USER MOD reduce.3.24.130724 H: found=0, std=0, add=1095, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1093 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 59 LYS NZ :NH3+ 168:sc= -2.22! (180deg=-3.7!) USER MOD Set 1.2: A 87 ASN : amide:sc= -4.23! C(o=-6.5!,f=-9.8!) USER MOD Set 2.1: A 54 SER OG : rot 180:sc= -0.768! USER MOD Set 2.2: A 94 THR OG1 : rot -169:sc= -4.24! USER MOD Set 3.1: A 40 GLN : amide:sc= -1.93! X(o=-19!,f=-19) USER MOD Set 3.2: A 89 ASN : amide:sc= -17! C(o=-19!,f=-26!) USER MOD Single : A 1 MET CE :methyl -145:sc= 0 (180deg=-0.0468) USER MOD Single : A 1 MET N :NH3+ 156:sc= 1.4 (180deg=0.845) USER MOD Single : A 2 ASN :FLIP amide:sc= -0.138 F(o=-1.8!,f=-0.14) USER MOD Single : A 3 LYS NZ :NH3+ 171:sc= -0.443 (180deg=-1.15) USER MOD Single : A 7 GLN : amide:sc= 0 X(o=0,f=0.079) USER MOD Single : A 13 SER OG : rot 79:sc= 0.343! USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 CYS SG : rot 180:sc= -0.62 USER MOD Single : A 21 SER OG : rot 66:sc= -1.9! USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot -170:sc= 0.766 USER MOD Single : A 31 CYS SG : rot -20:sc= -14.2! USER MOD Single : A 45 GLN :FLIP amide:sc= -0.369 F(o=-1.4!,f=-0.37) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 180:sc= -2.48 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 55 MET CE :methyl -115:sc=-0.00238 (180deg=-0.483) USER MOD Single : A 61 ASN : amide:sc= -0.0241 X(o=-0.024,f=0) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot -112:sc= 1.28 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 138:sc= -7.2! USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 GLN : amide:sc= -2.57 X(o=-2.6,f=-3!) USER MOD Single : A 85 LYS NZ :NH3+ -179:sc= -3.55! (180deg=-3.76!) USER MOD Single : A 86 THR OG1 : rot 170:sc= -5.18! USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 CYS SG : rot 180:sc= -2.42! USER MOD Single : A 99 GLN : amide:sc= -1.38 K(o=-1.4,f=-7.9!) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0.611 USER MOD Single : A 104 LYS NZ :NH3+ -163:sc= -3.06 (180deg=-4.6!) USER MOD Single : A 113 TYR OH : rot 180:sc= -0.0656 USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 GLN :FLIP amide:sc= -0.771 F(o=-3.4!,f=-0.77) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot -71:sc= 0.568 USER MOD Single : A 125 GLN :FLIP amide:sc= -10.5! C(o=-17!,f=-11!) USER MOD Single : A 126 HIS : no HD1:sc= -1.85 X(o=-1.9,f=-1.7) USER MOD Single : A 129 THR OG1 : rot 52:sc= 0.006 USER MOD Single : A 130 TYR OH : rot 76:sc= 0.954 USER MOD Single : A 131 ASN :FLIP amide:sc= -3.07! C(o=-4.1!,f=-3.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.753 12.516 -17.640 1.00 0.00 N ATOM 2 CA MET A 1 2.736 12.929 -16.680 1.00 0.00 C ATOM 3 C MET A 1 2.789 12.055 -15.431 1.00 0.00 C ATOM 4 O MET A 1 3.592 12.294 -14.528 1.00 0.00 O ATOM 5 CB MET A 1 1.349 12.828 -17.315 1.00 0.00 C ATOM 6 CG MET A 1 1.121 14.025 -18.240 1.00 0.00 C ATOM 7 SD MET A 1 2.015 13.765 -19.794 1.00 0.00 S ATOM 8 CE MET A 1 0.750 12.767 -20.616 1.00 0.00 C ATOM 0 H1 MET A 1 3.467 12.809 -18.596 1.00 0.00 H new ATOM 0 H2 MET A 1 4.660 12.963 -17.398 1.00 0.00 H new ATOM 0 H3 MET A 1 3.858 11.482 -17.611 1.00 0.00 H new ATOM 0 HA MET A 1 2.932 13.962 -16.394 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.262 11.899 -17.878 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.584 12.804 -16.539 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.056 14.149 -18.437 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.465 14.941 -17.759 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.230 12.013 -21.240 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.130 12.276 -19.866 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.127 13.410 -21.238 1.00 0.00 H new ATOM 18 N ASN A 2 1.932 11.042 -15.386 1.00 0.00 N ATOM 19 CA ASN A 2 1.891 10.138 -14.244 1.00 0.00 C ATOM 20 C ASN A 2 3.292 9.633 -13.912 1.00 0.00 C ATOM 21 O ASN A 2 3.815 8.743 -14.582 1.00 0.00 O ATOM 22 CB ASN A 2 0.977 8.949 -14.550 1.00 0.00 C ATOM 23 CG ASN A 2 0.321 8.449 -13.267 1.00 0.00 C ATOM 24 OD1 ASN A 2 0.733 8.903 -12.115 1.00 0.00 O flip ATOM 25 ND2 ASN A 2 -0.592 7.626 -13.316 1.00 0.00 N flip ATOM 0 H ASN A 2 1.260 10.827 -16.123 1.00 0.00 H new ATOM 0 HA ASN A 2 1.500 10.684 -13.386 1.00 0.00 H new ATOM 0 HB2 ASN A 2 0.212 9.244 -15.268 1.00 0.00 H new ATOM 0 HB3 ASN A 2 1.553 8.146 -15.010 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -0.912 7.273 -14.218 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -1.029 7.297 -12.455 1.00 0.00 H new ATOM 32 N LYS A 3 3.892 10.209 -12.876 1.00 0.00 N ATOM 33 CA LYS A 3 5.234 9.811 -12.466 1.00 0.00 C ATOM 34 C LYS A 3 5.178 8.960 -11.200 1.00 0.00 C ATOM 35 O LYS A 3 5.058 7.738 -11.269 1.00 0.00 O ATOM 36 CB LYS A 3 6.094 11.051 -12.215 1.00 0.00 C ATOM 37 CG LYS A 3 6.921 11.359 -13.466 1.00 0.00 C ATOM 38 CD LYS A 3 7.345 12.830 -13.450 1.00 0.00 C ATOM 39 CE LYS A 3 8.145 13.145 -14.715 1.00 0.00 C ATOM 40 NZ LYS A 3 7.677 12.273 -15.829 1.00 0.00 N ATOM 0 H LYS A 3 3.475 10.947 -12.309 1.00 0.00 H new ATOM 0 HA LYS A 3 5.678 9.220 -13.267 1.00 0.00 H new ATOM 0 HB2 LYS A 3 5.460 11.902 -11.966 1.00 0.00 H new ATOM 0 HB3 LYS A 3 6.752 10.884 -11.363 1.00 0.00 H new ATOM 0 HG2 LYS A 3 7.801 10.717 -13.500 1.00 0.00 H new ATOM 0 HG3 LYS A 3 6.337 11.148 -14.362 1.00 0.00 H new ATOM 0 HD2 LYS A 3 6.466 13.472 -13.394 1.00 0.00 H new ATOM 0 HD3 LYS A 3 7.947 13.036 -12.565 1.00 0.00 H new ATOM 0 HE2 LYS A 3 8.022 14.194 -14.984 1.00 0.00 H new ATOM 0 HE3 LYS A 3 9.208 12.984 -14.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 8.109 12.588 -16.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 7.953 11.289 -15.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 6.642 12.333 -15.906 1.00 0.00 H new ATOM 54 N GLU A 4 5.263 9.614 -10.046 1.00 0.00 N ATOM 55 CA GLU A 4 5.218 8.903 -8.774 1.00 0.00 C ATOM 56 C GLU A 4 3.773 8.672 -8.340 1.00 0.00 C ATOM 57 O GLU A 4 2.897 9.499 -8.594 1.00 0.00 O ATOM 58 CB GLU A 4 5.958 9.705 -7.701 1.00 0.00 C ATOM 59 CG GLU A 4 7.466 9.604 -7.932 1.00 0.00 C ATOM 60 CD GLU A 4 8.143 10.906 -7.519 1.00 0.00 C ATOM 61 OE1 GLU A 4 8.168 11.821 -8.327 1.00 0.00 O ATOM 62 OE2 GLU A 4 8.626 10.970 -6.401 1.00 0.00 O ATOM 0 H GLU A 4 5.363 10.626 -9.965 1.00 0.00 H new ATOM 0 HA GLU A 4 5.704 7.936 -8.901 1.00 0.00 H new ATOM 0 HB2 GLU A 4 5.644 10.748 -7.732 1.00 0.00 H new ATOM 0 HB3 GLU A 4 5.706 9.326 -6.711 1.00 0.00 H new ATOM 0 HG2 GLU A 4 7.876 8.773 -7.358 1.00 0.00 H new ATOM 0 HG3 GLU A 4 7.669 9.396 -8.983 1.00 0.00 H new ATOM 69 N LEU A 5 3.532 7.537 -7.690 1.00 0.00 N ATOM 70 CA LEU A 5 2.192 7.197 -7.229 1.00 0.00 C ATOM 71 C LEU A 5 1.683 8.215 -6.213 1.00 0.00 C ATOM 72 O LEU A 5 0.488 8.268 -5.929 1.00 0.00 O ATOM 73 CB LEU A 5 2.171 5.801 -6.599 1.00 0.00 C ATOM 74 CG LEU A 5 1.138 4.906 -7.300 1.00 0.00 C ATOM 75 CD1 LEU A 5 -0.169 5.662 -7.537 1.00 0.00 C ATOM 76 CD2 LEU A 5 1.702 4.423 -8.638 1.00 0.00 C ATOM 0 H LEU A 5 4.245 6.841 -7.472 1.00 0.00 H new ATOM 0 HA LEU A 5 1.537 7.209 -8.100 1.00 0.00 H new ATOM 0 HB2 LEU A 5 3.160 5.349 -6.671 1.00 0.00 H new ATOM 0 HB3 LEU A 5 1.933 5.879 -5.538 1.00 0.00 H new ATOM 0 HG LEU A 5 0.929 4.051 -6.657 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -0.884 5.006 -8.035 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -0.580 5.987 -6.581 1.00 0.00 H new ATOM 0 HD13 LEU A 5 0.023 6.532 -8.165 1.00 0.00 H new ATOM 0 HD21 LEU A 5 0.968 3.788 -9.134 1.00 0.00 H new ATOM 0 HD22 LEU A 5 1.925 5.282 -9.270 1.00 0.00 H new ATOM 0 HD23 LEU A 5 2.615 3.854 -8.464 1.00 0.00 H new ATOM 88 N LEU A 6 2.584 9.005 -5.645 1.00 0.00 N ATOM 89 CA LEU A 6 2.174 9.991 -4.651 1.00 0.00 C ATOM 90 C LEU A 6 1.022 10.847 -5.170 1.00 0.00 C ATOM 91 O LEU A 6 0.671 11.857 -4.560 1.00 0.00 O ATOM 92 CB LEU A 6 3.339 10.901 -4.274 1.00 0.00 C ATOM 93 CG LEU A 6 4.004 11.430 -5.547 1.00 0.00 C ATOM 94 CD1 LEU A 6 3.204 12.612 -6.098 1.00 0.00 C ATOM 95 CD2 LEU A 6 5.430 11.884 -5.224 1.00 0.00 C ATOM 0 H LEU A 6 3.583 8.986 -5.848 1.00 0.00 H new ATOM 0 HA LEU A 6 1.844 9.442 -3.769 1.00 0.00 H new ATOM 0 HB2 LEU A 6 2.983 11.732 -3.664 1.00 0.00 H new ATOM 0 HB3 LEU A 6 4.064 10.352 -3.673 1.00 0.00 H new ATOM 0 HG LEU A 6 4.032 10.637 -6.295 1.00 0.00 H new ATOM 0 HD11 LEU A 6 3.682 12.984 -7.004 1.00 0.00 H new ATOM 0 HD12 LEU A 6 2.189 12.288 -6.330 1.00 0.00 H new ATOM 0 HD13 LEU A 6 3.170 13.407 -5.353 1.00 0.00 H new ATOM 0 HD21 LEU A 6 5.906 12.261 -6.129 1.00 0.00 H new ATOM 0 HD22 LEU A 6 5.399 12.674 -4.474 1.00 0.00 H new ATOM 0 HD23 LEU A 6 6.002 11.040 -4.838 1.00 0.00 H new ATOM 107 N GLN A 7 0.414 10.432 -6.279 1.00 0.00 N ATOM 108 CA GLN A 7 -0.707 11.167 -6.825 1.00 0.00 C ATOM 109 C GLN A 7 -1.833 11.124 -5.805 1.00 0.00 C ATOM 110 O GLN A 7 -2.792 11.892 -5.880 1.00 0.00 O ATOM 111 CB GLN A 7 -1.166 10.533 -8.140 1.00 0.00 C ATOM 112 CG GLN A 7 -2.029 11.532 -8.918 1.00 0.00 C ATOM 113 CD GLN A 7 -3.359 10.886 -9.294 1.00 0.00 C ATOM 114 OE1 GLN A 7 -4.171 10.585 -8.420 1.00 0.00 O ATOM 115 NE2 GLN A 7 -3.631 10.656 -10.550 1.00 0.00 N ATOM 0 H GLN A 7 0.680 9.600 -6.806 1.00 0.00 H new ATOM 0 HA GLN A 7 -0.418 12.198 -7.030 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -0.301 10.242 -8.737 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -1.735 9.625 -7.939 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -2.205 12.422 -8.314 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -1.505 11.856 -9.817 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -2.956 10.907 -11.272 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -4.519 10.226 -10.809 1.00 0.00 H new ATOM 124 N LEU A 8 -1.683 10.230 -4.830 1.00 0.00 N ATOM 125 CA LEU A 8 -2.671 10.103 -3.768 1.00 0.00 C ATOM 126 C LEU A 8 -2.870 11.452 -3.070 1.00 0.00 C ATOM 127 O LEU A 8 -1.939 12.246 -2.962 1.00 0.00 O ATOM 128 CB LEU A 8 -2.207 9.065 -2.745 1.00 0.00 C ATOM 129 CG LEU A 8 -2.749 7.687 -3.128 1.00 0.00 C ATOM 130 CD1 LEU A 8 -2.221 7.293 -4.508 1.00 0.00 C ATOM 131 CD2 LEU A 8 -2.287 6.657 -2.094 1.00 0.00 C ATOM 0 H LEU A 8 -0.893 9.589 -4.756 1.00 0.00 H new ATOM 0 HA LEU A 8 -3.616 9.782 -4.206 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -1.118 9.040 -2.706 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -2.556 9.340 -1.750 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.838 7.719 -3.153 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -2.608 6.311 -4.779 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -2.546 8.027 -5.245 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -1.132 7.260 -4.485 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -2.671 5.673 -2.364 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -1.198 6.627 -2.072 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -2.663 6.936 -1.110 1.00 0.00 H new ATOM 143 N PRO A 9 -4.058 11.717 -2.600 1.00 0.00 N ATOM 144 CA PRO A 9 -4.408 12.993 -1.899 1.00 0.00 C ATOM 145 C PRO A 9 -3.370 13.483 -0.877 1.00 0.00 C ATOM 146 O PRO A 9 -3.441 14.632 -0.441 1.00 0.00 O ATOM 147 CB PRO A 9 -5.715 12.658 -1.185 1.00 0.00 C ATOM 148 CG PRO A 9 -6.353 11.584 -1.997 1.00 0.00 C ATOM 149 CD PRO A 9 -5.226 10.822 -2.698 1.00 0.00 C ATOM 0 HA PRO A 9 -4.465 13.809 -2.619 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -5.529 12.320 -0.166 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -6.360 13.534 -1.118 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -6.934 10.915 -1.362 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -7.042 12.010 -2.726 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -5.034 9.864 -2.214 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -5.477 10.610 -3.737 1.00 0.00 H new ATOM 157 N LEU A 10 -2.450 12.622 -0.452 1.00 0.00 N ATOM 158 CA LEU A 10 -1.480 13.036 0.572 1.00 0.00 C ATOM 159 C LEU A 10 -0.740 14.304 0.184 1.00 0.00 C ATOM 160 O LEU A 10 -0.629 15.227 0.989 1.00 0.00 O ATOM 161 CB LEU A 10 -0.432 11.968 0.885 1.00 0.00 C ATOM 162 CG LEU A 10 -0.389 10.875 -0.180 1.00 0.00 C ATOM 163 CD1 LEU A 10 0.764 11.185 -1.133 1.00 0.00 C ATOM 164 CD2 LEU A 10 -0.180 9.519 0.508 1.00 0.00 C ATOM 0 H LEU A 10 -2.351 11.663 -0.784 1.00 0.00 H new ATOM 0 HA LEU A 10 -2.089 13.208 1.459 1.00 0.00 H new ATOM 0 HB2 LEU A 10 0.549 12.436 0.963 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -0.650 11.520 1.855 1.00 0.00 H new ATOM 0 HG LEU A 10 -1.321 10.837 -0.744 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.815 10.417 -1.904 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.600 12.157 -1.599 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.701 11.203 -0.577 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -0.148 8.731 -0.244 1.00 0.00 H new ATOM 0 HD22 LEU A 10 0.760 9.532 1.060 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -1.003 9.330 1.197 1.00 0.00 H new ATOM 176 N PHE A 11 -0.220 14.346 -1.028 1.00 0.00 N ATOM 177 CA PHE A 11 0.520 15.520 -1.461 1.00 0.00 C ATOM 178 C PHE A 11 -0.386 16.494 -2.212 1.00 0.00 C ATOM 179 O PHE A 11 -0.236 17.711 -2.098 1.00 0.00 O ATOM 180 CB PHE A 11 1.706 15.138 -2.343 1.00 0.00 C ATOM 181 CG PHE A 11 1.215 14.996 -3.757 1.00 0.00 C ATOM 182 CD1 PHE A 11 0.115 14.194 -3.987 1.00 0.00 C ATOM 183 CD2 PHE A 11 1.828 15.675 -4.819 1.00 0.00 C ATOM 184 CE1 PHE A 11 -0.397 14.051 -5.278 1.00 0.00 C ATOM 185 CE2 PHE A 11 1.325 15.532 -6.119 1.00 0.00 C ATOM 186 CZ PHE A 11 0.210 14.718 -6.348 1.00 0.00 C ATOM 0 H PHE A 11 -0.292 13.599 -1.719 1.00 0.00 H new ATOM 0 HA PHE A 11 0.898 16.009 -0.563 1.00 0.00 H new ATOM 0 HB2 PHE A 11 2.483 15.900 -2.285 1.00 0.00 H new ATOM 0 HB3 PHE A 11 2.150 14.204 -1.999 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -0.352 13.674 -3.164 1.00 0.00 H new ATOM 0 HD2 PHE A 11 2.685 16.306 -4.636 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -1.261 13.426 -5.451 1.00 0.00 H new ATOM 0 HE2 PHE A 11 1.797 16.049 -6.942 1.00 0.00 H new ATOM 0 HZ PHE A 11 -0.181 14.605 -7.348 1.00 0.00 H new ATOM 196 N GLU A 12 -1.325 15.948 -2.980 1.00 0.00 N ATOM 197 CA GLU A 12 -2.249 16.770 -3.748 1.00 0.00 C ATOM 198 C GLU A 12 -2.949 17.777 -2.846 1.00 0.00 C ATOM 199 O GLU A 12 -3.145 18.933 -3.222 1.00 0.00 O ATOM 200 CB GLU A 12 -3.282 15.889 -4.434 1.00 0.00 C ATOM 201 CG GLU A 12 -3.474 16.382 -5.861 1.00 0.00 C ATOM 202 CD GLU A 12 -3.638 17.899 -5.871 1.00 0.00 C ATOM 203 OE1 GLU A 12 -4.732 18.357 -5.589 1.00 0.00 O ATOM 204 OE2 GLU A 12 -2.667 18.579 -6.159 1.00 0.00 O ATOM 0 H GLU A 12 -1.464 14.943 -3.085 1.00 0.00 H new ATOM 0 HA GLU A 12 -1.681 17.314 -4.502 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -2.952 14.850 -4.434 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -4.227 15.923 -3.892 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -2.617 16.096 -6.472 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -4.352 15.910 -6.303 1.00 0.00 H new ATOM 211 N SER A 13 -3.317 17.331 -1.651 1.00 0.00 N ATOM 212 CA SER A 13 -3.988 18.203 -0.698 1.00 0.00 C ATOM 213 C SER A 13 -2.967 18.894 0.196 1.00 0.00 C ATOM 214 O SER A 13 -3.325 19.543 1.178 1.00 0.00 O ATOM 215 CB SER A 13 -4.958 17.392 0.160 1.00 0.00 C ATOM 216 OG SER A 13 -5.112 16.095 -0.403 1.00 0.00 O ATOM 0 H SER A 13 -3.163 16.378 -1.322 1.00 0.00 H new ATOM 0 HA SER A 13 -4.544 18.960 -1.251 1.00 0.00 H new ATOM 0 HB2 SER A 13 -4.583 17.316 1.180 1.00 0.00 H new ATOM 0 HB3 SER A 13 -5.923 17.895 0.212 1.00 0.00 H new ATOM 0 HG SER A 13 -4.342 15.539 -0.160 1.00 0.00 H new ATOM 222 N ALA A 14 -1.690 18.753 -0.152 1.00 0.00 N ATOM 223 CA ALA A 14 -0.627 19.366 0.621 1.00 0.00 C ATOM 224 C ALA A 14 0.120 20.376 -0.221 1.00 0.00 C ATOM 225 O ALA A 14 0.070 20.332 -1.450 1.00 0.00 O ATOM 226 CB ALA A 14 0.369 18.300 1.068 1.00 0.00 C ATOM 0 H ALA A 14 -1.373 18.221 -0.962 1.00 0.00 H new ATOM 0 HA ALA A 14 -1.075 19.857 1.484 1.00 0.00 H new ATOM 0 HB1 ALA A 14 1.165 18.766 1.648 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -0.142 17.559 1.683 1.00 0.00 H new ATOM 0 HB3 ALA A 14 0.797 17.812 0.192 1.00 0.00 H new ATOM 232 N SER A 15 0.850 21.255 0.439 1.00 0.00 N ATOM 233 CA SER A 15 1.638 22.225 -0.280 1.00 0.00 C ATOM 234 C SER A 15 2.729 21.475 -1.028 1.00 0.00 C ATOM 235 O SER A 15 3.248 20.461 -0.541 1.00 0.00 O ATOM 236 CB SER A 15 2.262 23.230 0.688 1.00 0.00 C ATOM 237 OG SER A 15 2.829 24.304 -0.050 1.00 0.00 O ATOM 0 H SER A 15 0.911 21.314 1.455 1.00 0.00 H new ATOM 0 HA SER A 15 1.008 22.778 -0.976 1.00 0.00 H new ATOM 0 HB2 SER A 15 1.506 23.606 1.377 1.00 0.00 H new ATOM 0 HB3 SER A 15 3.029 22.743 1.291 1.00 0.00 H new ATOM 0 HG SER A 15 3.228 24.951 0.568 1.00 0.00 H new ATOM 243 N ARG A 16 3.080 21.944 -2.206 1.00 0.00 N ATOM 244 CA ARG A 16 4.108 21.258 -2.951 1.00 0.00 C ATOM 245 C ARG A 16 5.250 20.955 -2.000 1.00 0.00 C ATOM 246 O ARG A 16 6.072 20.072 -2.248 1.00 0.00 O ATOM 247 CB ARG A 16 4.594 22.110 -4.120 1.00 0.00 C ATOM 248 CG ARG A 16 4.093 21.503 -5.430 1.00 0.00 C ATOM 249 CD ARG A 16 2.596 21.780 -5.583 1.00 0.00 C ATOM 250 NE ARG A 16 2.150 21.423 -6.926 1.00 0.00 N ATOM 251 CZ ARG A 16 0.857 21.339 -7.219 1.00 0.00 C ATOM 252 NH1 ARG A 16 -0.038 21.573 -6.298 1.00 0.00 N ATOM 253 NH2 ARG A 16 0.481 21.021 -8.428 1.00 0.00 N ATOM 0 H ARG A 16 2.683 22.769 -2.655 1.00 0.00 H new ATOM 0 HA ARG A 16 3.710 20.333 -3.369 1.00 0.00 H new ATOM 0 HB2 ARG A 16 4.229 23.132 -4.016 1.00 0.00 H new ATOM 0 HB3 ARG A 16 5.683 22.159 -4.121 1.00 0.00 H new ATOM 0 HG2 ARG A 16 4.640 21.927 -6.272 1.00 0.00 H new ATOM 0 HG3 ARG A 16 4.277 20.429 -5.439 1.00 0.00 H new ATOM 0 HD2 ARG A 16 2.036 21.209 -4.843 1.00 0.00 H new ATOM 0 HD3 ARG A 16 2.393 22.834 -5.393 1.00 0.00 H new ATOM 0 HE ARG A 16 2.842 21.235 -7.651 1.00 0.00 H new ATOM 0 HH11 ARG A 16 0.255 21.820 -5.353 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -1.031 21.508 -6.523 1.00 0.00 H new ATOM 0 HH21 ARG A 16 1.180 20.837 -9.148 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -0.512 20.956 -8.653 1.00 0.00 H new ATOM 267 N GLY A 17 5.272 21.691 -0.893 1.00 0.00 N ATOM 268 CA GLY A 17 6.292 21.496 0.121 1.00 0.00 C ATOM 269 C GLY A 17 6.243 20.067 0.644 1.00 0.00 C ATOM 270 O GLY A 17 7.282 19.449 0.862 1.00 0.00 O ATOM 0 H GLY A 17 4.596 22.424 -0.680 1.00 0.00 H new ATOM 0 HA2 GLY A 17 7.277 21.705 -0.298 1.00 0.00 H new ATOM 0 HA3 GLY A 17 6.139 22.197 0.941 1.00 0.00 H new ATOM 274 N CYS A 18 5.032 19.531 0.825 1.00 0.00 N ATOM 275 CA CYS A 18 4.896 18.160 1.299 1.00 0.00 C ATOM 276 C CYS A 18 5.359 17.218 0.217 1.00 0.00 C ATOM 277 O CYS A 18 5.893 16.152 0.501 1.00 0.00 O ATOM 278 CB CYS A 18 3.439 17.846 1.650 1.00 0.00 C ATOM 279 SG CYS A 18 3.367 17.067 3.282 1.00 0.00 S ATOM 0 H CYS A 18 4.152 20.017 0.653 1.00 0.00 H new ATOM 0 HA CYS A 18 5.503 18.038 2.196 1.00 0.00 H new ATOM 0 HB2 CYS A 18 2.847 18.761 1.646 1.00 0.00 H new ATOM 0 HB3 CYS A 18 3.007 17.184 0.900 1.00 0.00 H new ATOM 0 HG CYS A 18 2.130 16.802 3.582 1.00 0.00 H new ATOM 285 N LEU A 19 5.164 17.620 -1.028 1.00 0.00 N ATOM 286 CA LEU A 19 5.594 16.783 -2.134 1.00 0.00 C ATOM 287 C LEU A 19 7.115 16.719 -2.136 1.00 0.00 C ATOM 288 O LEU A 19 7.707 15.672 -2.399 1.00 0.00 O ATOM 289 CB LEU A 19 5.072 17.336 -3.456 1.00 0.00 C ATOM 290 CG LEU A 19 5.406 16.362 -4.591 1.00 0.00 C ATOM 291 CD1 LEU A 19 4.928 14.948 -4.233 1.00 0.00 C ATOM 292 CD2 LEU A 19 4.716 16.821 -5.879 1.00 0.00 C ATOM 0 H LEU A 19 4.721 18.500 -1.294 1.00 0.00 H new ATOM 0 HA LEU A 19 5.190 15.778 -2.015 1.00 0.00 H new ATOM 0 HB2 LEU A 19 3.994 17.486 -3.398 1.00 0.00 H new ATOM 0 HB3 LEU A 19 5.519 18.310 -3.656 1.00 0.00 H new ATOM 0 HG LEU A 19 6.486 16.347 -4.737 1.00 0.00 H new ATOM 0 HD11 LEU A 19 5.171 14.265 -5.047 1.00 0.00 H new ATOM 0 HD12 LEU A 19 5.424 14.616 -3.321 1.00 0.00 H new ATOM 0 HD13 LEU A 19 3.849 14.957 -4.077 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.954 16.128 -6.686 1.00 0.00 H new ATOM 0 HD22 LEU A 19 3.637 16.843 -5.726 1.00 0.00 H new ATOM 0 HD23 LEU A 19 5.065 17.819 -6.143 1.00 0.00 H new ATOM 304 N ARG A 20 7.736 17.841 -1.788 1.00 0.00 N ATOM 305 CA ARG A 20 9.187 17.909 -1.693 1.00 0.00 C ATOM 306 C ARG A 20 9.613 17.066 -0.510 1.00 0.00 C ATOM 307 O ARG A 20 10.590 16.325 -0.555 1.00 0.00 O ATOM 308 CB ARG A 20 9.610 19.353 -1.467 1.00 0.00 C ATOM 309 CG ARG A 20 9.279 20.164 -2.708 1.00 0.00 C ATOM 310 CD ARG A 20 10.111 19.658 -3.886 1.00 0.00 C ATOM 311 NE ARG A 20 11.397 19.155 -3.415 1.00 0.00 N ATOM 312 CZ ARG A 20 12.519 19.380 -4.093 1.00 0.00 C ATOM 313 NH1 ARG A 20 12.487 20.056 -5.209 1.00 0.00 N ATOM 314 NH2 ARG A 20 13.655 18.922 -3.642 1.00 0.00 N ATOM 0 H ARG A 20 7.257 18.714 -1.568 1.00 0.00 H new ATOM 0 HA ARG A 20 9.650 17.543 -2.609 1.00 0.00 H new ATOM 0 HB2 ARG A 20 9.095 19.765 -0.599 1.00 0.00 H new ATOM 0 HB3 ARG A 20 10.678 19.404 -1.257 1.00 0.00 H new ATOM 0 HG2 ARG A 20 8.217 20.080 -2.937 1.00 0.00 H new ATOM 0 HG3 ARG A 20 9.485 21.220 -2.531 1.00 0.00 H new ATOM 0 HD2 ARG A 20 9.572 18.867 -4.408 1.00 0.00 H new ATOM 0 HD3 ARG A 20 10.268 20.464 -4.603 1.00 0.00 H new ATOM 0 HE ARG A 20 11.436 18.620 -2.548 1.00 0.00 H new ATOM 0 HH11 ARG A 20 11.600 20.413 -5.563 1.00 0.00 H new ATOM 0 HH12 ARG A 20 13.349 20.227 -5.727 1.00 0.00 H new ATOM 0 HH21 ARG A 20 13.682 18.392 -2.771 1.00 0.00 H new ATOM 0 HH22 ARG A 20 14.516 19.094 -4.161 1.00 0.00 H new ATOM 328 N SER A 21 8.821 17.185 0.538 1.00 0.00 N ATOM 329 CA SER A 21 9.021 16.441 1.765 1.00 0.00 C ATOM 330 C SER A 21 8.988 14.942 1.461 1.00 0.00 C ATOM 331 O SER A 21 9.934 14.207 1.775 1.00 0.00 O ATOM 332 CB SER A 21 7.899 16.856 2.720 1.00 0.00 C ATOM 333 OG SER A 21 7.745 18.268 2.660 1.00 0.00 O ATOM 0 H SER A 21 8.013 17.807 0.561 1.00 0.00 H new ATOM 0 HA SER A 21 9.988 16.652 2.222 1.00 0.00 H new ATOM 0 HB2 SER A 21 6.967 16.363 2.444 1.00 0.00 H new ATOM 0 HB3 SER A 21 8.135 16.545 3.738 1.00 0.00 H new ATOM 0 HG SER A 21 7.420 18.524 1.772 1.00 0.00 H new ATOM 339 N LEU A 22 7.931 14.494 0.808 1.00 0.00 N ATOM 340 CA LEU A 22 7.824 13.088 0.456 1.00 0.00 C ATOM 341 C LEU A 22 8.969 12.682 -0.458 1.00 0.00 C ATOM 342 O LEU A 22 9.695 11.730 -0.178 1.00 0.00 O ATOM 343 CB LEU A 22 6.508 12.821 -0.267 1.00 0.00 C ATOM 344 CG LEU A 22 5.666 11.846 0.548 1.00 0.00 C ATOM 345 CD1 LEU A 22 5.224 12.507 1.845 1.00 0.00 C ATOM 346 CD2 LEU A 22 4.437 11.458 -0.253 1.00 0.00 C ATOM 0 H LEU A 22 7.144 15.073 0.514 1.00 0.00 H new ATOM 0 HA LEU A 22 7.864 12.507 1.377 1.00 0.00 H new ATOM 0 HB2 LEU A 22 5.964 13.755 -0.411 1.00 0.00 H new ATOM 0 HB3 LEU A 22 6.702 12.410 -1.257 1.00 0.00 H new ATOM 0 HG LEU A 22 6.259 10.960 0.775 1.00 0.00 H new ATOM 0 HD11 LEU A 22 4.623 11.806 2.424 1.00 0.00 H new ATOM 0 HD12 LEU A 22 6.101 12.796 2.423 1.00 0.00 H new ATOM 0 HD13 LEU A 22 4.631 13.393 1.618 1.00 0.00 H new ATOM 0 HD21 LEU A 22 3.831 10.761 0.325 1.00 0.00 H new ATOM 0 HD22 LEU A 22 3.851 12.350 -0.475 1.00 0.00 H new ATOM 0 HD23 LEU A 22 4.745 10.984 -1.185 1.00 0.00 H new ATOM 358 N SER A 23 9.114 13.406 -1.562 1.00 0.00 N ATOM 359 CA SER A 23 10.160 13.097 -2.514 1.00 0.00 C ATOM 360 C SER A 23 11.517 13.089 -1.842 1.00 0.00 C ATOM 361 O SER A 23 12.410 12.339 -2.240 1.00 0.00 O ATOM 362 CB SER A 23 10.111 14.043 -3.700 1.00 0.00 C ATOM 363 OG SER A 23 11.435 14.348 -4.122 1.00 0.00 O ATOM 0 H SER A 23 8.526 14.200 -1.813 1.00 0.00 H new ATOM 0 HA SER A 23 9.989 12.092 -2.901 1.00 0.00 H new ATOM 0 HB2 SER A 23 9.553 13.588 -4.518 1.00 0.00 H new ATOM 0 HB3 SER A 23 9.586 14.958 -3.427 1.00 0.00 H new ATOM 0 HG SER A 23 11.402 14.957 -4.889 1.00 0.00 H new ATOM 369 N LEU A 24 11.663 13.884 -0.795 1.00 0.00 N ATOM 370 CA LEU A 24 12.910 13.899 -0.062 1.00 0.00 C ATOM 371 C LEU A 24 13.172 12.500 0.481 1.00 0.00 C ATOM 372 O LEU A 24 14.320 12.077 0.612 1.00 0.00 O ATOM 373 CB LEU A 24 12.834 14.901 1.083 1.00 0.00 C ATOM 374 CG LEU A 24 13.805 16.051 0.812 1.00 0.00 C ATOM 375 CD1 LEU A 24 15.245 15.544 0.925 1.00 0.00 C ATOM 376 CD2 LEU A 24 13.568 16.609 -0.596 1.00 0.00 C ATOM 0 H LEU A 24 10.945 14.516 -0.441 1.00 0.00 H new ATOM 0 HA LEU A 24 13.724 14.197 -0.723 1.00 0.00 H new ATOM 0 HB2 LEU A 24 11.818 15.283 1.181 1.00 0.00 H new ATOM 0 HB3 LEU A 24 13.083 14.414 2.026 1.00 0.00 H new ATOM 0 HG LEU A 24 13.639 16.841 1.545 1.00 0.00 H new ATOM 0 HD11 LEU A 24 15.936 16.365 0.732 1.00 0.00 H new ATOM 0 HD12 LEU A 24 15.416 15.155 1.929 1.00 0.00 H new ATOM 0 HD13 LEU A 24 15.410 14.751 0.195 1.00 0.00 H new ATOM 0 HD21 LEU A 24 14.262 17.428 -0.784 1.00 0.00 H new ATOM 0 HD22 LEU A 24 13.729 15.821 -1.332 1.00 0.00 H new ATOM 0 HD23 LEU A 24 12.544 16.975 -0.675 1.00 0.00 H new ATOM 388 N ILE A 25 12.088 11.781 0.791 1.00 0.00 N ATOM 389 CA ILE A 25 12.218 10.421 1.316 1.00 0.00 C ATOM 390 C ILE A 25 11.496 9.383 0.451 1.00 0.00 C ATOM 391 O ILE A 25 11.141 8.310 0.939 1.00 0.00 O ATOM 392 CB ILE A 25 11.671 10.337 2.737 1.00 0.00 C ATOM 393 CG1 ILE A 25 12.280 9.112 3.423 1.00 0.00 C ATOM 394 CG2 ILE A 25 10.160 10.150 2.693 1.00 0.00 C ATOM 395 CD1 ILE A 25 13.191 9.549 4.569 1.00 0.00 C ATOM 0 H ILE A 25 11.128 12.111 0.690 1.00 0.00 H new ATOM 0 HA ILE A 25 13.284 10.193 1.306 1.00 0.00 H new ATOM 0 HB ILE A 25 11.919 11.251 3.277 1.00 0.00 H new ATOM 0 HG12 ILE A 25 11.488 8.468 3.804 1.00 0.00 H new ATOM 0 HG13 ILE A 25 12.848 8.526 2.700 1.00 0.00 H new ATOM 0 HG21 ILE A 25 9.771 10.090 3.709 1.00 0.00 H new ATOM 0 HG22 ILE A 25 9.704 10.996 2.179 1.00 0.00 H new ATOM 0 HG23 ILE A 25 9.923 9.230 2.159 1.00 0.00 H new ATOM 0 HD11 ILE A 25 13.619 8.669 5.050 1.00 0.00 H new ATOM 0 HD12 ILE A 25 13.993 10.175 4.178 1.00 0.00 H new ATOM 0 HD13 ILE A 25 12.612 10.115 5.298 1.00 0.00 H new ATOM 407 N ILE A 26 11.267 9.696 -0.818 1.00 0.00 N ATOM 408 CA ILE A 26 10.581 8.785 -1.705 1.00 0.00 C ATOM 409 C ILE A 26 11.411 7.524 -1.946 1.00 0.00 C ATOM 410 O ILE A 26 12.604 7.602 -2.240 1.00 0.00 O ATOM 411 CB ILE A 26 10.326 9.511 -3.030 1.00 0.00 C ATOM 412 CG1 ILE A 26 8.896 10.049 -3.072 1.00 0.00 C ATOM 413 CG2 ILE A 26 10.530 8.568 -4.194 1.00 0.00 C ATOM 414 CD1 ILE A 26 7.923 8.905 -3.240 1.00 0.00 C ATOM 0 H ILE A 26 11.549 10.576 -1.250 1.00 0.00 H new ATOM 0 HA ILE A 26 9.639 8.476 -1.253 1.00 0.00 H new ATOM 0 HB ILE A 26 11.031 10.339 -3.105 1.00 0.00 H new ATOM 0 HG12 ILE A 26 8.676 10.594 -2.154 1.00 0.00 H new ATOM 0 HG13 ILE A 26 8.787 10.755 -3.896 1.00 0.00 H new ATOM 0 HG21 ILE A 26 10.345 9.098 -5.128 1.00 0.00 H new ATOM 0 HG22 ILE A 26 11.554 8.195 -4.185 1.00 0.00 H new ATOM 0 HG23 ILE A 26 9.838 7.730 -4.109 1.00 0.00 H new ATOM 0 HD11 ILE A 26 6.905 9.294 -3.269 1.00 0.00 H new ATOM 0 HD12 ILE A 26 8.137 8.379 -4.170 1.00 0.00 H new ATOM 0 HD13 ILE A 26 8.024 8.216 -2.402 1.00 0.00 H new ATOM 426 N LYS A 27 10.766 6.365 -1.840 1.00 0.00 N ATOM 427 CA LYS A 27 11.457 5.099 -2.075 1.00 0.00 C ATOM 428 C LYS A 27 10.782 4.332 -3.211 1.00 0.00 C ATOM 429 O LYS A 27 9.572 4.442 -3.407 1.00 0.00 O ATOM 430 CB LYS A 27 11.469 4.260 -0.800 1.00 0.00 C ATOM 431 CG LYS A 27 12.906 3.831 -0.496 1.00 0.00 C ATOM 432 CD LYS A 27 13.659 4.975 0.190 1.00 0.00 C ATOM 433 CE LYS A 27 14.796 4.400 1.037 1.00 0.00 C ATOM 434 NZ LYS A 27 15.730 5.495 1.425 1.00 0.00 N ATOM 0 H LYS A 27 9.780 6.275 -1.596 1.00 0.00 H new ATOM 0 HA LYS A 27 12.487 5.310 -2.362 1.00 0.00 H new ATOM 0 HB2 LYS A 27 11.064 4.836 0.033 1.00 0.00 H new ATOM 0 HB3 LYS A 27 10.833 3.383 -0.921 1.00 0.00 H new ATOM 0 HG2 LYS A 27 12.903 2.950 0.146 1.00 0.00 H new ATOM 0 HG3 LYS A 27 13.414 3.552 -1.419 1.00 0.00 H new ATOM 0 HD2 LYS A 27 14.058 5.661 -0.557 1.00 0.00 H new ATOM 0 HD3 LYS A 27 12.977 5.549 0.818 1.00 0.00 H new ATOM 0 HE2 LYS A 27 14.393 3.919 1.928 1.00 0.00 H new ATOM 0 HE3 LYS A 27 15.330 3.634 0.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 16.503 5.104 2.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 16.124 5.935 0.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 15.215 6.211 1.976 1.00 0.00 H new ATOM 448 N THR A 28 11.567 3.566 -3.968 1.00 0.00 N ATOM 449 CA THR A 28 11.015 2.805 -5.089 1.00 0.00 C ATOM 450 C THR A 28 11.518 1.361 -5.089 1.00 0.00 C ATOM 451 O THR A 28 12.722 1.110 -5.093 1.00 0.00 O ATOM 452 CB THR A 28 11.405 3.474 -6.409 1.00 0.00 C ATOM 453 OG1 THR A 28 12.715 4.012 -6.297 1.00 0.00 O ATOM 454 CG2 THR A 28 10.417 4.596 -6.728 1.00 0.00 C ATOM 0 H THR A 28 12.572 3.456 -3.829 1.00 0.00 H new ATOM 0 HA THR A 28 9.931 2.790 -4.980 1.00 0.00 H new ATOM 0 HB THR A 28 11.382 2.735 -7.210 1.00 0.00 H new ATOM 0 HG1 THR A 28 12.967 4.439 -7.142 1.00 0.00 H new ATOM 0 HG21 THR A 28 10.697 5.071 -7.668 1.00 0.00 H new ATOM 0 HG22 THR A 28 9.412 4.182 -6.815 1.00 0.00 H new ATOM 0 HG23 THR A 28 10.436 5.336 -5.928 1.00 0.00 H new ATOM 462 N SER A 29 10.578 0.418 -5.099 1.00 0.00 N ATOM 463 CA SER A 29 10.925 -1.001 -5.114 1.00 0.00 C ATOM 464 C SER A 29 10.422 -1.642 -6.407 1.00 0.00 C ATOM 465 O SER A 29 9.401 -1.226 -6.954 1.00 0.00 O ATOM 466 CB SER A 29 10.302 -1.709 -3.907 1.00 0.00 C ATOM 467 OG SER A 29 8.923 -1.374 -3.828 1.00 0.00 O ATOM 0 H SER A 29 9.576 0.609 -5.097 1.00 0.00 H new ATOM 0 HA SER A 29 12.009 -1.101 -5.061 1.00 0.00 H new ATOM 0 HB2 SER A 29 10.421 -2.788 -4.002 1.00 0.00 H new ATOM 0 HB3 SER A 29 10.814 -1.411 -2.992 1.00 0.00 H new ATOM 0 HG SER A 29 8.557 -1.695 -2.978 1.00 0.00 H new ATOM 473 N PHE A 30 11.143 -2.644 -6.901 1.00 0.00 N ATOM 474 CA PHE A 30 10.745 -3.310 -8.141 1.00 0.00 C ATOM 475 C PHE A 30 10.734 -4.829 -7.981 1.00 0.00 C ATOM 476 O PHE A 30 11.552 -5.393 -7.253 1.00 0.00 O ATOM 477 CB PHE A 30 11.704 -2.926 -9.272 1.00 0.00 C ATOM 478 CG PHE A 30 12.911 -2.222 -8.698 1.00 0.00 C ATOM 479 CD1 PHE A 30 13.834 -2.933 -7.923 1.00 0.00 C ATOM 480 CD2 PHE A 30 13.108 -0.858 -8.945 1.00 0.00 C ATOM 481 CE1 PHE A 30 14.954 -2.279 -7.394 1.00 0.00 C ATOM 482 CE2 PHE A 30 14.227 -0.205 -8.417 1.00 0.00 C ATOM 483 CZ PHE A 30 15.151 -0.916 -7.641 1.00 0.00 C ATOM 0 H PHE A 30 11.993 -3.010 -6.472 1.00 0.00 H new ATOM 0 HA PHE A 30 9.734 -2.983 -8.384 1.00 0.00 H new ATOM 0 HB2 PHE A 30 12.016 -3.818 -9.816 1.00 0.00 H new ATOM 0 HB3 PHE A 30 11.198 -2.277 -9.987 1.00 0.00 H new ATOM 0 HD1 PHE A 30 13.683 -3.985 -7.733 1.00 0.00 H new ATOM 0 HD2 PHE A 30 12.396 -0.310 -9.544 1.00 0.00 H new ATOM 0 HE1 PHE A 30 15.666 -2.827 -6.795 1.00 0.00 H new ATOM 0 HE2 PHE A 30 14.378 0.847 -8.608 1.00 0.00 H new ATOM 0 HZ PHE A 30 16.015 -0.412 -7.233 1.00 0.00 H new ATOM 493 N CYS A 31 9.805 -5.484 -8.676 1.00 0.00 N ATOM 494 CA CYS A 31 9.699 -6.941 -8.615 1.00 0.00 C ATOM 495 C CYS A 31 9.590 -7.530 -10.017 1.00 0.00 C ATOM 496 O CYS A 31 9.123 -6.870 -10.946 1.00 0.00 O ATOM 497 CB CYS A 31 8.479 -7.361 -7.797 1.00 0.00 C ATOM 498 SG CYS A 31 8.437 -6.431 -6.246 1.00 0.00 S ATOM 0 H CYS A 31 9.120 -5.033 -9.283 1.00 0.00 H new ATOM 0 HA CYS A 31 10.601 -7.320 -8.134 1.00 0.00 H new ATOM 0 HB2 CYS A 31 7.567 -7.179 -8.366 1.00 0.00 H new ATOM 0 HB3 CYS A 31 8.518 -8.430 -7.590 1.00 0.00 H new ATOM 0 HG CYS A 31 9.622 -5.961 -5.989 1.00 0.00 H new ATOM 504 N ALA A 32 10.035 -8.773 -10.163 1.00 0.00 N ATOM 505 CA ALA A 32 9.998 -9.446 -11.456 1.00 0.00 C ATOM 506 C ALA A 32 9.089 -10.674 -11.405 1.00 0.00 C ATOM 507 O ALA A 32 8.664 -11.095 -10.329 1.00 0.00 O ATOM 508 CB ALA A 32 11.412 -9.883 -11.832 1.00 0.00 C ATOM 0 H ALA A 32 10.424 -9.333 -9.405 1.00 0.00 H new ATOM 0 HA ALA A 32 9.604 -8.753 -12.200 1.00 0.00 H new ATOM 0 HB1 ALA A 32 11.392 -10.387 -12.798 1.00 0.00 H new ATOM 0 HB2 ALA A 32 12.059 -9.008 -11.893 1.00 0.00 H new ATOM 0 HB3 ALA A 32 11.795 -10.566 -11.074 1.00 0.00 H new ATOM 514 N PRO A 33 8.799 -11.266 -12.539 1.00 0.00 N ATOM 515 CA PRO A 33 7.943 -12.486 -12.605 1.00 0.00 C ATOM 516 C PRO A 33 8.554 -13.630 -11.805 1.00 0.00 C ATOM 517 O PRO A 33 9.718 -13.982 -12.003 1.00 0.00 O ATOM 518 CB PRO A 33 7.888 -12.836 -14.097 1.00 0.00 C ATOM 519 CG PRO A 33 8.330 -11.610 -14.824 1.00 0.00 C ATOM 520 CD PRO A 33 9.247 -10.841 -13.876 1.00 0.00 C ATOM 0 HA PRO A 33 6.954 -12.316 -12.180 1.00 0.00 H new ATOM 0 HB2 PRO A 33 8.539 -13.680 -14.324 1.00 0.00 H new ATOM 0 HB3 PRO A 33 6.879 -13.123 -14.393 1.00 0.00 H new ATOM 0 HG2 PRO A 33 8.856 -11.873 -15.742 1.00 0.00 H new ATOM 0 HG3 PRO A 33 7.473 -11.001 -15.111 1.00 0.00 H new ATOM 0 HD2 PRO A 33 10.295 -11.088 -14.045 1.00 0.00 H new ATOM 0 HD3 PRO A 33 9.148 -9.764 -14.008 1.00 0.00 H new ATOM 528 N GLY A 34 7.777 -14.204 -10.896 1.00 0.00 N ATOM 529 CA GLY A 34 8.275 -15.296 -10.074 1.00 0.00 C ATOM 530 C GLY A 34 9.298 -14.781 -9.069 1.00 0.00 C ATOM 531 O GLY A 34 9.903 -15.559 -8.331 1.00 0.00 O ATOM 0 H GLY A 34 6.811 -13.935 -10.711 1.00 0.00 H new ATOM 0 HA2 GLY A 34 7.447 -15.771 -9.548 1.00 0.00 H new ATOM 0 HA3 GLY A 34 8.730 -16.058 -10.707 1.00 0.00 H new ATOM 535 N GLU A 35 9.502 -13.463 -9.057 1.00 0.00 N ATOM 536 CA GLU A 35 10.470 -12.858 -8.149 1.00 0.00 C ATOM 537 C GLU A 35 9.931 -12.795 -6.723 1.00 0.00 C ATOM 538 O GLU A 35 8.826 -12.318 -6.487 1.00 0.00 O ATOM 539 CB GLU A 35 10.821 -11.460 -8.633 1.00 0.00 C ATOM 540 CG GLU A 35 12.244 -11.099 -8.220 1.00 0.00 C ATOM 541 CD GLU A 35 12.230 -10.344 -6.894 1.00 0.00 C ATOM 542 OE1 GLU A 35 11.165 -10.226 -6.313 1.00 0.00 O ATOM 543 OE2 GLU A 35 13.287 -9.895 -6.480 1.00 0.00 O ATOM 0 H GLU A 35 9.014 -12.802 -9.661 1.00 0.00 H new ATOM 0 HA GLU A 35 11.365 -13.480 -8.142 1.00 0.00 H new ATOM 0 HB2 GLU A 35 10.726 -11.409 -9.718 1.00 0.00 H new ATOM 0 HB3 GLU A 35 10.120 -10.737 -8.217 1.00 0.00 H new ATOM 0 HG2 GLU A 35 12.844 -12.004 -8.126 1.00 0.00 H new ATOM 0 HG3 GLU A 35 12.710 -10.486 -8.991 1.00 0.00 H new ATOM 550 N PHE A 36 10.726 -13.284 -5.778 1.00 0.00 N ATOM 551 CA PHE A 36 10.328 -13.292 -4.371 1.00 0.00 C ATOM 552 C PHE A 36 10.664 -11.963 -3.698 1.00 0.00 C ATOM 553 O PHE A 36 11.833 -11.607 -3.559 1.00 0.00 O ATOM 554 CB PHE A 36 11.056 -14.421 -3.635 1.00 0.00 C ATOM 555 CG PHE A 36 10.112 -15.579 -3.408 1.00 0.00 C ATOM 556 CD1 PHE A 36 9.252 -15.994 -4.431 1.00 0.00 C ATOM 557 CD2 PHE A 36 10.103 -16.243 -2.175 1.00 0.00 C ATOM 558 CE1 PHE A 36 8.382 -17.070 -4.222 1.00 0.00 C ATOM 559 CE2 PHE A 36 9.232 -17.319 -1.965 1.00 0.00 C ATOM 560 CZ PHE A 36 8.371 -17.733 -2.990 1.00 0.00 C ATOM 0 H PHE A 36 11.649 -13.680 -5.958 1.00 0.00 H new ATOM 0 HA PHE A 36 9.250 -13.447 -4.325 1.00 0.00 H new ATOM 0 HB2 PHE A 36 11.917 -14.751 -4.217 1.00 0.00 H new ATOM 0 HB3 PHE A 36 11.437 -14.058 -2.680 1.00 0.00 H new ATOM 0 HD1 PHE A 36 9.260 -15.483 -5.383 1.00 0.00 H new ATOM 0 HD2 PHE A 36 10.768 -15.925 -1.386 1.00 0.00 H new ATOM 0 HE1 PHE A 36 7.719 -17.389 -5.012 1.00 0.00 H new ATOM 0 HE2 PHE A 36 9.224 -17.830 -1.013 1.00 0.00 H new ATOM 0 HZ PHE A 36 7.699 -18.563 -2.829 1.00 0.00 H new ATOM 570 N LEU A 37 9.633 -11.234 -3.276 1.00 0.00 N ATOM 571 CA LEU A 37 9.847 -9.953 -2.615 1.00 0.00 C ATOM 572 C LEU A 37 9.911 -10.108 -1.097 1.00 0.00 C ATOM 573 O LEU A 37 10.771 -9.504 -0.457 1.00 0.00 O ATOM 574 CB LEU A 37 8.745 -8.963 -2.976 1.00 0.00 C ATOM 575 CG LEU A 37 9.321 -7.546 -3.001 1.00 0.00 C ATOM 576 CD1 LEU A 37 10.350 -7.422 -4.127 1.00 0.00 C ATOM 577 CD2 LEU A 37 8.186 -6.545 -3.237 1.00 0.00 C ATOM 0 H LEU A 37 8.655 -11.505 -3.379 1.00 0.00 H new ATOM 0 HA LEU A 37 10.805 -9.570 -2.966 1.00 0.00 H new ATOM 0 HB2 LEU A 37 8.322 -9.212 -3.949 1.00 0.00 H new ATOM 0 HB3 LEU A 37 7.934 -9.025 -2.250 1.00 0.00 H new ATOM 0 HG LEU A 37 9.807 -7.337 -2.048 1.00 0.00 H new ATOM 0 HD11 LEU A 37 10.756 -6.411 -4.139 1.00 0.00 H new ATOM 0 HD12 LEU A 37 11.158 -8.135 -3.962 1.00 0.00 H new ATOM 0 HD13 LEU A 37 9.870 -7.632 -5.083 1.00 0.00 H new ATOM 0 HD21 LEU A 37 8.591 -5.533 -3.256 1.00 0.00 H new ATOM 0 HD22 LEU A 37 7.703 -6.760 -4.190 1.00 0.00 H new ATOM 0 HD23 LEU A 37 7.455 -6.628 -2.433 1.00 0.00 H new ATOM 589 N ILE A 38 9.024 -10.920 -0.502 1.00 0.00 N ATOM 590 CA ILE A 38 9.072 -11.097 0.932 1.00 0.00 C ATOM 591 C ILE A 38 8.909 -12.551 1.293 1.00 0.00 C ATOM 592 O ILE A 38 8.343 -13.340 0.538 1.00 0.00 O ATOM 593 CB ILE A 38 8.025 -10.246 1.664 1.00 0.00 C ATOM 594 CG1 ILE A 38 6.689 -10.966 1.748 1.00 0.00 C ATOM 595 CG2 ILE A 38 7.846 -8.905 0.977 1.00 0.00 C ATOM 596 CD1 ILE A 38 6.662 -11.817 2.997 1.00 0.00 C ATOM 0 H ILE A 38 8.293 -11.443 -0.984 1.00 0.00 H new ATOM 0 HA ILE A 38 10.053 -10.754 1.260 1.00 0.00 H new ATOM 0 HB ILE A 38 8.390 -10.079 2.677 1.00 0.00 H new ATOM 0 HG12 ILE A 38 5.873 -10.243 1.768 1.00 0.00 H new ATOM 0 HG13 ILE A 38 6.542 -11.589 0.866 1.00 0.00 H new ATOM 0 HG21 ILE A 38 7.100 -8.319 1.513 1.00 0.00 H new ATOM 0 HG22 ILE A 38 8.795 -8.368 0.973 1.00 0.00 H new ATOM 0 HG23 ILE A 38 7.515 -9.063 -0.049 1.00 0.00 H new ATOM 0 HD11 ILE A 38 5.706 -12.336 3.063 1.00 0.00 H new ATOM 0 HD12 ILE A 38 7.470 -12.548 2.957 1.00 0.00 H new ATOM 0 HD13 ILE A 38 6.791 -11.181 3.873 1.00 0.00 H new ATOM 608 N ARG A 39 9.417 -12.894 2.458 1.00 0.00 N ATOM 609 CA ARG A 39 9.336 -14.261 2.941 1.00 0.00 C ATOM 610 C ARG A 39 8.791 -14.300 4.367 1.00 0.00 C ATOM 611 O ARG A 39 9.403 -13.770 5.293 1.00 0.00 O ATOM 612 CB ARG A 39 10.717 -14.897 2.891 1.00 0.00 C ATOM 613 CG ARG A 39 10.661 -16.302 3.475 1.00 0.00 C ATOM 614 CD ARG A 39 9.782 -17.174 2.588 1.00 0.00 C ATOM 615 NE ARG A 39 10.421 -18.465 2.357 1.00 0.00 N ATOM 616 CZ ARG A 39 9.704 -19.551 2.090 1.00 0.00 C ATOM 617 NH1 ARG A 39 8.403 -19.477 2.029 1.00 0.00 N ATOM 618 NH2 ARG A 39 10.302 -20.695 1.891 1.00 0.00 N ATOM 0 H ARG A 39 9.890 -12.248 3.089 1.00 0.00 H new ATOM 0 HA ARG A 39 8.653 -14.821 2.302 1.00 0.00 H new ATOM 0 HB2 ARG A 39 11.072 -14.936 1.861 1.00 0.00 H new ATOM 0 HB3 ARG A 39 11.428 -14.289 3.451 1.00 0.00 H new ATOM 0 HG2 ARG A 39 11.664 -16.723 3.540 1.00 0.00 H new ATOM 0 HG3 ARG A 39 10.261 -16.273 4.489 1.00 0.00 H new ATOM 0 HD2 ARG A 39 8.810 -17.320 3.059 1.00 0.00 H new ATOM 0 HD3 ARG A 39 9.603 -16.673 1.636 1.00 0.00 H new ATOM 0 HE ARG A 39 11.438 -18.535 2.401 1.00 0.00 H new ATOM 0 HH11 ARG A 39 7.935 -18.584 2.186 1.00 0.00 H new ATOM 0 HH12 ARG A 39 7.854 -20.312 1.824 1.00 0.00 H new ATOM 0 HH21 ARG A 39 11.319 -20.754 1.941 1.00 0.00 H new ATOM 0 HH22 ARG A 39 9.752 -21.529 1.686 1.00 0.00 H new ATOM 632 N GLN A 40 7.640 -14.940 4.517 1.00 0.00 N ATOM 633 CA GLN A 40 6.976 -15.070 5.816 1.00 0.00 C ATOM 634 C GLN A 40 7.839 -14.548 6.963 1.00 0.00 C ATOM 635 O GLN A 40 8.975 -14.984 7.148 1.00 0.00 O ATOM 636 CB GLN A 40 6.654 -16.544 6.075 1.00 0.00 C ATOM 637 CG GLN A 40 6.039 -17.163 4.820 1.00 0.00 C ATOM 638 CD GLN A 40 5.973 -18.679 4.967 1.00 0.00 C ATOM 639 OE1 GLN A 40 5.459 -19.367 4.086 1.00 0.00 O ATOM 640 NE2 GLN A 40 6.467 -19.243 6.034 1.00 0.00 N ATOM 0 H GLN A 40 7.138 -15.384 3.748 1.00 0.00 H new ATOM 0 HA GLN A 40 6.066 -14.471 5.779 1.00 0.00 H new ATOM 0 HB2 GLN A 40 7.561 -17.082 6.351 1.00 0.00 H new ATOM 0 HB3 GLN A 40 5.963 -16.634 6.913 1.00 0.00 H new ATOM 0 HG2 GLN A 40 5.039 -16.761 4.659 1.00 0.00 H new ATOM 0 HG3 GLN A 40 6.634 -16.899 3.945 1.00 0.00 H new ATOM 0 HE21 GLN A 40 6.893 -18.670 6.763 1.00 0.00 H new ATOM 0 HE22 GLN A 40 6.428 -20.257 6.140 1.00 0.00 H new ATOM 649 N GLY A 41 7.277 -13.629 7.746 1.00 0.00 N ATOM 650 CA GLY A 41 7.988 -13.076 8.894 1.00 0.00 C ATOM 651 C GLY A 41 8.738 -11.792 8.549 1.00 0.00 C ATOM 652 O GLY A 41 9.492 -11.275 9.374 1.00 0.00 O ATOM 0 H GLY A 41 6.338 -13.255 7.607 1.00 0.00 H new ATOM 0 HA2 GLY A 41 7.277 -12.875 9.696 1.00 0.00 H new ATOM 0 HA3 GLY A 41 8.694 -13.816 9.272 1.00 0.00 H new ATOM 656 N ASP A 42 8.540 -11.275 7.343 1.00 0.00 N ATOM 657 CA ASP A 42 9.227 -10.049 6.947 1.00 0.00 C ATOM 658 C ASP A 42 8.786 -8.882 7.818 1.00 0.00 C ATOM 659 O ASP A 42 7.804 -8.978 8.552 1.00 0.00 O ATOM 660 CB ASP A 42 8.940 -9.714 5.486 1.00 0.00 C ATOM 661 CG ASP A 42 9.765 -10.613 4.577 1.00 0.00 C ATOM 662 OD1 ASP A 42 9.388 -11.760 4.415 1.00 0.00 O ATOM 663 OD2 ASP A 42 10.763 -10.143 4.056 1.00 0.00 O ATOM 0 H ASP A 42 7.924 -11.674 6.635 1.00 0.00 H new ATOM 0 HA ASP A 42 10.297 -10.215 7.075 1.00 0.00 H new ATOM 0 HB2 ASP A 42 7.879 -9.845 5.276 1.00 0.00 H new ATOM 0 HB3 ASP A 42 9.177 -8.668 5.290 1.00 0.00 H new ATOM 668 N ALA A 43 9.522 -7.781 7.725 1.00 0.00 N ATOM 669 CA ALA A 43 9.209 -6.591 8.502 1.00 0.00 C ATOM 670 C ALA A 43 8.595 -5.516 7.611 1.00 0.00 C ATOM 671 O ALA A 43 9.238 -5.027 6.681 1.00 0.00 O ATOM 672 CB ALA A 43 10.486 -6.055 9.147 1.00 0.00 C ATOM 0 H ALA A 43 10.338 -7.689 7.120 1.00 0.00 H new ATOM 0 HA ALA A 43 8.488 -6.855 9.276 1.00 0.00 H new ATOM 0 HB1 ALA A 43 10.253 -5.164 9.729 1.00 0.00 H new ATOM 0 HB2 ALA A 43 10.910 -6.816 9.802 1.00 0.00 H new ATOM 0 HB3 ALA A 43 11.208 -5.802 8.370 1.00 0.00 H new ATOM 678 N LEU A 44 7.350 -5.154 7.898 1.00 0.00 N ATOM 679 CA LEU A 44 6.663 -4.137 7.113 1.00 0.00 C ATOM 680 C LEU A 44 6.831 -2.760 7.745 1.00 0.00 C ATOM 681 O LEU A 44 6.285 -2.486 8.814 1.00 0.00 O ATOM 682 CB LEU A 44 5.181 -4.474 7.017 1.00 0.00 C ATOM 683 CG LEU A 44 4.464 -3.386 6.222 1.00 0.00 C ATOM 684 CD1 LEU A 44 5.202 -3.153 4.904 1.00 0.00 C ATOM 685 CD2 LEU A 44 3.043 -3.845 5.925 1.00 0.00 C ATOM 0 H LEU A 44 6.800 -5.546 8.662 1.00 0.00 H new ATOM 0 HA LEU A 44 7.102 -4.119 6.115 1.00 0.00 H new ATOM 0 HB2 LEU A 44 5.047 -5.441 6.533 1.00 0.00 H new ATOM 0 HB3 LEU A 44 4.750 -4.555 8.015 1.00 0.00 H new ATOM 0 HG LEU A 44 4.443 -2.461 6.798 1.00 0.00 H new ATOM 0 HD11 LEU A 44 4.692 -2.376 4.334 1.00 0.00 H new ATOM 0 HD12 LEU A 44 6.225 -2.839 5.110 1.00 0.00 H new ATOM 0 HD13 LEU A 44 5.216 -4.077 4.326 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.523 -3.074 5.357 1.00 0.00 H new ATOM 0 HD22 LEU A 44 3.072 -4.766 5.343 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.515 -4.024 6.862 1.00 0.00 H new ATOM 697 N GLN A 45 7.585 -1.894 7.076 1.00 0.00 N ATOM 698 CA GLN A 45 7.812 -0.545 7.579 1.00 0.00 C ATOM 699 C GLN A 45 7.446 0.487 6.521 1.00 0.00 C ATOM 700 O GLN A 45 7.272 1.668 6.822 1.00 0.00 O ATOM 701 CB GLN A 45 9.279 -0.372 7.981 1.00 0.00 C ATOM 702 CG GLN A 45 9.385 -0.296 9.506 1.00 0.00 C ATOM 703 CD GLN A 45 10.846 -0.168 9.922 1.00 0.00 C ATOM 704 OE1 GLN A 45 11.787 -0.413 9.051 1.00 0.00 O flip ATOM 705 NE2 GLN A 45 11.138 0.167 11.070 1.00 0.00 N flip ATOM 0 H GLN A 45 8.046 -2.101 6.190 1.00 0.00 H new ATOM 0 HA GLN A 45 7.179 -0.393 8.454 1.00 0.00 H new ATOM 0 HB2 GLN A 45 9.871 -1.207 7.606 1.00 0.00 H new ATOM 0 HB3 GLN A 45 9.686 0.534 7.532 1.00 0.00 H new ATOM 0 HG2 GLN A 45 8.817 0.558 9.876 1.00 0.00 H new ATOM 0 HG3 GLN A 45 8.948 -1.188 9.954 1.00 0.00 H new ATOM 0 HE21 GLN A 45 10.401 0.358 11.749 1.00 0.00 H new ATOM 0 HE22 GLN A 45 12.117 0.254 11.343 1.00 0.00 H new ATOM 714 N ALA A 46 7.338 0.035 5.276 1.00 0.00 N ATOM 715 CA ALA A 46 7.001 0.927 4.174 1.00 0.00 C ATOM 716 C ALA A 46 5.760 0.430 3.438 1.00 0.00 C ATOM 717 O ALA A 46 5.512 -0.774 3.364 1.00 0.00 O ATOM 718 CB ALA A 46 8.179 1.005 3.196 1.00 0.00 C ATOM 0 H ALA A 46 7.478 -0.939 5.006 1.00 0.00 H new ATOM 0 HA ALA A 46 6.793 1.917 4.580 1.00 0.00 H new ATOM 0 HB1 ALA A 46 7.925 1.673 2.373 1.00 0.00 H new ATOM 0 HB2 ALA A 46 9.058 1.387 3.715 1.00 0.00 H new ATOM 0 HB3 ALA A 46 8.393 0.011 2.804 1.00 0.00 H new ATOM 724 N ILE A 47 4.988 1.362 2.883 1.00 0.00 N ATOM 725 CA ILE A 47 3.782 0.999 2.141 1.00 0.00 C ATOM 726 C ILE A 47 4.106 0.933 0.655 1.00 0.00 C ATOM 727 O ILE A 47 4.877 1.751 0.159 1.00 0.00 O ATOM 728 CB ILE A 47 2.677 2.028 2.387 1.00 0.00 C ATOM 729 CG1 ILE A 47 1.380 1.547 1.730 1.00 0.00 C ATOM 730 CG2 ILE A 47 3.084 3.372 1.779 1.00 0.00 C ATOM 731 CD1 ILE A 47 0.401 1.082 2.811 1.00 0.00 C ATOM 0 H ILE A 47 5.173 2.364 2.932 1.00 0.00 H new ATOM 0 HA ILE A 47 3.432 0.025 2.483 1.00 0.00 H new ATOM 0 HB ILE A 47 2.523 2.146 3.460 1.00 0.00 H new ATOM 0 HG12 ILE A 47 0.936 2.352 1.145 1.00 0.00 H new ATOM 0 HG13 ILE A 47 1.591 0.730 1.040 1.00 0.00 H new ATOM 0 HG21 ILE A 47 2.296 4.104 1.955 1.00 0.00 H new ATOM 0 HG22 ILE A 47 4.009 3.716 2.242 1.00 0.00 H new ATOM 0 HG23 ILE A 47 3.237 3.255 0.706 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -0.522 0.740 2.343 1.00 0.00 H new ATOM 0 HD12 ILE A 47 0.846 0.264 3.377 1.00 0.00 H new ATOM 0 HD13 ILE A 47 0.181 1.911 3.484 1.00 0.00 H new ATOM 743 N TYR A 48 3.531 -0.040 -0.056 1.00 0.00 N ATOM 744 CA TYR A 48 3.818 -0.174 -1.487 1.00 0.00 C ATOM 745 C TYR A 48 2.591 0.090 -2.350 1.00 0.00 C ATOM 746 O TYR A 48 1.455 -0.116 -1.929 1.00 0.00 O ATOM 747 CB TYR A 48 4.308 -1.585 -1.828 1.00 0.00 C ATOM 748 CG TYR A 48 5.510 -1.981 -0.997 1.00 0.00 C ATOM 749 CD1 TYR A 48 5.378 -2.203 0.376 1.00 0.00 C ATOM 750 CD2 TYR A 48 6.755 -2.158 -1.615 1.00 0.00 C ATOM 751 CE1 TYR A 48 6.485 -2.601 1.135 1.00 0.00 C ATOM 752 CE2 TYR A 48 7.864 -2.551 -0.856 1.00 0.00 C ATOM 753 CZ TYR A 48 7.728 -2.775 0.519 1.00 0.00 C ATOM 754 OH TYR A 48 8.819 -3.168 1.266 1.00 0.00 O ATOM 0 H TYR A 48 2.881 -0.730 0.322 1.00 0.00 H new ATOM 0 HA TYR A 48 4.588 0.568 -1.699 1.00 0.00 H new ATOM 0 HB2 TYR A 48 3.501 -2.299 -1.663 1.00 0.00 H new ATOM 0 HB3 TYR A 48 4.566 -1.634 -2.886 1.00 0.00 H new ATOM 0 HD1 TYR A 48 4.419 -2.067 0.853 1.00 0.00 H new ATOM 0 HD2 TYR A 48 6.859 -1.991 -2.677 1.00 0.00 H new ATOM 0 HE1 TYR A 48 6.379 -2.774 2.196 1.00 0.00 H new ATOM 0 HE2 TYR A 48 8.825 -2.681 -1.332 1.00 0.00 H new ATOM 0 HH TYR A 48 9.604 -3.243 0.684 1.00 0.00 H new ATOM 764 N PHE A 49 2.861 0.498 -3.585 1.00 0.00 N ATOM 765 CA PHE A 49 1.826 0.756 -4.576 1.00 0.00 C ATOM 766 C PHE A 49 2.283 0.179 -5.905 1.00 0.00 C ATOM 767 O PHE A 49 3.438 0.349 -6.293 1.00 0.00 O ATOM 768 CB PHE A 49 1.616 2.255 -4.772 1.00 0.00 C ATOM 769 CG PHE A 49 0.140 2.583 -4.895 1.00 0.00 C ATOM 770 CD1 PHE A 49 -0.610 2.140 -6.003 1.00 0.00 C ATOM 771 CD2 PHE A 49 -0.474 3.358 -3.905 1.00 0.00 C ATOM 772 CE1 PHE A 49 -1.966 2.475 -6.105 1.00 0.00 C ATOM 773 CE2 PHE A 49 -1.829 3.687 -4.010 1.00 0.00 C ATOM 774 CZ PHE A 49 -2.574 3.245 -5.108 1.00 0.00 C ATOM 0 H PHE A 49 3.808 0.659 -3.927 1.00 0.00 H new ATOM 0 HA PHE A 49 0.896 0.304 -4.233 1.00 0.00 H new ATOM 0 HB2 PHE A 49 2.045 2.799 -3.931 1.00 0.00 H new ATOM 0 HB3 PHE A 49 2.142 2.586 -5.667 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -0.140 1.544 -6.771 1.00 0.00 H new ATOM 0 HD2 PHE A 49 0.100 3.703 -3.058 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -2.543 2.139 -6.954 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -2.301 4.283 -3.243 1.00 0.00 H new ATOM 0 HZ PHE A 49 -3.621 3.499 -5.186 1.00 0.00 H new ATOM 784 N VAL A 50 1.392 -0.483 -6.601 1.00 0.00 N ATOM 785 CA VAL A 50 1.731 -1.051 -7.877 1.00 0.00 C ATOM 786 C VAL A 50 1.161 -0.171 -8.988 1.00 0.00 C ATOM 787 O VAL A 50 0.007 0.245 -8.925 1.00 0.00 O ATOM 788 CB VAL A 50 1.190 -2.474 -7.905 1.00 0.00 C ATOM 789 CG1 VAL A 50 0.417 -2.711 -9.182 1.00 0.00 C ATOM 790 CG2 VAL A 50 2.347 -3.466 -7.803 1.00 0.00 C ATOM 0 H VAL A 50 0.429 -0.640 -6.304 1.00 0.00 H new ATOM 0 HA VAL A 50 2.809 -1.092 -8.036 1.00 0.00 H new ATOM 0 HB VAL A 50 0.519 -2.617 -7.058 1.00 0.00 H new ATOM 0 HG11 VAL A 50 0.035 -3.732 -9.192 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -0.416 -2.011 -9.238 1.00 0.00 H new ATOM 0 HG13 VAL A 50 1.075 -2.562 -10.038 1.00 0.00 H new ATOM 0 HG21 VAL A 50 1.957 -4.484 -7.823 1.00 0.00 H new ATOM 0 HG22 VAL A 50 3.026 -3.321 -8.643 1.00 0.00 H new ATOM 0 HG23 VAL A 50 2.885 -3.302 -6.869 1.00 0.00 H new ATOM 800 N CYS A 51 1.978 0.128 -9.990 1.00 0.00 N ATOM 801 CA CYS A 51 1.530 0.977 -11.089 1.00 0.00 C ATOM 802 C CYS A 51 1.137 0.134 -12.298 1.00 0.00 C ATOM 803 O CYS A 51 0.229 0.491 -13.047 1.00 0.00 O ATOM 804 CB CYS A 51 2.643 1.951 -11.485 1.00 0.00 C ATOM 805 SG CYS A 51 1.961 3.624 -11.613 1.00 0.00 S ATOM 0 H CYS A 51 2.941 -0.199 -10.066 1.00 0.00 H new ATOM 0 HA CYS A 51 0.657 1.537 -10.754 1.00 0.00 H new ATOM 0 HB2 CYS A 51 3.442 1.928 -10.744 1.00 0.00 H new ATOM 0 HB3 CYS A 51 3.082 1.651 -12.437 1.00 0.00 H new ATOM 0 HG CYS A 51 2.905 4.453 -11.947 1.00 0.00 H new ATOM 811 N SER A 52 1.829 -0.983 -12.476 1.00 0.00 N ATOM 812 CA SER A 52 1.550 -1.876 -13.593 1.00 0.00 C ATOM 813 C SER A 52 2.234 -3.219 -13.373 1.00 0.00 C ATOM 814 O SER A 52 3.312 -3.281 -12.785 1.00 0.00 O ATOM 815 CB SER A 52 2.044 -1.251 -14.899 1.00 0.00 C ATOM 816 OG SER A 52 3.216 -1.929 -15.329 1.00 0.00 O ATOM 0 H SER A 52 2.585 -1.292 -11.864 1.00 0.00 H new ATOM 0 HA SER A 52 0.473 -2.032 -13.657 1.00 0.00 H new ATOM 0 HB2 SER A 52 1.270 -1.318 -15.663 1.00 0.00 H new ATOM 0 HB3 SER A 52 2.256 -0.192 -14.752 1.00 0.00 H new ATOM 0 HG SER A 52 3.535 -1.532 -16.167 1.00 0.00 H new ATOM 822 N GLY A 53 1.600 -4.291 -13.835 1.00 0.00 N ATOM 823 CA GLY A 53 2.159 -5.628 -13.668 1.00 0.00 C ATOM 824 C GLY A 53 1.218 -6.499 -12.841 1.00 0.00 C ATOM 825 O GLY A 53 0.024 -6.211 -12.749 1.00 0.00 O ATOM 0 H GLY A 53 0.706 -4.262 -14.324 1.00 0.00 H new ATOM 0 HA2 GLY A 53 2.324 -6.085 -14.644 1.00 0.00 H new ATOM 0 HA3 GLY A 53 3.131 -5.564 -13.178 1.00 0.00 H new ATOM 829 N SER A 54 1.749 -7.562 -12.241 1.00 0.00 N ATOM 830 CA SER A 54 0.909 -8.445 -11.430 1.00 0.00 C ATOM 831 C SER A 54 1.729 -9.174 -10.371 1.00 0.00 C ATOM 832 O SER A 54 2.876 -9.551 -10.610 1.00 0.00 O ATOM 833 CB SER A 54 0.214 -9.471 -12.326 1.00 0.00 C ATOM 834 OG SER A 54 0.150 -8.969 -13.655 1.00 0.00 O ATOM 0 H SER A 54 2.732 -7.830 -12.297 1.00 0.00 H new ATOM 0 HA SER A 54 0.166 -7.827 -10.926 1.00 0.00 H new ATOM 0 HB2 SER A 54 0.759 -10.415 -12.308 1.00 0.00 H new ATOM 0 HB3 SER A 54 -0.790 -9.675 -11.954 1.00 0.00 H new ATOM 0 HG SER A 54 -0.294 -9.626 -14.232 1.00 0.00 H new ATOM 840 N MET A 55 1.132 -9.383 -9.200 1.00 0.00 N ATOM 841 CA MET A 55 1.834 -10.083 -8.131 1.00 0.00 C ATOM 842 C MET A 55 0.858 -10.675 -7.123 1.00 0.00 C ATOM 843 O MET A 55 -0.330 -10.355 -7.126 1.00 0.00 O ATOM 844 CB MET A 55 2.813 -9.140 -7.427 1.00 0.00 C ATOM 845 CG MET A 55 2.066 -7.920 -6.895 1.00 0.00 C ATOM 846 SD MET A 55 2.108 -7.929 -5.085 1.00 0.00 S ATOM 847 CE MET A 55 3.846 -7.457 -4.894 1.00 0.00 C ATOM 0 H MET A 55 0.184 -9.084 -8.971 1.00 0.00 H new ATOM 0 HA MET A 55 2.394 -10.903 -8.581 1.00 0.00 H new ATOM 0 HB2 MET A 55 3.307 -9.661 -6.607 1.00 0.00 H new ATOM 0 HB3 MET A 55 3.592 -8.826 -8.121 1.00 0.00 H new ATOM 0 HG2 MET A 55 2.522 -7.006 -7.276 1.00 0.00 H new ATOM 0 HG3 MET A 55 1.034 -7.931 -7.246 1.00 0.00 H new ATOM 0 HE1 MET A 55 4.397 -8.277 -4.434 1.00 0.00 H new ATOM 0 HE2 MET A 55 4.273 -7.237 -5.872 1.00 0.00 H new ATOM 0 HE3 MET A 55 3.915 -6.573 -4.260 1.00 0.00 H new ATOM 857 N GLU A 56 1.373 -11.558 -6.274 1.00 0.00 N ATOM 858 CA GLU A 56 0.547 -12.216 -5.271 1.00 0.00 C ATOM 859 C GLU A 56 1.416 -12.767 -4.144 1.00 0.00 C ATOM 860 O GLU A 56 2.583 -13.099 -4.355 1.00 0.00 O ATOM 861 CB GLU A 56 -0.221 -13.379 -5.917 1.00 0.00 C ATOM 862 CG GLU A 56 -0.122 -13.294 -7.437 1.00 0.00 C ATOM 863 CD GLU A 56 -0.700 -14.559 -8.065 1.00 0.00 C ATOM 864 OE1 GLU A 56 0.015 -15.545 -8.128 1.00 0.00 O ATOM 865 OE2 GLU A 56 -1.851 -14.523 -8.469 1.00 0.00 O ATOM 0 H GLU A 56 2.355 -11.833 -6.261 1.00 0.00 H new ATOM 0 HA GLU A 56 -0.152 -11.485 -4.864 1.00 0.00 H new ATOM 0 HB2 GLU A 56 0.185 -14.330 -5.571 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -1.267 -13.349 -5.611 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -0.662 -12.419 -7.797 1.00 0.00 H new ATOM 0 HG3 GLU A 56 0.919 -13.171 -7.736 1.00 0.00 H new ATOM 872 N VAL A 57 0.834 -12.898 -2.955 1.00 0.00 N ATOM 873 CA VAL A 57 1.568 -13.450 -1.824 1.00 0.00 C ATOM 874 C VAL A 57 1.270 -14.947 -1.755 1.00 0.00 C ATOM 875 O VAL A 57 0.125 -15.359 -1.971 1.00 0.00 O ATOM 876 CB VAL A 57 1.174 -12.751 -0.520 1.00 0.00 C ATOM 877 CG1 VAL A 57 0.871 -11.278 -0.799 1.00 0.00 C ATOM 878 CG2 VAL A 57 -0.061 -13.417 0.076 1.00 0.00 C ATOM 0 H VAL A 57 -0.130 -12.633 -2.752 1.00 0.00 H new ATOM 0 HA VAL A 57 2.638 -13.289 -1.959 1.00 0.00 H new ATOM 0 HB VAL A 57 2.000 -12.828 0.187 1.00 0.00 H new ATOM 0 HG11 VAL A 57 0.591 -10.782 0.130 1.00 0.00 H new ATOM 0 HG12 VAL A 57 1.756 -10.797 -1.215 1.00 0.00 H new ATOM 0 HG13 VAL A 57 0.050 -11.204 -1.512 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -0.334 -12.913 1.003 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -0.888 -13.349 -0.631 1.00 0.00 H new ATOM 0 HG23 VAL A 57 0.155 -14.465 0.282 1.00 0.00 H new ATOM 888 N LEU A 58 2.307 -15.755 -1.504 1.00 0.00 N ATOM 889 CA LEU A 58 2.158 -17.210 -1.474 1.00 0.00 C ATOM 890 C LEU A 58 2.183 -17.768 -0.058 1.00 0.00 C ATOM 891 O LEU A 58 3.161 -17.604 0.673 1.00 0.00 O ATOM 892 CB LEU A 58 3.287 -17.852 -2.290 1.00 0.00 C ATOM 893 CG LEU A 58 2.703 -18.610 -3.487 1.00 0.00 C ATOM 894 CD1 LEU A 58 3.819 -19.377 -4.199 1.00 0.00 C ATOM 895 CD2 LEU A 58 1.640 -19.598 -3.004 1.00 0.00 C ATOM 0 H LEU A 58 3.254 -15.425 -1.320 1.00 0.00 H new ATOM 0 HA LEU A 58 1.185 -17.448 -1.904 1.00 0.00 H new ATOM 0 HB2 LEU A 58 3.978 -17.084 -2.637 1.00 0.00 H new ATOM 0 HB3 LEU A 58 3.859 -18.534 -1.661 1.00 0.00 H new ATOM 0 HG LEU A 58 2.249 -17.898 -4.176 1.00 0.00 H new ATOM 0 HD11 LEU A 58 3.404 -19.916 -5.050 1.00 0.00 H new ATOM 0 HD12 LEU A 58 4.577 -18.676 -4.548 1.00 0.00 H new ATOM 0 HD13 LEU A 58 4.272 -20.086 -3.506 1.00 0.00 H new ATOM 0 HD21 LEU A 58 1.227 -20.135 -3.858 1.00 0.00 H new ATOM 0 HD22 LEU A 58 2.092 -20.309 -2.312 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.842 -19.055 -2.497 1.00 0.00 H new ATOM 907 N LYS A 59 1.099 -18.442 0.316 1.00 0.00 N ATOM 908 CA LYS A 59 1.004 -19.036 1.639 1.00 0.00 C ATOM 909 C LYS A 59 -0.091 -20.104 1.684 1.00 0.00 C ATOM 910 O LYS A 59 -1.129 -19.972 1.038 1.00 0.00 O ATOM 911 CB LYS A 59 0.740 -17.944 2.672 1.00 0.00 C ATOM 912 CG LYS A 59 0.316 -18.555 4.018 1.00 0.00 C ATOM 913 CD LYS A 59 1.453 -19.402 4.610 1.00 0.00 C ATOM 914 CE LYS A 59 2.632 -18.504 4.992 1.00 0.00 C ATOM 915 NZ LYS A 59 2.133 -17.351 5.792 1.00 0.00 N ATOM 0 H LYS A 59 0.281 -18.588 -0.276 1.00 0.00 H new ATOM 0 HA LYS A 59 1.949 -19.526 1.873 1.00 0.00 H new ATOM 0 HB2 LYS A 59 1.638 -17.341 2.808 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -0.041 -17.275 2.309 1.00 0.00 H new ATOM 0 HG2 LYS A 59 0.046 -17.761 4.715 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -0.571 -19.173 3.880 1.00 0.00 H new ATOM 0 HD2 LYS A 59 1.097 -19.941 5.488 1.00 0.00 H new ATOM 0 HD3 LYS A 59 1.775 -20.150 3.886 1.00 0.00 H new ATOM 0 HE2 LYS A 59 3.364 -19.071 5.567 1.00 0.00 H new ATOM 0 HE3 LYS A 59 3.138 -18.147 4.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 2.938 -16.853 6.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 1.613 -16.697 5.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 1.499 -17.696 6.540 1.00 0.00 H new ATOM 929 N ASP A 60 0.156 -21.161 2.455 1.00 0.00 N ATOM 930 CA ASP A 60 -0.803 -22.254 2.592 1.00 0.00 C ATOM 931 C ASP A 60 -1.098 -22.916 1.249 1.00 0.00 C ATOM 932 O ASP A 60 -2.249 -23.219 0.934 1.00 0.00 O ATOM 933 CB ASP A 60 -2.106 -21.728 3.194 1.00 0.00 C ATOM 934 CG ASP A 60 -1.853 -21.195 4.599 1.00 0.00 C ATOM 935 OD1 ASP A 60 -0.873 -21.604 5.198 1.00 0.00 O ATOM 936 OD2 ASP A 60 -2.643 -20.384 5.055 1.00 0.00 O ATOM 0 H ASP A 60 1.013 -21.283 2.995 1.00 0.00 H new ATOM 0 HA ASP A 60 -0.361 -23.002 3.251 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -2.514 -20.937 2.564 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -2.849 -22.525 3.227 1.00 0.00 H new ATOM 941 N ASN A 61 -0.047 -23.163 0.475 1.00 0.00 N ATOM 942 CA ASN A 61 -0.194 -23.822 -0.818 1.00 0.00 C ATOM 943 C ASN A 61 -0.949 -22.951 -1.817 1.00 0.00 C ATOM 944 O ASN A 61 -1.030 -23.288 -2.998 1.00 0.00 O ATOM 945 CB ASN A 61 -0.937 -25.151 -0.636 1.00 0.00 C ATOM 946 CG ASN A 61 0.000 -26.319 -0.928 1.00 0.00 C ATOM 947 OD1 ASN A 61 0.272 -27.132 -0.045 1.00 0.00 O ATOM 948 ND2 ASN A 61 0.511 -26.453 -2.121 1.00 0.00 N ATOM 0 H ASN A 61 0.913 -22.918 0.719 1.00 0.00 H new ATOM 0 HA ASN A 61 0.805 -23.999 -1.216 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -1.319 -25.227 0.382 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -1.798 -25.190 -1.303 1.00 0.00 H new ATOM 0 HD21 ASN A 61 1.137 -27.233 -2.323 1.00 0.00 H new ATOM 0 HD22 ASN A 61 0.284 -25.778 -2.852 1.00 0.00 H new ATOM 955 N THR A 62 -1.499 -21.833 -1.353 1.00 0.00 N ATOM 956 CA THR A 62 -2.232 -20.949 -2.252 1.00 0.00 C ATOM 957 C THR A 62 -1.775 -19.521 -2.095 1.00 0.00 C ATOM 958 O THR A 62 -1.246 -19.130 -1.053 1.00 0.00 O ATOM 959 CB THR A 62 -3.735 -20.998 -1.976 1.00 0.00 C ATOM 960 OG1 THR A 62 -4.168 -22.351 -1.941 1.00 0.00 O ATOM 961 CG2 THR A 62 -4.492 -20.241 -3.083 1.00 0.00 C ATOM 0 H THR A 62 -1.453 -21.523 -0.382 1.00 0.00 H new ATOM 0 HA THR A 62 -2.033 -21.297 -3.266 1.00 0.00 H new ATOM 0 HB THR A 62 -3.940 -20.527 -1.015 1.00 0.00 H new ATOM 0 HG1 THR A 62 -5.131 -22.382 -1.762 1.00 0.00 H new ATOM 0 HG21 THR A 62 -5.563 -20.278 -2.882 1.00 0.00 H new ATOM 0 HG22 THR A 62 -4.163 -19.202 -3.104 1.00 0.00 H new ATOM 0 HG23 THR A 62 -4.287 -20.706 -4.047 1.00 0.00 H new ATOM 969 N VAL A 63 -2.020 -18.737 -3.125 1.00 0.00 N ATOM 970 CA VAL A 63 -1.674 -17.342 -3.087 1.00 0.00 C ATOM 971 C VAL A 63 -2.620 -16.650 -2.113 1.00 0.00 C ATOM 972 O VAL A 63 -3.836 -16.657 -2.308 1.00 0.00 O ATOM 973 CB VAL A 63 -1.782 -16.762 -4.487 1.00 0.00 C ATOM 974 CG1 VAL A 63 -0.392 -16.748 -5.126 1.00 0.00 C ATOM 975 CG2 VAL A 63 -2.693 -17.660 -5.311 1.00 0.00 C ATOM 0 H VAL A 63 -2.456 -19.046 -3.994 1.00 0.00 H new ATOM 0 HA VAL A 63 -0.649 -17.194 -2.747 1.00 0.00 H new ATOM 0 HB VAL A 63 -2.183 -15.749 -4.447 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -0.458 -16.333 -6.132 1.00 0.00 H new ATOM 0 HG12 VAL A 63 0.279 -16.135 -4.524 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -0.005 -17.766 -5.178 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -2.783 -17.259 -6.321 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -2.271 -18.664 -5.355 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -3.679 -17.701 -4.848 1.00 0.00 H new ATOM 985 N LEU A 64 -2.069 -16.103 -1.033 1.00 0.00 N ATOM 986 CA LEU A 64 -2.899 -15.474 -0.012 1.00 0.00 C ATOM 987 C LEU A 64 -3.429 -14.125 -0.472 1.00 0.00 C ATOM 988 O LEU A 64 -4.429 -13.642 0.056 1.00 0.00 O ATOM 989 CB LEU A 64 -2.100 -15.298 1.283 1.00 0.00 C ATOM 990 CG LEU A 64 -2.887 -15.852 2.477 1.00 0.00 C ATOM 991 CD1 LEU A 64 -2.521 -17.321 2.698 1.00 0.00 C ATOM 992 CD2 LEU A 64 -2.528 -15.050 3.732 1.00 0.00 C ATOM 0 H LEU A 64 -1.067 -16.082 -0.844 1.00 0.00 H new ATOM 0 HA LEU A 64 -3.751 -16.129 0.168 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -1.143 -15.813 1.200 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -1.881 -14.242 1.442 1.00 0.00 H new ATOM 0 HG LEU A 64 -3.955 -15.770 2.277 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -3.082 -17.712 3.547 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -2.767 -17.896 1.805 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -1.453 -17.404 2.900 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -3.085 -15.440 4.584 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -1.459 -15.137 3.926 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -2.785 -14.002 3.580 1.00 0.00 H new ATOM 1004 N ALA A 65 -2.793 -13.522 -1.470 1.00 0.00 N ATOM 1005 CA ALA A 65 -3.290 -12.247 -1.962 1.00 0.00 C ATOM 1006 C ALA A 65 -3.075 -12.165 -3.455 1.00 0.00 C ATOM 1007 O ALA A 65 -1.978 -12.415 -3.936 1.00 0.00 O ATOM 1008 CB ALA A 65 -2.568 -11.089 -1.269 1.00 0.00 C ATOM 0 H ALA A 65 -1.961 -13.881 -1.939 1.00 0.00 H new ATOM 0 HA ALA A 65 -4.355 -12.174 -1.742 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -2.952 -10.142 -1.648 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -2.739 -11.145 -0.194 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -1.499 -11.154 -1.470 1.00 0.00 H new ATOM 1014 N ILE A 66 -4.126 -11.810 -4.180 1.00 0.00 N ATOM 1015 CA ILE A 66 -4.038 -11.704 -5.627 1.00 0.00 C ATOM 1016 C ILE A 66 -4.408 -10.288 -6.059 1.00 0.00 C ATOM 1017 O ILE A 66 -5.576 -9.903 -5.999 1.00 0.00 O ATOM 1018 CB ILE A 66 -4.995 -12.711 -6.274 1.00 0.00 C ATOM 1019 CG1 ILE A 66 -4.349 -14.104 -6.294 1.00 0.00 C ATOM 1020 CG2 ILE A 66 -5.303 -12.274 -7.707 1.00 0.00 C ATOM 1021 CD1 ILE A 66 -4.480 -14.754 -4.913 1.00 0.00 C ATOM 0 H ILE A 66 -5.044 -11.592 -3.792 1.00 0.00 H new ATOM 0 HA ILE A 66 -3.019 -11.922 -5.946 1.00 0.00 H new ATOM 0 HB ILE A 66 -5.919 -12.750 -5.696 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -4.830 -14.728 -7.047 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -3.298 -14.024 -6.571 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -5.984 -12.990 -8.167 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -5.767 -11.288 -7.695 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -4.378 -12.232 -8.281 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -4.021 -15.742 -4.931 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -3.978 -14.134 -4.170 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -5.535 -14.849 -4.654 1.00 0.00 H new ATOM 1033 N LEU A 67 -3.415 -9.506 -6.473 1.00 0.00 N ATOM 1034 CA LEU A 67 -3.679 -8.130 -6.883 1.00 0.00 C ATOM 1035 C LEU A 67 -3.012 -7.787 -8.216 1.00 0.00 C ATOM 1036 O LEU A 67 -2.109 -8.491 -8.682 1.00 0.00 O ATOM 1037 CB LEU A 67 -3.198 -7.158 -5.805 1.00 0.00 C ATOM 1038 CG LEU A 67 -2.221 -7.862 -4.871 1.00 0.00 C ATOM 1039 CD1 LEU A 67 -0.957 -8.194 -5.653 1.00 0.00 C ATOM 1040 CD2 LEU A 67 -1.874 -6.934 -3.705 1.00 0.00 C ATOM 0 H LEU A 67 -2.438 -9.794 -6.533 1.00 0.00 H new ATOM 0 HA LEU A 67 -4.757 -8.034 -7.015 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -2.716 -6.297 -6.268 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -4.049 -6.780 -5.238 1.00 0.00 H new ATOM 0 HG LEU A 67 -2.668 -8.776 -4.480 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.246 -8.699 -4.999 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -1.207 -8.847 -6.489 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -0.511 -7.274 -6.032 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.175 -7.436 -3.036 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -1.417 -6.022 -4.089 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -2.782 -6.682 -3.158 1.00 0.00 H new ATOM 1052 N GLY A 68 -3.471 -6.691 -8.820 1.00 0.00 N ATOM 1053 CA GLY A 68 -2.929 -6.240 -10.094 1.00 0.00 C ATOM 1054 C GLY A 68 -2.533 -4.763 -10.047 1.00 0.00 C ATOM 1055 O GLY A 68 -2.201 -4.227 -8.990 1.00 0.00 O ATOM 0 H GLY A 68 -4.215 -6.103 -8.446 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -2.058 -6.842 -10.353 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -3.669 -6.394 -10.880 1.00 0.00 H new ATOM 1059 N LYS A 69 -2.559 -4.125 -11.213 1.00 0.00 N ATOM 1060 CA LYS A 69 -2.192 -2.722 -11.349 1.00 0.00 C ATOM 1061 C LYS A 69 -2.978 -1.807 -10.409 1.00 0.00 C ATOM 1062 O LYS A 69 -4.202 -1.894 -10.314 1.00 0.00 O ATOM 1063 CB LYS A 69 -2.445 -2.289 -12.787 1.00 0.00 C ATOM 1064 CG LYS A 69 -1.926 -3.362 -13.746 1.00 0.00 C ATOM 1065 CD LYS A 69 -3.106 -4.096 -14.383 1.00 0.00 C ATOM 1066 CE LYS A 69 -2.613 -4.913 -15.577 1.00 0.00 C ATOM 1067 NZ LYS A 69 -3.428 -6.154 -15.699 1.00 0.00 N ATOM 0 H LYS A 69 -2.835 -4.567 -12.090 1.00 0.00 H new ATOM 0 HA LYS A 69 -1.139 -2.631 -11.082 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -3.511 -2.129 -12.947 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -1.947 -1.339 -12.984 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -1.309 -2.905 -14.519 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -1.293 -4.068 -13.209 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -3.579 -4.751 -13.651 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -3.862 -3.380 -14.706 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -2.689 -4.324 -16.491 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -1.561 -5.167 -15.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -3.093 -6.711 -16.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -3.334 -6.718 -14.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -4.427 -5.901 -15.841 1.00 0.00 H new ATOM 1081 N GLY A 70 -2.253 -0.904 -9.746 1.00 0.00 N ATOM 1082 CA GLY A 70 -2.863 0.065 -8.840 1.00 0.00 C ATOM 1083 C GLY A 70 -3.055 -0.507 -7.441 1.00 0.00 C ATOM 1084 O GLY A 70 -3.423 0.210 -6.511 1.00 0.00 O ATOM 0 H GLY A 70 -1.239 -0.825 -9.822 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -2.236 0.955 -8.785 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -3.828 0.378 -9.240 1.00 0.00 H new ATOM 1088 N ASP A 71 -2.829 -1.800 -7.298 1.00 0.00 N ATOM 1089 CA ASP A 71 -3.002 -2.445 -6.007 1.00 0.00 C ATOM 1090 C ASP A 71 -2.020 -1.894 -4.978 1.00 0.00 C ATOM 1091 O ASP A 71 -0.821 -1.789 -5.238 1.00 0.00 O ATOM 1092 CB ASP A 71 -2.800 -3.948 -6.146 1.00 0.00 C ATOM 1093 CG ASP A 71 -1.311 -4.271 -6.198 1.00 0.00 C ATOM 1094 OD1 ASP A 71 -0.637 -4.025 -5.212 1.00 0.00 O ATOM 1095 OD2 ASP A 71 -0.867 -4.759 -7.225 1.00 0.00 O ATOM 0 H ASP A 71 -2.528 -2.420 -8.050 1.00 0.00 H new ATOM 0 HA ASP A 71 -4.015 -2.239 -5.662 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -3.264 -4.465 -5.306 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -3.290 -4.307 -7.051 1.00 0.00 H new ATOM 1100 N LEU A 72 -2.542 -1.556 -3.805 1.00 0.00 N ATOM 1101 CA LEU A 72 -1.718 -1.029 -2.727 1.00 0.00 C ATOM 1102 C LEU A 72 -1.492 -2.109 -1.675 1.00 0.00 C ATOM 1103 O LEU A 72 -2.358 -2.953 -1.446 1.00 0.00 O ATOM 1104 CB LEU A 72 -2.410 0.184 -2.091 1.00 0.00 C ATOM 1105 CG LEU A 72 -1.595 0.693 -0.899 1.00 0.00 C ATOM 1106 CD1 LEU A 72 -0.433 1.546 -1.399 1.00 0.00 C ATOM 1107 CD2 LEU A 72 -2.492 1.541 0.005 1.00 0.00 C ATOM 0 H LEU A 72 -3.533 -1.638 -3.577 1.00 0.00 H new ATOM 0 HA LEU A 72 -0.754 -0.718 -3.131 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.521 0.977 -2.830 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -3.413 -0.090 -1.764 1.00 0.00 H new ATOM 0 HG LEU A 72 -1.206 -0.157 -0.338 1.00 0.00 H new ATOM 0 HD11 LEU A 72 0.146 1.907 -0.549 1.00 0.00 H new ATOM 0 HD12 LEU A 72 0.208 0.946 -2.045 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.821 2.396 -1.961 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -1.913 1.904 0.854 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -2.880 2.389 -0.559 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -3.323 0.935 0.365 1.00 0.00 H new ATOM 1119 N ILE A 73 -0.323 -2.082 -1.042 1.00 0.00 N ATOM 1120 CA ILE A 73 -0.006 -3.072 -0.024 1.00 0.00 C ATOM 1121 C ILE A 73 0.224 -2.407 1.318 1.00 0.00 C ATOM 1122 O ILE A 73 0.741 -1.290 1.406 1.00 0.00 O ATOM 1123 CB ILE A 73 1.234 -3.898 -0.402 1.00 0.00 C ATOM 1124 CG1 ILE A 73 2.463 -3.346 0.309 1.00 0.00 C ATOM 1125 CG2 ILE A 73 1.430 -3.834 -1.901 1.00 0.00 C ATOM 1126 CD1 ILE A 73 2.452 -3.785 1.778 1.00 0.00 C ATOM 0 H ILE A 73 0.410 -1.394 -1.214 1.00 0.00 H new ATOM 0 HA ILE A 73 -0.861 -3.744 0.045 1.00 0.00 H new ATOM 0 HB ILE A 73 1.091 -4.934 -0.096 1.00 0.00 H new ATOM 0 HG12 ILE A 73 3.369 -3.703 -0.180 1.00 0.00 H new ATOM 0 HG13 ILE A 73 2.474 -2.258 0.245 1.00 0.00 H new ATOM 0 HG21 ILE A 73 2.308 -4.417 -2.178 1.00 0.00 H new ATOM 0 HG22 ILE A 73 0.551 -4.241 -2.401 1.00 0.00 H new ATOM 0 HG23 ILE A 73 1.573 -2.797 -2.205 1.00 0.00 H new ATOM 0 HD11 ILE A 73 3.333 -3.388 2.283 1.00 0.00 H new ATOM 0 HD12 ILE A 73 1.553 -3.406 2.264 1.00 0.00 H new ATOM 0 HD13 ILE A 73 2.462 -4.874 1.833 1.00 0.00 H new ATOM 1138 N GLY A 74 -0.137 -3.140 2.348 1.00 0.00 N ATOM 1139 CA GLY A 74 0.035 -2.684 3.723 1.00 0.00 C ATOM 1140 C GLY A 74 -1.301 -2.620 4.456 1.00 0.00 C ATOM 1141 O GLY A 74 -2.339 -2.348 3.855 1.00 0.00 O ATOM 0 H GLY A 74 -0.557 -4.066 2.264 1.00 0.00 H new ATOM 0 HA2 GLY A 74 0.710 -3.358 4.250 1.00 0.00 H new ATOM 0 HA3 GLY A 74 0.502 -1.699 3.726 1.00 0.00 H new ATOM 1145 N SER A 75 -1.261 -2.859 5.765 1.00 0.00 N ATOM 1146 CA SER A 75 -2.471 -2.812 6.579 1.00 0.00 C ATOM 1147 C SER A 75 -2.827 -1.364 6.903 1.00 0.00 C ATOM 1148 O SER A 75 -1.961 -0.576 7.283 1.00 0.00 O ATOM 1149 CB SER A 75 -2.265 -3.586 7.885 1.00 0.00 C ATOM 1150 OG SER A 75 -0.878 -3.628 8.193 1.00 0.00 O ATOM 0 H SER A 75 -0.410 -3.085 6.280 1.00 0.00 H new ATOM 0 HA SER A 75 -3.284 -3.270 6.015 1.00 0.00 H new ATOM 0 HB2 SER A 75 -2.815 -3.107 8.695 1.00 0.00 H new ATOM 0 HB3 SER A 75 -2.658 -4.598 7.787 1.00 0.00 H new ATOM 0 HG SER A 75 -0.553 -4.549 8.111 1.00 0.00 H new ATOM 1156 N ASP A 76 -4.100 -1.019 6.752 1.00 0.00 N ATOM 1157 CA ASP A 76 -4.545 0.340 7.034 1.00 0.00 C ATOM 1158 C ASP A 76 -4.151 0.748 8.451 1.00 0.00 C ATOM 1159 O ASP A 76 -3.404 0.040 9.126 1.00 0.00 O ATOM 1160 CB ASP A 76 -6.063 0.439 6.873 1.00 0.00 C ATOM 1161 CG ASP A 76 -6.758 -0.375 7.959 1.00 0.00 C ATOM 1162 OD1 ASP A 76 -6.084 -0.777 8.893 1.00 0.00 O ATOM 1163 OD2 ASP A 76 -7.954 -0.583 7.841 1.00 0.00 O ATOM 0 H ASP A 76 -4.835 -1.653 6.439 1.00 0.00 H new ATOM 0 HA ASP A 76 -4.063 1.015 6.326 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -6.376 1.481 6.932 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -6.357 0.074 5.889 1.00 0.00 H new ATOM 1168 N SER A 77 -4.657 1.894 8.893 1.00 0.00 N ATOM 1169 CA SER A 77 -4.351 2.389 10.231 1.00 0.00 C ATOM 1170 C SER A 77 -2.882 2.789 10.329 1.00 0.00 C ATOM 1171 O SER A 77 -2.221 2.525 11.334 1.00 0.00 O ATOM 1172 CB SER A 77 -4.659 1.312 11.271 1.00 0.00 C ATOM 1173 OG SER A 77 -5.286 1.913 12.397 1.00 0.00 O ATOM 0 H SER A 77 -5.277 2.494 8.349 1.00 0.00 H new ATOM 0 HA SER A 77 -4.970 3.265 10.424 1.00 0.00 H new ATOM 0 HB2 SER A 77 -5.310 0.550 10.841 1.00 0.00 H new ATOM 0 HB3 SER A 77 -3.740 0.811 11.576 1.00 0.00 H new ATOM 0 HG SER A 77 -5.487 1.225 13.066 1.00 0.00 H new ATOM 1179 N LEU A 78 -2.379 3.426 9.277 1.00 0.00 N ATOM 1180 CA LEU A 78 -0.986 3.860 9.250 1.00 0.00 C ATOM 1181 C LEU A 78 -0.657 4.693 10.487 1.00 0.00 C ATOM 1182 O LEU A 78 0.499 5.050 10.717 1.00 0.00 O ATOM 1183 CB LEU A 78 -0.725 4.690 7.989 1.00 0.00 C ATOM 1184 CG LEU A 78 -0.244 3.771 6.864 1.00 0.00 C ATOM 1185 CD1 LEU A 78 -1.290 2.685 6.610 1.00 0.00 C ATOM 1186 CD2 LEU A 78 -0.038 4.591 5.585 1.00 0.00 C ATOM 0 H LEU A 78 -2.911 3.652 8.437 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.349 2.976 9.244 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.635 5.207 7.686 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.024 5.455 8.193 1.00 0.00 H new ATOM 0 HG LEU A 78 0.699 3.307 7.153 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.948 2.030 5.809 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.436 2.101 7.519 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -2.233 3.149 6.321 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.305 3.936 4.784 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.980 5.056 5.295 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.708 5.365 5.765 1.00 0.00 H new ATOM 1198 N THR A 79 -1.681 5.004 11.275 1.00 0.00 N ATOM 1199 CA THR A 79 -1.495 5.803 12.482 1.00 0.00 C ATOM 1200 C THR A 79 -1.213 4.915 13.690 1.00 0.00 C ATOM 1201 O THR A 79 -0.658 5.370 14.689 1.00 0.00 O ATOM 1202 CB THR A 79 -2.751 6.635 12.749 1.00 0.00 C ATOM 1203 OG1 THR A 79 -3.347 7.002 11.511 1.00 0.00 O ATOM 1204 CG2 THR A 79 -2.374 7.893 13.530 1.00 0.00 C ATOM 0 H THR A 79 -2.644 4.717 11.101 1.00 0.00 H new ATOM 0 HA THR A 79 -0.639 6.460 12.326 1.00 0.00 H new ATOM 0 HB THR A 79 -3.460 6.047 13.332 1.00 0.00 H new ATOM 0 HG1 THR A 79 -4.320 6.902 11.574 1.00 0.00 H new ATOM 0 HG21 THR A 79 -3.269 8.485 13.720 1.00 0.00 H new ATOM 0 HG22 THR A 79 -1.919 7.609 14.479 1.00 0.00 H new ATOM 0 HG23 THR A 79 -1.665 8.483 12.949 1.00 0.00 H new ATOM 1212 N LYS A 80 -1.605 3.650 13.594 1.00 0.00 N ATOM 1213 CA LYS A 80 -1.394 2.712 14.690 1.00 0.00 C ATOM 1214 C LYS A 80 0.040 2.193 14.688 1.00 0.00 C ATOM 1215 O LYS A 80 0.300 1.070 15.113 1.00 0.00 O ATOM 1216 CB LYS A 80 -2.362 1.534 14.566 1.00 0.00 C ATOM 1217 CG LYS A 80 -2.282 0.673 15.830 1.00 0.00 C ATOM 1218 CD LYS A 80 -2.038 -0.789 15.446 1.00 0.00 C ATOM 1219 CE LYS A 80 -3.342 -1.405 14.935 1.00 0.00 C ATOM 1220 NZ LYS A 80 -3.855 -2.380 15.939 1.00 0.00 N ATOM 0 H LYS A 80 -2.067 3.253 12.776 1.00 0.00 H new ATOM 0 HA LYS A 80 -1.577 3.237 15.628 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -3.379 1.899 14.425 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -2.114 0.936 13.689 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -1.477 1.029 16.473 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -3.207 0.760 16.399 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -1.268 -0.851 14.677 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -1.673 -1.347 16.308 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -4.082 -0.624 14.759 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -3.172 -1.904 13.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -4.742 -2.800 15.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -3.150 -3.131 16.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -4.032 -1.891 16.839 1.00 0.00 H new ATOM 1234 N GLU A 81 0.962 3.020 14.204 1.00 0.00 N ATOM 1235 CA GLU A 81 2.374 2.643 14.144 1.00 0.00 C ATOM 1236 C GLU A 81 2.687 1.514 15.124 1.00 0.00 C ATOM 1237 O GLU A 81 2.994 1.758 16.291 1.00 0.00 O ATOM 1238 CB GLU A 81 3.250 3.856 14.465 1.00 0.00 C ATOM 1239 CG GLU A 81 2.372 4.997 14.983 1.00 0.00 C ATOM 1240 CD GLU A 81 3.237 6.048 15.669 1.00 0.00 C ATOM 1241 OE1 GLU A 81 3.805 6.869 14.968 1.00 0.00 O ATOM 1242 OE2 GLU A 81 3.316 6.018 16.886 1.00 0.00 O ATOM 0 H GLU A 81 0.759 3.954 13.848 1.00 0.00 H new ATOM 0 HA GLU A 81 2.587 2.291 13.135 1.00 0.00 H new ATOM 0 HB2 GLU A 81 3.998 3.590 15.212 1.00 0.00 H new ATOM 0 HB3 GLU A 81 3.790 4.174 13.573 1.00 0.00 H new ATOM 0 HG2 GLU A 81 1.823 5.449 14.157 1.00 0.00 H new ATOM 0 HG3 GLU A 81 1.632 4.609 15.683 1.00 0.00 H new ATOM 1249 N GLN A 82 2.614 0.279 14.635 1.00 0.00 N ATOM 1250 CA GLN A 82 2.897 -0.888 15.465 1.00 0.00 C ATOM 1251 C GLN A 82 3.773 -1.876 14.705 1.00 0.00 C ATOM 1252 O GLN A 82 4.052 -1.690 13.521 1.00 0.00 O ATOM 1253 CB GLN A 82 1.599 -1.579 15.892 1.00 0.00 C ATOM 1254 CG GLN A 82 1.525 -1.645 17.414 1.00 0.00 C ATOM 1255 CD GLN A 82 1.686 -0.253 18.015 1.00 0.00 C ATOM 1256 OE1 GLN A 82 1.146 0.718 17.486 1.00 0.00 O ATOM 1257 NE2 GLN A 82 2.403 -0.097 19.093 1.00 0.00 N ATOM 0 H GLN A 82 2.362 0.061 13.671 1.00 0.00 H new ATOM 0 HA GLN A 82 3.424 -0.549 16.356 1.00 0.00 H new ATOM 0 HB2 GLN A 82 0.740 -1.034 15.500 1.00 0.00 H new ATOM 0 HB3 GLN A 82 1.557 -2.584 15.473 1.00 0.00 H new ATOM 0 HG2 GLN A 82 0.570 -2.072 17.720 1.00 0.00 H new ATOM 0 HG3 GLN A 82 2.305 -2.305 17.794 1.00 0.00 H new ATOM 0 HE21 GLN A 82 2.850 -0.903 19.530 1.00 0.00 H new ATOM 0 HE22 GLN A 82 2.517 0.831 19.500 1.00 0.00 H new ATOM 1266 N VAL A 83 4.208 -2.922 15.395 1.00 0.00 N ATOM 1267 CA VAL A 83 5.056 -3.930 14.774 1.00 0.00 C ATOM 1268 C VAL A 83 4.242 -4.755 13.777 1.00 0.00 C ATOM 1269 O VAL A 83 3.319 -5.476 14.155 1.00 0.00 O ATOM 1270 CB VAL A 83 5.681 -4.828 15.855 1.00 0.00 C ATOM 1271 CG1 VAL A 83 5.009 -4.546 17.196 1.00 0.00 C ATOM 1272 CG2 VAL A 83 5.508 -6.312 15.503 1.00 0.00 C ATOM 0 H VAL A 83 3.990 -3.094 16.376 1.00 0.00 H new ATOM 0 HA VAL A 83 5.863 -3.439 14.230 1.00 0.00 H new ATOM 0 HB VAL A 83 6.747 -4.608 15.914 1.00 0.00 H new ATOM 0 HG11 VAL A 83 5.450 -5.181 17.965 1.00 0.00 H new ATOM 0 HG12 VAL A 83 5.154 -3.499 17.463 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.942 -4.756 17.120 1.00 0.00 H new ATOM 0 HG21 VAL A 83 5.958 -6.926 16.283 1.00 0.00 H new ATOM 0 HG22 VAL A 83 4.446 -6.546 15.425 1.00 0.00 H new ATOM 0 HG23 VAL A 83 5.996 -6.519 14.551 1.00 0.00 H new ATOM 1282 N ILE A 84 4.589 -4.633 12.501 1.00 0.00 N ATOM 1283 CA ILE A 84 3.888 -5.363 11.453 1.00 0.00 C ATOM 1284 C ILE A 84 4.868 -6.174 10.620 1.00 0.00 C ATOM 1285 O ILE A 84 5.878 -5.653 10.149 1.00 0.00 O ATOM 1286 CB ILE A 84 3.133 -4.387 10.550 1.00 0.00 C ATOM 1287 CG1 ILE A 84 2.210 -3.512 11.403 1.00 0.00 C ATOM 1288 CG2 ILE A 84 2.297 -5.167 9.535 1.00 0.00 C ATOM 1289 CD1 ILE A 84 1.948 -2.189 10.681 1.00 0.00 C ATOM 0 H ILE A 84 5.348 -4.038 12.169 1.00 0.00 H new ATOM 0 HA ILE A 84 3.178 -6.044 11.924 1.00 0.00 H new ATOM 0 HB ILE A 84 3.849 -3.757 10.022 1.00 0.00 H new ATOM 0 HG12 ILE A 84 1.269 -4.030 11.588 1.00 0.00 H new ATOM 0 HG13 ILE A 84 2.666 -3.324 12.375 1.00 0.00 H new ATOM 0 HG21 ILE A 84 1.760 -4.469 8.893 1.00 0.00 H new ATOM 0 HG22 ILE A 84 2.952 -5.790 8.926 1.00 0.00 H new ATOM 0 HG23 ILE A 84 1.582 -5.799 10.062 1.00 0.00 H new ATOM 0 HD11 ILE A 84 1.291 -1.567 11.289 1.00 0.00 H new ATOM 0 HD12 ILE A 84 2.892 -1.669 10.519 1.00 0.00 H new ATOM 0 HD13 ILE A 84 1.474 -2.387 9.720 1.00 0.00 H new ATOM 1301 N LYS A 85 4.563 -7.453 10.447 1.00 0.00 N ATOM 1302 CA LYS A 85 5.419 -8.333 9.669 1.00 0.00 C ATOM 1303 C LYS A 85 4.578 -9.218 8.759 1.00 0.00 C ATOM 1304 O LYS A 85 3.564 -9.769 9.182 1.00 0.00 O ATOM 1305 CB LYS A 85 6.260 -9.204 10.604 1.00 0.00 C ATOM 1306 CG LYS A 85 5.458 -9.510 11.864 1.00 0.00 C ATOM 1307 CD LYS A 85 6.173 -10.593 12.679 1.00 0.00 C ATOM 1308 CE LYS A 85 7.134 -9.949 13.676 1.00 0.00 C ATOM 1309 NZ LYS A 85 7.640 -8.655 13.133 1.00 0.00 N ATOM 0 H LYS A 85 3.732 -7.901 10.834 1.00 0.00 H new ATOM 0 HA LYS A 85 6.081 -7.723 9.055 1.00 0.00 H new ATOM 0 HB2 LYS A 85 6.540 -10.131 10.103 1.00 0.00 H new ATOM 0 HB3 LYS A 85 7.186 -8.690 10.864 1.00 0.00 H new ATOM 0 HG2 LYS A 85 5.344 -8.606 12.463 1.00 0.00 H new ATOM 0 HG3 LYS A 85 4.456 -9.844 11.597 1.00 0.00 H new ATOM 0 HD2 LYS A 85 5.441 -11.203 13.209 1.00 0.00 H new ATOM 0 HD3 LYS A 85 6.721 -11.259 12.012 1.00 0.00 H new ATOM 0 HE2 LYS A 85 6.627 -9.781 14.626 1.00 0.00 H new ATOM 0 HE3 LYS A 85 7.969 -10.621 13.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 8.306 -8.231 13.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 8.125 -8.824 12.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 6.841 -8.006 12.981 1.00 0.00 H new ATOM 1323 N THR A 86 5.001 -9.351 7.510 1.00 0.00 N ATOM 1324 CA THR A 86 4.264 -10.176 6.559 1.00 0.00 C ATOM 1325 C THR A 86 4.491 -11.657 6.862 1.00 0.00 C ATOM 1326 O THR A 86 5.614 -12.156 6.783 1.00 0.00 O ATOM 1327 CB THR A 86 4.686 -9.839 5.121 1.00 0.00 C ATOM 1328 OG1 THR A 86 4.770 -8.427 4.980 1.00 0.00 O ATOM 1329 CG2 THR A 86 3.644 -10.388 4.146 1.00 0.00 C ATOM 0 H THR A 86 5.838 -8.906 7.134 1.00 0.00 H new ATOM 0 HA THR A 86 3.199 -9.965 6.658 1.00 0.00 H new ATOM 0 HB THR A 86 5.656 -10.287 4.906 1.00 0.00 H new ATOM 0 HG1 THR A 86 5.191 -8.208 4.122 1.00 0.00 H new ATOM 0 HG21 THR A 86 3.941 -10.150 3.124 1.00 0.00 H new ATOM 0 HG22 THR A 86 3.573 -11.470 4.261 1.00 0.00 H new ATOM 0 HG23 THR A 86 2.675 -9.936 4.357 1.00 0.00 H new ATOM 1337 N ASN A 87 3.410 -12.342 7.240 1.00 0.00 N ATOM 1338 CA ASN A 87 3.480 -13.759 7.594 1.00 0.00 C ATOM 1339 C ASN A 87 3.518 -14.655 6.357 1.00 0.00 C ATOM 1340 O ASN A 87 3.991 -15.787 6.421 1.00 0.00 O ATOM 1341 CB ASN A 87 2.269 -14.132 8.452 1.00 0.00 C ATOM 1342 CG ASN A 87 2.565 -15.398 9.248 1.00 0.00 C ATOM 1343 OD1 ASN A 87 2.359 -16.506 8.753 1.00 0.00 O ATOM 1344 ND2 ASN A 87 3.040 -15.299 10.458 1.00 0.00 N ATOM 0 H ASN A 87 2.476 -11.937 7.309 1.00 0.00 H new ATOM 0 HA ASN A 87 4.404 -13.917 8.151 1.00 0.00 H new ATOM 0 HB2 ASN A 87 2.028 -13.314 9.131 1.00 0.00 H new ATOM 0 HB3 ASN A 87 1.397 -14.287 7.817 1.00 0.00 H new ATOM 0 HD21 ASN A 87 3.242 -16.141 10.997 1.00 0.00 H new ATOM 0 HD22 ASN A 87 3.210 -14.380 10.866 1.00 0.00 H new ATOM 1351 N ALA A 88 3.023 -14.148 5.236 1.00 0.00 N ATOM 1352 CA ALA A 88 3.017 -14.927 4.002 1.00 0.00 C ATOM 1353 C ALA A 88 4.271 -14.629 3.195 1.00 0.00 C ATOM 1354 O ALA A 88 5.196 -13.993 3.688 1.00 0.00 O ATOM 1355 CB ALA A 88 1.774 -14.598 3.161 1.00 0.00 C ATOM 0 H ALA A 88 2.625 -13.213 5.154 1.00 0.00 H new ATOM 0 HA ALA A 88 2.995 -15.985 4.263 1.00 0.00 H new ATOM 0 HB1 ALA A 88 1.788 -15.189 2.245 1.00 0.00 H new ATOM 0 HB2 ALA A 88 0.876 -14.834 3.732 1.00 0.00 H new ATOM 0 HB3 ALA A 88 1.776 -13.538 2.909 1.00 0.00 H new ATOM 1361 N ASN A 89 4.295 -15.094 1.957 1.00 0.00 N ATOM 1362 CA ASN A 89 5.433 -14.858 1.080 1.00 0.00 C ATOM 1363 C ASN A 89 4.978 -13.953 -0.054 1.00 0.00 C ATOM 1364 O ASN A 89 3.800 -13.945 -0.378 1.00 0.00 O ATOM 1365 CB ASN A 89 5.943 -16.183 0.507 1.00 0.00 C ATOM 1366 CG ASN A 89 5.762 -17.307 1.524 1.00 0.00 C ATOM 1367 OD1 ASN A 89 5.019 -17.158 2.493 1.00 0.00 O ATOM 1368 ND2 ASN A 89 6.402 -18.432 1.357 1.00 0.00 N ATOM 0 H ASN A 89 3.541 -15.637 1.536 1.00 0.00 H new ATOM 0 HA ASN A 89 6.242 -14.390 1.640 1.00 0.00 H new ATOM 0 HB2 ASN A 89 5.403 -16.422 -0.409 1.00 0.00 H new ATOM 0 HB3 ASN A 89 6.996 -16.090 0.241 1.00 0.00 H new ATOM 0 HD21 ASN A 89 6.286 -19.189 2.030 1.00 0.00 H new ATOM 0 HD22 ASN A 89 7.018 -18.554 0.553 1.00 0.00 H new ATOM 1375 N VAL A 90 5.885 -13.196 -0.663 1.00 0.00 N ATOM 1376 CA VAL A 90 5.503 -12.335 -1.747 1.00 0.00 C ATOM 1377 C VAL A 90 6.263 -12.736 -2.992 1.00 0.00 C ATOM 1378 O VAL A 90 7.493 -12.809 -2.974 1.00 0.00 O ATOM 1379 CB VAL A 90 5.816 -10.896 -1.411 1.00 0.00 C ATOM 1380 CG1 VAL A 90 5.816 -10.112 -2.697 1.00 0.00 C ATOM 1381 CG2 VAL A 90 4.771 -10.325 -0.458 1.00 0.00 C ATOM 0 H VAL A 90 6.875 -13.169 -0.419 1.00 0.00 H new ATOM 0 HA VAL A 90 4.431 -12.432 -1.917 1.00 0.00 H new ATOM 0 HB VAL A 90 6.787 -10.833 -0.920 1.00 0.00 H new ATOM 0 HG11 VAL A 90 6.040 -9.066 -2.486 1.00 0.00 H new ATOM 0 HG12 VAL A 90 6.573 -10.516 -3.370 1.00 0.00 H new ATOM 0 HG13 VAL A 90 4.836 -10.185 -3.168 1.00 0.00 H new ATOM 0 HG21 VAL A 90 5.016 -9.288 -0.229 1.00 0.00 H new ATOM 0 HG22 VAL A 90 3.788 -10.371 -0.926 1.00 0.00 H new ATOM 0 HG23 VAL A 90 4.762 -10.907 0.463 1.00 0.00 H new ATOM 1391 N LYS A 91 5.525 -12.981 -4.065 1.00 0.00 N ATOM 1392 CA LYS A 91 6.137 -13.366 -5.325 1.00 0.00 C ATOM 1393 C LYS A 91 5.486 -12.618 -6.481 1.00 0.00 C ATOM 1394 O LYS A 91 4.292 -12.772 -6.739 1.00 0.00 O ATOM 1395 CB LYS A 91 5.984 -14.876 -5.541 1.00 0.00 C ATOM 1396 CG LYS A 91 6.579 -15.271 -6.898 1.00 0.00 C ATOM 1397 CD LYS A 91 6.178 -16.709 -7.230 1.00 0.00 C ATOM 1398 CE LYS A 91 4.921 -16.700 -8.102 1.00 0.00 C ATOM 1399 NZ LYS A 91 4.285 -18.048 -8.067 1.00 0.00 N ATOM 0 H LYS A 91 4.507 -12.920 -4.087 1.00 0.00 H new ATOM 0 HA LYS A 91 7.196 -13.111 -5.289 1.00 0.00 H new ATOM 0 HB2 LYS A 91 6.487 -15.420 -4.741 1.00 0.00 H new ATOM 0 HB3 LYS A 91 4.931 -15.153 -5.501 1.00 0.00 H new ATOM 0 HG2 LYS A 91 6.223 -14.594 -7.674 1.00 0.00 H new ATOM 0 HG3 LYS A 91 7.665 -15.182 -6.871 1.00 0.00 H new ATOM 0 HD2 LYS A 91 6.992 -17.213 -7.751 1.00 0.00 H new ATOM 0 HD3 LYS A 91 5.993 -17.267 -6.312 1.00 0.00 H new ATOM 0 HE2 LYS A 91 4.221 -15.946 -7.742 1.00 0.00 H new ATOM 0 HE3 LYS A 91 5.178 -16.433 -9.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 3.430 -18.044 -8.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 4.954 -18.757 -8.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 4.027 -18.285 -7.088 1.00 0.00 H new ATOM 1413 N ALA A 92 6.282 -11.825 -7.188 1.00 0.00 N ATOM 1414 CA ALA A 92 5.775 -11.079 -8.326 1.00 0.00 C ATOM 1415 C ALA A 92 5.475 -12.044 -9.463 1.00 0.00 C ATOM 1416 O ALA A 92 6.379 -12.721 -9.957 1.00 0.00 O ATOM 1417 CB ALA A 92 6.805 -10.045 -8.782 1.00 0.00 C ATOM 0 H ALA A 92 7.273 -11.684 -6.993 1.00 0.00 H new ATOM 0 HA ALA A 92 4.863 -10.558 -8.036 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.413 -9.493 -9.636 1.00 0.00 H new ATOM 0 HB2 ALA A 92 7.012 -9.353 -7.966 1.00 0.00 H new ATOM 0 HB3 ALA A 92 7.726 -10.552 -9.070 1.00 0.00 H new ATOM 1423 N LEU A 93 4.206 -12.103 -9.858 1.00 0.00 N ATOM 1424 CA LEU A 93 3.774 -12.995 -10.928 1.00 0.00 C ATOM 1425 C LEU A 93 4.249 -12.470 -12.276 1.00 0.00 C ATOM 1426 O LEU A 93 4.817 -13.207 -13.083 1.00 0.00 O ATOM 1427 CB LEU A 93 2.246 -13.086 -10.927 1.00 0.00 C ATOM 1428 CG LEU A 93 1.803 -14.547 -11.033 1.00 0.00 C ATOM 1429 CD1 LEU A 93 2.390 -15.353 -9.872 1.00 0.00 C ATOM 1430 CD2 LEU A 93 0.276 -14.610 -10.973 1.00 0.00 C ATOM 0 H LEU A 93 3.458 -11.542 -9.451 1.00 0.00 H new ATOM 0 HA LEU A 93 4.204 -13.983 -10.762 1.00 0.00 H new ATOM 0 HB2 LEU A 93 1.849 -12.643 -10.014 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.840 -12.514 -11.761 1.00 0.00 H new ATOM 0 HG LEU A 93 2.156 -14.967 -11.975 1.00 0.00 H new ATOM 0 HD11 LEU A 93 2.071 -16.392 -9.953 1.00 0.00 H new ATOM 0 HD12 LEU A 93 3.478 -15.303 -9.908 1.00 0.00 H new ATOM 0 HD13 LEU A 93 2.039 -14.938 -8.927 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -0.049 -15.648 -11.048 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -0.069 -14.189 -10.028 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -0.145 -14.038 -11.800 1.00 0.00 H new ATOM 1442 N THR A 94 4.017 -11.185 -12.500 1.00 0.00 N ATOM 1443 CA THR A 94 4.426 -10.537 -13.737 1.00 0.00 C ATOM 1444 C THR A 94 5.231 -9.290 -13.409 1.00 0.00 C ATOM 1445 O THR A 94 4.959 -8.615 -12.413 1.00 0.00 O ATOM 1446 CB THR A 94 3.197 -10.153 -14.562 1.00 0.00 C ATOM 1447 OG1 THR A 94 2.389 -9.257 -13.813 1.00 0.00 O ATOM 1448 CG2 THR A 94 2.391 -11.407 -14.899 1.00 0.00 C ATOM 0 H THR A 94 3.546 -10.568 -11.838 1.00 0.00 H new ATOM 0 HA THR A 94 5.038 -11.227 -14.317 1.00 0.00 H new ATOM 0 HB THR A 94 3.517 -9.672 -15.486 1.00 0.00 H new ATOM 0 HG1 THR A 94 1.521 -9.150 -14.256 1.00 0.00 H new ATOM 0 HG21 THR A 94 1.516 -11.130 -15.487 1.00 0.00 H new ATOM 0 HG22 THR A 94 3.011 -12.095 -15.474 1.00 0.00 H new ATOM 0 HG23 THR A 94 2.070 -11.892 -13.977 1.00 0.00 H new ATOM 1456 N TYR A 95 6.219 -8.983 -14.241 1.00 0.00 N ATOM 1457 CA TYR A 95 7.051 -7.813 -14.003 1.00 0.00 C ATOM 1458 C TYR A 95 6.178 -6.617 -13.664 1.00 0.00 C ATOM 1459 O TYR A 95 5.328 -6.210 -14.456 1.00 0.00 O ATOM 1460 CB TYR A 95 7.888 -7.501 -15.241 1.00 0.00 C ATOM 1461 CG TYR A 95 7.510 -8.444 -16.356 1.00 0.00 C ATOM 1462 CD1 TYR A 95 6.275 -8.305 -17.001 1.00 0.00 C ATOM 1463 CD2 TYR A 95 8.393 -9.457 -16.746 1.00 0.00 C ATOM 1464 CE1 TYR A 95 5.923 -9.180 -18.035 1.00 0.00 C ATOM 1465 CE2 TYR A 95 8.042 -10.333 -17.780 1.00 0.00 C ATOM 1466 CZ TYR A 95 6.806 -10.194 -18.425 1.00 0.00 C ATOM 1467 OH TYR A 95 6.459 -11.058 -19.444 1.00 0.00 O ATOM 0 H TYR A 95 6.460 -9.520 -15.074 1.00 0.00 H new ATOM 0 HA TYR A 95 7.717 -8.022 -13.166 1.00 0.00 H new ATOM 0 HB2 TYR A 95 7.725 -6.469 -15.552 1.00 0.00 H new ATOM 0 HB3 TYR A 95 8.949 -7.601 -15.010 1.00 0.00 H new ATOM 0 HD1 TYR A 95 5.594 -7.522 -16.701 1.00 0.00 H new ATOM 0 HD2 TYR A 95 9.346 -9.563 -16.249 1.00 0.00 H new ATOM 0 HE1 TYR A 95 4.970 -9.073 -18.532 1.00 0.00 H new ATOM 0 HE2 TYR A 95 8.723 -11.115 -18.080 1.00 0.00 H new ATOM 0 HH TYR A 95 7.184 -11.701 -19.589 1.00 0.00 H new ATOM 1477 N CYS A 96 6.384 -6.064 -12.476 1.00 0.00 N ATOM 1478 CA CYS A 96 5.597 -4.923 -12.042 1.00 0.00 C ATOM 1479 C CYS A 96 6.460 -3.897 -11.325 1.00 0.00 C ATOM 1480 O CYS A 96 7.411 -4.242 -10.621 1.00 0.00 O ATOM 1481 CB CYS A 96 4.485 -5.389 -11.102 1.00 0.00 C ATOM 1482 SG CYS A 96 5.130 -5.496 -9.414 1.00 0.00 S ATOM 0 H CYS A 96 7.082 -6.384 -11.804 1.00 0.00 H new ATOM 0 HA CYS A 96 5.167 -4.456 -12.928 1.00 0.00 H new ATOM 0 HB2 CYS A 96 3.647 -4.693 -11.139 1.00 0.00 H new ATOM 0 HB3 CYS A 96 4.107 -6.360 -11.421 1.00 0.00 H new ATOM 0 HG CYS A 96 4.185 -5.890 -8.613 1.00 0.00 H new ATOM 1488 N ASP A 97 6.098 -2.634 -11.493 1.00 0.00 N ATOM 1489 CA ASP A 97 6.816 -1.549 -10.844 1.00 0.00 C ATOM 1490 C ASP A 97 6.102 -1.187 -9.550 1.00 0.00 C ATOM 1491 O ASP A 97 4.888 -0.977 -9.544 1.00 0.00 O ATOM 1492 CB ASP A 97 6.877 -0.328 -11.762 1.00 0.00 C ATOM 1493 CG ASP A 97 7.506 0.846 -11.022 1.00 0.00 C ATOM 1494 OD1 ASP A 97 8.627 0.699 -10.564 1.00 0.00 O ATOM 1495 OD2 ASP A 97 6.858 1.874 -10.922 1.00 0.00 O ATOM 0 H ASP A 97 5.313 -2.336 -12.072 1.00 0.00 H new ATOM 0 HA ASP A 97 7.835 -1.869 -10.627 1.00 0.00 H new ATOM 0 HB2 ASP A 97 7.459 -0.561 -12.654 1.00 0.00 H new ATOM 0 HB3 ASP A 97 5.874 -0.063 -12.096 1.00 0.00 H new ATOM 1500 N LEU A 98 6.844 -1.140 -8.455 1.00 0.00 N ATOM 1501 CA LEU A 98 6.240 -0.829 -7.169 1.00 0.00 C ATOM 1502 C LEU A 98 6.884 0.388 -6.524 1.00 0.00 C ATOM 1503 O LEU A 98 8.108 0.490 -6.437 1.00 0.00 O ATOM 1504 CB LEU A 98 6.378 -2.028 -6.228 1.00 0.00 C ATOM 1505 CG LEU A 98 6.118 -3.325 -6.999 1.00 0.00 C ATOM 1506 CD1 LEU A 98 7.413 -3.809 -7.657 1.00 0.00 C ATOM 1507 CD2 LEU A 98 5.614 -4.396 -6.030 1.00 0.00 C ATOM 0 H LEU A 98 7.849 -1.310 -8.429 1.00 0.00 H new ATOM 0 HA LEU A 98 5.188 -0.606 -7.344 1.00 0.00 H new ATOM 0 HB2 LEU A 98 7.377 -2.047 -5.793 1.00 0.00 H new ATOM 0 HB3 LEU A 98 5.672 -1.937 -5.402 1.00 0.00 H new ATOM 0 HG LEU A 98 5.370 -3.141 -7.770 1.00 0.00 H new ATOM 0 HD11 LEU A 98 7.220 -4.732 -8.204 1.00 0.00 H new ATOM 0 HD12 LEU A 98 7.777 -3.048 -8.347 1.00 0.00 H new ATOM 0 HD13 LEU A 98 8.165 -3.992 -6.889 1.00 0.00 H new ATOM 0 HD21 LEU A 98 5.428 -5.321 -6.575 1.00 0.00 H new ATOM 0 HD22 LEU A 98 6.366 -4.573 -5.261 1.00 0.00 H new ATOM 0 HD23 LEU A 98 4.689 -4.058 -5.563 1.00 0.00 H new ATOM 1519 N GLN A 99 6.043 1.291 -6.042 1.00 0.00 N ATOM 1520 CA GLN A 99 6.520 2.485 -5.365 1.00 0.00 C ATOM 1521 C GLN A 99 6.233 2.335 -3.880 1.00 0.00 C ATOM 1522 O GLN A 99 5.178 1.834 -3.500 1.00 0.00 O ATOM 1523 CB GLN A 99 5.815 3.728 -5.915 1.00 0.00 C ATOM 1524 CG GLN A 99 6.553 4.984 -5.448 1.00 0.00 C ATOM 1525 CD GLN A 99 5.567 5.960 -4.816 1.00 0.00 C ATOM 1526 OE1 GLN A 99 4.725 6.529 -5.510 1.00 0.00 O ATOM 1527 NE2 GLN A 99 5.621 6.189 -3.533 1.00 0.00 N ATOM 0 H GLN A 99 5.028 1.219 -6.108 1.00 0.00 H new ATOM 0 HA GLN A 99 7.591 2.604 -5.531 1.00 0.00 H new ATOM 0 HB2 GLN A 99 5.790 3.692 -7.004 1.00 0.00 H new ATOM 0 HB3 GLN A 99 4.780 3.753 -5.573 1.00 0.00 H new ATOM 0 HG2 GLN A 99 7.325 4.716 -4.727 1.00 0.00 H new ATOM 0 HG3 GLN A 99 7.055 5.456 -6.292 1.00 0.00 H new ATOM 0 HE21 GLN A 99 6.320 5.716 -2.960 1.00 0.00 H new ATOM 0 HE22 GLN A 99 4.965 6.841 -3.103 1.00 0.00 H new ATOM 1536 N TYR A 100 7.167 2.742 -3.037 1.00 0.00 N ATOM 1537 CA TYR A 100 6.966 2.603 -1.608 1.00 0.00 C ATOM 1538 C TYR A 100 7.834 3.570 -0.832 1.00 0.00 C ATOM 1539 O TYR A 100 8.836 4.080 -1.335 1.00 0.00 O ATOM 1540 CB TYR A 100 7.261 1.166 -1.149 1.00 0.00 C ATOM 1541 CG TYR A 100 8.751 0.879 -1.149 1.00 0.00 C ATOM 1542 CD1 TYR A 100 9.624 1.520 -2.044 1.00 0.00 C ATOM 1543 CD2 TYR A 100 9.256 -0.059 -0.247 1.00 0.00 C ATOM 1544 CE1 TYR A 100 10.992 1.218 -2.021 1.00 0.00 C ATOM 1545 CE2 TYR A 100 10.619 -0.360 -0.229 1.00 0.00 C ATOM 1546 CZ TYR A 100 11.488 0.279 -1.115 1.00 0.00 C ATOM 1547 OH TYR A 100 12.835 -0.018 -1.097 1.00 0.00 O ATOM 0 H TYR A 100 8.055 3.163 -3.311 1.00 0.00 H new ATOM 0 HA TYR A 100 5.920 2.834 -1.406 1.00 0.00 H new ATOM 0 HB2 TYR A 100 6.860 1.013 -0.147 1.00 0.00 H new ATOM 0 HB3 TYR A 100 6.753 0.461 -1.807 1.00 0.00 H new ATOM 0 HD1 TYR A 100 9.241 2.244 -2.748 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.588 -0.555 0.441 1.00 0.00 H new ATOM 0 HE1 TYR A 100 11.664 1.713 -2.706 1.00 0.00 H new ATOM 0 HE2 TYR A 100 11.002 -1.088 0.471 1.00 0.00 H new ATOM 0 HH TYR A 100 13.013 -0.690 -0.407 1.00 0.00 H new ATOM 1557 N ILE A 101 7.429 3.824 0.399 1.00 0.00 N ATOM 1558 CA ILE A 101 8.169 4.728 1.250 1.00 0.00 C ATOM 1559 C ILE A 101 7.913 4.412 2.720 1.00 0.00 C ATOM 1560 O ILE A 101 6.775 4.161 3.125 1.00 0.00 O ATOM 1561 CB ILE A 101 7.799 6.158 0.893 1.00 0.00 C ATOM 1562 CG1 ILE A 101 7.963 7.077 2.097 1.00 0.00 C ATOM 1563 CG2 ILE A 101 6.356 6.186 0.433 1.00 0.00 C ATOM 1564 CD1 ILE A 101 7.571 8.480 1.662 1.00 0.00 C ATOM 0 H ILE A 101 6.597 3.418 0.827 1.00 0.00 H new ATOM 0 HA ILE A 101 9.239 4.602 1.088 1.00 0.00 H new ATOM 0 HB ILE A 101 8.460 6.509 0.100 1.00 0.00 H new ATOM 0 HG12 ILE A 101 7.334 6.742 2.922 1.00 0.00 H new ATOM 0 HG13 ILE A 101 8.993 7.061 2.454 1.00 0.00 H new ATOM 0 HG21 ILE A 101 6.077 7.207 0.173 1.00 0.00 H new ATOM 0 HG22 ILE A 101 6.240 5.545 -0.441 1.00 0.00 H new ATOM 0 HG23 ILE A 101 5.711 5.826 1.235 1.00 0.00 H new ATOM 0 HD11 ILE A 101 7.677 9.165 2.503 1.00 0.00 H new ATOM 0 HD12 ILE A 101 8.219 8.803 0.847 1.00 0.00 H new ATOM 0 HD13 ILE A 101 6.535 8.480 1.323 1.00 0.00 H new ATOM 1576 N SER A 102 8.982 4.405 3.510 1.00 0.00 N ATOM 1577 CA SER A 102 8.875 4.099 4.932 1.00 0.00 C ATOM 1578 C SER A 102 7.786 4.940 5.588 1.00 0.00 C ATOM 1579 O SER A 102 7.710 6.149 5.374 1.00 0.00 O ATOM 1580 CB SER A 102 10.213 4.364 5.622 1.00 0.00 C ATOM 1581 OG SER A 102 10.396 5.766 5.770 1.00 0.00 O ATOM 0 H SER A 102 9.929 4.607 3.191 1.00 0.00 H new ATOM 0 HA SER A 102 8.611 3.047 5.037 1.00 0.00 H new ATOM 0 HB2 SER A 102 10.235 3.878 6.597 1.00 0.00 H new ATOM 0 HB3 SER A 102 11.028 3.939 5.036 1.00 0.00 H new ATOM 0 HG SER A 102 11.252 5.939 6.214 1.00 0.00 H new ATOM 1587 N LEU A 103 6.947 4.293 6.391 1.00 0.00 N ATOM 1588 CA LEU A 103 5.874 4.999 7.075 1.00 0.00 C ATOM 1589 C LEU A 103 6.433 6.211 7.807 1.00 0.00 C ATOM 1590 O LEU A 103 5.809 7.269 7.845 1.00 0.00 O ATOM 1591 CB LEU A 103 5.181 4.069 8.070 1.00 0.00 C ATOM 1592 CG LEU A 103 3.735 4.521 8.270 1.00 0.00 C ATOM 1593 CD1 LEU A 103 2.932 3.359 8.838 1.00 0.00 C ATOM 1594 CD2 LEU A 103 3.691 5.701 9.246 1.00 0.00 C ATOM 0 H LEU A 103 6.990 3.292 6.582 1.00 0.00 H new ATOM 0 HA LEU A 103 5.146 5.332 6.335 1.00 0.00 H new ATOM 0 HB2 LEU A 103 5.205 3.043 7.702 1.00 0.00 H new ATOM 0 HB3 LEU A 103 5.711 4.078 9.022 1.00 0.00 H new ATOM 0 HG LEU A 103 3.312 4.834 7.316 1.00 0.00 H new ATOM 0 HD11 LEU A 103 1.898 3.669 8.985 1.00 0.00 H new ATOM 0 HD12 LEU A 103 2.964 2.520 8.142 1.00 0.00 H new ATOM 0 HD13 LEU A 103 3.359 3.054 9.793 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.658 6.020 9.385 1.00 0.00 H new ATOM 0 HD22 LEU A 103 4.109 5.396 10.205 1.00 0.00 H new ATOM 0 HD23 LEU A 103 4.275 6.529 8.843 1.00 0.00 H new ATOM 1606 N LYS A 104 7.620 6.046 8.380 1.00 0.00 N ATOM 1607 CA LYS A 104 8.268 7.133 9.100 1.00 0.00 C ATOM 1608 C LYS A 104 8.692 8.226 8.126 1.00 0.00 C ATOM 1609 O LYS A 104 8.608 9.415 8.435 1.00 0.00 O ATOM 1610 CB LYS A 104 9.492 6.606 9.852 1.00 0.00 C ATOM 1611 CG LYS A 104 9.217 5.180 10.337 1.00 0.00 C ATOM 1612 CD LYS A 104 10.378 4.705 11.212 1.00 0.00 C ATOM 1613 CE LYS A 104 10.299 3.187 11.389 1.00 0.00 C ATOM 1614 NZ LYS A 104 9.001 2.690 10.851 1.00 0.00 N ATOM 0 H LYS A 104 8.150 5.175 8.360 1.00 0.00 H new ATOM 0 HA LYS A 104 7.561 7.550 9.817 1.00 0.00 H new ATOM 0 HB2 LYS A 104 10.366 6.618 9.200 1.00 0.00 H new ATOM 0 HB3 LYS A 104 9.718 7.253 10.700 1.00 0.00 H new ATOM 0 HG2 LYS A 104 8.286 5.150 10.903 1.00 0.00 H new ATOM 0 HG3 LYS A 104 9.093 4.512 9.484 1.00 0.00 H new ATOM 0 HD2 LYS A 104 11.328 4.979 10.753 1.00 0.00 H new ATOM 0 HD3 LYS A 104 10.339 5.197 12.184 1.00 0.00 H new ATOM 0 HE2 LYS A 104 11.128 2.706 10.870 1.00 0.00 H new ATOM 0 HE3 LYS A 104 10.391 2.928 12.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 8.816 1.735 11.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 8.235 3.329 11.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 9.045 2.659 9.812 1.00 0.00 H new ATOM 1628 N GLY A 105 9.141 7.813 6.944 1.00 0.00 N ATOM 1629 CA GLY A 105 9.571 8.763 5.924 1.00 0.00 C ATOM 1630 C GLY A 105 8.398 9.597 5.440 1.00 0.00 C ATOM 1631 O GLY A 105 8.492 10.819 5.336 1.00 0.00 O ATOM 0 H GLY A 105 9.216 6.833 6.670 1.00 0.00 H new ATOM 0 HA2 GLY A 105 10.344 9.415 6.330 1.00 0.00 H new ATOM 0 HA3 GLY A 105 10.014 8.227 5.084 1.00 0.00 H new ATOM 1635 N LEU A 106 7.299 8.916 5.140 1.00 0.00 N ATOM 1636 CA LEU A 106 6.099 9.579 4.653 1.00 0.00 C ATOM 1637 C LEU A 106 5.418 10.383 5.750 1.00 0.00 C ATOM 1638 O LEU A 106 4.949 11.485 5.513 1.00 0.00 O ATOM 1639 CB LEU A 106 5.119 8.548 4.100 1.00 0.00 C ATOM 1640 CG LEU A 106 3.835 9.252 3.653 1.00 0.00 C ATOM 1641 CD1 LEU A 106 3.568 8.942 2.180 1.00 0.00 C ATOM 1642 CD2 LEU A 106 2.659 8.755 4.500 1.00 0.00 C ATOM 0 H LEU A 106 7.215 7.903 5.226 1.00 0.00 H new ATOM 0 HA LEU A 106 6.401 10.266 3.862 1.00 0.00 H new ATOM 0 HB2 LEU A 106 5.568 8.019 3.259 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.891 7.802 4.862 1.00 0.00 H new ATOM 0 HG LEU A 106 3.948 10.328 3.782 1.00 0.00 H new ATOM 0 HD11 LEU A 106 2.654 9.444 1.863 1.00 0.00 H new ATOM 0 HD12 LEU A 106 4.404 9.295 1.576 1.00 0.00 H new ATOM 0 HD13 LEU A 106 3.456 7.866 2.049 1.00 0.00 H new ATOM 0 HD21 LEU A 106 1.744 9.256 4.182 1.00 0.00 H new ATOM 0 HD22 LEU A 106 2.547 7.679 4.371 1.00 0.00 H new ATOM 0 HD23 LEU A 106 2.848 8.977 5.550 1.00 0.00 H new ATOM 1654 N ARG A 107 5.332 9.811 6.940 1.00 0.00 N ATOM 1655 CA ARG A 107 4.674 10.491 8.049 1.00 0.00 C ATOM 1656 C ARG A 107 5.488 11.674 8.570 1.00 0.00 C ATOM 1657 O ARG A 107 4.925 12.643 9.070 1.00 0.00 O ATOM 1658 CB ARG A 107 4.375 9.511 9.186 1.00 0.00 C ATOM 1659 CG ARG A 107 3.770 10.261 10.375 1.00 0.00 C ATOM 1660 CD ARG A 107 2.412 10.835 9.976 1.00 0.00 C ATOM 1661 NE ARG A 107 1.357 10.249 10.793 1.00 0.00 N ATOM 1662 CZ ARG A 107 1.382 10.341 12.119 1.00 0.00 C ATOM 1663 NH1 ARG A 107 2.356 10.976 12.711 1.00 0.00 N ATOM 1664 NH2 ARG A 107 0.430 9.799 12.827 1.00 0.00 N ATOM 0 H ARG A 107 5.704 8.888 7.164 1.00 0.00 H new ATOM 0 HA ARG A 107 3.734 10.887 7.664 1.00 0.00 H new ATOM 0 HB2 ARG A 107 3.685 8.741 8.842 1.00 0.00 H new ATOM 0 HB3 ARG A 107 5.291 9.005 9.492 1.00 0.00 H new ATOM 0 HG2 ARG A 107 3.657 9.587 11.224 1.00 0.00 H new ATOM 0 HG3 ARG A 107 4.437 11.063 10.691 1.00 0.00 H new ATOM 0 HD2 ARG A 107 2.417 11.918 10.098 1.00 0.00 H new ATOM 0 HD3 ARG A 107 2.220 10.634 8.922 1.00 0.00 H new ATOM 0 HE ARG A 107 0.586 9.760 10.339 1.00 0.00 H new ATOM 0 HH11 ARG A 107 3.099 11.402 12.156 1.00 0.00 H new ATOM 0 HH12 ARG A 107 2.375 11.046 13.728 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -0.333 9.305 12.363 1.00 0.00 H new ATOM 0 HH22 ARG A 107 0.448 9.869 13.844 1.00 0.00 H new ATOM 1678 N GLU A 108 6.805 11.585 8.468 1.00 0.00 N ATOM 1679 CA GLU A 108 7.677 12.660 8.948 1.00 0.00 C ATOM 1680 C GLU A 108 7.450 13.899 8.100 1.00 0.00 C ATOM 1681 O GLU A 108 7.139 14.983 8.602 1.00 0.00 O ATOM 1682 CB GLU A 108 9.145 12.231 8.856 1.00 0.00 C ATOM 1683 CG GLU A 108 10.034 13.302 9.492 1.00 0.00 C ATOM 1684 CD GLU A 108 11.017 13.845 8.459 1.00 0.00 C ATOM 1685 OE1 GLU A 108 11.891 13.098 8.051 1.00 0.00 O ATOM 1686 OE2 GLU A 108 10.881 15.000 8.091 1.00 0.00 O ATOM 0 H GLU A 108 7.296 10.789 8.061 1.00 0.00 H new ATOM 0 HA GLU A 108 7.442 12.878 9.990 1.00 0.00 H new ATOM 0 HB2 GLU A 108 9.288 11.277 9.364 1.00 0.00 H new ATOM 0 HB3 GLU A 108 9.426 12.083 7.813 1.00 0.00 H new ATOM 0 HG2 GLU A 108 9.419 14.113 9.882 1.00 0.00 H new ATOM 0 HG3 GLU A 108 10.578 12.880 10.337 1.00 0.00 H new ATOM 1693 N VAL A 109 7.562 13.700 6.802 1.00 0.00 N ATOM 1694 CA VAL A 109 7.331 14.760 5.839 1.00 0.00 C ATOM 1695 C VAL A 109 5.923 15.302 6.061 1.00 0.00 C ATOM 1696 O VAL A 109 5.701 16.508 6.260 1.00 0.00 O ATOM 1697 CB VAL A 109 7.480 14.160 4.438 1.00 0.00 C ATOM 1698 CG1 VAL A 109 8.966 13.948 4.148 1.00 0.00 C ATOM 1699 CG2 VAL A 109 6.768 12.818 4.378 1.00 0.00 C ATOM 0 H VAL A 109 7.814 12.804 6.386 1.00 0.00 H new ATOM 0 HA VAL A 109 8.042 15.578 5.951 1.00 0.00 H new ATOM 0 HB VAL A 109 7.044 14.836 3.702 1.00 0.00 H new ATOM 0 HG11 VAL A 109 9.085 13.521 3.152 1.00 0.00 H new ATOM 0 HG12 VAL A 109 9.486 14.905 4.197 1.00 0.00 H new ATOM 0 HG13 VAL A 109 9.388 13.267 4.888 1.00 0.00 H new ATOM 0 HG21 VAL A 109 6.876 12.393 3.380 1.00 0.00 H new ATOM 0 HG22 VAL A 109 7.207 12.140 5.110 1.00 0.00 H new ATOM 0 HG23 VAL A 109 5.710 12.957 4.601 1.00 0.00 H new ATOM 1709 N LEU A 110 4.979 14.384 6.090 1.00 0.00 N ATOM 1710 CA LEU A 110 3.605 14.740 6.352 1.00 0.00 C ATOM 1711 C LEU A 110 3.546 15.502 7.669 1.00 0.00 C ATOM 1712 O LEU A 110 2.763 16.438 7.827 1.00 0.00 O ATOM 1713 CB LEU A 110 2.778 13.459 6.411 1.00 0.00 C ATOM 1714 CG LEU A 110 1.881 13.358 5.180 1.00 0.00 C ATOM 1715 CD1 LEU A 110 2.732 13.382 3.914 1.00 0.00 C ATOM 1716 CD2 LEU A 110 1.118 12.042 5.234 1.00 0.00 C ATOM 0 H LEU A 110 5.140 13.389 5.935 1.00 0.00 H new ATOM 0 HA LEU A 110 3.201 15.378 5.566 1.00 0.00 H new ATOM 0 HB2 LEU A 110 3.438 12.593 6.462 1.00 0.00 H new ATOM 0 HB3 LEU A 110 2.170 13.451 7.316 1.00 0.00 H new ATOM 0 HG LEU A 110 1.188 14.200 5.167 1.00 0.00 H new ATOM 0 HD11 LEU A 110 2.085 13.310 3.040 1.00 0.00 H new ATOM 0 HD12 LEU A 110 3.296 14.314 3.872 1.00 0.00 H new ATOM 0 HD13 LEU A 110 3.424 12.540 3.925 1.00 0.00 H new ATOM 0 HD21 LEU A 110 0.473 11.959 4.359 1.00 0.00 H new ATOM 0 HD22 LEU A 110 1.824 11.212 5.244 1.00 0.00 H new ATOM 0 HD23 LEU A 110 0.509 12.011 6.137 1.00 0.00 H new ATOM 1728 N ARG A 111 4.418 15.121 8.600 1.00 0.00 N ATOM 1729 CA ARG A 111 4.483 15.802 9.882 1.00 0.00 C ATOM 1730 C ARG A 111 4.685 17.284 9.625 1.00 0.00 C ATOM 1731 O ARG A 111 4.205 18.131 10.379 1.00 0.00 O ATOM 1732 CB ARG A 111 5.631 15.251 10.726 1.00 0.00 C ATOM 1733 CG ARG A 111 5.258 15.333 12.208 1.00 0.00 C ATOM 1734 CD ARG A 111 6.374 14.715 13.050 1.00 0.00 C ATOM 1735 NE ARG A 111 7.395 15.714 13.341 1.00 0.00 N ATOM 1736 CZ ARG A 111 8.422 15.438 14.138 1.00 0.00 C ATOM 1737 NH1 ARG A 111 8.526 14.257 14.684 1.00 0.00 N ATOM 1738 NH2 ARG A 111 9.326 16.349 14.375 1.00 0.00 N ATOM 0 H ARG A 111 5.080 14.353 8.489 1.00 0.00 H new ATOM 0 HA ARG A 111 3.556 15.640 10.433 1.00 0.00 H new ATOM 0 HB2 ARG A 111 5.837 14.217 10.448 1.00 0.00 H new ATOM 0 HB3 ARG A 111 6.541 15.820 10.537 1.00 0.00 H new ATOM 0 HG2 ARG A 111 5.102 16.372 12.498 1.00 0.00 H new ATOM 0 HG3 ARG A 111 4.320 14.808 12.387 1.00 0.00 H new ATOM 0 HD2 ARG A 111 5.963 14.322 13.980 1.00 0.00 H new ATOM 0 HD3 ARG A 111 6.818 13.874 12.518 1.00 0.00 H new ATOM 0 HE ARG A 111 7.320 16.642 12.925 1.00 0.00 H new ATOM 0 HH11 ARG A 111 7.819 13.546 14.499 1.00 0.00 H new ATOM 0 HH12 ARG A 111 9.314 14.046 15.296 1.00 0.00 H new ATOM 0 HH21 ARG A 111 9.244 17.272 13.949 1.00 0.00 H new ATOM 0 HH22 ARG A 111 10.115 16.138 14.987 1.00 0.00 H new ATOM 1752 N LEU A 112 5.363 17.589 8.520 1.00 0.00 N ATOM 1753 CA LEU A 112 5.572 18.978 8.143 1.00 0.00 C ATOM 1754 C LEU A 112 4.201 19.590 7.930 1.00 0.00 C ATOM 1755 O LEU A 112 3.961 20.757 8.241 1.00 0.00 O ATOM 1756 CB LEU A 112 6.392 19.069 6.855 1.00 0.00 C ATOM 1757 CG LEU A 112 7.186 20.377 6.846 1.00 0.00 C ATOM 1758 CD1 LEU A 112 8.596 20.124 7.382 1.00 0.00 C ATOM 1759 CD2 LEU A 112 7.271 20.909 5.414 1.00 0.00 C ATOM 0 H LEU A 112 5.769 16.904 7.883 1.00 0.00 H new ATOM 0 HA LEU A 112 6.122 19.507 8.921 1.00 0.00 H new ATOM 0 HB2 LEU A 112 7.070 18.219 6.783 1.00 0.00 H new ATOM 0 HB3 LEU A 112 5.733 19.025 5.988 1.00 0.00 H new ATOM 0 HG LEU A 112 6.686 21.111 7.478 1.00 0.00 H new ATOM 0 HD11 LEU A 112 9.161 21.056 7.375 1.00 0.00 H new ATOM 0 HD12 LEU A 112 8.535 19.744 8.402 1.00 0.00 H new ATOM 0 HD13 LEU A 112 9.099 19.391 6.751 1.00 0.00 H new ATOM 0 HD21 LEU A 112 7.836 21.841 5.405 1.00 0.00 H new ATOM 0 HD22 LEU A 112 7.771 20.175 4.782 1.00 0.00 H new ATOM 0 HD23 LEU A 112 6.266 21.091 5.033 1.00 0.00 H new ATOM 1771 N TYR A 113 3.293 18.753 7.438 1.00 0.00 N ATOM 1772 CA TYR A 113 1.905 19.166 7.224 1.00 0.00 C ATOM 1773 C TYR A 113 0.992 18.284 8.077 1.00 0.00 C ATOM 1774 O TYR A 113 0.473 17.272 7.611 1.00 0.00 O ATOM 1775 CB TYR A 113 1.522 19.045 5.747 1.00 0.00 C ATOM 1776 CG TYR A 113 0.703 20.251 5.347 1.00 0.00 C ATOM 1777 CD1 TYR A 113 -0.238 20.785 6.238 1.00 0.00 C ATOM 1778 CD2 TYR A 113 0.889 20.840 4.091 1.00 0.00 C ATOM 1779 CE1 TYR A 113 -0.992 21.907 5.872 1.00 0.00 C ATOM 1780 CE2 TYR A 113 0.132 21.961 3.725 1.00 0.00 C ATOM 1781 CZ TYR A 113 -0.807 22.495 4.614 1.00 0.00 C ATOM 1782 OH TYR A 113 -1.549 23.601 4.253 1.00 0.00 O ATOM 0 H TYR A 113 3.490 17.786 7.180 1.00 0.00 H new ATOM 0 HA TYR A 113 1.793 20.210 7.515 1.00 0.00 H new ATOM 0 HB2 TYR A 113 2.418 18.978 5.131 1.00 0.00 H new ATOM 0 HB3 TYR A 113 0.952 18.131 5.580 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -0.382 20.331 7.207 1.00 0.00 H new ATOM 0 HD2 TYR A 113 1.615 20.431 3.404 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -1.716 22.319 6.559 1.00 0.00 H new ATOM 0 HE2 TYR A 113 0.274 22.414 2.755 1.00 0.00 H new ATOM 0 HH TYR A 113 -1.296 23.884 3.349 1.00 0.00 H new ATOM 1792 N PRO A 114 0.840 18.638 9.325 1.00 0.00 N ATOM 1793 CA PRO A 114 0.024 17.862 10.319 1.00 0.00 C ATOM 1794 C PRO A 114 -1.457 17.696 9.962 1.00 0.00 C ATOM 1795 O PRO A 114 -2.041 16.650 10.240 1.00 0.00 O ATOM 1796 CB PRO A 114 0.164 18.664 11.621 1.00 0.00 C ATOM 1797 CG PRO A 114 1.340 19.561 11.429 1.00 0.00 C ATOM 1798 CD PRO A 114 1.438 19.832 9.932 1.00 0.00 C ATOM 0 HA PRO A 114 0.390 16.837 10.371 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -0.738 19.242 11.822 1.00 0.00 H new ATOM 0 HB3 PRO A 114 0.314 18.001 12.473 1.00 0.00 H new ATOM 0 HG2 PRO A 114 1.214 20.491 11.984 1.00 0.00 H new ATOM 0 HG3 PRO A 114 2.251 19.091 11.799 1.00 0.00 H new ATOM 0 HD2 PRO A 114 0.898 20.737 9.652 1.00 0.00 H new ATOM 0 HD3 PRO A 114 2.472 19.967 9.616 1.00 0.00 H new ATOM 1806 N GLU A 115 -2.076 18.717 9.380 1.00 0.00 N ATOM 1807 CA GLU A 115 -3.499 18.621 9.051 1.00 0.00 C ATOM 1808 C GLU A 115 -3.728 17.647 7.905 1.00 0.00 C ATOM 1809 O GLU A 115 -4.528 16.713 8.010 1.00 0.00 O ATOM 1810 CB GLU A 115 -4.035 20.002 8.667 1.00 0.00 C ATOM 1811 CG GLU A 115 -4.304 20.813 9.934 1.00 0.00 C ATOM 1812 CD GLU A 115 -3.848 22.256 9.737 1.00 0.00 C ATOM 1813 OE1 GLU A 115 -4.221 22.842 8.734 1.00 0.00 O ATOM 1814 OE2 GLU A 115 -3.133 22.752 10.591 1.00 0.00 O ATOM 0 H GLU A 115 -1.632 19.601 9.130 1.00 0.00 H new ATOM 0 HA GLU A 115 -4.030 18.252 9.929 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -3.314 20.521 8.036 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -4.952 19.900 8.086 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -5.367 20.788 10.172 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -3.777 20.369 10.779 1.00 0.00 H new ATOM 1821 N TYR A 116 -3.003 17.855 6.820 1.00 0.00 N ATOM 1822 CA TYR A 116 -3.118 16.986 5.665 1.00 0.00 C ATOM 1823 C TYR A 116 -2.560 15.610 5.998 1.00 0.00 C ATOM 1824 O TYR A 116 -3.031 14.590 5.495 1.00 0.00 O ATOM 1825 CB TYR A 116 -2.352 17.591 4.489 1.00 0.00 C ATOM 1826 CG TYR A 116 -3.160 18.718 3.889 1.00 0.00 C ATOM 1827 CD1 TYR A 116 -4.438 18.469 3.372 1.00 0.00 C ATOM 1828 CD2 TYR A 116 -2.634 20.014 3.858 1.00 0.00 C ATOM 1829 CE1 TYR A 116 -5.188 19.516 2.825 1.00 0.00 C ATOM 1830 CE2 TYR A 116 -3.383 21.061 3.309 1.00 0.00 C ATOM 1831 CZ TYR A 116 -4.661 20.812 2.794 1.00 0.00 C ATOM 1832 OH TYR A 116 -5.400 21.844 2.254 1.00 0.00 O ATOM 0 H TYR A 116 -2.331 18.615 6.716 1.00 0.00 H new ATOM 0 HA TYR A 116 -4.168 16.885 5.392 1.00 0.00 H new ATOM 0 HB2 TYR A 116 -1.383 17.962 4.824 1.00 0.00 H new ATOM 0 HB3 TYR A 116 -2.158 16.827 3.736 1.00 0.00 H new ATOM 0 HD1 TYR A 116 -4.844 17.469 3.396 1.00 0.00 H new ATOM 0 HD2 TYR A 116 -1.649 20.207 4.258 1.00 0.00 H new ATOM 0 HE1 TYR A 116 -6.173 19.324 2.427 1.00 0.00 H new ATOM 0 HE2 TYR A 116 -2.975 22.061 3.283 1.00 0.00 H new ATOM 0 HH TYR A 116 -4.888 22.678 2.312 1.00 0.00 H new ATOM 1842 N ALA A 117 -1.536 15.604 6.841 1.00 0.00 N ATOM 1843 CA ALA A 117 -0.884 14.371 7.243 1.00 0.00 C ATOM 1844 C ALA A 117 -1.820 13.450 8.004 1.00 0.00 C ATOM 1845 O ALA A 117 -2.086 12.334 7.568 1.00 0.00 O ATOM 1846 CB ALA A 117 0.302 14.722 8.126 1.00 0.00 C ATOM 0 H ALA A 117 -1.139 16.445 7.260 1.00 0.00 H new ATOM 0 HA ALA A 117 -0.566 13.843 6.344 1.00 0.00 H new ATOM 0 HB1 ALA A 117 0.806 13.808 8.439 1.00 0.00 H new ATOM 0 HB2 ALA A 117 0.999 15.347 7.568 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -0.047 15.263 9.006 1.00 0.00 H new ATOM 1852 N GLN A 118 -2.329 13.913 9.129 1.00 0.00 N ATOM 1853 CA GLN A 118 -3.232 13.089 9.905 1.00 0.00 C ATOM 1854 C GLN A 118 -4.330 12.587 8.988 1.00 0.00 C ATOM 1855 O GLN A 118 -4.876 11.499 9.175 1.00 0.00 O ATOM 1856 CB GLN A 118 -3.826 13.909 11.046 1.00 0.00 C ATOM 1857 CG GLN A 118 -2.739 14.249 12.066 1.00 0.00 C ATOM 1858 CD GLN A 118 -1.988 12.988 12.482 1.00 0.00 C ATOM 1859 OE1 GLN A 118 -0.981 12.575 11.761 1.00 0.00 O flip ATOM 1860 NE2 GLN A 118 -2.329 12.363 13.486 1.00 0.00 N flip ATOM 0 H GLN A 118 -2.138 14.836 9.519 1.00 0.00 H new ATOM 0 HA GLN A 118 -2.697 12.242 10.334 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -4.268 14.825 10.655 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -4.627 13.349 11.529 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -2.043 14.970 11.638 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -3.187 14.719 12.942 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -3.116 12.689 14.047 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -1.824 11.519 13.757 1.00 0.00 H new ATOM 1869 N LYS A 119 -4.624 13.390 7.979 1.00 0.00 N ATOM 1870 CA LYS A 119 -5.634 13.044 6.993 1.00 0.00 C ATOM 1871 C LYS A 119 -5.138 11.937 6.053 1.00 0.00 C ATOM 1872 O LYS A 119 -5.943 11.214 5.467 1.00 0.00 O ATOM 1873 CB LYS A 119 -6.003 14.282 6.174 1.00 0.00 C ATOM 1874 CG LYS A 119 -7.498 14.258 5.851 1.00 0.00 C ATOM 1875 CD LYS A 119 -8.291 14.734 7.070 1.00 0.00 C ATOM 1876 CE LYS A 119 -8.583 16.230 6.938 1.00 0.00 C ATOM 1877 NZ LYS A 119 -9.874 16.423 6.220 1.00 0.00 N ATOM 0 H LYS A 119 -4.174 14.292 7.821 1.00 0.00 H new ATOM 0 HA LYS A 119 -6.512 12.675 7.524 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -5.756 15.186 6.731 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -5.422 14.307 5.252 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -7.706 14.900 4.995 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -7.805 13.249 5.575 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -9.224 14.176 7.150 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -7.726 14.542 7.982 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -8.631 16.690 7.925 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -7.776 16.722 6.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -10.073 17.440 6.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -9.812 15.997 5.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -10.640 15.967 6.755 1.00 0.00 H new ATOM 1891 N PHE A 120 -3.814 11.830 5.875 1.00 0.00 N ATOM 1892 CA PHE A 120 -3.257 10.833 4.961 1.00 0.00 C ATOM 1893 C PHE A 120 -3.596 9.408 5.374 1.00 0.00 C ATOM 1894 O PHE A 120 -4.053 8.614 4.550 1.00 0.00 O ATOM 1895 CB PHE A 120 -1.742 11.023 4.862 1.00 0.00 C ATOM 1896 CG PHE A 120 -0.975 9.839 5.430 1.00 0.00 C ATOM 1897 CD1 PHE A 120 -0.690 8.726 4.623 1.00 0.00 C ATOM 1898 CD2 PHE A 120 -0.500 9.877 6.749 1.00 0.00 C ATOM 1899 CE1 PHE A 120 0.059 7.666 5.133 1.00 0.00 C ATOM 1900 CE2 PHE A 120 0.242 8.808 7.260 1.00 0.00 C ATOM 1901 CZ PHE A 120 0.524 7.704 6.453 1.00 0.00 C ATOM 0 H PHE A 120 -3.121 12.413 6.345 1.00 0.00 H new ATOM 0 HA PHE A 120 -3.712 10.987 3.982 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -1.463 11.167 3.818 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -1.456 11.929 5.396 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -1.051 8.691 3.606 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -0.708 10.735 7.372 1.00 0.00 H new ATOM 0 HE1 PHE A 120 0.281 6.814 4.508 1.00 0.00 H new ATOM 0 HE2 PHE A 120 0.597 8.836 8.280 1.00 0.00 H new ATOM 0 HZ PHE A 120 1.100 6.880 6.847 1.00 0.00 H new ATOM 1911 N VAL A 121 -3.372 9.078 6.633 1.00 0.00 N ATOM 1912 CA VAL A 121 -3.658 7.743 7.099 1.00 0.00 C ATOM 1913 C VAL A 121 -5.094 7.358 6.753 1.00 0.00 C ATOM 1914 O VAL A 121 -5.380 6.200 6.444 1.00 0.00 O ATOM 1915 CB VAL A 121 -3.460 7.670 8.612 1.00 0.00 C ATOM 1916 CG1 VAL A 121 -3.759 6.251 9.083 1.00 0.00 C ATOM 1917 CG2 VAL A 121 -2.015 8.034 8.961 1.00 0.00 C ATOM 0 H VAL A 121 -2.997 9.711 7.340 1.00 0.00 H new ATOM 0 HA VAL A 121 -2.977 7.048 6.609 1.00 0.00 H new ATOM 0 HB VAL A 121 -4.133 8.372 9.105 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -3.620 6.189 10.162 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -4.789 5.994 8.834 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -3.082 5.554 8.590 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -1.877 7.981 10.041 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -1.336 7.335 8.474 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -1.802 9.046 8.617 1.00 0.00 H new ATOM 1927 N SER A 122 -5.993 8.336 6.811 1.00 0.00 N ATOM 1928 CA SER A 122 -7.399 8.092 6.504 1.00 0.00 C ATOM 1929 C SER A 122 -7.658 8.215 5.004 1.00 0.00 C ATOM 1930 O SER A 122 -8.559 7.570 4.467 1.00 0.00 O ATOM 1931 CB SER A 122 -8.277 9.091 7.257 1.00 0.00 C ATOM 1932 OG SER A 122 -9.170 9.714 6.343 1.00 0.00 O ATOM 0 H SER A 122 -5.775 9.299 7.066 1.00 0.00 H new ATOM 0 HA SER A 122 -7.646 7.078 6.818 1.00 0.00 H new ATOM 0 HB2 SER A 122 -8.838 8.581 8.041 1.00 0.00 H new ATOM 0 HB3 SER A 122 -7.656 9.842 7.746 1.00 0.00 H new ATOM 0 HG SER A 122 -8.669 10.321 5.759 1.00 0.00 H new ATOM 1938 N GLU A 123 -6.871 9.051 4.334 1.00 0.00 N ATOM 1939 CA GLU A 123 -7.034 9.252 2.897 1.00 0.00 C ATOM 1940 C GLU A 123 -6.462 8.072 2.116 1.00 0.00 C ATOM 1941 O GLU A 123 -6.894 7.786 0.999 1.00 0.00 O ATOM 1942 CB GLU A 123 -6.331 10.541 2.464 1.00 0.00 C ATOM 1943 CG GLU A 123 -7.373 11.584 2.054 1.00 0.00 C ATOM 1944 CD GLU A 123 -8.091 12.116 3.289 1.00 0.00 C ATOM 1945 OE1 GLU A 123 -8.476 11.309 4.120 1.00 0.00 O ATOM 1946 OE2 GLU A 123 -8.244 13.322 3.389 1.00 0.00 O ATOM 0 H GLU A 123 -6.120 9.596 4.758 1.00 0.00 H new ATOM 0 HA GLU A 123 -8.100 9.329 2.683 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -5.720 10.925 3.281 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -5.658 10.338 1.631 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -6.890 12.404 1.523 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -8.094 11.140 1.367 1.00 0.00 H new ATOM 1953 N ILE A 124 -5.486 7.392 2.708 1.00 0.00 N ATOM 1954 CA ILE A 124 -4.859 6.249 2.059 1.00 0.00 C ATOM 1955 C ILE A 124 -5.901 5.189 1.693 1.00 0.00 C ATOM 1956 O ILE A 124 -5.829 4.577 0.627 1.00 0.00 O ATOM 1957 CB ILE A 124 -3.814 5.640 2.999 1.00 0.00 C ATOM 1958 CG1 ILE A 124 -2.621 5.160 2.174 1.00 0.00 C ATOM 1959 CG2 ILE A 124 -4.421 4.461 3.767 1.00 0.00 C ATOM 1960 CD1 ILE A 124 -1.898 4.033 2.916 1.00 0.00 C ATOM 0 H ILE A 124 -5.114 7.612 3.632 1.00 0.00 H new ATOM 0 HA ILE A 124 -4.379 6.590 1.142 1.00 0.00 H new ATOM 0 HB ILE A 124 -3.487 6.393 3.716 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -2.959 4.808 1.199 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -1.935 5.988 1.994 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -3.670 4.035 4.432 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -5.271 4.808 4.354 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -4.754 3.700 3.061 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -1.048 3.694 2.324 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -1.545 4.400 3.880 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -2.585 3.202 3.073 1.00 0.00 H new ATOM 1972 N GLN A 125 -6.856 4.966 2.594 1.00 0.00 N ATOM 1973 CA GLN A 125 -7.894 3.965 2.372 1.00 0.00 C ATOM 1974 C GLN A 125 -8.510 4.109 0.987 1.00 0.00 C ATOM 1975 O GLN A 125 -8.940 3.123 0.387 1.00 0.00 O ATOM 1976 CB GLN A 125 -8.992 4.102 3.428 1.00 0.00 C ATOM 1977 CG GLN A 125 -8.507 3.520 4.746 1.00 0.00 C ATOM 1978 CD GLN A 125 -7.451 4.423 5.370 1.00 0.00 C ATOM 1979 OE1 GLN A 125 -7.435 5.693 5.074 1.00 0.00 O flip ATOM 1980 NE2 GLN A 125 -6.618 3.959 6.148 1.00 0.00 N flip ATOM 0 H GLN A 125 -6.931 5.464 3.481 1.00 0.00 H new ATOM 0 HA GLN A 125 -7.430 2.982 2.448 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -9.257 5.151 3.558 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -9.893 3.584 3.100 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -9.347 3.405 5.431 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -8.092 2.526 4.581 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -6.633 2.965 6.378 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -5.913 4.568 6.563 1.00 0.00 H new ATOM 1989 N HIS A 126 -8.554 5.333 0.481 1.00 0.00 N ATOM 1990 CA HIS A 126 -9.128 5.573 -0.835 1.00 0.00 C ATOM 1991 C HIS A 126 -8.397 4.751 -1.891 1.00 0.00 C ATOM 1992 O HIS A 126 -8.884 4.587 -3.010 1.00 0.00 O ATOM 1993 CB HIS A 126 -9.037 7.052 -1.183 1.00 0.00 C ATOM 1994 CG HIS A 126 -9.211 7.231 -2.667 1.00 0.00 C ATOM 1995 ND1 HIS A 126 -10.372 6.854 -3.324 1.00 0.00 N ATOM 1996 CD2 HIS A 126 -8.381 7.740 -3.634 1.00 0.00 C ATOM 1997 CE1 HIS A 126 -10.210 7.140 -4.628 1.00 0.00 C ATOM 1998 NE2 HIS A 126 -9.014 7.683 -4.872 1.00 0.00 N ATOM 0 H HIS A 126 -8.204 6.166 0.955 1.00 0.00 H new ATOM 0 HA HIS A 126 -10.176 5.273 -0.816 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -9.804 7.610 -0.646 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -8.073 7.452 -0.868 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -7.387 8.126 -3.461 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -10.956 6.953 -5.386 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -8.644 7.990 -5.772 1.00 0.00 H new ATOM 2007 N ASP A 127 -7.228 4.234 -1.528 1.00 0.00 N ATOM 2008 CA ASP A 127 -6.441 3.429 -2.455 1.00 0.00 C ATOM 2009 C ASP A 127 -6.206 2.028 -1.895 1.00 0.00 C ATOM 2010 O ASP A 127 -6.103 1.058 -2.647 1.00 0.00 O ATOM 2011 CB ASP A 127 -5.096 4.106 -2.716 1.00 0.00 C ATOM 2012 CG ASP A 127 -5.277 5.269 -3.686 1.00 0.00 C ATOM 2013 OD1 ASP A 127 -6.311 5.914 -3.622 1.00 0.00 O ATOM 2014 OD2 ASP A 127 -4.379 5.497 -4.480 1.00 0.00 O ATOM 0 H ASP A 127 -6.807 4.356 -0.607 1.00 0.00 H new ATOM 0 HA ASP A 127 -6.996 3.342 -3.389 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -4.673 4.466 -1.778 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -4.390 3.385 -3.128 1.00 0.00 H new ATOM 2019 N LEU A 128 -6.115 1.932 -0.574 1.00 0.00 N ATOM 2020 CA LEU A 128 -5.882 0.646 0.077 1.00 0.00 C ATOM 2021 C LEU A 128 -6.647 -0.470 -0.627 1.00 0.00 C ATOM 2022 O LEU A 128 -7.878 -0.480 -0.642 1.00 0.00 O ATOM 2023 CB LEU A 128 -6.311 0.718 1.544 1.00 0.00 C ATOM 2024 CG LEU A 128 -5.895 -0.570 2.264 1.00 0.00 C ATOM 2025 CD1 LEU A 128 -4.934 -0.232 3.404 1.00 0.00 C ATOM 2026 CD2 LEU A 128 -7.137 -1.260 2.836 1.00 0.00 C ATOM 0 H LEU A 128 -6.198 2.723 0.065 1.00 0.00 H new ATOM 0 HA LEU A 128 -4.816 0.424 0.019 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -5.852 1.581 2.026 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -7.391 0.852 1.612 1.00 0.00 H new ATOM 0 HG LEU A 128 -5.401 -1.235 1.556 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -4.639 -1.148 3.915 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -4.049 0.259 3.000 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -5.428 0.435 4.111 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -6.841 -2.176 3.348 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -7.631 -0.593 3.542 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -7.824 -1.503 2.025 1.00 0.00 H new ATOM 2038 N THR A 129 -5.904 -1.410 -1.203 1.00 0.00 N ATOM 2039 CA THR A 129 -6.517 -2.536 -1.902 1.00 0.00 C ATOM 2040 C THR A 129 -6.399 -3.809 -1.073 1.00 0.00 C ATOM 2041 O THR A 129 -7.350 -4.583 -0.970 1.00 0.00 O ATOM 2042 CB THR A 129 -5.839 -2.745 -3.257 1.00 0.00 C ATOM 2043 OG1 THR A 129 -6.404 -1.858 -4.211 1.00 0.00 O ATOM 2044 CG2 THR A 129 -6.044 -4.191 -3.715 1.00 0.00 C ATOM 0 H THR A 129 -4.884 -1.416 -1.200 1.00 0.00 H new ATOM 0 HA THR A 129 -7.572 -2.310 -2.056 1.00 0.00 H new ATOM 0 HB THR A 129 -4.772 -2.544 -3.164 1.00 0.00 H new ATOM 0 HG1 THR A 129 -6.392 -0.945 -3.856 1.00 0.00 H new ATOM 0 HG21 THR A 129 -5.560 -4.339 -4.681 1.00 0.00 H new ATOM 0 HG22 THR A 129 -5.607 -4.870 -2.983 1.00 0.00 H new ATOM 0 HG23 THR A 129 -7.111 -4.395 -3.808 1.00 0.00 H new ATOM 2052 N TYR A 130 -5.224 -4.023 -0.483 1.00 0.00 N ATOM 2053 CA TYR A 130 -5.002 -5.209 0.332 1.00 0.00 C ATOM 2054 C TYR A 130 -4.328 -4.827 1.644 1.00 0.00 C ATOM 2055 O TYR A 130 -3.252 -4.228 1.652 1.00 0.00 O ATOM 2056 CB TYR A 130 -4.131 -6.212 -0.426 1.00 0.00 C ATOM 2057 CG TYR A 130 -4.362 -7.594 0.132 1.00 0.00 C ATOM 2058 CD1 TYR A 130 -5.484 -8.331 -0.267 1.00 0.00 C ATOM 2059 CD2 TYR A 130 -3.458 -8.137 1.053 1.00 0.00 C ATOM 2060 CE1 TYR A 130 -5.701 -9.612 0.255 1.00 0.00 C ATOM 2061 CE2 TYR A 130 -3.676 -9.418 1.574 1.00 0.00 C ATOM 2062 CZ TYR A 130 -4.797 -10.156 1.176 1.00 0.00 C ATOM 2063 OH TYR A 130 -5.013 -11.417 1.691 1.00 0.00 O ATOM 0 H TYR A 130 -4.422 -3.397 -0.554 1.00 0.00 H new ATOM 0 HA TYR A 130 -5.966 -5.668 0.550 1.00 0.00 H new ATOM 0 HB2 TYR A 130 -4.373 -6.191 -1.489 1.00 0.00 H new ATOM 0 HB3 TYR A 130 -3.079 -5.941 -0.333 1.00 0.00 H new ATOM 0 HD1 TYR A 130 -6.181 -7.912 -0.977 1.00 0.00 H new ATOM 0 HD2 TYR A 130 -2.593 -7.568 1.361 1.00 0.00 H new ATOM 0 HE1 TYR A 130 -6.566 -10.181 -0.053 1.00 0.00 H new ATOM 0 HE2 TYR A 130 -2.978 -9.837 2.284 1.00 0.00 H new ATOM 0 HH TYR A 130 -4.786 -12.090 1.015 1.00 0.00 H new ATOM 2073 N ASN A 131 -4.975 -5.168 2.753 1.00 0.00 N ATOM 2074 CA ASN A 131 -4.439 -4.847 4.069 1.00 0.00 C ATOM 2075 C ASN A 131 -3.513 -5.950 4.565 1.00 0.00 C ATOM 2076 O ASN A 131 -3.971 -6.982 5.054 1.00 0.00 O ATOM 2077 CB ASN A 131 -5.587 -4.665 5.065 1.00 0.00 C ATOM 2078 CG ASN A 131 -6.336 -5.983 5.241 1.00 0.00 C ATOM 2079 OD1 ASN A 131 -5.947 -6.826 6.159 1.00 0.00 O flip ATOM 2080 ND2 ASN A 131 -7.299 -6.250 4.524 1.00 0.00 N flip ATOM 0 H ASN A 131 -5.866 -5.664 2.767 1.00 0.00 H new ATOM 0 HA ASN A 131 -3.868 -3.922 3.987 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -5.197 -4.327 6.025 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -6.270 -3.893 4.709 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -7.600 -5.589 3.808 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -7.796 -7.132 4.646 1.00 0.00 H new ATOM 2087 N LEU A 132 -2.207 -5.724 4.452 1.00 0.00 N ATOM 2088 CA LEU A 132 -1.240 -6.713 4.911 1.00 0.00 C ATOM 2089 C LEU A 132 -1.298 -6.810 6.430 1.00 0.00 C ATOM 2090 O LEU A 132 -0.988 -5.849 7.132 1.00 0.00 O ATOM 2091 CB LEU A 132 0.171 -6.301 4.481 1.00 0.00 C ATOM 2092 CG LEU A 132 1.084 -7.531 4.461 1.00 0.00 C ATOM 2093 CD1 LEU A 132 0.830 -8.347 3.192 1.00 0.00 C ATOM 2094 CD2 LEU A 132 2.544 -7.076 4.482 1.00 0.00 C ATOM 0 H LEU A 132 -1.800 -4.878 4.053 1.00 0.00 H new ATOM 0 HA LEU A 132 -1.481 -7.681 4.471 1.00 0.00 H new ATOM 0 HB2 LEU A 132 0.141 -5.842 3.493 1.00 0.00 H new ATOM 0 HB3 LEU A 132 0.567 -5.553 5.168 1.00 0.00 H new ATOM 0 HG LEU A 132 0.874 -8.148 5.335 1.00 0.00 H new ATOM 0 HD11 LEU A 132 1.482 -9.220 3.184 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -0.210 -8.671 3.170 1.00 0.00 H new ATOM 0 HD13 LEU A 132 1.037 -7.732 2.316 1.00 0.00 H new ATOM 0 HD21 LEU A 132 3.197 -7.948 4.468 1.00 0.00 H new ATOM 0 HD22 LEU A 132 2.745 -6.458 3.607 1.00 0.00 H new ATOM 0 HD23 LEU A 132 2.732 -6.497 5.386 1.00 0.00 H new ATOM 2106 N ARG A 133 -1.701 -7.969 6.933 1.00 0.00 N ATOM 2107 CA ARG A 133 -1.799 -8.161 8.373 1.00 0.00 C ATOM 2108 C ARG A 133 -0.622 -8.981 8.893 1.00 0.00 C ATOM 2109 O ARG A 133 -0.050 -9.794 8.168 1.00 0.00 O ATOM 2110 CB ARG A 133 -3.112 -8.873 8.717 1.00 0.00 C ATOM 2111 CG ARG A 133 -3.918 -8.024 9.702 1.00 0.00 C ATOM 2112 CD ARG A 133 -4.956 -8.901 10.401 1.00 0.00 C ATOM 2113 NE ARG A 133 -4.330 -10.115 10.913 1.00 0.00 N ATOM 2114 CZ ARG A 133 -3.712 -10.126 12.090 1.00 0.00 C ATOM 2115 NH1 ARG A 133 -3.654 -9.037 12.806 1.00 0.00 N ATOM 2116 NH2 ARG A 133 -3.162 -11.226 12.527 1.00 0.00 N ATOM 0 H ARG A 133 -1.962 -8.781 6.373 1.00 0.00 H new ATOM 0 HA ARG A 133 -1.779 -7.181 8.850 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -3.692 -9.044 7.810 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -2.903 -9.851 9.151 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -3.253 -7.572 10.438 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -4.412 -7.207 9.175 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -5.417 -8.348 11.220 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -5.752 -9.161 9.703 1.00 0.00 H new ATOM 0 HE ARG A 133 -4.367 -10.970 10.358 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -4.083 -8.178 12.463 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -3.180 -9.045 13.709 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -3.206 -12.076 11.966 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -2.688 -11.235 13.430 1.00 0.00 H new ATOM 2130 N GLU A 134 -0.272 -8.767 10.158 1.00 0.00 N ATOM 2131 CA GLU A 134 0.832 -9.498 10.769 1.00 0.00 C ATOM 2132 C GLU A 134 0.320 -10.756 11.463 1.00 0.00 C ATOM 2133 O GLU A 134 -0.817 -10.798 11.934 1.00 0.00 O ATOM 2134 CB GLU A 134 1.553 -8.609 11.786 1.00 0.00 C ATOM 2135 CG GLU A 134 0.629 -8.342 12.975 1.00 0.00 C ATOM 2136 CD GLU A 134 0.897 -9.357 14.080 1.00 0.00 C ATOM 2137 OE1 GLU A 134 0.406 -10.468 13.969 1.00 0.00 O ATOM 2138 OE2 GLU A 134 1.590 -9.009 15.023 1.00 0.00 O ATOM 0 H GLU A 134 -0.733 -8.099 10.775 1.00 0.00 H new ATOM 0 HA GLU A 134 1.530 -9.787 9.983 1.00 0.00 H new ATOM 0 HB2 GLU A 134 2.468 -9.094 12.125 1.00 0.00 H new ATOM 0 HB3 GLU A 134 1.845 -7.668 11.320 1.00 0.00 H new ATOM 0 HG2 GLU A 134 0.789 -7.332 13.351 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -0.412 -8.403 12.658 1.00 0.00 H new ATOM 2145 N GLY A 135 1.166 -11.780 11.522 1.00 0.00 N ATOM 2146 CA GLY A 135 0.785 -13.035 12.161 1.00 0.00 C ATOM 2147 C GLY A 135 0.663 -14.153 11.134 1.00 0.00 C ATOM 2148 O GLY A 135 -0.192 -15.032 11.257 1.00 0.00 O ATOM 0 H GLY A 135 2.111 -11.767 11.139 1.00 0.00 H new ATOM 0 HA2 GLY A 135 1.527 -13.305 12.912 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -0.164 -12.909 12.682 1.00 0.00 H new TER 2152 GLY A 135