USER MOD reduce.3.24.130724 H: found=0, std=0, add=1182, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1177 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 100 MET CE :methyl 178:sc= -1.69 (180deg=-1.72) USER MOD Set 1.2: A 114 MET CE :methyl -114:sc= -1.89 (180deg=-4.93!) USER MOD Set 2.1: A 102 SER OG : rot 180:sc=0.000167 USER MOD Set 2.2: A 106 LYS NZ :NH3+ 172:sc=0.000442 (180deg=-0.0611) USER MOD Set 3.1: A 76 TYR OH : rot 16:sc= 0.249 USER MOD Set 3.2: A 103 HIS : no HD1:sc= 0.225 K(o=-6.4,f=-12!) USER MOD Set 3.3: A 104 CYS SG : rot -13:sc= -0.0485 USER MOD Set 3.4: A 107 ASN : amide:sc= -6.87! C(o=-6.4!,f=-13!) USER MOD Set 4.1: A 89 THR OG1 : rot 180:sc= -0.071 USER MOD Set 4.2: A 92 ASN : amide:sc= -0.066 K(o=-0.03,f=-4.5!) USER MOD Set 4.3: A 95 LYS NZ :NH3+ 167:sc= 0.107 (180deg=0) USER MOD Set 5.1: A 90 TYR OH : rot -99:sc= 0.129 USER MOD Set 5.2: A 128 ASN :FLIP amide:sc= 0.127 F(o=-0.81,f=0.26) USER MOD Set 6.1: A 46 LYS NZ :NH3+ -98:sc= -0.0394 (180deg=0) USER MOD Set 6.2: A 47 LYS NZ :NH3+ -111:sc= -4.05! (180deg=-8.58!) USER MOD Single : A 1 GLY N :NH3+ -103:sc= 0.057 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot -51:sc= 0.319 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 CYS SG : rot 118:sc= -0.0331 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 HIS : no HD1:sc= -2.84 K(o=-2.8,f=-4.2) USER MOD Single : A 30 CYS SG : rot 180:sc= -1.55 USER MOD Single : A 32 SER OG : rot 180:sc=-0.00929 USER MOD Single : A 35 CYS SG : rot 62:sc= -0.248 USER MOD Single : A 37 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 ASN :FLIP amide:sc= -0.483 F(o=-1.9,f=-0.48) USER MOD Single : A 58 GLN : amide:sc= -1.24 K(o=-1.2,f=-5.2!) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 LYS NZ :NH3+ 165:sc= 1.04 (180deg=0.927) USER MOD Single : A 61 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.00978) USER MOD Single : A 62 SER OG : rot -160:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.257) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ 160:sc= -2.67! (180deg=-3.11!) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 HIS : no HD1:sc= -4.78! C(o=-4.8!,f=-6.6!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 GLN : amide:sc= -1.01! K(o=-1!,f=-1.6) USER MOD Single : A 96 SER OG : rot -150:sc= -0.0844 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 170:sc= -0.0311 USER MOD Single : A 119 CYS SG : rot 180:sc= 0 USER MOD Single : A 125 GLN : amide:sc= -1.66 K(o=-1.7,f=-4.8!) USER MOD Single : A 130 SER OG : rot -76:sc= 0.378 USER MOD Single : A 132 MET CE :methyl 149:sc= -0.85 (180deg=-3.84!) USER MOD Single : A 140 THR OG1 : rot -33:sc= 0.887 USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 THR OG1 : rot 30:sc= 0.428 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 26.947 -8.746 -14.408 1.00 0.00 N ATOM 2 CA GLY A 1 26.065 -9.757 -13.856 1.00 0.00 C ATOM 3 C GLY A 1 25.219 -9.227 -12.715 1.00 0.00 C ATOM 4 O GLY A 1 25.563 -8.221 -12.094 1.00 0.00 O ATOM 0 H1 GLY A 1 26.556 -8.397 -15.307 1.00 0.00 H new ATOM 0 H2 GLY A 1 27.032 -7.956 -13.737 1.00 0.00 H new ATOM 0 H3 GLY A 1 27.886 -9.159 -14.576 1.00 0.00 H new ATOM 0 HA2 GLY A 1 25.413 -10.135 -14.643 1.00 0.00 H new ATOM 0 HA3 GLY A 1 26.659 -10.600 -13.503 1.00 0.00 H new ATOM 8 N SER A 2 24.110 -9.904 -12.438 1.00 0.00 N ATOM 9 CA SER A 2 23.210 -9.493 -11.367 1.00 0.00 C ATOM 10 C SER A 2 22.738 -10.698 -10.560 1.00 0.00 C ATOM 11 O SER A 2 22.191 -11.653 -11.111 1.00 0.00 O ATOM 12 CB SER A 2 22.004 -8.748 -11.944 1.00 0.00 C ATOM 13 OG SER A 2 22.383 -7.481 -12.453 1.00 0.00 O ATOM 0 H SER A 2 23.813 -10.740 -12.941 1.00 0.00 H new ATOM 0 HA SER A 2 23.758 -8.825 -10.702 1.00 0.00 H new ATOM 0 HB2 SER A 2 21.552 -9.342 -12.738 1.00 0.00 H new ATOM 0 HB3 SER A 2 21.247 -8.621 -11.170 1.00 0.00 H new ATOM 0 HG SER A 2 21.595 -7.026 -12.817 1.00 0.00 H new ATOM 19 N SER A 3 22.955 -10.646 -9.249 1.00 0.00 N ATOM 20 CA SER A 3 22.556 -11.735 -8.365 1.00 0.00 C ATOM 21 C SER A 3 21.630 -11.229 -7.263 1.00 0.00 C ATOM 22 O SER A 3 21.629 -10.044 -6.933 1.00 0.00 O ATOM 23 CB SER A 3 23.790 -12.395 -7.746 1.00 0.00 C ATOM 24 OG SER A 3 24.282 -11.636 -6.655 1.00 0.00 O ATOM 0 H SER A 3 23.405 -9.862 -8.776 1.00 0.00 H new ATOM 0 HA SER A 3 22.016 -12.473 -8.959 1.00 0.00 H new ATOM 0 HB2 SER A 3 23.538 -13.400 -7.409 1.00 0.00 H new ATOM 0 HB3 SER A 3 24.569 -12.498 -8.502 1.00 0.00 H new ATOM 0 HG SER A 3 25.069 -12.080 -6.276 1.00 0.00 H new ATOM 30 N GLY A 4 20.841 -12.138 -6.698 1.00 0.00 N ATOM 31 CA GLY A 4 19.920 -11.765 -5.640 1.00 0.00 C ATOM 32 C GLY A 4 19.907 -12.768 -4.503 1.00 0.00 C ATOM 33 O GLY A 4 20.958 -13.129 -3.973 1.00 0.00 O ATOM 0 H GLY A 4 20.823 -13.125 -6.954 1.00 0.00 H new ATOM 0 HA2 GLY A 4 20.195 -10.784 -5.252 1.00 0.00 H new ATOM 0 HA3 GLY A 4 18.915 -11.675 -6.052 1.00 0.00 H new ATOM 37 N SER A 5 18.715 -13.218 -4.127 1.00 0.00 N ATOM 38 CA SER A 5 18.569 -14.181 -3.042 1.00 0.00 C ATOM 39 C SER A 5 19.215 -13.660 -1.762 1.00 0.00 C ATOM 40 O SER A 5 19.892 -14.400 -1.049 1.00 0.00 O ATOM 41 CB SER A 5 19.194 -15.521 -3.433 1.00 0.00 C ATOM 42 OG SER A 5 18.866 -16.531 -2.495 1.00 0.00 O ATOM 0 H SER A 5 17.836 -12.931 -4.558 1.00 0.00 H new ATOM 0 HA SER A 5 17.504 -14.325 -2.858 1.00 0.00 H new ATOM 0 HB2 SER A 5 18.845 -15.813 -4.423 1.00 0.00 H new ATOM 0 HB3 SER A 5 20.277 -15.416 -3.495 1.00 0.00 H new ATOM 0 HG SER A 5 19.069 -16.215 -1.590 1.00 0.00 H new ATOM 48 N SER A 6 19.000 -12.379 -1.477 1.00 0.00 N ATOM 49 CA SER A 6 19.564 -11.756 -0.285 1.00 0.00 C ATOM 50 C SER A 6 18.463 -11.175 0.596 1.00 0.00 C ATOM 51 O SER A 6 17.679 -10.334 0.157 1.00 0.00 O ATOM 52 CB SER A 6 20.552 -10.656 -0.678 1.00 0.00 C ATOM 53 OG SER A 6 21.643 -11.189 -1.409 1.00 0.00 O ATOM 0 H SER A 6 18.440 -11.753 -2.055 1.00 0.00 H new ATOM 0 HA SER A 6 20.092 -12.523 0.281 1.00 0.00 H new ATOM 0 HB2 SER A 6 20.042 -9.902 -1.277 1.00 0.00 H new ATOM 0 HB3 SER A 6 20.920 -10.156 0.218 1.00 0.00 H new ATOM 0 HG SER A 6 22.259 -10.466 -1.650 1.00 0.00 H new ATOM 59 N GLY A 7 18.410 -11.630 1.845 1.00 0.00 N ATOM 60 CA GLY A 7 17.402 -11.146 2.769 1.00 0.00 C ATOM 61 C GLY A 7 17.790 -9.828 3.411 1.00 0.00 C ATOM 62 O GLY A 7 18.249 -8.911 2.732 1.00 0.00 O ATOM 0 H GLY A 7 19.048 -12.325 2.233 1.00 0.00 H new ATOM 0 HA2 GLY A 7 16.457 -11.025 2.240 1.00 0.00 H new ATOM 0 HA3 GLY A 7 17.239 -11.892 3.547 1.00 0.00 H new ATOM 66 N GLY A 8 17.603 -9.733 4.724 1.00 0.00 N ATOM 67 CA GLY A 8 17.940 -8.514 5.435 1.00 0.00 C ATOM 68 C GLY A 8 16.744 -7.904 6.139 1.00 0.00 C ATOM 69 O GLY A 8 15.868 -8.621 6.623 1.00 0.00 O ATOM 0 H GLY A 8 17.224 -10.479 5.308 1.00 0.00 H new ATOM 0 HA2 GLY A 8 18.719 -8.728 6.167 1.00 0.00 H new ATOM 0 HA3 GLY A 8 18.353 -7.790 4.733 1.00 0.00 H new ATOM 73 N SER A 9 16.707 -6.577 6.199 1.00 0.00 N ATOM 74 CA SER A 9 15.612 -5.871 6.855 1.00 0.00 C ATOM 75 C SER A 9 14.356 -5.895 5.990 1.00 0.00 C ATOM 76 O SER A 9 14.410 -5.629 4.789 1.00 0.00 O ATOM 77 CB SER A 9 16.014 -4.425 7.150 1.00 0.00 C ATOM 78 OG SER A 9 17.193 -4.374 7.936 1.00 0.00 O ATOM 0 H SER A 9 17.423 -5.969 5.801 1.00 0.00 H new ATOM 0 HA SER A 9 15.395 -6.379 7.795 1.00 0.00 H new ATOM 0 HB2 SER A 9 16.174 -3.890 6.214 1.00 0.00 H new ATOM 0 HB3 SER A 9 15.203 -3.918 7.672 1.00 0.00 H new ATOM 0 HG SER A 9 17.430 -3.439 8.110 1.00 0.00 H new ATOM 84 N ARG A 10 13.225 -6.216 6.610 1.00 0.00 N ATOM 85 CA ARG A 10 11.954 -6.276 5.898 1.00 0.00 C ATOM 86 C ARG A 10 11.859 -5.163 4.859 1.00 0.00 C ATOM 87 O ARG A 10 11.897 -5.419 3.655 1.00 0.00 O ATOM 88 CB ARG A 10 10.788 -6.170 6.883 1.00 0.00 C ATOM 89 CG ARG A 10 10.755 -7.289 7.911 1.00 0.00 C ATOM 90 CD ARG A 10 10.279 -8.596 7.297 1.00 0.00 C ATOM 91 NE ARG A 10 10.512 -9.733 8.183 1.00 0.00 N ATOM 92 CZ ARG A 10 9.827 -9.946 9.301 1.00 0.00 C ATOM 93 NH1 ARG A 10 8.871 -9.104 9.667 1.00 0.00 N ATOM 94 NH2 ARG A 10 10.097 -11.004 10.055 1.00 0.00 N ATOM 0 H ARG A 10 13.163 -6.438 7.604 1.00 0.00 H new ATOM 0 HA ARG A 10 11.900 -7.235 5.383 1.00 0.00 H new ATOM 0 HB2 ARG A 10 10.848 -5.213 7.402 1.00 0.00 H new ATOM 0 HB3 ARG A 10 9.851 -6.172 6.326 1.00 0.00 H new ATOM 0 HG2 ARG A 10 11.750 -7.426 8.334 1.00 0.00 H new ATOM 0 HG3 ARG A 10 10.095 -7.010 8.733 1.00 0.00 H new ATOM 0 HD2 ARG A 10 9.215 -8.524 7.071 1.00 0.00 H new ATOM 0 HD3 ARG A 10 10.795 -8.762 6.351 1.00 0.00 H new ATOM 0 HE ARG A 10 11.241 -10.400 7.930 1.00 0.00 H new ATOM 0 HH11 ARG A 10 8.660 -8.290 9.090 1.00 0.00 H new ATOM 0 HH12 ARG A 10 8.347 -9.270 10.526 1.00 0.00 H new ATOM 0 HH21 ARG A 10 10.831 -11.655 9.776 1.00 0.00 H new ATOM 0 HH22 ARG A 10 9.570 -11.166 10.913 1.00 0.00 H new ATOM 108 N ILE A 11 11.736 -3.928 5.333 1.00 0.00 N ATOM 109 CA ILE A 11 11.637 -2.776 4.445 1.00 0.00 C ATOM 110 C ILE A 11 12.994 -2.426 3.844 1.00 0.00 C ATOM 111 O ILE A 11 13.974 -2.233 4.565 1.00 0.00 O ATOM 112 CB ILE A 11 11.081 -1.543 5.182 1.00 0.00 C ATOM 113 CG1 ILE A 11 9.725 -1.866 5.812 1.00 0.00 C ATOM 114 CG2 ILE A 11 10.961 -0.365 4.227 1.00 0.00 C ATOM 115 CD1 ILE A 11 9.140 -0.721 6.608 1.00 0.00 C ATOM 0 H ILE A 11 11.703 -3.699 6.326 1.00 0.00 H new ATOM 0 HA ILE A 11 10.949 -3.052 3.646 1.00 0.00 H new ATOM 0 HB ILE A 11 11.774 -1.271 5.978 1.00 0.00 H new ATOM 0 HG12 ILE A 11 9.025 -2.145 5.025 1.00 0.00 H new ATOM 0 HG13 ILE A 11 9.834 -2.733 6.464 1.00 0.00 H new ATOM 0 HG21 ILE A 11 10.567 0.499 4.762 1.00 0.00 H new ATOM 0 HG22 ILE A 11 11.944 -0.123 3.822 1.00 0.00 H new ATOM 0 HG23 ILE A 11 10.286 -0.625 3.411 1.00 0.00 H new ATOM 0 HD11 ILE A 11 8.179 -1.022 7.025 1.00 0.00 H new ATOM 0 HD12 ILE A 11 9.820 -0.456 7.417 1.00 0.00 H new ATOM 0 HD13 ILE A 11 8.999 0.141 5.956 1.00 0.00 H new ATOM 127 N THR A 12 13.045 -2.345 2.518 1.00 0.00 N ATOM 128 CA THR A 12 14.281 -2.018 1.819 1.00 0.00 C ATOM 129 C THR A 12 14.113 -0.772 0.957 1.00 0.00 C ATOM 130 O THR A 12 13.104 -0.613 0.270 1.00 0.00 O ATOM 131 CB THR A 12 14.749 -3.185 0.929 1.00 0.00 C ATOM 132 OG1 THR A 12 15.010 -4.341 1.733 1.00 0.00 O ATOM 133 CG2 THR A 12 16.002 -2.806 0.154 1.00 0.00 C ATOM 0 H THR A 12 12.244 -2.502 1.907 1.00 0.00 H new ATOM 0 HA THR A 12 15.035 -1.828 2.583 1.00 0.00 H new ATOM 0 HB THR A 12 13.955 -3.411 0.217 1.00 0.00 H new ATOM 0 HG1 THR A 12 15.305 -5.079 1.159 1.00 0.00 H new ATOM 0 HG21 THR A 12 16.313 -3.646 -0.467 1.00 0.00 H new ATOM 0 HG22 THR A 12 15.791 -1.944 -0.480 1.00 0.00 H new ATOM 0 HG23 THR A 12 16.800 -2.556 0.853 1.00 0.00 H new ATOM 141 N TYR A 13 15.107 0.108 0.998 1.00 0.00 N ATOM 142 CA TYR A 13 15.067 1.342 0.221 1.00 0.00 C ATOM 143 C TYR A 13 16.089 1.305 -0.911 1.00 0.00 C ATOM 144 O TYR A 13 17.294 1.218 -0.674 1.00 0.00 O ATOM 145 CB TYR A 13 15.334 2.547 1.125 1.00 0.00 C ATOM 146 CG TYR A 13 14.508 2.548 2.392 1.00 0.00 C ATOM 147 CD1 TYR A 13 13.136 2.759 2.349 1.00 0.00 C ATOM 148 CD2 TYR A 13 15.101 2.339 3.631 1.00 0.00 C ATOM 149 CE1 TYR A 13 12.377 2.763 3.504 1.00 0.00 C ATOM 150 CE2 TYR A 13 14.350 2.339 4.791 1.00 0.00 C ATOM 151 CZ TYR A 13 12.989 2.551 4.722 1.00 0.00 C ATOM 152 OH TYR A 13 12.238 2.553 5.875 1.00 0.00 O ATOM 0 H TYR A 13 15.950 -0.010 1.560 1.00 0.00 H new ATOM 0 HA TYR A 13 14.072 1.436 -0.214 1.00 0.00 H new ATOM 0 HB2 TYR A 13 16.391 2.564 1.390 1.00 0.00 H new ATOM 0 HB3 TYR A 13 15.130 3.461 0.568 1.00 0.00 H new ATOM 0 HD1 TYR A 13 12.654 2.923 1.397 1.00 0.00 H new ATOM 0 HD2 TYR A 13 16.167 2.174 3.688 1.00 0.00 H new ATOM 0 HE1 TYR A 13 11.311 2.931 3.453 1.00 0.00 H new ATOM 0 HE2 TYR A 13 14.826 2.174 5.746 1.00 0.00 H new ATOM 0 HH TYR A 13 12.821 2.388 6.645 1.00 0.00 H new ATOM 162 N VAL A 14 15.597 1.373 -2.145 1.00 0.00 N ATOM 163 CA VAL A 14 16.466 1.350 -3.316 1.00 0.00 C ATOM 164 C VAL A 14 16.317 2.627 -4.135 1.00 0.00 C ATOM 165 O VAL A 14 15.257 3.252 -4.145 1.00 0.00 O ATOM 166 CB VAL A 14 16.162 0.137 -4.216 1.00 0.00 C ATOM 167 CG1 VAL A 14 17.075 0.133 -5.433 1.00 0.00 C ATOM 168 CG2 VAL A 14 16.302 -1.157 -3.430 1.00 0.00 C ATOM 0 H VAL A 14 14.602 1.444 -2.359 1.00 0.00 H new ATOM 0 HA VAL A 14 17.490 1.274 -2.950 1.00 0.00 H new ATOM 0 HB VAL A 14 15.132 0.214 -4.565 1.00 0.00 H new ATOM 0 HG11 VAL A 14 16.846 -0.731 -6.057 1.00 0.00 H new ATOM 0 HG12 VAL A 14 16.920 1.047 -6.007 1.00 0.00 H new ATOM 0 HG13 VAL A 14 18.114 0.080 -5.108 1.00 0.00 H new ATOM 0 HG21 VAL A 14 16.084 -2.004 -4.081 1.00 0.00 H new ATOM 0 HG22 VAL A 14 17.320 -1.244 -3.051 1.00 0.00 H new ATOM 0 HG23 VAL A 14 15.603 -1.152 -2.594 1.00 0.00 H new ATOM 178 N LYS A 15 17.388 3.010 -4.823 1.00 0.00 N ATOM 179 CA LYS A 15 17.378 4.211 -5.648 1.00 0.00 C ATOM 180 C LYS A 15 17.256 3.856 -7.126 1.00 0.00 C ATOM 181 O LYS A 15 18.109 3.163 -7.681 1.00 0.00 O ATOM 182 CB LYS A 15 18.652 5.027 -5.413 1.00 0.00 C ATOM 183 CG LYS A 15 18.679 6.345 -6.167 1.00 0.00 C ATOM 184 CD LYS A 15 19.784 7.255 -5.660 1.00 0.00 C ATOM 185 CE LYS A 15 19.341 8.043 -4.437 1.00 0.00 C ATOM 186 NZ LYS A 15 20.491 8.685 -3.744 1.00 0.00 N ATOM 0 H LYS A 15 18.274 2.505 -4.825 1.00 0.00 H new ATOM 0 HA LYS A 15 16.512 4.809 -5.363 1.00 0.00 H new ATOM 0 HB2 LYS A 15 18.754 5.226 -4.346 1.00 0.00 H new ATOM 0 HB3 LYS A 15 19.515 4.431 -5.710 1.00 0.00 H new ATOM 0 HG2 LYS A 15 18.823 6.154 -7.230 1.00 0.00 H new ATOM 0 HG3 LYS A 15 17.717 6.846 -6.061 1.00 0.00 H new ATOM 0 HD2 LYS A 15 20.662 6.659 -5.411 1.00 0.00 H new ATOM 0 HD3 LYS A 15 20.080 7.945 -6.451 1.00 0.00 H new ATOM 0 HE2 LYS A 15 18.625 8.808 -4.738 1.00 0.00 H new ATOM 0 HE3 LYS A 15 18.825 7.378 -3.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 20.147 9.212 -2.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 21.162 7.953 -3.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 20.969 9.339 -4.397 1.00 0.00 H new ATOM 200 N GLY A 16 16.190 4.336 -7.760 1.00 0.00 N ATOM 201 CA GLY A 16 15.978 4.058 -9.169 1.00 0.00 C ATOM 202 C GLY A 16 14.515 3.843 -9.503 1.00 0.00 C ATOM 203 O GLY A 16 13.648 3.967 -8.637 1.00 0.00 O ATOM 0 H GLY A 16 15.470 4.912 -7.323 1.00 0.00 H new ATOM 0 HA2 GLY A 16 16.365 4.887 -9.762 1.00 0.00 H new ATOM 0 HA3 GLY A 16 16.546 3.172 -9.451 1.00 0.00 H new ATOM 207 N ASP A 17 14.238 3.520 -10.761 1.00 0.00 N ATOM 208 CA ASP A 17 12.870 3.288 -11.208 1.00 0.00 C ATOM 209 C ASP A 17 12.088 2.488 -10.170 1.00 0.00 C ATOM 210 O ASP A 17 12.672 1.821 -9.315 1.00 0.00 O ATOM 211 CB ASP A 17 12.866 2.550 -12.548 1.00 0.00 C ATOM 212 CG ASP A 17 13.950 3.045 -13.484 1.00 0.00 C ATOM 213 OD1 ASP A 17 15.142 2.814 -13.189 1.00 0.00 O ATOM 214 OD2 ASP A 17 13.607 3.663 -14.514 1.00 0.00 O ATOM 0 H ASP A 17 14.943 3.413 -11.490 1.00 0.00 H new ATOM 0 HA ASP A 17 12.386 4.256 -11.335 1.00 0.00 H new ATOM 0 HB2 ASP A 17 13.001 1.483 -12.372 1.00 0.00 H new ATOM 0 HB3 ASP A 17 11.894 2.674 -13.025 1.00 0.00 H new ATOM 219 N LEU A 18 10.764 2.560 -10.251 1.00 0.00 N ATOM 220 CA LEU A 18 9.901 1.843 -9.318 1.00 0.00 C ATOM 221 C LEU A 18 9.071 0.789 -10.043 1.00 0.00 C ATOM 222 O LEU A 18 8.763 -0.265 -9.487 1.00 0.00 O ATOM 223 CB LEU A 18 8.978 2.823 -8.590 1.00 0.00 C ATOM 224 CG LEU A 18 7.676 2.238 -8.044 1.00 0.00 C ATOM 225 CD1 LEU A 18 7.958 1.015 -7.186 1.00 0.00 C ATOM 226 CD2 LEU A 18 6.914 3.287 -7.246 1.00 0.00 C ATOM 0 H LEU A 18 10.265 3.107 -10.952 1.00 0.00 H new ATOM 0 HA LEU A 18 10.536 1.340 -8.588 1.00 0.00 H new ATOM 0 HB2 LEU A 18 9.531 3.264 -7.761 1.00 0.00 H new ATOM 0 HB3 LEU A 18 8.730 3.634 -9.275 1.00 0.00 H new ATOM 0 HG LEU A 18 7.057 1.930 -8.887 1.00 0.00 H new ATOM 0 HD11 LEU A 18 7.019 0.613 -6.806 1.00 0.00 H new ATOM 0 HD12 LEU A 18 8.461 0.257 -7.787 1.00 0.00 H new ATOM 0 HD13 LEU A 18 8.597 1.297 -6.349 1.00 0.00 H new ATOM 0 HD21 LEU A 18 5.990 2.853 -6.865 1.00 0.00 H new ATOM 0 HD22 LEU A 18 7.527 3.626 -6.411 1.00 0.00 H new ATOM 0 HD23 LEU A 18 6.679 4.134 -7.890 1.00 0.00 H new ATOM 238 N PHE A 19 8.714 1.080 -11.290 1.00 0.00 N ATOM 239 CA PHE A 19 7.921 0.156 -12.093 1.00 0.00 C ATOM 240 C PHE A 19 8.808 -0.622 -13.061 1.00 0.00 C ATOM 241 O PHE A 19 8.477 -1.738 -13.462 1.00 0.00 O ATOM 242 CB PHE A 19 6.845 0.917 -12.869 1.00 0.00 C ATOM 243 CG PHE A 19 6.132 1.953 -12.047 1.00 0.00 C ATOM 244 CD1 PHE A 19 5.637 1.639 -10.792 1.00 0.00 C ATOM 245 CD2 PHE A 19 5.958 3.240 -12.529 1.00 0.00 C ATOM 246 CE1 PHE A 19 4.980 2.590 -10.034 1.00 0.00 C ATOM 247 CE2 PHE A 19 5.303 4.195 -11.776 1.00 0.00 C ATOM 248 CZ PHE A 19 4.814 3.870 -10.526 1.00 0.00 C ATOM 0 H PHE A 19 8.961 1.948 -11.766 1.00 0.00 H new ATOM 0 HA PHE A 19 7.440 -0.553 -11.419 1.00 0.00 H new ATOM 0 HB2 PHE A 19 7.304 1.401 -13.731 1.00 0.00 H new ATOM 0 HB3 PHE A 19 6.115 0.205 -13.255 1.00 0.00 H new ATOM 0 HD1 PHE A 19 5.766 0.640 -10.402 1.00 0.00 H new ATOM 0 HD2 PHE A 19 6.339 3.500 -13.506 1.00 0.00 H new ATOM 0 HE1 PHE A 19 4.597 2.332 -9.058 1.00 0.00 H new ATOM 0 HE2 PHE A 19 5.173 5.194 -12.164 1.00 0.00 H new ATOM 0 HZ PHE A 19 4.303 4.615 -9.934 1.00 0.00 H new ATOM 258 N ALA A 20 9.935 -0.024 -13.433 1.00 0.00 N ATOM 259 CA ALA A 20 10.870 -0.660 -14.353 1.00 0.00 C ATOM 260 C ALA A 20 11.795 -1.623 -13.616 1.00 0.00 C ATOM 261 O ALA A 20 12.304 -2.580 -14.201 1.00 0.00 O ATOM 262 CB ALA A 20 11.682 0.392 -15.092 1.00 0.00 C ATOM 0 H ALA A 20 10.223 0.900 -13.111 1.00 0.00 H new ATOM 0 HA ALA A 20 10.294 -1.234 -15.079 1.00 0.00 H new ATOM 0 HB1 ALA A 20 12.376 -0.098 -15.775 1.00 0.00 H new ATOM 0 HB2 ALA A 20 11.011 1.038 -15.658 1.00 0.00 H new ATOM 0 HB3 ALA A 20 12.242 0.990 -14.373 1.00 0.00 H new ATOM 268 N CYS A 21 12.008 -1.365 -12.331 1.00 0.00 N ATOM 269 CA CYS A 21 12.874 -2.208 -11.514 1.00 0.00 C ATOM 270 C CYS A 21 12.319 -3.626 -11.419 1.00 0.00 C ATOM 271 O CYS A 21 12.960 -4.598 -11.819 1.00 0.00 O ATOM 272 CB CYS A 21 13.027 -1.613 -10.114 1.00 0.00 C ATOM 273 SG CYS A 21 14.479 -0.553 -9.917 1.00 0.00 S ATOM 0 H CYS A 21 11.593 -0.578 -11.832 1.00 0.00 H new ATOM 0 HA CYS A 21 13.853 -2.251 -11.991 1.00 0.00 H new ATOM 0 HB2 CYS A 21 12.134 -1.035 -9.877 1.00 0.00 H new ATOM 0 HB3 CYS A 21 13.083 -2.426 -9.390 1.00 0.00 H new ATOM 0 HG CYS A 21 14.098 0.656 -9.630 1.00 0.00 H new ATOM 279 N PRO A 22 11.099 -3.749 -10.876 1.00 0.00 N ATOM 280 CA PRO A 22 10.431 -5.044 -10.715 1.00 0.00 C ATOM 281 C PRO A 22 10.005 -5.646 -12.049 1.00 0.00 C ATOM 282 O PRO A 22 10.082 -4.993 -13.090 1.00 0.00 O ATOM 283 CB PRO A 22 9.204 -4.706 -9.865 1.00 0.00 C ATOM 284 CG PRO A 22 8.934 -3.268 -10.142 1.00 0.00 C ATOM 285 CD PRO A 22 10.277 -2.633 -10.378 1.00 0.00 C ATOM 0 HA PRO A 22 11.087 -5.788 -10.264 1.00 0.00 H new ATOM 0 HB2 PRO A 22 8.351 -5.328 -10.137 1.00 0.00 H new ATOM 0 HB3 PRO A 22 9.398 -4.875 -8.806 1.00 0.00 H new ATOM 0 HG2 PRO A 22 8.289 -3.153 -11.013 1.00 0.00 H new ATOM 0 HG3 PRO A 22 8.422 -2.798 -9.302 1.00 0.00 H new ATOM 0 HD2 PRO A 22 10.216 -1.823 -11.105 1.00 0.00 H new ATOM 0 HD3 PRO A 22 10.688 -2.209 -9.462 1.00 0.00 H new ATOM 293 N LYS A 23 9.555 -6.896 -12.012 1.00 0.00 N ATOM 294 CA LYS A 23 9.115 -7.588 -13.218 1.00 0.00 C ATOM 295 C LYS A 23 7.695 -8.118 -13.053 1.00 0.00 C ATOM 296 O LYS A 23 6.885 -8.054 -13.979 1.00 0.00 O ATOM 297 CB LYS A 23 10.067 -8.741 -13.546 1.00 0.00 C ATOM 298 CG LYS A 23 11.272 -8.319 -14.368 1.00 0.00 C ATOM 299 CD LYS A 23 12.110 -9.517 -14.784 1.00 0.00 C ATOM 300 CE LYS A 23 13.037 -9.964 -13.664 1.00 0.00 C ATOM 301 NZ LYS A 23 14.056 -10.938 -14.144 1.00 0.00 N ATOM 0 H LYS A 23 9.485 -7.451 -11.159 1.00 0.00 H new ATOM 0 HA LYS A 23 9.124 -6.873 -14.041 1.00 0.00 H new ATOM 0 HB2 LYS A 23 10.412 -9.192 -12.616 1.00 0.00 H new ATOM 0 HB3 LYS A 23 9.519 -9.511 -14.089 1.00 0.00 H new ATOM 0 HG2 LYS A 23 10.938 -7.781 -15.256 1.00 0.00 H new ATOM 0 HG3 LYS A 23 11.885 -7.628 -13.789 1.00 0.00 H new ATOM 0 HD2 LYS A 23 11.454 -10.341 -15.066 1.00 0.00 H new ATOM 0 HD3 LYS A 23 12.699 -9.262 -15.665 1.00 0.00 H new ATOM 0 HE2 LYS A 23 13.538 -9.095 -13.238 1.00 0.00 H new ATOM 0 HE3 LYS A 23 12.450 -10.417 -12.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 14.668 -11.219 -13.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 13.579 -11.779 -14.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 14.633 -10.498 -14.889 1.00 0.00 H new ATOM 315 N THR A 24 7.397 -8.641 -11.868 1.00 0.00 N ATOM 316 CA THR A 24 6.074 -9.183 -11.581 1.00 0.00 C ATOM 317 C THR A 24 5.486 -8.559 -10.321 1.00 0.00 C ATOM 318 O THR A 24 4.267 -8.487 -10.163 1.00 0.00 O ATOM 319 CB THR A 24 6.118 -10.713 -11.411 1.00 0.00 C ATOM 320 OG1 THR A 24 7.102 -11.069 -10.434 1.00 0.00 O ATOM 321 CG2 THR A 24 6.438 -11.395 -12.733 1.00 0.00 C ATOM 0 H THR A 24 8.055 -8.701 -11.091 1.00 0.00 H new ATOM 0 HA THR A 24 5.441 -8.938 -12.434 1.00 0.00 H new ATOM 0 HB THR A 24 5.136 -11.048 -11.076 1.00 0.00 H new ATOM 0 HG1 THR A 24 7.123 -12.043 -10.330 1.00 0.00 H new ATOM 0 HG21 THR A 24 6.464 -12.475 -12.588 1.00 0.00 H new ATOM 0 HG22 THR A 24 5.671 -11.145 -13.466 1.00 0.00 H new ATOM 0 HG23 THR A 24 7.409 -11.054 -13.093 1.00 0.00 H new ATOM 329 N ASP A 25 6.359 -8.109 -9.426 1.00 0.00 N ATOM 330 CA ASP A 25 5.926 -7.489 -8.179 1.00 0.00 C ATOM 331 C ASP A 25 4.776 -6.519 -8.426 1.00 0.00 C ATOM 332 O ASP A 25 4.773 -5.781 -9.411 1.00 0.00 O ATOM 333 CB ASP A 25 7.094 -6.758 -7.516 1.00 0.00 C ATOM 334 CG ASP A 25 8.295 -7.658 -7.302 1.00 0.00 C ATOM 335 OD1 ASP A 25 8.385 -8.700 -7.984 1.00 0.00 O ATOM 336 OD2 ASP A 25 9.145 -7.320 -6.452 1.00 0.00 O ATOM 0 H ASP A 25 7.371 -8.162 -9.541 1.00 0.00 H new ATOM 0 HA ASP A 25 5.576 -8.277 -7.512 1.00 0.00 H new ATOM 0 HB2 ASP A 25 7.386 -5.909 -8.135 1.00 0.00 H new ATOM 0 HB3 ASP A 25 6.769 -6.356 -6.556 1.00 0.00 H new ATOM 341 N SER A 26 3.798 -6.526 -7.525 1.00 0.00 N ATOM 342 CA SER A 26 2.639 -5.649 -7.647 1.00 0.00 C ATOM 343 C SER A 26 2.931 -4.276 -7.050 1.00 0.00 C ATOM 344 O SER A 26 3.955 -4.076 -6.394 1.00 0.00 O ATOM 345 CB SER A 26 1.427 -6.273 -6.953 1.00 0.00 C ATOM 346 OG SER A 26 1.098 -7.525 -7.529 1.00 0.00 O ATOM 0 H SER A 26 3.785 -7.129 -6.703 1.00 0.00 H new ATOM 0 HA SER A 26 2.418 -5.524 -8.707 1.00 0.00 H new ATOM 0 HB2 SER A 26 1.638 -6.402 -5.891 1.00 0.00 H new ATOM 0 HB3 SER A 26 0.574 -5.599 -7.029 1.00 0.00 H new ATOM 0 HG SER A 26 0.321 -7.904 -7.067 1.00 0.00 H new ATOM 352 N LEU A 27 2.025 -3.333 -7.282 1.00 0.00 N ATOM 353 CA LEU A 27 2.184 -1.977 -6.768 1.00 0.00 C ATOM 354 C LEU A 27 1.135 -1.673 -5.702 1.00 0.00 C ATOM 355 O LEU A 27 0.065 -2.279 -5.679 1.00 0.00 O ATOM 356 CB LEU A 27 2.078 -0.962 -7.908 1.00 0.00 C ATOM 357 CG LEU A 27 2.803 -1.330 -9.202 1.00 0.00 C ATOM 358 CD1 LEU A 27 2.524 -0.296 -10.283 1.00 0.00 C ATOM 359 CD2 LEU A 27 4.300 -1.456 -8.957 1.00 0.00 C ATOM 0 H LEU A 27 1.173 -3.482 -7.822 1.00 0.00 H new ATOM 0 HA LEU A 27 3.172 -1.901 -6.313 1.00 0.00 H new ATOM 0 HB2 LEU A 27 1.023 -0.811 -8.136 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.468 -0.007 -7.555 1.00 0.00 H new ATOM 0 HG LEU A 27 2.428 -2.294 -9.544 1.00 0.00 H new ATOM 0 HD11 LEU A 27 3.048 -0.575 -11.197 1.00 0.00 H new ATOM 0 HD12 LEU A 27 1.452 -0.254 -10.478 1.00 0.00 H new ATOM 0 HD13 LEU A 27 2.871 0.682 -9.949 1.00 0.00 H new ATOM 0 HD21 LEU A 27 4.800 -1.718 -9.889 1.00 0.00 H new ATOM 0 HD22 LEU A 27 4.690 -0.506 -8.591 1.00 0.00 H new ATOM 0 HD23 LEU A 27 4.483 -2.234 -8.215 1.00 0.00 H new ATOM 371 N ALA A 28 1.451 -0.728 -4.822 1.00 0.00 N ATOM 372 CA ALA A 28 0.534 -0.340 -3.757 1.00 0.00 C ATOM 373 C ALA A 28 0.707 1.130 -3.392 1.00 0.00 C ATOM 374 O ALA A 28 1.739 1.529 -2.852 1.00 0.00 O ATOM 375 CB ALA A 28 0.747 -1.218 -2.532 1.00 0.00 C ATOM 0 H ALA A 28 2.334 -0.218 -4.826 1.00 0.00 H new ATOM 0 HA ALA A 28 -0.484 -0.480 -4.119 1.00 0.00 H new ATOM 0 HB1 ALA A 28 0.056 -0.918 -1.744 1.00 0.00 H new ATOM 0 HB2 ALA A 28 0.566 -2.260 -2.795 1.00 0.00 H new ATOM 0 HB3 ALA A 28 1.772 -1.106 -2.178 1.00 0.00 H new ATOM 381 N HIS A 29 -0.309 1.933 -3.692 1.00 0.00 N ATOM 382 CA HIS A 29 -0.269 3.361 -3.396 1.00 0.00 C ATOM 383 C HIS A 29 -1.511 3.790 -2.620 1.00 0.00 C ATOM 384 O HIS A 29 -2.510 3.070 -2.581 1.00 0.00 O ATOM 385 CB HIS A 29 -0.157 4.168 -4.689 1.00 0.00 C ATOM 386 CG HIS A 29 0.114 5.624 -4.464 1.00 0.00 C ATOM 387 ND1 HIS A 29 -0.886 6.564 -4.331 1.00 0.00 N ATOM 388 CD2 HIS A 29 1.282 6.300 -4.348 1.00 0.00 C ATOM 389 CE1 HIS A 29 -0.345 7.755 -4.144 1.00 0.00 C ATOM 390 NE2 HIS A 29 0.969 7.622 -4.149 1.00 0.00 N ATOM 0 H HIS A 29 -1.170 1.619 -4.140 1.00 0.00 H new ATOM 0 HA HIS A 29 0.608 3.555 -2.779 1.00 0.00 H new ATOM 0 HB2 HIS A 29 0.641 3.749 -5.302 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -1.082 4.062 -5.255 1.00 0.00 H new ATOM 0 HD2 HIS A 29 2.275 5.878 -4.402 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -0.886 8.680 -4.010 1.00 0.00 H new ATOM 0 HE2 HIS A 29 1.642 8.378 -4.025 1.00 0.00 H new ATOM 398 N CYS A 30 -1.441 4.964 -2.004 1.00 0.00 N ATOM 399 CA CYS A 30 -2.559 5.488 -1.228 1.00 0.00 C ATOM 400 C CYS A 30 -3.248 6.630 -1.969 1.00 0.00 C ATOM 401 O CYS A 30 -2.593 7.562 -2.439 1.00 0.00 O ATOM 402 CB CYS A 30 -2.076 5.970 0.141 1.00 0.00 C ATOM 403 SG CYS A 30 -1.145 4.732 1.073 1.00 0.00 S ATOM 0 H CYS A 30 -0.622 5.571 -2.027 1.00 0.00 H new ATOM 0 HA CYS A 30 -3.280 4.683 -1.088 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -1.450 6.852 0.004 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -2.939 6.280 0.730 1.00 0.00 H new ATOM 0 HG CYS A 30 -0.778 5.234 2.215 1.00 0.00 H new ATOM 409 N ILE A 31 -4.570 6.551 -2.070 1.00 0.00 N ATOM 410 CA ILE A 31 -5.346 7.578 -2.754 1.00 0.00 C ATOM 411 C ILE A 31 -6.635 7.887 -2.000 1.00 0.00 C ATOM 412 O ILE A 31 -6.925 7.278 -0.970 1.00 0.00 O ATOM 413 CB ILE A 31 -5.696 7.154 -4.193 1.00 0.00 C ATOM 414 CG1 ILE A 31 -6.491 5.846 -4.183 1.00 0.00 C ATOM 415 CG2 ILE A 31 -4.431 7.005 -5.024 1.00 0.00 C ATOM 416 CD1 ILE A 31 -7.201 5.561 -5.488 1.00 0.00 C ATOM 0 H ILE A 31 -5.126 5.787 -1.687 1.00 0.00 H new ATOM 0 HA ILE A 31 -4.724 8.473 -2.788 1.00 0.00 H new ATOM 0 HB ILE A 31 -6.314 7.930 -4.645 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -5.815 5.021 -3.959 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -7.226 5.883 -3.379 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -4.695 6.705 -6.038 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -3.901 7.957 -5.054 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -3.789 6.246 -4.577 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -7.744 4.619 -5.409 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -7.902 6.367 -5.704 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -6.469 5.491 -6.293 1.00 0.00 H new ATOM 428 N SER A 32 -7.406 8.836 -2.520 1.00 0.00 N ATOM 429 CA SER A 32 -8.663 9.228 -1.895 1.00 0.00 C ATOM 430 C SER A 32 -9.839 8.496 -2.534 1.00 0.00 C ATOM 431 O SER A 32 -9.754 8.040 -3.674 1.00 0.00 O ATOM 432 CB SER A 32 -8.866 10.740 -2.011 1.00 0.00 C ATOM 433 OG SER A 32 -9.544 11.073 -3.210 1.00 0.00 O ATOM 0 H SER A 32 -7.182 9.348 -3.373 1.00 0.00 H new ATOM 0 HA SER A 32 -8.616 8.955 -0.841 1.00 0.00 H new ATOM 0 HB2 SER A 32 -9.436 11.100 -1.155 1.00 0.00 H new ATOM 0 HB3 SER A 32 -7.899 11.243 -1.984 1.00 0.00 H new ATOM 0 HG SER A 32 -9.663 12.044 -3.260 1.00 0.00 H new ATOM 439 N GLU A 33 -10.936 8.388 -1.791 1.00 0.00 N ATOM 440 CA GLU A 33 -12.129 7.710 -2.284 1.00 0.00 C ATOM 441 C GLU A 33 -12.493 8.200 -3.683 1.00 0.00 C ATOM 442 O GLU A 33 -12.973 7.431 -4.516 1.00 0.00 O ATOM 443 CB GLU A 33 -13.304 7.938 -1.331 1.00 0.00 C ATOM 444 CG GLU A 33 -13.307 7.002 -0.134 1.00 0.00 C ATOM 445 CD GLU A 33 -14.693 6.806 0.450 1.00 0.00 C ATOM 446 OE1 GLU A 33 -15.162 7.708 1.177 1.00 0.00 O ATOM 447 OE2 GLU A 33 -15.308 5.753 0.182 1.00 0.00 O ATOM 0 H GLU A 33 -11.023 8.761 -0.846 1.00 0.00 H new ATOM 0 HA GLU A 33 -11.914 6.643 -2.335 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -13.278 8.968 -0.976 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -14.237 7.814 -1.881 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -12.903 6.035 -0.433 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -12.646 7.400 0.635 1.00 0.00 H new ATOM 454 N ASP A 34 -12.262 9.484 -3.933 1.00 0.00 N ATOM 455 CA ASP A 34 -12.565 10.077 -5.230 1.00 0.00 C ATOM 456 C ASP A 34 -11.654 9.508 -6.314 1.00 0.00 C ATOM 457 O ASP A 34 -12.038 9.425 -7.481 1.00 0.00 O ATOM 458 CB ASP A 34 -12.415 11.598 -5.167 1.00 0.00 C ATOM 459 CG ASP A 34 -13.601 12.269 -4.503 1.00 0.00 C ATOM 460 OD1 ASP A 34 -13.739 12.145 -3.268 1.00 0.00 O ATOM 461 OD2 ASP A 34 -14.391 12.920 -5.219 1.00 0.00 O ATOM 0 H ASP A 34 -11.866 10.134 -3.254 1.00 0.00 H new ATOM 0 HA ASP A 34 -13.597 9.832 -5.482 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -11.506 11.848 -4.620 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -12.297 11.991 -6.177 1.00 0.00 H new ATOM 466 N CYS A 35 -10.446 9.119 -5.920 1.00 0.00 N ATOM 467 CA CYS A 35 -9.479 8.560 -6.858 1.00 0.00 C ATOM 468 C CYS A 35 -9.104 9.582 -7.926 1.00 0.00 C ATOM 469 O CYS A 35 -9.068 9.267 -9.115 1.00 0.00 O ATOM 470 CB CYS A 35 -10.046 7.301 -7.516 1.00 0.00 C ATOM 471 SG CYS A 35 -10.530 6.011 -6.346 1.00 0.00 S ATOM 0 H CYS A 35 -10.113 9.180 -4.958 1.00 0.00 H new ATOM 0 HA CYS A 35 -8.579 8.297 -6.301 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -10.913 7.577 -8.116 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -9.301 6.895 -8.201 1.00 0.00 H new ATOM 0 HG CYS A 35 -11.479 6.456 -5.577 1.00 0.00 H new ATOM 477 N ARG A 36 -8.828 10.808 -7.493 1.00 0.00 N ATOM 478 CA ARG A 36 -8.458 11.877 -8.413 1.00 0.00 C ATOM 479 C ARG A 36 -7.019 12.324 -8.177 1.00 0.00 C ATOM 480 O ARG A 36 -6.689 13.499 -8.338 1.00 0.00 O ATOM 481 CB ARG A 36 -9.406 13.067 -8.252 1.00 0.00 C ATOM 482 CG ARG A 36 -10.852 12.745 -8.592 1.00 0.00 C ATOM 483 CD ARG A 36 -11.147 12.995 -10.063 1.00 0.00 C ATOM 484 NE ARG A 36 -12.556 13.302 -10.294 1.00 0.00 N ATOM 485 CZ ARG A 36 -13.074 14.518 -10.162 1.00 0.00 C ATOM 486 NH1 ARG A 36 -12.302 15.535 -9.803 1.00 0.00 N ATOM 487 NH2 ARG A 36 -14.365 14.719 -10.390 1.00 0.00 N ATOM 0 H ARG A 36 -8.854 11.085 -6.512 1.00 0.00 H new ATOM 0 HA ARG A 36 -8.538 11.492 -9.429 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -9.355 13.425 -7.224 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -9.064 13.882 -8.891 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -11.061 11.703 -8.350 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -11.516 13.354 -7.978 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -10.533 13.821 -10.421 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -10.868 12.116 -10.643 1.00 0.00 H new ATOM 0 HE ARG A 36 -13.176 12.541 -10.572 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -11.309 15.384 -9.628 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -12.702 16.468 -9.702 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -14.961 13.939 -10.667 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -14.761 15.653 -10.288 1.00 0.00 H new ATOM 501 N MET A 37 -6.166 11.379 -7.794 1.00 0.00 N ATOM 502 CA MET A 37 -4.762 11.676 -7.536 1.00 0.00 C ATOM 503 C MET A 37 -4.201 12.616 -8.598 1.00 0.00 C ATOM 504 O MET A 37 -4.320 12.357 -9.795 1.00 0.00 O ATOM 505 CB MET A 37 -3.944 10.383 -7.499 1.00 0.00 C ATOM 506 CG MET A 37 -4.128 9.513 -8.731 1.00 0.00 C ATOM 507 SD MET A 37 -3.672 7.792 -8.440 1.00 0.00 S ATOM 508 CE MET A 37 -5.189 6.958 -8.899 1.00 0.00 C ATOM 0 H MET A 37 -6.423 10.402 -7.656 1.00 0.00 H new ATOM 0 HA MET A 37 -4.693 12.169 -6.567 1.00 0.00 H new ATOM 0 HB2 MET A 37 -2.888 10.633 -7.395 1.00 0.00 H new ATOM 0 HB3 MET A 37 -4.224 9.811 -6.615 1.00 0.00 H new ATOM 0 HG2 MET A 37 -5.169 9.560 -9.052 1.00 0.00 H new ATOM 0 HG3 MET A 37 -3.525 9.912 -9.546 1.00 0.00 H new ATOM 0 HE1 MET A 37 -5.065 5.882 -8.773 1.00 0.00 H new ATOM 0 HE2 MET A 37 -6.003 7.307 -8.263 1.00 0.00 H new ATOM 0 HE3 MET A 37 -5.423 7.177 -9.941 1.00 0.00 H new ATOM 518 N GLY A 38 -3.590 13.709 -8.152 1.00 0.00 N ATOM 519 CA GLY A 38 -3.021 14.671 -9.078 1.00 0.00 C ATOM 520 C GLY A 38 -1.814 15.385 -8.502 1.00 0.00 C ATOM 521 O GLY A 38 -1.526 16.525 -8.868 1.00 0.00 O ATOM 0 H GLY A 38 -3.479 13.946 -7.166 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -2.733 14.160 -9.997 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -3.780 15.406 -9.346 1.00 0.00 H new ATOM 525 N ALA A 39 -1.107 14.715 -7.598 1.00 0.00 N ATOM 526 CA ALA A 39 0.075 15.293 -6.971 1.00 0.00 C ATOM 527 C ALA A 39 1.157 14.239 -6.764 1.00 0.00 C ATOM 528 O ALA A 39 0.889 13.040 -6.822 1.00 0.00 O ATOM 529 CB ALA A 39 -0.294 15.940 -5.644 1.00 0.00 C ATOM 0 H ALA A 39 -1.332 13.771 -7.283 1.00 0.00 H new ATOM 0 HA ALA A 39 0.472 16.058 -7.638 1.00 0.00 H new ATOM 0 HB1 ALA A 39 0.598 16.367 -5.187 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -1.027 16.728 -5.815 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -0.718 15.188 -4.978 1.00 0.00 H new ATOM 535 N GLY A 40 2.383 14.696 -6.524 1.00 0.00 N ATOM 536 CA GLY A 40 3.488 13.779 -6.313 1.00 0.00 C ATOM 537 C GLY A 40 3.451 12.598 -7.263 1.00 0.00 C ATOM 538 O GLY A 40 2.968 12.715 -8.390 1.00 0.00 O ATOM 0 H GLY A 40 2.630 15.684 -6.472 1.00 0.00 H new ATOM 0 HA2 GLY A 40 4.429 14.314 -6.440 1.00 0.00 H new ATOM 0 HA3 GLY A 40 3.464 13.416 -5.286 1.00 0.00 H new ATOM 542 N ILE A 41 3.962 11.459 -6.810 1.00 0.00 N ATOM 543 CA ILE A 41 3.986 10.253 -7.628 1.00 0.00 C ATOM 544 C ILE A 41 2.575 9.733 -7.881 1.00 0.00 C ATOM 545 O ILE A 41 2.332 9.012 -8.849 1.00 0.00 O ATOM 546 CB ILE A 41 4.821 9.140 -6.967 1.00 0.00 C ATOM 547 CG1 ILE A 41 4.919 7.927 -7.894 1.00 0.00 C ATOM 548 CG2 ILE A 41 4.211 8.744 -5.630 1.00 0.00 C ATOM 549 CD1 ILE A 41 6.151 7.083 -7.657 1.00 0.00 C ATOM 0 H ILE A 41 4.365 11.346 -5.880 1.00 0.00 H new ATOM 0 HA ILE A 41 4.446 10.525 -8.578 1.00 0.00 H new ATOM 0 HB ILE A 41 5.827 9.519 -6.788 1.00 0.00 H new ATOM 0 HG12 ILE A 41 4.033 7.307 -7.762 1.00 0.00 H new ATOM 0 HG13 ILE A 41 4.917 8.270 -8.929 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.812 7.957 -5.175 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.188 9.611 -4.969 1.00 0.00 H new ATOM 0 HG23 ILE A 41 3.195 8.381 -5.787 1.00 0.00 H new ATOM 0 HD11 ILE A 41 6.154 6.241 -8.349 1.00 0.00 H new ATOM 0 HD12 ILE A 41 7.043 7.688 -7.818 1.00 0.00 H new ATOM 0 HD13 ILE A 41 6.145 6.710 -6.633 1.00 0.00 H new ATOM 561 N ALA A 42 1.647 10.104 -7.005 1.00 0.00 N ATOM 562 CA ALA A 42 0.259 9.678 -7.135 1.00 0.00 C ATOM 563 C ALA A 42 -0.242 9.870 -8.562 1.00 0.00 C ATOM 564 O ALA A 42 -1.118 9.140 -9.026 1.00 0.00 O ATOM 565 CB ALA A 42 -0.621 10.442 -6.157 1.00 0.00 C ATOM 0 H ALA A 42 1.831 10.699 -6.197 1.00 0.00 H new ATOM 0 HA ALA A 42 0.207 8.615 -6.899 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -1.655 10.114 -6.265 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -0.284 10.251 -5.138 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -0.556 11.510 -6.366 1.00 0.00 H new ATOM 571 N VAL A 43 0.318 10.857 -9.253 1.00 0.00 N ATOM 572 CA VAL A 43 -0.072 11.145 -10.628 1.00 0.00 C ATOM 573 C VAL A 43 0.424 10.061 -11.579 1.00 0.00 C ATOM 574 O VAL A 43 -0.350 9.498 -12.354 1.00 0.00 O ATOM 575 CB VAL A 43 0.472 12.509 -11.093 1.00 0.00 C ATOM 576 CG1 VAL A 43 0.007 12.816 -12.508 1.00 0.00 C ATOM 577 CG2 VAL A 43 0.045 13.608 -10.132 1.00 0.00 C ATOM 0 H VAL A 43 1.044 11.471 -8.883 1.00 0.00 H new ATOM 0 HA VAL A 43 -1.161 11.171 -10.648 1.00 0.00 H new ATOM 0 HB VAL A 43 1.561 12.464 -11.097 1.00 0.00 H new ATOM 0 HG11 VAL A 43 0.401 13.783 -12.819 1.00 0.00 H new ATOM 0 HG12 VAL A 43 0.368 12.042 -13.186 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -1.082 12.843 -12.535 1.00 0.00 H new ATOM 0 HG21 VAL A 43 0.438 14.565 -10.476 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -1.043 13.655 -10.094 1.00 0.00 H new ATOM 0 HG23 VAL A 43 0.434 13.392 -9.137 1.00 0.00 H new ATOM 587 N LEU A 44 1.719 9.773 -11.513 1.00 0.00 N ATOM 588 CA LEU A 44 2.320 8.755 -12.368 1.00 0.00 C ATOM 589 C LEU A 44 1.416 7.531 -12.476 1.00 0.00 C ATOM 590 O LEU A 44 1.164 7.028 -13.571 1.00 0.00 O ATOM 591 CB LEU A 44 3.689 8.345 -11.821 1.00 0.00 C ATOM 592 CG LEU A 44 4.871 9.215 -12.250 1.00 0.00 C ATOM 593 CD1 LEU A 44 6.162 8.706 -11.626 1.00 0.00 C ATOM 594 CD2 LEU A 44 4.986 9.247 -13.767 1.00 0.00 C ATOM 0 H LEU A 44 2.373 10.229 -10.877 1.00 0.00 H new ATOM 0 HA LEU A 44 2.445 9.180 -13.364 1.00 0.00 H new ATOM 0 HB2 LEU A 44 3.638 8.347 -10.732 1.00 0.00 H new ATOM 0 HB3 LEU A 44 3.888 7.319 -12.129 1.00 0.00 H new ATOM 0 HG LEU A 44 4.697 10.232 -11.897 1.00 0.00 H new ATOM 0 HD11 LEU A 44 6.993 9.337 -11.942 1.00 0.00 H new ATOM 0 HD12 LEU A 44 6.077 8.735 -10.540 1.00 0.00 H new ATOM 0 HD13 LEU A 44 6.342 7.681 -11.948 1.00 0.00 H new ATOM 0 HD21 LEU A 44 5.832 9.871 -14.055 1.00 0.00 H new ATOM 0 HD22 LEU A 44 5.137 8.235 -14.142 1.00 0.00 H new ATOM 0 HD23 LEU A 44 4.071 9.659 -14.193 1.00 0.00 H new ATOM 606 N PHE A 45 0.929 7.059 -11.334 1.00 0.00 N ATOM 607 CA PHE A 45 0.051 5.895 -11.300 1.00 0.00 C ATOM 608 C PHE A 45 -1.227 6.155 -12.091 1.00 0.00 C ATOM 609 O PHE A 45 -1.766 5.255 -12.736 1.00 0.00 O ATOM 610 CB PHE A 45 -0.295 5.532 -9.854 1.00 0.00 C ATOM 611 CG PHE A 45 0.762 4.711 -9.172 1.00 0.00 C ATOM 612 CD1 PHE A 45 1.911 5.309 -8.678 1.00 0.00 C ATOM 613 CD2 PHE A 45 0.608 3.342 -9.025 1.00 0.00 C ATOM 614 CE1 PHE A 45 2.885 4.555 -8.051 1.00 0.00 C ATOM 615 CE2 PHE A 45 1.579 2.584 -8.399 1.00 0.00 C ATOM 616 CZ PHE A 45 2.719 3.191 -7.910 1.00 0.00 C ATOM 0 H PHE A 45 1.127 7.464 -10.419 1.00 0.00 H new ATOM 0 HA PHE A 45 0.579 5.060 -11.760 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.454 6.449 -9.286 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.236 4.981 -9.841 1.00 0.00 H new ATOM 0 HD1 PHE A 45 2.046 6.375 -8.784 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -0.282 2.861 -9.404 1.00 0.00 H new ATOM 0 HE1 PHE A 45 3.776 5.032 -7.671 1.00 0.00 H new ATOM 0 HE2 PHE A 45 1.446 1.517 -8.292 1.00 0.00 H new ATOM 0 HZ PHE A 45 3.479 2.601 -7.419 1.00 0.00 H new ATOM 626 N LYS A 46 -1.708 7.392 -12.036 1.00 0.00 N ATOM 627 CA LYS A 46 -2.923 7.773 -12.747 1.00 0.00 C ATOM 628 C LYS A 46 -2.673 7.849 -14.250 1.00 0.00 C ATOM 629 O LYS A 46 -3.602 7.742 -15.050 1.00 0.00 O ATOM 630 CB LYS A 46 -3.436 9.121 -12.236 1.00 0.00 C ATOM 631 CG LYS A 46 -4.158 9.938 -13.293 1.00 0.00 C ATOM 632 CD LYS A 46 -3.179 10.668 -14.198 1.00 0.00 C ATOM 633 CE LYS A 46 -3.757 11.984 -14.697 1.00 0.00 C ATOM 634 NZ LYS A 46 -3.237 12.343 -16.045 1.00 0.00 N ATOM 0 H LYS A 46 -1.275 8.148 -11.506 1.00 0.00 H new ATOM 0 HA LYS A 46 -3.678 7.009 -12.560 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -4.111 8.949 -11.398 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -2.595 9.699 -11.854 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -4.790 9.282 -13.892 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -4.816 10.660 -12.810 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -2.253 10.858 -13.656 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -2.926 10.035 -15.048 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -4.844 11.912 -14.735 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -3.514 12.778 -13.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -2.454 13.020 -15.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -2.895 11.486 -16.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -3.998 12.774 -16.607 1.00 0.00 H new ATOM 648 N LYS A 47 -1.412 8.033 -14.626 1.00 0.00 N ATOM 649 CA LYS A 47 -1.038 8.120 -16.033 1.00 0.00 C ATOM 650 C LYS A 47 -0.816 6.731 -16.624 1.00 0.00 C ATOM 651 O LYS A 47 -1.310 6.420 -17.708 1.00 0.00 O ATOM 652 CB LYS A 47 0.228 8.963 -16.194 1.00 0.00 C ATOM 653 CG LYS A 47 0.037 10.424 -15.825 1.00 0.00 C ATOM 654 CD LYS A 47 1.367 11.112 -15.564 1.00 0.00 C ATOM 655 CE LYS A 47 1.279 12.609 -15.818 1.00 0.00 C ATOM 656 NZ LYS A 47 0.003 13.184 -15.311 1.00 0.00 N ATOM 0 H LYS A 47 -0.631 8.125 -13.976 1.00 0.00 H new ATOM 0 HA LYS A 47 -1.856 8.598 -16.572 1.00 0.00 H new ATOM 0 HB2 LYS A 47 1.017 8.540 -15.573 1.00 0.00 H new ATOM 0 HB3 LYS A 47 0.568 8.899 -17.228 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -0.488 10.938 -16.630 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -0.592 10.497 -14.938 1.00 0.00 H new ATOM 0 HD2 LYS A 47 1.674 10.934 -14.533 1.00 0.00 H new ATOM 0 HD3 LYS A 47 2.135 10.678 -16.205 1.00 0.00 H new ATOM 0 HE2 LYS A 47 2.119 13.109 -15.336 1.00 0.00 H new ATOM 0 HE3 LYS A 47 1.364 12.801 -16.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -0.590 13.476 -16.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -0.502 12.468 -14.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 0.208 14.011 -14.714 1.00 0.00 H new ATOM 670 N LYS A 48 -0.070 5.900 -15.905 1.00 0.00 N ATOM 671 CA LYS A 48 0.217 4.543 -16.356 1.00 0.00 C ATOM 672 C LYS A 48 -0.956 3.613 -16.062 1.00 0.00 C ATOM 673 O LYS A 48 -1.460 2.932 -16.955 1.00 0.00 O ATOM 674 CB LYS A 48 1.483 4.015 -15.678 1.00 0.00 C ATOM 675 CG LYS A 48 2.762 4.377 -16.412 1.00 0.00 C ATOM 676 CD LYS A 48 3.295 5.729 -15.968 1.00 0.00 C ATOM 677 CE LYS A 48 4.767 5.890 -16.318 1.00 0.00 C ATOM 678 NZ LYS A 48 4.980 5.987 -17.789 1.00 0.00 N ATOM 0 H LYS A 48 0.347 6.142 -15.006 1.00 0.00 H new ATOM 0 HA LYS A 48 0.375 4.571 -17.434 1.00 0.00 H new ATOM 0 HB2 LYS A 48 1.533 4.409 -14.663 1.00 0.00 H new ATOM 0 HB3 LYS A 48 1.416 2.930 -15.596 1.00 0.00 H new ATOM 0 HG2 LYS A 48 3.516 3.610 -16.232 1.00 0.00 H new ATOM 0 HG3 LYS A 48 2.575 4.393 -17.486 1.00 0.00 H new ATOM 0 HD2 LYS A 48 2.718 6.523 -16.443 1.00 0.00 H new ATOM 0 HD3 LYS A 48 3.162 5.838 -14.892 1.00 0.00 H new ATOM 0 HE2 LYS A 48 5.160 6.785 -15.834 1.00 0.00 H new ATOM 0 HE3 LYS A 48 5.329 5.043 -15.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 5.995 6.096 -17.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 4.629 5.123 -18.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 4.465 6.810 -18.161 1.00 0.00 H new ATOM 692 N PHE A 49 -1.387 3.591 -14.805 1.00 0.00 N ATOM 693 CA PHE A 49 -2.501 2.745 -14.394 1.00 0.00 C ATOM 694 C PHE A 49 -3.706 3.590 -13.989 1.00 0.00 C ATOM 695 O PHE A 49 -4.228 3.457 -12.883 1.00 0.00 O ATOM 696 CB PHE A 49 -2.083 1.844 -13.230 1.00 0.00 C ATOM 697 CG PHE A 49 -0.649 1.403 -13.300 1.00 0.00 C ATOM 698 CD1 PHE A 49 -0.270 0.360 -14.129 1.00 0.00 C ATOM 699 CD2 PHE A 49 0.321 2.032 -12.535 1.00 0.00 C ATOM 700 CE1 PHE A 49 1.049 -0.048 -14.196 1.00 0.00 C ATOM 701 CE2 PHE A 49 1.641 1.629 -12.597 1.00 0.00 C ATOM 702 CZ PHE A 49 2.006 0.587 -13.428 1.00 0.00 C ATOM 0 H PHE A 49 -0.982 4.149 -14.054 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.784 2.123 -15.243 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -2.246 2.376 -12.292 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -2.725 0.964 -13.213 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -1.014 -0.141 -14.730 1.00 0.00 H new ATOM 0 HD2 PHE A 49 0.042 2.846 -11.883 1.00 0.00 H new ATOM 0 HE1 PHE A 49 1.331 -0.862 -14.848 1.00 0.00 H new ATOM 0 HE2 PHE A 49 2.387 2.128 -11.996 1.00 0.00 H new ATOM 0 HZ PHE A 49 3.037 0.270 -13.477 1.00 0.00 H new ATOM 712 N GLY A 50 -4.141 4.462 -14.894 1.00 0.00 N ATOM 713 CA GLY A 50 -5.279 5.317 -14.614 1.00 0.00 C ATOM 714 C GLY A 50 -6.450 4.551 -14.030 1.00 0.00 C ATOM 715 O GLY A 50 -6.715 4.627 -12.831 1.00 0.00 O ATOM 0 H GLY A 50 -3.725 4.591 -15.816 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -4.978 6.101 -13.919 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -5.594 5.810 -15.534 1.00 0.00 H new ATOM 719 N GLY A 51 -7.154 3.810 -14.881 1.00 0.00 N ATOM 720 CA GLY A 51 -8.296 3.039 -14.425 1.00 0.00 C ATOM 721 C GLY A 51 -9.078 3.750 -13.338 1.00 0.00 C ATOM 722 O GLY A 51 -9.620 3.112 -12.436 1.00 0.00 O ATOM 0 H GLY A 51 -6.954 3.730 -15.878 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -8.955 2.837 -15.270 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -7.953 2.075 -14.050 1.00 0.00 H new ATOM 726 N VAL A 52 -9.136 5.075 -13.423 1.00 0.00 N ATOM 727 CA VAL A 52 -9.857 5.873 -12.439 1.00 0.00 C ATOM 728 C VAL A 52 -11.315 5.437 -12.339 1.00 0.00 C ATOM 729 O VAL A 52 -11.931 5.538 -11.279 1.00 0.00 O ATOM 730 CB VAL A 52 -9.804 7.373 -12.785 1.00 0.00 C ATOM 731 CG1 VAL A 52 -8.407 7.926 -12.549 1.00 0.00 C ATOM 732 CG2 VAL A 52 -10.242 7.604 -14.223 1.00 0.00 C ATOM 0 H VAL A 52 -8.692 5.618 -14.163 1.00 0.00 H new ATOM 0 HA VAL A 52 -9.366 5.711 -11.479 1.00 0.00 H new ATOM 0 HB VAL A 52 -10.495 7.904 -12.130 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -8.389 8.987 -12.799 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -8.136 7.795 -11.501 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -7.694 7.393 -13.178 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -10.198 8.669 -14.450 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -9.579 7.062 -14.897 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -11.263 7.247 -14.354 1.00 0.00 H new ATOM 742 N GLN A 53 -11.859 4.952 -13.451 1.00 0.00 N ATOM 743 CA GLN A 53 -13.245 4.500 -13.488 1.00 0.00 C ATOM 744 C GLN A 53 -13.349 3.029 -13.101 1.00 0.00 C ATOM 745 O GLN A 53 -14.382 2.579 -12.607 1.00 0.00 O ATOM 746 CB GLN A 53 -13.836 4.717 -14.882 1.00 0.00 C ATOM 747 CG GLN A 53 -15.293 4.296 -14.997 1.00 0.00 C ATOM 748 CD GLN A 53 -16.252 5.399 -14.596 1.00 0.00 C ATOM 749 OE1 GLN A 53 -16.399 6.397 -15.302 1.00 0.00 O ATOM 750 NE2 GLN A 53 -16.912 5.225 -13.456 1.00 0.00 N ATOM 0 H GLN A 53 -11.362 4.862 -14.337 1.00 0.00 H new ATOM 0 HA GLN A 53 -13.812 5.087 -12.765 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -13.749 5.771 -15.144 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -13.246 4.158 -15.609 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -15.500 3.995 -16.024 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -15.466 3.423 -14.368 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -16.760 4.382 -12.902 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -17.571 5.934 -13.135 1.00 0.00 H new ATOM 759 N GLU A 54 -12.271 2.284 -13.330 1.00 0.00 N ATOM 760 CA GLU A 54 -12.243 0.863 -13.007 1.00 0.00 C ATOM 761 C GLU A 54 -12.129 0.650 -11.500 1.00 0.00 C ATOM 762 O GLU A 54 -12.614 -0.347 -10.964 1.00 0.00 O ATOM 763 CB GLU A 54 -11.075 0.178 -13.720 1.00 0.00 C ATOM 764 CG GLU A 54 -11.369 -0.175 -15.168 1.00 0.00 C ATOM 765 CD GLU A 54 -10.108 -0.405 -15.979 1.00 0.00 C ATOM 766 OE1 GLU A 54 -9.197 0.446 -15.916 1.00 0.00 O ATOM 767 OE2 GLU A 54 -10.034 -1.438 -16.678 1.00 0.00 O ATOM 0 H GLU A 54 -11.407 2.641 -13.738 1.00 0.00 H new ATOM 0 HA GLU A 54 -13.178 0.420 -13.350 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -10.204 0.832 -13.684 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -10.813 -0.731 -13.179 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -11.987 -1.072 -15.201 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -11.948 0.628 -15.624 1.00 0.00 H new ATOM 774 N LEU A 55 -11.484 1.593 -10.823 1.00 0.00 N ATOM 775 CA LEU A 55 -11.304 1.510 -9.377 1.00 0.00 C ATOM 776 C LEU A 55 -12.550 1.999 -8.645 1.00 0.00 C ATOM 777 O LEU A 55 -12.953 1.425 -7.633 1.00 0.00 O ATOM 778 CB LEU A 55 -10.089 2.334 -8.946 1.00 0.00 C ATOM 779 CG LEU A 55 -8.754 1.942 -9.580 1.00 0.00 C ATOM 780 CD1 LEU A 55 -7.731 3.052 -9.399 1.00 0.00 C ATOM 781 CD2 LEU A 55 -8.241 0.640 -8.981 1.00 0.00 C ATOM 0 H LEU A 55 -11.077 2.424 -11.251 1.00 0.00 H new ATOM 0 HA LEU A 55 -11.137 0.465 -9.115 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -10.285 3.381 -9.177 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -9.990 2.260 -7.863 1.00 0.00 H new ATOM 0 HG LEU A 55 -8.912 1.791 -10.648 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.787 2.755 -9.856 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -8.094 3.963 -9.875 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.577 3.235 -8.336 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.290 0.376 -9.444 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -8.100 0.764 -7.907 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -8.965 -0.154 -9.162 1.00 0.00 H new ATOM 793 N LEU A 56 -13.156 3.061 -9.164 1.00 0.00 N ATOM 794 CA LEU A 56 -14.358 3.627 -8.561 1.00 0.00 C ATOM 795 C LEU A 56 -15.498 2.614 -8.566 1.00 0.00 C ATOM 796 O LEU A 56 -16.306 2.569 -7.640 1.00 0.00 O ATOM 797 CB LEU A 56 -14.781 4.892 -9.310 1.00 0.00 C ATOM 798 CG LEU A 56 -13.819 6.078 -9.221 1.00 0.00 C ATOM 799 CD1 LEU A 56 -14.027 7.022 -10.394 1.00 0.00 C ATOM 800 CD2 LEU A 56 -14.001 6.814 -7.902 1.00 0.00 C ATOM 0 H LEU A 56 -12.835 3.548 -10.001 1.00 0.00 H new ATOM 0 HA LEU A 56 -14.130 3.884 -7.527 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.918 4.639 -10.361 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -15.752 5.208 -8.929 1.00 0.00 H new ATOM 0 HG LEU A 56 -12.798 5.698 -9.264 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -13.334 7.860 -10.314 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -13.845 6.489 -11.327 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -15.051 7.396 -10.383 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -13.309 7.655 -7.856 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -15.024 7.182 -7.829 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -13.801 6.133 -7.075 1.00 0.00 H new ATOM 812 N ASN A 57 -15.555 1.801 -9.616 1.00 0.00 N ATOM 813 CA ASN A 57 -16.596 0.786 -9.742 1.00 0.00 C ATOM 814 C ASN A 57 -16.671 -0.074 -8.484 1.00 0.00 C ATOM 815 O ASN A 57 -17.752 -0.489 -8.068 1.00 0.00 O ATOM 816 CB ASN A 57 -16.332 -0.097 -10.962 1.00 0.00 C ATOM 817 CG ASN A 57 -16.838 0.528 -12.248 1.00 0.00 C ATOM 818 OD1 ASN A 57 -15.970 0.603 -13.251 1.00 0.00 O flip ATOM 819 ND2 ASN A 57 -17.995 0.937 -12.339 1.00 0.00 N flip ATOM 0 H ASN A 57 -14.893 1.825 -10.392 1.00 0.00 H new ATOM 0 HA ASN A 57 -17.551 1.295 -9.871 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -15.261 -0.283 -11.048 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -16.813 -1.065 -10.818 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -18.628 0.859 -11.543 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -18.321 1.354 -13.211 1.00 0.00 H new ATOM 826 N GLN A 58 -15.515 -0.337 -7.884 1.00 0.00 N ATOM 827 CA GLN A 58 -15.450 -1.148 -6.674 1.00 0.00 C ATOM 828 C GLN A 58 -16.138 -0.445 -5.509 1.00 0.00 C ATOM 829 O GLN A 58 -16.610 -1.090 -4.574 1.00 0.00 O ATOM 830 CB GLN A 58 -13.994 -1.450 -6.314 1.00 0.00 C ATOM 831 CG GLN A 58 -13.266 -2.274 -7.364 1.00 0.00 C ATOM 832 CD GLN A 58 -11.825 -2.558 -6.987 1.00 0.00 C ATOM 833 OE1 GLN A 58 -11.546 -3.094 -5.914 1.00 0.00 O ATOM 834 NE2 GLN A 58 -10.900 -2.199 -7.870 1.00 0.00 N ATOM 0 H GLN A 58 -14.611 -0.001 -8.216 1.00 0.00 H new ATOM 0 HA GLN A 58 -15.971 -2.085 -6.868 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -13.462 -0.510 -6.169 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -13.966 -1.982 -5.363 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -13.792 -3.217 -7.509 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -13.291 -1.745 -8.317 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -11.176 -1.757 -8.747 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -9.913 -2.365 -7.671 1.00 0.00 H new ATOM 843 N GLN A 59 -16.191 0.882 -5.573 1.00 0.00 N ATOM 844 CA GLN A 59 -16.821 1.673 -4.523 1.00 0.00 C ATOM 845 C GLN A 59 -16.235 1.329 -3.157 1.00 0.00 C ATOM 846 O GLN A 59 -16.967 1.040 -2.211 1.00 0.00 O ATOM 847 CB GLN A 59 -18.333 1.438 -4.516 1.00 0.00 C ATOM 848 CG GLN A 59 -19.048 2.047 -5.711 1.00 0.00 C ATOM 849 CD GLN A 59 -20.487 2.413 -5.406 1.00 0.00 C ATOM 850 OE1 GLN A 59 -21.312 1.546 -5.116 1.00 0.00 O ATOM 851 NE2 GLN A 59 -20.797 3.702 -5.468 1.00 0.00 N ATOM 0 H GLN A 59 -15.805 1.431 -6.341 1.00 0.00 H new ATOM 0 HA GLN A 59 -16.625 2.725 -4.728 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -18.526 0.365 -4.496 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -18.753 1.855 -3.601 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -18.511 2.939 -6.035 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -19.025 1.342 -6.542 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -20.082 4.387 -5.712 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -21.750 4.007 -5.271 1.00 0.00 H new ATOM 860 N LYS A 60 -14.910 1.363 -3.062 1.00 0.00 N ATOM 861 CA LYS A 60 -14.224 1.056 -1.812 1.00 0.00 C ATOM 862 C LYS A 60 -14.594 2.063 -0.728 1.00 0.00 C ATOM 863 O LYS A 60 -15.441 2.932 -0.935 1.00 0.00 O ATOM 864 CB LYS A 60 -12.709 1.054 -2.026 1.00 0.00 C ATOM 865 CG LYS A 60 -12.204 -0.157 -2.791 1.00 0.00 C ATOM 866 CD LYS A 60 -12.292 -1.422 -1.955 1.00 0.00 C ATOM 867 CE LYS A 60 -12.512 -2.651 -2.823 1.00 0.00 C ATOM 868 NZ LYS A 60 -12.186 -3.909 -2.097 1.00 0.00 N ATOM 0 H LYS A 60 -14.289 1.600 -3.836 1.00 0.00 H new ATOM 0 HA LYS A 60 -14.540 0.065 -1.486 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -12.426 1.958 -2.565 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -12.213 1.093 -1.056 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -12.788 -0.281 -3.703 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -11.170 0.008 -3.094 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -11.375 -1.542 -1.378 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -13.109 -1.330 -1.239 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -13.550 -2.681 -3.153 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -11.895 -2.578 -3.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -12.581 -4.720 -2.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -11.153 -4.012 -2.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -12.596 -3.875 -1.142 1.00 0.00 H new ATOM 882 N LYS A 61 -13.953 1.941 0.429 1.00 0.00 N ATOM 883 CA LYS A 61 -14.211 2.842 1.547 1.00 0.00 C ATOM 884 C LYS A 61 -12.971 2.994 2.421 1.00 0.00 C ATOM 885 O LYS A 61 -11.935 2.384 2.157 1.00 0.00 O ATOM 886 CB LYS A 61 -15.380 2.322 2.387 1.00 0.00 C ATOM 887 CG LYS A 61 -15.097 0.993 3.066 1.00 0.00 C ATOM 888 CD LYS A 61 -15.063 -0.149 2.064 1.00 0.00 C ATOM 889 CE LYS A 61 -15.251 -1.495 2.747 1.00 0.00 C ATOM 890 NZ LYS A 61 -16.678 -1.746 3.093 1.00 0.00 N ATOM 0 H LYS A 61 -13.250 1.226 0.618 1.00 0.00 H new ATOM 0 HA LYS A 61 -14.469 3.820 1.141 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -15.628 3.063 3.147 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -16.256 2.215 1.748 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -14.143 1.047 3.590 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -15.862 0.797 3.817 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -15.846 -0.005 1.320 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -14.112 -0.139 1.532 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -14.891 -2.288 2.092 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -14.646 -1.530 3.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -16.781 -2.712 3.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -16.985 -1.064 3.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -17.266 -1.637 2.242 1.00 0.00 H new ATOM 904 N SER A 62 -13.084 3.811 3.463 1.00 0.00 N ATOM 905 CA SER A 62 -11.970 4.046 4.375 1.00 0.00 C ATOM 906 C SER A 62 -11.615 2.772 5.138 1.00 0.00 C ATOM 907 O SER A 62 -12.391 2.294 5.964 1.00 0.00 O ATOM 908 CB SER A 62 -12.317 5.164 5.360 1.00 0.00 C ATOM 909 OG SER A 62 -12.598 6.374 4.679 1.00 0.00 O ATOM 0 H SER A 62 -13.935 4.321 3.697 1.00 0.00 H new ATOM 0 HA SER A 62 -11.105 4.348 3.784 1.00 0.00 H new ATOM 0 HB2 SER A 62 -13.180 4.871 5.958 1.00 0.00 H new ATOM 0 HB3 SER A 62 -11.487 5.316 6.050 1.00 0.00 H new ATOM 0 HG SER A 62 -12.504 7.127 5.299 1.00 0.00 H new ATOM 915 N GLY A 63 -10.436 2.228 4.852 1.00 0.00 N ATOM 916 CA GLY A 63 -9.998 1.016 5.519 1.00 0.00 C ATOM 917 C GLY A 63 -9.939 -0.173 4.579 1.00 0.00 C ATOM 918 O GLY A 63 -9.304 -1.181 4.885 1.00 0.00 O ATOM 0 H GLY A 63 -9.777 2.605 4.171 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -9.012 1.180 5.955 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -10.677 0.792 6.342 1.00 0.00 H new ATOM 922 N GLU A 64 -10.603 -0.054 3.434 1.00 0.00 N ATOM 923 CA GLU A 64 -10.624 -1.129 2.449 1.00 0.00 C ATOM 924 C GLU A 64 -9.637 -0.851 1.319 1.00 0.00 C ATOM 925 O GLU A 64 -9.265 0.297 1.073 1.00 0.00 O ATOM 926 CB GLU A 64 -12.034 -1.301 1.880 1.00 0.00 C ATOM 927 CG GLU A 64 -12.275 -2.665 1.254 1.00 0.00 C ATOM 928 CD GLU A 64 -12.448 -3.759 2.289 1.00 0.00 C ATOM 929 OE1 GLU A 64 -12.106 -3.523 3.466 1.00 0.00 O ATOM 930 OE2 GLU A 64 -12.926 -4.853 1.921 1.00 0.00 O ATOM 0 H GLU A 64 -11.133 0.775 3.166 1.00 0.00 H new ATOM 0 HA GLU A 64 -10.327 -2.051 2.948 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -12.760 -1.143 2.677 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -12.211 -0.530 1.130 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -13.165 -2.620 0.626 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -11.437 -2.915 0.603 1.00 0.00 H new ATOM 937 N VAL A 65 -9.217 -1.909 0.634 1.00 0.00 N ATOM 938 CA VAL A 65 -8.274 -1.780 -0.471 1.00 0.00 C ATOM 939 C VAL A 65 -8.895 -2.252 -1.781 1.00 0.00 C ATOM 940 O VAL A 65 -9.796 -3.091 -1.786 1.00 0.00 O ATOM 941 CB VAL A 65 -6.987 -2.584 -0.207 1.00 0.00 C ATOM 942 CG1 VAL A 65 -7.302 -4.065 -0.060 1.00 0.00 C ATOM 943 CG2 VAL A 65 -5.977 -2.353 -1.321 1.00 0.00 C ATOM 0 H VAL A 65 -9.515 -2.866 0.825 1.00 0.00 H new ATOM 0 HA VAL A 65 -8.023 -0.722 -0.551 1.00 0.00 H new ATOM 0 HB VAL A 65 -6.548 -2.237 0.728 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -6.380 -4.616 0.126 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -7.987 -4.210 0.776 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.765 -4.431 -0.976 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -5.074 -2.929 -1.118 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -6.405 -2.672 -2.272 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -5.728 -1.293 -1.372 1.00 0.00 H new ATOM 953 N ALA A 66 -8.407 -1.707 -2.890 1.00 0.00 N ATOM 954 CA ALA A 66 -8.911 -2.074 -4.208 1.00 0.00 C ATOM 955 C ALA A 66 -7.870 -2.861 -4.995 1.00 0.00 C ATOM 956 O ALA A 66 -6.674 -2.786 -4.711 1.00 0.00 O ATOM 957 CB ALA A 66 -9.329 -0.831 -4.978 1.00 0.00 C ATOM 0 H ALA A 66 -7.663 -1.009 -2.902 1.00 0.00 H new ATOM 0 HA ALA A 66 -9.783 -2.713 -4.071 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -9.703 -1.120 -5.960 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -10.114 -0.310 -4.430 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -8.470 -0.171 -5.097 1.00 0.00 H new ATOM 963 N VAL A 67 -8.331 -3.618 -5.986 1.00 0.00 N ATOM 964 CA VAL A 67 -7.438 -4.419 -6.815 1.00 0.00 C ATOM 965 C VAL A 67 -7.817 -4.317 -8.289 1.00 0.00 C ATOM 966 O VAL A 67 -8.991 -4.425 -8.648 1.00 0.00 O ATOM 967 CB VAL A 67 -7.458 -5.900 -6.393 1.00 0.00 C ATOM 968 CG1 VAL A 67 -6.733 -6.758 -7.419 1.00 0.00 C ATOM 969 CG2 VAL A 67 -6.841 -6.068 -5.013 1.00 0.00 C ATOM 0 H VAL A 67 -9.317 -3.693 -6.234 1.00 0.00 H new ATOM 0 HA VAL A 67 -6.433 -4.022 -6.673 1.00 0.00 H new ATOM 0 HB VAL A 67 -8.495 -6.233 -6.345 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -6.758 -7.801 -7.104 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -7.224 -6.660 -8.387 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -5.697 -6.428 -7.502 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -6.863 -7.120 -4.730 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -5.809 -5.719 -5.031 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -7.408 -5.485 -4.287 1.00 0.00 H new ATOM 979 N LEU A 68 -6.817 -4.109 -9.138 1.00 0.00 N ATOM 980 CA LEU A 68 -7.045 -3.993 -10.574 1.00 0.00 C ATOM 981 C LEU A 68 -6.018 -4.805 -11.356 1.00 0.00 C ATOM 982 O LEU A 68 -4.818 -4.537 -11.291 1.00 0.00 O ATOM 983 CB LEU A 68 -6.986 -2.526 -11.003 1.00 0.00 C ATOM 984 CG LEU A 68 -7.787 -2.159 -12.253 1.00 0.00 C ATOM 985 CD1 LEU A 68 -9.278 -2.303 -11.993 1.00 0.00 C ATOM 986 CD2 LEU A 68 -7.456 -0.743 -12.702 1.00 0.00 C ATOM 0 H LEU A 68 -5.841 -4.017 -8.857 1.00 0.00 H new ATOM 0 HA LEU A 68 -8.037 -4.389 -10.792 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -7.341 -1.912 -10.175 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -5.943 -2.260 -11.173 1.00 0.00 H new ATOM 0 HG LEU A 68 -7.511 -2.846 -13.053 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -9.832 -2.038 -12.894 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -9.502 -3.334 -11.720 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -9.571 -1.640 -11.179 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -8.035 -0.499 -13.593 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -7.703 -0.042 -11.905 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -6.392 -0.673 -12.930 1.00 0.00 H new ATOM 998 N LYS A 69 -6.496 -5.799 -12.097 1.00 0.00 N ATOM 999 CA LYS A 69 -5.621 -6.649 -12.895 1.00 0.00 C ATOM 1000 C LYS A 69 -5.346 -6.020 -14.258 1.00 0.00 C ATOM 1001 O LYS A 69 -6.140 -6.158 -15.187 1.00 0.00 O ATOM 1002 CB LYS A 69 -6.248 -8.033 -13.078 1.00 0.00 C ATOM 1003 CG LYS A 69 -5.529 -8.896 -14.101 1.00 0.00 C ATOM 1004 CD LYS A 69 -4.192 -9.390 -13.572 1.00 0.00 C ATOM 1005 CE LYS A 69 -3.778 -10.694 -14.236 1.00 0.00 C ATOM 1006 NZ LYS A 69 -4.011 -10.665 -15.707 1.00 0.00 N ATOM 0 H LYS A 69 -7.486 -6.036 -12.161 1.00 0.00 H new ATOM 0 HA LYS A 69 -4.675 -6.753 -12.364 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -6.253 -8.550 -12.118 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -7.288 -7.914 -13.382 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -6.155 -9.749 -14.364 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -5.371 -8.323 -15.015 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -3.428 -8.633 -13.747 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -4.257 -9.534 -12.494 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -2.723 -10.883 -14.039 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -4.337 -11.519 -13.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -3.494 -11.448 -16.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -5.028 -10.766 -15.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -3.673 -9.761 -16.094 1.00 0.00 H new ATOM 1020 N ARG A 70 -4.215 -5.330 -14.368 1.00 0.00 N ATOM 1021 CA ARG A 70 -3.835 -4.680 -15.617 1.00 0.00 C ATOM 1022 C ARG A 70 -2.572 -5.311 -16.196 1.00 0.00 C ATOM 1023 O ARG A 70 -2.623 -6.012 -17.206 1.00 0.00 O ATOM 1024 CB ARG A 70 -3.613 -3.184 -15.391 1.00 0.00 C ATOM 1025 CG ARG A 70 -4.004 -2.323 -16.582 1.00 0.00 C ATOM 1026 CD ARG A 70 -4.544 -0.973 -16.140 1.00 0.00 C ATOM 1027 NE ARG A 70 -4.303 0.067 -17.137 1.00 0.00 N ATOM 1028 CZ ARG A 70 -3.092 0.507 -17.461 1.00 0.00 C ATOM 1029 NH1 ARG A 70 -2.019 0.002 -16.869 1.00 0.00 N ATOM 1030 NH2 ARG A 70 -2.953 1.456 -18.378 1.00 0.00 N ATOM 0 H ARG A 70 -3.546 -5.207 -13.608 1.00 0.00 H new ATOM 0 HA ARG A 70 -4.648 -4.816 -16.330 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -4.188 -2.868 -14.520 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -2.562 -3.012 -15.159 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -3.137 -2.176 -17.226 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -4.758 -2.841 -17.175 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -5.615 -1.055 -15.953 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -4.077 -0.687 -15.198 1.00 0.00 H new ATOM 0 HE ARG A 70 -5.108 0.478 -17.610 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -2.122 -0.727 -16.163 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -1.091 0.342 -17.120 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -3.776 1.848 -18.835 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -2.023 1.793 -18.626 1.00 0.00 H new ATOM 1044 N ASP A 71 -1.440 -5.056 -15.549 1.00 0.00 N ATOM 1045 CA ASP A 71 -0.164 -5.599 -15.999 1.00 0.00 C ATOM 1046 C ASP A 71 0.106 -6.956 -15.357 1.00 0.00 C ATOM 1047 O ASP A 71 0.940 -7.075 -14.460 1.00 0.00 O ATOM 1048 CB ASP A 71 0.972 -4.629 -15.667 1.00 0.00 C ATOM 1049 CG ASP A 71 2.127 -4.735 -16.644 1.00 0.00 C ATOM 1050 OD1 ASP A 71 2.797 -5.789 -16.659 1.00 0.00 O ATOM 1051 OD2 ASP A 71 2.360 -3.765 -17.394 1.00 0.00 O ATOM 0 H ASP A 71 -1.380 -4.477 -14.711 1.00 0.00 H new ATOM 0 HA ASP A 71 -0.214 -5.732 -17.080 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.588 -3.609 -15.672 1.00 0.00 H new ATOM 0 HB3 ASP A 71 1.333 -4.829 -14.658 1.00 0.00 H new ATOM 1056 N GLY A 72 -0.606 -7.978 -15.822 1.00 0.00 N ATOM 1057 CA GLY A 72 -0.430 -9.313 -15.281 1.00 0.00 C ATOM 1058 C GLY A 72 -0.163 -9.303 -13.789 1.00 0.00 C ATOM 1059 O GLY A 72 0.509 -10.192 -13.267 1.00 0.00 O ATOM 0 H GLY A 72 -1.302 -7.905 -16.564 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -1.323 -9.904 -15.483 1.00 0.00 H new ATOM 0 HA3 GLY A 72 0.399 -9.803 -15.792 1.00 0.00 H new ATOM 1063 N ARG A 73 -0.690 -8.295 -13.102 1.00 0.00 N ATOM 1064 CA ARG A 73 -0.503 -8.172 -11.661 1.00 0.00 C ATOM 1065 C ARG A 73 -1.719 -7.523 -11.008 1.00 0.00 C ATOM 1066 O ARG A 73 -2.620 -7.039 -11.693 1.00 0.00 O ATOM 1067 CB ARG A 73 0.752 -7.350 -11.357 1.00 0.00 C ATOM 1068 CG ARG A 73 0.635 -5.889 -11.759 1.00 0.00 C ATOM 1069 CD ARG A 73 1.978 -5.181 -11.680 1.00 0.00 C ATOM 1070 NE ARG A 73 2.946 -5.735 -12.623 1.00 0.00 N ATOM 1071 CZ ARG A 73 4.121 -5.173 -12.884 1.00 0.00 C ATOM 1072 NH1 ARG A 73 4.472 -4.049 -12.277 1.00 0.00 N ATOM 1073 NH2 ARG A 73 4.948 -5.738 -13.755 1.00 0.00 N ATOM 0 H ARG A 73 -1.250 -7.552 -13.520 1.00 0.00 H new ATOM 0 HA ARG A 73 -0.383 -9.174 -11.249 1.00 0.00 H new ATOM 0 HB2 ARG A 73 0.965 -7.408 -10.290 1.00 0.00 H new ATOM 0 HB3 ARG A 73 1.601 -7.794 -11.876 1.00 0.00 H new ATOM 0 HG2 ARG A 73 0.245 -5.820 -12.775 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -0.081 -5.387 -11.108 1.00 0.00 H new ATOM 0 HD2 ARG A 73 1.840 -4.119 -11.884 1.00 0.00 H new ATOM 0 HD3 ARG A 73 2.372 -5.263 -10.667 1.00 0.00 H new ATOM 0 HE ARG A 73 2.707 -6.600 -13.107 1.00 0.00 H new ATOM 0 HH11 ARG A 73 3.839 -3.612 -11.607 1.00 0.00 H new ATOM 0 HH12 ARG A 73 5.375 -3.620 -12.480 1.00 0.00 H new ATOM 0 HH21 ARG A 73 4.681 -6.604 -14.224 1.00 0.00 H new ATOM 0 HH22 ARG A 73 5.850 -5.306 -13.955 1.00 0.00 H new ATOM 1087 N TYR A 74 -1.739 -7.518 -9.680 1.00 0.00 N ATOM 1088 CA TYR A 74 -2.846 -6.932 -8.934 1.00 0.00 C ATOM 1089 C TYR A 74 -2.386 -5.709 -8.147 1.00 0.00 C ATOM 1090 O TYR A 74 -1.737 -5.833 -7.108 1.00 0.00 O ATOM 1091 CB TYR A 74 -3.451 -7.966 -7.982 1.00 0.00 C ATOM 1092 CG TYR A 74 -3.707 -9.308 -8.630 1.00 0.00 C ATOM 1093 CD1 TYR A 74 -4.587 -9.429 -9.698 1.00 0.00 C ATOM 1094 CD2 TYR A 74 -3.070 -10.455 -8.172 1.00 0.00 C ATOM 1095 CE1 TYR A 74 -4.825 -10.654 -10.293 1.00 0.00 C ATOM 1096 CE2 TYR A 74 -3.301 -11.683 -8.762 1.00 0.00 C ATOM 1097 CZ TYR A 74 -4.179 -11.777 -9.821 1.00 0.00 C ATOM 1098 OH TYR A 74 -4.412 -12.999 -10.410 1.00 0.00 O ATOM 0 H TYR A 74 -1.001 -7.913 -9.098 1.00 0.00 H new ATOM 0 HA TYR A 74 -3.606 -6.617 -9.649 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -2.780 -8.103 -7.134 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -4.390 -7.578 -7.586 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -5.094 -8.551 -10.070 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -2.383 -10.386 -7.341 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -5.513 -10.731 -11.122 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -2.796 -12.565 -8.395 1.00 0.00 H new ATOM 0 HH TYR A 74 -3.878 -13.686 -9.960 1.00 0.00 H new ATOM 1108 N ILE A 75 -2.727 -4.527 -8.651 1.00 0.00 N ATOM 1109 CA ILE A 75 -2.351 -3.281 -7.996 1.00 0.00 C ATOM 1110 C ILE A 75 -3.287 -2.966 -6.834 1.00 0.00 C ATOM 1111 O ILE A 75 -4.509 -3.017 -6.976 1.00 0.00 O ATOM 1112 CB ILE A 75 -2.363 -2.099 -8.984 1.00 0.00 C ATOM 1113 CG1 ILE A 75 -1.579 -2.456 -10.248 1.00 0.00 C ATOM 1114 CG2 ILE A 75 -1.784 -0.855 -8.328 1.00 0.00 C ATOM 1115 CD1 ILE A 75 -1.574 -1.356 -11.287 1.00 0.00 C ATOM 0 H ILE A 75 -3.263 -4.407 -9.511 1.00 0.00 H new ATOM 0 HA ILE A 75 -1.338 -3.418 -7.617 1.00 0.00 H new ATOM 0 HB ILE A 75 -3.395 -1.890 -9.266 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -0.550 -2.690 -9.974 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -2.005 -3.358 -10.687 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -1.799 -0.028 -9.038 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -2.381 -0.593 -7.454 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -0.757 -1.050 -8.021 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.000 -1.679 -12.156 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -2.598 -1.137 -11.590 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -1.121 -0.459 -10.865 1.00 0.00 H new ATOM 1127 N TYR A 76 -2.706 -2.641 -5.684 1.00 0.00 N ATOM 1128 CA TYR A 76 -3.488 -2.318 -4.497 1.00 0.00 C ATOM 1129 C TYR A 76 -3.588 -0.808 -4.304 1.00 0.00 C ATOM 1130 O TYR A 76 -2.614 -0.080 -4.495 1.00 0.00 O ATOM 1131 CB TYR A 76 -2.861 -2.961 -3.258 1.00 0.00 C ATOM 1132 CG TYR A 76 -2.717 -4.462 -3.362 1.00 0.00 C ATOM 1133 CD1 TYR A 76 -3.817 -5.298 -3.208 1.00 0.00 C ATOM 1134 CD2 TYR A 76 -1.482 -5.046 -3.614 1.00 0.00 C ATOM 1135 CE1 TYR A 76 -3.690 -6.670 -3.301 1.00 0.00 C ATOM 1136 CE2 TYR A 76 -1.346 -6.417 -3.711 1.00 0.00 C ATOM 1137 CZ TYR A 76 -2.453 -7.225 -3.554 1.00 0.00 C ATOM 1138 OH TYR A 76 -2.321 -8.592 -3.648 1.00 0.00 O ATOM 0 H TYR A 76 -1.696 -2.594 -5.549 1.00 0.00 H new ATOM 0 HA TYR A 76 -4.493 -2.715 -4.636 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -1.878 -2.521 -3.089 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -3.471 -2.722 -2.387 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -4.788 -4.867 -3.012 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -0.613 -4.417 -3.736 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -4.555 -7.305 -3.176 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -0.378 -6.854 -3.909 1.00 0.00 H new ATOM 0 HH TYR A 76 -3.205 -8.999 -3.766 1.00 0.00 H new ATOM 1148 N TYR A 77 -4.774 -0.345 -3.924 1.00 0.00 N ATOM 1149 CA TYR A 77 -5.004 1.078 -3.707 1.00 0.00 C ATOM 1150 C TYR A 77 -5.555 1.334 -2.307 1.00 0.00 C ATOM 1151 O TYR A 77 -6.762 1.250 -2.077 1.00 0.00 O ATOM 1152 CB TYR A 77 -5.974 1.626 -4.756 1.00 0.00 C ATOM 1153 CG TYR A 77 -5.406 1.639 -6.157 1.00 0.00 C ATOM 1154 CD1 TYR A 77 -5.530 0.533 -6.989 1.00 0.00 C ATOM 1155 CD2 TYR A 77 -4.744 2.757 -6.649 1.00 0.00 C ATOM 1156 CE1 TYR A 77 -5.012 0.541 -8.270 1.00 0.00 C ATOM 1157 CE2 TYR A 77 -4.224 2.775 -7.928 1.00 0.00 C ATOM 1158 CZ TYR A 77 -4.360 1.664 -8.735 1.00 0.00 C ATOM 1159 OH TYR A 77 -3.842 1.676 -10.010 1.00 0.00 O ATOM 0 H TYR A 77 -5.590 -0.934 -3.760 1.00 0.00 H new ATOM 0 HA TYR A 77 -4.048 1.592 -3.802 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -6.883 1.025 -4.747 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -6.260 2.641 -4.479 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -6.040 -0.348 -6.628 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -4.634 3.628 -6.020 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -5.117 -0.327 -8.904 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -3.714 3.653 -8.295 1.00 0.00 H new ATOM 0 HH TYR A 77 -3.416 2.542 -10.182 1.00 0.00 H new ATOM 1169 N LEU A 78 -4.661 1.646 -1.376 1.00 0.00 N ATOM 1170 CA LEU A 78 -5.055 1.915 0.003 1.00 0.00 C ATOM 1171 C LEU A 78 -5.866 3.204 0.096 1.00 0.00 C ATOM 1172 O LEU A 78 -5.379 4.281 -0.249 1.00 0.00 O ATOM 1173 CB LEU A 78 -3.819 2.012 0.898 1.00 0.00 C ATOM 1174 CG LEU A 78 -2.798 0.882 0.756 1.00 0.00 C ATOM 1175 CD1 LEU A 78 -1.414 1.359 1.170 1.00 0.00 C ATOM 1176 CD2 LEU A 78 -3.218 -0.324 1.584 1.00 0.00 C ATOM 0 H LEU A 78 -3.659 1.719 -1.550 1.00 0.00 H new ATOM 0 HA LEU A 78 -5.679 1.089 0.344 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -3.317 2.957 0.689 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -4.149 2.049 1.936 1.00 0.00 H new ATOM 0 HG LEU A 78 -2.759 0.583 -0.291 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.700 0.542 1.063 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.111 2.191 0.535 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -1.438 1.686 2.210 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -2.480 -1.118 1.471 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -3.286 -0.039 2.634 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -4.189 -0.680 1.241 1.00 0.00 H new ATOM 1188 N ILE A 79 -7.103 3.086 0.566 1.00 0.00 N ATOM 1189 CA ILE A 79 -7.980 4.242 0.708 1.00 0.00 C ATOM 1190 C ILE A 79 -8.164 4.616 2.175 1.00 0.00 C ATOM 1191 O ILE A 79 -8.999 4.042 2.874 1.00 0.00 O ATOM 1192 CB ILE A 79 -9.361 3.982 0.079 1.00 0.00 C ATOM 1193 CG1 ILE A 79 -9.239 3.861 -1.441 1.00 0.00 C ATOM 1194 CG2 ILE A 79 -10.331 5.093 0.451 1.00 0.00 C ATOM 1195 CD1 ILE A 79 -10.399 3.133 -2.085 1.00 0.00 C ATOM 0 H ILE A 79 -7.521 2.202 0.855 1.00 0.00 H new ATOM 0 HA ILE A 79 -7.500 5.068 0.182 1.00 0.00 H new ATOM 0 HB ILE A 79 -9.750 3.042 0.470 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -9.163 4.859 -1.872 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -8.313 3.338 -1.683 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -11.303 4.894 -0.001 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -10.437 5.135 1.535 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -9.949 6.047 0.086 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -10.245 3.085 -3.163 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -10.463 2.122 -1.682 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -11.326 3.667 -1.874 1.00 0.00 H new ATOM 1207 N THR A 80 -7.378 5.585 2.636 1.00 0.00 N ATOM 1208 CA THR A 80 -7.455 6.037 4.019 1.00 0.00 C ATOM 1209 C THR A 80 -8.307 7.295 4.140 1.00 0.00 C ATOM 1210 O THR A 80 -9.040 7.470 5.114 1.00 0.00 O ATOM 1211 CB THR A 80 -6.054 6.322 4.595 1.00 0.00 C ATOM 1212 OG1 THR A 80 -5.413 7.353 3.837 1.00 0.00 O ATOM 1213 CG2 THR A 80 -5.197 5.065 4.579 1.00 0.00 C ATOM 0 H THR A 80 -6.681 6.071 2.071 1.00 0.00 H new ATOM 0 HA THR A 80 -7.918 5.232 4.590 1.00 0.00 H new ATOM 0 HB THR A 80 -6.170 6.651 5.628 1.00 0.00 H new ATOM 0 HG1 THR A 80 -4.524 7.529 4.211 1.00 0.00 H new ATOM 0 HG21 THR A 80 -4.213 5.290 4.990 1.00 0.00 H new ATOM 0 HG22 THR A 80 -5.674 4.292 5.182 1.00 0.00 H new ATOM 0 HG23 THR A 80 -5.090 4.711 3.554 1.00 0.00 H new ATOM 1221 N LYS A 81 -8.206 8.170 3.145 1.00 0.00 N ATOM 1222 CA LYS A 81 -8.969 9.413 3.138 1.00 0.00 C ATOM 1223 C LYS A 81 -10.108 9.347 2.125 1.00 0.00 C ATOM 1224 O LYS A 81 -10.104 8.506 1.225 1.00 0.00 O ATOM 1225 CB LYS A 81 -8.054 10.596 2.816 1.00 0.00 C ATOM 1226 CG LYS A 81 -7.517 10.581 1.395 1.00 0.00 C ATOM 1227 CD LYS A 81 -6.182 9.860 1.311 1.00 0.00 C ATOM 1228 CE LYS A 81 -5.018 10.825 1.477 1.00 0.00 C ATOM 1229 NZ LYS A 81 -4.949 11.380 2.857 1.00 0.00 N ATOM 0 H LYS A 81 -7.603 8.041 2.333 1.00 0.00 H new ATOM 0 HA LYS A 81 -9.397 9.553 4.131 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -8.603 11.524 2.978 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -7.215 10.596 3.512 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -8.237 10.093 0.738 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -7.402 11.604 1.038 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -6.133 9.092 2.083 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -6.101 9.352 0.350 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -4.085 10.311 1.245 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -5.119 11.642 0.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -3.992 11.747 3.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -5.640 12.151 2.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -5.167 10.630 3.544 1.00 0.00 H new ATOM 1243 N LYS A 82 -11.081 10.239 2.276 1.00 0.00 N ATOM 1244 CA LYS A 82 -12.225 10.284 1.373 1.00 0.00 C ATOM 1245 C LYS A 82 -12.099 11.448 0.394 1.00 0.00 C ATOM 1246 O LYS A 82 -12.596 11.381 -0.730 1.00 0.00 O ATOM 1247 CB LYS A 82 -13.525 10.412 2.170 1.00 0.00 C ATOM 1248 CG LYS A 82 -13.679 9.362 3.256 1.00 0.00 C ATOM 1249 CD LYS A 82 -14.871 9.655 4.151 1.00 0.00 C ATOM 1250 CE LYS A 82 -15.319 8.414 4.907 1.00 0.00 C ATOM 1251 NZ LYS A 82 -16.444 8.707 5.838 1.00 0.00 N ATOM 0 H LYS A 82 -11.100 10.941 3.016 1.00 0.00 H new ATOM 0 HA LYS A 82 -12.245 9.354 0.804 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -13.566 11.402 2.625 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -14.370 10.341 1.485 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -13.799 8.380 2.799 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -12.771 9.325 3.858 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -14.610 10.440 4.861 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -15.696 10.032 3.547 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -15.626 7.647 4.196 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -14.478 8.008 5.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -16.720 7.836 6.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -16.143 9.420 6.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -17.256 9.070 5.298 1.00 0.00 H new ATOM 1265 N ARG A 83 -11.431 12.511 0.829 1.00 0.00 N ATOM 1266 CA ARG A 83 -11.240 13.689 -0.010 1.00 0.00 C ATOM 1267 C ARG A 83 -10.324 14.700 0.674 1.00 0.00 C ATOM 1268 O ARG A 83 -10.280 14.783 1.900 1.00 0.00 O ATOM 1269 CB ARG A 83 -12.588 14.339 -0.327 1.00 0.00 C ATOM 1270 CG ARG A 83 -13.369 14.755 0.909 1.00 0.00 C ATOM 1271 CD ARG A 83 -14.443 15.777 0.570 1.00 0.00 C ATOM 1272 NE ARG A 83 -15.553 15.181 -0.169 1.00 0.00 N ATOM 1273 CZ ARG A 83 -16.365 15.874 -0.959 1.00 0.00 C ATOM 1274 NH1 ARG A 83 -16.193 17.180 -1.112 1.00 0.00 N ATOM 1275 NH2 ARG A 83 -17.353 15.260 -1.599 1.00 0.00 N ATOM 0 H ARG A 83 -11.013 12.581 1.757 1.00 0.00 H new ATOM 0 HA ARG A 83 -10.770 13.370 -0.940 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -12.421 15.216 -0.953 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -13.190 13.642 -0.909 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -13.830 13.877 1.362 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -12.686 15.174 1.648 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -14.819 16.226 1.489 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -14.004 16.581 -0.021 1.00 0.00 H new ATOM 0 HE ARG A 83 -15.713 14.178 -0.073 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -15.435 17.655 -0.622 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -16.819 17.709 -1.720 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -17.489 14.256 -1.484 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -17.976 15.793 -2.206 1.00 0.00 H new ATOM 1289 N ALA A 84 -9.593 15.465 -0.130 1.00 0.00 N ATOM 1290 CA ALA A 84 -8.679 16.472 0.396 1.00 0.00 C ATOM 1291 C ALA A 84 -9.220 17.085 1.683 1.00 0.00 C ATOM 1292 O ALA A 84 -8.516 17.161 2.690 1.00 0.00 O ATOM 1293 CB ALA A 84 -8.431 17.555 -0.643 1.00 0.00 C ATOM 0 H ALA A 84 -9.616 15.407 -1.148 1.00 0.00 H new ATOM 0 HA ALA A 84 -7.733 15.983 0.627 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -7.747 18.300 -0.236 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -7.993 17.109 -1.536 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -9.375 18.033 -0.903 1.00 0.00 H new ATOM 1299 N SER A 85 -10.475 17.522 1.643 1.00 0.00 N ATOM 1300 CA SER A 85 -11.109 18.133 2.806 1.00 0.00 C ATOM 1301 C SER A 85 -10.741 17.383 4.082 1.00 0.00 C ATOM 1302 O SER A 85 -10.359 17.989 5.084 1.00 0.00 O ATOM 1303 CB SER A 85 -12.629 18.153 2.632 1.00 0.00 C ATOM 1304 OG SER A 85 -13.260 18.772 3.740 1.00 0.00 O ATOM 0 H SER A 85 -11.073 17.464 0.818 1.00 0.00 H new ATOM 0 HA SER A 85 -10.747 19.157 2.891 1.00 0.00 H new ATOM 0 HB2 SER A 85 -12.887 18.687 1.717 1.00 0.00 H new ATOM 0 HB3 SER A 85 -12.999 17.134 2.521 1.00 0.00 H new ATOM 0 HG SER A 85 -14.231 18.774 3.605 1.00 0.00 H new ATOM 1310 N HIS A 86 -10.859 16.060 4.039 1.00 0.00 N ATOM 1311 CA HIS A 86 -10.538 15.226 5.191 1.00 0.00 C ATOM 1312 C HIS A 86 -9.066 14.827 5.181 1.00 0.00 C ATOM 1313 O HIS A 86 -8.434 14.772 4.125 1.00 0.00 O ATOM 1314 CB HIS A 86 -11.417 13.974 5.202 1.00 0.00 C ATOM 1315 CG HIS A 86 -12.805 14.213 4.691 1.00 0.00 C ATOM 1316 ND1 HIS A 86 -13.440 13.361 3.813 1.00 0.00 N ATOM 1317 CD2 HIS A 86 -13.681 15.214 4.942 1.00 0.00 C ATOM 1318 CE1 HIS A 86 -14.646 13.829 3.543 1.00 0.00 C ATOM 1319 NE2 HIS A 86 -14.817 14.952 4.216 1.00 0.00 N ATOM 0 H HIS A 86 -11.175 15.543 3.219 1.00 0.00 H new ATOM 0 HA HIS A 86 -10.733 15.806 6.093 1.00 0.00 H new ATOM 0 HB2 HIS A 86 -10.943 13.202 4.596 1.00 0.00 H new ATOM 0 HB3 HIS A 86 -11.475 13.589 6.220 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -13.517 16.061 5.592 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -15.369 13.371 2.884 1.00 0.00 H new ATOM 0 HE2 HIS A 86 -15.657 15.531 4.199 1.00 0.00 H new ATOM 1327 N LYS A 87 -8.524 14.550 6.362 1.00 0.00 N ATOM 1328 CA LYS A 87 -7.126 14.156 6.490 1.00 0.00 C ATOM 1329 C LYS A 87 -7.010 12.714 6.974 1.00 0.00 C ATOM 1330 O LYS A 87 -7.877 12.199 7.681 1.00 0.00 O ATOM 1331 CB LYS A 87 -6.398 15.091 7.458 1.00 0.00 C ATOM 1332 CG LYS A 87 -5.599 16.182 6.765 1.00 0.00 C ATOM 1333 CD LYS A 87 -6.418 16.874 5.689 1.00 0.00 C ATOM 1334 CE LYS A 87 -5.551 17.291 4.511 1.00 0.00 C ATOM 1335 NZ LYS A 87 -5.027 18.675 4.670 1.00 0.00 N ATOM 0 H LYS A 87 -9.032 14.591 7.245 1.00 0.00 H new ATOM 0 HA LYS A 87 -6.662 14.229 5.507 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -7.128 15.553 8.122 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -5.727 14.502 8.083 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -5.269 16.916 7.501 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -4.702 15.751 6.320 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -7.206 16.205 5.343 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -6.907 17.752 6.111 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -4.717 16.596 4.410 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -6.133 17.226 3.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -4.441 18.921 3.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -5.822 19.341 4.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -4.451 18.731 5.534 1.00 0.00 H new ATOM 1349 N PRO A 88 -5.912 12.047 6.589 1.00 0.00 N ATOM 1350 CA PRO A 88 -5.655 10.656 6.975 1.00 0.00 C ATOM 1351 C PRO A 88 -5.338 10.515 8.460 1.00 0.00 C ATOM 1352 O PRO A 88 -4.899 11.468 9.105 1.00 0.00 O ATOM 1353 CB PRO A 88 -4.438 10.272 6.129 1.00 0.00 C ATOM 1354 CG PRO A 88 -3.750 11.564 5.848 1.00 0.00 C ATOM 1355 CD PRO A 88 -4.837 12.598 5.747 1.00 0.00 C ATOM 0 HA PRO A 88 -6.524 10.020 6.809 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -3.784 9.584 6.665 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -4.738 9.774 5.207 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -3.047 11.813 6.643 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -3.177 11.508 4.922 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -4.502 13.570 6.109 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -5.165 12.737 4.717 1.00 0.00 H new ATOM 1363 N THR A 89 -5.564 9.321 8.998 1.00 0.00 N ATOM 1364 CA THR A 89 -5.303 9.056 10.407 1.00 0.00 C ATOM 1365 C THR A 89 -4.541 7.748 10.588 1.00 0.00 C ATOM 1366 O THR A 89 -4.907 6.720 10.017 1.00 0.00 O ATOM 1367 CB THR A 89 -6.611 8.991 11.218 1.00 0.00 C ATOM 1368 OG1 THR A 89 -7.632 8.343 10.451 1.00 0.00 O ATOM 1369 CG2 THR A 89 -7.073 10.386 11.611 1.00 0.00 C ATOM 0 H THR A 89 -5.927 8.522 8.479 1.00 0.00 H new ATOM 0 HA THR A 89 -4.695 9.882 10.777 1.00 0.00 H new ATOM 0 HB THR A 89 -6.422 8.419 12.126 1.00 0.00 H new ATOM 0 HG1 THR A 89 -8.460 8.305 10.974 1.00 0.00 H new ATOM 0 HG21 THR A 89 -7.998 10.315 12.183 1.00 0.00 H new ATOM 0 HG22 THR A 89 -6.306 10.865 12.220 1.00 0.00 H new ATOM 0 HG23 THR A 89 -7.246 10.979 10.713 1.00 0.00 H new ATOM 1377 N TYR A 90 -3.481 7.793 11.387 1.00 0.00 N ATOM 1378 CA TYR A 90 -2.666 6.611 11.642 1.00 0.00 C ATOM 1379 C TYR A 90 -3.543 5.385 11.880 1.00 0.00 C ATOM 1380 O TYR A 90 -3.148 4.259 11.581 1.00 0.00 O ATOM 1381 CB TYR A 90 -1.757 6.844 12.850 1.00 0.00 C ATOM 1382 CG TYR A 90 -0.650 7.841 12.592 1.00 0.00 C ATOM 1383 CD1 TYR A 90 0.081 7.808 11.411 1.00 0.00 C ATOM 1384 CD2 TYR A 90 -0.336 8.818 13.529 1.00 0.00 C ATOM 1385 CE1 TYR A 90 1.093 8.717 11.172 1.00 0.00 C ATOM 1386 CE2 TYR A 90 0.673 9.732 13.298 1.00 0.00 C ATOM 1387 CZ TYR A 90 1.385 9.677 12.118 1.00 0.00 C ATOM 1388 OH TYR A 90 2.392 10.585 11.882 1.00 0.00 O ATOM 0 H TYR A 90 -3.166 8.635 11.869 1.00 0.00 H new ATOM 0 HA TYR A 90 -2.050 6.429 10.761 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -2.362 7.194 13.687 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -1.316 5.894 13.151 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -0.146 7.059 10.667 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -0.891 8.863 14.454 1.00 0.00 H new ATOM 0 HE1 TYR A 90 1.653 8.676 10.249 1.00 0.00 H new ATOM 0 HE2 TYR A 90 0.903 10.485 14.037 1.00 0.00 H new ATOM 0 HH TYR A 90 3.206 10.299 12.346 1.00 0.00 H new ATOM 1398 N GLU A 91 -4.735 5.615 12.421 1.00 0.00 N ATOM 1399 CA GLU A 91 -5.669 4.530 12.700 1.00 0.00 C ATOM 1400 C GLU A 91 -6.163 3.892 11.405 1.00 0.00 C ATOM 1401 O GLU A 91 -6.080 2.677 11.228 1.00 0.00 O ATOM 1402 CB GLU A 91 -6.858 5.047 13.513 1.00 0.00 C ATOM 1403 CG GLU A 91 -7.959 4.017 13.702 1.00 0.00 C ATOM 1404 CD GLU A 91 -8.842 4.320 14.897 1.00 0.00 C ATOM 1405 OE1 GLU A 91 -8.421 4.022 16.035 1.00 0.00 O ATOM 1406 OE2 GLU A 91 -9.952 4.854 14.696 1.00 0.00 O ATOM 0 H GLU A 91 -5.077 6.542 12.675 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.143 3.772 13.281 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -6.505 5.372 14.491 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -7.273 5.924 13.016 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -8.573 3.977 12.802 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -7.512 3.031 13.826 1.00 0.00 H new ATOM 1413 N ASN A 92 -6.679 4.721 10.503 1.00 0.00 N ATOM 1414 CA ASN A 92 -7.189 4.238 9.224 1.00 0.00 C ATOM 1415 C ASN A 92 -6.096 3.517 8.441 1.00 0.00 C ATOM 1416 O ASN A 92 -6.296 2.402 7.958 1.00 0.00 O ATOM 1417 CB ASN A 92 -7.741 5.402 8.399 1.00 0.00 C ATOM 1418 CG ASN A 92 -9.158 5.769 8.793 1.00 0.00 C ATOM 1419 OD1 ASN A 92 -9.947 4.910 9.188 1.00 0.00 O ATOM 1420 ND2 ASN A 92 -9.489 7.050 8.686 1.00 0.00 N ATOM 0 H ASN A 92 -6.755 5.730 10.634 1.00 0.00 H new ATOM 0 HA ASN A 92 -7.994 3.531 9.425 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -7.095 6.271 8.525 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -7.718 5.138 7.342 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -10.429 7.356 8.936 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -8.803 7.728 8.354 1.00 0.00 H new ATOM 1427 N LEU A 93 -4.941 4.161 8.318 1.00 0.00 N ATOM 1428 CA LEU A 93 -3.815 3.582 7.594 1.00 0.00 C ATOM 1429 C LEU A 93 -3.637 2.110 7.951 1.00 0.00 C ATOM 1430 O LEU A 93 -3.826 1.231 7.110 1.00 0.00 O ATOM 1431 CB LEU A 93 -2.531 4.353 7.906 1.00 0.00 C ATOM 1432 CG LEU A 93 -1.225 3.682 7.481 1.00 0.00 C ATOM 1433 CD1 LEU A 93 -0.983 3.881 5.992 1.00 0.00 C ATOM 1434 CD2 LEU A 93 -0.057 4.227 8.290 1.00 0.00 C ATOM 0 H LEU A 93 -4.759 5.085 8.710 1.00 0.00 H new ATOM 0 HA LEU A 93 -4.025 3.655 6.527 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -2.590 5.328 7.422 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -2.491 4.533 8.980 1.00 0.00 H new ATOM 0 HG LEU A 93 -1.308 2.613 7.676 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -0.049 3.397 5.707 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -1.806 3.442 5.428 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -0.921 4.947 5.773 1.00 0.00 H new ATOM 0 HD21 LEU A 93 0.864 3.738 7.974 1.00 0.00 H new ATOM 0 HD22 LEU A 93 0.028 5.301 8.127 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -0.226 4.033 9.349 1.00 0.00 H new ATOM 1446 N GLN A 94 -3.274 1.850 9.202 1.00 0.00 N ATOM 1447 CA GLN A 94 -3.072 0.483 9.670 1.00 0.00 C ATOM 1448 C GLN A 94 -4.059 -0.471 9.005 1.00 0.00 C ATOM 1449 O GLN A 94 -3.662 -1.424 8.334 1.00 0.00 O ATOM 1450 CB GLN A 94 -3.224 0.415 11.191 1.00 0.00 C ATOM 1451 CG GLN A 94 -2.386 -0.676 11.837 1.00 0.00 C ATOM 1452 CD GLN A 94 -2.915 -1.091 13.196 1.00 0.00 C ATOM 1453 OE1 GLN A 94 -3.608 -0.325 13.865 1.00 0.00 O ATOM 1454 NE2 GLN A 94 -2.590 -2.310 13.611 1.00 0.00 N ATOM 0 H GLN A 94 -3.114 2.567 9.910 1.00 0.00 H new ATOM 0 HA GLN A 94 -2.061 0.178 9.399 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -2.945 1.378 11.619 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -4.273 0.249 11.436 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -2.360 -1.546 11.180 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -1.359 -0.326 11.943 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -2.013 -2.912 13.023 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -2.917 -2.644 14.517 1.00 0.00 H new ATOM 1463 N LYS A 95 -5.348 -0.209 9.196 1.00 0.00 N ATOM 1464 CA LYS A 95 -6.392 -1.044 8.614 1.00 0.00 C ATOM 1465 C LYS A 95 -6.109 -1.323 7.142 1.00 0.00 C ATOM 1466 O LYS A 95 -5.996 -2.478 6.730 1.00 0.00 O ATOM 1467 CB LYS A 95 -7.756 -0.365 8.762 1.00 0.00 C ATOM 1468 CG LYS A 95 -8.119 -0.036 10.200 1.00 0.00 C ATOM 1469 CD LYS A 95 -9.556 0.444 10.316 1.00 0.00 C ATOM 1470 CE LYS A 95 -9.729 1.833 9.720 1.00 0.00 C ATOM 1471 NZ LYS A 95 -11.146 2.106 9.353 1.00 0.00 N ATOM 0 H LYS A 95 -5.694 0.575 9.749 1.00 0.00 H new ATOM 0 HA LYS A 95 -6.404 -1.994 9.149 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -7.761 0.554 8.176 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -8.524 -1.015 8.342 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -7.978 -0.919 10.823 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -7.446 0.733 10.580 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -10.217 -0.257 9.806 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -9.853 0.457 11.365 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -9.389 2.581 10.437 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -9.100 1.930 8.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -11.265 3.121 9.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -11.396 1.560 8.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -11.768 1.827 10.139 1.00 0.00 H new ATOM 1485 N SER A 96 -5.994 -0.259 6.354 1.00 0.00 N ATOM 1486 CA SER A 96 -5.725 -0.391 4.926 1.00 0.00 C ATOM 1487 C SER A 96 -4.661 -1.453 4.669 1.00 0.00 C ATOM 1488 O SER A 96 -4.818 -2.308 3.797 1.00 0.00 O ATOM 1489 CB SER A 96 -5.275 0.951 4.345 1.00 0.00 C ATOM 1490 OG SER A 96 -6.242 1.959 4.581 1.00 0.00 O ATOM 0 H SER A 96 -6.083 0.704 6.679 1.00 0.00 H new ATOM 0 HA SER A 96 -6.647 -0.701 4.434 1.00 0.00 H new ATOM 0 HB2 SER A 96 -4.324 1.243 4.791 1.00 0.00 H new ATOM 0 HB3 SER A 96 -5.106 0.848 3.273 1.00 0.00 H new ATOM 0 HG SER A 96 -6.207 2.621 3.859 1.00 0.00 H new ATOM 1496 N LEU A 97 -3.577 -1.392 5.435 1.00 0.00 N ATOM 1497 CA LEU A 97 -2.484 -2.348 5.292 1.00 0.00 C ATOM 1498 C LEU A 97 -2.958 -3.766 5.596 1.00 0.00 C ATOM 1499 O LEU A 97 -2.525 -4.725 4.958 1.00 0.00 O ATOM 1500 CB LEU A 97 -1.328 -1.974 6.221 1.00 0.00 C ATOM 1501 CG LEU A 97 -0.620 -0.654 5.913 1.00 0.00 C ATOM 1502 CD1 LEU A 97 0.170 -0.178 7.122 1.00 0.00 C ATOM 1503 CD2 LEU A 97 0.291 -0.807 4.704 1.00 0.00 C ATOM 0 H LEU A 97 -3.431 -0.691 6.161 1.00 0.00 H new ATOM 0 HA LEU A 97 -2.137 -2.314 4.259 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -1.708 -1.930 7.242 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -0.590 -2.775 6.190 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.376 0.096 5.680 1.00 0.00 H new ATOM 0 HD11 LEU A 97 0.667 0.762 6.884 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -0.507 -0.028 7.963 1.00 0.00 H new ATOM 0 HD13 LEU A 97 0.917 -0.927 7.386 1.00 0.00 H new ATOM 0 HD21 LEU A 97 0.787 0.142 4.499 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.041 -1.571 4.908 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -0.301 -1.101 3.837 1.00 0.00 H new ATOM 1515 N GLU A 98 -3.850 -3.889 6.574 1.00 0.00 N ATOM 1516 CA GLU A 98 -4.383 -5.190 6.961 1.00 0.00 C ATOM 1517 C GLU A 98 -5.298 -5.748 5.875 1.00 0.00 C ATOM 1518 O GLU A 98 -5.502 -6.958 5.781 1.00 0.00 O ATOM 1519 CB GLU A 98 -5.149 -5.080 8.281 1.00 0.00 C ATOM 1520 CG GLU A 98 -4.250 -5.065 9.506 1.00 0.00 C ATOM 1521 CD GLU A 98 -4.919 -5.666 10.727 1.00 0.00 C ATOM 1522 OE1 GLU A 98 -5.089 -6.903 10.763 1.00 0.00 O ATOM 1523 OE2 GLU A 98 -5.273 -4.899 11.647 1.00 0.00 O ATOM 0 H GLU A 98 -4.218 -3.105 7.112 1.00 0.00 H new ATOM 0 HA GLU A 98 -3.544 -5.873 7.092 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -5.748 -4.170 8.269 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -5.843 -5.917 8.360 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -3.336 -5.617 9.288 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -3.957 -4.038 9.725 1.00 0.00 H new ATOM 1530 N ALA A 99 -5.847 -4.857 5.056 1.00 0.00 N ATOM 1531 CA ALA A 99 -6.739 -5.259 3.975 1.00 0.00 C ATOM 1532 C ALA A 99 -5.952 -5.624 2.721 1.00 0.00 C ATOM 1533 O ALA A 99 -6.353 -6.503 1.959 1.00 0.00 O ATOM 1534 CB ALA A 99 -7.735 -4.150 3.673 1.00 0.00 C ATOM 0 H ALA A 99 -5.690 -3.851 5.121 1.00 0.00 H new ATOM 0 HA ALA A 99 -7.286 -6.145 4.298 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -8.395 -4.464 2.864 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -8.327 -3.941 4.564 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -7.198 -3.250 3.375 1.00 0.00 H new ATOM 1540 N MET A 100 -4.831 -4.942 2.513 1.00 0.00 N ATOM 1541 CA MET A 100 -3.987 -5.195 1.350 1.00 0.00 C ATOM 1542 C MET A 100 -3.360 -6.583 1.425 1.00 0.00 C ATOM 1543 O MET A 100 -3.578 -7.422 0.551 1.00 0.00 O ATOM 1544 CB MET A 100 -2.891 -4.132 1.247 1.00 0.00 C ATOM 1545 CG MET A 100 -1.864 -4.422 0.165 1.00 0.00 C ATOM 1546 SD MET A 100 -0.767 -3.024 -0.143 1.00 0.00 S ATOM 1547 CE MET A 100 -0.229 -2.643 1.522 1.00 0.00 C ATOM 0 H MET A 100 -4.486 -4.210 3.134 1.00 0.00 H new ATOM 0 HA MET A 100 -4.614 -5.147 0.460 1.00 0.00 H new ATOM 0 HB2 MET A 100 -3.352 -3.164 1.049 1.00 0.00 H new ATOM 0 HB3 MET A 100 -2.382 -4.052 2.208 1.00 0.00 H new ATOM 0 HG2 MET A 100 -1.270 -5.288 0.456 1.00 0.00 H new ATOM 0 HG3 MET A 100 -2.379 -4.685 -0.759 1.00 0.00 H new ATOM 0 HE1 MET A 100 0.485 -1.820 1.494 1.00 0.00 H new ATOM 0 HE2 MET A 100 -1.090 -2.357 2.126 1.00 0.00 H new ATOM 0 HE3 MET A 100 0.246 -3.520 1.961 1.00 0.00 H new ATOM 1557 N LYS A 101 -2.581 -6.819 2.475 1.00 0.00 N ATOM 1558 CA LYS A 101 -1.923 -8.106 2.665 1.00 0.00 C ATOM 1559 C LYS A 101 -2.914 -9.254 2.502 1.00 0.00 C ATOM 1560 O LYS A 101 -2.671 -10.193 1.743 1.00 0.00 O ATOM 1561 CB LYS A 101 -1.275 -8.171 4.050 1.00 0.00 C ATOM 1562 CG LYS A 101 -2.275 -8.116 5.192 1.00 0.00 C ATOM 1563 CD LYS A 101 -1.579 -7.982 6.537 1.00 0.00 C ATOM 1564 CE LYS A 101 -2.468 -8.460 7.674 1.00 0.00 C ATOM 1565 NZ LYS A 101 -2.408 -9.939 7.842 1.00 0.00 N ATOM 0 H LYS A 101 -2.390 -6.136 3.208 1.00 0.00 H new ATOM 0 HA LYS A 101 -1.150 -8.206 1.903 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -0.697 -9.092 4.129 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -0.573 -7.344 4.153 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -2.950 -7.273 5.045 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -2.886 -9.019 5.186 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -0.655 -8.560 6.529 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -1.303 -6.941 6.703 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -2.162 -7.977 8.602 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -3.497 -8.158 7.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -3.028 -10.225 8.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -2.724 -10.401 6.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -1.430 -10.225 8.051 1.00 0.00 H new ATOM 1579 N SER A 102 -4.031 -9.171 3.217 1.00 0.00 N ATOM 1580 CA SER A 102 -5.058 -10.205 3.152 1.00 0.00 C ATOM 1581 C SER A 102 -5.150 -10.793 1.747 1.00 0.00 C ATOM 1582 O SER A 102 -5.234 -12.009 1.576 1.00 0.00 O ATOM 1583 CB SER A 102 -6.415 -9.631 3.566 1.00 0.00 C ATOM 1584 OG SER A 102 -7.316 -10.664 3.926 1.00 0.00 O ATOM 0 H SER A 102 -4.248 -8.399 3.848 1.00 0.00 H new ATOM 0 HA SER A 102 -4.781 -11.001 3.843 1.00 0.00 H new ATOM 0 HB2 SER A 102 -6.284 -8.949 4.406 1.00 0.00 H new ATOM 0 HB3 SER A 102 -6.833 -9.049 2.745 1.00 0.00 H new ATOM 0 HG SER A 102 -8.175 -10.272 4.188 1.00 0.00 H new ATOM 1590 N HIS A 103 -5.132 -9.920 0.745 1.00 0.00 N ATOM 1591 CA HIS A 103 -5.213 -10.352 -0.646 1.00 0.00 C ATOM 1592 C HIS A 103 -3.973 -11.149 -1.040 1.00 0.00 C ATOM 1593 O HIS A 103 -4.076 -12.271 -1.538 1.00 0.00 O ATOM 1594 CB HIS A 103 -5.370 -9.143 -1.569 1.00 0.00 C ATOM 1595 CG HIS A 103 -6.070 -9.459 -2.855 1.00 0.00 C ATOM 1596 ND1 HIS A 103 -5.434 -9.457 -4.079 1.00 0.00 N ATOM 1597 CD2 HIS A 103 -7.359 -9.790 -3.104 1.00 0.00 C ATOM 1598 CE1 HIS A 103 -6.301 -9.771 -5.024 1.00 0.00 C ATOM 1599 NE2 HIS A 103 -7.477 -9.979 -4.459 1.00 0.00 N ATOM 0 H HIS A 103 -5.062 -8.910 0.870 1.00 0.00 H new ATOM 0 HA HIS A 103 -6.086 -10.996 -0.751 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -5.925 -8.365 -1.044 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -4.384 -8.736 -1.792 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -8.148 -9.887 -2.373 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -6.085 -9.845 -6.080 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -8.333 -10.238 -4.949 1.00 0.00 H new ATOM 1607 N CYS A 104 -2.802 -10.563 -0.814 1.00 0.00 N ATOM 1608 CA CYS A 104 -1.542 -11.218 -1.147 1.00 0.00 C ATOM 1609 C CYS A 104 -1.592 -12.702 -0.797 1.00 0.00 C ATOM 1610 O CYS A 104 -1.360 -13.560 -1.650 1.00 0.00 O ATOM 1611 CB CYS A 104 -0.384 -10.546 -0.409 1.00 0.00 C ATOM 1612 SG CYS A 104 -0.238 -8.772 -0.724 1.00 0.00 S ATOM 0 H CYS A 104 -2.699 -9.636 -0.402 1.00 0.00 H new ATOM 0 HA CYS A 104 -1.383 -11.122 -2.221 1.00 0.00 H new ATOM 0 HB2 CYS A 104 -0.509 -10.705 0.662 1.00 0.00 H new ATOM 0 HB3 CYS A 104 0.548 -11.033 -0.697 1.00 0.00 H new ATOM 0 HG CYS A 104 -0.984 -8.449 -1.738 1.00 0.00 H new ATOM 1618 N LEU A 105 -1.894 -12.997 0.462 1.00 0.00 N ATOM 1619 CA LEU A 105 -1.972 -14.378 0.926 1.00 0.00 C ATOM 1620 C LEU A 105 -3.032 -15.154 0.151 1.00 0.00 C ATOM 1621 O LEU A 105 -2.753 -16.210 -0.417 1.00 0.00 O ATOM 1622 CB LEU A 105 -2.289 -14.417 2.423 1.00 0.00 C ATOM 1623 CG LEU A 105 -1.429 -13.520 3.314 1.00 0.00 C ATOM 1624 CD1 LEU A 105 -2.061 -12.144 3.455 1.00 0.00 C ATOM 1625 CD2 LEU A 105 -1.229 -14.160 4.680 1.00 0.00 C ATOM 0 H LEU A 105 -2.089 -12.299 1.180 1.00 0.00 H new ATOM 0 HA LEU A 105 -1.004 -14.848 0.753 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -3.334 -14.138 2.560 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -2.186 -15.445 2.769 1.00 0.00 H new ATOM 0 HG LEU A 105 -0.453 -13.402 2.844 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -1.435 -11.520 4.092 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -2.152 -11.683 2.472 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -3.050 -12.242 3.902 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -0.615 -13.508 5.301 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -2.198 -14.309 5.157 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -0.731 -15.122 4.562 1.00 0.00 H new ATOM 1637 N LYS A 106 -4.249 -14.622 0.129 1.00 0.00 N ATOM 1638 CA LYS A 106 -5.352 -15.262 -0.580 1.00 0.00 C ATOM 1639 C LYS A 106 -4.870 -15.886 -1.886 1.00 0.00 C ATOM 1640 O LYS A 106 -5.048 -17.081 -2.116 1.00 0.00 O ATOM 1641 CB LYS A 106 -6.459 -14.245 -0.866 1.00 0.00 C ATOM 1642 CG LYS A 106 -7.381 -14.001 0.315 1.00 0.00 C ATOM 1643 CD LYS A 106 -8.222 -12.751 0.118 1.00 0.00 C ATOM 1644 CE LYS A 106 -9.515 -12.817 0.917 1.00 0.00 C ATOM 1645 NZ LYS A 106 -9.258 -13.007 2.372 1.00 0.00 N ATOM 0 H LYS A 106 -4.497 -13.749 0.594 1.00 0.00 H new ATOM 0 HA LYS A 106 -5.749 -16.054 0.055 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -6.004 -13.300 -1.163 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -7.051 -14.593 -1.712 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -8.035 -14.862 0.451 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -6.789 -13.903 1.225 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -7.650 -11.875 0.422 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -8.453 -12.630 -0.940 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -10.083 -11.899 0.765 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -10.130 -13.637 0.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -10.150 -12.912 2.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -8.861 -13.954 2.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -8.583 -12.288 2.702 1.00 0.00 H new ATOM 1659 N ASN A 107 -4.257 -15.068 -2.736 1.00 0.00 N ATOM 1660 CA ASN A 107 -3.749 -15.541 -4.019 1.00 0.00 C ATOM 1661 C ASN A 107 -2.365 -16.163 -3.859 1.00 0.00 C ATOM 1662 O ASN A 107 -2.190 -17.367 -4.041 1.00 0.00 O ATOM 1663 CB ASN A 107 -3.689 -14.389 -5.024 1.00 0.00 C ATOM 1664 CG ASN A 107 -3.441 -13.050 -4.355 1.00 0.00 C ATOM 1665 OD1 ASN A 107 -2.299 -12.682 -4.082 1.00 0.00 O ATOM 1666 ND2 ASN A 107 -4.515 -12.316 -4.086 1.00 0.00 N ATOM 0 H ASN A 107 -4.100 -14.076 -2.560 1.00 0.00 H new ATOM 0 HA ASN A 107 -4.431 -16.305 -4.393 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -2.897 -14.583 -5.748 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -4.626 -14.346 -5.580 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -4.412 -11.407 -3.635 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -5.443 -12.661 -4.330 1.00 0.00 H new ATOM 1673 N GLY A 108 -1.384 -15.333 -3.517 1.00 0.00 N ATOM 1674 CA GLY A 108 -0.029 -15.819 -3.339 1.00 0.00 C ATOM 1675 C GLY A 108 1.013 -14.790 -3.729 1.00 0.00 C ATOM 1676 O GLY A 108 2.050 -15.130 -4.299 1.00 0.00 O ATOM 0 H GLY A 108 -1.504 -14.332 -3.360 1.00 0.00 H new ATOM 0 HA2 GLY A 108 0.118 -16.103 -2.297 1.00 0.00 H new ATOM 0 HA3 GLY A 108 0.112 -16.719 -3.937 1.00 0.00 H new ATOM 1680 N VAL A 109 0.737 -13.526 -3.424 1.00 0.00 N ATOM 1681 CA VAL A 109 1.658 -12.443 -3.747 1.00 0.00 C ATOM 1682 C VAL A 109 2.714 -12.277 -2.660 1.00 0.00 C ATOM 1683 O VAL A 109 2.442 -11.727 -1.592 1.00 0.00 O ATOM 1684 CB VAL A 109 0.913 -11.108 -3.932 1.00 0.00 C ATOM 1685 CG1 VAL A 109 1.887 -9.997 -4.292 1.00 0.00 C ATOM 1686 CG2 VAL A 109 -0.169 -11.245 -4.993 1.00 0.00 C ATOM 0 H VAL A 109 -0.117 -13.227 -2.954 1.00 0.00 H new ATOM 0 HA VAL A 109 2.145 -12.711 -4.685 1.00 0.00 H new ATOM 0 HB VAL A 109 0.434 -10.846 -2.989 1.00 0.00 H new ATOM 0 HG11 VAL A 109 1.342 -9.062 -4.419 1.00 0.00 H new ATOM 0 HG12 VAL A 109 2.621 -9.884 -3.494 1.00 0.00 H new ATOM 0 HG13 VAL A 109 2.398 -10.248 -5.222 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -0.686 -10.292 -5.111 1.00 0.00 H new ATOM 0 HG22 VAL A 109 0.286 -11.531 -5.941 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -0.883 -12.010 -4.688 1.00 0.00 H new ATOM 1696 N THR A 110 3.923 -12.755 -2.938 1.00 0.00 N ATOM 1697 CA THR A 110 5.021 -12.660 -1.984 1.00 0.00 C ATOM 1698 C THR A 110 5.884 -11.434 -2.259 1.00 0.00 C ATOM 1699 O THR A 110 6.539 -10.910 -1.358 1.00 0.00 O ATOM 1700 CB THR A 110 5.909 -13.918 -2.023 1.00 0.00 C ATOM 1701 OG1 THR A 110 6.912 -13.841 -1.004 1.00 0.00 O ATOM 1702 CG2 THR A 110 6.571 -14.071 -3.384 1.00 0.00 C ATOM 0 H THR A 110 4.167 -13.212 -3.817 1.00 0.00 H new ATOM 0 HA THR A 110 4.573 -12.571 -0.994 1.00 0.00 H new ATOM 0 HB THR A 110 5.277 -14.788 -1.845 1.00 0.00 H new ATOM 0 HG1 THR A 110 7.471 -14.645 -1.034 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.193 -14.966 -3.388 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.804 -14.159 -4.154 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.191 -13.198 -3.587 1.00 0.00 H new ATOM 1710 N ASP A 111 5.879 -10.981 -3.508 1.00 0.00 N ATOM 1711 CA ASP A 111 6.660 -9.814 -3.901 1.00 0.00 C ATOM 1712 C ASP A 111 5.761 -8.596 -4.087 1.00 0.00 C ATOM 1713 O ASP A 111 4.786 -8.639 -4.838 1.00 0.00 O ATOM 1714 CB ASP A 111 7.428 -10.099 -5.192 1.00 0.00 C ATOM 1715 CG ASP A 111 8.296 -11.338 -5.089 1.00 0.00 C ATOM 1716 OD1 ASP A 111 8.629 -11.735 -3.953 1.00 0.00 O ATOM 1717 OD2 ASP A 111 8.643 -11.910 -6.143 1.00 0.00 O ATOM 0 H ASP A 111 5.343 -11.404 -4.265 1.00 0.00 H new ATOM 0 HA ASP A 111 7.372 -9.599 -3.104 1.00 0.00 H new ATOM 0 HB2 ASP A 111 6.721 -10.222 -6.012 1.00 0.00 H new ATOM 0 HB3 ASP A 111 8.053 -9.240 -5.436 1.00 0.00 H new ATOM 1722 N LEU A 112 6.095 -7.510 -3.398 1.00 0.00 N ATOM 1723 CA LEU A 112 5.318 -6.279 -3.486 1.00 0.00 C ATOM 1724 C LEU A 112 6.233 -5.059 -3.537 1.00 0.00 C ATOM 1725 O LEU A 112 7.375 -5.109 -3.081 1.00 0.00 O ATOM 1726 CB LEU A 112 4.366 -6.167 -2.294 1.00 0.00 C ATOM 1727 CG LEU A 112 3.068 -5.396 -2.541 1.00 0.00 C ATOM 1728 CD1 LEU A 112 2.097 -6.235 -3.358 1.00 0.00 C ATOM 1729 CD2 LEU A 112 2.436 -4.979 -1.222 1.00 0.00 C ATOM 0 H LEU A 112 6.899 -7.457 -2.772 1.00 0.00 H new ATOM 0 HA LEU A 112 4.735 -6.312 -4.407 1.00 0.00 H new ATOM 0 HB2 LEU A 112 4.110 -7.174 -1.963 1.00 0.00 H new ATOM 0 HB3 LEU A 112 4.899 -5.688 -1.473 1.00 0.00 H new ATOM 0 HG LEU A 112 3.305 -4.495 -3.108 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.179 -5.671 -3.524 1.00 0.00 H new ATOM 0 HD12 LEU A 112 2.549 -6.483 -4.318 1.00 0.00 H new ATOM 0 HD13 LEU A 112 1.866 -7.153 -2.818 1.00 0.00 H new ATOM 0 HD21 LEU A 112 1.514 -4.432 -1.417 1.00 0.00 H new ATOM 0 HD22 LEU A 112 2.213 -5.866 -0.629 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.128 -4.340 -0.673 1.00 0.00 H new ATOM 1741 N SER A 113 5.722 -3.965 -4.093 1.00 0.00 N ATOM 1742 CA SER A 113 6.494 -2.733 -4.205 1.00 0.00 C ATOM 1743 C SER A 113 5.591 -1.512 -4.061 1.00 0.00 C ATOM 1744 O SER A 113 4.481 -1.481 -4.593 1.00 0.00 O ATOM 1745 CB SER A 113 7.226 -2.685 -5.547 1.00 0.00 C ATOM 1746 OG SER A 113 8.401 -1.897 -5.459 1.00 0.00 O ATOM 0 H SER A 113 4.777 -3.907 -4.473 1.00 0.00 H new ATOM 0 HA SER A 113 7.228 -2.718 -3.399 1.00 0.00 H new ATOM 0 HB2 SER A 113 7.485 -3.696 -5.860 1.00 0.00 H new ATOM 0 HB3 SER A 113 6.565 -2.275 -6.311 1.00 0.00 H new ATOM 0 HG SER A 113 8.937 -2.017 -6.271 1.00 0.00 H new ATOM 1752 N MET A 114 6.075 -0.507 -3.339 1.00 0.00 N ATOM 1753 CA MET A 114 5.313 0.718 -3.126 1.00 0.00 C ATOM 1754 C MET A 114 6.244 1.902 -2.884 1.00 0.00 C ATOM 1755 O MET A 114 7.235 1.806 -2.161 1.00 0.00 O ATOM 1756 CB MET A 114 4.361 0.552 -1.940 1.00 0.00 C ATOM 1757 CG MET A 114 5.072 0.289 -0.622 1.00 0.00 C ATOM 1758 SD MET A 114 3.957 -0.311 0.661 1.00 0.00 S ATOM 1759 CE MET A 114 3.402 -1.851 -0.066 1.00 0.00 C ATOM 0 H MET A 114 6.992 -0.517 -2.891 1.00 0.00 H new ATOM 0 HA MET A 114 4.730 0.915 -4.026 1.00 0.00 H new ATOM 0 HB2 MET A 114 3.754 1.452 -1.843 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.678 -0.272 -2.146 1.00 0.00 H new ATOM 0 HG2 MET A 114 5.864 -0.443 -0.781 1.00 0.00 H new ATOM 0 HG3 MET A 114 5.550 1.208 -0.282 1.00 0.00 H new ATOM 0 HE1 MET A 114 2.337 -1.786 -0.288 1.00 0.00 H new ATOM 0 HE2 MET A 114 3.954 -2.038 -0.987 1.00 0.00 H new ATOM 0 HE3 MET A 114 3.577 -2.668 0.634 1.00 0.00 H new ATOM 1769 N PRO A 115 5.919 3.047 -3.504 1.00 0.00 N ATOM 1770 CA PRO A 115 6.714 4.272 -3.370 1.00 0.00 C ATOM 1771 C PRO A 115 6.609 4.882 -1.977 1.00 0.00 C ATOM 1772 O PRO A 115 6.156 4.230 -1.036 1.00 0.00 O ATOM 1773 CB PRO A 115 6.098 5.209 -4.412 1.00 0.00 C ATOM 1774 CG PRO A 115 4.699 4.724 -4.578 1.00 0.00 C ATOM 1775 CD PRO A 115 4.752 3.234 -4.381 1.00 0.00 C ATOM 0 HA PRO A 115 7.778 4.086 -3.519 1.00 0.00 H new ATOM 0 HB2 PRO A 115 6.120 6.245 -4.075 1.00 0.00 H new ATOM 0 HB3 PRO A 115 6.645 5.168 -5.354 1.00 0.00 H new ATOM 0 HG2 PRO A 115 4.035 5.191 -3.850 1.00 0.00 H new ATOM 0 HG3 PRO A 115 4.314 4.974 -5.567 1.00 0.00 H new ATOM 0 HD2 PRO A 115 3.839 2.857 -3.921 1.00 0.00 H new ATOM 0 HD3 PRO A 115 4.872 2.708 -5.328 1.00 0.00 H new ATOM 1783 N ARG A 116 7.032 6.136 -1.851 1.00 0.00 N ATOM 1784 CA ARG A 116 6.986 6.833 -0.572 1.00 0.00 C ATOM 1785 C ARG A 116 5.571 7.317 -0.266 1.00 0.00 C ATOM 1786 O ARG A 116 4.991 8.089 -1.030 1.00 0.00 O ATOM 1787 CB ARG A 116 7.952 8.019 -0.578 1.00 0.00 C ATOM 1788 CG ARG A 116 9.364 7.657 -0.149 1.00 0.00 C ATOM 1789 CD ARG A 116 9.482 7.572 1.365 1.00 0.00 C ATOM 1790 NE ARG A 116 9.741 8.876 1.968 1.00 0.00 N ATOM 1791 CZ ARG A 116 10.914 9.496 1.902 1.00 0.00 C ATOM 1792 NH1 ARG A 116 11.930 8.934 1.263 1.00 0.00 N ATOM 1793 NH2 ARG A 116 11.072 10.682 2.476 1.00 0.00 N ATOM 0 H ARG A 116 7.410 6.690 -2.620 1.00 0.00 H new ATOM 0 HA ARG A 116 7.287 6.132 0.206 1.00 0.00 H new ATOM 0 HB2 ARG A 116 7.984 8.445 -1.581 1.00 0.00 H new ATOM 0 HB3 ARG A 116 7.567 8.793 0.085 1.00 0.00 H new ATOM 0 HG2 ARG A 116 9.646 6.701 -0.591 1.00 0.00 H new ATOM 0 HG3 ARG A 116 10.063 8.402 -0.528 1.00 0.00 H new ATOM 0 HD2 ARG A 116 8.562 7.158 1.778 1.00 0.00 H new ATOM 0 HD3 ARG A 116 10.286 6.885 1.628 1.00 0.00 H new ATOM 0 HE ARG A 116 8.980 9.336 2.467 1.00 0.00 H new ATOM 0 HH11 ARG A 116 11.813 8.023 0.820 1.00 0.00 H new ATOM 0 HH12 ARG A 116 12.829 9.413 1.214 1.00 0.00 H new ATOM 0 HH21 ARG A 116 10.292 11.118 2.968 1.00 0.00 H new ATOM 0 HH22 ARG A 116 11.973 11.157 2.425 1.00 0.00 H new ATOM 1807 N ILE A 117 5.023 6.857 0.854 1.00 0.00 N ATOM 1808 CA ILE A 117 3.678 7.244 1.259 1.00 0.00 C ATOM 1809 C ILE A 117 3.696 7.973 2.599 1.00 0.00 C ATOM 1810 O ILE A 117 4.463 7.626 3.496 1.00 0.00 O ATOM 1811 CB ILE A 117 2.749 6.020 1.366 1.00 0.00 C ATOM 1812 CG1 ILE A 117 3.374 4.954 2.268 1.00 0.00 C ATOM 1813 CG2 ILE A 117 2.462 5.451 -0.016 1.00 0.00 C ATOM 1814 CD1 ILE A 117 2.513 3.722 2.433 1.00 0.00 C ATOM 0 H ILE A 117 5.490 6.216 1.496 1.00 0.00 H new ATOM 0 HA ILE A 117 3.296 7.914 0.489 1.00 0.00 H new ATOM 0 HB ILE A 117 1.806 6.336 1.811 1.00 0.00 H new ATOM 0 HG12 ILE A 117 4.339 4.660 1.855 1.00 0.00 H new ATOM 0 HG13 ILE A 117 3.566 5.387 3.250 1.00 0.00 H new ATOM 0 HG21 ILE A 117 1.804 4.587 0.076 1.00 0.00 H new ATOM 0 HG22 ILE A 117 1.978 6.211 -0.629 1.00 0.00 H new ATOM 0 HG23 ILE A 117 3.397 5.147 -0.486 1.00 0.00 H new ATOM 0 HD11 ILE A 117 3.019 3.009 3.085 1.00 0.00 H new ATOM 0 HD12 ILE A 117 1.557 4.003 2.875 1.00 0.00 H new ATOM 0 HD13 ILE A 117 2.342 3.265 1.459 1.00 0.00 H new ATOM 1826 N GLY A 118 2.842 8.984 2.727 1.00 0.00 N ATOM 1827 CA GLY A 118 2.775 9.745 3.961 1.00 0.00 C ATOM 1828 C GLY A 118 2.560 11.226 3.718 1.00 0.00 C ATOM 1829 O GLY A 118 3.266 12.063 4.282 1.00 0.00 O ATOM 0 H GLY A 118 2.196 9.289 1.999 1.00 0.00 H new ATOM 0 HA2 GLY A 118 1.963 9.360 4.578 1.00 0.00 H new ATOM 0 HA3 GLY A 118 3.698 9.602 4.523 1.00 0.00 H new ATOM 1833 N CYS A 119 1.584 11.550 2.877 1.00 0.00 N ATOM 1834 CA CYS A 119 1.280 12.941 2.558 1.00 0.00 C ATOM 1835 C CYS A 119 1.258 13.795 3.821 1.00 0.00 C ATOM 1836 O CYS A 119 0.960 13.306 4.909 1.00 0.00 O ATOM 1837 CB CYS A 119 -0.066 13.038 1.838 1.00 0.00 C ATOM 1838 SG CYS A 119 -0.223 14.479 0.758 1.00 0.00 S ATOM 0 H CYS A 119 0.990 10.869 2.404 1.00 0.00 H new ATOM 0 HA CYS A 119 2.063 13.318 1.900 1.00 0.00 H new ATOM 0 HB2 CYS A 119 -0.215 12.135 1.245 1.00 0.00 H new ATOM 0 HB3 CYS A 119 -0.862 13.066 2.582 1.00 0.00 H new ATOM 0 HG CYS A 119 -1.394 14.472 0.192 1.00 0.00 H new ATOM 1844 N GLY A 120 1.577 15.077 3.668 1.00 0.00 N ATOM 1845 CA GLY A 120 1.589 15.979 4.804 1.00 0.00 C ATOM 1846 C GLY A 120 2.889 15.915 5.582 1.00 0.00 C ATOM 1847 O GLY A 120 3.115 14.980 6.352 1.00 0.00 O ATOM 0 H GLY A 120 1.827 15.506 2.777 1.00 0.00 H new ATOM 0 HA2 GLY A 120 1.428 16.999 4.456 1.00 0.00 H new ATOM 0 HA3 GLY A 120 0.760 15.734 5.467 1.00 0.00 H new ATOM 1851 N LEU A 121 3.747 16.909 5.381 1.00 0.00 N ATOM 1852 CA LEU A 121 5.033 16.960 6.068 1.00 0.00 C ATOM 1853 C LEU A 121 4.848 16.843 7.577 1.00 0.00 C ATOM 1854 O LEU A 121 5.554 16.084 8.242 1.00 0.00 O ATOM 1855 CB LEU A 121 5.761 18.262 5.731 1.00 0.00 C ATOM 1856 CG LEU A 121 7.273 18.265 5.962 1.00 0.00 C ATOM 1857 CD1 LEU A 121 7.618 17.534 7.250 1.00 0.00 C ATOM 1858 CD2 LEU A 121 7.994 17.634 4.779 1.00 0.00 C ATOM 0 H LEU A 121 3.576 17.690 4.748 1.00 0.00 H new ATOM 0 HA LEU A 121 5.634 16.117 5.728 1.00 0.00 H new ATOM 0 HB2 LEU A 121 5.573 18.499 4.684 1.00 0.00 H new ATOM 0 HB3 LEU A 121 5.322 19.064 6.323 1.00 0.00 H new ATOM 0 HG LEU A 121 7.605 19.299 6.055 1.00 0.00 H new ATOM 0 HD11 LEU A 121 8.698 17.547 7.397 1.00 0.00 H new ATOM 0 HD12 LEU A 121 7.131 18.029 8.091 1.00 0.00 H new ATOM 0 HD13 LEU A 121 7.272 16.502 7.187 1.00 0.00 H new ATOM 0 HD21 LEU A 121 9.069 17.644 4.960 1.00 0.00 H new ATOM 0 HD22 LEU A 121 7.657 16.605 4.654 1.00 0.00 H new ATOM 0 HD23 LEU A 121 7.773 18.200 3.874 1.00 0.00 H new ATOM 1870 N ASP A 122 3.894 17.597 8.112 1.00 0.00 N ATOM 1871 CA ASP A 122 3.614 17.576 9.543 1.00 0.00 C ATOM 1872 C ASP A 122 2.548 16.536 9.872 1.00 0.00 C ATOM 1873 O ASP A 122 2.768 15.645 10.693 1.00 0.00 O ATOM 1874 CB ASP A 122 3.161 18.958 10.016 1.00 0.00 C ATOM 1875 CG ASP A 122 2.931 19.010 11.514 1.00 0.00 C ATOM 1876 OD1 ASP A 122 2.143 18.185 12.023 1.00 0.00 O ATOM 1877 OD2 ASP A 122 3.539 19.876 12.177 1.00 0.00 O ATOM 0 H ASP A 122 3.301 18.231 7.576 1.00 0.00 H new ATOM 0 HA ASP A 122 4.532 17.306 10.065 1.00 0.00 H new ATOM 0 HB2 ASP A 122 3.913 19.698 9.741 1.00 0.00 H new ATOM 0 HB3 ASP A 122 2.241 19.232 9.500 1.00 0.00 H new ATOM 1882 N ARG A 123 1.391 16.658 9.228 1.00 0.00 N ATOM 1883 CA ARG A 123 0.290 15.730 9.455 1.00 0.00 C ATOM 1884 C ARG A 123 0.812 14.325 9.741 1.00 0.00 C ATOM 1885 O ARG A 123 0.733 13.840 10.871 1.00 0.00 O ATOM 1886 CB ARG A 123 -0.639 15.702 8.239 1.00 0.00 C ATOM 1887 CG ARG A 123 -2.102 15.489 8.596 1.00 0.00 C ATOM 1888 CD ARG A 123 -2.579 16.507 9.619 1.00 0.00 C ATOM 1889 NE ARG A 123 -2.415 16.025 10.988 1.00 0.00 N ATOM 1890 CZ ARG A 123 -2.528 16.803 12.059 1.00 0.00 C ATOM 1891 NH1 ARG A 123 -2.804 18.092 11.921 1.00 0.00 N ATOM 1892 NH2 ARG A 123 -2.365 16.291 13.272 1.00 0.00 N ATOM 0 H ARG A 123 1.193 17.390 8.546 1.00 0.00 H new ATOM 0 HA ARG A 123 -0.269 16.075 10.325 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -0.539 16.641 7.694 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -0.318 14.907 7.565 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -2.712 15.563 7.696 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -2.238 14.483 8.992 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -2.023 17.436 9.493 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -3.629 16.737 9.439 1.00 0.00 H new ATOM 0 HE ARG A 123 -2.202 15.038 11.129 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -2.930 18.490 10.990 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -2.890 18.686 12.746 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -2.153 15.299 13.383 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -2.452 16.889 14.094 1.00 0.00 H new ATOM 1906 N LEU A 124 1.345 13.676 8.712 1.00 0.00 N ATOM 1907 CA LEU A 124 1.880 12.327 8.852 1.00 0.00 C ATOM 1908 C LEU A 124 3.385 12.308 8.599 1.00 0.00 C ATOM 1909 O LEU A 124 3.937 13.242 8.019 1.00 0.00 O ATOM 1910 CB LEU A 124 1.177 11.374 7.883 1.00 0.00 C ATOM 1911 CG LEU A 124 -0.350 11.351 7.955 1.00 0.00 C ATOM 1912 CD1 LEU A 124 -0.915 10.334 6.976 1.00 0.00 C ATOM 1913 CD2 LEU A 124 -0.813 11.045 9.372 1.00 0.00 C ATOM 0 H LEU A 124 1.418 14.063 7.771 1.00 0.00 H new ATOM 0 HA LEU A 124 1.698 11.996 9.874 1.00 0.00 H new ATOM 0 HB2 LEU A 124 1.469 11.640 6.867 1.00 0.00 H new ATOM 0 HB3 LEU A 124 1.545 10.364 8.066 1.00 0.00 H new ATOM 0 HG LEU A 124 -0.723 12.337 7.678 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -2.003 10.332 7.041 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -0.613 10.598 5.962 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -0.535 9.342 7.221 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -1.902 11.033 9.404 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -0.430 10.071 9.678 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -0.439 11.811 10.051 1.00 0.00 H new ATOM 1925 N GLN A 125 4.040 11.238 9.037 1.00 0.00 N ATOM 1926 CA GLN A 125 5.480 11.098 8.856 1.00 0.00 C ATOM 1927 C GLN A 125 5.851 9.653 8.539 1.00 0.00 C ATOM 1928 O GLN A 125 5.370 8.722 9.185 1.00 0.00 O ATOM 1929 CB GLN A 125 6.220 11.563 10.112 1.00 0.00 C ATOM 1930 CG GLN A 125 6.097 13.055 10.373 1.00 0.00 C ATOM 1931 CD GLN A 125 6.928 13.886 9.415 1.00 0.00 C ATOM 1932 OE1 GLN A 125 6.760 13.804 8.198 1.00 0.00 O ATOM 1933 NE2 GLN A 125 7.831 14.692 9.961 1.00 0.00 N ATOM 0 H GLN A 125 3.597 10.456 9.519 1.00 0.00 H new ATOM 0 HA GLN A 125 5.778 11.723 8.014 1.00 0.00 H new ATOM 0 HB2 GLN A 125 5.834 11.019 10.974 1.00 0.00 H new ATOM 0 HB3 GLN A 125 7.275 11.305 10.019 1.00 0.00 H new ATOM 0 HG2 GLN A 125 5.051 13.349 10.290 1.00 0.00 H new ATOM 0 HG3 GLN A 125 6.408 13.268 11.396 1.00 0.00 H new ATOM 0 HE21 GLN A 125 7.936 14.728 10.975 1.00 0.00 H new ATOM 0 HE22 GLN A 125 8.420 15.275 9.366 1.00 0.00 H new ATOM 1942 N TRP A 126 6.707 9.474 7.540 1.00 0.00 N ATOM 1943 CA TRP A 126 7.142 8.141 7.136 1.00 0.00 C ATOM 1944 C TRP A 126 7.591 7.326 8.344 1.00 0.00 C ATOM 1945 O TRP A 126 7.285 6.139 8.451 1.00 0.00 O ATOM 1946 CB TRP A 126 8.281 8.240 6.120 1.00 0.00 C ATOM 1947 CG TRP A 126 8.840 6.907 5.723 1.00 0.00 C ATOM 1948 CD1 TRP A 126 10.114 6.459 5.927 1.00 0.00 C ATOM 1949 CD2 TRP A 126 8.143 5.852 5.051 1.00 0.00 C ATOM 1950 NE1 TRP A 126 10.251 5.188 5.422 1.00 0.00 N ATOM 1951 CE2 TRP A 126 9.056 4.793 4.881 1.00 0.00 C ATOM 1952 CE3 TRP A 126 6.837 5.697 4.579 1.00 0.00 C ATOM 1953 CZ2 TRP A 126 8.703 3.599 4.258 1.00 0.00 C ATOM 1954 CZ3 TRP A 126 6.488 4.512 3.961 1.00 0.00 C ATOM 1955 CH2 TRP A 126 7.417 3.475 3.805 1.00 0.00 C ATOM 0 H TRP A 126 7.114 10.234 6.995 1.00 0.00 H new ATOM 0 HA TRP A 126 6.295 7.634 6.673 1.00 0.00 H new ATOM 0 HB2 TRP A 126 7.920 8.755 5.229 1.00 0.00 H new ATOM 0 HB3 TRP A 126 9.080 8.851 6.539 1.00 0.00 H new ATOM 0 HD1 TRP A 126 10.898 7.021 6.413 1.00 0.00 H new ATOM 0 HE1 TRP A 126 11.104 4.629 5.446 1.00 0.00 H new ATOM 0 HE3 TRP A 126 6.113 6.490 4.695 1.00 0.00 H new ATOM 0 HZ2 TRP A 126 9.418 2.799 4.136 1.00 0.00 H new ATOM 0 HZ3 TRP A 126 5.481 4.383 3.592 1.00 0.00 H new ATOM 0 HH2 TRP A 126 7.113 2.560 3.318 1.00 0.00 H new ATOM 1966 N GLU A 127 8.318 7.971 9.251 1.00 0.00 N ATOM 1967 CA GLU A 127 8.809 7.303 10.451 1.00 0.00 C ATOM 1968 C GLU A 127 7.698 6.499 11.119 1.00 0.00 C ATOM 1969 O GLU A 127 7.923 5.389 11.599 1.00 0.00 O ATOM 1970 CB GLU A 127 9.376 8.328 11.436 1.00 0.00 C ATOM 1971 CG GLU A 127 10.292 7.721 12.485 1.00 0.00 C ATOM 1972 CD GLU A 127 11.335 8.701 12.986 1.00 0.00 C ATOM 1973 OE1 GLU A 127 10.956 9.831 13.360 1.00 0.00 O ATOM 1974 OE2 GLU A 127 12.530 8.339 13.004 1.00 0.00 O ATOM 0 H GLU A 127 8.580 8.954 9.178 1.00 0.00 H new ATOM 0 HA GLU A 127 9.603 6.617 10.155 1.00 0.00 H new ATOM 0 HB2 GLU A 127 9.926 9.087 10.881 1.00 0.00 H new ATOM 0 HB3 GLU A 127 8.550 8.835 11.936 1.00 0.00 H new ATOM 0 HG2 GLU A 127 9.693 7.372 13.326 1.00 0.00 H new ATOM 0 HG3 GLU A 127 10.791 6.848 12.065 1.00 0.00 H new ATOM 1981 N ASN A 128 6.498 7.070 11.147 1.00 0.00 N ATOM 1982 CA ASN A 128 5.351 6.408 11.758 1.00 0.00 C ATOM 1983 C ASN A 128 4.805 5.313 10.846 1.00 0.00 C ATOM 1984 O ASN A 128 4.622 4.171 11.269 1.00 0.00 O ATOM 1985 CB ASN A 128 4.251 7.426 12.064 1.00 0.00 C ATOM 1986 CG ASN A 128 4.538 8.227 13.319 1.00 0.00 C ATOM 1987 OD1 ASN A 128 5.057 9.436 13.144 1.00 0.00 O flip ATOM 1988 ND2 ASN A 128 4.295 7.763 14.434 1.00 0.00 N flip ATOM 0 H ASN A 128 6.295 7.989 10.754 1.00 0.00 H new ATOM 0 HA ASN A 128 5.682 5.949 12.690 1.00 0.00 H new ATOM 0 HB2 ASN A 128 4.144 8.106 11.219 1.00 0.00 H new ATOM 0 HB3 ASN A 128 3.300 6.906 12.178 1.00 0.00 H new ATOM 0 HD21 ASN A 128 3.896 6.828 14.522 1.00 0.00 H new ATOM 0 HD22 ASN A 128 4.493 8.313 15.270 1.00 0.00 H new ATOM 1995 N VAL A 129 4.549 5.668 9.591 1.00 0.00 N ATOM 1996 CA VAL A 129 4.027 4.716 8.618 1.00 0.00 C ATOM 1997 C VAL A 129 4.922 3.487 8.517 1.00 0.00 C ATOM 1998 O VAL A 129 4.494 2.369 8.805 1.00 0.00 O ATOM 1999 CB VAL A 129 3.893 5.356 7.223 1.00 0.00 C ATOM 2000 CG1 VAL A 129 3.365 4.342 6.219 1.00 0.00 C ATOM 2001 CG2 VAL A 129 2.990 6.579 7.283 1.00 0.00 C ATOM 0 H VAL A 129 4.695 6.609 9.224 1.00 0.00 H new ATOM 0 HA VAL A 129 3.040 4.415 8.968 1.00 0.00 H new ATOM 0 HB VAL A 129 4.881 5.678 6.893 1.00 0.00 H new ATOM 0 HG11 VAL A 129 3.277 4.812 5.239 1.00 0.00 H new ATOM 0 HG12 VAL A 129 4.054 3.499 6.157 1.00 0.00 H new ATOM 0 HG13 VAL A 129 2.386 3.987 6.541 1.00 0.00 H new ATOM 0 HG21 VAL A 129 2.906 7.019 6.289 1.00 0.00 H new ATOM 0 HG22 VAL A 129 2.001 6.284 7.634 1.00 0.00 H new ATOM 0 HG23 VAL A 129 3.415 7.312 7.969 1.00 0.00 H new ATOM 2011 N SER A 130 6.168 3.701 8.107 1.00 0.00 N ATOM 2012 CA SER A 130 7.124 2.609 7.965 1.00 0.00 C ATOM 2013 C SER A 130 6.939 1.577 9.073 1.00 0.00 C ATOM 2014 O SER A 130 7.006 0.372 8.831 1.00 0.00 O ATOM 2015 CB SER A 130 8.555 3.149 7.990 1.00 0.00 C ATOM 2016 OG SER A 130 8.849 3.756 9.236 1.00 0.00 O ATOM 0 H SER A 130 6.539 4.620 7.867 1.00 0.00 H new ATOM 0 HA SER A 130 6.943 2.124 7.006 1.00 0.00 H new ATOM 0 HB2 SER A 130 9.257 2.336 7.803 1.00 0.00 H new ATOM 0 HB3 SER A 130 8.687 3.875 7.188 1.00 0.00 H new ATOM 0 HG SER A 130 8.416 4.634 9.283 1.00 0.00 H new ATOM 2022 N ALA A 131 6.705 2.059 10.289 1.00 0.00 N ATOM 2023 CA ALA A 131 6.508 1.179 11.434 1.00 0.00 C ATOM 2024 C ALA A 131 5.256 0.325 11.262 1.00 0.00 C ATOM 2025 O ALA A 131 5.294 -0.891 11.444 1.00 0.00 O ATOM 2026 CB ALA A 131 6.420 1.994 12.716 1.00 0.00 C ATOM 0 H ALA A 131 6.647 3.054 10.507 1.00 0.00 H new ATOM 0 HA ALA A 131 7.366 0.510 11.499 1.00 0.00 H new ATOM 0 HB1 ALA A 131 6.273 1.324 13.563 1.00 0.00 H new ATOM 0 HB2 ALA A 131 7.344 2.556 12.854 1.00 0.00 H new ATOM 0 HB3 ALA A 131 5.580 2.686 12.650 1.00 0.00 H new ATOM 2032 N MET A 132 4.149 0.970 10.910 1.00 0.00 N ATOM 2033 CA MET A 132 2.886 0.268 10.712 1.00 0.00 C ATOM 2034 C MET A 132 3.062 -0.908 9.757 1.00 0.00 C ATOM 2035 O MET A 132 2.382 -1.927 9.881 1.00 0.00 O ATOM 2036 CB MET A 132 1.825 1.227 10.169 1.00 0.00 C ATOM 2037 CG MET A 132 1.034 1.936 11.257 1.00 0.00 C ATOM 2038 SD MET A 132 1.955 3.286 12.018 1.00 0.00 S ATOM 2039 CE MET A 132 0.808 4.644 11.801 1.00 0.00 C ATOM 0 H MET A 132 4.101 1.977 10.756 1.00 0.00 H new ATOM 0 HA MET A 132 2.557 -0.117 11.677 1.00 0.00 H new ATOM 0 HB2 MET A 132 2.309 1.973 9.539 1.00 0.00 H new ATOM 0 HB3 MET A 132 1.136 0.671 9.533 1.00 0.00 H new ATOM 0 HG2 MET A 132 0.109 2.326 10.832 1.00 0.00 H new ATOM 0 HG3 MET A 132 0.753 1.215 12.025 1.00 0.00 H new ATOM 0 HE1 MET A 132 0.921 5.350 12.623 1.00 0.00 H new ATOM 0 HE2 MET A 132 1.016 5.149 10.858 1.00 0.00 H new ATOM 0 HE3 MET A 132 -0.212 4.260 11.789 1.00 0.00 H new ATOM 2049 N ILE A 133 3.976 -0.759 8.804 1.00 0.00 N ATOM 2050 CA ILE A 133 4.241 -1.810 7.829 1.00 0.00 C ATOM 2051 C ILE A 133 4.980 -2.980 8.469 1.00 0.00 C ATOM 2052 O ILE A 133 4.887 -4.115 8.002 1.00 0.00 O ATOM 2053 CB ILE A 133 5.068 -1.282 6.642 1.00 0.00 C ATOM 2054 CG1 ILE A 133 4.327 -0.140 5.944 1.00 0.00 C ATOM 2055 CG2 ILE A 133 5.364 -2.406 5.661 1.00 0.00 C ATOM 2056 CD1 ILE A 133 5.202 0.666 5.010 1.00 0.00 C ATOM 0 H ILE A 133 4.545 0.079 8.686 1.00 0.00 H new ATOM 0 HA ILE A 133 3.273 -2.152 7.463 1.00 0.00 H new ATOM 0 HB ILE A 133 6.015 -0.898 7.021 1.00 0.00 H new ATOM 0 HG12 ILE A 133 3.490 -0.552 5.380 1.00 0.00 H new ATOM 0 HG13 ILE A 133 3.906 0.524 6.699 1.00 0.00 H new ATOM 0 HG21 ILE A 133 5.949 -2.017 4.828 1.00 0.00 H new ATOM 0 HG22 ILE A 133 5.928 -3.190 6.166 1.00 0.00 H new ATOM 0 HG23 ILE A 133 4.427 -2.817 5.286 1.00 0.00 H new ATOM 0 HD11 ILE A 133 4.611 1.458 4.550 1.00 0.00 H new ATOM 0 HD12 ILE A 133 6.025 1.107 5.572 1.00 0.00 H new ATOM 0 HD13 ILE A 133 5.602 0.014 4.233 1.00 0.00 H new ATOM 2068 N GLU A 134 5.713 -2.696 9.541 1.00 0.00 N ATOM 2069 CA GLU A 134 6.467 -3.726 10.245 1.00 0.00 C ATOM 2070 C GLU A 134 5.598 -4.417 11.292 1.00 0.00 C ATOM 2071 O GLU A 134 5.758 -5.608 11.557 1.00 0.00 O ATOM 2072 CB GLU A 134 7.702 -3.118 10.913 1.00 0.00 C ATOM 2073 CG GLU A 134 8.476 -2.169 10.013 1.00 0.00 C ATOM 2074 CD GLU A 134 9.950 -2.104 10.363 1.00 0.00 C ATOM 2075 OE1 GLU A 134 10.497 -3.132 10.816 1.00 0.00 O ATOM 2076 OE2 GLU A 134 10.556 -1.027 10.185 1.00 0.00 O ATOM 0 H GLU A 134 5.801 -1.762 9.941 1.00 0.00 H new ATOM 0 HA GLU A 134 6.786 -4.469 9.515 1.00 0.00 H new ATOM 0 HB2 GLU A 134 7.393 -2.583 11.811 1.00 0.00 H new ATOM 0 HB3 GLU A 134 8.364 -3.922 11.234 1.00 0.00 H new ATOM 0 HG2 GLU A 134 8.366 -2.487 8.976 1.00 0.00 H new ATOM 0 HG3 GLU A 134 8.044 -1.171 10.087 1.00 0.00 H new ATOM 2083 N GLU A 135 4.678 -3.660 11.882 1.00 0.00 N ATOM 2084 CA GLU A 135 3.785 -4.200 12.901 1.00 0.00 C ATOM 2085 C GLU A 135 2.615 -4.941 12.260 1.00 0.00 C ATOM 2086 O GLU A 135 1.949 -5.750 12.907 1.00 0.00 O ATOM 2087 CB GLU A 135 3.262 -3.077 13.798 1.00 0.00 C ATOM 2088 CG GLU A 135 2.170 -2.240 13.153 1.00 0.00 C ATOM 2089 CD GLU A 135 0.789 -2.839 13.338 1.00 0.00 C ATOM 2090 OE1 GLU A 135 0.696 -3.950 13.900 1.00 0.00 O ATOM 2091 OE2 GLU A 135 -0.197 -2.197 12.920 1.00 0.00 O ATOM 0 H GLU A 135 4.532 -2.673 11.672 1.00 0.00 H new ATOM 0 HA GLU A 135 4.351 -4.906 13.508 1.00 0.00 H new ATOM 0 HB2 GLU A 135 2.878 -3.510 14.721 1.00 0.00 H new ATOM 0 HB3 GLU A 135 4.092 -2.426 14.072 1.00 0.00 H new ATOM 0 HG2 GLU A 135 2.187 -1.237 13.579 1.00 0.00 H new ATOM 0 HG3 GLU A 135 2.378 -2.137 12.088 1.00 0.00 H new ATOM 2098 N VAL A 136 2.370 -4.658 10.985 1.00 0.00 N ATOM 2099 CA VAL A 136 1.281 -5.298 10.256 1.00 0.00 C ATOM 2100 C VAL A 136 1.749 -6.585 9.587 1.00 0.00 C ATOM 2101 O VAL A 136 1.046 -7.596 9.603 1.00 0.00 O ATOM 2102 CB VAL A 136 0.695 -4.359 9.184 1.00 0.00 C ATOM 2103 CG1 VAL A 136 -0.117 -5.148 8.169 1.00 0.00 C ATOM 2104 CG2 VAL A 136 -0.153 -3.275 9.832 1.00 0.00 C ATOM 0 H VAL A 136 2.910 -3.990 10.435 1.00 0.00 H new ATOM 0 HA VAL A 136 0.506 -5.532 10.986 1.00 0.00 H new ATOM 0 HB VAL A 136 1.519 -3.877 8.658 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -0.523 -4.468 7.420 1.00 0.00 H new ATOM 0 HG12 VAL A 136 0.524 -5.883 7.682 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -0.935 -5.659 8.676 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -0.559 -2.621 9.060 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -0.972 -3.735 10.385 1.00 0.00 H new ATOM 0 HG23 VAL A 136 0.463 -2.691 10.516 1.00 0.00 H new ATOM 2114 N PHE A 137 2.940 -6.542 9.001 1.00 0.00 N ATOM 2115 CA PHE A 137 3.503 -7.705 8.325 1.00 0.00 C ATOM 2116 C PHE A 137 4.372 -8.520 9.279 1.00 0.00 C ATOM 2117 O PHE A 137 4.897 -9.571 8.912 1.00 0.00 O ATOM 2118 CB PHE A 137 4.327 -7.269 7.113 1.00 0.00 C ATOM 2119 CG PHE A 137 3.497 -6.708 5.994 1.00 0.00 C ATOM 2120 CD1 PHE A 137 2.879 -5.475 6.122 1.00 0.00 C ATOM 2121 CD2 PHE A 137 3.335 -7.415 4.813 1.00 0.00 C ATOM 2122 CE1 PHE A 137 2.114 -4.957 5.094 1.00 0.00 C ATOM 2123 CE2 PHE A 137 2.571 -6.902 3.781 1.00 0.00 C ATOM 2124 CZ PHE A 137 1.961 -5.671 3.922 1.00 0.00 C ATOM 0 H PHE A 137 3.535 -5.714 8.980 1.00 0.00 H new ATOM 0 HA PHE A 137 2.678 -8.332 7.987 1.00 0.00 H new ATOM 0 HB2 PHE A 137 5.052 -6.519 7.428 1.00 0.00 H new ATOM 0 HB3 PHE A 137 4.893 -8.124 6.742 1.00 0.00 H new ATOM 0 HD1 PHE A 137 2.996 -4.912 7.036 1.00 0.00 H new ATOM 0 HD2 PHE A 137 3.811 -8.378 4.697 1.00 0.00 H new ATOM 0 HE1 PHE A 137 1.636 -3.995 5.207 1.00 0.00 H new ATOM 0 HE2 PHE A 137 2.451 -7.463 2.866 1.00 0.00 H new ATOM 0 HZ PHE A 137 1.365 -5.267 3.117 1.00 0.00 H new ATOM 2134 N GLU A 138 4.519 -8.026 10.504 1.00 0.00 N ATOM 2135 CA GLU A 138 5.326 -8.707 11.510 1.00 0.00 C ATOM 2136 C GLU A 138 5.076 -10.212 11.480 1.00 0.00 C ATOM 2137 O GLU A 138 5.987 -11.008 11.708 1.00 0.00 O ATOM 2138 CB GLU A 138 5.017 -8.156 12.903 1.00 0.00 C ATOM 2139 CG GLU A 138 3.868 -8.867 13.598 1.00 0.00 C ATOM 2140 CD GLU A 138 3.538 -8.261 14.948 1.00 0.00 C ATOM 2141 OE1 GLU A 138 4.253 -8.563 15.926 1.00 0.00 O ATOM 2142 OE2 GLU A 138 2.563 -7.483 15.026 1.00 0.00 O ATOM 0 H GLU A 138 4.090 -7.157 10.824 1.00 0.00 H new ATOM 0 HA GLU A 138 6.376 -8.525 11.280 1.00 0.00 H new ATOM 0 HB2 GLU A 138 5.910 -8.236 13.522 1.00 0.00 H new ATOM 0 HB3 GLU A 138 4.780 -7.095 12.821 1.00 0.00 H new ATOM 0 HG2 GLU A 138 2.984 -8.829 12.961 1.00 0.00 H new ATOM 0 HG3 GLU A 138 4.122 -9.919 13.729 1.00 0.00 H new ATOM 2149 N ALA A 139 3.835 -10.594 11.196 1.00 0.00 N ATOM 2150 CA ALA A 139 3.465 -12.003 11.134 1.00 0.00 C ATOM 2151 C ALA A 139 2.959 -12.377 9.745 1.00 0.00 C ATOM 2152 O ALA A 139 1.787 -12.709 9.568 1.00 0.00 O ATOM 2153 CB ALA A 139 2.410 -12.318 12.185 1.00 0.00 C ATOM 0 H ALA A 139 3.069 -9.948 11.005 1.00 0.00 H new ATOM 0 HA ALA A 139 4.356 -12.597 11.339 1.00 0.00 H new ATOM 0 HB1 ALA A 139 2.143 -13.373 12.128 1.00 0.00 H new ATOM 0 HB2 ALA A 139 2.807 -12.097 13.176 1.00 0.00 H new ATOM 0 HB3 ALA A 139 1.524 -11.709 12.005 1.00 0.00 H new ATOM 2159 N THR A 140 3.851 -12.321 8.761 1.00 0.00 N ATOM 2160 CA THR A 140 3.495 -12.652 7.387 1.00 0.00 C ATOM 2161 C THR A 140 4.698 -13.189 6.621 1.00 0.00 C ATOM 2162 O THR A 140 5.826 -13.155 7.114 1.00 0.00 O ATOM 2163 CB THR A 140 2.930 -11.428 6.642 1.00 0.00 C ATOM 2164 OG1 THR A 140 3.854 -10.337 6.723 1.00 0.00 O ATOM 2165 CG2 THR A 140 1.590 -11.009 7.227 1.00 0.00 C ATOM 0 H THR A 140 4.826 -12.049 8.890 1.00 0.00 H new ATOM 0 HA THR A 140 2.727 -13.423 7.437 1.00 0.00 H new ATOM 0 HB THR A 140 2.782 -11.702 5.597 1.00 0.00 H new ATOM 0 HG1 THR A 140 4.321 -10.367 7.584 1.00 0.00 H new ATOM 0 HG21 THR A 140 1.211 -10.143 6.685 1.00 0.00 H new ATOM 0 HG22 THR A 140 0.881 -11.832 7.138 1.00 0.00 H new ATOM 0 HG23 THR A 140 1.717 -10.752 8.279 1.00 0.00 H new ATOM 2173 N ASP A 141 4.452 -13.682 5.412 1.00 0.00 N ATOM 2174 CA ASP A 141 5.517 -14.225 4.576 1.00 0.00 C ATOM 2175 C ASP A 141 5.616 -13.461 3.259 1.00 0.00 C ATOM 2176 O ASP A 141 5.906 -14.043 2.213 1.00 0.00 O ATOM 2177 CB ASP A 141 5.273 -15.709 4.302 1.00 0.00 C ATOM 2178 CG ASP A 141 6.522 -16.423 3.824 1.00 0.00 C ATOM 2179 OD1 ASP A 141 7.629 -16.030 4.248 1.00 0.00 O ATOM 2180 OD2 ASP A 141 6.393 -17.374 3.026 1.00 0.00 O ATOM 0 H ASP A 141 3.525 -13.717 4.989 1.00 0.00 H new ATOM 0 HA ASP A 141 6.459 -14.113 5.112 1.00 0.00 H new ATOM 0 HB2 ASP A 141 4.910 -16.188 5.211 1.00 0.00 H new ATOM 0 HB3 ASP A 141 4.489 -15.813 3.552 1.00 0.00 H new ATOM 2185 N ILE A 142 5.374 -12.156 3.319 1.00 0.00 N ATOM 2186 CA ILE A 142 5.436 -11.313 2.131 1.00 0.00 C ATOM 2187 C ILE A 142 6.558 -10.286 2.244 1.00 0.00 C ATOM 2188 O ILE A 142 6.755 -9.679 3.297 1.00 0.00 O ATOM 2189 CB ILE A 142 4.104 -10.578 1.891 1.00 0.00 C ATOM 2190 CG1 ILE A 142 2.944 -11.575 1.869 1.00 0.00 C ATOM 2191 CG2 ILE A 142 4.159 -9.792 0.590 1.00 0.00 C ATOM 2192 CD1 ILE A 142 1.624 -10.975 2.303 1.00 0.00 C ATOM 0 H ILE A 142 5.133 -11.660 4.177 1.00 0.00 H new ATOM 0 HA ILE A 142 5.634 -11.973 1.286 1.00 0.00 H new ATOM 0 HB ILE A 142 3.940 -9.876 2.709 1.00 0.00 H new ATOM 0 HG12 ILE A 142 2.838 -11.975 0.861 1.00 0.00 H new ATOM 0 HG13 ILE A 142 3.184 -12.415 2.521 1.00 0.00 H new ATOM 0 HG21 ILE A 142 3.210 -9.278 0.435 1.00 0.00 H new ATOM 0 HG22 ILE A 142 4.964 -9.059 0.641 1.00 0.00 H new ATOM 0 HG23 ILE A 142 4.342 -10.474 -0.240 1.00 0.00 H new ATOM 0 HD11 ILE A 142 0.847 -11.738 2.263 1.00 0.00 H new ATOM 0 HD12 ILE A 142 1.712 -10.600 3.323 1.00 0.00 H new ATOM 0 HD13 ILE A 142 1.361 -10.154 1.636 1.00 0.00 H new ATOM 2204 N LYS A 143 7.289 -10.093 1.151 1.00 0.00 N ATOM 2205 CA LYS A 143 8.389 -9.137 1.125 1.00 0.00 C ATOM 2206 C LYS A 143 7.966 -7.840 0.442 1.00 0.00 C ATOM 2207 O LYS A 143 7.230 -7.859 -0.544 1.00 0.00 O ATOM 2208 CB LYS A 143 9.596 -9.737 0.401 1.00 0.00 C ATOM 2209 CG LYS A 143 10.189 -10.945 1.105 1.00 0.00 C ATOM 2210 CD LYS A 143 11.131 -10.532 2.223 1.00 0.00 C ATOM 2211 CE LYS A 143 12.489 -10.110 1.682 1.00 0.00 C ATOM 2212 NZ LYS A 143 13.172 -9.146 2.588 1.00 0.00 N ATOM 0 H LYS A 143 7.139 -10.587 0.271 1.00 0.00 H new ATOM 0 HA LYS A 143 8.666 -8.911 2.155 1.00 0.00 H new ATOM 0 HB2 LYS A 143 9.298 -10.025 -0.607 1.00 0.00 H new ATOM 0 HB3 LYS A 143 10.366 -8.972 0.300 1.00 0.00 H new ATOM 0 HG2 LYS A 143 9.387 -11.560 1.513 1.00 0.00 H new ATOM 0 HG3 LYS A 143 10.727 -11.560 0.383 1.00 0.00 H new ATOM 0 HD2 LYS A 143 10.691 -9.709 2.785 1.00 0.00 H new ATOM 0 HD3 LYS A 143 11.257 -11.362 2.919 1.00 0.00 H new ATOM 0 HE2 LYS A 143 13.117 -10.991 1.550 1.00 0.00 H new ATOM 0 HE3 LYS A 143 12.363 -9.657 0.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 14.094 -8.883 2.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 12.585 -8.294 2.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 13.315 -9.586 3.519 1.00 0.00 H new ATOM 2226 N ILE A 144 8.438 -6.717 0.973 1.00 0.00 N ATOM 2227 CA ILE A 144 8.111 -5.412 0.412 1.00 0.00 C ATOM 2228 C ILE A 144 9.374 -4.625 0.077 1.00 0.00 C ATOM 2229 O ILE A 144 10.408 -4.782 0.726 1.00 0.00 O ATOM 2230 CB ILE A 144 7.246 -4.584 1.381 1.00 0.00 C ATOM 2231 CG1 ILE A 144 5.847 -5.192 1.497 1.00 0.00 C ATOM 2232 CG2 ILE A 144 7.165 -3.138 0.915 1.00 0.00 C ATOM 2233 CD1 ILE A 144 5.125 -4.809 2.770 1.00 0.00 C ATOM 0 H ILE A 144 9.048 -6.685 1.790 1.00 0.00 H new ATOM 0 HA ILE A 144 7.546 -5.594 -0.502 1.00 0.00 H new ATOM 0 HB ILE A 144 7.712 -4.602 2.366 1.00 0.00 H new ATOM 0 HG12 ILE A 144 5.250 -4.876 0.641 1.00 0.00 H new ATOM 0 HG13 ILE A 144 5.926 -6.278 1.447 1.00 0.00 H new ATOM 0 HG21 ILE A 144 6.550 -2.566 1.610 1.00 0.00 H new ATOM 0 HG22 ILE A 144 8.167 -2.710 0.880 1.00 0.00 H new ATOM 0 HG23 ILE A 144 6.719 -3.100 -0.079 1.00 0.00 H new ATOM 0 HD11 ILE A 144 4.140 -5.276 2.784 1.00 0.00 H new ATOM 0 HD12 ILE A 144 5.700 -5.149 3.631 1.00 0.00 H new ATOM 0 HD13 ILE A 144 5.014 -3.726 2.813 1.00 0.00 H new ATOM 2245 N THR A 145 9.282 -3.776 -0.942 1.00 0.00 N ATOM 2246 CA THR A 145 10.416 -2.963 -1.364 1.00 0.00 C ATOM 2247 C THR A 145 9.982 -1.537 -1.683 1.00 0.00 C ATOM 2248 O THR A 145 8.989 -1.320 -2.377 1.00 0.00 O ATOM 2249 CB THR A 145 11.109 -3.566 -2.601 1.00 0.00 C ATOM 2250 OG1 THR A 145 11.352 -4.962 -2.395 1.00 0.00 O ATOM 2251 CG2 THR A 145 12.423 -2.853 -2.885 1.00 0.00 C ATOM 0 H THR A 145 8.434 -3.634 -1.490 1.00 0.00 H new ATOM 0 HA THR A 145 11.121 -2.947 -0.533 1.00 0.00 H new ATOM 0 HB THR A 145 10.450 -3.436 -3.459 1.00 0.00 H new ATOM 0 HG1 THR A 145 11.791 -5.338 -3.186 1.00 0.00 H new ATOM 0 HG21 THR A 145 12.895 -3.295 -3.762 1.00 0.00 H new ATOM 0 HG22 THR A 145 12.231 -1.796 -3.070 1.00 0.00 H new ATOM 0 HG23 THR A 145 13.086 -2.956 -2.026 1.00 0.00 H new ATOM 2259 N VAL A 146 10.733 -0.567 -1.171 1.00 0.00 N ATOM 2260 CA VAL A 146 10.427 0.840 -1.404 1.00 0.00 C ATOM 2261 C VAL A 146 11.447 1.477 -2.341 1.00 0.00 C ATOM 2262 O VAL A 146 12.646 1.477 -2.062 1.00 0.00 O ATOM 2263 CB VAL A 146 10.394 1.632 -0.083 1.00 0.00 C ATOM 2264 CG1 VAL A 146 10.119 3.104 -0.350 1.00 0.00 C ATOM 2265 CG2 VAL A 146 9.354 1.050 0.862 1.00 0.00 C ATOM 0 H VAL A 146 11.557 -0.729 -0.592 1.00 0.00 H new ATOM 0 HA VAL A 146 9.441 0.878 -1.867 1.00 0.00 H new ATOM 0 HB VAL A 146 11.371 1.550 0.394 1.00 0.00 H new ATOM 0 HG11 VAL A 146 10.099 3.648 0.595 1.00 0.00 H new ATOM 0 HG12 VAL A 146 10.904 3.511 -0.987 1.00 0.00 H new ATOM 0 HG13 VAL A 146 9.156 3.209 -0.849 1.00 0.00 H new ATOM 0 HG21 VAL A 146 9.345 1.622 1.790 1.00 0.00 H new ATOM 0 HG22 VAL A 146 8.370 1.100 0.395 1.00 0.00 H new ATOM 0 HG23 VAL A 146 9.601 0.011 1.079 1.00 0.00 H new ATOM 2275 N TYR A 147 10.962 2.019 -3.452 1.00 0.00 N ATOM 2276 CA TYR A 147 11.832 2.659 -4.433 1.00 0.00 C ATOM 2277 C TYR A 147 11.692 4.177 -4.377 1.00 0.00 C ATOM 2278 O TYR A 147 10.594 4.717 -4.518 1.00 0.00 O ATOM 2279 CB TYR A 147 11.504 2.156 -5.840 1.00 0.00 C ATOM 2280 CG TYR A 147 11.878 0.709 -6.069 1.00 0.00 C ATOM 2281 CD1 TYR A 147 11.003 -0.316 -5.733 1.00 0.00 C ATOM 2282 CD2 TYR A 147 13.106 0.368 -6.622 1.00 0.00 C ATOM 2283 CE1 TYR A 147 11.341 -1.640 -5.939 1.00 0.00 C ATOM 2284 CE2 TYR A 147 13.452 -0.953 -6.834 1.00 0.00 C ATOM 2285 CZ TYR A 147 12.566 -1.953 -6.490 1.00 0.00 C ATOM 2286 OH TYR A 147 12.906 -3.270 -6.699 1.00 0.00 O ATOM 0 H TYR A 147 9.972 2.028 -3.696 1.00 0.00 H new ATOM 0 HA TYR A 147 12.863 2.399 -4.192 1.00 0.00 H new ATOM 0 HB2 TYR A 147 10.436 2.279 -6.021 1.00 0.00 H new ATOM 0 HB3 TYR A 147 12.025 2.777 -6.569 1.00 0.00 H new ATOM 0 HD1 TYR A 147 10.042 -0.074 -5.303 1.00 0.00 H new ATOM 0 HD2 TYR A 147 13.802 1.149 -6.891 1.00 0.00 H new ATOM 0 HE1 TYR A 147 10.650 -2.425 -5.670 1.00 0.00 H new ATOM 0 HE2 TYR A 147 14.410 -1.201 -7.266 1.00 0.00 H new ATOM 0 HH TYR A 147 13.801 -3.318 -7.095 1.00 0.00 H new ATOM 2296 N THR A 148 12.813 4.861 -4.171 1.00 0.00 N ATOM 2297 CA THR A 148 12.818 6.316 -4.096 1.00 0.00 C ATOM 2298 C THR A 148 13.698 6.920 -5.184 1.00 0.00 C ATOM 2299 O THR A 148 14.903 6.672 -5.231 1.00 0.00 O ATOM 2300 CB THR A 148 13.312 6.806 -2.721 1.00 0.00 C ATOM 2301 OG1 THR A 148 14.615 6.278 -2.453 1.00 0.00 O ATOM 2302 CG2 THR A 148 12.351 6.385 -1.619 1.00 0.00 C ATOM 0 H THR A 148 13.730 4.430 -4.053 1.00 0.00 H new ATOM 0 HA THR A 148 11.789 6.643 -4.242 1.00 0.00 H new ATOM 0 HB THR A 148 13.359 7.895 -2.743 1.00 0.00 H new ATOM 0 HG1 THR A 148 15.095 6.147 -3.297 1.00 0.00 H new ATOM 0 HG21 THR A 148 12.721 6.742 -0.658 1.00 0.00 H new ATOM 0 HG22 THR A 148 11.367 6.813 -1.811 1.00 0.00 H new ATOM 0 HG23 THR A 148 12.276 5.298 -1.598 1.00 0.00 H new ATOM 2310 N LEU A 149 13.088 7.714 -6.058 1.00 0.00 N ATOM 2311 CA LEU A 149 13.817 8.355 -7.147 1.00 0.00 C ATOM 2312 C LEU A 149 13.614 9.866 -7.123 1.00 0.00 C ATOM 2313 O LEU A 149 12.884 10.391 -6.283 1.00 0.00 O ATOM 2314 CB LEU A 149 13.363 7.788 -8.494 1.00 0.00 C ATOM 2315 CG LEU A 149 12.059 8.356 -9.055 1.00 0.00 C ATOM 2316 CD1 LEU A 149 12.027 8.222 -10.570 1.00 0.00 C ATOM 2317 CD2 LEU A 149 10.860 7.658 -8.430 1.00 0.00 C ATOM 0 H LEU A 149 12.091 7.929 -6.034 1.00 0.00 H new ATOM 0 HA LEU A 149 14.879 8.148 -7.012 1.00 0.00 H new ATOM 0 HB2 LEU A 149 14.155 7.960 -9.223 1.00 0.00 H new ATOM 0 HB3 LEU A 149 13.252 6.708 -8.393 1.00 0.00 H new ATOM 0 HG LEU A 149 12.008 9.415 -8.803 1.00 0.00 H new ATOM 0 HD11 LEU A 149 11.092 8.631 -10.952 1.00 0.00 H new ATOM 0 HD12 LEU A 149 12.865 8.769 -11.001 1.00 0.00 H new ATOM 0 HD13 LEU A 149 12.101 7.170 -10.844 1.00 0.00 H new ATOM 0 HD21 LEU A 149 9.941 8.075 -8.841 1.00 0.00 H new ATOM 0 HD22 LEU A 149 10.904 6.591 -8.650 1.00 0.00 H new ATOM 0 HD23 LEU A 149 10.875 7.807 -7.350 1.00 0.00 H new TER 2329 LEU A 149