USER MOD reduce.3.24.130724 H: found=0, std=0, add=1073, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1069 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 106 SER OG : rot -128:sc= 0.928 USER MOD Set 1.2: A 108 ASN :FLIP amide:sc= 0.278 F(o=-0.54,f=1.2) USER MOD Set 2.1: A 67 LYS NZ :NH3+ -120:sc= -0.0834 (180deg=-3.06!) USER MOD Set 2.2: A 83 THR OG1 : rot 27:sc= 0.0255 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -136:sc= -0.133 (180deg=-0.955) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 ASN : amide:sc= -0.0241 K(o=-0.024,f=-0.7) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= -0.0137 K(o=-0.014,f=-0.96) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 CYS SG : rot 139:sc= 1.23 USER MOD Single : A 22 GLN : amide:sc= -0.395 K(o=-0.39,f=-1.7!) USER MOD Single : A 24 SER OG : rot 180:sc= 0.00802 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 MET CE :methyl -174:sc= -1.9 (180deg=-2.2) USER MOD Single : A 28 SER OG : rot -80:sc= -1.89 USER MOD Single : A 32 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= -0.767 X(o=-0.77,f=-1.2) USER MOD Single : A 45 THR OG1 : rot 103:sc= 1.22 USER MOD Single : A 47 LYS NZ :NH3+ 161:sc= -0.0415 (180deg=-0.31) USER MOD Single : A 58 MET CE :methyl -139:sc= -3.58! (180deg=-6.73!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 CYS SG : rot -166:sc= 0.862 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot -171:sc= 1.22 USER MOD Single : A 73 HIS :FLIP no HD1:sc= -0.186 F(o=-1.1,f=-0.19) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot -90:sc= -0.311 USER MOD Single : A 85 TYR OH : rot 180:sc= -0.0406 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 CYS SG : rot 52:sc= 1.11 USER MOD Single : A 88 THR OG1 : rot 73:sc= 0.649 USER MOD Single : A 90 ASN : amide:sc= -3.03! C(o=-3!,f=-9!) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 THR OG1 : rot 168:sc= -0.325 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 HIS : no HE2:sc= -0.247 X(o=-0.25,f=-0.31) USER MOD Single : A 100 LYS NZ :NH3+ -117:sc= 0.11 (180deg=0) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 ASN : amide:sc= -0.151 K(o=-0.15,f=-2.1!) USER MOD Single : A 124 ASN : amide:sc= -0.0378 K(o=-0.038,f=-0.94) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 MET CE :methyl -177:sc= -0.724 (180deg=-0.736) USER MOD Single : A 128 THR OG1 : rot 92:sc= 0.374 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.655 1.782 0.146 1.00 2.22 N ATOM 2 CA MET A 1 3.893 1.042 -0.068 1.00 21.42 C ATOM 3 C MET A 1 3.628 -0.460 -0.106 1.00 25.21 C ATOM 4 O MET A 1 2.512 -0.911 0.151 1.00 71.11 O ATOM 5 CB MET A 1 4.903 1.365 1.035 1.00 43.45 C ATOM 6 CG MET A 1 5.244 2.844 1.131 1.00 21.44 C ATOM 7 SD MET A 1 6.467 3.356 -0.091 1.00 15.21 S ATOM 8 CE MET A 1 7.885 3.667 0.958 1.00 14.12 C ATOM 0 H1 MET A 1 2.623 2.599 -0.497 1.00 2.22 H new ATOM 0 H2 MET A 1 1.842 1.161 -0.043 1.00 2.22 H new ATOM 0 H3 MET A 1 2.615 2.115 1.131 1.00 2.22 H new ATOM 0 HA MET A 1 4.307 1.345 -1.030 1.00 21.42 H new ATOM 0 HB2 MET A 1 4.504 1.029 1.992 1.00 43.45 H new ATOM 0 HB3 MET A 1 5.818 0.800 0.856 1.00 43.45 H new ATOM 0 HG2 MET A 1 4.336 3.432 0.998 1.00 21.44 H new ATOM 0 HG3 MET A 1 5.621 3.062 2.130 1.00 21.44 H new ATOM 0 HE1 MET A 1 8.726 3.993 0.346 1.00 14.12 H new ATOM 0 HE2 MET A 1 7.639 4.445 1.681 1.00 14.12 H new ATOM 0 HE3 MET A 1 8.154 2.753 1.487 1.00 14.12 H new ATOM 18 N LYS A 2 4.662 -1.231 -0.428 1.00 51.43 N ATOM 19 CA LYS A 2 4.542 -2.682 -0.499 1.00 42.03 C ATOM 20 C LYS A 2 4.390 -3.284 0.894 1.00 62.21 C ATOM 21 O LYS A 2 4.185 -2.566 1.873 1.00 72.51 O ATOM 22 CB LYS A 2 5.766 -3.282 -1.195 1.00 41.21 C ATOM 23 CG LYS A 2 6.118 -2.597 -2.504 1.00 43.40 C ATOM 24 CD LYS A 2 5.101 -2.909 -3.588 1.00 53.34 C ATOM 25 CE LYS A 2 3.965 -1.897 -3.595 1.00 42.30 C ATOM 26 NZ LYS A 2 3.388 -1.720 -4.956 1.00 52.13 N ATOM 0 H LYS A 2 5.593 -0.874 -0.644 1.00 51.43 H new ATOM 0 HA LYS A 2 3.650 -2.920 -1.078 1.00 42.03 H new ATOM 0 HB2 LYS A 2 6.621 -3.223 -0.522 1.00 41.21 H new ATOM 0 HB3 LYS A 2 5.583 -4.339 -1.386 1.00 41.21 H new ATOM 0 HG2 LYS A 2 6.167 -1.519 -2.350 1.00 43.40 H new ATOM 0 HG3 LYS A 2 7.108 -2.918 -2.829 1.00 43.40 H new ATOM 0 HD2 LYS A 2 5.593 -2.911 -4.560 1.00 53.34 H new ATOM 0 HD3 LYS A 2 4.697 -3.910 -3.433 1.00 53.34 H new ATOM 0 HE2 LYS A 2 3.183 -2.224 -2.909 1.00 42.30 H new ATOM 0 HE3 LYS A 2 4.331 -0.938 -3.228 1.00 42.30 H new ATOM 0 HZ1 LYS A 2 2.617 -1.023 -4.918 1.00 52.13 H new ATOM 0 HZ2 LYS A 2 4.127 -1.384 -5.606 1.00 52.13 H new ATOM 0 HZ3 LYS A 2 3.016 -2.630 -5.296 1.00 52.13 H new ATOM 40 N LYS A 3 4.494 -4.606 0.976 1.00 31.35 N ATOM 41 CA LYS A 3 4.371 -5.306 2.250 1.00 40.22 C ATOM 42 C LYS A 3 5.684 -5.259 3.025 1.00 31.40 C ATOM 43 O LYS A 3 6.583 -6.067 2.791 1.00 44.40 O ATOM 44 CB LYS A 3 3.954 -6.760 2.018 1.00 23.02 C ATOM 45 CG LYS A 3 2.498 -6.919 1.616 1.00 2.23 C ATOM 46 CD LYS A 3 1.979 -8.310 1.940 1.00 12.43 C ATOM 47 CE LYS A 3 0.459 -8.362 1.893 1.00 4.04 C ATOM 48 NZ LYS A 3 -0.065 -9.676 2.358 1.00 2.04 N ATOM 0 H LYS A 3 4.663 -5.215 0.175 1.00 31.35 H new ATOM 0 HA LYS A 3 3.604 -4.805 2.840 1.00 40.22 H new ATOM 0 HB2 LYS A 3 4.586 -7.191 1.241 1.00 23.02 H new ATOM 0 HB3 LYS A 3 4.135 -7.331 2.929 1.00 23.02 H new ATOM 0 HG2 LYS A 3 1.893 -6.174 2.134 1.00 2.23 H new ATOM 0 HG3 LYS A 3 2.392 -6.730 0.548 1.00 2.23 H new ATOM 0 HD2 LYS A 3 2.391 -9.028 1.231 1.00 12.43 H new ATOM 0 HD3 LYS A 3 2.324 -8.607 2.930 1.00 12.43 H new ATOM 0 HE2 LYS A 3 0.049 -7.567 2.515 1.00 4.04 H new ATOM 0 HE3 LYS A 3 0.120 -8.176 0.874 1.00 4.04 H new ATOM 0 HZ1 LYS A 3 -1.104 -9.672 2.311 1.00 2.04 H new ATOM 0 HZ2 LYS A 3 0.306 -10.433 1.749 1.00 2.04 H new ATOM 0 HZ3 LYS A 3 0.237 -9.842 3.339 1.00 2.04 H new ATOM 62 N VAL A 4 5.787 -4.310 3.950 1.00 34.31 N ATOM 63 CA VAL A 4 6.989 -4.161 4.762 1.00 55.33 C ATOM 64 C VAL A 4 7.157 -5.337 5.716 1.00 21.51 C ATOM 65 O VAL A 4 6.469 -5.428 6.734 1.00 44.24 O ATOM 66 CB VAL A 4 6.957 -2.854 5.576 1.00 13.21 C ATOM 67 CG1 VAL A 4 5.645 -2.730 6.336 1.00 21.15 C ATOM 68 CG2 VAL A 4 8.142 -2.790 6.528 1.00 70.45 C ATOM 0 H VAL A 4 5.053 -3.633 4.156 1.00 34.31 H new ATOM 0 HA VAL A 4 7.834 -4.132 4.074 1.00 55.33 H new ATOM 0 HB VAL A 4 7.030 -2.014 4.885 1.00 13.21 H new ATOM 0 HG11 VAL A 4 5.641 -1.800 6.905 1.00 21.15 H new ATOM 0 HG12 VAL A 4 4.814 -2.727 5.630 1.00 21.15 H new ATOM 0 HG13 VAL A 4 5.538 -3.574 7.018 1.00 21.15 H new ATOM 0 HG21 VAL A 4 8.103 -1.860 7.095 1.00 70.45 H new ATOM 0 HG22 VAL A 4 8.103 -3.636 7.215 1.00 70.45 H new ATOM 0 HG23 VAL A 4 9.070 -2.829 5.957 1.00 70.45 H new ATOM 78 N ILE A 5 8.076 -6.237 5.381 1.00 3.43 N ATOM 79 CA ILE A 5 8.336 -7.407 6.210 1.00 65.32 C ATOM 80 C ILE A 5 9.299 -7.075 7.345 1.00 40.32 C ATOM 81 O ILE A 5 10.170 -6.218 7.202 1.00 2.12 O ATOM 82 CB ILE A 5 8.920 -8.566 5.380 1.00 41.12 C ATOM 83 CG1 ILE A 5 8.192 -8.679 4.039 1.00 41.33 C ATOM 84 CG2 ILE A 5 8.823 -9.873 6.153 1.00 41.41 C ATOM 85 CD1 ILE A 5 6.705 -8.919 4.177 1.00 60.02 C ATOM 0 H ILE A 5 8.652 -6.178 4.542 1.00 3.43 H new ATOM 0 HA ILE A 5 7.378 -7.716 6.628 1.00 65.32 H new ATOM 0 HB ILE A 5 9.972 -8.359 5.185 1.00 41.12 H new ATOM 0 HG12 ILE A 5 8.353 -7.764 3.469 1.00 41.33 H new ATOM 0 HG13 ILE A 5 8.631 -9.494 3.464 1.00 41.33 H new ATOM 0 HG21 ILE A 5 9.240 -10.682 5.553 1.00 41.41 H new ATOM 0 HG22 ILE A 5 9.382 -9.787 7.085 1.00 41.41 H new ATOM 0 HG23 ILE A 5 7.778 -10.087 6.375 1.00 41.41 H new ATOM 0 HD11 ILE A 5 6.254 -8.988 3.187 1.00 60.02 H new ATOM 0 HD12 ILE A 5 6.535 -9.849 4.719 1.00 60.02 H new ATOM 0 HD13 ILE A 5 6.252 -8.092 4.725 1.00 60.02 H new ATOM 97 N ASN A 6 9.136 -7.760 8.472 1.00 71.23 N ATOM 98 CA ASN A 6 9.991 -7.539 9.632 1.00 45.52 C ATOM 99 C ASN A 6 10.618 -8.847 10.104 1.00 74.21 C ATOM 100 O ASN A 6 9.953 -9.678 10.724 1.00 4.42 O ATOM 101 CB ASN A 6 9.189 -6.904 10.770 1.00 71.43 C ATOM 102 CG ASN A 6 9.991 -5.871 11.537 1.00 52.44 C ATOM 103 OD1 ASN A 6 9.623 -4.697 11.588 1.00 1.12 O ATOM 104 ND2 ASN A 6 11.093 -6.303 12.137 1.00 64.52 N ATOM 0 H ASN A 6 8.419 -8.473 8.606 1.00 71.23 H new ATOM 0 HA ASN A 6 10.791 -6.860 9.338 1.00 45.52 H new ATOM 0 HB2 ASN A 6 8.294 -6.435 10.362 1.00 71.43 H new ATOM 0 HB3 ASN A 6 8.856 -7.684 11.455 1.00 71.43 H new ATOM 0 HD21 ASN A 6 11.673 -5.653 12.667 1.00 64.52 H new ATOM 0 HD22 ASN A 6 11.360 -7.285 12.068 1.00 64.52 H new ATOM 111 N VAL A 7 11.901 -9.024 9.806 1.00 20.12 N ATOM 112 CA VAL A 7 12.618 -10.230 10.201 1.00 22.53 C ATOM 113 C VAL A 7 13.921 -9.887 10.914 1.00 44.41 C ATOM 114 O VAL A 7 14.479 -8.805 10.724 1.00 33.33 O ATOM 115 CB VAL A 7 12.931 -11.121 8.984 1.00 31.44 C ATOM 116 CG1 VAL A 7 11.678 -11.848 8.518 1.00 4.33 C ATOM 117 CG2 VAL A 7 13.527 -10.292 7.857 1.00 63.51 C ATOM 0 H VAL A 7 12.465 -8.347 9.292 1.00 20.12 H new ATOM 0 HA VAL A 7 11.967 -10.775 10.884 1.00 22.53 H new ATOM 0 HB VAL A 7 13.666 -11.869 9.282 1.00 31.44 H new ATOM 0 HG11 VAL A 7 11.918 -12.473 7.658 1.00 4.33 H new ATOM 0 HG12 VAL A 7 11.299 -12.474 9.326 1.00 4.33 H new ATOM 0 HG13 VAL A 7 10.918 -11.119 8.236 1.00 4.33 H new ATOM 0 HG21 VAL A 7 13.742 -10.937 7.005 1.00 63.51 H new ATOM 0 HG22 VAL A 7 12.817 -9.521 7.558 1.00 63.51 H new ATOM 0 HG23 VAL A 7 14.450 -9.823 8.199 1.00 63.51 H new ATOM 127 N VAL A 8 14.403 -10.814 11.735 1.00 63.41 N ATOM 128 CA VAL A 8 15.643 -10.611 12.475 1.00 14.34 C ATOM 129 C VAL A 8 16.522 -11.855 12.427 1.00 4.23 C ATOM 130 O VAL A 8 16.089 -12.918 11.986 1.00 75.01 O ATOM 131 CB VAL A 8 15.364 -10.249 13.946 1.00 3.35 C ATOM 132 CG1 VAL A 8 14.571 -8.954 14.037 1.00 33.31 C ATOM 133 CG2 VAL A 8 14.630 -11.384 14.644 1.00 4.33 C ATOM 0 H VAL A 8 13.953 -11.714 11.905 1.00 63.41 H new ATOM 0 HA VAL A 8 16.166 -9.783 11.997 1.00 14.34 H new ATOM 0 HB VAL A 8 16.318 -10.098 14.452 1.00 3.35 H new ATOM 0 HG11 VAL A 8 14.384 -8.715 15.084 1.00 33.31 H new ATOM 0 HG12 VAL A 8 15.139 -8.146 13.576 1.00 33.31 H new ATOM 0 HG13 VAL A 8 13.621 -9.072 13.516 1.00 33.31 H new ATOM 0 HG21 VAL A 8 14.441 -11.111 15.682 1.00 4.33 H new ATOM 0 HG22 VAL A 8 13.682 -11.569 14.139 1.00 4.33 H new ATOM 0 HG23 VAL A 8 15.240 -12.286 14.611 1.00 4.33 H new ATOM 143 N GLY A 9 17.763 -11.714 12.885 1.00 33.25 N ATOM 144 CA GLY A 9 18.685 -12.835 12.886 1.00 13.13 C ATOM 145 C GLY A 9 19.304 -13.075 14.249 1.00 74.41 C ATOM 146 O GLY A 9 18.757 -12.656 15.269 1.00 63.41 O ATOM 0 H GLY A 9 18.146 -10.844 13.255 1.00 33.25 H new ATOM 0 HA2 GLY A 9 18.159 -13.734 12.566 1.00 13.13 H new ATOM 0 HA3 GLY A 9 19.476 -12.652 12.158 1.00 13.13 H new ATOM 150 N ALA A 10 20.446 -13.754 14.267 1.00 44.34 N ATOM 151 CA ALA A 10 21.140 -14.049 15.514 1.00 21.11 C ATOM 152 C ALA A 10 22.580 -14.477 15.253 1.00 22.32 C ATOM 153 O ALA A 10 22.838 -15.341 14.415 1.00 64.42 O ATOM 154 CB ALA A 10 20.398 -15.129 16.288 1.00 62.14 C ATOM 0 H ALA A 10 20.910 -14.110 13.432 1.00 44.34 H new ATOM 0 HA ALA A 10 21.162 -13.139 16.113 1.00 21.11 H new ATOM 0 HB1 ALA A 10 20.927 -15.339 17.217 1.00 62.14 H new ATOM 0 HB2 ALA A 10 19.389 -14.786 16.515 1.00 62.14 H new ATOM 0 HB3 ALA A 10 20.346 -16.037 15.687 1.00 62.14 H new ATOM 160 N ILE A 11 23.514 -13.867 15.975 1.00 31.35 N ATOM 161 CA ILE A 11 24.928 -14.187 15.822 1.00 52.54 C ATOM 162 C ILE A 11 25.534 -14.649 17.142 1.00 33.52 C ATOM 163 O ILE A 11 25.930 -13.833 17.975 1.00 72.32 O ATOM 164 CB ILE A 11 25.725 -12.976 15.300 1.00 33.05 C ATOM 165 CG1 ILE A 11 25.261 -11.695 15.996 1.00 10.33 C ATOM 166 CG2 ILE A 11 25.572 -12.851 13.792 1.00 60.00 C ATOM 167 CD1 ILE A 11 26.016 -10.460 15.556 1.00 64.44 C ATOM 0 H ILE A 11 23.317 -13.148 16.672 1.00 31.35 H new ATOM 0 HA ILE A 11 24.991 -14.996 15.094 1.00 52.54 H new ATOM 0 HB ILE A 11 26.780 -13.129 15.527 1.00 33.05 H new ATOM 0 HG12 ILE A 11 24.198 -11.550 15.801 1.00 10.33 H new ATOM 0 HG13 ILE A 11 25.374 -11.815 17.073 1.00 10.33 H new ATOM 0 HG21 ILE A 11 26.141 -11.991 13.439 1.00 60.00 H new ATOM 0 HG22 ILE A 11 25.946 -13.755 13.312 1.00 60.00 H new ATOM 0 HG23 ILE A 11 24.519 -12.717 13.543 1.00 60.00 H new ATOM 0 HD11 ILE A 11 25.634 -9.590 16.090 1.00 64.44 H new ATOM 0 HD12 ILE A 11 27.076 -10.584 15.776 1.00 64.44 H new ATOM 0 HD13 ILE A 11 25.882 -10.315 14.484 1.00 64.44 H new ATOM 179 N ILE A 12 25.604 -15.964 17.326 1.00 42.51 N ATOM 180 CA ILE A 12 26.165 -16.535 18.544 1.00 71.00 C ATOM 181 C ILE A 12 27.684 -16.632 18.457 1.00 2.00 C ATOM 182 O ILE A 12 28.226 -17.257 17.545 1.00 30.11 O ATOM 183 CB ILE A 12 25.588 -17.935 18.827 1.00 53.44 C ATOM 184 CG1 ILE A 12 24.067 -17.862 18.976 1.00 33.32 C ATOM 185 CG2 ILE A 12 26.221 -18.526 20.077 1.00 11.03 C ATOM 186 CD1 ILE A 12 23.317 -18.233 17.715 1.00 3.45 C ATOM 0 H ILE A 12 25.279 -16.653 16.647 1.00 42.51 H new ATOM 0 HA ILE A 12 25.892 -15.866 19.360 1.00 71.00 H new ATOM 0 HB ILE A 12 25.821 -18.586 17.984 1.00 53.44 H new ATOM 0 HG12 ILE A 12 23.757 -18.527 19.782 1.00 33.32 H new ATOM 0 HG13 ILE A 12 23.787 -16.851 19.271 1.00 33.32 H new ATOM 0 HG21 ILE A 12 25.803 -19.515 20.264 1.00 11.03 H new ATOM 0 HG22 ILE A 12 27.299 -18.608 19.935 1.00 11.03 H new ATOM 0 HG23 ILE A 12 26.016 -17.879 20.930 1.00 11.03 H new ATOM 0 HD11 ILE A 12 22.244 -18.159 17.894 1.00 3.45 H new ATOM 0 HD12 ILE A 12 23.598 -17.553 16.911 1.00 3.45 H new ATOM 0 HD13 ILE A 12 23.567 -19.255 17.430 1.00 3.45 H new ATOM 198 N PHE A 13 28.367 -16.011 19.413 1.00 51.41 N ATOM 199 CA PHE A 13 29.825 -16.027 19.445 1.00 32.33 C ATOM 200 C PHE A 13 30.334 -16.954 20.546 1.00 53.32 C ATOM 201 O PHE A 13 29.854 -16.912 21.679 1.00 53.15 O ATOM 202 CB PHE A 13 30.367 -14.613 19.662 1.00 24.11 C ATOM 203 CG PHE A 13 30.141 -13.699 18.492 1.00 4.53 C ATOM 204 CD1 PHE A 13 28.873 -13.223 18.203 1.00 73.24 C ATOM 205 CD2 PHE A 13 31.198 -13.315 17.682 1.00 11.51 C ATOM 206 CE1 PHE A 13 28.661 -12.381 17.127 1.00 23.01 C ATOM 207 CE2 PHE A 13 30.993 -12.472 16.606 1.00 73.43 C ATOM 208 CZ PHE A 13 29.723 -12.006 16.327 1.00 33.10 C ATOM 0 H PHE A 13 27.934 -15.490 20.176 1.00 51.41 H new ATOM 0 HA PHE A 13 30.181 -16.401 18.485 1.00 32.33 H new ATOM 0 HB2 PHE A 13 29.895 -14.183 20.545 1.00 24.11 H new ATOM 0 HB3 PHE A 13 31.436 -14.670 19.868 1.00 24.11 H new ATOM 0 HD1 PHE A 13 28.040 -13.513 18.826 1.00 73.24 H new ATOM 0 HD2 PHE A 13 32.193 -13.678 17.894 1.00 11.51 H new ATOM 0 HE1 PHE A 13 27.667 -12.017 16.912 1.00 23.01 H new ATOM 0 HE2 PHE A 13 31.825 -12.178 15.984 1.00 73.43 H new ATOM 0 HZ PHE A 13 29.561 -11.350 15.485 1.00 33.10 H new ATOM 218 N SER A 14 31.309 -17.790 20.203 1.00 15.23 N ATOM 219 CA SER A 14 31.880 -18.730 21.160 1.00 64.21 C ATOM 220 C SER A 14 33.331 -19.047 20.809 1.00 30.22 C ATOM 221 O SER A 14 33.654 -19.336 19.657 1.00 74.12 O ATOM 222 CB SER A 14 31.058 -20.020 21.193 1.00 2.12 C ATOM 223 OG SER A 14 30.675 -20.414 19.887 1.00 23.41 O ATOM 0 H SER A 14 31.720 -17.835 19.270 1.00 15.23 H new ATOM 0 HA SER A 14 31.855 -18.267 22.146 1.00 64.21 H new ATOM 0 HB2 SER A 14 31.641 -20.814 21.660 1.00 2.12 H new ATOM 0 HB3 SER A 14 30.170 -19.873 21.807 1.00 2.12 H new ATOM 0 HG SER A 14 30.152 -21.242 19.935 1.00 23.41 H new ATOM 229 N ASP A 15 34.201 -18.991 21.811 1.00 10.05 N ATOM 230 CA ASP A 15 35.618 -19.273 21.611 1.00 53.11 C ATOM 231 C ASP A 15 36.175 -18.456 20.449 1.00 21.23 C ATOM 232 O ASP A 15 37.016 -18.934 19.689 1.00 21.12 O ATOM 233 CB ASP A 15 35.831 -20.765 21.350 1.00 12.23 C ATOM 234 CG ASP A 15 35.722 -21.595 22.614 1.00 12.34 C ATOM 235 OD1 ASP A 15 36.016 -21.058 23.703 1.00 71.41 O ATOM 236 OD2 ASP A 15 35.343 -22.781 22.515 1.00 3.10 O ATOM 0 H ASP A 15 33.950 -18.753 22.771 1.00 10.05 H new ATOM 0 HA ASP A 15 36.151 -18.991 22.519 1.00 53.11 H new ATOM 0 HB2 ASP A 15 35.095 -21.113 20.626 1.00 12.23 H new ATOM 0 HB3 ASP A 15 36.814 -20.916 20.903 1.00 12.23 H new ATOM 241 N ASN A 16 35.699 -17.222 20.318 1.00 23.11 N ATOM 242 CA ASN A 16 36.149 -16.339 19.248 1.00 60.41 C ATOM 243 C ASN A 16 35.787 -16.913 17.881 1.00 12.13 C ATOM 244 O ASN A 16 36.548 -16.789 16.922 1.00 64.52 O ATOM 245 CB ASN A 16 37.661 -16.123 19.338 1.00 20.32 C ATOM 246 CG ASN A 16 38.107 -15.735 20.735 1.00 41.34 C ATOM 247 OD1 ASN A 16 38.343 -16.594 21.585 1.00 53.45 O ATOM 248 ND2 ASN A 16 38.225 -14.434 20.978 1.00 72.55 N ATOM 0 H ASN A 16 35.002 -16.811 20.939 1.00 23.11 H new ATOM 0 HA ASN A 16 35.644 -15.380 19.366 1.00 60.41 H new ATOM 0 HB2 ASN A 16 38.174 -17.036 19.036 1.00 20.32 H new ATOM 0 HB3 ASN A 16 37.957 -15.344 18.636 1.00 20.32 H new ATOM 0 HD21 ASN A 16 38.522 -14.112 21.899 1.00 72.55 H new ATOM 0 HD22 ASN A 16 38.019 -13.757 20.243 1.00 72.55 H new ATOM 255 N LYS A 17 34.618 -17.540 17.800 1.00 64.30 N ATOM 256 CA LYS A 17 34.152 -18.132 16.551 1.00 3.15 C ATOM 257 C LYS A 17 32.670 -17.847 16.334 1.00 14.15 C ATOM 258 O LYS A 17 32.027 -17.194 17.157 1.00 32.23 O ATOM 259 CB LYS A 17 34.397 -19.643 16.557 1.00 52.45 C ATOM 260 CG LYS A 17 35.746 -20.042 15.985 1.00 70.42 C ATOM 261 CD LYS A 17 36.798 -20.168 17.074 1.00 31.31 C ATOM 262 CE LYS A 17 38.028 -20.912 16.577 1.00 21.35 C ATOM 263 NZ LYS A 17 37.816 -22.386 16.560 1.00 34.12 N ATOM 0 H LYS A 17 33.976 -17.651 18.585 1.00 64.30 H new ATOM 0 HA LYS A 17 34.714 -17.682 15.732 1.00 3.15 H new ATOM 0 HB2 LYS A 17 34.322 -20.011 17.580 1.00 52.45 H new ATOM 0 HB3 LYS A 17 33.610 -20.133 15.984 1.00 52.45 H new ATOM 0 HG2 LYS A 17 35.652 -20.991 15.457 1.00 70.42 H new ATOM 0 HG3 LYS A 17 36.066 -19.300 15.253 1.00 70.42 H new ATOM 0 HD2 LYS A 17 37.087 -19.175 17.419 1.00 31.31 H new ATOM 0 HD3 LYS A 17 36.375 -20.693 17.931 1.00 31.31 H new ATOM 0 HE2 LYS A 17 38.278 -20.570 15.573 1.00 21.35 H new ATOM 0 HE3 LYS A 17 38.879 -20.675 17.216 1.00 21.35 H new ATOM 0 HZ1 LYS A 17 38.677 -22.857 16.215 1.00 34.12 H new ATOM 0 HZ2 LYS A 17 37.602 -22.717 17.522 1.00 34.12 H new ATOM 0 HZ3 LYS A 17 37.021 -22.615 15.930 1.00 34.12 H new ATOM 277 N ILE A 18 32.133 -18.341 15.224 1.00 62.11 N ATOM 278 CA ILE A 18 30.726 -18.141 14.901 1.00 31.24 C ATOM 279 C ILE A 18 30.068 -19.449 14.475 1.00 64.41 C ATOM 280 O ILE A 18 30.721 -20.332 13.916 1.00 42.32 O ATOM 281 CB ILE A 18 30.548 -17.101 13.780 1.00 15.30 C ATOM 282 CG1 ILE A 18 31.344 -15.834 14.099 1.00 52.31 C ATOM 283 CG2 ILE A 18 29.074 -16.773 13.591 1.00 71.11 C ATOM 284 CD1 ILE A 18 31.320 -14.809 12.986 1.00 23.22 C ATOM 0 H ILE A 18 32.651 -18.883 14.533 1.00 62.11 H new ATOM 0 HA ILE A 18 30.244 -17.773 15.807 1.00 31.24 H new ATOM 0 HB ILE A 18 30.929 -17.522 12.850 1.00 15.30 H new ATOM 0 HG12 ILE A 18 30.944 -15.382 15.007 1.00 52.31 H new ATOM 0 HG13 ILE A 18 32.378 -16.107 14.308 1.00 52.31 H new ATOM 0 HG21 ILE A 18 28.964 -16.036 12.795 1.00 71.11 H new ATOM 0 HG22 ILE A 18 28.531 -17.679 13.324 1.00 71.11 H new ATOM 0 HG23 ILE A 18 28.670 -16.368 14.519 1.00 71.11 H new ATOM 0 HD11 ILE A 18 31.904 -13.938 13.281 1.00 23.22 H new ATOM 0 HD12 ILE A 18 31.747 -15.243 12.082 1.00 23.22 H new ATOM 0 HD13 ILE A 18 30.291 -14.507 12.792 1.00 23.22 H new ATOM 296 N LEU A 19 28.772 -19.568 14.741 1.00 43.34 N ATOM 297 CA LEU A 19 28.024 -20.768 14.383 1.00 43.13 C ATOM 298 C LEU A 19 27.420 -20.637 12.988 1.00 33.24 C ATOM 299 O LEU A 19 27.301 -19.534 12.453 1.00 21.24 O ATOM 300 CB LEU A 19 26.919 -21.029 15.408 1.00 43.32 C ATOM 301 CG LEU A 19 25.583 -20.334 15.145 1.00 35.30 C ATOM 302 CD1 LEU A 19 24.553 -20.748 16.185 1.00 11.51 C ATOM 303 CD2 LEU A 19 25.759 -18.823 15.138 1.00 41.13 C ATOM 0 H LEU A 19 28.217 -18.848 15.204 1.00 43.34 H new ATOM 0 HA LEU A 19 28.715 -21.611 14.382 1.00 43.13 H new ATOM 0 HB2 LEU A 19 26.743 -22.104 15.458 1.00 43.32 H new ATOM 0 HB3 LEU A 19 27.280 -20.719 16.389 1.00 43.32 H new ATOM 0 HG LEU A 19 25.223 -20.641 14.163 1.00 35.30 H new ATOM 0 HD11 LEU A 19 23.608 -20.244 15.982 1.00 11.51 H new ATOM 0 HD12 LEU A 19 24.405 -21.827 16.141 1.00 11.51 H new ATOM 0 HD13 LEU A 19 24.907 -20.470 17.178 1.00 11.51 H new ATOM 0 HD21 LEU A 19 24.797 -18.346 14.949 1.00 41.13 H new ATOM 0 HD22 LEU A 19 26.143 -18.497 16.105 1.00 41.13 H new ATOM 0 HD23 LEU A 19 26.463 -18.542 14.355 1.00 41.13 H new ATOM 315 N CYS A 20 27.037 -21.769 12.407 1.00 45.53 N ATOM 316 CA CYS A 20 26.443 -21.781 11.075 1.00 42.54 C ATOM 317 C CYS A 20 25.101 -22.504 11.085 1.00 72.43 C ATOM 318 O CYS A 20 24.943 -23.532 11.743 1.00 4.02 O ATOM 319 CB CYS A 20 27.390 -22.450 10.077 1.00 11.13 C ATOM 320 SG CYS A 20 26.605 -22.925 8.519 1.00 41.50 S ATOM 0 H CYS A 20 27.127 -22.689 12.837 1.00 45.53 H new ATOM 0 HA CYS A 20 26.276 -20.748 10.769 1.00 42.54 H new ATOM 0 HB2 CYS A 20 28.215 -21.770 9.863 1.00 11.13 H new ATOM 0 HB3 CYS A 20 27.820 -23.338 10.540 1.00 11.13 H new ATOM 0 HG CYS A 20 27.404 -22.653 7.530 1.00 41.50 H new ATOM 326 N ALA A 21 24.135 -21.960 10.351 1.00 4.03 N ATOM 327 CA ALA A 21 22.806 -22.554 10.276 1.00 44.15 C ATOM 328 C ALA A 21 22.258 -22.493 8.854 1.00 41.01 C ATOM 329 O ALA A 21 22.562 -21.567 8.102 1.00 74.42 O ATOM 330 CB ALA A 21 21.860 -21.854 11.239 1.00 54.41 C ATOM 0 H ALA A 21 24.248 -21.109 9.800 1.00 4.03 H new ATOM 0 HA ALA A 21 22.886 -23.603 10.562 1.00 44.15 H new ATOM 0 HB1 ALA A 21 20.871 -22.308 11.172 1.00 54.41 H new ATOM 0 HB2 ALA A 21 22.237 -21.954 12.257 1.00 54.41 H new ATOM 0 HB3 ALA A 21 21.792 -20.798 10.979 1.00 54.41 H new ATOM 336 N GLN A 22 21.451 -23.485 8.493 1.00 34.00 N ATOM 337 CA GLN A 22 20.862 -23.544 7.160 1.00 13.34 C ATOM 338 C GLN A 22 19.348 -23.367 7.226 1.00 43.33 C ATOM 339 O GLN A 22 18.611 -24.324 7.461 1.00 62.31 O ATOM 340 CB GLN A 22 21.203 -24.874 6.487 1.00 31.22 C ATOM 341 CG GLN A 22 20.833 -24.923 5.013 1.00 1.25 C ATOM 342 CD GLN A 22 21.861 -25.660 4.178 1.00 73.40 C ATOM 343 OE1 GLN A 22 22.251 -26.783 4.501 1.00 13.22 O ATOM 344 NE2 GLN A 22 22.306 -25.032 3.096 1.00 75.31 N ATOM 0 H GLN A 22 21.190 -24.259 9.104 1.00 34.00 H new ATOM 0 HA GLN A 22 21.280 -22.729 6.569 1.00 13.34 H new ATOM 0 HB2 GLN A 22 22.272 -25.061 6.591 1.00 31.22 H new ATOM 0 HB3 GLN A 22 20.686 -25.679 7.010 1.00 31.22 H new ATOM 0 HG2 GLN A 22 19.864 -25.409 4.902 1.00 1.25 H new ATOM 0 HG3 GLN A 22 20.725 -23.906 4.635 1.00 1.25 H new ATOM 0 HE21 GLN A 22 21.956 -24.102 2.866 1.00 75.31 H new ATOM 0 HE22 GLN A 22 22.998 -25.479 2.495 1.00 75.31 H new ATOM 353 N ARG A 23 18.892 -22.136 7.017 1.00 71.24 N ATOM 354 CA ARG A 23 17.466 -21.834 7.053 1.00 2.45 C ATOM 355 C ARG A 23 16.808 -22.152 5.714 1.00 1.11 C ATOM 356 O ARG A 23 17.407 -22.798 4.855 1.00 63.23 O ATOM 357 CB ARG A 23 17.244 -20.362 7.406 1.00 44.43 C ATOM 358 CG ARG A 23 16.248 -20.149 8.533 1.00 15.41 C ATOM 359 CD ARG A 23 16.929 -20.176 9.892 1.00 3.22 C ATOM 360 NE ARG A 23 15.969 -20.320 10.983 1.00 23.33 N ATOM 361 CZ ARG A 23 15.291 -21.437 11.222 1.00 13.00 C ATOM 362 NH1 ARG A 23 15.466 -22.501 10.451 1.00 63.12 N ATOM 363 NH2 ARG A 23 14.435 -21.491 12.234 1.00 13.04 N ATOM 0 H ARG A 23 19.489 -21.332 6.821 1.00 71.24 H new ATOM 0 HA ARG A 23 17.007 -22.458 7.820 1.00 2.45 H new ATOM 0 HB2 ARG A 23 18.198 -19.917 7.687 1.00 44.43 H new ATOM 0 HB3 ARG A 23 16.895 -19.833 6.519 1.00 44.43 H new ATOM 0 HG2 ARG A 23 15.743 -19.193 8.397 1.00 15.41 H new ATOM 0 HG3 ARG A 23 15.482 -20.923 8.494 1.00 15.41 H new ATOM 0 HD2 ARG A 23 17.641 -21.001 9.924 1.00 3.22 H new ATOM 0 HD3 ARG A 23 17.499 -19.257 10.030 1.00 3.22 H new ATOM 0 HE ARG A 23 15.810 -19.519 11.595 1.00 23.33 H new ATOM 0 HH11 ARG A 23 16.123 -22.464 9.672 1.00 63.12 H new ATOM 0 HH12 ARG A 23 14.944 -23.357 10.637 1.00 63.12 H new ATOM 0 HH21 ARG A 23 14.297 -20.674 12.829 1.00 13.04 H new ATOM 0 HH22 ARG A 23 13.915 -22.349 12.417 1.00 13.04 H new ATOM 377 N SER A 24 15.572 -21.694 5.544 1.00 11.13 N ATOM 378 CA SER A 24 14.831 -21.933 4.312 1.00 75.44 C ATOM 379 C SER A 24 15.423 -21.132 3.157 1.00 44.13 C ATOM 380 O SER A 24 15.958 -20.041 3.355 1.00 73.33 O ATOM 381 CB SER A 24 13.357 -21.567 4.498 1.00 0.33 C ATOM 382 OG SER A 24 12.912 -21.890 5.804 1.00 25.43 O ATOM 0 H SER A 24 15.063 -21.155 6.244 1.00 11.13 H new ATOM 0 HA SER A 24 14.907 -22.994 4.073 1.00 75.44 H new ATOM 0 HB2 SER A 24 13.218 -20.501 4.316 1.00 0.33 H new ATOM 0 HB3 SER A 24 12.752 -22.097 3.763 1.00 0.33 H new ATOM 0 HG SER A 24 11.968 -21.645 5.898 1.00 25.43 H new ATOM 388 N GLU A 25 15.324 -21.682 1.951 1.00 43.05 N ATOM 389 CA GLU A 25 15.852 -21.019 0.764 1.00 55.14 C ATOM 390 C GLU A 25 14.843 -20.018 0.206 1.00 22.24 C ATOM 391 O GLU A 25 15.101 -19.352 -0.796 1.00 61.14 O ATOM 392 CB GLU A 25 16.208 -22.051 -0.308 1.00 50.13 C ATOM 393 CG GLU A 25 17.172 -21.528 -1.360 1.00 21.01 C ATOM 394 CD GLU A 25 17.125 -22.331 -2.645 1.00 52.24 C ATOM 395 OE1 GLU A 25 17.550 -21.799 -3.692 1.00 44.12 O ATOM 396 OE2 GLU A 25 16.662 -23.490 -2.605 1.00 43.11 O ATOM 0 H GLU A 25 14.884 -22.584 1.770 1.00 43.05 H new ATOM 0 HA GLU A 25 16.754 -20.479 1.052 1.00 55.14 H new ATOM 0 HB2 GLU A 25 16.647 -22.925 0.173 1.00 50.13 H new ATOM 0 HB3 GLU A 25 15.293 -22.383 -0.799 1.00 50.13 H new ATOM 0 HG2 GLU A 25 16.936 -20.486 -1.578 1.00 21.01 H new ATOM 0 HG3 GLU A 25 18.186 -21.548 -0.960 1.00 21.01 H new ATOM 403 N LYS A 26 13.693 -19.918 0.864 1.00 72.23 N ATOM 404 CA LYS A 26 12.644 -18.999 0.437 1.00 64.34 C ATOM 405 C LYS A 26 12.974 -17.568 0.848 1.00 24.12 C ATOM 406 O LYS A 26 12.796 -16.632 0.069 1.00 25.04 O ATOM 407 CB LYS A 26 11.298 -19.416 1.034 1.00 4.42 C ATOM 408 CG LYS A 26 10.802 -20.762 0.535 1.00 13.45 C ATOM 409 CD LYS A 26 10.308 -20.677 -0.899 1.00 62.21 C ATOM 410 CE LYS A 26 8.933 -20.032 -0.978 1.00 60.15 C ATOM 411 NZ LYS A 26 8.254 -20.330 -2.270 1.00 43.11 N ATOM 0 H LYS A 26 13.464 -20.462 1.696 1.00 72.23 H new ATOM 0 HA LYS A 26 12.580 -19.040 -0.650 1.00 64.34 H new ATOM 0 HB2 LYS A 26 11.387 -19.451 2.120 1.00 4.42 H new ATOM 0 HB3 LYS A 26 10.554 -18.654 0.799 1.00 4.42 H new ATOM 0 HG2 LYS A 26 11.606 -21.495 0.601 1.00 13.45 H new ATOM 0 HG3 LYS A 26 9.996 -21.115 1.178 1.00 13.45 H new ATOM 0 HD2 LYS A 26 11.016 -20.101 -1.495 1.00 62.21 H new ATOM 0 HD3 LYS A 26 10.267 -21.677 -1.331 1.00 62.21 H new ATOM 0 HE2 LYS A 26 8.317 -20.389 -0.153 1.00 60.15 H new ATOM 0 HE3 LYS A 26 9.031 -18.953 -0.859 1.00 60.15 H new ATOM 0 HZ1 LYS A 26 7.320 -19.873 -2.285 1.00 43.11 H new ATOM 0 HZ2 LYS A 26 8.830 -19.967 -3.056 1.00 43.11 H new ATOM 0 HZ3 LYS A 26 8.138 -21.358 -2.372 1.00 43.11 H new ATOM 425 N MET A 27 13.457 -17.407 2.076 1.00 50.41 N ATOM 426 CA MET A 27 13.814 -16.089 2.589 1.00 64.11 C ATOM 427 C MET A 27 15.168 -15.643 2.045 1.00 12.30 C ATOM 428 O MET A 27 15.243 -14.763 1.188 1.00 41.42 O ATOM 429 CB MET A 27 13.846 -16.105 4.118 1.00 23.23 C ATOM 430 CG MET A 27 12.515 -15.746 4.758 1.00 71.11 C ATOM 431 SD MET A 27 12.112 -13.997 4.588 1.00 3.23 S ATOM 432 CE MET A 27 13.479 -13.248 5.471 1.00 50.30 C ATOM 0 H MET A 27 13.610 -18.172 2.733 1.00 50.41 H new ATOM 0 HA MET A 27 13.057 -15.379 2.256 1.00 64.11 H new ATOM 0 HB2 MET A 27 14.147 -17.097 4.456 1.00 23.23 H new ATOM 0 HB3 MET A 27 14.607 -15.406 4.465 1.00 23.23 H new ATOM 0 HG2 MET A 27 11.725 -16.343 4.303 1.00 71.11 H new ATOM 0 HG3 MET A 27 12.543 -16.007 5.816 1.00 71.11 H new ATOM 0 HE1 MET A 27 13.318 -12.173 5.547 1.00 50.30 H new ATOM 0 HE2 MET A 27 13.545 -13.676 6.471 1.00 50.30 H new ATOM 0 HE3 MET A 27 14.408 -13.439 4.933 1.00 50.30 H new ATOM 442 N SER A 28 16.234 -16.255 2.549 1.00 24.12 N ATOM 443 CA SER A 28 17.585 -15.917 2.117 1.00 64.44 C ATOM 444 C SER A 28 18.196 -17.056 1.305 1.00 43.41 C ATOM 445 O SER A 28 17.488 -17.941 0.825 1.00 72.53 O ATOM 446 CB SER A 28 18.469 -15.607 3.327 1.00 74.43 C ATOM 447 OG SER A 28 18.784 -16.788 4.044 1.00 72.32 O ATOM 0 H SER A 28 16.189 -16.988 3.257 1.00 24.12 H new ATOM 0 HA SER A 28 17.526 -15.032 1.483 1.00 64.44 H new ATOM 0 HB2 SER A 28 19.388 -15.123 2.996 1.00 74.43 H new ATOM 0 HB3 SER A 28 17.958 -14.904 3.985 1.00 74.43 H new ATOM 0 HG SER A 28 18.029 -17.033 4.619 1.00 72.32 H new ATOM 453 N LEU A 29 19.516 -17.025 1.156 1.00 70.23 N ATOM 454 CA LEU A 29 20.225 -18.054 0.402 1.00 13.13 C ATOM 455 C LEU A 29 21.189 -18.821 1.302 1.00 54.12 C ATOM 456 O LEU A 29 22.409 -18.717 1.177 1.00 40.21 O ATOM 457 CB LEU A 29 20.989 -17.424 -0.764 1.00 32.42 C ATOM 458 CG LEU A 29 21.348 -15.946 -0.611 1.00 53.10 C ATOM 459 CD1 LEU A 29 20.093 -15.087 -0.633 1.00 31.00 C ATOM 460 CD2 LEU A 29 22.130 -15.717 0.674 1.00 64.23 C ATOM 0 H LEU A 29 20.117 -16.299 1.547 1.00 70.23 H new ATOM 0 HA LEU A 29 19.488 -18.755 0.009 1.00 13.13 H new ATOM 0 HB2 LEU A 29 21.910 -17.987 -0.915 1.00 32.42 H new ATOM 0 HB3 LEU A 29 20.392 -17.540 -1.669 1.00 32.42 H new ATOM 0 HG LEU A 29 21.977 -15.656 -1.452 1.00 53.10 H new ATOM 0 HD11 LEU A 29 20.368 -14.038 -0.523 1.00 31.00 H new ATOM 0 HD12 LEU A 29 19.572 -15.228 -1.580 1.00 31.00 H new ATOM 0 HD13 LEU A 29 19.438 -15.378 0.188 1.00 31.00 H new ATOM 0 HD21 LEU A 29 22.377 -14.659 0.766 1.00 64.23 H new ATOM 0 HD22 LEU A 29 21.526 -16.024 1.527 1.00 64.23 H new ATOM 0 HD23 LEU A 29 23.049 -16.303 0.650 1.00 64.23 H new ATOM 472 N PRO A 30 20.630 -19.612 2.230 1.00 70.13 N ATOM 473 CA PRO A 30 21.422 -20.415 3.167 1.00 51.44 C ATOM 474 C PRO A 30 22.143 -21.567 2.477 1.00 70.55 C ATOM 475 O PRO A 30 22.848 -22.346 3.120 1.00 73.42 O ATOM 476 CB PRO A 30 20.376 -20.949 4.148 1.00 11.01 C ATOM 477 CG PRO A 30 19.101 -20.954 3.377 1.00 10.25 C ATOM 478 CD PRO A 30 19.182 -19.785 2.435 1.00 1.34 C ATOM 0 HA PRO A 30 22.210 -19.830 3.640 1.00 51.44 H new ATOM 0 HB2 PRO A 30 20.633 -21.950 4.495 1.00 11.01 H new ATOM 0 HB3 PRO A 30 20.302 -20.315 5.032 1.00 11.01 H new ATOM 0 HG2 PRO A 30 18.980 -21.889 2.829 1.00 10.25 H new ATOM 0 HG3 PRO A 30 18.242 -20.860 4.042 1.00 10.25 H new ATOM 0 HD2 PRO A 30 18.665 -19.988 1.497 1.00 1.34 H new ATOM 0 HD3 PRO A 30 18.727 -18.892 2.863 1.00 1.34 H new ATOM 486 N LEU A 31 21.963 -21.671 1.164 1.00 1.14 N ATOM 487 CA LEU A 31 22.598 -22.729 0.386 1.00 35.33 C ATOM 488 C LEU A 31 24.090 -22.808 0.690 1.00 43.05 C ATOM 489 O LEU A 31 24.683 -23.886 0.663 1.00 70.22 O ATOM 490 CB LEU A 31 22.381 -22.490 -1.109 1.00 2.40 C ATOM 491 CG LEU A 31 20.935 -22.265 -1.550 1.00 55.03 C ATOM 492 CD1 LEU A 31 20.846 -22.181 -3.066 1.00 51.52 C ATOM 493 CD2 LEU A 31 20.038 -23.375 -1.023 1.00 35.32 C ATOM 0 H LEU A 31 21.383 -21.036 0.617 1.00 1.14 H new ATOM 0 HA LEU A 31 22.139 -23.677 0.666 1.00 35.33 H new ATOM 0 HB2 LEU A 31 22.970 -21.622 -1.407 1.00 2.40 H new ATOM 0 HB3 LEU A 31 22.777 -23.347 -1.655 1.00 2.40 H new ATOM 0 HG LEU A 31 20.592 -21.318 -1.133 1.00 55.03 H new ATOM 0 HD11 LEU A 31 19.809 -22.021 -3.361 1.00 51.52 H new ATOM 0 HD12 LEU A 31 21.457 -21.351 -3.421 1.00 51.52 H new ATOM 0 HD13 LEU A 31 21.208 -23.111 -3.504 1.00 51.52 H new ATOM 0 HD21 LEU A 31 19.012 -23.198 -1.347 1.00 35.32 H new ATOM 0 HD22 LEU A 31 20.381 -24.334 -1.410 1.00 35.32 H new ATOM 0 HD23 LEU A 31 20.078 -23.388 0.066 1.00 35.32 H new ATOM 505 N MET A 32 24.691 -21.659 0.980 1.00 43.32 N ATOM 506 CA MET A 32 26.115 -21.599 1.292 1.00 54.42 C ATOM 507 C MET A 32 26.335 -21.233 2.756 1.00 21.43 C ATOM 508 O MET A 32 27.106 -21.887 3.459 1.00 0.01 O ATOM 509 CB MET A 32 26.814 -20.580 0.389 1.00 32.22 C ATOM 510 CG MET A 32 26.089 -19.247 0.302 1.00 51.11 C ATOM 511 SD MET A 32 26.830 -18.131 -0.905 1.00 3.03 S ATOM 512 CE MET A 32 25.639 -16.793 -0.905 1.00 64.10 C ATOM 0 H MET A 32 24.215 -20.757 1.006 1.00 43.32 H new ATOM 0 HA MET A 32 26.543 -22.586 1.114 1.00 54.42 H new ATOM 0 HB2 MET A 32 27.825 -20.411 0.760 1.00 32.22 H new ATOM 0 HB3 MET A 32 26.908 -20.999 -0.613 1.00 32.22 H new ATOM 0 HG2 MET A 32 25.046 -19.422 0.037 1.00 51.11 H new ATOM 0 HG3 MET A 32 26.094 -18.771 1.282 1.00 51.11 H new ATOM 0 HE1 MET A 32 25.959 -16.021 -1.605 1.00 64.10 H new ATOM 0 HE2 MET A 32 24.663 -17.174 -1.206 1.00 64.10 H new ATOM 0 HE3 MET A 32 25.569 -16.368 0.096 1.00 64.10 H new ATOM 522 N TRP A 33 25.655 -20.187 3.209 1.00 14.31 N ATOM 523 CA TRP A 33 25.777 -19.735 4.591 1.00 62.15 C ATOM 524 C TRP A 33 24.536 -18.962 5.022 1.00 3.54 C ATOM 525 O TRP A 33 23.798 -18.440 4.188 1.00 43.35 O ATOM 526 CB TRP A 33 27.021 -18.860 4.754 1.00 23.52 C ATOM 527 CG TRP A 33 28.293 -19.560 4.378 1.00 55.40 C ATOM 528 CD1 TRP A 33 29.055 -19.333 3.268 1.00 51.22 C ATOM 529 CD2 TRP A 33 28.948 -20.600 5.111 1.00 33.14 C ATOM 530 NE1 TRP A 33 30.145 -20.170 3.267 1.00 54.31 N ATOM 531 CE2 TRP A 33 30.102 -20.956 4.387 1.00 24.45 C ATOM 532 CE3 TRP A 33 28.673 -21.264 6.310 1.00 53.11 C ATOM 533 CZ2 TRP A 33 30.978 -21.947 4.824 1.00 71.22 C ATOM 534 CZ3 TRP A 33 29.542 -22.247 6.741 1.00 24.33 C ATOM 535 CH2 TRP A 33 30.684 -22.581 6.000 1.00 0.15 C ATOM 0 H TRP A 33 25.013 -19.635 2.640 1.00 14.31 H new ATOM 0 HA TRP A 33 25.874 -20.614 5.228 1.00 62.15 H new ATOM 0 HB2 TRP A 33 26.911 -17.966 4.140 1.00 23.52 H new ATOM 0 HB3 TRP A 33 27.090 -18.528 5.790 1.00 23.52 H new ATOM 0 HD1 TRP A 33 28.834 -18.603 2.503 1.00 51.22 H new ATOM 0 HE1 TRP A 33 30.868 -20.201 2.549 1.00 54.31 H new ATOM 0 HE3 TRP A 33 27.797 -21.013 6.889 1.00 53.11 H new ATOM 0 HZ2 TRP A 33 31.858 -22.206 4.254 1.00 71.22 H new ATOM 0 HZ3 TRP A 33 29.338 -22.767 7.665 1.00 24.33 H new ATOM 0 HH2 TRP A 33 31.345 -23.354 6.365 1.00 0.15 H new ATOM 546 N GLU A 34 24.313 -18.892 6.331 1.00 3.21 N ATOM 547 CA GLU A 34 23.160 -18.182 6.872 1.00 3.40 C ATOM 548 C GLU A 34 23.171 -18.209 8.398 1.00 72.43 C ATOM 549 O GLU A 34 23.998 -18.884 9.012 1.00 74.12 O ATOM 550 CB GLU A 34 21.862 -18.799 6.349 1.00 54.43 C ATOM 551 CG GLU A 34 20.963 -17.807 5.630 1.00 52.41 C ATOM 552 CD GLU A 34 19.950 -17.160 6.555 1.00 4.13 C ATOM 553 OE1 GLU A 34 20.048 -15.935 6.779 1.00 30.45 O ATOM 554 OE2 GLU A 34 19.060 -17.879 7.055 1.00 61.20 O ATOM 0 H GLU A 34 24.915 -19.318 7.036 1.00 3.21 H new ATOM 0 HA GLU A 34 23.218 -17.144 6.544 1.00 3.40 H new ATOM 0 HB2 GLU A 34 22.106 -19.615 5.669 1.00 54.43 H new ATOM 0 HB3 GLU A 34 21.314 -19.234 7.185 1.00 54.43 H new ATOM 0 HG2 GLU A 34 21.577 -17.032 5.171 1.00 52.41 H new ATOM 0 HG3 GLU A 34 20.438 -18.317 4.823 1.00 52.41 H new ATOM 561 N PHE A 35 22.247 -17.471 9.003 1.00 33.15 N ATOM 562 CA PHE A 35 22.150 -17.409 10.457 1.00 33.22 C ATOM 563 C PHE A 35 20.762 -17.835 10.928 1.00 23.43 C ATOM 564 O PHE A 35 19.792 -17.826 10.171 1.00 72.42 O ATOM 565 CB PHE A 35 22.455 -15.993 10.950 1.00 24.31 C ATOM 566 CG PHE A 35 23.920 -15.733 11.155 1.00 64.11 C ATOM 567 CD1 PHE A 35 24.549 -14.683 10.505 1.00 15.11 C ATOM 568 CD2 PHE A 35 24.669 -16.539 11.997 1.00 65.10 C ATOM 569 CE1 PHE A 35 25.897 -14.440 10.692 1.00 75.53 C ATOM 570 CE2 PHE A 35 26.018 -16.301 12.188 1.00 75.33 C ATOM 571 CZ PHE A 35 26.632 -15.252 11.533 1.00 1.54 C ATOM 0 H PHE A 35 21.555 -16.907 8.510 1.00 33.15 H new ATOM 0 HA PHE A 35 22.884 -18.098 10.875 1.00 33.22 H new ATOM 0 HB2 PHE A 35 22.064 -15.274 10.230 1.00 24.31 H new ATOM 0 HB3 PHE A 35 21.929 -15.823 11.889 1.00 24.31 H new ATOM 0 HD1 PHE A 35 23.979 -14.047 9.844 1.00 15.11 H new ATOM 0 HD2 PHE A 35 24.194 -17.362 12.510 1.00 65.10 H new ATOM 0 HE1 PHE A 35 26.374 -13.617 10.181 1.00 75.53 H new ATOM 0 HE2 PHE A 35 26.591 -16.935 12.849 1.00 75.33 H new ATOM 0 HZ PHE A 35 27.686 -15.067 11.678 1.00 1.54 H new ATOM 581 N PRO A 36 20.665 -18.219 12.210 1.00 41.30 N ATOM 582 CA PRO A 36 19.402 -18.656 12.812 1.00 50.21 C ATOM 583 C PRO A 36 18.411 -17.509 12.978 1.00 43.52 C ATOM 584 O PRO A 36 18.784 -16.338 12.905 1.00 72.32 O ATOM 585 CB PRO A 36 19.829 -19.196 14.179 1.00 13.32 C ATOM 586 CG PRO A 36 21.097 -18.479 14.491 1.00 51.44 C ATOM 587 CD PRO A 36 21.781 -18.254 13.170 1.00 32.44 C ATOM 0 HA PRO A 36 18.887 -19.389 12.191 1.00 50.21 H new ATOM 0 HB2 PRO A 36 19.069 -19.003 14.936 1.00 13.32 H new ATOM 0 HB3 PRO A 36 19.982 -20.275 14.148 1.00 13.32 H new ATOM 0 HG2 PRO A 36 20.897 -17.532 14.993 1.00 51.44 H new ATOM 0 HG3 PRO A 36 21.724 -19.068 15.160 1.00 51.44 H new ATOM 0 HD2 PRO A 36 22.346 -17.322 13.164 1.00 32.44 H new ATOM 0 HD3 PRO A 36 22.484 -19.055 12.940 1.00 32.44 H new ATOM 595 N GLY A 37 17.147 -17.852 13.202 1.00 75.31 N ATOM 596 CA GLY A 37 16.122 -16.839 13.375 1.00 31.20 C ATOM 597 C GLY A 37 14.816 -17.215 12.704 1.00 33.22 C ATOM 598 O GLY A 37 14.598 -18.376 12.361 1.00 34.42 O ATOM 0 H GLY A 37 16.814 -18.814 13.267 1.00 75.31 H new ATOM 0 HA2 GLY A 37 15.948 -16.681 14.439 1.00 31.20 H new ATOM 0 HA3 GLY A 37 16.478 -15.893 12.966 1.00 31.20 H new ATOM 602 N GLY A 38 13.943 -16.230 12.518 1.00 55.21 N ATOM 603 CA GLY A 38 12.661 -16.484 11.886 1.00 11.13 C ATOM 604 C GLY A 38 11.994 -15.214 11.396 1.00 44.13 C ATOM 605 O GLY A 38 12.532 -14.513 10.538 1.00 74.13 O ATOM 0 H GLY A 38 14.100 -15.261 12.794 1.00 55.21 H new ATOM 0 HA2 GLY A 38 12.802 -17.164 11.046 1.00 11.13 H new ATOM 0 HA3 GLY A 38 12.003 -16.986 12.595 1.00 11.13 H new ATOM 609 N LYS A 39 10.819 -14.916 11.940 1.00 63.33 N ATOM 610 CA LYS A 39 10.077 -13.722 11.553 1.00 70.42 C ATOM 611 C LYS A 39 9.709 -12.890 12.777 1.00 60.01 C ATOM 612 O LYS A 39 9.778 -13.369 13.909 1.00 13.41 O ATOM 613 CB LYS A 39 8.810 -14.110 10.787 1.00 30.41 C ATOM 614 CG LYS A 39 7.817 -14.905 11.617 1.00 30.23 C ATOM 615 CD LYS A 39 6.442 -14.927 10.972 1.00 54.32 C ATOM 616 CE LYS A 39 6.433 -15.769 9.705 1.00 24.25 C ATOM 617 NZ LYS A 39 6.181 -17.207 9.998 1.00 74.33 N ATOM 0 H LYS A 39 10.360 -15.485 12.651 1.00 63.33 H new ATOM 0 HA LYS A 39 10.716 -13.121 10.906 1.00 70.42 H new ATOM 0 HB2 LYS A 39 8.324 -13.205 10.423 1.00 30.41 H new ATOM 0 HB3 LYS A 39 9.090 -14.696 9.911 1.00 30.41 H new ATOM 0 HG2 LYS A 39 8.179 -15.926 11.739 1.00 30.23 H new ATOM 0 HG3 LYS A 39 7.745 -14.471 12.614 1.00 30.23 H new ATOM 0 HD2 LYS A 39 5.714 -15.324 11.679 1.00 54.32 H new ATOM 0 HD3 LYS A 39 6.134 -13.909 10.735 1.00 54.32 H new ATOM 0 HE2 LYS A 39 5.666 -15.396 9.027 1.00 24.25 H new ATOM 0 HE3 LYS A 39 7.389 -15.665 9.193 1.00 24.25 H new ATOM 0 HZ1 LYS A 39 6.182 -17.748 9.110 1.00 74.33 H new ATOM 0 HZ2 LYS A 39 6.927 -17.569 10.625 1.00 74.33 H new ATOM 0 HZ3 LYS A 39 5.257 -17.310 10.464 1.00 74.33 H new ATOM 631 N VAL A 40 9.317 -11.642 12.542 1.00 11.21 N ATOM 632 CA VAL A 40 8.935 -10.744 13.625 1.00 4.35 C ATOM 633 C VAL A 40 7.581 -10.098 13.353 1.00 22.42 C ATOM 634 O VAL A 40 7.244 -9.801 12.208 1.00 41.21 O ATOM 635 CB VAL A 40 9.986 -9.637 13.834 1.00 64.32 C ATOM 636 CG1 VAL A 40 9.577 -8.719 14.975 1.00 34.22 C ATOM 637 CG2 VAL A 40 11.356 -10.246 14.094 1.00 70.21 C ATOM 0 H VAL A 40 9.256 -11.230 11.611 1.00 11.21 H new ATOM 0 HA VAL A 40 8.870 -11.350 14.529 1.00 4.35 H new ATOM 0 HB VAL A 40 10.045 -9.040 12.924 1.00 64.32 H new ATOM 0 HG11 VAL A 40 10.332 -7.944 15.107 1.00 34.22 H new ATOM 0 HG12 VAL A 40 8.618 -8.256 14.743 1.00 34.22 H new ATOM 0 HG13 VAL A 40 9.487 -9.298 15.894 1.00 34.22 H new ATOM 0 HG21 VAL A 40 12.086 -9.450 14.239 1.00 70.21 H new ATOM 0 HG22 VAL A 40 11.314 -10.868 14.988 1.00 70.21 H new ATOM 0 HG23 VAL A 40 11.650 -10.857 13.241 1.00 70.21 H new ATOM 647 N GLU A 41 6.810 -9.885 14.414 1.00 14.44 N ATOM 648 CA GLU A 41 5.491 -9.274 14.289 1.00 62.31 C ATOM 649 C GLU A 41 5.607 -7.768 14.071 1.00 23.43 C ATOM 650 O GLU A 41 6.564 -7.136 14.520 1.00 32.31 O ATOM 651 CB GLU A 41 4.653 -9.557 15.537 1.00 31.23 C ATOM 652 CG GLU A 41 4.520 -11.036 15.859 1.00 71.21 C ATOM 653 CD GLU A 41 3.867 -11.821 14.738 1.00 54.43 C ATOM 654 OE1 GLU A 41 2.664 -12.135 14.855 1.00 20.44 O ATOM 655 OE2 GLU A 41 4.559 -12.119 13.742 1.00 72.41 O ATOM 0 H GLU A 41 7.075 -10.126 15.369 1.00 14.44 H new ATOM 0 HA GLU A 41 4.997 -9.712 13.422 1.00 62.31 H new ATOM 0 HB2 GLU A 41 5.102 -9.047 16.389 1.00 31.23 H new ATOM 0 HB3 GLU A 41 3.658 -9.133 15.400 1.00 31.23 H new ATOM 0 HG2 GLU A 41 5.508 -11.450 16.060 1.00 71.21 H new ATOM 0 HG3 GLU A 41 3.933 -11.154 16.770 1.00 71.21 H new ATOM 662 N LYS A 42 4.626 -7.199 13.379 1.00 64.43 N ATOM 663 CA LYS A 42 4.616 -5.768 13.101 1.00 71.13 C ATOM 664 C LYS A 42 4.448 -4.965 14.387 1.00 64.32 C ATOM 665 O LYS A 42 5.013 -3.882 14.531 1.00 24.12 O ATOM 666 CB LYS A 42 3.489 -5.426 12.123 1.00 45.11 C ATOM 667 CG LYS A 42 2.113 -5.841 12.612 1.00 73.44 C ATOM 668 CD LYS A 42 1.265 -4.636 12.981 1.00 53.12 C ATOM 669 CE LYS A 42 -0.213 -4.898 12.736 1.00 74.11 C ATOM 670 NZ LYS A 42 -0.972 -3.636 12.516 1.00 43.51 N ATOM 0 H LYS A 42 3.827 -7.707 13.000 1.00 64.43 H new ATOM 0 HA LYS A 42 5.573 -5.504 12.651 1.00 71.13 H new ATOM 0 HB2 LYS A 42 3.492 -4.351 11.940 1.00 45.11 H new ATOM 0 HB3 LYS A 42 3.688 -5.912 11.168 1.00 45.11 H new ATOM 0 HG2 LYS A 42 1.609 -6.418 11.836 1.00 73.44 H new ATOM 0 HG3 LYS A 42 2.216 -6.494 13.479 1.00 73.44 H new ATOM 0 HD2 LYS A 42 1.422 -4.387 14.030 1.00 53.12 H new ATOM 0 HD3 LYS A 42 1.584 -3.773 12.397 1.00 53.12 H new ATOM 0 HE2 LYS A 42 -0.328 -5.547 11.867 1.00 74.11 H new ATOM 0 HE3 LYS A 42 -0.634 -5.430 13.589 1.00 74.11 H new ATOM 0 HZ1 LYS A 42 -1.975 -3.858 12.353 1.00 43.51 H new ATOM 0 HZ2 LYS A 42 -0.884 -3.027 13.355 1.00 43.51 H new ATOM 0 HZ3 LYS A 42 -0.588 -3.140 11.687 1.00 43.51 H new ATOM 684 N ASN A 43 3.669 -5.505 15.319 1.00 44.02 N ATOM 685 CA ASN A 43 3.429 -4.839 16.594 1.00 53.45 C ATOM 686 C ASN A 43 4.614 -5.023 17.536 1.00 30.43 C ATOM 687 O ASN A 43 4.962 -4.120 18.295 1.00 1.42 O ATOM 688 CB ASN A 43 2.155 -5.382 17.244 1.00 23.35 C ATOM 689 CG ASN A 43 0.900 -4.939 16.518 1.00 61.42 C ATOM 690 OD1 ASN A 43 0.134 -5.764 16.019 1.00 65.41 O ATOM 691 ND2 ASN A 43 0.684 -3.631 16.455 1.00 53.31 N ATOM 0 H ASN A 43 3.194 -6.401 15.215 1.00 44.02 H new ATOM 0 HA ASN A 43 3.305 -3.773 16.402 1.00 53.45 H new ATOM 0 HB2 ASN A 43 2.196 -6.471 17.262 1.00 23.35 H new ATOM 0 HB3 ASN A 43 2.109 -5.048 18.280 1.00 23.35 H new ATOM 0 HD21 ASN A 43 -0.144 -3.273 15.979 1.00 53.31 H new ATOM 0 HD22 ASN A 43 1.346 -2.984 16.883 1.00 53.31 H new ATOM 698 N GLU A 44 5.229 -6.201 17.481 1.00 44.51 N ATOM 699 CA GLU A 44 6.375 -6.503 18.330 1.00 23.32 C ATOM 700 C GLU A 44 7.666 -5.974 17.711 1.00 20.42 C ATOM 701 O GLU A 44 7.811 -5.931 16.489 1.00 74.30 O ATOM 702 CB GLU A 44 6.486 -8.013 18.556 1.00 2.52 C ATOM 703 CG GLU A 44 7.507 -8.396 19.614 1.00 30.22 C ATOM 704 CD GLU A 44 7.039 -9.544 20.488 1.00 55.41 C ATOM 705 OE1 GLU A 44 7.029 -9.380 21.726 1.00 14.01 O ATOM 706 OE2 GLU A 44 6.682 -10.605 19.934 1.00 3.43 O ATOM 0 H GLU A 44 4.953 -6.960 16.858 1.00 44.51 H new ATOM 0 HA GLU A 44 6.224 -6.009 19.290 1.00 23.32 H new ATOM 0 HB2 GLU A 44 5.510 -8.401 18.848 1.00 2.52 H new ATOM 0 HB3 GLU A 44 6.752 -8.494 17.615 1.00 2.52 H new ATOM 0 HG2 GLU A 44 8.442 -8.673 19.128 1.00 30.22 H new ATOM 0 HG3 GLU A 44 7.718 -7.530 20.241 1.00 30.22 H new ATOM 713 N THR A 45 8.603 -5.572 18.564 1.00 10.32 N ATOM 714 CA THR A 45 9.881 -5.044 18.103 1.00 73.11 C ATOM 715 C THR A 45 10.880 -6.167 17.848 1.00 34.00 C ATOM 716 O THR A 45 10.620 -7.325 18.172 1.00 22.41 O ATOM 717 CB THR A 45 10.483 -4.059 19.122 1.00 14.44 C ATOM 718 OG1 THR A 45 9.444 -3.497 19.933 1.00 42.03 O ATOM 719 CG2 THR A 45 11.240 -2.944 18.416 1.00 61.52 C ATOM 0 H THR A 45 8.501 -5.602 19.578 1.00 10.32 H new ATOM 0 HA THR A 45 9.686 -4.516 17.170 1.00 73.11 H new ATOM 0 HB THR A 45 11.182 -4.607 19.754 1.00 14.44 H new ATOM 0 HG1 THR A 45 9.448 -3.927 20.814 1.00 42.03 H new ATOM 0 HG21 THR A 45 11.656 -2.261 19.157 1.00 61.52 H new ATOM 0 HG22 THR A 45 12.048 -3.372 17.823 1.00 61.52 H new ATOM 0 HG23 THR A 45 10.559 -2.399 17.762 1.00 61.52 H new ATOM 727 N GLU A 46 12.022 -5.816 17.266 1.00 2.12 N ATOM 728 CA GLU A 46 13.060 -6.796 16.968 1.00 33.23 C ATOM 729 C GLU A 46 13.469 -7.555 18.227 1.00 34.43 C ATOM 730 O GLU A 46 13.360 -8.780 18.291 1.00 64.24 O ATOM 731 CB GLU A 46 14.281 -6.108 16.355 1.00 62.51 C ATOM 732 CG GLU A 46 14.009 -5.480 14.999 1.00 53.51 C ATOM 733 CD GLU A 46 13.495 -4.057 15.108 1.00 4.12 C ATOM 734 OE1 GLU A 46 13.380 -3.553 16.245 1.00 45.33 O ATOM 735 OE2 GLU A 46 13.209 -3.448 14.056 1.00 11.22 O ATOM 0 H GLU A 46 12.252 -4.861 16.992 1.00 2.12 H new ATOM 0 HA GLU A 46 12.655 -7.509 16.250 1.00 33.23 H new ATOM 0 HB2 GLU A 46 14.634 -5.336 17.039 1.00 62.51 H new ATOM 0 HB3 GLU A 46 15.085 -6.837 16.254 1.00 62.51 H new ATOM 0 HG2 GLU A 46 14.925 -5.487 14.409 1.00 53.51 H new ATOM 0 HG3 GLU A 46 13.279 -6.086 14.462 1.00 53.51 H new ATOM 742 N LYS A 47 13.940 -6.819 19.228 1.00 34.21 N ATOM 743 CA LYS A 47 14.365 -7.420 20.487 1.00 73.43 C ATOM 744 C LYS A 47 13.202 -8.134 21.169 1.00 50.10 C ATOM 745 O LYS A 47 13.303 -9.309 21.520 1.00 31.53 O ATOM 746 CB LYS A 47 14.938 -6.350 21.419 1.00 60.43 C ATOM 747 CG LYS A 47 16.419 -6.090 21.207 1.00 4.02 C ATOM 748 CD LYS A 47 17.271 -6.901 22.169 1.00 21.13 C ATOM 749 CE LYS A 47 18.717 -6.430 22.167 1.00 42.14 C ATOM 750 NZ LYS A 47 18.856 -5.061 22.737 1.00 74.30 N ATOM 0 H LYS A 47 14.037 -5.804 19.192 1.00 34.21 H new ATOM 0 HA LYS A 47 15.140 -8.154 20.267 1.00 73.43 H new ATOM 0 HB2 LYS A 47 14.389 -5.420 21.271 1.00 60.43 H new ATOM 0 HB3 LYS A 47 14.775 -6.655 22.453 1.00 60.43 H new ATOM 0 HG2 LYS A 47 16.690 -6.339 20.181 1.00 4.02 H new ATOM 0 HG3 LYS A 47 16.626 -5.028 21.342 1.00 4.02 H new ATOM 0 HD2 LYS A 47 16.862 -6.819 23.176 1.00 21.13 H new ATOM 0 HD3 LYS A 47 17.230 -7.955 21.893 1.00 21.13 H new ATOM 0 HE2 LYS A 47 19.326 -7.127 22.743 1.00 42.14 H new ATOM 0 HE3 LYS A 47 19.100 -6.439 21.147 1.00 42.14 H new ATOM 0 HZ1 LYS A 47 19.845 -4.900 23.017 1.00 74.30 H new ATOM 0 HZ2 LYS A 47 18.579 -4.358 22.022 1.00 74.30 H new ATOM 0 HZ3 LYS A 47 18.241 -4.968 23.570 1.00 74.30 H new ATOM 764 N ASP A 48 12.099 -7.416 21.352 1.00 21.40 N ATOM 765 CA ASP A 48 10.916 -7.982 21.990 1.00 70.01 C ATOM 766 C ASP A 48 10.484 -9.268 21.291 1.00 3.35 C ATOM 767 O ASP A 48 9.883 -10.148 21.906 1.00 24.14 O ATOM 768 CB ASP A 48 9.770 -6.970 21.976 1.00 14.30 C ATOM 769 CG ASP A 48 10.189 -5.613 22.506 1.00 0.23 C ATOM 770 OD1 ASP A 48 11.251 -5.533 23.159 1.00 42.35 O ATOM 771 OD2 ASP A 48 9.456 -4.631 22.268 1.00 15.34 O ATOM 0 H ASP A 48 12.000 -6.441 21.068 1.00 21.40 H new ATOM 0 HA ASP A 48 11.169 -8.219 23.023 1.00 70.01 H new ATOM 0 HB2 ASP A 48 9.399 -6.860 20.957 1.00 14.30 H new ATOM 0 HB3 ASP A 48 8.944 -7.352 22.576 1.00 14.30 H new ATOM 776 N ALA A 49 10.794 -9.368 20.003 1.00 41.20 N ATOM 777 CA ALA A 49 10.439 -10.546 19.221 1.00 1.32 C ATOM 778 C ALA A 49 11.495 -11.637 19.362 1.00 12.15 C ATOM 779 O ALA A 49 11.174 -12.826 19.391 1.00 14.23 O ATOM 780 CB ALA A 49 10.256 -10.172 17.758 1.00 71.24 C ATOM 0 H ALA A 49 11.290 -8.647 19.479 1.00 41.20 H new ATOM 0 HA ALA A 49 9.497 -10.937 19.605 1.00 1.32 H new ATOM 0 HB1 ALA A 49 9.991 -11.061 17.186 1.00 71.24 H new ATOM 0 HB2 ALA A 49 9.460 -9.432 17.668 1.00 71.24 H new ATOM 0 HB3 ALA A 49 11.185 -9.754 17.370 1.00 71.24 H new ATOM 786 N LEU A 50 12.755 -11.226 19.450 1.00 62.44 N ATOM 787 CA LEU A 50 13.859 -12.170 19.587 1.00 3.23 C ATOM 788 C LEU A 50 13.849 -12.823 20.966 1.00 73.14 C ATOM 789 O LEU A 50 14.081 -14.025 21.095 1.00 23.42 O ATOM 790 CB LEU A 50 15.195 -11.460 19.357 1.00 15.33 C ATOM 791 CG LEU A 50 15.705 -11.441 17.916 1.00 10.41 C ATOM 792 CD1 LEU A 50 17.002 -10.653 17.820 1.00 43.23 C ATOM 793 CD2 LEU A 50 15.901 -12.859 17.401 1.00 54.03 C ATOM 0 H LEU A 50 13.038 -10.246 19.429 1.00 62.44 H new ATOM 0 HA LEU A 50 13.734 -12.949 18.835 1.00 3.23 H new ATOM 0 HB2 LEU A 50 15.100 -10.430 19.701 1.00 15.33 H new ATOM 0 HB3 LEU A 50 15.950 -11.937 19.982 1.00 15.33 H new ATOM 0 HG LEU A 50 14.958 -10.950 17.293 1.00 10.41 H new ATOM 0 HD11 LEU A 50 17.350 -10.650 16.787 1.00 43.23 H new ATOM 0 HD12 LEU A 50 16.830 -9.628 18.148 1.00 43.23 H new ATOM 0 HD13 LEU A 50 17.757 -11.116 18.456 1.00 43.23 H new ATOM 0 HD21 LEU A 50 16.264 -12.826 16.374 1.00 54.03 H new ATOM 0 HD22 LEU A 50 16.628 -13.376 18.027 1.00 54.03 H new ATOM 0 HD23 LEU A 50 14.951 -13.392 17.433 1.00 54.03 H new ATOM 805 N ILE A 51 13.575 -12.024 21.991 1.00 3.13 N ATOM 806 CA ILE A 51 13.531 -12.525 23.359 1.00 31.52 C ATOM 807 C ILE A 51 12.634 -13.754 23.465 1.00 13.15 C ATOM 808 O ILE A 51 12.872 -14.640 24.287 1.00 55.42 O ATOM 809 CB ILE A 51 13.026 -11.449 24.338 1.00 53.45 C ATOM 810 CG1 ILE A 51 13.287 -11.879 25.783 1.00 54.44 C ATOM 811 CG2 ILE A 51 11.544 -11.186 24.117 1.00 54.13 C ATOM 812 CD1 ILE A 51 12.861 -10.849 26.806 1.00 42.24 C ATOM 0 H ILE A 51 13.380 -11.027 21.900 1.00 3.13 H new ATOM 0 HA ILE A 51 14.552 -12.798 23.628 1.00 31.52 H new ATOM 0 HB ILE A 51 13.571 -10.524 24.151 1.00 53.45 H new ATOM 0 HG12 ILE A 51 12.758 -12.812 25.977 1.00 54.44 H new ATOM 0 HG13 ILE A 51 14.351 -12.084 25.906 1.00 54.44 H new ATOM 0 HG21 ILE A 51 11.202 -10.423 24.816 1.00 54.13 H new ATOM 0 HG22 ILE A 51 11.384 -10.840 23.096 1.00 54.13 H new ATOM 0 HG23 ILE A 51 10.983 -12.106 24.280 1.00 54.13 H new ATOM 0 HD11 ILE A 51 13.076 -11.221 27.808 1.00 42.24 H new ATOM 0 HD12 ILE A 51 13.408 -9.921 26.638 1.00 42.24 H new ATOM 0 HD13 ILE A 51 11.792 -10.662 26.710 1.00 42.24 H new ATOM 824 N ARG A 52 11.603 -13.801 22.628 1.00 31.20 N ATOM 825 CA ARG A 52 10.670 -14.922 22.627 1.00 0.41 C ATOM 826 C ARG A 52 11.222 -16.088 21.813 1.00 24.34 C ATOM 827 O ARG A 52 11.270 -17.222 22.290 1.00 52.31 O ATOM 828 CB ARG A 52 9.317 -14.486 22.061 1.00 63.11 C ATOM 829 CG ARG A 52 8.313 -14.080 23.127 1.00 31.10 C ATOM 830 CD ARG A 52 8.721 -12.785 23.812 1.00 35.10 C ATOM 831 NE ARG A 52 7.564 -12.031 24.289 1.00 45.21 N ATOM 832 CZ ARG A 52 6.866 -12.362 25.369 1.00 11.42 C ATOM 833 NH1 ARG A 52 7.205 -13.428 26.081 1.00 13.51 N ATOM 834 NH2 ARG A 52 5.826 -11.625 25.740 1.00 62.03 N ATOM 0 H ARG A 52 11.392 -13.076 21.942 1.00 31.20 H new ATOM 0 HA ARG A 52 10.536 -15.252 23.657 1.00 0.41 H new ATOM 0 HB2 ARG A 52 9.470 -13.648 21.381 1.00 63.11 H new ATOM 0 HB3 ARG A 52 8.899 -15.303 21.472 1.00 63.11 H new ATOM 0 HG2 ARG A 52 7.329 -13.959 22.674 1.00 31.10 H new ATOM 0 HG3 ARG A 52 8.227 -14.874 23.869 1.00 31.10 H new ATOM 0 HD2 ARG A 52 9.378 -13.010 24.652 1.00 35.10 H new ATOM 0 HD3 ARG A 52 9.292 -12.171 23.116 1.00 35.10 H new ATOM 0 HE ARG A 52 7.277 -11.205 23.764 1.00 45.21 H new ATOM 0 HH11 ARG A 52 8.004 -13.996 25.800 1.00 13.51 H new ATOM 0 HH12 ARG A 52 6.667 -13.680 26.910 1.00 13.51 H new ATOM 0 HH21 ARG A 52 5.563 -10.804 25.195 1.00 62.03 H new ATOM 0 HH22 ARG A 52 5.290 -11.880 26.570 1.00 62.03 H new ATOM 848 N GLU A 53 11.638 -15.801 20.584 1.00 71.24 N ATOM 849 CA GLU A 53 12.185 -16.827 19.704 1.00 23.30 C ATOM 850 C GLU A 53 13.284 -17.618 20.408 1.00 3.22 C ATOM 851 O GLU A 53 13.207 -18.841 20.523 1.00 71.41 O ATOM 852 CB GLU A 53 12.737 -16.193 18.426 1.00 63.14 C ATOM 853 CG GLU A 53 13.537 -17.156 17.565 1.00 64.32 C ATOM 854 CD GLU A 53 13.680 -16.678 16.133 1.00 62.21 C ATOM 855 OE1 GLU A 53 14.408 -15.689 15.907 1.00 63.32 O ATOM 856 OE2 GLU A 53 13.064 -17.294 15.238 1.00 15.13 O ATOM 0 H GLU A 53 11.607 -14.867 20.175 1.00 71.24 H new ATOM 0 HA GLU A 53 11.379 -17.512 19.442 1.00 23.30 H new ATOM 0 HB2 GLU A 53 11.908 -15.797 17.839 1.00 63.14 H new ATOM 0 HB3 GLU A 53 13.370 -15.347 18.694 1.00 63.14 H new ATOM 0 HG2 GLU A 53 14.527 -17.289 18.000 1.00 64.32 H new ATOM 0 HG3 GLU A 53 13.052 -18.132 17.571 1.00 64.32 H new ATOM 863 N ILE A 54 14.306 -16.910 20.877 1.00 3.11 N ATOM 864 CA ILE A 54 15.420 -17.545 21.570 1.00 5.42 C ATOM 865 C ILE A 54 14.935 -18.345 22.774 1.00 71.12 C ATOM 866 O ILE A 54 15.617 -19.257 23.242 1.00 71.25 O ATOM 867 CB ILE A 54 16.455 -16.506 22.042 1.00 0.12 C ATOM 868 CG1 ILE A 54 16.976 -15.696 20.853 1.00 30.11 C ATOM 869 CG2 ILE A 54 17.603 -17.193 22.766 1.00 64.23 C ATOM 870 CD1 ILE A 54 17.835 -14.518 21.255 1.00 43.34 C ATOM 0 H ILE A 54 14.386 -15.897 20.790 1.00 3.11 H new ATOM 0 HA ILE A 54 15.893 -18.219 20.856 1.00 5.42 H new ATOM 0 HB ILE A 54 15.970 -15.822 22.738 1.00 0.12 H new ATOM 0 HG12 ILE A 54 17.554 -16.352 20.202 1.00 30.11 H new ATOM 0 HG13 ILE A 54 16.129 -15.335 20.270 1.00 30.11 H new ATOM 0 HG21 ILE A 54 18.326 -16.446 23.093 1.00 64.23 H new ATOM 0 HG22 ILE A 54 17.217 -17.729 23.633 1.00 64.23 H new ATOM 0 HG23 ILE A 54 18.089 -17.897 22.091 1.00 64.23 H new ATOM 0 HD11 ILE A 54 18.169 -13.990 20.362 1.00 43.34 H new ATOM 0 HD12 ILE A 54 17.254 -13.841 21.881 1.00 43.34 H new ATOM 0 HD13 ILE A 54 18.702 -14.873 21.812 1.00 43.34 H new ATOM 882 N ARG A 55 13.752 -17.999 23.270 1.00 55.25 N ATOM 883 CA ARG A 55 13.174 -18.686 24.419 1.00 52.55 C ATOM 884 C ARG A 55 12.447 -19.955 23.984 1.00 12.22 C ATOM 885 O ARG A 55 12.476 -20.967 24.683 1.00 74.32 O ATOM 886 CB ARG A 55 12.208 -17.760 25.160 1.00 55.10 C ATOM 887 CG ARG A 55 11.993 -18.143 26.615 1.00 33.11 C ATOM 888 CD ARG A 55 12.984 -17.439 27.529 1.00 70.34 C ATOM 889 NE ARG A 55 12.469 -16.162 28.015 1.00 33.30 N ATOM 890 CZ ARG A 55 13.180 -15.315 28.750 1.00 0.21 C ATOM 891 NH1 ARG A 55 14.430 -15.607 29.081 1.00 21.03 N ATOM 892 NH2 ARG A 55 12.641 -14.172 29.155 1.00 41.21 N ATOM 0 H ARG A 55 13.175 -17.247 22.894 1.00 55.25 H new ATOM 0 HA ARG A 55 13.986 -18.965 25.091 1.00 52.55 H new ATOM 0 HB2 ARG A 55 12.589 -16.740 25.114 1.00 55.10 H new ATOM 0 HB3 ARG A 55 11.247 -17.765 24.646 1.00 55.10 H new ATOM 0 HG2 ARG A 55 10.976 -17.887 26.913 1.00 33.11 H new ATOM 0 HG3 ARG A 55 12.096 -19.222 26.727 1.00 33.11 H new ATOM 0 HD2 ARG A 55 13.215 -18.083 28.377 1.00 70.34 H new ATOM 0 HD3 ARG A 55 13.918 -17.272 26.992 1.00 70.34 H new ATOM 0 HE ARG A 55 11.511 -15.907 27.777 1.00 33.30 H new ATOM 0 HH11 ARG A 55 14.848 -16.484 28.771 1.00 21.03 H new ATOM 0 HH12 ARG A 55 14.974 -14.954 29.646 1.00 21.03 H new ATOM 0 HH21 ARG A 55 11.680 -13.943 28.902 1.00 41.21 H new ATOM 0 HH22 ARG A 55 13.188 -13.522 29.720 1.00 41.21 H new ATOM 906 N GLU A 56 11.796 -19.891 22.827 1.00 72.31 N ATOM 907 CA GLU A 56 11.060 -21.035 22.301 1.00 25.40 C ATOM 908 C GLU A 56 11.924 -21.839 21.333 1.00 40.11 C ATOM 909 O GLU A 56 12.220 -23.009 21.574 1.00 2.42 O ATOM 910 CB GLU A 56 9.784 -20.570 21.597 1.00 1.22 C ATOM 911 CG GLU A 56 8.657 -21.588 21.644 1.00 63.11 C ATOM 912 CD GLU A 56 7.498 -21.218 20.739 1.00 3.50 C ATOM 913 OE1 GLU A 56 7.747 -20.616 19.673 1.00 4.44 O ATOM 914 OE2 GLU A 56 6.343 -21.529 21.096 1.00 40.10 O ATOM 0 H GLU A 56 11.763 -19.060 22.236 1.00 72.31 H new ATOM 0 HA GLU A 56 10.790 -21.677 23.139 1.00 25.40 H new ATOM 0 HB2 GLU A 56 9.443 -19.642 22.056 1.00 1.22 H new ATOM 0 HB3 GLU A 56 10.015 -20.344 20.556 1.00 1.22 H new ATOM 0 HG2 GLU A 56 9.043 -22.565 21.353 1.00 63.11 H new ATOM 0 HG3 GLU A 56 8.298 -21.680 22.669 1.00 63.11 H new ATOM 921 N GLU A 57 12.324 -21.202 20.237 1.00 54.43 N ATOM 922 CA GLU A 57 13.152 -21.858 19.232 1.00 53.54 C ATOM 923 C GLU A 57 14.430 -22.410 19.856 1.00 40.42 C ATOM 924 O GLU A 57 14.649 -23.620 19.878 1.00 25.31 O ATOM 925 CB GLU A 57 13.501 -20.879 18.109 1.00 51.34 C ATOM 926 CG GLU A 57 12.442 -20.796 17.022 1.00 12.43 C ATOM 927 CD GLU A 57 11.032 -20.799 17.581 1.00 70.14 C ATOM 928 OE1 GLU A 57 10.345 -21.834 17.452 1.00 11.21 O ATOM 929 OE2 GLU A 57 10.616 -19.766 18.147 1.00 61.35 O ATOM 0 H GLU A 57 12.088 -20.233 20.023 1.00 54.43 H new ATOM 0 HA GLU A 57 12.583 -22.689 18.816 1.00 53.54 H new ATOM 0 HB2 GLU A 57 13.649 -19.887 18.536 1.00 51.34 H new ATOM 0 HB3 GLU A 57 14.448 -21.178 17.660 1.00 51.34 H new ATOM 0 HG2 GLU A 57 12.596 -19.888 16.438 1.00 12.43 H new ATOM 0 HG3 GLU A 57 12.560 -21.638 16.339 1.00 12.43 H new ATOM 936 N MET A 58 15.270 -21.512 20.361 1.00 21.31 N ATOM 937 CA MET A 58 16.526 -21.909 20.986 1.00 24.32 C ATOM 938 C MET A 58 16.275 -22.583 22.331 1.00 22.33 C ATOM 939 O MET A 58 16.788 -23.670 22.598 1.00 31.42 O ATOM 940 CB MET A 58 17.434 -20.692 21.174 1.00 23.30 C ATOM 941 CG MET A 58 18.210 -20.314 19.923 1.00 51.23 C ATOM 942 SD MET A 58 19.948 -19.971 20.260 1.00 73.12 S ATOM 943 CE MET A 58 20.512 -19.456 18.640 1.00 73.03 C ATOM 0 H MET A 58 15.104 -20.506 20.350 1.00 21.31 H new ATOM 0 HA MET A 58 17.020 -22.624 20.328 1.00 24.32 H new ATOM 0 HB2 MET A 58 16.828 -19.842 21.487 1.00 23.30 H new ATOM 0 HB3 MET A 58 18.138 -20.895 21.981 1.00 23.30 H new ATOM 0 HG2 MET A 58 18.138 -21.124 19.197 1.00 51.23 H new ATOM 0 HG3 MET A 58 17.752 -19.436 19.468 1.00 51.23 H new ATOM 0 HE1 MET A 58 21.496 -19.883 18.444 1.00 73.03 H new ATOM 0 HE2 MET A 58 19.809 -19.803 17.883 1.00 73.03 H new ATOM 0 HE3 MET A 58 20.575 -18.368 18.606 1.00 73.03 H new ATOM 953 N LYS A 59 15.483 -21.931 23.176 1.00 25.30 N ATOM 954 CA LYS A 59 15.163 -22.467 24.494 1.00 71.34 C ATOM 955 C LYS A 59 16.401 -22.498 25.384 1.00 32.13 C ATOM 956 O LYS A 59 16.548 -23.383 26.228 1.00 12.14 O ATOM 957 CB LYS A 59 14.579 -23.876 24.365 1.00 14.15 C ATOM 958 CG LYS A 59 13.233 -24.041 25.050 1.00 12.41 C ATOM 959 CD LYS A 59 12.848 -25.505 25.178 1.00 10.04 C ATOM 960 CE LYS A 59 13.771 -26.242 26.137 1.00 52.11 C ATOM 961 NZ LYS A 59 13.166 -27.514 26.621 1.00 2.44 N ATOM 0 H LYS A 59 15.051 -21.030 22.971 1.00 25.30 H new ATOM 0 HA LYS A 59 14.422 -21.813 24.955 1.00 71.34 H new ATOM 0 HB2 LYS A 59 14.472 -24.121 23.308 1.00 14.15 H new ATOM 0 HB3 LYS A 59 15.283 -24.592 24.788 1.00 14.15 H new ATOM 0 HG2 LYS A 59 13.269 -23.586 26.040 1.00 12.41 H new ATOM 0 HG3 LYS A 59 12.468 -23.511 24.483 1.00 12.41 H new ATOM 0 HD2 LYS A 59 11.819 -25.582 25.530 1.00 10.04 H new ATOM 0 HD3 LYS A 59 12.886 -25.980 24.197 1.00 10.04 H new ATOM 0 HE2 LYS A 59 14.717 -26.456 25.639 1.00 52.11 H new ATOM 0 HE3 LYS A 59 13.997 -25.600 26.989 1.00 52.11 H new ATOM 0 HZ1 LYS A 59 13.825 -27.986 27.272 1.00 2.44 H new ATOM 0 HZ2 LYS A 59 12.276 -27.308 27.119 1.00 2.44 H new ATOM 0 HZ3 LYS A 59 12.973 -28.137 25.811 1.00 2.44 H new ATOM 975 N CYS A 60 17.287 -21.527 25.192 1.00 74.11 N ATOM 976 CA CYS A 60 18.512 -21.443 25.979 1.00 52.01 C ATOM 977 C CYS A 60 18.615 -20.093 26.682 1.00 70.33 C ATOM 978 O CYS A 60 17.678 -19.295 26.654 1.00 4.35 O ATOM 979 CB CYS A 60 19.733 -21.661 25.084 1.00 1.45 C ATOM 980 SG CYS A 60 19.681 -23.191 24.123 1.00 33.01 S ATOM 0 H CYS A 60 17.180 -20.787 24.498 1.00 74.11 H new ATOM 0 HA CYS A 60 18.482 -22.225 26.737 1.00 52.01 H new ATOM 0 HB2 CYS A 60 19.823 -20.818 24.399 1.00 1.45 H new ATOM 0 HB3 CYS A 60 20.629 -21.665 25.705 1.00 1.45 H new ATOM 0 HG CYS A 60 20.862 -23.441 23.641 1.00 33.01 H new ATOM 986 N ASP A 61 19.758 -19.846 27.312 1.00 61.23 N ATOM 987 CA ASP A 61 19.984 -18.593 28.023 1.00 71.22 C ATOM 988 C ASP A 61 20.790 -17.620 27.167 1.00 34.44 C ATOM 989 O ASP A 61 21.523 -16.779 27.689 1.00 60.24 O ATOM 990 CB ASP A 61 20.712 -18.855 29.342 1.00 12.13 C ATOM 991 CG ASP A 61 20.676 -17.657 30.271 1.00 42.13 C ATOM 992 OD1 ASP A 61 19.647 -16.950 30.288 1.00 13.22 O ATOM 993 OD2 ASP A 61 21.677 -17.427 30.980 1.00 4.13 O ATOM 0 H ASP A 61 20.543 -20.497 27.345 1.00 61.23 H new ATOM 0 HA ASP A 61 19.014 -18.144 28.235 1.00 71.22 H new ATOM 0 HB2 ASP A 61 20.258 -19.711 29.840 1.00 12.13 H new ATOM 0 HB3 ASP A 61 21.749 -19.120 29.135 1.00 12.13 H new ATOM 998 N LEU A 62 20.649 -17.742 25.852 1.00 44.50 N ATOM 999 CA LEU A 62 21.365 -16.874 24.923 1.00 0.52 C ATOM 1000 C LEU A 62 21.222 -15.409 25.326 1.00 23.33 C ATOM 1001 O LEU A 62 20.143 -14.828 25.216 1.00 15.34 O ATOM 1002 CB LEU A 62 20.843 -17.076 23.500 1.00 54.32 C ATOM 1003 CG LEU A 62 21.896 -17.385 22.436 1.00 62.03 C ATOM 1004 CD1 LEU A 62 22.279 -18.856 22.475 1.00 75.41 C ATOM 1005 CD2 LEU A 62 21.387 -17.001 21.054 1.00 44.11 C ATOM 0 H LEU A 62 20.046 -18.433 25.405 1.00 44.50 H new ATOM 0 HA LEU A 62 22.422 -17.140 24.957 1.00 0.52 H new ATOM 0 HB2 LEU A 62 20.118 -17.890 23.513 1.00 54.32 H new ATOM 0 HB3 LEU A 62 20.306 -16.176 23.200 1.00 54.32 H new ATOM 0 HG LEU A 62 22.786 -16.793 22.651 1.00 62.03 H new ATOM 0 HD11 LEU A 62 23.030 -19.057 21.711 1.00 75.41 H new ATOM 0 HD12 LEU A 62 22.686 -19.100 23.456 1.00 75.41 H new ATOM 0 HD13 LEU A 62 21.396 -19.467 22.286 1.00 75.41 H new ATOM 0 HD21 LEU A 62 22.150 -17.228 20.309 1.00 44.11 H new ATOM 0 HD22 LEU A 62 20.482 -17.565 20.830 1.00 44.11 H new ATOM 0 HD23 LEU A 62 21.164 -15.934 21.032 1.00 44.11 H new ATOM 1017 N ILE A 63 22.318 -14.819 25.791 1.00 65.51 N ATOM 1018 CA ILE A 63 22.316 -13.422 26.207 1.00 72.52 C ATOM 1019 C ILE A 63 22.659 -12.501 25.041 1.00 74.20 C ATOM 1020 O ILE A 63 23.680 -12.676 24.377 1.00 64.10 O ATOM 1021 CB ILE A 63 23.314 -13.174 27.353 1.00 31.42 C ATOM 1022 CG1 ILE A 63 23.105 -14.198 28.471 1.00 70.21 C ATOM 1023 CG2 ILE A 63 23.163 -11.759 27.889 1.00 4.43 C ATOM 1024 CD1 ILE A 63 24.052 -15.375 28.397 1.00 24.11 C ATOM 0 H ILE A 63 23.219 -15.287 25.889 1.00 65.51 H new ATOM 0 HA ILE A 63 21.309 -13.199 26.559 1.00 72.52 H new ATOM 0 HB ILE A 63 24.326 -13.289 26.965 1.00 31.42 H new ATOM 0 HG12 ILE A 63 23.228 -13.703 29.434 1.00 70.21 H new ATOM 0 HG13 ILE A 63 22.079 -14.564 28.430 1.00 70.21 H new ATOM 0 HG21 ILE A 63 23.875 -11.599 28.699 1.00 4.43 H new ATOM 0 HG22 ILE A 63 23.356 -11.044 27.089 1.00 4.43 H new ATOM 0 HG23 ILE A 63 22.149 -11.618 28.264 1.00 4.43 H new ATOM 0 HD11 ILE A 63 23.846 -16.060 29.220 1.00 24.11 H new ATOM 0 HD12 ILE A 63 23.913 -15.895 27.449 1.00 24.11 H new ATOM 0 HD13 ILE A 63 25.080 -15.020 28.469 1.00 24.11 H new ATOM 1036 N VAL A 64 21.798 -11.518 24.798 1.00 0.53 N ATOM 1037 CA VAL A 64 22.011 -10.566 23.714 1.00 13.24 C ATOM 1038 C VAL A 64 22.897 -9.410 24.164 1.00 3.11 C ATOM 1039 O VAL A 64 22.926 -9.058 25.343 1.00 41.15 O ATOM 1040 CB VAL A 64 20.676 -10.002 23.193 1.00 52.41 C ATOM 1041 CG1 VAL A 64 20.019 -9.123 24.246 1.00 3.45 C ATOM 1042 CG2 VAL A 64 20.893 -9.228 21.901 1.00 1.12 C ATOM 0 H VAL A 64 20.947 -11.360 25.337 1.00 0.53 H new ATOM 0 HA VAL A 64 22.507 -11.108 22.909 1.00 13.24 H new ATOM 0 HB VAL A 64 20.007 -10.836 22.983 1.00 52.41 H new ATOM 0 HG11 VAL A 64 19.077 -8.734 23.859 1.00 3.45 H new ATOM 0 HG12 VAL A 64 19.827 -9.712 25.143 1.00 3.45 H new ATOM 0 HG13 VAL A 64 20.681 -8.293 24.491 1.00 3.45 H new ATOM 0 HG21 VAL A 64 19.939 -8.836 21.547 1.00 1.12 H new ATOM 0 HG22 VAL A 64 21.580 -8.401 22.083 1.00 1.12 H new ATOM 0 HG23 VAL A 64 21.316 -9.891 21.146 1.00 1.12 H new ATOM 1052 N GLY A 65 23.620 -8.822 23.216 1.00 43.13 N ATOM 1053 CA GLY A 65 24.498 -7.711 23.534 1.00 42.03 C ATOM 1054 C GLY A 65 23.905 -6.373 23.140 1.00 5.53 C ATOM 1055 O GLY A 65 23.348 -5.662 23.978 1.00 65.43 O ATOM 0 H GLY A 65 23.613 -9.095 22.233 1.00 43.13 H new ATOM 0 HA2 GLY A 65 24.707 -7.712 24.604 1.00 42.03 H new ATOM 0 HA3 GLY A 65 25.451 -7.847 23.023 1.00 42.03 H new ATOM 1059 N ASP A 66 24.026 -6.026 21.864 1.00 64.25 N ATOM 1060 CA ASP A 66 23.499 -4.763 21.361 1.00 74.24 C ATOM 1061 C ASP A 66 23.176 -4.863 19.873 1.00 35.10 C ATOM 1062 O ASP A 66 23.423 -5.890 19.240 1.00 0.13 O ATOM 1063 CB ASP A 66 24.502 -3.634 21.603 1.00 74.24 C ATOM 1064 CG ASP A 66 24.018 -2.643 22.643 1.00 30.31 C ATOM 1065 OD1 ASP A 66 23.390 -3.079 23.631 1.00 10.11 O ATOM 1066 OD2 ASP A 66 24.268 -1.432 22.470 1.00 22.30 O ATOM 0 H ASP A 66 24.485 -6.602 21.158 1.00 64.25 H new ATOM 0 HA ASP A 66 22.578 -4.542 21.901 1.00 74.24 H new ATOM 0 HB2 ASP A 66 25.453 -4.059 21.925 1.00 74.24 H new ATOM 0 HB3 ASP A 66 24.688 -3.110 20.665 1.00 74.24 H new ATOM 1071 N LYS A 67 22.620 -3.790 19.320 1.00 21.21 N ATOM 1072 CA LYS A 67 22.263 -3.755 17.907 1.00 75.40 C ATOM 1073 C LYS A 67 23.510 -3.699 17.031 1.00 2.13 C ATOM 1074 O LYS A 67 24.484 -3.022 17.363 1.00 34.22 O ATOM 1075 CB LYS A 67 21.367 -2.549 17.616 1.00 41.01 C ATOM 1076 CG LYS A 67 21.134 -2.308 16.134 1.00 11.05 C ATOM 1077 CD LYS A 67 20.345 -3.442 15.502 1.00 21.53 C ATOM 1078 CE LYS A 67 20.317 -3.325 13.986 1.00 2.31 C ATOM 1079 NZ LYS A 67 19.068 -2.673 13.503 1.00 21.33 N ATOM 0 H LYS A 67 22.407 -2.933 19.830 1.00 21.21 H new ATOM 0 HA LYS A 67 21.718 -4.670 17.673 1.00 75.40 H new ATOM 0 HB2 LYS A 67 20.405 -2.695 18.108 1.00 41.01 H new ATOM 0 HB3 LYS A 67 21.817 -1.658 18.054 1.00 41.01 H new ATOM 0 HG2 LYS A 67 20.597 -1.369 15.997 1.00 11.05 H new ATOM 0 HG3 LYS A 67 22.093 -2.204 15.626 1.00 11.05 H new ATOM 0 HD2 LYS A 67 20.787 -4.397 15.786 1.00 21.53 H new ATOM 0 HD3 LYS A 67 19.325 -3.436 15.887 1.00 21.53 H new ATOM 0 HE2 LYS A 67 21.180 -2.750 13.650 1.00 2.31 H new ATOM 0 HE3 LYS A 67 20.403 -4.317 13.543 1.00 2.31 H new ATOM 0 HZ1 LYS A 67 18.556 -3.326 12.876 1.00 21.33 H new ATOM 0 HZ2 LYS A 67 18.467 -2.430 14.316 1.00 21.33 H new ATOM 0 HZ3 LYS A 67 19.308 -1.807 12.979 1.00 21.33 H new ATOM 1093 N VAL A 68 23.474 -4.413 15.911 1.00 41.14 N ATOM 1094 CA VAL A 68 24.601 -4.442 14.986 1.00 51.32 C ATOM 1095 C VAL A 68 24.351 -3.535 13.786 1.00 13.54 C ATOM 1096 O VAL A 68 25.077 -2.564 13.567 1.00 34.33 O ATOM 1097 CB VAL A 68 24.880 -5.871 14.485 1.00 35.30 C ATOM 1098 CG1 VAL A 68 26.038 -5.876 13.500 1.00 43.23 C ATOM 1099 CG2 VAL A 68 25.161 -6.800 15.656 1.00 23.23 C ATOM 0 H VAL A 68 22.677 -4.979 15.622 1.00 41.14 H new ATOM 0 HA VAL A 68 25.470 -4.081 15.536 1.00 51.32 H new ATOM 0 HB VAL A 68 23.993 -6.235 13.966 1.00 35.30 H new ATOM 0 HG11 VAL A 68 26.220 -6.895 13.157 1.00 43.23 H new ATOM 0 HG12 VAL A 68 25.792 -5.244 12.646 1.00 43.23 H new ATOM 0 HG13 VAL A 68 26.933 -5.492 13.989 1.00 43.23 H new ATOM 0 HG21 VAL A 68 25.356 -7.806 15.284 1.00 23.23 H new ATOM 0 HG22 VAL A 68 26.032 -6.441 16.205 1.00 23.23 H new ATOM 0 HG23 VAL A 68 24.297 -6.820 16.320 1.00 23.23 H new ATOM 1109 N ILE A 69 23.319 -3.856 13.013 1.00 22.32 N ATOM 1110 CA ILE A 69 22.972 -3.069 11.837 1.00 63.15 C ATOM 1111 C ILE A 69 21.692 -3.584 11.188 1.00 31.52 C ATOM 1112 O ILE A 69 21.271 -4.716 11.431 1.00 31.04 O ATOM 1113 CB ILE A 69 24.105 -3.086 10.794 1.00 64.34 C ATOM 1114 CG1 ILE A 69 23.981 -1.886 9.853 1.00 10.44 C ATOM 1115 CG2 ILE A 69 24.080 -4.388 10.006 1.00 44.42 C ATOM 1116 CD1 ILE A 69 25.229 -1.624 9.039 1.00 34.10 C ATOM 0 H ILE A 69 22.709 -4.656 13.180 1.00 22.32 H new ATOM 0 HA ILE A 69 22.817 -2.045 12.178 1.00 63.15 H new ATOM 0 HB ILE A 69 25.059 -3.017 11.316 1.00 64.34 H new ATOM 0 HG12 ILE A 69 23.143 -2.051 9.175 1.00 10.44 H new ATOM 0 HG13 ILE A 69 23.746 -0.998 10.439 1.00 10.44 H new ATOM 0 HG21 ILE A 69 24.887 -4.385 9.273 1.00 44.42 H new ATOM 0 HG22 ILE A 69 24.212 -5.228 10.688 1.00 44.42 H new ATOM 0 HG23 ILE A 69 23.123 -4.484 9.493 1.00 44.42 H new ATOM 0 HD11 ILE A 69 25.068 -0.759 8.395 1.00 34.10 H new ATOM 0 HD12 ILE A 69 26.066 -1.427 9.709 1.00 34.10 H new ATOM 0 HD13 ILE A 69 25.453 -2.497 8.426 1.00 34.10 H new ATOM 1128 N THR A 70 21.076 -2.747 10.359 1.00 21.12 N ATOM 1129 CA THR A 70 19.844 -3.118 9.675 1.00 40.54 C ATOM 1130 C THR A 70 20.029 -3.099 8.162 1.00 53.55 C ATOM 1131 O THR A 70 20.927 -2.434 7.643 1.00 55.10 O ATOM 1132 CB THR A 70 18.687 -2.173 10.051 1.00 74.41 C ATOM 1133 OG1 THR A 70 17.435 -2.758 9.674 1.00 20.54 O ATOM 1134 CG2 THR A 70 18.846 -0.823 9.369 1.00 4.13 C ATOM 0 H THR A 70 21.411 -1.807 10.145 1.00 21.12 H new ATOM 0 HA THR A 70 19.596 -4.130 9.996 1.00 40.54 H new ATOM 0 HB THR A 70 18.708 -2.021 11.130 1.00 74.41 H new ATOM 0 HG1 THR A 70 16.704 -2.152 9.918 1.00 20.54 H new ATOM 0 HG21 THR A 70 18.017 -0.173 9.650 1.00 4.13 H new ATOM 0 HG22 THR A 70 19.786 -0.367 9.680 1.00 4.13 H new ATOM 0 HG23 THR A 70 18.849 -0.960 8.288 1.00 4.13 H new ATOM 1142 N THR A 71 19.173 -3.832 7.456 1.00 11.31 N ATOM 1143 CA THR A 71 19.242 -3.899 6.002 1.00 61.31 C ATOM 1144 C THR A 71 17.849 -3.977 5.388 1.00 11.52 C ATOM 1145 O THR A 71 17.054 -4.847 5.740 1.00 71.54 O ATOM 1146 CB THR A 71 20.065 -5.115 5.535 1.00 53.14 C ATOM 1147 OG1 THR A 71 20.776 -5.680 6.642 1.00 74.24 O ATOM 1148 CG2 THR A 71 21.048 -4.716 4.444 1.00 32.13 C ATOM 0 H THR A 71 18.424 -4.388 7.868 1.00 11.31 H new ATOM 0 HA THR A 71 19.733 -2.986 5.666 1.00 61.31 H new ATOM 0 HB THR A 71 19.378 -5.857 5.129 1.00 53.14 H new ATOM 0 HG1 THR A 71 21.399 -6.363 6.316 1.00 74.24 H new ATOM 0 HG21 THR A 71 21.618 -5.591 4.130 1.00 32.13 H new ATOM 0 HG22 THR A 71 20.501 -4.314 3.591 1.00 32.13 H new ATOM 0 HG23 THR A 71 21.730 -3.957 4.828 1.00 32.13 H new ATOM 1156 N GLU A 72 17.560 -3.060 4.469 1.00 24.31 N ATOM 1157 CA GLU A 72 16.262 -3.026 3.807 1.00 73.11 C ATOM 1158 C GLU A 72 16.421 -3.124 2.292 1.00 15.24 C ATOM 1159 O GLU A 72 17.283 -2.471 1.704 1.00 63.11 O ATOM 1160 CB GLU A 72 15.513 -1.742 4.170 1.00 33.35 C ATOM 1161 CG GLU A 72 15.506 -1.442 5.660 1.00 64.30 C ATOM 1162 CD GLU A 72 14.955 -0.065 5.975 1.00 24.24 C ATOM 1163 OE1 GLU A 72 13.908 0.300 5.401 1.00 21.22 O ATOM 1164 OE2 GLU A 72 15.571 0.647 6.796 1.00 40.15 O ATOM 0 H GLU A 72 18.207 -2.332 4.167 1.00 24.31 H new ATOM 0 HA GLU A 72 15.685 -3.884 4.151 1.00 73.11 H new ATOM 0 HB2 GLU A 72 15.968 -0.904 3.641 1.00 33.35 H new ATOM 0 HB3 GLU A 72 14.484 -1.820 3.819 1.00 33.35 H new ATOM 0 HG2 GLU A 72 14.909 -2.195 6.176 1.00 64.30 H new ATOM 0 HG3 GLU A 72 16.522 -1.520 6.047 1.00 64.30 H new ATOM 1171 N HIS A 73 15.582 -3.944 1.667 1.00 22.30 N ATOM 1172 CA HIS A 73 15.629 -4.128 0.221 1.00 72.22 C ATOM 1173 C HIS A 73 14.244 -3.953 -0.394 1.00 55.10 C ATOM 1174 O HIS A 73 13.238 -4.343 0.198 1.00 0.25 O ATOM 1175 CB HIS A 73 16.180 -5.513 -0.121 1.00 13.11 C ATOM 1176 CG HIS A 73 17.558 -5.757 0.412 1.00 71.50 C ATOM 1177 ND1 HIS A 73 18.029 -5.759 1.681 1.00 23.41 N flip ATOM 1178 CD2 HIS A 73 18.638 -6.040 -0.397 1.00 43.52 C flip ATOM 1179 CE1 HIS A 73 19.372 -6.040 1.616 1.00 1.45 C flip ATOM 1180 NE2 HIS A 73 19.714 -6.207 0.351 1.00 33.33 N flip ATOM 0 H HIS A 73 14.862 -4.491 2.139 1.00 22.30 H new ATOM 0 HA HIS A 73 16.291 -3.369 -0.195 1.00 72.22 H new ATOM 0 HB2 HIS A 73 15.506 -6.272 0.277 1.00 13.11 H new ATOM 0 HB3 HIS A 73 16.192 -5.633 -1.204 1.00 13.11 H new ATOM 0 HD2 HIS A 73 18.609 -6.114 -1.474 1.00 43.52 H new ATOM 0 HE1 HIS A 73 20.040 -6.113 2.462 1.00 1.45 H new ATOM 0 HE2 HIS A 73 20.650 -6.427 0.010 1.00 33.33 H new ATOM 1188 N GLU A 74 14.200 -3.363 -1.585 1.00 20.33 N ATOM 1189 CA GLU A 74 12.938 -3.135 -2.278 1.00 35.41 C ATOM 1190 C GLU A 74 12.513 -4.377 -3.057 1.00 50.33 C ATOM 1191 O GLU A 74 13.098 -4.705 -4.090 1.00 13.20 O ATOM 1192 CB GLU A 74 13.059 -1.941 -3.227 1.00 24.14 C ATOM 1193 CG GLU A 74 11.799 -1.671 -4.031 1.00 34.35 C ATOM 1194 CD GLU A 74 11.817 -0.314 -4.707 1.00 20.14 C ATOM 1195 OE1 GLU A 74 10.868 -0.013 -5.459 1.00 54.44 O ATOM 1196 OE2 GLU A 74 12.782 0.447 -4.482 1.00 73.31 O ATOM 0 H GLU A 74 15.024 -3.035 -2.089 1.00 20.33 H new ATOM 0 HA GLU A 74 12.176 -2.918 -1.529 1.00 35.41 H new ATOM 0 HB2 GLU A 74 13.308 -1.052 -2.648 1.00 24.14 H new ATOM 0 HB3 GLU A 74 13.887 -2.116 -3.914 1.00 24.14 H new ATOM 0 HG2 GLU A 74 11.682 -2.448 -4.787 1.00 34.35 H new ATOM 0 HG3 GLU A 74 10.932 -1.733 -3.373 1.00 34.35 H new ATOM 1203 N TYR A 75 11.493 -5.063 -2.555 1.00 14.10 N ATOM 1204 CA TYR A 75 10.991 -6.270 -3.201 1.00 51.34 C ATOM 1205 C TYR A 75 9.664 -6.000 -3.904 1.00 40.13 C ATOM 1206 O TYR A 75 9.050 -4.950 -3.713 1.00 73.24 O ATOM 1207 CB TYR A 75 10.818 -7.390 -2.174 1.00 1.41 C ATOM 1208 CG TYR A 75 12.080 -8.185 -1.927 1.00 60.24 C ATOM 1209 CD1 TYR A 75 12.022 -9.473 -1.409 1.00 63.32 C ATOM 1210 CD2 TYR A 75 13.330 -7.649 -2.212 1.00 12.05 C ATOM 1211 CE1 TYR A 75 13.173 -10.204 -1.182 1.00 14.25 C ATOM 1212 CE2 TYR A 75 14.485 -8.373 -1.989 1.00 1.35 C ATOM 1213 CZ TYR A 75 14.401 -9.649 -1.473 1.00 64.43 C ATOM 1214 OH TYR A 75 15.550 -10.373 -1.248 1.00 60.04 O ATOM 0 H TYR A 75 10.997 -4.804 -1.702 1.00 14.10 H new ATOM 0 HA TYR A 75 11.721 -6.581 -3.948 1.00 51.34 H new ATOM 0 HB2 TYR A 75 10.480 -6.959 -1.232 1.00 1.41 H new ATOM 0 HB3 TYR A 75 10.034 -8.066 -2.515 1.00 1.41 H new ATOM 0 HD1 TYR A 75 11.061 -9.910 -1.180 1.00 63.32 H new ATOM 0 HD2 TYR A 75 13.400 -6.649 -2.615 1.00 12.05 H new ATOM 0 HE1 TYR A 75 13.111 -11.204 -0.779 1.00 14.25 H new ATOM 0 HE2 TYR A 75 15.449 -7.942 -2.218 1.00 1.35 H new ATOM 0 HH TYR A 75 16.329 -9.838 -1.507 1.00 60.04 H new ATOM 1224 N ASP A 76 9.228 -6.956 -4.717 1.00 50.44 N ATOM 1225 CA ASP A 76 7.973 -6.824 -5.449 1.00 1.24 C ATOM 1226 C ASP A 76 6.793 -7.262 -4.586 1.00 43.24 C ATOM 1227 O ASP A 76 5.701 -6.702 -4.681 1.00 34.35 O ATOM 1228 CB ASP A 76 8.017 -7.652 -6.733 1.00 63.34 C ATOM 1229 CG ASP A 76 8.747 -6.941 -7.856 1.00 73.11 C ATOM 1230 OD1 ASP A 76 9.305 -7.633 -8.733 1.00 65.01 O ATOM 1231 OD2 ASP A 76 8.758 -5.693 -7.858 1.00 42.53 O ATOM 0 H ASP A 76 9.725 -7.831 -4.886 1.00 50.44 H new ATOM 0 HA ASP A 76 7.841 -5.774 -5.709 1.00 1.24 H new ATOM 0 HB2 ASP A 76 8.507 -8.605 -6.531 1.00 63.34 H new ATOM 0 HB3 ASP A 76 6.999 -7.878 -7.051 1.00 63.34 H new ATOM 1236 N PHE A 77 7.021 -8.267 -3.747 1.00 42.41 N ATOM 1237 CA PHE A 77 5.977 -8.782 -2.869 1.00 53.45 C ATOM 1238 C PHE A 77 5.904 -7.973 -1.577 1.00 64.14 C ATOM 1239 O PHE A 77 4.875 -7.948 -0.905 1.00 14.22 O ATOM 1240 CB PHE A 77 6.232 -10.256 -2.548 1.00 53.34 C ATOM 1241 CG PHE A 77 5.778 -11.192 -3.632 1.00 24.34 C ATOM 1242 CD1 PHE A 77 6.701 -11.898 -4.387 1.00 4.05 C ATOM 1243 CD2 PHE A 77 4.429 -11.367 -3.895 1.00 24.45 C ATOM 1244 CE1 PHE A 77 6.287 -12.760 -5.384 1.00 51.33 C ATOM 1245 CE2 PHE A 77 4.009 -12.228 -4.891 1.00 32.31 C ATOM 1246 CZ PHE A 77 4.939 -12.926 -5.636 1.00 30.10 C ATOM 0 H PHE A 77 7.920 -8.741 -3.657 1.00 42.41 H new ATOM 0 HA PHE A 77 5.023 -8.690 -3.388 1.00 53.45 H new ATOM 0 HB2 PHE A 77 7.298 -10.403 -2.375 1.00 53.34 H new ATOM 0 HB3 PHE A 77 5.720 -10.512 -1.620 1.00 53.34 H new ATOM 0 HD1 PHE A 77 7.756 -11.773 -4.194 1.00 4.05 H new ATOM 0 HD2 PHE A 77 3.697 -10.824 -3.315 1.00 24.45 H new ATOM 0 HE1 PHE A 77 7.017 -13.304 -5.966 1.00 51.33 H new ATOM 0 HE2 PHE A 77 2.954 -12.355 -5.087 1.00 32.31 H new ATOM 0 HZ PHE A 77 4.613 -13.600 -6.414 1.00 30.10 H new ATOM 1256 N GLY A 78 7.007 -7.313 -1.237 1.00 24.25 N ATOM 1257 CA GLY A 78 7.049 -6.513 -0.026 1.00 62.44 C ATOM 1258 C GLY A 78 8.465 -6.257 0.450 1.00 0.33 C ATOM 1259 O GLY A 78 9.277 -7.179 0.530 1.00 31.10 O ATOM 0 H GLY A 78 7.872 -7.318 -1.778 1.00 24.25 H new ATOM 0 HA2 GLY A 78 6.552 -5.560 -0.206 1.00 62.44 H new ATOM 0 HA3 GLY A 78 6.491 -7.020 0.761 1.00 62.44 H new ATOM 1263 N ILE A 79 8.763 -5.001 0.766 1.00 14.22 N ATOM 1264 CA ILE A 79 10.090 -4.626 1.237 1.00 64.14 C ATOM 1265 C ILE A 79 10.548 -5.535 2.373 1.00 52.43 C ATOM 1266 O ILE A 79 9.871 -5.658 3.394 1.00 25.10 O ATOM 1267 CB ILE A 79 10.125 -3.164 1.718 1.00 1.40 C ATOM 1268 CG1 ILE A 79 10.427 -2.226 0.548 1.00 44.44 C ATOM 1269 CG2 ILE A 79 11.159 -2.994 2.821 1.00 41.50 C ATOM 1270 CD1 ILE A 79 9.524 -2.439 -0.647 1.00 21.13 C ATOM 0 H ILE A 79 8.103 -4.226 0.704 1.00 14.22 H new ATOM 0 HA ILE A 79 10.768 -4.737 0.391 1.00 64.14 H new ATOM 0 HB ILE A 79 9.146 -2.906 2.122 1.00 1.40 H new ATOM 0 HG12 ILE A 79 10.331 -1.194 0.886 1.00 44.44 H new ATOM 0 HG13 ILE A 79 11.463 -2.365 0.239 1.00 44.44 H new ATOM 0 HG21 ILE A 79 11.172 -1.955 3.151 1.00 41.50 H new ATOM 0 HG22 ILE A 79 10.903 -3.638 3.662 1.00 41.50 H new ATOM 0 HG23 ILE A 79 12.144 -3.267 2.442 1.00 41.50 H new ATOM 0 HD11 ILE A 79 9.796 -1.740 -1.438 1.00 21.13 H new ATOM 0 HD12 ILE A 79 9.637 -3.460 -1.011 1.00 21.13 H new ATOM 0 HD13 ILE A 79 8.488 -2.271 -0.354 1.00 21.13 H new ATOM 1282 N VAL A 80 11.702 -6.168 2.189 1.00 51.03 N ATOM 1283 CA VAL A 80 12.252 -7.063 3.199 1.00 22.33 C ATOM 1284 C VAL A 80 13.288 -6.349 4.061 1.00 73.32 C ATOM 1285 O VAL A 80 14.209 -5.716 3.545 1.00 20.21 O ATOM 1286 CB VAL A 80 12.902 -8.303 2.557 1.00 70.22 C ATOM 1287 CG1 VAL A 80 14.059 -7.895 1.658 1.00 50.51 C ATOM 1288 CG2 VAL A 80 13.367 -9.276 3.629 1.00 23.44 C ATOM 0 H VAL A 80 12.274 -6.077 1.349 1.00 51.03 H new ATOM 0 HA VAL A 80 11.419 -7.382 3.826 1.00 22.33 H new ATOM 0 HB VAL A 80 12.155 -8.805 1.942 1.00 70.22 H new ATOM 0 HG11 VAL A 80 14.506 -8.784 1.213 1.00 50.51 H new ATOM 0 HG12 VAL A 80 13.692 -7.240 0.868 1.00 50.51 H new ATOM 0 HG13 VAL A 80 14.809 -7.368 2.247 1.00 50.51 H new ATOM 0 HG21 VAL A 80 13.824 -10.146 3.157 1.00 23.44 H new ATOM 0 HG22 VAL A 80 14.098 -8.786 4.272 1.00 23.44 H new ATOM 0 HG23 VAL A 80 12.513 -9.594 4.227 1.00 23.44 H new ATOM 1298 N ARG A 81 13.130 -6.456 5.376 1.00 0.01 N ATOM 1299 CA ARG A 81 14.051 -5.820 6.310 1.00 1.21 C ATOM 1300 C ARG A 81 14.731 -6.859 7.196 1.00 21.33 C ATOM 1301 O ARG A 81 14.100 -7.452 8.072 1.00 21.34 O ATOM 1302 CB ARG A 81 13.309 -4.801 7.178 1.00 70.54 C ATOM 1303 CG ARG A 81 12.327 -3.940 6.400 1.00 32.35 C ATOM 1304 CD ARG A 81 12.086 -2.608 7.092 1.00 15.25 C ATOM 1305 NE ARG A 81 11.673 -2.780 8.483 1.00 53.13 N ATOM 1306 CZ ARG A 81 11.479 -1.769 9.322 1.00 14.12 C ATOM 1307 NH1 ARG A 81 11.659 -0.520 8.914 1.00 34.33 N ATOM 1308 NH2 ARG A 81 11.103 -2.006 10.573 1.00 61.04 N ATOM 0 H ARG A 81 12.373 -6.977 5.819 1.00 0.01 H new ATOM 0 HA ARG A 81 14.817 -5.304 5.731 1.00 1.21 H new ATOM 0 HB2 ARG A 81 12.771 -5.330 7.965 1.00 70.54 H new ATOM 0 HB3 ARG A 81 14.037 -4.155 7.668 1.00 70.54 H new ATOM 0 HG2 ARG A 81 12.711 -3.765 5.395 1.00 32.35 H new ATOM 0 HG3 ARG A 81 11.382 -4.472 6.292 1.00 32.35 H new ATOM 0 HD2 ARG A 81 12.997 -2.011 7.056 1.00 15.25 H new ATOM 0 HD3 ARG A 81 11.319 -2.053 6.552 1.00 15.25 H new ATOM 0 HE ARG A 81 11.526 -3.728 8.828 1.00 53.13 H new ATOM 0 HH11 ARG A 81 11.947 -0.334 7.953 1.00 34.33 H new ATOM 0 HH12 ARG A 81 11.509 0.254 9.561 1.00 34.33 H new ATOM 0 HH21 ARG A 81 10.963 -2.965 10.890 1.00 61.04 H new ATOM 0 HH22 ARG A 81 10.954 -1.229 11.217 1.00 61.04 H new ATOM 1322 N LEU A 82 16.021 -7.076 6.962 1.00 13.34 N ATOM 1323 CA LEU A 82 16.787 -8.044 7.739 1.00 61.21 C ATOM 1324 C LEU A 82 17.740 -7.340 8.700 1.00 61.15 C ATOM 1325 O LEU A 82 18.531 -6.488 8.294 1.00 1.30 O ATOM 1326 CB LEU A 82 17.574 -8.967 6.806 1.00 2.34 C ATOM 1327 CG LEU A 82 17.885 -10.362 7.349 1.00 65.13 C ATOM 1328 CD1 LEU A 82 18.717 -10.268 8.619 1.00 73.13 C ATOM 1329 CD2 LEU A 82 16.599 -11.133 7.607 1.00 62.22 C ATOM 0 H LEU A 82 16.558 -6.595 6.241 1.00 13.34 H new ATOM 0 HA LEU A 82 16.086 -8.640 8.324 1.00 61.21 H new ATOM 0 HB2 LEU A 82 17.013 -9.077 5.878 1.00 2.34 H new ATOM 0 HB3 LEU A 82 18.515 -8.479 6.554 1.00 2.34 H new ATOM 0 HG LEU A 82 18.464 -10.902 6.600 1.00 65.13 H new ATOM 0 HD11 LEU A 82 18.928 -11.271 8.991 1.00 73.13 H new ATOM 0 HD12 LEU A 82 19.655 -9.756 8.403 1.00 73.13 H new ATOM 0 HD13 LEU A 82 18.165 -9.710 9.375 1.00 73.13 H new ATOM 0 HD21 LEU A 82 16.840 -12.123 7.993 1.00 62.22 H new ATOM 0 HD22 LEU A 82 15.993 -10.596 8.337 1.00 62.22 H new ATOM 0 HD23 LEU A 82 16.041 -11.232 6.676 1.00 62.22 H new ATOM 1341 N THR A 83 17.661 -7.704 9.976 1.00 40.50 N ATOM 1342 CA THR A 83 18.517 -7.108 10.995 1.00 74.05 C ATOM 1343 C THR A 83 19.224 -8.181 11.815 1.00 73.04 C ATOM 1344 O THR A 83 18.771 -9.324 11.883 1.00 20.34 O ATOM 1345 CB THR A 83 17.712 -6.200 11.943 1.00 12.14 C ATOM 1346 OG1 THR A 83 18.582 -5.250 12.568 1.00 25.22 O ATOM 1347 CG2 THR A 83 17.003 -7.023 13.008 1.00 11.04 C ATOM 0 H THR A 83 17.013 -8.409 10.329 1.00 40.50 H new ATOM 0 HA THR A 83 19.260 -6.506 10.472 1.00 74.05 H new ATOM 0 HB THR A 83 16.962 -5.672 11.354 1.00 12.14 H new ATOM 0 HG1 THR A 83 19.352 -5.079 11.986 1.00 25.22 H new ATOM 0 HG21 THR A 83 16.441 -6.360 13.666 1.00 11.04 H new ATOM 0 HG22 THR A 83 16.320 -7.725 12.530 1.00 11.04 H new ATOM 0 HG23 THR A 83 17.740 -7.574 13.592 1.00 11.04 H new ATOM 1355 N THR A 84 20.337 -7.806 12.437 1.00 60.01 N ATOM 1356 CA THR A 84 21.107 -8.737 13.252 1.00 2.54 C ATOM 1357 C THR A 84 21.374 -8.162 14.639 1.00 53.10 C ATOM 1358 O THR A 84 21.328 -6.948 14.838 1.00 50.43 O ATOM 1359 CB THR A 84 22.452 -9.087 12.587 1.00 13.42 C ATOM 1360 OG1 THR A 84 23.091 -7.895 12.117 1.00 12.51 O ATOM 1361 CG2 THR A 84 22.247 -10.050 11.427 1.00 1.54 C ATOM 0 H THR A 84 20.725 -6.864 12.392 1.00 60.01 H new ATOM 0 HA THR A 84 20.509 -9.644 13.346 1.00 2.54 H new ATOM 0 HB THR A 84 23.086 -9.569 13.331 1.00 13.42 H new ATOM 0 HG1 THR A 84 22.812 -7.716 11.195 1.00 12.51 H new ATOM 0 HG21 THR A 84 23.210 -10.283 10.973 1.00 1.54 H new ATOM 0 HG22 THR A 84 21.787 -10.968 11.793 1.00 1.54 H new ATOM 0 HG23 THR A 84 21.597 -9.590 10.683 1.00 1.54 H new ATOM 1369 N TYR A 85 21.653 -9.041 15.595 1.00 74.11 N ATOM 1370 CA TYR A 85 21.925 -8.621 16.964 1.00 10.42 C ATOM 1371 C TYR A 85 22.989 -9.507 17.605 1.00 52.12 C ATOM 1372 O TYR A 85 22.924 -10.734 17.523 1.00 42.32 O ATOM 1373 CB TYR A 85 20.643 -8.661 17.797 1.00 54.01 C ATOM 1374 CG TYR A 85 19.877 -7.357 17.794 1.00 62.02 C ATOM 1375 CD1 TYR A 85 18.923 -7.091 16.820 1.00 72.02 C ATOM 1376 CD2 TYR A 85 20.108 -6.391 18.766 1.00 70.22 C ATOM 1377 CE1 TYR A 85 18.222 -5.901 16.813 1.00 51.33 C ATOM 1378 CE2 TYR A 85 19.411 -5.199 18.767 1.00 13.44 C ATOM 1379 CZ TYR A 85 18.469 -4.958 17.789 1.00 42.24 C ATOM 1380 OH TYR A 85 17.772 -3.771 17.786 1.00 60.41 O ATOM 0 H TYR A 85 21.697 -10.049 15.447 1.00 74.11 H new ATOM 0 HA TYR A 85 22.299 -7.598 16.935 1.00 10.42 H new ATOM 0 HB2 TYR A 85 19.997 -9.453 17.417 1.00 54.01 H new ATOM 0 HB3 TYR A 85 20.896 -8.922 18.825 1.00 54.01 H new ATOM 0 HD1 TYR A 85 18.726 -7.827 16.055 1.00 72.02 H new ATOM 0 HD2 TYR A 85 20.845 -6.576 19.533 1.00 70.22 H new ATOM 0 HE1 TYR A 85 17.484 -5.710 16.048 1.00 51.33 H new ATOM 0 HE2 TYR A 85 19.603 -4.459 19.530 1.00 13.44 H new ATOM 0 HH TYR A 85 18.064 -3.218 18.540 1.00 60.41 H new ATOM 1390 N LYS A 86 23.968 -8.876 18.244 1.00 62.30 N ATOM 1391 CA LYS A 86 25.047 -9.605 18.902 1.00 54.44 C ATOM 1392 C LYS A 86 24.493 -10.586 19.929 1.00 34.32 C ATOM 1393 O LYS A 86 23.776 -10.195 20.852 1.00 63.33 O ATOM 1394 CB LYS A 86 26.009 -8.628 19.581 1.00 43.11 C ATOM 1395 CG LYS A 86 27.410 -8.646 18.993 1.00 74.12 C ATOM 1396 CD LYS A 86 27.528 -7.704 17.806 1.00 24.14 C ATOM 1397 CE LYS A 86 28.980 -7.497 17.402 1.00 21.31 C ATOM 1398 NZ LYS A 86 29.210 -6.139 16.837 1.00 63.01 N ATOM 0 H LYS A 86 24.037 -7.861 18.321 1.00 62.30 H new ATOM 0 HA LYS A 86 25.588 -10.169 18.142 1.00 54.44 H new ATOM 0 HB2 LYS A 86 25.604 -7.619 19.503 1.00 43.11 H new ATOM 0 HB3 LYS A 86 26.067 -8.867 20.643 1.00 43.11 H new ATOM 0 HG2 LYS A 86 28.131 -8.360 19.759 1.00 74.12 H new ATOM 0 HG3 LYS A 86 27.662 -9.660 18.681 1.00 74.12 H new ATOM 0 HD2 LYS A 86 26.968 -8.108 16.962 1.00 24.14 H new ATOM 0 HD3 LYS A 86 27.078 -6.743 18.056 1.00 24.14 H new ATOM 0 HE2 LYS A 86 29.623 -7.643 18.270 1.00 21.31 H new ATOM 0 HE3 LYS A 86 29.263 -8.249 16.666 1.00 21.31 H new ATOM 0 HZ1 LYS A 86 30.211 -6.037 16.574 1.00 63.01 H new ATOM 0 HZ2 LYS A 86 28.616 -6.009 15.994 1.00 63.01 H new ATOM 0 HZ3 LYS A 86 28.964 -5.421 17.548 1.00 63.01 H new ATOM 1412 N CYS A 87 24.830 -11.861 19.765 1.00 55.43 N ATOM 1413 CA CYS A 87 24.366 -12.898 20.679 1.00 30.21 C ATOM 1414 C CYS A 87 25.544 -13.639 21.304 1.00 42.54 C ATOM 1415 O CYS A 87 26.505 -13.990 20.618 1.00 4.53 O ATOM 1416 CB CYS A 87 23.459 -13.886 19.945 1.00 73.25 C ATOM 1417 SG CYS A 87 21.968 -13.140 19.245 1.00 12.31 S ATOM 0 H CYS A 87 25.423 -12.201 19.008 1.00 55.43 H new ATOM 0 HA CYS A 87 23.798 -12.417 21.476 1.00 30.21 H new ATOM 0 HB2 CYS A 87 24.027 -14.357 19.143 1.00 73.25 H new ATOM 0 HB3 CYS A 87 23.167 -14.677 20.636 1.00 73.25 H new ATOM 0 HG CYS A 87 22.296 -12.107 18.528 1.00 12.31 H new ATOM 1423 N THR A 88 25.464 -13.872 22.610 1.00 65.10 N ATOM 1424 CA THR A 88 26.525 -14.568 23.328 1.00 12.11 C ATOM 1425 C THR A 88 26.170 -16.034 23.547 1.00 31.04 C ATOM 1426 O THR A 88 25.016 -16.434 23.391 1.00 75.22 O ATOM 1427 CB THR A 88 26.805 -13.910 24.692 1.00 10.42 C ATOM 1428 OG1 THR A 88 26.561 -12.501 24.616 1.00 54.22 O ATOM 1429 CG2 THR A 88 28.241 -14.157 25.128 1.00 63.51 C ATOM 0 H THR A 88 24.676 -13.589 23.192 1.00 65.10 H new ATOM 0 HA THR A 88 27.421 -14.502 22.710 1.00 12.11 H new ATOM 0 HB THR A 88 26.136 -14.355 25.429 1.00 10.42 H new ATOM 0 HG1 THR A 88 25.596 -12.338 24.574 1.00 54.22 H new ATOM 0 HG21 THR A 88 28.415 -13.683 26.094 1.00 63.51 H new ATOM 0 HG22 THR A 88 28.416 -15.229 25.214 1.00 63.51 H new ATOM 0 HG23 THR A 88 28.923 -13.736 24.389 1.00 63.51 H new ATOM 1437 N LEU A 89 27.168 -16.831 23.911 1.00 22.43 N ATOM 1438 CA LEU A 89 26.961 -18.255 24.153 1.00 0.04 C ATOM 1439 C LEU A 89 26.711 -18.525 25.634 1.00 52.24 C ATOM 1440 O LEU A 89 27.403 -17.989 26.498 1.00 51.31 O ATOM 1441 CB LEU A 89 28.174 -19.055 23.675 1.00 33.51 C ATOM 1442 CG LEU A 89 28.097 -20.570 23.869 1.00 31.31 C ATOM 1443 CD1 LEU A 89 27.430 -21.229 22.672 1.00 53.45 C ATOM 1444 CD2 LEU A 89 29.486 -21.150 24.094 1.00 73.22 C ATOM 0 H LEU A 89 28.129 -16.516 24.045 1.00 22.43 H new ATOM 0 HA LEU A 89 26.081 -18.570 23.592 1.00 0.04 H new ATOM 0 HB2 LEU A 89 28.323 -18.852 22.615 1.00 33.51 H new ATOM 0 HB3 LEU A 89 29.056 -18.686 24.198 1.00 33.51 H new ATOM 0 HG LEU A 89 27.492 -20.773 24.753 1.00 31.31 H new ATOM 0 HD11 LEU A 89 27.384 -22.307 22.829 1.00 53.45 H new ATOM 0 HD12 LEU A 89 26.420 -20.836 22.556 1.00 53.45 H new ATOM 0 HD13 LEU A 89 28.007 -21.017 21.772 1.00 53.45 H new ATOM 0 HD21 LEU A 89 29.412 -22.229 24.230 1.00 73.22 H new ATOM 0 HD22 LEU A 89 30.114 -20.936 23.229 1.00 73.22 H new ATOM 0 HD23 LEU A 89 29.928 -20.701 24.984 1.00 73.22 H new ATOM 1456 N ASN A 90 25.718 -19.361 25.918 1.00 71.52 N ATOM 1457 CA ASN A 90 25.377 -19.704 27.294 1.00 64.22 C ATOM 1458 C ASN A 90 25.783 -21.140 27.613 1.00 4.33 C ATOM 1459 O ASN A 90 26.381 -21.827 26.785 1.00 75.15 O ATOM 1460 CB ASN A 90 23.877 -19.522 27.530 1.00 32.13 C ATOM 1461 CG ASN A 90 23.038 -20.418 26.640 1.00 62.43 C ATOM 1462 OD1 ASN A 90 22.627 -21.506 27.045 1.00 3.21 O ATOM 1463 ND2 ASN A 90 22.781 -19.965 25.419 1.00 55.34 N ATOM 0 H ASN A 90 25.135 -19.814 25.214 1.00 71.52 H new ATOM 0 HA ASN A 90 25.926 -19.034 27.956 1.00 64.22 H new ATOM 0 HB2 ASN A 90 23.648 -19.735 28.574 1.00 32.13 H new ATOM 0 HB3 ASN A 90 23.608 -18.481 27.350 1.00 32.13 H new ATOM 0 HD21 ASN A 90 22.223 -20.525 24.774 1.00 55.34 H new ATOM 0 HD22 ASN A 90 23.142 -19.057 25.125 1.00 55.34 H new ATOM 1470 N LYS A 91 25.455 -21.587 28.821 1.00 52.05 N ATOM 1471 CA LYS A 91 25.782 -22.941 29.251 1.00 65.03 C ATOM 1472 C LYS A 91 25.304 -23.967 28.229 1.00 72.40 C ATOM 1473 O LYS A 91 25.991 -24.951 27.956 1.00 32.11 O ATOM 1474 CB LYS A 91 25.152 -23.231 30.615 1.00 63.42 C ATOM 1475 CG LYS A 91 25.773 -22.439 31.752 1.00 14.14 C ATOM 1476 CD LYS A 91 24.860 -21.314 32.211 1.00 50.34 C ATOM 1477 CE LYS A 91 24.012 -21.734 33.401 1.00 10.44 C ATOM 1478 NZ LYS A 91 23.350 -20.568 34.050 1.00 43.32 N ATOM 0 H LYS A 91 24.963 -21.030 29.520 1.00 52.05 H new ATOM 0 HA LYS A 91 26.866 -23.017 29.335 1.00 65.03 H new ATOM 0 HB2 LYS A 91 24.086 -23.009 30.568 1.00 63.42 H new ATOM 0 HB3 LYS A 91 25.246 -24.295 30.831 1.00 63.42 H new ATOM 0 HG2 LYS A 91 25.981 -23.105 32.590 1.00 14.14 H new ATOM 0 HG3 LYS A 91 26.728 -22.025 31.429 1.00 14.14 H new ATOM 0 HD2 LYS A 91 25.460 -20.444 32.479 1.00 50.34 H new ATOM 0 HD3 LYS A 91 24.211 -21.013 31.389 1.00 50.34 H new ATOM 0 HE2 LYS A 91 23.254 -22.446 33.074 1.00 10.44 H new ATOM 0 HE3 LYS A 91 24.639 -22.248 34.130 1.00 10.44 H new ATOM 0 HZ1 LYS A 91 22.781 -20.896 34.857 1.00 43.32 H new ATOM 0 HZ2 LYS A 91 24.073 -19.900 34.385 1.00 43.32 H new ATOM 0 HZ3 LYS A 91 22.732 -20.092 33.362 1.00 43.32 H new ATOM 1492 N GLU A 92 24.123 -23.730 27.667 1.00 73.01 N ATOM 1493 CA GLU A 92 23.554 -24.635 26.675 1.00 50.43 C ATOM 1494 C GLU A 92 23.834 -24.136 25.260 1.00 52.20 C ATOM 1495 O GLU A 92 23.730 -22.941 24.979 1.00 71.03 O ATOM 1496 CB GLU A 92 22.046 -24.778 26.888 1.00 54.22 C ATOM 1497 CG GLU A 92 21.421 -25.902 26.079 1.00 74.11 C ATOM 1498 CD GLU A 92 21.899 -27.272 26.518 1.00 65.34 C ATOM 1499 OE1 GLU A 92 21.833 -28.213 25.699 1.00 30.41 O ATOM 1500 OE2 GLU A 92 22.340 -27.404 27.678 1.00 2.14 O ATOM 0 H GLU A 92 23.542 -22.920 27.881 1.00 73.01 H new ATOM 0 HA GLU A 92 24.025 -25.610 26.798 1.00 50.43 H new ATOM 0 HB2 GLU A 92 21.852 -24.952 27.946 1.00 54.22 H new ATOM 0 HB3 GLU A 92 21.560 -23.839 26.625 1.00 54.22 H new ATOM 0 HG2 GLU A 92 20.336 -25.852 26.173 1.00 74.11 H new ATOM 0 HG3 GLU A 92 21.656 -25.760 25.024 1.00 74.11 H new ATOM 1507 N LEU A 93 24.190 -25.059 24.373 1.00 13.33 N ATOM 1508 CA LEU A 93 24.485 -24.714 22.987 1.00 64.10 C ATOM 1509 C LEU A 93 23.230 -24.235 22.265 1.00 0.43 C ATOM 1510 O LEU A 93 22.103 -24.496 22.688 1.00 45.03 O ATOM 1511 CB LEU A 93 25.078 -25.920 22.256 1.00 23.13 C ATOM 1512 CG LEU A 93 26.602 -26.046 22.295 1.00 53.11 C ATOM 1513 CD1 LEU A 93 27.073 -26.397 23.698 1.00 40.34 C ATOM 1514 CD2 LEU A 93 27.076 -27.090 21.294 1.00 2.42 C ATOM 0 H LEU A 93 24.281 -26.052 24.589 1.00 13.33 H new ATOM 0 HA LEU A 93 25.213 -23.903 22.988 1.00 64.10 H new ATOM 0 HB2 LEU A 93 24.648 -26.826 22.683 1.00 23.13 H new ATOM 0 HB3 LEU A 93 24.763 -25.878 21.213 1.00 23.13 H new ATOM 0 HG LEU A 93 27.034 -25.084 22.019 1.00 53.11 H new ATOM 0 HD11 LEU A 93 28.160 -26.482 23.706 1.00 40.34 H new ATOM 0 HD12 LEU A 93 26.765 -25.614 24.392 1.00 40.34 H new ATOM 0 HD13 LEU A 93 26.632 -27.346 24.003 1.00 40.34 H new ATOM 0 HD21 LEU A 93 28.163 -27.167 21.335 1.00 2.42 H new ATOM 0 HD22 LEU A 93 26.635 -28.056 21.539 1.00 2.42 H new ATOM 0 HD23 LEU A 93 26.771 -26.796 20.290 1.00 2.42 H new ATOM 1526 N PRO A 94 23.426 -23.518 21.149 1.00 43.41 N ATOM 1527 CA PRO A 94 22.322 -22.989 20.343 1.00 33.01 C ATOM 1528 C PRO A 94 21.554 -24.090 19.619 1.00 43.44 C ATOM 1529 O PRO A 94 22.088 -25.171 19.366 1.00 13.41 O ATOM 1530 CB PRO A 94 23.023 -22.074 19.336 1.00 63.40 C ATOM 1531 CG PRO A 94 24.405 -22.620 19.228 1.00 44.22 C ATOM 1532 CD PRO A 94 24.742 -23.168 20.587 1.00 72.21 C ATOM 0 HA PRO A 94 21.578 -22.479 20.955 1.00 33.01 H new ATOM 0 HB2 PRO A 94 22.516 -22.085 18.371 1.00 63.40 H new ATOM 0 HB3 PRO A 94 23.031 -21.040 19.680 1.00 63.40 H new ATOM 0 HG2 PRO A 94 24.458 -23.400 18.469 1.00 44.22 H new ATOM 0 HG3 PRO A 94 25.110 -21.842 18.935 1.00 44.22 H new ATOM 0 HD2 PRO A 94 25.394 -24.039 20.519 1.00 72.21 H new ATOM 0 HD3 PRO A 94 25.258 -22.430 21.201 1.00 72.21 H new ATOM 1540 N THR A 95 20.298 -23.808 19.285 1.00 24.33 N ATOM 1541 CA THR A 95 19.457 -24.774 18.590 1.00 23.52 C ATOM 1542 C THR A 95 19.438 -24.508 17.089 1.00 5.15 C ATOM 1543 O THR A 95 19.754 -23.405 16.640 1.00 25.34 O ATOM 1544 CB THR A 95 18.012 -24.747 19.123 1.00 23.41 C ATOM 1545 OG1 THR A 95 18.019 -24.662 20.552 1.00 12.55 O ATOM 1546 CG2 THR A 95 17.252 -25.991 18.688 1.00 13.12 C ATOM 0 H THR A 95 19.841 -22.918 19.485 1.00 24.33 H new ATOM 0 HA THR A 95 19.887 -25.758 18.776 1.00 23.52 H new ATOM 0 HB THR A 95 17.512 -23.871 18.710 1.00 23.41 H new ATOM 0 HG1 THR A 95 17.117 -24.449 20.871 1.00 12.55 H new ATOM 0 HG21 THR A 95 16.234 -25.950 19.076 1.00 13.12 H new ATOM 0 HG22 THR A 95 17.224 -26.038 17.599 1.00 13.12 H new ATOM 0 HG23 THR A 95 17.753 -26.878 19.077 1.00 13.12 H new ATOM 1554 N LEU A 96 19.066 -25.523 16.318 1.00 52.22 N ATOM 1555 CA LEU A 96 19.005 -25.398 14.866 1.00 52.34 C ATOM 1556 C LEU A 96 20.366 -25.012 14.295 1.00 55.33 C ATOM 1557 O LEU A 96 20.463 -24.519 13.170 1.00 33.11 O ATOM 1558 CB LEU A 96 17.958 -24.356 14.467 1.00 12.03 C ATOM 1559 CG LEU A 96 18.476 -22.935 14.245 1.00 12.55 C ATOM 1560 CD1 LEU A 96 18.378 -22.554 12.776 1.00 0.03 C ATOM 1561 CD2 LEU A 96 17.704 -21.945 15.107 1.00 25.30 C ATOM 0 H LEU A 96 18.802 -26.442 16.674 1.00 52.22 H new ATOM 0 HA LEU A 96 18.720 -26.366 14.455 1.00 52.34 H new ATOM 0 HB2 LEU A 96 17.472 -24.691 13.551 1.00 12.03 H new ATOM 0 HB3 LEU A 96 17.192 -24.325 15.242 1.00 12.03 H new ATOM 0 HG LEU A 96 19.525 -22.902 14.539 1.00 12.55 H new ATOM 0 HD11 LEU A 96 18.751 -21.539 12.638 1.00 0.03 H new ATOM 0 HD12 LEU A 96 18.975 -23.245 12.180 1.00 0.03 H new ATOM 0 HD13 LEU A 96 17.337 -22.605 12.456 1.00 0.03 H new ATOM 0 HD21 LEU A 96 18.086 -20.939 14.936 1.00 25.30 H new ATOM 0 HD22 LEU A 96 16.647 -21.981 14.844 1.00 25.30 H new ATOM 0 HD23 LEU A 96 17.826 -22.206 16.158 1.00 25.30 H new ATOM 1573 N THR A 97 21.416 -25.241 15.077 1.00 42.55 N ATOM 1574 CA THR A 97 22.772 -24.918 14.649 1.00 33.00 C ATOM 1575 C THR A 97 23.349 -26.023 13.772 1.00 21.10 C ATOM 1576 O THR A 97 24.189 -25.768 12.910 1.00 53.25 O ATOM 1577 CB THR A 97 23.703 -24.696 15.855 1.00 4.04 C ATOM 1578 OG1 THR A 97 25.002 -24.295 15.404 1.00 20.52 O ATOM 1579 CG2 THR A 97 23.819 -25.963 16.690 1.00 2.50 C ATOM 0 H THR A 97 21.354 -25.649 16.010 1.00 42.55 H new ATOM 0 HA THR A 97 22.711 -23.995 14.072 1.00 33.00 H new ATOM 0 HB THR A 97 23.275 -23.909 16.476 1.00 4.04 H new ATOM 0 HG1 THR A 97 25.588 -24.154 16.177 1.00 20.52 H new ATOM 0 HG21 THR A 97 24.482 -25.782 17.536 1.00 2.50 H new ATOM 0 HG22 THR A 97 22.833 -26.249 17.056 1.00 2.50 H new ATOM 0 HG23 THR A 97 24.225 -26.767 16.077 1.00 2.50 H new ATOM 1587 N GLU A 98 22.893 -27.251 13.998 1.00 20.13 N ATOM 1588 CA GLU A 98 23.366 -28.395 13.227 1.00 12.04 C ATOM 1589 C GLU A 98 22.627 -28.496 11.896 1.00 63.51 C ATOM 1590 O GLU A 98 22.884 -29.399 11.098 1.00 52.31 O ATOM 1591 CB GLU A 98 23.181 -29.687 14.025 1.00 22.53 C ATOM 1592 CG GLU A 98 23.344 -29.505 15.525 1.00 70.40 C ATOM 1593 CD GLU A 98 22.021 -29.289 16.233 1.00 32.14 C ATOM 1594 OE1 GLU A 98 21.091 -28.746 15.602 1.00 73.13 O ATOM 1595 OE2 GLU A 98 21.916 -29.664 17.420 1.00 11.33 O ATOM 0 H GLU A 98 22.197 -27.479 14.708 1.00 20.13 H new ATOM 0 HA GLU A 98 24.427 -28.251 13.024 1.00 12.04 H new ATOM 0 HB2 GLU A 98 22.189 -30.090 13.822 1.00 22.53 H new ATOM 0 HB3 GLU A 98 23.903 -30.426 13.677 1.00 22.53 H new ATOM 0 HG2 GLU A 98 23.836 -30.383 15.943 1.00 70.40 H new ATOM 0 HG3 GLU A 98 23.997 -28.653 15.715 1.00 70.40 H new ATOM 1602 N HIS A 99 21.708 -27.565 11.663 1.00 2.31 N ATOM 1603 CA HIS A 99 20.932 -27.548 10.429 1.00 74.45 C ATOM 1604 C HIS A 99 21.827 -27.802 9.220 1.00 64.22 C ATOM 1605 O HIS A 99 21.475 -28.567 8.322 1.00 53.02 O ATOM 1606 CB HIS A 99 20.211 -26.209 10.272 1.00 44.21 C ATOM 1607 CG HIS A 99 18.757 -26.266 10.625 1.00 51.11 C ATOM 1608 ND1 HIS A 99 18.226 -27.212 11.476 1.00 74.13 N ATOM 1609 CD2 HIS A 99 17.721 -25.486 10.238 1.00 12.42 C ATOM 1610 CE1 HIS A 99 16.925 -27.012 11.596 1.00 62.44 C ATOM 1611 NE2 HIS A 99 16.594 -25.970 10.855 1.00 73.21 N ATOM 0 H HIS A 99 21.482 -26.812 12.313 1.00 2.31 H new ATOM 0 HA HIS A 99 20.192 -28.346 10.485 1.00 74.45 H new ATOM 0 HB2 HIS A 99 20.700 -25.466 10.902 1.00 44.21 H new ATOM 0 HB3 HIS A 99 20.313 -25.870 9.241 1.00 44.21 H new ATOM 0 HD1 HIS A 99 18.754 -27.951 11.940 1.00 74.13 H new ATOM 0 HD2 HIS A 99 17.771 -24.640 9.568 1.00 12.42 H new ATOM 0 HE1 HIS A 99 16.248 -27.600 12.198 1.00 62.44 H new ATOM 1619 N LYS A 100 22.988 -27.155 9.203 1.00 13.02 N ATOM 1620 CA LYS A 100 23.935 -27.310 8.106 1.00 62.02 C ATOM 1621 C LYS A 100 25.055 -28.274 8.486 1.00 53.15 C ATOM 1622 O LYS A 100 25.236 -29.312 7.849 1.00 52.43 O ATOM 1623 CB LYS A 100 24.526 -25.952 7.719 1.00 20.32 C ATOM 1624 CG LYS A 100 24.898 -25.847 6.250 1.00 14.43 C ATOM 1625 CD LYS A 100 26.301 -26.368 5.991 1.00 4.43 C ATOM 1626 CE LYS A 100 27.278 -25.231 5.729 1.00 71.43 C ATOM 1627 NZ LYS A 100 28.346 -25.629 4.770 1.00 2.43 N ATOM 0 H LYS A 100 23.295 -26.518 9.938 1.00 13.02 H new ATOM 0 HA LYS A 100 23.398 -27.723 7.252 1.00 62.02 H new ATOM 0 HB2 LYS A 100 23.806 -25.170 7.960 1.00 20.32 H new ATOM 0 HB3 LYS A 100 25.413 -25.766 8.324 1.00 20.32 H new ATOM 0 HG2 LYS A 100 24.183 -26.412 5.652 1.00 14.43 H new ATOM 0 HG3 LYS A 100 24.830 -24.807 5.930 1.00 14.43 H new ATOM 0 HD2 LYS A 100 26.639 -26.949 6.849 1.00 4.43 H new ATOM 0 HD3 LYS A 100 26.288 -27.042 5.135 1.00 4.43 H new ATOM 0 HE2 LYS A 100 26.737 -24.371 5.334 1.00 71.43 H new ATOM 0 HE3 LYS A 100 27.732 -24.918 6.669 1.00 71.43 H new ATOM 0 HZ1 LYS A 100 29.271 -25.589 5.244 1.00 2.43 H new ATOM 0 HZ2 LYS A 100 28.170 -26.598 4.437 1.00 2.43 H new ATOM 0 HZ3 LYS A 100 28.344 -24.978 3.959 1.00 2.43 H new ATOM 1641 N SER A 101 25.802 -27.925 9.528 1.00 41.43 N ATOM 1642 CA SER A 101 26.905 -28.758 9.991 1.00 64.13 C ATOM 1643 C SER A 101 27.659 -28.078 11.130 1.00 60.12 C ATOM 1644 O SER A 101 27.231 -27.043 11.641 1.00 51.33 O ATOM 1645 CB SER A 101 27.864 -29.058 8.837 1.00 25.52 C ATOM 1646 OG SER A 101 28.079 -30.453 8.702 1.00 12.31 O ATOM 0 H SER A 101 25.663 -27.071 10.068 1.00 41.43 H new ATOM 0 HA SER A 101 26.489 -29.695 10.362 1.00 64.13 H new ATOM 0 HB2 SER A 101 27.457 -28.658 7.908 1.00 25.52 H new ATOM 0 HB3 SER A 101 28.815 -28.555 9.011 1.00 25.52 H new ATOM 0 HG SER A 101 28.694 -30.619 7.957 1.00 12.31 H new ATOM 1652 N ILE A 102 28.783 -28.668 11.522 1.00 20.12 N ATOM 1653 CA ILE A 102 29.597 -28.120 12.600 1.00 42.54 C ATOM 1654 C ILE A 102 30.836 -27.420 12.051 1.00 41.21 C ATOM 1655 O ILE A 102 31.817 -28.068 11.688 1.00 71.22 O ATOM 1656 CB ILE A 102 30.036 -29.216 13.588 1.00 62.22 C ATOM 1657 CG1 ILE A 102 28.862 -29.633 14.475 1.00 34.42 C ATOM 1658 CG2 ILE A 102 31.201 -28.729 14.436 1.00 22.03 C ATOM 1659 CD1 ILE A 102 28.641 -31.129 14.522 1.00 60.23 C ATOM 0 H ILE A 102 29.151 -29.525 11.109 1.00 20.12 H new ATOM 0 HA ILE A 102 28.976 -27.396 13.127 1.00 42.54 H new ATOM 0 HB ILE A 102 30.365 -30.086 13.020 1.00 62.22 H new ATOM 0 HG12 ILE A 102 29.034 -29.267 15.487 1.00 34.42 H new ATOM 0 HG13 ILE A 102 27.954 -29.151 14.112 1.00 34.42 H new ATOM 0 HG21 ILE A 102 31.500 -29.515 15.129 1.00 22.03 H new ATOM 0 HG22 ILE A 102 32.041 -28.477 13.789 1.00 22.03 H new ATOM 0 HG23 ILE A 102 30.898 -27.846 14.998 1.00 22.03 H new ATOM 0 HD11 ILE A 102 27.793 -31.351 15.170 1.00 60.23 H new ATOM 0 HD12 ILE A 102 28.437 -31.498 13.517 1.00 60.23 H new ATOM 0 HD13 ILE A 102 29.534 -31.617 14.913 1.00 60.23 H new ATOM 1671 N GLU A 103 30.784 -26.093 11.995 1.00 12.44 N ATOM 1672 CA GLU A 103 31.903 -25.305 11.492 1.00 71.11 C ATOM 1673 C GLU A 103 32.030 -23.990 12.255 1.00 13.22 C ATOM 1674 O GLU A 103 31.119 -23.162 12.241 1.00 10.21 O ATOM 1675 CB GLU A 103 31.727 -25.025 9.998 1.00 62.42 C ATOM 1676 CG GLU A 103 30.842 -26.037 9.289 1.00 22.12 C ATOM 1677 CD GLU A 103 30.820 -25.840 7.786 1.00 75.32 C ATOM 1678 OE1 GLU A 103 29.938 -25.103 7.298 1.00 55.20 O ATOM 1679 OE2 GLU A 103 31.683 -26.424 7.097 1.00 13.54 O ATOM 0 H GLU A 103 29.979 -25.541 12.292 1.00 12.44 H new ATOM 0 HA GLU A 103 32.816 -25.881 11.642 1.00 71.11 H new ATOM 0 HB2 GLU A 103 31.300 -24.030 9.871 1.00 62.42 H new ATOM 0 HB3 GLU A 103 32.707 -25.015 9.521 1.00 62.42 H new ATOM 0 HG2 GLU A 103 31.194 -27.043 9.515 1.00 22.12 H new ATOM 0 HG3 GLU A 103 29.826 -25.960 9.677 1.00 22.12 H new ATOM 1686 N TRP A 104 33.164 -23.806 12.920 1.00 24.13 N ATOM 1687 CA TRP A 104 33.411 -22.592 13.690 1.00 33.14 C ATOM 1688 C TRP A 104 34.606 -21.827 13.133 1.00 20.11 C ATOM 1689 O TRP A 104 35.757 -22.211 13.348 1.00 75.44 O ATOM 1690 CB TRP A 104 33.651 -22.936 15.161 1.00 35.42 C ATOM 1691 CG TRP A 104 32.867 -24.126 15.628 1.00 1.33 C ATOM 1692 CD1 TRP A 104 33.354 -25.225 16.276 1.00 60.12 C ATOM 1693 CD2 TRP A 104 31.458 -24.335 15.482 1.00 63.01 C ATOM 1694 NE1 TRP A 104 32.333 -26.105 16.541 1.00 72.42 N ATOM 1695 CE2 TRP A 104 31.160 -25.582 16.065 1.00 73.33 C ATOM 1696 CE3 TRP A 104 30.420 -23.590 14.917 1.00 12.45 C ATOM 1697 CZ2 TRP A 104 29.867 -26.098 16.096 1.00 30.35 C ATOM 1698 CZ3 TRP A 104 29.137 -24.103 14.950 1.00 64.35 C ATOM 1699 CH2 TRP A 104 28.870 -25.347 15.536 1.00 34.33 C ATOM 0 H TRP A 104 33.928 -24.482 12.942 1.00 24.13 H new ATOM 0 HA TRP A 104 32.529 -21.957 13.612 1.00 33.14 H new ATOM 0 HB2 TRP A 104 34.713 -23.127 15.314 1.00 35.42 H new ATOM 0 HB3 TRP A 104 33.391 -22.074 15.776 1.00 35.42 H new ATOM 0 HD1 TRP A 104 34.389 -25.380 16.541 1.00 60.12 H new ATOM 0 HE1 TRP A 104 32.432 -27.002 17.015 1.00 72.42 H new ATOM 0 HE3 TRP A 104 30.617 -22.630 14.462 1.00 12.45 H new ATOM 0 HZ2 TRP A 104 29.659 -27.057 16.546 1.00 30.35 H new ATOM 0 HZ3 TRP A 104 28.327 -23.535 14.517 1.00 64.35 H new ATOM 0 HH2 TRP A 104 27.857 -25.721 15.546 1.00 34.33 H new ATOM 1710 N LEU A 105 34.328 -20.743 12.417 1.00 33.23 N ATOM 1711 CA LEU A 105 35.381 -19.923 11.829 1.00 23.51 C ATOM 1712 C LEU A 105 35.694 -18.721 12.714 1.00 24.54 C ATOM 1713 O LEU A 105 34.882 -18.325 13.550 1.00 51.23 O ATOM 1714 CB LEU A 105 34.968 -19.450 10.435 1.00 72.15 C ATOM 1715 CG LEU A 105 35.008 -20.505 9.328 1.00 3.12 C ATOM 1716 CD1 LEU A 105 36.367 -21.186 9.290 1.00 65.13 C ATOM 1717 CD2 LEU A 105 33.901 -21.530 9.528 1.00 45.12 C ATOM 0 H LEU A 105 33.382 -20.412 12.230 1.00 33.23 H new ATOM 0 HA LEU A 105 36.280 -20.534 11.747 1.00 23.51 H new ATOM 0 HB2 LEU A 105 33.955 -19.052 10.494 1.00 72.15 H new ATOM 0 HB3 LEU A 105 35.618 -18.624 10.146 1.00 72.15 H new ATOM 0 HG LEU A 105 34.846 -20.008 8.372 1.00 3.12 H new ATOM 0 HD11 LEU A 105 36.377 -21.933 8.497 1.00 65.13 H new ATOM 0 HD12 LEU A 105 37.141 -20.443 9.099 1.00 65.13 H new ATOM 0 HD13 LEU A 105 36.558 -21.671 10.247 1.00 65.13 H new ATOM 0 HD21 LEU A 105 33.945 -22.273 8.731 1.00 45.12 H new ATOM 0 HD22 LEU A 105 34.031 -22.023 10.491 1.00 45.12 H new ATOM 0 HD23 LEU A 105 32.933 -21.029 9.505 1.00 45.12 H new ATOM 1729 N SER A 106 36.877 -18.145 12.524 1.00 12.21 N ATOM 1730 CA SER A 106 37.298 -16.989 13.307 1.00 41.45 C ATOM 1731 C SER A 106 36.717 -15.701 12.729 1.00 23.34 C ATOM 1732 O SER A 106 36.143 -15.701 11.640 1.00 15.54 O ATOM 1733 CB SER A 106 38.825 -16.901 13.344 1.00 0.40 C ATOM 1734 OG SER A 106 39.263 -16.087 14.419 1.00 73.05 O ATOM 0 H SER A 106 37.560 -18.460 11.835 1.00 12.21 H new ATOM 0 HA SER A 106 36.923 -17.113 14.323 1.00 41.45 H new ATOM 0 HB2 SER A 106 39.248 -17.901 13.445 1.00 0.40 H new ATOM 0 HB3 SER A 106 39.192 -16.493 12.402 1.00 0.40 H new ATOM 0 HG SER A 106 39.881 -15.405 14.082 1.00 73.05 H new ATOM 1740 N ILE A 107 36.872 -14.607 13.467 1.00 34.24 N ATOM 1741 CA ILE A 107 36.364 -13.313 13.029 1.00 32.04 C ATOM 1742 C ILE A 107 37.217 -12.740 11.903 1.00 62.41 C ATOM 1743 O ILE A 107 36.771 -11.874 11.152 1.00 62.23 O ATOM 1744 CB ILE A 107 36.322 -12.302 14.191 1.00 74.51 C ATOM 1745 CG1 ILE A 107 35.469 -12.847 15.339 1.00 54.24 C ATOM 1746 CG2 ILE A 107 35.780 -10.965 13.710 1.00 41.35 C ATOM 1747 CD1 ILE A 107 35.433 -11.939 16.548 1.00 32.00 C ATOM 0 H ILE A 107 37.345 -14.591 14.371 1.00 34.24 H new ATOM 0 HA ILE A 107 35.350 -13.479 12.665 1.00 32.04 H new ATOM 0 HB ILE A 107 37.337 -12.150 14.558 1.00 74.51 H new ATOM 0 HG12 ILE A 107 34.451 -13.004 14.982 1.00 54.24 H new ATOM 0 HG13 ILE A 107 35.856 -13.821 15.638 1.00 54.24 H new ATOM 0 HG21 ILE A 107 35.756 -10.261 14.542 1.00 41.35 H new ATOM 0 HG22 ILE A 107 36.424 -10.574 12.922 1.00 41.35 H new ATOM 0 HG23 ILE A 107 34.771 -11.100 13.321 1.00 41.35 H new ATOM 0 HD11 ILE A 107 34.810 -12.388 17.322 1.00 32.00 H new ATOM 0 HD12 ILE A 107 36.445 -11.802 16.930 1.00 32.00 H new ATOM 0 HD13 ILE A 107 35.018 -10.972 16.264 1.00 32.00 H new ATOM 1759 N ASN A 108 38.447 -13.232 11.791 1.00 71.12 N ATOM 1760 CA ASN A 108 39.363 -12.770 10.754 1.00 22.25 C ATOM 1761 C ASN A 108 39.233 -13.621 9.495 1.00 52.45 C ATOM 1762 O ASN A 108 39.919 -13.384 8.501 1.00 54.42 O ATOM 1763 CB ASN A 108 40.805 -12.812 11.264 1.00 2.42 C ATOM 1764 CG ASN A 108 41.149 -14.136 11.918 1.00 4.23 C ATOM 1765 OD1 ASN A 108 41.024 -14.193 13.239 1.00 75.33 O flip ATOM 1766 ND2 ASN A 108 41.524 -15.095 11.244 1.00 31.40 N flip ATOM 0 H ASN A 108 38.832 -13.950 12.405 1.00 71.12 H new ATOM 0 HA ASN A 108 39.102 -11.742 10.505 1.00 22.25 H new ATOM 0 HB2 ASN A 108 41.487 -12.633 10.433 1.00 2.42 H new ATOM 0 HB3 ASN A 108 40.957 -12.005 11.981 1.00 2.42 H new ATOM 0 HD21 ASN A 108 41.605 -15.006 10.231 1.00 31.40 H new ATOM 0 HD22 ASN A 108 41.753 -15.979 11.698 1.00 31.40 H new ATOM 1773 N GLU A 109 38.347 -14.611 9.545 1.00 43.15 N ATOM 1774 CA GLU A 109 38.128 -15.496 8.407 1.00 74.40 C ATOM 1775 C GLU A 109 36.637 -15.665 8.129 1.00 54.02 C ATOM 1776 O GLU A 109 36.240 -16.425 7.244 1.00 25.22 O ATOM 1777 CB GLU A 109 38.767 -16.862 8.664 1.00 22.35 C ATOM 1778 CG GLU A 109 40.244 -16.919 8.313 1.00 4.43 C ATOM 1779 CD GLU A 109 40.497 -16.767 6.826 1.00 54.32 C ATOM 1780 OE1 GLU A 109 39.550 -16.982 6.039 1.00 4.33 O ATOM 1781 OE2 GLU A 109 41.639 -16.434 6.448 1.00 2.41 O ATOM 0 H GLU A 109 37.770 -14.820 10.360 1.00 43.15 H new ATOM 0 HA GLU A 109 38.595 -15.043 7.532 1.00 74.40 H new ATOM 0 HB2 GLU A 109 38.642 -17.120 9.716 1.00 22.35 H new ATOM 0 HB3 GLU A 109 38.235 -17.617 8.085 1.00 22.35 H new ATOM 0 HG2 GLU A 109 40.772 -16.131 8.850 1.00 4.43 H new ATOM 0 HG3 GLU A 109 40.658 -17.868 8.653 1.00 4.43 H new ATOM 1788 N LEU A 110 35.815 -14.952 8.890 1.00 14.43 N ATOM 1789 CA LEU A 110 34.367 -15.022 8.727 1.00 14.54 C ATOM 1790 C LEU A 110 33.965 -14.719 7.287 1.00 24.41 C ATOM 1791 O LEU A 110 32.922 -15.172 6.815 1.00 42.41 O ATOM 1792 CB LEU A 110 33.679 -14.039 9.677 1.00 34.41 C ATOM 1793 CG LEU A 110 34.224 -12.611 9.676 1.00 2.11 C ATOM 1794 CD1 LEU A 110 33.710 -11.844 8.467 1.00 24.24 C ATOM 1795 CD2 LEU A 110 33.846 -11.895 10.964 1.00 2.34 C ATOM 0 H LEU A 110 36.126 -14.318 9.626 1.00 14.43 H new ATOM 0 HA LEU A 110 34.048 -16.036 8.968 1.00 14.54 H new ATOM 0 HB2 LEU A 110 32.619 -14.002 9.424 1.00 34.41 H new ATOM 0 HB3 LEU A 110 33.752 -14.433 10.691 1.00 34.41 H new ATOM 0 HG LEU A 110 35.311 -12.658 9.615 1.00 2.11 H new ATOM 0 HD11 LEU A 110 34.108 -10.830 8.483 1.00 24.24 H new ATOM 0 HD12 LEU A 110 34.032 -12.346 7.554 1.00 24.24 H new ATOM 0 HD13 LEU A 110 32.621 -11.807 8.496 1.00 24.24 H new ATOM 0 HD21 LEU A 110 34.242 -10.880 10.946 1.00 2.34 H new ATOM 0 HD22 LEU A 110 32.760 -11.859 11.055 1.00 2.34 H new ATOM 0 HD23 LEU A 110 34.264 -12.432 11.815 1.00 2.34 H new ATOM 1807 N ASP A 111 34.801 -13.954 6.594 1.00 64.52 N ATOM 1808 CA ASP A 111 34.536 -13.595 5.206 1.00 51.42 C ATOM 1809 C ASP A 111 34.352 -14.842 4.347 1.00 43.34 C ATOM 1810 O ASP A 111 33.665 -14.810 3.326 1.00 72.03 O ATOM 1811 CB ASP A 111 35.677 -12.741 4.651 1.00 63.14 C ATOM 1812 CG ASP A 111 36.995 -13.490 4.614 1.00 1.32 C ATOM 1813 OD1 ASP A 111 37.738 -13.431 5.616 1.00 42.11 O ATOM 1814 OD2 ASP A 111 37.284 -14.134 3.584 1.00 52.33 O ATOM 0 H ASP A 111 35.668 -13.571 6.971 1.00 64.52 H new ATOM 0 HA ASP A 111 33.612 -13.017 5.176 1.00 51.42 H new ATOM 0 HB2 ASP A 111 35.422 -12.409 3.644 1.00 63.14 H new ATOM 0 HB3 ASP A 111 35.788 -11.846 5.263 1.00 63.14 H new ATOM 1819 N LYS A 112 34.972 -15.939 4.766 1.00 25.40 N ATOM 1820 CA LYS A 112 34.878 -17.198 4.036 1.00 23.23 C ATOM 1821 C LYS A 112 33.473 -17.782 4.137 1.00 55.41 C ATOM 1822 O LYS A 112 33.127 -18.723 3.421 1.00 1.41 O ATOM 1823 CB LYS A 112 35.899 -18.202 4.577 1.00 74.41 C ATOM 1824 CG LYS A 112 35.454 -18.894 5.854 1.00 13.31 C ATOM 1825 CD LYS A 112 34.780 -20.224 5.563 1.00 64.34 C ATOM 1826 CE LYS A 112 35.670 -21.396 5.950 1.00 14.23 C ATOM 1827 NZ LYS A 112 35.805 -22.380 4.841 1.00 30.33 N ATOM 0 H LYS A 112 35.546 -15.982 5.608 1.00 25.40 H new ATOM 0 HA LYS A 112 35.095 -16.998 2.987 1.00 23.23 H new ATOM 0 HB2 LYS A 112 36.094 -18.956 3.814 1.00 74.41 H new ATOM 0 HB3 LYS A 112 36.841 -17.685 4.763 1.00 74.41 H new ATOM 0 HG2 LYS A 112 36.317 -19.056 6.500 1.00 13.31 H new ATOM 0 HG3 LYS A 112 34.765 -18.248 6.398 1.00 13.31 H new ATOM 0 HD2 LYS A 112 33.839 -20.284 6.110 1.00 64.34 H new ATOM 0 HD3 LYS A 112 34.536 -20.285 4.502 1.00 64.34 H new ATOM 0 HE2 LYS A 112 36.657 -21.026 6.229 1.00 14.23 H new ATOM 0 HE3 LYS A 112 35.256 -21.892 6.827 1.00 14.23 H new ATOM 0 HZ1 LYS A 112 36.419 -23.163 5.144 1.00 30.33 H new ATOM 0 HZ2 LYS A 112 34.867 -22.752 4.591 1.00 30.33 H new ATOM 0 HZ3 LYS A 112 36.224 -21.913 4.012 1.00 30.33 H new ATOM 1841 N LEU A 113 32.665 -17.217 5.028 1.00 41.11 N ATOM 1842 CA LEU A 113 31.295 -17.680 5.221 1.00 63.30 C ATOM 1843 C LEU A 113 30.306 -16.772 4.497 1.00 63.40 C ATOM 1844 O LEU A 113 29.227 -16.481 5.010 1.00 52.54 O ATOM 1845 CB LEU A 113 30.959 -17.733 6.712 1.00 3.03 C ATOM 1846 CG LEU A 113 31.875 -18.600 7.577 1.00 63.35 C ATOM 1847 CD1 LEU A 113 32.380 -17.813 8.776 1.00 62.12 C ATOM 1848 CD2 LEU A 113 31.148 -19.858 8.029 1.00 13.35 C ATOM 0 H LEU A 113 32.935 -16.438 5.628 1.00 41.11 H new ATOM 0 HA LEU A 113 31.214 -18.682 4.801 1.00 63.30 H new ATOM 0 HB2 LEU A 113 30.978 -16.716 7.104 1.00 3.03 H new ATOM 0 HB3 LEU A 113 29.938 -18.098 6.821 1.00 3.03 H new ATOM 0 HG LEU A 113 32.735 -18.898 6.977 1.00 63.35 H new ATOM 0 HD11 LEU A 113 33.030 -18.447 9.379 1.00 62.12 H new ATOM 0 HD12 LEU A 113 32.939 -16.943 8.431 1.00 62.12 H new ATOM 0 HD13 LEU A 113 31.533 -17.484 9.378 1.00 62.12 H new ATOM 0 HD21 LEU A 113 31.815 -20.463 8.643 1.00 13.35 H new ATOM 0 HD22 LEU A 113 30.269 -19.581 8.612 1.00 13.35 H new ATOM 0 HD23 LEU A 113 30.838 -20.433 7.156 1.00 13.35 H new ATOM 1860 N ASN A 114 30.682 -16.331 3.301 1.00 3.10 N ATOM 1861 CA ASN A 114 29.827 -15.458 2.505 1.00 4.53 C ATOM 1862 C ASN A 114 28.365 -15.611 2.911 1.00 13.24 C ATOM 1863 O ASN A 114 27.714 -16.596 2.564 1.00 31.44 O ATOM 1864 CB ASN A 114 29.990 -15.769 1.016 1.00 1.31 C ATOM 1865 CG ASN A 114 29.791 -14.544 0.144 1.00 2.24 C ATOM 1866 OD1 ASN A 114 29.648 -13.428 0.645 1.00 35.53 O ATOM 1867 ND2 ASN A 114 29.782 -14.747 -1.168 1.00 33.01 N ATOM 0 H ASN A 114 31.573 -16.564 2.862 1.00 3.10 H new ATOM 0 HA ASN A 114 30.131 -14.427 2.689 1.00 4.53 H new ATOM 0 HB2 ASN A 114 30.984 -16.179 0.840 1.00 1.31 H new ATOM 0 HB3 ASN A 114 29.273 -16.537 0.727 1.00 1.31 H new ATOM 0 HD21 ASN A 114 29.653 -13.961 -1.805 1.00 33.01 H new ATOM 0 HD22 ASN A 114 29.904 -15.689 -1.539 1.00 33.01 H new ATOM 1874 N TRP A 115 27.855 -14.630 3.647 1.00 1.22 N ATOM 1875 CA TRP A 115 26.469 -14.655 4.100 1.00 31.21 C ATOM 1876 C TRP A 115 25.572 -13.865 3.153 1.00 23.23 C ATOM 1877 O TRP A 115 26.043 -13.292 2.172 1.00 43.04 O ATOM 1878 CB TRP A 115 26.363 -14.087 5.516 1.00 0.51 C ATOM 1879 CG TRP A 115 27.561 -14.384 6.367 1.00 54.12 C ATOM 1880 CD1 TRP A 115 28.784 -13.781 6.299 1.00 1.22 C ATOM 1881 CD2 TRP A 115 27.649 -15.359 7.411 1.00 21.31 C ATOM 1882 NE1 TRP A 115 29.628 -14.323 7.239 1.00 52.43 N ATOM 1883 CE2 TRP A 115 28.955 -15.292 7.934 1.00 23.23 C ATOM 1884 CE3 TRP A 115 26.752 -16.281 7.957 1.00 73.13 C ATOM 1885 CZ2 TRP A 115 29.383 -16.113 8.974 1.00 2.14 C ATOM 1886 CZ3 TRP A 115 27.178 -17.095 8.989 1.00 61.12 C ATOM 1887 CH2 TRP A 115 28.484 -17.006 9.489 1.00 32.35 C ATOM 0 H TRP A 115 28.380 -13.807 3.943 1.00 1.22 H new ATOM 0 HA TRP A 115 26.134 -15.692 4.107 1.00 31.21 H new ATOM 0 HB2 TRP A 115 26.227 -13.007 5.457 1.00 0.51 H new ATOM 0 HB3 TRP A 115 25.474 -14.495 5.998 1.00 0.51 H new ATOM 0 HD1 TRP A 115 29.049 -12.994 5.608 1.00 1.22 H new ATOM 0 HE1 TRP A 115 30.598 -14.048 7.394 1.00 52.43 H new ATOM 0 HE3 TRP A 115 25.743 -16.356 7.579 1.00 73.13 H new ATOM 0 HZ2 TRP A 115 30.389 -16.047 9.360 1.00 2.14 H new ATOM 0 HZ3 TRP A 115 26.493 -17.812 9.417 1.00 61.12 H new ATOM 0 HH2 TRP A 115 28.787 -17.655 10.297 1.00 32.35 H new ATOM 1898 N ALA A 116 24.278 -13.839 3.455 1.00 42.03 N ATOM 1899 CA ALA A 116 23.316 -13.117 2.631 1.00 5.10 C ATOM 1900 C ALA A 116 23.742 -11.666 2.434 1.00 4.12 C ATOM 1901 O ALA A 116 24.626 -11.154 3.122 1.00 32.34 O ATOM 1902 CB ALA A 116 21.931 -13.182 3.257 1.00 23.11 C ATOM 0 H ALA A 116 23.872 -14.309 4.264 1.00 42.03 H new ATOM 0 HA ALA A 116 23.283 -13.595 1.652 1.00 5.10 H new ATOM 0 HB1 ALA A 116 21.223 -12.639 2.631 1.00 23.11 H new ATOM 0 HB2 ALA A 116 21.618 -14.223 3.340 1.00 23.11 H new ATOM 0 HB3 ALA A 116 21.959 -12.731 4.249 1.00 23.11 H new ATOM 1908 N PRO A 117 23.101 -10.986 1.472 1.00 4.53 N ATOM 1909 CA PRO A 117 23.398 -9.584 1.163 1.00 53.33 C ATOM 1910 C PRO A 117 22.945 -8.637 2.270 1.00 63.44 C ATOM 1911 O PRO A 117 23.373 -7.485 2.327 1.00 11.01 O ATOM 1912 CB PRO A 117 22.601 -9.327 -0.119 1.00 32.32 C ATOM 1913 CG PRO A 117 21.486 -10.315 -0.076 1.00 0.35 C ATOM 1914 CD PRO A 117 22.038 -11.532 0.613 1.00 33.22 C ATOM 0 HA PRO A 117 24.469 -9.408 1.059 1.00 53.33 H new ATOM 0 HB2 PRO A 117 22.223 -8.305 -0.152 1.00 32.32 H new ATOM 0 HB3 PRO A 117 23.220 -9.467 -1.005 1.00 32.32 H new ATOM 0 HG2 PRO A 117 20.630 -9.914 0.467 1.00 0.35 H new ATOM 0 HG3 PRO A 117 21.141 -10.558 -1.081 1.00 0.35 H new ATOM 0 HD2 PRO A 117 21.273 -12.044 1.197 1.00 33.22 H new ATOM 0 HD3 PRO A 117 22.431 -12.255 -0.102 1.00 33.22 H new ATOM 1922 N ALA A 118 22.078 -9.132 3.147 1.00 63.11 N ATOM 1923 CA ALA A 118 21.570 -8.331 4.254 1.00 61.04 C ATOM 1924 C ALA A 118 22.457 -8.472 5.486 1.00 20.10 C ATOM 1925 O ALA A 118 22.564 -7.550 6.295 1.00 52.25 O ATOM 1926 CB ALA A 118 20.139 -8.732 4.582 1.00 45.31 C ATOM 0 H ALA A 118 21.713 -10.084 3.112 1.00 63.11 H new ATOM 0 HA ALA A 118 21.582 -7.285 3.949 1.00 61.04 H new ATOM 0 HB1 ALA A 118 19.772 -8.126 5.410 1.00 45.31 H new ATOM 0 HB2 ALA A 118 19.507 -8.573 3.708 1.00 45.31 H new ATOM 0 HB3 ALA A 118 20.111 -9.785 4.863 1.00 45.31 H new ATOM 1932 N ASP A 119 23.090 -9.632 5.624 1.00 45.44 N ATOM 1933 CA ASP A 119 23.969 -9.893 6.758 1.00 71.11 C ATOM 1934 C ASP A 119 25.422 -9.602 6.398 1.00 25.10 C ATOM 1935 O ASP A 119 26.250 -9.347 7.274 1.00 54.12 O ATOM 1936 CB ASP A 119 23.825 -11.345 7.218 1.00 40.24 C ATOM 1937 CG ASP A 119 22.824 -11.498 8.346 1.00 62.31 C ATOM 1938 OD1 ASP A 119 21.630 -11.205 8.125 1.00 64.24 O ATOM 1939 OD2 ASP A 119 23.235 -11.912 9.450 1.00 34.41 O ATOM 0 H ASP A 119 23.011 -10.406 4.965 1.00 45.44 H new ATOM 0 HA ASP A 119 23.676 -9.231 7.573 1.00 71.11 H new ATOM 0 HB2 ASP A 119 23.514 -11.961 6.374 1.00 40.24 H new ATOM 0 HB3 ASP A 119 24.796 -11.718 7.545 1.00 40.24 H new ATOM 1944 N ILE A 120 25.726 -9.644 5.105 1.00 2.52 N ATOM 1945 CA ILE A 120 27.080 -9.384 4.630 1.00 33.33 C ATOM 1946 C ILE A 120 27.661 -8.135 5.282 1.00 1.54 C ATOM 1947 O ILE A 120 28.729 -8.163 5.894 1.00 44.11 O ATOM 1948 CB ILE A 120 27.117 -9.216 3.100 1.00 53.31 C ATOM 1949 CG1 ILE A 120 27.338 -10.569 2.421 1.00 15.00 C ATOM 1950 CG2 ILE A 120 28.208 -8.233 2.702 1.00 55.24 C ATOM 1951 CD1 ILE A 120 26.729 -10.658 1.039 1.00 33.32 C ATOM 0 H ILE A 120 25.053 -9.855 4.368 1.00 2.52 H new ATOM 0 HA ILE A 120 27.683 -10.249 4.907 1.00 33.33 H new ATOM 0 HB ILE A 120 26.158 -8.818 2.770 1.00 53.31 H new ATOM 0 HG12 ILE A 120 28.409 -10.760 2.350 1.00 15.00 H new ATOM 0 HG13 ILE A 120 26.914 -11.354 3.047 1.00 15.00 H new ATOM 0 HG21 ILE A 120 28.222 -8.125 1.618 1.00 55.24 H new ATOM 0 HG22 ILE A 120 28.010 -7.264 3.161 1.00 55.24 H new ATOM 0 HG23 ILE A 120 29.175 -8.605 3.042 1.00 55.24 H new ATOM 0 HD11 ILE A 120 26.925 -11.644 0.618 1.00 33.32 H new ATOM 0 HD12 ILE A 120 25.653 -10.498 1.105 1.00 33.32 H new ATOM 0 HD13 ILE A 120 27.170 -9.896 0.397 1.00 33.32 H new ATOM 1963 N PRO A 121 26.942 -7.010 5.152 1.00 50.11 N ATOM 1964 CA PRO A 121 27.366 -5.728 5.724 1.00 73.41 C ATOM 1965 C PRO A 121 27.286 -5.719 7.247 1.00 45.34 C ATOM 1966 O PRO A 121 27.885 -4.867 7.903 1.00 30.33 O ATOM 1967 CB PRO A 121 26.370 -4.729 5.130 1.00 3.52 C ATOM 1968 CG PRO A 121 25.159 -5.538 4.821 1.00 34.34 C ATOM 1969 CD PRO A 121 25.659 -6.903 4.436 1.00 4.23 C ATOM 0 HA PRO A 121 28.407 -5.502 5.493 1.00 73.41 H new ATOM 0 HB2 PRO A 121 26.143 -3.930 5.836 1.00 3.52 H new ATOM 0 HB3 PRO A 121 26.770 -4.257 4.233 1.00 3.52 H new ATOM 0 HG2 PRO A 121 24.497 -5.594 5.685 1.00 34.34 H new ATOM 0 HG3 PRO A 121 24.587 -5.089 4.009 1.00 34.34 H new ATOM 0 HD2 PRO A 121 24.963 -7.686 4.738 1.00 4.23 H new ATOM 0 HD3 PRO A 121 25.792 -6.993 3.358 1.00 4.23 H new ATOM 1977 N ALA A 122 26.544 -6.671 7.802 1.00 63.10 N ATOM 1978 CA ALA A 122 26.389 -6.773 9.248 1.00 62.23 C ATOM 1979 C ALA A 122 27.521 -7.587 9.865 1.00 24.02 C ATOM 1980 O ALA A 122 27.934 -7.336 10.998 1.00 73.33 O ATOM 1981 CB ALA A 122 25.043 -7.393 9.592 1.00 52.24 C ATOM 0 H ALA A 122 26.041 -7.383 7.272 1.00 63.10 H new ATOM 0 HA ALA A 122 26.431 -5.767 9.665 1.00 62.23 H new ATOM 0 HB1 ALA A 122 24.941 -7.463 10.675 1.00 52.24 H new ATOM 0 HB2 ALA A 122 24.243 -6.771 9.192 1.00 52.24 H new ATOM 0 HB3 ALA A 122 24.980 -8.390 9.156 1.00 52.24 H new ATOM 1987 N VAL A 123 28.020 -8.564 9.114 1.00 41.42 N ATOM 1988 CA VAL A 123 29.105 -9.414 9.587 1.00 23.44 C ATOM 1989 C VAL A 123 30.436 -8.670 9.568 1.00 73.22 C ATOM 1990 O VAL A 123 31.185 -8.692 10.543 1.00 21.31 O ATOM 1991 CB VAL A 123 29.231 -10.691 8.734 1.00 11.24 C ATOM 1992 CG1 VAL A 123 30.549 -11.395 9.019 1.00 74.54 C ATOM 1993 CG2 VAL A 123 28.054 -11.620 8.990 1.00 11.12 C ATOM 0 H VAL A 123 27.689 -8.786 8.175 1.00 41.42 H new ATOM 0 HA VAL A 123 28.863 -9.693 10.613 1.00 23.44 H new ATOM 0 HB VAL A 123 29.218 -10.408 7.682 1.00 11.24 H new ATOM 0 HG11 VAL A 123 30.621 -12.295 8.408 1.00 74.54 H new ATOM 0 HG12 VAL A 123 31.377 -10.727 8.781 1.00 74.54 H new ATOM 0 HG13 VAL A 123 30.595 -11.668 10.073 1.00 74.54 H new ATOM 0 HG21 VAL A 123 28.159 -12.517 8.380 1.00 11.12 H new ATOM 0 HG22 VAL A 123 28.033 -11.899 10.044 1.00 11.12 H new ATOM 0 HG23 VAL A 123 27.126 -11.111 8.731 1.00 11.12 H new ATOM 2003 N ASN A 124 30.722 -8.011 8.450 1.00 63.12 N ATOM 2004 CA ASN A 124 31.963 -7.259 8.303 1.00 63.24 C ATOM 2005 C ASN A 124 32.150 -6.285 9.462 1.00 52.02 C ATOM 2006 O ASN A 124 33.273 -6.026 9.896 1.00 74.32 O ATOM 2007 CB ASN A 124 31.968 -6.497 6.976 1.00 61.43 C ATOM 2008 CG ASN A 124 32.271 -7.397 5.793 1.00 30.54 C ATOM 2009 OD1 ASN A 124 33.079 -8.321 5.893 1.00 32.11 O ATOM 2010 ND2 ASN A 124 31.622 -7.131 4.666 1.00 63.03 N ATOM 0 H ASN A 124 30.112 -7.982 7.633 1.00 63.12 H new ATOM 0 HA ASN A 124 32.791 -7.968 8.311 1.00 63.24 H new ATOM 0 HB2 ASN A 124 30.998 -6.023 6.829 1.00 61.43 H new ATOM 0 HB3 ASN A 124 32.709 -5.699 7.021 1.00 61.43 H new ATOM 0 HD21 ASN A 124 31.784 -7.703 3.837 1.00 63.03 H new ATOM 0 HD22 ASN A 124 30.961 -6.355 4.629 1.00 63.03 H new ATOM 2017 N LYS A 125 31.041 -5.748 9.960 1.00 44.51 N ATOM 2018 CA LYS A 125 31.080 -4.803 11.070 1.00 25.11 C ATOM 2019 C LYS A 125 31.794 -5.409 12.275 1.00 53.33 C ATOM 2020 O LYS A 125 32.508 -4.714 12.999 1.00 71.15 O ATOM 2021 CB LYS A 125 29.661 -4.385 11.461 1.00 22.34 C ATOM 2022 CG LYS A 125 29.556 -3.839 12.875 1.00 52.03 C ATOM 2023 CD LYS A 125 30.492 -2.661 13.088 1.00 32.35 C ATOM 2024 CE LYS A 125 29.728 -1.408 13.488 1.00 4.03 C ATOM 2025 NZ LYS A 125 29.813 -1.150 14.953 1.00 63.34 N ATOM 0 H LYS A 125 30.104 -5.951 9.612 1.00 44.51 H new ATOM 0 HA LYS A 125 31.635 -3.922 10.746 1.00 25.11 H new ATOM 0 HB2 LYS A 125 29.308 -3.628 10.761 1.00 22.34 H new ATOM 0 HB3 LYS A 125 28.998 -5.244 11.362 1.00 22.34 H new ATOM 0 HG2 LYS A 125 28.529 -3.530 13.071 1.00 52.03 H new ATOM 0 HG3 LYS A 125 29.793 -4.627 13.589 1.00 52.03 H new ATOM 0 HD2 LYS A 125 31.219 -2.908 13.862 1.00 32.35 H new ATOM 0 HD3 LYS A 125 31.053 -2.470 12.173 1.00 32.35 H new ATOM 0 HE2 LYS A 125 30.126 -0.551 12.945 1.00 4.03 H new ATOM 0 HE3 LYS A 125 28.683 -1.512 13.198 1.00 4.03 H new ATOM 0 HZ1 LYS A 125 29.280 -0.288 15.185 1.00 63.34 H new ATOM 0 HZ2 LYS A 125 29.410 -1.956 15.471 1.00 63.34 H new ATOM 0 HZ3 LYS A 125 30.809 -1.025 15.226 1.00 63.34 H new ATOM 2039 N ILE A 126 31.597 -6.706 12.483 1.00 73.25 N ATOM 2040 CA ILE A 126 32.224 -7.405 13.598 1.00 54.42 C ATOM 2041 C ILE A 126 33.744 -7.314 13.519 1.00 53.32 C ATOM 2042 O ILE A 126 34.412 -7.043 14.516 1.00 20.21 O ATOM 2043 CB ILE A 126 31.811 -8.888 13.637 1.00 54.20 C ATOM 2044 CG1 ILE A 126 30.291 -9.013 13.767 1.00 62.43 C ATOM 2045 CG2 ILE A 126 32.507 -9.601 14.786 1.00 34.24 C ATOM 2046 CD1 ILE A 126 29.715 -10.185 13.004 1.00 74.51 C ATOM 0 H ILE A 126 31.008 -7.295 11.894 1.00 73.25 H new ATOM 0 HA ILE A 126 31.880 -6.917 14.510 1.00 54.42 H new ATOM 0 HB ILE A 126 32.117 -9.360 12.704 1.00 54.20 H new ATOM 0 HG12 ILE A 126 30.031 -9.113 14.821 1.00 62.43 H new ATOM 0 HG13 ILE A 126 29.827 -8.094 13.410 1.00 62.43 H new ATOM 0 HG21 ILE A 126 32.205 -10.648 14.801 1.00 34.24 H new ATOM 0 HG22 ILE A 126 33.587 -9.537 14.653 1.00 34.24 H new ATOM 0 HG23 ILE A 126 32.228 -9.130 15.729 1.00 34.24 H new ATOM 0 HD11 ILE A 126 28.634 -10.212 13.141 1.00 74.51 H new ATOM 0 HD12 ILE A 126 29.944 -10.077 11.944 1.00 74.51 H new ATOM 0 HD13 ILE A 126 30.151 -11.112 13.377 1.00 74.51 H new ATOM 2058 N MET A 127 34.283 -7.540 12.325 1.00 3.25 N ATOM 2059 CA MET A 127 35.725 -7.480 12.115 1.00 22.25 C ATOM 2060 C MET A 127 36.303 -6.185 12.676 1.00 2.32 C ATOM 2061 O MET A 127 37.435 -6.156 13.161 1.00 40.22 O ATOM 2062 CB MET A 127 36.050 -7.594 10.625 1.00 62.21 C ATOM 2063 CG MET A 127 36.268 -9.024 10.158 1.00 24.31 C ATOM 2064 SD MET A 127 37.972 -9.339 9.658 1.00 72.40 S ATOM 2065 CE MET A 127 38.807 -9.275 11.241 1.00 31.02 C ATOM 0 H MET A 127 33.744 -7.766 11.489 1.00 3.25 H new ATOM 0 HA MET A 127 36.179 -8.318 12.644 1.00 22.25 H new ATOM 0 HB2 MET A 127 35.236 -7.153 10.049 1.00 62.21 H new ATOM 0 HB3 MET A 127 36.945 -7.010 10.411 1.00 62.21 H new ATOM 0 HG2 MET A 127 35.996 -9.710 10.961 1.00 24.31 H new ATOM 0 HG3 MET A 127 35.603 -9.234 9.320 1.00 24.31 H new ATOM 0 HE1 MET A 127 39.880 -9.399 11.092 1.00 31.02 H new ATOM 0 HE2 MET A 127 38.615 -8.312 11.715 1.00 31.02 H new ATOM 0 HE3 MET A 127 38.435 -10.075 11.881 1.00 31.02 H new ATOM 2075 N THR A 128 35.519 -5.113 12.607 1.00 21.32 N ATOM 2076 CA THR A 128 35.954 -3.815 13.106 1.00 13.24 C ATOM 2077 C THR A 128 36.504 -3.927 14.524 1.00 53.43 C ATOM 2078 O THR A 128 37.399 -3.177 14.912 1.00 22.40 O ATOM 2079 CB THR A 128 34.800 -2.794 13.095 1.00 44.24 C ATOM 2080 OG1 THR A 128 34.205 -2.742 11.793 1.00 22.12 O ATOM 2081 CG2 THR A 128 35.298 -1.410 13.485 1.00 23.53 C ATOM 0 H THR A 128 34.579 -5.119 12.210 1.00 21.32 H new ATOM 0 HA THR A 128 36.743 -3.468 12.439 1.00 13.24 H new ATOM 0 HB THR A 128 34.055 -3.113 13.823 1.00 44.24 H new ATOM 0 HG1 THR A 128 33.453 -3.370 11.751 1.00 22.12 H new ATOM 0 HG21 THR A 128 34.466 -0.706 13.470 1.00 23.53 H new ATOM 0 HG22 THR A 128 35.725 -1.446 14.487 1.00 23.53 H new ATOM 0 HG23 THR A 128 36.061 -1.085 12.777 1.00 23.53 H new ATOM 2089 N GLU A 129 35.962 -4.867 15.291 1.00 21.23 N ATOM 2090 CA GLU A 129 36.400 -5.076 16.666 1.00 1.14 C ATOM 2091 C GLU A 129 37.881 -5.440 16.716 1.00 3.54 C ATOM 2092 O GLU A 129 38.634 -4.910 17.532 1.00 5.03 O ATOM 2093 CB GLU A 129 35.570 -6.178 17.328 1.00 64.43 C ATOM 2094 CG GLU A 129 36.031 -6.527 18.733 1.00 11.32 C ATOM 2095 CD GLU A 129 36.289 -5.298 19.584 1.00 61.23 C ATOM 2096 OE1 GLU A 129 35.377 -4.453 19.698 1.00 2.05 O ATOM 2097 OE2 GLU A 129 37.404 -5.183 20.135 1.00 52.30 O ATOM 0 H GLU A 129 35.220 -5.495 14.984 1.00 21.23 H new ATOM 0 HA GLU A 129 36.254 -4.144 17.212 1.00 1.14 H new ATOM 0 HB2 GLU A 129 34.527 -5.863 17.365 1.00 64.43 H new ATOM 0 HB3 GLU A 129 35.611 -7.074 16.708 1.00 64.43 H new ATOM 0 HG2 GLU A 129 35.276 -7.147 19.216 1.00 11.32 H new ATOM 0 HG3 GLU A 129 36.942 -7.122 18.675 1.00 11.32 H new ATOM 2104 N GLY A 130 38.292 -6.348 15.837 1.00 74.50 N ATOM 2105 CA GLY A 130 39.680 -6.769 15.797 1.00 2.45 C ATOM 2106 C GLY A 130 40.633 -5.605 15.609 1.00 51.21 C ATOM 2107 O GLY A 130 41.696 -5.755 15.007 1.00 73.44 O ATOM 0 H GLY A 130 37.688 -6.800 15.151 1.00 74.50 H new ATOM 0 HA2 GLY A 130 39.925 -7.290 16.723 1.00 2.45 H new ATOM 0 HA3 GLY A 130 39.817 -7.482 14.984 1.00 2.45 H new TER 2111 GLY A 130