USER MOD reduce.3.24.130724 H: found=0, std=0, add=1052, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1055 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 -71:sc= 1.03 USER MOD Set 1.2: A 939 TYR OH : rot -123:sc= 1.85 USER MOD Set 2.1: A 911 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 912 GLN : amide:sc= -1.19 K(o=-1.2,f=-3!) USER MOD Set 3.1: A 887 THR OG1 : rot -147:sc= 0.125 USER MOD Set 3.2: A 919 MET CE :methyl -177:sc= 0 (180deg=-0.0047) USER MOD Set 4.1: A 877 ASN : amide:sc=-0.00876 K(o=0.86,f=-0.35) USER MOD Set 4.2: A 925 LYS NZ :NH3+ 156:sc= 0.865! (180deg=-0.787!) USER MOD Set 5.1: A 826 MET CE :methyl 176:sc= -1.4 (180deg=-1.54) USER MOD Set 5.2: A 867 ASN : amide:sc= -0.0827 X(o=-1.5,f=-1.3) USER MOD Single : A 817 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 820 SER OG : rot 180:sc= 0.0149 USER MOD Single : A 822 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 825 MET CE :methyl 167:sc=-0.000694 (180deg=-0.0494) USER MOD Single : A 833 HIS : no HE2:sc= 1.2 K(o=1.2,f=-4!) USER MOD Single : A 836 ASN : amide:sc= 1.11 K(o=1.1,f=-2.7!) USER MOD Single : A 843 GLN : amide:sc= -1.1 X(o=-1.1,f=-1.4) USER MOD Single : A 846 SER OG : rot 57:sc= 0.254 USER MOD Single : A 849 TYR OH : rot -35:sc= 0.958 USER MOD Single : A 850 GLN : amide:sc= 0.561 K(o=0.56,f=-0.38) USER MOD Single : A 851 CYS SG : rot 1:sc= 0.768 USER MOD Single : A 852 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 853 THR OG1 : rot 180:sc= 0.0578 USER MOD Single : A 855 ASN : amide:sc= -0.15 X(o=-0.15,f=-0.59) USER MOD Single : A 862 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 865 SER OG : rot 78:sc= 1.31 USER MOD Single : A 866 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 868 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 874 SER OG : rot 180:sc= 0 USER MOD Single : A 878 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 880 ASN : amide:sc= -0.246 K(o=-0.25,f=-1) USER MOD Single : A 881 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 884 TYR OH : rot 180:sc= 0 USER MOD Single : A 888 GLN : amide:sc= -0.0183 X(o=-0.018,f=-0.35) USER MOD Single : A 892 GLN : amide:sc= -1.31! C(o=-1.3!,f=-3.8!) USER MOD Single : A 896 THR OG1 : rot -56:sc= 0.2 USER MOD Single : A 903 THR OG1 : rot 180:sc= 0 USER MOD Single : A 905 ASN : amide:sc=-0.00926 X(o=-0.0093,f=-0.43) USER MOD Single : A 914 CYS SG : rot 44:sc= 0.0657 USER MOD Single : A 917 SER OG : rot 86:sc= 1 USER MOD Single : A 922 CYS SG : rot 180:sc= -0.305 USER MOD Single : A 924 SER OG : rot 180:sc= 0 USER MOD Single : A 928 THR OG1 : rot 180:sc= 0 USER MOD Single : A 933 LYS NZ :NH3+ -148:sc= 1.3 (180deg=-0.502) USER MOD Single : A 934 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 935 THR OG1 : rot 180:sc= 0.131 USER MOD Single : A 937 THR OG1 : rot 85:sc= 1.24 USER MOD Single : A 945 LYS NZ :NH3+ -155:sc= 0.998 (180deg=0.22) USER MOD Single : A 946 SER OG : rot 78:sc= 1.27 USER MOD Single : A 949 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 817 7.867 -3.040 -6.113 1.00 5.91 N ATOM 2 CA LYS A 817 6.395 -2.921 -6.173 1.00 5.22 C ATOM 3 C LYS A 817 5.794 -4.182 -6.784 1.00 4.99 C ATOM 4 O LYS A 817 6.523 -5.056 -7.255 1.00 5.35 O ATOM 5 CB LYS A 817 5.996 -1.693 -6.997 1.00 5.32 C ATOM 6 CG LYS A 817 5.763 -0.447 -6.157 1.00 5.63 C ATOM 7 CD LYS A 817 6.575 0.731 -6.666 1.00 6.05 C ATOM 8 CE LYS A 817 7.395 1.365 -5.555 1.00 6.45 C ATOM 9 NZ LYS A 817 8.173 2.534 -6.038 1.00 7.01 N ATOM 0 HA LYS A 817 6.010 -2.802 -5.160 1.00 5.22 H new ATOM 0 HB2 LYS A 817 6.777 -1.487 -7.729 1.00 5.32 H new ATOM 0 HB3 LYS A 817 5.088 -1.920 -7.556 1.00 5.32 H new ATOM 0 HG2 LYS A 817 4.703 -0.192 -6.170 1.00 5.63 H new ATOM 0 HG3 LYS A 817 6.029 -0.652 -5.120 1.00 5.63 H new ATOM 0 HD2 LYS A 817 7.238 0.399 -7.465 1.00 6.05 H new ATOM 0 HD3 LYS A 817 5.906 1.476 -7.096 1.00 6.05 H new ATOM 0 HE2 LYS A 817 6.732 1.678 -4.748 1.00 6.45 H new ATOM 0 HE3 LYS A 817 8.076 0.623 -5.138 1.00 6.45 H new ATOM 0 HZ1 LYS A 817 8.718 2.938 -5.250 1.00 7.01 H new ATOM 0 HZ2 LYS A 817 8.824 2.231 -6.790 1.00 7.01 H new ATOM 0 HZ3 LYS A 817 7.522 3.253 -6.413 1.00 7.01 H new ATOM 25 N ALA A 818 4.473 -4.277 -6.764 1.00 4.74 N ATOM 26 CA ALA A 818 3.781 -5.429 -7.319 1.00 4.76 C ATOM 27 C ALA A 818 3.101 -5.073 -8.634 1.00 4.32 C ATOM 28 O ALA A 818 2.391 -4.070 -8.729 1.00 4.29 O ATOM 29 CB ALA A 818 2.767 -5.968 -6.320 1.00 5.35 C ATOM 0 H ALA A 818 3.857 -3.567 -6.368 1.00 4.74 H new ATOM 0 HA ALA A 818 4.518 -6.206 -7.521 1.00 4.76 H new ATOM 0 HB1 ALA A 818 2.256 -6.830 -6.749 1.00 5.35 H new ATOM 0 HB2 ALA A 818 3.280 -6.268 -5.406 1.00 5.35 H new ATOM 0 HB3 ALA A 818 2.037 -5.192 -6.088 1.00 5.35 H new ATOM 35 N VAL A 819 3.325 -5.896 -9.647 1.00 4.36 N ATOM 36 CA VAL A 819 2.734 -5.678 -10.960 1.00 4.13 C ATOM 37 C VAL A 819 1.346 -6.307 -11.021 1.00 4.01 C ATOM 38 O VAL A 819 1.186 -7.453 -11.443 1.00 4.59 O ATOM 39 CB VAL A 819 3.613 -6.261 -12.089 1.00 4.79 C ATOM 40 CG1 VAL A 819 3.295 -5.585 -13.413 1.00 5.29 C ATOM 41 CG2 VAL A 819 5.092 -6.116 -11.757 1.00 5.21 C ATOM 0 H VAL A 819 3.915 -6.726 -9.585 1.00 4.36 H new ATOM 0 HA VAL A 819 2.660 -4.601 -11.110 1.00 4.13 H new ATOM 0 HB VAL A 819 3.389 -7.324 -12.179 1.00 4.79 H new ATOM 0 HG11 VAL A 819 3.923 -6.008 -14.197 1.00 5.29 H new ATOM 0 HG12 VAL A 819 2.246 -5.747 -13.661 1.00 5.29 H new ATOM 0 HG13 VAL A 819 3.488 -4.515 -13.331 1.00 5.29 H new ATOM 0 HG21 VAL A 819 5.689 -6.534 -12.567 1.00 5.21 H new ATOM 0 HG22 VAL A 819 5.335 -5.061 -11.634 1.00 5.21 H new ATOM 0 HG23 VAL A 819 5.311 -6.649 -10.832 1.00 5.21 H new ATOM 51 N SER A 820 0.345 -5.554 -10.590 1.00 3.65 N ATOM 52 CA SER A 820 -1.020 -6.061 -10.503 1.00 3.77 C ATOM 53 C SER A 820 -1.751 -6.012 -11.852 1.00 3.30 C ATOM 54 O SER A 820 -2.866 -5.491 -11.953 1.00 3.17 O ATOM 55 CB SER A 820 -1.789 -5.269 -9.444 1.00 4.39 C ATOM 56 OG SER A 820 -0.902 -4.744 -8.460 1.00 4.72 O ATOM 0 H SER A 820 0.452 -4.584 -10.293 1.00 3.65 H new ATOM 0 HA SER A 820 -0.970 -7.111 -10.215 1.00 3.77 H new ATOM 0 HB2 SER A 820 -2.336 -4.454 -9.919 1.00 4.39 H new ATOM 0 HB3 SER A 820 -2.528 -5.913 -8.967 1.00 4.39 H new ATOM 0 HG SER A 820 -1.414 -4.240 -7.794 1.00 4.72 H new ATOM 62 N ASP A 821 -1.123 -6.553 -12.889 1.00 3.48 N ATOM 63 CA ASP A 821 -1.783 -6.717 -14.179 1.00 3.22 C ATOM 64 C ASP A 821 -2.150 -8.174 -14.362 1.00 3.34 C ATOM 65 O ASP A 821 -1.276 -9.041 -14.391 1.00 4.01 O ATOM 66 CB ASP A 821 -0.896 -6.271 -15.338 1.00 3.87 C ATOM 67 CG ASP A 821 -1.626 -6.333 -16.670 1.00 4.17 C ATOM 68 OD1 ASP A 821 -2.745 -5.786 -16.770 1.00 4.74 O ATOM 69 OD2 ASP A 821 -1.084 -6.930 -17.623 1.00 4.22 O ATOM 0 H ASP A 821 -0.159 -6.885 -12.862 1.00 3.48 H new ATOM 0 HA ASP A 821 -2.674 -6.089 -14.184 1.00 3.22 H new ATOM 0 HB2 ASP A 821 -0.552 -5.252 -15.160 1.00 3.87 H new ATOM 0 HB3 ASP A 821 -0.010 -6.904 -15.381 1.00 3.87 H new ATOM 74 N ASN A 822 -3.436 -8.446 -14.464 1.00 3.07 N ATOM 75 CA ASN A 822 -3.905 -9.819 -14.487 1.00 3.43 C ATOM 76 C ASN A 822 -4.369 -10.262 -15.867 1.00 3.49 C ATOM 77 O ASN A 822 -4.015 -11.350 -16.320 1.00 4.34 O ATOM 78 CB ASN A 822 -5.046 -10.008 -13.492 1.00 3.34 C ATOM 79 CG ASN A 822 -4.852 -11.242 -12.633 1.00 4.21 C ATOM 80 OD1 ASN A 822 -4.552 -11.144 -11.442 1.00 4.86 O ATOM 81 ND2 ASN A 822 -5.020 -12.413 -13.227 1.00 4.67 N ATOM 0 H ASN A 822 -4.170 -7.741 -14.532 1.00 3.07 H new ATOM 0 HA ASN A 822 -3.053 -10.439 -14.208 1.00 3.43 H new ATOM 0 HB2 ASN A 822 -5.118 -9.129 -12.852 1.00 3.34 H new ATOM 0 HB3 ASN A 822 -5.989 -10.087 -14.033 1.00 3.34 H new ATOM 0 HD21 ASN A 822 -4.901 -13.276 -12.696 1.00 4.67 H new ATOM 0 HD22 ASN A 822 -5.268 -12.452 -14.216 1.00 4.67 H new ATOM 88 N ASP A 823 -5.148 -9.424 -16.538 1.00 2.88 N ATOM 89 CA ASP A 823 -5.861 -9.872 -17.732 1.00 3.04 C ATOM 90 C ASP A 823 -6.343 -8.706 -18.582 1.00 2.00 C ATOM 91 O ASP A 823 -5.842 -8.483 -19.685 1.00 2.46 O ATOM 92 CB ASP A 823 -7.073 -10.711 -17.314 1.00 3.98 C ATOM 93 CG ASP A 823 -7.080 -12.099 -17.918 1.00 4.61 C ATOM 94 OD1 ASP A 823 -6.459 -13.011 -17.332 1.00 4.96 O ATOM 95 OD2 ASP A 823 -7.736 -12.297 -18.957 1.00 5.08 O ATOM 0 H ASP A 823 -5.302 -8.448 -16.285 1.00 2.88 H new ATOM 0 HA ASP A 823 -5.165 -10.462 -18.328 1.00 3.04 H new ATOM 0 HB2 ASP A 823 -7.090 -10.795 -16.227 1.00 3.98 H new ATOM 0 HB3 ASP A 823 -7.985 -10.190 -17.607 1.00 3.98 H new ATOM 100 N ASP A 824 -7.325 -7.982 -18.040 1.00 1.30 N ATOM 101 CA ASP A 824 -8.041 -6.902 -18.741 1.00 1.23 C ATOM 102 C ASP A 824 -9.057 -7.472 -19.727 1.00 1.03 C ATOM 103 O ASP A 824 -10.248 -7.166 -19.646 1.00 1.37 O ATOM 104 CB ASP A 824 -7.098 -5.929 -19.469 1.00 2.25 C ATOM 105 CG ASP A 824 -7.857 -4.914 -20.314 1.00 3.32 C ATOM 106 OD1 ASP A 824 -8.807 -4.289 -19.793 1.00 3.99 O ATOM 107 OD2 ASP A 824 -7.512 -4.735 -21.506 1.00 3.79 O ATOM 0 H ASP A 824 -7.654 -8.129 -17.086 1.00 1.30 H new ATOM 0 HA ASP A 824 -8.561 -6.334 -17.969 1.00 1.23 H new ATOM 0 HB2 ASP A 824 -6.485 -5.403 -18.737 1.00 2.25 H new ATOM 0 HB3 ASP A 824 -6.418 -6.494 -20.107 1.00 2.25 H new ATOM 112 N MET A 825 -8.593 -8.317 -20.641 1.00 0.74 N ATOM 113 CA MET A 825 -9.462 -8.870 -21.674 1.00 0.64 C ATOM 114 C MET A 825 -9.087 -10.311 -22.010 1.00 0.57 C ATOM 115 O MET A 825 -7.905 -10.650 -22.137 1.00 0.64 O ATOM 116 CB MET A 825 -9.391 -8.008 -22.933 1.00 0.76 C ATOM 117 CG MET A 825 -10.716 -7.886 -23.663 1.00 0.93 C ATOM 118 SD MET A 825 -10.638 -6.733 -25.046 1.00 1.60 S ATOM 119 CE MET A 825 -12.321 -6.125 -25.056 1.00 1.90 C ATOM 0 H MET A 825 -7.624 -8.633 -20.688 1.00 0.74 H new ATOM 0 HA MET A 825 -10.481 -8.869 -21.288 1.00 0.64 H new ATOM 0 HB2 MET A 825 -9.043 -7.012 -22.661 1.00 0.76 H new ATOM 0 HB3 MET A 825 -8.650 -8.431 -23.611 1.00 0.76 H new ATOM 0 HG2 MET A 825 -11.017 -8.868 -24.029 1.00 0.93 H new ATOM 0 HG3 MET A 825 -11.484 -7.557 -22.963 1.00 0.93 H new ATOM 0 HE1 MET A 825 -12.385 -5.243 -25.693 1.00 1.90 H new ATOM 0 HE2 MET A 825 -12.985 -6.899 -25.440 1.00 1.90 H new ATOM 0 HE3 MET A 825 -12.619 -5.862 -24.041 1.00 1.90 H new ATOM 129 N MET A 826 -10.106 -11.151 -22.167 1.00 0.51 N ATOM 130 CA MET A 826 -9.906 -12.553 -22.507 1.00 0.49 C ATOM 131 C MET A 826 -10.555 -12.865 -23.850 1.00 0.43 C ATOM 132 O MET A 826 -11.750 -12.640 -24.036 1.00 0.50 O ATOM 133 CB MET A 826 -10.491 -13.456 -21.418 1.00 0.60 C ATOM 134 CG MET A 826 -10.359 -14.941 -21.719 1.00 1.14 C ATOM 135 SD MET A 826 -10.222 -15.946 -20.228 1.00 1.62 S ATOM 136 CE MET A 826 -11.581 -15.301 -19.254 1.00 1.93 C ATOM 0 H MET A 826 -11.084 -10.881 -22.063 1.00 0.51 H new ATOM 0 HA MET A 826 -8.835 -12.743 -22.579 1.00 0.49 H new ATOM 0 HB2 MET A 826 -9.993 -13.240 -20.473 1.00 0.60 H new ATOM 0 HB3 MET A 826 -11.545 -13.214 -21.285 1.00 0.60 H new ATOM 0 HG2 MET A 826 -11.225 -15.269 -22.295 1.00 1.14 H new ATOM 0 HG3 MET A 826 -9.481 -15.104 -22.344 1.00 1.14 H new ATOM 0 HE1 MET A 826 -11.670 -15.873 -18.330 1.00 1.93 H new ATOM 0 HE2 MET A 826 -11.393 -14.254 -19.016 1.00 1.93 H new ATOM 0 HE3 MET A 826 -12.507 -15.384 -19.822 1.00 1.93 H new ATOM 146 N ILE A 827 -9.768 -13.379 -24.781 1.00 0.36 N ATOM 147 CA ILE A 827 -10.254 -13.649 -26.127 1.00 0.34 C ATOM 148 C ILE A 827 -10.165 -15.141 -26.445 1.00 0.34 C ATOM 149 O ILE A 827 -9.254 -15.833 -25.982 1.00 0.37 O ATOM 150 CB ILE A 827 -9.463 -12.852 -27.189 1.00 0.35 C ATOM 151 CG1 ILE A 827 -9.000 -11.496 -26.633 1.00 0.37 C ATOM 152 CG2 ILE A 827 -10.300 -12.657 -28.447 1.00 0.43 C ATOM 153 CD1 ILE A 827 -10.103 -10.460 -26.520 1.00 0.47 C ATOM 0 H ILE A 827 -8.788 -13.618 -24.630 1.00 0.36 H new ATOM 0 HA ILE A 827 -11.296 -13.332 -26.160 1.00 0.34 H new ATOM 0 HB ILE A 827 -8.576 -13.429 -27.450 1.00 0.35 H new ATOM 0 HG12 ILE A 827 -8.560 -11.651 -25.648 1.00 0.37 H new ATOM 0 HG13 ILE A 827 -8.212 -11.103 -27.275 1.00 0.37 H new ATOM 0 HG21 ILE A 827 -9.726 -12.094 -29.183 1.00 0.43 H new ATOM 0 HG22 ILE A 827 -10.566 -13.629 -28.861 1.00 0.43 H new ATOM 0 HG23 ILE A 827 -11.208 -12.108 -28.198 1.00 0.43 H new ATOM 0 HD11 ILE A 827 -9.692 -9.533 -26.120 1.00 0.47 H new ATOM 0 HD12 ILE A 827 -10.528 -10.272 -27.506 1.00 0.47 H new ATOM 0 HD13 ILE A 827 -10.882 -10.829 -25.853 1.00 0.47 H new ATOM 165 N LEU A 828 -11.115 -15.631 -27.228 1.00 0.34 N ATOM 166 CA LEU A 828 -11.153 -17.037 -27.598 1.00 0.35 C ATOM 167 C LEU A 828 -10.590 -17.240 -29.000 1.00 0.36 C ATOM 168 O LEU A 828 -11.154 -16.751 -29.979 1.00 0.40 O ATOM 169 CB LEU A 828 -12.588 -17.564 -27.538 1.00 0.44 C ATOM 170 CG LEU A 828 -12.843 -18.667 -26.510 1.00 0.62 C ATOM 171 CD1 LEU A 828 -14.333 -18.843 -26.280 1.00 1.37 C ATOM 172 CD2 LEU A 828 -12.219 -19.976 -26.962 1.00 1.16 C ATOM 0 H LEU A 828 -11.873 -15.072 -27.621 1.00 0.34 H new ATOM 0 HA LEU A 828 -10.538 -17.591 -26.889 1.00 0.35 H new ATOM 0 HB2 LEU A 828 -13.254 -16.729 -27.322 1.00 0.44 H new ATOM 0 HB3 LEU A 828 -12.859 -17.941 -28.524 1.00 0.44 H new ATOM 0 HG LEU A 828 -12.378 -18.372 -25.569 1.00 0.62 H new ATOM 0 HD11 LEU A 828 -14.497 -19.632 -25.546 1.00 1.37 H new ATOM 0 HD12 LEU A 828 -14.757 -17.909 -25.910 1.00 1.37 H new ATOM 0 HD13 LEU A 828 -14.816 -19.115 -27.218 1.00 1.37 H new ATOM 0 HD21 LEU A 828 -12.412 -20.748 -26.217 1.00 1.16 H new ATOM 0 HD22 LEU A 828 -12.653 -20.276 -27.916 1.00 1.16 H new ATOM 0 HD23 LEU A 828 -11.143 -19.845 -27.079 1.00 1.16 H new ATOM 184 N VAL A 829 -9.481 -17.960 -29.084 1.00 0.39 N ATOM 185 CA VAL A 829 -8.869 -18.284 -30.361 1.00 0.44 C ATOM 186 C VAL A 829 -9.199 -19.723 -30.741 1.00 0.43 C ATOM 187 O VAL A 829 -8.681 -20.680 -30.156 1.00 0.43 O ATOM 188 CB VAL A 829 -7.336 -18.083 -30.344 1.00 0.52 C ATOM 189 CG1 VAL A 829 -6.995 -16.618 -30.539 1.00 0.97 C ATOM 190 CG2 VAL A 829 -6.719 -18.608 -29.058 1.00 1.06 C ATOM 0 H VAL A 829 -8.984 -18.333 -28.275 1.00 0.39 H new ATOM 0 HA VAL A 829 -9.279 -17.599 -31.104 1.00 0.44 H new ATOM 0 HB VAL A 829 -6.914 -18.656 -31.170 1.00 0.52 H new ATOM 0 HG11 VAL A 829 -5.912 -16.491 -30.525 1.00 0.97 H new ATOM 0 HG12 VAL A 829 -7.388 -16.277 -31.497 1.00 0.97 H new ATOM 0 HG13 VAL A 829 -7.439 -16.031 -29.735 1.00 0.97 H new ATOM 0 HG21 VAL A 829 -5.641 -18.450 -29.081 1.00 1.06 H new ATOM 0 HG22 VAL A 829 -7.145 -18.077 -28.207 1.00 1.06 H new ATOM 0 HG23 VAL A 829 -6.928 -19.674 -28.963 1.00 1.06 H new ATOM 200 N VAL A 830 -10.089 -19.874 -31.704 1.00 0.46 N ATOM 201 CA VAL A 830 -10.592 -21.181 -32.077 1.00 0.50 C ATOM 202 C VAL A 830 -10.302 -21.500 -33.537 1.00 0.61 C ATOM 203 O VAL A 830 -10.505 -20.666 -34.412 1.00 1.07 O ATOM 204 CB VAL A 830 -12.117 -21.271 -31.849 1.00 0.53 C ATOM 205 CG1 VAL A 830 -12.603 -22.699 -31.994 1.00 0.97 C ATOM 206 CG2 VAL A 830 -12.502 -20.713 -30.486 1.00 0.80 C ATOM 0 H VAL A 830 -10.480 -19.102 -32.244 1.00 0.46 H new ATOM 0 HA VAL A 830 -10.078 -21.905 -31.444 1.00 0.50 H new ATOM 0 HB VAL A 830 -12.602 -20.664 -32.614 1.00 0.53 H new ATOM 0 HG11 VAL A 830 -13.680 -22.735 -31.829 1.00 0.97 H new ATOM 0 HG12 VAL A 830 -12.377 -23.060 -32.997 1.00 0.97 H new ATOM 0 HG13 VAL A 830 -12.102 -23.330 -31.260 1.00 0.97 H new ATOM 0 HG21 VAL A 830 -13.581 -20.789 -30.353 1.00 0.80 H new ATOM 0 HG22 VAL A 830 -11.999 -21.282 -29.704 1.00 0.80 H new ATOM 0 HG23 VAL A 830 -12.202 -19.667 -30.423 1.00 0.80 H new ATOM 216 N ASP A 831 -9.807 -22.702 -33.777 1.00 0.36 N ATOM 217 CA ASP A 831 -9.716 -23.256 -35.128 1.00 0.37 C ATOM 218 C ASP A 831 -9.795 -24.765 -35.034 1.00 0.42 C ATOM 219 O ASP A 831 -9.110 -25.368 -34.207 1.00 0.52 O ATOM 220 CB ASP A 831 -8.420 -22.847 -35.846 1.00 0.44 C ATOM 221 CG ASP A 831 -8.218 -23.581 -37.174 1.00 0.64 C ATOM 222 OD1 ASP A 831 -9.222 -23.940 -37.826 1.00 1.27 O ATOM 223 OD2 ASP A 831 -7.055 -23.806 -37.578 1.00 1.30 O ATOM 0 H ASP A 831 -9.457 -23.324 -33.048 1.00 0.36 H new ATOM 0 HA ASP A 831 -10.543 -22.857 -35.716 1.00 0.37 H new ATOM 0 HB2 ASP A 831 -8.436 -21.773 -36.029 1.00 0.44 H new ATOM 0 HB3 ASP A 831 -7.570 -23.047 -35.193 1.00 0.44 H new ATOM 228 N ASP A 832 -10.645 -25.367 -35.854 1.00 0.48 N ATOM 229 CA ASP A 832 -10.810 -26.818 -35.856 1.00 0.61 C ATOM 230 C ASP A 832 -9.470 -27.505 -36.109 1.00 0.66 C ATOM 231 O ASP A 832 -9.170 -28.546 -35.527 1.00 0.98 O ATOM 232 CB ASP A 832 -11.829 -27.246 -36.919 1.00 0.78 C ATOM 233 CG ASP A 832 -11.704 -28.715 -37.280 1.00 1.21 C ATOM 234 OD1 ASP A 832 -12.363 -29.547 -36.622 1.00 1.51 O ATOM 235 OD2 ASP A 832 -10.963 -29.040 -38.229 1.00 2.03 O ATOM 0 H ASP A 832 -11.232 -24.875 -36.527 1.00 0.48 H new ATOM 0 HA ASP A 832 -11.182 -27.120 -34.877 1.00 0.61 H new ATOM 0 HB2 ASP A 832 -12.837 -27.049 -36.553 1.00 0.78 H new ATOM 0 HB3 ASP A 832 -11.691 -26.641 -37.815 1.00 0.78 H new ATOM 240 N HIS A 833 -8.656 -26.899 -36.959 1.00 0.61 N ATOM 241 CA HIS A 833 -7.356 -27.456 -37.299 1.00 0.74 C ATOM 242 C HIS A 833 -6.267 -26.793 -36.453 1.00 0.75 C ATOM 243 O HIS A 833 -6.507 -25.761 -35.838 1.00 1.20 O ATOM 244 CB HIS A 833 -7.082 -27.273 -38.794 1.00 0.93 C ATOM 245 CG HIS A 833 -7.446 -28.476 -39.616 1.00 1.10 C ATOM 246 ND1 HIS A 833 -8.566 -29.249 -39.382 1.00 1.87 N ATOM 247 CD2 HIS A 833 -6.821 -29.044 -40.673 1.00 1.47 C ATOM 248 CE1 HIS A 833 -8.609 -30.235 -40.256 1.00 2.12 C ATOM 249 NE2 HIS A 833 -7.563 -30.134 -41.052 1.00 1.84 N ATOM 0 H HIS A 833 -8.873 -26.019 -37.427 1.00 0.61 H new ATOM 0 HA HIS A 833 -7.353 -28.524 -37.082 1.00 0.74 H new ATOM 0 HB2 HIS A 833 -7.642 -26.411 -39.156 1.00 0.93 H new ATOM 0 HB3 HIS A 833 -6.025 -27.049 -38.938 1.00 0.93 H new ATOM 0 HD1 HIS A 833 -9.253 -29.083 -38.647 1.00 1.87 H new ATOM 0 HD2 HIS A 833 -5.906 -28.702 -41.134 1.00 1.47 H new ATOM 0 HE1 HIS A 833 -9.372 -30.997 -40.311 1.00 2.12 H new ATOM 258 N PRO A 834 -5.068 -27.385 -36.365 1.00 0.66 N ATOM 259 CA PRO A 834 -3.987 -26.823 -35.552 1.00 0.70 C ATOM 260 C PRO A 834 -3.226 -25.685 -36.242 1.00 0.62 C ATOM 261 O PRO A 834 -2.590 -24.867 -35.575 1.00 0.61 O ATOM 262 CB PRO A 834 -3.070 -28.024 -35.327 1.00 0.92 C ATOM 263 CG PRO A 834 -3.265 -28.885 -36.527 1.00 1.12 C ATOM 264 CD PRO A 834 -4.679 -28.661 -36.996 1.00 0.98 C ATOM 0 HA PRO A 834 -4.369 -26.368 -34.638 1.00 0.70 H new ATOM 0 HB2 PRO A 834 -2.030 -27.714 -35.228 1.00 0.92 H new ATOM 0 HB3 PRO A 834 -3.332 -28.556 -34.412 1.00 0.92 H new ATOM 0 HG2 PRO A 834 -2.552 -28.625 -37.310 1.00 1.12 H new ATOM 0 HG3 PRO A 834 -3.100 -29.934 -36.281 1.00 1.12 H new ATOM 0 HD2 PRO A 834 -4.734 -28.602 -38.083 1.00 0.98 H new ATOM 0 HD3 PRO A 834 -5.335 -29.475 -36.688 1.00 0.98 H new ATOM 272 N ILE A 835 -3.308 -25.615 -37.567 1.00 0.68 N ATOM 273 CA ILE A 835 -2.491 -24.670 -38.327 1.00 0.72 C ATOM 274 C ILE A 835 -2.933 -23.219 -38.113 1.00 0.61 C ATOM 275 O ILE A 835 -2.112 -22.352 -37.791 1.00 0.58 O ATOM 276 CB ILE A 835 -2.517 -25.001 -39.841 1.00 0.91 C ATOM 277 CG1 ILE A 835 -1.887 -23.856 -40.654 1.00 1.64 C ATOM 278 CG2 ILE A 835 -3.943 -25.296 -40.300 1.00 1.72 C ATOM 279 CD1 ILE A 835 -2.459 -23.685 -42.046 1.00 2.26 C ATOM 0 H ILE A 835 -3.926 -26.195 -38.135 1.00 0.68 H new ATOM 0 HA ILE A 835 -1.472 -24.773 -37.953 1.00 0.72 H new ATOM 0 HB ILE A 835 -1.921 -25.897 -40.014 1.00 0.91 H new ATOM 0 HG12 ILE A 835 -2.016 -22.923 -40.105 1.00 1.64 H new ATOM 0 HG13 ILE A 835 -0.814 -24.032 -40.735 1.00 1.64 H new ATOM 0 HG21 ILE A 835 -3.942 -25.526 -41.365 1.00 1.72 H new ATOM 0 HG22 ILE A 835 -4.335 -26.148 -39.745 1.00 1.72 H new ATOM 0 HG23 ILE A 835 -4.572 -24.424 -40.118 1.00 1.72 H new ATOM 0 HD11 ILE A 835 -1.957 -22.857 -42.546 1.00 2.26 H new ATOM 0 HD12 ILE A 835 -2.306 -24.601 -42.617 1.00 2.26 H new ATOM 0 HD13 ILE A 835 -3.526 -23.475 -41.977 1.00 2.26 H new ATOM 291 N ASN A 836 -4.226 -22.957 -38.241 1.00 0.57 N ATOM 292 CA ASN A 836 -4.721 -21.597 -38.103 1.00 0.52 C ATOM 293 C ASN A 836 -4.922 -21.276 -36.640 1.00 0.42 C ATOM 294 O ASN A 836 -4.944 -20.118 -36.247 1.00 0.44 O ATOM 295 CB ASN A 836 -6.019 -21.381 -38.881 1.00 0.62 C ATOM 296 CG ASN A 836 -6.027 -20.063 -39.628 1.00 1.06 C ATOM 297 OD1 ASN A 836 -4.974 -19.501 -39.931 1.00 1.35 O ATOM 298 ND2 ASN A 836 -7.211 -19.562 -39.938 1.00 1.83 N ATOM 0 H ASN A 836 -4.941 -23.657 -38.437 1.00 0.57 H new ATOM 0 HA ASN A 836 -3.977 -20.922 -38.526 1.00 0.52 H new ATOM 0 HB2 ASN A 836 -6.156 -22.198 -39.589 1.00 0.62 H new ATOM 0 HB3 ASN A 836 -6.863 -21.411 -38.192 1.00 0.62 H new ATOM 0 HD21 ASN A 836 -7.274 -18.680 -40.446 1.00 1.83 H new ATOM 0 HD22 ASN A 836 -8.061 -20.058 -39.669 1.00 1.83 H new ATOM 305 N ARG A 837 -5.069 -22.318 -35.835 1.00 0.41 N ATOM 306 CA ARG A 837 -5.148 -22.159 -34.394 1.00 0.42 C ATOM 307 C ARG A 837 -3.843 -21.591 -33.850 1.00 0.38 C ATOM 308 O ARG A 837 -3.850 -20.602 -33.125 1.00 0.40 O ATOM 309 CB ARG A 837 -5.456 -23.491 -33.719 1.00 0.55 C ATOM 310 CG ARG A 837 -6.274 -23.347 -32.448 1.00 0.69 C ATOM 311 CD ARG A 837 -6.390 -24.669 -31.712 1.00 1.25 C ATOM 312 NE ARG A 837 -6.884 -25.735 -32.579 1.00 1.63 N ATOM 313 CZ ARG A 837 -6.349 -26.951 -32.643 1.00 2.06 C ATOM 314 NH1 ARG A 837 -5.270 -27.247 -31.926 1.00 2.44 N ATOM 315 NH2 ARG A 837 -6.886 -27.867 -33.433 1.00 2.78 N ATOM 0 H ARG A 837 -5.136 -23.283 -36.158 1.00 0.41 H new ATOM 0 HA ARG A 837 -5.957 -21.462 -34.174 1.00 0.42 H new ATOM 0 HB2 ARG A 837 -5.995 -24.129 -34.419 1.00 0.55 H new ATOM 0 HB3 ARG A 837 -4.519 -23.996 -33.484 1.00 0.55 H new ATOM 0 HG2 ARG A 837 -5.810 -22.606 -31.797 1.00 0.69 H new ATOM 0 HG3 ARG A 837 -7.269 -22.977 -32.694 1.00 0.69 H new ATOM 0 HD2 ARG A 837 -5.415 -24.949 -31.313 1.00 1.25 H new ATOM 0 HD3 ARG A 837 -7.061 -24.553 -30.861 1.00 1.25 H new ATOM 0 HE ARG A 837 -7.689 -25.535 -33.172 1.00 1.63 H new ATOM 0 HH11 ARG A 837 -4.849 -26.540 -31.323 1.00 2.44 H new ATOM 0 HH12 ARG A 837 -4.863 -28.181 -31.978 1.00 2.44 H new ATOM 0 HH21 ARG A 837 -7.709 -27.640 -33.991 1.00 2.78 H new ATOM 0 HH22 ARG A 837 -6.477 -28.800 -33.483 1.00 2.78 H new ATOM 329 N ARG A 838 -2.723 -22.207 -34.216 1.00 0.40 N ATOM 330 CA ARG A 838 -1.420 -21.745 -33.746 1.00 0.44 C ATOM 331 C ARG A 838 -1.103 -20.355 -34.300 1.00 0.37 C ATOM 332 O ARG A 838 -0.469 -19.539 -33.630 1.00 0.40 O ATOM 333 CB ARG A 838 -0.312 -22.751 -34.115 1.00 0.59 C ATOM 334 CG ARG A 838 0.163 -22.680 -35.564 1.00 0.96 C ATOM 335 CD ARG A 838 1.483 -21.934 -35.682 1.00 0.87 C ATOM 336 NE ARG A 838 2.094 -22.076 -37.005 1.00 1.50 N ATOM 337 CZ ARG A 838 3.319 -21.644 -37.313 1.00 2.03 C ATOM 338 NH1 ARG A 838 4.079 -21.073 -36.382 1.00 2.49 N ATOM 339 NH2 ARG A 838 3.780 -21.789 -38.549 1.00 2.75 N ATOM 0 H ARG A 838 -2.690 -23.020 -34.831 1.00 0.40 H new ATOM 0 HA ARG A 838 -1.460 -21.674 -32.659 1.00 0.44 H new ATOM 0 HB2 ARG A 838 0.543 -22.585 -33.459 1.00 0.59 H new ATOM 0 HB3 ARG A 838 -0.676 -23.759 -33.916 1.00 0.59 H new ATOM 0 HG2 ARG A 838 0.277 -23.689 -35.960 1.00 0.96 H new ATOM 0 HG3 ARG A 838 -0.593 -22.183 -36.172 1.00 0.96 H new ATOM 0 HD2 ARG A 838 1.318 -20.877 -35.474 1.00 0.87 H new ATOM 0 HD3 ARG A 838 2.174 -22.304 -34.925 1.00 0.87 H new ATOM 0 HE ARG A 838 1.550 -22.533 -37.737 1.00 1.50 H new ATOM 0 HH11 ARG A 838 3.726 -20.965 -35.431 1.00 2.49 H new ATOM 0 HH12 ARG A 838 5.015 -20.744 -36.619 1.00 2.49 H new ATOM 0 HH21 ARG A 838 3.199 -22.230 -39.262 1.00 2.75 H new ATOM 0 HH22 ARG A 838 4.716 -21.460 -38.786 1.00 2.75 H new ATOM 353 N LEU A 839 -1.557 -20.087 -35.519 1.00 0.36 N ATOM 354 CA LEU A 839 -1.317 -18.801 -36.157 1.00 0.40 C ATOM 355 C LEU A 839 -2.135 -17.693 -35.494 1.00 0.34 C ATOM 356 O LEU A 839 -1.594 -16.665 -35.096 1.00 0.37 O ATOM 357 CB LEU A 839 -1.652 -18.888 -37.646 1.00 0.52 C ATOM 358 CG LEU A 839 -0.690 -18.146 -38.575 1.00 0.82 C ATOM 359 CD1 LEU A 839 0.425 -19.073 -39.034 1.00 1.13 C ATOM 360 CD2 LEU A 839 -1.439 -17.575 -39.769 1.00 1.14 C ATOM 0 H LEU A 839 -2.094 -20.745 -36.085 1.00 0.36 H new ATOM 0 HA LEU A 839 -0.262 -18.554 -36.040 1.00 0.40 H new ATOM 0 HB2 LEU A 839 -1.674 -19.938 -37.936 1.00 0.52 H new ATOM 0 HB3 LEU A 839 -2.657 -18.494 -37.800 1.00 0.52 H new ATOM 0 HG LEU A 839 -0.243 -17.319 -38.023 1.00 0.82 H new ATOM 0 HD11 LEU A 839 1.101 -18.530 -39.694 1.00 1.13 H new ATOM 0 HD12 LEU A 839 0.978 -19.435 -38.167 1.00 1.13 H new ATOM 0 HD13 LEU A 839 -0.003 -19.920 -39.570 1.00 1.13 H new ATOM 0 HD21 LEU A 839 -0.740 -17.050 -40.420 1.00 1.14 H new ATOM 0 HD22 LEU A 839 -1.912 -18.386 -40.323 1.00 1.14 H new ATOM 0 HD23 LEU A 839 -2.203 -16.879 -39.421 1.00 1.14 H new ATOM 372 N LEU A 840 -3.434 -17.924 -35.358 1.00 0.35 N ATOM 373 CA LEU A 840 -4.344 -16.933 -34.790 1.00 0.42 C ATOM 374 C LEU A 840 -4.078 -16.734 -33.297 1.00 0.42 C ATOM 375 O LEU A 840 -4.261 -15.638 -32.761 1.00 0.47 O ATOM 376 CB LEU A 840 -5.799 -17.356 -35.061 1.00 0.55 C ATOM 377 CG LEU A 840 -6.687 -17.581 -33.839 1.00 0.86 C ATOM 378 CD1 LEU A 840 -7.971 -16.775 -33.964 1.00 1.43 C ATOM 379 CD2 LEU A 840 -7.001 -19.062 -33.681 1.00 1.10 C ATOM 0 H LEU A 840 -3.886 -18.796 -35.635 1.00 0.35 H new ATOM 0 HA LEU A 840 -4.171 -15.970 -35.271 1.00 0.42 H new ATOM 0 HB2 LEU A 840 -6.265 -16.593 -35.684 1.00 0.55 H new ATOM 0 HB3 LEU A 840 -5.783 -18.277 -35.644 1.00 0.55 H new ATOM 0 HG LEU A 840 -6.152 -17.244 -32.951 1.00 0.86 H new ATOM 0 HD11 LEU A 840 -8.594 -16.945 -33.086 1.00 1.43 H new ATOM 0 HD12 LEU A 840 -7.729 -15.715 -34.038 1.00 1.43 H new ATOM 0 HD13 LEU A 840 -8.511 -17.087 -34.858 1.00 1.43 H new ATOM 0 HD21 LEU A 840 -7.635 -19.208 -32.806 1.00 1.10 H new ATOM 0 HD22 LEU A 840 -7.521 -19.421 -34.570 1.00 1.10 H new ATOM 0 HD23 LEU A 840 -6.073 -19.619 -33.554 1.00 1.10 H new ATOM 391 N ALA A 841 -3.626 -17.788 -32.627 1.00 0.42 N ATOM 392 CA ALA A 841 -3.240 -17.687 -31.227 1.00 0.50 C ATOM 393 C ALA A 841 -1.986 -16.838 -31.087 1.00 0.46 C ATOM 394 O ALA A 841 -1.823 -16.119 -30.104 1.00 0.49 O ATOM 395 CB ALA A 841 -3.018 -19.064 -30.622 1.00 0.60 C ATOM 0 H ALA A 841 -3.519 -18.719 -33.030 1.00 0.42 H new ATOM 0 HA ALA A 841 -4.053 -17.206 -30.683 1.00 0.50 H new ATOM 0 HB1 ALA A 841 -2.731 -18.960 -29.576 1.00 0.60 H new ATOM 0 HB2 ALA A 841 -3.939 -19.644 -30.689 1.00 0.60 H new ATOM 0 HB3 ALA A 841 -2.225 -19.577 -31.167 1.00 0.60 H new ATOM 401 N ASP A 842 -1.106 -16.924 -32.076 1.00 0.43 N ATOM 402 CA ASP A 842 0.097 -16.101 -32.107 1.00 0.45 C ATOM 403 C ASP A 842 -0.275 -14.652 -32.387 1.00 0.40 C ATOM 404 O ASP A 842 0.321 -13.723 -31.836 1.00 0.42 O ATOM 405 CB ASP A 842 1.055 -16.610 -33.181 1.00 0.52 C ATOM 406 CG ASP A 842 2.468 -16.088 -33.010 1.00 0.82 C ATOM 407 OD1 ASP A 842 2.835 -15.733 -31.871 1.00 1.27 O ATOM 408 OD2 ASP A 842 3.215 -16.017 -34.009 1.00 1.34 O ATOM 0 H ASP A 842 -1.203 -17.557 -32.870 1.00 0.43 H new ATOM 0 HA ASP A 842 0.592 -16.162 -31.138 1.00 0.45 H new ATOM 0 HB2 ASP A 842 1.071 -17.700 -33.159 1.00 0.52 H new ATOM 0 HB3 ASP A 842 0.681 -16.317 -34.162 1.00 0.52 H new ATOM 413 N GLN A 843 -1.275 -14.473 -33.245 1.00 0.38 N ATOM 414 CA GLN A 843 -1.820 -13.153 -33.539 1.00 0.39 C ATOM 415 C GLN A 843 -2.355 -12.510 -32.262 1.00 0.36 C ATOM 416 O GLN A 843 -2.066 -11.348 -31.969 1.00 0.38 O ATOM 417 CB GLN A 843 -2.938 -13.266 -34.582 1.00 0.44 C ATOM 418 CG GLN A 843 -2.480 -13.008 -36.009 1.00 0.56 C ATOM 419 CD GLN A 843 -2.884 -14.113 -36.965 1.00 1.11 C ATOM 420 OE1 GLN A 843 -4.067 -14.397 -37.138 1.00 1.85 O ATOM 421 NE2 GLN A 843 -1.908 -14.749 -37.592 1.00 1.64 N ATOM 0 H GLN A 843 -1.727 -15.233 -33.753 1.00 0.38 H new ATOM 0 HA GLN A 843 -1.025 -12.525 -33.942 1.00 0.39 H new ATOM 0 HB2 GLN A 843 -3.374 -14.263 -34.526 1.00 0.44 H new ATOM 0 HB3 GLN A 843 -3.728 -12.558 -34.331 1.00 0.44 H new ATOM 0 HG2 GLN A 843 -2.899 -12.063 -36.355 1.00 0.56 H new ATOM 0 HG3 GLN A 843 -1.395 -12.900 -36.024 1.00 0.56 H new ATOM 0 HE21 GLN A 843 -0.937 -14.486 -37.424 1.00 1.64 H new ATOM 0 HE22 GLN A 843 -2.126 -15.502 -38.244 1.00 1.64 H new ATOM 430 N LEU A 844 -3.116 -13.282 -31.491 1.00 0.35 N ATOM 431 CA LEU A 844 -3.632 -12.812 -30.211 1.00 0.37 C ATOM 432 C LEU A 844 -2.494 -12.600 -29.217 1.00 0.38 C ATOM 433 O LEU A 844 -2.563 -11.726 -28.351 1.00 0.40 O ATOM 434 CB LEU A 844 -4.645 -13.802 -29.632 1.00 0.43 C ATOM 435 CG LEU A 844 -5.433 -13.277 -28.429 1.00 0.59 C ATOM 436 CD1 LEU A 844 -6.131 -11.975 -28.784 1.00 1.08 C ATOM 437 CD2 LEU A 844 -6.440 -14.312 -27.955 1.00 1.24 C ATOM 0 H LEU A 844 -3.388 -14.235 -31.731 1.00 0.35 H new ATOM 0 HA LEU A 844 -4.134 -11.860 -30.385 1.00 0.37 H new ATOM 0 HB2 LEU A 844 -5.348 -14.082 -30.416 1.00 0.43 H new ATOM 0 HB3 LEU A 844 -4.118 -14.710 -29.337 1.00 0.43 H new ATOM 0 HG LEU A 844 -4.734 -13.085 -27.615 1.00 0.59 H new ATOM 0 HD11 LEU A 844 -6.688 -11.613 -27.919 1.00 1.08 H new ATOM 0 HD12 LEU A 844 -5.389 -11.232 -29.075 1.00 1.08 H new ATOM 0 HD13 LEU A 844 -6.818 -12.145 -29.613 1.00 1.08 H new ATOM 0 HD21 LEU A 844 -6.990 -13.920 -27.099 1.00 1.24 H new ATOM 0 HD22 LEU A 844 -7.137 -14.537 -28.762 1.00 1.24 H new ATOM 0 HD23 LEU A 844 -5.916 -15.222 -27.663 1.00 1.24 H new ATOM 449 N GLY A 845 -1.454 -13.414 -29.339 1.00 0.42 N ATOM 450 CA GLY A 845 -0.274 -13.242 -28.519 1.00 0.49 C ATOM 451 C GLY A 845 0.396 -11.910 -28.788 1.00 0.47 C ATOM 452 O GLY A 845 0.949 -11.288 -27.882 1.00 0.52 O ATOM 0 H GLY A 845 -1.408 -14.194 -29.995 1.00 0.42 H new ATOM 0 HA2 GLY A 845 -0.548 -13.307 -27.466 1.00 0.49 H new ATOM 0 HA3 GLY A 845 0.429 -14.051 -28.716 1.00 0.49 H new ATOM 456 N SER A 846 0.317 -11.463 -30.037 1.00 0.47 N ATOM 457 CA SER A 846 0.842 -10.163 -30.419 1.00 0.52 C ATOM 458 C SER A 846 -0.022 -9.055 -29.817 1.00 0.46 C ATOM 459 O SER A 846 0.470 -7.971 -29.501 1.00 0.52 O ATOM 460 CB SER A 846 0.896 -10.041 -31.946 1.00 0.62 C ATOM 461 OG SER A 846 1.332 -11.257 -32.541 1.00 0.70 O ATOM 0 H SER A 846 -0.108 -11.986 -30.802 1.00 0.47 H new ATOM 0 HA SER A 846 1.856 -10.060 -30.033 1.00 0.52 H new ATOM 0 HB2 SER A 846 -0.090 -9.779 -32.328 1.00 0.62 H new ATOM 0 HB3 SER A 846 1.572 -9.233 -32.226 1.00 0.62 H new ATOM 0 HG SER A 846 0.740 -11.987 -32.264 1.00 0.70 H new ATOM 467 N LEU A 847 -1.312 -9.345 -29.652 1.00 0.42 N ATOM 468 CA LEU A 847 -2.227 -8.432 -28.978 1.00 0.47 C ATOM 469 C LEU A 847 -1.855 -8.314 -27.505 1.00 0.46 C ATOM 470 O LEU A 847 -1.985 -7.250 -26.900 1.00 0.56 O ATOM 471 CB LEU A 847 -3.671 -8.926 -29.102 1.00 0.56 C ATOM 472 CG LEU A 847 -4.520 -8.203 -30.144 1.00 0.74 C ATOM 473 CD1 LEU A 847 -4.740 -9.087 -31.363 1.00 1.36 C ATOM 474 CD2 LEU A 847 -5.850 -7.781 -29.540 1.00 1.56 C ATOM 0 H LEU A 847 -1.746 -10.209 -29.978 1.00 0.42 H new ATOM 0 HA LEU A 847 -2.147 -7.454 -29.453 1.00 0.47 H new ATOM 0 HB2 LEU A 847 -3.655 -9.989 -29.344 1.00 0.56 H new ATOM 0 HB3 LEU A 847 -4.156 -8.828 -28.131 1.00 0.56 H new ATOM 0 HG LEU A 847 -3.987 -7.308 -30.465 1.00 0.74 H new ATOM 0 HD11 LEU A 847 -5.347 -8.554 -32.094 1.00 1.36 H new ATOM 0 HD12 LEU A 847 -3.777 -9.341 -31.807 1.00 1.36 H new ATOM 0 HD13 LEU A 847 -5.253 -10.000 -31.062 1.00 1.36 H new ATOM 0 HD21 LEU A 847 -6.445 -7.266 -30.294 1.00 1.56 H new ATOM 0 HD22 LEU A 847 -6.388 -8.663 -29.193 1.00 1.56 H new ATOM 0 HD23 LEU A 847 -5.671 -7.111 -28.699 1.00 1.56 H new ATOM 486 N GLY A 848 -1.392 -9.420 -26.938 1.00 0.43 N ATOM 487 CA GLY A 848 -0.988 -9.432 -25.551 1.00 0.48 C ATOM 488 C GLY A 848 -2.153 -9.691 -24.622 1.00 0.48 C ATOM 489 O GLY A 848 -2.123 -9.305 -23.454 1.00 0.62 O ATOM 0 H GLY A 848 -1.290 -10.313 -27.420 1.00 0.43 H new ATOM 0 HA2 GLY A 848 -0.228 -10.199 -25.402 1.00 0.48 H new ATOM 0 HA3 GLY A 848 -0.529 -8.476 -25.299 1.00 0.48 H new ATOM 493 N TYR A 849 -3.182 -10.345 -25.140 1.00 0.42 N ATOM 494 CA TYR A 849 -4.369 -10.637 -24.347 1.00 0.46 C ATOM 495 C TYR A 849 -4.450 -12.122 -24.013 1.00 0.45 C ATOM 496 O TYR A 849 -3.679 -12.929 -24.542 1.00 0.51 O ATOM 497 CB TYR A 849 -5.629 -10.191 -25.091 1.00 0.53 C ATOM 498 CG TYR A 849 -5.969 -8.734 -24.872 1.00 0.63 C ATOM 499 CD1 TYR A 849 -5.667 -8.105 -23.670 1.00 1.07 C ATOM 500 CD2 TYR A 849 -6.590 -7.987 -25.865 1.00 0.93 C ATOM 501 CE1 TYR A 849 -5.971 -6.775 -23.464 1.00 1.20 C ATOM 502 CE2 TYR A 849 -6.899 -6.655 -25.667 1.00 1.09 C ATOM 503 CZ TYR A 849 -6.589 -6.054 -24.464 1.00 1.00 C ATOM 504 OH TYR A 849 -6.896 -4.729 -24.260 1.00 1.22 O ATOM 0 H TYR A 849 -3.220 -10.683 -26.102 1.00 0.42 H new ATOM 0 HA TYR A 849 -4.297 -10.081 -23.412 1.00 0.46 H new ATOM 0 HB2 TYR A 849 -5.495 -10.369 -26.158 1.00 0.53 H new ATOM 0 HB3 TYR A 849 -6.470 -10.805 -24.769 1.00 0.53 H new ATOM 0 HD1 TYR A 849 -5.186 -8.667 -22.883 1.00 1.07 H new ATOM 0 HD2 TYR A 849 -6.835 -8.455 -26.807 1.00 0.93 H new ATOM 0 HE1 TYR A 849 -5.726 -6.301 -22.525 1.00 1.20 H new ATOM 0 HE2 TYR A 849 -7.381 -6.087 -26.449 1.00 1.09 H new ATOM 0 HH TYR A 849 -7.150 -4.592 -23.323 1.00 1.22 H new ATOM 514 N GLN A 850 -5.381 -12.474 -23.132 1.00 0.47 N ATOM 515 CA GLN A 850 -5.572 -13.859 -22.718 1.00 0.49 C ATOM 516 C GLN A 850 -6.068 -14.701 -23.886 1.00 0.45 C ATOM 517 O GLN A 850 -7.101 -14.398 -24.483 1.00 0.51 O ATOM 518 CB GLN A 850 -6.570 -13.929 -21.558 1.00 0.59 C ATOM 519 CG GLN A 850 -6.394 -15.149 -20.666 1.00 0.97 C ATOM 520 CD GLN A 850 -5.012 -15.233 -20.054 1.00 1.66 C ATOM 521 OE1 GLN A 850 -4.163 -15.998 -20.515 1.00 2.38 O ATOM 522 NE2 GLN A 850 -4.779 -14.461 -19.007 1.00 2.17 N ATOM 0 H GLN A 850 -6.019 -11.813 -22.688 1.00 0.47 H new ATOM 0 HA GLN A 850 -4.613 -14.257 -22.385 1.00 0.49 H new ATOM 0 HB2 GLN A 850 -6.470 -13.030 -20.951 1.00 0.59 H new ATOM 0 HB3 GLN A 850 -7.582 -13.930 -21.962 1.00 0.59 H new ATOM 0 HG2 GLN A 850 -7.138 -15.122 -19.870 1.00 0.97 H new ATOM 0 HG3 GLN A 850 -6.584 -16.050 -21.249 1.00 0.97 H new ATOM 0 HE21 GLN A 850 -5.510 -13.842 -18.657 1.00 2.17 H new ATOM 0 HE22 GLN A 850 -3.868 -14.484 -18.549 1.00 2.17 H new ATOM 531 N CYS A 851 -5.329 -15.750 -24.212 1.00 0.45 N ATOM 532 CA CYS A 851 -5.679 -16.608 -25.333 1.00 0.47 C ATOM 533 C CYS A 851 -6.313 -17.908 -24.851 1.00 0.41 C ATOM 534 O CYS A 851 -5.638 -18.766 -24.280 1.00 0.51 O ATOM 535 CB CYS A 851 -4.435 -16.912 -26.172 1.00 0.61 C ATOM 536 SG CYS A 851 -3.236 -15.556 -26.245 1.00 0.94 S ATOM 0 H CYS A 851 -4.482 -16.028 -23.716 1.00 0.45 H new ATOM 0 HA CYS A 851 -6.407 -16.081 -25.949 1.00 0.47 H new ATOM 0 HB2 CYS A 851 -3.943 -17.795 -25.764 1.00 0.61 H new ATOM 0 HB3 CYS A 851 -4.747 -17.161 -27.186 1.00 0.61 H new ATOM 0 HG CYS A 851 -3.668 -14.556 -25.536 1.00 0.94 H new ATOM 542 N LYS A 852 -7.613 -18.043 -25.062 1.00 0.34 N ATOM 543 CA LYS A 852 -8.315 -19.275 -24.729 1.00 0.34 C ATOM 544 C LYS A 852 -8.438 -20.139 -25.976 1.00 0.31 C ATOM 545 O LYS A 852 -9.071 -19.742 -26.948 1.00 0.33 O ATOM 546 CB LYS A 852 -9.698 -18.967 -24.151 1.00 0.40 C ATOM 547 CG LYS A 852 -9.809 -19.227 -22.653 1.00 0.66 C ATOM 548 CD LYS A 852 -8.600 -18.696 -21.897 1.00 0.56 C ATOM 549 CE LYS A 852 -8.611 -19.135 -20.440 1.00 0.88 C ATOM 550 NZ LYS A 852 -7.903 -20.429 -20.242 1.00 1.44 N ATOM 0 H LYS A 852 -8.205 -17.315 -25.462 1.00 0.34 H new ATOM 0 HA LYS A 852 -7.747 -19.816 -23.972 1.00 0.34 H new ATOM 0 HB2 LYS A 852 -9.940 -17.923 -24.348 1.00 0.40 H new ATOM 0 HB3 LYS A 852 -10.442 -19.570 -24.671 1.00 0.40 H new ATOM 0 HG2 LYS A 852 -10.714 -18.756 -22.268 1.00 0.66 H new ATOM 0 HG3 LYS A 852 -9.907 -20.298 -22.476 1.00 0.66 H new ATOM 0 HD2 LYS A 852 -7.687 -19.049 -22.377 1.00 0.56 H new ATOM 0 HD3 LYS A 852 -8.587 -17.607 -21.949 1.00 0.56 H new ATOM 0 HE2 LYS A 852 -8.140 -18.367 -19.826 1.00 0.88 H new ATOM 0 HE3 LYS A 852 -9.642 -19.230 -20.098 1.00 0.88 H new ATOM 0 HZ1 LYS A 852 -7.934 -20.691 -19.236 1.00 1.44 H new ATOM 0 HZ2 LYS A 852 -8.367 -21.169 -20.807 1.00 1.44 H new ATOM 0 HZ3 LYS A 852 -6.913 -20.333 -20.544 1.00 1.44 H new ATOM 564 N THR A 853 -7.818 -21.305 -25.952 1.00 0.33 N ATOM 565 CA THR A 853 -7.751 -22.163 -27.127 1.00 0.34 C ATOM 566 C THR A 853 -8.918 -23.145 -27.197 1.00 0.34 C ATOM 567 O THR A 853 -9.316 -23.732 -26.188 1.00 0.44 O ATOM 568 CB THR A 853 -6.429 -22.952 -27.135 1.00 0.46 C ATOM 569 OG1 THR A 853 -5.654 -22.595 -25.980 1.00 0.62 O ATOM 570 CG2 THR A 853 -5.630 -22.661 -28.397 1.00 0.61 C ATOM 0 H THR A 853 -7.351 -21.683 -25.128 1.00 0.33 H new ATOM 0 HA THR A 853 -7.807 -21.510 -27.998 1.00 0.34 H new ATOM 0 HB THR A 853 -6.659 -24.017 -27.113 1.00 0.46 H new ATOM 0 HG1 THR A 853 -4.813 -23.098 -25.982 1.00 0.62 H new ATOM 0 HG21 THR A 853 -4.701 -23.230 -28.379 1.00 0.61 H new ATOM 0 HG22 THR A 853 -6.214 -22.948 -29.272 1.00 0.61 H new ATOM 0 HG23 THR A 853 -5.402 -21.596 -28.446 1.00 0.61 H new ATOM 578 N ALA A 854 -9.464 -23.302 -28.396 1.00 0.32 N ATOM 579 CA ALA A 854 -10.498 -24.292 -28.666 1.00 0.37 C ATOM 580 C ALA A 854 -10.394 -24.736 -30.119 1.00 0.34 C ATOM 581 O ALA A 854 -9.705 -24.091 -30.913 1.00 0.35 O ATOM 582 CB ALA A 854 -11.881 -23.726 -28.368 1.00 0.47 C ATOM 0 H ALA A 854 -9.202 -22.746 -29.210 1.00 0.32 H new ATOM 0 HA ALA A 854 -10.351 -25.154 -28.015 1.00 0.37 H new ATOM 0 HB1 ALA A 854 -12.637 -24.483 -28.577 1.00 0.47 H new ATOM 0 HB2 ALA A 854 -11.937 -23.437 -27.319 1.00 0.47 H new ATOM 0 HB3 ALA A 854 -12.059 -22.852 -28.995 1.00 0.47 H new ATOM 588 N ASN A 855 -11.067 -25.821 -30.483 1.00 0.36 N ATOM 589 CA ASN A 855 -10.978 -26.316 -31.854 1.00 0.43 C ATOM 590 C ASN A 855 -12.303 -26.887 -32.343 1.00 0.44 C ATOM 591 O ASN A 855 -12.452 -28.100 -32.503 1.00 0.53 O ATOM 592 CB ASN A 855 -9.853 -27.359 -31.992 1.00 0.54 C ATOM 593 CG ASN A 855 -9.965 -28.524 -31.021 1.00 1.11 C ATOM 594 OD1 ASN A 855 -9.826 -28.360 -29.810 1.00 1.90 O ATOM 595 ND2 ASN A 855 -10.205 -29.712 -31.552 1.00 1.75 N ATOM 0 H ASN A 855 -11.668 -26.366 -29.865 1.00 0.36 H new ATOM 0 HA ASN A 855 -10.738 -25.462 -32.487 1.00 0.43 H new ATOM 0 HB2 ASN A 855 -9.855 -27.747 -33.011 1.00 0.54 H new ATOM 0 HB3 ASN A 855 -8.893 -26.865 -31.841 1.00 0.54 H new ATOM 0 HD21 ASN A 855 -10.281 -30.533 -30.952 1.00 1.75 H new ATOM 0 HD22 ASN A 855 -10.314 -29.807 -32.562 1.00 1.75 H new ATOM 602 N ASP A 856 -13.240 -25.977 -32.605 1.00 0.43 N ATOM 603 CA ASP A 856 -14.540 -26.283 -33.213 1.00 0.47 C ATOM 604 C ASP A 856 -15.480 -25.113 -32.986 1.00 0.49 C ATOM 605 O ASP A 856 -15.286 -24.336 -32.051 1.00 0.60 O ATOM 606 CB ASP A 856 -15.171 -27.561 -32.642 1.00 0.51 C ATOM 607 CG ASP A 856 -16.430 -27.975 -33.377 1.00 0.80 C ATOM 608 OD1 ASP A 856 -16.586 -27.607 -34.564 1.00 1.01 O ATOM 609 OD2 ASP A 856 -17.274 -28.659 -32.769 1.00 1.45 O ATOM 0 H ASP A 856 -13.117 -24.986 -32.398 1.00 0.43 H new ATOM 0 HA ASP A 856 -14.376 -26.450 -34.278 1.00 0.47 H new ATOM 0 HB2 ASP A 856 -14.444 -28.372 -32.690 1.00 0.51 H new ATOM 0 HB3 ASP A 856 -15.405 -27.406 -31.589 1.00 0.51 H new ATOM 614 N GLY A 857 -16.489 -24.986 -33.827 1.00 0.53 N ATOM 615 CA GLY A 857 -17.460 -23.928 -33.650 1.00 0.58 C ATOM 616 C GLY A 857 -18.299 -24.155 -32.414 1.00 0.54 C ATOM 617 O GLY A 857 -18.538 -23.237 -31.635 1.00 0.57 O ATOM 0 H GLY A 857 -16.655 -25.594 -34.629 1.00 0.53 H new ATOM 0 HA2 GLY A 857 -16.947 -22.969 -33.573 1.00 0.58 H new ATOM 0 HA3 GLY A 857 -18.106 -23.874 -34.526 1.00 0.58 H new ATOM 621 N VAL A 858 -18.728 -25.397 -32.230 1.00 0.52 N ATOM 622 CA VAL A 858 -19.517 -25.772 -31.063 1.00 0.52 C ATOM 623 C VAL A 858 -18.637 -25.827 -29.816 1.00 0.50 C ATOM 624 O VAL A 858 -19.111 -25.611 -28.701 1.00 0.54 O ATOM 625 CB VAL A 858 -20.259 -27.115 -31.255 1.00 0.55 C ATOM 626 CG1 VAL A 858 -21.686 -27.005 -30.736 1.00 0.72 C ATOM 627 CG2 VAL A 858 -20.263 -27.537 -32.719 1.00 0.95 C ATOM 0 H VAL A 858 -18.542 -26.164 -32.876 1.00 0.52 H new ATOM 0 HA VAL A 858 -20.277 -25.001 -30.934 1.00 0.52 H new ATOM 0 HB VAL A 858 -19.730 -27.878 -30.685 1.00 0.55 H new ATOM 0 HG11 VAL A 858 -22.199 -27.957 -30.877 1.00 0.72 H new ATOM 0 HG12 VAL A 858 -21.669 -26.755 -29.675 1.00 0.72 H new ATOM 0 HG13 VAL A 858 -22.213 -26.224 -31.284 1.00 0.72 H new ATOM 0 HG21 VAL A 858 -20.792 -28.485 -32.823 1.00 0.95 H new ATOM 0 HG22 VAL A 858 -20.764 -26.775 -33.316 1.00 0.95 H new ATOM 0 HG23 VAL A 858 -19.237 -27.654 -33.067 1.00 0.95 H new ATOM 637 N ASP A 859 -17.357 -26.133 -30.010 1.00 0.47 N ATOM 638 CA ASP A 859 -16.373 -26.108 -28.923 1.00 0.49 C ATOM 639 C ASP A 859 -16.386 -24.758 -28.221 1.00 0.45 C ATOM 640 O ASP A 859 -16.292 -24.681 -26.997 1.00 0.46 O ATOM 641 CB ASP A 859 -14.974 -26.388 -29.469 1.00 0.55 C ATOM 642 CG ASP A 859 -14.057 -27.043 -28.458 1.00 0.64 C ATOM 643 OD1 ASP A 859 -14.555 -27.563 -27.439 1.00 0.75 O ATOM 644 OD2 ASP A 859 -12.827 -27.058 -28.693 1.00 0.84 O ATOM 0 H ASP A 859 -16.972 -26.403 -30.915 1.00 0.47 H new ATOM 0 HA ASP A 859 -16.639 -26.883 -28.204 1.00 0.49 H new ATOM 0 HB2 ASP A 859 -15.055 -27.031 -30.345 1.00 0.55 H new ATOM 0 HB3 ASP A 859 -14.527 -25.451 -29.801 1.00 0.55 H new ATOM 649 N ALA A 860 -16.523 -23.697 -29.010 1.00 0.45 N ATOM 650 CA ALA A 860 -16.606 -22.345 -28.471 1.00 0.47 C ATOM 651 C ALA A 860 -17.810 -22.199 -27.539 1.00 0.49 C ATOM 652 O ALA A 860 -17.748 -21.485 -26.543 1.00 0.51 O ATOM 653 CB ALA A 860 -16.680 -21.330 -29.602 1.00 0.51 C ATOM 0 H ALA A 860 -16.579 -23.748 -30.027 1.00 0.45 H new ATOM 0 HA ALA A 860 -15.705 -22.154 -27.888 1.00 0.47 H new ATOM 0 HB1 ALA A 860 -16.742 -20.325 -29.185 1.00 0.51 H new ATOM 0 HB2 ALA A 860 -15.788 -21.411 -30.223 1.00 0.51 H new ATOM 0 HB3 ALA A 860 -17.564 -21.526 -30.209 1.00 0.51 H new ATOM 659 N LEU A 861 -18.897 -22.894 -27.865 1.00 0.55 N ATOM 660 CA LEU A 861 -20.109 -22.866 -27.049 1.00 0.66 C ATOM 661 C LEU A 861 -19.856 -23.527 -25.701 1.00 0.59 C ATOM 662 O LEU A 861 -20.226 -22.997 -24.655 1.00 0.60 O ATOM 663 CB LEU A 861 -21.253 -23.596 -27.760 1.00 0.87 C ATOM 664 CG LEU A 861 -22.013 -22.780 -28.802 1.00 0.85 C ATOM 665 CD1 LEU A 861 -21.247 -22.738 -30.114 1.00 1.85 C ATOM 666 CD2 LEU A 861 -23.396 -23.367 -29.017 1.00 1.19 C ATOM 0 H LEU A 861 -18.964 -23.486 -28.693 1.00 0.55 H new ATOM 0 HA LEU A 861 -20.388 -21.824 -26.895 1.00 0.66 H new ATOM 0 HB2 LEU A 861 -20.847 -24.483 -28.246 1.00 0.87 H new ATOM 0 HB3 LEU A 861 -21.962 -23.941 -27.008 1.00 0.87 H new ATOM 0 HG LEU A 861 -22.117 -21.759 -28.434 1.00 0.85 H new ATOM 0 HD11 LEU A 861 -21.806 -22.151 -30.843 1.00 1.85 H new ATOM 0 HD12 LEU A 861 -20.271 -22.280 -29.951 1.00 1.85 H new ATOM 0 HD13 LEU A 861 -21.113 -23.752 -30.490 1.00 1.85 H new ATOM 0 HD21 LEU A 861 -23.930 -22.777 -29.762 1.00 1.19 H new ATOM 0 HD22 LEU A 861 -23.304 -24.396 -29.366 1.00 1.19 H new ATOM 0 HD23 LEU A 861 -23.948 -23.350 -28.078 1.00 1.19 H new ATOM 678 N ASN A 862 -19.212 -24.686 -25.742 1.00 0.58 N ATOM 679 CA ASN A 862 -18.926 -25.454 -24.536 1.00 0.59 C ATOM 680 C ASN A 862 -17.986 -24.674 -23.633 1.00 0.53 C ATOM 681 O ASN A 862 -18.212 -24.543 -22.426 1.00 0.55 O ATOM 682 CB ASN A 862 -18.294 -26.801 -24.902 1.00 0.66 C ATOM 683 CG ASN A 862 -18.821 -27.942 -24.054 1.00 1.02 C ATOM 684 OD1 ASN A 862 -18.755 -27.904 -22.825 1.00 1.21 O ATOM 685 ND2 ASN A 862 -19.333 -28.976 -24.708 1.00 1.72 N ATOM 0 H ASN A 862 -18.876 -25.118 -26.603 1.00 0.58 H new ATOM 0 HA ASN A 862 -19.862 -25.635 -24.008 1.00 0.59 H new ATOM 0 HB2 ASN A 862 -18.487 -27.015 -25.953 1.00 0.66 H new ATOM 0 HB3 ASN A 862 -17.212 -26.735 -24.784 1.00 0.66 H new ATOM 0 HD21 ASN A 862 -19.691 -29.780 -24.192 1.00 1.72 H new ATOM 0 HD22 ASN A 862 -19.369 -28.968 -25.727 1.00 1.72 H new ATOM 692 N VAL A 863 -16.943 -24.136 -24.244 1.00 0.48 N ATOM 693 CA VAL A 863 -15.957 -23.345 -23.537 1.00 0.48 C ATOM 694 C VAL A 863 -16.604 -22.092 -22.937 1.00 0.47 C ATOM 695 O VAL A 863 -16.278 -21.698 -21.824 1.00 0.50 O ATOM 696 CB VAL A 863 -14.792 -22.968 -24.488 1.00 0.51 C ATOM 697 CG1 VAL A 863 -14.162 -21.640 -24.115 1.00 0.81 C ATOM 698 CG2 VAL A 863 -13.739 -24.065 -24.498 1.00 0.89 C ATOM 0 H VAL A 863 -16.759 -24.237 -25.242 1.00 0.48 H new ATOM 0 HA VAL A 863 -15.551 -23.939 -22.718 1.00 0.48 H new ATOM 0 HB VAL A 863 -15.210 -22.864 -25.489 1.00 0.51 H new ATOM 0 HG11 VAL A 863 -13.351 -21.415 -24.807 1.00 0.81 H new ATOM 0 HG12 VAL A 863 -14.914 -20.853 -24.169 1.00 0.81 H new ATOM 0 HG13 VAL A 863 -13.768 -21.696 -23.100 1.00 0.81 H new ATOM 0 HG21 VAL A 863 -12.928 -23.785 -25.170 1.00 0.89 H new ATOM 0 HG22 VAL A 863 -13.345 -24.200 -23.491 1.00 0.89 H new ATOM 0 HG23 VAL A 863 -14.188 -24.997 -24.840 1.00 0.89 H new ATOM 708 N LEU A 864 -17.545 -21.502 -23.668 1.00 0.46 N ATOM 709 CA LEU A 864 -18.261 -20.312 -23.206 1.00 0.50 C ATOM 710 C LEU A 864 -19.173 -20.641 -22.024 1.00 0.55 C ATOM 711 O LEU A 864 -19.339 -19.835 -21.107 1.00 0.59 O ATOM 712 CB LEU A 864 -19.094 -19.726 -24.351 1.00 0.54 C ATOM 713 CG LEU A 864 -19.048 -18.201 -24.506 1.00 0.79 C ATOM 714 CD1 LEU A 864 -20.011 -17.531 -23.539 1.00 1.66 C ATOM 715 CD2 LEU A 864 -17.636 -17.675 -24.298 1.00 1.06 C ATOM 0 H LEU A 864 -17.833 -21.830 -24.590 1.00 0.46 H new ATOM 0 HA LEU A 864 -17.523 -19.580 -22.878 1.00 0.50 H new ATOM 0 HB2 LEU A 864 -18.758 -20.176 -25.285 1.00 0.54 H new ATOM 0 HB3 LEU A 864 -20.132 -20.025 -24.208 1.00 0.54 H new ATOM 0 HG LEU A 864 -19.356 -17.959 -25.523 1.00 0.79 H new ATOM 0 HD11 LEU A 864 -19.961 -16.450 -23.667 1.00 1.66 H new ATOM 0 HD12 LEU A 864 -21.026 -17.874 -23.740 1.00 1.66 H new ATOM 0 HD13 LEU A 864 -19.737 -17.788 -22.516 1.00 1.66 H new ATOM 0 HD21 LEU A 864 -17.631 -16.591 -24.413 1.00 1.06 H new ATOM 0 HD22 LEU A 864 -17.295 -17.935 -23.296 1.00 1.06 H new ATOM 0 HD23 LEU A 864 -16.969 -18.122 -25.036 1.00 1.06 H new ATOM 727 N SER A 865 -19.765 -21.826 -22.058 1.00 0.58 N ATOM 728 CA SER A 865 -20.676 -22.260 -21.008 1.00 0.67 C ATOM 729 C SER A 865 -19.935 -22.471 -19.689 1.00 0.66 C ATOM 730 O SER A 865 -20.519 -22.344 -18.609 1.00 0.77 O ATOM 731 CB SER A 865 -21.385 -23.551 -21.428 1.00 0.75 C ATOM 732 OG SER A 865 -22.008 -23.405 -22.696 1.00 0.82 O ATOM 0 H SER A 865 -19.630 -22.507 -22.805 1.00 0.58 H new ATOM 0 HA SER A 865 -21.419 -21.477 -20.857 1.00 0.67 H new ATOM 0 HB2 SER A 865 -20.665 -24.369 -21.465 1.00 0.75 H new ATOM 0 HB3 SER A 865 -22.133 -23.818 -20.681 1.00 0.75 H new ATOM 0 HG SER A 865 -21.331 -23.464 -23.402 1.00 0.82 H new ATOM 738 N LYS A 866 -18.654 -22.802 -19.782 1.00 0.61 N ATOM 739 CA LYS A 866 -17.832 -22.983 -18.595 1.00 0.66 C ATOM 740 C LYS A 866 -17.198 -21.661 -18.165 1.00 0.66 C ATOM 741 O LYS A 866 -17.354 -21.229 -17.022 1.00 0.83 O ATOM 742 CB LYS A 866 -16.743 -24.028 -18.851 1.00 0.73 C ATOM 743 CG LYS A 866 -17.197 -25.459 -18.599 1.00 1.12 C ATOM 744 CD LYS A 866 -17.816 -25.621 -17.218 1.00 1.85 C ATOM 745 CE LYS A 866 -16.766 -25.528 -16.120 1.00 2.63 C ATOM 746 NZ LYS A 866 -16.546 -26.829 -15.436 1.00 3.46 N ATOM 0 H LYS A 866 -18.164 -22.950 -20.664 1.00 0.61 H new ATOM 0 HA LYS A 866 -18.476 -23.335 -17.790 1.00 0.66 H new ATOM 0 HB2 LYS A 866 -16.403 -23.940 -19.883 1.00 0.73 H new ATOM 0 HB3 LYS A 866 -15.886 -23.810 -18.214 1.00 0.73 H new ATOM 0 HG2 LYS A 866 -17.923 -25.749 -19.359 1.00 1.12 H new ATOM 0 HG3 LYS A 866 -16.346 -26.133 -18.697 1.00 1.12 H new ATOM 0 HD2 LYS A 866 -18.573 -24.851 -17.065 1.00 1.85 H new ATOM 0 HD3 LYS A 866 -18.324 -26.584 -17.157 1.00 1.85 H new ATOM 0 HE2 LYS A 866 -15.825 -25.182 -16.549 1.00 2.63 H new ATOM 0 HE3 LYS A 866 -17.075 -24.783 -15.387 1.00 2.63 H new ATOM 0 HZ1 LYS A 866 -15.823 -26.715 -14.697 1.00 3.46 H new ATOM 0 HZ2 LYS A 866 -17.436 -27.148 -15.003 1.00 3.46 H new ATOM 0 HZ3 LYS A 866 -16.225 -27.535 -16.128 1.00 3.46 H new ATOM 760 N ASN A 867 -16.506 -21.019 -19.093 1.00 0.61 N ATOM 761 CA ASN A 867 -15.780 -19.788 -18.814 1.00 0.68 C ATOM 762 C ASN A 867 -16.258 -18.674 -19.734 1.00 0.76 C ATOM 763 O ASN A 867 -16.505 -18.898 -20.915 1.00 1.40 O ATOM 764 CB ASN A 867 -14.277 -20.006 -19.008 1.00 0.77 C ATOM 765 CG ASN A 867 -13.442 -19.324 -17.943 1.00 1.08 C ATOM 766 OD1 ASN A 867 -13.016 -19.950 -16.972 1.00 1.86 O ATOM 767 ND2 ASN A 867 -13.186 -18.036 -18.120 1.00 1.40 N ATOM 0 H ASN A 867 -16.431 -21.335 -20.060 1.00 0.61 H new ATOM 0 HA ASN A 867 -15.969 -19.501 -17.780 1.00 0.68 H new ATOM 0 HB2 ASN A 867 -14.066 -21.075 -18.999 1.00 0.77 H new ATOM 0 HB3 ASN A 867 -13.984 -19.631 -19.989 1.00 0.77 H new ATOM 0 HD21 ASN A 867 -12.619 -17.530 -17.439 1.00 1.40 H new ATOM 0 HD22 ASN A 867 -13.556 -17.550 -18.937 1.00 1.40 H new ATOM 774 N HIS A 868 -16.379 -17.470 -19.197 1.00 0.78 N ATOM 775 CA HIS A 868 -16.867 -16.338 -19.976 1.00 0.81 C ATOM 776 C HIS A 868 -15.713 -15.633 -20.674 1.00 0.89 C ATOM 777 O HIS A 868 -14.707 -15.303 -20.048 1.00 1.90 O ATOM 778 CB HIS A 868 -17.619 -15.350 -19.082 1.00 1.06 C ATOM 779 CG HIS A 868 -18.712 -15.979 -18.274 1.00 1.68 C ATOM 780 ND1 HIS A 868 -18.911 -15.706 -16.939 1.00 2.38 N ATOM 781 CD2 HIS A 868 -19.659 -16.887 -18.613 1.00 2.48 C ATOM 782 CE1 HIS A 868 -19.929 -16.414 -16.493 1.00 3.08 C ATOM 783 NE2 HIS A 868 -20.399 -17.137 -17.488 1.00 3.12 N ATOM 0 H HIS A 868 -16.147 -17.250 -18.228 1.00 0.78 H new ATOM 0 HA HIS A 868 -17.555 -16.719 -20.731 1.00 0.81 H new ATOM 0 HB2 HIS A 868 -16.909 -14.872 -18.407 1.00 1.06 H new ATOM 0 HB3 HIS A 868 -18.046 -14.563 -19.704 1.00 1.06 H new ATOM 0 HD2 HIS A 868 -19.803 -17.330 -19.587 1.00 2.48 H new ATOM 0 HE1 HIS A 868 -20.312 -16.403 -15.483 1.00 3.08 H new ATOM 0 HE2 HIS A 868 -21.188 -17.781 -17.430 1.00 3.12 H new ATOM 792 N ILE A 869 -15.869 -15.413 -21.967 1.00 0.51 N ATOM 793 CA ILE A 869 -14.848 -14.764 -22.774 1.00 0.41 C ATOM 794 C ILE A 869 -15.435 -13.509 -23.419 1.00 0.46 C ATOM 795 O ILE A 869 -16.616 -13.488 -23.768 1.00 0.68 O ATOM 796 CB ILE A 869 -14.301 -15.741 -23.851 1.00 0.45 C ATOM 797 CG1 ILE A 869 -13.185 -16.605 -23.259 1.00 0.74 C ATOM 798 CG2 ILE A 869 -13.797 -15.001 -25.082 1.00 0.82 C ATOM 799 CD1 ILE A 869 -13.659 -17.951 -22.752 1.00 1.06 C ATOM 0 H ILE A 869 -16.705 -15.678 -22.488 1.00 0.51 H new ATOM 0 HA ILE A 869 -14.013 -14.475 -22.136 1.00 0.41 H new ATOM 0 HB ILE A 869 -15.125 -16.381 -24.167 1.00 0.45 H new ATOM 0 HG12 ILE A 869 -12.418 -16.762 -24.018 1.00 0.74 H new ATOM 0 HG13 ILE A 869 -12.715 -16.063 -22.438 1.00 0.74 H new ATOM 0 HG21 ILE A 869 -13.423 -15.720 -25.811 1.00 0.82 H new ATOM 0 HG22 ILE A 869 -14.614 -14.429 -25.522 1.00 0.82 H new ATOM 0 HG23 ILE A 869 -12.993 -14.323 -24.795 1.00 0.82 H new ATOM 0 HD11 ILE A 869 -12.813 -18.506 -22.347 1.00 1.06 H new ATOM 0 HD12 ILE A 869 -14.404 -17.804 -21.970 1.00 1.06 H new ATOM 0 HD13 ILE A 869 -14.102 -18.514 -23.574 1.00 1.06 H new ATOM 811 N ASP A 870 -14.614 -12.468 -23.553 1.00 0.41 N ATOM 812 CA ASP A 870 -15.066 -11.181 -24.082 1.00 0.48 C ATOM 813 C ASP A 870 -15.527 -11.310 -25.533 1.00 0.44 C ATOM 814 O ASP A 870 -16.678 -11.021 -25.857 1.00 0.56 O ATOM 815 CB ASP A 870 -13.943 -10.139 -23.988 1.00 0.58 C ATOM 816 CG ASP A 870 -13.665 -9.693 -22.565 1.00 1.07 C ATOM 817 OD1 ASP A 870 -14.415 -8.831 -22.052 1.00 1.48 O ATOM 818 OD2 ASP A 870 -12.710 -10.212 -21.946 1.00 1.64 O ATOM 0 H ASP A 870 -13.626 -12.491 -23.301 1.00 0.41 H new ATOM 0 HA ASP A 870 -15.913 -10.854 -23.478 1.00 0.48 H new ATOM 0 HB2 ASP A 870 -13.032 -10.556 -24.417 1.00 0.58 H new ATOM 0 HB3 ASP A 870 -14.210 -9.270 -24.590 1.00 0.58 H new ATOM 823 N ILE A 871 -14.620 -11.736 -26.406 1.00 0.38 N ATOM 824 CA ILE A 871 -14.940 -11.911 -27.821 1.00 0.39 C ATOM 825 C ILE A 871 -14.417 -13.253 -28.319 1.00 0.36 C ATOM 826 O ILE A 871 -13.322 -13.677 -27.947 1.00 0.37 O ATOM 827 CB ILE A 871 -14.353 -10.782 -28.702 1.00 0.46 C ATOM 828 CG1 ILE A 871 -13.641 -9.725 -27.847 1.00 0.53 C ATOM 829 CG2 ILE A 871 -15.457 -10.141 -29.532 1.00 0.74 C ATOM 830 CD1 ILE A 871 -13.029 -8.595 -28.649 1.00 1.03 C ATOM 0 H ILE A 871 -13.657 -11.967 -26.160 1.00 0.38 H new ATOM 0 HA ILE A 871 -16.026 -11.875 -27.904 1.00 0.39 H new ATOM 0 HB ILE A 871 -13.614 -11.221 -29.373 1.00 0.46 H new ATOM 0 HG12 ILE A 871 -14.354 -9.308 -27.136 1.00 0.53 H new ATOM 0 HG13 ILE A 871 -12.857 -10.210 -27.266 1.00 0.53 H new ATOM 0 HG21 ILE A 871 -15.035 -9.348 -30.149 1.00 0.74 H new ATOM 0 HG22 ILE A 871 -15.914 -10.895 -30.173 1.00 0.74 H new ATOM 0 HG23 ILE A 871 -16.214 -9.721 -28.869 1.00 0.74 H new ATOM 0 HD11 ILE A 871 -12.545 -7.890 -27.973 1.00 1.03 H new ATOM 0 HD12 ILE A 871 -12.291 -8.999 -29.342 1.00 1.03 H new ATOM 0 HD13 ILE A 871 -13.810 -8.082 -29.210 1.00 1.03 H new ATOM 842 N VAL A 872 -15.195 -13.925 -29.157 1.00 0.38 N ATOM 843 CA VAL A 872 -14.825 -15.255 -29.624 1.00 0.40 C ATOM 844 C VAL A 872 -14.559 -15.263 -31.121 1.00 0.41 C ATOM 845 O VAL A 872 -15.408 -14.858 -31.903 1.00 0.46 O ATOM 846 CB VAL A 872 -15.933 -16.283 -29.308 1.00 0.49 C ATOM 847 CG1 VAL A 872 -15.523 -17.679 -29.753 1.00 0.59 C ATOM 848 CG2 VAL A 872 -16.271 -16.271 -27.827 1.00 0.67 C ATOM 0 H VAL A 872 -16.079 -13.575 -29.525 1.00 0.38 H new ATOM 0 HA VAL A 872 -13.912 -15.532 -29.097 1.00 0.40 H new ATOM 0 HB VAL A 872 -16.825 -15.998 -29.866 1.00 0.49 H new ATOM 0 HG11 VAL A 872 -16.320 -18.384 -29.519 1.00 0.59 H new ATOM 0 HG12 VAL A 872 -15.342 -17.680 -30.828 1.00 0.59 H new ATOM 0 HG13 VAL A 872 -14.613 -17.975 -29.231 1.00 0.59 H new ATOM 0 HG21 VAL A 872 -17.054 -17.003 -27.627 1.00 0.67 H new ATOM 0 HG22 VAL A 872 -15.382 -16.523 -27.249 1.00 0.67 H new ATOM 0 HG23 VAL A 872 -16.620 -15.279 -27.542 1.00 0.67 H new ATOM 858 N LEU A 873 -13.380 -15.721 -31.514 1.00 0.41 N ATOM 859 CA LEU A 873 -13.066 -15.909 -32.925 1.00 0.44 C ATOM 860 C LEU A 873 -12.942 -17.399 -33.222 1.00 0.42 C ATOM 861 O LEU A 873 -11.991 -18.041 -32.784 1.00 0.50 O ATOM 862 CB LEU A 873 -11.761 -15.201 -33.314 1.00 0.52 C ATOM 863 CG LEU A 873 -11.361 -14.007 -32.443 1.00 0.51 C ATOM 864 CD1 LEU A 873 -10.062 -14.293 -31.711 1.00 0.78 C ATOM 865 CD2 LEU A 873 -11.223 -12.757 -33.292 1.00 0.87 C ATOM 0 H LEU A 873 -12.624 -15.970 -30.876 1.00 0.41 H new ATOM 0 HA LEU A 873 -13.874 -15.472 -33.511 1.00 0.44 H new ATOM 0 HB2 LEU A 873 -10.953 -15.932 -33.288 1.00 0.52 H new ATOM 0 HB3 LEU A 873 -11.849 -14.860 -34.345 1.00 0.52 H new ATOM 0 HG LEU A 873 -12.145 -13.842 -31.704 1.00 0.51 H new ATOM 0 HD11 LEU A 873 -9.793 -13.433 -31.097 1.00 0.78 H new ATOM 0 HD12 LEU A 873 -10.188 -15.168 -31.074 1.00 0.78 H new ATOM 0 HD13 LEU A 873 -9.270 -14.483 -32.436 1.00 0.78 H new ATOM 0 HD21 LEU A 873 -10.938 -11.917 -32.659 1.00 0.87 H new ATOM 0 HD22 LEU A 873 -10.457 -12.915 -34.051 1.00 0.87 H new ATOM 0 HD23 LEU A 873 -12.175 -12.540 -33.777 1.00 0.87 H new ATOM 877 N SER A 874 -13.898 -17.951 -33.952 1.00 0.38 N ATOM 878 CA SER A 874 -13.906 -19.386 -34.216 1.00 0.40 C ATOM 879 C SER A 874 -13.810 -19.676 -35.707 1.00 0.33 C ATOM 880 O SER A 874 -14.672 -19.266 -36.485 1.00 0.34 O ATOM 881 CB SER A 874 -15.168 -20.022 -33.631 1.00 0.53 C ATOM 882 OG SER A 874 -15.992 -19.041 -33.022 1.00 0.73 O ATOM 0 H SER A 874 -14.673 -17.436 -34.370 1.00 0.38 H new ATOM 0 HA SER A 874 -13.031 -19.822 -33.734 1.00 0.40 H new ATOM 0 HB2 SER A 874 -15.723 -20.531 -34.419 1.00 0.53 H new ATOM 0 HB3 SER A 874 -14.892 -20.778 -32.896 1.00 0.53 H new ATOM 0 HG SER A 874 -16.794 -19.469 -32.656 1.00 0.73 H new ATOM 888 N ASP A 875 -12.748 -20.364 -36.096 1.00 0.40 N ATOM 889 CA ASP A 875 -12.543 -20.758 -37.482 1.00 0.44 C ATOM 890 C ASP A 875 -13.102 -22.154 -37.726 1.00 0.48 C ATOM 891 O ASP A 875 -12.669 -23.136 -37.111 1.00 0.55 O ATOM 892 CB ASP A 875 -11.054 -20.714 -37.834 1.00 0.59 C ATOM 893 CG ASP A 875 -10.792 -20.809 -39.326 1.00 0.92 C ATOM 894 OD1 ASP A 875 -11.758 -21.042 -40.085 1.00 1.19 O ATOM 895 OD2 ASP A 875 -9.637 -20.627 -39.756 1.00 1.34 O ATOM 0 H ASP A 875 -12.006 -20.664 -35.463 1.00 0.40 H new ATOM 0 HA ASP A 875 -13.073 -20.054 -38.123 1.00 0.44 H new ATOM 0 HB2 ASP A 875 -10.624 -19.787 -37.454 1.00 0.59 H new ATOM 0 HB3 ASP A 875 -10.543 -21.533 -37.328 1.00 0.59 H new ATOM 900 N VAL A 876 -14.074 -22.230 -38.620 1.00 0.57 N ATOM 901 CA VAL A 876 -14.727 -23.481 -38.952 1.00 0.68 C ATOM 902 C VAL A 876 -14.090 -24.107 -40.186 1.00 0.80 C ATOM 903 O VAL A 876 -14.291 -23.640 -41.309 1.00 1.07 O ATOM 904 CB VAL A 876 -16.234 -23.283 -39.209 1.00 0.77 C ATOM 905 CG1 VAL A 876 -16.953 -24.621 -39.240 1.00 1.29 C ATOM 906 CG2 VAL A 876 -16.841 -22.374 -38.154 1.00 1.03 C ATOM 0 H VAL A 876 -14.431 -21.425 -39.135 1.00 0.57 H new ATOM 0 HA VAL A 876 -14.602 -24.145 -38.097 1.00 0.68 H new ATOM 0 HB VAL A 876 -16.355 -22.808 -40.182 1.00 0.77 H new ATOM 0 HG11 VAL A 876 -18.015 -24.459 -39.423 1.00 1.29 H new ATOM 0 HG12 VAL A 876 -16.538 -25.239 -40.036 1.00 1.29 H new ATOM 0 HG13 VAL A 876 -16.822 -25.127 -38.283 1.00 1.29 H new ATOM 0 HG21 VAL A 876 -17.905 -22.246 -38.352 1.00 1.03 H new ATOM 0 HG22 VAL A 876 -16.707 -22.820 -37.169 1.00 1.03 H new ATOM 0 HG23 VAL A 876 -16.347 -21.403 -38.183 1.00 1.03 H new ATOM 916 N ASN A 877 -13.323 -25.165 -39.966 1.00 0.89 N ATOM 917 CA ASN A 877 -12.659 -25.877 -41.050 1.00 1.08 C ATOM 918 C ASN A 877 -13.473 -27.107 -41.428 1.00 1.15 C ATOM 919 O ASN A 877 -13.200 -27.774 -42.423 1.00 1.54 O ATOM 920 CB ASN A 877 -11.248 -26.291 -40.620 1.00 1.45 C ATOM 921 CG ASN A 877 -10.351 -26.666 -41.787 1.00 1.82 C ATOM 922 OD1 ASN A 877 -9.702 -25.811 -42.389 1.00 2.11 O ATOM 923 ND2 ASN A 877 -10.303 -27.949 -42.105 1.00 2.55 N ATOM 0 H ASN A 877 -13.144 -25.552 -39.039 1.00 0.89 H new ATOM 0 HA ASN A 877 -12.582 -25.220 -41.916 1.00 1.08 H new ATOM 0 HB2 ASN A 877 -10.789 -25.472 -40.066 1.00 1.45 H new ATOM 0 HB3 ASN A 877 -11.317 -27.138 -39.937 1.00 1.45 H new ATOM 0 HD21 ASN A 877 -9.712 -28.262 -42.875 1.00 2.55 H new ATOM 0 HD22 ASN A 877 -10.857 -28.626 -41.580 1.00 2.55 H new ATOM 930 N MET A 878 -14.482 -27.391 -40.622 1.00 1.24 N ATOM 931 CA MET A 878 -15.296 -28.578 -40.805 1.00 1.58 C ATOM 932 C MET A 878 -16.778 -28.232 -40.742 1.00 1.84 C ATOM 933 O MET A 878 -17.330 -28.032 -39.659 1.00 2.29 O ATOM 934 CB MET A 878 -14.955 -29.616 -39.733 1.00 2.01 C ATOM 935 CG MET A 878 -15.585 -30.981 -39.977 1.00 2.50 C ATOM 936 SD MET A 878 -15.239 -31.626 -41.625 1.00 3.10 S ATOM 937 CE MET A 878 -16.846 -32.276 -42.079 1.00 3.66 C ATOM 0 H MET A 878 -14.757 -26.811 -39.830 1.00 1.24 H new ATOM 0 HA MET A 878 -15.081 -28.994 -41.789 1.00 1.58 H new ATOM 0 HB2 MET A 878 -13.872 -29.730 -39.682 1.00 2.01 H new ATOM 0 HB3 MET A 878 -15.282 -29.243 -38.762 1.00 2.01 H new ATOM 0 HG2 MET A 878 -15.216 -31.685 -39.231 1.00 2.50 H new ATOM 0 HG3 MET A 878 -16.664 -30.908 -39.840 1.00 2.50 H new ATOM 0 HE1 MET A 878 -16.794 -32.710 -43.077 1.00 3.66 H new ATOM 0 HE2 MET A 878 -17.143 -33.043 -41.364 1.00 3.66 H new ATOM 0 HE3 MET A 878 -17.580 -31.470 -42.072 1.00 3.66 H new ATOM 947 N PRO A 879 -17.436 -28.130 -41.906 1.00 2.17 N ATOM 948 CA PRO A 879 -18.876 -27.881 -41.982 1.00 2.74 C ATOM 949 C PRO A 879 -19.679 -29.085 -41.495 1.00 2.61 C ATOM 950 O PRO A 879 -19.995 -29.989 -42.271 1.00 3.10 O ATOM 951 CB PRO A 879 -19.133 -27.632 -43.478 1.00 3.48 C ATOM 952 CG PRO A 879 -17.783 -27.437 -44.086 1.00 3.44 C ATOM 953 CD PRO A 879 -16.832 -28.231 -43.240 1.00 2.61 C ATOM 0 HA PRO A 879 -19.181 -27.046 -41.351 1.00 2.74 H new ATOM 0 HB2 PRO A 879 -19.651 -28.476 -43.933 1.00 3.48 H new ATOM 0 HB3 PRO A 879 -19.762 -26.754 -43.628 1.00 3.48 H new ATOM 0 HG2 PRO A 879 -17.767 -27.782 -45.120 1.00 3.44 H new ATOM 0 HG3 PRO A 879 -17.508 -26.382 -44.097 1.00 3.44 H new ATOM 0 HD2 PRO A 879 -16.757 -29.266 -43.575 1.00 2.61 H new ATOM 0 HD3 PRO A 879 -15.825 -27.815 -43.262 1.00 2.61 H new ATOM 961 N ASN A 880 -20.008 -29.087 -40.206 1.00 2.56 N ATOM 962 CA ASN A 880 -20.743 -30.192 -39.578 1.00 2.85 C ATOM 963 C ASN A 880 -22.242 -30.121 -39.881 1.00 2.55 C ATOM 964 O ASN A 880 -23.069 -30.496 -39.045 1.00 3.00 O ATOM 965 CB ASN A 880 -20.518 -30.178 -38.059 1.00 3.69 C ATOM 966 CG ASN A 880 -20.735 -28.805 -37.443 1.00 4.31 C ATOM 967 OD1 ASN A 880 -21.819 -28.226 -37.540 1.00 4.65 O ATOM 968 ND2 ASN A 880 -19.701 -28.272 -36.811 1.00 4.87 N ATOM 0 H ASN A 880 -19.776 -28.328 -39.566 1.00 2.56 H new ATOM 0 HA ASN A 880 -20.361 -31.123 -39.997 1.00 2.85 H new ATOM 0 HB2 ASN A 880 -21.194 -30.893 -37.590 1.00 3.69 H new ATOM 0 HB3 ASN A 880 -19.503 -30.511 -37.844 1.00 3.69 H new ATOM 0 HD21 ASN A 880 -19.785 -27.350 -36.383 1.00 4.87 H new ATOM 0 HD22 ASN A 880 -18.820 -28.783 -36.752 1.00 4.87 H new ATOM 975 N MET A 881 -22.555 -29.656 -41.090 1.00 2.49 N ATOM 976 CA MET A 881 -23.923 -29.463 -41.583 1.00 2.73 C ATOM 977 C MET A 881 -23.871 -28.483 -42.743 1.00 2.54 C ATOM 978 O MET A 881 -24.143 -28.830 -43.893 1.00 3.03 O ATOM 979 CB MET A 881 -24.862 -28.913 -40.499 1.00 3.60 C ATOM 980 CG MET A 881 -26.276 -29.468 -40.577 1.00 4.30 C ATOM 981 SD MET A 881 -27.266 -28.666 -41.850 1.00 4.97 S ATOM 982 CE MET A 881 -28.238 -30.050 -42.437 1.00 5.58 C ATOM 0 H MET A 881 -21.845 -29.395 -41.775 1.00 2.49 H new ATOM 0 HA MET A 881 -24.318 -30.431 -41.892 1.00 2.73 H new ATOM 0 HB2 MET A 881 -24.445 -29.142 -39.519 1.00 3.60 H new ATOM 0 HB3 MET A 881 -24.902 -27.827 -40.582 1.00 3.60 H new ATOM 0 HG2 MET A 881 -26.232 -30.539 -40.777 1.00 4.30 H new ATOM 0 HG3 MET A 881 -26.765 -29.345 -39.610 1.00 4.30 H new ATOM 0 HE1 MET A 881 -28.905 -29.715 -43.232 1.00 5.58 H new ATOM 0 HE2 MET A 881 -27.574 -30.824 -42.822 1.00 5.58 H new ATOM 0 HE3 MET A 881 -28.828 -30.455 -41.615 1.00 5.58 H new ATOM 992 N ASP A 882 -23.481 -27.268 -42.406 1.00 2.52 N ATOM 993 CA ASP A 882 -23.273 -26.195 -43.362 1.00 2.88 C ATOM 994 C ASP A 882 -22.574 -25.059 -42.636 1.00 2.58 C ATOM 995 O ASP A 882 -22.388 -25.142 -41.416 1.00 2.86 O ATOM 996 CB ASP A 882 -24.599 -25.716 -43.961 1.00 3.72 C ATOM 997 CG ASP A 882 -24.583 -25.719 -45.477 1.00 4.36 C ATOM 998 OD1 ASP A 882 -23.483 -25.795 -46.062 1.00 4.99 O ATOM 999 OD2 ASP A 882 -25.670 -25.651 -46.092 1.00 4.57 O ATOM 0 H ASP A 882 -23.296 -26.993 -41.441 1.00 2.52 H new ATOM 0 HA ASP A 882 -22.663 -26.553 -44.191 1.00 2.88 H new ATOM 0 HB2 ASP A 882 -25.407 -26.357 -43.608 1.00 3.72 H new ATOM 0 HB3 ASP A 882 -24.813 -24.708 -43.605 1.00 3.72 H new ATOM 1004 N GLY A 883 -22.203 -24.008 -43.348 1.00 2.53 N ATOM 1005 CA GLY A 883 -21.467 -22.917 -42.732 1.00 2.45 C ATOM 1006 C GLY A 883 -22.361 -21.988 -41.932 1.00 2.28 C ATOM 1007 O GLY A 883 -22.384 -20.782 -42.172 1.00 3.04 O ATOM 0 H GLY A 883 -22.397 -23.887 -44.342 1.00 2.53 H new ATOM 0 HA2 GLY A 883 -20.697 -23.327 -42.078 1.00 2.45 H new ATOM 0 HA3 GLY A 883 -20.956 -22.345 -43.507 1.00 2.45 H new ATOM 1011 N TYR A 884 -23.090 -22.555 -40.977 1.00 1.69 N ATOM 1012 CA TYR A 884 -24.032 -21.786 -40.176 1.00 1.56 C ATOM 1013 C TYR A 884 -24.424 -22.500 -38.885 1.00 1.24 C ATOM 1014 O TYR A 884 -24.474 -21.905 -37.809 1.00 1.24 O ATOM 1015 CB TYR A 884 -25.302 -21.505 -40.995 1.00 1.85 C ATOM 1016 CG TYR A 884 -26.361 -22.595 -40.947 1.00 1.85 C ATOM 1017 CD1 TYR A 884 -26.212 -23.763 -41.683 1.00 1.99 C ATOM 1018 CD2 TYR A 884 -27.510 -22.452 -40.173 1.00 2.07 C ATOM 1019 CE1 TYR A 884 -27.175 -24.751 -41.657 1.00 2.24 C ATOM 1020 CE2 TYR A 884 -28.478 -23.437 -40.145 1.00 2.36 C ATOM 1021 CZ TYR A 884 -28.293 -24.593 -40.830 1.00 2.40 C ATOM 1022 OH TYR A 884 -29.268 -25.565 -40.869 1.00 2.84 O ATOM 0 H TYR A 884 -23.046 -23.546 -40.739 1.00 1.69 H new ATOM 0 HA TYR A 884 -23.533 -20.856 -39.905 1.00 1.56 H new ATOM 0 HB2 TYR A 884 -25.745 -20.575 -40.639 1.00 1.85 H new ATOM 0 HB3 TYR A 884 -25.016 -21.345 -42.035 1.00 1.85 H new ATOM 0 HD1 TYR A 884 -25.327 -23.901 -42.286 1.00 1.99 H new ATOM 0 HD2 TYR A 884 -27.646 -21.556 -39.585 1.00 2.07 H new ATOM 0 HE1 TYR A 884 -27.067 -25.635 -42.267 1.00 2.24 H new ATOM 0 HE2 TYR A 884 -29.384 -23.286 -39.577 1.00 2.36 H new ATOM 0 HH TYR A 884 -29.987 -25.332 -40.245 1.00 2.84 H new ATOM 1032 N ARG A 885 -24.665 -23.788 -38.991 1.00 1.14 N ATOM 1033 CA ARG A 885 -25.496 -24.474 -38.023 1.00 1.03 C ATOM 1034 C ARG A 885 -25.010 -24.305 -36.582 1.00 0.90 C ATOM 1035 O ARG A 885 -25.807 -24.306 -35.645 1.00 0.84 O ATOM 1036 CB ARG A 885 -25.619 -25.955 -38.373 1.00 1.24 C ATOM 1037 CG ARG A 885 -26.461 -26.733 -37.380 1.00 1.61 C ATOM 1038 CD ARG A 885 -25.612 -27.232 -36.218 1.00 1.94 C ATOM 1039 NE ARG A 885 -24.833 -28.424 -36.563 1.00 2.47 N ATOM 1040 CZ ARG A 885 -24.501 -29.381 -35.696 1.00 2.81 C ATOM 1041 NH1 ARG A 885 -24.928 -29.330 -34.443 1.00 3.10 N ATOM 1042 NH2 ARG A 885 -23.765 -30.412 -36.094 1.00 3.36 N ATOM 0 H ARG A 885 -24.299 -24.382 -39.735 1.00 1.14 H new ATOM 0 HA ARG A 885 -26.479 -24.006 -38.077 1.00 1.03 H new ATOM 0 HB2 ARG A 885 -26.057 -26.052 -39.366 1.00 1.24 H new ATOM 0 HB3 ARG A 885 -24.623 -26.395 -38.419 1.00 1.24 H new ATOM 0 HG2 ARG A 885 -27.264 -26.099 -37.003 1.00 1.61 H new ATOM 0 HG3 ARG A 885 -26.932 -27.579 -37.881 1.00 1.61 H new ATOM 0 HD2 ARG A 885 -24.935 -26.439 -35.900 1.00 1.94 H new ATOM 0 HD3 ARG A 885 -26.259 -27.458 -35.370 1.00 1.94 H new ATOM 0 HE ARG A 885 -24.525 -28.529 -37.530 1.00 2.47 H new ATOM 0 HH11 ARG A 885 -25.515 -28.555 -34.135 1.00 3.10 H new ATOM 0 HH12 ARG A 885 -24.670 -30.066 -33.786 1.00 3.10 H new ATOM 0 HH21 ARG A 885 -23.453 -30.472 -37.063 1.00 3.36 H new ATOM 0 HH22 ARG A 885 -23.511 -31.144 -35.430 1.00 3.36 H new ATOM 1056 N LEU A 886 -23.716 -24.140 -36.407 1.00 0.97 N ATOM 1057 CA LEU A 886 -23.126 -24.208 -35.069 1.00 0.97 C ATOM 1058 C LEU A 886 -23.562 -22.984 -34.293 1.00 0.82 C ATOM 1059 O LEU A 886 -23.819 -23.012 -33.081 1.00 0.79 O ATOM 1060 CB LEU A 886 -21.599 -24.273 -35.153 1.00 1.21 C ATOM 1061 CG LEU A 886 -20.990 -23.645 -36.408 1.00 1.54 C ATOM 1062 CD1 LEU A 886 -20.022 -22.534 -36.034 1.00 1.90 C ATOM 1063 CD2 LEU A 886 -20.293 -24.704 -37.250 1.00 2.34 C ATOM 0 H LEU A 886 -23.051 -23.959 -37.159 1.00 0.97 H new ATOM 0 HA LEU A 886 -23.466 -25.111 -34.562 1.00 0.97 H new ATOM 0 HB2 LEU A 886 -21.181 -23.776 -34.278 1.00 1.21 H new ATOM 0 HB3 LEU A 886 -21.292 -25.318 -35.103 1.00 1.21 H new ATOM 0 HG LEU A 886 -21.795 -23.211 -37.001 1.00 1.54 H new ATOM 0 HD11 LEU A 886 -19.599 -22.100 -36.940 1.00 1.90 H new ATOM 0 HD12 LEU A 886 -20.552 -21.763 -35.475 1.00 1.90 H new ATOM 0 HD13 LEU A 886 -19.220 -22.942 -35.419 1.00 1.90 H new ATOM 0 HD21 LEU A 886 -19.866 -24.239 -38.139 1.00 2.34 H new ATOM 0 HD22 LEU A 886 -19.499 -25.168 -36.666 1.00 2.34 H new ATOM 0 HD23 LEU A 886 -21.015 -25.464 -37.549 1.00 2.34 H new ATOM 1075 N THR A 887 -23.702 -21.924 -35.040 1.00 0.80 N ATOM 1076 CA THR A 887 -24.149 -20.669 -34.519 1.00 0.77 C ATOM 1077 C THR A 887 -25.650 -20.713 -34.273 1.00 0.66 C ATOM 1078 O THR A 887 -26.171 -19.998 -33.421 1.00 0.65 O ATOM 1079 CB THR A 887 -23.802 -19.550 -35.497 1.00 0.94 C ATOM 1080 OG1 THR A 887 -22.709 -19.958 -36.336 1.00 1.28 O ATOM 1081 CG2 THR A 887 -23.440 -18.297 -34.749 1.00 1.09 C ATOM 0 H THR A 887 -23.505 -21.911 -36.041 1.00 0.80 H new ATOM 0 HA THR A 887 -23.647 -20.475 -33.571 1.00 0.77 H new ATOM 0 HB THR A 887 -24.672 -19.343 -36.120 1.00 0.94 H new ATOM 0 HG1 THR A 887 -22.160 -19.178 -36.561 1.00 1.28 H new ATOM 0 HG21 THR A 887 -23.195 -17.507 -35.459 1.00 1.09 H new ATOM 0 HG22 THR A 887 -24.284 -17.983 -34.135 1.00 1.09 H new ATOM 0 HG23 THR A 887 -22.578 -18.491 -34.110 1.00 1.09 H new ATOM 1089 N GLN A 888 -26.341 -21.561 -35.028 1.00 0.66 N ATOM 1090 CA GLN A 888 -27.774 -21.764 -34.819 1.00 0.66 C ATOM 1091 C GLN A 888 -28.008 -22.348 -33.433 1.00 0.63 C ATOM 1092 O GLN A 888 -28.986 -22.020 -32.759 1.00 0.65 O ATOM 1093 CB GLN A 888 -28.360 -22.681 -35.894 1.00 0.77 C ATOM 1094 CG GLN A 888 -29.878 -22.701 -35.909 1.00 1.06 C ATOM 1095 CD GLN A 888 -30.441 -23.671 -36.928 1.00 1.38 C ATOM 1096 OE1 GLN A 888 -31.051 -23.269 -37.917 1.00 2.17 O ATOM 1097 NE2 GLN A 888 -30.251 -24.957 -36.688 1.00 1.84 N ATOM 0 H GLN A 888 -25.938 -22.115 -35.784 1.00 0.66 H new ATOM 0 HA GLN A 888 -28.279 -20.801 -34.893 1.00 0.66 H new ATOM 0 HB2 GLN A 888 -27.999 -22.360 -36.871 1.00 0.77 H new ATOM 0 HB3 GLN A 888 -27.992 -23.695 -35.736 1.00 0.77 H new ATOM 0 HG2 GLN A 888 -30.243 -22.969 -34.918 1.00 1.06 H new ATOM 0 HG3 GLN A 888 -30.248 -21.699 -36.125 1.00 1.06 H new ATOM 0 HE21 GLN A 888 -29.739 -25.250 -35.856 1.00 1.84 H new ATOM 0 HE22 GLN A 888 -30.616 -25.656 -37.335 1.00 1.84 H new ATOM 1106 N ARG A 889 -27.085 -23.199 -33.005 1.00 0.64 N ATOM 1107 CA ARG A 889 -27.104 -23.727 -31.650 1.00 0.66 C ATOM 1108 C ARG A 889 -26.956 -22.584 -30.650 1.00 0.63 C ATOM 1109 O ARG A 889 -27.644 -22.549 -29.627 1.00 0.67 O ATOM 1110 CB ARG A 889 -25.987 -24.756 -31.456 1.00 0.71 C ATOM 1111 CG ARG A 889 -26.370 -25.907 -30.541 1.00 0.94 C ATOM 1112 CD ARG A 889 -26.365 -25.479 -29.082 1.00 1.02 C ATOM 1113 NE ARG A 889 -26.576 -26.599 -28.169 1.00 1.36 N ATOM 1114 CZ ARG A 889 -27.773 -27.103 -27.866 1.00 1.67 C ATOM 1115 NH1 ARG A 889 -28.874 -26.590 -28.401 1.00 2.05 N ATOM 1116 NH2 ARG A 889 -27.867 -28.120 -27.021 1.00 2.36 N ATOM 0 H ARG A 889 -26.313 -23.538 -33.579 1.00 0.64 H new ATOM 0 HA ARG A 889 -28.058 -24.227 -31.480 1.00 0.66 H new ATOM 0 HB2 ARG A 889 -25.701 -25.156 -32.429 1.00 0.71 H new ATOM 0 HB3 ARG A 889 -25.110 -24.254 -31.047 1.00 0.71 H new ATOM 0 HG2 ARG A 889 -27.360 -26.275 -30.811 1.00 0.94 H new ATOM 0 HG3 ARG A 889 -25.674 -26.734 -30.682 1.00 0.94 H new ATOM 0 HD2 ARG A 889 -25.413 -25.000 -28.851 1.00 1.02 H new ATOM 0 HD3 ARG A 889 -27.144 -24.733 -28.923 1.00 1.02 H new ATOM 0 HE ARG A 889 -25.756 -27.023 -27.735 1.00 1.36 H new ATOM 0 HH11 ARG A 889 -28.808 -25.805 -29.049 1.00 2.05 H new ATOM 0 HH12 ARG A 889 -29.786 -26.981 -28.164 1.00 2.05 H new ATOM 0 HH21 ARG A 889 -27.025 -28.516 -26.604 1.00 2.36 H new ATOM 0 HH22 ARG A 889 -28.782 -28.507 -26.788 1.00 2.36 H new ATOM 1130 N ILE A 890 -26.052 -21.650 -30.952 1.00 0.61 N ATOM 1131 CA ILE A 890 -25.908 -20.433 -30.146 1.00 0.63 C ATOM 1132 C ILE A 890 -27.241 -19.690 -30.048 1.00 0.62 C ATOM 1133 O ILE A 890 -27.669 -19.294 -28.960 1.00 0.67 O ATOM 1134 CB ILE A 890 -24.844 -19.475 -30.735 1.00 0.69 C ATOM 1135 CG1 ILE A 890 -23.452 -20.092 -30.628 1.00 1.22 C ATOM 1136 CG2 ILE A 890 -24.878 -18.126 -30.024 1.00 0.71 C ATOM 1137 CD1 ILE A 890 -22.396 -19.351 -31.418 1.00 1.71 C ATOM 0 H ILE A 890 -25.412 -21.711 -31.744 1.00 0.61 H new ATOM 0 HA ILE A 890 -25.584 -20.748 -29.154 1.00 0.63 H new ATOM 0 HB ILE A 890 -25.076 -19.316 -31.788 1.00 0.69 H new ATOM 0 HG12 ILE A 890 -23.156 -20.119 -29.579 1.00 1.22 H new ATOM 0 HG13 ILE A 890 -23.494 -21.125 -30.974 1.00 1.22 H new ATOM 0 HG21 ILE A 890 -24.122 -17.469 -30.454 1.00 0.71 H new ATOM 0 HG22 ILE A 890 -25.863 -17.675 -30.146 1.00 0.71 H new ATOM 0 HG23 ILE A 890 -24.673 -18.269 -28.963 1.00 0.71 H new ATOM 0 HD11 ILE A 890 -21.434 -19.847 -31.294 1.00 1.71 H new ATOM 0 HD12 ILE A 890 -22.668 -19.346 -32.473 1.00 1.71 H new ATOM 0 HD13 ILE A 890 -22.324 -18.325 -31.057 1.00 1.71 H new ATOM 1149 N ARG A 891 -27.893 -19.524 -31.194 1.00 0.61 N ATOM 1150 CA ARG A 891 -29.165 -18.815 -31.285 1.00 0.67 C ATOM 1151 C ARG A 891 -30.232 -19.477 -30.421 1.00 0.72 C ATOM 1152 O ARG A 891 -30.984 -18.797 -29.723 1.00 0.80 O ATOM 1153 CB ARG A 891 -29.614 -18.773 -32.747 1.00 0.73 C ATOM 1154 CG ARG A 891 -31.086 -18.455 -32.957 1.00 0.95 C ATOM 1155 CD ARG A 891 -31.775 -19.547 -33.762 1.00 1.10 C ATOM 1156 NE ARG A 891 -31.815 -19.249 -35.197 1.00 1.37 N ATOM 1157 CZ ARG A 891 -32.942 -19.138 -35.911 1.00 1.59 C ATOM 1158 NH1 ARG A 891 -34.128 -19.238 -35.320 1.00 1.97 N ATOM 1159 NH2 ARG A 891 -32.877 -18.917 -37.218 1.00 2.24 N ATOM 0 H ARG A 891 -27.554 -19.878 -32.088 1.00 0.61 H new ATOM 0 HA ARG A 891 -29.027 -17.800 -30.914 1.00 0.67 H new ATOM 0 HB2 ARG A 891 -29.018 -18.028 -33.273 1.00 0.73 H new ATOM 0 HB3 ARG A 891 -29.397 -19.737 -33.206 1.00 0.73 H new ATOM 0 HG2 ARG A 891 -31.579 -18.346 -31.991 1.00 0.95 H new ATOM 0 HG3 ARG A 891 -31.184 -17.501 -33.475 1.00 0.95 H new ATOM 0 HD2 ARG A 891 -31.255 -20.492 -33.605 1.00 1.10 H new ATOM 0 HD3 ARG A 891 -32.792 -19.678 -33.393 1.00 1.10 H new ATOM 0 HE ARG A 891 -30.927 -19.118 -35.682 1.00 1.37 H new ATOM 0 HH11 ARG A 891 -34.185 -19.401 -34.315 1.00 1.97 H new ATOM 0 HH12 ARG A 891 -34.982 -19.152 -35.872 1.00 1.97 H new ATOM 0 HH21 ARG A 891 -31.970 -18.832 -37.676 1.00 2.24 H new ATOM 0 HH22 ARG A 891 -33.734 -18.832 -37.764 1.00 2.24 H new ATOM 1173 N GLN A 892 -30.289 -20.802 -30.467 1.00 0.74 N ATOM 1174 CA GLN A 892 -31.281 -21.546 -29.705 1.00 0.84 C ATOM 1175 C GLN A 892 -31.031 -21.415 -28.207 1.00 0.87 C ATOM 1176 O GLN A 892 -31.969 -21.413 -27.411 1.00 0.99 O ATOM 1177 CB GLN A 892 -31.282 -23.017 -30.119 1.00 0.91 C ATOM 1178 CG GLN A 892 -31.936 -23.272 -31.470 1.00 1.23 C ATOM 1179 CD GLN A 892 -33.286 -22.588 -31.615 1.00 1.87 C ATOM 1180 OE1 GLN A 892 -33.372 -21.369 -31.766 1.00 2.62 O ATOM 1181 NE2 GLN A 892 -34.349 -23.369 -31.569 1.00 2.39 N ATOM 0 H GLN A 892 -29.661 -21.382 -31.023 1.00 0.74 H new ATOM 0 HA GLN A 892 -32.261 -21.122 -29.923 1.00 0.84 H new ATOM 0 HB2 GLN A 892 -30.254 -23.378 -30.149 1.00 0.91 H new ATOM 0 HB3 GLN A 892 -31.802 -23.599 -29.358 1.00 0.91 H new ATOM 0 HG2 GLN A 892 -31.272 -22.924 -32.261 1.00 1.23 H new ATOM 0 HG3 GLN A 892 -32.062 -24.346 -31.610 1.00 1.23 H new ATOM 0 HE21 GLN A 892 -34.238 -24.375 -31.443 1.00 2.39 H new ATOM 0 HE22 GLN A 892 -35.282 -22.967 -31.660 1.00 2.39 H new ATOM 1190 N LEU A 893 -29.764 -21.297 -27.830 1.00 0.81 N ATOM 1191 CA LEU A 893 -29.405 -21.095 -26.432 1.00 0.87 C ATOM 1192 C LEU A 893 -29.742 -19.668 -26.003 1.00 0.88 C ATOM 1193 O LEU A 893 -30.179 -19.432 -24.876 1.00 1.05 O ATOM 1194 CB LEU A 893 -27.916 -21.377 -26.211 1.00 0.90 C ATOM 1195 CG LEU A 893 -27.600 -22.541 -25.268 1.00 1.12 C ATOM 1196 CD1 LEU A 893 -28.405 -22.428 -23.980 1.00 1.48 C ATOM 1197 CD2 LEU A 893 -27.867 -23.872 -25.955 1.00 1.91 C ATOM 0 H LEU A 893 -28.971 -21.337 -28.470 1.00 0.81 H new ATOM 0 HA LEU A 893 -29.981 -21.792 -25.823 1.00 0.87 H new ATOM 0 HB2 LEU A 893 -27.455 -21.579 -27.178 1.00 0.90 H new ATOM 0 HB3 LEU A 893 -27.448 -20.475 -25.817 1.00 0.90 H new ATOM 0 HG LEU A 893 -26.542 -22.494 -25.010 1.00 1.12 H new ATOM 0 HD11 LEU A 893 -28.164 -23.266 -23.326 1.00 1.48 H new ATOM 0 HD12 LEU A 893 -28.158 -21.493 -23.478 1.00 1.48 H new ATOM 0 HD13 LEU A 893 -29.470 -22.445 -24.214 1.00 1.48 H new ATOM 0 HD21 LEU A 893 -27.637 -24.688 -25.270 1.00 1.91 H new ATOM 0 HD22 LEU A 893 -28.916 -23.927 -26.246 1.00 1.91 H new ATOM 0 HD23 LEU A 893 -27.240 -23.956 -26.842 1.00 1.91 H new ATOM 1209 N GLY A 894 -29.541 -18.724 -26.913 1.00 0.82 N ATOM 1210 CA GLY A 894 -29.886 -17.343 -26.643 1.00 0.87 C ATOM 1211 C GLY A 894 -28.727 -16.553 -26.070 1.00 0.82 C ATOM 1212 O GLY A 894 -28.932 -15.581 -25.341 1.00 1.12 O ATOM 0 H GLY A 894 -29.143 -18.892 -27.837 1.00 0.82 H new ATOM 0 HA2 GLY A 894 -30.222 -16.870 -27.565 1.00 0.87 H new ATOM 0 HA3 GLY A 894 -30.723 -17.311 -25.945 1.00 0.87 H new ATOM 1216 N LEU A 895 -27.509 -16.963 -26.402 1.00 0.75 N ATOM 1217 CA LEU A 895 -26.318 -16.284 -25.909 1.00 0.81 C ATOM 1218 C LEU A 895 -25.995 -15.076 -26.778 1.00 0.85 C ATOM 1219 O LEU A 895 -25.683 -15.218 -27.961 1.00 1.21 O ATOM 1220 CB LEU A 895 -25.121 -17.243 -25.866 1.00 1.19 C ATOM 1221 CG LEU A 895 -25.474 -18.717 -25.660 1.00 2.21 C ATOM 1222 CD1 LEU A 895 -24.600 -19.604 -26.535 1.00 2.89 C ATOM 1223 CD2 LEU A 895 -25.326 -19.098 -24.195 1.00 2.82 C ATOM 0 H LEU A 895 -27.321 -17.761 -27.009 1.00 0.75 H new ATOM 0 HA LEU A 895 -26.519 -15.941 -24.894 1.00 0.81 H new ATOM 0 HB2 LEU A 895 -24.565 -17.146 -26.798 1.00 1.19 H new ATOM 0 HB3 LEU A 895 -24.454 -16.930 -25.063 1.00 1.19 H new ATOM 0 HG LEU A 895 -26.513 -18.867 -25.952 1.00 2.21 H new ATOM 0 HD11 LEU A 895 -24.866 -20.649 -26.374 1.00 2.89 H new ATOM 0 HD12 LEU A 895 -24.755 -19.347 -27.583 1.00 2.89 H new ATOM 0 HD13 LEU A 895 -23.552 -19.452 -26.275 1.00 2.89 H new ATOM 0 HD21 LEU A 895 -25.581 -20.150 -24.065 1.00 2.82 H new ATOM 0 HD22 LEU A 895 -24.296 -18.932 -23.878 1.00 2.82 H new ATOM 0 HD23 LEU A 895 -25.995 -18.485 -23.590 1.00 2.82 H new ATOM 1235 N THR A 896 -26.073 -13.892 -26.188 1.00 0.91 N ATOM 1236 CA THR A 896 -25.800 -12.650 -26.901 1.00 1.21 C ATOM 1237 C THR A 896 -24.286 -12.391 -26.973 1.00 1.12 C ATOM 1238 O THR A 896 -23.789 -11.313 -26.648 1.00 1.48 O ATOM 1239 CB THR A 896 -26.550 -11.463 -26.238 1.00 1.68 C ATOM 1240 OG1 THR A 896 -26.413 -10.272 -27.026 1.00 2.49 O ATOM 1241 CG2 THR A 896 -26.061 -11.209 -24.814 1.00 1.70 C ATOM 0 H THR A 896 -26.325 -13.764 -25.208 1.00 0.91 H new ATOM 0 HA THR A 896 -26.169 -12.745 -27.922 1.00 1.21 H new ATOM 0 HB THR A 896 -27.604 -11.735 -26.187 1.00 1.68 H new ATOM 0 HG1 THR A 896 -25.462 -10.077 -27.162 1.00 2.49 H new ATOM 0 HG21 THR A 896 -26.610 -10.371 -24.385 1.00 1.70 H new ATOM 0 HG22 THR A 896 -26.227 -12.100 -24.208 1.00 1.70 H new ATOM 0 HG23 THR A 896 -24.997 -10.975 -24.831 1.00 1.70 H new ATOM 1249 N LEU A 897 -23.561 -13.398 -27.429 1.00 0.81 N ATOM 1250 CA LEU A 897 -22.111 -13.342 -27.480 1.00 0.78 C ATOM 1251 C LEU A 897 -21.643 -12.938 -28.873 1.00 0.56 C ATOM 1252 O LEU A 897 -22.104 -13.489 -29.871 1.00 0.57 O ATOM 1253 CB LEU A 897 -21.532 -14.707 -27.091 1.00 0.98 C ATOM 1254 CG LEU A 897 -20.069 -14.942 -27.478 1.00 0.92 C ATOM 1255 CD1 LEU A 897 -19.149 -14.507 -26.349 1.00 1.20 C ATOM 1256 CD2 LEU A 897 -19.840 -16.409 -27.821 1.00 1.40 C ATOM 0 H LEU A 897 -23.958 -14.272 -27.772 1.00 0.81 H new ATOM 0 HA LEU A 897 -21.756 -12.592 -26.773 1.00 0.78 H new ATOM 0 HB2 LEU A 897 -21.627 -14.827 -26.012 1.00 0.98 H new ATOM 0 HB3 LEU A 897 -22.140 -15.484 -27.553 1.00 0.98 H new ATOM 0 HG LEU A 897 -19.840 -14.343 -28.360 1.00 0.92 H new ATOM 0 HD11 LEU A 897 -18.112 -14.680 -26.638 1.00 1.20 H new ATOM 0 HD12 LEU A 897 -19.298 -13.446 -26.147 1.00 1.20 H new ATOM 0 HD13 LEU A 897 -19.377 -15.083 -25.452 1.00 1.20 H new ATOM 0 HD21 LEU A 897 -18.796 -16.560 -28.094 1.00 1.40 H new ATOM 0 HD22 LEU A 897 -20.082 -17.027 -26.956 1.00 1.40 H new ATOM 0 HD23 LEU A 897 -20.478 -16.691 -28.658 1.00 1.40 H new ATOM 1268 N PRO A 898 -20.741 -11.945 -28.958 1.00 0.49 N ATOM 1269 CA PRO A 898 -20.177 -11.494 -30.232 1.00 0.42 C ATOM 1270 C PRO A 898 -19.210 -12.518 -30.828 1.00 0.38 C ATOM 1271 O PRO A 898 -18.083 -12.698 -30.338 1.00 0.42 O ATOM 1272 CB PRO A 898 -19.439 -10.203 -29.860 1.00 0.50 C ATOM 1273 CG PRO A 898 -19.110 -10.349 -28.414 1.00 0.73 C ATOM 1274 CD PRO A 898 -20.212 -11.179 -27.813 1.00 0.63 C ATOM 0 HA PRO A 898 -20.944 -11.352 -30.993 1.00 0.42 H new ATOM 0 HB2 PRO A 898 -18.537 -10.077 -30.459 1.00 0.50 H new ATOM 0 HB3 PRO A 898 -20.063 -9.327 -30.036 1.00 0.50 H new ATOM 0 HG2 PRO A 898 -18.142 -10.833 -28.282 1.00 0.73 H new ATOM 0 HG3 PRO A 898 -19.048 -9.375 -27.929 1.00 0.73 H new ATOM 0 HD2 PRO A 898 -19.835 -11.838 -27.031 1.00 0.63 H new ATOM 0 HD3 PRO A 898 -20.982 -10.554 -27.360 1.00 0.63 H new ATOM 1282 N VAL A 899 -19.648 -13.193 -31.882 1.00 0.36 N ATOM 1283 CA VAL A 899 -18.828 -14.219 -32.498 1.00 0.39 C ATOM 1284 C VAL A 899 -18.259 -13.751 -33.832 1.00 0.39 C ATOM 1285 O VAL A 899 -18.992 -13.462 -34.779 1.00 0.47 O ATOM 1286 CB VAL A 899 -19.601 -15.539 -32.706 1.00 0.47 C ATOM 1287 CG1 VAL A 899 -18.641 -16.673 -33.033 1.00 0.64 C ATOM 1288 CG2 VAL A 899 -20.431 -15.886 -31.479 1.00 0.50 C ATOM 0 H VAL A 899 -20.557 -13.049 -32.322 1.00 0.36 H new ATOM 0 HA VAL A 899 -18.008 -14.408 -31.805 1.00 0.39 H new ATOM 0 HB VAL A 899 -20.280 -15.402 -33.547 1.00 0.47 H new ATOM 0 HG11 VAL A 899 -19.203 -17.596 -33.176 1.00 0.64 H new ATOM 0 HG12 VAL A 899 -18.095 -16.435 -33.946 1.00 0.64 H new ATOM 0 HG13 VAL A 899 -17.936 -16.801 -32.211 1.00 0.64 H new ATOM 0 HG21 VAL A 899 -20.965 -16.820 -31.653 1.00 0.50 H new ATOM 0 HG22 VAL A 899 -19.775 -15.998 -30.616 1.00 0.50 H new ATOM 0 HG23 VAL A 899 -21.149 -15.088 -31.288 1.00 0.50 H new ATOM 1298 N ILE A 900 -16.946 -13.663 -33.881 1.00 0.37 N ATOM 1299 CA ILE A 900 -16.234 -13.374 -35.107 1.00 0.38 C ATOM 1300 C ILE A 900 -15.935 -14.690 -35.816 1.00 0.40 C ATOM 1301 O ILE A 900 -14.988 -15.401 -35.466 1.00 0.48 O ATOM 1302 CB ILE A 900 -14.924 -12.603 -34.821 1.00 0.42 C ATOM 1303 CG1 ILE A 900 -15.222 -11.369 -33.957 1.00 0.53 C ATOM 1304 CG2 ILE A 900 -14.241 -12.199 -36.119 1.00 0.61 C ATOM 1305 CD1 ILE A 900 -13.986 -10.635 -33.484 1.00 0.64 C ATOM 0 H ILE A 900 -16.342 -13.790 -33.069 1.00 0.37 H new ATOM 0 HA ILE A 900 -16.852 -12.741 -35.743 1.00 0.38 H new ATOM 0 HB ILE A 900 -14.245 -13.258 -34.275 1.00 0.42 H new ATOM 0 HG12 ILE A 900 -15.845 -10.680 -34.528 1.00 0.53 H new ATOM 0 HG13 ILE A 900 -15.803 -11.678 -33.088 1.00 0.53 H new ATOM 0 HG21 ILE A 900 -13.322 -11.658 -35.893 1.00 0.61 H new ATOM 0 HG22 ILE A 900 -14.004 -13.091 -36.698 1.00 0.61 H new ATOM 0 HG23 ILE A 900 -14.907 -11.558 -36.696 1.00 0.61 H new ATOM 0 HD11 ILE A 900 -14.281 -9.777 -32.881 1.00 0.64 H new ATOM 0 HD12 ILE A 900 -13.371 -11.306 -32.884 1.00 0.64 H new ATOM 0 HD13 ILE A 900 -13.414 -10.293 -34.346 1.00 0.64 H new ATOM 1317 N GLY A 901 -16.767 -15.027 -36.788 1.00 0.39 N ATOM 1318 CA GLY A 901 -16.691 -16.332 -37.401 1.00 0.44 C ATOM 1319 C GLY A 901 -15.778 -16.378 -38.604 1.00 0.40 C ATOM 1320 O GLY A 901 -15.950 -15.621 -39.559 1.00 0.48 O ATOM 0 H GLY A 901 -17.494 -14.418 -37.163 1.00 0.39 H new ATOM 0 HA2 GLY A 901 -16.342 -17.053 -36.662 1.00 0.44 H new ATOM 0 HA3 GLY A 901 -17.692 -16.643 -37.702 1.00 0.44 H new ATOM 1324 N VAL A 902 -14.802 -17.264 -38.547 1.00 0.38 N ATOM 1325 CA VAL A 902 -13.930 -17.528 -39.679 1.00 0.39 C ATOM 1326 C VAL A 902 -14.382 -18.825 -40.337 1.00 0.40 C ATOM 1327 O VAL A 902 -14.882 -19.715 -39.656 1.00 0.59 O ATOM 1328 CB VAL A 902 -12.447 -17.641 -39.254 1.00 0.51 C ATOM 1329 CG1 VAL A 902 -11.557 -16.903 -40.234 1.00 0.89 C ATOM 1330 CG2 VAL A 902 -12.233 -17.110 -37.843 1.00 1.04 C ATOM 0 H VAL A 902 -14.590 -17.820 -37.718 1.00 0.38 H new ATOM 0 HA VAL A 902 -13.999 -16.694 -40.377 1.00 0.39 H new ATOM 0 HB VAL A 902 -12.178 -18.697 -39.260 1.00 0.51 H new ATOM 0 HG11 VAL A 902 -10.517 -16.993 -39.920 1.00 0.89 H new ATOM 0 HG12 VAL A 902 -11.674 -17.334 -41.228 1.00 0.89 H new ATOM 0 HG13 VAL A 902 -11.839 -15.850 -40.260 1.00 0.89 H new ATOM 0 HG21 VAL A 902 -11.181 -17.204 -37.575 1.00 1.04 H new ATOM 0 HG22 VAL A 902 -12.526 -16.061 -37.801 1.00 1.04 H new ATOM 0 HG23 VAL A 902 -12.839 -17.685 -37.142 1.00 1.04 H new ATOM 1340 N THR A 903 -14.253 -18.930 -41.649 1.00 0.44 N ATOM 1341 CA THR A 903 -14.742 -20.109 -42.344 1.00 0.53 C ATOM 1342 C THR A 903 -13.843 -20.488 -43.514 1.00 0.59 C ATOM 1343 O THR A 903 -13.295 -19.622 -44.198 1.00 0.72 O ATOM 1344 CB THR A 903 -16.178 -19.888 -42.856 1.00 0.67 C ATOM 1345 OG1 THR A 903 -16.423 -18.489 -43.045 1.00 0.89 O ATOM 1346 CG2 THR A 903 -17.196 -20.449 -41.876 1.00 0.83 C ATOM 0 H THR A 903 -13.821 -18.225 -42.247 1.00 0.44 H new ATOM 0 HA THR A 903 -14.736 -20.927 -41.623 1.00 0.53 H new ATOM 0 HB THR A 903 -16.281 -20.410 -43.807 1.00 0.67 H new ATOM 0 HG1 THR A 903 -17.338 -18.358 -43.372 1.00 0.89 H new ATOM 0 HG21 THR A 903 -18.202 -20.281 -42.260 1.00 0.83 H new ATOM 0 HG22 THR A 903 -17.030 -21.519 -41.751 1.00 0.83 H new ATOM 0 HG23 THR A 903 -17.087 -19.950 -40.913 1.00 0.83 H new ATOM 1354 N ALA A 904 -13.691 -21.786 -43.736 1.00 0.72 N ATOM 1355 CA ALA A 904 -12.901 -22.282 -44.850 1.00 0.84 C ATOM 1356 C ALA A 904 -13.798 -22.687 -46.018 1.00 0.92 C ATOM 1357 O ALA A 904 -14.464 -23.722 -45.963 1.00 1.19 O ATOM 1358 CB ALA A 904 -12.040 -23.459 -44.407 1.00 1.07 C ATOM 0 H ALA A 904 -14.106 -22.515 -43.156 1.00 0.72 H new ATOM 0 HA ALA A 904 -12.247 -21.478 -45.188 1.00 0.84 H new ATOM 0 HB1 ALA A 904 -11.454 -23.820 -45.252 1.00 1.07 H new ATOM 0 HB2 ALA A 904 -11.369 -23.139 -43.610 1.00 1.07 H new ATOM 0 HB3 ALA A 904 -12.681 -24.261 -44.041 1.00 1.07 H new ATOM 1364 N ASN A 905 -13.809 -21.854 -47.058 1.00 1.03 N ATOM 1365 CA ASN A 905 -14.567 -22.118 -48.290 1.00 1.27 C ATOM 1366 C ASN A 905 -16.025 -22.452 -48.006 1.00 1.48 C ATOM 1367 O ASN A 905 -16.557 -23.456 -48.488 1.00 2.14 O ATOM 1368 CB ASN A 905 -13.906 -23.238 -49.101 1.00 1.73 C ATOM 1369 CG ASN A 905 -12.929 -22.705 -50.135 1.00 2.13 C ATOM 1370 OD1 ASN A 905 -12.358 -21.624 -49.971 1.00 2.42 O ATOM 1371 ND2 ASN A 905 -12.721 -23.457 -51.205 1.00 2.70 N ATOM 0 H ASN A 905 -13.293 -20.974 -47.074 1.00 1.03 H new ATOM 0 HA ASN A 905 -14.554 -21.201 -48.879 1.00 1.27 H new ATOM 0 HB2 ASN A 905 -13.382 -23.913 -48.424 1.00 1.73 H new ATOM 0 HB3 ASN A 905 -14.677 -23.824 -49.602 1.00 1.73 H new ATOM 0 HD21 ASN A 905 -12.071 -23.148 -51.927 1.00 2.70 H new ATOM 0 HD22 ASN A 905 -13.211 -24.346 -51.307 1.00 2.70 H new ATOM 1378 N ALA A 906 -16.669 -21.599 -47.226 1.00 1.42 N ATOM 1379 CA ALA A 906 -18.087 -21.733 -46.960 1.00 1.94 C ATOM 1380 C ALA A 906 -18.871 -20.811 -47.884 1.00 2.10 C ATOM 1381 O ALA A 906 -18.981 -19.614 -47.634 1.00 2.81 O ATOM 1382 CB ALA A 906 -18.392 -21.423 -45.500 1.00 2.30 C ATOM 0 H ALA A 906 -16.227 -20.803 -46.765 1.00 1.42 H new ATOM 0 HA ALA A 906 -18.388 -22.763 -47.152 1.00 1.94 H new ATOM 0 HB1 ALA A 906 -19.462 -21.529 -45.321 1.00 2.30 H new ATOM 0 HB2 ALA A 906 -17.846 -22.116 -44.859 1.00 2.30 H new ATOM 0 HB3 ALA A 906 -18.086 -20.402 -45.273 1.00 2.30 H new ATOM 1388 N LEU A 907 -19.375 -21.361 -48.974 1.00 1.83 N ATOM 1389 CA LEU A 907 -20.153 -20.581 -49.928 1.00 2.05 C ATOM 1390 C LEU A 907 -21.549 -20.279 -49.388 1.00 1.86 C ATOM 1391 O LEU A 907 -22.139 -21.098 -48.680 1.00 2.51 O ATOM 1392 CB LEU A 907 -20.256 -21.315 -51.264 1.00 2.52 C ATOM 1393 CG LEU A 907 -20.258 -20.408 -52.495 1.00 3.20 C ATOM 1394 CD1 LEU A 907 -18.958 -20.563 -53.269 1.00 3.93 C ATOM 1395 CD2 LEU A 907 -21.455 -20.714 -53.381 1.00 3.55 C ATOM 0 H LEU A 907 -19.261 -22.344 -49.223 1.00 1.83 H new ATOM 0 HA LEU A 907 -19.635 -19.635 -50.083 1.00 2.05 H new ATOM 0 HB2 LEU A 907 -19.422 -22.012 -51.345 1.00 2.52 H new ATOM 0 HB3 LEU A 907 -21.170 -21.910 -51.267 1.00 2.52 H new ATOM 0 HG LEU A 907 -20.337 -19.373 -52.164 1.00 3.20 H new ATOM 0 HD11 LEU A 907 -18.975 -19.911 -54.142 1.00 3.93 H new ATOM 0 HD12 LEU A 907 -18.119 -20.291 -52.629 1.00 3.93 H new ATOM 0 HD13 LEU A 907 -18.848 -21.598 -53.591 1.00 3.93 H new ATOM 0 HD21 LEU A 907 -21.440 -20.059 -54.252 1.00 3.55 H new ATOM 0 HD22 LEU A 907 -21.410 -21.753 -53.708 1.00 3.55 H new ATOM 0 HD23 LEU A 907 -22.375 -20.550 -52.820 1.00 3.55 H new ATOM 1407 N ALA A 908 -22.057 -19.090 -49.725 1.00 1.67 N ATOM 1408 CA ALA A 908 -23.403 -18.654 -49.336 1.00 1.75 C ATOM 1409 C ALA A 908 -23.550 -18.552 -47.817 1.00 1.63 C ATOM 1410 O ALA A 908 -24.637 -18.753 -47.265 1.00 1.53 O ATOM 1411 CB ALA A 908 -24.464 -19.582 -49.920 1.00 2.09 C ATOM 0 H ALA A 908 -21.546 -18.401 -50.276 1.00 1.67 H new ATOM 0 HA ALA A 908 -23.553 -17.656 -49.747 1.00 1.75 H new ATOM 0 HB1 ALA A 908 -25.454 -19.239 -49.618 1.00 2.09 H new ATOM 0 HB2 ALA A 908 -24.394 -19.576 -51.008 1.00 2.09 H new ATOM 0 HB3 ALA A 908 -24.304 -20.595 -49.552 1.00 2.09 H new ATOM 1417 N GLU A 909 -22.460 -18.203 -47.147 1.00 1.71 N ATOM 1418 CA GLU A 909 -22.457 -18.109 -45.695 1.00 1.70 C ATOM 1419 C GLU A 909 -23.233 -16.889 -45.217 1.00 1.59 C ATOM 1420 O GLU A 909 -23.614 -16.817 -44.058 1.00 1.46 O ATOM 1421 CB GLU A 909 -21.031 -18.065 -45.149 1.00 1.97 C ATOM 1422 CG GLU A 909 -20.036 -17.364 -46.060 1.00 2.30 C ATOM 1423 CD GLU A 909 -19.918 -15.882 -45.777 1.00 2.85 C ATOM 1424 OE1 GLU A 909 -19.621 -15.522 -44.622 1.00 3.28 O ATOM 1425 OE2 GLU A 909 -20.120 -15.083 -46.717 1.00 3.31 O ATOM 0 H GLU A 909 -21.567 -17.980 -47.587 1.00 1.71 H new ATOM 0 HA GLU A 909 -22.950 -19.003 -45.313 1.00 1.70 H new ATOM 0 HB2 GLU A 909 -21.039 -17.561 -44.183 1.00 1.97 H new ATOM 0 HB3 GLU A 909 -20.690 -19.085 -44.973 1.00 1.97 H new ATOM 0 HG2 GLU A 909 -19.057 -17.829 -45.946 1.00 2.30 H new ATOM 0 HG3 GLU A 909 -20.338 -17.507 -47.097 1.00 2.30 H new ATOM 1432 N GLU A 910 -23.460 -15.930 -46.107 1.00 1.70 N ATOM 1433 CA GLU A 910 -24.260 -14.759 -45.769 1.00 1.71 C ATOM 1434 C GLU A 910 -25.673 -15.183 -45.381 1.00 1.51 C ATOM 1435 O GLU A 910 -26.163 -14.841 -44.304 1.00 1.45 O ATOM 1436 CB GLU A 910 -24.309 -13.784 -46.946 1.00 1.95 C ATOM 1437 CG GLU A 910 -23.487 -12.523 -46.725 1.00 2.30 C ATOM 1438 CD GLU A 910 -24.343 -11.280 -46.590 1.00 2.97 C ATOM 1439 OE1 GLU A 910 -25.260 -11.090 -47.421 1.00 3.43 O ATOM 1440 OE2 GLU A 910 -24.107 -10.489 -45.649 1.00 3.58 O ATOM 0 H GLU A 910 -23.104 -15.940 -47.063 1.00 1.70 H new ATOM 0 HA GLU A 910 -23.795 -14.256 -44.921 1.00 1.71 H new ATOM 0 HB2 GLU A 910 -23.949 -14.290 -47.842 1.00 1.95 H new ATOM 0 HB3 GLU A 910 -25.346 -13.504 -47.133 1.00 1.95 H new ATOM 0 HG2 GLU A 910 -22.883 -12.642 -45.826 1.00 2.30 H new ATOM 0 HG3 GLU A 910 -22.796 -12.394 -47.558 1.00 2.30 H new ATOM 1447 N LYS A 911 -26.308 -15.963 -46.252 1.00 1.45 N ATOM 1448 CA LYS A 911 -27.665 -16.429 -46.008 1.00 1.34 C ATOM 1449 C LYS A 911 -27.698 -17.390 -44.827 1.00 1.19 C ATOM 1450 O LYS A 911 -28.640 -17.370 -44.025 1.00 1.13 O ATOM 1451 CB LYS A 911 -28.241 -17.114 -47.253 1.00 1.41 C ATOM 1452 CG LYS A 911 -29.725 -17.429 -47.138 1.00 1.46 C ATOM 1453 CD LYS A 911 -30.023 -18.868 -47.530 1.00 1.59 C ATOM 1454 CE LYS A 911 -31.102 -19.479 -46.649 1.00 1.83 C ATOM 1455 NZ LYS A 911 -31.359 -20.904 -46.991 1.00 2.29 N ATOM 0 H LYS A 911 -25.903 -16.284 -47.131 1.00 1.45 H new ATOM 0 HA LYS A 911 -28.279 -15.559 -45.774 1.00 1.34 H new ATOM 0 HB2 LYS A 911 -28.080 -16.472 -48.119 1.00 1.41 H new ATOM 0 HB3 LYS A 911 -27.694 -18.039 -47.435 1.00 1.41 H new ATOM 0 HG2 LYS A 911 -30.057 -17.254 -46.115 1.00 1.46 H new ATOM 0 HG3 LYS A 911 -30.292 -16.752 -47.777 1.00 1.46 H new ATOM 0 HD2 LYS A 911 -30.341 -18.903 -48.572 1.00 1.59 H new ATOM 0 HD3 LYS A 911 -29.112 -19.462 -47.455 1.00 1.59 H new ATOM 0 HE2 LYS A 911 -30.802 -19.405 -45.604 1.00 1.83 H new ATOM 0 HE3 LYS A 911 -32.024 -18.908 -46.757 1.00 1.83 H new ATOM 0 HZ1 LYS A 911 -32.101 -21.282 -46.368 1.00 2.29 H new ATOM 0 HZ2 LYS A 911 -31.670 -20.973 -47.981 1.00 2.29 H new ATOM 0 HZ3 LYS A 911 -30.486 -21.454 -46.864 1.00 2.29 H new ATOM 1469 N GLN A 912 -26.669 -18.224 -44.707 1.00 1.20 N ATOM 1470 CA GLN A 912 -26.623 -19.177 -43.610 1.00 1.16 C ATOM 1471 C GLN A 912 -26.445 -18.442 -42.290 1.00 1.08 C ATOM 1472 O GLN A 912 -26.913 -18.895 -41.254 1.00 1.00 O ATOM 1473 CB GLN A 912 -25.514 -20.219 -43.806 1.00 1.35 C ATOM 1474 CG GLN A 912 -25.958 -21.471 -44.562 1.00 1.50 C ATOM 1475 CD GLN A 912 -27.111 -21.231 -45.527 1.00 2.04 C ATOM 1476 OE1 GLN A 912 -28.263 -21.092 -45.119 1.00 2.65 O ATOM 1477 NE2 GLN A 912 -26.815 -21.201 -46.817 1.00 2.53 N ATOM 0 H GLN A 912 -25.872 -18.258 -45.343 1.00 1.20 H new ATOM 0 HA GLN A 912 -27.570 -19.716 -43.593 1.00 1.16 H new ATOM 0 HB2 GLN A 912 -24.687 -19.756 -44.345 1.00 1.35 H new ATOM 0 HB3 GLN A 912 -25.132 -20.514 -42.829 1.00 1.35 H new ATOM 0 HG2 GLN A 912 -25.109 -21.869 -45.117 1.00 1.50 H new ATOM 0 HG3 GLN A 912 -26.253 -22.234 -43.841 1.00 1.50 H new ATOM 0 HE21 GLN A 912 -25.849 -21.320 -47.121 1.00 2.53 H new ATOM 0 HE22 GLN A 912 -27.553 -21.059 -47.506 1.00 2.53 H new ATOM 1486 N ARG A 913 -25.788 -17.290 -42.344 1.00 1.17 N ATOM 1487 CA ARG A 913 -25.593 -16.463 -41.163 1.00 1.19 C ATOM 1488 C ARG A 913 -26.917 -15.931 -40.647 1.00 1.09 C ATOM 1489 O ARG A 913 -27.115 -15.820 -39.442 1.00 1.07 O ATOM 1490 CB ARG A 913 -24.656 -15.297 -41.444 1.00 1.40 C ATOM 1491 CG ARG A 913 -24.056 -14.709 -40.180 1.00 1.47 C ATOM 1492 CD ARG A 913 -22.545 -14.842 -40.175 1.00 1.72 C ATOM 1493 NE ARG A 913 -22.129 -16.208 -40.475 1.00 2.36 N ATOM 1494 CZ ARG A 913 -21.345 -16.541 -41.498 1.00 3.09 C ATOM 1495 NH1 ARG A 913 -20.883 -15.596 -42.310 1.00 3.38 N ATOM 1496 NH2 ARG A 913 -21.033 -17.814 -41.712 1.00 4.05 N ATOM 0 H ARG A 913 -25.380 -16.907 -43.197 1.00 1.17 H new ATOM 0 HA ARG A 913 -25.140 -17.099 -40.402 1.00 1.19 H new ATOM 0 HB2 ARG A 913 -23.853 -15.632 -42.101 1.00 1.40 H new ATOM 0 HB3 ARG A 913 -25.201 -14.519 -41.978 1.00 1.40 H new ATOM 0 HG2 ARG A 913 -24.331 -13.657 -40.099 1.00 1.47 H new ATOM 0 HG3 ARG A 913 -24.471 -15.215 -39.308 1.00 1.47 H new ATOM 0 HD2 ARG A 913 -22.116 -14.160 -40.909 1.00 1.72 H new ATOM 0 HD3 ARG A 913 -22.156 -14.547 -39.200 1.00 1.72 H new ATOM 0 HE ARG A 913 -22.459 -16.954 -39.863 1.00 2.36 H new ATOM 0 HH11 ARG A 913 -21.129 -14.619 -42.148 1.00 3.38 H new ATOM 0 HH12 ARG A 913 -20.282 -15.847 -43.095 1.00 3.38 H new ATOM 0 HH21 ARG A 913 -21.394 -18.539 -41.092 1.00 4.05 H new ATOM 0 HH22 ARG A 913 -20.432 -18.067 -42.496 1.00 4.05 H new ATOM 1510 N CYS A 914 -27.814 -15.575 -41.554 1.00 1.12 N ATOM 1511 CA CYS A 914 -29.159 -15.196 -41.151 1.00 1.16 C ATOM 1512 C CYS A 914 -29.846 -16.381 -40.479 1.00 1.02 C ATOM 1513 O CYS A 914 -30.645 -16.212 -39.555 1.00 1.08 O ATOM 1514 CB CYS A 914 -29.979 -14.727 -42.356 1.00 1.36 C ATOM 1515 SG CYS A 914 -29.003 -13.948 -43.662 1.00 1.65 S ATOM 0 H CYS A 914 -27.639 -15.541 -42.558 1.00 1.12 H new ATOM 0 HA CYS A 914 -29.090 -14.368 -40.445 1.00 1.16 H new ATOM 0 HB2 CYS A 914 -30.508 -15.582 -42.775 1.00 1.36 H new ATOM 0 HB3 CYS A 914 -30.735 -14.021 -42.013 1.00 1.36 H new ATOM 0 HG CYS A 914 -27.924 -14.642 -43.870 1.00 1.65 H new ATOM 1521 N LEU A 915 -29.508 -17.582 -40.941 1.00 0.93 N ATOM 1522 CA LEU A 915 -30.095 -18.801 -40.408 1.00 0.94 C ATOM 1523 C LEU A 915 -29.600 -19.109 -38.993 1.00 0.87 C ATOM 1524 O LEU A 915 -30.412 -19.384 -38.111 1.00 0.96 O ATOM 1525 CB LEU A 915 -29.828 -19.986 -41.334 1.00 1.01 C ATOM 1526 CG LEU A 915 -31.088 -20.675 -41.860 1.00 1.21 C ATOM 1527 CD1 LEU A 915 -30.871 -21.177 -43.275 1.00 1.82 C ATOM 1528 CD2 LEU A 915 -31.496 -21.816 -40.944 1.00 1.88 C ATOM 0 H LEU A 915 -28.828 -17.734 -41.686 1.00 0.93 H new ATOM 0 HA LEU A 915 -31.171 -18.635 -40.351 1.00 0.94 H new ATOM 0 HB2 LEU A 915 -29.236 -19.642 -42.182 1.00 1.01 H new ATOM 0 HB3 LEU A 915 -29.224 -20.719 -40.800 1.00 1.01 H new ATOM 0 HG LEU A 915 -31.896 -19.944 -41.876 1.00 1.21 H new ATOM 0 HD11 LEU A 915 -31.779 -21.664 -43.631 1.00 1.82 H new ATOM 0 HD12 LEU A 915 -30.630 -20.337 -43.926 1.00 1.82 H new ATOM 0 HD13 LEU A 915 -30.048 -21.891 -43.285 1.00 1.82 H new ATOM 0 HD21 LEU A 915 -32.394 -22.293 -41.335 1.00 1.88 H new ATOM 0 HD22 LEU A 915 -30.689 -22.547 -40.892 1.00 1.88 H new ATOM 0 HD23 LEU A 915 -31.697 -21.427 -39.946 1.00 1.88 H new ATOM 1540 N GLU A 916 -28.286 -19.060 -38.748 1.00 0.82 N ATOM 1541 CA GLU A 916 -27.792 -19.356 -37.404 1.00 0.84 C ATOM 1542 C GLU A 916 -28.063 -18.173 -36.484 1.00 0.74 C ATOM 1543 O GLU A 916 -28.560 -18.342 -35.379 1.00 0.76 O ATOM 1544 CB GLU A 916 -26.301 -19.711 -37.354 1.00 1.00 C ATOM 1545 CG GLU A 916 -25.453 -19.314 -38.543 1.00 1.74 C ATOM 1546 CD GLU A 916 -24.700 -18.009 -38.348 1.00 2.82 C ATOM 1547 OE1 GLU A 916 -25.142 -17.194 -37.513 1.00 3.40 O ATOM 1548 OE2 GLU A 916 -23.691 -17.775 -39.053 1.00 3.47 O ATOM 0 H GLU A 916 -27.570 -18.827 -39.436 1.00 0.82 H new ATOM 0 HA GLU A 916 -28.333 -20.241 -37.070 1.00 0.84 H new ATOM 0 HB2 GLU A 916 -25.873 -19.247 -36.465 1.00 1.00 H new ATOM 0 HB3 GLU A 916 -26.215 -20.790 -37.224 1.00 1.00 H new ATOM 0 HG2 GLU A 916 -24.737 -20.109 -38.749 1.00 1.74 H new ATOM 0 HG3 GLU A 916 -26.093 -19.226 -39.421 1.00 1.74 H new ATOM 1555 N SER A 917 -27.760 -16.980 -36.983 1.00 0.74 N ATOM 1556 CA SER A 917 -27.992 -15.729 -36.274 1.00 0.80 C ATOM 1557 C SER A 917 -27.379 -15.716 -34.873 1.00 0.76 C ATOM 1558 O SER A 917 -28.056 -15.395 -33.891 1.00 0.86 O ATOM 1559 CB SER A 917 -29.486 -15.465 -36.177 1.00 0.95 C ATOM 1560 OG SER A 917 -29.948 -14.700 -37.282 1.00 1.35 O ATOM 0 H SER A 917 -27.341 -16.854 -37.904 1.00 0.74 H new ATOM 0 HA SER A 917 -27.501 -14.943 -36.847 1.00 0.80 H new ATOM 0 HB2 SER A 917 -30.023 -16.413 -36.138 1.00 0.95 H new ATOM 0 HB3 SER A 917 -29.705 -14.936 -35.249 1.00 0.95 H new ATOM 0 HG SER A 917 -30.166 -15.299 -38.026 1.00 1.35 H new ATOM 1566 N GLY A 918 -26.108 -16.057 -34.775 1.00 0.73 N ATOM 1567 CA GLY A 918 -25.441 -15.993 -33.488 1.00 0.82 C ATOM 1568 C GLY A 918 -24.054 -15.384 -33.564 1.00 0.77 C ATOM 1569 O GLY A 918 -23.462 -15.060 -32.540 1.00 1.02 O ATOM 0 H GLY A 918 -25.527 -16.374 -35.551 1.00 0.73 H new ATOM 0 HA2 GLY A 918 -26.050 -15.408 -32.799 1.00 0.82 H new ATOM 0 HA3 GLY A 918 -25.367 -16.999 -33.074 1.00 0.82 H new ATOM 1573 N MET A 919 -23.533 -15.230 -34.777 1.00 0.62 N ATOM 1574 CA MET A 919 -22.161 -14.771 -34.967 1.00 0.59 C ATOM 1575 C MET A 919 -22.081 -13.249 -34.898 1.00 0.55 C ATOM 1576 O MET A 919 -22.300 -12.666 -33.834 1.00 0.54 O ATOM 1577 CB MET A 919 -21.619 -15.280 -36.307 1.00 0.73 C ATOM 1578 CG MET A 919 -20.460 -16.253 -36.164 1.00 0.90 C ATOM 1579 SD MET A 919 -20.386 -17.451 -37.508 1.00 1.46 S ATOM 1580 CE MET A 919 -19.467 -18.775 -36.728 1.00 2.01 C ATOM 0 H MET A 919 -24.039 -15.416 -35.643 1.00 0.62 H new ATOM 0 HA MET A 919 -21.546 -15.175 -34.163 1.00 0.59 H new ATOM 0 HB2 MET A 919 -22.426 -15.767 -36.854 1.00 0.73 H new ATOM 0 HB3 MET A 919 -21.296 -14.428 -36.906 1.00 0.73 H new ATOM 0 HG2 MET A 919 -19.525 -15.694 -36.129 1.00 0.90 H new ATOM 0 HG3 MET A 919 -20.551 -16.783 -35.216 1.00 0.90 H new ATOM 0 HE1 MET A 919 -19.292 -19.572 -37.451 1.00 2.01 H new ATOM 0 HE2 MET A 919 -18.511 -18.393 -36.371 1.00 2.01 H new ATOM 0 HE3 MET A 919 -20.038 -19.168 -35.887 1.00 2.01 H new ATOM 1590 N ASP A 920 -21.740 -12.639 -36.040 1.00 0.60 N ATOM 1591 CA ASP A 920 -21.670 -11.182 -36.220 1.00 0.66 C ATOM 1592 C ASP A 920 -20.737 -10.870 -37.379 1.00 0.62 C ATOM 1593 O ASP A 920 -21.127 -10.243 -38.362 1.00 0.76 O ATOM 1594 CB ASP A 920 -21.168 -10.442 -34.974 1.00 0.72 C ATOM 1595 CG ASP A 920 -21.729 -9.036 -34.882 1.00 0.83 C ATOM 1596 OD1 ASP A 920 -21.405 -8.199 -35.749 1.00 1.01 O ATOM 1597 OD2 ASP A 920 -22.505 -8.756 -33.945 1.00 1.26 O ATOM 0 H ASP A 920 -21.499 -13.157 -36.885 1.00 0.60 H new ATOM 0 HA ASP A 920 -22.685 -10.837 -36.416 1.00 0.66 H new ATOM 0 HB2 ASP A 920 -21.448 -11.003 -34.082 1.00 0.72 H new ATOM 0 HB3 ASP A 920 -20.079 -10.397 -34.993 1.00 0.72 H new ATOM 1602 N SER A 921 -19.504 -11.337 -37.259 1.00 0.54 N ATOM 1603 CA SER A 921 -18.485 -11.094 -38.270 1.00 0.59 C ATOM 1604 C SER A 921 -18.271 -12.325 -39.139 1.00 0.51 C ATOM 1605 O SER A 921 -18.412 -13.455 -38.671 1.00 0.61 O ATOM 1606 CB SER A 921 -17.179 -10.704 -37.588 1.00 0.76 C ATOM 1607 OG SER A 921 -17.394 -10.486 -36.207 1.00 1.26 O ATOM 0 H SER A 921 -19.182 -11.891 -36.465 1.00 0.54 H new ATOM 0 HA SER A 921 -18.821 -10.282 -38.914 1.00 0.59 H new ATOM 0 HB2 SER A 921 -16.438 -11.491 -37.728 1.00 0.76 H new ATOM 0 HB3 SER A 921 -16.776 -9.801 -38.047 1.00 0.76 H new ATOM 0 HG SER A 921 -17.898 -9.655 -36.082 1.00 1.26 H new ATOM 1613 N CYS A 922 -17.934 -12.097 -40.401 1.00 0.49 N ATOM 1614 CA CYS A 922 -17.690 -13.179 -41.342 1.00 0.48 C ATOM 1615 C CYS A 922 -16.335 -12.999 -42.022 1.00 0.49 C ATOM 1616 O CYS A 922 -16.098 -11.993 -42.692 1.00 0.60 O ATOM 1617 CB CYS A 922 -18.801 -13.222 -42.392 1.00 0.59 C ATOM 1618 SG CYS A 922 -20.344 -12.437 -41.865 1.00 1.13 S ATOM 0 H CYS A 922 -17.823 -11.164 -40.798 1.00 0.49 H new ATOM 0 HA CYS A 922 -17.682 -14.121 -40.794 1.00 0.48 H new ATOM 0 HB2 CYS A 922 -18.448 -12.732 -43.300 1.00 0.59 H new ATOM 0 HB3 CYS A 922 -19.004 -14.262 -42.649 1.00 0.59 H new ATOM 0 HG CYS A 922 -21.222 -12.522 -42.820 1.00 1.13 H new ATOM 1624 N LEU A 923 -15.442 -13.956 -41.813 1.00 0.44 N ATOM 1625 CA LEU A 923 -14.123 -13.931 -42.432 1.00 0.46 C ATOM 1626 C LEU A 923 -13.782 -15.307 -42.984 1.00 0.43 C ATOM 1627 O LEU A 923 -14.509 -16.273 -42.757 1.00 0.43 O ATOM 1628 CB LEU A 923 -13.047 -13.495 -41.428 1.00 0.53 C ATOM 1629 CG LEU A 923 -13.556 -13.048 -40.056 1.00 0.55 C ATOM 1630 CD1 LEU A 923 -12.635 -13.559 -38.962 1.00 0.69 C ATOM 1631 CD2 LEU A 923 -13.666 -11.531 -39.993 1.00 0.66 C ATOM 0 H LEU A 923 -15.608 -14.765 -41.215 1.00 0.44 H new ATOM 0 HA LEU A 923 -14.146 -13.206 -43.246 1.00 0.46 H new ATOM 0 HB2 LEU A 923 -12.354 -14.324 -41.285 1.00 0.53 H new ATOM 0 HB3 LEU A 923 -12.478 -12.676 -41.868 1.00 0.53 H new ATOM 0 HG LEU A 923 -14.549 -13.470 -39.901 1.00 0.55 H new ATOM 0 HD11 LEU A 923 -13.008 -13.234 -37.991 1.00 0.69 H new ATOM 0 HD12 LEU A 923 -12.603 -14.648 -38.993 1.00 0.69 H new ATOM 0 HD13 LEU A 923 -11.632 -13.162 -39.116 1.00 0.69 H new ATOM 0 HD21 LEU A 923 -14.030 -11.233 -39.010 1.00 0.66 H new ATOM 0 HD22 LEU A 923 -12.686 -11.088 -40.167 1.00 0.66 H new ATOM 0 HD23 LEU A 923 -14.362 -11.185 -40.757 1.00 0.66 H new ATOM 1643 N SER A 924 -12.675 -15.398 -43.701 1.00 0.48 N ATOM 1644 CA SER A 924 -12.253 -16.655 -44.292 1.00 0.53 C ATOM 1645 C SER A 924 -10.985 -17.159 -43.616 1.00 0.50 C ATOM 1646 O SER A 924 -10.232 -16.366 -43.047 1.00 0.51 O ATOM 1647 CB SER A 924 -12.028 -16.472 -45.790 1.00 0.67 C ATOM 1648 OG SER A 924 -12.834 -15.419 -46.295 1.00 0.89 O ATOM 0 H SER A 924 -12.051 -14.613 -43.888 1.00 0.48 H new ATOM 0 HA SER A 924 -13.036 -17.399 -44.144 1.00 0.53 H new ATOM 0 HB2 SER A 924 -10.977 -16.255 -45.981 1.00 0.67 H new ATOM 0 HB3 SER A 924 -12.262 -17.399 -46.314 1.00 0.67 H new ATOM 0 HG SER A 924 -12.674 -15.317 -47.256 1.00 0.89 H new ATOM 1654 N LYS A 925 -10.768 -18.474 -43.682 1.00 0.54 N ATOM 1655 CA LYS A 925 -9.619 -19.128 -43.042 1.00 0.57 C ATOM 1656 C LYS A 925 -8.295 -18.376 -43.268 1.00 0.61 C ATOM 1657 O LYS A 925 -7.561 -18.155 -42.309 1.00 0.64 O ATOM 1658 CB LYS A 925 -9.489 -20.582 -43.519 1.00 0.64 C ATOM 1659 CG LYS A 925 -8.265 -21.301 -42.962 1.00 0.60 C ATOM 1660 CD LYS A 925 -8.530 -22.782 -42.748 1.00 0.86 C ATOM 1661 CE LYS A 925 -8.074 -23.241 -41.373 1.00 1.03 C ATOM 1662 NZ LYS A 925 -9.159 -23.126 -40.369 1.00 1.11 N ATOM 0 H LYS A 925 -11.383 -19.118 -44.180 1.00 0.54 H new ATOM 0 HA LYS A 925 -9.814 -19.112 -41.970 1.00 0.57 H new ATOM 0 HB2 LYS A 925 -10.385 -21.132 -43.231 1.00 0.64 H new ATOM 0 HB3 LYS A 925 -9.443 -20.595 -44.608 1.00 0.64 H new ATOM 0 HG2 LYS A 925 -7.427 -21.177 -43.648 1.00 0.60 H new ATOM 0 HG3 LYS A 925 -7.973 -20.843 -42.017 1.00 0.60 H new ATOM 0 HD2 LYS A 925 -9.595 -22.982 -42.864 1.00 0.86 H new ATOM 0 HD3 LYS A 925 -8.013 -23.359 -43.515 1.00 0.86 H new ATOM 0 HE2 LYS A 925 -7.737 -24.276 -41.428 1.00 1.03 H new ATOM 0 HE3 LYS A 925 -7.219 -22.644 -41.055 1.00 1.03 H new ATOM 0 HZ1 LYS A 925 -8.981 -23.789 -39.588 1.00 1.11 H new ATOM 0 HZ2 LYS A 925 -9.188 -22.155 -39.999 1.00 1.11 H new ATOM 0 HZ3 LYS A 925 -10.070 -23.353 -40.815 1.00 1.11 H new ATOM 1676 N PRO A 926 -7.953 -17.986 -44.525 1.00 0.68 N ATOM 1677 CA PRO A 926 -6.740 -17.195 -44.799 1.00 0.77 C ATOM 1678 C PRO A 926 -6.792 -15.793 -44.183 1.00 0.70 C ATOM 1679 O PRO A 926 -6.862 -14.783 -44.892 1.00 0.80 O ATOM 1680 CB PRO A 926 -6.698 -17.101 -46.327 1.00 0.94 C ATOM 1681 CG PRO A 926 -8.100 -17.335 -46.762 1.00 1.01 C ATOM 1682 CD PRO A 926 -8.679 -18.302 -45.772 1.00 0.73 C ATOM 0 HA PRO A 926 -5.857 -17.663 -44.363 1.00 0.77 H new ATOM 0 HB2 PRO A 926 -6.341 -16.124 -46.653 1.00 0.94 H new ATOM 0 HB3 PRO A 926 -6.023 -17.845 -46.750 1.00 0.94 H new ATOM 0 HG2 PRO A 926 -8.666 -16.403 -46.776 1.00 1.01 H new ATOM 0 HG3 PRO A 926 -8.133 -17.743 -47.772 1.00 1.01 H new ATOM 0 HD2 PRO A 926 -9.754 -18.165 -45.657 1.00 0.73 H new ATOM 0 HD3 PRO A 926 -8.520 -19.336 -46.079 1.00 0.73 H new ATOM 1690 N VAL A 927 -6.774 -15.746 -42.865 1.00 0.63 N ATOM 1691 CA VAL A 927 -6.756 -14.501 -42.124 1.00 0.63 C ATOM 1692 C VAL A 927 -5.317 -14.018 -41.930 1.00 0.69 C ATOM 1693 O VAL A 927 -4.368 -14.781 -42.132 1.00 1.10 O ATOM 1694 CB VAL A 927 -7.465 -14.681 -40.755 1.00 0.63 C ATOM 1695 CG1 VAL A 927 -6.480 -15.041 -39.649 1.00 1.36 C ATOM 1696 CG2 VAL A 927 -8.259 -13.437 -40.391 1.00 1.14 C ATOM 0 H VAL A 927 -6.771 -16.578 -42.274 1.00 0.63 H new ATOM 0 HA VAL A 927 -7.296 -13.745 -42.694 1.00 0.63 H new ATOM 0 HB VAL A 927 -8.159 -15.516 -40.854 1.00 0.63 H new ATOM 0 HG11 VAL A 927 -7.017 -15.158 -38.708 1.00 1.36 H new ATOM 0 HG12 VAL A 927 -5.978 -15.976 -39.899 1.00 1.36 H new ATOM 0 HG13 VAL A 927 -5.740 -14.247 -39.548 1.00 1.36 H new ATOM 0 HG21 VAL A 927 -8.747 -13.586 -39.428 1.00 1.14 H new ATOM 0 HG22 VAL A 927 -7.586 -12.581 -40.328 1.00 1.14 H new ATOM 0 HG23 VAL A 927 -9.013 -13.250 -41.155 1.00 1.14 H new ATOM 1706 N THR A 928 -5.159 -12.756 -41.558 1.00 0.51 N ATOM 1707 CA THR A 928 -3.843 -12.173 -41.356 1.00 0.58 C ATOM 1708 C THR A 928 -3.816 -11.341 -40.071 1.00 0.50 C ATOM 1709 O THR A 928 -4.867 -11.076 -39.481 1.00 0.46 O ATOM 1710 CB THR A 928 -3.448 -11.296 -42.561 1.00 0.71 C ATOM 1711 OG1 THR A 928 -4.573 -11.141 -43.444 1.00 0.80 O ATOM 1712 CG2 THR A 928 -2.286 -11.911 -43.326 1.00 0.92 C ATOM 0 H THR A 928 -5.933 -12.113 -41.389 1.00 0.51 H new ATOM 0 HA THR A 928 -3.122 -12.985 -41.263 1.00 0.58 H new ATOM 0 HB THR A 928 -3.139 -10.321 -42.183 1.00 0.71 H new ATOM 0 HG1 THR A 928 -4.316 -10.581 -44.206 1.00 0.80 H new ATOM 0 HG21 THR A 928 -2.028 -11.272 -44.171 1.00 0.92 H new ATOM 0 HG22 THR A 928 -1.424 -12.005 -42.665 1.00 0.92 H new ATOM 0 HG23 THR A 928 -2.572 -12.897 -43.691 1.00 0.92 H new ATOM 1720 N LEU A 929 -2.622 -10.928 -39.648 1.00 0.52 N ATOM 1721 CA LEU A 929 -2.449 -10.187 -38.396 1.00 0.51 C ATOM 1722 C LEU A 929 -3.209 -8.863 -38.422 1.00 0.49 C ATOM 1723 O LEU A 929 -3.931 -8.538 -37.482 1.00 0.51 O ATOM 1724 CB LEU A 929 -0.958 -9.917 -38.147 1.00 0.59 C ATOM 1725 CG LEU A 929 -0.488 -9.872 -36.681 1.00 0.67 C ATOM 1726 CD1 LEU A 929 0.476 -8.715 -36.484 1.00 0.92 C ATOM 1727 CD2 LEU A 929 -1.651 -9.753 -35.702 1.00 0.71 C ATOM 0 H LEU A 929 -1.754 -11.095 -40.157 1.00 0.52 H new ATOM 0 HA LEU A 929 -2.853 -10.798 -37.589 1.00 0.51 H new ATOM 0 HB2 LEU A 929 -0.384 -10.687 -38.663 1.00 0.59 H new ATOM 0 HB3 LEU A 929 -0.704 -8.965 -38.613 1.00 0.59 H new ATOM 0 HG LEU A 929 0.016 -10.815 -36.471 1.00 0.67 H new ATOM 0 HD11 LEU A 929 0.805 -8.688 -35.445 1.00 0.92 H new ATOM 0 HD12 LEU A 929 1.340 -8.847 -37.135 1.00 0.92 H new ATOM 0 HD13 LEU A 929 -0.024 -7.779 -36.730 1.00 0.92 H new ATOM 0 HD21 LEU A 929 -1.267 -9.725 -34.682 1.00 0.71 H new ATOM 0 HD22 LEU A 929 -2.206 -8.837 -35.906 1.00 0.71 H new ATOM 0 HD23 LEU A 929 -2.313 -10.611 -35.817 1.00 0.71 H new ATOM 1739 N ASP A 930 -3.067 -8.113 -39.505 1.00 0.54 N ATOM 1740 CA ASP A 930 -3.702 -6.800 -39.598 1.00 0.63 C ATOM 1741 C ASP A 930 -5.214 -6.955 -39.618 1.00 0.53 C ATOM 1742 O ASP A 930 -5.935 -6.225 -38.941 1.00 0.52 O ATOM 1743 CB ASP A 930 -3.233 -6.049 -40.847 1.00 0.85 C ATOM 1744 CG ASP A 930 -3.375 -4.541 -40.726 1.00 1.34 C ATOM 1745 OD1 ASP A 930 -3.843 -4.071 -39.668 1.00 1.73 O ATOM 1746 OD2 ASP A 930 -3.023 -3.815 -41.683 1.00 1.85 O ATOM 0 H ASP A 930 -2.525 -8.384 -40.325 1.00 0.54 H new ATOM 0 HA ASP A 930 -3.412 -6.217 -38.724 1.00 0.63 H new ATOM 0 HB2 ASP A 930 -2.189 -6.295 -41.041 1.00 0.85 H new ATOM 0 HB3 ASP A 930 -3.806 -6.394 -41.707 1.00 0.85 H new ATOM 1751 N VAL A 931 -5.682 -7.943 -40.372 1.00 0.52 N ATOM 1752 CA VAL A 931 -7.107 -8.218 -40.482 1.00 0.50 C ATOM 1753 C VAL A 931 -7.697 -8.596 -39.127 1.00 0.43 C ATOM 1754 O VAL A 931 -8.728 -8.059 -38.723 1.00 0.44 O ATOM 1755 CB VAL A 931 -7.386 -9.351 -41.496 1.00 0.60 C ATOM 1756 CG1 VAL A 931 -8.844 -9.785 -41.447 1.00 0.70 C ATOM 1757 CG2 VAL A 931 -7.014 -8.903 -42.897 1.00 0.93 C ATOM 0 H VAL A 931 -5.091 -8.569 -40.918 1.00 0.52 H new ATOM 0 HA VAL A 931 -7.582 -7.304 -40.837 1.00 0.50 H new ATOM 0 HB VAL A 931 -6.771 -10.209 -41.224 1.00 0.60 H new ATOM 0 HG11 VAL A 931 -9.011 -10.583 -42.171 1.00 0.70 H new ATOM 0 HG12 VAL A 931 -9.083 -10.147 -40.447 1.00 0.70 H new ATOM 0 HG13 VAL A 931 -9.484 -8.937 -41.688 1.00 0.70 H new ATOM 0 HG21 VAL A 931 -7.215 -9.709 -43.602 1.00 0.93 H new ATOM 0 HG22 VAL A 931 -7.605 -8.028 -43.168 1.00 0.93 H new ATOM 0 HG23 VAL A 931 -5.954 -8.649 -42.928 1.00 0.93 H new ATOM 1767 N ILE A 932 -7.027 -9.501 -38.419 1.00 0.40 N ATOM 1768 CA ILE A 932 -7.515 -9.962 -37.128 1.00 0.41 C ATOM 1769 C ILE A 932 -7.444 -8.844 -36.092 1.00 0.39 C ATOM 1770 O ILE A 932 -8.281 -8.762 -35.199 1.00 0.39 O ATOM 1771 CB ILE A 932 -6.749 -11.222 -36.640 1.00 0.49 C ATOM 1772 CG1 ILE A 932 -7.733 -12.225 -36.041 1.00 0.77 C ATOM 1773 CG2 ILE A 932 -5.656 -10.877 -35.631 1.00 0.57 C ATOM 1774 CD1 ILE A 932 -7.241 -13.654 -36.075 1.00 1.18 C ATOM 0 H ILE A 932 -6.149 -9.926 -38.718 1.00 0.40 H new ATOM 0 HA ILE A 932 -8.560 -10.246 -37.254 1.00 0.41 H new ATOM 0 HB ILE A 932 -6.256 -11.667 -37.504 1.00 0.49 H new ATOM 0 HG12 ILE A 932 -7.939 -11.946 -35.008 1.00 0.77 H new ATOM 0 HG13 ILE A 932 -8.677 -12.162 -36.582 1.00 0.77 H new ATOM 0 HG21 ILE A 932 -5.148 -11.789 -35.319 1.00 0.57 H new ATOM 0 HG22 ILE A 932 -4.936 -10.200 -36.092 1.00 0.57 H new ATOM 0 HG23 ILE A 932 -6.103 -10.395 -34.762 1.00 0.57 H new ATOM 0 HD11 ILE A 932 -7.992 -14.308 -35.633 1.00 1.18 H new ATOM 0 HD12 ILE A 932 -7.062 -13.953 -37.108 1.00 1.18 H new ATOM 0 HD13 ILE A 932 -6.313 -13.733 -35.509 1.00 1.18 H new ATOM 1786 N LYS A 933 -6.453 -7.969 -36.237 1.00 0.40 N ATOM 1787 CA LYS A 933 -6.306 -6.821 -35.354 1.00 0.43 C ATOM 1788 C LYS A 933 -7.445 -5.837 -35.577 1.00 0.43 C ATOM 1789 O LYS A 933 -7.933 -5.218 -34.632 1.00 0.44 O ATOM 1790 CB LYS A 933 -4.959 -6.135 -35.597 1.00 0.50 C ATOM 1791 CG LYS A 933 -4.619 -5.062 -34.576 1.00 0.79 C ATOM 1792 CD LYS A 933 -4.462 -3.696 -35.229 1.00 1.08 C ATOM 1793 CE LYS A 933 -3.499 -3.738 -36.408 1.00 1.50 C ATOM 1794 NZ LYS A 933 -3.769 -2.658 -37.393 1.00 1.90 N ATOM 0 H LYS A 933 -5.738 -8.036 -36.961 1.00 0.40 H new ATOM 0 HA LYS A 933 -6.340 -7.168 -34.321 1.00 0.43 H new ATOM 0 HB2 LYS A 933 -4.172 -6.890 -35.592 1.00 0.50 H new ATOM 0 HB3 LYS A 933 -4.965 -5.688 -36.591 1.00 0.50 H new ATOM 0 HG2 LYS A 933 -5.403 -5.017 -33.820 1.00 0.79 H new ATOM 0 HG3 LYS A 933 -3.696 -5.328 -34.062 1.00 0.79 H new ATOM 0 HD2 LYS A 933 -5.435 -3.341 -35.568 1.00 1.08 H new ATOM 0 HD3 LYS A 933 -4.101 -2.980 -34.491 1.00 1.08 H new ATOM 0 HE2 LYS A 933 -2.476 -3.647 -36.043 1.00 1.50 H new ATOM 0 HE3 LYS A 933 -3.575 -4.706 -36.903 1.00 1.50 H new ATOM 0 HZ1 LYS A 933 -3.528 -2.991 -38.348 1.00 1.90 H new ATOM 0 HZ2 LYS A 933 -4.776 -2.401 -37.359 1.00 1.90 H new ATOM 0 HZ3 LYS A 933 -3.191 -1.825 -37.162 1.00 1.90 H new ATOM 1808 N GLN A 934 -7.868 -5.708 -36.827 1.00 0.47 N ATOM 1809 CA GLN A 934 -8.972 -4.828 -37.172 1.00 0.53 C ATOM 1810 C GLN A 934 -10.246 -5.276 -36.467 1.00 0.46 C ATOM 1811 O GLN A 934 -10.862 -4.500 -35.739 1.00 0.47 O ATOM 1812 CB GLN A 934 -9.190 -4.805 -38.686 1.00 0.69 C ATOM 1813 CG GLN A 934 -8.089 -4.091 -39.450 1.00 0.79 C ATOM 1814 CD GLN A 934 -8.586 -2.868 -40.191 1.00 1.51 C ATOM 1815 OE1 GLN A 934 -9.070 -1.913 -39.584 1.00 2.06 O ATOM 1816 NE2 GLN A 934 -8.478 -2.891 -41.509 1.00 2.25 N ATOM 0 H GLN A 934 -7.461 -6.204 -37.620 1.00 0.47 H new ATOM 0 HA GLN A 934 -8.722 -3.820 -36.842 1.00 0.53 H new ATOM 0 HB2 GLN A 934 -9.266 -5.830 -39.049 1.00 0.69 H new ATOM 0 HB3 GLN A 934 -10.142 -4.320 -38.900 1.00 0.69 H new ATOM 0 HG2 GLN A 934 -7.304 -3.794 -38.754 1.00 0.79 H new ATOM 0 HG3 GLN A 934 -7.639 -4.783 -40.162 1.00 0.79 H new ATOM 0 HE21 GLN A 934 -8.070 -3.703 -41.973 1.00 2.25 H new ATOM 0 HE22 GLN A 934 -8.802 -2.097 -42.061 1.00 2.25 H new ATOM 1825 N THR A 935 -10.624 -6.532 -36.663 1.00 0.44 N ATOM 1826 CA THR A 935 -11.830 -7.066 -36.045 1.00 0.43 C ATOM 1827 C THR A 935 -11.710 -7.081 -34.520 1.00 0.38 C ATOM 1828 O THR A 935 -12.648 -6.708 -33.815 1.00 0.40 O ATOM 1829 CB THR A 935 -12.131 -8.488 -36.552 1.00 0.51 C ATOM 1830 OG1 THR A 935 -11.207 -8.835 -37.590 1.00 0.62 O ATOM 1831 CG2 THR A 935 -13.552 -8.586 -37.084 1.00 0.57 C ATOM 0 H THR A 935 -10.115 -7.198 -37.243 1.00 0.44 H new ATOM 0 HA THR A 935 -12.653 -6.409 -36.327 1.00 0.43 H new ATOM 0 HB THR A 935 -12.026 -9.180 -35.716 1.00 0.51 H new ATOM 0 HG1 THR A 935 -11.400 -9.741 -37.910 1.00 0.62 H new ATOM 0 HG21 THR A 935 -13.740 -9.600 -37.436 1.00 0.57 H new ATOM 0 HG22 THR A 935 -14.256 -8.342 -36.288 1.00 0.57 H new ATOM 0 HG23 THR A 935 -13.681 -7.886 -37.909 1.00 0.57 H new ATOM 1839 N LEU A 936 -10.546 -7.498 -34.024 1.00 0.37 N ATOM 1840 CA LEU A 936 -10.280 -7.545 -32.586 1.00 0.40 C ATOM 1841 C LEU A 936 -10.522 -6.185 -31.944 1.00 0.40 C ATOM 1842 O LEU A 936 -11.325 -6.053 -31.023 1.00 0.43 O ATOM 1843 CB LEU A 936 -8.828 -7.965 -32.329 1.00 0.46 C ATOM 1844 CG LEU A 936 -8.622 -9.165 -31.392 1.00 0.55 C ATOM 1845 CD1 LEU A 936 -9.751 -9.281 -30.377 1.00 0.86 C ATOM 1846 CD2 LEU A 936 -8.488 -10.450 -32.195 1.00 0.67 C ATOM 0 H LEU A 936 -9.766 -7.811 -34.602 1.00 0.37 H new ATOM 0 HA LEU A 936 -10.959 -8.274 -32.145 1.00 0.40 H new ATOM 0 HB2 LEU A 936 -8.364 -8.196 -33.288 1.00 0.46 H new ATOM 0 HB3 LEU A 936 -8.293 -7.111 -31.914 1.00 0.46 H new ATOM 0 HG LEU A 936 -7.697 -9.001 -30.839 1.00 0.55 H new ATOM 0 HD11 LEU A 936 -9.572 -10.140 -29.731 1.00 0.86 H new ATOM 0 HD12 LEU A 936 -9.791 -8.375 -29.773 1.00 0.86 H new ATOM 0 HD13 LEU A 936 -10.698 -9.411 -30.900 1.00 0.86 H new ATOM 0 HD21 LEU A 936 -8.343 -11.290 -31.516 1.00 0.67 H new ATOM 0 HD22 LEU A 936 -9.393 -10.609 -32.781 1.00 0.67 H new ATOM 0 HD23 LEU A 936 -7.632 -10.373 -32.865 1.00 0.67 H new ATOM 1858 N THR A 937 -9.833 -5.179 -32.456 1.00 0.43 N ATOM 1859 CA THR A 937 -9.869 -3.844 -31.885 1.00 0.51 C ATOM 1860 C THR A 937 -11.222 -3.162 -32.102 1.00 0.48 C ATOM 1861 O THR A 937 -11.729 -2.480 -31.210 1.00 0.52 O ATOM 1862 CB THR A 937 -8.739 -2.986 -32.478 1.00 0.62 C ATOM 1863 OG1 THR A 937 -7.504 -3.714 -32.414 1.00 0.67 O ATOM 1864 CG2 THR A 937 -8.595 -1.673 -31.730 1.00 0.87 C ATOM 0 H THR A 937 -9.234 -5.265 -33.277 1.00 0.43 H new ATOM 0 HA THR A 937 -9.724 -3.943 -30.809 1.00 0.51 H new ATOM 0 HB THR A 937 -8.987 -2.761 -33.515 1.00 0.62 H new ATOM 0 HG1 THR A 937 -7.428 -4.299 -33.197 1.00 0.67 H new ATOM 0 HG21 THR A 937 -7.788 -1.089 -32.173 1.00 0.87 H new ATOM 0 HG22 THR A 937 -9.528 -1.112 -31.796 1.00 0.87 H new ATOM 0 HG23 THR A 937 -8.366 -1.874 -30.683 1.00 0.87 H new ATOM 1872 N LEU A 938 -11.816 -3.362 -33.274 1.00 0.45 N ATOM 1873 CA LEU A 938 -13.101 -2.747 -33.585 1.00 0.49 C ATOM 1874 C LEU A 938 -14.206 -3.313 -32.698 1.00 0.45 C ATOM 1875 O LEU A 938 -15.068 -2.578 -32.216 1.00 0.50 O ATOM 1876 CB LEU A 938 -13.456 -2.949 -35.060 1.00 0.55 C ATOM 1877 CG LEU A 938 -13.162 -1.749 -35.959 1.00 0.99 C ATOM 1878 CD1 LEU A 938 -12.721 -2.209 -37.339 1.00 1.42 C ATOM 1879 CD2 LEU A 938 -14.385 -0.850 -36.059 1.00 1.39 C ATOM 0 H LEU A 938 -11.431 -3.941 -34.020 1.00 0.45 H new ATOM 0 HA LEU A 938 -13.014 -1.678 -33.390 1.00 0.49 H new ATOM 0 HB2 LEU A 938 -12.906 -3.811 -35.437 1.00 0.55 H new ATOM 0 HB3 LEU A 938 -14.516 -3.190 -35.134 1.00 0.55 H new ATOM 0 HG LEU A 938 -12.348 -1.176 -35.515 1.00 0.99 H new ATOM 0 HD11 LEU A 938 -12.516 -1.340 -37.964 1.00 1.42 H new ATOM 0 HD12 LEU A 938 -11.818 -2.813 -37.250 1.00 1.42 H new ATOM 0 HD13 LEU A 938 -13.512 -2.805 -37.794 1.00 1.42 H new ATOM 0 HD21 LEU A 938 -14.160 0.000 -36.703 1.00 1.39 H new ATOM 0 HD22 LEU A 938 -15.217 -1.414 -36.480 1.00 1.39 H new ATOM 0 HD23 LEU A 938 -14.655 -0.492 -35.066 1.00 1.39 H new ATOM 1891 N TYR A 939 -14.171 -4.618 -32.468 1.00 0.40 N ATOM 1892 CA TYR A 939 -15.165 -5.257 -31.619 1.00 0.43 C ATOM 1893 C TYR A 939 -14.866 -4.979 -30.152 1.00 0.42 C ATOM 1894 O TYR A 939 -15.769 -4.979 -29.316 1.00 0.48 O ATOM 1895 CB TYR A 939 -15.224 -6.761 -31.889 1.00 0.51 C ATOM 1896 CG TYR A 939 -16.173 -7.122 -33.011 1.00 0.68 C ATOM 1897 CD1 TYR A 939 -15.942 -6.679 -34.307 1.00 0.92 C ATOM 1898 CD2 TYR A 939 -17.303 -7.895 -32.775 1.00 1.21 C ATOM 1899 CE1 TYR A 939 -16.805 -6.997 -35.336 1.00 1.13 C ATOM 1900 CE2 TYR A 939 -18.172 -8.219 -33.801 1.00 1.47 C ATOM 1901 CZ TYR A 939 -17.920 -7.764 -35.079 1.00 1.27 C ATOM 1902 OH TYR A 939 -18.779 -8.089 -36.108 1.00 1.59 O ATOM 0 H TYR A 939 -13.470 -5.251 -32.854 1.00 0.40 H new ATOM 0 HA TYR A 939 -16.142 -4.836 -31.855 1.00 0.43 H new ATOM 0 HB2 TYR A 939 -14.225 -7.120 -32.136 1.00 0.51 H new ATOM 0 HB3 TYR A 939 -15.532 -7.276 -30.979 1.00 0.51 H new ATOM 0 HD1 TYR A 939 -15.071 -6.075 -34.513 1.00 0.92 H new ATOM 0 HD2 TYR A 939 -17.506 -8.248 -31.775 1.00 1.21 H new ATOM 0 HE1 TYR A 939 -16.607 -6.646 -36.338 1.00 1.13 H new ATOM 0 HE2 TYR A 939 -19.044 -8.825 -33.603 1.00 1.47 H new ATOM 0 HH TYR A 939 -19.682 -7.777 -35.891 1.00 1.59 H new ATOM 1912 N ALA A 940 -13.598 -4.724 -29.850 1.00 0.43 N ATOM 1913 CA ALA A 940 -13.192 -4.330 -28.508 1.00 0.52 C ATOM 1914 C ALA A 940 -13.786 -2.972 -28.152 1.00 0.55 C ATOM 1915 O ALA A 940 -14.284 -2.775 -27.045 1.00 0.61 O ATOM 1916 CB ALA A 940 -11.676 -4.293 -28.393 1.00 0.61 C ATOM 0 H ALA A 940 -12.831 -4.784 -30.520 1.00 0.43 H new ATOM 0 HA ALA A 940 -13.570 -5.071 -27.804 1.00 0.52 H new ATOM 0 HB1 ALA A 940 -11.395 -3.996 -27.383 1.00 0.61 H new ATOM 0 HB2 ALA A 940 -11.271 -5.282 -28.607 1.00 0.61 H new ATOM 0 HB3 ALA A 940 -11.274 -3.574 -29.107 1.00 0.61 H new ATOM 1922 N GLU A 941 -13.743 -2.043 -29.101 1.00 0.56 N ATOM 1923 CA GLU A 941 -14.350 -0.732 -28.908 1.00 0.67 C ATOM 1924 C GLU A 941 -15.867 -0.873 -28.793 1.00 0.65 C ATOM 1925 O GLU A 941 -16.518 -0.131 -28.058 1.00 0.73 O ATOM 1926 CB GLU A 941 -13.968 0.219 -30.059 1.00 0.79 C ATOM 1927 CG GLU A 941 -15.024 0.348 -31.151 1.00 0.99 C ATOM 1928 CD GLU A 941 -15.270 1.780 -31.583 1.00 1.36 C ATOM 1929 OE1 GLU A 941 -14.685 2.696 -30.963 1.00 1.72 O ATOM 1930 OE2 GLU A 941 -16.037 2.002 -32.543 1.00 1.87 O ATOM 0 H GLU A 941 -13.296 -2.173 -30.008 1.00 0.56 H new ATOM 0 HA GLU A 941 -13.971 -0.300 -27.982 1.00 0.67 H new ATOM 0 HB2 GLU A 941 -13.769 1.208 -29.645 1.00 0.79 H new ATOM 0 HB3 GLU A 941 -13.039 -0.131 -30.509 1.00 0.79 H new ATOM 0 HG2 GLU A 941 -14.714 -0.237 -32.017 1.00 0.99 H new ATOM 0 HG3 GLU A 941 -15.960 -0.082 -30.794 1.00 0.99 H new ATOM 1937 N ARG A 942 -16.415 -1.856 -29.501 1.00 0.60 N ATOM 1938 CA ARG A 942 -17.849 -2.091 -29.513 1.00 0.67 C ATOM 1939 C ARG A 942 -18.323 -2.604 -28.158 1.00 0.65 C ATOM 1940 O ARG A 942 -19.302 -2.102 -27.602 1.00 0.74 O ATOM 1941 CB ARG A 942 -18.203 -3.090 -30.619 1.00 0.74 C ATOM 1942 CG ARG A 942 -19.567 -3.740 -30.449 1.00 1.10 C ATOM 1943 CD ARG A 942 -19.617 -5.101 -31.115 1.00 1.46 C ATOM 1944 NE ARG A 942 -20.358 -5.059 -32.371 1.00 1.84 N ATOM 1945 CZ ARG A 942 -21.066 -6.076 -32.857 1.00 2.35 C ATOM 1946 NH1 ARG A 942 -21.139 -7.225 -32.197 1.00 2.73 N ATOM 1947 NH2 ARG A 942 -21.707 -5.945 -34.007 1.00 3.11 N ATOM 0 H ARG A 942 -15.880 -2.506 -30.077 1.00 0.60 H new ATOM 0 HA ARG A 942 -18.357 -1.147 -29.713 1.00 0.67 H new ATOM 0 HB2 ARG A 942 -18.173 -2.578 -31.581 1.00 0.74 H new ATOM 0 HB3 ARG A 942 -17.441 -3.869 -30.649 1.00 0.74 H new ATOM 0 HG2 ARG A 942 -19.793 -3.844 -29.388 1.00 1.10 H new ATOM 0 HG3 ARG A 942 -20.335 -3.095 -30.877 1.00 1.10 H new ATOM 0 HD2 ARG A 942 -18.602 -5.452 -31.302 1.00 1.46 H new ATOM 0 HD3 ARG A 942 -20.083 -5.819 -30.441 1.00 1.46 H new ATOM 0 HE ARG A 942 -20.332 -4.194 -32.912 1.00 1.84 H new ATOM 0 HH11 ARG A 942 -20.650 -7.335 -31.309 1.00 2.73 H new ATOM 0 HH12 ARG A 942 -21.684 -7.998 -32.578 1.00 2.73 H new ATOM 0 HH21 ARG A 942 -21.658 -5.065 -34.521 1.00 3.11 H new ATOM 0 HH22 ARG A 942 -22.250 -6.724 -34.380 1.00 3.11 H new ATOM 1961 N VAL A 943 -17.622 -3.592 -27.615 1.00 0.59 N ATOM 1962 CA VAL A 943 -17.979 -4.134 -26.311 1.00 0.64 C ATOM 1963 C VAL A 943 -17.670 -3.122 -25.217 1.00 0.67 C ATOM 1964 O VAL A 943 -18.347 -3.084 -24.195 1.00 0.75 O ATOM 1965 CB VAL A 943 -17.276 -5.477 -26.004 1.00 0.66 C ATOM 1966 CG1 VAL A 943 -17.739 -6.554 -26.971 1.00 0.75 C ATOM 1967 CG2 VAL A 943 -15.764 -5.337 -26.043 1.00 0.61 C ATOM 0 H VAL A 943 -16.811 -4.030 -28.052 1.00 0.59 H new ATOM 0 HA VAL A 943 -19.050 -4.334 -26.337 1.00 0.64 H new ATOM 0 HB VAL A 943 -17.554 -5.773 -24.992 1.00 0.66 H new ATOM 0 HG11 VAL A 943 -17.234 -7.492 -26.740 1.00 0.75 H new ATOM 0 HG12 VAL A 943 -18.816 -6.689 -26.876 1.00 0.75 H new ATOM 0 HG13 VAL A 943 -17.499 -6.254 -27.991 1.00 0.75 H new ATOM 0 HG21 VAL A 943 -15.304 -6.300 -25.823 1.00 0.61 H new ATOM 0 HG22 VAL A 943 -15.455 -5.005 -27.034 1.00 0.61 H new ATOM 0 HG23 VAL A 943 -15.447 -4.605 -25.300 1.00 0.61 H new ATOM 1977 N ARG A 944 -16.653 -2.295 -25.448 1.00 0.67 N ATOM 1978 CA ARG A 944 -16.326 -1.212 -24.530 1.00 0.79 C ATOM 1979 C ARG A 944 -17.486 -0.229 -24.442 1.00 0.88 C ATOM 1980 O ARG A 944 -17.897 0.152 -23.350 1.00 0.98 O ATOM 1981 CB ARG A 944 -15.054 -0.485 -24.977 1.00 0.85 C ATOM 1982 CG ARG A 944 -14.338 0.240 -23.850 1.00 1.10 C ATOM 1983 CD ARG A 944 -14.147 1.714 -24.168 1.00 1.67 C ATOM 1984 NE ARG A 944 -14.610 2.581 -23.084 1.00 2.12 N ATOM 1985 CZ ARG A 944 -13.955 3.659 -22.660 1.00 2.78 C ATOM 1986 NH1 ARG A 944 -12.762 3.956 -23.162 1.00 3.17 N ATOM 1987 NH2 ARG A 944 -14.484 4.425 -21.715 1.00 3.58 N ATOM 0 H ARG A 944 -16.043 -2.356 -26.263 1.00 0.67 H new ATOM 0 HA ARG A 944 -16.148 -1.642 -23.544 1.00 0.79 H new ATOM 0 HB2 ARG A 944 -14.371 -1.207 -25.424 1.00 0.85 H new ATOM 0 HB3 ARG A 944 -15.311 0.234 -25.755 1.00 0.85 H new ATOM 0 HG2 ARG A 944 -14.910 0.137 -22.928 1.00 1.10 H new ATOM 0 HG3 ARG A 944 -13.367 -0.224 -23.676 1.00 1.10 H new ATOM 0 HD2 ARG A 944 -13.092 1.908 -24.360 1.00 1.67 H new ATOM 0 HD3 ARG A 944 -14.688 1.959 -25.082 1.00 1.67 H new ATOM 0 HE ARG A 944 -15.490 2.344 -22.625 1.00 2.12 H new ATOM 0 HH11 ARG A 944 -12.345 3.357 -23.875 1.00 3.17 H new ATOM 0 HH12 ARG A 944 -12.263 4.783 -22.835 1.00 3.17 H new ATOM 0 HH21 ARG A 944 -15.391 4.187 -21.314 1.00 3.58 H new ATOM 0 HH22 ARG A 944 -13.983 5.252 -21.389 1.00 3.58 H new ATOM 2001 N LYS A 945 -18.019 0.163 -25.599 1.00 0.91 N ATOM 2002 CA LYS A 945 -19.184 1.046 -25.653 1.00 1.09 C ATOM 2003 C LYS A 945 -20.390 0.379 -25.002 1.00 1.10 C ATOM 2004 O LYS A 945 -21.231 1.038 -24.390 1.00 1.22 O ATOM 2005 CB LYS A 945 -19.523 1.408 -27.104 1.00 1.25 C ATOM 2006 CG LYS A 945 -18.458 2.244 -27.795 1.00 1.04 C ATOM 2007 CD LYS A 945 -19.054 3.097 -28.905 1.00 1.40 C ATOM 2008 CE LYS A 945 -18.005 3.482 -29.935 1.00 2.02 C ATOM 2009 NZ LYS A 945 -18.331 2.948 -31.283 1.00 2.78 N ATOM 0 H LYS A 945 -17.662 -0.117 -26.512 1.00 0.91 H new ATOM 0 HA LYS A 945 -18.940 1.957 -25.107 1.00 1.09 H new ATOM 0 HB2 LYS A 945 -19.675 0.490 -27.671 1.00 1.25 H new ATOM 0 HB3 LYS A 945 -20.467 1.953 -27.121 1.00 1.25 H new ATOM 0 HG2 LYS A 945 -17.967 2.887 -27.064 1.00 1.04 H new ATOM 0 HG3 LYS A 945 -17.692 1.589 -28.209 1.00 1.04 H new ATOM 0 HD2 LYS A 945 -19.861 2.550 -29.393 1.00 1.40 H new ATOM 0 HD3 LYS A 945 -19.493 3.998 -28.477 1.00 1.40 H new ATOM 0 HE2 LYS A 945 -17.926 4.568 -29.984 1.00 2.02 H new ATOM 0 HE3 LYS A 945 -17.032 3.105 -29.621 1.00 2.02 H new ATOM 0 HZ1 LYS A 945 -17.457 2.848 -31.837 1.00 2.78 H new ATOM 0 HZ2 LYS A 945 -18.788 2.019 -31.187 1.00 2.78 H new ATOM 0 HZ3 LYS A 945 -18.976 3.603 -31.769 1.00 2.78 H new ATOM 2023 N SER A 946 -20.467 -0.939 -25.142 1.00 1.04 N ATOM 2024 CA SER A 946 -21.560 -1.704 -24.560 1.00 1.14 C ATOM 2025 C SER A 946 -21.475 -1.706 -23.033 1.00 1.18 C ATOM 2026 O SER A 946 -22.498 -1.695 -22.345 1.00 1.34 O ATOM 2027 CB SER A 946 -21.542 -3.135 -25.098 1.00 1.15 C ATOM 2028 OG SER A 946 -21.538 -3.145 -26.519 1.00 1.20 O ATOM 0 H SER A 946 -19.785 -1.499 -25.654 1.00 1.04 H new ATOM 0 HA SER A 946 -22.500 -1.231 -24.843 1.00 1.14 H new ATOM 0 HB2 SER A 946 -20.661 -3.657 -24.725 1.00 1.15 H new ATOM 0 HB3 SER A 946 -22.413 -3.677 -24.729 1.00 1.15 H new ATOM 0 HG SER A 946 -20.635 -2.950 -26.845 1.00 1.20 H new ATOM 2034 N ARG A 947 -20.253 -1.706 -22.510 1.00 1.11 N ATOM 2035 CA ARG A 947 -20.033 -1.681 -21.069 1.00 1.21 C ATOM 2036 C ARG A 947 -20.266 -0.279 -20.519 1.00 1.25 C ATOM 2037 O ARG A 947 -21.096 -0.075 -19.628 1.00 1.40 O ATOM 2038 CB ARG A 947 -18.609 -2.140 -20.731 1.00 1.29 C ATOM 2039 CG ARG A 947 -18.294 -3.557 -21.184 1.00 1.48 C ATOM 2040 CD ARG A 947 -17.040 -4.095 -20.516 1.00 1.79 C ATOM 2041 NE ARG A 947 -15.881 -3.220 -20.708 1.00 2.18 N ATOM 2042 CZ ARG A 947 -14.627 -3.662 -20.814 1.00 2.70 C ATOM 2043 NH1 ARG A 947 -14.378 -4.967 -20.843 1.00 2.98 N ATOM 2044 NH2 ARG A 947 -13.623 -2.801 -20.923 1.00 3.53 N ATOM 0 H ARG A 947 -19.398 -1.723 -23.065 1.00 1.11 H new ATOM 0 HA ARG A 947 -20.743 -2.367 -20.606 1.00 1.21 H new ATOM 0 HB2 ARG A 947 -17.898 -1.455 -21.193 1.00 1.29 H new ATOM 0 HB3 ARG A 947 -18.462 -2.073 -19.653 1.00 1.29 H new ATOM 0 HG2 ARG A 947 -19.137 -4.208 -20.954 1.00 1.48 H new ATOM 0 HG3 ARG A 947 -18.165 -3.573 -22.266 1.00 1.48 H new ATOM 0 HD2 ARG A 947 -17.225 -4.218 -19.449 1.00 1.79 H new ATOM 0 HD3 ARG A 947 -16.815 -5.083 -20.916 1.00 1.79 H new ATOM 0 HE ARG A 947 -16.042 -2.214 -20.764 1.00 2.18 H new ATOM 0 HH11 ARG A 947 -15.147 -5.634 -20.784 1.00 2.98 H new ATOM 0 HH12 ARG A 947 -13.418 -5.301 -20.924 1.00 2.98 H new ATOM 0 HH21 ARG A 947 -13.809 -1.798 -20.926 1.00 3.53 H new ATOM 0 HH22 ARG A 947 -12.665 -3.142 -21.004 1.00 3.53 H new ATOM 2058 N ASP A 948 -19.544 0.682 -21.070 1.00 1.23 N ATOM 2059 CA ASP A 948 -19.649 2.066 -20.643 1.00 1.39 C ATOM 2060 C ASP A 948 -19.827 2.977 -21.851 1.00 1.99 C ATOM 2061 O ASP A 948 -19.146 2.828 -22.867 1.00 2.64 O ATOM 2062 CB ASP A 948 -18.423 2.475 -19.806 1.00 1.92 C ATOM 2063 CG ASP A 948 -17.252 2.984 -20.630 1.00 2.20 C ATOM 2064 OD1 ASP A 948 -16.621 2.168 -21.342 1.00 2.57 O ATOM 2065 OD2 ASP A 948 -16.975 4.201 -20.599 1.00 2.50 O ATOM 0 H ASP A 948 -18.872 0.526 -21.822 1.00 1.23 H new ATOM 0 HA ASP A 948 -20.528 2.171 -20.007 1.00 1.39 H new ATOM 0 HB2 ASP A 948 -18.721 3.250 -19.100 1.00 1.92 H new ATOM 0 HB3 ASP A 948 -18.095 1.617 -19.219 1.00 1.92 H new ATOM 2070 N SER A 949 -20.766 3.899 -21.745 1.00 2.70 N ATOM 2071 CA SER A 949 -21.101 4.779 -22.848 1.00 3.83 C ATOM 2072 C SER A 949 -20.477 6.154 -22.652 1.00 4.49 C ATOM 2073 O SER A 949 -20.432 6.934 -23.625 1.00 5.09 O ATOM 2074 CB SER A 949 -22.619 4.893 -22.965 1.00 4.60 C ATOM 2075 OG SER A 949 -23.256 3.781 -22.345 1.00 4.44 O ATOM 2076 OXT SER A 949 -20.022 6.446 -21.526 1.00 4.83 O ATOM 0 H SER A 949 -21.314 4.058 -20.899 1.00 2.70 H new ATOM 0 HA SER A 949 -20.700 4.358 -23.770 1.00 3.83 H new ATOM 0 HB2 SER A 949 -22.956 5.818 -22.498 1.00 4.60 H new ATOM 0 HB3 SER A 949 -22.905 4.943 -24.016 1.00 4.60 H new ATOM 0 HG SER A 949 -24.228 3.872 -22.429 1.00 4.44 H new TER 2082 SER A 949