00 0.00 C ATOM 1458 O ASN A 89 9.482 22.395 -31.894 1.00 0.00 O ATOM 1459 CB ASN A 89 11.163 19.699 -32.198 1.00 0.00 C ATOM 1460 CG ASN A 89 11.999 20.898 -31.745 1.00 0.00 C ATOM 1461 OD1 ASN A 89 12.228 21.790 -32.705 1.00 0.00 O flip ATOM 1462 ND2 ASN A 89 12.408 21.006 -30.602 1.00 0.00 N flip ATOM 0 H ASN A 89 9.439 18.324 -33.339 1.00 0.00 H new ATOM 0 HA ASN A 89 9.337 19.928 -31.084 1.00 0.00 H new ATOM 0 HB2 ASN A 89 11.391 18.835 -31.573 1.00 0.00 H new ATOM 0 HB3 ASN A 89 11.429 19.431 -33.221 1.00 0.00 H new ATOM 0 HD21 ASN A 89 12.195 20.284 -29.914 1.00 0.00 H new ATOM 0 HD22 ASN A 89 12.963 21.819 -30.334 1.00 0.00 H new ATOM 1469 N ALA A 90 9.240 21.508 -33.960 1.00 0.00 N ATOM 1470 CA ALA A 90 9.020 22.790 -34.606 1.00 0.00 C ATOM 1471 C ALA A 90 7.698 23.385 -34.114 1.00 0.00 C ATOM 1472 O ALA A 90 7.448 24.576 -34.284 1.00 0.00 O ATOM 1473 CB ALA A 90 9.047 22.609 -36.125 1.00 0.00 C ATOM 0 H ALA A 90 9.216 20.704 -34.588 1.00 0.00 H new ATOM 0 HA ALA A 90 9.814 23.490 -34.347 1.00 0.00 H new ATOM 0 HB1 ALA A 90 8.882 23.572 -36.609 1.00 0.00 H new ATOM 0 HB2 ALA A 90 10.016 22.213 -36.427 1.00 0.00 H new ATOM 0 HB3 ALA A 90 8.262 21.914 -36.423 1.00 0.00 H new ATOM 1479 N THR A 91 6.887 22.525 -33.514 1.00 0.00 N ATOM 1480 CA THR A 91 5.598 22.950 -32.996 1.00 0.00 C ATOM 1481 C THR A 91 5.750 23.511 -31.581 1.00 0.00 C ATOM 1482 O THR A 91 4.853 24.188 -31.078 1.00 0.00 O ATOM 1483 CB THR A 91 4.640 21.759 -33.078 1.00 0.00 C ATOM 1484 OG1 THR A 91 3.365 22.354 -33.307 1.00 0.00 O ATOM 1485 CG2 THR A 91 4.481 21.042 -31.735 1.00 0.00 C ATOM 0 H THR A 91 7.098 21.537 -33.375 1.00 0.00 H new ATOM 0 HA THR A 91 5.181 23.763 -33.591 1.00 0.00 H new ATOM 0 HB THR A 91 5.002 21.053 -33.826 1.00 0.00 H new ATOM 0 HG1 THR A 91 2.684 21.652 -33.375 1.00 0.00 H new ATOM 0 HG21 THR A 91 3.791 20.206 -31.849 1.00 0.00 H new ATOM 0 HG22 THR A 91 5.451 20.670 -31.404 1.00 0.00 H new ATOM 0 HG23 THR A 91 4.087 21.739 -30.995 1.00 0.00 H new ATOM 1493 N LEU A 92 6.891 23.210 -30.979 1.00 0.00 N ATOM 1494 CA LEU A 92 7.173 23.677 -29.632 1.00 0.00 C ATOM 1495 C LEU A 92 8.668 23.970 -29.500 1.00 0.00 C ATOM 1496 O LEU A 92 9.383 23.260 -28.794 1.00 0.00 O ATOM 1497 CB LEU A 92 6.648 22.678 -28.599 1.00 0.00 C ATOM 1498 CG LEU A 92 7.355 21.320 -28.560 1.00 0.00 C ATOM 1499 CD1 LEU A 92 8.382 21.270 -27.428 1.00 0.00 C ATOM 1500 CD2 LEU A 92 6.341 20.177 -28.464 1.00 0.00 C ATOM 0 H LEU A 92 7.631 22.648 -31.399 1.00 0.00 H new ATOM 0 HA LEU A 92 6.647 24.611 -29.435 1.00 0.00 H new ATOM 0 HB2 LEU A 92 6.723 23.133 -27.611 1.00 0.00 H new ATOM 0 HB3 LEU A 92 5.589 22.509 -28.792 1.00 0.00 H new ATOM 0 HG LEU A 92 7.899 21.191 -29.495 1.00 0.00 H new ATOM 0 HD11 LEU A 92 8.870 20.295 -27.422 1.00 0.00 H new ATOM 0 HD12 LEU A 92 9.129 22.049 -27.580 1.00 0.00 H new ATOM 0 HD13 LEU A 92 7.880 21.430 -26.474 1.00 0.00 H new ATOM 0 HD21 LEU A 92 6.869 19.224 -28.438 1.00 0.00 H new ATOM 0 HD22 LEU A 92 5.750 20.290 -27.555 1.00 0.00 H new ATOM 0 HD23 LEU A 92 5.681 20.203 -29.331 1.00 0.00 H new ATOM 1512 N ALA A 93 9.097 25.016 -30.190 1.00 0.00 N ATOM 1513 CA ALA A 93 10.494 25.413 -30.159 1.00 0.00 C ATOM 1514 C ALA A 93 11.374 24.173 -30.327 1.00 0.00 C ATOM 1515 O ALA A 93 12.436 24.240 -30.946 1.00 0.00 O ATOM 1516 CB ALA A 93 10.784 26.161 -28.856 1.00 0.00 C ATOM 0 H ALA A 93 8.501 25.602 -30.775 1.00 0.00 H new ATOM 0 HA ALA A 93 10.719 26.092 -30.981 1.00 0.00 H new ATOM 0 HB1 ALA A 93 11.832 26.459 -28.833 1.00 0.00 H new ATOM 0 HB2 ALA A 93 10.153 27.048 -28.798 1.00 0.00 H new ATOM 0 HB3 ALA A 93 10.573 25.510 -28.008 1.00 0.00 H new TER 1522 ALA A 93