USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 950 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 921 SER OG : rot -120:sc= 1.75 USER MOD Set 1.2: A 939 TYR OH : rot 15:sc= 0.654 USER MOD Set 2.1: A 887 THR OG1 : rot 160:sc= 0 USER MOD Set 2.2: A 919 MET CE :methyl -111:sc= -0.0898 (180deg=-1.44!) USER MOD Set 3.1: A 868 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 3.2: A 896 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 850 GLN : amide:sc= 0.694 K(o=1.6,f=-4.9) USER MOD Set 4.2: A 852 LYS NZ :NH3+ -135:sc= 0.954 (180deg=-0.972) USER MOD Single : A 825 MET CE :methyl -162:sc= 0 (180deg=-0.524) USER MOD Single : A 826 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 833 HIS : no HD1:sc= -0.0209 X(o=-0.021,f=-0.25) USER MOD Single : A 836 ASN : amide:sc= -0.816 K(o=-0.82,f=-2) USER MOD Single : A 843 GLN : amide:sc= -0.154 X(o=-0.15,f=-0.01) USER MOD Single : A 846 SER OG : rot 68:sc= 1.02 USER MOD Single : A 849 TYR OH : rot 30:sc= -0.0261 USER MOD Single : A 851 CYS SG : rot -43:sc= 0.347 USER MOD Single : A 853 THR OG1 : rot 180:sc= 0.033 USER MOD Single : A 855 ASN : amide:sc= -1.35! X(o=-1.4!,f=-1.7) USER MOD Single : A 862 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 865 SER OG : rot 74:sc= 1.21 USER MOD Single : A 866 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 867 ASN : amide:sc= 0.902 K(o=0.9,f=-0.0049) USER MOD Single : A 874 SER OG : rot 180:sc= 0.0533 USER MOD Single : A 884 TYR OH : rot 180:sc= 0 USER MOD Single : A 888 GLN : amide:sc= -1.69! C(o=-1.7!,f=-4.9!) USER MOD Single : A 892 GLN : amide:sc= -0.162 K(o=-0.16,f=-7.2!) USER MOD Single : A 903 THR OG1 : rot 140:sc= 1.21 USER MOD Single : A 905 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 911 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 912 GLN : amide:sc= -0.843 K(o=-0.84,f=-2.7!) USER MOD Single : A 914 CYS SG : rot 62:sc= 1.25 USER MOD Single : A 917 SER OG : rot 92:sc= 0.206 USER MOD Single : A 922 CYS SG : rot 180:sc= 0 USER MOD Single : A 924 SER OG : rot 180:sc= 0 USER MOD Single : A 925 LYS NZ :NH3+ -134:sc= 1.54! (180deg=-2.67!) USER MOD Single : A 928 THR OG1 : rot 180:sc= 0.12 USER MOD Single : A 933 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 934 GLN : amide:sc= -0.0714 X(o=-0.071,f=0) USER MOD Single : A 935 THR OG1 : rot 180:sc= 0.0844 USER MOD Single : A 937 THR OG1 : rot 95:sc= 1.22 USER MOD Single : A 945 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 946 SER OG : rot 81:sc= 1.3 USER MOD ----------------------------------------------------------------- ATOM 112 N MET A 825 -8.723 -9.110 -21.572 1.00 0.74 N ATOM 113 CA MET A 825 -9.682 -9.472 -22.600 1.00 0.64 C ATOM 114 C MET A 825 -9.512 -10.933 -22.974 1.00 0.57 C ATOM 115 O MET A 825 -8.445 -11.339 -23.439 1.00 0.64 O ATOM 116 CB MET A 825 -9.506 -8.591 -23.834 1.00 0.76 C ATOM 117 CG MET A 825 -10.800 -7.955 -24.317 1.00 0.93 C ATOM 118 SD MET A 825 -12.252 -8.949 -23.928 1.00 1.60 S ATOM 119 CE MET A 825 -13.087 -7.873 -22.765 1.00 1.90 C ATOM 0 HA MET A 825 -10.687 -9.318 -22.207 1.00 0.64 H new ATOM 0 HB2 MET A 825 -8.786 -7.804 -23.609 1.00 0.76 H new ATOM 0 HB3 MET A 825 -9.082 -9.190 -24.640 1.00 0.76 H new ATOM 0 HG2 MET A 825 -10.907 -6.970 -23.863 1.00 0.93 H new ATOM 0 HG3 MET A 825 -10.746 -7.805 -25.395 1.00 0.93 H new ATOM 0 HE1 MET A 825 -13.815 -8.450 -22.194 1.00 1.90 H new ATOM 0 HE2 MET A 825 -12.356 -7.435 -22.085 1.00 1.90 H new ATOM 0 HE3 MET A 825 -13.599 -7.078 -23.308 1.00 1.90 H new ATOM 129 N MET A 826 -10.556 -11.719 -22.768 1.00 0.51 N ATOM 130 CA MET A 826 -10.502 -13.136 -23.083 1.00 0.49 C ATOM 131 C MET A 826 -11.145 -13.396 -24.430 1.00 0.43 C ATOM 132 O MET A 826 -12.351 -13.207 -24.606 1.00 0.50 O ATOM 133 CB MET A 826 -11.179 -13.989 -22.000 1.00 0.60 C ATOM 134 CG MET A 826 -12.089 -13.217 -21.057 1.00 1.14 C ATOM 135 SD MET A 826 -12.860 -14.278 -19.819 1.00 1.62 S ATOM 136 CE MET A 826 -11.608 -14.260 -18.539 1.00 1.93 C ATOM 0 H MET A 826 -11.447 -11.401 -22.386 1.00 0.51 H new ATOM 0 HA MET A 826 -9.452 -13.425 -23.121 1.00 0.49 H new ATOM 0 HB2 MET A 826 -11.762 -14.772 -22.485 1.00 0.60 H new ATOM 0 HB3 MET A 826 -10.407 -14.485 -21.412 1.00 0.60 H new ATOM 0 HG2 MET A 826 -11.512 -12.439 -20.556 1.00 1.14 H new ATOM 0 HG3 MET A 826 -12.865 -12.716 -21.635 1.00 1.14 H new ATOM 0 HE1 MET A 826 -11.937 -14.873 -17.700 1.00 1.93 H new ATOM 0 HE2 MET A 826 -10.675 -14.659 -18.937 1.00 1.93 H new ATOM 0 HE3 MET A 826 -11.449 -13.236 -18.200 1.00 1.93 H new ATOM 146 N ILE A 827 -10.326 -13.808 -25.380 1.00 0.36 N ATOM 147 CA ILE A 827 -10.785 -14.121 -26.720 1.00 0.34 C ATOM 148 C ILE A 827 -10.685 -15.622 -26.961 1.00 0.34 C ATOM 149 O ILE A 827 -9.708 -16.254 -26.571 1.00 0.37 O ATOM 150 CB ILE A 827 -9.962 -13.380 -27.797 1.00 0.35 C ATOM 151 CG1 ILE A 827 -9.431 -12.041 -27.261 1.00 0.37 C ATOM 152 CG2 ILE A 827 -10.803 -13.168 -29.048 1.00 0.43 C ATOM 153 CD1 ILE A 827 -10.486 -10.960 -27.145 1.00 0.47 C ATOM 0 H ILE A 827 -9.323 -13.935 -25.244 1.00 0.36 H new ATOM 0 HA ILE A 827 -11.821 -13.793 -26.797 1.00 0.34 H new ATOM 0 HB ILE A 827 -9.102 -13.997 -28.058 1.00 0.35 H new ATOM 0 HG12 ILE A 827 -8.985 -12.206 -26.280 1.00 0.37 H new ATOM 0 HG13 ILE A 827 -8.636 -11.689 -27.918 1.00 0.37 H new ATOM 0 HG21 ILE A 827 -10.212 -12.645 -29.800 1.00 0.43 H new ATOM 0 HG22 ILE A 827 -11.118 -14.134 -29.442 1.00 0.43 H new ATOM 0 HG23 ILE A 827 -11.682 -12.573 -28.799 1.00 0.43 H new ATOM 0 HD11 ILE A 827 -10.031 -10.047 -26.760 1.00 0.47 H new ATOM 0 HD12 ILE A 827 -10.916 -10.764 -28.127 1.00 0.47 H new ATOM 0 HD13 ILE A 827 -11.271 -11.289 -26.464 1.00 0.47 H new ATOM 165 N LEU A 828 -11.702 -16.185 -27.590 1.00 0.34 N ATOM 166 CA LEU A 828 -11.749 -17.617 -27.843 1.00 0.35 C ATOM 167 C LEU A 828 -11.215 -17.937 -29.228 1.00 0.36 C ATOM 168 O LEU A 828 -11.769 -17.490 -30.232 1.00 0.40 O ATOM 169 CB LEU A 828 -13.188 -18.125 -27.729 1.00 0.44 C ATOM 170 CG LEU A 828 -13.406 -19.292 -26.765 1.00 0.62 C ATOM 171 CD1 LEU A 828 -14.884 -19.636 -26.683 1.00 1.37 C ATOM 172 CD2 LEU A 828 -12.598 -20.508 -27.196 1.00 1.16 C ATOM 0 H LEU A 828 -12.511 -15.670 -27.937 1.00 0.34 H new ATOM 0 HA LEU A 828 -11.125 -18.112 -27.099 1.00 0.35 H new ATOM 0 HB2 LEU A 828 -13.823 -17.296 -27.416 1.00 0.44 H new ATOM 0 HB3 LEU A 828 -13.526 -18.428 -28.720 1.00 0.44 H new ATOM 0 HG LEU A 828 -13.062 -18.990 -25.776 1.00 0.62 H new ATOM 0 HD11 LEU A 828 -15.026 -20.468 -25.994 1.00 1.37 H new ATOM 0 HD12 LEU A 828 -15.440 -18.769 -26.325 1.00 1.37 H new ATOM 0 HD13 LEU A 828 -15.247 -19.917 -27.671 1.00 1.37 H new ATOM 0 HD21 LEU A 828 -12.769 -21.325 -26.495 1.00 1.16 H new ATOM 0 HD22 LEU A 828 -12.908 -20.815 -28.195 1.00 1.16 H new ATOM 0 HD23 LEU A 828 -11.538 -20.255 -27.207 1.00 1.16 H new ATOM 184 N VAL A 829 -10.145 -18.710 -29.280 1.00 0.39 N ATOM 185 CA VAL A 829 -9.619 -19.183 -30.545 1.00 0.44 C ATOM 186 C VAL A 829 -10.047 -20.635 -30.755 1.00 0.43 C ATOM 187 O VAL A 829 -9.409 -21.569 -30.264 1.00 0.43 O ATOM 188 CB VAL A 829 -8.078 -19.057 -30.625 1.00 0.52 C ATOM 189 CG1 VAL A 829 -7.683 -17.636 -30.986 1.00 0.97 C ATOM 190 CG2 VAL A 829 -7.413 -19.468 -29.320 1.00 1.06 C ATOM 0 H VAL A 829 -9.624 -19.023 -28.460 1.00 0.39 H new ATOM 0 HA VAL A 829 -10.027 -18.555 -31.337 1.00 0.44 H new ATOM 0 HB VAL A 829 -7.732 -19.735 -31.405 1.00 0.52 H new ATOM 0 HG11 VAL A 829 -6.597 -17.563 -31.039 1.00 0.97 H new ATOM 0 HG12 VAL A 829 -8.112 -17.374 -31.953 1.00 0.97 H new ATOM 0 HG13 VAL A 829 -8.057 -16.950 -30.226 1.00 0.97 H new ATOM 0 HG21 VAL A 829 -6.332 -19.366 -29.415 1.00 1.06 H new ATOM 0 HG22 VAL A 829 -7.768 -18.827 -28.513 1.00 1.06 H new ATOM 0 HG23 VAL A 829 -7.661 -20.505 -29.096 1.00 1.06 H new ATOM 200 N VAL A 830 -11.147 -20.805 -31.472 1.00 0.46 N ATOM 201 CA VAL A 830 -11.743 -22.118 -31.667 1.00 0.50 C ATOM 202 C VAL A 830 -11.576 -22.569 -33.105 1.00 0.61 C ATOM 203 O VAL A 830 -12.484 -22.413 -33.913 1.00 1.07 O ATOM 204 CB VAL A 830 -13.248 -22.127 -31.316 1.00 0.53 C ATOM 205 CG1 VAL A 830 -13.539 -23.180 -30.270 1.00 0.97 C ATOM 206 CG2 VAL A 830 -13.719 -20.761 -30.835 1.00 0.80 C ATOM 0 H VAL A 830 -11.648 -20.045 -31.931 1.00 0.46 H new ATOM 0 HA VAL A 830 -11.224 -22.803 -30.996 1.00 0.50 H new ATOM 0 HB VAL A 830 -13.798 -22.368 -32.226 1.00 0.53 H new ATOM 0 HG11 VAL A 830 -14.603 -23.174 -30.034 1.00 0.97 H new ATOM 0 HG12 VAL A 830 -13.258 -24.161 -30.653 1.00 0.97 H new ATOM 0 HG13 VAL A 830 -12.966 -22.965 -29.368 1.00 0.97 H new ATOM 0 HG21 VAL A 830 -14.782 -20.805 -30.597 1.00 0.80 H new ATOM 0 HG22 VAL A 830 -13.160 -20.476 -29.944 1.00 0.80 H new ATOM 0 HG23 VAL A 830 -13.553 -20.022 -31.619 1.00 0.80 H new ATOM 216 N ASP A 831 -10.431 -23.150 -33.411 1.00 0.36 N ATOM 217 CA ASP A 831 -10.086 -23.460 -34.795 1.00 0.37 C ATOM 218 C ASP A 831 -10.197 -24.959 -35.067 1.00 0.42 C ATOM 219 O ASP A 831 -10.090 -25.772 -34.149 1.00 0.52 O ATOM 220 CB ASP A 831 -8.676 -22.948 -35.110 1.00 0.44 C ATOM 221 CG ASP A 831 -7.854 -23.936 -35.909 1.00 0.64 C ATOM 222 OD1 ASP A 831 -7.918 -23.902 -37.158 1.00 1.30 O ATOM 223 OD2 ASP A 831 -7.163 -24.766 -35.287 1.00 1.27 O ATOM 0 H ASP A 831 -9.724 -23.418 -32.727 1.00 0.36 H new ATOM 0 HA ASP A 831 -10.795 -22.955 -35.451 1.00 0.37 H new ATOM 0 HB2 ASP A 831 -8.750 -22.013 -35.665 1.00 0.44 H new ATOM 0 HB3 ASP A 831 -8.159 -22.725 -34.177 1.00 0.44 H new ATOM 228 N ASP A 832 -10.419 -25.314 -36.332 1.00 0.48 N ATOM 229 CA ASP A 832 -10.608 -26.709 -36.732 1.00 0.61 C ATOM 230 C ASP A 832 -9.303 -27.383 -37.180 1.00 0.66 C ATOM 231 O ASP A 832 -9.221 -28.611 -37.210 1.00 0.98 O ATOM 232 CB ASP A 832 -11.658 -26.803 -37.848 1.00 0.78 C ATOM 233 CG ASP A 832 -11.098 -26.509 -39.232 1.00 1.21 C ATOM 234 OD1 ASP A 832 -10.390 -25.492 -39.399 1.00 2.03 O ATOM 235 OD2 ASP A 832 -11.378 -27.285 -40.167 1.00 1.51 O ATOM 0 H ASP A 832 -10.473 -24.649 -37.104 1.00 0.48 H new ATOM 0 HA ASP A 832 -10.957 -27.245 -35.850 1.00 0.61 H new ATOM 0 HB2 ASP A 832 -12.092 -27.803 -37.845 1.00 0.78 H new ATOM 0 HB3 ASP A 832 -12.467 -26.104 -37.635 1.00 0.78 H new ATOM 240 N HIS A 833 -8.286 -26.596 -37.512 1.00 0.61 N ATOM 241 CA HIS A 833 -7.022 -27.142 -38.010 1.00 0.74 C ATOM 242 C HIS A 833 -5.850 -26.602 -37.199 1.00 0.75 C ATOM 243 O HIS A 833 -5.463 -25.448 -37.364 1.00 1.20 O ATOM 244 CB HIS A 833 -6.833 -26.802 -39.490 1.00 0.93 C ATOM 245 CG HIS A 833 -7.754 -27.547 -40.407 1.00 1.10 C ATOM 246 ND1 HIS A 833 -8.062 -28.878 -40.256 1.00 1.87 N ATOM 247 CD2 HIS A 833 -8.442 -27.129 -41.492 1.00 1.47 C ATOM 248 CE1 HIS A 833 -8.899 -29.246 -41.205 1.00 2.12 C ATOM 249 NE2 HIS A 833 -9.150 -28.202 -41.975 1.00 1.84 N ATOM 0 H HIS A 833 -8.309 -25.578 -37.447 1.00 0.61 H new ATOM 0 HA HIS A 833 -7.055 -28.226 -37.902 1.00 0.74 H new ATOM 0 HB2 HIS A 833 -6.985 -25.732 -39.629 1.00 0.93 H new ATOM 0 HB3 HIS A 833 -5.803 -27.017 -39.773 1.00 0.93 H new ATOM 0 HD2 HIS A 833 -8.436 -26.131 -41.905 1.00 1.47 H new ATOM 0 HE1 HIS A 833 -9.311 -30.236 -41.332 1.00 2.12 H new ATOM 0 HE2 HIS A 833 -9.765 -28.194 -42.789 1.00 1.84 H new ATOM 258 N PRO A 834 -5.240 -27.464 -36.358 1.00 0.66 N ATOM 259 CA PRO A 834 -4.276 -27.079 -35.306 1.00 0.70 C ATOM 260 C PRO A 834 -3.275 -25.986 -35.700 1.00 0.62 C ATOM 261 O PRO A 834 -2.949 -25.117 -34.888 1.00 0.61 O ATOM 262 CB PRO A 834 -3.532 -28.389 -34.996 1.00 0.92 C ATOM 263 CG PRO A 834 -4.089 -29.421 -35.928 1.00 1.12 C ATOM 264 CD PRO A 834 -5.430 -28.916 -36.371 1.00 0.98 C ATOM 0 HA PRO A 834 -4.808 -26.640 -34.462 1.00 0.70 H new ATOM 0 HB2 PRO A 834 -2.459 -28.271 -35.144 1.00 0.92 H new ATOM 0 HB3 PRO A 834 -3.680 -28.683 -33.957 1.00 0.92 H new ATOM 0 HG2 PRO A 834 -3.429 -29.569 -36.782 1.00 1.12 H new ATOM 0 HG3 PRO A 834 -4.183 -30.385 -35.428 1.00 1.12 H new ATOM 0 HD2 PRO A 834 -5.694 -29.282 -37.363 1.00 0.98 H new ATOM 0 HD3 PRO A 834 -6.225 -29.228 -35.694 1.00 0.98 H new ATOM 272 N ILE A 835 -2.783 -26.028 -36.934 1.00 0.68 N ATOM 273 CA ILE A 835 -1.783 -25.064 -37.384 1.00 0.72 C ATOM 274 C ILE A 835 -2.334 -23.630 -37.358 1.00 0.61 C ATOM 275 O ILE A 835 -1.612 -22.678 -37.046 1.00 0.58 O ATOM 276 CB ILE A 835 -1.253 -25.422 -38.796 1.00 0.91 C ATOM 277 CG1 ILE A 835 0.064 -24.678 -39.080 1.00 1.64 C ATOM 278 CG2 ILE A 835 -2.297 -25.148 -39.877 1.00 1.72 C ATOM 279 CD1 ILE A 835 -0.075 -23.440 -39.947 1.00 2.26 C ATOM 0 H ILE A 835 -3.058 -26.714 -37.637 1.00 0.68 H new ATOM 0 HA ILE A 835 -0.947 -25.114 -36.686 1.00 0.72 H new ATOM 0 HB ILE A 835 -1.050 -26.493 -38.818 1.00 0.91 H new ATOM 0 HG12 ILE A 835 0.513 -24.390 -38.130 1.00 1.64 H new ATOM 0 HG13 ILE A 835 0.756 -25.367 -39.564 1.00 1.64 H new ATOM 0 HG21 ILE A 835 -1.888 -25.411 -40.853 1.00 1.72 H new ATOM 0 HG22 ILE A 835 -3.187 -25.746 -39.683 1.00 1.72 H new ATOM 0 HG23 ILE A 835 -2.561 -24.091 -39.868 1.00 1.72 H new ATOM 0 HD11 ILE A 835 0.905 -22.985 -40.091 1.00 2.26 H new ATOM 0 HD12 ILE A 835 -0.492 -23.719 -40.915 1.00 2.26 H new ATOM 0 HD13 ILE A 835 -0.738 -22.726 -39.458 1.00 2.26 H new ATOM 291 N ASN A 836 -3.620 -23.483 -37.639 1.00 0.57 N ATOM 292 CA ASN A 836 -4.228 -22.164 -37.681 1.00 0.52 C ATOM 293 C ASN A 836 -4.622 -21.714 -36.286 1.00 0.42 C ATOM 294 O ASN A 836 -4.758 -20.527 -36.038 1.00 0.44 O ATOM 295 CB ASN A 836 -5.443 -22.135 -38.606 1.00 0.62 C ATOM 296 CG ASN A 836 -5.477 -20.882 -39.464 1.00 1.06 C ATOM 297 OD1 ASN A 836 -4.583 -20.648 -40.281 1.00 1.35 O ATOM 298 ND2 ASN A 836 -6.510 -20.071 -39.299 1.00 1.83 N ATOM 0 H ASN A 836 -4.257 -24.254 -37.840 1.00 0.57 H new ATOM 0 HA ASN A 836 -3.485 -21.473 -38.080 1.00 0.52 H new ATOM 0 HB2 ASN A 836 -5.429 -23.015 -39.250 1.00 0.62 H new ATOM 0 HB3 ASN A 836 -6.354 -22.191 -38.010 1.00 0.62 H new ATOM 0 HD21 ASN A 836 -6.585 -19.221 -39.857 1.00 1.83 H new ATOM 0 HD22 ASN A 836 -7.231 -20.296 -38.614 1.00 1.83 H new ATOM 305 N ARG A 837 -4.805 -22.664 -35.376 1.00 0.41 N ATOM 306 CA ARG A 837 -5.068 -22.333 -33.978 1.00 0.42 C ATOM 307 C ARG A 837 -3.894 -21.562 -33.396 1.00 0.38 C ATOM 308 O ARG A 837 -4.065 -20.489 -32.816 1.00 0.40 O ATOM 309 CB ARG A 837 -5.311 -23.596 -33.151 1.00 0.55 C ATOM 310 CG ARG A 837 -6.407 -23.441 -32.111 1.00 0.69 C ATOM 311 CD ARG A 837 -6.974 -24.789 -31.698 1.00 1.25 C ATOM 312 NE ARG A 837 -7.121 -25.692 -32.835 1.00 1.63 N ATOM 313 CZ ARG A 837 -7.123 -27.017 -32.744 1.00 2.06 C ATOM 314 NH1 ARG A 837 -7.017 -27.612 -31.563 1.00 2.44 N ATOM 315 NH2 ARG A 837 -7.253 -27.753 -33.837 1.00 2.78 N ATOM 0 H ARG A 837 -4.777 -23.663 -35.578 1.00 0.41 H new ATOM 0 HA ARG A 837 -5.966 -21.716 -33.940 1.00 0.42 H new ATOM 0 HB2 ARG A 837 -5.571 -24.415 -33.822 1.00 0.55 H new ATOM 0 HB3 ARG A 837 -4.384 -23.876 -32.651 1.00 0.55 H new ATOM 0 HG2 ARG A 837 -6.010 -22.928 -31.235 1.00 0.69 H new ATOM 0 HG3 ARG A 837 -7.205 -22.816 -32.512 1.00 0.69 H new ATOM 0 HD2 ARG A 837 -6.320 -25.245 -30.955 1.00 1.25 H new ATOM 0 HD3 ARG A 837 -7.944 -24.644 -31.222 1.00 1.25 H new ATOM 0 HE ARG A 837 -7.229 -25.278 -33.761 1.00 1.63 H new ATOM 0 HH11 ARG A 837 -6.933 -27.051 -30.715 1.00 2.44 H new ATOM 0 HH12 ARG A 837 -7.019 -28.630 -31.503 1.00 2.44 H new ATOM 0 HH21 ARG A 837 -7.351 -27.302 -34.747 1.00 2.78 H new ATOM 0 HH22 ARG A 837 -7.255 -28.771 -33.769 1.00 2.78 H new ATOM 329 N ARG A 838 -2.696 -22.105 -33.581 1.00 0.40 N ATOM 330 CA ARG A 838 -1.490 -21.488 -33.048 1.00 0.44 C ATOM 331 C ARG A 838 -1.170 -20.179 -33.768 1.00 0.37 C ATOM 332 O ARG A 838 -0.629 -19.258 -33.168 1.00 0.40 O ATOM 333 CB ARG A 838 -0.301 -22.455 -33.129 1.00 0.59 C ATOM 334 CG ARG A 838 0.221 -22.697 -34.538 1.00 0.96 C ATOM 335 CD ARG A 838 1.641 -22.175 -34.705 1.00 0.87 C ATOM 336 NE ARG A 838 2.414 -22.958 -35.676 1.00 1.50 N ATOM 337 CZ ARG A 838 2.781 -24.234 -35.507 1.00 2.03 C ATOM 338 NH1 ARG A 838 2.487 -24.881 -34.387 1.00 2.49 N ATOM 339 NH2 ARG A 838 3.458 -24.858 -36.466 1.00 2.75 N ATOM 0 H ARG A 838 -2.535 -22.971 -34.096 1.00 0.40 H new ATOM 0 HA ARG A 838 -1.674 -21.256 -31.999 1.00 0.44 H new ATOM 0 HB2 ARG A 838 0.511 -22.064 -32.516 1.00 0.59 H new ATOM 0 HB3 ARG A 838 -0.596 -23.411 -32.695 1.00 0.59 H new ATOM 0 HG2 ARG A 838 0.197 -23.764 -34.758 1.00 0.96 H new ATOM 0 HG3 ARG A 838 -0.434 -22.208 -35.259 1.00 0.96 H new ATOM 0 HD2 ARG A 838 1.607 -21.134 -35.026 1.00 0.87 H new ATOM 0 HD3 ARG A 838 2.148 -22.194 -33.740 1.00 0.87 H new ATOM 0 HE ARG A 838 2.692 -22.497 -36.542 1.00 1.50 H new ATOM 0 HH11 ARG A 838 1.976 -24.406 -33.643 1.00 2.49 H new ATOM 0 HH12 ARG A 838 2.772 -25.853 -34.270 1.00 2.49 H new ATOM 0 HH21 ARG A 838 3.696 -24.364 -37.326 1.00 2.75 H new ATOM 0 HH22 ARG A 838 3.740 -25.830 -36.341 1.00 2.75 H new ATOM 353 N LEU A 839 -1.507 -20.094 -35.051 1.00 0.36 N ATOM 354 CA LEU A 839 -1.244 -18.881 -35.824 1.00 0.40 C ATOM 355 C LEU A 839 -2.236 -17.774 -35.471 1.00 0.34 C ATOM 356 O LEU A 839 -1.873 -16.600 -35.376 1.00 0.37 O ATOM 357 CB LEU A 839 -1.306 -19.185 -37.317 1.00 0.52 C ATOM 358 CG LEU A 839 -0.071 -18.757 -38.111 1.00 0.82 C ATOM 359 CD1 LEU A 839 0.851 -19.943 -38.346 1.00 1.13 C ATOM 360 CD2 LEU A 839 -0.477 -18.123 -39.433 1.00 1.14 C ATOM 0 H LEU A 839 -1.959 -20.843 -35.576 1.00 0.36 H new ATOM 0 HA LEU A 839 -0.243 -18.531 -35.572 1.00 0.40 H new ATOM 0 HB2 LEU A 839 -1.452 -20.257 -37.449 1.00 0.52 H new ATOM 0 HB3 LEU A 839 -2.181 -18.690 -37.738 1.00 0.52 H new ATOM 0 HG LEU A 839 0.471 -18.013 -37.527 1.00 0.82 H new ATOM 0 HD11 LEU A 839 1.724 -19.619 -38.912 1.00 1.13 H new ATOM 0 HD12 LEU A 839 1.171 -20.350 -37.387 1.00 1.13 H new ATOM 0 HD13 LEU A 839 0.319 -20.712 -38.907 1.00 1.13 H new ATOM 0 HD21 LEU A 839 0.416 -17.825 -39.983 1.00 1.14 H new ATOM 0 HD22 LEU A 839 -1.044 -18.843 -40.023 1.00 1.14 H new ATOM 0 HD23 LEU A 839 -1.094 -17.245 -39.241 1.00 1.14 H new ATOM 372 N LEU A 840 -3.487 -18.159 -35.275 1.00 0.35 N ATOM 373 CA LEU A 840 -4.532 -17.230 -34.881 1.00 0.42 C ATOM 374 C LEU A 840 -4.255 -16.706 -33.475 1.00 0.42 C ATOM 375 O LEU A 840 -4.411 -15.516 -33.198 1.00 0.47 O ATOM 376 CB LEU A 840 -5.894 -17.933 -34.946 1.00 0.55 C ATOM 377 CG LEU A 840 -7.110 -17.093 -34.545 1.00 0.86 C ATOM 378 CD1 LEU A 840 -7.343 -15.978 -35.550 1.00 1.43 C ATOM 379 CD2 LEU A 840 -8.347 -17.975 -34.433 1.00 1.10 C ATOM 0 H LEU A 840 -3.805 -19.122 -35.384 1.00 0.35 H new ATOM 0 HA LEU A 840 -4.547 -16.381 -35.565 1.00 0.42 H new ATOM 0 HB2 LEU A 840 -6.046 -18.291 -35.964 1.00 0.55 H new ATOM 0 HB3 LEU A 840 -5.857 -18.811 -34.301 1.00 0.55 H new ATOM 0 HG LEU A 840 -6.914 -16.643 -33.572 1.00 0.86 H new ATOM 0 HD11 LEU A 840 -8.211 -15.392 -35.248 1.00 1.43 H new ATOM 0 HD12 LEU A 840 -6.465 -15.333 -35.588 1.00 1.43 H new ATOM 0 HD13 LEU A 840 -7.520 -16.408 -36.536 1.00 1.43 H new ATOM 0 HD21 LEU A 840 -9.204 -17.365 -34.147 1.00 1.10 H new ATOM 0 HD22 LEU A 840 -8.544 -18.450 -35.394 1.00 1.10 H new ATOM 0 HD23 LEU A 840 -8.180 -18.742 -33.677 1.00 1.10 H new ATOM 391 N ALA A 841 -3.817 -17.603 -32.598 1.00 0.42 N ATOM 392 CA ALA A 841 -3.443 -17.230 -31.240 1.00 0.50 C ATOM 393 C ALA A 841 -2.143 -16.429 -31.233 1.00 0.46 C ATOM 394 O ALA A 841 -1.887 -15.656 -30.315 1.00 0.49 O ATOM 395 CB ALA A 841 -3.309 -18.469 -30.368 1.00 0.60 C ATOM 0 H ALA A 841 -3.712 -18.596 -32.805 1.00 0.42 H new ATOM 0 HA ALA A 841 -4.232 -16.599 -30.831 1.00 0.50 H new ATOM 0 HB1 ALA A 841 -3.029 -18.174 -29.357 1.00 0.60 H new ATOM 0 HB2 ALA A 841 -4.261 -19.000 -30.341 1.00 0.60 H new ATOM 0 HB3 ALA A 841 -2.541 -19.123 -30.781 1.00 0.60 H new ATOM 401 N ASP A 842 -1.326 -16.621 -32.261 1.00 0.43 N ATOM 402 CA ASP A 842 -0.071 -15.889 -32.394 1.00 0.45 C ATOM 403 C ASP A 842 -0.346 -14.415 -32.672 1.00 0.40 C ATOM 404 O ASP A 842 0.208 -13.531 -32.017 1.00 0.42 O ATOM 405 CB ASP A 842 0.781 -16.490 -33.515 1.00 0.52 C ATOM 406 CG ASP A 842 2.124 -15.805 -33.680 1.00 0.82 C ATOM 407 OD1 ASP A 842 2.634 -15.251 -32.685 1.00 1.27 O ATOM 408 OD2 ASP A 842 2.674 -15.805 -34.800 1.00 1.34 O ATOM 0 H ASP A 842 -1.510 -17.280 -33.018 1.00 0.43 H new ATOM 0 HA ASP A 842 0.480 -15.971 -31.457 1.00 0.45 H new ATOM 0 HB2 ASP A 842 0.943 -17.548 -33.311 1.00 0.52 H new ATOM 0 HB3 ASP A 842 0.231 -16.427 -34.454 1.00 0.52 H new ATOM 413 N GLN A 843 -1.222 -14.156 -33.637 1.00 0.38 N ATOM 414 CA GLN A 843 -1.616 -12.789 -33.962 1.00 0.39 C ATOM 415 C GLN A 843 -2.346 -12.157 -32.777 1.00 0.36 C ATOM 416 O GLN A 843 -2.193 -10.966 -32.502 1.00 0.38 O ATOM 417 CB GLN A 843 -2.499 -12.762 -35.215 1.00 0.44 C ATOM 418 CG GLN A 843 -1.842 -12.082 -36.411 1.00 0.56 C ATOM 419 CD GLN A 843 -0.669 -12.871 -36.961 1.00 1.11 C ATOM 420 OE1 GLN A 843 0.431 -12.342 -37.120 1.00 1.85 O ATOM 421 NE2 GLN A 843 -0.896 -14.140 -37.258 1.00 1.64 N ATOM 0 H GLN A 843 -1.672 -14.872 -34.207 1.00 0.38 H new ATOM 0 HA GLN A 843 -0.717 -12.209 -34.169 1.00 0.39 H new ATOM 0 HB2 GLN A 843 -2.760 -13.785 -35.487 1.00 0.44 H new ATOM 0 HB3 GLN A 843 -3.431 -12.247 -34.982 1.00 0.44 H new ATOM 0 HG2 GLN A 843 -2.583 -11.945 -37.198 1.00 0.56 H new ATOM 0 HG3 GLN A 843 -1.501 -11.089 -36.117 1.00 0.56 H new ATOM 0 HE21 GLN A 843 -1.823 -14.540 -37.111 1.00 1.64 H new ATOM 0 HE22 GLN A 843 -0.144 -14.718 -37.634 1.00 1.64 H new ATOM 430 N LEU A 844 -3.113 -12.974 -32.063 1.00 0.35 N ATOM 431 CA LEU A 844 -3.804 -12.528 -30.856 1.00 0.37 C ATOM 432 C LEU A 844 -2.797 -12.111 -29.787 1.00 0.38 C ATOM 433 O LEU A 844 -2.960 -11.079 -29.131 1.00 0.40 O ATOM 434 CB LEU A 844 -4.705 -13.646 -30.323 1.00 0.43 C ATOM 435 CG LEU A 844 -5.930 -13.182 -29.534 1.00 0.59 C ATOM 436 CD1 LEU A 844 -6.537 -11.941 -30.167 1.00 1.08 C ATOM 437 CD2 LEU A 844 -6.960 -14.298 -29.455 1.00 1.24 C ATOM 0 H LEU A 844 -3.273 -13.953 -32.300 1.00 0.35 H new ATOM 0 HA LEU A 844 -4.421 -11.665 -31.107 1.00 0.37 H new ATOM 0 HB2 LEU A 844 -5.044 -14.249 -31.165 1.00 0.43 H new ATOM 0 HB3 LEU A 844 -4.108 -14.297 -29.684 1.00 0.43 H new ATOM 0 HG LEU A 844 -5.613 -12.929 -28.522 1.00 0.59 H new ATOM 0 HD11 LEU A 844 -7.407 -11.627 -29.591 1.00 1.08 H new ATOM 0 HD12 LEU A 844 -5.799 -11.139 -30.176 1.00 1.08 H new ATOM 0 HD13 LEU A 844 -6.841 -12.166 -31.189 1.00 1.08 H new ATOM 0 HD21 LEU A 844 -7.827 -13.954 -28.891 1.00 1.24 H new ATOM 0 HD22 LEU A 844 -7.270 -14.579 -30.461 1.00 1.24 H new ATOM 0 HD23 LEU A 844 -6.522 -15.163 -28.956 1.00 1.24 H new ATOM 449 N GLY A 845 -1.750 -12.915 -29.628 1.00 0.42 N ATOM 450 CA GLY A 845 -0.692 -12.598 -28.687 1.00 0.49 C ATOM 451 C GLY A 845 0.084 -11.366 -29.105 1.00 0.47 C ATOM 452 O GLY A 845 0.623 -10.647 -28.265 1.00 0.52 O ATOM 0 H GLY A 845 -1.616 -13.787 -30.139 1.00 0.42 H new ATOM 0 HA2 GLY A 845 -1.121 -12.439 -27.698 1.00 0.49 H new ATOM 0 HA3 GLY A 845 -0.012 -13.446 -28.606 1.00 0.49 H new ATOM 456 N SER A 846 0.128 -11.109 -30.406 1.00 0.47 N ATOM 457 CA SER A 846 0.770 -9.909 -30.922 1.00 0.52 C ATOM 458 C SER A 846 -0.035 -8.671 -30.525 1.00 0.46 C ATOM 459 O SER A 846 0.512 -7.578 -30.369 1.00 0.52 O ATOM 460 CB SER A 846 0.913 -9.995 -32.444 1.00 0.62 C ATOM 461 OG SER A 846 1.399 -11.271 -32.837 1.00 0.70 O ATOM 0 H SER A 846 -0.273 -11.715 -31.122 1.00 0.47 H new ATOM 0 HA SER A 846 1.767 -9.828 -30.489 1.00 0.52 H new ATOM 0 HB2 SER A 846 -0.052 -9.808 -32.915 1.00 0.62 H new ATOM 0 HB3 SER A 846 1.594 -9.219 -32.794 1.00 0.62 H new ATOM 0 HG SER A 846 0.720 -11.952 -32.649 1.00 0.70 H new ATOM 467 N LEU A 847 -1.340 -8.861 -30.357 1.00 0.42 N ATOM 468 CA LEU A 847 -2.221 -7.801 -29.885 1.00 0.47 C ATOM 469 C LEU A 847 -2.153 -7.688 -28.365 1.00 0.46 C ATOM 470 O LEU A 847 -2.588 -6.695 -27.781 1.00 0.56 O ATOM 471 CB LEU A 847 -3.663 -8.081 -30.316 1.00 0.56 C ATOM 472 CG LEU A 847 -4.084 -7.417 -31.623 1.00 0.74 C ATOM 473 CD1 LEU A 847 -4.584 -8.453 -32.616 1.00 1.36 C ATOM 474 CD2 LEU A 847 -5.143 -6.357 -31.363 1.00 1.56 C ATOM 0 H LEU A 847 -1.812 -9.746 -30.543 1.00 0.42 H new ATOM 0 HA LEU A 847 -1.892 -6.860 -30.325 1.00 0.47 H new ATOM 0 HB2 LEU A 847 -3.795 -9.159 -30.414 1.00 0.56 H new ATOM 0 HB3 LEU A 847 -4.334 -7.749 -29.524 1.00 0.56 H new ATOM 0 HG LEU A 847 -3.212 -6.928 -32.059 1.00 0.74 H new ATOM 0 HD11 LEU A 847 -4.879 -7.958 -33.541 1.00 1.36 H new ATOM 0 HD12 LEU A 847 -3.790 -9.169 -32.825 1.00 1.36 H new ATOM 0 HD13 LEU A 847 -5.443 -8.976 -32.195 1.00 1.36 H new ATOM 0 HD21 LEU A 847 -5.432 -5.893 -32.306 1.00 1.56 H new ATOM 0 HD22 LEU A 847 -6.016 -6.820 -30.903 1.00 1.56 H new ATOM 0 HD23 LEU A 847 -4.740 -5.597 -30.693 1.00 1.56 H new ATOM 486 N GLY A 848 -1.605 -8.718 -27.732 1.00 0.43 N ATOM 487 CA GLY A 848 -1.530 -8.753 -26.285 1.00 0.48 C ATOM 488 C GLY A 848 -2.841 -9.185 -25.664 1.00 0.48 C ATOM 489 O GLY A 848 -3.091 -8.942 -24.482 1.00 0.62 O ATOM 0 H GLY A 848 -1.209 -9.534 -28.199 1.00 0.43 H new ATOM 0 HA2 GLY A 848 -0.740 -9.438 -25.979 1.00 0.48 H new ATOM 0 HA3 GLY A 848 -1.259 -7.766 -25.911 1.00 0.48 H new ATOM 493 N TYR A 849 -3.688 -9.819 -26.463 1.00 0.42 N ATOM 494 CA TYR A 849 -4.988 -10.270 -25.986 1.00 0.46 C ATOM 495 C TYR A 849 -4.951 -11.754 -25.648 1.00 0.45 C ATOM 496 O TYR A 849 -4.285 -12.540 -26.327 1.00 0.51 O ATOM 497 CB TYR A 849 -6.069 -9.977 -27.028 1.00 0.53 C ATOM 498 CG TYR A 849 -6.614 -8.567 -26.943 1.00 0.63 C ATOM 499 CD1 TYR A 849 -5.762 -7.478 -26.804 1.00 1.07 C ATOM 500 CD2 TYR A 849 -7.978 -8.325 -26.993 1.00 0.93 C ATOM 501 CE1 TYR A 849 -6.254 -6.192 -26.716 1.00 1.20 C ATOM 502 CE2 TYR A 849 -8.479 -7.041 -26.908 1.00 1.09 C ATOM 503 CZ TYR A 849 -7.613 -5.978 -26.769 1.00 1.00 C ATOM 504 OH TYR A 849 -8.109 -4.699 -26.676 1.00 1.22 O ATOM 0 H TYR A 849 -3.499 -10.032 -27.442 1.00 0.42 H new ATOM 0 HA TYR A 849 -5.231 -9.722 -25.076 1.00 0.46 H new ATOM 0 HB2 TYR A 849 -5.658 -10.141 -28.024 1.00 0.53 H new ATOM 0 HB3 TYR A 849 -6.888 -10.684 -26.901 1.00 0.53 H new ATOM 0 HD1 TYR A 849 -4.695 -7.641 -26.764 1.00 1.07 H new ATOM 0 HD2 TYR A 849 -8.661 -9.155 -27.100 1.00 0.93 H new ATOM 0 HE1 TYR A 849 -5.577 -5.358 -26.606 1.00 1.20 H new ATOM 0 HE2 TYR A 849 -9.545 -6.871 -26.950 1.00 1.09 H new ATOM 0 HH TYR A 849 -7.457 -4.068 -27.046 1.00 1.22 H new ATOM 514 N GLN A 850 -5.670 -12.130 -24.596 1.00 0.47 N ATOM 515 CA GLN A 850 -5.637 -13.495 -24.092 1.00 0.49 C ATOM 516 C GLN A 850 -6.364 -14.448 -25.030 1.00 0.45 C ATOM 517 O GLN A 850 -7.479 -14.177 -25.471 1.00 0.51 O ATOM 518 CB GLN A 850 -6.237 -13.560 -22.689 1.00 0.59 C ATOM 519 CG GLN A 850 -5.196 -13.757 -21.601 1.00 0.97 C ATOM 520 CD GLN A 850 -4.510 -15.106 -21.693 1.00 1.66 C ATOM 521 OE1 GLN A 850 -5.074 -16.067 -22.222 1.00 2.38 O ATOM 522 NE2 GLN A 850 -3.302 -15.192 -21.165 1.00 2.17 N ATOM 0 H GLN A 850 -6.285 -11.505 -24.075 1.00 0.47 H new ATOM 0 HA GLN A 850 -4.595 -13.809 -24.041 1.00 0.49 H new ATOM 0 HB2 GLN A 850 -6.788 -12.640 -22.493 1.00 0.59 H new ATOM 0 HB3 GLN A 850 -6.957 -14.377 -22.646 1.00 0.59 H new ATOM 0 HG2 GLN A 850 -4.448 -12.967 -21.670 1.00 0.97 H new ATOM 0 HG3 GLN A 850 -5.672 -13.661 -20.625 1.00 0.97 H new ATOM 0 HE21 GLN A 850 -2.873 -14.371 -20.737 1.00 2.17 H new ATOM 0 HE22 GLN A 850 -2.799 -16.079 -21.185 1.00 2.17 H new ATOM 531 N CYS A 851 -5.720 -15.566 -25.320 1.00 0.45 N ATOM 532 CA CYS A 851 -6.231 -16.519 -26.289 1.00 0.47 C ATOM 533 C CYS A 851 -6.569 -17.851 -25.627 1.00 0.41 C ATOM 534 O CYS A 851 -5.680 -18.607 -25.235 1.00 0.51 O ATOM 535 CB CYS A 851 -5.192 -16.730 -27.393 1.00 0.61 C ATOM 536 SG CYS A 851 -3.709 -15.708 -27.208 1.00 0.94 S ATOM 0 H CYS A 851 -4.834 -15.837 -24.893 1.00 0.45 H new ATOM 0 HA CYS A 851 -7.148 -16.117 -26.720 1.00 0.47 H new ATOM 0 HB2 CYS A 851 -4.899 -17.780 -27.407 1.00 0.61 H new ATOM 0 HB3 CYS A 851 -5.652 -16.515 -28.357 1.00 0.61 H new ATOM 0 HG CYS A 851 -4.053 -14.502 -26.867 1.00 0.94 H new ATOM 542 N LYS A 852 -7.857 -18.129 -25.502 1.00 0.34 N ATOM 543 CA LYS A 852 -8.321 -19.382 -24.927 1.00 0.34 C ATOM 544 C LYS A 852 -8.558 -20.388 -26.048 1.00 0.31 C ATOM 545 O LYS A 852 -9.375 -20.156 -26.935 1.00 0.33 O ATOM 546 CB LYS A 852 -9.601 -19.150 -24.114 1.00 0.40 C ATOM 547 CG LYS A 852 -9.353 -18.896 -22.626 1.00 0.66 C ATOM 548 CD LYS A 852 -8.426 -17.708 -22.394 1.00 0.56 C ATOM 549 CE LYS A 852 -8.537 -17.178 -20.969 1.00 0.88 C ATOM 550 NZ LYS A 852 -7.413 -16.269 -20.622 1.00 1.44 N ATOM 0 H LYS A 852 -8.604 -17.499 -25.793 1.00 0.34 H new ATOM 0 HA LYS A 852 -7.565 -19.780 -24.250 1.00 0.34 H new ATOM 0 HB2 LYS A 852 -10.137 -18.298 -24.533 1.00 0.40 H new ATOM 0 HB3 LYS A 852 -10.250 -20.019 -24.221 1.00 0.40 H new ATOM 0 HG2 LYS A 852 -10.305 -18.716 -22.126 1.00 0.66 H new ATOM 0 HG3 LYS A 852 -8.919 -19.788 -22.174 1.00 0.66 H new ATOM 0 HD2 LYS A 852 -7.396 -18.005 -22.593 1.00 0.56 H new ATOM 0 HD3 LYS A 852 -8.670 -16.913 -23.098 1.00 0.56 H new ATOM 0 HE2 LYS A 852 -9.482 -16.647 -20.853 1.00 0.88 H new ATOM 0 HE3 LYS A 852 -8.554 -18.015 -20.271 1.00 0.88 H new ATOM 0 HZ1 LYS A 852 -7.051 -16.510 -19.677 1.00 1.44 H new ATOM 0 HZ2 LYS A 852 -6.652 -16.375 -21.322 1.00 1.44 H new ATOM 0 HZ3 LYS A 852 -7.749 -15.285 -20.623 1.00 1.44 H new ATOM 564 N THR A 853 -7.836 -21.495 -26.009 1.00 0.33 N ATOM 565 CA THR A 853 -7.788 -22.418 -27.137 1.00 0.34 C ATOM 566 C THR A 853 -8.854 -23.509 -27.054 1.00 0.34 C ATOM 567 O THR A 853 -9.077 -24.095 -25.994 1.00 0.44 O ATOM 568 CB THR A 853 -6.402 -23.076 -27.225 1.00 0.46 C ATOM 569 OG1 THR A 853 -5.506 -22.448 -26.296 1.00 0.62 O ATOM 570 CG2 THR A 853 -5.834 -22.964 -28.627 1.00 0.61 C ATOM 0 H THR A 853 -7.273 -21.779 -25.208 1.00 0.33 H new ATOM 0 HA THR A 853 -7.987 -21.827 -28.031 1.00 0.34 H new ATOM 0 HB THR A 853 -6.511 -24.132 -26.978 1.00 0.46 H new ATOM 0 HG1 THR A 853 -4.624 -22.872 -26.354 1.00 0.62 H new ATOM 0 HG21 THR A 853 -4.853 -23.438 -28.661 1.00 0.61 H new ATOM 0 HG22 THR A 853 -6.502 -23.461 -29.331 1.00 0.61 H new ATOM 0 HG23 THR A 853 -5.739 -21.913 -28.898 1.00 0.61 H new ATOM 578 N ALA A 854 -9.502 -23.774 -28.186 1.00 0.32 N ATOM 579 CA ALA A 854 -10.491 -24.845 -28.291 1.00 0.37 C ATOM 580 C ALA A 854 -10.654 -25.258 -29.754 1.00 0.34 C ATOM 581 O ALA A 854 -10.071 -24.628 -30.645 1.00 0.35 O ATOM 582 CB ALA A 854 -11.822 -24.412 -27.691 1.00 0.47 C ATOM 0 H ALA A 854 -9.358 -23.256 -29.052 1.00 0.32 H new ATOM 0 HA ALA A 854 -10.140 -25.707 -27.724 1.00 0.37 H new ATOM 0 HB1 ALA A 854 -12.543 -25.225 -27.780 1.00 0.47 H new ATOM 0 HB2 ALA A 854 -11.683 -24.164 -26.639 1.00 0.47 H new ATOM 0 HB3 ALA A 854 -12.194 -23.537 -28.224 1.00 0.47 H new ATOM 588 N ASN A 855 -11.455 -26.292 -30.019 1.00 0.36 N ATOM 589 CA ASN A 855 -11.529 -26.852 -31.369 1.00 0.43 C ATOM 590 C ASN A 855 -12.931 -27.389 -31.684 1.00 0.44 C ATOM 591 O ASN A 855 -13.167 -28.600 -31.641 1.00 0.53 O ATOM 592 CB ASN A 855 -10.452 -27.950 -31.521 1.00 0.54 C ATOM 593 CG ASN A 855 -10.655 -28.885 -32.710 1.00 1.11 C ATOM 594 OD1 ASN A 855 -10.786 -30.097 -32.539 1.00 1.90 O ATOM 595 ND2 ASN A 855 -10.666 -28.341 -33.912 1.00 1.75 N ATOM 0 H ASN A 855 -12.051 -26.751 -29.331 1.00 0.36 H new ATOM 0 HA ASN A 855 -11.334 -26.060 -32.092 1.00 0.43 H new ATOM 0 HB2 ASN A 855 -9.477 -27.472 -31.615 1.00 0.54 H new ATOM 0 HB3 ASN A 855 -10.429 -28.545 -30.608 1.00 0.54 H new ATOM 0 HD21 ASN A 855 -10.786 -28.929 -34.737 1.00 1.75 H new ATOM 0 HD22 ASN A 855 -10.555 -27.332 -34.016 1.00 1.75 H new ATOM 602 N ASP A 856 -13.861 -26.454 -31.927 1.00 0.43 N ATOM 603 CA ASP A 856 -15.187 -26.731 -32.513 1.00 0.47 C ATOM 604 C ASP A 856 -16.133 -25.581 -32.212 1.00 0.49 C ATOM 605 O ASP A 856 -15.871 -24.775 -31.324 1.00 0.60 O ATOM 606 CB ASP A 856 -15.824 -28.033 -32.007 1.00 0.51 C ATOM 607 CG ASP A 856 -16.745 -28.658 -33.037 1.00 0.80 C ATOM 608 OD1 ASP A 856 -17.869 -28.148 -33.223 1.00 1.01 O ATOM 609 OD2 ASP A 856 -16.354 -29.668 -33.660 1.00 1.45 O ATOM 0 H ASP A 856 -13.713 -25.466 -31.719 1.00 0.43 H new ATOM 0 HA ASP A 856 -15.026 -26.843 -33.585 1.00 0.47 H new ATOM 0 HB2 ASP A 856 -15.039 -28.742 -31.746 1.00 0.51 H new ATOM 0 HB3 ASP A 856 -16.386 -27.830 -31.095 1.00 0.51 H new ATOM 614 N GLY A 857 -17.244 -25.524 -32.926 1.00 0.53 N ATOM 615 CA GLY A 857 -18.257 -24.539 -32.625 1.00 0.58 C ATOM 616 C GLY A 857 -19.011 -24.907 -31.366 1.00 0.54 C ATOM 617 O GLY A 857 -19.259 -24.062 -30.509 1.00 0.57 O ATOM 0 H GLY A 857 -17.462 -26.142 -33.708 1.00 0.53 H new ATOM 0 HA2 GLY A 857 -17.793 -23.560 -32.503 1.00 0.58 H new ATOM 0 HA3 GLY A 857 -18.953 -24.460 -33.460 1.00 0.58 H new ATOM 621 N VAL A 858 -19.346 -26.186 -31.240 1.00 0.52 N ATOM 622 CA VAL A 858 -20.040 -26.680 -30.062 1.00 0.52 C ATOM 623 C VAL A 858 -19.091 -26.722 -28.865 1.00 0.50 C ATOM 624 O VAL A 858 -19.512 -26.592 -27.715 1.00 0.54 O ATOM 625 CB VAL A 858 -20.674 -28.068 -30.302 1.00 0.55 C ATOM 626 CG1 VAL A 858 -21.784 -27.967 -31.341 1.00 0.72 C ATOM 627 CG2 VAL A 858 -19.630 -29.089 -30.732 1.00 0.95 C ATOM 0 H VAL A 858 -19.147 -26.899 -31.942 1.00 0.52 H new ATOM 0 HA VAL A 858 -20.853 -25.987 -29.846 1.00 0.52 H new ATOM 0 HB VAL A 858 -21.102 -28.410 -29.360 1.00 0.55 H new ATOM 0 HG11 VAL A 858 -22.223 -28.952 -31.501 1.00 0.72 H new ATOM 0 HG12 VAL A 858 -22.553 -27.280 -30.987 1.00 0.72 H new ATOM 0 HG13 VAL A 858 -21.371 -27.597 -32.279 1.00 0.72 H new ATOM 0 HG21 VAL A 858 -20.110 -30.054 -30.892 1.00 0.95 H new ATOM 0 HG22 VAL A 858 -19.159 -28.760 -31.658 1.00 0.95 H new ATOM 0 HG23 VAL A 858 -18.873 -29.185 -29.954 1.00 0.95 H new ATOM 637 N ASP A 859 -17.804 -26.915 -29.149 1.00 0.47 N ATOM 638 CA ASP A 859 -16.769 -26.872 -28.119 1.00 0.49 C ATOM 639 C ASP A 859 -16.720 -25.482 -27.499 1.00 0.45 C ATOM 640 O ASP A 859 -16.597 -25.330 -26.281 1.00 0.46 O ATOM 641 CB ASP A 859 -15.408 -27.220 -28.726 1.00 0.55 C ATOM 642 CG ASP A 859 -14.377 -27.638 -27.693 1.00 0.64 C ATOM 643 OD1 ASP A 859 -14.784 -28.053 -26.583 1.00 0.75 O ATOM 644 OD2 ASP A 859 -13.166 -27.537 -27.971 1.00 0.84 O ATOM 0 H ASP A 859 -17.453 -27.103 -30.088 1.00 0.47 H new ATOM 0 HA ASP A 859 -17.006 -27.602 -27.346 1.00 0.49 H new ATOM 0 HB2 ASP A 859 -15.536 -28.026 -29.448 1.00 0.55 H new ATOM 0 HB3 ASP A 859 -15.032 -26.357 -29.275 1.00 0.55 H new ATOM 649 N ALA A 860 -16.850 -24.468 -28.351 1.00 0.45 N ATOM 650 CA ALA A 860 -16.866 -23.084 -27.904 1.00 0.47 C ATOM 651 C ALA A 860 -18.094 -22.819 -27.048 1.00 0.49 C ATOM 652 O ALA A 860 -18.048 -22.035 -26.107 1.00 0.51 O ATOM 653 CB ALA A 860 -16.841 -22.138 -29.094 1.00 0.51 C ATOM 0 H ALA A 860 -16.946 -24.584 -29.360 1.00 0.45 H new ATOM 0 HA ALA A 860 -15.975 -22.907 -27.302 1.00 0.47 H new ATOM 0 HB1 ALA A 860 -16.853 -21.107 -28.740 1.00 0.51 H new ATOM 0 HB2 ALA A 860 -15.936 -22.310 -29.677 1.00 0.51 H new ATOM 0 HB3 ALA A 860 -17.715 -22.317 -29.720 1.00 0.51 H new ATOM 659 N LEU A 861 -19.188 -23.485 -27.383 1.00 0.55 N ATOM 660 CA LEU A 861 -20.422 -23.376 -26.621 1.00 0.66 C ATOM 661 C LEU A 861 -20.220 -23.888 -25.197 1.00 0.59 C ATOM 662 O LEU A 861 -20.671 -23.271 -24.226 1.00 0.60 O ATOM 663 CB LEU A 861 -21.526 -24.179 -27.306 1.00 0.87 C ATOM 664 CG LEU A 861 -22.556 -23.359 -28.077 1.00 0.85 C ATOM 665 CD1 LEU A 861 -22.099 -23.131 -29.509 1.00 1.85 C ATOM 666 CD2 LEU A 861 -23.895 -24.064 -28.057 1.00 1.19 C ATOM 0 H LEU A 861 -19.246 -24.112 -28.185 1.00 0.55 H new ATOM 0 HA LEU A 861 -20.711 -22.326 -26.577 1.00 0.66 H new ATOM 0 HB2 LEU A 861 -21.063 -24.886 -27.994 1.00 0.87 H new ATOM 0 HB3 LEU A 861 -22.047 -24.765 -26.549 1.00 0.87 H new ATOM 0 HG LEU A 861 -22.660 -22.387 -27.595 1.00 0.85 H new ATOM 0 HD11 LEU A 861 -22.848 -22.544 -30.041 1.00 1.85 H new ATOM 0 HD12 LEU A 861 -21.151 -22.593 -29.507 1.00 1.85 H new ATOM 0 HD13 LEU A 861 -21.970 -24.092 -30.007 1.00 1.85 H new ATOM 0 HD21 LEU A 861 -24.626 -23.473 -28.609 1.00 1.19 H new ATOM 0 HD22 LEU A 861 -23.797 -25.045 -28.521 1.00 1.19 H new ATOM 0 HD23 LEU A 861 -24.229 -24.182 -27.026 1.00 1.19 H new ATOM 678 N ASN A 862 -19.527 -25.014 -25.081 1.00 0.58 N ATOM 679 CA ASN A 862 -19.288 -25.635 -23.783 1.00 0.59 C ATOM 680 C ASN A 862 -18.335 -24.795 -22.941 1.00 0.53 C ATOM 681 O ASN A 862 -18.625 -24.492 -21.784 1.00 0.55 O ATOM 682 CB ASN A 862 -18.716 -27.043 -23.947 1.00 0.66 C ATOM 683 CG ASN A 862 -18.482 -27.722 -22.608 1.00 1.02 C ATOM 684 OD1 ASN A 862 -19.395 -27.843 -21.791 1.00 1.21 O ATOM 685 ND2 ASN A 862 -17.257 -28.163 -22.372 1.00 1.72 N ATOM 0 H ASN A 862 -19.120 -25.516 -25.870 1.00 0.58 H new ATOM 0 HA ASN A 862 -20.249 -25.699 -23.272 1.00 0.59 H new ATOM 0 HB2 ASN A 862 -19.401 -27.645 -24.544 1.00 0.66 H new ATOM 0 HB3 ASN A 862 -17.776 -26.991 -24.496 1.00 0.66 H new ATOM 0 HD21 ASN A 862 -17.042 -28.622 -21.487 1.00 1.72 H new ATOM 0 HD22 ASN A 862 -16.528 -28.044 -23.075 1.00 1.72 H new ATOM 692 N VAL A 863 -17.207 -24.408 -23.529 1.00 0.48 N ATOM 693 CA VAL A 863 -16.214 -23.615 -22.813 1.00 0.48 C ATOM 694 C VAL A 863 -16.783 -22.245 -22.436 1.00 0.47 C ATOM 695 O VAL A 863 -16.449 -21.701 -21.388 1.00 0.50 O ATOM 696 CB VAL A 863 -14.897 -23.464 -23.620 1.00 0.51 C ATOM 697 CG1 VAL A 863 -15.093 -22.595 -24.850 1.00 0.81 C ATOM 698 CG2 VAL A 863 -13.785 -22.907 -22.738 1.00 0.89 C ATOM 0 H VAL A 863 -16.959 -24.629 -24.493 1.00 0.48 H new ATOM 0 HA VAL A 863 -15.970 -24.153 -21.897 1.00 0.48 H new ATOM 0 HB VAL A 863 -14.604 -24.457 -23.961 1.00 0.51 H new ATOM 0 HG11 VAL A 863 -14.150 -22.511 -25.390 1.00 0.81 H new ATOM 0 HG12 VAL A 863 -15.844 -23.046 -25.498 1.00 0.81 H new ATOM 0 HG13 VAL A 863 -15.426 -21.603 -24.545 1.00 0.81 H new ATOM 0 HG21 VAL A 863 -12.871 -22.809 -23.323 1.00 0.89 H new ATOM 0 HG22 VAL A 863 -14.078 -21.929 -22.357 1.00 0.89 H new ATOM 0 HG23 VAL A 863 -13.610 -23.584 -21.902 1.00 0.89 H new ATOM 708 N LEU A 864 -17.671 -21.710 -23.276 1.00 0.46 N ATOM 709 CA LEU A 864 -18.354 -20.450 -22.982 1.00 0.50 C ATOM 710 C LEU A 864 -19.274 -20.612 -21.777 1.00 0.55 C ATOM 711 O LEU A 864 -19.491 -19.677 -21.009 1.00 0.59 O ATOM 712 CB LEU A 864 -19.172 -19.984 -24.190 1.00 0.54 C ATOM 713 CG LEU A 864 -18.651 -18.733 -24.896 1.00 0.79 C ATOM 714 CD1 LEU A 864 -19.521 -18.407 -26.101 1.00 1.66 C ATOM 715 CD2 LEU A 864 -18.610 -17.557 -23.934 1.00 1.06 C ATOM 0 H LEU A 864 -17.934 -22.131 -24.167 1.00 0.46 H new ATOM 0 HA LEU A 864 -17.596 -19.700 -22.757 1.00 0.50 H new ATOM 0 HB2 LEU A 864 -19.213 -20.798 -24.914 1.00 0.54 H new ATOM 0 HB3 LEU A 864 -20.195 -19.796 -23.863 1.00 0.54 H new ATOM 0 HG LEU A 864 -17.636 -18.927 -25.243 1.00 0.79 H new ATOM 0 HD11 LEU A 864 -19.139 -17.514 -26.595 1.00 1.66 H new ATOM 0 HD12 LEU A 864 -19.503 -19.243 -26.800 1.00 1.66 H new ATOM 0 HD13 LEU A 864 -20.545 -18.230 -25.773 1.00 1.66 H new ATOM 0 HD21 LEU A 864 -18.237 -16.675 -24.454 1.00 1.06 H new ATOM 0 HD22 LEU A 864 -19.614 -17.359 -23.558 1.00 1.06 H new ATOM 0 HD23 LEU A 864 -17.950 -17.793 -23.099 1.00 1.06 H new ATOM 727 N SER A 865 -19.825 -21.808 -21.628 1.00 0.58 N ATOM 728 CA SER A 865 -20.692 -22.112 -20.503 1.00 0.67 C ATOM 729 C SER A 865 -19.870 -22.325 -19.233 1.00 0.66 C ATOM 730 O SER A 865 -20.379 -22.187 -18.119 1.00 0.77 O ATOM 731 CB SER A 865 -21.531 -23.352 -20.818 1.00 0.75 C ATOM 732 OG SER A 865 -22.305 -23.152 -21.994 1.00 0.82 O ATOM 0 H SER A 865 -19.685 -22.584 -22.275 1.00 0.58 H new ATOM 0 HA SER A 865 -21.360 -21.268 -20.333 1.00 0.67 H new ATOM 0 HB2 SER A 865 -20.878 -24.215 -20.949 1.00 0.75 H new ATOM 0 HB3 SER A 865 -22.189 -23.575 -19.978 1.00 0.75 H new ATOM 0 HG SER A 865 -21.722 -23.193 -22.780 1.00 0.82 H new ATOM 738 N LYS A 866 -18.595 -22.649 -19.408 1.00 0.61 N ATOM 739 CA LYS A 866 -17.693 -22.863 -18.283 1.00 0.66 C ATOM 740 C LYS A 866 -17.095 -21.541 -17.813 1.00 0.66 C ATOM 741 O LYS A 866 -16.874 -21.336 -16.621 1.00 0.83 O ATOM 742 CB LYS A 866 -16.579 -23.834 -18.675 1.00 0.73 C ATOM 743 CG LYS A 866 -17.047 -25.274 -18.812 1.00 1.12 C ATOM 744 CD LYS A 866 -16.489 -26.145 -17.702 1.00 1.85 C ATOM 745 CE LYS A 866 -15.180 -26.801 -18.111 1.00 2.63 C ATOM 746 NZ LYS A 866 -15.154 -28.249 -17.778 1.00 3.46 N ATOM 0 H LYS A 866 -18.161 -22.770 -20.323 1.00 0.61 H new ATOM 0 HA LYS A 866 -18.265 -23.295 -17.462 1.00 0.66 H new ATOM 0 HB2 LYS A 866 -16.143 -23.511 -19.620 1.00 0.73 H new ATOM 0 HB3 LYS A 866 -15.788 -23.787 -17.927 1.00 0.73 H new ATOM 0 HG2 LYS A 866 -18.136 -25.308 -18.790 1.00 1.12 H new ATOM 0 HG3 LYS A 866 -16.735 -25.669 -19.779 1.00 1.12 H new ATOM 0 HD2 LYS A 866 -16.330 -25.540 -16.809 1.00 1.85 H new ATOM 0 HD3 LYS A 866 -17.216 -26.914 -17.441 1.00 1.85 H new ATOM 0 HE2 LYS A 866 -15.030 -26.673 -19.183 1.00 2.63 H new ATOM 0 HE3 LYS A 866 -14.352 -26.299 -17.611 1.00 2.63 H new ATOM 0 HZ1 LYS A 866 -14.244 -28.657 -18.074 1.00 3.46 H new ATOM 0 HZ2 LYS A 866 -15.271 -28.371 -16.752 1.00 3.46 H new ATOM 0 HZ3 LYS A 866 -15.928 -28.733 -18.275 1.00 3.46 H new ATOM 760 N ASN A 867 -16.818 -20.664 -18.765 1.00 0.61 N ATOM 761 CA ASN A 867 -16.310 -19.327 -18.479 1.00 0.68 C ATOM 762 C ASN A 867 -16.727 -18.393 -19.609 1.00 0.76 C ATOM 763 O ASN A 867 -16.665 -18.763 -20.781 1.00 1.40 O ATOM 764 CB ASN A 867 -14.778 -19.350 -18.306 1.00 0.77 C ATOM 765 CG ASN A 867 -14.059 -18.193 -18.988 1.00 1.08 C ATOM 766 OD1 ASN A 867 -13.385 -18.380 -20.000 1.00 1.86 O ATOM 767 ND2 ASN A 867 -14.182 -16.995 -18.434 1.00 1.40 N ATOM 0 H ASN A 867 -16.938 -20.857 -19.759 1.00 0.61 H new ATOM 0 HA ASN A 867 -16.732 -18.965 -17.542 1.00 0.68 H new ATOM 0 HB2 ASN A 867 -14.543 -19.334 -17.242 1.00 0.77 H new ATOM 0 HB3 ASN A 867 -14.392 -20.289 -18.703 1.00 0.77 H new ATOM 0 HD21 ASN A 867 -13.709 -16.191 -18.847 1.00 1.40 H new ATOM 0 HD22 ASN A 867 -14.749 -16.877 -17.595 1.00 1.40 H new ATOM 774 N HIS A 868 -17.163 -17.196 -19.257 1.00 0.78 N ATOM 775 CA HIS A 868 -17.743 -16.292 -20.237 1.00 0.81 C ATOM 776 C HIS A 868 -16.674 -15.511 -20.992 1.00 0.89 C ATOM 777 O HIS A 868 -16.334 -14.384 -20.627 1.00 1.90 O ATOM 778 CB HIS A 868 -18.729 -15.334 -19.571 1.00 1.06 C ATOM 779 CG HIS A 868 -20.075 -15.320 -20.228 1.00 1.68 C ATOM 780 ND1 HIS A 868 -20.466 -14.350 -21.126 1.00 2.38 N ATOM 781 CD2 HIS A 868 -21.121 -16.174 -20.126 1.00 2.48 C ATOM 782 CE1 HIS A 868 -21.693 -14.601 -21.539 1.00 3.08 C ATOM 783 NE2 HIS A 868 -22.116 -15.704 -20.950 1.00 3.12 N ATOM 0 H HIS A 868 -17.127 -16.828 -18.306 1.00 0.78 H new ATOM 0 HA HIS A 868 -18.280 -16.903 -20.962 1.00 0.81 H new ATOM 0 HB2 HIS A 868 -18.846 -15.614 -18.524 1.00 1.06 H new ATOM 0 HB3 HIS A 868 -18.314 -14.326 -19.587 1.00 1.06 H new ATOM 0 HD2 HIS A 868 -21.165 -17.061 -19.511 1.00 2.48 H new ATOM 0 HE1 HIS A 868 -22.257 -14.005 -22.241 1.00 3.08 H new ATOM 0 HE2 HIS A 868 -23.030 -16.136 -21.084 1.00 3.12 H new ATOM 792 N ILE A 869 -16.139 -16.134 -22.033 1.00 0.51 N ATOM 793 CA ILE A 869 -15.263 -15.457 -22.981 1.00 0.41 C ATOM 794 C ILE A 869 -16.027 -14.313 -23.652 1.00 0.46 C ATOM 795 O ILE A 869 -17.205 -14.460 -23.977 1.00 0.68 O ATOM 796 CB ILE A 869 -14.746 -16.456 -24.042 1.00 0.45 C ATOM 797 CG1 ILE A 869 -13.781 -17.457 -23.400 1.00 0.74 C ATOM 798 CG2 ILE A 869 -14.066 -15.732 -25.190 1.00 0.82 C ATOM 799 CD1 ILE A 869 -14.376 -18.834 -23.206 1.00 1.06 C ATOM 0 H ILE A 869 -16.299 -17.119 -22.244 1.00 0.51 H new ATOM 0 HA ILE A 869 -14.403 -15.049 -22.449 1.00 0.41 H new ATOM 0 HB ILE A 869 -15.603 -16.997 -24.444 1.00 0.45 H new ATOM 0 HG12 ILE A 869 -12.890 -17.540 -24.022 1.00 0.74 H new ATOM 0 HG13 ILE A 869 -13.460 -17.070 -22.433 1.00 0.74 H new ATOM 0 HG21 ILE A 869 -13.713 -16.460 -25.921 1.00 0.82 H new ATOM 0 HG22 ILE A 869 -14.776 -15.056 -25.666 1.00 0.82 H new ATOM 0 HG23 ILE A 869 -13.220 -15.160 -24.809 1.00 0.82 H new ATOM 0 HD11 ILE A 869 -13.635 -19.489 -22.747 1.00 1.06 H new ATOM 0 HD12 ILE A 869 -15.250 -18.765 -22.559 1.00 1.06 H new ATOM 0 HD13 ILE A 869 -14.672 -19.242 -24.173 1.00 1.06 H new ATOM 811 N ASP A 870 -15.371 -13.173 -23.847 1.00 0.41 N ATOM 812 CA ASP A 870 -16.072 -11.971 -24.296 1.00 0.48 C ATOM 813 C ASP A 870 -16.170 -11.881 -25.819 1.00 0.44 C ATOM 814 O ASP A 870 -17.122 -11.312 -26.346 1.00 0.56 O ATOM 815 CB ASP A 870 -15.406 -10.718 -23.726 1.00 0.58 C ATOM 816 CG ASP A 870 -16.384 -9.874 -22.930 1.00 1.07 C ATOM 817 OD1 ASP A 870 -17.290 -10.458 -22.288 1.00 1.48 O ATOM 818 OD2 ASP A 870 -16.264 -8.631 -22.937 1.00 1.64 O ATOM 0 H ASP A 870 -14.368 -13.055 -23.704 1.00 0.41 H new ATOM 0 HA ASP A 870 -17.092 -12.038 -23.917 1.00 0.48 H new ATOM 0 HB2 ASP A 870 -14.572 -11.008 -23.087 1.00 0.58 H new ATOM 0 HB3 ASP A 870 -14.992 -10.124 -24.540 1.00 0.58 H new ATOM 823 N ILE A 871 -15.194 -12.435 -26.527 1.00 0.38 N ATOM 824 CA ILE A 871 -15.227 -12.443 -27.988 1.00 0.39 C ATOM 825 C ILE A 871 -14.864 -13.828 -28.513 1.00 0.36 C ATOM 826 O ILE A 871 -13.860 -14.406 -28.100 1.00 0.37 O ATOM 827 CB ILE A 871 -14.263 -11.389 -28.590 1.00 0.46 C ATOM 828 CG1 ILE A 871 -14.718 -9.973 -28.227 1.00 0.53 C ATOM 829 CG2 ILE A 871 -14.174 -11.537 -30.103 1.00 0.74 C ATOM 830 CD1 ILE A 871 -13.576 -9.023 -27.944 1.00 1.03 C ATOM 0 H ILE A 871 -14.374 -12.883 -26.119 1.00 0.38 H new ATOM 0 HA ILE A 871 -16.241 -12.187 -28.295 1.00 0.39 H new ATOM 0 HB ILE A 871 -13.273 -11.559 -28.167 1.00 0.46 H new ATOM 0 HG12 ILE A 871 -15.318 -9.573 -29.044 1.00 0.53 H new ATOM 0 HG13 ILE A 871 -15.364 -10.022 -27.351 1.00 0.53 H new ATOM 0 HG21 ILE A 871 -13.492 -10.787 -30.502 1.00 0.74 H new ATOM 0 HG22 ILE A 871 -13.804 -12.532 -30.350 1.00 0.74 H new ATOM 0 HG23 ILE A 871 -15.163 -11.398 -30.541 1.00 0.74 H new ATOM 0 HD11 ILE A 871 -13.974 -8.040 -27.694 1.00 1.03 H new ATOM 0 HD12 ILE A 871 -12.988 -9.400 -27.107 1.00 1.03 H new ATOM 0 HD13 ILE A 871 -12.941 -8.944 -28.827 1.00 1.03 H new ATOM 842 N VAL A 872 -15.679 -14.367 -29.414 1.00 0.38 N ATOM 843 CA VAL A 872 -15.452 -15.721 -29.918 1.00 0.40 C ATOM 844 C VAL A 872 -15.066 -15.712 -31.399 1.00 0.41 C ATOM 845 O VAL A 872 -15.711 -15.051 -32.208 1.00 0.46 O ATOM 846 CB VAL A 872 -16.706 -16.609 -29.714 1.00 0.49 C ATOM 847 CG1 VAL A 872 -16.626 -17.891 -30.535 1.00 0.59 C ATOM 848 CG2 VAL A 872 -16.887 -16.937 -28.240 1.00 0.67 C ATOM 0 H VAL A 872 -16.494 -13.896 -29.808 1.00 0.38 H new ATOM 0 HA VAL A 872 -14.623 -16.139 -29.346 1.00 0.40 H new ATOM 0 HB VAL A 872 -17.571 -16.045 -30.063 1.00 0.49 H new ATOM 0 HG11 VAL A 872 -17.522 -18.488 -30.366 1.00 0.59 H new ATOM 0 HG12 VAL A 872 -16.550 -17.641 -31.593 1.00 0.59 H new ATOM 0 HG13 VAL A 872 -15.748 -18.462 -30.233 1.00 0.59 H new ATOM 0 HG21 VAL A 872 -17.771 -17.561 -28.112 1.00 0.67 H new ATOM 0 HG22 VAL A 872 -16.010 -17.472 -27.876 1.00 0.67 H new ATOM 0 HG23 VAL A 872 -17.010 -16.013 -27.674 1.00 0.67 H new ATOM 858 N LEU A 873 -14.004 -16.441 -31.736 1.00 0.41 N ATOM 859 CA LEU A 873 -13.592 -16.624 -33.125 1.00 0.44 C ATOM 860 C LEU A 873 -13.663 -18.100 -33.503 1.00 0.42 C ATOM 861 O LEU A 873 -12.758 -18.871 -33.178 1.00 0.50 O ATOM 862 CB LEU A 873 -12.159 -16.122 -33.340 1.00 0.52 C ATOM 863 CG LEU A 873 -11.926 -14.639 -33.060 1.00 0.51 C ATOM 864 CD1 LEU A 873 -10.564 -14.429 -32.417 1.00 0.78 C ATOM 865 CD2 LEU A 873 -12.039 -13.833 -34.345 1.00 0.87 C ATOM 0 H LEU A 873 -13.409 -16.918 -31.059 1.00 0.41 H new ATOM 0 HA LEU A 873 -14.270 -16.048 -33.755 1.00 0.44 H new ATOM 0 HB2 LEU A 873 -11.491 -16.702 -32.703 1.00 0.52 H new ATOM 0 HB3 LEU A 873 -11.873 -16.327 -34.372 1.00 0.52 H new ATOM 0 HG LEU A 873 -12.692 -14.292 -32.367 1.00 0.51 H new ATOM 0 HD11 LEU A 873 -10.413 -13.367 -32.224 1.00 0.78 H new ATOM 0 HD12 LEU A 873 -10.517 -14.979 -31.477 1.00 0.78 H new ATOM 0 HD13 LEU A 873 -9.785 -14.790 -33.089 1.00 0.78 H new ATOM 0 HD21 LEU A 873 -11.870 -12.778 -34.129 1.00 0.87 H new ATOM 0 HD22 LEU A 873 -11.293 -14.181 -35.059 1.00 0.87 H new ATOM 0 HD23 LEU A 873 -13.035 -13.962 -34.769 1.00 0.87 H new ATOM 877 N SER A 874 -14.732 -18.494 -34.180 1.00 0.38 N ATOM 878 CA SER A 874 -14.891 -19.877 -34.601 1.00 0.40 C ATOM 879 C SER A 874 -14.280 -20.082 -35.985 1.00 0.33 C ATOM 880 O SER A 874 -14.861 -19.690 -36.998 1.00 0.34 O ATOM 881 CB SER A 874 -16.369 -20.262 -34.605 1.00 0.53 C ATOM 882 OG SER A 874 -17.166 -19.199 -35.102 1.00 0.73 O ATOM 0 H SER A 874 -15.499 -17.878 -34.448 1.00 0.38 H new ATOM 0 HA SER A 874 -14.368 -20.521 -33.894 1.00 0.40 H new ATOM 0 HB2 SER A 874 -16.516 -21.150 -35.219 1.00 0.53 H new ATOM 0 HB3 SER A 874 -16.685 -20.517 -33.594 1.00 0.53 H new ATOM 0 HG SER A 874 -18.109 -19.467 -35.098 1.00 0.73 H new ATOM 888 N ASP A 875 -13.105 -20.684 -36.010 1.00 0.40 N ATOM 889 CA ASP A 875 -12.355 -20.899 -37.241 1.00 0.44 C ATOM 890 C ASP A 875 -12.662 -22.278 -37.818 1.00 0.48 C ATOM 891 O ASP A 875 -12.391 -23.302 -37.189 1.00 0.55 O ATOM 892 CB ASP A 875 -10.859 -20.765 -36.948 1.00 0.59 C ATOM 893 CG ASP A 875 -9.997 -20.754 -38.194 1.00 0.92 C ATOM 894 OD1 ASP A 875 -10.528 -20.964 -39.302 1.00 1.19 O ATOM 895 OD2 ASP A 875 -8.771 -20.576 -38.064 1.00 1.34 O ATOM 0 H ASP A 875 -12.639 -21.040 -35.175 1.00 0.40 H new ATOM 0 HA ASP A 875 -12.648 -20.151 -37.977 1.00 0.44 H new ATOM 0 HB2 ASP A 875 -10.687 -19.845 -36.389 1.00 0.59 H new ATOM 0 HB3 ASP A 875 -10.547 -21.590 -36.307 1.00 0.59 H new ATOM 900 N VAL A 876 -13.222 -22.296 -39.018 1.00 0.57 N ATOM 901 CA VAL A 876 -13.647 -23.536 -39.651 1.00 0.68 C ATOM 902 C VAL A 876 -13.188 -23.603 -41.105 1.00 0.80 C ATOM 903 O VAL A 876 -13.586 -22.786 -41.937 1.00 1.07 O ATOM 904 CB VAL A 876 -15.185 -23.702 -39.609 1.00 0.77 C ATOM 905 CG1 VAL A 876 -15.601 -24.527 -38.402 1.00 1.29 C ATOM 906 CG2 VAL A 876 -15.884 -22.347 -39.600 1.00 1.03 C ATOM 0 H VAL A 876 -13.394 -21.460 -39.577 1.00 0.57 H new ATOM 0 HA VAL A 876 -13.184 -24.344 -39.085 1.00 0.68 H new ATOM 0 HB VAL A 876 -15.491 -24.231 -40.512 1.00 0.77 H new ATOM 0 HG11 VAL A 876 -16.686 -24.633 -38.390 1.00 1.29 H new ATOM 0 HG12 VAL A 876 -15.141 -25.513 -38.460 1.00 1.29 H new ATOM 0 HG13 VAL A 876 -15.275 -24.027 -37.490 1.00 1.29 H new ATOM 0 HG21 VAL A 876 -16.964 -22.495 -39.570 1.00 1.03 H new ATOM 0 HG22 VAL A 876 -15.571 -21.782 -38.722 1.00 1.03 H new ATOM 0 HG23 VAL A 876 -15.618 -21.794 -40.501 1.00 1.03 H new ATOM 1011 N TYR A 884 -21.585 -22.481 -40.273 1.00 1.69 N ATOM 1012 CA TYR A 884 -22.714 -21.655 -39.866 1.00 1.56 C ATOM 1013 C TYR A 884 -23.460 -22.301 -38.707 1.00 1.24 C ATOM 1014 O TYR A 884 -23.836 -21.649 -37.731 1.00 1.24 O ATOM 1015 CB TYR A 884 -23.668 -21.442 -41.049 1.00 1.85 C ATOM 1016 CG TYR A 884 -24.781 -22.475 -41.170 1.00 1.85 C ATOM 1017 CD1 TYR A 884 -24.555 -23.710 -41.772 1.00 1.99 C ATOM 1018 CD2 TYR A 884 -26.054 -22.214 -40.676 1.00 2.07 C ATOM 1019 CE1 TYR A 884 -25.563 -24.649 -41.876 1.00 2.24 C ATOM 1020 CE2 TYR A 884 -27.066 -23.150 -40.776 1.00 2.36 C ATOM 1021 CZ TYR A 884 -26.815 -24.363 -41.377 1.00 2.40 C ATOM 1022 OH TYR A 884 -27.820 -25.298 -41.473 1.00 2.84 O ATOM 0 HA TYR A 884 -22.332 -20.688 -39.538 1.00 1.56 H new ATOM 0 HB2 TYR A 884 -24.118 -20.453 -40.960 1.00 1.85 H new ATOM 0 HB3 TYR A 884 -23.087 -21.446 -41.971 1.00 1.85 H new ATOM 0 HD1 TYR A 884 -23.575 -23.938 -42.164 1.00 1.99 H new ATOM 0 HD2 TYR A 884 -26.256 -21.263 -40.206 1.00 2.07 H new ATOM 0 HE1 TYR A 884 -25.371 -25.602 -42.346 1.00 2.24 H new ATOM 0 HE2 TYR A 884 -28.049 -22.931 -40.385 1.00 2.36 H new ATOM 0 HH TYR A 884 -28.639 -24.940 -41.072 1.00 2.84 H new ATOM 1032 N ARG A 885 -23.630 -23.606 -38.799 1.00 1.14 N ATOM 1033 CA ARG A 885 -24.512 -24.319 -37.907 1.00 1.03 C ATOM 1034 C ARG A 885 -24.114 -24.115 -36.445 1.00 0.90 C ATOM 1035 O ARG A 885 -24.951 -24.161 -35.545 1.00 0.84 O ATOM 1036 CB ARG A 885 -24.559 -25.807 -38.251 1.00 1.24 C ATOM 1037 CG ARG A 885 -25.932 -26.423 -38.027 1.00 1.61 C ATOM 1038 CD ARG A 885 -26.273 -26.480 -36.545 1.00 1.94 C ATOM 1039 NE ARG A 885 -26.309 -27.843 -36.026 1.00 2.47 N ATOM 1040 CZ ARG A 885 -25.228 -28.566 -35.732 1.00 2.81 C ATOM 1041 NH1 ARG A 885 -24.014 -28.047 -35.878 1.00 3.10 N ATOM 1042 NH2 ARG A 885 -25.370 -29.801 -35.275 1.00 3.36 N ATOM 0 H ARG A 885 -23.163 -24.194 -39.489 1.00 1.14 H new ATOM 0 HA ARG A 885 -25.512 -23.907 -38.041 1.00 1.03 H new ATOM 0 HB2 ARG A 885 -24.271 -25.943 -39.293 1.00 1.24 H new ATOM 0 HB3 ARG A 885 -23.825 -26.338 -37.645 1.00 1.24 H new ATOM 0 HG2 ARG A 885 -26.686 -25.839 -38.554 1.00 1.61 H new ATOM 0 HG3 ARG A 885 -25.956 -27.428 -38.448 1.00 1.61 H new ATOM 0 HD2 ARG A 885 -25.538 -25.902 -35.985 1.00 1.94 H new ATOM 0 HD3 ARG A 885 -27.242 -26.008 -36.381 1.00 1.94 H new ATOM 0 HE ARG A 885 -27.223 -28.272 -35.878 1.00 2.47 H new ATOM 0 HH11 ARG A 885 -23.905 -27.091 -36.216 1.00 3.10 H new ATOM 0 HH12 ARG A 885 -23.190 -28.605 -35.652 1.00 3.10 H new ATOM 0 HH21 ARG A 885 -26.303 -30.194 -35.150 1.00 3.36 H new ATOM 0 HH22 ARG A 885 -24.547 -30.359 -35.048 1.00 3.36 H new ATOM 1056 N LEU A 886 -22.842 -23.855 -36.217 1.00 0.97 N ATOM 1057 CA LEU A 886 -22.318 -23.846 -34.853 1.00 0.97 C ATOM 1058 C LEU A 886 -22.816 -22.601 -34.167 1.00 0.82 C ATOM 1059 O LEU A 886 -23.016 -22.557 -32.955 1.00 0.79 O ATOM 1060 CB LEU A 886 -20.786 -23.880 -34.814 1.00 1.21 C ATOM 1061 CG LEU A 886 -20.091 -24.273 -36.115 1.00 1.54 C ATOM 1062 CD1 LEU A 886 -18.673 -23.719 -36.147 1.00 1.90 C ATOM 1063 CD2 LEU A 886 -20.076 -25.785 -36.283 1.00 2.34 C ATOM 0 H LEU A 886 -22.155 -23.649 -36.943 1.00 0.97 H new ATOM 0 HA LEU A 886 -22.667 -24.744 -34.344 1.00 0.97 H new ATOM 0 HB2 LEU A 886 -20.428 -22.894 -34.518 1.00 1.21 H new ATOM 0 HB3 LEU A 886 -20.478 -24.578 -34.036 1.00 1.21 H new ATOM 0 HG LEU A 886 -20.651 -23.844 -36.946 1.00 1.54 H new ATOM 0 HD11 LEU A 886 -18.191 -24.008 -37.081 1.00 1.90 H new ATOM 0 HD12 LEU A 886 -18.705 -22.632 -36.076 1.00 1.90 H new ATOM 0 HD13 LEU A 886 -18.106 -24.120 -35.307 1.00 1.90 H new ATOM 0 HD21 LEU A 886 -19.576 -26.042 -37.217 1.00 2.34 H new ATOM 0 HD22 LEU A 886 -19.542 -26.239 -35.448 1.00 2.34 H new ATOM 0 HD23 LEU A 886 -21.100 -26.159 -36.305 1.00 2.34 H new ATOM 1075 N THR A 887 -23.058 -21.606 -34.990 1.00 0.80 N ATOM 1076 CA THR A 887 -23.566 -20.345 -34.537 1.00 0.77 C ATOM 1077 C THR A 887 -25.057 -20.454 -34.270 1.00 0.66 C ATOM 1078 O THR A 887 -25.609 -19.752 -33.427 1.00 0.65 O ATOM 1079 CB THR A 887 -23.307 -19.263 -35.584 1.00 0.94 C ATOM 1080 OG1 THR A 887 -21.947 -19.338 -36.035 1.00 1.28 O ATOM 1081 CG2 THR A 887 -23.595 -17.896 -35.012 1.00 1.09 C ATOM 0 H THR A 887 -22.905 -21.656 -35.997 1.00 0.80 H new ATOM 0 HA THR A 887 -23.054 -20.073 -33.614 1.00 0.77 H new ATOM 0 HB THR A 887 -23.972 -19.427 -36.432 1.00 0.94 H new ATOM 0 HG1 THR A 887 -21.864 -18.887 -36.901 1.00 1.28 H new ATOM 0 HG21 THR A 887 -23.405 -17.137 -35.771 1.00 1.09 H new ATOM 0 HG22 THR A 887 -24.638 -17.845 -34.700 1.00 1.09 H new ATOM 0 HG23 THR A 887 -22.950 -17.718 -34.152 1.00 1.09 H new ATOM 1089 N GLN A 888 -25.707 -21.361 -34.993 1.00 0.66 N ATOM 1090 CA GLN A 888 -27.124 -21.622 -34.773 1.00 0.66 C ATOM 1091 C GLN A 888 -27.339 -22.133 -33.355 1.00 0.63 C ATOM 1092 O GLN A 888 -28.280 -21.734 -32.667 1.00 0.65 O ATOM 1093 CB GLN A 888 -27.655 -22.636 -35.788 1.00 0.77 C ATOM 1094 CG GLN A 888 -29.171 -22.721 -35.817 1.00 1.06 C ATOM 1095 CD GLN A 888 -29.676 -23.959 -36.533 1.00 1.38 C ATOM 1096 OE1 GLN A 888 -28.897 -24.805 -36.968 1.00 2.17 O ATOM 1097 NE2 GLN A 888 -30.990 -24.076 -36.657 1.00 1.84 N ATOM 0 H GLN A 888 -25.279 -21.922 -35.729 1.00 0.66 H new ATOM 0 HA GLN A 888 -27.674 -20.690 -34.906 1.00 0.66 H new ATOM 0 HB2 GLN A 888 -27.294 -22.368 -36.781 1.00 0.77 H new ATOM 0 HB3 GLN A 888 -27.247 -23.620 -35.555 1.00 0.77 H new ATOM 0 HG2 GLN A 888 -29.550 -22.718 -34.795 1.00 1.06 H new ATOM 0 HG3 GLN A 888 -29.571 -21.834 -36.308 1.00 1.06 H new ATOM 0 HE21 GLN A 888 -31.604 -23.353 -36.283 1.00 1.84 H new ATOM 0 HE22 GLN A 888 -31.388 -24.889 -37.127 1.00 1.84 H new ATOM 1106 N ARG A 889 -26.445 -23.004 -32.916 1.00 0.64 N ATOM 1107 CA ARG A 889 -26.497 -23.526 -31.561 1.00 0.66 C ATOM 1108 C ARG A 889 -26.176 -22.427 -30.547 1.00 0.63 C ATOM 1109 O ARG A 889 -26.781 -22.371 -29.480 1.00 0.67 O ATOM 1110 CB ARG A 889 -25.528 -24.700 -31.398 1.00 0.71 C ATOM 1111 CG ARG A 889 -26.194 -25.964 -30.876 1.00 0.94 C ATOM 1112 CD ARG A 889 -26.889 -25.714 -29.548 1.00 1.02 C ATOM 1113 NE ARG A 889 -26.297 -26.495 -28.466 1.00 1.36 N ATOM 1114 CZ ARG A 889 -26.895 -26.731 -27.299 1.00 1.67 C ATOM 1115 NH1 ARG A 889 -28.141 -26.317 -27.093 1.00 2.05 N ATOM 1116 NH2 ARG A 889 -26.251 -27.403 -26.354 1.00 2.36 N ATOM 0 H ARG A 889 -25.674 -23.364 -33.479 1.00 0.64 H new ATOM 0 HA ARG A 889 -27.509 -23.884 -31.373 1.00 0.66 H new ATOM 0 HB2 ARG A 889 -25.063 -24.914 -32.360 1.00 0.71 H new ATOM 0 HB3 ARG A 889 -24.729 -24.410 -30.715 1.00 0.71 H new ATOM 0 HG2 ARG A 889 -26.919 -26.324 -31.606 1.00 0.94 H new ATOM 0 HG3 ARG A 889 -25.447 -26.748 -30.756 1.00 0.94 H new ATOM 0 HD2 ARG A 889 -26.832 -24.653 -29.303 1.00 1.02 H new ATOM 0 HD3 ARG A 889 -27.946 -25.964 -29.639 1.00 1.02 H new ATOM 0 HE ARG A 889 -25.366 -26.885 -28.613 1.00 1.36 H new ATOM 0 HH11 ARG A 889 -28.641 -25.818 -27.829 1.00 2.05 H new ATOM 0 HH12 ARG A 889 -28.597 -26.498 -26.199 1.00 2.05 H new ATOM 0 HH21 ARG A 889 -25.302 -27.737 -26.522 1.00 2.36 H new ATOM 0 HH22 ARG A 889 -26.705 -27.586 -25.459 1.00 2.36 H new ATOM 1130 N ILE A 890 -25.236 -21.550 -30.895 1.00 0.61 N ATOM 1131 CA ILE A 890 -24.868 -20.434 -30.023 1.00 0.63 C ATOM 1132 C ILE A 890 -26.048 -19.471 -29.846 1.00 0.62 C ATOM 1133 O ILE A 890 -26.250 -18.913 -28.767 1.00 0.67 O ATOM 1134 CB ILE A 890 -23.608 -19.686 -30.560 1.00 0.69 C ATOM 1135 CG1 ILE A 890 -22.506 -19.659 -29.495 1.00 1.22 C ATOM 1136 CG2 ILE A 890 -23.928 -18.267 -31.027 1.00 0.71 C ATOM 1137 CD1 ILE A 890 -22.892 -18.935 -28.219 1.00 1.71 C ATOM 0 H ILE A 890 -24.716 -21.589 -31.772 1.00 0.61 H new ATOM 0 HA ILE A 890 -24.615 -20.843 -29.045 1.00 0.63 H new ATOM 0 HB ILE A 890 -23.255 -20.240 -31.430 1.00 0.69 H new ATOM 0 HG12 ILE A 890 -22.229 -20.684 -29.248 1.00 1.22 H new ATOM 0 HG13 ILE A 890 -21.621 -19.183 -29.916 1.00 1.22 H new ATOM 0 HG21 ILE A 890 -23.018 -17.790 -31.391 1.00 0.71 H new ATOM 0 HG22 ILE A 890 -24.664 -18.306 -31.830 1.00 0.71 H new ATOM 0 HG23 ILE A 890 -24.331 -17.692 -30.193 1.00 0.71 H new ATOM 0 HD11 ILE A 890 -22.057 -18.962 -27.519 1.00 1.71 H new ATOM 0 HD12 ILE A 890 -23.139 -17.899 -28.449 1.00 1.71 H new ATOM 0 HD13 ILE A 890 -23.757 -19.424 -27.771 1.00 1.71 H new ATOM 1149 N ARG A 891 -26.837 -19.304 -30.903 1.00 0.61 N ATOM 1150 CA ARG A 891 -28.010 -18.445 -30.857 1.00 0.67 C ATOM 1151 C ARG A 891 -29.078 -19.065 -29.960 1.00 0.72 C ATOM 1152 O ARG A 891 -29.743 -18.366 -29.198 1.00 0.80 O ATOM 1153 CB ARG A 891 -28.535 -18.192 -32.281 1.00 0.73 C ATOM 1154 CG ARG A 891 -30.020 -18.472 -32.479 1.00 0.95 C ATOM 1155 CD ARG A 891 -30.242 -19.496 -33.577 1.00 1.10 C ATOM 1156 NE ARG A 891 -31.645 -19.595 -33.968 1.00 1.37 N ATOM 1157 CZ ARG A 891 -32.092 -19.353 -35.196 1.00 1.59 C ATOM 1158 NH1 ARG A 891 -31.260 -18.953 -36.148 1.00 1.97 N ATOM 1159 NH2 ARG A 891 -33.376 -19.510 -35.476 1.00 2.24 N ATOM 0 H ARG A 891 -26.682 -19.755 -31.804 1.00 0.61 H new ATOM 0 HA ARG A 891 -27.738 -17.480 -30.429 1.00 0.67 H new ATOM 0 HB2 ARG A 891 -28.338 -17.153 -32.545 1.00 0.73 H new ATOM 0 HB3 ARG A 891 -27.968 -18.811 -32.976 1.00 0.73 H new ATOM 0 HG2 ARG A 891 -30.452 -18.835 -31.546 1.00 0.95 H new ATOM 0 HG3 ARG A 891 -30.537 -17.546 -32.731 1.00 0.95 H new ATOM 0 HD2 ARG A 891 -29.643 -19.228 -34.447 1.00 1.10 H new ATOM 0 HD3 ARG A 891 -29.892 -20.471 -33.237 1.00 1.10 H new ATOM 0 HE ARG A 891 -32.323 -19.866 -33.256 1.00 1.37 H new ATOM 0 HH11 ARG A 891 -30.269 -18.829 -35.940 1.00 1.97 H new ATOM 0 HH12 ARG A 891 -31.611 -18.769 -37.088 1.00 1.97 H new ATOM 0 HH21 ARG A 891 -34.023 -19.817 -34.749 1.00 2.24 H new ATOM 0 HH22 ARG A 891 -33.719 -19.324 -36.419 1.00 2.24 H new ATOM 1173 N GLN A 892 -29.216 -20.383 -30.043 1.00 0.74 N ATOM 1174 CA GLN A 892 -30.154 -21.115 -29.200 1.00 0.84 C ATOM 1175 C GLN A 892 -29.729 -21.014 -27.736 1.00 0.87 C ATOM 1176 O GLN A 892 -30.560 -20.895 -26.833 1.00 0.99 O ATOM 1177 CB GLN A 892 -30.210 -22.582 -29.643 1.00 0.91 C ATOM 1178 CG GLN A 892 -30.523 -23.560 -28.521 1.00 1.23 C ATOM 1179 CD GLN A 892 -30.972 -24.912 -29.030 1.00 1.87 C ATOM 1180 OE1 GLN A 892 -30.181 -25.854 -29.106 1.00 2.62 O ATOM 1181 NE2 GLN A 892 -32.242 -25.015 -29.384 1.00 2.39 N ATOM 0 H GLN A 892 -28.687 -20.969 -30.689 1.00 0.74 H new ATOM 0 HA GLN A 892 -31.148 -20.679 -29.302 1.00 0.84 H new ATOM 0 HB2 GLN A 892 -30.965 -22.686 -30.422 1.00 0.91 H new ATOM 0 HB3 GLN A 892 -29.253 -22.852 -30.089 1.00 0.91 H new ATOM 0 HG2 GLN A 892 -29.637 -23.687 -27.898 1.00 1.23 H new ATOM 0 HG3 GLN A 892 -31.302 -23.139 -27.885 1.00 1.23 H new ATOM 0 HE21 GLN A 892 -32.861 -24.208 -29.304 1.00 2.39 H new ATOM 0 HE22 GLN A 892 -32.603 -25.901 -29.737 1.00 2.39 H new ATOM 1190 N LEU A 893 -28.422 -21.051 -27.520 1.00 0.81 N ATOM 1191 CA LEU A 893 -27.847 -20.992 -26.186 1.00 0.87 C ATOM 1192 C LEU A 893 -28.019 -19.603 -25.569 1.00 0.88 C ATOM 1193 O LEU A 893 -28.018 -19.448 -24.345 1.00 1.05 O ATOM 1194 CB LEU A 893 -26.364 -21.369 -26.256 1.00 0.90 C ATOM 1195 CG LEU A 893 -25.614 -21.320 -24.925 1.00 1.12 C ATOM 1196 CD1 LEU A 893 -25.821 -22.612 -24.149 1.00 1.48 C ATOM 1197 CD2 LEU A 893 -24.133 -21.066 -25.158 1.00 1.91 C ATOM 0 H LEU A 893 -27.730 -21.123 -28.266 1.00 0.81 H new ATOM 0 HA LEU A 893 -28.372 -21.701 -25.547 1.00 0.87 H new ATOM 0 HB2 LEU A 893 -26.281 -22.376 -26.664 1.00 0.90 H new ATOM 0 HB3 LEU A 893 -25.868 -20.699 -26.958 1.00 0.90 H new ATOM 0 HG LEU A 893 -26.014 -20.497 -24.333 1.00 1.12 H new ATOM 0 HD11 LEU A 893 -25.280 -22.560 -23.204 1.00 1.48 H new ATOM 0 HD12 LEU A 893 -26.884 -22.751 -23.951 1.00 1.48 H new ATOM 0 HD13 LEU A 893 -25.448 -23.452 -24.735 1.00 1.48 H new ATOM 0 HD21 LEU A 893 -23.614 -21.034 -24.200 1.00 1.91 H new ATOM 0 HD22 LEU A 893 -23.718 -21.868 -25.769 1.00 1.91 H new ATOM 0 HD23 LEU A 893 -24.004 -20.114 -25.672 1.00 1.91 H new ATOM 1209 N GLY A 894 -28.173 -18.597 -26.420 1.00 0.82 N ATOM 1210 CA GLY A 894 -28.349 -17.240 -25.944 1.00 0.87 C ATOM 1211 C GLY A 894 -27.031 -16.502 -25.843 1.00 0.82 C ATOM 1212 O GLY A 894 -26.503 -16.295 -24.748 1.00 1.12 O ATOM 0 H GLY A 894 -28.179 -18.698 -27.435 1.00 0.82 H new ATOM 0 HA2 GLY A 894 -29.015 -16.702 -26.618 1.00 0.87 H new ATOM 0 HA3 GLY A 894 -28.831 -17.258 -24.967 1.00 0.87 H new ATOM 1216 N LEU A 895 -26.488 -16.124 -26.991 1.00 0.75 N ATOM 1217 CA LEU A 895 -25.227 -15.400 -27.042 1.00 0.81 C ATOM 1218 C LEU A 895 -25.379 -13.989 -26.489 1.00 0.85 C ATOM 1219 O LEU A 895 -26.329 -13.279 -26.814 1.00 1.21 O ATOM 1220 CB LEU A 895 -24.700 -15.335 -28.479 1.00 1.19 C ATOM 1221 CG LEU A 895 -25.554 -14.515 -29.452 1.00 2.21 C ATOM 1222 CD1 LEU A 895 -24.689 -13.550 -30.244 1.00 2.89 C ATOM 1223 CD2 LEU A 895 -26.321 -15.431 -30.388 1.00 2.82 C ATOM 0 H LEU A 895 -26.904 -16.308 -27.904 1.00 0.75 H new ATOM 0 HA LEU A 895 -24.512 -15.941 -26.422 1.00 0.81 H new ATOM 0 HB2 LEU A 895 -23.694 -14.915 -28.461 1.00 1.19 H new ATOM 0 HB3 LEU A 895 -24.615 -16.351 -28.864 1.00 1.19 H new ATOM 0 HG LEU A 895 -26.271 -13.934 -28.871 1.00 2.21 H new ATOM 0 HD11 LEU A 895 -25.315 -12.978 -30.929 1.00 2.89 H new ATOM 0 HD12 LEU A 895 -24.183 -12.869 -29.560 1.00 2.89 H new ATOM 0 HD13 LEU A 895 -23.947 -14.110 -30.813 1.00 2.89 H new ATOM 0 HD21 LEU A 895 -26.922 -14.832 -31.072 1.00 2.82 H new ATOM 0 HD22 LEU A 895 -25.619 -16.038 -30.959 1.00 2.82 H new ATOM 0 HD23 LEU A 895 -26.974 -16.082 -29.806 1.00 2.82 H new ATOM 1235 N THR A 896 -24.444 -13.596 -25.642 1.00 0.91 N ATOM 1236 CA THR A 896 -24.408 -12.240 -25.120 1.00 1.21 C ATOM 1237 C THR A 896 -23.078 -11.582 -25.464 1.00 1.12 C ATOM 1238 O THR A 896 -22.604 -10.693 -24.757 1.00 1.48 O ATOM 1239 CB THR A 896 -24.616 -12.224 -23.597 1.00 1.68 C ATOM 1240 OG1 THR A 896 -24.864 -13.557 -23.127 1.00 2.49 O ATOM 1241 CG2 THR A 896 -25.785 -11.325 -23.228 1.00 1.70 C ATOM 0 H THR A 896 -23.696 -14.199 -25.299 1.00 0.91 H new ATOM 0 HA THR A 896 -25.221 -11.681 -25.583 1.00 1.21 H new ATOM 0 HB THR A 896 -23.713 -11.835 -23.126 1.00 1.68 H new ATOM 0 HG1 THR A 896 -24.994 -13.542 -22.156 1.00 2.49 H new ATOM 0 HG21 THR A 896 -25.917 -11.326 -22.146 1.00 1.70 H new ATOM 0 HG22 THR A 896 -25.584 -10.309 -23.568 1.00 1.70 H new ATOM 0 HG23 THR A 896 -26.693 -11.694 -23.705 1.00 1.70 H new ATOM 1249 N LEU A 897 -22.486 -12.038 -26.559 1.00 0.81 N ATOM 1250 CA LEU A 897 -21.189 -11.553 -26.997 1.00 0.78 C ATOM 1251 C LEU A 897 -21.060 -11.726 -28.505 1.00 0.56 C ATOM 1252 O LEU A 897 -21.710 -12.596 -29.084 1.00 0.57 O ATOM 1253 CB LEU A 897 -20.071 -12.309 -26.274 1.00 0.98 C ATOM 1254 CG LEU A 897 -20.137 -13.830 -26.386 1.00 0.92 C ATOM 1255 CD1 LEU A 897 -18.863 -14.368 -27.016 1.00 1.20 C ATOM 1256 CD2 LEU A 897 -20.369 -14.455 -25.019 1.00 1.40 C ATOM 0 H LEU A 897 -22.891 -12.752 -27.165 1.00 0.81 H new ATOM 0 HA LEU A 897 -21.101 -10.494 -26.754 1.00 0.78 H new ATOM 0 HB2 LEU A 897 -19.112 -11.973 -26.669 1.00 0.98 H new ATOM 0 HB3 LEU A 897 -20.094 -12.037 -25.219 1.00 0.98 H new ATOM 0 HG LEU A 897 -20.977 -14.096 -27.028 1.00 0.92 H new ATOM 0 HD11 LEU A 897 -18.924 -15.454 -27.090 1.00 1.20 H new ATOM 0 HD12 LEU A 897 -18.742 -13.943 -28.012 1.00 1.20 H new ATOM 0 HD13 LEU A 897 -18.008 -14.094 -26.398 1.00 1.20 H new ATOM 0 HD21 LEU A 897 -20.413 -15.540 -25.118 1.00 1.40 H new ATOM 0 HD22 LEU A 897 -19.551 -14.184 -24.352 1.00 1.40 H new ATOM 0 HD23 LEU A 897 -21.309 -14.089 -24.607 1.00 1.40 H new ATOM 1268 N PRO A 898 -20.240 -10.889 -29.158 1.00 0.49 N ATOM 1269 CA PRO A 898 -20.058 -10.929 -30.613 1.00 0.42 C ATOM 1270 C PRO A 898 -19.345 -12.195 -31.087 1.00 0.38 C ATOM 1271 O PRO A 898 -18.325 -12.608 -30.511 1.00 0.42 O ATOM 1272 CB PRO A 898 -19.196 -9.692 -30.911 1.00 0.50 C ATOM 1273 CG PRO A 898 -19.235 -8.866 -29.669 1.00 0.73 C ATOM 1274 CD PRO A 898 -19.430 -9.833 -28.538 1.00 0.63 C ATOM 0 HA PRO A 898 -21.017 -10.933 -31.131 1.00 0.42 H new ATOM 0 HB2 PRO A 898 -18.174 -9.977 -31.160 1.00 0.50 H new ATOM 0 HB3 PRO A 898 -19.588 -9.137 -31.763 1.00 0.50 H new ATOM 0 HG2 PRO A 898 -18.310 -8.302 -29.546 1.00 0.73 H new ATOM 0 HG3 PRO A 898 -20.048 -8.141 -29.707 1.00 0.73 H new ATOM 0 HD2 PRO A 898 -18.481 -10.217 -28.164 1.00 0.63 H new ATOM 0 HD3 PRO A 898 -19.942 -9.372 -27.694 1.00 0.63 H new ATOM 1282 N VAL A 899 -19.883 -12.811 -32.135 1.00 0.36 N ATOM 1283 CA VAL A 899 -19.270 -13.998 -32.708 1.00 0.39 C ATOM 1284 C VAL A 899 -18.679 -13.685 -34.078 1.00 0.39 C ATOM 1285 O VAL A 899 -19.361 -13.163 -34.964 1.00 0.47 O ATOM 1286 CB VAL A 899 -20.281 -15.158 -32.834 1.00 0.47 C ATOM 1287 CG1 VAL A 899 -19.594 -16.420 -33.338 1.00 0.64 C ATOM 1288 CG2 VAL A 899 -20.961 -15.422 -31.498 1.00 0.50 C ATOM 0 H VAL A 899 -20.738 -12.508 -32.601 1.00 0.36 H new ATOM 0 HA VAL A 899 -18.475 -14.310 -32.031 1.00 0.39 H new ATOM 0 HB VAL A 899 -21.042 -14.869 -33.559 1.00 0.47 H new ATOM 0 HG11 VAL A 899 -20.325 -17.224 -33.419 1.00 0.64 H new ATOM 0 HG12 VAL A 899 -19.155 -16.229 -34.317 1.00 0.64 H new ATOM 0 HG13 VAL A 899 -18.810 -16.711 -32.639 1.00 0.64 H new ATOM 0 HG21 VAL A 899 -21.670 -16.243 -31.607 1.00 0.50 H new ATOM 0 HG22 VAL A 899 -20.210 -15.687 -30.754 1.00 0.50 H new ATOM 0 HG23 VAL A 899 -21.491 -14.525 -31.176 1.00 0.50 H new ATOM 1298 N ILE A 900 -17.401 -13.980 -34.239 1.00 0.37 N ATOM 1299 CA ILE A 900 -16.720 -13.775 -35.503 1.00 0.38 C ATOM 1300 C ILE A 900 -16.344 -15.117 -36.116 1.00 0.40 C ATOM 1301 O ILE A 900 -15.534 -15.861 -35.560 1.00 0.48 O ATOM 1302 CB ILE A 900 -15.450 -12.913 -35.338 1.00 0.42 C ATOM 1303 CG1 ILE A 900 -15.667 -11.835 -34.272 1.00 0.53 C ATOM 1304 CG2 ILE A 900 -15.071 -12.283 -36.669 1.00 0.61 C ATOM 1305 CD1 ILE A 900 -14.395 -11.128 -33.856 1.00 0.64 C ATOM 0 H ILE A 900 -16.810 -14.366 -33.502 1.00 0.37 H new ATOM 0 HA ILE A 900 -17.407 -13.244 -36.162 1.00 0.38 H new ATOM 0 HB ILE A 900 -14.631 -13.554 -35.010 1.00 0.42 H new ATOM 0 HG12 ILE A 900 -16.375 -11.098 -34.652 1.00 0.53 H new ATOM 0 HG13 ILE A 900 -16.123 -12.291 -33.393 1.00 0.53 H new ATOM 0 HG21 ILE A 900 -14.174 -11.677 -36.542 1.00 0.61 H new ATOM 0 HG22 ILE A 900 -14.879 -13.067 -37.401 1.00 0.61 H new ATOM 0 HG23 ILE A 900 -15.888 -11.653 -37.019 1.00 0.61 H new ATOM 0 HD11 ILE A 900 -14.626 -10.379 -33.099 1.00 0.64 H new ATOM 0 HD12 ILE A 900 -13.693 -11.854 -33.446 1.00 0.64 H new ATOM 0 HD13 ILE A 900 -13.949 -10.642 -34.723 1.00 0.64 H new ATOM 1317 N GLY A 901 -16.946 -15.430 -37.250 1.00 0.39 N ATOM 1318 CA GLY A 901 -16.679 -16.692 -37.902 1.00 0.44 C ATOM 1319 C GLY A 901 -15.533 -16.594 -38.884 1.00 0.40 C ATOM 1320 O GLY A 901 -15.550 -15.760 -39.785 1.00 0.48 O ATOM 0 H GLY A 901 -17.617 -14.831 -37.732 1.00 0.39 H new ATOM 0 HA2 GLY A 901 -16.448 -17.446 -37.150 1.00 0.44 H new ATOM 0 HA3 GLY A 901 -17.575 -17.027 -38.424 1.00 0.44 H new ATOM 1324 N VAL A 902 -14.533 -17.436 -38.700 1.00 0.38 N ATOM 1325 CA VAL A 902 -13.398 -17.490 -39.605 1.00 0.39 C ATOM 1326 C VAL A 902 -13.612 -18.612 -40.609 1.00 0.40 C ATOM 1327 O VAL A 902 -13.342 -19.772 -40.320 1.00 0.59 O ATOM 1328 CB VAL A 902 -12.072 -17.723 -38.847 1.00 0.51 C ATOM 1329 CG1 VAL A 902 -10.898 -17.192 -39.647 1.00 0.89 C ATOM 1330 CG2 VAL A 902 -12.112 -17.078 -37.467 1.00 1.04 C ATOM 0 H VAL A 902 -14.483 -18.098 -37.925 1.00 0.38 H new ATOM 0 HA VAL A 902 -13.326 -16.530 -40.116 1.00 0.39 H new ATOM 0 HB VAL A 902 -11.944 -18.797 -38.716 1.00 0.51 H new ATOM 0 HG11 VAL A 902 -9.974 -17.366 -39.096 1.00 0.89 H new ATOM 0 HG12 VAL A 902 -10.850 -17.706 -40.607 1.00 0.89 H new ATOM 0 HG13 VAL A 902 -11.025 -16.122 -39.814 1.00 0.89 H new ATOM 0 HG21 VAL A 902 -11.167 -17.257 -36.954 1.00 1.04 H new ATOM 0 HG22 VAL A 902 -12.271 -16.005 -37.571 1.00 1.04 H new ATOM 0 HG23 VAL A 902 -12.927 -17.511 -36.887 1.00 1.04 H new ATOM 1340 N THR A 903 -14.119 -18.269 -41.775 1.00 0.44 N ATOM 1341 CA THR A 903 -14.521 -19.265 -42.749 1.00 0.53 C ATOM 1342 C THR A 903 -13.696 -19.164 -44.030 1.00 0.59 C ATOM 1343 O THR A 903 -12.892 -18.246 -44.198 1.00 0.72 O ATOM 1344 CB THR A 903 -16.014 -19.095 -43.083 1.00 0.67 C ATOM 1345 OG1 THR A 903 -16.339 -17.701 -43.150 1.00 0.89 O ATOM 1346 CG2 THR A 903 -16.880 -19.758 -42.026 1.00 0.83 C ATOM 0 H THR A 903 -14.263 -17.304 -42.073 1.00 0.44 H new ATOM 0 HA THR A 903 -14.347 -20.248 -42.312 1.00 0.53 H new ATOM 0 HB THR A 903 -16.206 -19.568 -44.046 1.00 0.67 H new ATOM 0 HG1 THR A 903 -16.950 -17.543 -43.900 1.00 0.89 H new ATOM 0 HG21 THR A 903 -17.931 -19.626 -42.282 1.00 0.83 H new ATOM 0 HG22 THR A 903 -16.649 -20.822 -41.981 1.00 0.83 H new ATOM 0 HG23 THR A 903 -16.683 -19.302 -41.056 1.00 0.83 H new ATOM 1354 N ALA A 904 -13.868 -20.135 -44.918 1.00 0.72 N ATOM 1355 CA ALA A 904 -13.252 -20.074 -46.233 1.00 0.84 C ATOM 1356 C ALA A 904 -14.174 -20.684 -47.281 1.00 0.92 C ATOM 1357 O ALA A 904 -14.261 -21.908 -47.398 1.00 1.19 O ATOM 1358 CB ALA A 904 -11.903 -20.783 -46.228 1.00 1.07 C ATOM 0 H ALA A 904 -14.428 -20.971 -44.750 1.00 0.72 H new ATOM 0 HA ALA A 904 -13.086 -19.027 -46.487 1.00 0.84 H new ATOM 0 HB1 ALA A 904 -11.458 -20.726 -47.222 1.00 1.07 H new ATOM 0 HB2 ALA A 904 -11.242 -20.303 -45.507 1.00 1.07 H new ATOM 0 HB3 ALA A 904 -12.042 -21.828 -45.952 1.00 1.07 H new ATOM 1364 N ASN A 905 -14.834 -19.815 -48.041 1.00 1.03 N ATOM 1365 CA ASN A 905 -15.744 -20.218 -49.120 1.00 1.27 C ATOM 1366 C ASN A 905 -16.723 -21.297 -48.672 1.00 1.48 C ATOM 1367 O ASN A 905 -16.702 -22.423 -49.174 1.00 2.14 O ATOM 1368 CB ASN A 905 -14.964 -20.695 -50.343 1.00 1.73 C ATOM 1369 CG ASN A 905 -15.630 -20.280 -51.642 1.00 2.13 C ATOM 1370 OD1 ASN A 905 -16.550 -20.942 -52.128 1.00 2.42 O ATOM 1371 ND2 ASN A 905 -15.172 -19.176 -52.212 1.00 2.70 N ATOM 0 H ASN A 905 -14.755 -18.804 -47.929 1.00 1.03 H new ATOM 0 HA ASN A 905 -16.323 -19.335 -49.390 1.00 1.27 H new ATOM 0 HB2 ASN A 905 -13.953 -20.289 -50.309 1.00 1.73 H new ATOM 0 HB3 ASN A 905 -14.873 -21.781 -50.314 1.00 1.73 H new ATOM 0 HD21 ASN A 905 -15.582 -18.845 -53.085 1.00 2.70 H new ATOM 0 HD22 ASN A 905 -14.409 -18.657 -51.778 1.00 2.70 H new ATOM 1378 N ALA A 906 -17.592 -20.944 -47.741 1.00 1.42 N ATOM 1379 CA ALA A 906 -18.592 -21.876 -47.234 1.00 1.94 C ATOM 1380 C ALA A 906 -19.812 -21.906 -48.152 1.00 2.10 C ATOM 1381 O ALA A 906 -20.952 -21.798 -47.695 1.00 2.81 O ATOM 1382 CB ALA A 906 -18.993 -21.500 -45.814 1.00 2.30 C ATOM 0 H ALA A 906 -17.628 -20.017 -47.318 1.00 1.42 H new ATOM 0 HA ALA A 906 -18.158 -22.876 -47.215 1.00 1.94 H new ATOM 0 HB1 ALA A 906 -19.740 -22.204 -45.448 1.00 2.30 H new ATOM 0 HB2 ALA A 906 -18.116 -21.533 -45.167 1.00 2.30 H new ATOM 0 HB3 ALA A 906 -19.410 -20.493 -45.808 1.00 2.30 H new ATOM 1388 N LEU A 907 -19.548 -22.059 -49.453 1.00 1.83 N ATOM 1389 CA LEU A 907 -20.583 -22.060 -50.490 1.00 2.05 C ATOM 1390 C LEU A 907 -21.250 -20.689 -50.600 1.00 1.86 C ATOM 1391 O LEU A 907 -20.989 -19.934 -51.538 1.00 2.51 O ATOM 1392 CB LEU A 907 -21.634 -23.147 -50.219 1.00 2.52 C ATOM 1393 CG LEU A 907 -22.209 -23.822 -51.465 1.00 3.20 C ATOM 1394 CD1 LEU A 907 -21.836 -25.296 -51.495 1.00 3.93 C ATOM 1395 CD2 LEU A 907 -23.719 -23.652 -51.514 1.00 3.55 C ATOM 0 H LEU A 907 -18.604 -22.186 -49.818 1.00 1.83 H new ATOM 0 HA LEU A 907 -20.098 -22.282 -51.441 1.00 2.05 H new ATOM 0 HB2 LEU A 907 -21.187 -23.912 -49.585 1.00 2.52 H new ATOM 0 HB3 LEU A 907 -22.454 -22.704 -49.654 1.00 2.52 H new ATOM 0 HG LEU A 907 -21.780 -23.342 -52.345 1.00 3.20 H new ATOM 0 HD11 LEU A 907 -22.254 -25.759 -52.389 1.00 3.93 H new ATOM 0 HD12 LEU A 907 -20.751 -25.396 -51.508 1.00 3.93 H new ATOM 0 HD13 LEU A 907 -22.235 -25.790 -50.610 1.00 3.93 H new ATOM 0 HD21 LEU A 907 -24.111 -24.138 -52.407 1.00 3.55 H new ATOM 0 HD22 LEU A 907 -24.165 -24.105 -50.629 1.00 3.55 H new ATOM 0 HD23 LEU A 907 -23.965 -22.590 -51.541 1.00 3.55 H new ATOM 1407 N ALA A 908 -22.087 -20.373 -49.629 1.00 1.67 N ATOM 1408 CA ALA A 908 -22.804 -19.113 -49.598 1.00 1.75 C ATOM 1409 C ALA A 908 -22.936 -18.642 -48.158 1.00 1.63 C ATOM 1410 O ALA A 908 -24.006 -18.743 -47.552 1.00 1.53 O ATOM 1411 CB ALA A 908 -24.172 -19.260 -50.252 1.00 2.09 C ATOM 0 H ALA A 908 -22.289 -20.985 -48.838 1.00 1.67 H new ATOM 0 HA ALA A 908 -22.246 -18.366 -50.163 1.00 1.75 H new ATOM 0 HB1 ALA A 908 -24.695 -18.304 -50.219 1.00 2.09 H new ATOM 0 HB2 ALA A 908 -24.048 -19.571 -51.289 1.00 2.09 H new ATOM 0 HB3 ALA A 908 -24.753 -20.010 -49.716 1.00 2.09 H new ATOM 1417 N GLU A 909 -21.838 -18.131 -47.617 1.00 1.71 N ATOM 1418 CA GLU A 909 -21.773 -17.738 -46.213 1.00 1.70 C ATOM 1419 C GLU A 909 -22.791 -16.655 -45.887 1.00 1.59 C ATOM 1420 O GLU A 909 -23.214 -16.527 -44.747 1.00 1.46 O ATOM 1421 CB GLU A 909 -20.376 -17.244 -45.850 1.00 1.97 C ATOM 1422 CG GLU A 909 -19.375 -17.304 -46.994 1.00 2.30 C ATOM 1423 CD GLU A 909 -17.973 -17.636 -46.528 1.00 2.85 C ATOM 1424 OE1 GLU A 909 -17.614 -17.268 -45.393 1.00 3.31 O ATOM 1425 OE2 GLU A 909 -17.228 -18.270 -47.302 1.00 3.28 O ATOM 0 H GLU A 909 -20.972 -17.977 -48.134 1.00 1.71 H new ATOM 0 HA GLU A 909 -22.007 -18.624 -45.623 1.00 1.70 H new ATOM 0 HB2 GLU A 909 -20.447 -16.215 -45.498 1.00 1.97 H new ATOM 0 HB3 GLU A 909 -19.997 -17.839 -45.019 1.00 1.97 H new ATOM 0 HG2 GLU A 909 -19.700 -18.053 -47.717 1.00 2.30 H new ATOM 0 HG3 GLU A 909 -19.364 -16.345 -47.512 1.00 2.30 H new ATOM 1432 N GLU A 910 -23.177 -15.875 -46.885 1.00 1.70 N ATOM 1433 CA GLU A 910 -24.200 -14.855 -46.698 1.00 1.71 C ATOM 1434 C GLU A 910 -25.522 -15.504 -46.286 1.00 1.51 C ATOM 1435 O GLU A 910 -26.189 -15.059 -45.344 1.00 1.45 O ATOM 1436 CB GLU A 910 -24.388 -14.033 -47.981 1.00 1.95 C ATOM 1437 CG GLU A 910 -24.442 -14.867 -49.255 1.00 2.30 C ATOM 1438 CD GLU A 910 -23.090 -15.009 -49.918 1.00 2.97 C ATOM 1439 OE1 GLU A 910 -22.271 -15.811 -49.435 1.00 3.58 O ATOM 1440 OE2 GLU A 910 -22.843 -14.325 -50.932 1.00 3.43 O ATOM 0 H GLU A 910 -22.799 -15.928 -47.831 1.00 1.70 H new ATOM 0 HA GLU A 910 -23.875 -14.182 -45.905 1.00 1.71 H new ATOM 0 HB2 GLU A 910 -25.309 -13.457 -47.898 1.00 1.95 H new ATOM 0 HB3 GLU A 910 -23.570 -13.317 -48.063 1.00 1.95 H new ATOM 0 HG2 GLU A 910 -24.832 -15.857 -49.020 1.00 2.30 H new ATOM 0 HG3 GLU A 910 -25.139 -14.408 -49.956 1.00 2.30 H new ATOM 1447 N LYS A 911 -25.869 -16.584 -46.972 1.00 1.45 N ATOM 1448 CA LYS A 911 -27.110 -17.288 -46.708 1.00 1.34 C ATOM 1449 C LYS A 911 -27.045 -17.998 -45.364 1.00 1.19 C ATOM 1450 O LYS A 911 -28.013 -17.998 -44.606 1.00 1.13 O ATOM 1451 CB LYS A 911 -27.400 -18.302 -47.816 1.00 1.41 C ATOM 1452 CG LYS A 911 -28.833 -18.814 -47.813 1.00 1.46 C ATOM 1453 CD LYS A 911 -28.929 -20.209 -47.220 1.00 1.59 C ATOM 1454 CE LYS A 911 -30.087 -20.992 -47.813 1.00 1.83 C ATOM 1455 NZ LYS A 911 -29.620 -22.017 -48.782 1.00 2.29 N ATOM 0 H LYS A 911 -25.304 -16.991 -47.718 1.00 1.45 H new ATOM 0 HA LYS A 911 -27.916 -16.555 -46.682 1.00 1.34 H new ATOM 0 HB2 LYS A 911 -27.189 -17.843 -48.782 1.00 1.41 H new ATOM 0 HB3 LYS A 911 -26.721 -19.148 -47.710 1.00 1.41 H new ATOM 0 HG2 LYS A 911 -29.462 -18.131 -47.242 1.00 1.46 H new ATOM 0 HG3 LYS A 911 -29.218 -18.825 -48.833 1.00 1.46 H new ATOM 0 HD2 LYS A 911 -27.997 -20.746 -47.399 1.00 1.59 H new ATOM 0 HD3 LYS A 911 -29.053 -20.138 -46.139 1.00 1.59 H new ATOM 0 HE2 LYS A 911 -30.646 -21.476 -47.013 1.00 1.83 H new ATOM 0 HE3 LYS A 911 -30.772 -20.306 -48.311 1.00 1.83 H new ATOM 0 HZ1 LYS A 911 -30.439 -22.531 -49.165 1.00 2.29 H new ATOM 0 HZ2 LYS A 911 -29.108 -21.552 -49.559 1.00 2.29 H new ATOM 0 HZ3 LYS A 911 -28.986 -22.686 -48.301 1.00 2.29 H new ATOM 1469 N GLN A 912 -25.894 -18.587 -45.059 1.00 1.20 N ATOM 1470 CA GLN A 912 -25.749 -19.344 -43.826 1.00 1.16 C ATOM 1471 C GLN A 912 -25.659 -18.409 -42.626 1.00 1.08 C ATOM 1472 O GLN A 912 -26.059 -18.772 -41.524 1.00 1.00 O ATOM 1473 CB GLN A 912 -24.542 -20.275 -43.882 1.00 1.35 C ATOM 1474 CG GLN A 912 -24.845 -21.613 -44.539 1.00 1.50 C ATOM 1475 CD GLN A 912 -24.864 -21.543 -46.052 1.00 2.04 C ATOM 1476 OE1 GLN A 912 -25.872 -21.180 -46.659 1.00 2.65 O ATOM 1477 NE2 GLN A 912 -23.765 -21.921 -46.675 1.00 2.53 N ATOM 0 H GLN A 912 -25.058 -18.555 -45.642 1.00 1.20 H new ATOM 0 HA GLN A 912 -26.638 -19.964 -43.711 1.00 1.16 H new ATOM 0 HB2 GLN A 912 -23.738 -19.783 -44.429 1.00 1.35 H new ATOM 0 HB3 GLN A 912 -24.179 -20.449 -42.869 1.00 1.35 H new ATOM 0 HG2 GLN A 912 -24.098 -22.342 -44.225 1.00 1.50 H new ATOM 0 HG3 GLN A 912 -25.811 -21.973 -44.186 1.00 1.50 H new ATOM 0 HE21 GLN A 912 -22.950 -22.215 -46.137 1.00 2.53 H new ATOM 0 HE22 GLN A 912 -23.730 -21.919 -47.694 1.00 2.53 H new ATOM 1486 N ARG A 913 -25.144 -17.206 -42.849 1.00 1.17 N ATOM 1487 CA ARG A 913 -25.107 -16.181 -41.810 1.00 1.19 C ATOM 1488 C ARG A 913 -26.525 -15.806 -41.394 1.00 1.09 C ATOM 1489 O ARG A 913 -26.797 -15.533 -40.225 1.00 1.07 O ATOM 1490 CB ARG A 913 -24.356 -14.940 -42.297 1.00 1.40 C ATOM 1491 CG ARG A 913 -23.610 -14.201 -41.195 1.00 1.47 C ATOM 1492 CD ARG A 913 -24.257 -12.858 -40.893 1.00 1.72 C ATOM 1493 NE ARG A 913 -23.284 -11.843 -40.479 1.00 2.36 N ATOM 1494 CZ ARG A 913 -22.517 -11.148 -41.323 1.00 3.09 C ATOM 1495 NH1 ARG A 913 -22.558 -11.387 -42.626 1.00 3.38 N ATOM 1496 NH2 ARG A 913 -21.704 -10.206 -40.859 1.00 4.05 N ATOM 0 H ARG A 913 -24.745 -16.915 -43.741 1.00 1.17 H new ATOM 0 HA ARG A 913 -24.578 -16.585 -40.947 1.00 1.19 H new ATOM 0 HB2 ARG A 913 -23.645 -15.236 -43.068 1.00 1.40 H new ATOM 0 HB3 ARG A 913 -25.066 -14.257 -42.763 1.00 1.40 H new ATOM 0 HG2 ARG A 913 -23.594 -14.811 -40.292 1.00 1.47 H new ATOM 0 HG3 ARG A 913 -22.573 -14.048 -41.494 1.00 1.47 H new ATOM 0 HD2 ARG A 913 -24.788 -12.507 -41.778 1.00 1.72 H new ATOM 0 HD3 ARG A 913 -25.000 -12.986 -40.106 1.00 1.72 H new ATOM 0 HE ARG A 913 -23.186 -11.655 -39.481 1.00 2.36 H new ATOM 0 HH11 ARG A 913 -23.180 -12.108 -42.993 1.00 3.38 H new ATOM 0 HH12 ARG A 913 -21.968 -10.850 -43.262 1.00 3.38 H new ATOM 0 HH21 ARG A 913 -21.665 -10.013 -39.858 1.00 4.05 H new ATOM 0 HH22 ARG A 913 -21.118 -9.675 -41.504 1.00 4.05 H new ATOM 1510 N CYS A 914 -27.428 -15.790 -42.363 1.00 1.12 N ATOM 1511 CA CYS A 914 -28.838 -15.578 -42.072 1.00 1.16 C ATOM 1512 C CYS A 914 -29.442 -16.828 -41.433 1.00 1.02 C ATOM 1513 O CYS A 914 -30.424 -16.751 -40.690 1.00 1.08 O ATOM 1514 CB CYS A 914 -29.599 -15.219 -43.350 1.00 1.36 C ATOM 1515 SG CYS A 914 -28.776 -13.969 -44.365 1.00 1.65 S ATOM 0 H CYS A 914 -27.212 -15.920 -43.351 1.00 1.12 H new ATOM 0 HA CYS A 914 -28.925 -14.749 -41.370 1.00 1.16 H new ATOM 0 HB2 CYS A 914 -29.738 -16.122 -43.944 1.00 1.36 H new ATOM 0 HB3 CYS A 914 -30.592 -14.859 -43.081 1.00 1.36 H new ATOM 0 HG CYS A 914 -27.623 -14.421 -44.761 1.00 1.65 H new ATOM 1521 N LEU A 915 -28.847 -17.979 -41.737 1.00 0.93 N ATOM 1522 CA LEU A 915 -29.331 -19.259 -41.242 1.00 0.94 C ATOM 1523 C LEU A 915 -29.063 -19.434 -39.743 1.00 0.87 C ATOM 1524 O LEU A 915 -29.981 -19.759 -38.987 1.00 0.96 O ATOM 1525 CB LEU A 915 -28.702 -20.407 -42.035 1.00 1.01 C ATOM 1526 CG LEU A 915 -29.676 -21.214 -42.900 1.00 1.21 C ATOM 1527 CD1 LEU A 915 -30.579 -20.291 -43.703 1.00 1.82 C ATOM 1528 CD2 LEU A 915 -28.910 -22.146 -43.828 1.00 1.88 C ATOM 0 H LEU A 915 -28.020 -18.048 -42.330 1.00 0.93 H new ATOM 0 HA LEU A 915 -30.412 -19.277 -41.383 1.00 0.94 H new ATOM 0 HB2 LEU A 915 -27.923 -19.998 -42.678 1.00 1.01 H new ATOM 0 HB3 LEU A 915 -28.214 -21.086 -41.335 1.00 1.01 H new ATOM 0 HG LEU A 915 -30.303 -21.814 -42.240 1.00 1.21 H new ATOM 0 HD11 LEU A 915 -31.262 -20.887 -44.309 1.00 1.82 H new ATOM 0 HD12 LEU A 915 -31.153 -19.661 -43.023 1.00 1.82 H new ATOM 0 HD13 LEU A 915 -29.971 -19.662 -44.353 1.00 1.82 H new ATOM 0 HD21 LEU A 915 -29.614 -22.713 -44.437 1.00 1.88 H new ATOM 0 HD22 LEU A 915 -28.260 -21.559 -44.477 1.00 1.88 H new ATOM 0 HD23 LEU A 915 -28.306 -22.834 -43.236 1.00 1.88 H new ATOM 1540 N GLU A 916 -27.816 -19.230 -39.301 1.00 0.82 N ATOM 1541 CA GLU A 916 -27.508 -19.365 -37.876 1.00 0.84 C ATOM 1542 C GLU A 916 -27.977 -18.134 -37.105 1.00 0.74 C ATOM 1543 O GLU A 916 -28.569 -18.257 -36.029 1.00 0.76 O ATOM 1544 CB GLU A 916 -26.016 -19.660 -37.596 1.00 1.00 C ATOM 1545 CG GLU A 916 -25.005 -19.144 -38.612 1.00 1.74 C ATOM 1546 CD GLU A 916 -24.671 -17.666 -38.478 1.00 2.82 C ATOM 1547 OE1 GLU A 916 -25.109 -17.028 -37.497 1.00 3.40 O ATOM 1548 OE2 GLU A 916 -23.948 -17.146 -39.343 1.00 3.47 O ATOM 0 H GLU A 916 -27.024 -18.978 -39.893 1.00 0.82 H new ATOM 0 HA GLU A 916 -28.059 -20.237 -37.522 1.00 0.84 H new ATOM 0 HB2 GLU A 916 -25.764 -19.237 -36.623 1.00 1.00 H new ATOM 0 HB3 GLU A 916 -25.894 -20.740 -37.516 1.00 1.00 H new ATOM 0 HG2 GLU A 916 -24.085 -19.721 -38.515 1.00 1.74 H new ATOM 0 HG3 GLU A 916 -25.392 -19.326 -39.615 1.00 1.74 H new ATOM 1555 N SER A 917 -27.737 -16.962 -37.684 1.00 0.74 N ATOM 1556 CA SER A 917 -28.163 -15.685 -37.117 1.00 0.80 C ATOM 1557 C SER A 917 -27.735 -15.512 -35.658 1.00 0.76 C ATOM 1558 O SER A 917 -28.551 -15.161 -34.800 1.00 0.86 O ATOM 1559 CB SER A 917 -29.678 -15.550 -37.216 1.00 0.95 C ATOM 1560 OG SER A 917 -30.053 -14.745 -38.325 1.00 1.35 O ATOM 0 H SER A 917 -27.237 -16.870 -38.568 1.00 0.74 H new ATOM 0 HA SER A 917 -27.672 -14.904 -37.698 1.00 0.80 H new ATOM 0 HB2 SER A 917 -30.128 -16.538 -37.313 1.00 0.95 H new ATOM 0 HB3 SER A 917 -30.067 -15.111 -36.297 1.00 0.95 H new ATOM 0 HG SER A 917 -30.202 -15.315 -39.108 1.00 1.35 H new ATOM 1566 N GLY A 918 -26.464 -15.749 -35.376 1.00 0.73 N ATOM 1567 CA GLY A 918 -25.961 -15.509 -34.036 1.00 0.82 C ATOM 1568 C GLY A 918 -24.517 -15.059 -34.031 1.00 0.77 C ATOM 1569 O GLY A 918 -23.876 -15.024 -32.984 1.00 1.02 O ATOM 0 H GLY A 918 -25.776 -16.100 -36.042 1.00 0.73 H new ATOM 0 HA2 GLY A 918 -26.576 -14.751 -33.551 1.00 0.82 H new ATOM 0 HA3 GLY A 918 -26.056 -16.421 -33.447 1.00 0.82 H new ATOM 1573 N MET A 919 -24.001 -14.734 -35.207 1.00 0.62 N ATOM 1574 CA MET A 919 -22.599 -14.374 -35.362 1.00 0.59 C ATOM 1575 C MET A 919 -22.386 -12.879 -35.128 1.00 0.55 C ATOM 1576 O MET A 919 -22.618 -12.375 -34.024 1.00 0.54 O ATOM 1577 CB MET A 919 -22.130 -14.767 -36.768 1.00 0.73 C ATOM 1578 CG MET A 919 -20.917 -15.678 -36.785 1.00 0.90 C ATOM 1579 SD MET A 919 -20.027 -15.604 -38.352 1.00 1.46 S ATOM 1580 CE MET A 919 -20.716 -17.024 -39.200 1.00 2.01 C ATOM 0 H MET A 919 -24.537 -14.712 -36.074 1.00 0.62 H new ATOM 0 HA MET A 919 -22.012 -14.912 -34.617 1.00 0.59 H new ATOM 0 HB2 MET A 919 -22.950 -15.262 -37.288 1.00 0.73 H new ATOM 0 HB3 MET A 919 -21.898 -13.861 -37.328 1.00 0.73 H new ATOM 0 HG2 MET A 919 -20.244 -15.399 -35.974 1.00 0.90 H new ATOM 0 HG3 MET A 919 -21.233 -16.704 -36.598 1.00 0.90 H new ATOM 0 HE1 MET A 919 -19.952 -17.795 -39.298 1.00 2.01 H new ATOM 0 HE2 MET A 919 -21.557 -17.416 -38.628 1.00 2.01 H new ATOM 0 HE3 MET A 919 -21.059 -16.725 -40.191 1.00 2.01 H new ATOM 1590 N ASP A 920 -21.904 -12.204 -36.173 1.00 0.60 N ATOM 1591 CA ASP A 920 -21.752 -10.749 -36.212 1.00 0.66 C ATOM 1592 C ASP A 920 -20.864 -10.373 -37.386 1.00 0.62 C ATOM 1593 O ASP A 920 -21.245 -9.567 -38.232 1.00 0.76 O ATOM 1594 CB ASP A 920 -21.155 -10.167 -34.924 1.00 0.72 C ATOM 1595 CG ASP A 920 -21.487 -8.694 -34.755 1.00 0.83 C ATOM 1596 OD1 ASP A 920 -22.423 -8.208 -35.423 1.00 1.26 O ATOM 1597 OD2 ASP A 920 -20.826 -8.015 -33.939 1.00 1.01 O ATOM 0 H ASP A 920 -21.603 -12.663 -37.033 1.00 0.60 H new ATOM 0 HA ASP A 920 -22.751 -10.327 -36.319 1.00 0.66 H new ATOM 0 HB2 ASP A 920 -21.532 -10.724 -34.066 1.00 0.72 H new ATOM 0 HB3 ASP A 920 -20.073 -10.295 -34.936 1.00 0.72 H new ATOM 1602 N SER A 921 -19.690 -10.987 -37.450 1.00 0.54 N ATOM 1603 CA SER A 921 -18.744 -10.712 -38.527 1.00 0.59 C ATOM 1604 C SER A 921 -18.137 -12.007 -39.061 1.00 0.51 C ATOM 1605 O SER A 921 -18.121 -13.023 -38.370 1.00 0.61 O ATOM 1606 CB SER A 921 -17.637 -9.782 -38.030 1.00 0.76 C ATOM 1607 OG SER A 921 -17.562 -9.798 -36.614 1.00 1.26 O ATOM 0 H SER A 921 -19.369 -11.677 -36.771 1.00 0.54 H new ATOM 0 HA SER A 921 -19.283 -10.224 -39.339 1.00 0.59 H new ATOM 0 HB2 SER A 921 -16.681 -10.090 -38.453 1.00 0.76 H new ATOM 0 HB3 SER A 921 -17.827 -8.766 -38.377 1.00 0.76 H new ATOM 0 HG SER A 921 -17.722 -8.895 -36.268 1.00 1.26 H new ATOM 1613 N CYS A 922 -17.642 -11.962 -40.291 1.00 0.49 N ATOM 1614 CA CYS A 922 -17.031 -13.125 -40.916 1.00 0.48 C ATOM 1615 C CYS A 922 -15.707 -12.744 -41.571 1.00 0.49 C ATOM 1616 O CYS A 922 -15.574 -11.656 -42.140 1.00 0.60 O ATOM 1617 CB CYS A 922 -17.981 -13.723 -41.956 1.00 0.59 C ATOM 1618 SG CYS A 922 -19.308 -12.605 -42.468 1.00 1.13 S ATOM 0 H CYS A 922 -17.653 -11.127 -40.877 1.00 0.49 H new ATOM 0 HA CYS A 922 -16.835 -13.871 -40.146 1.00 0.48 H new ATOM 0 HB2 CYS A 922 -17.405 -14.014 -42.835 1.00 0.59 H new ATOM 0 HB3 CYS A 922 -18.423 -14.633 -41.549 1.00 0.59 H new ATOM 0 HG CYS A 922 -20.058 -13.197 -43.350 1.00 1.13 H new ATOM 1624 N LEU A 923 -14.733 -13.637 -41.476 1.00 0.44 N ATOM 1625 CA LEU A 923 -13.415 -13.420 -42.058 1.00 0.46 C ATOM 1626 C LEU A 923 -12.953 -14.676 -42.777 1.00 0.43 C ATOM 1627 O LEU A 923 -13.694 -15.648 -42.875 1.00 0.43 O ATOM 1628 CB LEU A 923 -12.384 -13.050 -40.985 1.00 0.53 C ATOM 1629 CG LEU A 923 -12.954 -12.628 -39.634 1.00 0.55 C ATOM 1630 CD1 LEU A 923 -12.128 -13.220 -38.506 1.00 0.69 C ATOM 1631 CD2 LEU A 923 -12.992 -11.112 -39.529 1.00 0.66 C ATOM 0 H LEU A 923 -14.833 -14.531 -40.995 1.00 0.44 H new ATOM 0 HA LEU A 923 -13.496 -12.593 -42.763 1.00 0.46 H new ATOM 0 HB2 LEU A 923 -11.726 -13.905 -40.830 1.00 0.53 H new ATOM 0 HB3 LEU A 923 -11.766 -12.238 -41.367 1.00 0.53 H new ATOM 0 HG LEU A 923 -13.973 -13.006 -39.550 1.00 0.55 H new ATOM 0 HD11 LEU A 923 -12.546 -12.911 -37.548 1.00 0.69 H new ATOM 0 HD12 LEU A 923 -12.145 -14.308 -38.575 1.00 0.69 H new ATOM 0 HD13 LEU A 923 -11.100 -12.867 -38.584 1.00 0.69 H new ATOM 0 HD21 LEU A 923 -13.401 -10.825 -38.560 1.00 0.66 H new ATOM 0 HD22 LEU A 923 -11.982 -10.715 -39.629 1.00 0.66 H new ATOM 0 HD23 LEU A 923 -13.621 -10.708 -40.322 1.00 0.66 H new ATOM 1643 N SER A 924 -11.729 -14.653 -43.273 1.00 0.48 N ATOM 1644 CA SER A 924 -11.157 -15.811 -43.932 1.00 0.53 C ATOM 1645 C SER A 924 -10.124 -16.472 -43.027 1.00 0.50 C ATOM 1646 O SER A 924 -9.484 -15.796 -42.222 1.00 0.51 O ATOM 1647 CB SER A 924 -10.523 -15.396 -45.255 1.00 0.67 C ATOM 1648 OG SER A 924 -11.383 -14.519 -45.966 1.00 0.89 O ATOM 0 H SER A 924 -11.111 -13.842 -43.231 1.00 0.48 H new ATOM 0 HA SER A 924 -11.948 -16.532 -44.136 1.00 0.53 H new ATOM 0 HB2 SER A 924 -9.567 -14.906 -45.069 1.00 0.67 H new ATOM 0 HB3 SER A 924 -10.316 -16.280 -45.858 1.00 0.67 H new ATOM 0 HG SER A 924 -10.960 -14.261 -46.812 1.00 0.89 H new ATOM 1654 N LYS A 925 -9.987 -17.790 -43.170 1.00 0.54 N ATOM 1655 CA LYS A 925 -9.064 -18.597 -42.359 1.00 0.57 C ATOM 1656 C LYS A 925 -7.676 -17.949 -42.188 1.00 0.61 C ATOM 1657 O LYS A 925 -7.201 -17.816 -41.059 1.00 0.64 O ATOM 1658 CB LYS A 925 -8.919 -19.997 -42.966 1.00 0.64 C ATOM 1659 CG LYS A 925 -8.082 -20.943 -42.122 1.00 0.60 C ATOM 1660 CD LYS A 925 -8.896 -22.137 -41.661 1.00 0.86 C ATOM 1661 CE LYS A 925 -8.168 -22.954 -40.605 1.00 1.03 C ATOM 1662 NZ LYS A 925 -9.034 -23.224 -39.431 1.00 1.11 N ATOM 0 H LYS A 925 -10.514 -18.334 -43.853 1.00 0.54 H new ATOM 0 HA LYS A 925 -9.501 -18.664 -41.363 1.00 0.57 H new ATOM 0 HB2 LYS A 925 -9.910 -20.428 -43.105 1.00 0.64 H new ATOM 0 HB3 LYS A 925 -8.468 -19.910 -43.955 1.00 0.64 H new ATOM 0 HG2 LYS A 925 -7.224 -21.286 -42.700 1.00 0.60 H new ATOM 0 HG3 LYS A 925 -7.690 -20.411 -41.255 1.00 0.60 H new ATOM 0 HD2 LYS A 925 -9.848 -21.792 -41.259 1.00 0.86 H new ATOM 0 HD3 LYS A 925 -9.123 -22.772 -42.517 1.00 0.86 H new ATOM 0 HE2 LYS A 925 -7.837 -23.898 -41.038 1.00 1.03 H new ATOM 0 HE3 LYS A 925 -7.274 -22.420 -40.283 1.00 1.03 H new ATOM 0 HZ1 LYS A 925 -8.502 -23.037 -38.557 1.00 1.11 H new ATOM 0 HZ2 LYS A 925 -9.870 -22.606 -39.467 1.00 1.11 H new ATOM 0 HZ3 LYS A 925 -9.338 -24.219 -39.445 1.00 1.11 H new ATOM 1676 N PRO A 926 -6.986 -17.555 -43.282 1.00 0.68 N ATOM 1677 CA PRO A 926 -5.675 -16.913 -43.171 1.00 0.77 C ATOM 1678 C PRO A 926 -5.776 -15.444 -42.763 1.00 0.70 C ATOM 1679 O PRO A 926 -5.427 -14.550 -43.535 1.00 0.80 O ATOM 1680 CB PRO A 926 -5.100 -17.045 -44.582 1.00 0.94 C ATOM 1681 CG PRO A 926 -6.291 -17.050 -45.473 1.00 1.01 C ATOM 1682 CD PRO A 926 -7.398 -17.710 -44.694 1.00 0.73 C ATOM 0 HA PRO A 926 -5.057 -17.373 -42.400 1.00 0.77 H new ATOM 0 HB2 PRO A 926 -4.432 -16.216 -44.817 1.00 0.94 H new ATOM 0 HB3 PRO A 926 -4.520 -17.962 -44.690 1.00 0.94 H new ATOM 0 HG2 PRO A 926 -6.568 -16.035 -45.758 1.00 1.01 H new ATOM 0 HG3 PRO A 926 -6.085 -17.595 -46.394 1.00 1.01 H new ATOM 0 HD2 PRO A 926 -8.359 -17.232 -44.884 1.00 0.73 H new ATOM 0 HD3 PRO A 926 -7.505 -18.760 -44.965 1.00 0.73 H new ATOM 1690 N VAL A 927 -6.258 -15.199 -41.549 1.00 0.63 N ATOM 1691 CA VAL A 927 -6.360 -13.840 -41.024 1.00 0.63 C ATOM 1692 C VAL A 927 -4.974 -13.237 -40.836 1.00 0.69 C ATOM 1693 O VAL A 927 -4.162 -13.747 -40.061 1.00 1.10 O ATOM 1694 CB VAL A 927 -7.117 -13.774 -39.675 1.00 0.63 C ATOM 1695 CG1 VAL A 927 -8.134 -12.642 -39.700 1.00 1.36 C ATOM 1696 CG2 VAL A 927 -7.795 -15.097 -39.353 1.00 1.14 C ATOM 0 H VAL A 927 -6.584 -15.923 -40.909 1.00 0.63 H new ATOM 0 HA VAL A 927 -6.928 -13.270 -41.759 1.00 0.63 H new ATOM 0 HB VAL A 927 -6.389 -13.578 -38.888 1.00 0.63 H new ATOM 0 HG11 VAL A 927 -8.661 -12.605 -38.746 1.00 1.36 H new ATOM 0 HG12 VAL A 927 -7.621 -11.695 -39.868 1.00 1.36 H new ATOM 0 HG13 VAL A 927 -8.850 -12.814 -40.503 1.00 1.36 H new ATOM 0 HG21 VAL A 927 -8.317 -15.016 -38.400 1.00 1.14 H new ATOM 0 HG22 VAL A 927 -8.510 -15.340 -40.139 1.00 1.14 H new ATOM 0 HG23 VAL A 927 -7.044 -15.885 -39.289 1.00 1.14 H new ATOM 1706 N THR A 928 -4.702 -12.167 -41.566 1.00 0.51 N ATOM 1707 CA THR A 928 -3.413 -11.502 -41.498 1.00 0.58 C ATOM 1708 C THR A 928 -3.369 -10.522 -40.323 1.00 0.50 C ATOM 1709 O THR A 928 -4.398 -10.250 -39.703 1.00 0.46 O ATOM 1710 CB THR A 928 -3.129 -10.766 -42.815 1.00 0.71 C ATOM 1711 OG1 THR A 928 -4.324 -10.714 -43.611 1.00 0.80 O ATOM 1712 CG2 THR A 928 -2.027 -11.463 -43.596 1.00 0.92 C ATOM 0 H THR A 928 -5.362 -11.739 -42.216 1.00 0.51 H new ATOM 0 HA THR A 928 -2.643 -12.258 -41.341 1.00 0.58 H new ATOM 0 HB THR A 928 -2.802 -9.753 -42.579 1.00 0.71 H new ATOM 0 HG1 THR A 928 -4.138 -10.242 -44.449 1.00 0.80 H new ATOM 0 HG21 THR A 928 -1.843 -10.924 -44.525 1.00 0.92 H new ATOM 0 HG22 THR A 928 -1.114 -11.481 -43.000 1.00 0.92 H new ATOM 0 HG23 THR A 928 -2.332 -12.484 -43.823 1.00 0.92 H new ATOM 1720 N LEU A 929 -2.182 -9.996 -40.028 1.00 0.52 N ATOM 1721 CA LEU A 929 -1.982 -9.112 -38.876 1.00 0.51 C ATOM 1722 C LEU A 929 -2.873 -7.874 -38.950 1.00 0.49 C ATOM 1723 O LEU A 929 -3.522 -7.509 -37.971 1.00 0.51 O ATOM 1724 CB LEU A 929 -0.508 -8.687 -38.794 1.00 0.59 C ATOM 1725 CG LEU A 929 -0.019 -8.151 -37.437 1.00 0.67 C ATOM 1726 CD1 LEU A 929 -0.045 -6.629 -37.425 1.00 0.92 C ATOM 1727 CD2 LEU A 929 -0.843 -8.711 -36.284 1.00 0.71 C ATOM 0 H LEU A 929 -1.337 -10.167 -40.574 1.00 0.52 H new ATOM 0 HA LEU A 929 -2.257 -9.668 -37.980 1.00 0.51 H new ATOM 0 HB2 LEU A 929 0.109 -9.544 -39.064 1.00 0.59 H new ATOM 0 HB3 LEU A 929 -0.333 -7.918 -39.547 1.00 0.59 H new ATOM 0 HG LEU A 929 1.010 -8.485 -37.299 1.00 0.67 H new ATOM 0 HD11 LEU A 929 0.304 -6.267 -36.458 1.00 0.92 H new ATOM 0 HD12 LEU A 929 0.606 -6.248 -38.212 1.00 0.92 H new ATOM 0 HD13 LEU A 929 -1.064 -6.281 -37.597 1.00 0.92 H new ATOM 0 HD21 LEU A 929 -0.469 -8.311 -35.342 1.00 0.71 H new ATOM 0 HD22 LEU A 929 -1.887 -8.425 -36.411 1.00 0.71 H new ATOM 0 HD23 LEU A 929 -0.763 -9.798 -36.274 1.00 0.71 H new ATOM 1739 N ASP A 930 -2.917 -7.243 -40.110 1.00 0.54 N ATOM 1740 CA ASP A 930 -3.648 -5.991 -40.267 1.00 0.63 C ATOM 1741 C ASP A 930 -5.145 -6.229 -40.173 1.00 0.53 C ATOM 1742 O ASP A 930 -5.860 -5.491 -39.493 1.00 0.52 O ATOM 1743 CB ASP A 930 -3.310 -5.331 -41.601 1.00 0.85 C ATOM 1744 CG ASP A 930 -3.342 -3.817 -41.525 1.00 1.34 C ATOM 1745 OD1 ASP A 930 -3.452 -3.278 -40.402 1.00 1.73 O ATOM 1746 OD2 ASP A 930 -3.263 -3.159 -42.581 1.00 1.85 O ATOM 0 H ASP A 930 -2.457 -7.574 -40.958 1.00 0.54 H new ATOM 0 HA ASP A 930 -3.347 -5.323 -39.460 1.00 0.63 H new ATOM 0 HB2 ASP A 930 -2.320 -5.654 -41.922 1.00 0.85 H new ATOM 0 HB3 ASP A 930 -4.017 -5.668 -42.359 1.00 0.85 H new ATOM 1751 N VAL A 931 -5.607 -7.276 -40.841 1.00 0.52 N ATOM 1752 CA VAL A 931 -7.022 -7.623 -40.839 1.00 0.50 C ATOM 1753 C VAL A 931 -7.482 -8.005 -39.438 1.00 0.43 C ATOM 1754 O VAL A 931 -8.504 -7.516 -38.956 1.00 0.44 O ATOM 1755 CB VAL A 931 -7.320 -8.781 -41.817 1.00 0.60 C ATOM 1756 CG1 VAL A 931 -8.760 -9.258 -41.680 1.00 0.70 C ATOM 1757 CG2 VAL A 931 -7.040 -8.342 -43.243 1.00 0.93 C ATOM 0 H VAL A 931 -5.021 -7.902 -41.393 1.00 0.52 H new ATOM 0 HA VAL A 931 -7.573 -6.742 -41.169 1.00 0.50 H new ATOM 0 HB VAL A 931 -6.666 -9.617 -41.568 1.00 0.60 H new ATOM 0 HG11 VAL A 931 -8.941 -10.073 -42.380 1.00 0.70 H new ATOM 0 HG12 VAL A 931 -8.932 -9.609 -40.662 1.00 0.70 H new ATOM 0 HG13 VAL A 931 -9.439 -8.434 -41.899 1.00 0.70 H new ATOM 0 HG21 VAL A 931 -7.253 -9.165 -43.925 1.00 0.93 H new ATOM 0 HG22 VAL A 931 -7.673 -7.491 -43.493 1.00 0.93 H new ATOM 0 HG23 VAL A 931 -5.993 -8.055 -43.336 1.00 0.93 H new ATOM 1767 N ILE A 932 -6.706 -8.859 -38.779 1.00 0.40 N ATOM 1768 CA ILE A 932 -7.038 -9.308 -37.437 1.00 0.41 C ATOM 1769 C ILE A 932 -7.008 -8.144 -36.447 1.00 0.39 C ATOM 1770 O ILE A 932 -7.787 -8.108 -35.504 1.00 0.39 O ATOM 1771 CB ILE A 932 -6.096 -10.452 -36.971 1.00 0.49 C ATOM 1772 CG1 ILE A 932 -6.884 -11.476 -36.158 1.00 0.77 C ATOM 1773 CG2 ILE A 932 -4.911 -9.927 -36.168 1.00 0.57 C ATOM 1774 CD1 ILE A 932 -6.132 -12.765 -35.917 1.00 1.18 C ATOM 0 H ILE A 932 -5.843 -9.253 -39.155 1.00 0.40 H new ATOM 0 HA ILE A 932 -8.053 -9.705 -37.466 1.00 0.41 H new ATOM 0 HB ILE A 932 -5.691 -10.933 -37.861 1.00 0.49 H new ATOM 0 HG12 ILE A 932 -7.152 -11.036 -35.197 1.00 0.77 H new ATOM 0 HG13 ILE A 932 -7.816 -11.700 -36.677 1.00 0.77 H new ATOM 0 HG21 ILE A 932 -4.280 -10.762 -35.863 1.00 0.57 H new ATOM 0 HG22 ILE A 932 -4.331 -9.239 -36.783 1.00 0.57 H new ATOM 0 HG23 ILE A 932 -5.274 -9.405 -35.283 1.00 0.57 H new ATOM 0 HD11 ILE A 932 -6.753 -13.445 -35.333 1.00 1.18 H new ATOM 0 HD12 ILE A 932 -5.887 -13.228 -36.873 1.00 1.18 H new ATOM 0 HD13 ILE A 932 -5.213 -12.553 -35.370 1.00 1.18 H new ATOM 1786 N LYS A 933 -6.122 -7.184 -36.686 1.00 0.40 N ATOM 1787 CA LYS A 933 -6.012 -6.009 -35.841 1.00 0.43 C ATOM 1788 C LYS A 933 -7.249 -5.138 -35.973 1.00 0.43 C ATOM 1789 O LYS A 933 -7.696 -4.528 -35.001 1.00 0.44 O ATOM 1790 CB LYS A 933 -4.773 -5.218 -36.237 1.00 0.50 C ATOM 1791 CG LYS A 933 -3.776 -5.033 -35.113 1.00 0.79 C ATOM 1792 CD LYS A 933 -3.328 -3.589 -35.027 1.00 1.08 C ATOM 1793 CE LYS A 933 -2.425 -3.212 -36.192 1.00 1.50 C ATOM 1794 NZ LYS A 933 -2.729 -1.854 -36.713 1.00 1.90 N ATOM 0 H LYS A 933 -5.465 -7.201 -37.466 1.00 0.40 H new ATOM 0 HA LYS A 933 -5.926 -6.326 -34.802 1.00 0.43 H new ATOM 0 HB2 LYS A 933 -4.280 -5.725 -37.066 1.00 0.50 H new ATOM 0 HB3 LYS A 933 -5.081 -4.238 -36.601 1.00 0.50 H new ATOM 0 HG2 LYS A 933 -4.226 -5.336 -34.168 1.00 0.79 H new ATOM 0 HG3 LYS A 933 -2.912 -5.678 -35.276 1.00 0.79 H new ATOM 0 HD2 LYS A 933 -4.201 -2.937 -35.017 1.00 1.08 H new ATOM 0 HD3 LYS A 933 -2.798 -3.427 -34.088 1.00 1.08 H new ATOM 0 HE2 LYS A 933 -1.384 -3.253 -35.872 1.00 1.50 H new ATOM 0 HE3 LYS A 933 -2.542 -3.942 -36.993 1.00 1.50 H new ATOM 0 HZ1 LYS A 933 -2.092 -1.636 -37.506 1.00 1.90 H new ATOM 0 HZ2 LYS A 933 -3.715 -1.821 -37.042 1.00 1.90 H new ATOM 0 HZ3 LYS A 933 -2.593 -1.153 -35.956 1.00 1.90 H new ATOM 1808 N GLN A 934 -7.800 -5.093 -37.177 1.00 0.47 N ATOM 1809 CA GLN A 934 -9.003 -4.316 -37.443 1.00 0.53 C ATOM 1810 C GLN A 934 -10.178 -4.864 -36.643 1.00 0.46 C ATOM 1811 O GLN A 934 -10.814 -4.135 -35.882 1.00 0.47 O ATOM 1812 CB GLN A 934 -9.334 -4.327 -38.938 1.00 0.69 C ATOM 1813 CG GLN A 934 -8.283 -3.643 -39.793 1.00 0.79 C ATOM 1814 CD GLN A 934 -8.799 -2.384 -40.457 1.00 1.51 C ATOM 1815 OE1 GLN A 934 -8.266 -1.296 -40.247 1.00 2.06 O ATOM 1816 NE2 GLN A 934 -9.840 -2.524 -41.265 1.00 2.25 N ATOM 0 H GLN A 934 -7.431 -5.588 -37.989 1.00 0.47 H new ATOM 0 HA GLN A 934 -8.818 -3.287 -37.136 1.00 0.53 H new ATOM 0 HB2 GLN A 934 -9.446 -5.359 -39.270 1.00 0.69 H new ATOM 0 HB3 GLN A 934 -10.294 -3.836 -39.094 1.00 0.69 H new ATOM 0 HG2 GLN A 934 -7.421 -3.395 -39.173 1.00 0.79 H new ATOM 0 HG3 GLN A 934 -7.936 -4.337 -40.559 1.00 0.79 H new ATOM 0 HE21 GLN A 934 -10.252 -3.446 -41.411 1.00 2.25 H new ATOM 0 HE22 GLN A 934 -10.229 -1.710 -41.741 1.00 2.25 H new ATOM 1825 N THR A 935 -10.446 -6.156 -36.802 1.00 0.44 N ATOM 1826 CA THR A 935 -11.551 -6.798 -36.101 1.00 0.43 C ATOM 1827 C THR A 935 -11.319 -6.795 -34.592 1.00 0.38 C ATOM 1828 O THR A 935 -12.240 -6.534 -33.815 1.00 0.40 O ATOM 1829 CB THR A 935 -11.749 -8.243 -36.587 1.00 0.51 C ATOM 1830 OG1 THR A 935 -11.027 -8.445 -37.810 1.00 0.62 O ATOM 1831 CG2 THR A 935 -13.226 -8.536 -36.805 1.00 0.57 C ATOM 0 H THR A 935 -9.913 -6.778 -37.410 1.00 0.44 H new ATOM 0 HA THR A 935 -12.451 -6.225 -36.322 1.00 0.43 H new ATOM 0 HB THR A 935 -11.369 -8.923 -35.825 1.00 0.51 H new ATOM 0 HG1 THR A 935 -11.154 -9.367 -38.116 1.00 0.62 H new ATOM 0 HG21 THR A 935 -13.346 -9.563 -37.149 1.00 0.57 H new ATOM 0 HG22 THR A 935 -13.766 -8.402 -35.868 1.00 0.57 H new ATOM 0 HG23 THR A 935 -13.626 -7.853 -37.555 1.00 0.57 H new ATOM 1839 N LEU A 936 -10.079 -7.065 -34.193 1.00 0.37 N ATOM 1840 CA LEU A 936 -9.709 -7.111 -32.785 1.00 0.40 C ATOM 1841 C LEU A 936 -9.965 -5.774 -32.109 1.00 0.40 C ATOM 1842 O LEU A 936 -10.708 -5.698 -31.140 1.00 0.43 O ATOM 1843 CB LEU A 936 -8.231 -7.479 -32.626 1.00 0.46 C ATOM 1844 CG LEU A 936 -7.945 -8.786 -31.884 1.00 0.55 C ATOM 1845 CD1 LEU A 936 -8.659 -8.813 -30.540 1.00 0.86 C ATOM 1846 CD2 LEU A 936 -8.354 -9.978 -32.734 1.00 0.67 C ATOM 0 H LEU A 936 -9.308 -7.257 -34.833 1.00 0.37 H new ATOM 0 HA LEU A 936 -10.326 -7.874 -32.310 1.00 0.40 H new ATOM 0 HB2 LEU A 936 -7.783 -7.541 -33.618 1.00 0.46 H new ATOM 0 HB3 LEU A 936 -7.729 -6.667 -32.100 1.00 0.46 H new ATOM 0 HG LEU A 936 -6.873 -8.847 -31.697 1.00 0.55 H new ATOM 0 HD11 LEU A 936 -8.441 -9.752 -30.031 1.00 0.86 H new ATOM 0 HD12 LEU A 936 -8.314 -7.980 -29.928 1.00 0.86 H new ATOM 0 HD13 LEU A 936 -9.734 -8.727 -30.697 1.00 0.86 H new ATOM 0 HD21 LEU A 936 -8.144 -10.900 -32.192 1.00 0.67 H new ATOM 0 HD22 LEU A 936 -9.420 -9.920 -32.953 1.00 0.67 H new ATOM 0 HD23 LEU A 936 -7.791 -9.969 -33.667 1.00 0.67 H new ATOM 1858 N THR A 937 -9.350 -4.724 -32.635 1.00 0.43 N ATOM 1859 CA THR A 937 -9.458 -3.398 -32.044 1.00 0.51 C ATOM 1860 C THR A 937 -10.902 -2.893 -32.066 1.00 0.48 C ATOM 1861 O THR A 937 -11.391 -2.334 -31.081 1.00 0.52 O ATOM 1862 CB THR A 937 -8.544 -2.397 -32.778 1.00 0.62 C ATOM 1863 OG1 THR A 937 -7.220 -2.942 -32.892 1.00 0.67 O ATOM 1864 CG2 THR A 937 -8.488 -1.062 -32.047 1.00 0.87 C ATOM 0 H THR A 937 -8.769 -4.765 -33.473 1.00 0.43 H new ATOM 0 HA THR A 937 -9.137 -3.477 -31.005 1.00 0.51 H new ATOM 0 HB THR A 937 -8.958 -2.224 -33.771 1.00 0.62 H new ATOM 0 HG1 THR A 937 -7.120 -3.379 -33.763 1.00 0.67 H new ATOM 0 HG21 THR A 937 -7.836 -0.377 -32.589 1.00 0.87 H new ATOM 0 HG22 THR A 937 -9.490 -0.638 -31.987 1.00 0.87 H new ATOM 0 HG23 THR A 937 -8.098 -1.214 -31.041 1.00 0.87 H new ATOM 1872 N LEU A 938 -11.591 -3.122 -33.181 1.00 0.45 N ATOM 1873 CA LEU A 938 -12.965 -2.660 -33.344 1.00 0.49 C ATOM 1874 C LEU A 938 -13.898 -3.319 -32.334 1.00 0.45 C ATOM 1875 O LEU A 938 -14.761 -2.665 -31.750 1.00 0.50 O ATOM 1876 CB LEU A 938 -13.459 -2.951 -34.763 1.00 0.55 C ATOM 1877 CG LEU A 938 -14.045 -1.753 -35.509 1.00 0.99 C ATOM 1878 CD1 LEU A 938 -13.357 -1.577 -36.854 1.00 1.42 C ATOM 1879 CD2 LEU A 938 -15.542 -1.927 -35.695 1.00 1.39 C ATOM 0 H LEU A 938 -11.219 -3.626 -33.986 1.00 0.45 H new ATOM 0 HA LEU A 938 -12.973 -1.584 -33.169 1.00 0.49 H new ATOM 0 HB2 LEU A 938 -12.628 -3.349 -35.345 1.00 0.55 H new ATOM 0 HB3 LEU A 938 -14.217 -3.733 -34.713 1.00 0.55 H new ATOM 0 HG LEU A 938 -13.873 -0.856 -34.915 1.00 0.99 H new ATOM 0 HD11 LEU A 938 -13.786 -0.720 -37.373 1.00 1.42 H new ATOM 0 HD12 LEU A 938 -12.291 -1.411 -36.698 1.00 1.42 H new ATOM 0 HD13 LEU A 938 -13.500 -2.474 -37.456 1.00 1.42 H new ATOM 0 HD21 LEU A 938 -15.945 -1.066 -36.228 1.00 1.39 H new ATOM 0 HD22 LEU A 938 -15.734 -2.832 -36.271 1.00 1.39 H new ATOM 0 HD23 LEU A 938 -16.023 -2.008 -34.720 1.00 1.39 H new ATOM 1891 N TYR A 939 -13.719 -4.615 -32.120 1.00 0.40 N ATOM 1892 CA TYR A 939 -14.614 -5.359 -31.250 1.00 0.43 C ATOM 1893 C TYR A 939 -14.199 -5.243 -29.791 1.00 0.42 C ATOM 1894 O TYR A 939 -15.033 -5.360 -28.896 1.00 0.48 O ATOM 1895 CB TYR A 939 -14.691 -6.819 -31.683 1.00 0.51 C ATOM 1896 CG TYR A 939 -15.766 -7.052 -32.720 1.00 0.68 C ATOM 1897 CD1 TYR A 939 -16.072 -6.089 -33.670 1.00 0.92 C ATOM 1898 CD2 TYR A 939 -16.464 -8.256 -32.758 1.00 1.21 C ATOM 1899 CE1 TYR A 939 -17.044 -6.319 -34.625 1.00 1.13 C ATOM 1900 CE2 TYR A 939 -17.436 -8.490 -33.706 1.00 1.47 C ATOM 1901 CZ TYR A 939 -17.762 -7.437 -34.614 1.00 1.27 C ATOM 1902 OH TYR A 939 -18.680 -7.757 -35.592 1.00 1.59 O ATOM 0 H TYR A 939 -12.968 -5.168 -32.534 1.00 0.40 H new ATOM 0 HA TYR A 939 -15.608 -4.921 -31.341 1.00 0.43 H new ATOM 0 HB2 TYR A 939 -13.727 -7.128 -32.086 1.00 0.51 H new ATOM 0 HB3 TYR A 939 -14.887 -7.444 -30.812 1.00 0.51 H new ATOM 0 HD1 TYR A 939 -15.544 -5.147 -33.663 1.00 0.92 H new ATOM 0 HD2 TYR A 939 -16.239 -9.022 -32.030 1.00 1.21 H new ATOM 0 HE1 TYR A 939 -17.223 -5.579 -35.391 1.00 1.13 H new ATOM 0 HE2 TYR A 939 -17.938 -9.445 -33.761 1.00 1.47 H new ATOM 0 HH TYR A 939 -18.540 -7.181 -36.373 1.00 1.59 H new ATOM 1912 N ALA A 940 -12.921 -4.999 -29.556 1.00 0.43 N ATOM 1913 CA ALA A 940 -12.432 -4.759 -28.209 1.00 0.52 C ATOM 1914 C ALA A 940 -13.028 -3.472 -27.664 1.00 0.55 C ATOM 1915 O ALA A 940 -13.411 -3.394 -26.498 1.00 0.61 O ATOM 1916 CB ALA A 940 -10.916 -4.691 -28.195 1.00 0.61 C ATOM 0 H ALA A 940 -12.204 -4.962 -30.280 1.00 0.43 H new ATOM 0 HA ALA A 940 -12.740 -5.588 -27.571 1.00 0.52 H new ATOM 0 HB1 ALA A 940 -10.569 -4.511 -27.177 1.00 0.61 H new ATOM 0 HB2 ALA A 940 -10.506 -5.634 -28.556 1.00 0.61 H new ATOM 0 HB3 ALA A 940 -10.582 -3.879 -28.841 1.00 0.61 H new ATOM 1922 N GLU A 941 -13.114 -2.465 -28.521 1.00 0.56 N ATOM 1923 CA GLU A 941 -13.762 -1.219 -28.157 1.00 0.67 C ATOM 1924 C GLU A 941 -15.270 -1.433 -28.059 1.00 0.65 C ATOM 1925 O GLU A 941 -15.929 -0.869 -27.191 1.00 0.73 O ATOM 1926 CB GLU A 941 -13.415 -0.116 -29.173 1.00 0.79 C ATOM 1927 CG GLU A 941 -14.571 0.321 -30.064 1.00 0.99 C ATOM 1928 CD GLU A 941 -14.472 1.773 -30.475 1.00 1.36 C ATOM 1929 OE1 GLU A 941 -13.414 2.173 -31.004 1.00 1.72 O ATOM 1930 OE2 GLU A 941 -15.451 2.522 -30.273 1.00 1.87 O ATOM 0 H GLU A 941 -12.743 -2.489 -29.471 1.00 0.56 H new ATOM 0 HA GLU A 941 -13.398 -0.894 -27.182 1.00 0.67 H new ATOM 0 HB2 GLU A 941 -13.044 0.754 -28.631 1.00 0.79 H new ATOM 0 HB3 GLU A 941 -12.600 -0.468 -29.806 1.00 0.79 H new ATOM 0 HG2 GLU A 941 -14.594 -0.305 -30.956 1.00 0.99 H new ATOM 0 HG3 GLU A 941 -15.512 0.160 -29.538 1.00 0.99 H new ATOM 1937 N ARG A 942 -15.796 -2.283 -28.942 1.00 0.60 N ATOM 1938 CA ARG A 942 -17.219 -2.596 -28.976 1.00 0.67 C ATOM 1939 C ARG A 942 -17.685 -3.169 -27.644 1.00 0.65 C ATOM 1940 O ARG A 942 -18.676 -2.709 -27.079 1.00 0.74 O ATOM 1941 CB ARG A 942 -17.502 -3.595 -30.104 1.00 0.74 C ATOM 1942 CG ARG A 942 -18.968 -3.708 -30.487 1.00 1.10 C ATOM 1943 CD ARG A 942 -19.144 -3.737 -31.999 1.00 1.46 C ATOM 1944 NE ARG A 942 -19.982 -4.857 -32.443 1.00 1.84 N ATOM 1945 CZ ARG A 942 -21.317 -4.825 -32.482 1.00 2.35 C ATOM 1946 NH1 ARG A 942 -21.971 -3.742 -32.082 1.00 2.73 N ATOM 1947 NH2 ARG A 942 -21.994 -5.875 -32.929 1.00 3.11 N ATOM 0 H ARG A 942 -15.247 -2.771 -29.650 1.00 0.60 H new ATOM 0 HA ARG A 942 -17.770 -1.674 -29.160 1.00 0.67 H new ATOM 0 HB2 ARG A 942 -16.930 -3.302 -30.985 1.00 0.74 H new ATOM 0 HB3 ARG A 942 -17.141 -4.578 -29.802 1.00 0.74 H new ATOM 0 HG2 ARG A 942 -19.391 -4.614 -30.052 1.00 1.10 H new ATOM 0 HG3 ARG A 942 -19.521 -2.866 -30.070 1.00 1.10 H new ATOM 0 HD2 ARG A 942 -19.591 -2.799 -32.328 1.00 1.46 H new ATOM 0 HD3 ARG A 942 -18.166 -3.808 -32.475 1.00 1.46 H new ATOM 0 HE ARG A 942 -19.516 -5.714 -32.741 1.00 1.84 H new ATOM 0 HH11 ARG A 942 -21.454 -2.930 -31.743 1.00 2.73 H new ATOM 0 HH12 ARG A 942 -22.990 -3.721 -32.113 1.00 2.73 H new ATOM 0 HH21 ARG A 942 -21.495 -6.707 -33.243 1.00 3.11 H new ATOM 0 HH22 ARG A 942 -23.013 -5.850 -32.958 1.00 3.11 H new ATOM 1961 N VAL A 943 -16.949 -4.147 -27.126 1.00 0.59 N ATOM 1962 CA VAL A 943 -17.308 -4.774 -25.862 1.00 0.64 C ATOM 1963 C VAL A 943 -16.968 -3.866 -24.687 1.00 0.67 C ATOM 1964 O VAL A 943 -17.696 -3.824 -23.703 1.00 0.75 O ATOM 1965 CB VAL A 943 -16.626 -6.149 -25.667 1.00 0.66 C ATOM 1966 CG1 VAL A 943 -17.187 -7.162 -26.652 1.00 0.75 C ATOM 1967 CG2 VAL A 943 -15.115 -6.048 -25.806 1.00 0.61 C ATOM 0 H VAL A 943 -16.105 -4.520 -27.560 1.00 0.59 H new ATOM 0 HA VAL A 943 -18.385 -4.937 -25.897 1.00 0.64 H new ATOM 0 HB VAL A 943 -16.841 -6.487 -24.653 1.00 0.66 H new ATOM 0 HG11 VAL A 943 -16.697 -8.124 -26.503 1.00 0.75 H new ATOM 0 HG12 VAL A 943 -18.259 -7.271 -26.490 1.00 0.75 H new ATOM 0 HG13 VAL A 943 -17.007 -6.818 -27.670 1.00 0.75 H new ATOM 0 HG21 VAL A 943 -14.670 -7.033 -25.663 1.00 0.61 H new ATOM 0 HG22 VAL A 943 -14.865 -5.678 -26.800 1.00 0.61 H new ATOM 0 HG23 VAL A 943 -14.726 -5.361 -25.055 1.00 0.61 H new ATOM 1977 N ARG A 944 -15.880 -3.115 -24.807 1.00 0.67 N ATOM 1978 CA ARG A 944 -15.437 -2.238 -23.730 1.00 0.79 C ATOM 1979 C ARG A 944 -16.448 -1.121 -23.472 1.00 0.88 C ATOM 1980 O ARG A 944 -16.794 -0.838 -22.323 1.00 0.98 O ATOM 1981 CB ARG A 944 -14.072 -1.633 -24.063 1.00 0.85 C ATOM 1982 CG ARG A 944 -13.016 -1.898 -23.002 1.00 1.10 C ATOM 1983 CD ARG A 944 -12.182 -3.126 -23.332 1.00 1.67 C ATOM 1984 NE ARG A 944 -11.343 -3.529 -22.204 1.00 2.12 N ATOM 1985 CZ ARG A 944 -10.158 -4.129 -22.317 1.00 2.78 C ATOM 1986 NH1 ARG A 944 -9.660 -4.425 -23.515 1.00 3.17 N ATOM 1987 NH2 ARG A 944 -9.471 -4.421 -21.223 1.00 3.58 N ATOM 0 H ARG A 944 -15.289 -3.096 -25.638 1.00 0.67 H new ATOM 0 HA ARG A 944 -15.353 -2.841 -22.826 1.00 0.79 H new ATOM 0 HB2 ARG A 944 -13.728 -2.036 -25.016 1.00 0.85 H new ATOM 0 HB3 ARG A 944 -14.183 -0.556 -24.193 1.00 0.85 H new ATOM 0 HG2 ARG A 944 -12.364 -1.029 -22.912 1.00 1.10 H new ATOM 0 HG3 ARG A 944 -13.499 -2.035 -22.034 1.00 1.10 H new ATOM 0 HD2 ARG A 944 -12.840 -3.950 -23.608 1.00 1.67 H new ATOM 0 HD3 ARG A 944 -11.553 -2.917 -24.197 1.00 1.67 H new ATOM 0 HE ARG A 944 -11.689 -3.337 -21.264 1.00 2.12 H new ATOM 0 HH11 ARG A 944 -10.186 -4.193 -24.358 1.00 3.17 H new ATOM 0 HH12 ARG A 944 -8.752 -4.884 -23.591 1.00 3.17 H new ATOM 0 HH21 ARG A 944 -9.850 -4.187 -20.305 1.00 3.58 H new ATOM 0 HH22 ARG A 944 -8.563 -4.880 -21.298 1.00 3.58 H new ATOM 2001 N LYS A 945 -16.933 -0.503 -24.544 1.00 0.91 N ATOM 2002 CA LYS A 945 -17.842 0.628 -24.419 1.00 1.09 C ATOM 2003 C LYS A 945 -19.283 0.176 -24.171 1.00 1.10 C ATOM 2004 O LYS A 945 -20.049 0.880 -23.519 1.00 1.22 O ATOM 2005 CB LYS A 945 -17.755 1.537 -25.653 1.00 1.25 C ATOM 2006 CG LYS A 945 -18.322 0.933 -26.930 1.00 1.04 C ATOM 2007 CD LYS A 945 -19.560 1.682 -27.395 1.00 1.40 C ATOM 2008 CE LYS A 945 -19.210 2.743 -28.420 1.00 2.02 C ATOM 2009 NZ LYS A 945 -19.756 4.076 -28.052 1.00 2.78 N ATOM 0 H LYS A 945 -16.712 -0.766 -25.505 1.00 0.91 H new ATOM 0 HA LYS A 945 -17.530 1.203 -23.547 1.00 1.09 H new ATOM 0 HB2 LYS A 945 -18.284 2.466 -25.441 1.00 1.25 H new ATOM 0 HB3 LYS A 945 -16.710 1.797 -25.823 1.00 1.25 H new ATOM 0 HG2 LYS A 945 -17.564 0.957 -27.713 1.00 1.04 H new ATOM 0 HG3 LYS A 945 -18.571 -0.114 -26.760 1.00 1.04 H new ATOM 0 HD2 LYS A 945 -20.273 0.979 -27.826 1.00 1.40 H new ATOM 0 HD3 LYS A 945 -20.049 2.147 -26.539 1.00 1.40 H new ATOM 0 HE2 LYS A 945 -18.126 2.810 -28.517 1.00 2.02 H new ATOM 0 HE3 LYS A 945 -19.600 2.448 -29.394 1.00 2.02 H new ATOM 0 HZ1 LYS A 945 -19.494 4.771 -28.779 1.00 2.78 H new ATOM 0 HZ2 LYS A 945 -20.792 4.020 -27.984 1.00 2.78 H new ATOM 0 HZ3 LYS A 945 -19.365 4.370 -27.134 1.00 2.78 H new ATOM 2023 N SER A 946 -19.658 -0.996 -24.676 1.00 1.04 N ATOM 2024 CA SER A 946 -21.003 -1.512 -24.435 1.00 1.14 C ATOM 2025 C SER A 946 -21.122 -2.043 -23.009 1.00 1.18 C ATOM 2026 O SER A 946 -22.145 -1.858 -22.349 1.00 1.34 O ATOM 2027 CB SER A 946 -21.361 -2.596 -25.452 1.00 1.15 C ATOM 2028 OG SER A 946 -21.238 -2.104 -26.777 1.00 1.20 O ATOM 0 H SER A 946 -19.062 -1.598 -25.245 1.00 1.04 H new ATOM 0 HA SER A 946 -21.712 -0.693 -24.556 1.00 1.14 H new ATOM 0 HB2 SER A 946 -20.707 -3.458 -25.317 1.00 1.15 H new ATOM 0 HB3 SER A 946 -22.381 -2.940 -25.280 1.00 1.15 H new ATOM 0 HG SER A 946 -20.298 -2.134 -27.051 1.00 1.20 H new ATOM 2034 N ARG A 947 -20.064 -2.691 -22.534 1.00 1.11 N ATOM 2035 CA ARG A 947 -19.995 -3.137 -21.146 1.00 1.21 C ATOM 2036 C ARG A 947 -19.769 -1.942 -20.229 1.00 1.25 C ATOM 2037 O ARG A 947 -19.991 -2.017 -19.020 1.00 1.40 O ATOM 2038 CB ARG A 947 -18.862 -4.145 -20.967 1.00 1.29 C ATOM 2039 CG ARG A 947 -19.194 -5.270 -20.003 1.00 1.48 C ATOM 2040 CD ARG A 947 -17.939 -5.953 -19.494 1.00 1.79 C ATOM 2041 NE ARG A 947 -18.250 -7.103 -18.648 1.00 2.18 N ATOM 2042 CZ ARG A 947 -18.043 -8.367 -19.007 1.00 2.70 C ATOM 2043 NH1 ARG A 947 -17.546 -8.646 -20.207 1.00 2.98 N ATOM 2044 NH2 ARG A 947 -18.331 -9.353 -18.165 1.00 3.53 N ATOM 0 H ARG A 947 -19.240 -2.920 -23.091 1.00 1.11 H new ATOM 0 HA ARG A 947 -20.938 -3.618 -20.887 1.00 1.21 H new ATOM 0 HB2 ARG A 947 -18.611 -4.572 -21.938 1.00 1.29 H new ATOM 0 HB3 ARG A 947 -17.975 -3.622 -20.610 1.00 1.29 H new ATOM 0 HG2 ARG A 947 -19.761 -4.874 -19.161 1.00 1.48 H new ATOM 0 HG3 ARG A 947 -19.831 -6.001 -20.501 1.00 1.48 H new ATOM 0 HD2 ARG A 947 -17.334 -6.278 -20.340 1.00 1.79 H new ATOM 0 HD3 ARG A 947 -17.340 -5.238 -18.930 1.00 1.79 H new ATOM 0 HE ARG A 947 -18.650 -6.926 -17.727 1.00 2.18 H new ATOM 0 HH11 ARG A 947 -17.322 -7.890 -20.855 1.00 2.98 H new ATOM 0 HH12 ARG A 947 -17.388 -9.616 -20.481 1.00 2.98 H new ATOM 0 HH21 ARG A 947 -18.711 -9.141 -17.242 1.00 3.53 H new ATOM 0 HH22 ARG A 947 -18.172 -10.322 -18.441 1.00 3.53 H new