USER MOD reduce.3.24.130724 H: found=0, std=0, add=1073, rem=0, adj=32 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 86 LYS NZ :NH3+ -125:sc= 0 (180deg=0) USER MOD Set 1.2: A 125 LYS NZ :NH3+ -133:sc= -0.658 (180deg=-2.88!) USER MOD Set 2.1: A 108 ASN : amide:sc= -0.413 X(o=-1.1,f=-0.64) USER MOD Set 2.2: A 127 MET CE :methyl 180:sc= -0.637 (180deg=-0.637) USER MOD Set 3.1: A 32 MET CE :methyl 151:sc= -3.71! (180deg=-4.34!) USER MOD Set 3.2: A 114 ASN : amide:sc= 0 K(o=-3.7,f=-4.3) USER MOD Set 4.1: A 22 GLN : amide:sc= -1.67 K(o=-1.7,f=-4.8!) USER MOD Set 4.2: A 100 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0161) USER MOD Single : A 1 MET CE :methyl -171:sc= 0 (180deg=-0.0762) USER MOD Single : A 1 MET N :NH3+ -129:sc= 0.128 (180deg=-0.177) 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= -0.0636 X(o=-0.064,f=-0.0012) USER MOD Single : A 14 SER OG : rot 38:sc= 0.0886 USER MOD Single : A 16 ASN : amide:sc= -0.133 X(o=-0.13,f=-0.13) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 CYS SG : rot 130:sc= 0.12 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -167:sc=-0.00253 (180deg=-0.0971) USER MOD Single : A 27 MET CE :methyl 160:sc= -0.126 (180deg=-1.03) USER MOD Single : A 28 SER OG : rot -85:sc= -2.71 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= -0.0451 X(o=-0.045,f=0) USER MOD Single : A 45 THR OG1 : rot 148:sc= 1.19 USER MOD Single : A 47 LYS NZ :NH3+ -151:sc= -0.398 (180deg=-1.58!) USER MOD Single : A 58 MET CE :methyl -114:sc= -1.31 (180deg=-4.59!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 CYS SG : rot 52:sc= 1.19 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 169:sc= 1.24 USER MOD Single : A 73 HIS : no HE2:sc= -2.06 K(o=-2.1,f=-7.4!) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 52:sc= 1.17 USER MOD Single : A 84 THR OG1 : rot -80:sc= -1.48 USER MOD Single : A 85 TYR OH : rot -28:sc= -0.614 USER MOD Single : A 87 CYS SG : rot 40:sc= 0.824 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 ASN : amide:sc= -0.888 K(o=-0.89,f=-4.5!) USER MOD Single : A 91 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0175) USER MOD Single : A 95 THR OG1 : rot 106:sc= 1.27 USER MOD Single : A 97 THR OG1 : rot 180:sc= -0.592 USER MOD Single : A 99 HIS : no HD1:sc= -0.389 X(o=-0.39,f=-0.42) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= -0.104 USER MOD Single : A 112 LYS NZ :NH3+ -151:sc= -0.0658 (180deg=-0.572) USER MOD Single : A 124 ASN : amide:sc= -0.108 K(o=-0.11,f=-1.7!) USER MOD Single : A 128 THR OG1 : rot 180:sc= -0.14 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.608 1.527 2.490 1.00 73.40 N ATOM 2 CA MET A 1 3.686 0.896 1.738 1.00 23.10 C ATOM 3 C MET A 1 3.318 -0.534 1.355 1.00 51.13 C ATOM 4 O MET A 1 2.202 -0.988 1.609 1.00 40.03 O ATOM 5 CB MET A 1 4.978 0.900 2.557 1.00 22.14 C ATOM 6 CG MET A 1 5.543 2.291 2.794 1.00 22.04 C ATOM 7 SD MET A 1 7.037 2.271 3.805 1.00 55.33 S ATOM 8 CE MET A 1 6.342 1.974 5.429 1.00 45.30 C ATOM 0 H1 MET A 1 2.379 2.447 2.063 1.00 73.40 H new ATOM 0 H2 MET A 1 1.766 0.916 2.469 1.00 73.40 H new ATOM 0 H3 MET A 1 2.909 1.668 3.476 1.00 73.40 H new ATOM 0 HA MET A 1 3.841 1.469 0.824 1.00 23.10 H new ATOM 0 HB2 MET A 1 4.790 0.424 3.520 1.00 22.14 H new ATOM 0 HB3 MET A 1 5.726 0.296 2.044 1.00 22.14 H new ATOM 0 HG2 MET A 1 5.765 2.757 1.834 1.00 22.04 H new ATOM 0 HG3 MET A 1 4.788 2.908 3.281 1.00 22.04 H new ATOM 0 HE1 MET A 1 7.119 2.093 6.184 1.00 45.30 H new ATOM 0 HE2 MET A 1 5.540 2.688 5.618 1.00 45.30 H new ATOM 0 HE3 MET A 1 5.944 0.960 5.475 1.00 45.30 H new ATOM 18 N LYS A 2 4.262 -1.239 0.742 1.00 63.34 N ATOM 19 CA LYS A 2 4.038 -2.618 0.324 1.00 63.13 C ATOM 20 C LYS A 2 4.164 -3.573 1.507 1.00 53.51 C ATOM 21 O LYS A 2 4.295 -3.143 2.653 1.00 35.03 O ATOM 22 CB LYS A 2 5.035 -3.010 -0.769 1.00 44.12 C ATOM 23 CG LYS A 2 4.824 -2.270 -2.079 1.00 22.12 C ATOM 24 CD LYS A 2 5.542 -0.931 -2.085 1.00 24.10 C ATOM 25 CE LYS A 2 5.429 -0.244 -3.437 1.00 54.21 C ATOM 26 NZ LYS A 2 6.539 -0.630 -4.351 1.00 22.22 N ATOM 0 H LYS A 2 5.191 -0.878 0.523 1.00 63.34 H new ATOM 0 HA LYS A 2 3.025 -2.690 -0.073 1.00 63.13 H new ATOM 0 HB2 LYS A 2 6.047 -2.818 -0.412 1.00 44.12 H new ATOM 0 HB3 LYS A 2 4.959 -4.082 -0.951 1.00 44.12 H new ATOM 0 HG2 LYS A 2 5.186 -2.881 -2.906 1.00 22.12 H new ATOM 0 HG3 LYS A 2 3.758 -2.113 -2.241 1.00 22.12 H new ATOM 0 HD2 LYS A 2 5.121 -0.288 -1.312 1.00 24.10 H new ATOM 0 HD3 LYS A 2 6.593 -1.080 -1.838 1.00 24.10 H new ATOM 0 HE2 LYS A 2 4.475 -0.501 -3.896 1.00 54.21 H new ATOM 0 HE3 LYS A 2 5.434 0.837 -3.296 1.00 54.21 H new ATOM 0 HZ1 LYS A 2 6.425 -0.140 -5.261 1.00 22.22 H new ATOM 0 HZ2 LYS A 2 7.449 -0.362 -3.925 1.00 22.22 H new ATOM 0 HZ3 LYS A 2 6.519 -1.658 -4.506 1.00 22.22 H new ATOM 40 N LYS A 3 4.125 -4.870 1.222 1.00 55.44 N ATOM 41 CA LYS A 3 4.237 -5.886 2.261 1.00 15.12 C ATOM 42 C LYS A 3 5.606 -5.831 2.930 1.00 23.21 C ATOM 43 O LYS A 3 6.553 -6.479 2.483 1.00 40.32 O ATOM 44 CB LYS A 3 4.001 -7.278 1.670 1.00 1.30 C ATOM 45 CG LYS A 3 4.138 -8.400 2.684 1.00 34.30 C ATOM 46 CD LYS A 3 2.928 -8.474 3.601 1.00 42.40 C ATOM 47 CE LYS A 3 2.699 -9.889 4.110 1.00 43.35 C ATOM 48 NZ LYS A 3 1.740 -9.920 5.248 1.00 24.53 N ATOM 0 H LYS A 3 4.017 -5.243 0.279 1.00 55.44 H new ATOM 0 HA LYS A 3 3.476 -5.685 3.015 1.00 15.12 H new ATOM 0 HB2 LYS A 3 3.003 -7.314 1.234 1.00 1.30 H new ATOM 0 HB3 LYS A 3 4.710 -7.444 0.859 1.00 1.30 H new ATOM 0 HG2 LYS A 3 4.259 -9.350 2.163 1.00 34.30 H new ATOM 0 HG3 LYS A 3 5.038 -8.246 3.279 1.00 34.30 H new ATOM 0 HD2 LYS A 3 3.069 -7.801 4.446 1.00 42.40 H new ATOM 0 HD3 LYS A 3 2.043 -8.131 3.065 1.00 42.40 H new ATOM 0 HE2 LYS A 3 2.320 -10.510 3.298 1.00 43.35 H new ATOM 0 HE3 LYS A 3 3.649 -10.320 4.424 1.00 43.35 H new ATOM 0 HZ1 LYS A 3 1.611 -10.902 5.566 1.00 24.53 H new ATOM 0 HZ2 LYS A 3 2.113 -9.348 6.032 1.00 24.53 H new ATOM 0 HZ3 LYS A 3 0.825 -9.532 4.942 1.00 24.53 H new ATOM 62 N VAL A 4 5.704 -5.055 4.005 1.00 24.40 N ATOM 63 CA VAL A 4 6.958 -4.919 4.737 1.00 12.43 C ATOM 64 C VAL A 4 7.341 -6.227 5.420 1.00 42.23 C ATOM 65 O VAL A 4 6.718 -6.632 6.402 1.00 64.14 O ATOM 66 CB VAL A 4 6.869 -3.806 5.798 1.00 4.53 C ATOM 67 CG1 VAL A 4 8.196 -3.655 6.527 1.00 63.25 C ATOM 68 CG2 VAL A 4 6.452 -2.491 5.157 1.00 13.20 C ATOM 0 H VAL A 4 4.931 -4.511 4.388 1.00 24.40 H new ATOM 0 HA VAL A 4 7.724 -4.656 4.007 1.00 12.43 H new ATOM 0 HB VAL A 4 6.110 -4.085 6.529 1.00 4.53 H new ATOM 0 HG11 VAL A 4 8.114 -2.864 7.273 1.00 63.25 H new ATOM 0 HG12 VAL A 4 8.449 -4.594 7.020 1.00 63.25 H new ATOM 0 HG13 VAL A 4 8.977 -3.399 5.811 1.00 63.25 H new ATOM 0 HG21 VAL A 4 6.394 -1.716 5.921 1.00 13.20 H new ATOM 0 HG22 VAL A 4 7.186 -2.204 4.404 1.00 13.20 H new ATOM 0 HG23 VAL A 4 5.476 -2.609 4.686 1.00 13.20 H new ATOM 78 N ILE A 5 8.370 -6.883 4.893 1.00 10.25 N ATOM 79 CA ILE A 5 8.838 -8.145 5.453 1.00 15.22 C ATOM 80 C ILE A 5 9.765 -7.909 6.640 1.00 24.52 C ATOM 81 O ILE A 5 10.936 -7.571 6.469 1.00 74.04 O ATOM 82 CB ILE A 5 9.576 -8.989 4.398 1.00 22.31 C ATOM 83 CG1 ILE A 5 8.910 -8.832 3.030 1.00 41.13 C ATOM 84 CG2 ILE A 5 9.603 -10.452 4.815 1.00 64.21 C ATOM 85 CD1 ILE A 5 7.435 -9.167 3.034 1.00 51.24 C ATOM 0 H ILE A 5 8.895 -6.562 4.080 1.00 10.25 H new ATOM 0 HA ILE A 5 7.955 -8.689 5.788 1.00 15.22 H new ATOM 0 HB ILE A 5 10.604 -8.633 4.324 1.00 22.31 H new ATOM 0 HG12 ILE A 5 9.040 -7.806 2.687 1.00 41.13 H new ATOM 0 HG13 ILE A 5 9.418 -9.475 2.311 1.00 41.13 H new ATOM 0 HG21 ILE A 5 10.128 -11.036 4.059 1.00 64.21 H new ATOM 0 HG22 ILE A 5 10.118 -10.548 5.771 1.00 64.21 H new ATOM 0 HG23 ILE A 5 8.582 -10.821 4.914 1.00 64.21 H new ATOM 0 HD11 ILE A 5 7.029 -9.033 2.031 1.00 51.24 H new ATOM 0 HD12 ILE A 5 7.298 -10.202 3.346 1.00 51.24 H new ATOM 0 HD13 ILE A 5 6.914 -8.507 3.728 1.00 51.24 H new ATOM 97 N ASN A 6 9.235 -8.093 7.845 1.00 74.12 N ATOM 98 CA ASN A 6 10.016 -7.902 9.061 1.00 33.05 C ATOM 99 C ASN A 6 10.696 -9.202 9.481 1.00 50.42 C ATOM 100 O ASN A 6 10.034 -10.167 9.861 1.00 74.45 O ATOM 101 CB ASN A 6 9.120 -7.394 10.193 1.00 32.10 C ATOM 102 CG ASN A 6 9.403 -5.947 10.549 1.00 35.31 C ATOM 103 OD1 ASN A 6 8.513 -5.098 10.496 1.00 33.24 O ATOM 104 ND2 ASN A 6 10.647 -5.660 10.914 1.00 33.30 N ATOM 0 H ASN A 6 8.268 -8.374 8.005 1.00 74.12 H new ATOM 0 HA ASN A 6 10.787 -7.159 8.855 1.00 33.05 H new ATOM 0 HB2 ASN A 6 8.075 -7.495 9.899 1.00 32.10 H new ATOM 0 HB3 ASN A 6 9.265 -8.017 11.075 1.00 32.10 H new ATOM 0 HD21 ASN A 6 10.897 -4.703 11.165 1.00 33.30 H new ATOM 0 HD22 ASN A 6 11.352 -6.396 10.944 1.00 33.30 H new ATOM 111 N VAL A 7 12.023 -9.218 9.410 1.00 63.12 N ATOM 112 CA VAL A 7 12.794 -10.398 9.783 1.00 3.25 C ATOM 113 C VAL A 7 13.994 -10.020 10.644 1.00 5.13 C ATOM 114 O VAL A 7 14.467 -8.884 10.605 1.00 3.12 O ATOM 115 CB VAL A 7 13.288 -11.162 8.541 1.00 61.41 C ATOM 116 CG1 VAL A 7 12.149 -11.948 7.910 1.00 71.05 C ATOM 117 CG2 VAL A 7 13.906 -10.202 7.536 1.00 72.14 C ATOM 0 H VAL A 7 12.587 -8.427 9.098 1.00 63.12 H new ATOM 0 HA VAL A 7 12.128 -11.043 10.356 1.00 3.25 H new ATOM 0 HB VAL A 7 14.057 -11.869 8.853 1.00 61.41 H new ATOM 0 HG11 VAL A 7 12.517 -12.482 7.034 1.00 71.05 H new ATOM 0 HG12 VAL A 7 11.757 -12.664 8.632 1.00 71.05 H new ATOM 0 HG13 VAL A 7 11.356 -11.263 7.611 1.00 71.05 H new ATOM 0 HG21 VAL A 7 14.250 -10.759 6.665 1.00 72.14 H new ATOM 0 HG22 VAL A 7 13.161 -9.469 7.227 1.00 72.14 H new ATOM 0 HG23 VAL A 7 14.751 -9.689 7.995 1.00 72.14 H new ATOM 127 N VAL A 8 14.484 -10.981 11.422 1.00 50.51 N ATOM 128 CA VAL A 8 15.631 -10.750 12.292 1.00 12.41 C ATOM 129 C VAL A 8 16.512 -11.991 12.381 1.00 13.32 C ATOM 130 O VAL A 8 16.094 -13.089 12.016 1.00 43.35 O ATOM 131 CB VAL A 8 15.187 -10.346 13.711 1.00 52.24 C ATOM 132 CG1 VAL A 8 14.258 -9.142 13.657 1.00 31.42 C ATOM 133 CG2 VAL A 8 14.516 -11.517 14.412 1.00 13.00 C ATOM 0 H VAL A 8 14.104 -11.927 11.467 1.00 50.51 H new ATOM 0 HA VAL A 8 16.203 -9.933 11.852 1.00 12.41 H new ATOM 0 HB VAL A 8 16.071 -10.067 14.285 1.00 52.24 H new ATOM 0 HG11 VAL A 8 13.955 -8.871 14.668 1.00 31.42 H new ATOM 0 HG12 VAL A 8 14.778 -8.302 13.197 1.00 31.42 H new ATOM 0 HG13 VAL A 8 13.375 -9.390 13.067 1.00 31.42 H new ATOM 0 HG21 VAL A 8 14.209 -11.214 15.413 1.00 13.00 H new ATOM 0 HG22 VAL A 8 13.641 -11.829 13.842 1.00 13.00 H new ATOM 0 HG23 VAL A 8 15.217 -12.348 14.484 1.00 13.00 H new ATOM 143 N GLY A 9 17.734 -11.808 12.871 1.00 65.22 N ATOM 144 CA GLY A 9 18.656 -12.922 13.000 1.00 52.02 C ATOM 145 C GLY A 9 19.460 -12.863 14.283 1.00 25.10 C ATOM 146 O GLY A 9 19.401 -11.877 15.016 1.00 13.33 O ATOM 0 H GLY A 9 18.102 -10.909 13.181 1.00 65.22 H new ATOM 0 HA2 GLY A 9 18.098 -13.858 12.967 1.00 52.02 H new ATOM 0 HA3 GLY A 9 19.336 -12.927 12.148 1.00 52.02 H new ATOM 150 N ALA A 10 20.214 -13.923 14.556 1.00 23.10 N ATOM 151 CA ALA A 10 21.034 -13.988 15.759 1.00 3.33 C ATOM 152 C ALA A 10 22.454 -14.438 15.432 1.00 3.55 C ATOM 153 O ALA A 10 22.659 -15.326 14.605 1.00 52.24 O ATOM 154 CB ALA A 10 20.403 -14.925 16.778 1.00 2.14 C ATOM 0 H ALA A 10 20.274 -14.749 13.960 1.00 23.10 H new ATOM 0 HA ALA A 10 21.088 -12.987 16.187 1.00 3.33 H new ATOM 0 HB1 ALA A 10 21.026 -14.964 17.671 1.00 2.14 H new ATOM 0 HB2 ALA A 10 19.411 -14.559 17.043 1.00 2.14 H new ATOM 0 HB3 ALA A 10 20.319 -15.924 16.350 1.00 2.14 H new ATOM 160 N ILE A 11 23.431 -13.819 16.087 1.00 43.33 N ATOM 161 CA ILE A 11 24.832 -14.156 15.865 1.00 32.41 C ATOM 162 C ILE A 11 25.481 -14.677 17.143 1.00 14.12 C ATOM 163 O ILE A 11 25.940 -13.899 17.979 1.00 2.53 O ATOM 164 CB ILE A 11 25.630 -12.942 15.355 1.00 11.14 C ATOM 165 CG1 ILE A 11 25.207 -11.676 16.104 1.00 44.13 C ATOM 166 CG2 ILE A 11 25.432 -12.769 13.857 1.00 71.01 C ATOM 167 CD1 ILE A 11 25.962 -10.438 15.671 1.00 34.21 C ATOM 0 H ILE A 11 23.278 -13.082 16.775 1.00 43.33 H new ATOM 0 HA ILE A 11 24.852 -14.937 15.105 1.00 32.41 H new ATOM 0 HB ILE A 11 26.689 -13.117 15.543 1.00 11.14 H new ATOM 0 HG12 ILE A 11 24.140 -11.513 15.952 1.00 44.13 H new ATOM 0 HG13 ILE A 11 25.357 -11.828 17.173 1.00 44.13 H new ATOM 0 HG21 ILE A 11 26.002 -11.907 13.512 1.00 71.01 H new ATOM 0 HG22 ILE A 11 25.777 -13.664 13.339 1.00 71.01 H new ATOM 0 HG23 ILE A 11 24.374 -12.612 13.645 1.00 71.01 H new ATOM 0 HD11 ILE A 11 25.611 -9.579 16.243 1.00 34.21 H new ATOM 0 HD12 ILE A 11 27.028 -10.581 15.849 1.00 34.21 H new ATOM 0 HD13 ILE A 11 25.792 -10.261 14.609 1.00 34.21 H new ATOM 179 N ILE A 12 25.516 -15.997 17.287 1.00 71.42 N ATOM 180 CA ILE A 12 26.111 -16.622 18.462 1.00 44.14 C ATOM 181 C ILE A 12 27.629 -16.697 18.334 1.00 21.42 C ATOM 182 O ILE A 12 28.155 -17.316 17.409 1.00 42.44 O ATOM 183 CB ILE A 12 25.555 -18.040 18.688 1.00 22.11 C ATOM 184 CG1 ILE A 12 24.039 -17.991 18.888 1.00 60.13 C ATOM 185 CG2 ILE A 12 26.232 -18.689 19.886 1.00 30.31 C ATOM 186 CD1 ILE A 12 23.256 -18.112 17.599 1.00 12.52 C ATOM 0 H ILE A 12 25.139 -16.655 16.605 1.00 71.42 H new ATOM 0 HA ILE A 12 25.851 -15.999 19.318 1.00 44.14 H new ATOM 0 HB ILE A 12 25.767 -18.643 17.805 1.00 22.11 H new ATOM 0 HG12 ILE A 12 23.743 -18.796 19.561 1.00 60.13 H new ATOM 0 HG13 ILE A 12 23.775 -17.054 19.377 1.00 60.13 H new ATOM 0 HG21 ILE A 12 25.829 -19.691 20.033 1.00 30.31 H new ATOM 0 HG22 ILE A 12 27.305 -18.753 19.707 1.00 30.31 H new ATOM 0 HG23 ILE A 12 26.048 -18.089 20.777 1.00 30.31 H new ATOM 0 HD11 ILE A 12 22.189 -18.069 17.816 1.00 12.52 H new ATOM 0 HD12 ILE A 12 23.524 -17.292 16.932 1.00 12.52 H new ATOM 0 HD13 ILE A 12 23.491 -19.062 17.118 1.00 12.52 H new ATOM 198 N PHE A 13 28.328 -16.066 19.271 1.00 1.53 N ATOM 199 CA PHE A 13 29.786 -16.062 19.265 1.00 44.51 C ATOM 200 C PHE A 13 30.337 -17.030 20.307 1.00 4.03 C ATOM 201 O PHE A 13 29.958 -16.982 21.477 1.00 12.53 O ATOM 202 CB PHE A 13 30.315 -14.651 19.533 1.00 12.11 C ATOM 203 CG PHE A 13 30.163 -13.721 18.363 1.00 63.51 C ATOM 204 CD1 PHE A 13 28.932 -13.164 18.059 1.00 32.00 C ATOM 205 CD2 PHE A 13 31.253 -13.405 17.567 1.00 15.23 C ATOM 206 CE1 PHE A 13 28.790 -12.309 16.982 1.00 34.24 C ATOM 207 CE2 PHE A 13 31.117 -12.550 16.489 1.00 35.14 C ATOM 208 CZ PHE A 13 29.884 -12.001 16.197 1.00 15.14 C ATOM 0 H PHE A 13 27.908 -15.551 20.045 1.00 1.53 H new ATOM 0 HA PHE A 13 30.121 -16.387 18.280 1.00 44.51 H new ATOM 0 HB2 PHE A 13 29.789 -14.232 20.391 1.00 12.11 H new ATOM 0 HB3 PHE A 13 31.369 -14.712 19.804 1.00 12.11 H new ATOM 0 HD1 PHE A 13 28.073 -13.400 18.670 1.00 32.00 H new ATOM 0 HD2 PHE A 13 32.219 -13.832 17.791 1.00 15.23 H new ATOM 0 HE1 PHE A 13 27.824 -11.882 16.755 1.00 34.24 H new ATOM 0 HE2 PHE A 13 31.974 -12.312 15.876 1.00 35.14 H new ATOM 0 HZ PHE A 13 29.775 -11.332 15.356 1.00 15.14 H new ATOM 218 N SER A 14 31.235 -17.909 19.873 1.00 33.45 N ATOM 219 CA SER A 14 31.835 -18.893 20.767 1.00 5.31 C ATOM 220 C SER A 14 33.312 -19.094 20.439 1.00 32.51 C ATOM 221 O SER A 14 33.666 -19.451 19.315 1.00 2.32 O ATOM 222 CB SER A 14 31.092 -20.226 20.666 1.00 21.03 C ATOM 223 OG SER A 14 30.896 -20.600 19.314 1.00 42.35 O ATOM 0 H SER A 14 31.563 -17.960 18.908 1.00 33.45 H new ATOM 0 HA SER A 14 31.754 -18.518 21.787 1.00 5.31 H new ATOM 0 HB2 SER A 14 31.658 -21.001 21.182 1.00 21.03 H new ATOM 0 HB3 SER A 14 30.128 -20.147 21.168 1.00 21.03 H new ATOM 0 HG SER A 14 31.684 -20.350 18.788 1.00 42.35 H new ATOM 229 N ASP A 15 34.168 -18.864 21.428 1.00 12.04 N ATOM 230 CA ASP A 15 35.606 -19.021 21.247 1.00 2.10 C ATOM 231 C ASP A 15 36.113 -18.123 20.122 1.00 23.55 C ATOM 232 O ASP A 15 37.024 -18.494 19.383 1.00 52.53 O ATOM 233 CB ASP A 15 35.947 -20.481 20.944 1.00 3.14 C ATOM 234 CG ASP A 15 35.951 -21.345 22.190 1.00 3.32 C ATOM 235 OD1 ASP A 15 36.134 -22.573 22.059 1.00 11.04 O ATOM 236 OD2 ASP A 15 35.771 -20.793 23.296 1.00 11.30 O ATOM 0 H ASP A 15 33.891 -18.568 22.364 1.00 12.04 H new ATOM 0 HA ASP A 15 36.099 -18.726 22.173 1.00 2.10 H new ATOM 0 HB2 ASP A 15 35.225 -20.879 20.231 1.00 3.14 H new ATOM 0 HB3 ASP A 15 36.926 -20.531 20.467 1.00 3.14 H new ATOM 241 N ASN A 16 35.516 -16.942 20.000 1.00 61.41 N ATOM 242 CA ASN A 16 35.906 -15.993 18.964 1.00 2.42 C ATOM 243 C ASN A 16 35.597 -16.544 17.576 1.00 62.32 C ATOM 244 O ASN A 16 36.334 -16.300 16.620 1.00 12.30 O ATOM 245 CB ASN A 16 37.397 -15.668 19.076 1.00 22.01 C ATOM 246 CG ASN A 16 37.840 -15.473 20.513 1.00 1.43 C ATOM 247 OD1 ASN A 16 38.656 -16.234 21.032 1.00 22.41 O ATOM 248 ND2 ASN A 16 37.302 -14.448 21.164 1.00 51.42 N ATOM 0 H ASN A 16 34.761 -16.620 20.605 1.00 61.41 H new ATOM 0 HA ASN A 16 35.330 -15.079 19.108 1.00 2.42 H new ATOM 0 HB2 ASN A 16 37.977 -16.474 18.626 1.00 22.01 H new ATOM 0 HB3 ASN A 16 37.613 -14.764 18.506 1.00 22.01 H new ATOM 0 HD21 ASN A 16 37.562 -14.267 22.134 1.00 51.42 H new ATOM 0 HD22 ASN A 16 36.629 -13.842 20.694 1.00 51.42 H new ATOM 255 N LYS A 17 34.502 -17.290 17.472 1.00 43.13 N ATOM 256 CA LYS A 17 34.093 -17.876 16.201 1.00 51.43 C ATOM 257 C LYS A 17 32.621 -17.590 15.919 1.00 43.01 C ATOM 258 O LYS A 17 31.944 -16.935 16.712 1.00 72.32 O ATOM 259 CB LYS A 17 34.338 -19.386 16.210 1.00 74.34 C ATOM 260 CG LYS A 17 35.724 -19.775 16.692 1.00 23.01 C ATOM 261 CD LYS A 17 36.809 -19.058 15.907 1.00 44.51 C ATOM 262 CE LYS A 17 37.808 -20.038 15.312 1.00 24.45 C ATOM 263 NZ LYS A 17 38.924 -20.333 16.254 1.00 41.32 N ATOM 0 H LYS A 17 33.882 -17.503 18.253 1.00 43.13 H new ATOM 0 HA LYS A 17 34.691 -17.422 15.411 1.00 51.43 H new ATOM 0 HB2 LYS A 17 33.594 -19.862 16.848 1.00 74.34 H new ATOM 0 HB3 LYS A 17 34.190 -19.775 15.203 1.00 74.34 H new ATOM 0 HG2 LYS A 17 35.822 -19.537 17.751 1.00 23.01 H new ATOM 0 HG3 LYS A 17 35.855 -20.853 16.594 1.00 23.01 H new ATOM 0 HD2 LYS A 17 36.354 -18.471 15.109 1.00 44.51 H new ATOM 0 HD3 LYS A 17 37.330 -18.358 16.560 1.00 44.51 H new ATOM 0 HE2 LYS A 17 37.297 -20.965 15.053 1.00 24.45 H new ATOM 0 HE3 LYS A 17 38.213 -19.628 14.387 1.00 24.45 H new ATOM 0 HZ1 LYS A 17 39.583 -21.005 15.812 1.00 41.32 H new ATOM 0 HZ2 LYS A 17 39.428 -19.452 16.482 1.00 41.32 H new ATOM 0 HZ3 LYS A 17 38.541 -20.748 17.127 1.00 41.32 H new ATOM 277 N ILE A 18 32.133 -18.086 14.787 1.00 44.31 N ATOM 278 CA ILE A 18 30.742 -17.885 14.403 1.00 35.40 C ATOM 279 C ILE A 18 30.072 -19.210 14.050 1.00 5.45 C ATOM 280 O ILE A 18 30.723 -20.137 13.567 1.00 30.33 O ATOM 281 CB ILE A 18 30.621 -16.927 13.204 1.00 53.23 C ATOM 282 CG1 ILE A 18 31.403 -15.639 13.471 1.00 23.51 C ATOM 283 CG2 ILE A 18 29.159 -16.615 12.920 1.00 72.20 C ATOM 284 CD1 ILE A 18 32.844 -15.702 13.013 1.00 14.13 C ATOM 0 H ILE A 18 32.681 -18.630 14.120 1.00 44.31 H new ATOM 0 HA ILE A 18 30.239 -17.443 15.263 1.00 35.40 H new ATOM 0 HB ILE A 18 31.046 -17.413 12.326 1.00 53.23 H new ATOM 0 HG12 ILE A 18 30.906 -14.810 12.967 1.00 23.51 H new ATOM 0 HG13 ILE A 18 31.379 -15.423 14.539 1.00 23.51 H new ATOM 0 HG21 ILE A 18 29.090 -15.937 12.070 1.00 72.20 H new ATOM 0 HG22 ILE A 18 28.628 -17.539 12.691 1.00 72.20 H new ATOM 0 HG23 ILE A 18 28.710 -16.146 13.796 1.00 72.20 H new ATOM 0 HD11 ILE A 18 33.338 -14.756 13.234 1.00 14.13 H new ATOM 0 HD12 ILE A 18 33.357 -16.509 13.536 1.00 14.13 H new ATOM 0 HD13 ILE A 18 32.877 -15.887 11.939 1.00 14.13 H new ATOM 296 N LEU A 19 28.769 -19.290 14.294 1.00 60.55 N ATOM 297 CA LEU A 19 28.010 -20.501 14.000 1.00 73.00 C ATOM 298 C LEU A 19 27.351 -20.411 12.627 1.00 22.30 C ATOM 299 O LEU A 19 27.210 -19.324 12.065 1.00 35.34 O ATOM 300 CB LEU A 19 26.946 -20.732 15.074 1.00 33.44 C ATOM 301 CG LEU A 19 25.602 -20.039 14.849 1.00 51.34 C ATOM 302 CD1 LEU A 19 24.596 -20.466 15.907 1.00 44.42 C ATOM 303 CD2 LEU A 19 25.775 -18.527 14.854 1.00 53.24 C ATOM 0 H LEU A 19 28.216 -18.532 14.694 1.00 60.55 H new ATOM 0 HA LEU A 19 28.703 -21.343 13.996 1.00 73.00 H new ATOM 0 HB2 LEU A 19 26.769 -21.804 15.157 1.00 33.44 H new ATOM 0 HB3 LEU A 19 27.347 -20.400 16.032 1.00 33.44 H new ATOM 0 HG LEU A 19 25.220 -20.338 13.873 1.00 51.34 H new ATOM 0 HD11 LEU A 19 23.646 -19.962 15.730 1.00 44.42 H new ATOM 0 HD12 LEU A 19 24.450 -21.545 15.856 1.00 44.42 H new ATOM 0 HD13 LEU A 19 24.971 -20.197 16.895 1.00 44.42 H new ATOM 0 HD21 LEU A 19 24.808 -18.050 14.692 1.00 53.24 H new ATOM 0 HD22 LEU A 19 26.180 -18.210 15.815 1.00 53.24 H new ATOM 0 HD23 LEU A 19 26.461 -18.237 14.058 1.00 53.24 H new ATOM 315 N CYS A 20 26.949 -21.559 12.094 1.00 60.35 N ATOM 316 CA CYS A 20 26.304 -21.610 10.786 1.00 34.44 C ATOM 317 C CYS A 20 24.949 -22.306 10.876 1.00 41.22 C ATOM 318 O CYS A 20 24.798 -23.303 11.580 1.00 35.24 O ATOM 319 CB CYS A 20 27.198 -22.337 9.781 1.00 41.11 C ATOM 320 SG CYS A 20 26.324 -22.942 8.318 1.00 23.53 S ATOM 0 H CYS A 20 27.058 -22.467 12.546 1.00 60.35 H new ATOM 0 HA CYS A 20 26.146 -20.587 10.446 1.00 34.44 H new ATOM 0 HB2 CYS A 20 27.993 -21.662 9.463 1.00 41.11 H new ATOM 0 HB3 CYS A 20 27.676 -23.180 10.280 1.00 41.11 H new ATOM 0 HG CYS A 20 26.958 -22.566 7.247 1.00 23.53 H new ATOM 326 N ALA A 21 23.967 -21.771 10.158 1.00 52.02 N ATOM 327 CA ALA A 21 22.625 -22.340 10.156 1.00 71.12 C ATOM 328 C ALA A 21 21.971 -22.199 8.786 1.00 54.54 C ATOM 329 O ALA A 21 22.182 -21.208 8.087 1.00 44.12 O ATOM 330 CB ALA A 21 21.768 -21.676 11.223 1.00 1.42 C ATOM 0 H ALA A 21 24.076 -20.944 9.570 1.00 52.02 H new ATOM 0 HA ALA A 21 22.708 -23.403 10.382 1.00 71.12 H new ATOM 0 HB1 ALA A 21 20.769 -22.111 11.210 1.00 1.42 H new ATOM 0 HB2 ALA A 21 22.219 -21.834 12.202 1.00 1.42 H new ATOM 0 HB3 ALA A 21 21.701 -20.607 11.022 1.00 1.42 H new ATOM 336 N GLN A 22 21.176 -23.195 8.408 1.00 23.24 N ATOM 337 CA GLN A 22 20.493 -23.181 7.121 1.00 53.04 C ATOM 338 C GLN A 22 18.983 -23.300 7.304 1.00 24.11 C ATOM 339 O GLN A 22 18.451 -24.401 7.448 1.00 52.32 O ATOM 340 CB GLN A 22 21.002 -24.320 6.236 1.00 24.33 C ATOM 341 CG GLN A 22 20.176 -24.530 4.978 1.00 40.03 C ATOM 342 CD GLN A 22 21.010 -25.008 3.805 1.00 54.50 C ATOM 343 OE1 GLN A 22 22.078 -25.593 3.985 1.00 34.23 O ATOM 344 NE2 GLN A 22 20.525 -24.760 2.594 1.00 51.42 N ATOM 0 H GLN A 22 20.989 -24.022 8.975 1.00 23.24 H new ATOM 0 HA GLN A 22 20.708 -22.229 6.635 1.00 53.04 H new ATOM 0 HB2 GLN A 22 22.034 -24.115 5.952 1.00 24.33 H new ATOM 0 HB3 GLN A 22 21.008 -25.244 6.815 1.00 24.33 H new ATOM 0 HG2 GLN A 22 19.391 -25.258 5.181 1.00 40.03 H new ATOM 0 HG3 GLN A 22 19.683 -23.595 4.711 1.00 40.03 H new ATOM 0 HE21 GLN A 22 19.635 -24.272 2.491 1.00 51.42 H new ATOM 0 HE22 GLN A 22 21.042 -25.058 1.767 1.00 51.42 H new ATOM 353 N ARG A 23 18.300 -22.160 7.299 1.00 72.44 N ATOM 354 CA ARG A 23 16.852 -22.137 7.466 1.00 32.31 C ATOM 355 C ARG A 23 16.149 -22.562 6.180 1.00 32.22 C ATOM 356 O ARG A 23 15.703 -23.702 6.052 1.00 30.43 O ATOM 357 CB ARG A 23 16.387 -20.739 7.876 1.00 53.31 C ATOM 358 CG ARG A 23 14.876 -20.574 7.872 1.00 12.31 C ATOM 359 CD ARG A 23 14.362 -20.117 9.228 1.00 12.14 C ATOM 360 NE ARG A 23 14.044 -21.244 10.101 1.00 12.22 N ATOM 361 CZ ARG A 23 13.217 -21.160 11.138 1.00 64.22 C ATOM 362 NH1 ARG A 23 12.629 -20.009 11.429 1.00 15.41 N ATOM 363 NH2 ARG A 23 12.978 -22.230 11.885 1.00 21.21 N ATOM 0 H ARG A 23 18.726 -21.241 7.181 1.00 72.44 H new ATOM 0 HA ARG A 23 16.591 -22.845 8.253 1.00 32.31 H new ATOM 0 HB2 ARG A 23 16.766 -20.518 8.874 1.00 53.31 H new ATOM 0 HB3 ARG A 23 16.826 -20.006 7.199 1.00 53.31 H new ATOM 0 HG2 ARG A 23 14.590 -19.849 7.110 1.00 12.31 H new ATOM 0 HG3 ARG A 23 14.406 -21.520 7.604 1.00 12.31 H new ATOM 0 HD2 ARG A 23 15.112 -19.488 9.707 1.00 12.14 H new ATOM 0 HD3 ARG A 23 13.472 -19.503 9.090 1.00 12.14 H new ATOM 0 HE ARG A 23 14.480 -22.145 9.904 1.00 12.22 H new ATOM 0 HH11 ARG A 23 12.811 -19.185 10.857 1.00 15.41 H new ATOM 0 HH12 ARG A 23 11.995 -19.947 12.225 1.00 15.41 H new ATOM 0 HH21 ARG A 23 13.429 -23.118 11.664 1.00 21.21 H new ATOM 0 HH22 ARG A 23 12.343 -22.165 12.681 1.00 21.21 H new ATOM 377 N SER A 24 16.053 -21.637 5.231 1.00 63.04 N ATOM 378 CA SER A 24 15.401 -21.914 3.956 1.00 32.22 C ATOM 379 C SER A 24 15.840 -20.913 2.892 1.00 21.10 C ATOM 380 O SER A 24 16.285 -19.810 3.209 1.00 72.43 O ATOM 381 CB SER A 24 13.880 -21.870 4.118 1.00 41.05 C ATOM 382 OG SER A 24 13.474 -20.698 4.804 1.00 71.54 O ATOM 0 H SER A 24 16.418 -20.689 5.321 1.00 63.04 H new ATOM 0 HA SER A 24 15.697 -22.912 3.634 1.00 32.22 H new ATOM 0 HB2 SER A 24 13.406 -21.904 3.137 1.00 41.05 H new ATOM 0 HB3 SER A 24 13.544 -22.751 4.665 1.00 41.05 H new ATOM 0 HG SER A 24 12.498 -20.693 4.893 1.00 71.54 H new ATOM 388 N GLU A 25 15.712 -21.307 1.629 1.00 75.11 N ATOM 389 CA GLU A 25 16.096 -20.445 0.518 1.00 50.15 C ATOM 390 C GLU A 25 14.963 -19.490 0.153 1.00 41.32 C ATOM 391 O GLU A 25 15.075 -18.707 -0.791 1.00 11.11 O ATOM 392 CB GLU A 25 16.480 -21.287 -0.701 1.00 41.20 C ATOM 393 CG GLU A 25 17.435 -20.583 -1.651 1.00 11.14 C ATOM 394 CD GLU A 25 17.466 -21.221 -3.026 1.00 23.33 C ATOM 395 OE1 GLU A 25 17.917 -20.553 -3.979 1.00 43.33 O ATOM 396 OE2 GLU A 25 17.040 -22.388 -3.148 1.00 71.45 O ATOM 0 H GLU A 25 15.346 -22.217 1.350 1.00 75.11 H new ATOM 0 HA GLU A 25 16.958 -19.856 0.830 1.00 50.15 H new ATOM 0 HB2 GLU A 25 16.938 -22.216 -0.361 1.00 41.20 H new ATOM 0 HB3 GLU A 25 15.575 -21.558 -1.244 1.00 41.20 H new ATOM 0 HG2 GLU A 25 17.142 -19.538 -1.746 1.00 11.14 H new ATOM 0 HG3 GLU A 25 18.439 -20.595 -1.226 1.00 11.14 H new ATOM 403 N LYS A 26 13.872 -19.560 0.907 1.00 33.34 N ATOM 404 CA LYS A 26 12.717 -18.703 0.666 1.00 4.11 C ATOM 405 C LYS A 26 12.979 -17.285 1.165 1.00 32.42 C ATOM 406 O LYS A 26 12.649 -16.310 0.491 1.00 4.34 O ATOM 407 CB LYS A 26 11.477 -19.277 1.355 1.00 41.23 C ATOM 408 CG LYS A 26 11.034 -20.616 0.792 1.00 30.20 C ATOM 409 CD LYS A 26 10.407 -20.463 -0.584 1.00 31.25 C ATOM 410 CE LYS A 26 8.947 -20.048 -0.487 1.00 51.44 C ATOM 411 NZ LYS A 26 8.078 -21.174 -0.047 1.00 15.41 N ATOM 0 H LYS A 26 13.763 -20.202 1.692 1.00 33.34 H new ATOM 0 HA LYS A 26 12.542 -18.665 -0.409 1.00 4.11 H new ATOM 0 HB2 LYS A 26 11.683 -19.390 2.419 1.00 41.23 H new ATOM 0 HB3 LYS A 26 10.657 -18.564 1.262 1.00 41.23 H new ATOM 0 HG2 LYS A 26 11.891 -21.287 0.730 1.00 30.20 H new ATOM 0 HG3 LYS A 26 10.316 -21.077 1.470 1.00 30.20 H new ATOM 0 HD2 LYS A 26 10.961 -19.719 -1.157 1.00 31.25 H new ATOM 0 HD3 LYS A 26 10.483 -21.405 -1.127 1.00 31.25 H new ATOM 0 HE2 LYS A 26 8.851 -19.220 0.215 1.00 51.44 H new ATOM 0 HE3 LYS A 26 8.608 -19.685 -1.457 1.00 51.44 H new ATOM 0 HZ1 LYS A 26 7.081 -20.924 -0.203 1.00 15.41 H new ATOM 0 HZ2 LYS A 26 8.311 -22.027 -0.595 1.00 15.41 H new ATOM 0 HZ3 LYS A 26 8.235 -21.359 0.964 1.00 15.41 H new ATOM 425 N MET A 27 13.574 -17.180 2.349 1.00 52.01 N ATOM 426 CA MET A 27 13.882 -15.881 2.936 1.00 34.10 C ATOM 427 C MET A 27 15.250 -15.387 2.477 1.00 20.50 C ATOM 428 O MET A 27 15.357 -14.358 1.810 1.00 25.34 O ATOM 429 CB MET A 27 13.843 -15.966 4.463 1.00 11.31 C ATOM 430 CG MET A 27 14.740 -14.949 5.151 1.00 72.30 C ATOM 431 SD MET A 27 14.127 -14.471 6.778 1.00 40.22 S ATOM 432 CE MET A 27 13.533 -16.045 7.392 1.00 5.15 C ATOM 0 H MET A 27 13.852 -17.978 2.920 1.00 52.01 H new ATOM 0 HA MET A 27 13.128 -15.170 2.599 1.00 34.10 H new ATOM 0 HB2 MET A 27 12.817 -15.821 4.801 1.00 11.31 H new ATOM 0 HB3 MET A 27 14.141 -16.968 4.771 1.00 11.31 H new ATOM 0 HG2 MET A 27 15.743 -15.364 5.252 1.00 72.30 H new ATOM 0 HG3 MET A 27 14.825 -14.062 4.524 1.00 72.30 H new ATOM 0 HE1 MET A 27 13.456 -16.006 8.479 1.00 5.15 H new ATOM 0 HE2 MET A 27 12.552 -16.255 6.966 1.00 5.15 H new ATOM 0 HE3 MET A 27 14.229 -16.833 7.106 1.00 5.15 H new ATOM 442 N SER A 28 16.293 -16.128 2.838 1.00 1.24 N ATOM 443 CA SER A 28 17.655 -15.763 2.467 1.00 41.31 C ATOM 444 C SER A 28 18.297 -16.854 1.616 1.00 23.33 C ATOM 445 O SER A 28 17.607 -17.703 1.049 1.00 3.51 O ATOM 446 CB SER A 28 18.498 -15.514 3.719 1.00 44.52 C ATOM 447 OG SER A 28 18.739 -16.721 4.420 1.00 21.12 O ATOM 0 H SER A 28 16.221 -16.985 3.387 1.00 1.24 H new ATOM 0 HA SER A 28 17.612 -14.846 1.879 1.00 41.31 H new ATOM 0 HB2 SER A 28 19.447 -15.058 3.437 1.00 44.52 H new ATOM 0 HB3 SER A 28 17.986 -14.807 4.371 1.00 44.52 H new ATOM 0 HG SER A 28 17.986 -16.908 5.018 1.00 21.12 H new ATOM 453 N LEU A 29 19.623 -16.827 1.532 1.00 52.41 N ATOM 454 CA LEU A 29 20.361 -17.813 0.751 1.00 75.33 C ATOM 455 C LEU A 29 21.259 -18.657 1.649 1.00 63.33 C ATOM 456 O LEU A 29 22.486 -18.624 1.549 1.00 51.43 O ATOM 457 CB LEU A 29 21.200 -17.119 -0.323 1.00 4.44 C ATOM 458 CG LEU A 29 21.697 -15.713 0.019 1.00 75.12 C ATOM 459 CD1 LEU A 29 23.009 -15.423 -0.692 1.00 63.11 C ATOM 460 CD2 LEU A 29 20.648 -14.673 -0.349 1.00 31.43 C ATOM 0 H LEU A 29 20.209 -16.133 1.996 1.00 52.41 H new ATOM 0 HA LEU A 29 19.639 -18.472 0.268 1.00 75.33 H new ATOM 0 HB2 LEU A 29 22.065 -17.745 -0.541 1.00 4.44 H new ATOM 0 HB3 LEU A 29 20.609 -17.062 -1.237 1.00 4.44 H new ATOM 0 HG LEU A 29 21.871 -15.661 1.094 1.00 75.12 H new ATOM 0 HD11 LEU A 29 23.347 -14.419 -0.437 1.00 63.11 H new ATOM 0 HD12 LEU A 29 23.760 -16.149 -0.380 1.00 63.11 H new ATOM 0 HD13 LEU A 29 22.862 -15.493 -1.770 1.00 63.11 H new ATOM 0 HD21 LEU A 29 21.018 -13.679 -0.099 1.00 31.43 H new ATOM 0 HD22 LEU A 29 20.443 -14.726 -1.418 1.00 31.43 H new ATOM 0 HD23 LEU A 29 19.731 -14.869 0.206 1.00 31.43 H new ATOM 472 N PRO A 30 20.636 -19.435 2.547 1.00 65.15 N ATOM 473 CA PRO A 30 21.361 -20.305 3.478 1.00 72.22 C ATOM 474 C PRO A 30 22.026 -21.483 2.773 1.00 15.21 C ATOM 475 O PRO A 30 22.712 -22.289 3.402 1.00 5.32 O ATOM 476 CB PRO A 30 20.266 -20.799 4.427 1.00 53.23 C ATOM 477 CG PRO A 30 19.008 -20.709 3.633 1.00 62.40 C ATOM 478 CD PRO A 30 19.177 -19.526 2.721 1.00 1.54 C ATOM 0 HA PRO A 30 22.173 -19.779 3.979 1.00 72.22 H new ATOM 0 HB2 PRO A 30 20.456 -21.822 4.753 1.00 53.23 H new ATOM 0 HB3 PRO A 30 20.213 -20.183 5.325 1.00 53.23 H new ATOM 0 HG2 PRO A 30 18.842 -21.622 3.061 1.00 62.40 H new ATOM 0 HG3 PRO A 30 18.144 -20.579 4.285 1.00 62.40 H new ATOM 0 HD2 PRO A 30 18.667 -19.676 1.769 1.00 1.54 H new ATOM 0 HD3 PRO A 30 18.767 -18.617 3.162 1.00 1.54 H new ATOM 486 N LEU A 31 21.818 -21.577 1.464 1.00 11.24 N ATOM 487 CA LEU A 31 22.398 -22.656 0.673 1.00 30.52 C ATOM 488 C LEU A 31 23.884 -22.817 0.978 1.00 50.13 C ATOM 489 O LEU A 31 24.420 -23.924 0.937 1.00 51.13 O ATOM 490 CB LEU A 31 22.198 -22.386 -0.819 1.00 72.20 C ATOM 491 CG LEU A 31 20.764 -22.093 -1.262 1.00 12.25 C ATOM 492 CD1 LEU A 31 20.681 -22.003 -2.777 1.00 52.24 C ATOM 493 CD2 LEU A 31 19.815 -23.160 -0.736 1.00 14.20 C ATOM 0 H LEU A 31 21.252 -20.919 0.928 1.00 11.24 H new ATOM 0 HA LEU A 31 21.889 -23.582 0.939 1.00 30.52 H new ATOM 0 HB2 LEU A 31 22.824 -21.540 -1.102 1.00 72.20 H new ATOM 0 HB3 LEU A 31 22.560 -23.250 -1.376 1.00 72.20 H new ATOM 0 HG LEU A 31 20.465 -21.131 -0.845 1.00 12.25 H new ATOM 0 HD11 LEU A 31 19.653 -21.794 -3.073 1.00 52.24 H new ATOM 0 HD12 LEU A 31 21.330 -21.202 -3.130 1.00 52.24 H new ATOM 0 HD13 LEU A 31 21.000 -22.948 -3.216 1.00 52.24 H new ATOM 0 HD21 LEU A 31 18.799 -22.935 -1.061 1.00 14.20 H new ATOM 0 HD22 LEU A 31 20.113 -24.135 -1.123 1.00 14.20 H new ATOM 0 HD23 LEU A 31 19.853 -23.175 0.353 1.00 14.20 H new ATOM 505 N MET A 32 24.543 -21.705 1.285 1.00 2.42 N ATOM 506 CA MET A 32 25.967 -21.723 1.600 1.00 11.13 C ATOM 507 C MET A 32 26.206 -21.337 3.056 1.00 4.34 C ATOM 508 O MET A 32 26.954 -22.005 3.770 1.00 34.45 O ATOM 509 CB MET A 32 26.728 -20.770 0.676 1.00 31.40 C ATOM 510 CG MET A 32 26.079 -19.402 0.546 1.00 74.24 C ATOM 511 SD MET A 32 26.925 -18.342 -0.642 1.00 42.00 S ATOM 512 CE MET A 32 25.839 -16.918 -0.659 1.00 1.21 C ATOM 0 H MET A 32 24.114 -20.780 1.322 1.00 2.42 H new ATOM 0 HA MET A 32 26.335 -22.737 1.446 1.00 11.13 H new ATOM 0 HB2 MET A 32 27.744 -20.647 1.052 1.00 31.40 H new ATOM 0 HB3 MET A 32 26.806 -21.221 -0.313 1.00 31.40 H new ATOM 0 HG2 MET A 32 25.040 -19.525 0.242 1.00 74.24 H new ATOM 0 HG3 MET A 32 26.070 -18.914 1.521 1.00 74.24 H new ATOM 0 HE1 MET A 32 26.416 -16.023 -0.894 1.00 1.21 H new ATOM 0 HE2 MET A 32 25.065 -17.059 -1.414 1.00 1.21 H new ATOM 0 HE3 MET A 32 25.374 -16.803 0.320 1.00 1.21 H new ATOM 522 N TRP A 33 25.569 -20.255 3.489 1.00 33.23 N ATOM 523 CA TRP A 33 25.713 -19.781 4.861 1.00 45.52 C ATOM 524 C TRP A 33 24.504 -18.953 5.281 1.00 34.41 C ATOM 525 O TRP A 33 23.799 -18.397 4.440 1.00 61.15 O ATOM 526 CB TRP A 33 26.989 -18.949 5.002 1.00 24.05 C ATOM 527 CG TRP A 33 28.223 -19.672 4.552 1.00 14.01 C ATOM 528 CD1 TRP A 33 28.889 -19.500 3.373 1.00 50.44 C ATOM 529 CD2 TRP A 33 28.935 -20.683 5.274 1.00 40.24 C ATOM 530 NE1 TRP A 33 29.973 -20.342 3.317 1.00 32.53 N ATOM 531 CE2 TRP A 33 30.024 -21.078 4.472 1.00 74.13 C ATOM 532 CE3 TRP A 33 28.761 -21.291 6.520 1.00 53.13 C ATOM 533 CZ2 TRP A 33 30.930 -22.054 4.877 1.00 44.13 C ATOM 534 CZ3 TRP A 33 29.661 -22.259 6.920 1.00 64.40 C ATOM 535 CH2 TRP A 33 30.736 -22.633 6.101 1.00 15.22 C ATOM 0 H TRP A 33 24.948 -19.689 2.910 1.00 33.23 H new ATOM 0 HA TRP A 33 25.779 -20.651 5.515 1.00 45.52 H new ATOM 0 HB2 TRP A 33 26.882 -18.032 4.422 1.00 24.05 H new ATOM 0 HB3 TRP A 33 27.109 -18.655 6.045 1.00 24.05 H new ATOM 0 HD1 TRP A 33 28.605 -18.804 2.598 1.00 50.44 H new ATOM 0 HE1 TRP A 33 30.633 -20.409 2.542 1.00 32.53 H new ATOM 0 HE3 TRP A 33 27.937 -21.009 7.159 1.00 53.13 H new ATOM 0 HZ2 TRP A 33 31.758 -22.344 4.247 1.00 44.13 H new ATOM 0 HZ3 TRP A 33 29.535 -22.736 7.880 1.00 64.40 H new ATOM 0 HH2 TRP A 33 31.424 -23.392 6.443 1.00 15.22 H new ATOM 546 N GLU A 34 24.269 -18.877 6.587 1.00 20.04 N ATOM 547 CA GLU A 34 23.143 -18.117 7.117 1.00 31.45 C ATOM 548 C GLU A 34 23.191 -18.066 8.642 1.00 75.11 C ATOM 549 O GLU A 34 24.133 -18.560 9.262 1.00 74.23 O ATOM 550 CB GLU A 34 21.821 -18.736 6.658 1.00 13.52 C ATOM 551 CG GLU A 34 20.876 -17.738 6.009 1.00 73.51 C ATOM 552 CD GLU A 34 19.756 -17.307 6.936 1.00 73.42 C ATOM 553 OE1 GLU A 34 19.639 -16.092 7.199 1.00 74.14 O ATOM 554 OE2 GLU A 34 18.997 -18.185 7.398 1.00 11.54 O ATOM 0 H GLU A 34 24.843 -19.332 7.297 1.00 20.04 H new ATOM 0 HA GLU A 34 23.212 -17.099 6.734 1.00 31.45 H new ATOM 0 HB2 GLU A 34 22.031 -19.538 5.951 1.00 13.52 H new ATOM 0 HB3 GLU A 34 21.324 -19.189 7.516 1.00 13.52 H new ATOM 0 HG2 GLU A 34 21.441 -16.860 5.695 1.00 73.51 H new ATOM 0 HG3 GLU A 34 20.448 -18.181 5.109 1.00 73.51 H new ATOM 561 N PHE A 35 22.168 -17.464 9.240 1.00 72.00 N ATOM 562 CA PHE A 35 22.093 -17.346 10.691 1.00 12.05 C ATOM 563 C PHE A 35 20.738 -17.823 11.207 1.00 51.34 C ATOM 564 O PHE A 35 19.743 -17.845 10.482 1.00 14.41 O ATOM 565 CB PHE A 35 22.333 -15.897 11.120 1.00 53.24 C ATOM 566 CG PHE A 35 23.785 -15.556 11.295 1.00 30.11 C ATOM 567 CD1 PHE A 35 24.330 -14.446 10.671 1.00 0.31 C ATOM 568 CD2 PHE A 35 24.605 -16.347 12.084 1.00 42.22 C ATOM 569 CE1 PHE A 35 25.666 -14.129 10.831 1.00 60.12 C ATOM 570 CE2 PHE A 35 25.942 -16.035 12.248 1.00 54.05 C ATOM 571 CZ PHE A 35 26.473 -14.926 11.619 1.00 0.43 C ATOM 0 H PHE A 35 21.380 -17.050 8.742 1.00 72.00 H new ATOM 0 HA PHE A 35 22.869 -17.978 11.122 1.00 12.05 H new ATOM 0 HB2 PHE A 35 21.898 -15.230 10.376 1.00 53.24 H new ATOM 0 HB3 PHE A 35 21.809 -15.713 12.058 1.00 53.24 H new ATOM 0 HD1 PHE A 35 23.704 -13.821 10.052 1.00 0.31 H new ATOM 0 HD2 PHE A 35 24.195 -17.217 12.576 1.00 42.22 H new ATOM 0 HE1 PHE A 35 26.078 -13.259 10.341 1.00 60.12 H new ATOM 0 HE2 PHE A 35 26.570 -16.658 12.867 1.00 54.05 H new ATOM 0 HZ PHE A 35 27.518 -14.682 11.743 1.00 0.43 H new ATOM 581 N PRO A 36 20.697 -18.215 12.489 1.00 45.43 N ATOM 582 CA PRO A 36 19.471 -18.698 13.130 1.00 24.43 C ATOM 583 C PRO A 36 18.447 -17.587 13.336 1.00 63.45 C ATOM 584 O PRO A 36 18.786 -16.405 13.306 1.00 14.15 O ATOM 585 CB PRO A 36 19.963 -19.229 14.480 1.00 53.34 C ATOM 586 CG PRO A 36 21.215 -18.469 14.752 1.00 13.22 C ATOM 587 CD PRO A 36 21.845 -18.215 13.411 1.00 65.11 C ATOM 0 HA PRO A 36 18.960 -19.445 12.522 1.00 24.43 H new ATOM 0 HB2 PRO A 36 19.223 -19.066 15.263 1.00 53.34 H new ATOM 0 HB3 PRO A 36 20.152 -20.302 14.438 1.00 53.34 H new ATOM 0 HG2 PRO A 36 20.999 -17.532 15.265 1.00 13.22 H new ATOM 0 HG3 PRO A 36 21.885 -19.038 15.396 1.00 13.22 H new ATOM 0 HD2 PRO A 36 22.377 -17.264 13.391 1.00 65.11 H new ATOM 0 HD3 PRO A 36 22.567 -18.990 13.153 1.00 65.11 H new ATOM 595 N GLY A 37 17.193 -17.976 13.544 1.00 52.03 N ATOM 596 CA GLY A 37 16.139 -17.000 13.751 1.00 32.21 C ATOM 597 C GLY A 37 14.901 -17.301 12.930 1.00 14.10 C ATOM 598 O GLY A 37 14.624 -18.456 12.611 1.00 63.50 O ATOM 0 H GLY A 37 16.888 -18.949 13.573 1.00 52.03 H new ATOM 0 HA2 GLY A 37 15.873 -16.975 14.808 1.00 32.21 H new ATOM 0 HA3 GLY A 37 16.510 -16.008 13.493 1.00 32.21 H new ATOM 602 N GLY A 38 14.151 -16.257 12.588 1.00 62.21 N ATOM 603 CA GLY A 38 12.943 -16.436 11.804 1.00 64.54 C ATOM 604 C GLY A 38 12.354 -15.120 11.337 1.00 64.01 C ATOM 605 O GLY A 38 13.029 -14.327 10.680 1.00 62.12 O ATOM 0 H GLY A 38 14.359 -15.291 12.840 1.00 62.21 H new ATOM 0 HA2 GLY A 38 13.165 -17.059 10.937 1.00 64.54 H new ATOM 0 HA3 GLY A 38 12.203 -16.971 12.400 1.00 64.54 H new ATOM 609 N LYS A 39 11.091 -14.886 11.675 1.00 10.03 N ATOM 610 CA LYS A 39 10.409 -13.657 11.287 1.00 45.11 C ATOM 611 C LYS A 39 9.896 -12.909 12.513 1.00 41.30 C ATOM 612 O LYS A 39 9.835 -13.463 13.611 1.00 43.05 O ATOM 613 CB LYS A 39 9.246 -13.971 10.344 1.00 50.34 C ATOM 614 CG LYS A 39 9.680 -14.599 9.031 1.00 71.52 C ATOM 615 CD LYS A 39 9.685 -16.117 9.114 1.00 40.31 C ATOM 616 CE LYS A 39 9.442 -16.750 7.753 1.00 73.32 C ATOM 617 NZ LYS A 39 10.137 -18.060 7.618 1.00 24.13 N ATOM 0 H LYS A 39 10.518 -15.532 12.218 1.00 10.03 H new ATOM 0 HA LYS A 39 11.127 -13.021 10.769 1.00 45.11 H new ATOM 0 HB2 LYS A 39 8.553 -14.645 10.848 1.00 50.34 H new ATOM 0 HB3 LYS A 39 8.701 -13.051 10.134 1.00 50.34 H new ATOM 0 HG2 LYS A 39 9.008 -14.279 8.234 1.00 71.52 H new ATOM 0 HG3 LYS A 39 10.677 -14.245 8.769 1.00 71.52 H new ATOM 0 HD2 LYS A 39 10.642 -16.458 9.509 1.00 40.31 H new ATOM 0 HD3 LYS A 39 8.916 -16.447 9.812 1.00 40.31 H new ATOM 0 HE2 LYS A 39 8.371 -16.890 7.604 1.00 73.32 H new ATOM 0 HE3 LYS A 39 9.787 -16.074 6.971 1.00 73.32 H new ATOM 0 HZ1 LYS A 39 9.946 -18.459 6.677 1.00 24.13 H new ATOM 0 HZ2 LYS A 39 11.161 -17.923 7.735 1.00 24.13 H new ATOM 0 HZ3 LYS A 39 9.789 -18.714 8.348 1.00 24.13 H new ATOM 631 N VAL A 40 9.526 -11.647 12.319 1.00 41.23 N ATOM 632 CA VAL A 40 9.015 -10.823 13.408 1.00 22.52 C ATOM 633 C VAL A 40 7.700 -10.155 13.022 1.00 23.52 C ATOM 634 O VAL A 40 7.497 -9.786 11.866 1.00 0.44 O ATOM 635 CB VAL A 40 10.030 -9.738 13.815 1.00 73.21 C ATOM 636 CG1 VAL A 40 9.478 -8.891 14.951 1.00 4.42 C ATOM 637 CG2 VAL A 40 11.357 -10.370 14.206 1.00 42.04 C ATOM 0 H VAL A 40 9.571 -11.173 11.417 1.00 41.23 H new ATOM 0 HA VAL A 40 8.846 -11.488 14.255 1.00 22.52 H new ATOM 0 HB VAL A 40 10.203 -9.086 12.958 1.00 73.21 H new ATOM 0 HG11 VAL A 40 10.208 -8.130 15.225 1.00 4.42 H new ATOM 0 HG12 VAL A 40 8.555 -8.409 14.630 1.00 4.42 H new ATOM 0 HG13 VAL A 40 9.275 -9.526 15.813 1.00 4.42 H new ATOM 0 HG21 VAL A 40 12.062 -9.589 14.491 1.00 42.04 H new ATOM 0 HG22 VAL A 40 11.204 -11.045 15.048 1.00 42.04 H new ATOM 0 HG23 VAL A 40 11.757 -10.929 13.360 1.00 42.04 H new ATOM 647 N GLU A 41 6.811 -10.004 13.999 1.00 72.14 N ATOM 648 CA GLU A 41 5.515 -9.380 13.760 1.00 35.40 C ATOM 649 C GLU A 41 5.646 -7.861 13.693 1.00 34.53 C ATOM 650 O GLU A 41 6.409 -7.259 14.448 1.00 13.43 O ATOM 651 CB GLU A 41 4.526 -9.770 14.861 1.00 71.11 C ATOM 652 CG GLU A 41 4.046 -11.209 14.767 1.00 50.33 C ATOM 653 CD GLU A 41 2.839 -11.480 15.644 1.00 4.11 C ATOM 654 OE1 GLU A 41 2.965 -12.276 16.598 1.00 63.25 O ATOM 655 OE2 GLU A 41 1.769 -10.895 15.377 1.00 52.22 O ATOM 0 H GLU A 41 6.964 -10.305 14.962 1.00 72.14 H new ATOM 0 HA GLU A 41 5.140 -9.737 12.801 1.00 35.40 H new ATOM 0 HB2 GLU A 41 4.997 -9.616 15.832 1.00 71.11 H new ATOM 0 HB3 GLU A 41 3.664 -9.105 14.816 1.00 71.11 H new ATOM 0 HG2 GLU A 41 3.796 -11.438 13.731 1.00 50.33 H new ATOM 0 HG3 GLU A 41 4.857 -11.878 15.055 1.00 50.33 H new ATOM 662 N LYS A 42 4.896 -7.248 12.784 1.00 70.34 N ATOM 663 CA LYS A 42 4.926 -5.800 12.617 1.00 61.23 C ATOM 664 C LYS A 42 4.718 -5.094 13.953 1.00 63.03 C ATOM 665 O LYS A 42 5.229 -3.996 14.171 1.00 74.22 O ATOM 666 CB LYS A 42 3.851 -5.358 11.622 1.00 74.44 C ATOM 667 CG LYS A 42 2.443 -5.398 12.190 1.00 13.02 C ATOM 668 CD LYS A 42 1.955 -6.825 12.372 1.00 32.43 C ATOM 669 CE LYS A 42 0.456 -6.937 12.136 1.00 3.44 C ATOM 670 NZ LYS A 42 -0.003 -8.353 12.146 1.00 32.02 N ATOM 0 H LYS A 42 4.259 -7.732 12.151 1.00 70.34 H new ATOM 0 HA LYS A 42 5.907 -5.525 12.229 1.00 61.23 H new ATOM 0 HB2 LYS A 42 4.071 -4.344 11.289 1.00 74.44 H new ATOM 0 HB3 LYS A 42 3.897 -5.999 10.742 1.00 74.44 H new ATOM 0 HG2 LYS A 42 2.422 -4.880 13.149 1.00 13.02 H new ATOM 0 HG3 LYS A 42 1.766 -4.863 11.524 1.00 13.02 H new ATOM 0 HD2 LYS A 42 2.483 -7.482 11.681 1.00 32.43 H new ATOM 0 HD3 LYS A 42 2.192 -7.166 13.380 1.00 32.43 H new ATOM 0 HE2 LYS A 42 -0.076 -6.378 12.906 1.00 3.44 H new ATOM 0 HE3 LYS A 42 0.204 -6.480 11.179 1.00 3.44 H new ATOM 0 HZ1 LYS A 42 -1.029 -8.386 11.982 1.00 32.02 H new ATOM 0 HZ2 LYS A 42 0.485 -8.881 11.395 1.00 32.02 H new ATOM 0 HZ3 LYS A 42 0.214 -8.782 13.068 1.00 32.02 H new ATOM 684 N ASN A 43 3.967 -5.733 14.844 1.00 51.42 N ATOM 685 CA ASN A 43 3.693 -5.165 16.159 1.00 32.42 C ATOM 686 C ASN A 43 4.870 -5.388 17.104 1.00 70.43 C ATOM 687 O ASN A 43 5.199 -4.524 17.916 1.00 74.23 O ATOM 688 CB ASN A 43 2.425 -5.785 16.751 1.00 62.12 C ATOM 689 CG ASN A 43 1.717 -4.848 17.710 1.00 54.15 C ATOM 690 OD1 ASN A 43 1.570 -5.148 18.894 1.00 20.44 O ATOM 691 ND2 ASN A 43 1.273 -3.705 17.200 1.00 53.14 N ATOM 0 H ASN A 43 3.538 -6.644 14.680 1.00 51.42 H new ATOM 0 HA ASN A 43 3.544 -4.092 16.040 1.00 32.42 H new ATOM 0 HB2 ASN A 43 1.745 -6.056 15.943 1.00 62.12 H new ATOM 0 HB3 ASN A 43 2.684 -6.707 17.272 1.00 62.12 H new ATOM 0 HD21 ASN A 43 0.788 -3.035 17.797 1.00 53.14 H new ATOM 0 HD22 ASN A 43 1.417 -3.497 16.212 1.00 53.14 H new ATOM 698 N GLU A 44 5.501 -6.553 16.990 1.00 35.21 N ATOM 699 CA GLU A 44 6.641 -6.889 17.834 1.00 30.24 C ATOM 700 C GLU A 44 7.924 -6.268 17.289 1.00 73.44 C ATOM 701 O GLU A 44 8.113 -6.170 16.076 1.00 70.44 O ATOM 702 CB GLU A 44 6.799 -8.408 17.935 1.00 1.24 C ATOM 703 CG GLU A 44 7.383 -8.872 19.259 1.00 31.31 C ATOM 704 CD GLU A 44 6.374 -8.827 20.390 1.00 54.22 C ATOM 705 OE1 GLU A 44 6.063 -7.714 20.864 1.00 75.32 O ATOM 706 OE2 GLU A 44 5.895 -9.905 20.800 1.00 13.34 O ATOM 0 H GLU A 44 5.242 -7.279 16.322 1.00 35.21 H new ATOM 0 HA GLU A 44 6.456 -6.483 18.829 1.00 30.24 H new ATOM 0 HB2 GLU A 44 5.825 -8.876 17.793 1.00 1.24 H new ATOM 0 HB3 GLU A 44 7.440 -8.753 17.124 1.00 1.24 H new ATOM 0 HG2 GLU A 44 7.756 -9.890 19.150 1.00 31.31 H new ATOM 0 HG3 GLU A 44 8.237 -8.245 19.514 1.00 31.31 H new ATOM 713 N THR A 45 8.803 -5.849 18.193 1.00 21.43 N ATOM 714 CA THR A 45 10.067 -5.237 17.804 1.00 12.53 C ATOM 715 C THR A 45 11.097 -6.294 17.425 1.00 20.11 C ATOM 716 O THR A 45 10.931 -7.473 17.735 1.00 63.44 O ATOM 717 CB THR A 45 10.639 -4.361 18.936 1.00 74.53 C ATOM 718 OG1 THR A 45 9.572 -3.742 19.663 1.00 72.30 O ATOM 719 CG2 THR A 45 11.566 -3.292 18.377 1.00 34.51 C ATOM 0 H THR A 45 8.663 -5.922 19.201 1.00 21.43 H new ATOM 0 HA THR A 45 9.860 -4.609 16.937 1.00 12.53 H new ATOM 0 HB THR A 45 11.212 -5.001 19.607 1.00 74.53 H new ATOM 0 HG1 THR A 45 9.837 -3.630 20.600 1.00 72.30 H new ATOM 0 HG21 THR A 45 11.957 -2.686 19.194 1.00 34.51 H new ATOM 0 HG22 THR A 45 12.393 -3.767 17.849 1.00 34.51 H new ATOM 0 HG23 THR A 45 11.013 -2.656 17.686 1.00 34.51 H new ATOM 727 N GLU A 46 12.161 -5.864 16.754 1.00 12.30 N ATOM 728 CA GLU A 46 13.218 -6.776 16.333 1.00 10.40 C ATOM 729 C GLU A 46 13.736 -7.591 17.514 1.00 14.05 C ATOM 730 O GLU A 46 13.698 -8.821 17.499 1.00 70.52 O ATOM 731 CB GLU A 46 14.369 -5.997 15.693 1.00 2.43 C ATOM 732 CG GLU A 46 13.947 -5.158 14.499 1.00 51.12 C ATOM 733 CD GLU A 46 14.867 -3.976 14.261 1.00 21.40 C ATOM 734 OE1 GLU A 46 15.924 -3.906 14.923 1.00 62.05 O ATOM 735 OE2 GLU A 46 14.531 -3.123 13.414 1.00 13.54 O ATOM 0 H GLU A 46 12.314 -4.891 16.490 1.00 12.30 H new ATOM 0 HA GLU A 46 12.799 -7.462 15.597 1.00 10.40 H new ATOM 0 HB2 GLU A 46 14.817 -5.346 16.443 1.00 2.43 H new ATOM 0 HB3 GLU A 46 15.141 -6.699 15.378 1.00 2.43 H new ATOM 0 HG2 GLU A 46 13.929 -5.785 13.607 1.00 51.12 H new ATOM 0 HG3 GLU A 46 12.931 -4.797 14.655 1.00 51.12 H new ATOM 742 N LYS A 47 14.220 -6.896 18.538 1.00 33.14 N ATOM 743 CA LYS A 47 14.745 -7.553 19.729 1.00 31.04 C ATOM 744 C LYS A 47 13.613 -8.103 20.592 1.00 50.35 C ATOM 745 O LYS A 47 13.661 -9.249 21.039 1.00 3.52 O ATOM 746 CB LYS A 47 15.592 -6.574 20.545 1.00 23.01 C ATOM 747 CG LYS A 47 17.077 -6.896 20.531 1.00 35.43 C ATOM 748 CD LYS A 47 17.444 -7.877 21.632 1.00 5.34 C ATOM 749 CE LYS A 47 17.608 -9.288 21.090 1.00 33.41 C ATOM 750 NZ LYS A 47 17.488 -10.313 22.164 1.00 13.44 N ATOM 0 H LYS A 47 14.259 -5.877 18.567 1.00 33.14 H new ATOM 0 HA LYS A 47 15.371 -8.386 19.407 1.00 31.04 H new ATOM 0 HB2 LYS A 47 15.444 -5.567 20.156 1.00 23.01 H new ATOM 0 HB3 LYS A 47 15.239 -6.573 21.576 1.00 23.01 H new ATOM 0 HG2 LYS A 47 17.350 -7.315 19.563 1.00 35.43 H new ATOM 0 HG3 LYS A 47 17.651 -5.978 20.654 1.00 35.43 H new ATOM 0 HD2 LYS A 47 18.371 -7.560 22.109 1.00 5.34 H new ATOM 0 HD3 LYS A 47 16.671 -7.869 22.400 1.00 5.34 H new ATOM 0 HE2 LYS A 47 16.853 -9.473 20.326 1.00 33.41 H new ATOM 0 HE3 LYS A 47 18.581 -9.381 20.607 1.00 33.41 H new ATOM 0 HZ1 LYS A 47 18.056 -11.147 21.913 1.00 13.44 H new ATOM 0 HZ2 LYS A 47 17.833 -9.917 23.062 1.00 13.44 H new ATOM 0 HZ3 LYS A 47 16.491 -10.591 22.268 1.00 13.44 H new ATOM 764 N ASP A 48 12.595 -7.280 20.819 1.00 45.51 N ATOM 765 CA ASP A 48 11.450 -7.684 21.625 1.00 32.52 C ATOM 766 C ASP A 48 10.877 -9.009 21.129 1.00 1.43 C ATOM 767 O ASP A 48 10.322 -9.785 21.905 1.00 34.35 O ATOM 768 CB ASP A 48 10.369 -6.603 21.593 1.00 32.02 C ATOM 769 CG ASP A 48 10.862 -5.276 22.135 1.00 54.41 C ATOM 770 OD1 ASP A 48 12.038 -5.203 22.548 1.00 41.21 O ATOM 771 OD2 ASP A 48 10.071 -4.309 22.145 1.00 21.21 O ATOM 0 H ASP A 48 12.540 -6.329 20.456 1.00 45.51 H new ATOM 0 HA ASP A 48 11.789 -7.817 22.652 1.00 32.52 H new ATOM 0 HB2 ASP A 48 10.024 -6.468 20.568 1.00 32.02 H new ATOM 0 HB3 ASP A 48 9.510 -6.934 22.177 1.00 32.02 H new ATOM 776 N ALA A 49 11.016 -9.258 19.831 1.00 34.24 N ATOM 777 CA ALA A 49 10.513 -10.488 19.232 1.00 31.22 C ATOM 778 C ALA A 49 11.526 -11.620 19.370 1.00 52.21 C ATOM 779 O ALA A 49 11.154 -12.784 19.526 1.00 44.21 O ATOM 780 CB ALA A 49 10.170 -10.260 17.768 1.00 53.14 C ATOM 0 H ALA A 49 11.472 -8.625 19.175 1.00 34.24 H new ATOM 0 HA ALA A 49 9.608 -10.779 19.765 1.00 31.22 H new ATOM 0 HB1 ALA A 49 9.796 -11.187 17.333 1.00 53.14 H new ATOM 0 HB2 ALA A 49 9.405 -9.487 17.690 1.00 53.14 H new ATOM 0 HB3 ALA A 49 11.063 -9.942 17.230 1.00 53.14 H new ATOM 786 N LEU A 50 12.806 -11.272 19.311 1.00 44.44 N ATOM 787 CA LEU A 50 13.874 -12.259 19.428 1.00 0.22 C ATOM 788 C LEU A 50 13.924 -12.842 20.837 1.00 74.13 C ATOM 789 O LEU A 50 14.108 -14.047 21.014 1.00 4.51 O ATOM 790 CB LEU A 50 15.222 -11.626 19.078 1.00 12.43 C ATOM 791 CG LEU A 50 15.634 -11.694 17.607 1.00 30.24 C ATOM 792 CD1 LEU A 50 16.964 -10.989 17.392 1.00 23.34 C ATOM 793 CD2 LEU A 50 15.714 -13.141 17.143 1.00 72.11 C ATOM 0 H LEU A 50 13.130 -10.313 19.183 1.00 44.44 H new ATOM 0 HA LEU A 50 13.666 -13.067 18.727 1.00 0.22 H new ATOM 0 HB2 LEU A 50 15.198 -10.579 19.380 1.00 12.43 H new ATOM 0 HB3 LEU A 50 15.995 -12.112 19.674 1.00 12.43 H new ATOM 0 HG LEU A 50 14.876 -11.184 17.013 1.00 30.24 H new ATOM 0 HD11 LEU A 50 17.241 -11.048 16.339 1.00 23.34 H new ATOM 0 HD12 LEU A 50 16.873 -9.943 17.685 1.00 23.34 H new ATOM 0 HD13 LEU A 50 17.733 -11.470 17.997 1.00 23.34 H new ATOM 0 HD21 LEU A 50 16.008 -13.171 16.094 1.00 72.11 H new ATOM 0 HD22 LEU A 50 16.451 -13.675 17.742 1.00 72.11 H new ATOM 0 HD23 LEU A 50 14.739 -13.615 17.260 1.00 72.11 H new ATOM 805 N ILE A 51 13.756 -11.981 21.834 1.00 15.34 N ATOM 806 CA ILE A 51 13.778 -12.411 23.227 1.00 71.43 C ATOM 807 C ILE A 51 12.828 -13.582 23.455 1.00 30.23 C ATOM 808 O ILE A 51 13.067 -14.430 24.316 1.00 52.33 O ATOM 809 CB ILE A 51 13.396 -11.262 24.178 1.00 50.12 C ATOM 810 CG1 ILE A 51 13.785 -11.610 25.616 1.00 33.31 C ATOM 811 CG2 ILE A 51 11.906 -10.968 24.082 1.00 22.23 C ATOM 812 CD1 ILE A 51 13.996 -10.398 26.495 1.00 4.14 C ATOM 0 H ILE A 51 13.603 -10.981 21.704 1.00 15.34 H new ATOM 0 HA ILE A 51 14.799 -12.726 23.444 1.00 71.43 H new ATOM 0 HB ILE A 51 13.943 -10.367 23.881 1.00 50.12 H new ATOM 0 HG12 ILE A 51 13.006 -12.235 26.053 1.00 33.31 H new ATOM 0 HG13 ILE A 51 14.700 -12.203 25.603 1.00 33.31 H new ATOM 0 HG21 ILE A 51 11.651 -10.153 24.760 1.00 22.23 H new ATOM 0 HG22 ILE A 51 11.657 -10.681 23.060 1.00 22.23 H new ATOM 0 HG23 ILE A 51 11.341 -11.859 24.357 1.00 22.23 H new ATOM 0 HD11 ILE A 51 14.269 -10.720 27.500 1.00 4.14 H new ATOM 0 HD12 ILE A 51 14.795 -9.783 26.081 1.00 4.14 H new ATOM 0 HD13 ILE A 51 13.076 -9.816 26.539 1.00 4.14 H new ATOM 824 N ARG A 52 11.751 -13.624 22.678 1.00 52.41 N ATOM 825 CA ARG A 52 10.765 -14.691 22.795 1.00 72.11 C ATOM 826 C ARG A 52 11.208 -15.928 22.020 1.00 64.41 C ATOM 827 O ARG A 52 11.234 -17.034 22.560 1.00 52.13 O ATOM 828 CB ARG A 52 9.404 -14.216 22.282 1.00 0.24 C ATOM 829 CG ARG A 52 8.847 -13.027 23.047 1.00 15.43 C ATOM 830 CD ARG A 52 8.711 -13.332 24.531 1.00 62.22 C ATOM 831 NE ARG A 52 7.945 -14.552 24.771 1.00 53.04 N ATOM 832 CZ ARG A 52 6.617 -14.602 24.750 1.00 44.10 C ATOM 833 NH1 ARG A 52 5.913 -13.506 24.501 1.00 23.34 N ATOM 834 NH2 ARG A 52 5.992 -15.750 24.978 1.00 52.32 N ATOM 0 H ARG A 52 11.539 -12.931 21.960 1.00 52.41 H new ATOM 0 HA ARG A 52 10.677 -14.955 23.849 1.00 72.11 H new ATOM 0 HB2 ARG A 52 9.495 -13.950 21.229 1.00 0.24 H new ATOM 0 HB3 ARG A 52 8.694 -15.041 22.342 1.00 0.24 H new ATOM 0 HG2 ARG A 52 9.501 -12.166 22.910 1.00 15.43 H new ATOM 0 HG3 ARG A 52 7.873 -12.755 22.640 1.00 15.43 H new ATOM 0 HD2 ARG A 52 9.702 -13.434 24.973 1.00 62.22 H new ATOM 0 HD3 ARG A 52 8.224 -12.494 25.030 1.00 62.22 H new ATOM 0 HE ARG A 52 8.457 -15.413 24.965 1.00 53.04 H new ATOM 0 HH11 ARG A 52 6.391 -12.622 24.325 1.00 23.34 H new ATOM 0 HH12 ARG A 52 4.894 -13.547 24.485 1.00 23.34 H new ATOM 0 HH21 ARG A 52 6.531 -16.595 25.170 1.00 52.32 H new ATOM 0 HH22 ARG A 52 4.973 -15.788 24.962 1.00 52.32 H new ATOM 848 N GLU A 53 11.556 -15.733 20.752 1.00 42.02 N ATOM 849 CA GLU A 53 11.997 -16.834 19.903 1.00 2.41 C ATOM 850 C GLU A 53 13.136 -17.606 20.562 1.00 64.10 C ATOM 851 O GLU A 53 13.015 -18.801 20.833 1.00 74.10 O ATOM 852 CB GLU A 53 12.446 -16.307 18.539 1.00 40.45 C ATOM 853 CG GLU A 53 11.298 -16.050 17.577 1.00 34.13 C ATOM 854 CD GLU A 53 11.758 -15.440 16.268 1.00 40.22 C ATOM 855 OE1 GLU A 53 12.884 -15.755 15.829 1.00 33.00 O ATOM 856 OE2 GLU A 53 10.992 -14.647 15.682 1.00 54.23 O ATOM 0 H GLU A 53 11.541 -14.824 20.290 1.00 42.02 H new ATOM 0 HA GLU A 53 11.155 -17.511 19.763 1.00 2.41 H new ATOM 0 HB2 GLU A 53 13.003 -15.381 18.682 1.00 40.45 H new ATOM 0 HB3 GLU A 53 13.132 -17.025 18.089 1.00 40.45 H new ATOM 0 HG2 GLU A 53 10.782 -16.988 17.374 1.00 34.13 H new ATOM 0 HG3 GLU A 53 10.575 -15.384 18.049 1.00 34.13 H new ATOM 863 N ILE A 54 14.243 -16.915 20.816 1.00 75.20 N ATOM 864 CA ILE A 54 15.403 -17.535 21.443 1.00 31.41 C ATOM 865 C ILE A 54 15.031 -18.174 22.777 1.00 61.52 C ATOM 866 O ILE A 54 15.735 -19.054 23.273 1.00 62.11 O ATOM 867 CB ILE A 54 16.532 -16.513 21.673 1.00 31.45 C ATOM 868 CG1 ILE A 54 16.957 -15.883 20.346 1.00 65.12 C ATOM 869 CG2 ILE A 54 17.718 -17.179 22.354 1.00 23.34 C ATOM 870 CD1 ILE A 54 17.813 -14.647 20.511 1.00 44.22 C ATOM 0 H ILE A 54 14.360 -15.926 20.597 1.00 75.20 H new ATOM 0 HA ILE A 54 15.757 -18.307 20.759 1.00 31.41 H new ATOM 0 HB ILE A 54 16.160 -15.723 22.325 1.00 31.45 H new ATOM 0 HG12 ILE A 54 17.507 -16.621 19.762 1.00 65.12 H new ATOM 0 HG13 ILE A 54 16.066 -15.624 19.774 1.00 65.12 H new ATOM 0 HG21 ILE A 54 18.508 -16.444 22.510 1.00 23.34 H new ATOM 0 HG22 ILE A 54 17.405 -17.584 23.316 1.00 23.34 H new ATOM 0 HG23 ILE A 54 18.093 -17.986 21.725 1.00 23.34 H new ATOM 0 HD11 ILE A 54 18.077 -14.254 19.529 1.00 44.22 H new ATOM 0 HD12 ILE A 54 17.258 -13.892 21.067 1.00 44.22 H new ATOM 0 HD13 ILE A 54 18.722 -14.904 21.055 1.00 44.22 H new ATOM 882 N ARG A 55 13.919 -17.727 23.351 1.00 23.34 N ATOM 883 CA ARG A 55 13.453 -18.256 24.628 1.00 40.14 C ATOM 884 C ARG A 55 12.708 -19.573 24.431 1.00 54.31 C ATOM 885 O ARG A 55 12.932 -20.538 25.160 1.00 34.21 O ATOM 886 CB ARG A 55 12.543 -17.241 25.322 1.00 30.22 C ATOM 887 CG ARG A 55 13.230 -16.470 26.437 1.00 2.02 C ATOM 888 CD ARG A 55 12.238 -15.634 27.230 1.00 52.10 C ATOM 889 NE ARG A 55 12.906 -14.663 28.093 1.00 71.42 N ATOM 890 CZ ARG A 55 12.273 -13.675 28.715 1.00 42.23 C ATOM 891 NH1 ARG A 55 10.964 -13.527 28.570 1.00 35.04 N ATOM 892 NH2 ARG A 55 12.951 -12.832 29.483 1.00 13.35 N ATOM 0 H ARG A 55 13.324 -17.000 22.953 1.00 23.34 H new ATOM 0 HA ARG A 55 14.324 -18.442 25.256 1.00 40.14 H new ATOM 0 HB2 ARG A 55 12.169 -16.535 24.581 1.00 30.22 H new ATOM 0 HB3 ARG A 55 11.678 -17.762 25.732 1.00 30.22 H new ATOM 0 HG2 ARG A 55 13.735 -17.167 27.105 1.00 2.02 H new ATOM 0 HG3 ARG A 55 13.997 -15.822 26.013 1.00 2.02 H new ATOM 0 HD2 ARG A 55 11.574 -15.111 26.542 1.00 52.10 H new ATOM 0 HD3 ARG A 55 11.615 -16.290 27.837 1.00 52.10 H new ATOM 0 HE ARG A 55 13.914 -14.748 28.225 1.00 71.42 H new ATOM 0 HH11 ARG A 55 10.440 -14.173 27.979 1.00 35.04 H new ATOM 0 HH12 ARG A 55 10.481 -12.767 29.049 1.00 35.04 H new ATOM 0 HH21 ARG A 55 13.959 -12.943 29.596 1.00 13.35 H new ATOM 0 HH22 ARG A 55 12.465 -12.073 29.961 1.00 13.35 H new ATOM 906 N GLU A 56 11.821 -19.603 23.441 1.00 14.41 N ATOM 907 CA GLU A 56 11.042 -20.801 23.150 1.00 13.52 C ATOM 908 C GLU A 56 11.734 -21.657 22.094 1.00 42.42 C ATOM 909 O GLU A 56 12.098 -22.804 22.351 1.00 1.52 O ATOM 910 CB GLU A 56 9.638 -20.420 22.674 1.00 21.13 C ATOM 911 CG GLU A 56 8.741 -19.894 23.783 1.00 63.35 C ATOM 912 CD GLU A 56 7.557 -19.110 23.252 1.00 42.30 C ATOM 913 OE1 GLU A 56 7.571 -18.753 22.055 1.00 0.11 O ATOM 914 OE2 GLU A 56 6.617 -18.852 24.033 1.00 64.33 O ATOM 0 H GLU A 56 11.624 -18.812 22.828 1.00 14.41 H new ATOM 0 HA GLU A 56 10.961 -21.383 24.068 1.00 13.52 H new ATOM 0 HB2 GLU A 56 9.721 -19.662 21.895 1.00 21.13 H new ATOM 0 HB3 GLU A 56 9.168 -21.293 22.221 1.00 21.13 H new ATOM 0 HG2 GLU A 56 8.379 -20.731 24.381 1.00 63.35 H new ATOM 0 HG3 GLU A 56 9.326 -19.257 24.447 1.00 63.35 H new ATOM 921 N GLU A 57 11.912 -21.090 20.904 1.00 13.24 N ATOM 922 CA GLU A 57 12.559 -21.802 19.809 1.00 40.43 C ATOM 923 C GLU A 57 13.886 -22.405 20.260 1.00 1.43 C ATOM 924 O GLU A 57 14.057 -23.623 20.263 1.00 21.31 O ATOM 925 CB GLU A 57 12.791 -20.860 18.625 1.00 13.44 C ATOM 926 CG GLU A 57 11.507 -20.361 17.984 1.00 12.21 C ATOM 927 CD GLU A 57 10.902 -21.370 17.028 1.00 61.15 C ATOM 928 OE1 GLU A 57 11.668 -22.010 16.277 1.00 31.24 O ATOM 929 OE2 GLU A 57 9.662 -21.520 17.030 1.00 41.42 O ATOM 0 H GLU A 57 11.617 -20.141 20.675 1.00 13.24 H new ATOM 0 HA GLU A 57 11.899 -22.612 19.497 1.00 40.43 H new ATOM 0 HB2 GLU A 57 13.376 -20.004 18.962 1.00 13.44 H new ATOM 0 HB3 GLU A 57 13.386 -21.376 17.872 1.00 13.44 H new ATOM 0 HG2 GLU A 57 10.783 -20.126 18.764 1.00 12.21 H new ATOM 0 HG3 GLU A 57 11.710 -19.434 17.448 1.00 12.21 H new ATOM 936 N MET A 58 14.822 -21.542 20.641 1.00 43.51 N ATOM 937 CA MET A 58 16.134 -21.989 21.095 1.00 0.42 C ATOM 938 C MET A 58 16.027 -22.722 22.429 1.00 52.35 C ATOM 939 O MET A 58 16.809 -23.628 22.715 1.00 60.40 O ATOM 940 CB MET A 58 17.084 -20.797 21.230 1.00 61.00 C ATOM 941 CG MET A 58 17.895 -20.522 19.974 1.00 4.44 C ATOM 942 SD MET A 58 16.859 -20.186 18.538 1.00 60.15 S ATOM 943 CE MET A 58 17.449 -18.562 18.066 1.00 0.14 C ATOM 0 H MET A 58 14.697 -20.530 20.644 1.00 43.51 H new ATOM 0 HA MET A 58 16.532 -22.680 20.352 1.00 0.42 H new ATOM 0 HB2 MET A 58 16.505 -19.908 21.481 1.00 61.00 H new ATOM 0 HB3 MET A 58 17.766 -20.978 22.061 1.00 61.00 H new ATOM 0 HG2 MET A 58 18.552 -19.671 20.150 1.00 4.44 H new ATOM 0 HG3 MET A 58 18.534 -21.380 19.764 1.00 4.44 H new ATOM 0 HE1 MET A 58 16.654 -17.830 18.209 1.00 0.14 H new ATOM 0 HE2 MET A 58 18.306 -18.293 18.683 1.00 0.14 H new ATOM 0 HE3 MET A 58 17.747 -18.574 17.018 1.00 0.14 H new ATOM 953 N LYS A 59 15.054 -22.324 23.241 1.00 12.40 N ATOM 954 CA LYS A 59 14.843 -22.943 24.544 1.00 0.11 C ATOM 955 C LYS A 59 16.064 -22.757 25.439 1.00 42.31 C ATOM 956 O LYS A 59 16.360 -23.601 26.285 1.00 34.24 O ATOM 957 CB LYS A 59 14.540 -24.434 24.380 1.00 23.00 C ATOM 958 CG LYS A 59 13.056 -24.753 24.345 1.00 33.04 C ATOM 959 CD LYS A 59 12.640 -25.603 25.534 1.00 22.23 C ATOM 960 CE LYS A 59 13.329 -26.959 25.518 1.00 71.23 C ATOM 961 NZ LYS A 59 12.545 -27.988 26.256 1.00 63.45 N ATOM 0 H LYS A 59 14.398 -21.575 23.019 1.00 12.40 H new ATOM 0 HA LYS A 59 13.991 -22.455 25.016 1.00 0.11 H new ATOM 0 HB2 LYS A 59 15.001 -24.791 23.459 1.00 23.00 H new ATOM 0 HB3 LYS A 59 15.002 -24.982 25.201 1.00 23.00 H new ATOM 0 HG2 LYS A 59 12.484 -23.825 24.342 1.00 33.04 H new ATOM 0 HG3 LYS A 59 12.818 -25.278 23.420 1.00 33.04 H new ATOM 0 HD2 LYS A 59 12.884 -25.081 26.459 1.00 22.23 H new ATOM 0 HD3 LYS A 59 11.559 -25.743 25.522 1.00 22.23 H new ATOM 0 HE2 LYS A 59 13.472 -27.282 24.487 1.00 71.23 H new ATOM 0 HE3 LYS A 59 14.320 -26.868 25.964 1.00 71.23 H new ATOM 0 HZ1 LYS A 59 13.048 -28.898 26.222 1.00 63.45 H new ATOM 0 HZ2 LYS A 59 12.430 -27.693 27.247 1.00 63.45 H new ATOM 0 HZ3 LYS A 59 11.609 -28.093 25.815 1.00 63.45 H new ATOM 975 N CYS A 60 16.769 -21.647 25.247 1.00 33.12 N ATOM 976 CA CYS A 60 17.958 -21.350 26.038 1.00 71.11 C ATOM 977 C CYS A 60 17.846 -19.978 26.694 1.00 12.20 C ATOM 978 O CYS A 60 16.801 -19.330 26.626 1.00 3.40 O ATOM 979 CB CYS A 60 19.208 -21.408 25.159 1.00 51.13 C ATOM 980 SG CYS A 60 19.407 -22.964 24.261 1.00 63.44 S ATOM 0 H CYS A 60 16.538 -20.938 24.551 1.00 33.12 H new ATOM 0 HA CYS A 60 18.039 -22.102 26.823 1.00 71.11 H new ATOM 0 HB2 CYS A 60 19.173 -20.589 24.441 1.00 51.13 H new ATOM 0 HB3 CYS A 60 20.086 -21.247 25.784 1.00 51.13 H new ATOM 0 HG CYS A 60 18.311 -23.236 23.616 1.00 63.44 H new ATOM 986 N ASP A 61 18.927 -19.542 27.330 1.00 24.13 N ATOM 987 CA ASP A 61 18.951 -18.247 28.000 1.00 52.22 C ATOM 988 C ASP A 61 19.869 -17.273 27.268 1.00 61.13 C ATOM 989 O ASP A 61 20.450 -16.374 27.877 1.00 43.13 O ATOM 990 CB ASP A 61 19.409 -18.407 29.450 1.00 10.33 C ATOM 991 CG ASP A 61 19.013 -17.226 30.316 1.00 65.52 C ATOM 992 OD1 ASP A 61 17.824 -16.845 30.293 1.00 62.34 O ATOM 993 OD2 ASP A 61 19.893 -16.684 31.017 1.00 30.51 O ATOM 0 H ASP A 61 19.799 -20.067 27.396 1.00 24.13 H new ATOM 0 HA ASP A 61 17.939 -17.842 27.990 1.00 52.22 H new ATOM 0 HB2 ASP A 61 18.979 -19.319 29.865 1.00 10.33 H new ATOM 0 HB3 ASP A 61 20.492 -18.525 29.475 1.00 10.33 H new ATOM 998 N LEU A 62 19.996 -17.459 25.958 1.00 2.35 N ATOM 999 CA LEU A 62 20.845 -16.597 25.142 1.00 31.45 C ATOM 1000 C LEU A 62 20.597 -15.127 25.463 1.00 2.14 C ATOM 1001 O LEU A 62 19.455 -14.667 25.471 1.00 71.15 O ATOM 1002 CB LEU A 62 20.590 -16.857 23.657 1.00 41.24 C ATOM 1003 CG LEU A 62 21.814 -16.785 22.743 1.00 22.11 C ATOM 1004 CD1 LEU A 62 22.486 -18.146 22.642 1.00 15.05 C ATOM 1005 CD2 LEU A 62 21.421 -16.279 21.363 1.00 72.10 C ATOM 0 H LEU A 62 19.522 -18.198 25.439 1.00 2.35 H new ATOM 0 HA LEU A 62 21.885 -16.829 25.372 1.00 31.45 H new ATOM 0 HB2 LEU A 62 20.142 -17.845 23.553 1.00 41.24 H new ATOM 0 HB3 LEU A 62 19.854 -16.135 23.303 1.00 41.24 H new ATOM 0 HG LEU A 62 22.526 -16.082 23.176 1.00 22.11 H new ATOM 0 HD11 LEU A 62 23.355 -18.075 21.988 1.00 15.05 H new ATOM 0 HD12 LEU A 62 22.804 -18.469 23.633 1.00 15.05 H new ATOM 0 HD13 LEU A 62 21.782 -18.870 22.233 1.00 15.05 H new ATOM 0 HD21 LEU A 62 22.305 -16.234 20.727 1.00 72.10 H new ATOM 0 HD22 LEU A 62 20.690 -16.956 20.922 1.00 72.10 H new ATOM 0 HD23 LEU A 62 20.986 -15.283 21.451 1.00 72.10 H new ATOM 1017 N ILE A 63 21.674 -14.394 25.726 1.00 22.52 N ATOM 1018 CA ILE A 63 21.573 -12.976 26.044 1.00 4.43 C ATOM 1019 C ILE A 63 22.079 -12.116 24.890 1.00 34.32 C ATOM 1020 O ILE A 63 22.999 -12.503 24.170 1.00 21.53 O ATOM 1021 CB ILE A 63 22.368 -12.626 27.316 1.00 4.11 C ATOM 1022 CG1 ILE A 63 22.037 -13.612 28.438 1.00 14.54 C ATOM 1023 CG2 ILE A 63 22.070 -11.199 27.752 1.00 43.04 C ATOM 1024 CD1 ILE A 63 22.949 -14.818 28.473 1.00 51.51 C ATOM 0 H ILE A 63 22.626 -14.759 25.725 1.00 22.52 H new ATOM 0 HA ILE A 63 20.517 -12.766 26.215 1.00 4.43 H new ATOM 0 HB ILE A 63 23.432 -12.702 27.093 1.00 4.11 H new ATOM 0 HG12 ILE A 63 22.097 -13.094 29.395 1.00 14.54 H new ATOM 0 HG13 ILE A 63 21.007 -13.949 28.322 1.00 14.54 H new ATOM 0 HG21 ILE A 63 22.639 -10.967 28.652 1.00 43.04 H new ATOM 0 HG22 ILE A 63 22.352 -10.509 26.957 1.00 43.04 H new ATOM 0 HG23 ILE A 63 21.005 -11.097 27.960 1.00 43.04 H new ATOM 0 HD11 ILE A 63 22.655 -15.473 29.293 1.00 51.51 H new ATOM 0 HD12 ILE A 63 22.872 -15.360 27.531 1.00 51.51 H new ATOM 0 HD13 ILE A 63 23.978 -14.492 28.620 1.00 51.51 H new ATOM 1036 N VAL A 64 21.471 -10.946 24.721 1.00 71.23 N ATOM 1037 CA VAL A 64 21.861 -10.030 23.656 1.00 53.41 C ATOM 1038 C VAL A 64 22.809 -8.955 24.176 1.00 62.24 C ATOM 1039 O VAL A 64 22.741 -8.562 25.339 1.00 24.55 O ATOM 1040 CB VAL A 64 20.632 -9.351 23.022 1.00 70.12 C ATOM 1041 CG1 VAL A 64 19.919 -8.476 24.042 1.00 44.25 C ATOM 1042 CG2 VAL A 64 21.042 -8.538 21.803 1.00 25.13 C ATOM 0 H VAL A 64 20.707 -10.610 25.308 1.00 71.23 H new ATOM 0 HA VAL A 64 22.371 -10.625 22.898 1.00 53.41 H new ATOM 0 HB VAL A 64 19.938 -10.126 22.696 1.00 70.12 H new ATOM 0 HG11 VAL A 64 19.054 -8.005 23.576 1.00 44.25 H new ATOM 0 HG12 VAL A 64 19.590 -9.089 24.881 1.00 44.25 H new ATOM 0 HG13 VAL A 64 20.602 -7.706 24.401 1.00 44.25 H new ATOM 0 HG21 VAL A 64 20.161 -8.065 21.368 1.00 25.13 H new ATOM 0 HG22 VAL A 64 21.756 -7.770 22.101 1.00 25.13 H new ATOM 0 HG23 VAL A 64 21.503 -9.195 21.066 1.00 25.13 H new ATOM 1052 N GLY A 65 23.694 -8.482 23.303 1.00 24.42 N ATOM 1053 CA GLY A 65 24.645 -7.457 23.692 1.00 14.13 C ATOM 1054 C GLY A 65 24.240 -6.078 23.209 1.00 62.31 C ATOM 1055 O GLY A 65 23.810 -5.237 23.999 1.00 63.53 O ATOM 0 H GLY A 65 23.769 -8.790 22.334 1.00 24.42 H new ATOM 0 HA2 GLY A 65 24.738 -7.445 24.778 1.00 14.13 H new ATOM 0 HA3 GLY A 65 25.627 -7.706 23.290 1.00 14.13 H new ATOM 1059 N ASP A 66 24.379 -5.845 21.909 1.00 42.14 N ATOM 1060 CA ASP A 66 24.026 -4.558 21.321 1.00 74.14 C ATOM 1061 C ASP A 66 23.564 -4.729 19.877 1.00 42.24 C ATOM 1062 O ASP A 66 23.773 -5.778 19.267 1.00 55.34 O ATOM 1063 CB ASP A 66 25.218 -3.602 21.378 1.00 21.05 C ATOM 1064 CG ASP A 66 25.077 -2.566 22.476 1.00 32.13 C ATOM 1065 OD1 ASP A 66 26.025 -2.415 23.275 1.00 71.33 O ATOM 1066 OD2 ASP A 66 24.018 -1.907 22.538 1.00 52.44 O ATOM 0 H ASP A 66 24.734 -6.530 21.242 1.00 42.14 H new ATOM 0 HA ASP A 66 23.204 -4.136 21.899 1.00 74.14 H new ATOM 0 HB2 ASP A 66 26.132 -4.174 21.538 1.00 21.05 H new ATOM 0 HB3 ASP A 66 25.322 -3.097 20.417 1.00 21.05 H new ATOM 1071 N LYS A 67 22.935 -3.691 19.335 1.00 22.13 N ATOM 1072 CA LYS A 67 22.444 -3.725 17.963 1.00 13.40 C ATOM 1073 C LYS A 67 23.597 -3.864 16.975 1.00 24.21 C ATOM 1074 O LYS A 67 24.644 -3.235 17.134 1.00 32.53 O ATOM 1075 CB LYS A 67 21.645 -2.456 17.655 1.00 72.24 C ATOM 1076 CG LYS A 67 21.065 -2.429 16.251 1.00 45.42 C ATOM 1077 CD LYS A 67 19.732 -3.154 16.184 1.00 52.44 C ATOM 1078 CE LYS A 67 18.881 -2.649 15.028 1.00 32.12 C ATOM 1079 NZ LYS A 67 18.020 -1.503 15.432 1.00 32.35 N ATOM 0 H LYS A 67 22.753 -2.816 19.826 1.00 22.13 H new ATOM 0 HA LYS A 67 21.793 -4.593 17.858 1.00 13.40 H new ATOM 0 HB2 LYS A 67 20.833 -2.364 18.376 1.00 72.24 H new ATOM 0 HB3 LYS A 67 22.291 -1.588 17.789 1.00 72.24 H new ATOM 0 HG2 LYS A 67 20.934 -1.395 15.930 1.00 45.42 H new ATOM 0 HG3 LYS A 67 21.767 -2.892 15.557 1.00 45.42 H new ATOM 0 HD2 LYS A 67 19.904 -4.224 16.070 1.00 52.44 H new ATOM 0 HD3 LYS A 67 19.194 -3.015 17.122 1.00 52.44 H new ATOM 0 HE2 LYS A 67 19.529 -2.344 14.206 1.00 32.12 H new ATOM 0 HE3 LYS A 67 18.255 -3.460 14.656 1.00 32.12 H new ATOM 0 HZ1 LYS A 67 17.456 -1.188 14.617 1.00 32.35 H new ATOM 0 HZ2 LYS A 67 17.384 -1.800 16.199 1.00 32.35 H new ATOM 0 HZ3 LYS A 67 18.618 -0.719 15.763 1.00 32.35 H new ATOM 1093 N VAL A 68 23.399 -4.691 15.953 1.00 20.25 N ATOM 1094 CA VAL A 68 24.422 -4.911 14.938 1.00 31.11 C ATOM 1095 C VAL A 68 24.262 -3.937 13.777 1.00 52.44 C ATOM 1096 O VAL A 68 25.146 -3.121 13.511 1.00 75.40 O ATOM 1097 CB VAL A 68 24.374 -6.352 14.395 1.00 13.25 C ATOM 1098 CG1 VAL A 68 25.448 -6.561 13.339 1.00 22.14 C ATOM 1099 CG2 VAL A 68 24.527 -7.353 15.530 1.00 23.41 C ATOM 0 H VAL A 68 22.539 -5.220 15.806 1.00 20.25 H new ATOM 0 HA VAL A 68 25.386 -4.744 15.419 1.00 31.11 H new ATOM 0 HB VAL A 68 23.403 -6.514 13.927 1.00 13.25 H new ATOM 0 HG11 VAL A 68 25.399 -7.584 12.967 1.00 22.14 H new ATOM 0 HG12 VAL A 68 25.287 -5.867 12.514 1.00 22.14 H new ATOM 0 HG13 VAL A 68 26.430 -6.381 13.778 1.00 22.14 H new ATOM 0 HG21 VAL A 68 24.491 -8.366 15.129 1.00 23.41 H new ATOM 0 HG22 VAL A 68 25.483 -7.194 16.029 1.00 23.41 H new ATOM 0 HG23 VAL A 68 23.717 -7.217 16.247 1.00 23.41 H new ATOM 1109 N ILE A 69 23.129 -4.026 13.088 1.00 31.42 N ATOM 1110 CA ILE A 69 22.852 -3.151 11.956 1.00 62.32 C ATOM 1111 C ILE A 69 21.448 -3.387 11.409 1.00 2.44 C ATOM 1112 O ILE A 69 20.842 -4.431 11.651 1.00 10.15 O ATOM 1113 CB ILE A 69 23.874 -3.358 10.822 1.00 74.12 C ATOM 1114 CG1 ILE A 69 23.875 -2.151 9.881 1.00 61.50 C ATOM 1115 CG2 ILE A 69 23.562 -4.634 10.055 1.00 61.43 C ATOM 1116 CD1 ILE A 69 25.262 -1.703 9.476 1.00 13.42 C ATOM 0 H ILE A 69 22.388 -4.696 13.294 1.00 31.42 H new ATOM 0 HA ILE A 69 22.929 -2.127 12.322 1.00 62.32 H new ATOM 0 HB ILE A 69 24.867 -3.454 11.260 1.00 74.12 H new ATOM 0 HG12 ILE A 69 23.306 -2.398 8.985 1.00 61.50 H new ATOM 0 HG13 ILE A 69 23.361 -1.321 10.366 1.00 61.50 H new ATOM 0 HG21 ILE A 69 24.293 -4.767 9.257 1.00 61.43 H new ATOM 0 HG22 ILE A 69 23.606 -5.486 10.733 1.00 61.43 H new ATOM 0 HG23 ILE A 69 22.563 -4.565 9.624 1.00 61.43 H new ATOM 0 HD11 ILE A 69 25.187 -0.844 8.809 1.00 13.42 H new ATOM 0 HD12 ILE A 69 25.828 -1.424 10.365 1.00 13.42 H new ATOM 0 HD13 ILE A 69 25.772 -2.518 8.962 1.00 13.42 H new ATOM 1128 N THR A 70 20.936 -2.409 10.668 1.00 12.25 N ATOM 1129 CA THR A 70 19.603 -2.509 10.086 1.00 4.14 C ATOM 1130 C THR A 70 19.673 -2.598 8.566 1.00 31.22 C ATOM 1131 O THR A 70 19.725 -1.580 7.875 1.00 20.03 O ATOM 1132 CB THR A 70 18.727 -1.305 10.479 1.00 11.30 C ATOM 1133 OG1 THR A 70 18.626 -1.217 11.905 1.00 54.43 O ATOM 1134 CG2 THR A 70 17.337 -1.427 9.873 1.00 12.24 C ATOM 0 H THR A 70 21.424 -1.539 10.457 1.00 12.25 H new ATOM 0 HA THR A 70 19.153 -3.420 10.480 1.00 4.14 H new ATOM 0 HB THR A 70 19.196 -0.400 10.092 1.00 11.30 H new ATOM 0 HG1 THR A 70 18.069 -0.448 12.147 1.00 54.43 H new ATOM 0 HG21 THR A 70 16.736 -0.565 10.164 1.00 12.24 H new ATOM 0 HG22 THR A 70 17.416 -1.464 8.786 1.00 12.24 H new ATOM 0 HG23 THR A 70 16.862 -2.339 10.233 1.00 12.24 H new ATOM 1142 N THR A 71 19.673 -3.823 8.049 1.00 34.02 N ATOM 1143 CA THR A 71 19.736 -4.045 6.610 1.00 21.22 C ATOM 1144 C THR A 71 18.340 -4.156 6.009 1.00 73.31 C ATOM 1145 O THR A 71 17.424 -4.684 6.639 1.00 54.43 O ATOM 1146 CB THR A 71 20.531 -5.321 6.273 1.00 33.13 C ATOM 1147 OG1 THR A 71 21.434 -5.632 7.340 1.00 10.31 O ATOM 1148 CG2 THR A 71 21.309 -5.148 4.978 1.00 54.35 C ATOM 0 H THR A 71 19.630 -4.676 8.606 1.00 34.02 H new ATOM 0 HA THR A 71 20.246 -3.183 6.179 1.00 21.22 H new ATOM 0 HB THR A 71 19.823 -6.140 6.146 1.00 33.13 H new ATOM 0 HG1 THR A 71 21.801 -6.531 7.206 1.00 10.31 H new ATOM 0 HG21 THR A 71 21.862 -6.062 4.761 1.00 54.35 H new ATOM 0 HG22 THR A 71 20.616 -4.941 4.162 1.00 54.35 H new ATOM 0 HG23 THR A 71 22.007 -4.317 5.081 1.00 54.35 H new ATOM 1156 N GLU A 72 18.185 -3.657 4.787 1.00 41.43 N ATOM 1157 CA GLU A 72 16.899 -3.700 4.101 1.00 32.53 C ATOM 1158 C GLU A 72 17.089 -3.904 2.601 1.00 75.11 C ATOM 1159 O GLU A 72 18.069 -3.438 2.019 1.00 73.42 O ATOM 1160 CB GLU A 72 16.115 -2.411 4.357 1.00 23.31 C ATOM 1161 CG GLU A 72 15.549 -2.312 5.764 1.00 42.04 C ATOM 1162 CD GLU A 72 15.224 -0.886 6.162 1.00 13.41 C ATOM 1163 OE1 GLU A 72 14.359 -0.268 5.506 1.00 33.43 O ATOM 1164 OE2 GLU A 72 15.834 -0.387 7.131 1.00 45.24 O ATOM 0 H GLU A 72 18.934 -3.218 4.252 1.00 41.43 H new ATOM 0 HA GLU A 72 16.334 -4.544 4.496 1.00 32.53 H new ATOM 0 HB2 GLU A 72 16.767 -1.557 4.176 1.00 23.31 H new ATOM 0 HB3 GLU A 72 15.297 -2.345 3.640 1.00 23.31 H new ATOM 0 HG2 GLU A 72 14.646 -2.919 5.832 1.00 42.04 H new ATOM 0 HG3 GLU A 72 16.267 -2.728 6.471 1.00 42.04 H new ATOM 1171 N HIS A 73 16.144 -4.604 1.981 1.00 52.14 N ATOM 1172 CA HIS A 73 16.206 -4.870 0.548 1.00 50.12 C ATOM 1173 C HIS A 73 14.825 -4.747 -0.088 1.00 54.11 C ATOM 1174 O HIS A 73 13.887 -5.439 0.306 1.00 74.25 O ATOM 1175 CB HIS A 73 16.776 -6.265 0.291 1.00 30.30 C ATOM 1176 CG HIS A 73 17.971 -6.589 1.134 1.00 13.33 C ATOM 1177 ND1 HIS A 73 19.267 -6.386 0.711 1.00 25.33 N ATOM 1178 CD2 HIS A 73 18.060 -7.102 2.384 1.00 52.43 C ATOM 1179 CE1 HIS A 73 20.103 -6.762 1.663 1.00 34.44 C ATOM 1180 NE2 HIS A 73 19.395 -7.200 2.689 1.00 0.03 N ATOM 0 H HIS A 73 15.327 -4.997 2.448 1.00 52.14 H new ATOM 0 HA HIS A 73 16.863 -4.128 0.094 1.00 50.12 H new ATOM 0 HB2 HIS A 73 15.999 -7.006 0.477 1.00 30.30 H new ATOM 0 HB3 HIS A 73 17.050 -6.348 -0.761 1.00 30.30 H new ATOM 0 HD1 HIS A 73 19.539 -6.005 -0.195 1.00 25.33 H new ATOM 0 HD2 HIS A 73 17.235 -7.382 3.022 1.00 52.43 H new ATOM 0 HE1 HIS A 73 21.181 -6.719 1.611 1.00 34.44 H new ATOM 1188 N GLU A 74 14.708 -3.861 -1.072 1.00 41.33 N ATOM 1189 CA GLU A 74 13.441 -3.647 -1.761 1.00 15.24 C ATOM 1190 C GLU A 74 13.106 -4.830 -2.665 1.00 11.33 C ATOM 1191 O GLU A 74 13.942 -5.284 -3.446 1.00 2.11 O ATOM 1192 CB GLU A 74 13.494 -2.359 -2.586 1.00 33.24 C ATOM 1193 CG GLU A 74 14.285 -2.495 -3.876 1.00 34.32 C ATOM 1194 CD GLU A 74 14.367 -1.194 -4.649 1.00 44.24 C ATOM 1195 OE1 GLU A 74 15.497 -0.718 -4.890 1.00 71.43 O ATOM 1196 OE2 GLU A 74 13.304 -0.651 -5.013 1.00 54.45 O ATOM 0 H GLU A 74 15.475 -3.280 -1.410 1.00 41.33 H new ATOM 0 HA GLU A 74 12.659 -3.555 -1.008 1.00 15.24 H new ATOM 0 HB2 GLU A 74 12.477 -2.048 -2.824 1.00 33.24 H new ATOM 0 HB3 GLU A 74 13.936 -1.568 -1.981 1.00 33.24 H new ATOM 0 HG2 GLU A 74 15.293 -2.840 -3.645 1.00 34.32 H new ATOM 0 HG3 GLU A 74 13.822 -3.257 -4.503 1.00 34.32 H new ATOM 1203 N TYR A 75 11.878 -5.324 -2.552 1.00 1.10 N ATOM 1204 CA TYR A 75 11.433 -6.456 -3.356 1.00 50.42 C ATOM 1205 C TYR A 75 10.220 -6.080 -4.201 1.00 55.21 C ATOM 1206 O TYR A 75 9.702 -4.967 -4.104 1.00 44.35 O ATOM 1207 CB TYR A 75 11.093 -7.645 -2.457 1.00 23.23 C ATOM 1208 CG TYR A 75 12.184 -8.691 -2.398 1.00 0.32 C ATOM 1209 CD1 TYR A 75 12.245 -9.714 -3.336 1.00 52.51 C ATOM 1210 CD2 TYR A 75 13.155 -8.655 -1.404 1.00 54.11 C ATOM 1211 CE1 TYR A 75 13.239 -10.671 -3.286 1.00 21.25 C ATOM 1212 CE2 TYR A 75 14.154 -9.608 -1.347 1.00 14.54 C ATOM 1213 CZ TYR A 75 14.191 -10.614 -2.289 1.00 42.22 C ATOM 1214 OH TYR A 75 15.184 -11.565 -2.236 1.00 61.12 O ATOM 0 H TYR A 75 11.173 -4.958 -1.912 1.00 1.10 H new ATOM 0 HA TYR A 75 12.247 -6.736 -4.025 1.00 50.42 H new ATOM 0 HB2 TYR A 75 10.894 -7.282 -1.449 1.00 23.23 H new ATOM 0 HB3 TYR A 75 10.175 -8.110 -2.815 1.00 23.23 H new ATOM 0 HD1 TYR A 75 11.502 -9.762 -4.118 1.00 52.51 H new ATOM 0 HD2 TYR A 75 13.128 -7.869 -0.664 1.00 54.11 H new ATOM 0 HE1 TYR A 75 13.271 -11.460 -4.023 1.00 21.25 H new ATOM 0 HE2 TYR A 75 14.902 -9.565 -0.569 1.00 14.54 H new ATOM 0 HH TYR A 75 15.773 -11.380 -1.475 1.00 61.12 H new ATOM 1224 N ASP A 76 9.770 -7.017 -5.029 1.00 3.32 N ATOM 1225 CA ASP A 76 8.616 -6.786 -5.890 1.00 65.44 C ATOM 1226 C ASP A 76 7.316 -7.069 -5.145 1.00 22.54 C ATOM 1227 O ASP A 76 6.251 -6.585 -5.527 1.00 11.43 O ATOM 1228 CB ASP A 76 8.703 -7.664 -7.140 1.00 43.53 C ATOM 1229 CG ASP A 76 9.355 -6.947 -8.306 1.00 44.14 C ATOM 1230 OD1 ASP A 76 10.523 -7.261 -8.617 1.00 42.21 O ATOM 1231 OD2 ASP A 76 8.698 -6.071 -8.908 1.00 21.43 O ATOM 0 H ASP A 76 10.187 -7.943 -5.122 1.00 3.32 H new ATOM 0 HA ASP A 76 8.621 -5.738 -6.189 1.00 65.44 H new ATOM 0 HB2 ASP A 76 9.270 -8.566 -6.909 1.00 43.53 H new ATOM 0 HB3 ASP A 76 7.701 -7.983 -7.427 1.00 43.53 H new ATOM 1236 N PHE A 77 7.411 -7.858 -4.079 1.00 73.33 N ATOM 1237 CA PHE A 77 6.242 -8.208 -3.281 1.00 13.02 C ATOM 1238 C PHE A 77 6.364 -7.653 -1.865 1.00 4.32 C ATOM 1239 O PHE A 77 5.911 -8.271 -0.902 1.00 44.14 O ATOM 1240 CB PHE A 77 6.067 -9.727 -3.232 1.00 22.33 C ATOM 1241 CG PHE A 77 5.893 -10.355 -4.585 1.00 51.31 C ATOM 1242 CD1 PHE A 77 6.784 -11.314 -5.039 1.00 11.13 C ATOM 1243 CD2 PHE A 77 4.838 -9.985 -5.404 1.00 42.11 C ATOM 1244 CE1 PHE A 77 6.626 -11.894 -6.284 1.00 3.45 C ATOM 1245 CE2 PHE A 77 4.675 -10.561 -6.650 1.00 22.44 C ATOM 1246 CZ PHE A 77 5.571 -11.516 -7.090 1.00 51.14 C ATOM 0 H PHE A 77 8.285 -8.267 -3.748 1.00 73.33 H new ATOM 0 HA PHE A 77 5.366 -7.764 -3.752 1.00 13.02 H new ATOM 0 HB2 PHE A 77 6.936 -10.169 -2.744 1.00 22.33 H new ATOM 0 HB3 PHE A 77 5.200 -9.965 -2.616 1.00 22.33 H new ATOM 0 HD1 PHE A 77 7.612 -11.612 -4.413 1.00 11.13 H new ATOM 0 HD2 PHE A 77 4.135 -9.238 -5.065 1.00 42.11 H new ATOM 0 HE1 PHE A 77 7.327 -12.642 -6.625 1.00 3.45 H new ATOM 0 HE2 PHE A 77 3.848 -10.265 -7.279 1.00 22.44 H new ATOM 0 HZ PHE A 77 5.446 -11.966 -8.064 1.00 51.14 H new ATOM 1256 N GLY A 78 6.982 -6.481 -1.746 1.00 54.02 N ATOM 1257 CA GLY A 78 7.154 -5.862 -0.445 1.00 41.32 C ATOM 1258 C GLY A 78 8.607 -5.805 -0.018 1.00 44.12 C ATOM 1259 O GLY A 78 9.339 -6.787 -0.151 1.00 12.42 O ATOM 0 H GLY A 78 7.366 -5.950 -2.527 1.00 54.02 H new ATOM 0 HA2 GLY A 78 6.746 -4.852 -0.470 1.00 41.32 H new ATOM 0 HA3 GLY A 78 6.582 -6.419 0.297 1.00 41.32 H new ATOM 1263 N ILE A 79 9.027 -4.653 0.494 1.00 63.01 N ATOM 1264 CA ILE A 79 10.403 -4.473 0.941 1.00 50.43 C ATOM 1265 C ILE A 79 10.719 -5.378 2.127 1.00 51.43 C ATOM 1266 O ILE A 79 9.839 -5.706 2.922 1.00 31.53 O ATOM 1267 CB ILE A 79 10.679 -3.010 1.337 1.00 32.25 C ATOM 1268 CG1 ILE A 79 10.025 -2.055 0.337 1.00 70.44 C ATOM 1269 CG2 ILE A 79 12.177 -2.757 1.419 1.00 72.05 C ATOM 1270 CD1 ILE A 79 10.094 -2.540 -1.095 1.00 35.44 C ATOM 0 H ILE A 79 8.435 -3.831 0.610 1.00 63.01 H new ATOM 0 HA ILE A 79 11.045 -4.741 0.102 1.00 50.43 H new ATOM 0 HB ILE A 79 10.245 -2.828 2.320 1.00 32.25 H new ATOM 0 HG12 ILE A 79 8.981 -1.911 0.614 1.00 70.44 H new ATOM 0 HG13 ILE A 79 10.510 -1.081 0.406 1.00 70.44 H new ATOM 0 HG21 ILE A 79 12.356 -1.719 1.700 1.00 72.05 H new ATOM 0 HG22 ILE A 79 12.617 -3.416 2.167 1.00 72.05 H new ATOM 0 HG23 ILE A 79 12.633 -2.954 0.449 1.00 72.05 H new ATOM 0 HD11 ILE A 79 9.611 -1.814 -1.749 1.00 35.44 H new ATOM 0 HD12 ILE A 79 11.137 -2.657 -1.390 1.00 35.44 H new ATOM 0 HD13 ILE A 79 9.584 -3.500 -1.179 1.00 35.44 H new ATOM 1282 N VAL A 80 11.982 -5.776 2.240 1.00 30.11 N ATOM 1283 CA VAL A 80 12.416 -6.641 3.331 1.00 52.12 C ATOM 1284 C VAL A 80 13.362 -5.905 4.273 1.00 42.15 C ATOM 1285 O VAL A 80 14.216 -5.134 3.833 1.00 13.15 O ATOM 1286 CB VAL A 80 13.118 -7.905 2.800 1.00 52.23 C ATOM 1287 CG1 VAL A 80 13.432 -8.861 3.941 1.00 54.25 C ATOM 1288 CG2 VAL A 80 12.261 -8.586 1.743 1.00 11.52 C ATOM 0 H VAL A 80 12.723 -5.513 1.590 1.00 30.11 H new ATOM 0 HA VAL A 80 11.520 -6.935 3.878 1.00 52.12 H new ATOM 0 HB VAL A 80 14.059 -7.609 2.337 1.00 52.23 H new ATOM 0 HG11 VAL A 80 13.928 -9.748 3.547 1.00 54.25 H new ATOM 0 HG12 VAL A 80 14.088 -8.368 4.659 1.00 54.25 H new ATOM 0 HG13 VAL A 80 12.506 -9.153 4.436 1.00 54.25 H new ATOM 0 HG21 VAL A 80 12.772 -9.477 1.379 1.00 11.52 H new ATOM 0 HG22 VAL A 80 11.303 -8.870 2.179 1.00 11.52 H new ATOM 0 HG23 VAL A 80 12.093 -7.900 0.913 1.00 11.52 H new ATOM 1298 N ARG A 81 13.205 -6.148 5.570 1.00 64.44 N ATOM 1299 CA ARG A 81 14.046 -5.508 6.574 1.00 33.12 C ATOM 1300 C ARG A 81 14.618 -6.540 7.542 1.00 42.22 C ATOM 1301 O ARG A 81 13.917 -7.034 8.426 1.00 41.21 O ATOM 1302 CB ARG A 81 13.244 -4.459 7.346 1.00 3.45 C ATOM 1303 CG ARG A 81 12.207 -3.739 6.499 1.00 24.23 C ATOM 1304 CD ARG A 81 11.549 -2.604 7.269 1.00 65.54 C ATOM 1305 NE ARG A 81 12.177 -1.316 6.987 1.00 23.22 N ATOM 1306 CZ ARG A 81 11.939 -0.214 7.689 1.00 40.21 C ATOM 1307 NH1 ARG A 81 11.092 -0.243 8.708 1.00 12.13 N ATOM 1308 NH2 ARG A 81 12.549 0.921 7.372 1.00 63.14 N ATOM 0 H ARG A 81 12.503 -6.783 5.950 1.00 64.44 H new ATOM 0 HA ARG A 81 14.874 -5.019 6.061 1.00 33.12 H new ATOM 0 HB2 ARG A 81 12.743 -4.942 8.185 1.00 3.45 H new ATOM 0 HB3 ARG A 81 13.932 -3.724 7.765 1.00 3.45 H new ATOM 0 HG2 ARG A 81 12.681 -3.344 5.600 1.00 24.23 H new ATOM 0 HG3 ARG A 81 11.446 -4.448 6.173 1.00 24.23 H new ATOM 0 HD2 ARG A 81 10.491 -2.556 7.011 1.00 65.54 H new ATOM 0 HD3 ARG A 81 11.607 -2.809 8.338 1.00 65.54 H new ATOM 0 HE ARG A 81 12.834 -1.260 6.209 1.00 23.22 H new ATOM 0 HH11 ARG A 81 10.621 -1.113 8.955 1.00 12.13 H new ATOM 0 HH12 ARG A 81 10.911 0.605 9.245 1.00 12.13 H new ATOM 0 HH21 ARG A 81 13.201 0.948 6.588 1.00 63.14 H new ATOM 0 HH22 ARG A 81 12.365 1.767 7.912 1.00 63.14 H new ATOM 1322 N LEU A 82 15.895 -6.861 7.368 1.00 24.12 N ATOM 1323 CA LEU A 82 16.563 -7.835 8.225 1.00 11.45 C ATOM 1324 C LEU A 82 17.576 -7.152 9.139 1.00 50.23 C ATOM 1325 O LEU A 82 18.314 -6.263 8.712 1.00 54.23 O ATOM 1326 CB LEU A 82 17.261 -8.898 7.376 1.00 74.22 C ATOM 1327 CG LEU A 82 17.953 -10.024 8.145 1.00 2.30 C ATOM 1328 CD1 LEU A 82 17.042 -10.564 9.236 1.00 2.45 C ATOM 1329 CD2 LEU A 82 18.372 -11.138 7.197 1.00 32.33 C ATOM 0 H LEU A 82 16.489 -6.461 6.641 1.00 24.12 H new ATOM 0 HA LEU A 82 15.806 -8.315 8.846 1.00 11.45 H new ATOM 0 HB2 LEU A 82 16.524 -9.342 6.707 1.00 74.22 H new ATOM 0 HB3 LEU A 82 18.003 -8.404 6.749 1.00 74.22 H new ATOM 0 HG LEU A 82 18.849 -9.619 8.616 1.00 2.30 H new ATOM 0 HD11 LEU A 82 17.552 -11.364 9.772 1.00 2.45 H new ATOM 0 HD12 LEU A 82 16.793 -9.763 9.931 1.00 2.45 H new ATOM 0 HD13 LEU A 82 16.128 -10.953 8.787 1.00 2.45 H new ATOM 0 HD21 LEU A 82 18.863 -11.931 7.762 1.00 32.33 H new ATOM 0 HD22 LEU A 82 17.491 -11.541 6.697 1.00 32.33 H new ATOM 0 HD23 LEU A 82 19.063 -10.742 6.453 1.00 32.33 H new ATOM 1341 N THR A 83 17.609 -7.575 10.399 1.00 54.42 N ATOM 1342 CA THR A 83 18.532 -7.005 11.372 1.00 34.23 C ATOM 1343 C THR A 83 19.219 -8.098 12.183 1.00 32.10 C ATOM 1344 O THR A 83 18.714 -9.216 12.291 1.00 23.41 O ATOM 1345 CB THR A 83 17.810 -6.044 12.336 1.00 73.23 C ATOM 1346 OG1 THR A 83 18.769 -5.275 13.070 1.00 34.35 O ATOM 1347 CG2 THR A 83 16.921 -6.813 13.302 1.00 51.02 C ATOM 0 H THR A 83 17.007 -8.310 10.769 1.00 54.42 H new ATOM 0 HA THR A 83 19.281 -6.448 10.809 1.00 34.23 H new ATOM 0 HB THR A 83 17.184 -5.375 11.746 1.00 73.23 H new ATOM 0 HG1 THR A 83 19.402 -4.861 12.447 1.00 34.35 H new ATOM 0 HG21 THR A 83 16.422 -6.113 13.973 1.00 51.02 H new ATOM 0 HG22 THR A 83 16.174 -7.374 12.741 1.00 51.02 H new ATOM 0 HG23 THR A 83 17.530 -7.503 13.886 1.00 51.02 H new ATOM 1355 N THR A 84 20.374 -7.768 12.753 1.00 33.31 N ATOM 1356 CA THR A 84 21.131 -8.722 13.554 1.00 14.00 C ATOM 1357 C THR A 84 21.356 -8.196 14.967 1.00 23.40 C ATOM 1358 O THR A 84 21.229 -6.999 15.222 1.00 13.30 O ATOM 1359 CB THR A 84 22.495 -9.037 12.912 1.00 73.22 C ATOM 1360 OG1 THR A 84 22.953 -7.910 12.156 1.00 33.24 O ATOM 1361 CG2 THR A 84 22.398 -10.256 12.006 1.00 12.41 C ATOM 0 H THR A 84 20.805 -6.847 12.675 1.00 33.31 H new ATOM 0 HA THR A 84 20.540 -9.637 13.599 1.00 14.00 H new ATOM 0 HB THR A 84 23.206 -9.252 13.710 1.00 73.22 H new ATOM 0 HG1 THR A 84 22.504 -7.896 11.285 1.00 33.24 H new ATOM 0 HG21 THR A 84 23.373 -10.459 11.564 1.00 12.41 H new ATOM 0 HG22 THR A 84 22.077 -11.119 12.590 1.00 12.41 H new ATOM 0 HG23 THR A 84 21.674 -10.064 11.214 1.00 12.41 H new ATOM 1369 N TYR A 85 21.693 -9.099 15.882 1.00 53.31 N ATOM 1370 CA TYR A 85 21.935 -8.726 17.271 1.00 54.45 C ATOM 1371 C TYR A 85 23.023 -9.598 17.887 1.00 25.33 C ATOM 1372 O TYR A 85 22.976 -10.826 17.800 1.00 3.55 O ATOM 1373 CB TYR A 85 20.646 -8.847 18.085 1.00 33.12 C ATOM 1374 CG TYR A 85 19.780 -7.608 18.037 1.00 30.41 C ATOM 1375 CD1 TYR A 85 18.649 -7.559 17.232 1.00 54.32 C ATOM 1376 CD2 TYR A 85 20.094 -6.488 18.796 1.00 54.53 C ATOM 1377 CE1 TYR A 85 17.855 -6.429 17.184 1.00 51.00 C ATOM 1378 CE2 TYR A 85 19.305 -5.354 18.755 1.00 30.13 C ATOM 1379 CZ TYR A 85 18.187 -5.330 17.948 1.00 50.42 C ATOM 1380 OH TYR A 85 17.400 -4.202 17.904 1.00 54.13 O ATOM 0 H TYR A 85 21.805 -10.094 15.687 1.00 53.31 H new ATOM 0 HA TYR A 85 22.272 -7.690 17.289 1.00 54.45 H new ATOM 0 HB2 TYR A 85 20.071 -9.696 17.715 1.00 33.12 H new ATOM 0 HB3 TYR A 85 20.901 -9.062 19.123 1.00 33.12 H new ATOM 0 HD1 TYR A 85 18.386 -8.419 16.634 1.00 54.32 H new ATOM 0 HD2 TYR A 85 20.969 -6.503 19.429 1.00 54.53 H new ATOM 0 HE1 TYR A 85 16.980 -6.407 16.552 1.00 51.00 H new ATOM 0 HE2 TYR A 85 19.563 -4.491 19.352 1.00 30.13 H new ATOM 0 HH TYR A 85 16.964 -4.141 17.028 1.00 54.13 H new ATOM 1390 N LYS A 86 24.005 -8.956 18.512 1.00 55.43 N ATOM 1391 CA LYS A 86 25.106 -9.670 19.146 1.00 31.20 C ATOM 1392 C LYS A 86 24.593 -10.598 20.242 1.00 34.33 C ATOM 1393 O LYS A 86 23.811 -10.187 21.101 1.00 23.41 O ATOM 1394 CB LYS A 86 26.113 -8.679 19.733 1.00 45.13 C ATOM 1395 CG LYS A 86 27.514 -8.827 19.164 1.00 22.44 C ATOM 1396 CD LYS A 86 27.729 -7.918 17.966 1.00 21.12 C ATOM 1397 CE LYS A 86 29.093 -8.145 17.332 1.00 52.11 C ATOM 1398 NZ LYS A 86 30.133 -7.258 17.922 1.00 44.12 N ATOM 0 H LYS A 86 24.060 -7.941 18.593 1.00 55.43 H new ATOM 0 HA LYS A 86 25.601 -10.273 18.385 1.00 31.20 H new ATOM 0 HB2 LYS A 86 25.761 -7.664 19.549 1.00 45.13 H new ATOM 0 HB3 LYS A 86 26.153 -8.812 20.814 1.00 45.13 H new ATOM 0 HG2 LYS A 86 28.247 -8.593 19.936 1.00 22.44 H new ATOM 0 HG3 LYS A 86 27.680 -9.863 18.870 1.00 22.44 H new ATOM 0 HD2 LYS A 86 26.948 -8.098 17.227 1.00 21.12 H new ATOM 0 HD3 LYS A 86 27.640 -6.877 18.277 1.00 21.12 H new ATOM 0 HE2 LYS A 86 29.386 -9.186 17.464 1.00 52.11 H new ATOM 0 HE3 LYS A 86 29.029 -7.966 16.259 1.00 52.11 H new ATOM 0 HZ1 LYS A 86 30.597 -6.717 17.165 1.00 44.12 H new ATOM 0 HZ2 LYS A 86 29.688 -6.601 18.595 1.00 44.12 H new ATOM 0 HZ3 LYS A 86 30.841 -7.836 18.419 1.00 44.12 H new ATOM 1412 N CYS A 87 25.037 -11.850 20.208 1.00 42.53 N ATOM 1413 CA CYS A 87 24.623 -12.836 21.199 1.00 0.23 C ATOM 1414 C CYS A 87 25.832 -13.421 21.922 1.00 11.34 C ATOM 1415 O CYS A 87 26.854 -13.720 21.305 1.00 44.04 O ATOM 1416 CB CYS A 87 23.822 -13.955 20.532 1.00 11.13 C ATOM 1417 SG CYS A 87 22.449 -13.372 19.510 1.00 11.34 S ATOM 0 H CYS A 87 25.684 -12.206 19.504 1.00 42.53 H new ATOM 0 HA CYS A 87 23.991 -12.335 21.932 1.00 0.23 H new ATOM 0 HB2 CYS A 87 24.494 -14.549 19.913 1.00 11.13 H new ATOM 0 HB3 CYS A 87 23.430 -14.617 21.304 1.00 11.13 H new ATOM 0 HG CYS A 87 22.814 -12.307 18.859 1.00 11.34 H new ATOM 1423 N THR A 88 25.709 -13.580 23.237 1.00 41.04 N ATOM 1424 CA THR A 88 26.792 -14.126 24.045 1.00 71.02 C ATOM 1425 C THR A 88 26.609 -15.623 24.270 1.00 44.42 C ATOM 1426 O THR A 88 25.484 -16.114 24.366 1.00 52.32 O ATOM 1427 CB THR A 88 26.884 -13.421 25.411 1.00 0.50 C ATOM 1428 OG1 THR A 88 26.902 -12.000 25.229 1.00 61.32 O ATOM 1429 CG2 THR A 88 28.133 -13.856 26.162 1.00 21.50 C ATOM 0 H THR A 88 24.870 -13.338 23.764 1.00 41.04 H new ATOM 0 HA THR A 88 27.716 -13.954 23.493 1.00 71.02 H new ATOM 0 HB THR A 88 26.010 -13.701 25.999 1.00 0.50 H new ATOM 0 HG1 THR A 88 26.959 -11.559 26.102 1.00 61.32 H new ATOM 0 HG21 THR A 88 28.176 -13.345 27.124 1.00 21.50 H new ATOM 0 HG22 THR A 88 28.103 -14.933 26.325 1.00 21.50 H new ATOM 0 HG23 THR A 88 29.017 -13.602 25.576 1.00 21.50 H new ATOM 1437 N LEU A 89 27.722 -16.343 24.354 1.00 60.43 N ATOM 1438 CA LEU A 89 27.685 -17.786 24.569 1.00 52.14 C ATOM 1439 C LEU A 89 27.220 -18.114 25.984 1.00 2.30 C ATOM 1440 O LEU A 89 27.935 -17.868 26.955 1.00 72.32 O ATOM 1441 CB LEU A 89 29.066 -18.394 24.319 1.00 31.41 C ATOM 1442 CG LEU A 89 29.269 -19.826 24.817 1.00 14.33 C ATOM 1443 CD1 LEU A 89 28.381 -20.790 24.046 1.00 32.13 C ATOM 1444 CD2 LEU A 89 30.731 -20.231 24.696 1.00 55.41 C ATOM 0 H LEU A 89 28.661 -15.952 24.277 1.00 60.43 H new ATOM 0 HA LEU A 89 26.973 -18.216 23.864 1.00 52.14 H new ATOM 0 HB2 LEU A 89 29.262 -18.372 23.247 1.00 31.41 H new ATOM 0 HB3 LEU A 89 29.813 -17.757 24.793 1.00 31.41 H new ATOM 0 HG LEU A 89 28.988 -19.868 25.869 1.00 14.33 H new ATOM 0 HD11 LEU A 89 28.539 -21.804 24.414 1.00 32.13 H new ATOM 0 HD12 LEU A 89 27.336 -20.512 24.185 1.00 32.13 H new ATOM 0 HD13 LEU A 89 28.630 -20.746 22.986 1.00 32.13 H new ATOM 0 HD21 LEU A 89 30.856 -21.253 25.055 1.00 55.41 H new ATOM 0 HD22 LEU A 89 31.040 -20.173 23.652 1.00 55.41 H new ATOM 0 HD23 LEU A 89 31.346 -19.558 25.294 1.00 55.41 H new ATOM 1456 N ASN A 90 26.019 -18.672 26.093 1.00 51.14 N ATOM 1457 CA ASN A 90 25.459 -19.035 27.389 1.00 24.34 C ATOM 1458 C ASN A 90 25.824 -20.471 27.756 1.00 12.21 C ATOM 1459 O ASN A 90 26.561 -21.140 27.032 1.00 21.43 O ATOM 1460 CB ASN A 90 23.938 -18.871 27.376 1.00 2.01 C ATOM 1461 CG ASN A 90 23.253 -19.902 26.500 1.00 30.03 C ATOM 1462 OD1 ASN A 90 23.515 -19.986 25.300 1.00 20.23 O ATOM 1463 ND2 ASN A 90 22.369 -20.693 27.098 1.00 4.33 N ATOM 0 H ASN A 90 25.415 -18.883 25.299 1.00 51.14 H new ATOM 0 HA ASN A 90 25.883 -18.367 28.139 1.00 24.34 H new ATOM 0 HB2 ASN A 90 23.558 -18.953 28.394 1.00 2.01 H new ATOM 0 HB3 ASN A 90 23.686 -17.872 27.021 1.00 2.01 H new ATOM 0 HD21 ASN A 90 21.876 -21.406 26.560 1.00 4.33 H new ATOM 0 HD22 ASN A 90 22.183 -20.588 28.095 1.00 4.33 H new ATOM 1470 N LYS A 91 25.302 -20.938 28.885 1.00 14.10 N ATOM 1471 CA LYS A 91 25.569 -22.294 29.349 1.00 61.24 C ATOM 1472 C LYS A 91 25.249 -23.314 28.260 1.00 24.13 C ATOM 1473 O LYS A 91 26.122 -24.066 27.827 1.00 33.11 O ATOM 1474 CB LYS A 91 24.748 -22.598 30.604 1.00 53.53 C ATOM 1475 CG LYS A 91 25.275 -21.917 31.855 1.00 41.11 C ATOM 1476 CD LYS A 91 26.503 -22.627 32.400 1.00 11.45 C ATOM 1477 CE LYS A 91 26.719 -22.315 33.873 1.00 13.44 C ATOM 1478 NZ LYS A 91 26.951 -20.862 34.104 1.00 13.24 N ATOM 0 H LYS A 91 24.691 -20.396 29.496 1.00 14.10 H new ATOM 0 HA LYS A 91 26.629 -22.366 29.591 1.00 61.24 H new ATOM 0 HB2 LYS A 91 23.717 -22.286 30.438 1.00 53.53 H new ATOM 0 HB3 LYS A 91 24.733 -23.676 30.766 1.00 53.53 H new ATOM 0 HG2 LYS A 91 25.523 -20.880 31.629 1.00 41.11 H new ATOM 0 HG3 LYS A 91 24.496 -21.899 32.617 1.00 41.11 H new ATOM 0 HD2 LYS A 91 26.391 -23.703 32.267 1.00 11.45 H new ATOM 0 HD3 LYS A 91 27.382 -22.325 31.830 1.00 11.45 H new ATOM 0 HE2 LYS A 91 25.849 -22.639 34.444 1.00 13.44 H new ATOM 0 HE3 LYS A 91 27.573 -22.882 34.243 1.00 13.44 H new ATOM 0 HZ1 LYS A 91 27.194 -20.704 35.103 1.00 13.24 H new ATOM 0 HZ2 LYS A 91 27.733 -20.535 33.501 1.00 13.24 H new ATOM 0 HZ3 LYS A 91 26.088 -20.331 33.870 1.00 13.24 H new ATOM 1492 N GLU A 92 23.994 -23.332 27.823 1.00 62.33 N ATOM 1493 CA GLU A 92 23.561 -24.260 26.784 1.00 4.03 C ATOM 1494 C GLU A 92 23.930 -23.737 25.399 1.00 3.21 C ATOM 1495 O GLU A 92 24.210 -22.550 25.225 1.00 2.14 O ATOM 1496 CB GLU A 92 22.051 -24.487 26.870 1.00 73.41 C ATOM 1497 CG GLU A 92 21.667 -25.759 27.607 1.00 24.34 C ATOM 1498 CD GLU A 92 21.479 -26.940 26.675 1.00 74.01 C ATOM 1499 OE1 GLU A 92 20.339 -27.441 26.574 1.00 42.31 O ATOM 1500 OE2 GLU A 92 22.471 -27.363 26.046 1.00 42.12 O ATOM 0 H GLU A 92 23.260 -22.716 28.171 1.00 62.33 H new ATOM 0 HA GLU A 92 24.074 -25.209 26.943 1.00 4.03 H new ATOM 0 HB2 GLU A 92 21.592 -23.635 27.371 1.00 73.41 H new ATOM 0 HB3 GLU A 92 21.640 -24.523 25.861 1.00 73.41 H new ATOM 0 HG2 GLU A 92 22.439 -25.998 28.338 1.00 24.34 H new ATOM 0 HG3 GLU A 92 20.744 -25.588 28.162 1.00 24.34 H new ATOM 1507 N LEU A 93 23.929 -24.630 24.416 1.00 22.52 N ATOM 1508 CA LEU A 93 24.264 -24.260 23.045 1.00 21.54 C ATOM 1509 C LEU A 93 23.015 -23.855 22.270 1.00 33.30 C ATOM 1510 O LEU A 93 21.889 -24.189 22.640 1.00 31.41 O ATOM 1511 CB LEU A 93 24.962 -25.424 22.338 1.00 1.44 C ATOM 1512 CG LEU A 93 26.482 -25.488 22.492 1.00 1.33 C ATOM 1513 CD1 LEU A 93 26.869 -25.520 23.963 1.00 51.43 C ATOM 1514 CD2 LEU A 93 27.041 -26.702 21.765 1.00 30.25 C ATOM 0 H LEU A 93 23.700 -25.616 24.542 1.00 22.52 H new ATOM 0 HA LEU A 93 24.940 -23.406 23.080 1.00 21.54 H new ATOM 0 HB2 LEU A 93 24.539 -26.356 22.712 1.00 1.44 H new ATOM 0 HB3 LEU A 93 24.726 -25.371 21.275 1.00 1.44 H new ATOM 0 HG LEU A 93 26.911 -24.592 22.044 1.00 1.33 H new ATOM 0 HD11 LEU A 93 27.954 -25.566 24.053 1.00 51.43 H new ATOM 0 HD12 LEU A 93 26.502 -24.620 24.456 1.00 51.43 H new ATOM 0 HD13 LEU A 93 26.429 -26.398 24.436 1.00 51.43 H new ATOM 0 HD21 LEU A 93 28.124 -26.731 21.885 1.00 30.25 H new ATOM 0 HD22 LEU A 93 26.605 -27.609 22.183 1.00 30.25 H new ATOM 0 HD23 LEU A 93 26.795 -26.636 20.705 1.00 30.25 H new ATOM 1526 N PRO A 94 23.215 -23.120 21.167 1.00 43.44 N ATOM 1527 CA PRO A 94 22.117 -22.655 20.314 1.00 31.31 C ATOM 1528 C PRO A 94 21.453 -23.797 19.551 1.00 1.51 C ATOM 1529 O PRO A 94 22.116 -24.546 18.833 1.00 31.33 O ATOM 1530 CB PRO A 94 22.804 -21.692 19.343 1.00 1.45 C ATOM 1531 CG PRO A 94 24.221 -22.149 19.295 1.00 1.13 C ATOM 1532 CD PRO A 94 24.530 -22.685 20.666 1.00 41.31 C ATOM 0 HA PRO A 94 21.316 -22.197 20.894 1.00 31.31 H new ATOM 0 HB2 PRO A 94 22.343 -21.729 18.356 1.00 1.45 H new ATOM 0 HB3 PRO A 94 22.732 -20.661 19.690 1.00 1.45 H new ATOM 0 HG2 PRO A 94 24.357 -22.919 18.535 1.00 1.13 H new ATOM 0 HG3 PRO A 94 24.888 -21.326 19.038 1.00 1.13 H new ATOM 0 HD2 PRO A 94 25.238 -23.513 20.624 1.00 41.31 H new ATOM 0 HD3 PRO A 94 24.971 -21.921 21.306 1.00 41.31 H new ATOM 1540 N THR A 95 20.139 -23.923 19.710 1.00 22.41 N ATOM 1541 CA THR A 95 19.386 -24.974 19.037 1.00 52.32 C ATOM 1542 C THR A 95 19.185 -24.647 17.562 1.00 51.25 C ATOM 1543 O THR A 95 19.296 -23.491 17.150 1.00 22.04 O ATOM 1544 CB THR A 95 18.010 -25.188 19.695 1.00 30.44 C ATOM 1545 OG1 THR A 95 18.140 -25.161 21.121 1.00 14.42 O ATOM 1546 CG2 THR A 95 17.404 -26.515 19.262 1.00 13.40 C ATOM 0 H THR A 95 19.575 -23.310 20.299 1.00 22.41 H new ATOM 0 HA THR A 95 19.971 -25.890 19.128 1.00 52.32 H new ATOM 0 HB THR A 95 17.349 -24.382 19.375 1.00 30.44 H new ATOM 0 HG1 THR A 95 17.776 -24.319 21.467 1.00 14.42 H new ATOM 0 HG21 THR A 95 16.433 -26.644 19.739 1.00 13.40 H new ATOM 0 HG22 THR A 95 17.280 -26.522 18.179 1.00 13.40 H new ATOM 0 HG23 THR A 95 18.065 -27.330 19.557 1.00 13.40 H new ATOM 1554 N LEU A 96 18.888 -25.670 16.769 1.00 73.52 N ATOM 1555 CA LEU A 96 18.670 -25.492 15.337 1.00 0.34 C ATOM 1556 C LEU A 96 19.931 -24.969 14.656 1.00 73.30 C ATOM 1557 O LEU A 96 19.881 -24.471 13.531 1.00 11.50 O ATOM 1558 CB LEU A 96 17.508 -24.527 15.095 1.00 42.41 C ATOM 1559 CG LEU A 96 17.890 -23.068 14.837 1.00 74.51 C ATOM 1560 CD1 LEU A 96 17.617 -22.694 13.388 1.00 1.24 C ATOM 1561 CD2 LEU A 96 17.133 -22.144 15.780 1.00 21.51 C ATOM 0 H LEU A 96 18.792 -26.632 17.093 1.00 73.52 H new ATOM 0 HA LEU A 96 18.423 -26.463 14.908 1.00 0.34 H new ATOM 0 HB2 LEU A 96 16.934 -24.888 14.242 1.00 42.41 H new ATOM 0 HB3 LEU A 96 16.847 -24.561 15.961 1.00 42.41 H new ATOM 0 HG LEU A 96 18.957 -22.952 15.026 1.00 74.51 H new ATOM 0 HD11 LEU A 96 17.894 -21.653 13.222 1.00 1.24 H new ATOM 0 HD12 LEU A 96 18.204 -23.335 12.730 1.00 1.24 H new ATOM 0 HD13 LEU A 96 16.557 -22.826 13.172 1.00 1.24 H new ATOM 0 HD21 LEU A 96 17.417 -21.110 15.582 1.00 21.51 H new ATOM 0 HD22 LEU A 96 16.061 -22.262 15.622 1.00 21.51 H new ATOM 0 HD23 LEU A 96 17.378 -22.397 16.812 1.00 21.51 H new ATOM 1573 N THR A 97 21.062 -25.089 15.344 1.00 41.21 N ATOM 1574 CA THR A 97 22.336 -24.630 14.805 1.00 22.13 C ATOM 1575 C THR A 97 22.918 -25.645 13.828 1.00 35.30 C ATOM 1576 O THR A 97 23.637 -25.283 12.898 1.00 53.32 O ATOM 1577 CB THR A 97 23.359 -24.370 15.927 1.00 24.21 C ATOM 1578 OG1 THR A 97 24.557 -23.808 15.378 1.00 75.53 O ATOM 1579 CG2 THR A 97 23.690 -25.658 16.667 1.00 43.34 C ATOM 0 H THR A 97 21.122 -25.500 16.276 1.00 41.21 H new ATOM 0 HA THR A 97 22.138 -23.696 14.279 1.00 22.13 H new ATOM 0 HB THR A 97 22.919 -23.666 16.634 1.00 24.21 H new ATOM 0 HG1 THR A 97 25.201 -23.644 16.098 1.00 75.53 H new ATOM 0 HG21 THR A 97 24.414 -25.449 17.454 1.00 43.34 H new ATOM 0 HG22 THR A 97 22.782 -26.068 17.109 1.00 43.34 H new ATOM 0 HG23 THR A 97 24.112 -26.381 15.969 1.00 43.34 H new ATOM 1587 N GLU A 98 22.600 -26.918 14.045 1.00 4.13 N ATOM 1588 CA GLU A 98 23.093 -27.985 13.182 1.00 35.12 C ATOM 1589 C GLU A 98 22.270 -28.070 11.899 1.00 23.35 C ATOM 1590 O GLU A 98 22.532 -28.907 11.035 1.00 23.42 O ATOM 1591 CB GLU A 98 23.051 -29.326 13.918 1.00 72.33 C ATOM 1592 CG GLU A 98 23.814 -29.324 15.231 1.00 22.04 C ATOM 1593 CD GLU A 98 23.985 -30.715 15.809 1.00 32.54 C ATOM 1594 OE1 GLU A 98 24.567 -31.578 15.119 1.00 11.03 O ATOM 1595 OE2 GLU A 98 23.536 -30.941 16.953 1.00 71.32 O ATOM 0 H GLU A 98 22.004 -27.235 14.810 1.00 4.13 H new ATOM 0 HA GLU A 98 24.125 -27.756 12.917 1.00 35.12 H new ATOM 0 HB2 GLU A 98 22.012 -29.592 14.112 1.00 72.33 H new ATOM 0 HB3 GLU A 98 23.462 -30.100 13.270 1.00 72.33 H new ATOM 0 HG2 GLU A 98 24.796 -28.876 15.076 1.00 22.04 H new ATOM 0 HG3 GLU A 98 23.288 -28.697 15.951 1.00 22.04 H new ATOM 1602 N HIS A 99 21.274 -27.198 11.783 1.00 31.12 N ATOM 1603 CA HIS A 99 20.412 -27.174 10.606 1.00 4.14 C ATOM 1604 C HIS A 99 21.231 -27.346 9.330 1.00 11.53 C ATOM 1605 O HIS A 99 20.811 -28.032 8.398 1.00 1.32 O ATOM 1606 CB HIS A 99 19.627 -25.863 10.550 1.00 21.21 C ATOM 1607 CG HIS A 99 18.144 -26.049 10.641 1.00 72.43 C ATOM 1608 ND1 HIS A 99 17.554 -27.028 11.413 1.00 12.40 N ATOM 1609 CD2 HIS A 99 17.129 -25.374 10.052 1.00 62.45 C ATOM 1610 CE1 HIS A 99 16.241 -26.947 11.294 1.00 74.44 C ATOM 1611 NE2 HIS A 99 15.957 -25.952 10.473 1.00 11.13 N ATOM 0 H HIS A 99 21.044 -26.499 12.489 1.00 31.12 H new ATOM 0 HA HIS A 99 19.711 -28.005 10.682 1.00 4.14 H new ATOM 0 HB2 HIS A 99 19.955 -25.218 11.365 1.00 21.21 H new ATOM 0 HB3 HIS A 99 19.864 -25.347 9.620 1.00 21.21 H new ATOM 0 HD2 HIS A 99 17.224 -24.537 9.377 1.00 62.45 H new ATOM 0 HE1 HIS A 99 15.522 -27.586 11.785 1.00 74.44 H new ATOM 0 HE2 HIS A 99 15.019 -25.660 10.197 1.00 11.13 H new ATOM 1619 N LYS A 100 22.401 -26.717 9.295 1.00 61.12 N ATOM 1620 CA LYS A 100 23.280 -26.800 8.134 1.00 14.20 C ATOM 1621 C LYS A 100 24.426 -27.774 8.387 1.00 34.14 C ATOM 1622 O LYS A 100 24.577 -28.768 7.677 1.00 54.23 O ATOM 1623 CB LYS A 100 23.838 -25.417 7.792 1.00 42.23 C ATOM 1624 CG LYS A 100 24.301 -25.287 6.351 1.00 75.12 C ATOM 1625 CD LYS A 100 25.691 -25.868 6.157 1.00 3.40 C ATOM 1626 CE LYS A 100 26.176 -25.687 4.727 1.00 63.33 C ATOM 1627 NZ LYS A 100 25.433 -26.559 3.775 1.00 41.30 N ATOM 0 H LYS A 100 22.763 -26.144 10.057 1.00 61.12 H new ATOM 0 HA LYS A 100 22.694 -27.168 7.292 1.00 14.20 H new ATOM 0 HB2 LYS A 100 23.072 -24.667 7.988 1.00 42.23 H new ATOM 0 HB3 LYS A 100 24.675 -25.198 8.455 1.00 42.23 H new ATOM 0 HG2 LYS A 100 23.597 -25.798 5.694 1.00 75.12 H new ATOM 0 HG3 LYS A 100 24.301 -24.236 6.061 1.00 75.12 H new ATOM 0 HD2 LYS A 100 26.387 -25.385 6.842 1.00 3.40 H new ATOM 0 HD3 LYS A 100 25.681 -26.929 6.408 1.00 3.40 H new ATOM 0 HE2 LYS A 100 26.058 -24.644 4.433 1.00 63.33 H new ATOM 0 HE3 LYS A 100 27.241 -25.915 4.673 1.00 63.33 H new ATOM 0 HZ1 LYS A 100 25.848 -26.470 2.826 1.00 41.30 H new ATOM 0 HZ2 LYS A 100 25.496 -27.548 4.089 1.00 41.30 H new ATOM 0 HZ3 LYS A 100 24.435 -26.268 3.745 1.00 41.30 H new ATOM 1641 N SER A 101 25.229 -27.483 9.405 1.00 24.42 N ATOM 1642 CA SER A 101 26.363 -28.333 9.751 1.00 42.13 C ATOM 1643 C SER A 101 27.183 -27.713 10.878 1.00 11.22 C ATOM 1644 O SER A 101 26.783 -26.711 11.472 1.00 21.24 O ATOM 1645 CB SER A 101 27.250 -28.559 8.525 1.00 62.31 C ATOM 1646 OG SER A 101 27.404 -29.942 8.255 1.00 1.11 O ATOM 0 H SER A 101 25.116 -26.666 10.005 1.00 24.42 H new ATOM 0 HA SER A 101 25.975 -29.293 10.093 1.00 42.13 H new ATOM 0 HB2 SER A 101 26.812 -28.063 7.659 1.00 62.31 H new ATOM 0 HB3 SER A 101 28.228 -28.107 8.691 1.00 62.31 H new ATOM 0 HG SER A 101 27.973 -30.060 7.466 1.00 1.11 H new ATOM 1652 N ILE A 102 28.331 -28.316 11.167 1.00 43.33 N ATOM 1653 CA ILE A 102 29.208 -27.823 12.222 1.00 42.14 C ATOM 1654 C ILE A 102 30.476 -27.206 11.640 1.00 73.54 C ATOM 1655 O ILE A 102 31.388 -27.919 11.223 1.00 45.43 O ATOM 1656 CB ILE A 102 29.600 -28.947 13.199 1.00 15.22 C ATOM 1657 CG1 ILE A 102 28.442 -29.249 14.153 1.00 72.02 C ATOM 1658 CG2 ILE A 102 30.848 -28.560 13.978 1.00 33.15 C ATOM 1659 CD1 ILE A 102 28.104 -30.721 14.246 1.00 3.42 C ATOM 0 H ILE A 102 28.676 -29.147 10.686 1.00 43.33 H new ATOM 0 HA ILE A 102 28.651 -27.059 12.764 1.00 42.14 H new ATOM 0 HB ILE A 102 29.818 -29.848 12.625 1.00 15.22 H new ATOM 0 HG12 ILE A 102 28.695 -28.879 15.147 1.00 72.02 H new ATOM 0 HG13 ILE A 102 27.559 -28.702 13.824 1.00 72.02 H new ATOM 0 HG21 ILE A 102 31.113 -29.364 14.664 1.00 33.15 H new ATOM 0 HG22 ILE A 102 31.671 -28.389 13.285 1.00 33.15 H new ATOM 0 HG23 ILE A 102 30.656 -27.649 14.544 1.00 33.15 H new ATOM 0 HD11 ILE A 102 27.275 -30.861 14.939 1.00 3.42 H new ATOM 0 HD12 ILE A 102 27.820 -31.092 13.261 1.00 3.42 H new ATOM 0 HD13 ILE A 102 28.973 -31.272 14.604 1.00 3.42 H new ATOM 1671 N GLU A 103 30.525 -25.878 11.617 1.00 73.24 N ATOM 1672 CA GLU A 103 31.682 -25.166 11.086 1.00 35.25 C ATOM 1673 C GLU A 103 31.913 -23.863 11.845 1.00 13.53 C ATOM 1674 O GLU A 103 31.056 -22.978 11.856 1.00 23.30 O ATOM 1675 CB GLU A 103 31.490 -24.875 9.597 1.00 42.24 C ATOM 1676 CG GLU A 103 30.528 -25.829 8.908 1.00 3.35 C ATOM 1677 CD GLU A 103 30.441 -25.591 7.413 1.00 33.14 C ATOM 1678 OE1 GLU A 103 29.346 -25.230 6.933 1.00 63.35 O ATOM 1679 OE2 GLU A 103 31.468 -25.766 6.724 1.00 14.14 O ATOM 0 H GLU A 103 29.778 -25.274 11.959 1.00 73.24 H new ATOM 0 HA GLU A 103 32.558 -25.801 11.214 1.00 35.25 H new ATOM 0 HB2 GLU A 103 31.123 -23.855 9.479 1.00 42.24 H new ATOM 0 HB3 GLU A 103 32.458 -24.925 9.098 1.00 42.24 H new ATOM 0 HG2 GLU A 103 30.847 -26.855 9.091 1.00 3.35 H new ATOM 0 HG3 GLU A 103 29.537 -25.720 9.348 1.00 3.35 H new ATOM 1686 N TRP A 104 33.075 -23.752 12.479 1.00 73.03 N ATOM 1687 CA TRP A 104 33.419 -22.557 13.241 1.00 72.11 C ATOM 1688 C TRP A 104 34.639 -21.864 12.645 1.00 51.32 C ATOM 1689 O TRP A 104 35.726 -22.440 12.585 1.00 74.50 O ATOM 1690 CB TRP A 104 33.686 -22.919 14.703 1.00 61.12 C ATOM 1691 CG TRP A 104 32.860 -24.071 15.190 1.00 13.52 C ATOM 1692 CD1 TRP A 104 33.312 -25.196 15.818 1.00 72.24 C ATOM 1693 CD2 TRP A 104 31.438 -24.209 15.088 1.00 23.02 C ATOM 1694 NE1 TRP A 104 32.257 -26.026 16.112 1.00 70.22 N ATOM 1695 CE2 TRP A 104 31.097 -25.443 15.676 1.00 72.15 C ATOM 1696 CE3 TRP A 104 30.421 -23.410 14.560 1.00 33.11 C ATOM 1697 CZ2 TRP A 104 29.782 -25.895 15.747 1.00 53.43 C ATOM 1698 CZ3 TRP A 104 29.116 -23.860 14.631 1.00 0.23 C ATOM 1699 CH2 TRP A 104 28.806 -25.092 15.222 1.00 74.14 C ATOM 0 H TRP A 104 33.795 -24.475 12.480 1.00 73.03 H new ATOM 0 HA TRP A 104 32.574 -21.870 13.193 1.00 72.11 H new ATOM 0 HB2 TRP A 104 34.742 -23.162 14.823 1.00 61.12 H new ATOM 0 HB3 TRP A 104 33.486 -22.048 15.328 1.00 61.12 H new ATOM 0 HD1 TRP A 104 34.346 -25.403 16.050 1.00 72.24 H new ATOM 0 HE1 TRP A 104 32.327 -26.930 16.579 1.00 70.22 H new ATOM 0 HE3 TRP A 104 30.650 -22.458 14.105 1.00 33.11 H new ATOM 0 HZ2 TRP A 104 29.541 -26.845 16.200 1.00 53.43 H new ATOM 0 HZ3 TRP A 104 28.322 -23.252 14.224 1.00 0.23 H new ATOM 0 HH2 TRP A 104 27.776 -25.414 15.264 1.00 74.14 H new ATOM 1710 N LEU A 105 34.453 -20.624 12.205 1.00 64.11 N ATOM 1711 CA LEU A 105 35.540 -19.852 11.613 1.00 2.52 C ATOM 1712 C LEU A 105 35.863 -18.627 12.463 1.00 2.30 C ATOM 1713 O LEU A 105 35.044 -18.183 13.267 1.00 34.12 O ATOM 1714 CB LEU A 105 35.170 -19.418 10.194 1.00 62.24 C ATOM 1715 CG LEU A 105 35.218 -20.510 9.125 1.00 72.54 C ATOM 1716 CD1 LEU A 105 36.571 -21.205 9.131 1.00 52.23 C ATOM 1717 CD2 LEU A 105 34.098 -21.518 9.341 1.00 22.14 C ATOM 0 H LEU A 105 33.560 -20.132 12.247 1.00 64.11 H new ATOM 0 HA LEU A 105 36.424 -20.488 11.573 1.00 2.52 H new ATOM 0 HB2 LEU A 105 34.163 -19.001 10.214 1.00 62.24 H new ATOM 0 HB3 LEU A 105 35.842 -18.614 9.894 1.00 62.24 H new ATOM 0 HG LEU A 105 35.077 -20.043 8.150 1.00 72.54 H new ATOM 0 HD11 LEU A 105 36.586 -21.979 8.364 1.00 52.23 H new ATOM 0 HD12 LEU A 105 37.355 -20.476 8.927 1.00 52.23 H new ATOM 0 HD13 LEU A 105 36.743 -21.659 10.107 1.00 52.23 H new ATOM 0 HD21 LEU A 105 34.148 -22.288 8.571 1.00 22.14 H new ATOM 0 HD22 LEU A 105 34.208 -21.979 10.323 1.00 22.14 H new ATOM 0 HD23 LEU A 105 33.135 -21.010 9.284 1.00 22.14 H new ATOM 1729 N SER A 106 37.062 -18.084 12.278 1.00 41.55 N ATOM 1730 CA SER A 106 37.494 -16.911 13.028 1.00 2.52 C ATOM 1731 C SER A 106 36.895 -15.637 12.439 1.00 64.25 C ATOM 1732 O SER A 106 36.295 -15.661 11.364 1.00 41.23 O ATOM 1733 CB SER A 106 39.021 -16.815 13.032 1.00 22.30 C ATOM 1734 OG SER A 106 39.524 -16.632 11.720 1.00 51.21 O ATOM 0 H SER A 106 37.752 -18.438 11.615 1.00 41.55 H new ATOM 0 HA SER A 106 37.141 -17.017 14.054 1.00 2.52 H new ATOM 0 HB2 SER A 106 39.335 -15.984 13.664 1.00 22.30 H new ATOM 0 HB3 SER A 106 39.444 -17.722 13.464 1.00 22.30 H new ATOM 0 HG SER A 106 40.502 -16.572 11.750 1.00 51.21 H new ATOM 1740 N ILE A 107 37.063 -14.528 13.150 1.00 44.52 N ATOM 1741 CA ILE A 107 36.541 -13.244 12.697 1.00 20.22 C ATOM 1742 C ILE A 107 37.375 -12.685 11.549 1.00 32.33 C ATOM 1743 O ILE A 107 36.899 -11.865 10.766 1.00 44.51 O ATOM 1744 CB ILE A 107 36.508 -12.214 13.842 1.00 63.41 C ATOM 1745 CG1 ILE A 107 35.624 -12.717 14.984 1.00 34.45 C ATOM 1746 CG2 ILE A 107 36.010 -10.871 13.331 1.00 2.43 C ATOM 1747 CD1 ILE A 107 35.567 -11.773 16.165 1.00 34.51 C ATOM 0 H ILE A 107 37.556 -14.492 14.042 1.00 44.52 H new ATOM 0 HA ILE A 107 35.523 -13.422 12.350 1.00 20.22 H new ATOM 0 HB ILE A 107 37.521 -12.083 14.223 1.00 63.41 H new ATOM 0 HG12 ILE A 107 34.614 -12.876 14.607 1.00 34.45 H new ATOM 0 HG13 ILE A 107 35.995 -13.685 15.321 1.00 34.45 H new ATOM 0 HG21 ILE A 107 35.992 -10.153 14.151 1.00 2.43 H new ATOM 0 HG22 ILE A 107 36.676 -10.510 12.548 1.00 2.43 H new ATOM 0 HG23 ILE A 107 35.004 -10.986 12.927 1.00 2.43 H new ATOM 0 HD11 ILE A 107 34.922 -12.194 16.936 1.00 34.51 H new ATOM 0 HD12 ILE A 107 36.570 -11.633 16.567 1.00 34.51 H new ATOM 0 HD13 ILE A 107 35.167 -10.811 15.843 1.00 34.51 H new ATOM 1759 N ASN A 108 38.621 -13.138 11.455 1.00 0.54 N ATOM 1760 CA ASN A 108 39.522 -12.683 10.402 1.00 75.51 C ATOM 1761 C ASN A 108 39.366 -13.538 9.147 1.00 15.34 C ATOM 1762 O ASN A 108 40.059 -13.329 8.153 1.00 50.43 O ATOM 1763 CB ASN A 108 40.972 -12.730 10.887 1.00 51.21 C ATOM 1764 CG ASN A 108 41.139 -12.129 12.270 1.00 74.55 C ATOM 1765 OD1 ASN A 108 41.491 -10.959 12.412 1.00 41.55 O ATOM 1766 ND2 ASN A 108 40.886 -12.932 13.297 1.00 15.41 N ATOM 0 H ASN A 108 39.030 -13.819 12.095 1.00 0.54 H new ATOM 0 HA ASN A 108 39.262 -11.654 10.155 1.00 75.51 H new ATOM 0 HB2 ASN A 108 41.315 -13.765 10.900 1.00 51.21 H new ATOM 0 HB3 ASN A 108 41.606 -12.193 10.181 1.00 51.21 H new ATOM 0 HD21 ASN A 108 40.981 -12.585 14.251 1.00 15.41 H new ATOM 0 HD22 ASN A 108 40.596 -13.896 13.131 1.00 15.41 H new ATOM 1773 N GLU A 109 38.450 -14.500 9.203 1.00 12.32 N ATOM 1774 CA GLU A 109 38.203 -15.385 8.071 1.00 23.32 C ATOM 1775 C GLU A 109 36.707 -15.616 7.876 1.00 4.15 C ATOM 1776 O GLU A 109 36.296 -16.452 7.070 1.00 2.35 O ATOM 1777 CB GLU A 109 38.914 -16.724 8.279 1.00 61.44 C ATOM 1778 CG GLU A 109 40.327 -16.756 7.720 1.00 72.51 C ATOM 1779 CD GLU A 109 40.837 -18.168 7.504 1.00 31.14 C ATOM 1780 OE1 GLU A 109 40.030 -19.115 7.616 1.00 42.44 O ATOM 1781 OE2 GLU A 109 42.044 -18.326 7.224 1.00 12.32 O ATOM 0 H GLU A 109 37.867 -14.686 10.019 1.00 12.32 H new ATOM 0 HA GLU A 109 38.598 -14.906 7.175 1.00 23.32 H new ATOM 0 HB2 GLU A 109 38.949 -16.945 9.346 1.00 61.44 H new ATOM 0 HB3 GLU A 109 38.328 -17.514 7.809 1.00 61.44 H new ATOM 0 HG2 GLU A 109 40.352 -16.216 6.773 1.00 72.51 H new ATOM 0 HG3 GLU A 109 40.996 -16.233 8.403 1.00 72.51 H new ATOM 1788 N LEU A 110 35.898 -14.870 8.620 1.00 2.22 N ATOM 1789 CA LEU A 110 34.447 -14.992 8.531 1.00 63.22 C ATOM 1790 C LEU A 110 33.968 -14.755 7.102 1.00 31.43 C ATOM 1791 O LEU A 110 32.931 -15.277 6.690 1.00 3.54 O ATOM 1792 CB LEU A 110 33.773 -13.999 9.479 1.00 53.14 C ATOM 1793 CG LEU A 110 34.279 -12.558 9.412 1.00 3.31 C ATOM 1794 CD1 LEU A 110 33.691 -11.840 8.207 1.00 30.03 C ATOM 1795 CD2 LEU A 110 33.941 -11.814 10.696 1.00 43.21 C ATOM 0 H LEU A 110 36.222 -14.174 9.292 1.00 2.22 H new ATOM 0 HA LEU A 110 34.173 -16.006 8.823 1.00 63.22 H new ATOM 0 HB2 LEU A 110 32.703 -13.997 9.270 1.00 53.14 H new ATOM 0 HB3 LEU A 110 33.898 -14.360 10.500 1.00 53.14 H new ATOM 0 HG LEU A 110 35.363 -12.579 9.302 1.00 3.31 H new ATOM 0 HD11 LEU A 110 34.063 -10.816 8.177 1.00 30.03 H new ATOM 0 HD12 LEU A 110 33.984 -12.360 7.295 1.00 30.03 H new ATOM 0 HD13 LEU A 110 32.604 -11.829 8.285 1.00 30.03 H new ATOM 0 HD21 LEU A 110 34.309 -10.790 10.631 1.00 43.21 H new ATOM 0 HD22 LEU A 110 32.860 -11.803 10.837 1.00 43.21 H new ATOM 0 HD23 LEU A 110 34.412 -12.315 11.542 1.00 43.21 H new ATOM 1807 N ASP A 111 34.730 -13.968 6.351 1.00 32.11 N ATOM 1808 CA ASP A 111 34.385 -13.665 4.967 1.00 52.10 C ATOM 1809 C ASP A 111 34.194 -14.946 4.161 1.00 32.13 C ATOM 1810 O ASP A 111 33.427 -14.979 3.199 1.00 51.23 O ATOM 1811 CB ASP A 111 35.472 -12.801 4.325 1.00 20.54 C ATOM 1812 CG ASP A 111 35.186 -12.499 2.868 1.00 40.14 C ATOM 1813 OD1 ASP A 111 35.921 -13.014 1.999 1.00 5.51 O ATOM 1814 OD2 ASP A 111 34.226 -11.748 2.595 1.00 22.32 O ATOM 0 H ASP A 111 35.591 -13.528 6.677 1.00 32.11 H new ATOM 0 HA ASP A 111 33.445 -13.113 4.966 1.00 52.10 H new ATOM 0 HB2 ASP A 111 35.561 -11.865 4.876 1.00 20.54 H new ATOM 0 HB3 ASP A 111 36.432 -13.311 4.406 1.00 20.54 H new ATOM 1819 N LYS A 112 34.897 -16.000 4.560 1.00 23.34 N ATOM 1820 CA LYS A 112 34.806 -17.285 3.877 1.00 42.12 C ATOM 1821 C LYS A 112 33.396 -17.857 3.979 1.00 53.33 C ATOM 1822 O LYS A 112 32.993 -18.691 3.167 1.00 52.22 O ATOM 1823 CB LYS A 112 35.813 -18.274 4.469 1.00 12.32 C ATOM 1824 CG LYS A 112 35.539 -19.719 4.092 1.00 22.43 C ATOM 1825 CD LYS A 112 34.687 -20.417 5.139 1.00 21.02 C ATOM 1826 CE LYS A 112 35.454 -21.537 5.826 1.00 11.53 C ATOM 1827 NZ LYS A 112 35.916 -22.568 4.857 1.00 21.42 N ATOM 0 H LYS A 112 35.537 -15.990 5.354 1.00 23.34 H new ATOM 0 HA LYS A 112 35.039 -17.125 2.824 1.00 42.12 H new ATOM 0 HB2 LYS A 112 36.815 -18.004 4.135 1.00 12.32 H new ATOM 0 HB3 LYS A 112 35.804 -18.183 5.555 1.00 12.32 H new ATOM 0 HG2 LYS A 112 35.033 -19.754 3.127 1.00 22.43 H new ATOM 0 HG3 LYS A 112 36.483 -20.251 3.976 1.00 22.43 H new ATOM 0 HD2 LYS A 112 34.356 -19.692 5.883 1.00 21.02 H new ATOM 0 HD3 LYS A 112 33.791 -20.823 4.669 1.00 21.02 H new ATOM 0 HE2 LYS A 112 36.314 -21.120 6.350 1.00 11.53 H new ATOM 0 HE3 LYS A 112 34.818 -22.004 6.578 1.00 11.53 H new ATOM 0 HZ1 LYS A 112 35.977 -23.490 5.334 1.00 21.42 H new ATOM 0 HZ2 LYS A 112 35.241 -22.630 4.068 1.00 21.42 H new ATOM 0 HZ3 LYS A 112 36.853 -22.305 4.491 1.00 21.42 H new ATOM 1841 N LEU A 113 32.649 -17.402 4.979 1.00 21.41 N ATOM 1842 CA LEU A 113 31.282 -17.868 5.186 1.00 1.21 C ATOM 1843 C LEU A 113 30.282 -16.937 4.508 1.00 35.14 C ATOM 1844 O LEU A 113 29.227 -16.634 5.064 1.00 54.42 O ATOM 1845 CB LEU A 113 30.976 -17.963 6.682 1.00 54.42 C ATOM 1846 CG LEU A 113 32.020 -18.681 7.537 1.00 60.23 C ATOM 1847 CD1 LEU A 113 32.503 -17.778 8.660 1.00 5.44 C ATOM 1848 CD2 LEU A 113 31.450 -19.976 8.098 1.00 4.45 C ATOM 0 H LEU A 113 32.967 -16.711 5.659 1.00 21.41 H new ATOM 0 HA LEU A 113 31.189 -18.858 4.739 1.00 1.21 H new ATOM 0 HB2 LEU A 113 30.849 -16.953 7.071 1.00 54.42 H new ATOM 0 HB3 LEU A 113 30.021 -18.474 6.805 1.00 54.42 H new ATOM 0 HG LEU A 113 32.873 -18.927 6.905 1.00 60.23 H new ATOM 0 HD11 LEU A 113 33.246 -18.306 9.258 1.00 5.44 H new ATOM 0 HD12 LEU A 113 32.951 -16.879 8.237 1.00 5.44 H new ATOM 0 HD13 LEU A 113 31.659 -17.500 9.292 1.00 5.44 H new ATOM 0 HD21 LEU A 113 32.207 -20.474 8.704 1.00 4.45 H new ATOM 0 HD22 LEU A 113 30.580 -19.753 8.715 1.00 4.45 H new ATOM 0 HD23 LEU A 113 31.155 -20.629 7.277 1.00 4.45 H new ATOM 1860 N ASN A 114 30.620 -16.489 3.304 1.00 71.23 N ATOM 1861 CA ASN A 114 29.750 -15.594 2.549 1.00 62.21 C ATOM 1862 C ASN A 114 28.300 -15.735 3.002 1.00 2.31 C ATOM 1863 O ASN A 114 27.641 -16.731 2.706 1.00 14.00 O ATOM 1864 CB ASN A 114 29.859 -15.887 1.051 1.00 32.11 C ATOM 1865 CG ASN A 114 29.677 -14.642 0.204 1.00 74.50 C ATOM 1866 OD1 ASN A 114 28.618 -14.431 -0.388 1.00 44.25 O ATOM 1867 ND2 ASN A 114 30.711 -13.812 0.143 1.00 51.10 N ATOM 0 H ASN A 114 31.490 -16.731 2.830 1.00 71.23 H new ATOM 0 HA ASN A 114 30.073 -14.570 2.737 1.00 62.21 H new ATOM 0 HB2 ASN A 114 30.833 -16.328 0.840 1.00 32.11 H new ATOM 0 HB3 ASN A 114 29.108 -16.626 0.772 1.00 32.11 H new ATOM 0 HD21 ASN A 114 30.648 -12.958 -0.411 1.00 51.10 H new ATOM 0 HD22 ASN A 114 31.569 -14.028 0.650 1.00 51.10 H new ATOM 1874 N TRP A 115 27.811 -14.731 3.721 1.00 42.43 N ATOM 1875 CA TRP A 115 26.439 -14.742 4.214 1.00 12.34 C ATOM 1876 C TRP A 115 25.516 -13.974 3.275 1.00 51.24 C ATOM 1877 O TRP A 115 25.972 -13.341 2.323 1.00 74.04 O ATOM 1878 CB TRP A 115 26.375 -14.137 5.618 1.00 21.41 C ATOM 1879 CG TRP A 115 27.586 -14.437 6.449 1.00 33.23 C ATOM 1880 CD1 TRP A 115 28.830 -13.892 6.311 1.00 22.22 C ATOM 1881 CD2 TRP A 115 27.667 -15.355 7.546 1.00 54.44 C ATOM 1882 NE1 TRP A 115 29.680 -14.415 7.256 1.00 61.54 N ATOM 1883 CE2 TRP A 115 28.990 -15.314 8.026 1.00 64.13 C ATOM 1884 CE3 TRP A 115 26.750 -16.204 8.170 1.00 74.43 C ATOM 1885 CZ2 TRP A 115 29.417 -16.092 9.099 1.00 53.01 C ATOM 1886 CZ3 TRP A 115 27.174 -16.976 9.235 1.00 64.05 C ATOM 1887 CH2 TRP A 115 28.498 -16.915 9.691 1.00 72.20 C ATOM 0 H TRP A 115 28.344 -13.899 3.975 1.00 42.43 H new ATOM 0 HA TRP A 115 26.103 -15.778 4.256 1.00 12.34 H new ATOM 0 HB2 TRP A 115 26.258 -13.056 5.535 1.00 21.41 H new ATOM 0 HB3 TRP A 115 25.490 -14.515 6.129 1.00 21.41 H new ATOM 0 HD1 TRP A 115 29.106 -13.158 5.568 1.00 22.22 H new ATOM 0 HE1 TRP A 115 30.665 -14.173 7.366 1.00 61.54 H new ATOM 0 HE3 TRP A 115 25.728 -16.256 7.826 1.00 74.43 H new ATOM 0 HZ2 TRP A 115 30.437 -16.047 9.451 1.00 53.01 H new ATOM 0 HZ3 TRP A 115 26.474 -17.637 9.724 1.00 64.05 H new ATOM 0 HH2 TRP A 115 28.799 -17.530 10.526 1.00 72.20 H new ATOM 1898 N ALA A 116 24.217 -14.034 3.548 1.00 12.43 N ATOM 1899 CA ALA A 116 23.231 -13.342 2.728 1.00 54.52 C ATOM 1900 C ALA A 116 23.590 -11.869 2.563 1.00 12.33 C ATOM 1901 O ALA A 116 24.477 -11.343 3.235 1.00 45.42 O ATOM 1902 CB ALA A 116 21.844 -13.484 3.337 1.00 12.33 C ATOM 0 H ALA A 116 23.823 -14.555 4.331 1.00 12.43 H new ATOM 0 HA ALA A 116 23.231 -13.802 1.740 1.00 54.52 H new ATOM 0 HB1 ALA A 116 21.118 -12.962 2.714 1.00 12.33 H new ATOM 0 HB2 ALA A 116 21.579 -14.540 3.396 1.00 12.33 H new ATOM 0 HB3 ALA A 116 21.840 -13.052 4.338 1.00 12.33 H new ATOM 1908 N PRO A 117 22.886 -11.186 1.649 1.00 55.34 N ATOM 1909 CA PRO A 117 23.113 -9.764 1.375 1.00 51.35 C ATOM 1910 C PRO A 117 22.665 -8.872 2.528 1.00 64.22 C ATOM 1911 O PRO A 117 23.030 -7.699 2.596 1.00 42.05 O ATOM 1912 CB PRO A 117 22.258 -9.501 0.132 1.00 11.34 C ATOM 1913 CG PRO A 117 21.186 -10.534 0.184 1.00 23.44 C ATOM 1914 CD PRO A 117 21.813 -11.749 0.812 1.00 53.12 C ATOM 0 HA PRO A 117 24.171 -9.540 1.237 1.00 51.35 H new ATOM 0 HB2 PRO A 117 21.839 -8.495 0.145 1.00 11.34 H new ATOM 0 HB3 PRO A 117 22.848 -9.589 -0.780 1.00 11.34 H new ATOM 0 HG2 PRO A 117 20.336 -10.186 0.771 1.00 23.44 H new ATOM 0 HG3 PRO A 117 20.812 -10.760 -0.815 1.00 23.44 H new ATOM 0 HD2 PRO A 117 21.093 -12.311 1.407 1.00 53.12 H new ATOM 0 HD3 PRO A 117 22.207 -12.432 0.060 1.00 53.12 H new ATOM 1922 N ALA A 118 21.873 -9.437 3.433 1.00 23.03 N ATOM 1923 CA ALA A 118 21.378 -8.694 4.585 1.00 2.42 C ATOM 1924 C ALA A 118 22.338 -8.806 5.765 1.00 42.23 C ATOM 1925 O ALA A 118 22.493 -7.864 6.543 1.00 61.41 O ATOM 1926 CB ALA A 118 19.995 -9.190 4.979 1.00 71.11 C ATOM 0 H ALA A 118 21.560 -10.407 3.391 1.00 23.03 H new ATOM 0 HA ALA A 118 21.309 -7.643 4.305 1.00 2.42 H new ATOM 0 HB1 ALA A 118 19.638 -8.626 5.841 1.00 71.11 H new ATOM 0 HB2 ALA A 118 19.307 -9.052 4.145 1.00 71.11 H new ATOM 0 HB3 ALA A 118 20.047 -10.248 5.234 1.00 71.11 H new ATOM 1932 N ASP A 119 22.980 -9.962 5.892 1.00 74.15 N ATOM 1933 CA ASP A 119 23.925 -10.197 6.977 1.00 61.14 C ATOM 1934 C ASP A 119 25.336 -9.789 6.565 1.00 24.34 C ATOM 1935 O ASP A 119 26.176 -9.482 7.412 1.00 33.15 O ATOM 1936 CB ASP A 119 23.906 -11.670 7.388 1.00 10.03 C ATOM 1937 CG ASP A 119 24.973 -11.998 8.414 1.00 33.24 C ATOM 1938 OD1 ASP A 119 24.970 -11.371 9.494 1.00 41.42 O ATOM 1939 OD2 ASP A 119 25.811 -12.882 8.138 1.00 73.13 O ATOM 0 H ASP A 119 22.863 -10.751 5.257 1.00 74.15 H new ATOM 0 HA ASP A 119 23.623 -9.587 7.828 1.00 61.14 H new ATOM 0 HB2 ASP A 119 22.926 -11.918 7.795 1.00 10.03 H new ATOM 0 HB3 ASP A 119 24.051 -12.293 6.505 1.00 10.03 H new ATOM 1944 N ILE A 120 25.591 -9.790 5.261 1.00 14.23 N ATOM 1945 CA ILE A 120 26.900 -9.420 4.739 1.00 50.05 C ATOM 1946 C ILE A 120 27.413 -8.143 5.395 1.00 40.44 C ATOM 1947 O ILE A 120 28.503 -8.103 5.965 1.00 3.03 O ATOM 1948 CB ILE A 120 26.861 -9.220 3.212 1.00 14.50 C ATOM 1949 CG1 ILE A 120 27.143 -10.541 2.495 1.00 74.32 C ATOM 1950 CG2 ILE A 120 27.865 -8.157 2.791 1.00 24.52 C ATOM 1951 CD1 ILE A 120 26.508 -10.633 1.125 1.00 51.33 C ATOM 0 H ILE A 120 24.908 -10.043 4.547 1.00 14.23 H new ATOM 0 HA ILE A 120 27.577 -10.242 4.972 1.00 50.05 H new ATOM 0 HB ILE A 120 25.864 -8.882 2.930 1.00 14.50 H new ATOM 0 HG12 ILE A 120 28.221 -10.668 2.396 1.00 74.32 H new ATOM 0 HG13 ILE A 120 26.780 -11.364 3.111 1.00 74.32 H new ATOM 0 HG21 ILE A 120 27.825 -8.027 1.709 1.00 24.52 H new ATOM 0 HG22 ILE A 120 27.622 -7.213 3.279 1.00 24.52 H new ATOM 0 HG23 ILE A 120 28.868 -8.468 3.083 1.00 24.52 H new ATOM 0 HD11 ILE A 120 26.750 -11.596 0.676 1.00 51.33 H new ATOM 0 HD12 ILE A 120 25.426 -10.538 1.218 1.00 51.33 H new ATOM 0 HD13 ILE A 120 26.890 -9.831 0.493 1.00 51.33 H new ATOM 1963 N PRO A 121 26.609 -7.072 5.314 1.00 31.15 N ATOM 1964 CA PRO A 121 26.959 -5.773 5.897 1.00 23.41 C ATOM 1965 C PRO A 121 26.938 -5.797 7.422 1.00 64.34 C ATOM 1966 O PRO A 121 27.523 -4.932 8.073 1.00 32.33 O ATOM 1967 CB PRO A 121 25.871 -4.839 5.362 1.00 61.31 C ATOM 1968 CG PRO A 121 24.711 -5.731 5.081 1.00 10.24 C ATOM 1969 CD PRO A 121 25.295 -7.047 4.649 1.00 23.35 C ATOM 0 HA PRO A 121 27.971 -5.467 5.632 1.00 23.41 H new ATOM 0 HB2 PRO A 121 25.613 -4.072 6.093 1.00 61.31 H new ATOM 0 HB3 PRO A 121 26.201 -4.322 4.461 1.00 61.31 H new ATOM 0 HG2 PRO A 121 24.089 -5.853 5.968 1.00 10.24 H new ATOM 0 HG3 PRO A 121 24.076 -5.311 4.301 1.00 10.24 H new ATOM 0 HD2 PRO A 121 24.671 -7.885 4.960 1.00 23.35 H new ATOM 0 HD3 PRO A 121 25.392 -7.107 3.565 1.00 23.35 H new ATOM 1977 N ALA A 122 26.262 -6.793 7.984 1.00 72.40 N ATOM 1978 CA ALA A 122 26.167 -6.931 9.432 1.00 43.20 C ATOM 1979 C ALA A 122 27.380 -7.665 9.994 1.00 33.40 C ATOM 1980 O ALA A 122 27.782 -7.438 11.135 1.00 31.21 O ATOM 1981 CB ALA A 122 24.885 -7.658 9.811 1.00 43.54 C ATOM 0 H ALA A 122 25.772 -7.517 7.458 1.00 72.40 H new ATOM 0 HA ALA A 122 26.146 -5.932 9.867 1.00 43.20 H new ATOM 0 HB1 ALA A 122 24.828 -7.754 10.895 1.00 43.54 H new ATOM 0 HB2 ALA A 122 24.026 -7.092 9.451 1.00 43.54 H new ATOM 0 HB3 ALA A 122 24.882 -8.650 9.359 1.00 43.54 H new ATOM 1987 N VAL A 123 27.958 -8.548 9.186 1.00 43.13 N ATOM 1988 CA VAL A 123 29.125 -9.316 9.602 1.00 4.05 C ATOM 1989 C VAL A 123 30.401 -8.491 9.472 1.00 21.40 C ATOM 1990 O VAL A 123 31.304 -8.591 10.302 1.00 52.51 O ATOM 1991 CB VAL A 123 29.274 -10.606 8.774 1.00 51.34 C ATOM 1992 CG1 VAL A 123 30.654 -11.213 8.973 1.00 30.14 C ATOM 1993 CG2 VAL A 123 28.185 -11.603 9.141 1.00 42.32 C ATOM 0 H VAL A 123 27.637 -8.749 8.239 1.00 43.13 H new ATOM 0 HA VAL A 123 28.972 -9.581 10.648 1.00 4.05 H new ATOM 0 HB VAL A 123 29.164 -10.355 7.719 1.00 51.34 H new ATOM 0 HG11 VAL A 123 30.740 -12.124 8.380 1.00 30.14 H new ATOM 0 HG12 VAL A 123 31.414 -10.500 8.655 1.00 30.14 H new ATOM 0 HG13 VAL A 123 30.798 -11.451 10.027 1.00 30.14 H new ATOM 0 HG21 VAL A 123 28.305 -12.509 8.546 1.00 42.32 H new ATOM 0 HG22 VAL A 123 28.261 -11.851 10.200 1.00 42.32 H new ATOM 0 HG23 VAL A 123 27.208 -11.164 8.940 1.00 42.32 H new ATOM 2003 N ASN A 124 30.468 -7.677 8.424 1.00 50.30 N ATOM 2004 CA ASN A 124 31.634 -6.834 8.184 1.00 12.13 C ATOM 2005 C ASN A 124 31.982 -6.020 9.427 1.00 34.21 C ATOM 2006 O ASN A 124 33.154 -5.850 9.764 1.00 35.41 O ATOM 2007 CB ASN A 124 31.377 -5.897 7.003 1.00 41.54 C ATOM 2008 CG ASN A 124 31.580 -6.583 5.666 1.00 41.24 C ATOM 2009 OD1 ASN A 124 32.344 -7.542 5.557 1.00 3.12 O ATOM 2010 ND2 ASN A 124 30.895 -6.093 4.639 1.00 12.31 N ATOM 0 H ASN A 124 29.729 -7.583 7.727 1.00 50.30 H new ATOM 0 HA ASN A 124 32.478 -7.482 7.948 1.00 12.13 H new ATOM 0 HB2 ASN A 124 30.358 -5.515 7.061 1.00 41.54 H new ATOM 0 HB3 ASN A 124 32.044 -5.038 7.072 1.00 41.54 H new ATOM 0 HD21 ASN A 124 30.991 -6.513 3.715 1.00 12.31 H new ATOM 0 HD22 ASN A 124 30.273 -5.296 4.775 1.00 12.31 H new ATOM 2017 N LYS A 125 30.955 -5.519 10.106 1.00 60.13 N ATOM 2018 CA LYS A 125 31.150 -4.725 11.313 1.00 51.53 C ATOM 2019 C LYS A 125 31.942 -5.506 12.356 1.00 10.43 C ATOM 2020 O LYS A 125 32.811 -4.952 13.031 1.00 33.54 O ATOM 2021 CB LYS A 125 29.799 -4.302 11.894 1.00 75.14 C ATOM 2022 CG LYS A 125 29.896 -3.700 13.285 1.00 71.32 C ATOM 2023 CD LYS A 125 29.631 -4.739 14.362 1.00 75.04 C ATOM 2024 CE LYS A 125 28.142 -5.000 14.529 1.00 15.04 C ATOM 2025 NZ LYS A 125 27.776 -5.231 15.955 1.00 40.45 N ATOM 0 H LYS A 125 29.979 -5.649 9.840 1.00 60.13 H new ATOM 0 HA LYS A 125 31.718 -3.834 11.044 1.00 51.53 H new ATOM 0 HB2 LYS A 125 29.336 -3.576 11.225 1.00 75.14 H new ATOM 0 HB3 LYS A 125 29.140 -5.170 11.928 1.00 75.14 H new ATOM 0 HG2 LYS A 125 30.888 -3.271 13.428 1.00 71.32 H new ATOM 0 HG3 LYS A 125 29.179 -2.885 13.380 1.00 71.32 H new ATOM 0 HD2 LYS A 125 30.138 -5.669 14.105 1.00 75.04 H new ATOM 0 HD3 LYS A 125 30.050 -4.399 15.309 1.00 75.04 H new ATOM 0 HE2 LYS A 125 27.579 -4.151 14.142 1.00 15.04 H new ATOM 0 HE3 LYS A 125 27.857 -5.869 13.935 1.00 15.04 H new ATOM 0 HZ1 LYS A 125 27.165 -6.070 16.025 1.00 40.45 H new ATOM 0 HZ2 LYS A 125 28.639 -5.384 16.515 1.00 40.45 H new ATOM 0 HZ3 LYS A 125 27.268 -4.401 16.322 1.00 40.45 H new ATOM 2039 N ILE A 126 31.638 -6.793 12.482 1.00 54.10 N ATOM 2040 CA ILE A 126 32.323 -7.649 13.441 1.00 25.35 C ATOM 2041 C ILE A 126 33.837 -7.528 13.303 1.00 42.11 C ATOM 2042 O ILE A 126 34.546 -7.322 14.288 1.00 61.44 O ATOM 2043 CB ILE A 126 31.920 -9.125 13.267 1.00 21.44 C ATOM 2044 CG1 ILE A 126 30.407 -9.286 13.428 1.00 51.43 C ATOM 2045 CG2 ILE A 126 32.660 -9.998 14.270 1.00 32.41 C ATOM 2046 CD1 ILE A 126 29.874 -10.585 12.867 1.00 61.43 C ATOM 0 H ILE A 126 30.921 -7.266 11.931 1.00 54.10 H new ATOM 0 HA ILE A 126 32.023 -7.313 14.434 1.00 25.35 H new ATOM 0 HB ILE A 126 32.196 -9.445 12.262 1.00 21.44 H new ATOM 0 HG12 ILE A 126 30.154 -9.226 14.487 1.00 51.43 H new ATOM 0 HG13 ILE A 126 29.907 -8.454 12.933 1.00 51.43 H new ATOM 0 HG21 ILE A 126 32.365 -11.038 14.134 1.00 32.41 H new ATOM 0 HG22 ILE A 126 33.734 -9.902 14.113 1.00 32.41 H new ATOM 0 HG23 ILE A 126 32.412 -9.679 15.282 1.00 32.41 H new ATOM 0 HD11 ILE A 126 28.795 -10.630 13.016 1.00 61.43 H new ATOM 0 HD12 ILE A 126 30.095 -10.639 11.801 1.00 61.43 H new ATOM 0 HD13 ILE A 126 30.347 -11.423 13.379 1.00 61.43 H new ATOM 2058 N MET A 127 34.325 -7.655 12.073 1.00 5.24 N ATOM 2059 CA MET A 127 35.756 -7.556 11.805 1.00 35.05 C ATOM 2060 C MET A 127 36.335 -6.282 12.411 1.00 5.13 C ATOM 2061 O MET A 127 37.471 -6.269 12.889 1.00 75.50 O ATOM 2062 CB MET A 127 36.017 -7.583 10.298 1.00 12.23 C ATOM 2063 CG MET A 127 36.388 -8.959 9.770 1.00 34.12 C ATOM 2064 SD MET A 127 38.152 -9.123 9.437 1.00 70.12 S ATOM 2065 CE MET A 127 38.828 -8.914 11.082 1.00 22.42 C ATOM 0 H MET A 127 33.752 -7.826 11.247 1.00 5.24 H new ATOM 0 HA MET A 127 36.247 -8.412 12.267 1.00 35.05 H new ATOM 0 HB2 MET A 127 35.127 -7.231 9.777 1.00 12.23 H new ATOM 0 HB3 MET A 127 36.820 -6.884 10.064 1.00 12.23 H new ATOM 0 HG2 MET A 127 36.087 -9.715 10.495 1.00 34.12 H new ATOM 0 HG3 MET A 127 35.830 -9.155 8.855 1.00 34.12 H new ATOM 0 HE1 MET A 127 39.915 -8.990 11.041 1.00 22.42 H new ATOM 0 HE2 MET A 127 38.547 -7.935 11.469 1.00 22.42 H new ATOM 0 HE3 MET A 127 38.435 -9.690 11.738 1.00 22.42 H new ATOM 2075 N THR A 128 35.549 -5.210 12.389 1.00 44.14 N ATOM 2076 CA THR A 128 35.985 -3.931 12.934 1.00 44.30 C ATOM 2077 C THR A 128 36.491 -4.086 14.363 1.00 24.35 C ATOM 2078 O THR A 128 37.421 -3.396 14.780 1.00 20.35 O ATOM 2079 CB THR A 128 34.846 -2.894 12.915 1.00 62.13 C ATOM 2080 OG1 THR A 128 34.087 -3.023 11.708 1.00 71.15 O ATOM 2081 CG2 THR A 128 35.399 -1.481 13.024 1.00 55.12 C ATOM 0 H THR A 128 34.606 -5.203 11.999 1.00 44.14 H new ATOM 0 HA THR A 128 36.798 -3.578 12.299 1.00 44.30 H new ATOM 0 HB THR A 128 34.199 -3.081 13.772 1.00 62.13 H new ATOM 0 HG1 THR A 128 33.364 -2.362 11.704 1.00 71.15 H new ATOM 0 HG21 THR A 128 34.576 -0.766 13.008 1.00 55.12 H new ATOM 0 HG22 THR A 128 35.952 -1.378 13.958 1.00 55.12 H new ATOM 0 HG23 THR A 128 36.066 -1.285 12.184 1.00 55.12 H new ATOM 2089 N GLU A 129 35.874 -4.997 15.109 1.00 31.32 N ATOM 2090 CA GLU A 129 36.263 -5.242 16.493 1.00 63.31 C ATOM 2091 C GLU A 129 37.716 -5.703 16.576 1.00 74.10 C ATOM 2092 O GLU A 129 38.452 -5.310 17.480 1.00 62.42 O ATOM 2093 CB GLU A 129 35.347 -6.291 17.126 1.00 72.52 C ATOM 2094 CG GLU A 129 35.771 -6.705 18.525 1.00 74.30 C ATOM 2095 CD GLU A 129 34.682 -7.456 19.266 1.00 34.32 C ATOM 2096 OE1 GLU A 129 34.894 -8.644 19.590 1.00 54.52 O ATOM 2097 OE2 GLU A 129 33.617 -6.856 19.523 1.00 40.21 O ATOM 0 H GLU A 129 35.103 -5.577 14.778 1.00 31.32 H new ATOM 0 HA GLU A 129 36.164 -4.306 17.042 1.00 63.31 H new ATOM 0 HB2 GLU A 129 34.331 -5.898 17.165 1.00 72.52 H new ATOM 0 HB3 GLU A 129 35.323 -7.173 16.487 1.00 72.52 H new ATOM 0 HG2 GLU A 129 36.660 -7.332 18.461 1.00 74.30 H new ATOM 0 HG3 GLU A 129 36.047 -5.818 19.094 1.00 74.30 H new ATOM 2104 N GLY A 130 38.120 -6.540 15.625 1.00 23.13 N ATOM 2105 CA GLY A 130 39.482 -7.042 15.609 1.00 51.30 C ATOM 2106 C GLY A 130 40.417 -6.155 14.810 1.00 31.25 C ATOM 2107 O GLY A 130 41.205 -6.643 14.001 1.00 62.31 O ATOM 0 H GLY A 130 37.529 -6.879 14.866 1.00 23.13 H new ATOM 0 HA2 GLY A 130 39.848 -7.122 16.632 1.00 51.30 H new ATOM 0 HA3 GLY A 130 39.491 -8.047 15.187 1.00 51.30 H new TER 2111 GLY A 130