USER MOD reduce.3.24.130724 H: found=0, std=0, add=911, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 766 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 93 SER OG : rot -106:sc= 0.374 USER MOD Set 1.2: A 100 SER OG : rot 108:sc= 0.287 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (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 180:sc= 0 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 13 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 22 GLN : amide:sc= -1.36 X(o=-1.4,f=-1.8) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= -0.592 X(o=-0.59,f=-0.22) USER MOD Single : A 37 THR OG1 : rot 170:sc= -1.77 USER MOD Single : A 39 THR OG1 : rot -172:sc= -1.16 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= 1.16 K(o=1.2,f=-0.095) USER MOD Single : A 50 THR OG1 : rot 180:sc= -0.0857 USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot -149:sc= -1.55 USER MOD Single : A 55 GLN : amide:sc= -0.407 K(o=-0.41,f=-9.4!) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 157:sc= 0.0896 (180deg=0.0131) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 62 MET CE :methyl -106:sc= 0 (180deg=-0.483) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 HIS :FLIP no HD1:sc= -1.81 F(o=-5!,f=-1.8) USER MOD Single : A 71 TYR OH : rot -161:sc= 0.366 USER MOD Single : A 72 HIS : no HD1:sc= -0.553 X(o=-0.55,f=-0.085) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.0366 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0.506! USER MOD Single : A 85 ASN : amide:sc= -1.11 K(o=-1.1,f=-2.1) USER MOD Single : A 87 TYR OH : rot -5:sc= 0.0738 USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 ASN : amide:sc= -7.7! C(o=-7.7!,f=-11!) USER MOD Single : A 96 MET CE :methyl -145:sc= -3.22 (180deg=-3.52!) USER MOD Single : A 97 CYS SG : rot 43:sc= -0.0951 USER MOD Single : A 104 THR OG1 : rot 171:sc= 0.123 USER MOD Single : A 105 MET CE :methyl -170:sc= -2.01 (180deg=-2.75!) USER MOD Single : A 106 THR OG1 : rot 49:sc= 0.475 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 SER OG : rot -63:sc= 0.158 USER MOD Single : A 117 LYS NZ :NH3+ -152:sc= -0.0279 (180deg=-0.443) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -17.124 -34.632 28.546 1.00 0.00 N ATOM 2 CA GLY A 1 -18.345 -33.911 28.862 1.00 0.00 C ATOM 3 C GLY A 1 -18.603 -32.797 27.846 1.00 0.00 C ATOM 4 O GLY A 1 -18.924 -33.069 26.690 1.00 0.00 O ATOM 0 H1 GLY A 1 -16.972 -35.382 29.250 1.00 0.00 H new ATOM 0 H2 GLY A 1 -17.206 -35.056 27.600 1.00 0.00 H new ATOM 0 H3 GLY A 1 -16.319 -33.974 28.561 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -19.188 -34.602 28.871 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -18.271 -33.485 29.863 1.00 0.00 H new ATOM 8 N SER A 2 -18.453 -31.566 28.313 1.00 0.00 N ATOM 9 CA SER A 2 -18.666 -30.410 27.459 1.00 0.00 C ATOM 10 C SER A 2 -20.130 -30.348 27.017 1.00 0.00 C ATOM 11 O SER A 2 -20.660 -31.317 26.477 1.00 0.00 O ATOM 12 CB SER A 2 -17.744 -30.450 26.238 1.00 0.00 C ATOM 13 OG SER A 2 -17.952 -29.335 25.375 1.00 0.00 O ATOM 0 H SER A 2 -18.186 -31.344 29.272 1.00 0.00 H new ATOM 0 HA SER A 2 -18.428 -29.513 28.031 1.00 0.00 H new ATOM 0 HB2 SER A 2 -16.705 -30.464 26.568 1.00 0.00 H new ATOM 0 HB3 SER A 2 -17.915 -31.373 25.685 1.00 0.00 H new ATOM 0 HG SER A 2 -17.344 -29.396 24.609 1.00 0.00 H new ATOM 18 N SER A 3 -20.740 -29.199 27.264 1.00 0.00 N ATOM 19 CA SER A 3 -22.132 -28.998 26.899 1.00 0.00 C ATOM 20 C SER A 3 -22.448 -27.502 26.847 1.00 0.00 C ATOM 21 O SER A 3 -22.449 -26.828 27.875 1.00 0.00 O ATOM 22 CB SER A 3 -23.067 -29.704 27.882 1.00 0.00 C ATOM 23 OG SER A 3 -23.808 -30.748 27.257 1.00 0.00 O ATOM 0 H SER A 3 -20.296 -28.397 27.712 1.00 0.00 H new ATOM 0 HA SER A 3 -22.293 -29.432 25.912 1.00 0.00 H new ATOM 0 HB2 SER A 3 -22.483 -30.116 28.705 1.00 0.00 H new ATOM 0 HB3 SER A 3 -23.756 -28.978 28.312 1.00 0.00 H new ATOM 0 HG SER A 3 -24.392 -31.175 27.918 1.00 0.00 H new ATOM 28 N GLY A 4 -22.709 -27.025 25.637 1.00 0.00 N ATOM 29 CA GLY A 4 -23.026 -25.622 25.438 1.00 0.00 C ATOM 30 C GLY A 4 -23.533 -25.371 24.016 1.00 0.00 C ATOM 31 O GLY A 4 -24.114 -26.260 23.395 1.00 0.00 O ATOM 0 H GLY A 4 -22.707 -27.587 24.786 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -23.783 -25.311 26.158 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -22.140 -25.015 25.624 1.00 0.00 H new ATOM 35 N SER A 5 -23.295 -24.157 23.543 1.00 0.00 N ATOM 36 CA SER A 5 -23.720 -23.778 22.207 1.00 0.00 C ATOM 37 C SER A 5 -22.499 -23.566 21.309 1.00 0.00 C ATOM 38 O SER A 5 -21.430 -23.194 21.788 1.00 0.00 O ATOM 39 CB SER A 5 -24.580 -22.513 22.241 1.00 0.00 C ATOM 40 OG SER A 5 -25.870 -22.728 21.675 1.00 0.00 O ATOM 0 H SER A 5 -22.813 -23.423 24.062 1.00 0.00 H new ATOM 0 HA SER A 5 -24.327 -24.587 21.799 1.00 0.00 H new ATOM 0 HB2 SER A 5 -24.688 -22.176 23.272 1.00 0.00 H new ATOM 0 HB3 SER A 5 -24.074 -21.716 21.697 1.00 0.00 H new ATOM 0 HG SER A 5 -26.388 -21.897 21.717 1.00 0.00 H new ATOM 45 N SER A 6 -22.701 -23.812 20.023 1.00 0.00 N ATOM 46 CA SER A 6 -21.629 -23.652 19.055 1.00 0.00 C ATOM 47 C SER A 6 -22.202 -23.202 17.710 1.00 0.00 C ATOM 48 O SER A 6 -23.299 -23.609 17.331 1.00 0.00 O ATOM 49 CB SER A 6 -20.841 -24.953 18.887 1.00 0.00 C ATOM 50 OG SER A 6 -19.564 -24.731 18.294 1.00 0.00 O ATOM 0 H SER A 6 -23.590 -24.121 19.629 1.00 0.00 H new ATOM 0 HA SER A 6 -20.944 -22.889 19.425 1.00 0.00 H new ATOM 0 HB2 SER A 6 -20.711 -25.427 19.860 1.00 0.00 H new ATOM 0 HB3 SER A 6 -21.412 -25.646 18.269 1.00 0.00 H new ATOM 0 HG SER A 6 -19.092 -25.585 18.205 1.00 0.00 H new ATOM 55 N GLY A 7 -21.434 -22.368 17.025 1.00 0.00 N ATOM 56 CA GLY A 7 -21.852 -21.858 15.730 1.00 0.00 C ATOM 57 C GLY A 7 -21.916 -22.980 14.693 1.00 0.00 C ATOM 58 O GLY A 7 -22.719 -23.903 14.820 1.00 0.00 O ATOM 0 H GLY A 7 -20.524 -22.032 17.342 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -22.830 -21.385 15.820 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -21.156 -21.089 15.396 1.00 0.00 H new ATOM 62 N ALA A 8 -21.059 -22.866 13.689 1.00 0.00 N ATOM 63 CA ALA A 8 -21.008 -23.860 12.630 1.00 0.00 C ATOM 64 C ALA A 8 -22.417 -24.085 12.081 1.00 0.00 C ATOM 65 O ALA A 8 -22.962 -25.183 12.189 1.00 0.00 O ATOM 66 CB ALA A 8 -20.379 -25.146 13.168 1.00 0.00 C ATOM 0 H ALA A 8 -20.394 -22.100 13.586 1.00 0.00 H new ATOM 0 HA ALA A 8 -20.385 -23.513 11.806 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -20.340 -25.892 12.374 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -19.368 -24.937 13.519 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -20.979 -25.526 13.995 1.00 0.00 H new ATOM 72 N SER A 9 -22.969 -23.029 11.503 1.00 0.00 N ATOM 73 CA SER A 9 -24.306 -23.097 10.936 1.00 0.00 C ATOM 74 C SER A 9 -24.223 -23.382 9.435 1.00 0.00 C ATOM 75 O SER A 9 -23.608 -22.622 8.689 1.00 0.00 O ATOM 76 CB SER A 9 -25.078 -21.802 11.189 1.00 0.00 C ATOM 77 OG SER A 9 -26.488 -22.013 11.187 1.00 0.00 O ATOM 0 H SER A 9 -22.515 -22.120 11.415 1.00 0.00 H new ATOM 0 HA SER A 9 -24.844 -23.909 11.424 1.00 0.00 H new ATOM 0 HB2 SER A 9 -24.776 -21.381 12.148 1.00 0.00 H new ATOM 0 HB3 SER A 9 -24.820 -21.070 10.424 1.00 0.00 H new ATOM 0 HG SER A 9 -26.946 -21.163 11.354 1.00 0.00 H new ATOM 82 N ILE A 10 -24.851 -24.479 9.038 1.00 0.00 N ATOM 83 CA ILE A 10 -24.856 -24.873 7.640 1.00 0.00 C ATOM 84 C ILE A 10 -26.294 -24.853 7.114 1.00 0.00 C ATOM 85 O ILE A 10 -27.136 -25.624 7.571 1.00 0.00 O ATOM 86 CB ILE A 10 -24.155 -26.220 7.460 1.00 0.00 C ATOM 87 CG1 ILE A 10 -23.867 -26.496 5.982 1.00 0.00 C ATOM 88 CG2 ILE A 10 -24.961 -27.349 8.107 1.00 0.00 C ATOM 89 CD1 ILE A 10 -22.474 -27.102 5.800 1.00 0.00 C ATOM 0 H ILE A 10 -25.360 -25.107 9.660 1.00 0.00 H new ATOM 0 HA ILE A 10 -24.287 -24.161 7.042 1.00 0.00 H new ATOM 0 HB ILE A 10 -23.194 -26.175 7.973 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -24.619 -27.176 5.582 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -23.941 -25.569 5.414 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -24.440 -28.296 7.964 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -25.071 -27.152 9.173 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -25.946 -27.404 7.645 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -22.294 -27.289 4.741 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -21.723 -26.409 6.179 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -22.411 -28.041 6.350 1.00 0.00 H new ATOM 100 N ASP A 11 -26.529 -23.962 6.161 1.00 0.00 N ATOM 101 CA ASP A 11 -27.849 -23.832 5.569 1.00 0.00 C ATOM 102 C ASP A 11 -27.706 -23.444 4.095 1.00 0.00 C ATOM 103 O ASP A 11 -27.403 -22.295 3.779 1.00 0.00 O ATOM 104 CB ASP A 11 -28.661 -22.740 6.269 1.00 0.00 C ATOM 105 CG ASP A 11 -29.819 -23.248 7.130 1.00 0.00 C ATOM 106 OD1 ASP A 11 -30.716 -23.896 6.550 1.00 0.00 O ATOM 107 OD2 ASP A 11 -29.780 -22.974 8.350 1.00 0.00 O ATOM 0 H ASP A 11 -25.828 -23.324 5.785 1.00 0.00 H new ATOM 0 HA ASP A 11 -28.362 -24.788 5.676 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -27.989 -22.155 6.898 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -29.059 -22.063 5.513 1.00 0.00 H new ATOM 111 N ILE A 12 -27.931 -24.425 3.234 1.00 0.00 N ATOM 112 CA ILE A 12 -27.831 -24.201 1.802 1.00 0.00 C ATOM 113 C ILE A 12 -26.655 -23.264 1.518 1.00 0.00 C ATOM 114 O ILE A 12 -26.826 -22.047 1.464 1.00 0.00 O ATOM 115 CB ILE A 12 -29.165 -23.702 1.244 1.00 0.00 C ATOM 116 CG1 ILE A 12 -30.211 -24.818 1.241 1.00 0.00 C ATOM 117 CG2 ILE A 12 -28.981 -23.085 -0.145 1.00 0.00 C ATOM 118 CD1 ILE A 12 -31.599 -24.268 0.910 1.00 0.00 C ATOM 0 H ILE A 12 -28.182 -25.377 3.500 1.00 0.00 H new ATOM 0 HA ILE A 12 -27.625 -25.137 1.283 1.00 0.00 H new ATOM 0 HB ILE A 12 -29.537 -22.915 1.900 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -29.934 -25.579 0.511 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -30.232 -25.304 2.216 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -29.944 -22.738 -0.519 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -28.292 -22.243 -0.081 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -28.576 -23.834 -0.825 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -32.324 -25.082 0.915 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -31.883 -23.525 1.655 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -31.581 -23.804 -0.076 1.00 0.00 H new ATOM 129 N GLN A 13 -25.489 -23.867 1.343 1.00 0.00 N ATOM 130 CA GLN A 13 -24.285 -23.101 1.065 1.00 0.00 C ATOM 131 C GLN A 13 -23.469 -23.776 -0.039 1.00 0.00 C ATOM 132 O GLN A 13 -22.909 -24.853 0.168 1.00 0.00 O ATOM 133 CB GLN A 13 -23.448 -22.917 2.331 1.00 0.00 C ATOM 134 CG GLN A 13 -23.560 -21.486 2.861 1.00 0.00 C ATOM 135 CD GLN A 13 -23.148 -21.412 4.333 1.00 0.00 C ATOM 136 OE1 GLN A 13 -22.343 -22.189 4.818 1.00 0.00 O ATOM 137 NE2 GLN A 13 -23.742 -20.435 5.012 1.00 0.00 N ATOM 0 H GLN A 13 -25.352 -24.877 1.388 1.00 0.00 H new ATOM 0 HA GLN A 13 -24.580 -22.111 0.717 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -23.781 -23.619 3.096 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -22.404 -23.149 2.118 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -22.927 -20.825 2.269 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -24.585 -21.132 2.748 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -24.407 -19.820 4.544 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -23.533 -20.301 6.001 1.00 0.00 H new ATOM 144 N ILE A 14 -23.426 -23.117 -1.188 1.00 0.00 N ATOM 145 CA ILE A 14 -22.688 -23.641 -2.325 1.00 0.00 C ATOM 146 C ILE A 14 -21.608 -22.637 -2.730 1.00 0.00 C ATOM 147 O ILE A 14 -21.085 -21.908 -1.889 1.00 0.00 O ATOM 148 CB ILE A 14 -23.644 -24.009 -3.461 1.00 0.00 C ATOM 149 CG1 ILE A 14 -25.028 -24.371 -2.918 1.00 0.00 C ATOM 150 CG2 ILE A 14 -23.059 -25.124 -4.329 1.00 0.00 C ATOM 151 CD1 ILE A 14 -25.967 -24.795 -4.049 1.00 0.00 C ATOM 0 H ILE A 14 -23.890 -22.225 -1.356 1.00 0.00 H new ATOM 0 HA ILE A 14 -22.179 -24.567 -2.057 1.00 0.00 H new ATOM 0 HB ILE A 14 -23.768 -23.135 -4.100 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -24.938 -25.180 -2.193 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -25.451 -23.516 -2.391 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -23.758 -25.367 -5.129 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -22.115 -24.792 -4.761 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -22.887 -26.009 -3.717 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -26.944 -25.047 -3.636 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -26.074 -23.975 -4.760 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -25.553 -25.665 -4.559 1.00 0.00 H new ATOM 162 N ILE A 15 -21.304 -22.632 -4.020 1.00 0.00 N ATOM 163 CA ILE A 15 -20.295 -21.730 -4.549 1.00 0.00 C ATOM 164 C ILE A 15 -20.812 -20.293 -4.472 1.00 0.00 C ATOM 165 O ILE A 15 -21.963 -20.024 -4.814 1.00 0.00 O ATOM 166 CB ILE A 15 -19.876 -22.160 -5.956 1.00 0.00 C ATOM 167 CG1 ILE A 15 -21.098 -22.496 -6.813 1.00 0.00 C ATOM 168 CG2 ILE A 15 -18.878 -23.318 -5.903 1.00 0.00 C ATOM 169 CD1 ILE A 15 -20.987 -21.862 -8.201 1.00 0.00 C ATOM 0 H ILE A 15 -21.739 -23.239 -4.715 1.00 0.00 H new ATOM 0 HA ILE A 15 -19.389 -21.775 -3.945 1.00 0.00 H new ATOM 0 HB ILE A 15 -19.369 -21.321 -6.432 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -21.192 -23.578 -6.910 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -22.002 -22.141 -6.318 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -18.597 -23.603 -6.917 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -17.989 -23.007 -5.354 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -19.336 -24.170 -5.400 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -21.869 -22.117 -8.789 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -20.918 -20.779 -8.102 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -20.095 -22.238 -8.703 1.00 0.00 H new ATOM 180 N ASP A 16 -19.936 -19.405 -4.022 1.00 0.00 N ATOM 181 CA ASP A 16 -20.290 -18.002 -3.897 1.00 0.00 C ATOM 182 C ASP A 16 -19.083 -17.141 -4.272 1.00 0.00 C ATOM 183 O ASP A 16 -19.042 -15.952 -3.960 1.00 0.00 O ATOM 184 CB ASP A 16 -20.686 -17.660 -2.459 1.00 0.00 C ATOM 185 CG ASP A 16 -21.790 -18.538 -1.866 1.00 0.00 C ATOM 186 OD1 ASP A 16 -22.941 -18.393 -2.331 1.00 0.00 O ATOM 187 OD2 ASP A 16 -21.458 -19.333 -0.961 1.00 0.00 O ATOM 0 H ASP A 16 -18.982 -19.631 -3.740 1.00 0.00 H new ATOM 0 HA ASP A 16 -21.133 -17.807 -4.560 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -19.802 -17.738 -1.826 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -21.012 -16.620 -2.425 1.00 0.00 H new ATOM 191 N ARG A 17 -18.128 -17.774 -4.937 1.00 0.00 N ATOM 192 CA ARG A 17 -16.922 -17.081 -5.358 1.00 0.00 C ATOM 193 C ARG A 17 -16.222 -16.452 -4.152 1.00 0.00 C ATOM 194 O ARG A 17 -16.833 -16.274 -3.099 1.00 0.00 O ATOM 195 CB ARG A 17 -17.244 -15.988 -6.380 1.00 0.00 C ATOM 196 CG ARG A 17 -17.263 -16.555 -7.800 1.00 0.00 C ATOM 197 CD ARG A 17 -17.260 -15.432 -8.840 1.00 0.00 C ATOM 198 NE ARG A 17 -18.044 -15.838 -10.028 1.00 0.00 N ATOM 199 CZ ARG A 17 -19.349 -16.138 -9.999 1.00 0.00 C ATOM 200 NH1 ARG A 17 -20.026 -16.079 -8.845 1.00 0.00 N ATOM 201 NH2 ARG A 17 -19.978 -16.498 -11.127 1.00 0.00 N ATOM 0 H ARG A 17 -18.165 -18.760 -5.195 1.00 0.00 H new ATOM 0 HA ARG A 17 -16.263 -17.815 -5.822 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -18.212 -15.543 -6.149 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -16.503 -15.192 -6.312 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -16.395 -17.197 -7.951 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -18.147 -17.178 -7.935 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -17.683 -14.525 -8.408 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -16.236 -15.199 -9.132 1.00 0.00 H new ATOM 0 HE ARG A 17 -17.560 -15.893 -10.924 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -19.548 -15.805 -7.987 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -21.020 -16.308 -8.824 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -19.463 -16.543 -12.006 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -20.972 -16.727 -11.106 1.00 0.00 H new ATOM 212 N PRO A 18 -14.918 -16.123 -4.351 1.00 0.00 N ATOM 213 CA PRO A 18 -14.129 -15.517 -3.292 1.00 0.00 C ATOM 214 C PRO A 18 -14.507 -14.047 -3.100 1.00 0.00 C ATOM 215 O PRO A 18 -15.557 -13.605 -3.563 1.00 0.00 O ATOM 216 CB PRO A 18 -12.683 -15.707 -3.720 1.00 0.00 C ATOM 217 CG PRO A 18 -12.725 -15.994 -5.212 1.00 0.00 C ATOM 218 CD PRO A 18 -14.162 -16.318 -5.585 1.00 0.00 C ATOM 0 HA PRO A 18 -14.306 -15.977 -2.320 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -12.093 -14.815 -3.510 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -12.220 -16.531 -3.177 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -12.369 -15.132 -5.776 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -12.069 -16.829 -5.459 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -14.523 -15.663 -6.378 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -14.256 -17.341 -5.949 1.00 0.00 H new ATOM 223 N GLY A 19 -13.629 -13.329 -2.415 1.00 0.00 N ATOM 224 CA GLY A 19 -13.857 -11.916 -2.155 1.00 0.00 C ATOM 225 C GLY A 19 -12.575 -11.108 -2.361 1.00 0.00 C ATOM 226 O GLY A 19 -11.473 -11.650 -2.279 1.00 0.00 O ATOM 0 H GLY A 19 -12.759 -13.698 -2.032 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -14.638 -11.542 -2.817 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -14.215 -11.783 -1.134 1.00 0.00 H new ATOM 230 N PRO A 20 -12.765 -9.788 -2.632 1.00 0.00 N ATOM 231 CA PRO A 20 -11.637 -8.899 -2.850 1.00 0.00 C ATOM 232 C PRO A 20 -10.940 -8.563 -1.530 1.00 0.00 C ATOM 233 O PRO A 20 -11.423 -8.926 -0.459 1.00 0.00 O ATOM 234 CB PRO A 20 -12.226 -7.679 -3.539 1.00 0.00 C ATOM 235 CG PRO A 20 -13.721 -7.725 -3.262 1.00 0.00 C ATOM 236 CD PRO A 20 -14.055 -9.111 -2.737 1.00 0.00 C ATOM 0 HA PRO A 20 -10.858 -9.350 -3.465 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -11.785 -6.761 -3.151 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -12.026 -7.701 -4.610 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -13.998 -6.964 -2.533 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -14.284 -7.515 -4.171 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -14.555 -9.058 -1.770 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -14.726 -9.640 -3.414 1.00 0.00 H new ATOM 241 N PRO A 21 -9.785 -7.855 -1.654 1.00 0.00 N ATOM 242 CA PRO A 21 -9.017 -7.466 -0.484 1.00 0.00 C ATOM 243 C PRO A 21 -9.690 -6.306 0.254 1.00 0.00 C ATOM 244 O PRO A 21 -10.065 -5.309 -0.361 1.00 0.00 O ATOM 245 CB PRO A 21 -7.639 -7.110 -1.017 1.00 0.00 C ATOM 246 CG PRO A 21 -7.820 -6.866 -2.507 1.00 0.00 C ATOM 247 CD PRO A 21 -9.184 -7.408 -2.906 1.00 0.00 C ATOM 0 HA PRO A 21 -8.949 -8.262 0.257 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -7.245 -6.223 -0.521 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -6.930 -7.918 -0.837 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -7.752 -5.801 -2.730 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -7.032 -7.362 -3.074 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -9.791 -6.640 -3.385 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -9.091 -8.229 -3.616 1.00 0.00 H new ATOM 252 N GLN A 22 -9.823 -6.476 1.561 1.00 0.00 N ATOM 253 CA GLN A 22 -10.445 -5.455 2.389 1.00 0.00 C ATOM 254 C GLN A 22 -9.952 -4.066 1.978 1.00 0.00 C ATOM 255 O GLN A 22 -10.751 -3.149 1.799 1.00 0.00 O ATOM 256 CB GLN A 22 -10.178 -5.715 3.872 1.00 0.00 C ATOM 257 CG GLN A 22 -11.304 -6.541 4.496 1.00 0.00 C ATOM 258 CD GLN A 22 -11.675 -6.006 5.881 1.00 0.00 C ATOM 259 OE1 GLN A 22 -12.821 -6.030 6.297 1.00 0.00 O ATOM 260 NE2 GLN A 22 -10.643 -5.525 6.567 1.00 0.00 N ATOM 0 H GLN A 22 -9.511 -7.305 2.067 1.00 0.00 H new ATOM 0 HA GLN A 22 -11.523 -5.497 2.235 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -9.230 -6.240 3.988 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -10.083 -4.766 4.400 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -12.179 -6.518 3.847 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -10.994 -7.583 4.576 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -9.709 -5.536 6.158 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -10.785 -5.145 7.503 1.00 0.00 H new ATOM 267 N ILE A 23 -8.639 -3.956 1.840 1.00 0.00 N ATOM 268 CA ILE A 23 -8.031 -2.694 1.454 1.00 0.00 C ATOM 269 C ILE A 23 -6.686 -2.967 0.777 1.00 0.00 C ATOM 270 O ILE A 23 -6.143 -4.066 0.888 1.00 0.00 O ATOM 271 CB ILE A 23 -7.933 -1.756 2.659 1.00 0.00 C ATOM 272 CG1 ILE A 23 -8.027 -0.292 2.222 1.00 0.00 C ATOM 273 CG2 ILE A 23 -6.665 -2.032 3.468 1.00 0.00 C ATOM 274 CD1 ILE A 23 -6.644 0.360 2.190 1.00 0.00 C ATOM 0 H ILE A 23 -7.979 -4.720 1.989 1.00 0.00 H new ATOM 0 HA ILE A 23 -8.656 -2.177 0.726 1.00 0.00 H new ATOM 0 HB ILE A 23 -8.781 -1.952 3.315 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -8.484 -0.232 1.234 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -8.675 0.255 2.907 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -6.621 -1.351 4.318 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -6.679 -3.061 3.827 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -5.790 -1.881 2.836 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -6.739 1.400 1.876 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.200 0.320 3.185 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -6.006 -0.174 1.486 1.00 0.00 H new ATOM 285 N VAL A 24 -6.188 -1.949 0.092 1.00 0.00 N ATOM 286 CA VAL A 24 -4.917 -2.066 -0.604 1.00 0.00 C ATOM 287 C VAL A 24 -4.126 -0.767 -0.434 1.00 0.00 C ATOM 288 O VAL A 24 -4.568 0.295 -0.870 1.00 0.00 O ATOM 289 CB VAL A 24 -5.154 -2.434 -2.070 1.00 0.00 C ATOM 290 CG1 VAL A 24 -3.828 -2.626 -2.808 1.00 0.00 C ATOM 291 CG2 VAL A 24 -6.032 -3.681 -2.187 1.00 0.00 C ATOM 0 H VAL A 24 -6.641 -1.039 0.004 1.00 0.00 H new ATOM 0 HA VAL A 24 -4.319 -2.870 -0.174 1.00 0.00 H new ATOM 0 HB VAL A 24 -5.683 -1.606 -2.542 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -4.025 -2.887 -3.848 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -3.252 -1.701 -2.769 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -3.261 -3.427 -2.334 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -6.185 -3.921 -3.239 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -5.542 -4.519 -1.691 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -6.996 -3.493 -1.714 1.00 0.00 H new ATOM 301 N LYS A 25 -2.971 -0.894 0.201 1.00 0.00 N ATOM 302 CA LYS A 25 -2.114 0.257 0.435 1.00 0.00 C ATOM 303 C LYS A 25 -0.707 -0.048 -0.083 1.00 0.00 C ATOM 304 O LYS A 25 -0.413 -1.179 -0.463 1.00 0.00 O ATOM 305 CB LYS A 25 -2.153 0.663 1.909 1.00 0.00 C ATOM 306 CG LYS A 25 -1.826 -0.526 2.815 1.00 0.00 C ATOM 307 CD LYS A 25 -1.122 -0.063 4.092 1.00 0.00 C ATOM 308 CE LYS A 25 -2.120 0.098 5.241 1.00 0.00 C ATOM 309 NZ LYS A 25 -2.387 1.531 5.498 1.00 0.00 N ATOM 0 H LYS A 25 -2.608 -1.776 0.561 1.00 0.00 H new ATOM 0 HA LYS A 25 -2.477 1.123 -0.119 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -1.439 1.467 2.087 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -3.141 1.052 2.156 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -2.744 -1.055 3.072 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -1.190 -1.232 2.280 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -0.355 -0.785 4.371 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -0.616 0.885 3.909 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -3.051 -0.413 4.996 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -1.725 -0.372 6.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -3.066 1.623 6.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -1.499 2.009 5.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -2.784 1.969 4.642 1.00 0.00 H new ATOM 319 N ILE A 26 0.126 0.983 -0.079 1.00 0.00 N ATOM 320 CA ILE A 26 1.495 0.841 -0.543 1.00 0.00 C ATOM 321 C ILE A 26 2.453 1.096 0.622 1.00 0.00 C ATOM 322 O ILE A 26 2.646 2.239 1.033 1.00 0.00 O ATOM 323 CB ILE A 26 1.747 1.741 -1.755 1.00 0.00 C ATOM 324 CG1 ILE A 26 0.844 1.349 -2.926 1.00 0.00 C ATOM 325 CG2 ILE A 26 3.226 1.733 -2.145 1.00 0.00 C ATOM 326 CD1 ILE A 26 -0.080 2.504 -3.318 1.00 0.00 C ATOM 0 H ILE A 26 -0.122 1.920 0.238 1.00 0.00 H new ATOM 0 HA ILE A 26 1.676 -0.177 -0.888 1.00 0.00 H new ATOM 0 HB ILE A 26 1.492 2.764 -1.480 1.00 0.00 H new ATOM 0 HG12 ILE A 26 1.456 1.062 -3.781 1.00 0.00 H new ATOM 0 HG13 ILE A 26 0.248 0.478 -2.654 1.00 0.00 H new ATOM 0 HG21 ILE A 26 3.378 2.380 -3.009 1.00 0.00 H new ATOM 0 HG22 ILE A 26 3.825 2.096 -1.310 1.00 0.00 H new ATOM 0 HG23 ILE A 26 3.531 0.717 -2.395 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -0.711 2.198 -4.153 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -0.708 2.772 -2.468 1.00 0.00 H new ATOM 0 HD13 ILE A 26 0.519 3.365 -3.613 1.00 0.00 H new ATOM 337 N GLU A 27 3.029 0.012 1.121 1.00 0.00 N ATOM 338 CA GLU A 27 3.963 0.104 2.232 1.00 0.00 C ATOM 339 C GLU A 27 4.891 1.306 2.045 1.00 0.00 C ATOM 340 O GLU A 27 5.104 2.081 2.975 1.00 0.00 O ATOM 341 CB GLU A 27 4.763 -1.189 2.383 1.00 0.00 C ATOM 342 CG GLU A 27 4.638 -1.750 3.802 1.00 0.00 C ATOM 343 CD GLU A 27 5.867 -1.398 4.641 1.00 0.00 C ATOM 344 OE1 GLU A 27 6.921 -2.023 4.392 1.00 0.00 O ATOM 345 OE2 GLU A 27 5.725 -0.514 5.513 1.00 0.00 O ATOM 0 H GLU A 27 2.867 -0.935 0.777 1.00 0.00 H new ATOM 0 HA GLU A 27 3.394 0.248 3.150 1.00 0.00 H new ATOM 0 HB2 GLU A 27 4.407 -1.927 1.664 1.00 0.00 H new ATOM 0 HB3 GLU A 27 5.812 -1.001 2.154 1.00 0.00 H new ATOM 0 HG2 GLU A 27 3.742 -1.350 4.277 1.00 0.00 H new ATOM 0 HG3 GLU A 27 4.520 -2.833 3.760 1.00 0.00 H new ATOM 350 N ASP A 28 5.421 1.422 0.835 1.00 0.00 N ATOM 351 CA ASP A 28 6.322 2.516 0.515 1.00 0.00 C ATOM 352 C ASP A 28 6.829 2.350 -0.918 1.00 0.00 C ATOM 353 O ASP A 28 6.487 1.379 -1.593 1.00 0.00 O ATOM 354 CB ASP A 28 7.535 2.521 1.448 1.00 0.00 C ATOM 355 CG ASP A 28 7.941 3.900 1.974 1.00 0.00 C ATOM 356 OD1 ASP A 28 7.052 4.777 2.010 1.00 0.00 O ATOM 357 OD2 ASP A 28 9.131 4.044 2.327 1.00 0.00 O ATOM 0 H ASP A 28 5.243 0.776 0.065 1.00 0.00 H new ATOM 0 HA ASP A 28 5.773 3.450 0.632 1.00 0.00 H new ATOM 0 HB2 ASP A 28 7.323 1.872 2.298 1.00 0.00 H new ATOM 0 HB3 ASP A 28 8.383 2.086 0.919 1.00 0.00 H new ATOM 361 N VAL A 29 7.636 3.312 -1.342 1.00 0.00 N ATOM 362 CA VAL A 29 8.194 3.284 -2.683 1.00 0.00 C ATOM 363 C VAL A 29 9.583 3.924 -2.667 1.00 0.00 C ATOM 364 O VAL A 29 9.736 5.075 -2.263 1.00 0.00 O ATOM 365 CB VAL A 29 7.234 3.963 -3.663 1.00 0.00 C ATOM 366 CG1 VAL A 29 6.719 5.287 -3.097 1.00 0.00 C ATOM 367 CG2 VAL A 29 7.899 4.171 -5.026 1.00 0.00 C ATOM 0 H VAL A 29 7.917 4.116 -0.780 1.00 0.00 H new ATOM 0 HA VAL A 29 8.314 2.256 -3.025 1.00 0.00 H new ATOM 0 HB VAL A 29 6.378 3.304 -3.805 1.00 0.00 H new ATOM 0 HG11 VAL A 29 6.039 5.749 -3.813 1.00 0.00 H new ATOM 0 HG12 VAL A 29 6.190 5.102 -2.162 1.00 0.00 H new ATOM 0 HG13 VAL A 29 7.560 5.955 -2.912 1.00 0.00 H new ATOM 0 HG21 VAL A 29 7.196 4.655 -5.704 1.00 0.00 H new ATOM 0 HG22 VAL A 29 8.781 4.800 -4.908 1.00 0.00 H new ATOM 0 HG23 VAL A 29 8.194 3.206 -5.438 1.00 0.00 H new ATOM 377 N TRP A 30 10.562 3.149 -3.111 1.00 0.00 N ATOM 378 CA TRP A 30 11.934 3.626 -3.152 1.00 0.00 C ATOM 379 C TRP A 30 12.438 3.491 -4.591 1.00 0.00 C ATOM 380 O TRP A 30 12.294 2.437 -5.207 1.00 0.00 O ATOM 381 CB TRP A 30 12.806 2.878 -2.141 1.00 0.00 C ATOM 382 CG TRP A 30 12.771 1.356 -2.296 1.00 0.00 C ATOM 383 CD1 TRP A 30 13.703 0.560 -2.838 1.00 0.00 C ATOM 384 CD2 TRP A 30 11.708 0.473 -1.878 1.00 0.00 C ATOM 385 NE1 TRP A 30 13.320 -0.765 -2.801 1.00 0.00 N ATOM 386 CE2 TRP A 30 12.068 -0.819 -2.199 1.00 0.00 C ATOM 387 CE3 TRP A 30 10.483 0.758 -1.251 1.00 0.00 C ATOM 388 CZ2 TRP A 30 11.259 -1.930 -1.930 1.00 0.00 C ATOM 389 CZ3 TRP A 30 9.685 -0.362 -0.989 1.00 0.00 C ATOM 390 CH2 TRP A 30 10.034 -1.670 -1.306 1.00 0.00 C ATOM 0 H TRP A 30 10.432 2.194 -3.445 1.00 0.00 H new ATOM 0 HA TRP A 30 11.986 4.675 -2.861 1.00 0.00 H new ATOM 0 HB2 TRP A 30 13.836 3.220 -2.242 1.00 0.00 H new ATOM 0 HB3 TRP A 30 12.481 3.138 -1.134 1.00 0.00 H new ATOM 0 HD1 TRP A 30 14.637 0.912 -3.252 1.00 0.00 H new ATOM 0 HE1 TRP A 30 13.857 -1.559 -3.151 1.00 0.00 H new ATOM 0 HE3 TRP A 30 10.181 1.762 -0.992 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 11.564 -2.933 -2.190 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 8.732 -0.199 -0.507 1.00 0.00 H new ATOM 0 HH2 TRP A 30 9.362 -2.482 -1.071 1.00 0.00 H new ATOM 400 N GLY A 31 13.019 4.575 -5.084 1.00 0.00 N ATOM 401 CA GLY A 31 13.545 4.592 -6.438 1.00 0.00 C ATOM 402 C GLY A 31 12.615 3.846 -7.397 1.00 0.00 C ATOM 403 O GLY A 31 11.456 4.225 -7.563 1.00 0.00 O ATOM 0 H GLY A 31 13.137 5.448 -4.570 1.00 0.00 H new ATOM 0 HA2 GLY A 31 13.667 5.622 -6.772 1.00 0.00 H new ATOM 0 HA3 GLY A 31 14.534 4.133 -6.454 1.00 0.00 H new ATOM 407 N GLU A 32 13.156 2.801 -8.004 1.00 0.00 N ATOM 408 CA GLU A 32 12.389 2.000 -8.942 1.00 0.00 C ATOM 409 C GLU A 32 11.837 0.753 -8.247 1.00 0.00 C ATOM 410 O GLU A 32 11.841 -0.335 -8.823 1.00 0.00 O ATOM 411 CB GLU A 32 13.235 1.621 -10.160 1.00 0.00 C ATOM 412 CG GLU A 32 13.987 2.836 -10.705 1.00 0.00 C ATOM 413 CD GLU A 32 14.975 2.424 -11.798 1.00 0.00 C ATOM 414 OE1 GLU A 32 14.495 1.940 -12.845 1.00 0.00 O ATOM 415 OE2 GLU A 32 16.189 2.603 -11.561 1.00 0.00 O ATOM 0 H GLU A 32 14.117 2.490 -7.864 1.00 0.00 H new ATOM 0 HA GLU A 32 11.548 2.596 -9.297 1.00 0.00 H new ATOM 0 HB2 GLU A 32 13.946 0.842 -9.885 1.00 0.00 H new ATOM 0 HB3 GLU A 32 12.594 1.207 -10.938 1.00 0.00 H new ATOM 0 HG2 GLU A 32 13.276 3.558 -11.106 1.00 0.00 H new ATOM 0 HG3 GLU A 32 14.522 3.331 -9.894 1.00 0.00 H new ATOM 420 N ASN A 33 11.376 0.952 -7.022 1.00 0.00 N ATOM 421 CA ASN A 33 10.822 -0.141 -6.243 1.00 0.00 C ATOM 422 C ASN A 33 9.592 0.352 -5.480 1.00 0.00 C ATOM 423 O ASN A 33 9.625 1.416 -4.863 1.00 0.00 O ATOM 424 CB ASN A 33 11.836 -0.660 -5.221 1.00 0.00 C ATOM 425 CG ASN A 33 13.119 -1.127 -5.911 1.00 0.00 C ATOM 426 OD1 ASN A 33 13.318 -2.301 -6.179 1.00 0.00 O ATOM 427 ND2 ASN A 33 13.976 -0.148 -6.182 1.00 0.00 N ATOM 0 H ASN A 33 11.375 1.856 -6.549 1.00 0.00 H new ATOM 0 HA ASN A 33 10.560 -0.945 -6.931 1.00 0.00 H new ATOM 0 HB2 ASN A 33 12.070 0.127 -4.504 1.00 0.00 H new ATOM 0 HB3 ASN A 33 11.400 -1.485 -4.658 1.00 0.00 H new ATOM 0 HD21 ASN A 33 14.862 -0.358 -6.641 1.00 0.00 H new ATOM 0 HD22 ASN A 33 13.748 0.814 -5.931 1.00 0.00 H new ATOM 433 N VAL A 34 8.534 -0.443 -5.546 1.00 0.00 N ATOM 434 CA VAL A 34 7.295 -0.099 -4.868 1.00 0.00 C ATOM 435 C VAL A 34 6.910 -1.232 -3.914 1.00 0.00 C ATOM 436 O VAL A 34 7.181 -2.399 -4.190 1.00 0.00 O ATOM 437 CB VAL A 34 6.206 0.213 -5.896 1.00 0.00 C ATOM 438 CG1 VAL A 34 4.827 -0.191 -5.373 1.00 0.00 C ATOM 439 CG2 VAL A 34 6.232 1.692 -6.288 1.00 0.00 C ATOM 0 H VAL A 34 8.509 -1.324 -6.059 1.00 0.00 H new ATOM 0 HA VAL A 34 7.424 0.802 -4.268 1.00 0.00 H new ATOM 0 HB VAL A 34 6.410 -0.375 -6.791 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.071 0.042 -6.123 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.816 -1.261 -5.166 1.00 0.00 H new ATOM 0 HG13 VAL A 34 4.610 0.358 -4.457 1.00 0.00 H new ATOM 0 HG21 VAL A 34 5.448 1.888 -7.020 1.00 0.00 H new ATOM 0 HG22 VAL A 34 6.064 2.306 -5.403 1.00 0.00 H new ATOM 0 HG23 VAL A 34 7.202 1.937 -6.721 1.00 0.00 H new ATOM 449 N ALA A 35 6.284 -0.847 -2.812 1.00 0.00 N ATOM 450 CA ALA A 35 5.859 -1.815 -1.816 1.00 0.00 C ATOM 451 C ALA A 35 4.333 -1.789 -1.703 1.00 0.00 C ATOM 452 O ALA A 35 3.750 -0.763 -1.352 1.00 0.00 O ATOM 453 CB ALA A 35 6.546 -1.513 -0.483 1.00 0.00 C ATOM 0 H ALA A 35 6.061 0.123 -2.587 1.00 0.00 H new ATOM 0 HA ALA A 35 6.151 -2.822 -2.113 1.00 0.00 H new ATOM 0 HB1 ALA A 35 6.227 -2.240 0.264 1.00 0.00 H new ATOM 0 HB2 ALA A 35 7.627 -1.573 -0.609 1.00 0.00 H new ATOM 0 HB3 ALA A 35 6.275 -0.510 -0.153 1.00 0.00 H new ATOM 459 N LEU A 36 3.729 -2.927 -2.010 1.00 0.00 N ATOM 460 CA LEU A 36 2.283 -3.048 -1.948 1.00 0.00 C ATOM 461 C LEU A 36 1.888 -3.734 -0.639 1.00 0.00 C ATOM 462 O LEU A 36 2.636 -4.559 -0.116 1.00 0.00 O ATOM 463 CB LEU A 36 1.749 -3.752 -3.197 1.00 0.00 C ATOM 464 CG LEU A 36 1.672 -2.901 -4.465 1.00 0.00 C ATOM 465 CD1 LEU A 36 1.392 -3.770 -5.693 1.00 0.00 C ATOM 466 CD2 LEU A 36 0.642 -1.780 -4.310 1.00 0.00 C ATOM 0 H LEU A 36 4.215 -3.774 -2.303 1.00 0.00 H new ATOM 0 HA LEU A 36 1.819 -2.062 -1.944 1.00 0.00 H new ATOM 0 HB2 LEU A 36 2.381 -4.616 -3.401 1.00 0.00 H new ATOM 0 HB3 LEU A 36 0.751 -4.132 -2.977 1.00 0.00 H new ATOM 0 HG LEU A 36 2.642 -2.429 -4.619 1.00 0.00 H new ATOM 0 HD11 LEU A 36 1.342 -3.140 -6.581 1.00 0.00 H new ATOM 0 HD12 LEU A 36 2.192 -4.501 -5.811 1.00 0.00 H new ATOM 0 HD13 LEU A 36 0.442 -4.289 -5.563 1.00 0.00 H new ATOM 0 HD21 LEU A 36 0.607 -1.189 -5.225 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -0.340 -2.212 -4.119 1.00 0.00 H new ATOM 0 HD23 LEU A 36 0.925 -1.139 -3.475 1.00 0.00 H new ATOM 477 N THR A 37 0.714 -3.367 -0.146 1.00 0.00 N ATOM 478 CA THR A 37 0.210 -3.938 1.092 1.00 0.00 C ATOM 479 C THR A 37 -1.318 -3.993 1.071 1.00 0.00 C ATOM 480 O THR A 37 -1.982 -2.962 1.163 1.00 0.00 O ATOM 481 CB THR A 37 0.772 -3.116 2.254 1.00 0.00 C ATOM 482 OG1 THR A 37 0.858 -1.792 1.733 1.00 0.00 O ATOM 483 CG2 THR A 37 2.222 -3.481 2.582 1.00 0.00 C ATOM 0 H THR A 37 0.097 -2.681 -0.581 1.00 0.00 H new ATOM 0 HA THR A 37 0.539 -4.970 1.214 1.00 0.00 H new ATOM 0 HB THR A 37 0.151 -3.265 3.137 1.00 0.00 H new ATOM 0 HG1 THR A 37 1.058 -1.167 2.461 1.00 0.00 H new ATOM 0 HG21 THR A 37 2.572 -2.869 3.413 1.00 0.00 H new ATOM 0 HG22 THR A 37 2.279 -4.534 2.858 1.00 0.00 H new ATOM 0 HG23 THR A 37 2.849 -3.300 1.709 1.00 0.00 H new ATOM 491 N TRP A 38 -1.834 -5.208 0.948 1.00 0.00 N ATOM 492 CA TRP A 38 -3.271 -5.412 0.914 1.00 0.00 C ATOM 493 C TRP A 38 -3.650 -6.311 2.093 1.00 0.00 C ATOM 494 O TRP A 38 -2.846 -7.128 2.536 1.00 0.00 O ATOM 495 CB TRP A 38 -3.713 -5.979 -0.437 1.00 0.00 C ATOM 496 CG TRP A 38 -3.064 -7.318 -0.791 1.00 0.00 C ATOM 497 CD1 TRP A 38 -3.511 -8.551 -0.512 1.00 0.00 C ATOM 498 CD2 TRP A 38 -1.825 -7.512 -1.506 1.00 0.00 C ATOM 499 NE1 TRP A 38 -2.655 -9.520 -0.992 1.00 0.00 N ATOM 500 CE2 TRP A 38 -1.598 -8.868 -1.617 1.00 0.00 C ATOM 501 CE3 TRP A 38 -0.928 -6.571 -2.042 1.00 0.00 C ATOM 502 CZ2 TRP A 38 -0.475 -9.407 -2.258 1.00 0.00 C ATOM 503 CZ3 TRP A 38 0.188 -7.126 -2.680 1.00 0.00 C ATOM 504 CH2 TRP A 38 0.432 -8.489 -2.799 1.00 0.00 C ATOM 0 H TRP A 38 -1.281 -6.061 0.871 1.00 0.00 H new ATOM 0 HA TRP A 38 -3.797 -4.463 1.017 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -4.796 -6.102 -0.431 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -3.478 -5.255 -1.218 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -4.427 -8.759 0.022 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -2.775 -10.529 -0.905 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -1.087 -5.505 -1.968 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -0.318 -10.473 -2.331 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 0.910 -6.447 -3.110 1.00 0.00 H new ATOM 0 HH2 TRP A 38 1.319 -8.838 -3.307 1.00 0.00 H new ATOM 514 N THR A 39 -4.875 -6.128 2.565 1.00 0.00 N ATOM 515 CA THR A 39 -5.369 -6.914 3.683 1.00 0.00 C ATOM 516 C THR A 39 -6.088 -8.166 3.179 1.00 0.00 C ATOM 517 O THR A 39 -6.493 -8.230 2.019 1.00 0.00 O ATOM 518 CB THR A 39 -6.257 -6.007 4.541 1.00 0.00 C ATOM 519 OG1 THR A 39 -7.220 -5.497 3.623 1.00 0.00 O ATOM 520 CG2 THR A 39 -5.518 -4.763 5.037 1.00 0.00 C ATOM 0 H THR A 39 -5.539 -5.448 2.194 1.00 0.00 H new ATOM 0 HA THR A 39 -4.550 -7.276 4.305 1.00 0.00 H new ATOM 0 HB THR A 39 -6.633 -6.570 5.396 1.00 0.00 H new ATOM 0 HG1 THR A 39 -7.757 -4.805 4.063 1.00 0.00 H new ATOM 0 HG21 THR A 39 -6.193 -4.155 5.640 1.00 0.00 H new ATOM 0 HG22 THR A 39 -4.663 -5.065 5.642 1.00 0.00 H new ATOM 0 HG23 THR A 39 -5.171 -4.181 4.183 1.00 0.00 H new ATOM 528 N PRO A 40 -6.227 -9.159 4.099 1.00 0.00 N ATOM 529 CA PRO A 40 -6.889 -10.406 3.759 1.00 0.00 C ATOM 530 C PRO A 40 -8.406 -10.219 3.681 1.00 0.00 C ATOM 531 O PRO A 40 -8.947 -9.268 4.243 1.00 0.00 O ATOM 532 CB PRO A 40 -6.466 -11.383 4.844 1.00 0.00 C ATOM 533 CG PRO A 40 -5.964 -10.532 6.000 1.00 0.00 C ATOM 534 CD PRO A 40 -5.759 -9.118 5.481 1.00 0.00 C ATOM 0 HA PRO A 40 -6.607 -10.777 2.774 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -7.303 -12.008 5.154 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -5.685 -12.052 4.484 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -6.683 -10.538 6.819 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -5.030 -10.934 6.393 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -6.324 -8.395 6.069 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -4.711 -8.824 5.536 1.00 0.00 H new ATOM 539 N PRO A 41 -9.065 -11.166 2.961 1.00 0.00 N ATOM 540 CA PRO A 41 -10.508 -11.114 2.802 1.00 0.00 C ATOM 541 C PRO A 41 -11.218 -11.547 4.087 1.00 0.00 C ATOM 542 O PRO A 41 -10.789 -12.491 4.749 1.00 0.00 O ATOM 543 CB PRO A 41 -10.807 -12.025 1.623 1.00 0.00 C ATOM 544 CG PRO A 41 -9.583 -12.911 1.460 1.00 0.00 C ATOM 545 CD PRO A 41 -8.457 -12.306 2.283 1.00 0.00 C ATOM 0 HA PRO A 41 -10.874 -10.105 2.612 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -11.700 -12.622 1.808 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -10.993 -11.445 0.719 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -9.799 -13.925 1.795 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -9.296 -12.977 0.410 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -8.058 -13.026 2.998 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -7.627 -11.993 1.649 1.00 0.00 H new ATOM 550 N LYS A 42 -12.291 -10.837 4.400 1.00 0.00 N ATOM 551 CA LYS A 42 -13.064 -11.136 5.594 1.00 0.00 C ATOM 552 C LYS A 42 -14.089 -12.225 5.273 1.00 0.00 C ATOM 553 O LYS A 42 -14.677 -12.815 6.178 1.00 0.00 O ATOM 554 CB LYS A 42 -13.683 -9.859 6.166 1.00 0.00 C ATOM 555 CG LYS A 42 -12.831 -9.300 7.307 1.00 0.00 C ATOM 556 CD LYS A 42 -13.592 -8.222 8.082 1.00 0.00 C ATOM 557 CE LYS A 42 -14.460 -8.844 9.178 1.00 0.00 C ATOM 558 NZ LYS A 42 -13.695 -8.966 10.439 1.00 0.00 N ATOM 0 H LYS A 42 -12.644 -10.055 3.848 1.00 0.00 H new ATOM 0 HA LYS A 42 -12.416 -11.528 6.378 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -13.777 -9.112 5.378 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -14.689 -10.069 6.528 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -12.547 -10.107 7.983 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -11.908 -8.881 6.905 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -12.885 -7.521 8.527 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -14.219 -7.651 7.397 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -15.346 -8.230 9.341 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -14.808 -9.827 8.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -14.299 -9.390 11.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -12.863 -9.571 10.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -13.384 -8.023 10.749 1.00 0.00 H new ATOM 568 N ASP A 43 -14.271 -12.460 3.982 1.00 0.00 N ATOM 569 CA ASP A 43 -15.215 -13.469 3.530 1.00 0.00 C ATOM 570 C ASP A 43 -14.447 -14.702 3.051 1.00 0.00 C ATOM 571 O ASP A 43 -13.221 -14.751 3.150 1.00 0.00 O ATOM 572 CB ASP A 43 -16.056 -12.951 2.361 1.00 0.00 C ATOM 573 CG ASP A 43 -15.491 -11.717 1.654 1.00 0.00 C ATOM 574 OD1 ASP A 43 -14.247 -11.620 1.591 1.00 0.00 O ATOM 575 OD2 ASP A 43 -16.316 -10.901 1.193 1.00 0.00 O ATOM 0 H ASP A 43 -13.781 -11.969 3.234 1.00 0.00 H new ATOM 0 HA ASP A 43 -15.871 -13.716 4.365 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -16.166 -13.752 1.630 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -17.055 -12.715 2.728 1.00 0.00 H new ATOM 579 N ASP A 44 -15.198 -15.666 2.541 1.00 0.00 N ATOM 580 CA ASP A 44 -14.603 -16.897 2.047 1.00 0.00 C ATOM 581 C ASP A 44 -15.533 -17.527 1.008 1.00 0.00 C ATOM 582 O ASP A 44 -15.092 -17.912 -0.073 1.00 0.00 O ATOM 583 CB ASP A 44 -14.405 -17.907 3.179 1.00 0.00 C ATOM 584 CG ASP A 44 -15.633 -18.140 4.060 1.00 0.00 C ATOM 585 OD1 ASP A 44 -15.992 -17.194 4.795 1.00 0.00 O ATOM 586 OD2 ASP A 44 -16.186 -19.258 3.979 1.00 0.00 O ATOM 0 H ASP A 44 -16.214 -15.620 2.459 1.00 0.00 H new ATOM 0 HA ASP A 44 -13.635 -16.652 1.610 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -14.101 -18.860 2.746 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -13.584 -17.567 3.810 1.00 0.00 H new ATOM 590 N GLY A 45 -16.804 -17.611 1.373 1.00 0.00 N ATOM 591 CA GLY A 45 -17.800 -18.188 0.487 1.00 0.00 C ATOM 592 C GLY A 45 -17.806 -19.715 0.586 1.00 0.00 C ATOM 593 O GLY A 45 -18.705 -20.299 1.189 1.00 0.00 O ATOM 0 H GLY A 45 -17.167 -17.289 2.270 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -18.786 -17.800 0.742 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -17.595 -17.888 -0.541 1.00 0.00 H new ATOM 597 N ASN A 46 -16.789 -20.318 -0.013 1.00 0.00 N ATOM 598 CA ASN A 46 -16.666 -21.766 0.001 1.00 0.00 C ATOM 599 C ASN A 46 -15.291 -22.161 -0.543 1.00 0.00 C ATOM 600 O ASN A 46 -14.566 -22.929 0.088 1.00 0.00 O ATOM 601 CB ASN A 46 -17.729 -22.419 -0.884 1.00 0.00 C ATOM 602 CG ASN A 46 -18.419 -23.572 -0.153 1.00 0.00 C ATOM 603 OD1 ASN A 46 -17.787 -24.466 0.387 1.00 0.00 O ATOM 604 ND2 ASN A 46 -19.747 -23.503 -0.166 1.00 0.00 N ATOM 0 H ASN A 46 -16.044 -19.831 -0.510 1.00 0.00 H new ATOM 0 HA ASN A 46 -16.795 -22.105 1.029 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -18.470 -21.675 -1.178 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -17.268 -22.789 -1.800 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -20.300 -24.226 0.295 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -20.213 -22.727 -0.637 1.00 0.00 H new ATOM 610 N ALA A 47 -14.973 -21.618 -1.710 1.00 0.00 N ATOM 611 CA ALA A 47 -13.699 -21.904 -2.345 1.00 0.00 C ATOM 612 C ALA A 47 -12.584 -21.165 -1.602 1.00 0.00 C ATOM 613 O ALA A 47 -12.489 -19.940 -1.678 1.00 0.00 O ATOM 614 CB ALA A 47 -13.767 -21.518 -3.825 1.00 0.00 C ATOM 0 H ALA A 47 -15.576 -20.982 -2.231 1.00 0.00 H new ATOM 0 HA ALA A 47 -13.478 -22.970 -2.295 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -12.810 -21.733 -4.301 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -14.553 -22.092 -4.315 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -13.986 -20.454 -3.914 1.00 0.00 H new ATOM 620 N ALA A 48 -11.771 -21.938 -0.898 1.00 0.00 N ATOM 621 CA ALA A 48 -10.668 -21.371 -0.142 1.00 0.00 C ATOM 622 C ALA A 48 -9.791 -20.533 -1.074 1.00 0.00 C ATOM 623 O ALA A 48 -9.216 -21.057 -2.027 1.00 0.00 O ATOM 624 CB ALA A 48 -9.885 -22.495 0.540 1.00 0.00 C ATOM 0 H ALA A 48 -11.854 -22.953 -0.835 1.00 0.00 H new ATOM 0 HA ALA A 48 -11.041 -20.711 0.641 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -9.057 -22.069 1.107 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -10.545 -23.041 1.215 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -9.494 -23.177 -0.216 1.00 0.00 H new ATOM 630 N ILE A 49 -9.718 -19.247 -0.768 1.00 0.00 N ATOM 631 CA ILE A 49 -8.922 -18.332 -1.568 1.00 0.00 C ATOM 632 C ILE A 49 -7.609 -19.014 -1.960 1.00 0.00 C ATOM 633 O ILE A 49 -6.794 -19.339 -1.100 1.00 0.00 O ATOM 634 CB ILE A 49 -8.729 -17.005 -0.831 1.00 0.00 C ATOM 635 CG1 ILE A 49 -10.077 -16.358 -0.504 1.00 0.00 C ATOM 636 CG2 ILE A 49 -7.819 -16.064 -1.624 1.00 0.00 C ATOM 637 CD1 ILE A 49 -10.513 -16.692 0.924 1.00 0.00 C ATOM 0 H ILE A 49 -10.197 -18.816 0.023 1.00 0.00 H new ATOM 0 HA ILE A 49 -9.442 -18.084 -2.493 1.00 0.00 H new ATOM 0 HB ILE A 49 -8.232 -17.210 0.117 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -10.004 -15.277 -0.622 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -10.832 -16.705 -1.209 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -7.699 -15.128 -1.078 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -6.844 -16.532 -1.762 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -8.265 -15.861 -2.597 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -11.474 -16.220 1.131 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -10.609 -17.772 1.032 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -9.768 -16.322 1.628 1.00 0.00 H new ATOM 648 N THR A 50 -7.447 -19.208 -3.261 1.00 0.00 N ATOM 649 CA THR A 50 -6.247 -19.845 -3.778 1.00 0.00 C ATOM 650 C THR A 50 -5.031 -18.941 -3.568 1.00 0.00 C ATOM 651 O THR A 50 -4.063 -19.337 -2.921 1.00 0.00 O ATOM 652 CB THR A 50 -6.496 -20.200 -5.245 1.00 0.00 C ATOM 653 OG1 THR A 50 -7.302 -21.374 -5.187 1.00 0.00 O ATOM 654 CG2 THR A 50 -5.223 -20.659 -5.960 1.00 0.00 C ATOM 0 H THR A 50 -8.126 -18.936 -3.972 1.00 0.00 H new ATOM 0 HA THR A 50 -6.024 -20.766 -3.240 1.00 0.00 H new ATOM 0 HB THR A 50 -6.912 -19.335 -5.762 1.00 0.00 H new ATOM 0 HG1 THR A 50 -7.512 -21.672 -6.097 1.00 0.00 H new ATOM 0 HG21 THR A 50 -5.455 -20.899 -6.998 1.00 0.00 H new ATOM 0 HG22 THR A 50 -4.481 -19.862 -5.929 1.00 0.00 H new ATOM 0 HG23 THR A 50 -4.826 -21.544 -5.463 1.00 0.00 H new ATOM 662 N GLY A 51 -5.120 -17.744 -4.128 1.00 0.00 N ATOM 663 CA GLY A 51 -4.039 -16.781 -4.012 1.00 0.00 C ATOM 664 C GLY A 51 -4.536 -15.362 -4.295 1.00 0.00 C ATOM 665 O GLY A 51 -5.663 -15.014 -3.946 1.00 0.00 O ATOM 0 H GLY A 51 -5.925 -17.419 -4.664 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -3.612 -16.827 -3.010 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -3.242 -17.037 -4.711 1.00 0.00 H new ATOM 669 N TYR A 52 -3.670 -14.580 -4.923 1.00 0.00 N ATOM 670 CA TYR A 52 -4.007 -13.206 -5.256 1.00 0.00 C ATOM 671 C TYR A 52 -3.188 -12.716 -6.452 1.00 0.00 C ATOM 672 O TYR A 52 -1.959 -12.694 -6.401 1.00 0.00 O ATOM 673 CB TYR A 52 -3.642 -12.372 -4.027 1.00 0.00 C ATOM 674 CG TYR A 52 -4.340 -12.821 -2.741 1.00 0.00 C ATOM 675 CD1 TYR A 52 -5.676 -12.537 -2.546 1.00 0.00 C ATOM 676 CD2 TYR A 52 -3.633 -13.509 -1.777 1.00 0.00 C ATOM 677 CE1 TYR A 52 -6.333 -12.959 -1.337 1.00 0.00 C ATOM 678 CE2 TYR A 52 -4.289 -13.931 -0.566 1.00 0.00 C ATOM 679 CZ TYR A 52 -5.607 -13.635 -0.407 1.00 0.00 C ATOM 680 OH TYR A 52 -6.228 -14.033 0.736 1.00 0.00 O ATOM 0 H TYR A 52 -2.736 -14.872 -5.210 1.00 0.00 H new ATOM 0 HA TYR A 52 -5.061 -13.122 -5.519 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -2.563 -12.417 -3.877 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -3.894 -11.329 -4.220 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -6.229 -11.998 -3.301 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -2.587 -13.731 -1.930 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -7.378 -12.744 -1.172 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -3.747 -14.470 0.197 1.00 0.00 H new ATOM 0 HH TYR A 52 -5.588 -14.506 1.308 1.00 0.00 H new ATOM 689 N THR A 53 -3.902 -12.334 -7.501 1.00 0.00 N ATOM 690 CA THR A 53 -3.257 -11.846 -8.708 1.00 0.00 C ATOM 691 C THR A 53 -3.116 -10.323 -8.658 1.00 0.00 C ATOM 692 O THR A 53 -4.089 -9.613 -8.408 1.00 0.00 O ATOM 693 CB THR A 53 -4.064 -12.341 -9.909 1.00 0.00 C ATOM 694 OG1 THR A 53 -3.746 -13.728 -9.992 1.00 0.00 O ATOM 695 CG2 THR A 53 -3.558 -11.764 -11.233 1.00 0.00 C ATOM 0 H THR A 53 -4.921 -12.353 -7.540 1.00 0.00 H new ATOM 0 HA THR A 53 -2.242 -12.233 -8.798 1.00 0.00 H new ATOM 0 HB THR A 53 -5.113 -12.077 -9.775 1.00 0.00 H new ATOM 0 HG1 THR A 53 -3.784 -14.017 -10.928 1.00 0.00 H new ATOM 0 HG21 THR A 53 -4.165 -12.147 -12.053 1.00 0.00 H new ATOM 0 HG22 THR A 53 -3.629 -10.677 -11.207 1.00 0.00 H new ATOM 0 HG23 THR A 53 -2.519 -12.056 -11.384 1.00 0.00 H new ATOM 703 N ILE A 54 -1.896 -9.866 -8.901 1.00 0.00 N ATOM 704 CA ILE A 54 -1.616 -8.440 -8.886 1.00 0.00 C ATOM 705 C ILE A 54 -1.403 -7.952 -10.320 1.00 0.00 C ATOM 706 O ILE A 54 -0.993 -8.722 -11.187 1.00 0.00 O ATOM 707 CB ILE A 54 -0.443 -8.134 -7.952 1.00 0.00 C ATOM 708 CG1 ILE A 54 -0.761 -8.555 -6.516 1.00 0.00 C ATOM 709 CG2 ILE A 54 -0.040 -6.661 -8.042 1.00 0.00 C ATOM 710 CD1 ILE A 54 0.119 -9.729 -6.080 1.00 0.00 C ATOM 0 H ILE A 54 -1.091 -10.457 -9.109 1.00 0.00 H new ATOM 0 HA ILE A 54 -2.466 -7.889 -8.484 1.00 0.00 H new ATOM 0 HB ILE A 54 0.415 -8.723 -8.277 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -0.607 -7.711 -5.843 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -1.812 -8.836 -6.440 1.00 0.00 H new ATOM 0 HG21 ILE A 54 0.796 -6.471 -7.368 1.00 0.00 H new ATOM 0 HG22 ILE A 54 0.257 -6.427 -9.064 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -0.885 -6.034 -7.758 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -0.128 -10.008 -5.056 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -0.055 -10.579 -6.740 1.00 0.00 H new ATOM 0 HD13 ILE A 54 1.168 -9.437 -6.134 1.00 0.00 H new ATOM 721 N GLN A 55 -1.690 -6.675 -10.526 1.00 0.00 N ATOM 722 CA GLN A 55 -1.536 -6.076 -11.840 1.00 0.00 C ATOM 723 C GLN A 55 -1.158 -4.599 -11.709 1.00 0.00 C ATOM 724 O GLN A 55 -1.689 -3.892 -10.853 1.00 0.00 O ATOM 725 CB GLN A 55 -2.809 -6.243 -12.673 1.00 0.00 C ATOM 726 CG GLN A 55 -3.282 -7.699 -12.663 1.00 0.00 C ATOM 727 CD GLN A 55 -4.530 -7.875 -13.530 1.00 0.00 C ATOM 728 OE1 GLN A 55 -5.285 -6.948 -13.774 1.00 0.00 O ATOM 729 NE2 GLN A 55 -4.703 -9.114 -13.983 1.00 0.00 N ATOM 0 H GLN A 55 -2.028 -6.039 -9.804 1.00 0.00 H new ATOM 0 HA GLN A 55 -0.730 -6.594 -12.360 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -3.594 -5.599 -12.277 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -2.622 -5.924 -13.698 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -2.486 -8.347 -13.030 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -3.499 -8.008 -11.640 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -4.033 -9.844 -13.741 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -5.506 -9.334 -14.572 1.00 0.00 H new ATOM 736 N LYS A 56 -0.245 -4.176 -12.570 1.00 0.00 N ATOM 737 CA LYS A 56 0.211 -2.795 -12.561 1.00 0.00 C ATOM 738 C LYS A 56 -0.149 -2.136 -13.893 1.00 0.00 C ATOM 739 O LYS A 56 -0.186 -2.799 -14.929 1.00 0.00 O ATOM 740 CB LYS A 56 1.701 -2.725 -12.221 1.00 0.00 C ATOM 741 CG LYS A 56 2.556 -3.143 -13.419 1.00 0.00 C ATOM 742 CD LYS A 56 4.012 -3.359 -13.003 1.00 0.00 C ATOM 743 CE LYS A 56 4.714 -4.338 -13.948 1.00 0.00 C ATOM 744 NZ LYS A 56 6.182 -4.249 -13.789 1.00 0.00 N ATOM 0 H LYS A 56 0.192 -4.765 -13.279 1.00 0.00 H new ATOM 0 HA LYS A 56 -0.296 -2.230 -11.779 1.00 0.00 H new ATOM 0 HB2 LYS A 56 1.962 -1.710 -11.920 1.00 0.00 H new ATOM 0 HB3 LYS A 56 1.915 -3.375 -11.372 1.00 0.00 H new ATOM 0 HG2 LYS A 56 2.158 -4.060 -13.852 1.00 0.00 H new ATOM 0 HG3 LYS A 56 2.505 -2.377 -14.192 1.00 0.00 H new ATOM 0 HD2 LYS A 56 4.540 -2.405 -13.005 1.00 0.00 H new ATOM 0 HD3 LYS A 56 4.049 -3.742 -11.983 1.00 0.00 H new ATOM 0 HE2 LYS A 56 4.381 -5.355 -13.741 1.00 0.00 H new ATOM 0 HE3 LYS A 56 4.440 -4.117 -14.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 6.643 -4.919 -14.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 6.497 -3.283 -14.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 6.440 -4.482 -12.809 1.00 0.00 H new ATOM 754 N ALA A 57 -0.404 -0.838 -13.825 1.00 0.00 N ATOM 755 CA ALA A 57 -0.759 -0.081 -15.014 1.00 0.00 C ATOM 756 C ALA A 57 -0.456 1.401 -14.779 1.00 0.00 C ATOM 757 O ALA A 57 -0.714 1.926 -13.698 1.00 0.00 O ATOM 758 CB ALA A 57 -2.230 -0.328 -15.357 1.00 0.00 C ATOM 0 H ALA A 57 -0.372 -0.291 -12.965 1.00 0.00 H new ATOM 0 HA ALA A 57 -0.166 -0.408 -15.868 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -2.496 0.240 -16.249 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -2.387 -1.390 -15.543 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -2.856 -0.009 -14.524 1.00 0.00 H new ATOM 764 N ASP A 58 0.087 2.031 -15.810 1.00 0.00 N ATOM 765 CA ASP A 58 0.426 3.442 -15.730 1.00 0.00 C ATOM 766 C ASP A 58 -0.827 4.280 -15.985 1.00 0.00 C ATOM 767 O ASP A 58 -1.884 3.740 -16.310 1.00 0.00 O ATOM 768 CB ASP A 58 1.469 3.818 -16.783 1.00 0.00 C ATOM 769 CG ASP A 58 2.669 4.607 -16.255 1.00 0.00 C ATOM 770 OD1 ASP A 58 2.591 5.041 -15.085 1.00 0.00 O ATOM 771 OD2 ASP A 58 3.635 4.760 -17.032 1.00 0.00 O ATOM 0 H ASP A 58 0.301 1.591 -16.705 1.00 0.00 H new ATOM 0 HA ASP A 58 0.831 3.635 -14.736 1.00 0.00 H new ATOM 0 HB2 ASP A 58 1.833 2.905 -17.254 1.00 0.00 H new ATOM 0 HB3 ASP A 58 0.982 4.405 -17.561 1.00 0.00 H new ATOM 775 N LYS A 59 -0.670 5.586 -15.828 1.00 0.00 N ATOM 776 CA LYS A 59 -1.776 6.504 -16.038 1.00 0.00 C ATOM 777 C LYS A 59 -1.774 6.975 -17.494 1.00 0.00 C ATOM 778 O LYS A 59 -2.354 8.011 -17.816 1.00 0.00 O ATOM 779 CB LYS A 59 -1.724 7.647 -15.023 1.00 0.00 C ATOM 780 CG LYS A 59 -2.743 7.430 -13.901 1.00 0.00 C ATOM 781 CD LYS A 59 -3.908 8.414 -14.021 1.00 0.00 C ATOM 782 CE LYS A 59 -5.125 7.746 -14.664 1.00 0.00 C ATOM 783 NZ LYS A 59 -5.124 7.964 -16.127 1.00 0.00 N ATOM 0 H LYS A 59 0.207 6.030 -15.558 1.00 0.00 H new ATOM 0 HA LYS A 59 -2.727 5.999 -15.867 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -0.722 7.718 -14.600 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -1.926 8.593 -15.525 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -3.120 6.408 -13.940 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -2.256 7.554 -12.934 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -4.174 8.790 -13.033 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -3.603 9.274 -14.618 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -5.116 6.677 -14.450 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -6.040 8.150 -14.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -5.689 7.223 -16.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -5.535 8.895 -16.339 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -4.147 7.928 -16.483 1.00 0.00 H new ATOM 793 N LYS A 60 -1.115 6.190 -18.335 1.00 0.00 N ATOM 794 CA LYS A 60 -1.029 6.514 -19.749 1.00 0.00 C ATOM 795 C LYS A 60 -2.291 6.018 -20.459 1.00 0.00 C ATOM 796 O LYS A 60 -2.933 6.770 -21.191 1.00 0.00 O ATOM 797 CB LYS A 60 0.268 5.966 -20.346 1.00 0.00 C ATOM 798 CG LYS A 60 1.488 6.532 -19.618 1.00 0.00 C ATOM 799 CD LYS A 60 1.422 8.059 -19.540 1.00 0.00 C ATOM 800 CE LYS A 60 2.821 8.663 -19.411 1.00 0.00 C ATOM 801 NZ LYS A 60 3.096 9.579 -20.540 1.00 0.00 N ATOM 0 H LYS A 60 -0.636 5.331 -18.064 1.00 0.00 H new ATOM 0 HA LYS A 60 -0.987 7.594 -19.891 1.00 0.00 H new ATOM 0 HB2 LYS A 60 0.272 4.878 -20.279 1.00 0.00 H new ATOM 0 HB3 LYS A 60 0.321 6.220 -21.405 1.00 0.00 H new ATOM 0 HG2 LYS A 60 1.541 6.115 -18.612 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.398 6.230 -20.137 1.00 0.00 H new ATOM 0 HD2 LYS A 60 0.934 8.451 -20.432 1.00 0.00 H new ATOM 0 HD3 LYS A 60 0.813 8.357 -18.686 1.00 0.00 H new ATOM 0 HE2 LYS A 60 2.905 9.203 -18.468 1.00 0.00 H new ATOM 0 HE3 LYS A 60 3.566 7.868 -19.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 4.050 9.980 -20.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 3.036 9.054 -21.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 2.395 10.348 -20.542 1.00 0.00 H new ATOM 811 N SER A 61 -2.609 4.754 -20.217 1.00 0.00 N ATOM 812 CA SER A 61 -3.782 4.149 -20.824 1.00 0.00 C ATOM 813 C SER A 61 -4.270 2.979 -19.966 1.00 0.00 C ATOM 814 O SER A 61 -4.779 1.989 -20.491 1.00 0.00 O ATOM 815 CB SER A 61 -3.483 3.676 -22.247 1.00 0.00 C ATOM 816 OG SER A 61 -4.097 4.509 -23.227 1.00 0.00 O ATOM 0 H SER A 61 -2.075 4.133 -19.609 1.00 0.00 H new ATOM 0 HA SER A 61 -4.567 4.903 -20.879 1.00 0.00 H new ATOM 0 HB2 SER A 61 -2.405 3.664 -22.406 1.00 0.00 H new ATOM 0 HB3 SER A 61 -3.835 2.652 -22.370 1.00 0.00 H new ATOM 0 HG SER A 61 -3.881 4.175 -24.122 1.00 0.00 H new ATOM 821 N MET A 62 -4.096 3.130 -18.661 1.00 0.00 N ATOM 822 CA MET A 62 -4.512 2.098 -17.727 1.00 0.00 C ATOM 823 C MET A 62 -4.324 0.704 -18.329 1.00 0.00 C ATOM 824 O MET A 62 -5.272 -0.075 -18.407 1.00 0.00 O ATOM 825 CB MET A 62 -5.983 2.303 -17.362 1.00 0.00 C ATOM 826 CG MET A 62 -6.472 1.202 -16.418 1.00 0.00 C ATOM 827 SD MET A 62 -7.740 1.843 -15.338 1.00 0.00 S ATOM 828 CE MET A 62 -6.724 2.568 -14.062 1.00 0.00 C ATOM 0 H MET A 62 -3.673 3.951 -18.229 1.00 0.00 H new ATOM 0 HA MET A 62 -3.893 2.173 -16.833 1.00 0.00 H new ATOM 0 HB2 MET A 62 -6.112 3.276 -16.889 1.00 0.00 H new ATOM 0 HB3 MET A 62 -6.589 2.306 -18.268 1.00 0.00 H new ATOM 0 HG2 MET A 62 -6.864 0.364 -16.995 1.00 0.00 H new ATOM 0 HG3 MET A 62 -5.639 0.821 -15.828 1.00 0.00 H new ATOM 0 HE1 MET A 62 -6.761 1.944 -13.169 1.00 0.00 H new ATOM 0 HE2 MET A 62 -5.695 2.639 -14.413 1.00 0.00 H new ATOM 0 HE3 MET A 62 -7.096 3.565 -13.823 1.00 0.00 H new ATOM 836 N GLU A 63 -3.093 0.433 -18.740 1.00 0.00 N ATOM 837 CA GLU A 63 -2.769 -0.853 -19.334 1.00 0.00 C ATOM 838 C GLU A 63 -2.245 -1.813 -18.264 1.00 0.00 C ATOM 839 O GLU A 63 -1.298 -1.492 -17.546 1.00 0.00 O ATOM 840 CB GLU A 63 -1.758 -0.693 -20.470 1.00 0.00 C ATOM 841 CG GLU A 63 -2.174 0.431 -21.420 1.00 0.00 C ATOM 842 CD GLU A 63 -0.970 0.965 -22.199 1.00 0.00 C ATOM 843 OE1 GLU A 63 -0.545 0.263 -23.140 1.00 0.00 O ATOM 844 OE2 GLU A 63 -0.501 2.066 -21.833 1.00 0.00 O ATOM 0 H GLU A 63 -2.309 1.082 -18.673 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.679 -1.275 -19.760 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -0.772 -0.479 -20.057 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -1.675 -1.629 -21.022 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -2.928 0.063 -22.116 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -2.632 1.241 -20.852 1.00 0.00 H new ATOM 849 N TRP A 64 -2.883 -2.972 -18.191 1.00 0.00 N ATOM 850 CA TRP A 64 -2.492 -3.981 -17.221 1.00 0.00 C ATOM 851 C TRP A 64 -1.808 -5.123 -17.976 1.00 0.00 C ATOM 852 O TRP A 64 -2.375 -5.679 -18.915 1.00 0.00 O ATOM 853 CB TRP A 64 -3.695 -4.446 -16.398 1.00 0.00 C ATOM 854 CG TRP A 64 -4.495 -3.305 -15.766 1.00 0.00 C ATOM 855 CD1 TRP A 64 -5.622 -2.738 -16.219 1.00 0.00 C ATOM 856 CD2 TRP A 64 -4.180 -2.611 -14.541 1.00 0.00 C ATOM 857 NE1 TRP A 64 -6.055 -1.734 -15.377 1.00 0.00 N ATOM 858 CE2 TRP A 64 -5.150 -1.654 -14.325 1.00 0.00 C ATOM 859 CE3 TRP A 64 -3.112 -2.785 -13.645 1.00 0.00 C ATOM 860 CZ2 TRP A 64 -5.149 -0.796 -13.218 1.00 0.00 C ATOM 861 CZ3 TRP A 64 -3.124 -1.921 -12.544 1.00 0.00 C ATOM 862 CH2 TRP A 64 -4.093 -0.953 -12.312 1.00 0.00 C ATOM 0 H TRP A 64 -3.668 -3.235 -18.787 1.00 0.00 H new ATOM 0 HA TRP A 64 -1.787 -3.569 -16.499 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -4.357 -5.029 -17.038 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -3.347 -5.112 -15.609 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -6.127 -3.030 -17.128 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -6.886 -1.157 -15.503 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -2.342 -3.527 -13.794 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -5.920 -0.054 -13.071 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -2.324 -2.013 -11.824 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -4.032 -0.324 -11.436 1.00 0.00 H new ATOM 872 N PHE A 65 -0.597 -5.438 -17.538 1.00 0.00 N ATOM 873 CA PHE A 65 0.170 -6.503 -18.160 1.00 0.00 C ATOM 874 C PHE A 65 0.470 -7.621 -17.159 1.00 0.00 C ATOM 875 O PHE A 65 1.404 -8.398 -17.351 1.00 0.00 O ATOM 876 CB PHE A 65 1.489 -5.888 -18.630 1.00 0.00 C ATOM 877 CG PHE A 65 1.488 -5.460 -20.098 1.00 0.00 C ATOM 878 CD1 PHE A 65 0.685 -4.443 -20.511 1.00 0.00 C ATOM 879 CD2 PHE A 65 2.291 -6.097 -20.993 1.00 0.00 C ATOM 880 CE1 PHE A 65 0.684 -4.045 -21.873 1.00 0.00 C ATOM 881 CE2 PHE A 65 2.290 -5.700 -22.357 1.00 0.00 C ATOM 882 CZ PHE A 65 1.487 -4.683 -22.768 1.00 0.00 C ATOM 0 H PHE A 65 -0.129 -4.974 -16.760 1.00 0.00 H new ATOM 0 HA PHE A 65 -0.395 -6.934 -18.986 1.00 0.00 H new ATOM 0 HB2 PHE A 65 1.715 -5.021 -18.010 1.00 0.00 H new ATOM 0 HB3 PHE A 65 2.291 -6.610 -18.473 1.00 0.00 H new ATOM 0 HD1 PHE A 65 0.047 -3.937 -19.801 1.00 0.00 H new ATOM 0 HD2 PHE A 65 2.929 -6.905 -20.666 1.00 0.00 H new ATOM 0 HE1 PHE A 65 0.047 -3.236 -22.199 1.00 0.00 H new ATOM 0 HE2 PHE A 65 2.927 -6.206 -23.067 1.00 0.00 H new ATOM 0 HZ PHE A 65 1.486 -4.381 -23.805 1.00 0.00 H new ATOM 891 N THR A 66 -0.339 -7.666 -16.111 1.00 0.00 N ATOM 892 CA THR A 66 -0.172 -8.674 -15.079 1.00 0.00 C ATOM 893 C THR A 66 1.191 -8.524 -14.401 1.00 0.00 C ATOM 894 O THR A 66 2.210 -8.386 -15.075 1.00 0.00 O ATOM 895 CB THR A 66 -0.384 -10.048 -15.722 1.00 0.00 C ATOM 896 OG1 THR A 66 -1.796 -10.141 -15.885 1.00 0.00 O ATOM 897 CG2 THR A 66 -0.040 -11.197 -14.772 1.00 0.00 C ATOM 0 H THR A 66 -1.113 -7.020 -15.955 1.00 0.00 H new ATOM 0 HA THR A 66 -0.909 -8.553 -14.285 1.00 0.00 H new ATOM 0 HB THR A 66 0.226 -10.126 -16.622 1.00 0.00 H new ATOM 0 HG1 THR A 66 -2.022 -11.001 -16.297 1.00 0.00 H new ATOM 0 HG21 THR A 66 -0.208 -12.149 -15.276 1.00 0.00 H new ATOM 0 HG22 THR A 66 1.006 -11.123 -14.475 1.00 0.00 H new ATOM 0 HG23 THR A 66 -0.673 -11.139 -13.887 1.00 0.00 H new ATOM 905 N VAL A 67 1.164 -8.555 -13.077 1.00 0.00 N ATOM 906 CA VAL A 67 2.385 -8.423 -12.301 1.00 0.00 C ATOM 907 C VAL A 67 2.773 -9.790 -11.733 1.00 0.00 C ATOM 908 O VAL A 67 3.939 -10.178 -11.781 1.00 0.00 O ATOM 909 CB VAL A 67 2.205 -7.356 -11.220 1.00 0.00 C ATOM 910 CG1 VAL A 67 3.396 -7.343 -10.259 1.00 0.00 C ATOM 911 CG2 VAL A 67 1.989 -5.975 -11.843 1.00 0.00 C ATOM 0 H VAL A 67 0.316 -8.670 -12.522 1.00 0.00 H new ATOM 0 HA VAL A 67 3.206 -8.089 -12.935 1.00 0.00 H new ATOM 0 HB VAL A 67 1.313 -7.608 -10.646 1.00 0.00 H new ATOM 0 HG11 VAL A 67 3.243 -6.576 -9.500 1.00 0.00 H new ATOM 0 HG12 VAL A 67 3.486 -8.317 -9.777 1.00 0.00 H new ATOM 0 HG13 VAL A 67 4.309 -7.127 -10.814 1.00 0.00 H new ATOM 0 HG21 VAL A 67 1.864 -5.235 -11.053 1.00 0.00 H new ATOM 0 HG22 VAL A 67 2.853 -5.712 -12.453 1.00 0.00 H new ATOM 0 HG23 VAL A 67 1.096 -5.993 -12.468 1.00 0.00 H new ATOM 921 N ILE A 68 1.773 -10.483 -11.208 1.00 0.00 N ATOM 922 CA ILE A 68 1.994 -11.798 -10.631 1.00 0.00 C ATOM 923 C ILE A 68 0.656 -12.527 -10.506 1.00 0.00 C ATOM 924 O ILE A 68 -0.392 -11.893 -10.389 1.00 0.00 O ATOM 925 CB ILE A 68 2.757 -11.682 -9.310 1.00 0.00 C ATOM 926 CG1 ILE A 68 3.960 -12.627 -9.286 1.00 0.00 C ATOM 927 CG2 ILE A 68 1.827 -11.909 -8.117 1.00 0.00 C ATOM 928 CD1 ILE A 68 5.148 -11.986 -8.568 1.00 0.00 C ATOM 0 H ILE A 68 0.807 -10.158 -11.170 1.00 0.00 H new ATOM 0 HA ILE A 68 2.625 -12.400 -11.285 1.00 0.00 H new ATOM 0 HB ILE A 68 3.144 -10.666 -9.228 1.00 0.00 H new ATOM 0 HG12 ILE A 68 3.687 -13.556 -8.786 1.00 0.00 H new ATOM 0 HG13 ILE A 68 4.244 -12.886 -10.306 1.00 0.00 H new ATOM 0 HG21 ILE A 68 2.395 -11.821 -7.191 1.00 0.00 H new ATOM 0 HG22 ILE A 68 1.033 -11.163 -8.128 1.00 0.00 H new ATOM 0 HG23 ILE A 68 1.390 -12.905 -8.181 1.00 0.00 H new ATOM 0 HD11 ILE A 68 5.989 -12.679 -8.566 1.00 0.00 H new ATOM 0 HD12 ILE A 68 5.434 -11.070 -9.085 1.00 0.00 H new ATOM 0 HD13 ILE A 68 4.869 -11.751 -7.541 1.00 0.00 H new ATOM 939 N GLU A 69 0.734 -13.849 -10.536 1.00 0.00 N ATOM 940 CA GLU A 69 -0.459 -14.672 -10.427 1.00 0.00 C ATOM 941 C GLU A 69 -0.248 -15.780 -9.393 1.00 0.00 C ATOM 942 O GLU A 69 0.859 -16.296 -9.248 1.00 0.00 O ATOM 943 CB GLU A 69 -0.846 -15.258 -11.787 1.00 0.00 C ATOM 944 CG GLU A 69 -1.015 -14.155 -12.832 1.00 0.00 C ATOM 945 CD GLU A 69 -2.325 -14.326 -13.603 1.00 0.00 C ATOM 946 OE1 GLU A 69 -2.588 -15.471 -14.028 1.00 0.00 O ATOM 947 OE2 GLU A 69 -3.033 -13.307 -13.750 1.00 0.00 O ATOM 0 H GLU A 69 1.605 -14.371 -10.634 1.00 0.00 H new ATOM 0 HA GLU A 69 -1.282 -14.041 -10.091 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -0.080 -15.960 -12.115 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -1.775 -15.820 -11.693 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -1.001 -13.181 -12.343 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -0.175 -14.175 -13.526 1.00 0.00 H new ATOM 952 N HIS A 70 -1.327 -16.111 -8.699 1.00 0.00 N ATOM 953 CA HIS A 70 -1.274 -17.148 -7.682 1.00 0.00 C ATOM 954 C HIS A 70 -0.136 -16.849 -6.704 1.00 0.00 C ATOM 955 O HIS A 70 0.771 -17.663 -6.535 1.00 0.00 O ATOM 956 CB HIS A 70 -1.157 -18.532 -8.322 1.00 0.00 C ATOM 957 CG HIS A 70 -1.713 -18.610 -9.724 1.00 0.00 C ATOM 958 ND1 HIS A 70 -1.210 -18.158 -10.910 1.00 0.00 N flip ATOM 959 CD2 HIS A 70 -2.928 -19.205 -10.018 1.00 0.00 C flip ATOM 960 CE1 HIS A 70 -2.069 -18.464 -11.874 1.00 0.00 C flip ATOM 961 NE2 HIS A 70 -3.135 -19.113 -11.323 1.00 0.00 N flip ATOM 0 H HIS A 70 -2.243 -15.680 -8.821 1.00 0.00 H new ATOM 0 HA HIS A 70 -2.204 -17.153 -7.114 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -0.107 -18.824 -8.342 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -1.677 -19.256 -7.695 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -3.594 -19.666 -9.304 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -1.945 -18.237 -12.922 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -3.948 -19.465 -11.827 1.00 0.00 H new ATOM 968 N TYR A 71 -0.220 -15.680 -6.086 1.00 0.00 N ATOM 969 CA TYR A 71 0.791 -15.264 -5.130 1.00 0.00 C ATOM 970 C TYR A 71 0.655 -16.038 -3.816 1.00 0.00 C ATOM 971 O TYR A 71 -0.121 -16.988 -3.729 1.00 0.00 O ATOM 972 CB TYR A 71 0.534 -13.779 -4.863 1.00 0.00 C ATOM 973 CG TYR A 71 1.775 -13.002 -4.422 1.00 0.00 C ATOM 974 CD1 TYR A 71 2.940 -13.086 -5.158 1.00 0.00 C ATOM 975 CD2 TYR A 71 1.731 -12.217 -3.288 1.00 0.00 C ATOM 976 CE1 TYR A 71 4.108 -12.354 -4.743 1.00 0.00 C ATOM 977 CE2 TYR A 71 2.900 -11.485 -2.873 1.00 0.00 C ATOM 978 CZ TYR A 71 4.031 -11.590 -3.621 1.00 0.00 C ATOM 979 OH TYR A 71 5.135 -10.899 -3.229 1.00 0.00 O ATOM 0 H TYR A 71 -0.974 -15.008 -6.229 1.00 0.00 H new ATOM 0 HA TYR A 71 1.790 -15.451 -5.523 1.00 0.00 H new ATOM 0 HB2 TYR A 71 0.134 -13.322 -5.768 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -0.233 -13.686 -4.094 1.00 0.00 H new ATOM 0 HD1 TYR A 71 2.975 -13.701 -6.045 1.00 0.00 H new ATOM 0 HD2 TYR A 71 0.820 -12.151 -2.712 1.00 0.00 H new ATOM 0 HE1 TYR A 71 5.025 -12.410 -5.310 1.00 0.00 H new ATOM 0 HE2 TYR A 71 2.879 -10.867 -1.988 1.00 0.00 H new ATOM 0 HH TYR A 71 5.047 -10.649 -2.285 1.00 0.00 H new ATOM 988 N HIS A 72 1.422 -15.601 -2.828 1.00 0.00 N ATOM 989 CA HIS A 72 1.396 -16.240 -1.523 1.00 0.00 C ATOM 990 C HIS A 72 1.215 -15.179 -0.436 1.00 0.00 C ATOM 991 O HIS A 72 0.119 -15.013 0.097 1.00 0.00 O ATOM 992 CB HIS A 72 2.647 -17.096 -1.314 1.00 0.00 C ATOM 993 CG HIS A 72 2.665 -17.845 -0.003 1.00 0.00 C ATOM 994 ND1 HIS A 72 3.744 -18.607 0.409 1.00 0.00 N ATOM 995 CD2 HIS A 72 1.728 -17.939 0.984 1.00 0.00 C ATOM 996 CE1 HIS A 72 3.458 -19.133 1.592 1.00 0.00 C ATOM 997 NE2 HIS A 72 2.208 -18.718 1.946 1.00 0.00 N ATOM 0 H HIS A 72 2.065 -14.813 -2.905 1.00 0.00 H new ATOM 0 HA HIS A 72 0.546 -16.920 -1.463 1.00 0.00 H new ATOM 0 HB2 HIS A 72 2.725 -17.813 -2.132 1.00 0.00 H new ATOM 0 HB3 HIS A 72 3.527 -16.455 -1.367 1.00 0.00 H new ATOM 0 HD2 HIS A 72 0.760 -17.461 0.983 1.00 0.00 H new ATOM 0 HE1 HIS A 72 4.102 -19.777 2.173 1.00 0.00 H new ATOM 0 HE2 HIS A 72 1.722 -18.965 2.808 1.00 0.00 H new ATOM 1004 N ARG A 73 2.306 -14.490 -0.138 1.00 0.00 N ATOM 1005 CA ARG A 73 2.281 -13.450 0.876 1.00 0.00 C ATOM 1006 C ARG A 73 1.173 -12.439 0.574 1.00 0.00 C ATOM 1007 O ARG A 73 0.364 -12.652 -0.329 1.00 0.00 O ATOM 1008 CB ARG A 73 3.623 -12.718 0.947 1.00 0.00 C ATOM 1009 CG ARG A 73 4.482 -13.260 2.092 1.00 0.00 C ATOM 1010 CD ARG A 73 5.006 -14.661 1.769 1.00 0.00 C ATOM 1011 NE ARG A 73 5.275 -15.403 3.021 1.00 0.00 N ATOM 1012 CZ ARG A 73 6.406 -15.293 3.731 1.00 0.00 C ATOM 1013 NH1 ARG A 73 7.380 -14.473 3.317 1.00 0.00 N ATOM 1014 NH2 ARG A 73 6.562 -16.004 4.856 1.00 0.00 N ATOM 0 H ARG A 73 3.214 -14.632 -0.581 1.00 0.00 H new ATOM 0 HA ARG A 73 2.089 -13.929 1.836 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.155 -12.833 0.002 1.00 0.00 H new ATOM 0 HB3 ARG A 73 3.452 -11.651 1.089 1.00 0.00 H new ATOM 0 HG2 ARG A 73 5.320 -12.587 2.272 1.00 0.00 H new ATOM 0 HG3 ARG A 73 3.894 -13.290 3.009 1.00 0.00 H new ATOM 0 HD2 ARG A 73 4.276 -15.201 1.166 1.00 0.00 H new ATOM 0 HD3 ARG A 73 5.918 -14.589 1.176 1.00 0.00 H new ATOM 0 HE ARG A 73 4.554 -16.038 3.365 1.00 0.00 H new ATOM 0 HH11 ARG A 73 7.261 -13.932 2.461 1.00 0.00 H new ATOM 0 HH12 ARG A 73 8.241 -14.390 3.858 1.00 0.00 H new ATOM 0 HH21 ARG A 73 5.820 -16.629 5.172 1.00 0.00 H new ATOM 0 HH22 ARG A 73 7.423 -15.921 5.397 1.00 0.00 H new ATOM 1025 N THR A 74 1.172 -11.362 1.344 1.00 0.00 N ATOM 1026 CA THR A 74 0.176 -10.318 1.170 1.00 0.00 C ATOM 1027 C THR A 74 0.822 -9.055 0.596 1.00 0.00 C ATOM 1028 O THR A 74 0.128 -8.101 0.252 1.00 0.00 O ATOM 1029 CB THR A 74 -0.510 -10.090 2.518 1.00 0.00 C ATOM 1030 OG1 THR A 74 0.546 -10.196 3.468 1.00 0.00 O ATOM 1031 CG2 THR A 74 -1.462 -11.229 2.891 1.00 0.00 C ATOM 0 H THR A 74 1.845 -11.189 2.091 1.00 0.00 H new ATOM 0 HA THR A 74 -0.585 -10.614 0.447 1.00 0.00 H new ATOM 0 HB THR A 74 -1.062 -9.150 2.489 1.00 0.00 H new ATOM 0 HG1 THR A 74 0.189 -10.059 4.370 1.00 0.00 H new ATOM 0 HG21 THR A 74 -1.922 -11.017 3.856 1.00 0.00 H new ATOM 0 HG22 THR A 74 -2.238 -11.318 2.131 1.00 0.00 H new ATOM 0 HG23 THR A 74 -0.905 -12.164 2.952 1.00 0.00 H new ATOM 1039 N SER A 75 2.144 -9.092 0.511 1.00 0.00 N ATOM 1040 CA SER A 75 2.892 -7.963 -0.016 1.00 0.00 C ATOM 1041 C SER A 75 3.826 -8.429 -1.134 1.00 0.00 C ATOM 1042 O SER A 75 4.379 -9.526 -1.070 1.00 0.00 O ATOM 1043 CB SER A 75 3.690 -7.269 1.088 1.00 0.00 C ATOM 1044 OG SER A 75 3.843 -8.096 2.238 1.00 0.00 O ATOM 0 H SER A 75 2.716 -9.886 0.798 1.00 0.00 H new ATOM 0 HA SER A 75 2.182 -7.242 -0.422 1.00 0.00 H new ATOM 0 HB2 SER A 75 4.673 -6.994 0.706 1.00 0.00 H new ATOM 0 HB3 SER A 75 3.188 -6.344 1.371 1.00 0.00 H new ATOM 0 HG SER A 75 4.360 -7.617 2.919 1.00 0.00 H new ATOM 1049 N ALA A 76 3.974 -7.572 -2.135 1.00 0.00 N ATOM 1050 CA ALA A 76 4.831 -7.883 -3.265 1.00 0.00 C ATOM 1051 C ALA A 76 5.610 -6.630 -3.669 1.00 0.00 C ATOM 1052 O ALA A 76 5.028 -5.558 -3.829 1.00 0.00 O ATOM 1053 CB ALA A 76 3.983 -8.438 -4.413 1.00 0.00 C ATOM 0 H ALA A 76 3.514 -6.663 -2.186 1.00 0.00 H new ATOM 0 HA ALA A 76 5.557 -8.650 -2.996 1.00 0.00 H new ATOM 0 HB1 ALA A 76 4.627 -8.671 -5.261 1.00 0.00 H new ATOM 0 HB2 ALA A 76 3.474 -9.344 -4.084 1.00 0.00 H new ATOM 0 HB3 ALA A 76 3.244 -7.694 -4.712 1.00 0.00 H new ATOM 1059 N THR A 77 6.914 -6.806 -3.823 1.00 0.00 N ATOM 1060 CA THR A 77 7.778 -5.702 -4.205 1.00 0.00 C ATOM 1061 C THR A 77 7.796 -5.540 -5.726 1.00 0.00 C ATOM 1062 O THR A 77 8.163 -6.465 -6.449 1.00 0.00 O ATOM 1063 CB THR A 77 9.163 -5.955 -3.605 1.00 0.00 C ATOM 1064 OG1 THR A 77 8.934 -5.972 -2.199 1.00 0.00 O ATOM 1065 CG2 THR A 77 10.116 -4.778 -3.814 1.00 0.00 C ATOM 0 H THR A 77 7.393 -7.697 -3.690 1.00 0.00 H new ATOM 0 HA THR A 77 7.406 -4.755 -3.813 1.00 0.00 H new ATOM 0 HB THR A 77 9.593 -6.852 -4.050 1.00 0.00 H new ATOM 0 HG1 THR A 77 9.780 -6.132 -1.732 1.00 0.00 H new ATOM 0 HG21 THR A 77 11.084 -5.010 -3.369 1.00 0.00 H new ATOM 0 HG22 THR A 77 10.241 -4.596 -4.881 1.00 0.00 H new ATOM 0 HG23 THR A 77 9.703 -3.887 -3.340 1.00 0.00 H new ATOM 1073 N ILE A 78 7.393 -4.357 -6.168 1.00 0.00 N ATOM 1074 CA ILE A 78 7.358 -4.061 -7.590 1.00 0.00 C ATOM 1075 C ILE A 78 8.665 -3.376 -7.997 1.00 0.00 C ATOM 1076 O ILE A 78 9.273 -2.667 -7.196 1.00 0.00 O ATOM 1077 CB ILE A 78 6.105 -3.254 -7.939 1.00 0.00 C ATOM 1078 CG1 ILE A 78 4.875 -3.816 -7.224 1.00 0.00 C ATOM 1079 CG2 ILE A 78 5.906 -3.180 -9.454 1.00 0.00 C ATOM 1080 CD1 ILE A 78 4.405 -5.116 -7.882 1.00 0.00 C ATOM 0 H ILE A 78 7.088 -3.592 -5.566 1.00 0.00 H new ATOM 0 HA ILE A 78 7.287 -4.982 -8.169 1.00 0.00 H new ATOM 0 HB ILE A 78 6.244 -2.233 -7.583 1.00 0.00 H new ATOM 0 HG12 ILE A 78 5.111 -3.999 -6.176 1.00 0.00 H new ATOM 0 HG13 ILE A 78 4.070 -3.081 -7.246 1.00 0.00 H new ATOM 0 HG21 ILE A 78 5.009 -2.601 -9.675 1.00 0.00 H new ATOM 0 HG22 ILE A 78 6.770 -2.699 -9.911 1.00 0.00 H new ATOM 0 HG23 ILE A 78 5.796 -4.187 -9.856 1.00 0.00 H new ATOM 0 HD11 ILE A 78 3.529 -5.495 -7.355 1.00 0.00 H new ATOM 0 HD12 ILE A 78 4.147 -4.924 -8.923 1.00 0.00 H new ATOM 0 HD13 ILE A 78 5.204 -5.856 -7.837 1.00 0.00 H new ATOM 1091 N THR A 79 9.056 -3.612 -9.240 1.00 0.00 N ATOM 1092 CA THR A 79 10.280 -3.027 -9.763 1.00 0.00 C ATOM 1093 C THR A 79 10.085 -2.596 -11.218 1.00 0.00 C ATOM 1094 O THR A 79 8.979 -2.236 -11.620 1.00 0.00 O ATOM 1095 CB THR A 79 11.408 -4.043 -9.576 1.00 0.00 C ATOM 1096 OG1 THR A 79 12.570 -3.362 -10.043 1.00 0.00 O ATOM 1097 CG2 THR A 79 11.276 -5.243 -10.516 1.00 0.00 C ATOM 0 H THR A 79 8.548 -4.200 -9.901 1.00 0.00 H new ATOM 0 HA THR A 79 10.548 -2.120 -9.221 1.00 0.00 H new ATOM 0 HB THR A 79 11.416 -4.390 -8.543 1.00 0.00 H new ATOM 0 HG1 THR A 79 13.350 -3.949 -9.956 1.00 0.00 H new ATOM 0 HG21 THR A 79 12.101 -5.934 -10.343 1.00 0.00 H new ATOM 0 HG22 THR A 79 10.331 -5.752 -10.326 1.00 0.00 H new ATOM 0 HG23 THR A 79 11.302 -4.900 -11.550 1.00 0.00 H new ATOM 1105 N GLU A 80 11.176 -2.647 -11.967 1.00 0.00 N ATOM 1106 CA GLU A 80 11.139 -2.266 -13.369 1.00 0.00 C ATOM 1107 C GLU A 80 10.292 -1.006 -13.555 1.00 0.00 C ATOM 1108 O GLU A 80 9.623 -0.848 -14.574 1.00 0.00 O ATOM 1109 CB GLU A 80 10.614 -3.413 -14.235 1.00 0.00 C ATOM 1110 CG GLU A 80 11.766 -4.201 -14.861 1.00 0.00 C ATOM 1111 CD GLU A 80 11.276 -5.047 -16.038 1.00 0.00 C ATOM 1112 OE1 GLU A 80 10.436 -5.937 -15.786 1.00 0.00 O ATOM 1113 OE2 GLU A 80 11.754 -4.784 -17.164 1.00 0.00 O ATOM 0 H GLU A 80 12.091 -2.946 -11.630 1.00 0.00 H new ATOM 0 HA GLU A 80 12.156 -2.046 -13.693 1.00 0.00 H new ATOM 0 HB2 GLU A 80 10.000 -4.079 -13.629 1.00 0.00 H new ATOM 0 HB3 GLU A 80 9.972 -3.015 -15.021 1.00 0.00 H new ATOM 0 HG2 GLU A 80 12.540 -3.513 -15.201 1.00 0.00 H new ATOM 0 HG3 GLU A 80 12.221 -4.846 -14.109 1.00 0.00 H new ATOM 1118 N LEU A 81 10.350 -0.140 -12.553 1.00 0.00 N ATOM 1119 CA LEU A 81 9.596 1.102 -12.594 1.00 0.00 C ATOM 1120 C LEU A 81 10.483 2.213 -13.157 1.00 0.00 C ATOM 1121 O LEU A 81 11.706 2.158 -13.037 1.00 0.00 O ATOM 1122 CB LEU A 81 9.013 1.419 -11.215 1.00 0.00 C ATOM 1123 CG LEU A 81 7.751 0.646 -10.826 1.00 0.00 C ATOM 1124 CD1 LEU A 81 7.460 0.789 -9.331 1.00 0.00 C ATOM 1125 CD2 LEU A 81 6.560 1.072 -11.686 1.00 0.00 C ATOM 0 H LEU A 81 10.907 -0.274 -11.709 1.00 0.00 H new ATOM 0 HA LEU A 81 8.740 1.008 -13.263 1.00 0.00 H new ATOM 0 HB2 LEU A 81 9.780 1.225 -10.465 1.00 0.00 H new ATOM 0 HB3 LEU A 81 8.789 2.485 -11.173 1.00 0.00 H new ATOM 0 HG LEU A 81 7.925 -0.412 -11.020 1.00 0.00 H new ATOM 0 HD11 LEU A 81 6.558 0.230 -9.081 1.00 0.00 H new ATOM 0 HD12 LEU A 81 8.300 0.397 -8.758 1.00 0.00 H new ATOM 0 HD13 LEU A 81 7.314 1.841 -9.088 1.00 0.00 H new ATOM 0 HD21 LEU A 81 5.676 0.507 -11.389 1.00 0.00 H new ATOM 0 HD22 LEU A 81 6.374 2.137 -11.548 1.00 0.00 H new ATOM 0 HD23 LEU A 81 6.780 0.876 -12.735 1.00 0.00 H new ATOM 1136 N VAL A 82 9.833 3.198 -13.761 1.00 0.00 N ATOM 1137 CA VAL A 82 10.547 4.320 -14.344 1.00 0.00 C ATOM 1138 C VAL A 82 10.237 5.587 -13.543 1.00 0.00 C ATOM 1139 O VAL A 82 9.074 5.954 -13.381 1.00 0.00 O ATOM 1140 CB VAL A 82 10.198 4.450 -15.828 1.00 0.00 C ATOM 1141 CG1 VAL A 82 10.714 5.772 -16.399 1.00 0.00 C ATOM 1142 CG2 VAL A 82 10.738 3.260 -16.624 1.00 0.00 C ATOM 0 H VAL A 82 8.819 3.241 -13.859 1.00 0.00 H new ATOM 0 HA VAL A 82 11.623 4.157 -14.291 1.00 0.00 H new ATOM 0 HB VAL A 82 9.112 4.448 -15.918 1.00 0.00 H new ATOM 0 HG11 VAL A 82 10.453 5.839 -17.455 1.00 0.00 H new ATOM 0 HG12 VAL A 82 10.260 6.603 -15.859 1.00 0.00 H new ATOM 0 HG13 VAL A 82 11.798 5.817 -16.290 1.00 0.00 H new ATOM 0 HG21 VAL A 82 10.476 3.377 -17.676 1.00 0.00 H new ATOM 0 HG22 VAL A 82 11.822 3.216 -16.523 1.00 0.00 H new ATOM 0 HG23 VAL A 82 10.300 2.338 -16.242 1.00 0.00 H new ATOM 1152 N ILE A 83 11.297 6.220 -13.065 1.00 0.00 N ATOM 1153 CA ILE A 83 11.152 7.439 -12.285 1.00 0.00 C ATOM 1154 C ILE A 83 10.544 8.532 -13.165 1.00 0.00 C ATOM 1155 O ILE A 83 10.919 8.678 -14.328 1.00 0.00 O ATOM 1156 CB ILE A 83 12.488 7.831 -11.652 1.00 0.00 C ATOM 1157 CG1 ILE A 83 13.009 6.720 -10.737 1.00 0.00 C ATOM 1158 CG2 ILE A 83 12.376 9.170 -10.920 1.00 0.00 C ATOM 1159 CD1 ILE A 83 14.279 7.162 -10.005 1.00 0.00 C ATOM 0 H ILE A 83 12.260 5.913 -13.202 1.00 0.00 H new ATOM 0 HA ILE A 83 10.466 7.281 -11.453 1.00 0.00 H new ATOM 0 HB ILE A 83 13.219 7.960 -12.450 1.00 0.00 H new ATOM 0 HG12 ILE A 83 12.241 6.452 -10.011 1.00 0.00 H new ATOM 0 HG13 ILE A 83 13.217 5.827 -11.326 1.00 0.00 H new ATOM 0 HG21 ILE A 83 13.340 9.425 -10.479 1.00 0.00 H new ATOM 0 HG22 ILE A 83 12.083 9.947 -11.626 1.00 0.00 H new ATOM 0 HG23 ILE A 83 11.626 9.093 -10.133 1.00 0.00 H new ATOM 0 HD11 ILE A 83 14.628 6.354 -9.362 1.00 0.00 H new ATOM 0 HD12 ILE A 83 15.052 7.406 -10.733 1.00 0.00 H new ATOM 0 HD13 ILE A 83 14.062 8.041 -9.398 1.00 0.00 H new ATOM 1170 N GLY A 84 9.616 9.273 -12.577 1.00 0.00 N ATOM 1171 CA GLY A 84 8.952 10.349 -13.293 1.00 0.00 C ATOM 1172 C GLY A 84 7.649 9.862 -13.929 1.00 0.00 C ATOM 1173 O GLY A 84 7.318 10.250 -15.049 1.00 0.00 O ATOM 0 H GLY A 84 9.308 9.149 -11.612 1.00 0.00 H new ATOM 0 HA2 GLY A 84 8.742 11.171 -12.608 1.00 0.00 H new ATOM 0 HA3 GLY A 84 9.614 10.739 -14.066 1.00 0.00 H new ATOM 1177 N ASN A 85 6.944 9.019 -13.188 1.00 0.00 N ATOM 1178 CA ASN A 85 5.684 8.476 -13.665 1.00 0.00 C ATOM 1179 C ASN A 85 4.899 7.906 -12.483 1.00 0.00 C ATOM 1180 O ASN A 85 5.480 7.566 -11.453 1.00 0.00 O ATOM 1181 CB ASN A 85 5.918 7.344 -14.668 1.00 0.00 C ATOM 1182 CG ASN A 85 6.176 7.897 -16.071 1.00 0.00 C ATOM 1183 OD1 ASN A 85 5.537 8.831 -16.524 1.00 0.00 O ATOM 1184 ND2 ASN A 85 7.148 7.271 -16.729 1.00 0.00 N ATOM 0 H ASN A 85 7.222 8.699 -12.260 1.00 0.00 H new ATOM 0 HA ASN A 85 5.132 9.280 -14.151 1.00 0.00 H new ATOM 0 HB2 ASN A 85 6.768 6.741 -14.349 1.00 0.00 H new ATOM 0 HB3 ASN A 85 5.050 6.685 -14.687 1.00 0.00 H new ATOM 0 HD21 ASN A 85 7.398 7.567 -17.673 1.00 0.00 H new ATOM 0 HD22 ASN A 85 7.643 6.495 -16.290 1.00 0.00 H new ATOM 1190 N GLU A 86 3.591 7.818 -12.670 1.00 0.00 N ATOM 1191 CA GLU A 86 2.719 7.295 -11.631 1.00 0.00 C ATOM 1192 C GLU A 86 1.985 6.050 -12.132 1.00 0.00 C ATOM 1193 O GLU A 86 1.445 6.045 -13.237 1.00 0.00 O ATOM 1194 CB GLU A 86 1.729 8.362 -11.158 1.00 0.00 C ATOM 1195 CG GLU A 86 0.936 8.934 -12.333 1.00 0.00 C ATOM 1196 CD GLU A 86 1.407 10.349 -12.677 1.00 0.00 C ATOM 1197 OE1 GLU A 86 2.632 10.505 -12.878 1.00 0.00 O ATOM 1198 OE2 GLU A 86 0.534 11.241 -12.730 1.00 0.00 O ATOM 0 H GLU A 86 3.113 8.100 -13.526 1.00 0.00 H new ATOM 0 HA GLU A 86 3.333 7.012 -10.776 1.00 0.00 H new ATOM 0 HB2 GLU A 86 1.044 7.930 -10.429 1.00 0.00 H new ATOM 0 HB3 GLU A 86 2.267 9.164 -10.653 1.00 0.00 H new ATOM 0 HG2 GLU A 86 1.051 8.287 -13.203 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -0.126 8.950 -12.086 1.00 0.00 H new ATOM 1203 N TYR A 87 1.988 5.023 -11.294 1.00 0.00 N ATOM 1204 CA TYR A 87 1.330 3.774 -11.638 1.00 0.00 C ATOM 1205 C TYR A 87 0.294 3.391 -10.579 1.00 0.00 C ATOM 1206 O TYR A 87 0.234 4.003 -9.515 1.00 0.00 O ATOM 1207 CB TYR A 87 2.429 2.711 -11.666 1.00 0.00 C ATOM 1208 CG TYR A 87 3.642 3.092 -12.519 1.00 0.00 C ATOM 1209 CD1 TYR A 87 4.679 3.812 -11.959 1.00 0.00 C ATOM 1210 CD2 TYR A 87 3.699 2.717 -13.845 1.00 0.00 C ATOM 1211 CE1 TYR A 87 5.820 4.171 -12.761 1.00 0.00 C ATOM 1212 CE2 TYR A 87 4.841 3.077 -14.647 1.00 0.00 C ATOM 1213 CZ TYR A 87 5.845 3.785 -14.065 1.00 0.00 C ATOM 1214 OH TYR A 87 6.923 4.124 -14.822 1.00 0.00 O ATOM 0 H TYR A 87 2.436 5.031 -10.378 1.00 0.00 H new ATOM 0 HA TYR A 87 0.812 3.864 -12.593 1.00 0.00 H new ATOM 0 HB2 TYR A 87 2.761 2.519 -10.646 1.00 0.00 H new ATOM 0 HB3 TYR A 87 2.009 1.779 -12.045 1.00 0.00 H new ATOM 0 HD1 TYR A 87 4.634 4.106 -10.921 1.00 0.00 H new ATOM 0 HD2 TYR A 87 2.888 2.154 -14.282 1.00 0.00 H new ATOM 0 HE1 TYR A 87 6.638 4.734 -12.336 1.00 0.00 H new ATOM 0 HE2 TYR A 87 4.898 2.791 -15.687 1.00 0.00 H new ATOM 0 HH TYR A 87 7.523 4.697 -14.300 1.00 0.00 H new ATOM 1223 N TYR A 88 -0.497 2.381 -10.909 1.00 0.00 N ATOM 1224 CA TYR A 88 -1.527 1.909 -10.000 1.00 0.00 C ATOM 1225 C TYR A 88 -1.311 0.436 -9.644 1.00 0.00 C ATOM 1226 O TYR A 88 -0.352 -0.183 -10.102 1.00 0.00 O ATOM 1227 CB TYR A 88 -2.851 2.050 -10.753 1.00 0.00 C ATOM 1228 CG TYR A 88 -3.477 3.443 -10.653 1.00 0.00 C ATOM 1229 CD1 TYR A 88 -3.741 3.993 -9.416 1.00 0.00 C ATOM 1230 CD2 TYR A 88 -3.779 4.147 -11.800 1.00 0.00 C ATOM 1231 CE1 TYR A 88 -4.331 5.304 -9.322 1.00 0.00 C ATOM 1232 CE2 TYR A 88 -4.369 5.458 -11.706 1.00 0.00 C ATOM 1233 CZ TYR A 88 -4.616 5.971 -10.472 1.00 0.00 C ATOM 1234 OH TYR A 88 -5.173 7.209 -10.384 1.00 0.00 O ATOM 0 H TYR A 88 -0.445 1.876 -11.794 1.00 0.00 H new ATOM 0 HA TYR A 88 -1.511 2.480 -9.072 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -2.687 1.811 -11.804 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -3.558 1.316 -10.366 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -3.505 3.441 -8.518 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -3.573 3.716 -12.768 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -4.542 5.747 -8.360 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -4.610 6.020 -12.596 1.00 0.00 H new ATOM 0 HH TYR A 88 -5.321 7.566 -11.285 1.00 0.00 H new ATOM 1243 N PHE A 89 -2.220 -0.082 -8.830 1.00 0.00 N ATOM 1244 CA PHE A 89 -2.142 -1.470 -8.407 1.00 0.00 C ATOM 1245 C PHE A 89 -3.495 -1.964 -7.894 1.00 0.00 C ATOM 1246 O PHE A 89 -4.160 -1.274 -7.121 1.00 0.00 O ATOM 1247 CB PHE A 89 -1.123 -1.533 -7.267 1.00 0.00 C ATOM 1248 CG PHE A 89 0.243 -0.942 -7.619 1.00 0.00 C ATOM 1249 CD1 PHE A 89 1.059 -1.589 -8.495 1.00 0.00 C ATOM 1250 CD2 PHE A 89 0.642 0.231 -7.059 1.00 0.00 C ATOM 1251 CE1 PHE A 89 2.327 -1.041 -8.822 1.00 0.00 C ATOM 1252 CE2 PHE A 89 1.910 0.780 -7.385 1.00 0.00 C ATOM 1253 CZ PHE A 89 2.726 0.132 -8.260 1.00 0.00 C ATOM 0 H PHE A 89 -3.014 0.435 -8.452 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.851 -2.100 -9.248 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -1.525 -1.002 -6.404 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -0.991 -2.573 -6.968 1.00 0.00 H new ATOM 0 HD1 PHE A 89 0.742 -2.520 -8.942 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -0.006 0.746 -6.365 1.00 0.00 H new ATOM 0 HE1 PHE A 89 2.975 -1.555 -9.517 1.00 0.00 H new ATOM 0 HE2 PHE A 89 2.227 1.711 -6.939 1.00 0.00 H new ATOM 0 HZ PHE A 89 3.691 0.549 -8.508 1.00 0.00 H new ATOM 1262 N ARG A 90 -3.864 -3.154 -8.343 1.00 0.00 N ATOM 1263 CA ARG A 90 -5.127 -3.749 -7.939 1.00 0.00 C ATOM 1264 C ARG A 90 -4.949 -5.247 -7.679 1.00 0.00 C ATOM 1265 O ARG A 90 -4.419 -5.967 -8.523 1.00 0.00 O ATOM 1266 CB ARG A 90 -6.199 -3.548 -9.012 1.00 0.00 C ATOM 1267 CG ARG A 90 -5.799 -4.231 -10.321 1.00 0.00 C ATOM 1268 CD ARG A 90 -6.806 -3.922 -11.431 1.00 0.00 C ATOM 1269 NE ARG A 90 -6.352 -4.519 -12.707 1.00 0.00 N ATOM 1270 CZ ARG A 90 -7.065 -4.498 -13.841 1.00 0.00 C ATOM 1271 NH1 ARG A 90 -8.270 -3.909 -13.866 1.00 0.00 N ATOM 1272 NH2 ARG A 90 -6.576 -5.066 -14.952 1.00 0.00 N ATOM 0 H ARG A 90 -3.310 -3.723 -8.983 1.00 0.00 H new ATOM 0 HA ARG A 90 -5.449 -3.254 -7.023 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -7.149 -3.952 -8.662 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -6.350 -2.482 -9.185 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -4.807 -3.896 -10.622 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -5.739 -5.309 -10.169 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -7.786 -4.316 -11.164 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -6.916 -2.843 -11.543 1.00 0.00 H new ATOM 0 HE ARG A 90 -5.440 -4.975 -12.724 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -8.644 -3.477 -13.021 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -8.812 -3.893 -14.730 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -5.660 -5.515 -14.935 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -7.120 -5.050 -15.815 1.00 0.00 H new ATOM 1283 N VAL A 91 -5.404 -5.670 -6.509 1.00 0.00 N ATOM 1284 CA VAL A 91 -5.302 -7.067 -6.128 1.00 0.00 C ATOM 1285 C VAL A 91 -6.668 -7.738 -6.297 1.00 0.00 C ATOM 1286 O VAL A 91 -7.668 -7.257 -5.769 1.00 0.00 O ATOM 1287 CB VAL A 91 -4.750 -7.184 -4.706 1.00 0.00 C ATOM 1288 CG1 VAL A 91 -4.707 -8.645 -4.253 1.00 0.00 C ATOM 1289 CG2 VAL A 91 -3.369 -6.535 -4.599 1.00 0.00 C ATOM 0 H VAL A 91 -5.844 -5.069 -5.812 1.00 0.00 H new ATOM 0 HA VAL A 91 -4.600 -7.590 -6.778 1.00 0.00 H new ATOM 0 HB VAL A 91 -5.425 -6.647 -4.039 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -4.311 -8.700 -3.239 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -5.714 -9.062 -4.272 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -4.066 -9.215 -4.925 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -2.999 -6.632 -3.578 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -2.680 -7.031 -5.283 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -3.442 -5.479 -4.860 1.00 0.00 H new ATOM 1299 N PHE A 92 -6.664 -8.839 -7.034 1.00 0.00 N ATOM 1300 CA PHE A 92 -7.889 -9.581 -7.279 1.00 0.00 C ATOM 1301 C PHE A 92 -7.953 -10.837 -6.408 1.00 0.00 C ATOM 1302 O PHE A 92 -7.073 -11.067 -5.578 1.00 0.00 O ATOM 1303 CB PHE A 92 -7.874 -9.995 -8.751 1.00 0.00 C ATOM 1304 CG PHE A 92 -8.160 -8.849 -9.724 1.00 0.00 C ATOM 1305 CD1 PHE A 92 -9.442 -8.486 -9.990 1.00 0.00 C ATOM 1306 CD2 PHE A 92 -7.129 -8.193 -10.322 1.00 0.00 C ATOM 1307 CE1 PHE A 92 -9.707 -7.423 -10.893 1.00 0.00 C ATOM 1308 CE2 PHE A 92 -7.393 -7.129 -11.224 1.00 0.00 C ATOM 1309 CZ PHE A 92 -8.676 -6.766 -11.491 1.00 0.00 C ATOM 0 H PHE A 92 -5.831 -9.235 -7.470 1.00 0.00 H new ATOM 0 HA PHE A 92 -8.753 -8.962 -7.040 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -6.900 -10.424 -8.987 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -8.614 -10.781 -8.904 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -10.260 -9.006 -9.514 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -6.110 -8.482 -10.111 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -10.726 -7.136 -11.105 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -6.575 -6.608 -11.698 1.00 0.00 H new ATOM 0 HZ PHE A 92 -8.877 -5.957 -12.177 1.00 0.00 H new ATOM 1318 N SER A 93 -9.002 -11.616 -6.625 1.00 0.00 N ATOM 1319 CA SER A 93 -9.192 -12.843 -5.871 1.00 0.00 C ATOM 1320 C SER A 93 -9.194 -14.045 -6.817 1.00 0.00 C ATOM 1321 O SER A 93 -10.135 -14.234 -7.585 1.00 0.00 O ATOM 1322 CB SER A 93 -10.493 -12.800 -5.066 1.00 0.00 C ATOM 1323 OG SER A 93 -10.767 -11.494 -4.564 1.00 0.00 O ATOM 0 H SER A 93 -9.730 -11.421 -7.313 1.00 0.00 H new ATOM 0 HA SER A 93 -8.364 -12.943 -5.169 1.00 0.00 H new ATOM 0 HB2 SER A 93 -11.320 -13.127 -5.696 1.00 0.00 H new ATOM 0 HB3 SER A 93 -10.428 -13.502 -4.235 1.00 0.00 H new ATOM 0 HG SER A 93 -10.587 -11.469 -3.601 1.00 0.00 H new ATOM 1328 N GLU A 94 -8.127 -14.827 -6.731 1.00 0.00 N ATOM 1329 CA GLU A 94 -7.994 -16.005 -7.571 1.00 0.00 C ATOM 1330 C GLU A 94 -8.536 -17.238 -6.845 1.00 0.00 C ATOM 1331 O GLU A 94 -8.513 -17.300 -5.616 1.00 0.00 O ATOM 1332 CB GLU A 94 -6.538 -16.215 -7.994 1.00 0.00 C ATOM 1333 CG GLU A 94 -6.308 -15.725 -9.425 1.00 0.00 C ATOM 1334 CD GLU A 94 -5.198 -16.527 -10.108 1.00 0.00 C ATOM 1335 OE1 GLU A 94 -4.026 -16.121 -9.950 1.00 0.00 O ATOM 1336 OE2 GLU A 94 -5.547 -17.527 -10.770 1.00 0.00 O ATOM 0 H GLU A 94 -7.347 -14.668 -6.093 1.00 0.00 H new ATOM 0 HA GLU A 94 -8.583 -15.851 -8.475 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -5.877 -15.681 -7.312 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -6.283 -17.272 -7.922 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -7.231 -15.816 -9.997 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -6.043 -14.668 -9.413 1.00 0.00 H new ATOM 1341 N ASN A 95 -9.012 -18.189 -7.635 1.00 0.00 N ATOM 1342 CA ASN A 95 -9.559 -19.417 -7.083 1.00 0.00 C ATOM 1343 C ASN A 95 -10.082 -20.294 -8.222 1.00 0.00 C ATOM 1344 O ASN A 95 -9.783 -20.046 -9.390 1.00 0.00 O ATOM 1345 CB ASN A 95 -10.725 -19.123 -6.138 1.00 0.00 C ATOM 1346 CG ASN A 95 -11.979 -18.730 -6.921 1.00 0.00 C ATOM 1347 OD1 ASN A 95 -11.931 -17.991 -7.891 1.00 0.00 O ATOM 1348 ND2 ASN A 95 -13.102 -19.263 -6.448 1.00 0.00 N ATOM 0 H ASN A 95 -9.030 -18.134 -8.653 1.00 0.00 H new ATOM 0 HA ASN A 95 -8.766 -19.922 -6.531 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -10.934 -20.002 -5.528 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -10.451 -18.318 -5.456 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -13.993 -19.061 -6.902 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -13.072 -19.874 -5.632 1.00 0.00 H new ATOM 1354 N MET A 96 -10.853 -21.303 -7.843 1.00 0.00 N ATOM 1355 CA MET A 96 -11.420 -22.219 -8.818 1.00 0.00 C ATOM 1356 C MET A 96 -12.203 -21.461 -9.892 1.00 0.00 C ATOM 1357 O MET A 96 -12.134 -21.801 -11.072 1.00 0.00 O ATOM 1358 CB MET A 96 -12.350 -23.206 -8.111 1.00 0.00 C ATOM 1359 CG MET A 96 -13.430 -22.471 -7.317 1.00 0.00 C ATOM 1360 SD MET A 96 -14.902 -22.290 -8.311 1.00 0.00 S ATOM 1361 CE MET A 96 -16.093 -23.091 -7.249 1.00 0.00 C ATOM 0 H MET A 96 -11.098 -21.506 -6.874 1.00 0.00 H new ATOM 0 HA MET A 96 -10.604 -22.757 -9.301 1.00 0.00 H new ATOM 0 HB2 MET A 96 -12.817 -23.861 -8.846 1.00 0.00 H new ATOM 0 HB3 MET A 96 -11.770 -23.841 -7.441 1.00 0.00 H new ATOM 0 HG2 MET A 96 -13.662 -23.023 -6.406 1.00 0.00 H new ATOM 0 HG3 MET A 96 -13.065 -21.491 -7.012 1.00 0.00 H new ATOM 0 HE1 MET A 96 -16.828 -23.617 -7.858 1.00 0.00 H new ATOM 0 HE2 MET A 96 -15.582 -23.803 -6.601 1.00 0.00 H new ATOM 0 HE3 MET A 96 -16.597 -22.342 -6.638 1.00 0.00 H new ATOM 1369 N CYS A 97 -12.929 -20.446 -9.446 1.00 0.00 N ATOM 1370 CA CYS A 97 -13.723 -19.637 -10.353 1.00 0.00 C ATOM 1371 C CYS A 97 -12.771 -18.900 -11.298 1.00 0.00 C ATOM 1372 O CYS A 97 -12.536 -19.346 -12.420 1.00 0.00 O ATOM 1373 CB CYS A 97 -14.638 -18.671 -9.598 1.00 0.00 C ATOM 1374 SG CYS A 97 -16.216 -19.500 -9.182 1.00 0.00 S ATOM 0 H CYS A 97 -12.983 -20.166 -8.467 1.00 0.00 H new ATOM 0 HA CYS A 97 -14.384 -20.281 -10.933 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -14.147 -18.328 -8.687 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -14.831 -17.788 -10.208 1.00 0.00 H new ATOM 0 HG CYS A 97 -15.975 -20.705 -8.759 1.00 0.00 H new ATOM 1379 N GLY A 98 -12.251 -17.783 -10.810 1.00 0.00 N ATOM 1380 CA GLY A 98 -11.330 -16.980 -11.596 1.00 0.00 C ATOM 1381 C GLY A 98 -10.973 -15.684 -10.867 1.00 0.00 C ATOM 1382 O GLY A 98 -10.691 -15.698 -9.670 1.00 0.00 O ATOM 0 H GLY A 98 -12.450 -17.415 -9.880 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -10.423 -17.551 -11.795 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -11.778 -16.747 -12.562 1.00 0.00 H new ATOM 1386 N LEU A 99 -10.998 -14.593 -11.619 1.00 0.00 N ATOM 1387 CA LEU A 99 -10.681 -13.290 -11.059 1.00 0.00 C ATOM 1388 C LEU A 99 -11.979 -12.543 -10.749 1.00 0.00 C ATOM 1389 O LEU A 99 -13.012 -12.805 -11.365 1.00 0.00 O ATOM 1390 CB LEU A 99 -9.736 -12.524 -11.988 1.00 0.00 C ATOM 1391 CG LEU A 99 -8.322 -13.092 -12.123 1.00 0.00 C ATOM 1392 CD1 LEU A 99 -7.578 -13.034 -10.788 1.00 0.00 C ATOM 1393 CD2 LEU A 99 -8.352 -14.508 -12.701 1.00 0.00 C ATOM 0 H LEU A 99 -11.233 -14.585 -12.612 1.00 0.00 H new ATOM 0 HA LEU A 99 -10.145 -13.400 -10.117 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -10.187 -12.485 -12.980 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -9.661 -11.497 -11.631 1.00 0.00 H new ATOM 0 HG LEU A 99 -7.770 -12.469 -12.827 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -6.576 -13.444 -10.912 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -7.508 -11.998 -10.455 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -8.119 -13.618 -10.044 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -7.334 -14.888 -12.786 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -8.928 -15.158 -12.042 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -8.816 -14.489 -13.687 1.00 0.00 H new ATOM 1404 N SER A 100 -11.884 -11.628 -9.796 1.00 0.00 N ATOM 1405 CA SER A 100 -13.039 -10.840 -9.398 1.00 0.00 C ATOM 1406 C SER A 100 -13.199 -9.638 -10.329 1.00 0.00 C ATOM 1407 O SER A 100 -12.246 -8.894 -10.558 1.00 0.00 O ATOM 1408 CB SER A 100 -12.913 -10.374 -7.946 1.00 0.00 C ATOM 1409 OG SER A 100 -11.630 -9.816 -7.674 1.00 0.00 O ATOM 0 H SER A 100 -11.026 -11.414 -9.288 1.00 0.00 H new ATOM 0 HA SER A 100 -13.925 -11.470 -9.474 1.00 0.00 H new ATOM 0 HB2 SER A 100 -13.683 -9.632 -7.735 1.00 0.00 H new ATOM 0 HB3 SER A 100 -13.091 -11.217 -7.278 1.00 0.00 H new ATOM 0 HG SER A 100 -11.711 -8.845 -7.567 1.00 0.00 H new ATOM 1414 N GLU A 101 -14.411 -9.484 -10.842 1.00 0.00 N ATOM 1415 CA GLU A 101 -14.708 -8.384 -11.744 1.00 0.00 C ATOM 1416 C GLU A 101 -14.296 -7.053 -11.111 1.00 0.00 C ATOM 1417 O GLU A 101 -13.803 -6.160 -11.800 1.00 0.00 O ATOM 1418 CB GLU A 101 -16.190 -8.374 -12.126 1.00 0.00 C ATOM 1419 CG GLU A 101 -16.380 -8.764 -13.593 1.00 0.00 C ATOM 1420 CD GLU A 101 -17.279 -7.758 -14.315 1.00 0.00 C ATOM 1421 OE1 GLU A 101 -18.290 -7.357 -13.700 1.00 0.00 O ATOM 1422 OE2 GLU A 101 -16.934 -7.412 -15.466 1.00 0.00 O ATOM 0 H GLU A 101 -15.199 -10.103 -10.650 1.00 0.00 H new ATOM 0 HA GLU A 101 -14.131 -8.523 -12.659 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -16.739 -9.067 -11.488 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -16.607 -7.382 -11.953 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -15.410 -8.812 -14.089 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -16.819 -9.760 -13.655 1.00 0.00 H new ATOM 1427 N ASP A 102 -14.513 -6.961 -9.808 1.00 0.00 N ATOM 1428 CA ASP A 102 -14.170 -5.755 -9.074 1.00 0.00 C ATOM 1429 C ASP A 102 -12.923 -6.015 -8.228 1.00 0.00 C ATOM 1430 O ASP A 102 -12.819 -7.050 -7.570 1.00 0.00 O ATOM 1431 CB ASP A 102 -15.302 -5.341 -8.133 1.00 0.00 C ATOM 1432 CG ASP A 102 -16.655 -5.996 -8.422 1.00 0.00 C ATOM 1433 OD1 ASP A 102 -16.768 -7.210 -8.144 1.00 0.00 O ATOM 1434 OD2 ASP A 102 -17.545 -5.269 -8.914 1.00 0.00 O ATOM 0 H ASP A 102 -14.923 -7.703 -9.241 1.00 0.00 H new ATOM 0 HA ASP A 102 -13.994 -4.959 -9.798 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -15.010 -5.581 -7.110 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -15.421 -4.259 -8.185 1.00 0.00 H new ATOM 1438 N ALA A 103 -12.007 -5.057 -8.270 1.00 0.00 N ATOM 1439 CA ALA A 103 -10.771 -5.171 -7.514 1.00 0.00 C ATOM 1440 C ALA A 103 -10.545 -3.882 -6.720 1.00 0.00 C ATOM 1441 O ALA A 103 -11.057 -2.825 -7.086 1.00 0.00 O ATOM 1442 CB ALA A 103 -9.615 -5.476 -8.469 1.00 0.00 C ATOM 0 H ALA A 103 -12.096 -4.200 -8.815 1.00 0.00 H new ATOM 0 HA ALA A 103 -10.831 -5.993 -6.801 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -8.688 -5.562 -7.902 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -9.810 -6.414 -8.989 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.522 -4.670 -9.197 1.00 0.00 H new ATOM 1448 N THR A 104 -9.780 -4.015 -5.646 1.00 0.00 N ATOM 1449 CA THR A 104 -9.480 -2.875 -4.796 1.00 0.00 C ATOM 1450 C THR A 104 -8.174 -2.211 -5.236 1.00 0.00 C ATOM 1451 O THR A 104 -7.090 -2.689 -4.908 1.00 0.00 O ATOM 1452 CB THR A 104 -9.458 -3.360 -3.346 1.00 0.00 C ATOM 1453 OG1 THR A 104 -10.684 -4.070 -3.198 1.00 0.00 O ATOM 1454 CG2 THR A 104 -9.569 -2.210 -2.342 1.00 0.00 C ATOM 0 H THR A 104 -9.359 -4.894 -5.345 1.00 0.00 H new ATOM 0 HA THR A 104 -10.245 -2.103 -4.884 1.00 0.00 H new ATOM 0 HB THR A 104 -8.537 -3.914 -3.163 1.00 0.00 H new ATOM 0 HG1 THR A 104 -10.686 -4.544 -2.340 1.00 0.00 H new ATOM 0 HG21 THR A 104 -9.549 -2.609 -1.328 1.00 0.00 H new ATOM 0 HG22 THR A 104 -8.732 -1.525 -2.479 1.00 0.00 H new ATOM 0 HG23 THR A 104 -10.505 -1.676 -2.503 1.00 0.00 H new ATOM 1462 N MET A 105 -8.321 -1.119 -5.972 1.00 0.00 N ATOM 1463 CA MET A 105 -7.167 -0.383 -6.459 1.00 0.00 C ATOM 1464 C MET A 105 -6.795 0.751 -5.503 1.00 0.00 C ATOM 1465 O MET A 105 -7.659 1.307 -4.827 1.00 0.00 O ATOM 1466 CB MET A 105 -7.476 0.195 -7.841 1.00 0.00 C ATOM 1467 CG MET A 105 -6.228 0.824 -8.465 1.00 0.00 C ATOM 1468 SD MET A 105 -6.371 2.603 -8.454 1.00 0.00 S ATOM 1469 CE MET A 105 -6.632 2.903 -10.195 1.00 0.00 C ATOM 0 H MET A 105 -9.222 -0.726 -6.243 1.00 0.00 H new ATOM 0 HA MET A 105 -6.323 -1.070 -6.523 1.00 0.00 H new ATOM 0 HB2 MET A 105 -7.855 -0.593 -8.492 1.00 0.00 H new ATOM 0 HB3 MET A 105 -8.263 0.945 -7.758 1.00 0.00 H new ATOM 0 HG2 MET A 105 -5.341 0.519 -7.910 1.00 0.00 H new ATOM 0 HG3 MET A 105 -6.103 0.467 -9.487 1.00 0.00 H new ATOM 0 HE1 MET A 105 -6.565 3.973 -10.394 1.00 0.00 H new ATOM 0 HE2 MET A 105 -5.871 2.378 -10.773 1.00 0.00 H new ATOM 0 HE3 MET A 105 -7.619 2.542 -10.482 1.00 0.00 H new ATOM 1477 N THR A 106 -5.506 1.061 -5.475 1.00 0.00 N ATOM 1478 CA THR A 106 -5.009 2.118 -4.612 1.00 0.00 C ATOM 1479 C THR A 106 -5.442 3.487 -5.142 1.00 0.00 C ATOM 1480 O THR A 106 -4.864 3.996 -6.100 1.00 0.00 O ATOM 1481 CB THR A 106 -3.491 1.963 -4.500 1.00 0.00 C ATOM 1482 OG1 THR A 106 -3.053 1.849 -5.851 1.00 0.00 O ATOM 1483 CG2 THR A 106 -3.085 0.632 -3.862 1.00 0.00 C ATOM 0 H THR A 106 -4.792 0.598 -6.037 1.00 0.00 H new ATOM 0 HA THR A 106 -5.433 2.043 -3.611 1.00 0.00 H new ATOM 0 HB THR A 106 -3.084 2.786 -3.913 1.00 0.00 H new ATOM 0 HG1 THR A 106 -3.457 2.563 -6.387 1.00 0.00 H new ATOM 0 HG21 THR A 106 -1.998 0.572 -3.806 1.00 0.00 H new ATOM 0 HG22 THR A 106 -3.504 0.567 -2.858 1.00 0.00 H new ATOM 0 HG23 THR A 106 -3.463 -0.192 -4.467 1.00 0.00 H new ATOM 1491 N LYS A 107 -6.456 4.043 -4.495 1.00 0.00 N ATOM 1492 CA LYS A 107 -6.973 5.341 -4.890 1.00 0.00 C ATOM 1493 C LYS A 107 -5.842 6.371 -4.844 1.00 0.00 C ATOM 1494 O LYS A 107 -5.878 7.370 -5.561 1.00 0.00 O ATOM 1495 CB LYS A 107 -8.184 5.719 -4.033 1.00 0.00 C ATOM 1496 CG LYS A 107 -9.487 5.272 -4.697 1.00 0.00 C ATOM 1497 CD LYS A 107 -9.473 3.767 -4.973 1.00 0.00 C ATOM 1498 CE LYS A 107 -9.372 3.486 -6.475 1.00 0.00 C ATOM 1499 NZ LYS A 107 -10.575 2.767 -6.949 1.00 0.00 N ATOM 0 H LYS A 107 -6.933 3.618 -3.700 1.00 0.00 H new ATOM 0 HA LYS A 107 -7.336 5.310 -5.917 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -8.096 5.258 -3.049 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -8.202 6.798 -3.878 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -10.331 5.520 -4.053 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -9.628 5.815 -5.631 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -8.631 3.307 -4.456 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -10.380 3.312 -4.574 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -9.263 4.424 -7.020 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -8.481 2.892 -6.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -10.491 2.584 -7.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -10.662 1.863 -6.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -11.419 3.347 -6.770 1.00 0.00 H new ATOM 1509 N GLU A 108 -4.865 6.093 -3.994 1.00 0.00 N ATOM 1510 CA GLU A 108 -3.726 6.981 -3.845 1.00 0.00 C ATOM 1511 C GLU A 108 -2.678 6.686 -4.921 1.00 0.00 C ATOM 1512 O GLU A 108 -2.069 7.604 -5.468 1.00 0.00 O ATOM 1513 CB GLU A 108 -3.121 6.868 -2.444 1.00 0.00 C ATOM 1514 CG GLU A 108 -3.666 7.960 -1.522 1.00 0.00 C ATOM 1515 CD GLU A 108 -2.920 9.280 -1.731 1.00 0.00 C ATOM 1516 OE1 GLU A 108 -2.859 9.717 -2.900 1.00 0.00 O ATOM 1517 OE2 GLU A 108 -2.428 9.819 -0.717 1.00 0.00 O ATOM 0 H GLU A 108 -4.839 5.264 -3.401 1.00 0.00 H new ATOM 0 HA GLU A 108 -4.071 8.007 -3.973 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -3.346 5.887 -2.025 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -2.036 6.947 -2.505 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -4.729 8.105 -1.714 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -3.570 7.645 -0.483 1.00 0.00 H new ATOM 1522 N SER A 109 -2.500 5.401 -5.190 1.00 0.00 N ATOM 1523 CA SER A 109 -1.536 4.973 -6.190 1.00 0.00 C ATOM 1524 C SER A 109 -0.114 5.152 -5.657 1.00 0.00 C ATOM 1525 O SER A 109 0.088 5.295 -4.452 1.00 0.00 O ATOM 1526 CB SER A 109 -1.715 5.751 -7.496 1.00 0.00 C ATOM 1527 OG SER A 109 -0.753 6.793 -7.633 1.00 0.00 O ATOM 0 H SER A 109 -3.007 4.643 -4.733 1.00 0.00 H new ATOM 0 HA SER A 109 -1.708 3.917 -6.400 1.00 0.00 H new ATOM 0 HB2 SER A 109 -1.631 5.067 -8.340 1.00 0.00 H new ATOM 0 HB3 SER A 109 -2.718 6.177 -7.530 1.00 0.00 H new ATOM 0 HG SER A 109 -0.878 7.450 -6.917 1.00 0.00 H new ATOM 1532 N ALA A 110 0.837 5.138 -6.580 1.00 0.00 N ATOM 1533 CA ALA A 110 2.235 5.297 -6.217 1.00 0.00 C ATOM 1534 C ALA A 110 2.917 6.221 -7.228 1.00 0.00 C ATOM 1535 O ALA A 110 2.798 6.022 -8.436 1.00 0.00 O ATOM 1536 CB ALA A 110 2.901 3.923 -6.139 1.00 0.00 C ATOM 0 H ALA A 110 0.667 5.019 -7.579 1.00 0.00 H new ATOM 0 HA ALA A 110 2.327 5.759 -5.234 1.00 0.00 H new ATOM 0 HB1 ALA A 110 3.950 4.042 -5.867 1.00 0.00 H new ATOM 0 HB2 ALA A 110 2.397 3.317 -5.386 1.00 0.00 H new ATOM 0 HB3 ALA A 110 2.832 3.429 -7.108 1.00 0.00 H new ATOM 1542 N VAL A 111 3.618 7.212 -6.697 1.00 0.00 N ATOM 1543 CA VAL A 111 4.321 8.166 -7.538 1.00 0.00 C ATOM 1544 C VAL A 111 5.824 7.891 -7.471 1.00 0.00 C ATOM 1545 O VAL A 111 6.445 8.070 -6.424 1.00 0.00 O ATOM 1546 CB VAL A 111 3.956 9.594 -7.126 1.00 0.00 C ATOM 1547 CG1 VAL A 111 4.795 10.618 -7.894 1.00 0.00 C ATOM 1548 CG2 VAL A 111 2.461 9.855 -7.318 1.00 0.00 C ATOM 0 H VAL A 111 3.714 7.375 -5.695 1.00 0.00 H new ATOM 0 HA VAL A 111 4.017 8.053 -8.579 1.00 0.00 H new ATOM 0 HB VAL A 111 4.182 9.704 -6.065 1.00 0.00 H new ATOM 0 HG11 VAL A 111 4.516 11.624 -7.582 1.00 0.00 H new ATOM 0 HG12 VAL A 111 5.852 10.453 -7.684 1.00 0.00 H new ATOM 0 HG13 VAL A 111 4.616 10.507 -8.963 1.00 0.00 H new ATOM 0 HG21 VAL A 111 2.229 10.877 -7.018 1.00 0.00 H new ATOM 0 HG22 VAL A 111 2.199 9.717 -8.367 1.00 0.00 H new ATOM 0 HG23 VAL A 111 1.888 9.158 -6.706 1.00 0.00 H new ATOM 1558 N ILE A 112 6.365 7.458 -8.600 1.00 0.00 N ATOM 1559 CA ILE A 112 7.784 7.156 -8.682 1.00 0.00 C ATOM 1560 C ILE A 112 8.572 8.461 -8.808 1.00 0.00 C ATOM 1561 O ILE A 112 8.155 9.377 -9.514 1.00 0.00 O ATOM 1562 CB ILE A 112 8.055 6.162 -9.814 1.00 0.00 C ATOM 1563 CG1 ILE A 112 7.118 4.956 -9.720 1.00 0.00 C ATOM 1564 CG2 ILE A 112 9.527 5.744 -9.835 1.00 0.00 C ATOM 1565 CD1 ILE A 112 7.019 4.448 -8.280 1.00 0.00 C ATOM 0 H ILE A 112 5.846 7.309 -9.466 1.00 0.00 H new ATOM 0 HA ILE A 112 8.123 6.665 -7.770 1.00 0.00 H new ATOM 0 HB ILE A 112 7.847 6.658 -10.762 1.00 0.00 H new ATOM 0 HG12 ILE A 112 6.127 5.232 -10.081 1.00 0.00 H new ATOM 0 HG13 ILE A 112 7.482 4.157 -10.367 1.00 0.00 H new ATOM 0 HG21 ILE A 112 9.693 5.038 -10.648 1.00 0.00 H new ATOM 0 HG22 ILE A 112 10.153 6.624 -9.985 1.00 0.00 H new ATOM 0 HG23 ILE A 112 9.785 5.273 -8.887 1.00 0.00 H new ATOM 0 HD11 ILE A 112 6.347 3.591 -8.242 1.00 0.00 H new ATOM 0 HD12 ILE A 112 8.007 4.150 -7.931 1.00 0.00 H new ATOM 0 HD13 ILE A 112 6.632 5.241 -7.640 1.00 0.00 H new ATOM 1576 N ALA A 113 9.699 8.503 -8.112 1.00 0.00 N ATOM 1577 CA ALA A 113 10.551 9.681 -8.136 1.00 0.00 C ATOM 1578 C ALA A 113 11.872 9.364 -7.435 1.00 0.00 C ATOM 1579 O ALA A 113 11.949 8.426 -6.642 1.00 0.00 O ATOM 1580 CB ALA A 113 9.814 10.856 -7.491 1.00 0.00 C ATOM 0 H ALA A 113 10.042 7.740 -7.528 1.00 0.00 H new ATOM 0 HA ALA A 113 10.784 9.966 -9.162 1.00 0.00 H new ATOM 0 HB1 ALA A 113 10.452 11.740 -7.509 1.00 0.00 H new ATOM 0 HB2 ALA A 113 8.898 11.059 -8.045 1.00 0.00 H new ATOM 0 HB3 ALA A 113 9.566 10.608 -6.459 1.00 0.00 H new ATOM 1586 N ARG A 114 12.881 10.163 -7.752 1.00 0.00 N ATOM 1587 CA ARG A 114 14.195 9.979 -7.161 1.00 0.00 C ATOM 1588 C ARG A 114 14.235 10.580 -5.755 1.00 0.00 C ATOM 1589 O ARG A 114 15.090 11.413 -5.455 1.00 0.00 O ATOM 1590 CB ARG A 114 15.280 10.635 -8.019 1.00 0.00 C ATOM 1591 CG ARG A 114 15.891 9.626 -8.994 1.00 0.00 C ATOM 1592 CD ARG A 114 17.414 9.769 -9.047 1.00 0.00 C ATOM 1593 NE ARG A 114 18.038 8.927 -8.003 1.00 0.00 N ATOM 1594 CZ ARG A 114 19.305 9.063 -7.585 1.00 0.00 C ATOM 1595 NH1 ARG A 114 20.089 10.008 -8.123 1.00 0.00 N ATOM 1596 NH2 ARG A 114 19.786 8.255 -6.633 1.00 0.00 N ATOM 0 H ARG A 114 12.814 10.939 -8.411 1.00 0.00 H new ATOM 0 HA ARG A 114 14.387 8.907 -7.107 1.00 0.00 H new ATOM 0 HB2 ARG A 114 14.854 11.471 -8.574 1.00 0.00 H new ATOM 0 HB3 ARG A 114 16.060 11.043 -7.376 1.00 0.00 H new ATOM 0 HG2 ARG A 114 15.627 8.614 -8.688 1.00 0.00 H new ATOM 0 HG3 ARG A 114 15.473 9.777 -9.989 1.00 0.00 H new ATOM 0 HD2 ARG A 114 17.781 9.475 -10.030 1.00 0.00 H new ATOM 0 HD3 ARG A 114 17.695 10.812 -8.901 1.00 0.00 H new ATOM 0 HE ARG A 114 17.469 8.197 -7.574 1.00 0.00 H new ATOM 0 HH11 ARG A 114 19.722 10.623 -8.849 1.00 0.00 H new ATOM 0 HH12 ARG A 114 21.053 10.112 -7.806 1.00 0.00 H new ATOM 0 HH21 ARG A 114 19.189 7.536 -6.225 1.00 0.00 H new ATOM 0 HH22 ARG A 114 20.750 8.359 -6.315 1.00 0.00 H new ATOM 1607 N ASP A 115 13.299 10.135 -4.930 1.00 0.00 N ATOM 1608 CA ASP A 115 13.215 10.619 -3.562 1.00 0.00 C ATOM 1609 C ASP A 115 12.160 9.811 -2.804 1.00 0.00 C ATOM 1610 O ASP A 115 11.334 9.134 -3.413 1.00 0.00 O ATOM 1611 CB ASP A 115 12.802 12.092 -3.522 1.00 0.00 C ATOM 1612 CG ASP A 115 13.509 12.934 -2.459 1.00 0.00 C ATOM 1613 OD1 ASP A 115 14.732 12.731 -2.295 1.00 0.00 O ATOM 1614 OD2 ASP A 115 12.811 13.762 -1.834 1.00 0.00 O ATOM 0 H ASP A 115 12.592 9.444 -5.182 1.00 0.00 H new ATOM 0 HA ASP A 115 14.198 10.508 -3.105 1.00 0.00 H new ATOM 0 HB2 ASP A 115 12.993 12.534 -4.500 1.00 0.00 H new ATOM 0 HB3 ASP A 115 11.727 12.148 -3.352 1.00 0.00 H new ATOM 1618 N GLY A 116 12.222 9.909 -1.484 1.00 0.00 N ATOM 1619 CA GLY A 116 11.282 9.196 -0.636 1.00 0.00 C ATOM 1620 C GLY A 116 10.432 10.171 0.181 1.00 0.00 C ATOM 1621 O GLY A 116 10.945 11.159 0.706 1.00 0.00 O ATOM 0 H GLY A 116 12.909 10.471 -0.981 1.00 0.00 H new ATOM 0 HA2 GLY A 116 10.635 8.570 -1.250 1.00 0.00 H new ATOM 0 HA3 GLY A 116 11.825 8.530 0.035 1.00 0.00 H new ATOM 1625 N LYS A 117 9.147 9.861 0.264 1.00 0.00 N ATOM 1626 CA LYS A 117 8.221 10.697 1.008 1.00 0.00 C ATOM 1627 C LYS A 117 8.357 10.397 2.502 1.00 0.00 C ATOM 1628 O LYS A 117 8.548 9.246 2.893 1.00 0.00 O ATOM 1629 CB LYS A 117 6.797 10.527 0.474 1.00 0.00 C ATOM 1630 CG LYS A 117 5.782 11.215 1.390 1.00 0.00 C ATOM 1631 CD LYS A 117 6.002 12.729 1.411 1.00 0.00 C ATOM 1632 CE LYS A 117 4.749 13.471 0.942 1.00 0.00 C ATOM 1633 NZ LYS A 117 4.393 13.068 -0.436 1.00 0.00 N ATOM 0 H LYS A 117 8.725 9.041 -0.172 1.00 0.00 H new ATOM 0 HA LYS A 117 8.465 11.750 0.870 1.00 0.00 H new ATOM 0 HB2 LYS A 117 6.729 10.946 -0.530 1.00 0.00 H new ATOM 0 HB3 LYS A 117 6.559 9.466 0.393 1.00 0.00 H new ATOM 0 HG2 LYS A 117 4.771 10.995 1.048 1.00 0.00 H new ATOM 0 HG3 LYS A 117 5.870 10.817 2.401 1.00 0.00 H new ATOM 0 HD2 LYS A 117 6.262 13.048 2.420 1.00 0.00 H new ATOM 0 HD3 LYS A 117 6.844 12.987 0.768 1.00 0.00 H new ATOM 0 HE2 LYS A 117 3.919 13.257 1.616 1.00 0.00 H new ATOM 0 HE3 LYS A 117 4.921 14.547 0.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 3.894 13.849 -0.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 5.259 12.840 -0.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 3.776 12.231 -0.405 1.00 0.00 H new ATOM 1643 N ILE A 118 8.253 11.452 3.297 1.00 0.00 N ATOM 1644 CA ILE A 118 8.362 11.316 4.739 1.00 0.00 C ATOM 1645 C ILE A 118 7.149 10.547 5.268 1.00 0.00 C ATOM 1646 O ILE A 118 6.822 9.474 4.764 1.00 0.00 O ATOM 1647 CB ILE A 118 8.555 12.686 5.394 1.00 0.00 C ATOM 1648 CG1 ILE A 118 9.530 13.545 4.586 1.00 0.00 C ATOM 1649 CG2 ILE A 118 8.992 12.539 6.853 1.00 0.00 C ATOM 1650 CD1 ILE A 118 8.777 14.532 3.691 1.00 0.00 C ATOM 0 H ILE A 118 8.094 12.405 2.969 1.00 0.00 H new ATOM 0 HA ILE A 118 9.247 10.736 5.001 1.00 0.00 H new ATOM 0 HB ILE A 118 7.596 13.203 5.397 1.00 0.00 H new ATOM 0 HG12 ILE A 118 10.187 14.091 5.263 1.00 0.00 H new ATOM 0 HG13 ILE A 118 10.164 12.904 3.974 1.00 0.00 H new ATOM 0 HG21 ILE A 118 9.122 13.527 7.295 1.00 0.00 H new ATOM 0 HG22 ILE A 118 8.230 11.991 7.407 1.00 0.00 H new ATOM 0 HG23 ILE A 118 9.935 11.995 6.897 1.00 0.00 H new ATOM 0 HD11 ILE A 118 9.492 15.131 3.127 1.00 0.00 H new ATOM 0 HD12 ILE A 118 8.139 13.982 2.999 1.00 0.00 H new ATOM 0 HD13 ILE A 118 8.162 15.187 4.308 1.00 0.00 H new ATOM 1661 N TYR A 119 6.516 11.126 6.277 1.00 0.00 N ATOM 1662 CA TYR A 119 5.346 10.510 6.880 1.00 0.00 C ATOM 1663 C TYR A 119 4.386 11.570 7.424 1.00 0.00 C ATOM 1664 O TYR A 119 4.138 12.582 6.770 1.00 0.00 O ATOM 1665 CB TYR A 119 5.868 9.665 8.045 1.00 0.00 C ATOM 1666 CG TYR A 119 7.182 8.941 7.748 1.00 0.00 C ATOM 1667 CD1 TYR A 119 7.200 7.872 6.875 1.00 0.00 C ATOM 1668 CD2 TYR A 119 8.351 9.357 8.354 1.00 0.00 C ATOM 1669 CE1 TYR A 119 8.438 7.191 6.597 1.00 0.00 C ATOM 1670 CE2 TYR A 119 9.588 8.676 8.075 1.00 0.00 C ATOM 1671 CZ TYR A 119 9.571 7.626 7.210 1.00 0.00 C ATOM 1672 OH TYR A 119 10.740 6.983 6.948 1.00 0.00 O ATOM 0 H TYR A 119 6.791 12.016 6.693 1.00 0.00 H new ATOM 0 HA TYR A 119 4.802 9.918 6.144 1.00 0.00 H new ATOM 0 HB2 TYR A 119 6.008 10.309 8.913 1.00 0.00 H new ATOM 0 HB3 TYR A 119 5.111 8.928 8.313 1.00 0.00 H new ATOM 0 HD1 TYR A 119 6.286 7.546 6.401 1.00 0.00 H new ATOM 0 HD2 TYR A 119 8.337 10.193 9.037 1.00 0.00 H new ATOM 0 HE1 TYR A 119 8.466 6.353 5.916 1.00 0.00 H new ATOM 0 HE2 TYR A 119 10.509 8.992 8.542 1.00 0.00 H new ATOM 0 HH TYR A 119 11.465 7.403 7.455 1.00 0.00 H new ATOM 1681 N LYS A 120 3.872 11.301 8.615 1.00 0.00 N ATOM 1682 CA LYS A 120 2.944 12.218 9.254 1.00 0.00 C ATOM 1683 C LYS A 120 3.490 12.614 10.629 1.00 0.00 C ATOM 1684 O LYS A 120 4.315 13.521 10.735 1.00 0.00 O ATOM 1685 CB LYS A 120 1.540 11.615 9.301 1.00 0.00 C ATOM 1686 CG LYS A 120 1.498 10.392 10.221 1.00 0.00 C ATOM 1687 CD LYS A 120 0.281 9.518 9.917 1.00 0.00 C ATOM 1688 CE LYS A 120 -0.920 9.934 10.769 1.00 0.00 C ATOM 1689 NZ LYS A 120 -1.655 8.741 11.246 1.00 0.00 N ATOM 0 H LYS A 120 4.081 10.461 9.154 1.00 0.00 H new ATOM 0 HA LYS A 120 2.852 13.134 8.670 1.00 0.00 H new ATOM 0 HB2 LYS A 120 0.830 12.364 9.653 1.00 0.00 H new ATOM 0 HB3 LYS A 120 1.229 11.329 8.296 1.00 0.00 H new ATOM 0 HG2 LYS A 120 2.410 9.808 10.097 1.00 0.00 H new ATOM 0 HG3 LYS A 120 1.466 10.716 11.261 1.00 0.00 H new ATOM 0 HD2 LYS A 120 0.027 9.598 8.860 1.00 0.00 H new ATOM 0 HD3 LYS A 120 0.523 8.473 10.109 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -0.582 10.525 11.620 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -1.586 10.569 10.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -2.467 9.041 11.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -1.994 8.193 10.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -1.021 8.150 11.821 1.00 0.00 H new TER 1699 LYS A 120