USER MOD reduce.3.24.130724 H: found=0, std=0, add=525, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 523 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 4 HIS : no HE2:sc= -3.02! C(o=-5.3!,f=-12!) USER MOD Set 1.2: A 47 SER OG : rot -58:sc= -2.33! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -120:sc= -3.96! (180deg=-7.33!) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot 124:sc= -3.82! USER MOD Single : A 10 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 CYS SG : rot 140:sc= -0.786 USER MOD Single : A 15 CYS SG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot -130:sc= 0 USER MOD Single : A 24 ASN :FLIP amide:sc= -2.57! C(o=-5.4!,f=-2.6!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ -165:sc=-0.00135 (180deg=-0.0456) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 ASN :FLIP amide:sc= -0.16 F(o=-1.4,f=-0.16) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ -151:sc= -1.79! (180deg=-3.09!) USER MOD Single : A 41 CYS SG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 109:sc= -0.329 USER MOD Single : A 46 HIS : no HD1:sc= 0 X(o=0,f=-0.00077) USER MOD Single : A 48 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 170:sc= 0 USER MOD Single : A 54 THR OG1 : rot -70:sc= -2.59! USER MOD Single : A 56 LYS NZ :NH3+ 145:sc= -0.436 (180deg=-2.49!) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot 140:sc= 0.0887 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -17.546 -19.288 -20.872 1.00 0.00 N ATOM 2 CA MET A 1 -16.540 -18.191 -20.827 1.00 0.00 C ATOM 3 C MET A 1 -16.760 -17.254 -22.010 1.00 0.00 C ATOM 4 O MET A 1 -15.847 -17.004 -22.797 1.00 0.00 O ATOM 5 CB MET A 1 -15.133 -18.789 -20.892 1.00 0.00 C ATOM 6 CG MET A 1 -14.942 -19.774 -19.737 1.00 0.00 C ATOM 7 SD MET A 1 -13.327 -20.576 -19.891 1.00 0.00 S ATOM 8 CE MET A 1 -12.836 -20.443 -18.154 1.00 0.00 C ATOM 0 H1 MET A 1 -18.120 -19.268 -20.005 1.00 0.00 H new ATOM 0 H2 MET A 1 -18.163 -19.159 -21.699 1.00 0.00 H new ATOM 0 H3 MET A 1 -17.058 -20.204 -20.943 1.00 0.00 H new ATOM 0 HA MET A 1 -16.649 -17.630 -19.899 1.00 0.00 H new ATOM 0 HB2 MET A 1 -14.986 -19.297 -21.845 1.00 0.00 H new ATOM 0 HB3 MET A 1 -14.387 -17.997 -20.835 1.00 0.00 H new ATOM 0 HG2 MET A 1 -15.011 -19.251 -18.783 1.00 0.00 H new ATOM 0 HG3 MET A 1 -15.734 -20.522 -19.748 1.00 0.00 H new ATOM 0 HE1 MET A 1 -11.849 -20.885 -18.020 1.00 0.00 H new ATOM 0 HE2 MET A 1 -12.806 -19.393 -17.864 1.00 0.00 H new ATOM 0 HE3 MET A 1 -13.558 -20.971 -17.530 1.00 0.00 H new ATOM 20 N PRO A 2 -17.951 -16.737 -22.143 1.00 0.00 N ATOM 21 CA PRO A 2 -18.308 -15.805 -23.251 1.00 0.00 C ATOM 22 C PRO A 2 -17.695 -14.420 -23.055 1.00 0.00 C ATOM 23 O PRO A 2 -17.513 -13.965 -21.926 1.00 0.00 O ATOM 24 CB PRO A 2 -19.835 -15.740 -23.192 1.00 0.00 C ATOM 25 CG PRO A 2 -20.195 -16.075 -21.782 1.00 0.00 C ATOM 26 CD PRO A 2 -19.090 -16.988 -21.246 1.00 0.00 C ATOM 0 HA PRO A 2 -17.930 -16.148 -24.214 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -20.196 -14.748 -23.464 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -20.285 -16.446 -23.890 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -20.275 -15.171 -21.179 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -21.163 -16.574 -21.739 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -18.843 -16.750 -20.211 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -19.392 -18.035 -21.269 1.00 0.00 H new ATOM 34 N LYS A 3 -17.378 -13.755 -24.162 1.00 0.00 N ATOM 35 CA LYS A 3 -16.787 -12.424 -24.101 1.00 0.00 C ATOM 36 C LYS A 3 -17.877 -11.356 -24.082 1.00 0.00 C ATOM 37 O LYS A 3 -18.899 -11.490 -24.756 1.00 0.00 O ATOM 38 CB LYS A 3 -15.869 -12.202 -25.304 1.00 0.00 C ATOM 39 CG LYS A 3 -14.691 -13.177 -25.232 1.00 0.00 C ATOM 40 CD LYS A 3 -14.382 -13.713 -26.630 1.00 0.00 C ATOM 41 CE LYS A 3 -13.753 -12.604 -27.475 1.00 0.00 C ATOM 42 NZ LYS A 3 -13.272 -13.174 -28.765 1.00 0.00 N ATOM 0 H LYS A 3 -17.520 -14.114 -25.106 1.00 0.00 H new ATOM 0 HA LYS A 3 -16.203 -12.347 -23.184 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -16.423 -12.352 -26.231 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -15.505 -11.175 -25.313 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -13.815 -12.675 -24.822 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -14.929 -14.001 -24.560 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -13.703 -14.563 -26.563 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -15.296 -14.072 -27.104 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -14.483 -11.817 -27.663 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -12.923 -12.147 -26.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -12.844 -12.420 -29.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -12.562 -13.910 -28.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -14.073 -13.590 -29.281 1.00 0.00 H new ATOM 56 N HIS A 4 -17.656 -10.298 -23.308 1.00 0.00 N ATOM 57 CA HIS A 4 -18.633 -9.220 -23.215 1.00 0.00 C ATOM 58 C HIS A 4 -18.083 -7.938 -23.829 1.00 0.00 C ATOM 59 O HIS A 4 -16.929 -7.574 -23.600 1.00 0.00 O ATOM 60 CB HIS A 4 -18.997 -8.966 -21.751 1.00 0.00 C ATOM 61 CG HIS A 4 -19.457 -10.249 -21.116 1.00 0.00 C ATOM 62 ND1 HIS A 4 -20.361 -11.098 -21.736 1.00 0.00 N ATOM 63 CD2 HIS A 4 -19.147 -10.840 -19.918 1.00 0.00 C ATOM 64 CE1 HIS A 4 -20.560 -12.145 -20.916 1.00 0.00 C ATOM 65 NE2 HIS A 4 -19.845 -12.038 -19.792 1.00 0.00 N ATOM 0 H HIS A 4 -16.818 -10.165 -22.742 1.00 0.00 H new ATOM 0 HA HIS A 4 -19.524 -9.521 -23.766 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -18.134 -8.572 -21.214 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -19.783 -8.214 -21.686 1.00 0.00 H new ATOM 0 HD1 HIS A 4 -20.796 -10.955 -22.648 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -18.465 -10.437 -19.184 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -21.218 -12.972 -21.139 1.00 0.00 H new ATOM 73 N GLU A 5 -18.917 -7.253 -24.604 1.00 0.00 N ATOM 74 CA GLU A 5 -18.504 -6.009 -25.239 1.00 0.00 C ATOM 75 C GLU A 5 -19.203 -4.826 -24.581 1.00 0.00 C ATOM 76 O GLU A 5 -20.423 -4.828 -24.416 1.00 0.00 O ATOM 77 CB GLU A 5 -18.844 -6.043 -26.729 1.00 0.00 C ATOM 78 CG GLU A 5 -18.006 -7.120 -27.419 1.00 0.00 C ATOM 79 CD GLU A 5 -18.466 -7.294 -28.862 1.00 0.00 C ATOM 80 OE1 GLU A 5 -19.622 -7.015 -29.132 1.00 0.00 O ATOM 81 OE2 GLU A 5 -17.654 -7.703 -29.677 1.00 0.00 O ATOM 0 H GLU A 5 -19.876 -7.536 -24.806 1.00 0.00 H new ATOM 0 HA GLU A 5 -17.426 -5.897 -25.120 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -19.905 -6.250 -26.866 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -18.648 -5.070 -27.180 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -16.952 -6.843 -27.396 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -18.099 -8.064 -26.883 1.00 0.00 H new ATOM 88 N PHE A 6 -18.426 -3.818 -24.202 1.00 0.00 N ATOM 89 CA PHE A 6 -18.989 -2.639 -23.558 1.00 0.00 C ATOM 90 C PHE A 6 -18.287 -1.375 -24.041 1.00 0.00 C ATOM 91 O PHE A 6 -17.069 -1.357 -24.216 1.00 0.00 O ATOM 92 CB PHE A 6 -18.845 -2.762 -22.040 1.00 0.00 C ATOM 93 CG PHE A 6 -20.119 -3.320 -21.455 1.00 0.00 C ATOM 94 CD1 PHE A 6 -20.375 -4.695 -21.518 1.00 0.00 C ATOM 95 CD2 PHE A 6 -21.044 -2.463 -20.848 1.00 0.00 C ATOM 96 CE1 PHE A 6 -21.554 -5.213 -20.970 1.00 0.00 C ATOM 97 CE2 PHE A 6 -22.224 -2.980 -20.301 1.00 0.00 C ATOM 98 CZ PHE A 6 -22.479 -4.355 -20.362 1.00 0.00 C ATOM 0 H PHE A 6 -17.414 -3.793 -24.328 1.00 0.00 H new ATOM 0 HA PHE A 6 -20.045 -2.571 -23.820 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -18.005 -3.412 -21.796 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -18.630 -1.786 -21.605 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -19.663 -5.356 -21.989 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -20.847 -1.402 -20.802 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -21.750 -6.274 -21.016 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -22.937 -2.318 -19.832 1.00 0.00 H new ATOM 0 HZ PHE A 6 -23.389 -4.754 -19.940 1.00 0.00 H new ATOM 108 N SER A 7 -19.065 -0.319 -24.259 1.00 0.00 N ATOM 109 CA SER A 7 -18.507 0.946 -24.724 1.00 0.00 C ATOM 110 C SER A 7 -18.487 1.970 -23.594 1.00 0.00 C ATOM 111 O SER A 7 -19.536 2.430 -23.141 1.00 0.00 O ATOM 112 CB SER A 7 -19.337 1.483 -25.891 1.00 0.00 C ATOM 113 OG SER A 7 -20.434 0.610 -26.127 1.00 0.00 O ATOM 0 H SER A 7 -20.076 -0.313 -24.122 1.00 0.00 H new ATOM 0 HA SER A 7 -17.484 0.772 -25.057 1.00 0.00 H new ATOM 0 HB2 SER A 7 -19.698 2.486 -25.665 1.00 0.00 H new ATOM 0 HB3 SER A 7 -18.720 1.561 -26.786 1.00 0.00 H new ATOM 0 HG SER A 7 -21.272 1.116 -26.077 1.00 0.00 H new ATOM 119 N VAL A 8 -17.288 2.325 -23.144 1.00 0.00 N ATOM 120 CA VAL A 8 -17.148 3.297 -22.067 1.00 0.00 C ATOM 121 C VAL A 8 -16.156 4.388 -22.450 1.00 0.00 C ATOM 122 O VAL A 8 -14.991 4.110 -22.737 1.00 0.00 O ATOM 123 CB VAL A 8 -16.671 2.601 -20.792 1.00 0.00 C ATOM 124 CG1 VAL A 8 -15.327 1.916 -21.055 1.00 0.00 C ATOM 125 CG2 VAL A 8 -16.507 3.636 -19.674 1.00 0.00 C ATOM 0 H VAL A 8 -16.407 1.958 -23.505 1.00 0.00 H new ATOM 0 HA VAL A 8 -18.122 3.753 -21.891 1.00 0.00 H new ATOM 0 HB VAL A 8 -17.406 1.855 -20.490 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -14.987 1.420 -20.146 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -15.444 1.178 -21.849 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -14.592 2.662 -21.358 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -16.167 3.139 -18.765 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -15.773 4.384 -19.975 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -17.464 4.122 -19.485 1.00 0.00 H new ATOM 135 N ASP A 9 -16.625 5.630 -22.446 1.00 0.00 N ATOM 136 CA ASP A 9 -15.768 6.758 -22.789 1.00 0.00 C ATOM 137 C ASP A 9 -14.876 7.118 -21.607 1.00 0.00 C ATOM 138 O ASP A 9 -15.364 7.530 -20.554 1.00 0.00 O ATOM 139 CB ASP A 9 -16.621 7.967 -23.176 1.00 0.00 C ATOM 140 CG ASP A 9 -16.184 8.501 -24.536 1.00 0.00 C ATOM 141 OD1 ASP A 9 -15.235 9.265 -24.572 1.00 0.00 O ATOM 142 OD2 ASP A 9 -16.803 8.134 -25.521 1.00 0.00 O ATOM 0 H ASP A 9 -17.586 5.880 -22.211 1.00 0.00 H new ATOM 0 HA ASP A 9 -15.142 6.476 -23.636 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -17.673 7.684 -23.208 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -16.524 8.748 -22.421 1.00 0.00 H new ATOM 147 N MET A 10 -13.569 6.955 -21.781 1.00 0.00 N ATOM 148 CA MET A 10 -12.632 7.264 -20.710 1.00 0.00 C ATOM 149 C MET A 10 -12.524 8.772 -20.513 1.00 0.00 C ATOM 150 O MET A 10 -12.075 9.495 -21.403 1.00 0.00 O ATOM 151 CB MET A 10 -11.253 6.690 -21.037 1.00 0.00 C ATOM 152 CG MET A 10 -11.408 5.474 -21.952 1.00 0.00 C ATOM 153 SD MET A 10 -9.985 4.376 -21.741 1.00 0.00 S ATOM 154 CE MET A 10 -10.764 3.213 -20.593 1.00 0.00 C ATOM 0 H MET A 10 -13.140 6.615 -22.642 1.00 0.00 H new ATOM 0 HA MET A 10 -13.002 6.813 -19.789 1.00 0.00 H new ATOM 0 HB2 MET A 10 -10.638 7.448 -21.523 1.00 0.00 H new ATOM 0 HB3 MET A 10 -10.740 6.404 -20.119 1.00 0.00 H new ATOM 0 HG2 MET A 10 -12.330 4.942 -21.715 1.00 0.00 H new ATOM 0 HG3 MET A 10 -11.483 5.794 -22.991 1.00 0.00 H new ATOM 0 HE1 MET A 10 -10.050 2.434 -20.324 1.00 0.00 H new ATOM 0 HE2 MET A 10 -11.078 3.744 -19.694 1.00 0.00 H new ATOM 0 HE3 MET A 10 -11.634 2.759 -21.069 1.00 0.00 H new ATOM 164 N THR A 11 -12.931 9.236 -19.337 1.00 0.00 N ATOM 165 CA THR A 11 -12.869 10.656 -19.020 1.00 0.00 C ATOM 166 C THR A 11 -11.795 10.911 -17.971 1.00 0.00 C ATOM 167 O THR A 11 -11.177 11.975 -17.940 1.00 0.00 O ATOM 168 CB THR A 11 -14.224 11.138 -18.496 1.00 0.00 C ATOM 169 OG1 THR A 11 -15.255 10.319 -19.032 1.00 0.00 O ATOM 170 CG2 THR A 11 -14.451 12.589 -18.922 1.00 0.00 C ATOM 0 H THR A 11 -13.306 8.651 -18.590 1.00 0.00 H new ATOM 0 HA THR A 11 -12.621 11.206 -19.928 1.00 0.00 H new ATOM 0 HB THR A 11 -14.237 11.075 -17.408 1.00 0.00 H new ATOM 0 HG1 THR A 11 -16.123 10.625 -18.696 1.00 0.00 H new ATOM 0 HG21 THR A 11 -15.416 12.931 -18.548 1.00 0.00 H new ATOM 0 HG22 THR A 11 -13.660 13.217 -18.512 1.00 0.00 H new ATOM 0 HG23 THR A 11 -14.439 12.655 -20.010 1.00 0.00 H new ATOM 178 N CYS A 12 -11.579 9.920 -17.113 1.00 0.00 N ATOM 179 CA CYS A 12 -10.579 10.033 -16.061 1.00 0.00 C ATOM 180 C CYS A 12 -9.318 9.265 -16.436 1.00 0.00 C ATOM 181 O CYS A 12 -8.588 8.802 -15.563 1.00 0.00 O ATOM 182 CB CYS A 12 -11.142 9.489 -14.747 1.00 0.00 C ATOM 183 SG CYS A 12 -11.953 10.829 -13.841 1.00 0.00 S ATOM 0 H CYS A 12 -12.082 9.033 -17.126 1.00 0.00 H new ATOM 0 HA CYS A 12 -10.324 11.086 -15.938 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -11.853 8.688 -14.947 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -10.341 9.061 -14.145 1.00 0.00 H new ATOM 0 HG CYS A 12 -13.047 10.385 -13.297 1.00 0.00 H new ATOM 189 N GLY A 13 -9.072 9.136 -17.741 1.00 0.00 N ATOM 190 CA GLY A 13 -7.893 8.422 -18.230 1.00 0.00 C ATOM 191 C GLY A 13 -6.860 8.250 -17.124 1.00 0.00 C ATOM 192 O GLY A 13 -6.366 7.147 -16.886 1.00 0.00 O ATOM 0 H GLY A 13 -9.671 9.515 -18.475 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -8.188 7.445 -18.612 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -7.451 8.970 -19.063 1.00 0.00 H new ATOM 196 N GLY A 14 -6.547 9.347 -16.443 1.00 0.00 N ATOM 197 CA GLY A 14 -5.580 9.307 -15.354 1.00 0.00 C ATOM 198 C GLY A 14 -6.094 8.437 -14.211 1.00 0.00 C ATOM 199 O GLY A 14 -5.426 7.496 -13.784 1.00 0.00 O ATOM 0 H GLY A 14 -6.946 10.268 -16.624 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -4.630 8.915 -15.718 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -5.390 10.317 -14.992 1.00 0.00 H new ATOM 203 N CYS A 15 -7.289 8.758 -13.725 1.00 0.00 N ATOM 204 CA CYS A 15 -7.894 8.002 -12.635 1.00 0.00 C ATOM 205 C CYS A 15 -8.620 6.770 -13.172 1.00 0.00 C ATOM 206 O CYS A 15 -8.525 5.685 -12.597 1.00 0.00 O ATOM 207 CB CYS A 15 -8.881 8.889 -11.871 1.00 0.00 C ATOM 208 SG CYS A 15 -8.255 9.186 -10.199 1.00 0.00 S ATOM 0 H CYS A 15 -7.856 9.534 -14.068 1.00 0.00 H new ATOM 0 HA CYS A 15 -7.102 7.675 -11.961 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -9.016 9.836 -12.394 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -9.858 8.408 -11.825 1.00 0.00 H new ATOM 0 HG CYS A 15 -9.091 9.941 -9.550 1.00 0.00 H new ATOM 214 N ALA A 16 -9.346 6.940 -14.275 1.00 0.00 N ATOM 215 CA ALA A 16 -10.079 5.826 -14.869 1.00 0.00 C ATOM 216 C ALA A 16 -9.141 4.659 -15.163 1.00 0.00 C ATOM 217 O ALA A 16 -9.523 3.497 -15.028 1.00 0.00 O ATOM 218 CB ALA A 16 -10.757 6.273 -16.165 1.00 0.00 C ATOM 0 H ALA A 16 -9.442 7.827 -14.770 1.00 0.00 H new ATOM 0 HA ALA A 16 -10.837 5.499 -14.157 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -11.301 5.434 -16.599 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -11.453 7.084 -15.951 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -10.001 6.620 -16.870 1.00 0.00 H new ATOM 224 N GLU A 17 -7.913 4.974 -15.564 1.00 0.00 N ATOM 225 CA GLU A 17 -6.932 3.939 -15.872 1.00 0.00 C ATOM 226 C GLU A 17 -6.548 3.175 -14.609 1.00 0.00 C ATOM 227 O GLU A 17 -6.487 1.946 -14.611 1.00 0.00 O ATOM 228 CB GLU A 17 -5.682 4.564 -16.492 1.00 0.00 C ATOM 229 CG GLU A 17 -4.591 3.498 -16.615 1.00 0.00 C ATOM 230 CD GLU A 17 -3.700 3.797 -17.816 1.00 0.00 C ATOM 231 OE1 GLU A 17 -4.165 4.473 -18.720 1.00 0.00 O ATOM 232 OE2 GLU A 17 -2.568 3.345 -17.816 1.00 0.00 O ATOM 0 H GLU A 17 -7.576 5.929 -15.683 1.00 0.00 H new ATOM 0 HA GLU A 17 -7.378 3.245 -16.584 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -5.916 4.976 -17.474 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -5.331 5.391 -15.875 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -3.992 3.473 -15.705 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -5.045 2.513 -16.725 1.00 0.00 H new ATOM 239 N ALA A 18 -6.297 3.912 -13.531 1.00 0.00 N ATOM 240 CA ALA A 18 -5.930 3.288 -12.264 1.00 0.00 C ATOM 241 C ALA A 18 -7.121 2.521 -11.701 1.00 0.00 C ATOM 242 O ALA A 18 -6.964 1.468 -11.084 1.00 0.00 O ATOM 243 CB ALA A 18 -5.483 4.358 -11.264 1.00 0.00 C ATOM 0 H ALA A 18 -6.340 4.931 -13.508 1.00 0.00 H new ATOM 0 HA ALA A 18 -5.106 2.595 -12.435 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -5.211 3.884 -10.321 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -4.621 4.892 -11.664 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -6.299 5.061 -11.094 1.00 0.00 H new ATOM 249 N VAL A 19 -8.311 3.062 -11.933 1.00 0.00 N ATOM 250 CA VAL A 19 -9.542 2.435 -11.465 1.00 0.00 C ATOM 251 C VAL A 19 -9.724 1.066 -12.119 1.00 0.00 C ATOM 252 O VAL A 19 -10.213 0.127 -11.492 1.00 0.00 O ATOM 253 CB VAL A 19 -10.736 3.337 -11.796 1.00 0.00 C ATOM 254 CG1 VAL A 19 -11.982 2.486 -12.060 1.00 0.00 C ATOM 255 CG2 VAL A 19 -11.007 4.276 -10.617 1.00 0.00 C ATOM 0 H VAL A 19 -8.450 3.934 -12.443 1.00 0.00 H new ATOM 0 HA VAL A 19 -9.481 2.298 -10.385 1.00 0.00 H new ATOM 0 HB VAL A 19 -10.504 3.919 -12.688 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -12.824 3.137 -12.294 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -11.795 1.818 -12.901 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -12.215 1.897 -11.173 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -11.856 4.918 -10.851 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -11.231 3.688 -9.727 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -10.127 4.892 -10.432 1.00 0.00 H new ATOM 265 N SER A 20 -9.338 0.968 -13.388 1.00 0.00 N ATOM 266 CA SER A 20 -9.477 -0.283 -14.126 1.00 0.00 C ATOM 267 C SER A 20 -8.749 -1.418 -13.411 1.00 0.00 C ATOM 268 O SER A 20 -9.198 -2.563 -13.436 1.00 0.00 O ATOM 269 CB SER A 20 -8.914 -0.119 -15.538 1.00 0.00 C ATOM 270 OG SER A 20 -9.665 -0.922 -16.440 1.00 0.00 O ATOM 0 H SER A 20 -8.929 1.734 -13.923 1.00 0.00 H new ATOM 0 HA SER A 20 -10.537 -0.532 -14.183 1.00 0.00 H new ATOM 0 HB2 SER A 20 -8.959 0.927 -15.841 1.00 0.00 H new ATOM 0 HB3 SER A 20 -7.864 -0.412 -15.560 1.00 0.00 H new ATOM 0 HG SER A 20 -9.054 -1.461 -16.984 1.00 0.00 H new ATOM 276 N ARG A 21 -7.632 -1.099 -12.767 1.00 0.00 N ATOM 277 CA ARG A 21 -6.874 -2.114 -12.044 1.00 0.00 C ATOM 278 C ARG A 21 -7.766 -2.791 -11.007 1.00 0.00 C ATOM 279 O ARG A 21 -7.729 -4.009 -10.836 1.00 0.00 O ATOM 280 CB ARG A 21 -5.668 -1.476 -11.353 1.00 0.00 C ATOM 281 CG ARG A 21 -4.752 -0.848 -12.405 1.00 0.00 C ATOM 282 CD ARG A 21 -3.348 -0.680 -11.825 1.00 0.00 C ATOM 283 NE ARG A 21 -3.403 -0.653 -10.368 1.00 0.00 N ATOM 284 CZ ARG A 21 -2.404 -1.133 -9.634 1.00 0.00 C ATOM 285 NH1 ARG A 21 -1.353 -1.643 -10.216 1.00 0.00 N ATOM 286 NH2 ARG A 21 -2.472 -1.094 -8.331 1.00 0.00 N ATOM 0 H ARG A 21 -7.235 -0.160 -12.730 1.00 0.00 H new ATOM 0 HA ARG A 21 -6.521 -2.862 -12.754 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -6.000 -0.717 -10.645 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -5.123 -2.228 -10.782 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -4.717 -1.478 -13.294 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -5.147 0.119 -12.715 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -2.710 -1.499 -12.157 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -2.902 0.243 -12.196 1.00 0.00 H new ATOM 0 HE ARG A 21 -4.222 -0.259 -9.904 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -1.298 -1.673 -11.234 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -0.586 -2.011 -9.653 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -3.292 -0.695 -7.875 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -1.705 -1.463 -7.769 1.00 0.00 H new ATOM 300 N VAL A 22 -8.577 -1.984 -10.328 1.00 0.00 N ATOM 301 CA VAL A 22 -9.494 -2.493 -9.314 1.00 0.00 C ATOM 302 C VAL A 22 -10.465 -3.502 -9.931 1.00 0.00 C ATOM 303 O VAL A 22 -11.101 -4.281 -9.221 1.00 0.00 O ATOM 304 CB VAL A 22 -10.257 -1.324 -8.667 1.00 0.00 C ATOM 305 CG1 VAL A 22 -11.736 -1.359 -9.067 1.00 0.00 C ATOM 306 CG2 VAL A 22 -10.144 -1.425 -7.143 1.00 0.00 C ATOM 0 H VAL A 22 -8.617 -0.974 -10.462 1.00 0.00 H new ATOM 0 HA VAL A 22 -8.922 -3.006 -8.541 1.00 0.00 H new ATOM 0 HB VAL A 22 -9.820 -0.387 -9.013 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -12.259 -0.525 -8.600 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -11.822 -1.280 -10.151 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -12.180 -2.297 -8.735 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -10.684 -0.598 -6.682 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -10.573 -2.369 -6.808 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -9.094 -1.380 -6.852 1.00 0.00 H new ATOM 316 N LEU A 23 -10.580 -3.465 -11.256 1.00 0.00 N ATOM 317 CA LEU A 23 -11.486 -4.364 -11.966 1.00 0.00 C ATOM 318 C LEU A 23 -11.151 -5.821 -11.677 1.00 0.00 C ATOM 319 O LEU A 23 -12.040 -6.669 -11.633 1.00 0.00 O ATOM 320 CB LEU A 23 -11.389 -4.119 -13.475 1.00 0.00 C ATOM 321 CG LEU A 23 -12.411 -4.991 -14.207 1.00 0.00 C ATOM 322 CD1 LEU A 23 -13.747 -4.252 -14.296 1.00 0.00 C ATOM 323 CD2 LEU A 23 -11.902 -5.291 -15.619 1.00 0.00 C ATOM 0 H LEU A 23 -10.060 -2.826 -11.857 1.00 0.00 H new ATOM 0 HA LEU A 23 -12.499 -4.161 -11.619 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -11.571 -3.067 -13.695 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.383 -4.349 -13.826 1.00 0.00 H new ATOM 0 HG LEU A 23 -12.549 -5.924 -13.660 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -14.473 -4.875 -14.818 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -14.110 -4.035 -13.292 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -13.611 -3.319 -14.842 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -12.628 -5.912 -16.143 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -11.765 -4.356 -16.163 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -10.950 -5.818 -15.558 1.00 0.00 H new ATOM 335 N ASN A 24 -9.872 -6.113 -11.483 1.00 0.00 N ATOM 336 CA ASN A 24 -9.458 -7.482 -11.207 1.00 0.00 C ATOM 337 C ASN A 24 -10.246 -8.048 -10.027 1.00 0.00 C ATOM 338 O ASN A 24 -10.533 -9.244 -9.977 1.00 0.00 O ATOM 339 CB ASN A 24 -7.963 -7.524 -10.893 1.00 0.00 C ATOM 340 CG ASN A 24 -7.219 -6.515 -11.762 1.00 0.00 C ATOM 341 OD1 ASN A 24 -7.774 -6.079 -12.861 1.00 0.00 O flip ATOM 342 ND2 ASN A 24 -6.106 -6.109 -11.430 1.00 0.00 N flip ATOM 0 H ASN A 24 -9.113 -5.432 -11.511 1.00 0.00 H new ATOM 0 HA ASN A 24 -9.658 -8.089 -12.090 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -7.798 -7.300 -9.839 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -7.574 -8.526 -11.071 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -5.674 -6.450 -10.571 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -5.616 -5.431 -12.013 1.00 0.00 H new ATOM 349 N LYS A 25 -10.594 -7.181 -9.083 1.00 0.00 N ATOM 350 CA LYS A 25 -11.350 -7.604 -7.910 1.00 0.00 C ATOM 351 C LYS A 25 -12.771 -8.012 -8.292 1.00 0.00 C ATOM 352 O LYS A 25 -13.275 -9.037 -7.835 1.00 0.00 O ATOM 353 CB LYS A 25 -11.406 -6.467 -6.889 1.00 0.00 C ATOM 354 CG LYS A 25 -9.986 -6.099 -6.458 1.00 0.00 C ATOM 355 CD LYS A 25 -9.534 -7.039 -5.337 1.00 0.00 C ATOM 356 CE LYS A 25 -10.038 -6.511 -3.993 1.00 0.00 C ATOM 357 NZ LYS A 25 -10.481 -7.653 -3.145 1.00 0.00 N ATOM 0 H LYS A 25 -10.367 -6.187 -9.106 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.845 -8.466 -7.475 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -11.903 -5.599 -7.322 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -11.993 -6.771 -6.022 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -9.306 -6.174 -7.306 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -9.955 -5.065 -6.115 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -9.920 -8.043 -5.513 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -8.447 -7.112 -5.326 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.247 -5.955 -3.489 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -10.865 -5.818 -4.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -10.824 -7.294 -2.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.248 -8.165 -3.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -9.681 -8.298 -2.986 1.00 0.00 H new ATOM 371 N LEU A 26 -13.413 -7.200 -9.126 1.00 0.00 N ATOM 372 CA LEU A 26 -14.778 -7.482 -9.553 1.00 0.00 C ATOM 373 C LEU A 26 -14.795 -8.532 -10.660 1.00 0.00 C ATOM 374 O LEU A 26 -15.664 -9.403 -10.688 1.00 0.00 O ATOM 375 CB LEU A 26 -15.435 -6.197 -10.060 1.00 0.00 C ATOM 376 CG LEU A 26 -16.818 -6.042 -9.428 1.00 0.00 C ATOM 377 CD1 LEU A 26 -17.626 -7.324 -9.635 1.00 0.00 C ATOM 378 CD2 LEU A 26 -16.665 -5.772 -7.930 1.00 0.00 C ATOM 0 H LEU A 26 -13.013 -6.347 -9.517 1.00 0.00 H new ATOM 0 HA LEU A 26 -15.333 -7.868 -8.698 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -14.813 -5.337 -9.812 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -15.522 -6.226 -11.146 1.00 0.00 H new ATOM 0 HG LEU A 26 -17.339 -5.208 -9.898 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -18.611 -7.210 -9.183 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -17.736 -7.516 -10.702 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -17.107 -8.161 -9.167 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -17.651 -5.661 -7.478 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -16.142 -6.606 -7.461 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -16.093 -4.856 -7.782 1.00 0.00 H new ATOM 390 N GLY A 27 -13.836 -8.438 -11.573 1.00 0.00 N ATOM 391 CA GLY A 27 -13.758 -9.381 -12.681 1.00 0.00 C ATOM 392 C GLY A 27 -12.705 -10.454 -12.426 1.00 0.00 C ATOM 393 O GLY A 27 -13.025 -11.637 -12.314 1.00 0.00 O ATOM 0 H GLY A 27 -13.107 -7.724 -11.569 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -14.730 -9.851 -12.830 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -13.519 -8.846 -13.600 1.00 0.00 H new ATOM 397 N GLY A 28 -11.446 -10.035 -12.344 1.00 0.00 N ATOM 398 CA GLY A 28 -10.354 -10.974 -12.115 1.00 0.00 C ATOM 399 C GLY A 28 -10.207 -11.916 -13.304 1.00 0.00 C ATOM 400 O GLY A 28 -9.608 -12.985 -13.196 1.00 0.00 O ATOM 0 H GLY A 28 -11.158 -9.060 -12.432 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -9.424 -10.429 -11.958 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -10.544 -11.549 -11.209 1.00 0.00 H new ATOM 404 N VAL A 29 -10.766 -11.506 -14.438 1.00 0.00 N ATOM 405 CA VAL A 29 -10.706 -12.311 -15.652 1.00 0.00 C ATOM 406 C VAL A 29 -10.063 -11.529 -16.786 1.00 0.00 C ATOM 407 O VAL A 29 -9.523 -10.442 -16.584 1.00 0.00 O ATOM 408 CB VAL A 29 -12.115 -12.736 -16.058 1.00 0.00 C ATOM 409 CG1 VAL A 29 -12.094 -14.187 -16.539 1.00 0.00 C ATOM 410 CG2 VAL A 29 -13.050 -12.613 -14.852 1.00 0.00 C ATOM 0 H VAL A 29 -11.265 -10.622 -14.541 1.00 0.00 H new ATOM 0 HA VAL A 29 -10.100 -13.194 -15.451 1.00 0.00 H new ATOM 0 HB VAL A 29 -12.470 -12.093 -16.863 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -13.101 -14.489 -16.828 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -11.428 -14.276 -17.397 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -11.739 -14.832 -15.735 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -14.057 -12.916 -15.140 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -12.693 -13.257 -14.048 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -13.067 -11.579 -14.509 1.00 0.00 H new ATOM 420 N LYS A 30 -10.126 -12.100 -17.979 1.00 0.00 N ATOM 421 CA LYS A 30 -9.547 -11.465 -19.156 1.00 0.00 C ATOM 422 C LYS A 30 -10.130 -10.070 -19.356 1.00 0.00 C ATOM 423 O LYS A 30 -11.347 -9.888 -19.357 1.00 0.00 O ATOM 424 CB LYS A 30 -9.817 -12.320 -20.396 1.00 0.00 C ATOM 425 CG LYS A 30 -8.541 -12.420 -21.234 1.00 0.00 C ATOM 426 CD LYS A 30 -8.828 -13.207 -22.515 1.00 0.00 C ATOM 427 CE LYS A 30 -7.996 -14.491 -22.527 1.00 0.00 C ATOM 428 NZ LYS A 30 -6.561 -14.151 -22.742 1.00 0.00 N ATOM 0 H LYS A 30 -10.571 -13.000 -18.159 1.00 0.00 H new ATOM 0 HA LYS A 30 -8.471 -11.375 -19.005 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -10.149 -13.315 -20.100 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -10.620 -11.879 -20.987 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -8.178 -11.423 -21.482 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -7.755 -12.912 -20.661 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -9.889 -13.449 -22.575 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -8.590 -12.599 -23.388 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -8.117 -15.024 -21.584 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -8.345 -15.156 -23.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -6.036 -15.010 -23.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -6.481 -13.451 -23.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -6.163 -13.754 -21.867 1.00 0.00 H new ATOM 442 N TYR A 31 -9.248 -9.091 -19.524 1.00 0.00 N ATOM 443 CA TYR A 31 -9.679 -7.712 -19.723 1.00 0.00 C ATOM 444 C TYR A 31 -8.689 -6.956 -20.605 1.00 0.00 C ATOM 445 O TYR A 31 -7.501 -7.281 -20.641 1.00 0.00 O ATOM 446 CB TYR A 31 -9.796 -7.006 -18.372 1.00 0.00 C ATOM 447 CG TYR A 31 -8.414 -6.733 -17.825 1.00 0.00 C ATOM 448 CD1 TYR A 31 -7.689 -5.624 -18.277 1.00 0.00 C ATOM 449 CD2 TYR A 31 -7.856 -7.590 -16.868 1.00 0.00 C ATOM 450 CE1 TYR A 31 -6.409 -5.371 -17.773 1.00 0.00 C ATOM 451 CE2 TYR A 31 -6.575 -7.337 -16.364 1.00 0.00 C ATOM 452 CZ TYR A 31 -5.851 -6.227 -16.816 1.00 0.00 C ATOM 453 OH TYR A 31 -4.588 -5.976 -16.318 1.00 0.00 O ATOM 0 H TYR A 31 -8.237 -9.225 -19.526 1.00 0.00 H new ATOM 0 HA TYR A 31 -10.650 -7.725 -20.218 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -10.345 -6.071 -18.484 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -10.359 -7.625 -17.674 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -8.118 -4.963 -19.016 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -8.414 -8.446 -16.519 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -5.851 -4.515 -18.122 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -6.145 -7.998 -15.626 1.00 0.00 H new ATOM 0 HH TYR A 31 -4.352 -6.665 -15.662 1.00 0.00 H new ATOM 463 N ASP A 32 -9.185 -5.944 -21.311 1.00 0.00 N ATOM 464 CA ASP A 32 -8.335 -5.143 -22.186 1.00 0.00 C ATOM 465 C ASP A 32 -9.020 -3.825 -22.535 1.00 0.00 C ATOM 466 O ASP A 32 -10.131 -3.814 -23.064 1.00 0.00 O ATOM 467 CB ASP A 32 -8.029 -5.919 -23.470 1.00 0.00 C ATOM 468 CG ASP A 32 -7.631 -4.954 -24.581 1.00 0.00 C ATOM 469 OD1 ASP A 32 -8.455 -4.131 -24.948 1.00 0.00 O ATOM 470 OD2 ASP A 32 -6.509 -5.051 -25.050 1.00 0.00 O ATOM 0 H ASP A 32 -10.165 -5.660 -21.295 1.00 0.00 H new ATOM 0 HA ASP A 32 -7.404 -4.928 -21.662 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.224 -6.632 -23.291 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -8.903 -6.495 -23.773 1.00 0.00 H new ATOM 475 N ILE A 33 -8.353 -2.717 -22.228 1.00 0.00 N ATOM 476 CA ILE A 33 -8.902 -1.402 -22.503 1.00 0.00 C ATOM 477 C ILE A 33 -8.109 -0.698 -23.600 1.00 0.00 C ATOM 478 O ILE A 33 -6.881 -0.626 -23.541 1.00 0.00 O ATOM 479 CB ILE A 33 -8.854 -0.567 -21.230 1.00 0.00 C ATOM 480 CG1 ILE A 33 -7.427 -0.062 -21.007 1.00 0.00 C ATOM 481 CG2 ILE A 33 -9.286 -1.421 -20.038 1.00 0.00 C ATOM 482 CD1 ILE A 33 -7.258 0.361 -19.548 1.00 0.00 C ATOM 0 H ILE A 33 -7.432 -2.708 -21.789 1.00 0.00 H new ATOM 0 HA ILE A 33 -9.932 -1.517 -22.842 1.00 0.00 H new ATOM 0 HB ILE A 33 -9.530 0.282 -21.328 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -6.710 -0.845 -21.255 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -7.221 0.780 -21.667 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -9.251 -0.821 -19.129 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -10.303 -1.780 -20.197 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -8.613 -2.272 -19.937 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -6.241 0.721 -19.389 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -7.965 1.157 -19.316 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -7.447 -0.493 -18.897 1.00 0.00 H new ATOM 494 N ASP A 34 -8.818 -0.171 -24.593 1.00 0.00 N ATOM 495 CA ASP A 34 -8.168 0.534 -25.692 1.00 0.00 C ATOM 496 C ASP A 34 -8.477 2.026 -25.621 1.00 0.00 C ATOM 497 O ASP A 34 -9.555 2.467 -26.020 1.00 0.00 O ATOM 498 CB ASP A 34 -8.648 -0.027 -27.031 1.00 0.00 C ATOM 499 CG ASP A 34 -8.019 -1.393 -27.281 1.00 0.00 C ATOM 500 OD1 ASP A 34 -7.428 -1.929 -26.358 1.00 0.00 O ATOM 501 OD2 ASP A 34 -8.136 -1.884 -28.392 1.00 0.00 O ATOM 0 H ASP A 34 -9.835 -0.218 -24.660 1.00 0.00 H new ATOM 0 HA ASP A 34 -7.091 0.391 -25.607 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -9.735 -0.113 -27.030 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -8.383 0.657 -27.837 1.00 0.00 H new ATOM 506 N LEU A 35 -7.526 2.798 -25.106 1.00 0.00 N ATOM 507 CA LEU A 35 -7.703 4.242 -24.980 1.00 0.00 C ATOM 508 C LEU A 35 -7.924 4.889 -26.346 1.00 0.00 C ATOM 509 O LEU A 35 -8.816 5.720 -26.516 1.00 0.00 O ATOM 510 CB LEU A 35 -6.467 4.857 -24.318 1.00 0.00 C ATOM 511 CG LEU A 35 -6.889 5.703 -23.116 1.00 0.00 C ATOM 512 CD1 LEU A 35 -5.644 6.183 -22.367 1.00 0.00 C ATOM 513 CD2 LEU A 35 -7.690 6.915 -23.602 1.00 0.00 C ATOM 0 H LEU A 35 -6.628 2.451 -24.770 1.00 0.00 H new ATOM 0 HA LEU A 35 -8.583 4.426 -24.364 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -5.785 4.069 -23.998 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -5.927 5.474 -25.037 1.00 0.00 H new ATOM 0 HG LEU A 35 -7.506 5.102 -22.448 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -5.945 6.786 -21.510 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -5.072 5.322 -22.022 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -5.027 6.784 -23.035 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -7.991 7.519 -22.746 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -7.072 7.515 -24.270 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -8.577 6.574 -24.136 1.00 0.00 H new ATOM 525 N PRO A 36 -7.118 4.531 -27.308 1.00 0.00 N ATOM 526 CA PRO A 36 -7.203 5.092 -28.692 1.00 0.00 C ATOM 527 C PRO A 36 -8.573 4.891 -29.331 1.00 0.00 C ATOM 528 O PRO A 36 -9.001 5.692 -30.163 1.00 0.00 O ATOM 529 CB PRO A 36 -6.125 4.329 -29.471 1.00 0.00 C ATOM 530 CG PRO A 36 -5.203 3.760 -28.443 1.00 0.00 C ATOM 531 CD PRO A 36 -6.032 3.550 -27.179 1.00 0.00 C ATOM 0 HA PRO A 36 -7.054 6.172 -28.690 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -6.567 3.540 -30.079 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -5.591 4.993 -30.150 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -4.775 2.818 -28.786 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -4.371 4.438 -28.252 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -6.417 2.532 -27.117 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -5.441 3.723 -26.279 1.00 0.00 H new ATOM 539 N ASN A 37 -9.255 3.818 -28.951 1.00 0.00 N ATOM 540 CA ASN A 37 -10.569 3.531 -29.514 1.00 0.00 C ATOM 541 C ASN A 37 -11.679 3.846 -28.516 1.00 0.00 C ATOM 542 O ASN A 37 -12.863 3.758 -28.844 1.00 0.00 O ATOM 543 CB ASN A 37 -10.651 2.058 -29.918 1.00 0.00 C ATOM 544 CG ASN A 37 -11.352 1.927 -31.266 1.00 0.00 C ATOM 545 OD1 ASN A 37 -12.127 2.890 -31.686 1.00 0.00 O flip ATOM 546 ND2 ASN A 37 -11.189 0.921 -31.956 1.00 0.00 N flip ATOM 0 H ASN A 37 -8.926 3.140 -28.264 1.00 0.00 H new ATOM 0 HA ASN A 37 -10.705 4.164 -30.391 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -9.649 1.632 -29.976 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -11.194 1.494 -29.160 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -10.583 0.169 -31.627 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -11.660 0.839 -32.857 1.00 0.00 H new ATOM 553 N LYS A 38 -11.294 4.214 -27.299 1.00 0.00 N ATOM 554 CA LYS A 38 -12.274 4.538 -26.269 1.00 0.00 C ATOM 555 C LYS A 38 -13.249 3.380 -26.080 1.00 0.00 C ATOM 556 O LYS A 38 -14.446 3.588 -25.880 1.00 0.00 O ATOM 557 CB LYS A 38 -13.049 5.797 -26.658 1.00 0.00 C ATOM 558 CG LYS A 38 -12.073 6.872 -27.137 1.00 0.00 C ATOM 559 CD LYS A 38 -12.835 7.930 -27.938 1.00 0.00 C ATOM 560 CE LYS A 38 -12.039 9.235 -27.942 1.00 0.00 C ATOM 561 NZ LYS A 38 -12.318 9.990 -26.687 1.00 0.00 N ATOM 0 H LYS A 38 -10.321 4.295 -27.003 1.00 0.00 H new ATOM 0 HA LYS A 38 -11.744 4.714 -25.333 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -13.766 5.566 -27.445 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -13.619 6.163 -25.805 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -11.576 7.334 -26.284 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -11.295 6.423 -27.754 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -12.993 7.584 -28.960 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -13.820 8.093 -27.501 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -10.973 9.023 -28.022 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -12.311 9.837 -28.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -11.777 10.878 -26.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -13.334 10.204 -26.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -12.038 9.415 -25.867 1.00 0.00 H new ATOM 575 N LYS A 39 -12.727 2.160 -26.144 1.00 0.00 N ATOM 576 CA LYS A 39 -13.556 0.974 -25.977 1.00 0.00 C ATOM 577 C LYS A 39 -12.863 -0.029 -25.062 1.00 0.00 C ATOM 578 O LYS A 39 -11.637 -0.036 -24.951 1.00 0.00 O ATOM 579 CB LYS A 39 -13.827 0.326 -27.337 1.00 0.00 C ATOM 580 CG LYS A 39 -14.674 1.272 -28.196 1.00 0.00 C ATOM 581 CD LYS A 39 -15.982 0.579 -28.587 1.00 0.00 C ATOM 582 CE LYS A 39 -16.772 1.479 -29.540 1.00 0.00 C ATOM 583 NZ LYS A 39 -18.154 1.666 -29.014 1.00 0.00 N ATOM 0 H LYS A 39 -11.739 1.968 -26.309 1.00 0.00 H new ATOM 0 HA LYS A 39 -14.503 1.273 -25.527 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -12.886 0.106 -27.840 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -14.346 -0.623 -27.202 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -14.887 2.188 -27.644 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -14.122 1.560 -29.091 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -15.770 -0.377 -29.065 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -16.574 0.366 -27.697 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -16.276 2.444 -29.641 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -16.807 1.033 -30.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -18.809 1.823 -29.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -18.444 0.816 -28.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -18.175 2.489 -28.379 1.00 0.00 H new ATOM 597 N VAL A 40 -13.651 -0.869 -24.402 1.00 0.00 N ATOM 598 CA VAL A 40 -13.090 -1.862 -23.495 1.00 0.00 C ATOM 599 C VAL A 40 -13.773 -3.213 -23.674 1.00 0.00 C ATOM 600 O VAL A 40 -14.989 -3.332 -23.519 1.00 0.00 O ATOM 601 CB VAL A 40 -13.255 -1.398 -22.047 1.00 0.00 C ATOM 602 CG1 VAL A 40 -12.873 -2.536 -21.099 1.00 0.00 C ATOM 603 CG2 VAL A 40 -12.346 -0.193 -21.789 1.00 0.00 C ATOM 0 H VAL A 40 -14.668 -0.883 -24.476 1.00 0.00 H new ATOM 0 HA VAL A 40 -12.031 -1.973 -23.728 1.00 0.00 H new ATOM 0 HB VAL A 40 -14.293 -1.114 -21.874 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -12.991 -2.205 -20.067 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -13.520 -3.394 -21.281 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -11.835 -2.821 -21.272 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -12.464 0.137 -20.757 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -11.308 -0.476 -21.963 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -12.618 0.619 -22.463 1.00 0.00 H new ATOM 613 N CYS A 41 -12.980 -4.231 -23.988 1.00 0.00 N ATOM 614 CA CYS A 41 -13.513 -5.574 -24.170 1.00 0.00 C ATOM 615 C CYS A 41 -13.120 -6.449 -22.985 1.00 0.00 C ATOM 616 O CYS A 41 -11.939 -6.721 -22.770 1.00 0.00 O ATOM 617 CB CYS A 41 -12.971 -6.186 -25.465 1.00 0.00 C ATOM 618 SG CYS A 41 -13.679 -7.835 -25.696 1.00 0.00 S ATOM 0 H CYS A 41 -11.972 -4.152 -24.121 1.00 0.00 H new ATOM 0 HA CYS A 41 -14.600 -5.517 -24.233 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -13.221 -5.549 -26.313 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -11.884 -6.248 -25.423 1.00 0.00 H new ATOM 0 HG CYS A 41 -13.221 -8.354 -26.796 1.00 0.00 H new ATOM 624 N ILE A 42 -14.113 -6.874 -22.212 1.00 0.00 N ATOM 625 CA ILE A 42 -13.845 -7.704 -21.043 1.00 0.00 C ATOM 626 C ILE A 42 -14.625 -9.011 -21.100 1.00 0.00 C ATOM 627 O ILE A 42 -15.815 -9.023 -21.415 1.00 0.00 O ATOM 628 CB ILE A 42 -14.233 -6.946 -19.774 1.00 0.00 C ATOM 629 CG1 ILE A 42 -13.746 -7.724 -18.550 1.00 0.00 C ATOM 630 CG2 ILE A 42 -15.754 -6.800 -19.712 1.00 0.00 C ATOM 631 CD1 ILE A 42 -14.559 -7.305 -17.325 1.00 0.00 C ATOM 0 H ILE A 42 -15.098 -6.661 -22.370 1.00 0.00 H new ATOM 0 HA ILE A 42 -12.780 -7.936 -21.033 1.00 0.00 H new ATOM 0 HB ILE A 42 -13.774 -5.958 -19.785 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -13.851 -8.795 -18.721 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -12.687 -7.531 -18.381 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -16.031 -6.259 -18.807 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -16.102 -6.248 -20.585 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -16.214 -7.788 -19.700 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -14.213 -7.859 -16.452 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -14.431 -6.237 -17.151 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -15.614 -7.521 -17.497 1.00 0.00 H new ATOM 643 N GLU A 43 -13.950 -10.107 -20.769 1.00 0.00 N ATOM 644 CA GLU A 43 -14.595 -11.411 -20.759 1.00 0.00 C ATOM 645 C GLU A 43 -14.706 -11.900 -19.322 1.00 0.00 C ATOM 646 O GLU A 43 -13.696 -12.119 -18.658 1.00 0.00 O ATOM 647 CB GLU A 43 -13.776 -12.407 -21.585 1.00 0.00 C ATOM 648 CG GLU A 43 -14.117 -13.836 -21.155 1.00 0.00 C ATOM 649 CD GLU A 43 -13.450 -14.834 -22.095 1.00 0.00 C ATOM 650 OE1 GLU A 43 -12.603 -14.416 -22.865 1.00 0.00 O ATOM 651 OE2 GLU A 43 -13.796 -16.002 -22.029 1.00 0.00 O ATOM 0 H GLU A 43 -12.964 -10.117 -20.506 1.00 0.00 H new ATOM 0 HA GLU A 43 -15.590 -11.328 -21.196 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -13.988 -12.276 -22.646 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -12.711 -12.220 -21.447 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -13.782 -14.007 -20.132 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -15.197 -13.980 -21.165 1.00 0.00 H new ATOM 658 N SER A 44 -15.932 -12.053 -18.839 1.00 0.00 N ATOM 659 CA SER A 44 -16.138 -12.497 -17.468 1.00 0.00 C ATOM 660 C SER A 44 -17.287 -13.491 -17.380 1.00 0.00 C ATOM 661 O SER A 44 -18.118 -13.583 -18.284 1.00 0.00 O ATOM 662 CB SER A 44 -16.437 -11.294 -16.574 1.00 0.00 C ATOM 663 OG SER A 44 -16.006 -10.106 -17.225 1.00 0.00 O ATOM 0 H SER A 44 -16.787 -11.879 -19.367 1.00 0.00 H new ATOM 0 HA SER A 44 -15.227 -12.991 -17.131 1.00 0.00 H new ATOM 0 HB2 SER A 44 -17.505 -11.240 -16.363 1.00 0.00 H new ATOM 0 HB3 SER A 44 -15.928 -11.403 -15.616 1.00 0.00 H new ATOM 0 HG SER A 44 -16.787 -9.589 -17.514 1.00 0.00 H new ATOM 669 N GLU A 45 -17.326 -14.230 -16.279 1.00 0.00 N ATOM 670 CA GLU A 45 -18.370 -15.216 -16.065 1.00 0.00 C ATOM 671 C GLU A 45 -19.631 -14.543 -15.526 1.00 0.00 C ATOM 672 O GLU A 45 -20.682 -15.174 -15.411 1.00 0.00 O ATOM 673 CB GLU A 45 -17.873 -16.267 -15.075 1.00 0.00 C ATOM 674 CG GLU A 45 -16.379 -16.516 -15.309 1.00 0.00 C ATOM 675 CD GLU A 45 -16.036 -17.968 -14.995 1.00 0.00 C ATOM 676 OE1 GLU A 45 -16.766 -18.577 -14.231 1.00 0.00 O ATOM 677 OE2 GLU A 45 -15.048 -18.450 -15.524 1.00 0.00 O ATOM 0 H GLU A 45 -16.646 -14.163 -15.522 1.00 0.00 H new ATOM 0 HA GLU A 45 -18.613 -15.695 -17.013 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -18.041 -15.929 -14.053 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -18.432 -17.194 -15.200 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -16.122 -16.289 -16.344 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -15.788 -15.850 -14.680 1.00 0.00 H new ATOM 684 N HIS A 46 -19.517 -13.257 -15.204 1.00 0.00 N ATOM 685 CA HIS A 46 -20.653 -12.504 -14.685 1.00 0.00 C ATOM 686 C HIS A 46 -21.478 -11.932 -15.834 1.00 0.00 C ATOM 687 O HIS A 46 -22.572 -12.416 -16.126 1.00 0.00 O ATOM 688 CB HIS A 46 -20.160 -11.368 -13.784 1.00 0.00 C ATOM 689 CG HIS A 46 -20.503 -11.678 -12.352 1.00 0.00 C ATOM 690 ND1 HIS A 46 -19.546 -12.082 -11.434 1.00 0.00 N ATOM 691 CD2 HIS A 46 -21.693 -11.656 -11.667 1.00 0.00 C ATOM 692 CE1 HIS A 46 -20.171 -12.286 -10.260 1.00 0.00 C ATOM 693 NE2 HIS A 46 -21.481 -12.040 -10.347 1.00 0.00 N ATOM 0 H HIS A 46 -18.655 -12.718 -15.293 1.00 0.00 H new ATOM 0 HA HIS A 46 -21.281 -13.177 -14.101 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -19.082 -11.245 -13.893 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -20.620 -10.426 -14.084 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -22.649 -11.382 -12.089 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -19.674 -12.609 -9.357 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -22.176 -12.117 -9.605 1.00 0.00 H new ATOM 701 N SER A 47 -20.940 -10.908 -16.486 1.00 0.00 N ATOM 702 CA SER A 47 -21.625 -10.283 -17.614 1.00 0.00 C ATOM 703 C SER A 47 -22.534 -9.145 -17.153 1.00 0.00 C ATOM 704 O SER A 47 -23.610 -9.380 -16.604 1.00 0.00 O ATOM 705 CB SER A 47 -22.455 -11.328 -18.361 1.00 0.00 C ATOM 706 OG SER A 47 -21.847 -12.604 -18.213 1.00 0.00 O ATOM 0 H SER A 47 -20.037 -10.494 -16.256 1.00 0.00 H new ATOM 0 HA SER A 47 -20.867 -9.868 -18.278 1.00 0.00 H new ATOM 0 HB2 SER A 47 -23.472 -11.349 -17.969 1.00 0.00 H new ATOM 0 HB3 SER A 47 -22.526 -11.066 -19.417 1.00 0.00 H new ATOM 0 HG SER A 47 -20.929 -12.571 -18.555 1.00 0.00 H new ATOM 712 N MET A 48 -22.097 -7.913 -17.397 1.00 0.00 N ATOM 713 CA MET A 48 -22.882 -6.742 -17.020 1.00 0.00 C ATOM 714 C MET A 48 -22.973 -6.609 -15.506 1.00 0.00 C ATOM 715 O MET A 48 -24.062 -6.626 -14.932 1.00 0.00 O ATOM 716 CB MET A 48 -24.289 -6.845 -17.612 1.00 0.00 C ATOM 717 CG MET A 48 -24.960 -5.469 -17.587 1.00 0.00 C ATOM 718 SD MET A 48 -26.452 -5.542 -16.566 1.00 0.00 S ATOM 719 CE MET A 48 -26.972 -3.826 -16.807 1.00 0.00 C ATOM 0 H MET A 48 -21.209 -7.700 -17.851 1.00 0.00 H new ATOM 0 HA MET A 48 -22.383 -5.857 -17.415 1.00 0.00 H new ATOM 0 HB2 MET A 48 -24.237 -7.217 -18.635 1.00 0.00 H new ATOM 0 HB3 MET A 48 -24.882 -7.560 -17.043 1.00 0.00 H new ATOM 0 HG2 MET A 48 -24.271 -4.724 -17.189 1.00 0.00 H new ATOM 0 HG3 MET A 48 -25.215 -5.159 -18.600 1.00 0.00 H new ATOM 0 HE1 MET A 48 -27.894 -3.644 -16.254 1.00 0.00 H new ATOM 0 HE2 MET A 48 -26.193 -3.155 -16.444 1.00 0.00 H new ATOM 0 HE3 MET A 48 -27.143 -3.643 -17.868 1.00 0.00 H new ATOM 729 N ASP A 49 -21.821 -6.462 -14.867 1.00 0.00 N ATOM 730 CA ASP A 49 -21.768 -6.310 -13.420 1.00 0.00 C ATOM 731 C ASP A 49 -20.343 -5.992 -12.980 1.00 0.00 C ATOM 732 O ASP A 49 -20.126 -5.247 -12.026 1.00 0.00 O ATOM 733 CB ASP A 49 -22.246 -7.594 -12.736 1.00 0.00 C ATOM 734 CG ASP A 49 -23.592 -7.354 -12.060 1.00 0.00 C ATOM 735 OD1 ASP A 49 -24.309 -6.473 -12.506 1.00 0.00 O ATOM 736 OD2 ASP A 49 -23.887 -8.055 -11.106 1.00 0.00 O ATOM 0 H ASP A 49 -20.911 -6.445 -15.327 1.00 0.00 H new ATOM 0 HA ASP A 49 -22.423 -5.489 -13.131 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -22.336 -8.395 -13.470 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -21.512 -7.918 -11.998 1.00 0.00 H new ATOM 741 N THR A 50 -19.378 -6.576 -13.682 1.00 0.00 N ATOM 742 CA THR A 50 -17.972 -6.365 -13.359 1.00 0.00 C ATOM 743 C THR A 50 -17.448 -5.039 -13.914 1.00 0.00 C ATOM 744 O THR A 50 -16.784 -4.283 -13.206 1.00 0.00 O ATOM 745 CB THR A 50 -17.133 -7.514 -13.932 1.00 0.00 C ATOM 746 OG1 THR A 50 -15.853 -7.022 -14.301 1.00 0.00 O ATOM 747 CG2 THR A 50 -17.822 -8.100 -15.168 1.00 0.00 C ATOM 0 H THR A 50 -19.543 -7.196 -14.475 1.00 0.00 H new ATOM 0 HA THR A 50 -17.887 -6.334 -12.273 1.00 0.00 H new ATOM 0 HB THR A 50 -17.029 -8.292 -13.176 1.00 0.00 H new ATOM 0 HG1 THR A 50 -15.263 -7.774 -14.515 1.00 0.00 H new ATOM 0 HG21 THR A 50 -17.219 -8.915 -15.568 1.00 0.00 H new ATOM 0 HG22 THR A 50 -18.806 -8.478 -14.891 1.00 0.00 H new ATOM 0 HG23 THR A 50 -17.932 -7.324 -15.926 1.00 0.00 H new ATOM 755 N LEU A 51 -17.724 -4.778 -15.189 1.00 0.00 N ATOM 756 CA LEU A 51 -17.245 -3.556 -15.833 1.00 0.00 C ATOM 757 C LEU A 51 -17.878 -2.288 -15.255 1.00 0.00 C ATOM 758 O LEU A 51 -17.174 -1.333 -14.929 1.00 0.00 O ATOM 759 CB LEU A 51 -17.509 -3.614 -17.342 1.00 0.00 C ATOM 760 CG LEU A 51 -18.833 -4.331 -17.617 1.00 0.00 C ATOM 761 CD1 LEU A 51 -19.669 -3.503 -18.594 1.00 0.00 C ATOM 762 CD2 LEU A 51 -18.553 -5.705 -18.231 1.00 0.00 C ATOM 0 H LEU A 51 -18.272 -5.390 -15.793 1.00 0.00 H new ATOM 0 HA LEU A 51 -16.174 -3.503 -15.638 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -17.541 -2.605 -17.753 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -16.693 -4.136 -17.842 1.00 0.00 H new ATOM 0 HG LEU A 51 -19.378 -4.453 -16.681 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -20.612 -4.014 -18.790 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -19.870 -2.523 -18.161 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -19.122 -3.381 -19.529 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -19.496 -6.215 -18.427 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -18.007 -5.581 -19.166 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -17.956 -6.298 -17.538 1.00 0.00 H new ATOM 774 N LEU A 52 -19.205 -2.262 -15.168 1.00 0.00 N ATOM 775 CA LEU A 52 -19.904 -1.076 -14.675 1.00 0.00 C ATOM 776 C LEU A 52 -19.407 -0.640 -13.299 1.00 0.00 C ATOM 777 O LEU A 52 -19.134 0.540 -13.086 1.00 0.00 O ATOM 778 CB LEU A 52 -21.414 -1.330 -14.612 1.00 0.00 C ATOM 779 CG LEU A 52 -21.692 -2.773 -14.182 1.00 0.00 C ATOM 780 CD1 LEU A 52 -23.041 -2.836 -13.464 1.00 0.00 C ATOM 781 CD2 LEU A 52 -21.725 -3.694 -15.407 1.00 0.00 C ATOM 0 H LEU A 52 -19.813 -3.038 -15.429 1.00 0.00 H new ATOM 0 HA LEU A 52 -19.693 -0.272 -15.379 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -21.877 -0.638 -13.909 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -21.863 -1.141 -15.587 1.00 0.00 H new ATOM 0 HG LEU A 52 -20.899 -3.103 -13.511 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -23.242 -3.862 -13.157 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -23.016 -2.192 -12.585 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -23.828 -2.499 -14.138 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -21.923 -4.717 -15.088 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -22.512 -3.367 -16.087 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -20.763 -3.654 -15.919 1.00 0.00 H new ATOM 793 N ALA A 53 -19.303 -1.574 -12.361 1.00 0.00 N ATOM 794 CA ALA A 53 -18.856 -1.222 -11.016 1.00 0.00 C ATOM 795 C ALA A 53 -17.495 -0.533 -11.056 1.00 0.00 C ATOM 796 O ALA A 53 -17.305 0.519 -10.445 1.00 0.00 O ATOM 797 CB ALA A 53 -18.768 -2.480 -10.151 1.00 0.00 C ATOM 0 H ALA A 53 -19.517 -2.562 -12.500 1.00 0.00 H new ATOM 0 HA ALA A 53 -19.582 -0.532 -10.586 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -18.434 -2.210 -9.149 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -19.750 -2.950 -10.092 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -18.058 -3.178 -10.595 1.00 0.00 H new ATOM 803 N THR A 54 -16.554 -1.126 -11.780 1.00 0.00 N ATOM 804 CA THR A 54 -15.217 -0.553 -11.894 1.00 0.00 C ATOM 805 C THR A 54 -15.237 0.721 -12.737 1.00 0.00 C ATOM 806 O THR A 54 -14.667 1.742 -12.355 1.00 0.00 O ATOM 807 CB THR A 54 -14.266 -1.575 -12.523 1.00 0.00 C ATOM 808 OG1 THR A 54 -14.093 -2.662 -11.625 1.00 0.00 O ATOM 809 CG2 THR A 54 -12.910 -0.922 -12.799 1.00 0.00 C ATOM 0 H THR A 54 -16.689 -1.997 -12.294 1.00 0.00 H new ATOM 0 HA THR A 54 -14.868 -0.297 -10.894 1.00 0.00 H new ATOM 0 HB THR A 54 -14.687 -1.933 -13.462 1.00 0.00 H new ATOM 0 HG1 THR A 54 -13.570 -2.367 -10.851 1.00 0.00 H new ATOM 0 HG21 THR A 54 -12.238 -1.654 -13.246 1.00 0.00 H new ATOM 0 HG22 THR A 54 -13.042 -0.085 -13.484 1.00 0.00 H new ATOM 0 HG23 THR A 54 -12.483 -0.561 -11.863 1.00 0.00 H new ATOM 817 N LEU A 55 -15.882 0.644 -13.894 1.00 0.00 N ATOM 818 CA LEU A 55 -15.960 1.781 -14.800 1.00 0.00 C ATOM 819 C LEU A 55 -16.636 2.980 -14.136 1.00 0.00 C ATOM 820 O LEU A 55 -16.160 4.110 -14.251 1.00 0.00 O ATOM 821 CB LEU A 55 -16.730 1.371 -16.056 1.00 0.00 C ATOM 822 CG LEU A 55 -15.887 0.378 -16.862 1.00 0.00 C ATOM 823 CD1 LEU A 55 -16.681 -0.115 -18.072 1.00 0.00 C ATOM 824 CD2 LEU A 55 -14.610 1.070 -17.341 1.00 0.00 C ATOM 0 H LEU A 55 -16.359 -0.194 -14.227 1.00 0.00 H new ATOM 0 HA LEU A 55 -14.947 2.081 -15.067 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -17.683 0.918 -15.781 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -16.957 2.249 -16.661 1.00 0.00 H new ATOM 0 HG LEU A 55 -15.631 -0.472 -16.230 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -16.076 -0.821 -18.641 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -17.592 -0.609 -17.733 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -16.942 0.733 -18.706 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -14.008 0.366 -17.915 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -14.871 1.921 -17.970 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -14.039 1.417 -16.480 1.00 0.00 H new ATOM 836 N LYS A 56 -17.744 2.734 -13.445 1.00 0.00 N ATOM 837 CA LYS A 56 -18.468 3.811 -12.776 1.00 0.00 C ATOM 838 C LYS A 56 -17.606 4.468 -11.700 1.00 0.00 C ATOM 839 O LYS A 56 -17.712 5.670 -11.458 1.00 0.00 O ATOM 840 CB LYS A 56 -19.744 3.264 -12.133 1.00 0.00 C ATOM 841 CG LYS A 56 -20.787 4.379 -12.048 1.00 0.00 C ATOM 842 CD LYS A 56 -21.331 4.672 -13.449 1.00 0.00 C ATOM 843 CE LYS A 56 -22.819 4.326 -13.503 1.00 0.00 C ATOM 844 NZ LYS A 56 -23.506 4.887 -12.304 1.00 0.00 N ATOM 0 H LYS A 56 -18.158 1.808 -13.333 1.00 0.00 H new ATOM 0 HA LYS A 56 -18.723 4.560 -13.526 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -20.132 2.432 -12.720 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -19.526 2.878 -11.137 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -21.600 4.083 -11.385 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -20.341 5.278 -11.623 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -21.182 5.723 -13.695 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -20.785 4.090 -14.191 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -23.264 4.730 -14.412 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -22.950 3.244 -13.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -24.465 5.194 -12.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -23.565 4.158 -11.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -22.968 5.701 -11.945 1.00 0.00 H new ATOM 858 N LYS A 57 -16.767 3.671 -11.049 1.00 0.00 N ATOM 859 CA LYS A 57 -15.906 4.188 -9.992 1.00 0.00 C ATOM 860 C LYS A 57 -15.449 5.611 -10.296 1.00 0.00 C ATOM 861 O LYS A 57 -15.535 6.492 -9.440 1.00 0.00 O ATOM 862 CB LYS A 57 -14.686 3.285 -9.815 1.00 0.00 C ATOM 863 CG LYS A 57 -14.388 3.121 -8.323 1.00 0.00 C ATOM 864 CD LYS A 57 -13.965 4.470 -7.735 1.00 0.00 C ATOM 865 CE LYS A 57 -13.206 4.238 -6.428 1.00 0.00 C ATOM 866 NZ LYS A 57 -13.280 5.465 -5.585 1.00 0.00 N ATOM 0 H LYS A 57 -16.665 2.673 -11.232 1.00 0.00 H new ATOM 0 HA LYS A 57 -16.485 4.202 -9.069 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -14.871 2.312 -10.269 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -13.824 3.716 -10.324 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -15.271 2.747 -7.804 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -13.597 2.385 -8.178 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -13.335 5.007 -8.444 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -14.842 5.091 -7.554 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -13.633 3.390 -5.893 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -12.165 3.991 -6.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -12.764 5.307 -4.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -12.853 6.264 -6.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -14.275 5.682 -5.374 1.00 0.00 H new ATOM 880 N THR A 58 -14.956 5.839 -11.512 1.00 0.00 N ATOM 881 CA THR A 58 -14.488 7.168 -11.890 1.00 0.00 C ATOM 882 C THR A 58 -15.648 8.035 -12.375 1.00 0.00 C ATOM 883 O THR A 58 -15.536 9.259 -12.433 1.00 0.00 O ATOM 884 CB THR A 58 -13.427 7.062 -12.991 1.00 0.00 C ATOM 885 OG1 THR A 58 -13.239 5.696 -13.335 1.00 0.00 O ATOM 886 CG2 THR A 58 -12.106 7.651 -12.491 1.00 0.00 C ATOM 0 H THR A 58 -14.871 5.131 -12.242 1.00 0.00 H new ATOM 0 HA THR A 58 -14.048 7.636 -11.009 1.00 0.00 H new ATOM 0 HB THR A 58 -13.759 7.616 -13.869 1.00 0.00 H new ATOM 0 HG1 THR A 58 -13.135 5.615 -14.306 1.00 0.00 H new ATOM 0 HG21 THR A 58 -11.353 7.574 -13.276 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.251 8.699 -12.228 1.00 0.00 H new ATOM 0 HG23 THR A 58 -11.771 7.100 -11.612 1.00 0.00 H new ATOM 894 N GLY A 59 -16.763 7.396 -12.717 1.00 0.00 N ATOM 895 CA GLY A 59 -17.933 8.130 -13.186 1.00 0.00 C ATOM 896 C GLY A 59 -18.025 8.113 -14.709 1.00 0.00 C ATOM 897 O GLY A 59 -18.755 8.907 -15.303 1.00 0.00 O ATOM 0 H GLY A 59 -16.881 6.384 -12.679 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -18.835 7.691 -12.760 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -17.884 9.160 -12.834 1.00 0.00 H new ATOM 901 N ALA A 60 -17.283 7.208 -15.336 1.00 0.00 N ATOM 902 CA ALA A 60 -17.293 7.105 -16.791 1.00 0.00 C ATOM 903 C ALA A 60 -18.570 6.428 -17.272 1.00 0.00 C ATOM 904 O ALA A 60 -19.045 5.470 -16.662 1.00 0.00 O ATOM 905 CB ALA A 60 -16.081 6.302 -17.264 1.00 0.00 C ATOM 0 H ALA A 60 -16.672 6.540 -14.866 1.00 0.00 H new ATOM 0 HA ALA A 60 -17.250 8.111 -17.208 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -16.095 6.229 -18.351 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -15.166 6.802 -16.945 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -16.117 5.302 -16.833 1.00 0.00 H new ATOM 911 N THR A 61 -19.120 6.930 -18.374 1.00 0.00 N ATOM 912 CA THR A 61 -20.342 6.362 -18.930 1.00 0.00 C ATOM 913 C THR A 61 -20.089 4.939 -19.410 1.00 0.00 C ATOM 914 O THR A 61 -19.044 4.647 -19.992 1.00 0.00 O ATOM 915 CB THR A 61 -20.836 7.221 -20.096 1.00 0.00 C ATOM 916 OG1 THR A 61 -22.003 6.632 -20.654 1.00 0.00 O ATOM 917 CG2 THR A 61 -19.748 7.311 -21.169 1.00 0.00 C ATOM 0 H THR A 61 -18.742 7.722 -18.895 1.00 0.00 H new ATOM 0 HA THR A 61 -21.105 6.343 -18.151 1.00 0.00 H new ATOM 0 HB THR A 61 -21.068 8.223 -19.734 1.00 0.00 H new ATOM 0 HG1 THR A 61 -22.322 7.182 -21.400 1.00 0.00 H new ATOM 0 HG21 THR A 61 -20.104 7.923 -21.997 1.00 0.00 H new ATOM 0 HG22 THR A 61 -18.853 7.763 -20.742 1.00 0.00 H new ATOM 0 HG23 THR A 61 -19.512 6.311 -21.532 1.00 0.00 H new ATOM 925 N VAL A 62 -21.046 4.056 -19.159 1.00 0.00 N ATOM 926 CA VAL A 62 -20.908 2.665 -19.567 1.00 0.00 C ATOM 927 C VAL A 62 -22.139 2.204 -20.339 1.00 0.00 C ATOM 928 O VAL A 62 -23.272 2.459 -19.931 1.00 0.00 O ATOM 929 CB VAL A 62 -20.712 1.778 -18.337 1.00 0.00 C ATOM 930 CG1 VAL A 62 -20.543 0.323 -18.777 1.00 0.00 C ATOM 931 CG2 VAL A 62 -19.461 2.229 -17.576 1.00 0.00 C ATOM 0 H VAL A 62 -21.919 4.275 -18.679 1.00 0.00 H new ATOM 0 HA VAL A 62 -20.037 2.583 -20.217 1.00 0.00 H new ATOM 0 HB VAL A 62 -21.583 1.862 -17.688 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -20.403 -0.309 -17.900 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -21.433 0.001 -19.318 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -19.672 0.238 -19.427 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -19.321 1.597 -16.699 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -18.590 2.146 -18.226 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -19.581 3.266 -17.261 1.00 0.00 H new ATOM 941 N SER A 63 -21.908 1.521 -21.455 1.00 0.00 N ATOM 942 CA SER A 63 -23.003 1.024 -22.279 1.00 0.00 C ATOM 943 C SER A 63 -22.710 -0.396 -22.755 1.00 0.00 C ATOM 944 O SER A 63 -21.615 -0.684 -23.236 1.00 0.00 O ATOM 945 CB SER A 63 -23.200 1.939 -23.488 1.00 0.00 C ATOM 946 OG SER A 63 -24.424 2.647 -23.347 1.00 0.00 O ATOM 0 H SER A 63 -20.977 1.300 -21.808 1.00 0.00 H new ATOM 0 HA SER A 63 -23.913 1.014 -21.679 1.00 0.00 H new ATOM 0 HB2 SER A 63 -22.369 2.639 -23.568 1.00 0.00 H new ATOM 0 HB3 SER A 63 -23.210 1.351 -24.406 1.00 0.00 H new ATOM 0 HG SER A 63 -24.552 3.236 -24.120 1.00 0.00 H new ATOM 952 N TYR A 64 -23.693 -1.280 -22.620 1.00 0.00 N ATOM 953 CA TYR A 64 -23.524 -2.664 -23.043 1.00 0.00 C ATOM 954 C TYR A 64 -23.854 -2.814 -24.523 1.00 0.00 C ATOM 955 O TYR A 64 -24.859 -2.289 -25.003 1.00 0.00 O ATOM 956 CB TYR A 64 -24.430 -3.584 -22.223 1.00 0.00 C ATOM 957 CG TYR A 64 -25.809 -3.608 -22.837 1.00 0.00 C ATOM 958 CD1 TYR A 64 -26.709 -2.568 -22.579 1.00 0.00 C ATOM 959 CD2 TYR A 64 -26.185 -4.671 -23.666 1.00 0.00 C ATOM 960 CE1 TYR A 64 -27.988 -2.591 -23.150 1.00 0.00 C ATOM 961 CE2 TYR A 64 -27.464 -4.694 -24.238 1.00 0.00 C ATOM 962 CZ TYR A 64 -28.364 -3.654 -23.979 1.00 0.00 C ATOM 963 OH TYR A 64 -29.625 -3.675 -24.543 1.00 0.00 O ATOM 0 H TYR A 64 -24.608 -1.065 -22.224 1.00 0.00 H new ATOM 0 HA TYR A 64 -22.484 -2.945 -22.880 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -24.015 -4.591 -22.196 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -24.485 -3.234 -21.192 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -26.418 -1.748 -21.940 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -25.490 -5.473 -23.865 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -28.683 -1.789 -22.951 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -27.755 -5.514 -24.878 1.00 0.00 H new ATOM 0 HH TYR A 64 -29.724 -4.481 -25.092 1.00 0.00 H new ATOM 973 N LEU A 65 -23.003 -3.536 -25.238 1.00 0.00 N ATOM 974 CA LEU A 65 -23.210 -3.753 -26.665 1.00 0.00 C ATOM 975 C LEU A 65 -23.866 -5.108 -26.911 1.00 0.00 C ATOM 976 O LEU A 65 -24.676 -5.259 -27.825 1.00 0.00 O ATOM 977 CB LEU A 65 -21.871 -3.688 -27.400 1.00 0.00 C ATOM 978 CG LEU A 65 -21.155 -2.383 -27.045 1.00 0.00 C ATOM 979 CD1 LEU A 65 -19.695 -2.470 -27.488 1.00 0.00 C ATOM 980 CD2 LEU A 65 -21.836 -1.211 -27.759 1.00 0.00 C ATOM 0 H LEU A 65 -22.167 -3.980 -24.857 1.00 0.00 H new ATOM 0 HA LEU A 65 -23.869 -2.971 -27.043 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -21.251 -4.541 -27.125 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -22.032 -3.745 -28.477 1.00 0.00 H new ATOM 0 HG LEU A 65 -21.202 -2.225 -25.968 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -19.182 -1.542 -27.236 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -19.209 -3.302 -26.979 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -19.651 -2.628 -28.566 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -21.324 -0.283 -27.504 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -21.791 -1.366 -28.837 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -22.878 -1.149 -27.444 1.00 0.00 H new ATOM 992 N GLY A 66 -23.510 -6.091 -26.090 1.00 0.00 N ATOM 993 CA GLY A 66 -24.071 -7.430 -26.229 1.00 0.00 C ATOM 994 C GLY A 66 -23.071 -8.488 -25.775 1.00 0.00 C ATOM 995 O GLY A 66 -21.963 -8.163 -25.346 1.00 0.00 O ATOM 0 H GLY A 66 -22.841 -5.987 -25.327 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -24.984 -7.509 -25.639 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -24.347 -7.607 -27.268 1.00 0.00 H new ATOM 999 N LEU A 67 -23.467 -9.753 -25.870 1.00 0.00 N ATOM 1000 CA LEU A 67 -22.593 -10.847 -25.464 1.00 0.00 C ATOM 1001 C LEU A 67 -22.175 -11.676 -26.674 1.00 0.00 C ATOM 1002 O LEU A 67 -22.987 -11.959 -27.555 1.00 0.00 O ATOM 1003 CB LEU A 67 -23.312 -11.743 -24.453 1.00 0.00 C ATOM 1004 CG LEU A 67 -23.442 -11.003 -23.121 1.00 0.00 C ATOM 1005 CD1 LEU A 67 -24.409 -9.828 -23.283 1.00 0.00 C ATOM 1006 CD2 LEU A 67 -23.980 -11.963 -22.056 1.00 0.00 C ATOM 0 H LEU A 67 -24.379 -10.044 -26.221 1.00 0.00 H new ATOM 0 HA LEU A 67 -21.701 -10.422 -25.003 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -24.299 -12.015 -24.828 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -22.757 -12.671 -24.314 1.00 0.00 H new ATOM 0 HG LEU A 67 -22.465 -10.630 -22.815 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -24.502 -9.300 -22.334 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -24.028 -9.145 -24.042 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -25.387 -10.201 -23.588 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -24.073 -11.437 -21.106 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -24.958 -12.335 -22.362 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -23.293 -12.801 -21.941 1.00 0.00 H new ATOM 1018 N GLU A 68 -20.904 -12.059 -26.710 1.00 0.00 N ATOM 1019 CA GLU A 68 -20.388 -12.854 -27.819 1.00 0.00 C ATOM 1020 C GLU A 68 -21.072 -14.216 -27.868 1.00 0.00 C ATOM 1021 O GLU A 68 -21.428 -14.640 -28.955 1.00 0.00 O ATOM 1022 CB GLU A 68 -18.878 -13.047 -27.665 1.00 0.00 C ATOM 1023 CG GLU A 68 -18.252 -13.283 -29.040 1.00 0.00 C ATOM 1024 CD GLU A 68 -17.915 -11.949 -29.699 1.00 0.00 C ATOM 1025 OE1 GLU A 68 -16.954 -11.329 -29.276 1.00 0.00 O ATOM 1026 OE2 GLU A 68 -18.624 -11.568 -30.616 1.00 0.00 O ATOM 1027 OXT GLU A 68 -21.232 -14.814 -26.817 1.00 0.00 O ATOM 0 H GLU A 68 -20.216 -11.835 -25.991 1.00 0.00 H new ATOM 0 HA GLU A 68 -20.595 -12.322 -28.748 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -18.434 -12.168 -27.197 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -18.674 -13.894 -27.010 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -17.349 -13.886 -28.939 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -18.941 -13.845 -29.670 1.00 0.00 H new TER 1034 GLU A 68