USER MOD reduce.3.24.130724 H: found=0, std=0, add=1078, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1078 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 107 GLN : amide:sc= -0.167 X(o=-1.4,f=-1.5) USER MOD Set 1.2: A 125 GLN : amide:sc= -1.24 K(o=-1.4,f=-0.6) USER MOD Set 2.1: A 31 ASN : amide:sc= -0.176 X(o=-0.25,f=-0.073) USER MOD Set 2.2: A 33 LYS NZ :NH3+ -152:sc= -0.0699 (180deg=-0.406) USER MOD Single : A 1 ALA N :NH3+ 169:sc= -0.0329 (180deg=-0.207) USER MOD Single : A 3 GLN : amide:sc= -0.0136 X(o=-0.014,f=0) USER MOD Single : A 4 GLN : amide:sc= -1.17 K(o=-1.2,f=-0.6) USER MOD Single : A 8 MET CE :methyl -163:sc= 0 (180deg=-0.157) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 GLN : amide:sc= -0.0275 X(o=-0.028,f=-0.13) USER MOD Single : A 12 GLN : amide:sc= -0.279 K(o=-0.28,f=-1.5) USER MOD Single : A 25 GLN : amide:sc= -0.179 X(o=-0.18,f=-0.021) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 159:sc= -0.0144 (180deg=-0.207) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0.0046) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 TYR OH : rot 180:sc= -0.28 USER MOD Single : A 40 HIS : no HE2:sc= -8.49! C(o=-8.5!,f=-9.7!) USER MOD Single : A 49 GLN : amide:sc= -2.17 K(o=-2.2,f=-7.8!) USER MOD Single : A 50 MET CE :methyl 137:sc= -4.19! (180deg=-7.45!) USER MOD Single : A 53 HIS : no HE2:sc= -0.373 K(o=-0.37,f=-1.6) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 MET CE :methyl 172:sc= -7.61! (180deg=-7.91!) USER MOD Single : A 71 CYS SG : rot 99:sc= -3.2! USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= 0.56 K(o=0.56,f=-0.79) USER MOD Single : A 78 THR OG1 : rot 45:sc= -3.55! USER MOD Single : A 81 THR OG1 : rot -111:sc= 0.741 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 GLN : amide:sc= -0.0301 X(o=-0.03,f=0) USER MOD Single : A 100 CYS SG : rot -150:sc= -0.103 USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 TYR OH : rot 99:sc= 0.67 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= 1.17 K(o=1.2,f=-0.29) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot -109:sc= -1.29 USER MOD Single : A 123 MET CE :methyl -179:sc= -10.7! (180deg=-10.9!) USER MOD Single : A 126 ASN : amide:sc= 0.123 X(o=0.12,f=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -5.941 25.805 7.546 1.00 0.00 N ATOM 2 CA ALA A 1 -4.592 25.316 7.931 1.00 0.00 C ATOM 3 C ALA A 1 -4.363 23.895 7.428 1.00 0.00 C ATOM 4 O ALA A 1 -3.668 23.104 8.066 1.00 0.00 O ATOM 5 CB ALA A 1 -4.419 25.376 9.441 1.00 0.00 C ATOM 0 H1 ALA A 1 -6.146 26.691 8.051 1.00 0.00 H new ATOM 0 H2 ALA A 1 -5.968 25.977 6.521 1.00 0.00 H new ATOM 0 H3 ALA A 1 -6.654 25.090 7.796 1.00 0.00 H new ATOM 0 HA ALA A 1 -3.850 25.965 7.466 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -3.426 25.015 9.708 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -4.534 26.406 9.780 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -5.173 24.751 9.919 1.00 0.00 H new ATOM 13 N ARG A 2 -4.954 23.577 6.280 1.00 0.00 N ATOM 14 CA ARG A 2 -4.816 22.250 5.691 1.00 0.00 C ATOM 15 C ARG A 2 -3.364 21.966 5.325 1.00 0.00 C ATOM 16 O ARG A 2 -2.787 20.967 5.745 1.00 0.00 O ATOM 17 CB ARG A 2 -5.704 22.124 4.451 1.00 0.00 C ATOM 18 CG ARG A 2 -6.967 21.309 4.685 1.00 0.00 C ATOM 19 CD ARG A 2 -8.202 22.194 4.747 1.00 0.00 C ATOM 20 NE ARG A 2 -9.334 21.605 4.035 1.00 0.00 N ATOM 21 CZ ARG A 2 -10.484 22.238 3.819 1.00 0.00 C ATOM 22 NH1 ARG A 2 -10.660 23.479 4.256 1.00 0.00 N ATOM 23 NH2 ARG A 2 -11.464 21.630 3.162 1.00 0.00 N ATOM 0 H ARG A 2 -5.533 24.220 5.740 1.00 0.00 H new ATOM 0 HA ARG A 2 -5.134 21.516 6.431 1.00 0.00 H new ATOM 0 HB2 ARG A 2 -5.983 23.122 4.112 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -5.129 21.664 3.648 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -7.082 20.578 3.885 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -6.872 20.750 5.616 1.00 0.00 H new ATOM 0 HD2 ARG A 2 -8.476 22.361 5.789 1.00 0.00 H new ATOM 0 HD3 ARG A 2 -7.971 23.169 4.318 1.00 0.00 H new ATOM 0 HE ARG A 2 -9.237 20.653 3.683 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -9.911 23.953 4.761 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -11.544 23.959 4.087 1.00 0.00 H new ATOM 0 HH21 ARG A 2 -11.336 20.677 2.822 1.00 0.00 H new ATOM 0 HH22 ARG A 2 -12.345 22.116 2.997 1.00 0.00 H new ATOM 37 N GLN A 3 -2.772 22.858 4.544 1.00 0.00 N ATOM 38 CA GLN A 3 -1.380 22.697 4.130 1.00 0.00 C ATOM 39 C GLN A 3 -0.495 22.501 5.347 1.00 0.00 C ATOM 40 O GLN A 3 0.475 21.746 5.315 1.00 0.00 O ATOM 41 CB GLN A 3 -0.902 23.914 3.337 1.00 0.00 C ATOM 42 CG GLN A 3 -1.935 24.457 2.366 1.00 0.00 C ATOM 43 CD GLN A 3 -1.521 24.287 0.918 1.00 0.00 C ATOM 44 OE1 GLN A 3 -1.473 25.253 0.156 1.00 0.00 O ATOM 45 NE2 GLN A 3 -1.218 23.053 0.533 1.00 0.00 N ATOM 0 H GLN A 3 -3.228 23.697 4.185 1.00 0.00 H new ATOM 0 HA GLN A 3 -1.316 21.818 3.489 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -0.622 24.704 4.035 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -0.003 23.645 2.783 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -2.885 23.949 2.530 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -2.100 25.515 2.571 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -1.272 22.283 1.200 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -0.931 22.875 -0.429 1.00 0.00 H new ATOM 54 N GLN A 4 -0.844 23.191 6.420 1.00 0.00 N ATOM 55 CA GLN A 4 -0.091 23.098 7.663 1.00 0.00 C ATOM 56 C GLN A 4 -0.140 21.680 8.224 1.00 0.00 C ATOM 57 O GLN A 4 0.879 21.138 8.650 1.00 0.00 O ATOM 58 CB GLN A 4 -0.635 24.087 8.695 1.00 0.00 C ATOM 59 CG GLN A 4 0.135 24.079 10.005 1.00 0.00 C ATOM 60 CD GLN A 4 1.596 24.448 9.826 1.00 0.00 C ATOM 61 OE1 GLN A 4 2.020 25.546 10.191 1.00 0.00 O ATOM 62 NE2 GLN A 4 2.376 23.531 9.263 1.00 0.00 N ATOM 0 H GLN A 4 -1.644 23.822 6.457 1.00 0.00 H new ATOM 0 HA GLN A 4 0.947 23.349 7.446 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -0.609 25.092 8.273 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -1.680 23.853 8.896 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -0.330 24.779 10.700 1.00 0.00 H new ATOM 0 HG3 GLN A 4 0.067 23.089 10.456 1.00 0.00 H new ATOM 0 HE21 GLN A 4 1.984 22.634 8.976 1.00 0.00 H new ATOM 0 HE22 GLN A 4 3.367 23.724 9.118 1.00 0.00 H new ATOM 71 N GLU A 5 -1.328 21.082 8.224 1.00 0.00 N ATOM 72 CA GLU A 5 -1.495 19.724 8.739 1.00 0.00 C ATOM 73 C GLU A 5 -0.882 18.703 7.790 1.00 0.00 C ATOM 74 O GLU A 5 -0.162 17.800 8.217 1.00 0.00 O ATOM 75 CB GLU A 5 -2.973 19.408 8.982 1.00 0.00 C ATOM 76 CG GLU A 5 -3.882 19.738 7.813 1.00 0.00 C ATOM 77 CD GLU A 5 -5.315 19.301 8.047 1.00 0.00 C ATOM 78 OE1 GLU A 5 -5.711 19.173 9.225 1.00 0.00 O ATOM 79 OE2 GLU A 5 -6.041 19.090 7.053 1.00 0.00 O ATOM 0 H GLU A 5 -2.185 21.512 7.876 1.00 0.00 H new ATOM 0 HA GLU A 5 -0.971 19.663 9.693 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -3.072 18.348 9.216 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -3.312 19.961 9.858 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -3.859 20.813 7.632 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -3.501 19.255 6.913 1.00 0.00 H new ATOM 86 N ILE A 6 -1.154 18.859 6.502 1.00 0.00 N ATOM 87 CA ILE A 6 -0.610 17.961 5.493 1.00 0.00 C ATOM 88 C ILE A 6 0.899 18.105 5.431 1.00 0.00 C ATOM 89 O ILE A 6 1.649 17.156 5.660 1.00 0.00 O ATOM 90 CB ILE A 6 -1.184 18.273 4.095 1.00 0.00 C ATOM 91 CG1 ILE A 6 -2.694 18.055 4.073 1.00 0.00 C ATOM 92 CG2 ILE A 6 -0.502 17.434 3.020 1.00 0.00 C ATOM 93 CD1 ILE A 6 -3.463 19.322 3.792 1.00 0.00 C ATOM 0 H ILE A 6 -1.749 19.600 6.131 1.00 0.00 H new ATOM 0 HA ILE A 6 -0.887 16.945 5.775 1.00 0.00 H new ATOM 0 HB ILE A 6 -0.984 19.322 3.877 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -2.938 17.311 3.314 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -3.012 17.648 5.033 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -0.927 17.675 2.046 1.00 0.00 H new ATOM 0 HG22 ILE A 6 0.566 17.650 3.013 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -0.657 16.376 3.231 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -4.531 19.106 3.789 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -3.244 20.059 4.565 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -3.170 19.718 2.820 1.00 0.00 H new ATOM 105 N ASP A 7 1.323 19.315 5.102 1.00 0.00 N ATOM 106 CA ASP A 7 2.738 19.639 4.979 1.00 0.00 C ATOM 107 C ASP A 7 3.486 18.558 4.201 1.00 0.00 C ATOM 108 O ASP A 7 4.047 17.633 4.786 1.00 0.00 O ATOM 109 CB ASP A 7 3.367 19.824 6.361 1.00 0.00 C ATOM 110 CG ASP A 7 4.780 20.368 6.285 1.00 0.00 C ATOM 111 OD1 ASP A 7 5.119 20.999 5.261 1.00 0.00 O ATOM 112 OD2 ASP A 7 5.548 20.164 7.248 1.00 0.00 O ATOM 0 H ASP A 7 0.699 20.099 4.913 1.00 0.00 H new ATOM 0 HA ASP A 7 2.819 20.575 4.426 1.00 0.00 H new ATOM 0 HB2 ASP A 7 2.750 20.503 6.950 1.00 0.00 H new ATOM 0 HB3 ASP A 7 3.376 18.868 6.884 1.00 0.00 H new ATOM 117 N MET A 8 3.487 18.684 2.877 1.00 0.00 N ATOM 118 CA MET A 8 4.160 17.719 2.016 1.00 0.00 C ATOM 119 C MET A 8 5.622 18.105 1.797 1.00 0.00 C ATOM 120 O MET A 8 6.090 18.184 0.661 1.00 0.00 O ATOM 121 CB MET A 8 3.440 17.619 0.669 1.00 0.00 C ATOM 122 CG MET A 8 3.443 18.920 -0.117 1.00 0.00 C ATOM 123 SD MET A 8 1.870 19.242 -0.937 1.00 0.00 S ATOM 124 CE MET A 8 0.877 19.799 0.445 1.00 0.00 C ATOM 0 H MET A 8 3.029 19.446 2.377 1.00 0.00 H new ATOM 0 HA MET A 8 4.132 16.748 2.511 1.00 0.00 H new ATOM 0 HB2 MET A 8 3.913 16.841 0.070 1.00 0.00 H new ATOM 0 HB3 MET A 8 2.409 17.309 0.839 1.00 0.00 H new ATOM 0 HG2 MET A 8 3.673 19.746 0.556 1.00 0.00 H new ATOM 0 HG3 MET A 8 4.237 18.887 -0.863 1.00 0.00 H new ATOM 0 HE1 MET A 8 -0.179 19.749 0.178 1.00 0.00 H new ATOM 0 HE2 MET A 8 1.064 19.160 1.308 1.00 0.00 H new ATOM 0 HE3 MET A 8 1.141 20.828 0.691 1.00 0.00 H new ATOM 134 N LYS A 9 6.337 18.340 2.891 1.00 0.00 N ATOM 135 CA LYS A 9 7.744 18.712 2.818 1.00 0.00 C ATOM 136 C LYS A 9 8.643 17.498 3.037 1.00 0.00 C ATOM 137 O LYS A 9 9.765 17.445 2.538 1.00 0.00 O ATOM 138 CB LYS A 9 8.063 19.794 3.848 1.00 0.00 C ATOM 139 CG LYS A 9 7.899 19.328 5.283 1.00 0.00 C ATOM 140 CD LYS A 9 9.237 19.252 6.001 1.00 0.00 C ATOM 141 CE LYS A 9 9.058 18.960 7.481 1.00 0.00 C ATOM 142 NZ LYS A 9 9.172 20.192 8.308 1.00 0.00 N ATOM 0 H LYS A 9 5.965 18.279 3.839 1.00 0.00 H new ATOM 0 HA LYS A 9 7.937 19.106 1.820 1.00 0.00 H new ATOM 0 HB2 LYS A 9 9.087 20.136 3.700 1.00 0.00 H new ATOM 0 HB3 LYS A 9 7.413 20.652 3.676 1.00 0.00 H new ATOM 0 HG2 LYS A 9 7.238 20.012 5.815 1.00 0.00 H new ATOM 0 HG3 LYS A 9 7.422 18.348 5.296 1.00 0.00 H new ATOM 0 HD2 LYS A 9 9.851 18.474 5.547 1.00 0.00 H new ATOM 0 HD3 LYS A 9 9.772 20.194 5.877 1.00 0.00 H new ATOM 0 HE2 LYS A 9 8.083 18.502 7.645 1.00 0.00 H new ATOM 0 HE3 LYS A 9 9.808 18.237 7.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 9.044 19.950 9.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 10.112 20.616 8.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 8.440 20.872 8.020 1.00 0.00 H new ATOM 156 N ARG A 10 8.137 16.523 3.788 1.00 0.00 N ATOM 157 CA ARG A 10 8.893 15.308 4.073 1.00 0.00 C ATOM 158 C ARG A 10 9.113 14.494 2.802 1.00 0.00 C ATOM 159 O ARG A 10 8.717 14.905 1.711 1.00 0.00 O ATOM 160 CB ARG A 10 8.158 14.459 5.112 1.00 0.00 C ATOM 161 CG ARG A 10 8.533 14.794 6.546 1.00 0.00 C ATOM 162 CD ARG A 10 8.025 13.737 7.515 1.00 0.00 C ATOM 163 NE ARG A 10 8.232 14.126 8.906 1.00 0.00 N ATOM 164 CZ ARG A 10 9.425 14.152 9.499 1.00 0.00 C ATOM 165 NH1 ARG A 10 10.516 13.812 8.825 1.00 0.00 N ATOM 166 NH2 ARG A 10 9.525 14.521 10.769 1.00 0.00 N ATOM 0 H ARG A 10 7.208 16.551 4.209 1.00 0.00 H new ATOM 0 HA ARG A 10 9.865 15.599 4.471 1.00 0.00 H new ATOM 0 HB2 ARG A 10 7.084 14.594 4.985 1.00 0.00 H new ATOM 0 HB3 ARG A 10 8.371 13.406 4.926 1.00 0.00 H new ATOM 0 HG2 ARG A 10 9.617 14.876 6.630 1.00 0.00 H new ATOM 0 HG3 ARG A 10 8.118 15.765 6.815 1.00 0.00 H new ATOM 0 HD2 ARG A 10 6.963 13.566 7.341 1.00 0.00 H new ATOM 0 HD3 ARG A 10 8.536 12.793 7.323 1.00 0.00 H new ATOM 0 HE ARG A 10 7.416 14.394 9.456 1.00 0.00 H new ATOM 0 HH11 ARG A 10 10.444 13.529 7.848 1.00 0.00 H new ATOM 0 HH12 ARG A 10 11.427 13.834 9.284 1.00 0.00 H new ATOM 0 HH21 ARG A 10 8.689 14.785 11.291 1.00 0.00 H new ATOM 0 HH22 ARG A 10 10.438 14.541 11.224 1.00 0.00 H new ATOM 180 N GLN A 11 9.748 13.337 2.952 1.00 0.00 N ATOM 181 CA GLN A 11 10.022 12.462 1.817 1.00 0.00 C ATOM 182 C GLN A 11 8.884 11.466 1.611 1.00 0.00 C ATOM 183 O GLN A 11 8.353 10.908 2.572 1.00 0.00 O ATOM 184 CB GLN A 11 11.341 11.715 2.031 1.00 0.00 C ATOM 185 CG GLN A 11 12.267 11.761 0.826 1.00 0.00 C ATOM 186 CD GLN A 11 13.397 12.757 0.998 1.00 0.00 C ATOM 187 OE1 GLN A 11 14.115 12.732 1.998 1.00 0.00 O ATOM 188 NE2 GLN A 11 13.560 13.642 0.022 1.00 0.00 N ATOM 0 H GLN A 11 10.083 12.983 3.848 1.00 0.00 H new ATOM 0 HA GLN A 11 10.104 13.080 0.923 1.00 0.00 H new ATOM 0 HB2 GLN A 11 11.856 12.142 2.891 1.00 0.00 H new ATOM 0 HB3 GLN A 11 11.125 10.675 2.274 1.00 0.00 H new ATOM 0 HG2 GLN A 11 12.685 10.769 0.655 1.00 0.00 H new ATOM 0 HG3 GLN A 11 11.690 12.021 -0.061 1.00 0.00 H new ATOM 0 HE21 GLN A 11 12.942 13.626 -0.789 1.00 0.00 H new ATOM 0 HE22 GLN A 11 14.304 14.338 0.083 1.00 0.00 H new ATOM 197 N GLN A 12 8.514 11.249 0.354 1.00 0.00 N ATOM 198 CA GLN A 12 7.440 10.321 0.021 1.00 0.00 C ATOM 199 C GLN A 12 7.995 9.056 -0.623 1.00 0.00 C ATOM 200 O GLN A 12 8.357 9.055 -1.801 1.00 0.00 O ATOM 201 CB GLN A 12 6.436 10.989 -0.920 1.00 0.00 C ATOM 202 CG GLN A 12 5.430 11.875 -0.204 1.00 0.00 C ATOM 203 CD GLN A 12 6.030 13.193 0.247 1.00 0.00 C ATOM 204 OE1 GLN A 12 6.238 14.101 -0.557 1.00 0.00 O ATOM 205 NE2 GLN A 12 6.309 13.304 1.541 1.00 0.00 N ATOM 0 H GLN A 12 8.943 11.704 -0.452 1.00 0.00 H new ATOM 0 HA GLN A 12 6.933 10.043 0.945 1.00 0.00 H new ATOM 0 HB2 GLN A 12 6.979 11.587 -1.652 1.00 0.00 H new ATOM 0 HB3 GLN A 12 5.900 10.218 -1.473 1.00 0.00 H new ATOM 0 HG2 GLN A 12 4.588 12.072 -0.867 1.00 0.00 H new ATOM 0 HG3 GLN A 12 5.036 11.344 0.663 1.00 0.00 H new ATOM 0 HE21 GLN A 12 6.120 12.525 2.172 1.00 0.00 H new ATOM 0 HE22 GLN A 12 6.712 14.168 1.903 1.00 0.00 H new ATOM 214 N ARG A 13 8.063 7.980 0.155 1.00 0.00 N ATOM 215 CA ARG A 13 8.577 6.710 -0.344 1.00 0.00 C ATOM 216 C ARG A 13 7.467 5.665 -0.428 1.00 0.00 C ATOM 217 O ARG A 13 6.678 5.503 0.503 1.00 0.00 O ATOM 218 CB ARG A 13 9.703 6.198 0.555 1.00 0.00 C ATOM 219 CG ARG A 13 10.724 7.263 0.922 1.00 0.00 C ATOM 220 CD ARG A 13 11.097 7.198 2.395 1.00 0.00 C ATOM 221 NE ARG A 13 12.127 6.196 2.655 1.00 0.00 N ATOM 222 CZ ARG A 13 12.879 6.174 3.754 1.00 0.00 C ATOM 223 NH1 ARG A 13 12.719 7.095 4.695 1.00 0.00 N ATOM 224 NH2 ARG A 13 13.792 5.226 3.912 1.00 0.00 N ATOM 0 H ARG A 13 7.769 7.962 1.132 1.00 0.00 H new ATOM 0 HA ARG A 13 8.970 6.880 -1.346 1.00 0.00 H new ATOM 0 HB2 ARG A 13 9.270 5.792 1.469 1.00 0.00 H new ATOM 0 HB3 ARG A 13 10.213 5.377 0.052 1.00 0.00 H new ATOM 0 HG2 ARG A 13 11.619 7.134 0.314 1.00 0.00 H new ATOM 0 HG3 ARG A 13 10.321 8.249 0.691 1.00 0.00 H new ATOM 0 HD2 ARG A 13 11.451 8.175 2.723 1.00 0.00 H new ATOM 0 HD3 ARG A 13 10.209 6.967 2.984 1.00 0.00 H new ATOM 0 HE ARG A 13 12.279 5.471 1.954 1.00 0.00 H new ATOM 0 HH11 ARG A 13 12.017 7.826 4.579 1.00 0.00 H new ATOM 0 HH12 ARG A 13 13.298 7.073 5.534 1.00 0.00 H new ATOM 0 HH21 ARG A 13 13.918 4.514 3.192 1.00 0.00 H new ATOM 0 HH22 ARG A 13 14.368 5.208 4.753 1.00 0.00 H new ATOM 238 N PHE A 14 7.417 4.961 -1.553 1.00 0.00 N ATOM 239 CA PHE A 14 6.411 3.925 -1.770 1.00 0.00 C ATOM 240 C PHE A 14 7.083 2.570 -1.945 1.00 0.00 C ATOM 241 O PHE A 14 8.080 2.455 -2.658 1.00 0.00 O ATOM 242 CB PHE A 14 5.561 4.264 -2.999 1.00 0.00 C ATOM 243 CG PHE A 14 5.203 5.722 -3.094 1.00 0.00 C ATOM 244 CD1 PHE A 14 6.171 6.669 -3.393 1.00 0.00 C ATOM 245 CD2 PHE A 14 3.903 6.146 -2.876 1.00 0.00 C ATOM 246 CE1 PHE A 14 5.850 8.009 -3.470 1.00 0.00 C ATOM 247 CE2 PHE A 14 3.574 7.486 -2.955 1.00 0.00 C ATOM 248 CZ PHE A 14 4.549 8.419 -3.251 1.00 0.00 C ATOM 0 H PHE A 14 8.063 5.089 -2.332 1.00 0.00 H new ATOM 0 HA PHE A 14 5.758 3.879 -0.898 1.00 0.00 H new ATOM 0 HB2 PHE A 14 6.103 3.971 -3.898 1.00 0.00 H new ATOM 0 HB3 PHE A 14 4.645 3.674 -2.972 1.00 0.00 H new ATOM 0 HD1 PHE A 14 7.189 6.354 -3.568 1.00 0.00 H new ATOM 0 HD2 PHE A 14 3.137 5.421 -2.642 1.00 0.00 H new ATOM 0 HE1 PHE A 14 6.615 8.736 -3.701 1.00 0.00 H new ATOM 0 HE2 PHE A 14 2.556 7.803 -2.786 1.00 0.00 H new ATOM 0 HZ PHE A 14 4.295 9.467 -3.311 1.00 0.00 H new ATOM 258 N PHE A 15 6.551 1.548 -1.283 1.00 0.00 N ATOM 259 CA PHE A 15 7.134 0.213 -1.368 1.00 0.00 C ATOM 260 C PHE A 15 6.068 -0.867 -1.539 1.00 0.00 C ATOM 261 O PHE A 15 4.905 -0.681 -1.175 1.00 0.00 O ATOM 262 CB PHE A 15 7.967 -0.082 -0.118 1.00 0.00 C ATOM 263 CG PHE A 15 8.771 1.093 0.362 1.00 0.00 C ATOM 264 CD1 PHE A 15 8.153 2.164 0.986 1.00 0.00 C ATOM 265 CD2 PHE A 15 10.146 1.126 0.189 1.00 0.00 C ATOM 266 CE1 PHE A 15 8.889 3.246 1.427 1.00 0.00 C ATOM 267 CE2 PHE A 15 10.888 2.206 0.628 1.00 0.00 C ATOM 268 CZ PHE A 15 10.258 3.268 1.249 1.00 0.00 C ATOM 0 H PHE A 15 5.726 1.616 -0.687 1.00 0.00 H new ATOM 0 HA PHE A 15 7.774 0.196 -2.250 1.00 0.00 H new ATOM 0 HB2 PHE A 15 7.303 -0.408 0.682 1.00 0.00 H new ATOM 0 HB3 PHE A 15 8.642 -0.911 -0.329 1.00 0.00 H new ATOM 0 HD1 PHE A 15 7.083 2.153 1.129 1.00 0.00 H new ATOM 0 HD2 PHE A 15 10.643 0.298 -0.294 1.00 0.00 H new ATOM 0 HE1 PHE A 15 8.394 4.075 1.911 1.00 0.00 H new ATOM 0 HE2 PHE A 15 11.959 2.220 0.486 1.00 0.00 H new ATOM 0 HZ PHE A 15 10.835 4.113 1.594 1.00 0.00 H new ATOM 278 N ARG A 16 6.495 -2.003 -2.085 1.00 0.00 N ATOM 279 CA ARG A 16 5.615 -3.143 -2.310 1.00 0.00 C ATOM 280 C ARG A 16 6.412 -4.439 -2.205 1.00 0.00 C ATOM 281 O ARG A 16 7.585 -4.482 -2.575 1.00 0.00 O ATOM 282 CB ARG A 16 4.950 -3.046 -3.684 1.00 0.00 C ATOM 283 CG ARG A 16 4.031 -4.213 -4.006 1.00 0.00 C ATOM 284 CD ARG A 16 4.194 -4.668 -5.447 1.00 0.00 C ATOM 285 NE ARG A 16 5.513 -5.245 -5.693 1.00 0.00 N ATOM 286 CZ ARG A 16 6.043 -5.391 -6.906 1.00 0.00 C ATOM 287 NH1 ARG A 16 5.370 -5.005 -7.983 1.00 0.00 N ATOM 288 NH2 ARG A 16 7.251 -5.921 -7.041 1.00 0.00 N ATOM 0 H ARG A 16 7.458 -2.157 -2.383 1.00 0.00 H new ATOM 0 HA ARG A 16 4.835 -3.138 -1.549 1.00 0.00 H new ATOM 0 HB2 ARG A 16 4.377 -2.120 -3.735 1.00 0.00 H new ATOM 0 HB3 ARG A 16 5.725 -2.984 -4.448 1.00 0.00 H new ATOM 0 HG2 ARG A 16 4.247 -5.044 -3.334 1.00 0.00 H new ATOM 0 HG3 ARG A 16 2.996 -3.922 -3.830 1.00 0.00 H new ATOM 0 HD2 ARG A 16 3.426 -5.405 -5.684 1.00 0.00 H new ATOM 0 HD3 ARG A 16 4.039 -3.820 -6.115 1.00 0.00 H new ATOM 0 HE ARG A 16 6.060 -5.554 -4.889 1.00 0.00 H new ATOM 0 HH11 ARG A 16 4.442 -4.594 -7.884 1.00 0.00 H new ATOM 0 HH12 ARG A 16 5.781 -5.119 -8.909 1.00 0.00 H new ATOM 0 HH21 ARG A 16 7.773 -6.216 -6.216 1.00 0.00 H new ATOM 0 HH22 ARG A 16 7.658 -6.033 -7.970 1.00 0.00 H new ATOM 302 N ILE A 17 5.782 -5.493 -1.698 1.00 0.00 N ATOM 303 CA ILE A 17 6.462 -6.774 -1.552 1.00 0.00 C ATOM 304 C ILE A 17 5.535 -7.942 -1.896 1.00 0.00 C ATOM 305 O ILE A 17 4.449 -8.069 -1.329 1.00 0.00 O ATOM 306 CB ILE A 17 7.022 -6.973 -0.120 1.00 0.00 C ATOM 307 CG1 ILE A 17 6.764 -5.732 0.745 1.00 0.00 C ATOM 308 CG2 ILE A 17 8.512 -7.286 -0.175 1.00 0.00 C ATOM 309 CD1 ILE A 17 7.329 -5.837 2.147 1.00 0.00 C ATOM 0 H ILE A 17 4.811 -5.487 -1.384 1.00 0.00 H new ATOM 0 HA ILE A 17 7.296 -6.759 -2.254 1.00 0.00 H new ATOM 0 HB ILE A 17 6.505 -7.817 0.337 1.00 0.00 H new ATOM 0 HG12 ILE A 17 7.197 -4.861 0.253 1.00 0.00 H new ATOM 0 HG13 ILE A 17 5.689 -5.561 0.808 1.00 0.00 H new ATOM 0 HG21 ILE A 17 8.893 -7.423 0.837 1.00 0.00 H new ATOM 0 HG22 ILE A 17 8.671 -8.199 -0.749 1.00 0.00 H new ATOM 0 HG23 ILE A 17 9.040 -6.460 -0.652 1.00 0.00 H new ATOM 0 HD11 ILE A 17 7.107 -4.923 2.698 1.00 0.00 H new ATOM 0 HD12 ILE A 17 6.878 -6.687 2.658 1.00 0.00 H new ATOM 0 HD13 ILE A 17 8.409 -5.976 2.095 1.00 0.00 H new ATOM 321 N PRO A 18 5.955 -8.811 -2.836 1.00 0.00 N ATOM 322 CA PRO A 18 5.171 -9.966 -3.257 1.00 0.00 C ATOM 323 C PRO A 18 5.446 -11.194 -2.395 1.00 0.00 C ATOM 324 O PRO A 18 6.414 -11.918 -2.625 1.00 0.00 O ATOM 325 CB PRO A 18 5.667 -10.196 -4.680 1.00 0.00 C ATOM 326 CG PRO A 18 7.103 -9.792 -4.645 1.00 0.00 C ATOM 327 CD PRO A 18 7.235 -8.736 -3.570 1.00 0.00 C ATOM 0 HA PRO A 18 4.097 -9.797 -3.175 1.00 0.00 H new ATOM 0 HB2 PRO A 18 5.555 -11.239 -4.976 1.00 0.00 H new ATOM 0 HB3 PRO A 18 5.104 -9.599 -5.398 1.00 0.00 H new ATOM 0 HG2 PRO A 18 7.740 -10.649 -4.425 1.00 0.00 H new ATOM 0 HG3 PRO A 18 7.418 -9.400 -5.612 1.00 0.00 H new ATOM 0 HD2 PRO A 18 8.083 -8.937 -2.915 1.00 0.00 H new ATOM 0 HD3 PRO A 18 7.391 -7.747 -4.000 1.00 0.00 H new ATOM 335 N PHE A 19 4.594 -11.422 -1.403 1.00 0.00 N ATOM 336 CA PHE A 19 4.757 -12.564 -0.510 1.00 0.00 C ATOM 337 C PHE A 19 3.539 -13.480 -0.562 1.00 0.00 C ATOM 338 O PHE A 19 2.404 -13.017 -0.667 1.00 0.00 O ATOM 339 CB PHE A 19 4.992 -12.086 0.925 1.00 0.00 C ATOM 340 CG PHE A 19 3.862 -11.266 1.478 1.00 0.00 C ATOM 341 CD1 PHE A 19 2.652 -11.857 1.801 1.00 0.00 C ATOM 342 CD2 PHE A 19 4.011 -9.902 1.678 1.00 0.00 C ATOM 343 CE1 PHE A 19 1.611 -11.106 2.312 1.00 0.00 C ATOM 344 CE2 PHE A 19 2.973 -9.145 2.187 1.00 0.00 C ATOM 345 CZ PHE A 19 1.772 -9.749 2.505 1.00 0.00 C ATOM 0 H PHE A 19 3.786 -10.834 -1.197 1.00 0.00 H new ATOM 0 HA PHE A 19 5.626 -13.131 -0.844 1.00 0.00 H new ATOM 0 HB2 PHE A 19 5.149 -12.953 1.567 1.00 0.00 H new ATOM 0 HB3 PHE A 19 5.908 -11.496 0.957 1.00 0.00 H new ATOM 0 HD1 PHE A 19 2.520 -12.918 1.652 1.00 0.00 H new ATOM 0 HD2 PHE A 19 4.949 -9.426 1.433 1.00 0.00 H new ATOM 0 HE1 PHE A 19 0.673 -11.580 2.560 1.00 0.00 H new ATOM 0 HE2 PHE A 19 3.100 -8.083 2.336 1.00 0.00 H new ATOM 0 HZ PHE A 19 0.960 -9.160 2.904 1.00 0.00 H new ATOM 355 N ILE A 20 3.786 -14.783 -0.485 1.00 0.00 N ATOM 356 CA ILE A 20 2.713 -15.769 -0.521 1.00 0.00 C ATOM 357 C ILE A 20 2.172 -16.035 0.876 1.00 0.00 C ATOM 358 O ILE A 20 2.917 -16.018 1.857 1.00 0.00 O ATOM 359 CB ILE A 20 3.187 -17.101 -1.130 1.00 0.00 C ATOM 360 CG1 ILE A 20 4.007 -16.847 -2.393 1.00 0.00 C ATOM 361 CG2 ILE A 20 1.999 -17.999 -1.439 1.00 0.00 C ATOM 362 CD1 ILE A 20 4.569 -18.110 -3.011 1.00 0.00 C ATOM 0 H ILE A 20 4.721 -15.181 -0.397 1.00 0.00 H new ATOM 0 HA ILE A 20 1.924 -15.352 -1.148 1.00 0.00 H new ATOM 0 HB ILE A 20 3.821 -17.607 -0.402 1.00 0.00 H new ATOM 0 HG12 ILE A 20 3.381 -16.340 -3.127 1.00 0.00 H new ATOM 0 HG13 ILE A 20 4.829 -16.172 -2.154 1.00 0.00 H new ATOM 0 HG21 ILE A 20 2.353 -18.936 -1.869 1.00 0.00 H new ATOM 0 HG22 ILE A 20 1.450 -18.206 -0.520 1.00 0.00 H new ATOM 0 HG23 ILE A 20 1.341 -17.500 -2.150 1.00 0.00 H new ATOM 0 HD11 ILE A 20 5.140 -17.855 -3.904 1.00 0.00 H new ATOM 0 HD12 ILE A 20 5.221 -18.607 -2.293 1.00 0.00 H new ATOM 0 HD13 ILE A 20 3.751 -18.778 -3.282 1.00 0.00 H new ATOM 374 N ARG A 21 0.873 -16.286 0.962 1.00 0.00 N ATOM 375 CA ARG A 21 0.234 -16.564 2.241 1.00 0.00 C ATOM 376 C ARG A 21 0.727 -17.895 2.807 1.00 0.00 C ATOM 377 O ARG A 21 0.719 -18.910 2.113 1.00 0.00 O ATOM 378 CB ARG A 21 -1.287 -16.585 2.082 1.00 0.00 C ATOM 379 CG ARG A 21 -1.988 -15.492 2.870 1.00 0.00 C ATOM 380 CD ARG A 21 -3.471 -15.432 2.543 1.00 0.00 C ATOM 381 NE ARG A 21 -4.293 -15.322 3.746 1.00 0.00 N ATOM 382 CZ ARG A 21 -5.544 -14.866 3.753 1.00 0.00 C ATOM 383 NH1 ARG A 21 -6.121 -14.476 2.624 1.00 0.00 N ATOM 384 NH2 ARG A 21 -6.219 -14.799 4.893 1.00 0.00 N ATOM 0 H ARG A 21 0.241 -16.303 0.162 1.00 0.00 H new ATOM 0 HA ARG A 21 0.500 -15.771 2.940 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -1.537 -16.479 1.026 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -1.666 -17.555 2.404 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -1.857 -15.671 3.937 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -1.527 -14.530 2.649 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -3.665 -14.579 1.893 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -3.757 -16.326 1.989 1.00 0.00 H new ATOM 0 HE ARG A 21 -3.884 -15.612 4.634 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -5.606 -14.525 1.745 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -7.080 -14.128 2.635 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -5.780 -15.097 5.764 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -7.177 -14.450 4.898 1.00 0.00 H new ATOM 398 N PRO A 22 1.168 -17.909 4.077 1.00 0.00 N ATOM 399 CA PRO A 22 1.670 -19.127 4.722 1.00 0.00 C ATOM 400 C PRO A 22 0.720 -20.309 4.565 1.00 0.00 C ATOM 401 O PRO A 22 1.131 -21.405 4.188 1.00 0.00 O ATOM 402 CB PRO A 22 1.786 -18.727 6.193 1.00 0.00 C ATOM 403 CG PRO A 22 1.997 -17.254 6.167 1.00 0.00 C ATOM 404 CD PRO A 22 1.222 -16.745 4.983 1.00 0.00 C ATOM 0 HA PRO A 22 2.608 -19.461 4.279 1.00 0.00 H new ATOM 0 HB2 PRO A 22 0.884 -18.988 6.747 1.00 0.00 H new ATOM 0 HB3 PRO A 22 2.618 -19.238 6.678 1.00 0.00 H new ATOM 0 HG2 PRO A 22 1.646 -16.793 7.090 1.00 0.00 H new ATOM 0 HG3 PRO A 22 3.056 -17.013 6.073 1.00 0.00 H new ATOM 0 HD2 PRO A 22 0.224 -16.413 5.270 1.00 0.00 H new ATOM 0 HD3 PRO A 22 1.718 -15.895 4.515 1.00 0.00 H new ATOM 412 N ALA A 23 -0.554 -20.078 4.861 1.00 0.00 N ATOM 413 CA ALA A 23 -1.564 -21.124 4.760 1.00 0.00 C ATOM 414 C ALA A 23 -1.572 -21.758 3.376 1.00 0.00 C ATOM 415 O ALA A 23 -1.387 -22.967 3.233 1.00 0.00 O ATOM 416 CB ALA A 23 -2.938 -20.563 5.093 1.00 0.00 C ATOM 0 H ALA A 23 -0.912 -19.175 5.173 1.00 0.00 H new ATOM 0 HA ALA A 23 -1.314 -21.902 5.481 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -3.683 -21.355 5.014 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -2.934 -20.169 6.109 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -3.183 -19.763 4.395 1.00 0.00 H new ATOM 422 N ASP A 24 -1.788 -20.933 2.363 1.00 0.00 N ATOM 423 CA ASP A 24 -1.824 -21.407 0.982 1.00 0.00 C ATOM 424 C ASP A 24 -0.445 -21.886 0.534 1.00 0.00 C ATOM 425 O ASP A 24 -0.325 -22.803 -0.284 1.00 0.00 O ATOM 426 CB ASP A 24 -2.311 -20.290 0.055 1.00 0.00 C ATOM 427 CG ASP A 24 -3.617 -19.678 0.524 1.00 0.00 C ATOM 428 OD1 ASP A 24 -4.506 -20.440 0.957 1.00 0.00 O ATOM 429 OD2 ASP A 24 -3.749 -18.439 0.458 1.00 0.00 O ATOM 0 H ASP A 24 -1.942 -19.930 2.468 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.516 -22.247 0.929 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -1.549 -19.513 -0.004 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -2.440 -20.687 -0.952 1.00 0.00 H new ATOM 434 N GLN A 25 0.589 -21.252 1.080 1.00 0.00 N ATOM 435 CA GLN A 25 1.972 -21.582 0.752 1.00 0.00 C ATOM 436 C GLN A 25 2.240 -23.077 0.899 1.00 0.00 C ATOM 437 O GLN A 25 2.704 -23.729 -0.037 1.00 0.00 O ATOM 438 CB GLN A 25 2.917 -20.766 1.648 1.00 0.00 C ATOM 439 CG GLN A 25 4.241 -21.449 1.959 1.00 0.00 C ATOM 440 CD GLN A 25 5.381 -20.464 2.116 1.00 0.00 C ATOM 441 OE1 GLN A 25 6.051 -20.429 3.149 1.00 0.00 O ATOM 442 NE2 GLN A 25 5.611 -19.655 1.087 1.00 0.00 N ATOM 0 H GLN A 25 0.492 -20.498 1.760 1.00 0.00 H new ATOM 0 HA GLN A 25 2.154 -21.325 -0.292 1.00 0.00 H new ATOM 0 HB2 GLN A 25 3.121 -19.811 1.164 1.00 0.00 H new ATOM 0 HB3 GLN A 25 2.407 -20.546 2.586 1.00 0.00 H new ATOM 0 HG2 GLN A 25 4.139 -22.031 2.875 1.00 0.00 H new ATOM 0 HG3 GLN A 25 4.480 -22.151 1.160 1.00 0.00 H new ATOM 0 HE21 GLN A 25 5.032 -19.717 0.250 1.00 0.00 H new ATOM 0 HE22 GLN A 25 6.367 -18.972 1.134 1.00 0.00 H new ATOM 451 N TYR A 26 1.958 -23.610 2.077 1.00 0.00 N ATOM 452 CA TYR A 26 2.184 -25.029 2.341 1.00 0.00 C ATOM 453 C TYR A 26 0.928 -25.858 2.087 1.00 0.00 C ATOM 454 O TYR A 26 0.996 -27.084 1.999 1.00 0.00 O ATOM 455 CB TYR A 26 2.681 -25.251 3.773 1.00 0.00 C ATOM 456 CG TYR A 26 2.034 -24.355 4.803 1.00 0.00 C ATOM 457 CD1 TYR A 26 0.700 -24.513 5.149 1.00 0.00 C ATOM 458 CD2 TYR A 26 2.763 -23.352 5.430 1.00 0.00 C ATOM 459 CE1 TYR A 26 0.109 -23.698 6.093 1.00 0.00 C ATOM 460 CE2 TYR A 26 2.179 -22.532 6.376 1.00 0.00 C ATOM 461 CZ TYR A 26 0.851 -22.710 6.704 1.00 0.00 C ATOM 462 OH TYR A 26 0.266 -21.895 7.645 1.00 0.00 O ATOM 0 H TYR A 26 1.574 -23.088 2.864 1.00 0.00 H new ATOM 0 HA TYR A 26 2.955 -25.363 1.647 1.00 0.00 H new ATOM 0 HB2 TYR A 26 2.503 -26.290 4.050 1.00 0.00 H new ATOM 0 HB3 TYR A 26 3.759 -25.095 3.799 1.00 0.00 H new ATOM 0 HD1 TYR A 26 0.115 -25.286 4.672 1.00 0.00 H new ATOM 0 HD2 TYR A 26 3.803 -23.211 5.174 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -0.931 -23.834 6.352 1.00 0.00 H new ATOM 0 HE2 TYR A 26 2.758 -21.757 6.856 1.00 0.00 H new ATOM 0 HH TYR A 26 0.927 -21.253 7.978 1.00 0.00 H new ATOM 472 N LYS A 27 -0.218 -25.194 1.965 1.00 0.00 N ATOM 473 CA LYS A 27 -1.472 -25.893 1.717 1.00 0.00 C ATOM 474 C LYS A 27 -1.409 -26.655 0.402 1.00 0.00 C ATOM 475 O LYS A 27 -1.779 -27.827 0.331 1.00 0.00 O ATOM 476 CB LYS A 27 -2.641 -24.906 1.690 1.00 0.00 C ATOM 477 CG LYS A 27 -3.397 -24.822 3.005 1.00 0.00 C ATOM 478 CD LYS A 27 -4.083 -23.476 3.166 1.00 0.00 C ATOM 479 CE LYS A 27 -5.559 -23.556 2.807 1.00 0.00 C ATOM 480 NZ LYS A 27 -6.332 -24.349 3.803 1.00 0.00 N ATOM 0 H LYS A 27 -0.303 -24.180 2.033 1.00 0.00 H new ATOM 0 HA LYS A 27 -1.629 -26.604 2.528 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -2.264 -23.916 1.434 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -3.334 -25.198 0.900 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -4.140 -25.618 3.051 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -2.707 -24.982 3.834 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -3.976 -23.133 4.195 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -3.593 -22.738 2.531 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -5.972 -22.549 2.745 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -5.669 -24.007 1.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -7.339 -24.097 3.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -6.216 -25.363 3.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -5.981 -24.141 4.760 1.00 0.00 H new ATOM 494 N ASP A 28 -0.936 -25.982 -0.641 1.00 0.00 N ATOM 495 CA ASP A 28 -0.822 -26.601 -1.957 1.00 0.00 C ATOM 496 C ASP A 28 0.074 -25.774 -2.878 1.00 0.00 C ATOM 497 O ASP A 28 0.046 -24.544 -2.842 1.00 0.00 O ATOM 498 CB ASP A 28 -2.209 -26.767 -2.583 1.00 0.00 C ATOM 499 CG ASP A 28 -2.371 -28.102 -3.286 1.00 0.00 C ATOM 500 OD1 ASP A 28 -2.302 -29.145 -2.602 1.00 0.00 O ATOM 501 OD2 ASP A 28 -2.562 -28.103 -4.520 1.00 0.00 O ATOM 0 H ASP A 28 -0.626 -25.011 -0.602 1.00 0.00 H new ATOM 0 HA ASP A 28 -0.366 -27.583 -1.831 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -2.968 -26.674 -1.807 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -2.382 -25.961 -3.296 1.00 0.00 H new ATOM 506 N PRO A 29 0.886 -26.442 -3.720 1.00 0.00 N ATOM 507 CA PRO A 29 1.794 -25.764 -4.651 1.00 0.00 C ATOM 508 C PRO A 29 1.056 -25.072 -5.793 1.00 0.00 C ATOM 509 O PRO A 29 1.577 -24.144 -6.410 1.00 0.00 O ATOM 510 CB PRO A 29 2.667 -26.896 -5.188 1.00 0.00 C ATOM 511 CG PRO A 29 1.819 -28.109 -5.063 1.00 0.00 C ATOM 512 CD PRO A 29 0.986 -27.909 -3.827 1.00 0.00 C ATOM 0 HA PRO A 29 2.356 -24.970 -4.159 1.00 0.00 H new ATOM 0 HB2 PRO A 29 2.955 -26.718 -6.224 1.00 0.00 H new ATOM 0 HB3 PRO A 29 3.588 -26.994 -4.613 1.00 0.00 H new ATOM 0 HG2 PRO A 29 1.188 -28.236 -5.942 1.00 0.00 H new ATOM 0 HG3 PRO A 29 2.432 -29.006 -4.979 1.00 0.00 H new ATOM 0 HD2 PRO A 29 0.005 -28.373 -3.924 1.00 0.00 H new ATOM 0 HD3 PRO A 29 1.460 -28.345 -2.948 1.00 0.00 H new ATOM 520 N GLN A 30 -0.163 -25.528 -6.069 1.00 0.00 N ATOM 521 CA GLN A 30 -0.971 -24.951 -7.136 1.00 0.00 C ATOM 522 C GLN A 30 -1.920 -23.891 -6.584 1.00 0.00 C ATOM 523 O GLN A 30 -2.227 -22.906 -7.256 1.00 0.00 O ATOM 524 CB GLN A 30 -1.769 -26.043 -7.851 1.00 0.00 C ATOM 525 CG GLN A 30 -0.907 -27.178 -8.379 1.00 0.00 C ATOM 526 CD GLN A 30 -1.699 -28.448 -8.620 1.00 0.00 C ATOM 527 OE1 GLN A 30 -2.246 -29.038 -7.688 1.00 0.00 O ATOM 528 NE2 GLN A 30 -1.763 -28.876 -9.875 1.00 0.00 N ATOM 0 H GLN A 30 -0.611 -26.295 -5.568 1.00 0.00 H new ATOM 0 HA GLN A 30 -0.299 -24.477 -7.851 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -2.510 -26.450 -7.163 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -2.317 -25.597 -8.681 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -0.434 -26.867 -9.310 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -0.107 -27.383 -7.668 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -1.294 -28.355 -10.616 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -2.281 -29.726 -10.098 1.00 0.00 H new ATOM 537 N ASN A 31 -2.375 -24.101 -5.354 1.00 0.00 N ATOM 538 CA ASN A 31 -3.287 -23.168 -4.703 1.00 0.00 C ATOM 539 C ASN A 31 -2.538 -22.285 -3.710 1.00 0.00 C ATOM 540 O ASN A 31 -2.961 -22.119 -2.567 1.00 0.00 O ATOM 541 CB ASN A 31 -4.404 -23.932 -3.988 1.00 0.00 C ATOM 542 CG ASN A 31 -5.275 -24.717 -4.948 1.00 0.00 C ATOM 543 OD1 ASN A 31 -5.499 -25.913 -4.765 1.00 0.00 O ATOM 544 ND2 ASN A 31 -5.769 -24.046 -5.983 1.00 0.00 N ATOM 0 H ASN A 31 -2.126 -24.911 -4.786 1.00 0.00 H new ATOM 0 HA ASN A 31 -3.728 -22.530 -5.469 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -3.965 -24.614 -3.260 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -5.024 -23.228 -3.433 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -6.360 -24.522 -6.665 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -5.558 -23.055 -6.096 1.00 0.00 H new ATOM 551 N LYS A 32 -1.419 -21.721 -4.156 1.00 0.00 N ATOM 552 CA LYS A 32 -0.605 -20.855 -3.309 1.00 0.00 C ATOM 553 C LYS A 32 -0.611 -19.421 -3.835 1.00 0.00 C ATOM 554 O LYS A 32 0.436 -18.863 -4.165 1.00 0.00 O ATOM 555 CB LYS A 32 0.833 -21.378 -3.224 1.00 0.00 C ATOM 556 CG LYS A 32 1.232 -22.271 -4.388 1.00 0.00 C ATOM 557 CD LYS A 32 1.245 -21.504 -5.703 1.00 0.00 C ATOM 558 CE LYS A 32 2.662 -21.318 -6.227 1.00 0.00 C ATOM 559 NZ LYS A 32 2.738 -21.514 -7.701 1.00 0.00 N ATOM 0 H LYS A 32 -1.055 -21.848 -5.100 1.00 0.00 H new ATOM 0 HA LYS A 32 -1.038 -20.860 -2.309 1.00 0.00 H new ATOM 0 HB2 LYS A 32 1.516 -20.530 -3.179 1.00 0.00 H new ATOM 0 HB3 LYS A 32 0.953 -21.934 -2.294 1.00 0.00 H new ATOM 0 HG2 LYS A 32 2.220 -22.693 -4.202 1.00 0.00 H new ATOM 0 HG3 LYS A 32 0.537 -23.107 -4.461 1.00 0.00 H new ATOM 0 HD2 LYS A 32 0.650 -22.039 -6.443 1.00 0.00 H new ATOM 0 HD3 LYS A 32 0.778 -20.530 -5.562 1.00 0.00 H new ATOM 0 HE2 LYS A 32 3.014 -20.318 -5.975 1.00 0.00 H new ATOM 0 HE3 LYS A 32 3.328 -22.025 -5.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 3.719 -21.379 -8.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 2.426 -22.477 -7.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 2.122 -20.823 -8.175 1.00 0.00 H new ATOM 573 N LYS A 33 -1.802 -18.832 -3.912 1.00 0.00 N ATOM 574 CA LYS A 33 -1.957 -17.461 -4.396 1.00 0.00 C ATOM 575 C LYS A 33 -0.900 -16.538 -3.793 1.00 0.00 C ATOM 576 O LYS A 33 -0.483 -16.721 -2.649 1.00 0.00 O ATOM 577 CB LYS A 33 -3.357 -16.940 -4.066 1.00 0.00 C ATOM 578 CG LYS A 33 -4.405 -17.304 -5.106 1.00 0.00 C ATOM 579 CD LYS A 33 -4.667 -18.802 -5.138 1.00 0.00 C ATOM 580 CE LYS A 33 -3.748 -19.508 -6.123 1.00 0.00 C ATOM 581 NZ LYS A 33 -4.481 -20.511 -6.945 1.00 0.00 N ATOM 0 H LYS A 33 -2.677 -19.284 -3.645 1.00 0.00 H new ATOM 0 HA LYS A 33 -1.822 -17.469 -5.478 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -3.664 -17.337 -3.099 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -3.317 -15.855 -3.967 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -5.333 -16.776 -4.888 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -4.073 -16.971 -6.089 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -4.523 -19.219 -4.141 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -5.706 -18.985 -5.413 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -3.283 -18.771 -6.778 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -2.944 -20.003 -5.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -3.828 -21.267 -7.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -5.257 -20.919 -6.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -4.871 -20.048 -7.791 1.00 0.00 H new ATOM 595 N LYS A 34 -0.466 -15.553 -4.573 1.00 0.00 N ATOM 596 CA LYS A 34 0.550 -14.611 -4.118 1.00 0.00 C ATOM 597 C LYS A 34 -0.084 -13.297 -3.668 1.00 0.00 C ATOM 598 O LYS A 34 -0.705 -12.592 -4.463 1.00 0.00 O ATOM 599 CB LYS A 34 1.574 -14.331 -5.226 1.00 0.00 C ATOM 600 CG LYS A 34 1.754 -15.471 -6.223 1.00 0.00 C ATOM 601 CD LYS A 34 3.000 -16.290 -5.930 1.00 0.00 C ATOM 602 CE LYS A 34 4.257 -15.430 -5.936 1.00 0.00 C ATOM 603 NZ LYS A 34 5.213 -15.851 -6.996 1.00 0.00 N ATOM 0 H LYS A 34 -0.802 -15.387 -5.522 1.00 0.00 H new ATOM 0 HA LYS A 34 1.060 -15.067 -3.269 1.00 0.00 H new ATOM 0 HB2 LYS A 34 1.269 -13.436 -5.768 1.00 0.00 H new ATOM 0 HB3 LYS A 34 2.538 -14.112 -4.766 1.00 0.00 H new ATOM 0 HG2 LYS A 34 0.878 -16.120 -6.194 1.00 0.00 H new ATOM 0 HG3 LYS A 34 1.816 -15.064 -7.232 1.00 0.00 H new ATOM 0 HD2 LYS A 34 2.896 -16.775 -4.959 1.00 0.00 H new ATOM 0 HD3 LYS A 34 3.098 -17.082 -6.673 1.00 0.00 H new ATOM 0 HE2 LYS A 34 3.982 -14.386 -6.089 1.00 0.00 H new ATOM 0 HE3 LYS A 34 4.744 -15.492 -4.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 6.055 -15.241 -6.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 5.496 -16.839 -6.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 4.758 -15.768 -7.927 1.00 0.00 H new ATOM 617 N GLY A 35 0.083 -12.973 -2.389 1.00 0.00 N ATOM 618 CA GLY A 35 -0.472 -11.742 -1.858 1.00 0.00 C ATOM 619 C GLY A 35 0.514 -10.592 -1.926 1.00 0.00 C ATOM 620 O GLY A 35 1.641 -10.703 -1.441 1.00 0.00 O ATOM 0 H GLY A 35 0.592 -13.541 -1.712 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -1.371 -11.481 -2.416 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -0.774 -11.899 -0.822 1.00 0.00 H new ATOM 624 N TRP A 36 0.094 -9.488 -2.532 1.00 0.00 N ATOM 625 CA TRP A 36 0.951 -8.317 -2.665 1.00 0.00 C ATOM 626 C TRP A 36 0.578 -7.249 -1.646 1.00 0.00 C ATOM 627 O TRP A 36 -0.601 -6.958 -1.437 1.00 0.00 O ATOM 628 CB TRP A 36 0.855 -7.751 -4.083 1.00 0.00 C ATOM 629 CG TRP A 36 1.287 -8.731 -5.128 1.00 0.00 C ATOM 630 CD1 TRP A 36 2.563 -9.135 -5.390 1.00 0.00 C ATOM 631 CD2 TRP A 36 0.444 -9.435 -6.046 1.00 0.00 C ATOM 632 NE1 TRP A 36 2.568 -10.049 -6.414 1.00 0.00 N ATOM 633 CE2 TRP A 36 1.278 -10.251 -6.835 1.00 0.00 C ATOM 634 CE3 TRP A 36 -0.934 -9.457 -6.277 1.00 0.00 C ATOM 635 CZ2 TRP A 36 0.778 -11.079 -7.837 1.00 0.00 C ATOM 636 CZ3 TRP A 36 -1.429 -10.279 -7.272 1.00 0.00 C ATOM 637 CH2 TRP A 36 -0.575 -11.081 -8.040 1.00 0.00 C ATOM 0 H TRP A 36 -0.835 -9.379 -2.939 1.00 0.00 H new ATOM 0 HA TRP A 36 1.979 -8.624 -2.474 1.00 0.00 H new ATOM 0 HB2 TRP A 36 -0.173 -7.447 -4.279 1.00 0.00 H new ATOM 0 HB3 TRP A 36 1.472 -6.855 -4.154 1.00 0.00 H new ATOM 0 HD1 TRP A 36 3.442 -8.786 -4.868 1.00 0.00 H new ATOM 0 HE1 TRP A 36 3.396 -10.504 -6.799 1.00 0.00 H new ATOM 0 HE3 TRP A 36 -1.600 -8.843 -5.689 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 1.434 -11.697 -8.432 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 -2.492 -10.303 -7.460 1.00 0.00 H new ATOM 0 HH2 TRP A 36 -0.993 -11.714 -8.808 1.00 0.00 H new ATOM 648 N TRP A 37 1.590 -6.672 -1.006 1.00 0.00 N ATOM 649 CA TRP A 37 1.368 -5.641 0.000 1.00 0.00 C ATOM 650 C TRP A 37 1.984 -4.313 -0.431 1.00 0.00 C ATOM 651 O TRP A 37 3.200 -4.202 -0.585 1.00 0.00 O ATOM 652 CB TRP A 37 1.965 -6.088 1.338 1.00 0.00 C ATOM 653 CG TRP A 37 1.723 -5.133 2.467 1.00 0.00 C ATOM 654 CD1 TRP A 37 0.519 -4.797 3.017 1.00 0.00 C ATOM 655 CD2 TRP A 37 2.716 -4.398 3.193 1.00 0.00 C ATOM 656 NE1 TRP A 37 0.705 -3.899 4.043 1.00 0.00 N ATOM 657 CE2 TRP A 37 2.044 -3.638 4.170 1.00 0.00 C ATOM 658 CE3 TRP A 37 4.108 -4.311 3.111 1.00 0.00 C ATOM 659 CZ2 TRP A 37 2.721 -2.802 5.059 1.00 0.00 C ATOM 660 CZ3 TRP A 37 4.776 -3.483 3.992 1.00 0.00 C ATOM 661 CH2 TRP A 37 4.083 -2.739 4.954 1.00 0.00 C ATOM 0 H TRP A 37 2.571 -6.901 -1.166 1.00 0.00 H new ATOM 0 HA TRP A 37 0.294 -5.495 0.113 1.00 0.00 H new ATOM 0 HB2 TRP A 37 1.548 -7.060 1.603 1.00 0.00 H new ATOM 0 HB3 TRP A 37 3.040 -6.225 1.216 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -0.438 -5.180 2.694 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -0.035 -3.493 4.616 1.00 0.00 H new ATOM 0 HE3 TRP A 37 4.652 -4.881 2.372 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 2.189 -2.226 5.802 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 5.852 -3.408 3.938 1.00 0.00 H new ATOM 0 HH2 TRP A 37 4.636 -2.101 5.628 1.00 0.00 H new ATOM 672 N TYR A 38 1.136 -3.304 -0.609 1.00 0.00 N ATOM 673 CA TYR A 38 1.594 -1.977 -1.009 1.00 0.00 C ATOM 674 C TYR A 38 1.390 -0.987 0.130 1.00 0.00 C ATOM 675 O TYR A 38 0.481 -1.150 0.946 1.00 0.00 O ATOM 676 CB TYR A 38 0.839 -1.492 -2.249 1.00 0.00 C ATOM 677 CG TYR A 38 1.016 -2.365 -3.469 1.00 0.00 C ATOM 678 CD1 TYR A 38 0.479 -3.643 -3.514 1.00 0.00 C ATOM 679 CD2 TYR A 38 1.713 -1.906 -4.580 1.00 0.00 C ATOM 680 CE1 TYR A 38 0.632 -4.442 -4.632 1.00 0.00 C ATOM 681 CE2 TYR A 38 1.869 -2.697 -5.703 1.00 0.00 C ATOM 682 CZ TYR A 38 1.326 -3.965 -5.723 1.00 0.00 C ATOM 683 OH TYR A 38 1.479 -4.756 -6.838 1.00 0.00 O ATOM 0 H TYR A 38 0.127 -3.380 -0.482 1.00 0.00 H new ATOM 0 HA TYR A 38 2.655 -2.042 -1.248 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -0.223 -1.431 -2.012 1.00 0.00 H new ATOM 0 HB3 TYR A 38 1.170 -0.482 -2.489 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -0.067 -4.020 -2.662 1.00 0.00 H new ATOM 0 HD2 TYR A 38 2.140 -0.914 -4.566 1.00 0.00 H new ATOM 0 HE1 TYR A 38 0.209 -5.436 -4.650 1.00 0.00 H new ATOM 0 HE2 TYR A 38 2.412 -2.325 -6.559 1.00 0.00 H new ATOM 0 HH TYR A 38 1.992 -4.269 -7.516 1.00 0.00 H new ATOM 693 N ALA A 39 2.234 0.037 0.191 1.00 0.00 N ATOM 694 CA ALA A 39 2.120 1.038 1.244 1.00 0.00 C ATOM 695 C ALA A 39 3.010 2.244 0.984 1.00 0.00 C ATOM 696 O ALA A 39 4.224 2.115 0.809 1.00 0.00 O ATOM 697 CB ALA A 39 2.453 0.413 2.591 1.00 0.00 C ATOM 0 H ALA A 39 2.996 0.195 -0.468 1.00 0.00 H new ATOM 0 HA ALA A 39 1.090 1.394 1.254 1.00 0.00 H new ATOM 0 HB1 ALA A 39 2.366 1.167 3.373 1.00 0.00 H new ATOM 0 HB2 ALA A 39 1.760 -0.403 2.795 1.00 0.00 H new ATOM 0 HB3 ALA A 39 3.472 0.027 2.571 1.00 0.00 H new ATOM 703 N HIS A 40 2.395 3.421 0.979 1.00 0.00 N ATOM 704 CA HIS A 40 3.117 4.667 0.766 1.00 0.00 C ATOM 705 C HIS A 40 3.544 5.248 2.109 1.00 0.00 C ATOM 706 O HIS A 40 2.741 5.867 2.811 1.00 0.00 O ATOM 707 CB HIS A 40 2.240 5.667 0.008 1.00 0.00 C ATOM 708 CG HIS A 40 2.834 7.040 -0.091 1.00 0.00 C ATOM 709 ND1 HIS A 40 2.119 8.141 -0.511 1.00 0.00 N ATOM 710 CD2 HIS A 40 4.082 7.487 0.187 1.00 0.00 C ATOM 711 CE1 HIS A 40 2.903 9.206 -0.490 1.00 0.00 C ATOM 712 NE2 HIS A 40 4.098 8.836 -0.070 1.00 0.00 N ATOM 0 H HIS A 40 1.392 3.537 1.121 1.00 0.00 H new ATOM 0 HA HIS A 40 4.005 4.466 0.167 1.00 0.00 H new ATOM 0 HB2 HIS A 40 2.058 5.287 -0.997 1.00 0.00 H new ATOM 0 HB3 HIS A 40 1.272 5.735 0.504 1.00 0.00 H new ATOM 0 HD1 HIS A 40 1.139 8.135 -0.794 1.00 0.00 H new ATOM 0 HD2 HIS A 40 4.910 6.893 0.544 1.00 0.00 H new ATOM 0 HE1 HIS A 40 2.614 10.208 -0.769 1.00 0.00 H new ATOM 721 N PHE A 41 4.806 5.026 2.467 1.00 0.00 N ATOM 722 CA PHE A 41 5.336 5.509 3.734 1.00 0.00 C ATOM 723 C PHE A 41 5.826 6.950 3.630 1.00 0.00 C ATOM 724 O PHE A 41 6.756 7.249 2.881 1.00 0.00 O ATOM 725 CB PHE A 41 6.485 4.620 4.212 1.00 0.00 C ATOM 726 CG PHE A 41 6.050 3.278 4.726 1.00 0.00 C ATOM 727 CD1 PHE A 41 5.612 2.297 3.853 1.00 0.00 C ATOM 728 CD2 PHE A 41 6.091 2.994 6.082 1.00 0.00 C ATOM 729 CE1 PHE A 41 5.218 1.059 4.322 1.00 0.00 C ATOM 730 CE2 PHE A 41 5.698 1.757 6.557 1.00 0.00 C ATOM 731 CZ PHE A 41 5.261 0.789 5.674 1.00 0.00 C ATOM 0 H PHE A 41 5.479 4.514 1.896 1.00 0.00 H new ATOM 0 HA PHE A 41 4.520 5.473 4.455 1.00 0.00 H new ATOM 0 HB2 PHE A 41 7.183 4.472 3.388 1.00 0.00 H new ATOM 0 HB3 PHE A 41 7.029 5.140 5.001 1.00 0.00 H new ATOM 0 HD1 PHE A 41 5.578 2.502 2.793 1.00 0.00 H new ATOM 0 HD2 PHE A 41 6.434 3.748 6.775 1.00 0.00 H new ATOM 0 HE1 PHE A 41 4.876 0.303 3.631 1.00 0.00 H new ATOM 0 HE2 PHE A 41 5.733 1.548 7.616 1.00 0.00 H new ATOM 0 HZ PHE A 41 4.953 -0.179 6.042 1.00 0.00 H new ATOM 741 N ASP A 42 5.214 7.833 4.414 1.00 0.00 N ATOM 742 CA ASP A 42 5.608 9.234 4.441 1.00 0.00 C ATOM 743 C ASP A 42 6.652 9.436 5.529 1.00 0.00 C ATOM 744 O ASP A 42 6.374 9.234 6.715 1.00 0.00 O ATOM 745 CB ASP A 42 4.393 10.128 4.697 1.00 0.00 C ATOM 746 CG ASP A 42 3.845 10.740 3.421 1.00 0.00 C ATOM 747 OD1 ASP A 42 4.538 11.593 2.828 1.00 0.00 O ATOM 748 OD2 ASP A 42 2.724 10.366 3.017 1.00 0.00 O ATOM 0 H ASP A 42 4.442 7.600 5.039 1.00 0.00 H new ATOM 0 HA ASP A 42 6.031 9.508 3.475 1.00 0.00 H new ATOM 0 HB2 ASP A 42 3.611 9.543 5.181 1.00 0.00 H new ATOM 0 HB3 ASP A 42 4.670 10.924 5.388 1.00 0.00 H new ATOM 753 N GLY A 43 7.863 9.800 5.128 1.00 0.00 N ATOM 754 CA GLY A 43 8.924 9.978 6.099 1.00 0.00 C ATOM 755 C GLY A 43 9.153 8.707 6.898 1.00 0.00 C ATOM 756 O GLY A 43 9.177 7.616 6.325 1.00 0.00 O ATOM 0 H GLY A 43 8.128 9.974 4.158 1.00 0.00 H new ATOM 0 HA2 GLY A 43 9.845 10.261 5.589 1.00 0.00 H new ATOM 0 HA3 GLY A 43 8.670 10.795 6.774 1.00 0.00 H new ATOM 760 N PRO A 44 9.313 8.805 8.225 1.00 0.00 N ATOM 761 CA PRO A 44 9.526 7.636 9.078 1.00 0.00 C ATOM 762 C PRO A 44 8.257 6.797 9.243 1.00 0.00 C ATOM 763 O PRO A 44 8.319 5.636 9.645 1.00 0.00 O ATOM 764 CB PRO A 44 9.944 8.237 10.432 1.00 0.00 C ATOM 765 CG PRO A 44 10.154 9.695 10.183 1.00 0.00 C ATOM 766 CD PRO A 44 9.298 10.046 9.004 1.00 0.00 C ATOM 0 HA PRO A 44 10.267 6.960 8.652 1.00 0.00 H new ATOM 0 HB2 PRO A 44 9.173 8.076 11.186 1.00 0.00 H new ATOM 0 HB3 PRO A 44 10.856 7.768 10.803 1.00 0.00 H new ATOM 0 HG2 PRO A 44 9.873 10.283 11.057 1.00 0.00 H new ATOM 0 HG3 PRO A 44 11.203 9.908 9.979 1.00 0.00 H new ATOM 0 HD2 PRO A 44 8.288 10.325 9.304 1.00 0.00 H new ATOM 0 HD3 PRO A 44 9.707 10.885 8.440 1.00 0.00 H new ATOM 774 N TRP A 45 7.107 7.401 8.953 1.00 0.00 N ATOM 775 CA TRP A 45 5.823 6.721 9.094 1.00 0.00 C ATOM 776 C TRP A 45 5.141 6.519 7.745 1.00 0.00 C ATOM 777 O TRP A 45 5.732 6.765 6.693 1.00 0.00 O ATOM 778 CB TRP A 45 4.926 7.537 10.020 1.00 0.00 C ATOM 779 CG TRP A 45 5.710 8.356 10.996 1.00 0.00 C ATOM 780 CD1 TRP A 45 6.384 9.514 10.742 1.00 0.00 C ATOM 781 CD2 TRP A 45 5.925 8.058 12.373 1.00 0.00 C ATOM 782 NE1 TRP A 45 7.002 9.959 11.886 1.00 0.00 N ATOM 783 CE2 TRP A 45 6.728 9.082 12.904 1.00 0.00 C ATOM 784 CE3 TRP A 45 5.506 7.028 13.204 1.00 0.00 C ATOM 785 CZ2 TRP A 45 7.123 9.098 14.241 1.00 0.00 C ATOM 786 CZ3 TRP A 45 5.895 7.039 14.530 1.00 0.00 C ATOM 787 CH2 TRP A 45 6.697 8.071 15.038 1.00 0.00 C ATOM 0 H TRP A 45 7.039 8.362 8.618 1.00 0.00 H new ATOM 0 HA TRP A 45 6.000 5.733 9.520 1.00 0.00 H new ATOM 0 HB2 TRP A 45 4.294 8.194 9.423 1.00 0.00 H new ATOM 0 HB3 TRP A 45 4.262 6.865 10.564 1.00 0.00 H new ATOM 0 HD1 TRP A 45 6.426 10.009 9.783 1.00 0.00 H new ATOM 0 HE1 TRP A 45 7.571 10.802 11.965 1.00 0.00 H new ATOM 0 HE3 TRP A 45 4.886 6.231 12.820 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 7.742 9.891 14.633 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 5.577 6.241 15.185 1.00 0.00 H new ATOM 0 HH2 TRP A 45 6.984 8.055 16.079 1.00 0.00 H new ATOM 798 N ILE A 46 3.890 6.066 7.785 1.00 0.00 N ATOM 799 CA ILE A 46 3.127 5.825 6.567 1.00 0.00 C ATOM 800 C ILE A 46 1.744 6.461 6.639 1.00 0.00 C ATOM 801 O ILE A 46 1.153 6.578 7.713 1.00 0.00 O ATOM 802 CB ILE A 46 2.997 4.312 6.270 1.00 0.00 C ATOM 803 CG1 ILE A 46 1.854 4.034 5.288 1.00 0.00 C ATOM 804 CG2 ILE A 46 2.789 3.531 7.557 1.00 0.00 C ATOM 805 CD1 ILE A 46 1.947 2.676 4.629 1.00 0.00 C ATOM 0 H ILE A 46 3.386 5.859 8.647 1.00 0.00 H new ATOM 0 HA ILE A 46 3.679 6.291 5.751 1.00 0.00 H new ATOM 0 HB ILE A 46 3.927 3.983 5.807 1.00 0.00 H new ATOM 0 HG12 ILE A 46 0.904 4.109 5.817 1.00 0.00 H new ATOM 0 HG13 ILE A 46 1.851 4.805 4.517 1.00 0.00 H new ATOM 0 HG21 ILE A 46 2.700 2.469 7.328 1.00 0.00 H new ATOM 0 HG22 ILE A 46 3.640 3.689 8.220 1.00 0.00 H new ATOM 0 HG23 ILE A 46 1.878 3.874 8.048 1.00 0.00 H new ATOM 0 HD11 ILE A 46 1.107 2.544 3.947 1.00 0.00 H new ATOM 0 HD12 ILE A 46 2.882 2.605 4.072 1.00 0.00 H new ATOM 0 HD13 ILE A 46 1.919 1.898 5.392 1.00 0.00 H new ATOM 817 N ALA A 47 1.241 6.879 5.481 1.00 0.00 N ATOM 818 CA ALA A 47 -0.068 7.513 5.398 1.00 0.00 C ATOM 819 C ALA A 47 -0.999 6.772 4.438 1.00 0.00 C ATOM 820 O ALA A 47 -2.217 6.921 4.517 1.00 0.00 O ATOM 821 CB ALA A 47 0.081 8.965 4.970 1.00 0.00 C ATOM 0 H ALA A 47 1.722 6.789 4.586 1.00 0.00 H new ATOM 0 HA ALA A 47 -0.519 7.473 6.390 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -0.903 9.430 4.911 1.00 0.00 H new ATOM 0 HB2 ALA A 47 0.691 9.498 5.699 1.00 0.00 H new ATOM 0 HB3 ALA A 47 0.562 9.009 3.993 1.00 0.00 H new ATOM 827 N ARG A 48 -0.432 5.978 3.529 1.00 0.00 N ATOM 828 CA ARG A 48 -1.245 5.236 2.570 1.00 0.00 C ATOM 829 C ARG A 48 -0.855 3.763 2.535 1.00 0.00 C ATOM 830 O ARG A 48 0.329 3.422 2.565 1.00 0.00 O ATOM 831 CB ARG A 48 -1.109 5.852 1.176 1.00 0.00 C ATOM 832 CG ARG A 48 -2.382 6.520 0.687 1.00 0.00 C ATOM 833 CD ARG A 48 -2.468 6.514 -0.831 1.00 0.00 C ATOM 834 NE ARG A 48 -3.515 7.408 -1.320 1.00 0.00 N ATOM 835 CZ ARG A 48 -3.546 7.913 -2.551 1.00 0.00 C ATOM 836 NH1 ARG A 48 -2.592 7.622 -3.423 1.00 0.00 N ATOM 837 NH2 ARG A 48 -4.538 8.714 -2.909 1.00 0.00 N ATOM 0 H ARG A 48 0.574 5.834 3.438 1.00 0.00 H new ATOM 0 HA ARG A 48 -2.285 5.300 2.890 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -0.303 6.586 1.188 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -0.821 5.074 0.469 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -3.247 6.004 1.103 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -2.418 7.547 1.050 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -1.508 6.815 -1.250 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -2.664 5.500 -1.180 1.00 0.00 H new ATOM 0 HE ARG A 48 -4.268 7.660 -0.679 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -1.825 7.006 -3.153 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -2.624 8.014 -4.364 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -5.275 8.942 -2.242 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -4.565 9.103 -3.852 1.00 0.00 H new ATOM 851 N GLN A 49 -1.859 2.891 2.469 1.00 0.00 N ATOM 852 CA GLN A 49 -1.617 1.454 2.429 1.00 0.00 C ATOM 853 C GLN A 49 -2.691 0.743 1.608 1.00 0.00 C ATOM 854 O GLN A 49 -3.880 0.817 1.920 1.00 0.00 O ATOM 855 CB GLN A 49 -1.570 0.883 3.849 1.00 0.00 C ATOM 856 CG GLN A 49 -1.442 -0.632 3.899 1.00 0.00 C ATOM 857 CD GLN A 49 -0.523 -1.103 5.009 1.00 0.00 C ATOM 858 OE1 GLN A 49 0.662 -0.770 5.032 1.00 0.00 O ATOM 859 NE2 GLN A 49 -1.066 -1.883 5.936 1.00 0.00 N ATOM 0 H GLN A 49 -2.844 3.155 2.442 1.00 0.00 H new ATOM 0 HA GLN A 49 -0.653 1.285 1.949 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -0.729 1.327 4.381 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -2.475 1.179 4.380 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -2.429 -1.072 4.039 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -1.065 -0.993 2.942 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -2.053 -2.134 5.877 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -0.496 -2.231 6.707 1.00 0.00 H new ATOM 868 N MET A 50 -2.257 0.050 0.559 1.00 0.00 N ATOM 869 CA MET A 50 -3.170 -0.679 -0.312 1.00 0.00 C ATOM 870 C MET A 50 -2.820 -2.163 -0.339 1.00 0.00 C ATOM 871 O MET A 50 -1.766 -2.554 -0.842 1.00 0.00 O ATOM 872 CB MET A 50 -3.121 -0.108 -1.730 1.00 0.00 C ATOM 873 CG MET A 50 -4.317 -0.492 -2.586 1.00 0.00 C ATOM 874 SD MET A 50 -3.876 -0.768 -4.312 1.00 0.00 S ATOM 875 CE MET A 50 -2.952 0.725 -4.671 1.00 0.00 C ATOM 0 H MET A 50 -1.275 -0.021 0.292 1.00 0.00 H new ATOM 0 HA MET A 50 -4.180 -0.566 0.083 1.00 0.00 H new ATOM 0 HB2 MET A 50 -3.061 0.979 -1.672 1.00 0.00 H new ATOM 0 HB3 MET A 50 -2.210 -0.452 -2.219 1.00 0.00 H new ATOM 0 HG2 MET A 50 -4.772 -1.396 -2.182 1.00 0.00 H new ATOM 0 HG3 MET A 50 -5.068 0.296 -2.528 1.00 0.00 H new ATOM 0 HE1 MET A 50 -2.061 0.472 -5.246 1.00 0.00 H new ATOM 0 HE2 MET A 50 -3.575 1.408 -5.249 1.00 0.00 H new ATOM 0 HE3 MET A 50 -2.658 1.204 -3.737 1.00 0.00 H new ATOM 885 N GLU A 51 -3.706 -2.987 0.210 1.00 0.00 N ATOM 886 CA GLU A 51 -3.484 -4.428 0.252 1.00 0.00 C ATOM 887 C GLU A 51 -4.143 -5.122 -0.939 1.00 0.00 C ATOM 888 O GLU A 51 -5.321 -4.904 -1.224 1.00 0.00 O ATOM 889 CB GLU A 51 -4.021 -5.011 1.562 1.00 0.00 C ATOM 890 CG GLU A 51 -2.932 -5.371 2.559 1.00 0.00 C ATOM 891 CD GLU A 51 -3.489 -5.831 3.891 1.00 0.00 C ATOM 892 OE1 GLU A 51 -4.640 -6.313 3.918 1.00 0.00 O ATOM 893 OE2 GLU A 51 -2.774 -5.707 4.909 1.00 0.00 O ATOM 0 H GLU A 51 -4.583 -2.682 0.632 1.00 0.00 H new ATOM 0 HA GLU A 51 -2.410 -4.604 0.198 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -4.698 -4.290 2.020 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -4.608 -5.902 1.340 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -2.307 -6.159 2.139 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -2.289 -4.505 2.718 1.00 0.00 H new ATOM 900 N LEU A 52 -3.373 -5.958 -1.629 1.00 0.00 N ATOM 901 CA LEU A 52 -3.877 -6.687 -2.787 1.00 0.00 C ATOM 902 C LEU A 52 -3.573 -8.178 -2.665 1.00 0.00 C ATOM 903 O LEU A 52 -2.417 -8.592 -2.726 1.00 0.00 O ATOM 904 CB LEU A 52 -3.254 -6.141 -4.075 1.00 0.00 C ATOM 905 CG LEU A 52 -3.475 -4.647 -4.324 1.00 0.00 C ATOM 906 CD1 LEU A 52 -2.333 -4.068 -5.148 1.00 0.00 C ATOM 907 CD2 LEU A 52 -4.811 -4.414 -5.018 1.00 0.00 C ATOM 0 H LEU A 52 -2.396 -6.147 -1.405 1.00 0.00 H new ATOM 0 HA LEU A 52 -4.958 -6.550 -2.824 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -2.182 -6.334 -4.051 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -3.659 -6.698 -4.920 1.00 0.00 H new ATOM 0 HG LEU A 52 -3.495 -4.136 -3.361 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -2.507 -3.005 -5.315 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -1.393 -4.202 -4.612 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -2.280 -4.582 -6.108 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -4.952 -3.346 -5.187 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -4.821 -4.937 -5.974 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.618 -4.791 -4.390 1.00 0.00 H new ATOM 919 N HIS A 53 -4.619 -8.982 -2.496 1.00 0.00 N ATOM 920 CA HIS A 53 -4.457 -10.427 -2.370 1.00 0.00 C ATOM 921 C HIS A 53 -5.375 -11.163 -3.347 1.00 0.00 C ATOM 922 O HIS A 53 -6.573 -10.884 -3.410 1.00 0.00 O ATOM 923 CB HIS A 53 -4.759 -10.874 -0.938 1.00 0.00 C ATOM 924 CG HIS A 53 -4.049 -10.067 0.104 1.00 0.00 C ATOM 925 ND1 HIS A 53 -2.789 -10.380 0.568 1.00 0.00 N ATOM 926 CD2 HIS A 53 -4.429 -8.952 0.773 1.00 0.00 C ATOM 927 CE1 HIS A 53 -2.425 -9.493 1.478 1.00 0.00 C ATOM 928 NE2 HIS A 53 -3.402 -8.617 1.621 1.00 0.00 N ATOM 0 H HIS A 53 -5.585 -8.659 -2.443 1.00 0.00 H new ATOM 0 HA HIS A 53 -3.423 -10.674 -2.610 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -5.833 -10.810 -0.765 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -4.480 -11.922 -0.827 1.00 0.00 H new ATOM 0 HD1 HIS A 53 -2.226 -11.172 0.258 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -5.365 -8.425 0.660 1.00 0.00 H new ATOM 0 HE1 HIS A 53 -1.487 -9.486 2.014 1.00 0.00 H new ATOM 937 N PRO A 54 -4.828 -12.116 -4.123 1.00 0.00 N ATOM 938 CA PRO A 54 -5.610 -12.885 -5.096 1.00 0.00 C ATOM 939 C PRO A 54 -6.921 -13.405 -4.513 1.00 0.00 C ATOM 940 O PRO A 54 -7.892 -13.616 -5.239 1.00 0.00 O ATOM 941 CB PRO A 54 -4.680 -14.046 -5.447 1.00 0.00 C ATOM 942 CG PRO A 54 -3.311 -13.497 -5.256 1.00 0.00 C ATOM 943 CD PRO A 54 -3.408 -12.520 -4.115 1.00 0.00 C ATOM 0 HA PRO A 54 -5.907 -12.280 -5.953 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -4.857 -14.906 -4.800 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -4.834 -14.382 -6.473 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -2.601 -14.292 -5.029 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -2.959 -13.004 -6.162 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -3.128 -12.981 -3.168 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -2.747 -11.666 -4.262 1.00 0.00 H new ATOM 951 N ASP A 55 -6.941 -13.608 -3.200 1.00 0.00 N ATOM 952 CA ASP A 55 -8.134 -14.103 -2.524 1.00 0.00 C ATOM 953 C ASP A 55 -8.960 -12.950 -1.961 1.00 0.00 C ATOM 954 O ASP A 55 -10.188 -13.014 -1.925 1.00 0.00 O ATOM 955 CB ASP A 55 -7.747 -15.066 -1.401 1.00 0.00 C ATOM 956 CG ASP A 55 -6.672 -14.498 -0.496 1.00 0.00 C ATOM 957 OD1 ASP A 55 -6.988 -13.598 0.310 1.00 0.00 O ATOM 958 OD2 ASP A 55 -5.513 -14.955 -0.593 1.00 0.00 O ATOM 0 H ASP A 55 -6.146 -13.438 -2.584 1.00 0.00 H new ATOM 0 HA ASP A 55 -8.741 -14.636 -3.256 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -8.630 -15.301 -0.808 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -7.396 -16.002 -1.834 1.00 0.00 H new ATOM 963 N LYS A 56 -8.278 -11.896 -1.523 1.00 0.00 N ATOM 964 CA LYS A 56 -8.951 -10.733 -0.962 1.00 0.00 C ATOM 965 C LYS A 56 -8.797 -9.518 -1.877 1.00 0.00 C ATOM 966 O LYS A 56 -7.680 -9.080 -2.158 1.00 0.00 O ATOM 967 CB LYS A 56 -8.395 -10.418 0.425 1.00 0.00 C ATOM 968 CG LYS A 56 -9.084 -11.190 1.537 1.00 0.00 C ATOM 969 CD LYS A 56 -8.144 -11.454 2.700 1.00 0.00 C ATOM 970 CE LYS A 56 -8.543 -10.662 3.934 1.00 0.00 C ATOM 971 NZ LYS A 56 -7.357 -10.168 4.687 1.00 0.00 N ATOM 0 H LYS A 56 -7.261 -11.825 -1.546 1.00 0.00 H new ATOM 0 HA LYS A 56 -10.013 -10.965 -0.875 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -7.329 -10.644 0.442 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -8.497 -9.350 0.616 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -9.950 -10.628 1.888 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -9.456 -12.137 1.147 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -8.145 -12.518 2.934 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -7.126 -11.192 2.412 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -9.162 -9.816 3.637 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -9.151 -11.289 4.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -7.673 -9.633 5.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -6.779 -10.976 4.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -6.789 -9.549 4.074 1.00 0.00 H new ATOM 985 N PRO A 57 -9.923 -8.951 -2.356 1.00 0.00 N ATOM 986 CA PRO A 57 -9.904 -7.783 -3.242 1.00 0.00 C ATOM 987 C PRO A 57 -8.982 -6.678 -2.735 1.00 0.00 C ATOM 988 O PRO A 57 -8.433 -6.773 -1.636 1.00 0.00 O ATOM 989 CB PRO A 57 -11.358 -7.311 -3.230 1.00 0.00 C ATOM 990 CG PRO A 57 -12.149 -8.546 -2.970 1.00 0.00 C ATOM 991 CD PRO A 57 -11.299 -9.405 -2.072 1.00 0.00 C ATOM 0 HA PRO A 57 -9.526 -8.031 -4.234 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -11.526 -6.562 -2.456 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -11.635 -6.855 -4.180 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -13.100 -8.307 -2.494 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -12.380 -9.064 -3.901 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -11.558 -9.266 -1.022 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -11.425 -10.465 -2.294 1.00 0.00 H new ATOM 999 N PRO A 58 -8.795 -5.613 -3.532 1.00 0.00 N ATOM 1000 CA PRO A 58 -7.931 -4.488 -3.161 1.00 0.00 C ATOM 1001 C PRO A 58 -8.332 -3.864 -1.829 1.00 0.00 C ATOM 1002 O PRO A 58 -9.077 -2.884 -1.791 1.00 0.00 O ATOM 1003 CB PRO A 58 -8.132 -3.486 -4.301 1.00 0.00 C ATOM 1004 CG PRO A 58 -8.601 -4.304 -5.452 1.00 0.00 C ATOM 1005 CD PRO A 58 -9.409 -5.424 -4.859 1.00 0.00 C ATOM 0 HA PRO A 58 -6.895 -4.800 -3.030 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -8.864 -2.725 -4.033 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -7.204 -2.966 -4.538 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -9.204 -3.707 -6.136 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -7.759 -4.691 -6.025 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -10.464 -5.162 -4.781 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -9.348 -6.329 -5.464 1.00 0.00 H new ATOM 1013 N ILE A 59 -7.832 -4.431 -0.736 1.00 0.00 N ATOM 1014 CA ILE A 59 -8.138 -3.924 0.593 1.00 0.00 C ATOM 1015 C ILE A 59 -7.582 -2.519 0.775 1.00 0.00 C ATOM 1016 O ILE A 59 -6.431 -2.337 1.175 1.00 0.00 O ATOM 1017 CB ILE A 59 -7.577 -4.845 1.694 1.00 0.00 C ATOM 1018 CG1 ILE A 59 -8.185 -6.239 1.563 1.00 0.00 C ATOM 1019 CG2 ILE A 59 -7.852 -4.270 3.078 1.00 0.00 C ATOM 1020 CD1 ILE A 59 -7.578 -7.248 2.510 1.00 0.00 C ATOM 0 H ILE A 59 -7.213 -5.242 -0.746 1.00 0.00 H new ATOM 0 HA ILE A 59 -9.224 -3.898 0.685 1.00 0.00 H new ATOM 0 HB ILE A 59 -6.496 -4.916 1.570 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -9.258 -6.178 1.747 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -8.056 -6.589 0.539 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -7.446 -4.939 3.837 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -7.379 -3.292 3.166 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -8.928 -4.168 3.222 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -8.056 -8.217 2.364 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -6.510 -7.336 2.312 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -7.730 -6.919 3.538 1.00 0.00 H new ATOM 1032 N LEU A 60 -8.411 -1.530 0.475 1.00 0.00 N ATOM 1033 CA LEU A 60 -8.016 -0.134 0.598 1.00 0.00 C ATOM 1034 C LEU A 60 -7.743 0.223 2.055 1.00 0.00 C ATOM 1035 O LEU A 60 -8.528 -0.108 2.944 1.00 0.00 O ATOM 1036 CB LEU A 60 -9.110 0.777 0.023 1.00 0.00 C ATOM 1037 CG LEU A 60 -8.810 1.385 -1.353 1.00 0.00 C ATOM 1038 CD1 LEU A 60 -7.997 0.428 -2.216 1.00 0.00 C ATOM 1039 CD2 LEU A 60 -10.106 1.758 -2.055 1.00 0.00 C ATOM 0 H LEU A 60 -9.365 -1.669 0.143 1.00 0.00 H new ATOM 0 HA LEU A 60 -7.097 0.016 0.031 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -10.035 0.205 -0.046 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -9.289 1.589 0.728 1.00 0.00 H new ATOM 0 HG LEU A 60 -8.215 2.286 -1.201 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -7.801 0.888 -3.184 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -7.051 0.206 -1.722 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -8.556 -0.496 -2.360 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -9.880 2.189 -3.031 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -10.719 0.866 -2.185 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -10.649 2.487 -1.453 1.00 0.00 H new ATOM 1051 N LEU A 61 -6.620 0.890 2.295 1.00 0.00 N ATOM 1052 CA LEU A 61 -6.239 1.281 3.645 1.00 0.00 C ATOM 1053 C LEU A 61 -5.616 2.674 3.660 1.00 0.00 C ATOM 1054 O LEU A 61 -4.989 3.097 2.688 1.00 0.00 O ATOM 1055 CB LEU A 61 -5.261 0.260 4.226 1.00 0.00 C ATOM 1056 CG LEU A 61 -5.659 -0.317 5.583 1.00 0.00 C ATOM 1057 CD1 LEU A 61 -5.125 -1.735 5.739 1.00 0.00 C ATOM 1058 CD2 LEU A 61 -5.149 0.575 6.704 1.00 0.00 C ATOM 0 H LEU A 61 -5.958 1.171 1.572 1.00 0.00 H new ATOM 0 HA LEU A 61 -7.139 1.308 4.260 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.153 -0.561 3.517 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -4.282 0.730 4.321 1.00 0.00 H new ATOM 0 HG LEU A 61 -6.747 -0.355 5.639 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -5.419 -2.129 6.712 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -5.536 -2.367 4.952 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -4.038 -1.724 5.665 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -5.439 0.152 7.666 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -4.062 0.642 6.650 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -5.579 1.571 6.601 1.00 0.00 H new ATOM 1070 N VAL A 62 -5.790 3.382 4.774 1.00 0.00 N ATOM 1071 CA VAL A 62 -5.244 4.725 4.918 1.00 0.00 C ATOM 1072 C VAL A 62 -4.988 5.060 6.384 1.00 0.00 C ATOM 1073 O VAL A 62 -5.692 4.582 7.273 1.00 0.00 O ATOM 1074 CB VAL A 62 -6.191 5.784 4.315 1.00 0.00 C ATOM 1075 CG1 VAL A 62 -7.499 5.844 5.089 1.00 0.00 C ATOM 1076 CG2 VAL A 62 -5.516 7.147 4.286 1.00 0.00 C ATOM 0 H VAL A 62 -6.305 3.046 5.588 1.00 0.00 H new ATOM 0 HA VAL A 62 -4.299 4.743 4.375 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.421 5.494 3.290 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -8.150 6.597 4.645 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -7.990 4.872 5.050 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -7.296 6.106 6.127 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -6.198 7.882 3.858 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -5.253 7.444 5.301 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -4.613 7.093 3.678 1.00 0.00 H new ATOM 1086 N ALA A 63 -3.975 5.886 6.631 1.00 0.00 N ATOM 1087 CA ALA A 63 -3.630 6.283 7.990 1.00 0.00 C ATOM 1088 C ALA A 63 -4.795 7.001 8.661 1.00 0.00 C ATOM 1089 O ALA A 63 -5.758 7.392 8.004 1.00 0.00 O ATOM 1090 CB ALA A 63 -2.393 7.171 7.981 1.00 0.00 C ATOM 0 H ALA A 63 -3.381 6.292 5.908 1.00 0.00 H new ATOM 0 HA ALA A 63 -3.413 5.382 8.564 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -2.146 7.461 9.002 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -1.556 6.625 7.546 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -2.591 8.064 7.388 1.00 0.00 H new ATOM 1096 N GLY A 64 -4.700 7.170 9.976 1.00 0.00 N ATOM 1097 CA GLY A 64 -5.756 7.840 10.714 1.00 0.00 C ATOM 1098 C GLY A 64 -7.036 7.029 10.755 1.00 0.00 C ATOM 1099 O GLY A 64 -7.386 6.462 11.789 1.00 0.00 O ATOM 0 H GLY A 64 -3.913 6.856 10.543 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -5.418 8.032 11.732 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -5.957 8.809 10.256 1.00 0.00 H new ATOM 1103 N LYS A 65 -7.736 6.974 9.626 1.00 0.00 N ATOM 1104 CA LYS A 65 -8.985 6.225 9.536 1.00 0.00 C ATOM 1105 C LYS A 65 -8.760 4.755 9.871 1.00 0.00 C ATOM 1106 O LYS A 65 -9.380 4.214 10.788 1.00 0.00 O ATOM 1107 CB LYS A 65 -9.580 6.357 8.133 1.00 0.00 C ATOM 1108 CG LYS A 65 -11.096 6.255 8.103 1.00 0.00 C ATOM 1109 CD LYS A 65 -11.573 4.919 8.651 1.00 0.00 C ATOM 1110 CE LYS A 65 -13.077 4.758 8.495 1.00 0.00 C ATOM 1111 NZ LYS A 65 -13.824 5.442 9.586 1.00 0.00 N ATOM 0 H LYS A 65 -7.460 7.439 8.761 1.00 0.00 H new ATOM 0 HA LYS A 65 -9.685 6.641 10.260 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -9.280 7.315 7.709 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -9.159 5.580 7.494 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -11.528 7.066 8.689 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -11.450 6.378 7.080 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -11.063 4.108 8.131 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -11.305 4.840 9.705 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -13.388 5.164 7.532 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -13.330 3.698 8.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -14.846 5.309 9.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -13.547 5.038 10.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -13.602 6.458 9.574 1.00 0.00 H new ATOM 1125 N ASP A 66 -7.867 4.115 9.124 1.00 0.00 N ATOM 1126 CA ASP A 66 -7.553 2.707 9.341 1.00 0.00 C ATOM 1127 C ASP A 66 -6.157 2.553 9.937 1.00 0.00 C ATOM 1128 O ASP A 66 -5.352 1.750 9.463 1.00 0.00 O ATOM 1129 CB ASP A 66 -7.655 1.933 8.026 1.00 0.00 C ATOM 1130 CG ASP A 66 -9.091 1.649 7.628 1.00 0.00 C ATOM 1131 OD1 ASP A 66 -10.003 1.972 8.421 1.00 0.00 O ATOM 1132 OD2 ASP A 66 -9.305 1.105 6.525 1.00 0.00 O ATOM 0 H ASP A 66 -7.347 4.549 8.362 1.00 0.00 H new ATOM 0 HA ASP A 66 -8.276 2.298 10.047 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -7.168 2.503 7.234 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -7.114 0.991 8.120 1.00 0.00 H new ATOM 1137 N ASP A 67 -5.879 3.329 10.978 1.00 0.00 N ATOM 1138 CA ASP A 67 -4.582 3.286 11.644 1.00 0.00 C ATOM 1139 C ASP A 67 -4.355 1.944 12.337 1.00 0.00 C ATOM 1140 O ASP A 67 -3.222 1.591 12.665 1.00 0.00 O ATOM 1141 CB ASP A 67 -4.473 4.421 12.664 1.00 0.00 C ATOM 1142 CG ASP A 67 -3.090 5.043 12.694 1.00 0.00 C ATOM 1143 OD1 ASP A 67 -2.832 5.958 11.885 1.00 0.00 O ATOM 1144 OD2 ASP A 67 -2.265 4.611 13.526 1.00 0.00 O ATOM 0 H ASP A 67 -6.536 3.997 11.380 1.00 0.00 H new ATOM 0 HA ASP A 67 -3.813 3.409 10.881 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -5.209 5.190 12.428 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -4.718 4.039 13.655 1.00 0.00 H new ATOM 1149 N MET A 68 -5.433 1.199 12.558 1.00 0.00 N ATOM 1150 CA MET A 68 -5.341 -0.101 13.212 1.00 0.00 C ATOM 1151 C MET A 68 -4.943 -1.177 12.210 1.00 0.00 C ATOM 1152 O MET A 68 -4.253 -2.137 12.555 1.00 0.00 O ATOM 1153 CB MET A 68 -6.673 -0.464 13.870 1.00 0.00 C ATOM 1154 CG MET A 68 -6.924 0.268 15.178 1.00 0.00 C ATOM 1155 SD MET A 68 -5.802 -0.248 16.490 1.00 0.00 S ATOM 1156 CE MET A 68 -6.084 1.038 17.705 1.00 0.00 C ATOM 0 H MET A 68 -6.379 1.473 12.294 1.00 0.00 H new ATOM 0 HA MET A 68 -4.573 -0.041 13.983 1.00 0.00 H new ATOM 0 HB2 MET A 68 -7.484 -0.241 13.177 1.00 0.00 H new ATOM 0 HB3 MET A 68 -6.697 -1.538 14.054 1.00 0.00 H new ATOM 0 HG2 MET A 68 -6.818 1.341 15.016 1.00 0.00 H new ATOM 0 HG3 MET A 68 -7.952 0.094 15.495 1.00 0.00 H new ATOM 0 HE1 MET A 68 -5.458 0.857 18.579 1.00 0.00 H new ATOM 0 HE2 MET A 68 -5.833 2.007 17.274 1.00 0.00 H new ATOM 0 HE3 MET A 68 -7.133 1.034 18.003 1.00 0.00 H new ATOM 1166 N GLU A 69 -5.380 -1.009 10.966 1.00 0.00 N ATOM 1167 CA GLU A 69 -5.067 -1.964 9.913 1.00 0.00 C ATOM 1168 C GLU A 69 -3.760 -1.595 9.218 1.00 0.00 C ATOM 1169 O GLU A 69 -2.944 -2.460 8.904 1.00 0.00 O ATOM 1170 CB GLU A 69 -6.205 -2.023 8.892 1.00 0.00 C ATOM 1171 CG GLU A 69 -7.397 -2.845 9.353 1.00 0.00 C ATOM 1172 CD GLU A 69 -8.305 -2.079 10.295 1.00 0.00 C ATOM 1173 OE1 GLU A 69 -7.843 -1.708 11.395 1.00 0.00 O ATOM 1174 OE2 GLU A 69 -9.478 -1.850 9.933 1.00 0.00 O ATOM 0 H GLU A 69 -5.952 -0.220 10.664 1.00 0.00 H new ATOM 0 HA GLU A 69 -4.950 -2.947 10.370 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -6.538 -1.008 8.673 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -5.824 -2.442 7.961 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -7.970 -3.166 8.483 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -7.041 -3.747 9.851 1.00 0.00 H new ATOM 1181 N MET A 70 -3.569 -0.298 8.982 1.00 0.00 N ATOM 1182 CA MET A 70 -2.362 0.197 8.326 1.00 0.00 C ATOM 1183 C MET A 70 -1.107 -0.301 9.035 1.00 0.00 C ATOM 1184 O MET A 70 -1.165 -0.745 10.182 1.00 0.00 O ATOM 1185 CB MET A 70 -2.371 1.727 8.298 1.00 0.00 C ATOM 1186 CG MET A 70 -1.151 2.335 7.628 1.00 0.00 C ATOM 1187 SD MET A 70 -1.422 4.039 7.108 1.00 0.00 S ATOM 1188 CE MET A 70 -2.138 3.785 5.488 1.00 0.00 C ATOM 0 H MET A 70 -4.237 0.430 9.236 1.00 0.00 H new ATOM 0 HA MET A 70 -2.351 -0.184 7.305 1.00 0.00 H new ATOM 0 HB2 MET A 70 -3.267 2.066 7.778 1.00 0.00 H new ATOM 0 HB3 MET A 70 -2.436 2.099 9.320 1.00 0.00 H new ATOM 0 HG2 MET A 70 -0.307 2.299 8.317 1.00 0.00 H new ATOM 0 HG3 MET A 70 -0.880 1.733 6.761 1.00 0.00 H new ATOM 0 HE1 MET A 70 -2.492 4.737 5.093 1.00 0.00 H new ATOM 0 HE2 MET A 70 -1.384 3.372 4.818 1.00 0.00 H new ATOM 0 HE3 MET A 70 -2.974 3.090 5.565 1.00 0.00 H new ATOM 1198 N CYS A 71 0.029 -0.226 8.345 1.00 0.00 N ATOM 1199 CA CYS A 71 1.300 -0.668 8.912 1.00 0.00 C ATOM 1200 C CYS A 71 1.522 -0.059 10.295 1.00 0.00 C ATOM 1201 O CYS A 71 1.595 1.161 10.441 1.00 0.00 O ATOM 1202 CB CYS A 71 2.457 -0.290 7.988 1.00 0.00 C ATOM 1203 SG CYS A 71 3.852 -1.435 8.056 1.00 0.00 S ATOM 0 H CYS A 71 0.095 0.136 7.394 1.00 0.00 H new ATOM 0 HA CYS A 71 1.263 -1.753 9.012 1.00 0.00 H new ATOM 0 HB2 CYS A 71 2.089 -0.241 6.963 1.00 0.00 H new ATOM 0 HB3 CYS A 71 2.806 0.709 8.249 1.00 0.00 H new ATOM 0 HG CYS A 71 3.785 -2.260 7.054 1.00 0.00 H new ATOM 1209 N GLU A 72 1.617 -0.914 11.308 1.00 0.00 N ATOM 1210 CA GLU A 72 1.820 -0.454 12.678 1.00 0.00 C ATOM 1211 C GLU A 72 3.295 -0.175 12.970 1.00 0.00 C ATOM 1212 O GLU A 72 3.649 0.207 14.085 1.00 0.00 O ATOM 1213 CB GLU A 72 1.282 -1.489 13.667 1.00 0.00 C ATOM 1214 CG GLU A 72 1.327 -1.027 15.116 1.00 0.00 C ATOM 1215 CD GLU A 72 2.266 -1.858 15.965 1.00 0.00 C ATOM 1216 OE1 GLU A 72 2.209 -3.102 15.870 1.00 0.00 O ATOM 1217 OE2 GLU A 72 3.058 -1.267 16.729 1.00 0.00 O ATOM 0 H GLU A 72 1.557 -1.927 11.207 1.00 0.00 H new ATOM 0 HA GLU A 72 1.273 0.481 12.795 1.00 0.00 H new ATOM 0 HB2 GLU A 72 0.252 -1.731 13.403 1.00 0.00 H new ATOM 0 HB3 GLU A 72 1.860 -2.408 13.569 1.00 0.00 H new ATOM 0 HG2 GLU A 72 1.640 0.017 15.151 1.00 0.00 H new ATOM 0 HG3 GLU A 72 0.324 -1.073 15.539 1.00 0.00 H new ATOM 1224 N LYS A 73 4.154 -0.365 11.970 1.00 0.00 N ATOM 1225 CA LYS A 73 5.584 -0.127 12.142 1.00 0.00 C ATOM 1226 C LYS A 73 6.087 0.923 11.153 1.00 0.00 C ATOM 1227 O LYS A 73 5.409 1.246 10.178 1.00 0.00 O ATOM 1228 CB LYS A 73 6.379 -1.427 11.975 1.00 0.00 C ATOM 1229 CG LYS A 73 5.715 -2.447 11.066 1.00 0.00 C ATOM 1230 CD LYS A 73 4.719 -3.305 11.829 1.00 0.00 C ATOM 1231 CE LYS A 73 4.782 -4.758 11.386 1.00 0.00 C ATOM 1232 NZ LYS A 73 4.077 -5.660 12.336 1.00 0.00 N ATOM 0 H LYS A 73 3.886 -0.681 11.038 1.00 0.00 H new ATOM 0 HA LYS A 73 5.736 0.248 13.154 1.00 0.00 H new ATOM 0 HB2 LYS A 73 7.365 -1.189 11.577 1.00 0.00 H new ATOM 0 HB3 LYS A 73 6.532 -1.876 12.957 1.00 0.00 H new ATOM 0 HG2 LYS A 73 5.205 -1.933 10.251 1.00 0.00 H new ATOM 0 HG3 LYS A 73 6.476 -3.084 10.615 1.00 0.00 H new ATOM 0 HD2 LYS A 73 4.924 -3.240 12.897 1.00 0.00 H new ATOM 0 HD3 LYS A 73 3.711 -2.920 11.674 1.00 0.00 H new ATOM 0 HE2 LYS A 73 4.337 -4.855 10.396 1.00 0.00 H new ATOM 0 HE3 LYS A 73 5.824 -5.066 11.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 4.143 -6.641 11.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 4.517 -5.587 13.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 3.077 -5.383 12.400 1.00 0.00 H new ATOM 1246 N ASN A 74 7.278 1.451 11.417 1.00 0.00 N ATOM 1247 CA ASN A 74 7.876 2.467 10.556 1.00 0.00 C ATOM 1248 C ASN A 74 8.587 1.826 9.367 1.00 0.00 C ATOM 1249 O ASN A 74 8.602 0.603 9.222 1.00 0.00 O ATOM 1250 CB ASN A 74 8.858 3.331 11.353 1.00 0.00 C ATOM 1251 CG ASN A 74 8.169 4.148 12.432 1.00 0.00 C ATOM 1252 OD1 ASN A 74 7.614 3.595 13.382 1.00 0.00 O ATOM 1253 ND2 ASN A 74 8.199 5.471 12.293 1.00 0.00 N ATOM 0 H ASN A 74 7.849 1.192 12.221 1.00 0.00 H new ATOM 0 HA ASN A 74 7.075 3.101 10.176 1.00 0.00 H new ATOM 0 HB2 ASN A 74 9.611 2.690 11.812 1.00 0.00 H new ATOM 0 HB3 ASN A 74 9.382 4.002 10.672 1.00 0.00 H new ATOM 0 HD21 ASN A 74 7.751 6.067 12.989 1.00 0.00 H new ATOM 0 HD22 ASN A 74 8.670 5.889 11.491 1.00 0.00 H new ATOM 1260 N LEU A 75 9.172 2.663 8.517 1.00 0.00 N ATOM 1261 CA LEU A 75 9.882 2.189 7.332 1.00 0.00 C ATOM 1262 C LEU A 75 11.126 1.386 7.710 1.00 0.00 C ATOM 1263 O LEU A 75 11.503 0.444 7.012 1.00 0.00 O ATOM 1264 CB LEU A 75 10.278 3.375 6.450 1.00 0.00 C ATOM 1265 CG LEU A 75 9.434 3.554 5.189 1.00 0.00 C ATOM 1266 CD1 LEU A 75 9.835 4.824 4.453 1.00 0.00 C ATOM 1267 CD2 LEU A 75 9.572 2.342 4.279 1.00 0.00 C ATOM 0 H LEU A 75 9.169 3.677 8.626 1.00 0.00 H new ATOM 0 HA LEU A 75 9.210 1.532 6.780 1.00 0.00 H new ATOM 0 HB2 LEU A 75 10.214 4.287 7.044 1.00 0.00 H new ATOM 0 HB3 LEU A 75 11.321 3.258 6.157 1.00 0.00 H new ATOM 0 HG LEU A 75 8.389 3.645 5.485 1.00 0.00 H new ATOM 0 HD11 LEU A 75 9.223 4.934 3.558 1.00 0.00 H new ATOM 0 HD12 LEU A 75 9.684 5.685 5.104 1.00 0.00 H new ATOM 0 HD13 LEU A 75 10.886 4.764 4.169 1.00 0.00 H new ATOM 0 HD21 LEU A 75 8.964 2.487 3.386 1.00 0.00 H new ATOM 0 HD22 LEU A 75 10.616 2.220 3.991 1.00 0.00 H new ATOM 0 HD23 LEU A 75 9.234 1.450 4.807 1.00 0.00 H new ATOM 1279 N GLU A 76 11.767 1.781 8.802 1.00 0.00 N ATOM 1280 CA GLU A 76 12.984 1.114 9.264 1.00 0.00 C ATOM 1281 C GLU A 76 12.700 -0.282 9.815 1.00 0.00 C ATOM 1282 O GLU A 76 13.457 -1.220 9.566 1.00 0.00 O ATOM 1283 CB GLU A 76 13.682 1.957 10.338 1.00 0.00 C ATOM 1284 CG GLU A 76 13.516 3.456 10.150 1.00 0.00 C ATOM 1285 CD GLU A 76 14.815 4.216 10.336 1.00 0.00 C ATOM 1286 OE1 GLU A 76 15.743 4.011 9.525 1.00 0.00 O ATOM 1287 OE2 GLU A 76 14.904 5.016 11.291 1.00 0.00 O ATOM 0 H GLU A 76 11.467 2.561 9.387 1.00 0.00 H new ATOM 0 HA GLU A 76 13.638 1.007 8.398 1.00 0.00 H new ATOM 0 HB2 GLU A 76 13.290 1.678 11.316 1.00 0.00 H new ATOM 0 HB3 GLU A 76 14.745 1.717 10.340 1.00 0.00 H new ATOM 0 HG2 GLU A 76 13.125 3.652 9.152 1.00 0.00 H new ATOM 0 HG3 GLU A 76 12.777 3.828 10.860 1.00 0.00 H new ATOM 1294 N GLU A 77 11.624 -0.409 10.585 1.00 0.00 N ATOM 1295 CA GLU A 77 11.270 -1.693 11.191 1.00 0.00 C ATOM 1296 C GLU A 77 10.279 -2.484 10.337 1.00 0.00 C ATOM 1297 O GLU A 77 9.937 -3.618 10.673 1.00 0.00 O ATOM 1298 CB GLU A 77 10.689 -1.477 12.591 1.00 0.00 C ATOM 1299 CG GLU A 77 9.702 -0.325 12.675 1.00 0.00 C ATOM 1300 CD GLU A 77 8.782 -0.430 13.875 1.00 0.00 C ATOM 1301 OE1 GLU A 77 8.354 -1.558 14.198 1.00 0.00 O ATOM 1302 OE2 GLU A 77 8.491 0.615 14.493 1.00 0.00 O ATOM 0 H GLU A 77 10.984 0.354 10.805 1.00 0.00 H new ATOM 0 HA GLU A 77 12.187 -2.278 11.259 1.00 0.00 H new ATOM 0 HB2 GLU A 77 10.193 -2.392 12.913 1.00 0.00 H new ATOM 0 HB3 GLU A 77 11.506 -1.295 13.289 1.00 0.00 H new ATOM 0 HG2 GLU A 77 10.251 0.616 12.724 1.00 0.00 H new ATOM 0 HG3 GLU A 77 9.103 -0.298 11.765 1.00 0.00 H new ATOM 1309 N THR A 78 9.820 -1.898 9.236 1.00 0.00 N ATOM 1310 CA THR A 78 8.871 -2.580 8.360 1.00 0.00 C ATOM 1311 C THR A 78 9.523 -3.781 7.686 1.00 0.00 C ATOM 1312 O THR A 78 9.124 -4.925 7.912 1.00 0.00 O ATOM 1313 CB THR A 78 8.336 -1.619 7.301 1.00 0.00 C ATOM 1314 OG1 THR A 78 9.227 -0.538 7.108 1.00 0.00 O ATOM 1315 CG2 THR A 78 6.979 -1.045 7.646 1.00 0.00 C ATOM 0 H THR A 78 10.086 -0.962 8.930 1.00 0.00 H new ATOM 0 HA THR A 78 8.041 -2.932 8.972 1.00 0.00 H new ATOM 0 HB THR A 78 8.239 -2.214 6.393 1.00 0.00 H new ATOM 0 HG1 THR A 78 10.145 -0.877 7.053 1.00 0.00 H new ATOM 0 HG21 THR A 78 6.657 -0.371 6.853 1.00 0.00 H new ATOM 0 HG22 THR A 78 6.257 -1.855 7.749 1.00 0.00 H new ATOM 0 HG23 THR A 78 7.044 -0.495 8.585 1.00 0.00 H new ATOM 1323 N GLY A 79 10.525 -3.515 6.857 1.00 0.00 N ATOM 1324 CA GLY A 79 11.215 -4.585 6.160 1.00 0.00 C ATOM 1325 C GLY A 79 11.332 -4.334 4.667 1.00 0.00 C ATOM 1326 O GLY A 79 12.126 -4.983 3.986 1.00 0.00 O ATOM 0 H GLY A 79 10.873 -2.578 6.655 1.00 0.00 H new ATOM 0 HA2 GLY A 79 12.212 -4.704 6.583 1.00 0.00 H new ATOM 0 HA3 GLY A 79 10.684 -5.522 6.326 1.00 0.00 H new ATOM 1330 N LEU A 80 10.543 -3.393 4.154 1.00 0.00 N ATOM 1331 CA LEU A 80 10.571 -3.069 2.732 1.00 0.00 C ATOM 1332 C LEU A 80 11.891 -2.406 2.351 1.00 0.00 C ATOM 1333 O LEU A 80 12.500 -2.747 1.337 1.00 0.00 O ATOM 1334 CB LEU A 80 9.403 -2.147 2.374 1.00 0.00 C ATOM 1335 CG LEU A 80 8.047 -2.559 2.955 1.00 0.00 C ATOM 1336 CD1 LEU A 80 7.595 -1.568 4.018 1.00 0.00 C ATOM 1337 CD2 LEU A 80 7.003 -2.673 1.852 1.00 0.00 C ATOM 0 H LEU A 80 9.879 -2.844 4.700 1.00 0.00 H new ATOM 0 HA LEU A 80 10.476 -3.999 2.171 1.00 0.00 H new ATOM 0 HB2 LEU A 80 9.637 -1.140 2.718 1.00 0.00 H new ATOM 0 HB3 LEU A 80 9.317 -2.101 1.288 1.00 0.00 H new ATOM 0 HG LEU A 80 8.159 -3.537 3.424 1.00 0.00 H new ATOM 0 HD11 LEU A 80 6.630 -1.879 4.418 1.00 0.00 H new ATOM 0 HD12 LEU A 80 8.329 -1.538 4.823 1.00 0.00 H new ATOM 0 HD13 LEU A 80 7.502 -0.576 3.575 1.00 0.00 H new ATOM 0 HD21 LEU A 80 6.047 -2.967 2.285 1.00 0.00 H new ATOM 0 HD22 LEU A 80 6.895 -1.710 1.352 1.00 0.00 H new ATOM 0 HD23 LEU A 80 7.319 -3.424 1.128 1.00 0.00 H new ATOM 1349 N THR A 81 12.324 -1.454 3.171 1.00 0.00 N ATOM 1350 CA THR A 81 13.570 -0.739 2.921 1.00 0.00 C ATOM 1351 C THR A 81 14.771 -1.673 3.023 1.00 0.00 C ATOM 1352 O THR A 81 15.600 -1.734 2.116 1.00 0.00 O ATOM 1353 CB THR A 81 13.724 0.419 3.908 1.00 0.00 C ATOM 1354 OG1 THR A 81 13.648 -0.048 5.244 1.00 0.00 O ATOM 1355 CG2 THR A 81 12.675 1.494 3.735 1.00 0.00 C ATOM 0 H THR A 81 11.831 -1.160 4.014 1.00 0.00 H new ATOM 0 HA THR A 81 13.531 -0.342 1.907 1.00 0.00 H new ATOM 0 HB THR A 81 14.702 0.852 3.697 1.00 0.00 H new ATOM 0 HG1 THR A 81 12.816 0.269 5.654 1.00 0.00 H new ATOM 0 HG21 THR A 81 12.841 2.286 4.466 1.00 0.00 H new ATOM 0 HG22 THR A 81 12.741 1.909 2.729 1.00 0.00 H new ATOM 0 HG23 THR A 81 11.685 1.064 3.885 1.00 0.00 H new ATOM 1363 N ARG A 82 14.861 -2.398 4.134 1.00 0.00 N ATOM 1364 CA ARG A 82 15.967 -3.325 4.349 1.00 0.00 C ATOM 1365 C ARG A 82 15.973 -4.423 3.289 1.00 0.00 C ATOM 1366 O ARG A 82 17.023 -4.976 2.963 1.00 0.00 O ATOM 1367 CB ARG A 82 15.883 -3.941 5.745 1.00 0.00 C ATOM 1368 CG ARG A 82 14.609 -4.731 5.983 1.00 0.00 C ATOM 1369 CD ARG A 82 14.877 -6.228 6.023 1.00 0.00 C ATOM 1370 NE ARG A 82 14.104 -6.896 7.066 1.00 0.00 N ATOM 1371 CZ ARG A 82 12.861 -7.347 6.899 1.00 0.00 C ATOM 1372 NH1 ARG A 82 12.242 -7.199 5.735 1.00 0.00 N ATOM 1373 NH2 ARG A 82 12.236 -7.947 7.902 1.00 0.00 N ATOM 0 H ARG A 82 14.184 -2.362 4.896 1.00 0.00 H new ATOM 0 HA ARG A 82 16.898 -2.764 4.267 1.00 0.00 H new ATOM 0 HB2 ARG A 82 16.741 -4.596 5.897 1.00 0.00 H new ATOM 0 HB3 ARG A 82 15.953 -3.147 6.489 1.00 0.00 H new ATOM 0 HG2 ARG A 82 14.156 -4.417 6.923 1.00 0.00 H new ATOM 0 HG3 ARG A 82 13.891 -4.510 5.193 1.00 0.00 H new ATOM 0 HD2 ARG A 82 14.633 -6.666 5.055 1.00 0.00 H new ATOM 0 HD3 ARG A 82 15.940 -6.401 6.193 1.00 0.00 H new ATOM 0 HE ARG A 82 14.542 -7.025 7.978 1.00 0.00 H new ATOM 0 HH11 ARG A 82 12.717 -6.737 4.960 1.00 0.00 H new ATOM 0 HH12 ARG A 82 11.291 -7.547 5.615 1.00 0.00 H new ATOM 0 HH21 ARG A 82 12.706 -8.063 8.800 1.00 0.00 H new ATOM 0 HH22 ARG A 82 11.285 -8.293 7.776 1.00 0.00 H new ATOM 1387 N LYS A 83 14.796 -4.732 2.752 1.00 0.00 N ATOM 1388 CA LYS A 83 14.671 -5.762 1.726 1.00 0.00 C ATOM 1389 C LYS A 83 15.514 -5.415 0.502 1.00 0.00 C ATOM 1390 O LYS A 83 16.357 -4.520 0.551 1.00 0.00 O ATOM 1391 CB LYS A 83 13.205 -5.936 1.324 1.00 0.00 C ATOM 1392 CG LYS A 83 12.639 -7.307 1.665 1.00 0.00 C ATOM 1393 CD LYS A 83 11.297 -7.198 2.370 1.00 0.00 C ATOM 1394 CE LYS A 83 10.411 -8.396 2.065 1.00 0.00 C ATOM 1395 NZ LYS A 83 10.945 -9.649 2.667 1.00 0.00 N ATOM 0 H LYS A 83 13.917 -4.284 3.010 1.00 0.00 H new ATOM 0 HA LYS A 83 15.038 -6.701 2.140 1.00 0.00 H new ATOM 0 HB2 LYS A 83 12.607 -5.172 1.821 1.00 0.00 H new ATOM 0 HB3 LYS A 83 13.109 -5.769 0.251 1.00 0.00 H new ATOM 0 HG2 LYS A 83 12.525 -7.892 0.752 1.00 0.00 H new ATOM 0 HG3 LYS A 83 13.343 -7.844 2.301 1.00 0.00 H new ATOM 0 HD2 LYS A 83 11.455 -7.125 3.446 1.00 0.00 H new ATOM 0 HD3 LYS A 83 10.794 -6.283 2.058 1.00 0.00 H new ATOM 0 HE2 LYS A 83 9.406 -8.210 2.445 1.00 0.00 H new ATOM 0 HE3 LYS A 83 10.326 -8.519 0.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 10.313 -10.442 2.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 11.894 -9.840 2.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 11.002 -9.541 3.700 1.00 0.00 H new ATOM 1409 N ARG A 84 15.281 -6.129 -0.596 1.00 0.00 N ATOM 1410 CA ARG A 84 16.017 -5.894 -1.831 1.00 0.00 C ATOM 1411 C ARG A 84 15.307 -4.863 -2.703 1.00 0.00 C ATOM 1412 O ARG A 84 14.704 -5.203 -3.721 1.00 0.00 O ATOM 1413 CB ARG A 84 16.190 -7.205 -2.603 1.00 0.00 C ATOM 1414 CG ARG A 84 17.568 -7.829 -2.445 1.00 0.00 C ATOM 1415 CD ARG A 84 17.550 -8.972 -1.442 1.00 0.00 C ATOM 1416 NE ARG A 84 16.590 -10.010 -1.810 1.00 0.00 N ATOM 1417 CZ ARG A 84 16.761 -10.849 -2.829 1.00 0.00 C ATOM 1418 NH1 ARG A 84 17.852 -10.779 -3.580 1.00 0.00 N ATOM 1419 NH2 ARG A 84 15.839 -11.764 -3.095 1.00 0.00 N ATOM 0 H ARG A 84 14.588 -6.875 -0.654 1.00 0.00 H new ATOM 0 HA ARG A 84 17.000 -5.502 -1.570 1.00 0.00 H new ATOM 0 HB2 ARG A 84 15.437 -7.917 -2.265 1.00 0.00 H new ATOM 0 HB3 ARG A 84 16.003 -7.021 -3.661 1.00 0.00 H new ATOM 0 HG2 ARG A 84 17.915 -8.196 -3.411 1.00 0.00 H new ATOM 0 HG3 ARG A 84 18.278 -7.069 -2.119 1.00 0.00 H new ATOM 0 HD2 ARG A 84 18.546 -9.408 -1.372 1.00 0.00 H new ATOM 0 HD3 ARG A 84 17.302 -8.583 -0.454 1.00 0.00 H new ATOM 0 HE ARG A 84 15.739 -10.097 -1.254 1.00 0.00 H new ATOM 0 HH11 ARG A 84 18.566 -10.079 -3.378 1.00 0.00 H new ATOM 0 HH12 ARG A 84 17.977 -11.425 -4.359 1.00 0.00 H new ATOM 0 HH21 ARG A 84 14.999 -11.825 -2.519 1.00 0.00 H new ATOM 0 HH22 ARG A 84 15.969 -12.407 -3.876 1.00 0.00 H new ATOM 1433 N GLY A 85 15.383 -3.600 -2.295 1.00 0.00 N ATOM 1434 CA GLY A 85 14.745 -2.536 -3.048 1.00 0.00 C ATOM 1435 C GLY A 85 13.247 -2.728 -3.175 1.00 0.00 C ATOM 1436 O GLY A 85 12.730 -2.928 -4.273 1.00 0.00 O ATOM 0 H GLY A 85 15.875 -3.294 -1.456 1.00 0.00 H new ATOM 0 HA2 GLY A 85 14.945 -1.581 -2.561 1.00 0.00 H new ATOM 0 HA3 GLY A 85 15.187 -2.485 -4.043 1.00 0.00 H new ATOM 1440 N ALA A 86 12.547 -2.665 -2.046 1.00 0.00 N ATOM 1441 CA ALA A 86 11.098 -2.830 -2.036 1.00 0.00 C ATOM 1442 C ALA A 86 10.393 -1.626 -2.660 1.00 0.00 C ATOM 1443 O ALA A 86 9.204 -1.684 -2.972 1.00 0.00 O ATOM 1444 CB ALA A 86 10.603 -3.052 -0.614 1.00 0.00 C ATOM 0 H ALA A 86 12.960 -2.501 -1.128 1.00 0.00 H new ATOM 0 HA ALA A 86 10.858 -3.706 -2.638 1.00 0.00 H new ATOM 0 HB1 ALA A 86 9.520 -3.174 -0.621 1.00 0.00 H new ATOM 0 HB2 ALA A 86 11.066 -3.949 -0.203 1.00 0.00 H new ATOM 0 HB3 ALA A 86 10.868 -2.192 0.002 1.00 0.00 H new ATOM 1450 N GLU A 87 11.133 -0.532 -2.837 1.00 0.00 N ATOM 1451 CA GLU A 87 10.576 0.685 -3.421 1.00 0.00 C ATOM 1452 C GLU A 87 9.910 0.400 -4.764 1.00 0.00 C ATOM 1453 O GLU A 87 10.388 -0.426 -5.543 1.00 0.00 O ATOM 1454 CB GLU A 87 11.673 1.736 -3.597 1.00 0.00 C ATOM 1455 CG GLU A 87 11.211 3.155 -3.306 1.00 0.00 C ATOM 1456 CD GLU A 87 11.215 4.036 -4.541 1.00 0.00 C ATOM 1457 OE1 GLU A 87 11.154 3.487 -5.662 1.00 0.00 O ATOM 1458 OE2 GLU A 87 11.279 5.273 -4.388 1.00 0.00 O ATOM 0 H GLU A 87 12.119 -0.465 -2.584 1.00 0.00 H new ATOM 0 HA GLU A 87 9.817 1.067 -2.738 1.00 0.00 H new ATOM 0 HB2 GLU A 87 12.507 1.492 -2.938 1.00 0.00 H new ATOM 0 HB3 GLU A 87 12.049 1.688 -4.619 1.00 0.00 H new ATOM 0 HG2 GLU A 87 10.205 3.127 -2.888 1.00 0.00 H new ATOM 0 HG3 GLU A 87 11.859 3.596 -2.548 1.00 0.00 H new ATOM 1465 N ILE A 88 8.807 1.089 -5.029 1.00 0.00 N ATOM 1466 CA ILE A 88 8.074 0.914 -6.277 1.00 0.00 C ATOM 1467 C ILE A 88 7.849 2.250 -6.976 1.00 0.00 C ATOM 1468 O ILE A 88 8.269 3.298 -6.482 1.00 0.00 O ATOM 1469 CB ILE A 88 6.712 0.234 -6.043 1.00 0.00 C ATOM 1470 CG1 ILE A 88 5.851 1.076 -5.102 1.00 0.00 C ATOM 1471 CG2 ILE A 88 6.904 -1.166 -5.483 1.00 0.00 C ATOM 1472 CD1 ILE A 88 4.407 1.165 -5.538 1.00 0.00 C ATOM 0 H ILE A 88 8.399 1.776 -4.395 1.00 0.00 H new ATOM 0 HA ILE A 88 8.685 0.273 -6.912 1.00 0.00 H new ATOM 0 HB ILE A 88 6.197 0.152 -7.000 1.00 0.00 H new ATOM 0 HG12 ILE A 88 5.896 0.650 -4.100 1.00 0.00 H new ATOM 0 HG13 ILE A 88 6.268 2.081 -5.040 1.00 0.00 H new ATOM 0 HG21 ILE A 88 5.931 -1.631 -5.324 1.00 0.00 H new ATOM 0 HG22 ILE A 88 7.481 -1.764 -6.188 1.00 0.00 H new ATOM 0 HG23 ILE A 88 7.438 -1.108 -4.534 1.00 0.00 H new ATOM 0 HD11 ILE A 88 3.850 1.776 -4.828 1.00 0.00 H new ATOM 0 HD12 ILE A 88 4.353 1.618 -6.528 1.00 0.00 H new ATOM 0 HD13 ILE A 88 3.975 0.165 -5.573 1.00 0.00 H new ATOM 1484 N LEU A 89 7.186 2.207 -8.126 1.00 0.00 N ATOM 1485 CA LEU A 89 6.905 3.415 -8.892 1.00 0.00 C ATOM 1486 C LEU A 89 5.675 4.135 -8.340 1.00 0.00 C ATOM 1487 O LEU A 89 4.675 3.500 -8.004 1.00 0.00 O ATOM 1488 CB LEU A 89 6.686 3.069 -10.366 1.00 0.00 C ATOM 1489 CG LEU A 89 7.962 2.783 -11.159 1.00 0.00 C ATOM 1490 CD1 LEU A 89 7.684 1.786 -12.273 1.00 0.00 C ATOM 1491 CD2 LEU A 89 8.535 4.074 -11.725 1.00 0.00 C ATOM 0 H LEU A 89 6.833 1.348 -8.548 1.00 0.00 H new ATOM 0 HA LEU A 89 7.765 4.080 -8.804 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.036 2.196 -10.426 1.00 0.00 H new ATOM 0 HB3 LEU A 89 6.157 3.894 -10.843 1.00 0.00 H new ATOM 0 HG LEU A 89 8.699 2.346 -10.485 1.00 0.00 H new ATOM 0 HD11 LEU A 89 8.603 1.594 -12.827 1.00 0.00 H new ATOM 0 HD12 LEU A 89 7.318 0.854 -11.844 1.00 0.00 H new ATOM 0 HD13 LEU A 89 6.932 2.195 -12.948 1.00 0.00 H new ATOM 0 HD21 LEU A 89 9.443 3.854 -12.287 1.00 0.00 H new ATOM 0 HD22 LEU A 89 7.803 4.538 -12.386 1.00 0.00 H new ATOM 0 HD23 LEU A 89 8.770 4.756 -10.908 1.00 0.00 H new ATOM 1503 N PRO A 90 5.726 5.477 -8.241 1.00 0.00 N ATOM 1504 CA PRO A 90 4.604 6.271 -7.730 1.00 0.00 C ATOM 1505 C PRO A 90 3.351 6.099 -8.578 1.00 0.00 C ATOM 1506 O PRO A 90 2.270 5.812 -8.062 1.00 0.00 O ATOM 1507 CB PRO A 90 5.105 7.719 -7.818 1.00 0.00 C ATOM 1508 CG PRO A 90 6.588 7.618 -7.918 1.00 0.00 C ATOM 1509 CD PRO A 90 6.872 6.323 -8.620 1.00 0.00 C ATOM 0 HA PRO A 90 4.323 5.968 -6.721 1.00 0.00 H new ATOM 0 HB2 PRO A 90 4.686 8.228 -8.686 1.00 0.00 H new ATOM 0 HB3 PRO A 90 4.808 8.292 -6.939 1.00 0.00 H new ATOM 0 HG2 PRO A 90 6.999 8.461 -8.474 1.00 0.00 H new ATOM 0 HG3 PRO A 90 7.047 7.634 -6.929 1.00 0.00 H new ATOM 0 HD2 PRO A 90 6.935 6.456 -9.700 1.00 0.00 H new ATOM 0 HD3 PRO A 90 7.818 5.888 -8.297 1.00 0.00 H new ATOM 1517 N ARG A 91 3.505 6.279 -9.886 1.00 0.00 N ATOM 1518 CA ARG A 91 2.390 6.149 -10.817 1.00 0.00 C ATOM 1519 C ARG A 91 1.721 4.781 -10.690 1.00 0.00 C ATOM 1520 O ARG A 91 0.498 4.670 -10.780 1.00 0.00 O ATOM 1521 CB ARG A 91 2.872 6.388 -12.255 1.00 0.00 C ATOM 1522 CG ARG A 91 3.421 5.150 -12.944 1.00 0.00 C ATOM 1523 CD ARG A 91 2.305 4.327 -13.560 1.00 0.00 C ATOM 1524 NE ARG A 91 2.743 3.615 -14.758 1.00 0.00 N ATOM 1525 CZ ARG A 91 1.912 3.141 -15.684 1.00 0.00 C ATOM 1526 NH1 ARG A 91 0.602 3.303 -15.557 1.00 0.00 N ATOM 1527 NH2 ARG A 91 2.396 2.503 -16.742 1.00 0.00 N ATOM 0 H ARG A 91 4.394 6.516 -10.326 1.00 0.00 H new ATOM 0 HA ARG A 91 1.645 6.905 -10.567 1.00 0.00 H new ATOM 0 HB2 ARG A 91 2.042 6.779 -12.844 1.00 0.00 H new ATOM 0 HB3 ARG A 91 3.645 7.156 -12.244 1.00 0.00 H new ATOM 0 HG2 ARG A 91 4.129 5.445 -13.718 1.00 0.00 H new ATOM 0 HG3 ARG A 91 3.970 4.543 -12.224 1.00 0.00 H new ATOM 0 HD2 ARG A 91 1.937 3.609 -12.827 1.00 0.00 H new ATOM 0 HD3 ARG A 91 1.470 4.981 -13.812 1.00 0.00 H new ATOM 0 HE ARG A 91 3.744 3.473 -14.893 1.00 0.00 H new ATOM 0 HH11 ARG A 91 0.225 3.793 -14.746 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -0.029 2.937 -16.270 1.00 0.00 H new ATOM 0 HH21 ARG A 91 3.403 2.376 -16.845 1.00 0.00 H new ATOM 0 HH22 ARG A 91 1.761 2.139 -17.453 1.00 0.00 H new ATOM 1541 N GLN A 92 2.527 3.745 -10.481 1.00 0.00 N ATOM 1542 CA GLN A 92 2.009 2.386 -10.341 1.00 0.00 C ATOM 1543 C GLN A 92 1.094 2.273 -9.127 1.00 0.00 C ATOM 1544 O GLN A 92 -0.042 1.806 -9.231 1.00 0.00 O ATOM 1545 CB GLN A 92 3.162 1.389 -10.220 1.00 0.00 C ATOM 1546 CG GLN A 92 3.810 1.042 -11.550 1.00 0.00 C ATOM 1547 CD GLN A 92 3.097 -0.086 -12.269 1.00 0.00 C ATOM 1548 OE1 GLN A 92 2.519 0.111 -13.338 1.00 0.00 O ATOM 1549 NE2 GLN A 92 3.134 -1.276 -11.683 1.00 0.00 N ATOM 0 H GLN A 92 3.541 3.819 -10.405 1.00 0.00 H new ATOM 0 HA GLN A 92 1.427 2.153 -11.233 1.00 0.00 H new ATOM 0 HB2 GLN A 92 3.919 1.802 -9.553 1.00 0.00 H new ATOM 0 HB3 GLN A 92 2.793 0.474 -9.756 1.00 0.00 H new ATOM 0 HG2 GLN A 92 3.819 1.926 -12.187 1.00 0.00 H new ATOM 0 HG3 GLN A 92 4.849 0.761 -11.381 1.00 0.00 H new ATOM 0 HE21 GLN A 92 3.625 -1.393 -10.797 1.00 0.00 H new ATOM 0 HE22 GLN A 92 2.671 -2.074 -12.119 1.00 0.00 H new ATOM 1558 N PHE A 93 1.594 2.707 -7.974 1.00 0.00 N ATOM 1559 CA PHE A 93 0.826 2.660 -6.736 1.00 0.00 C ATOM 1560 C PHE A 93 -0.513 3.364 -6.910 1.00 0.00 C ATOM 1561 O PHE A 93 -1.566 2.791 -6.633 1.00 0.00 O ATOM 1562 CB PHE A 93 1.613 3.311 -5.597 1.00 0.00 C ATOM 1563 CG PHE A 93 0.959 3.156 -4.253 1.00 0.00 C ATOM 1564 CD1 PHE A 93 -0.035 4.033 -3.849 1.00 0.00 C ATOM 1565 CD2 PHE A 93 1.339 2.137 -3.395 1.00 0.00 C ATOM 1566 CE1 PHE A 93 -0.638 3.894 -2.614 1.00 0.00 C ATOM 1567 CE2 PHE A 93 0.739 1.995 -2.157 1.00 0.00 C ATOM 1568 CZ PHE A 93 -0.251 2.874 -1.766 1.00 0.00 C ATOM 0 H PHE A 93 2.531 3.096 -7.872 1.00 0.00 H new ATOM 0 HA PHE A 93 0.642 1.615 -6.487 1.00 0.00 H new ATOM 0 HB2 PHE A 93 2.611 2.874 -5.559 1.00 0.00 H new ATOM 0 HB3 PHE A 93 1.737 4.372 -5.812 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -0.341 4.833 -4.506 1.00 0.00 H new ATOM 0 HD2 PHE A 93 2.112 1.446 -3.696 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -1.412 4.583 -2.311 1.00 0.00 H new ATOM 0 HE2 PHE A 93 1.045 1.197 -1.497 1.00 0.00 H new ATOM 0 HZ PHE A 93 -0.722 2.765 -0.800 1.00 0.00 H new ATOM 1578 N GLU A 94 -0.466 4.605 -7.382 1.00 0.00 N ATOM 1579 CA GLU A 94 -1.680 5.376 -7.603 1.00 0.00 C ATOM 1580 C GLU A 94 -2.481 4.791 -8.760 1.00 0.00 C ATOM 1581 O GLU A 94 -3.688 5.010 -8.863 1.00 0.00 O ATOM 1582 CB GLU A 94 -1.345 6.844 -7.871 1.00 0.00 C ATOM 1583 CG GLU A 94 -1.812 7.778 -6.767 1.00 0.00 C ATOM 1584 CD GLU A 94 -0.677 8.238 -5.874 1.00 0.00 C ATOM 1585 OE1 GLU A 94 -0.001 9.225 -6.234 1.00 0.00 O ATOM 1586 OE2 GLU A 94 -0.462 7.610 -4.815 1.00 0.00 O ATOM 0 H GLU A 94 0.397 5.095 -7.618 1.00 0.00 H new ATOM 0 HA GLU A 94 -2.289 5.323 -6.700 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -0.267 6.947 -7.993 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -1.803 7.148 -8.812 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -2.295 8.648 -7.212 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -2.564 7.272 -6.161 1.00 0.00 H new ATOM 1593 N GLU A 95 -1.808 4.029 -9.623 1.00 0.00 N ATOM 1594 CA GLU A 95 -2.474 3.400 -10.756 1.00 0.00 C ATOM 1595 C GLU A 95 -3.558 2.464 -10.248 1.00 0.00 C ATOM 1596 O GLU A 95 -4.711 2.532 -10.677 1.00 0.00 O ATOM 1597 CB GLU A 95 -1.466 2.623 -11.608 1.00 0.00 C ATOM 1598 CG GLU A 95 -1.439 3.055 -13.062 1.00 0.00 C ATOM 1599 CD GLU A 95 -2.793 2.933 -13.733 1.00 0.00 C ATOM 1600 OE1 GLU A 95 -3.677 3.768 -13.443 1.00 0.00 O ATOM 1601 OE2 GLU A 95 -2.971 2.003 -14.546 1.00 0.00 O ATOM 0 H GLU A 95 -0.809 3.835 -9.557 1.00 0.00 H new ATOM 0 HA GLU A 95 -2.924 4.174 -11.378 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -0.470 2.748 -11.182 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -1.703 1.560 -11.558 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -1.099 4.089 -13.123 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -0.713 2.448 -13.604 1.00 0.00 H new ATOM 1608 N ILE A 96 -3.176 1.600 -9.315 1.00 0.00 N ATOM 1609 CA ILE A 96 -4.112 0.659 -8.727 1.00 0.00 C ATOM 1610 C ILE A 96 -5.082 1.384 -7.803 1.00 0.00 C ATOM 1611 O ILE A 96 -6.248 1.009 -7.686 1.00 0.00 O ATOM 1612 CB ILE A 96 -3.375 -0.433 -7.941 1.00 0.00 C ATOM 1613 CG1 ILE A 96 -2.230 -1.001 -8.781 1.00 0.00 C ATOM 1614 CG2 ILE A 96 -4.340 -1.536 -7.528 1.00 0.00 C ATOM 1615 CD1 ILE A 96 -2.645 -1.397 -10.182 1.00 0.00 C ATOM 0 H ILE A 96 -2.225 1.534 -8.952 1.00 0.00 H new ATOM 0 HA ILE A 96 -4.668 0.190 -9.539 1.00 0.00 H new ATOM 0 HB ILE A 96 -2.956 0.007 -7.036 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -1.433 -0.260 -8.843 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -1.816 -1.872 -8.274 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.800 -2.302 -6.971 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -5.125 -1.116 -6.899 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.787 -1.981 -8.417 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -1.782 -1.791 -10.719 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -3.420 -2.162 -10.129 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -3.032 -0.524 -10.707 1.00 0.00 H new ATOM 1627 N TRP A 97 -4.588 2.439 -7.162 1.00 0.00 N ATOM 1628 CA TRP A 97 -5.403 3.244 -6.260 1.00 0.00 C ATOM 1629 C TRP A 97 -6.641 3.751 -6.989 1.00 0.00 C ATOM 1630 O TRP A 97 -7.731 3.824 -6.420 1.00 0.00 O ATOM 1631 CB TRP A 97 -4.583 4.424 -5.730 1.00 0.00 C ATOM 1632 CG TRP A 97 -5.093 4.983 -4.438 1.00 0.00 C ATOM 1633 CD1 TRP A 97 -5.555 6.250 -4.220 1.00 0.00 C ATOM 1634 CD2 TRP A 97 -5.187 4.302 -3.183 1.00 0.00 C ATOM 1635 NE1 TRP A 97 -5.934 6.397 -2.908 1.00 0.00 N ATOM 1636 CE2 TRP A 97 -5.717 5.212 -2.250 1.00 0.00 C ATOM 1637 CE3 TRP A 97 -4.877 3.006 -2.759 1.00 0.00 C ATOM 1638 CZ2 TRP A 97 -5.941 4.866 -0.917 1.00 0.00 C ATOM 1639 CZ3 TRP A 97 -5.098 2.665 -1.439 1.00 0.00 C ATOM 1640 CH2 TRP A 97 -5.626 3.592 -0.532 1.00 0.00 C ATOM 0 H TRP A 97 -3.623 2.757 -7.252 1.00 0.00 H new ATOM 0 HA TRP A 97 -5.719 2.627 -5.419 1.00 0.00 H new ATOM 0 HB2 TRP A 97 -3.550 4.104 -5.594 1.00 0.00 H new ATOM 0 HB3 TRP A 97 -4.576 5.215 -6.480 1.00 0.00 H new ATOM 0 HD1 TRP A 97 -5.614 7.024 -4.971 1.00 0.00 H new ATOM 0 HE1 TRP A 97 -6.314 7.247 -2.491 1.00 0.00 H new ATOM 0 HE3 TRP A 97 -4.472 2.284 -3.452 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 -6.348 5.578 -0.215 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 -4.860 1.667 -1.101 1.00 0.00 H new ATOM 0 HH2 TRP A 97 -5.788 3.295 0.494 1.00 0.00 H new ATOM 1651 N GLU A 98 -6.458 4.091 -8.262 1.00 0.00 N ATOM 1652 CA GLU A 98 -7.547 4.582 -9.095 1.00 0.00 C ATOM 1653 C GLU A 98 -8.315 3.417 -9.720 1.00 0.00 C ATOM 1654 O GLU A 98 -9.504 3.534 -10.021 1.00 0.00 O ATOM 1655 CB GLU A 98 -7.000 5.498 -10.194 1.00 0.00 C ATOM 1656 CG GLU A 98 -7.715 6.835 -10.289 1.00 0.00 C ATOM 1657 CD GLU A 98 -7.990 7.250 -11.721 1.00 0.00 C ATOM 1658 OE1 GLU A 98 -7.037 7.258 -12.530 1.00 0.00 O ATOM 1659 OE2 GLU A 98 -9.157 7.566 -12.035 1.00 0.00 O ATOM 0 H GLU A 98 -5.559 4.034 -8.740 1.00 0.00 H new ATOM 0 HA GLU A 98 -8.231 5.151 -8.466 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -5.940 5.675 -10.012 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -7.078 4.986 -11.153 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -8.657 6.778 -9.744 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -7.111 7.601 -9.802 1.00 0.00 H new ATOM 1666 N ARG A 99 -7.622 2.297 -9.919 1.00 0.00 N ATOM 1667 CA ARG A 99 -8.230 1.112 -10.517 1.00 0.00 C ATOM 1668 C ARG A 99 -9.455 0.657 -9.727 1.00 0.00 C ATOM 1669 O ARG A 99 -10.540 0.500 -10.284 1.00 0.00 O ATOM 1670 CB ARG A 99 -7.214 -0.027 -10.591 1.00 0.00 C ATOM 1671 CG ARG A 99 -6.399 -0.034 -11.874 1.00 0.00 C ATOM 1672 CD ARG A 99 -6.801 -1.181 -12.790 1.00 0.00 C ATOM 1673 NE ARG A 99 -7.559 -0.716 -13.949 1.00 0.00 N ATOM 1674 CZ ARG A 99 -7.002 -0.217 -15.050 1.00 0.00 C ATOM 1675 NH1 ARG A 99 -5.681 -0.114 -15.147 1.00 0.00 N ATOM 1676 NH2 ARG A 99 -7.765 0.180 -16.059 1.00 0.00 N ATOM 0 H ARG A 99 -6.638 2.186 -9.674 1.00 0.00 H new ATOM 0 HA ARG A 99 -8.550 1.378 -11.524 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -6.536 0.046 -9.740 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -7.739 -0.978 -10.499 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -6.534 0.913 -12.396 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -5.339 -0.116 -11.632 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -5.907 -1.705 -13.128 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -7.399 -1.900 -12.230 1.00 0.00 H new ATOM 0 HE ARG A 99 -8.576 -0.777 -13.912 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -5.088 -0.418 -14.375 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -5.260 0.269 -15.993 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -8.780 0.103 -15.992 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -7.337 0.562 -16.902 1.00 0.00 H new ATOM 1690 N CYS A 100 -9.272 0.441 -8.428 1.00 0.00 N ATOM 1691 CA CYS A 100 -10.364 -0.002 -7.569 1.00 0.00 C ATOM 1692 C CYS A 100 -11.207 1.181 -7.101 1.00 0.00 C ATOM 1693 O CYS A 100 -12.275 1.447 -7.651 1.00 0.00 O ATOM 1694 CB CYS A 100 -9.814 -0.773 -6.365 1.00 0.00 C ATOM 1695 SG CYS A 100 -11.079 -1.316 -5.192 1.00 0.00 S ATOM 0 H CYS A 100 -8.380 0.565 -7.949 1.00 0.00 H new ATOM 0 HA CYS A 100 -11.005 -0.666 -8.150 1.00 0.00 H new ATOM 0 HB2 CYS A 100 -9.269 -1.646 -6.725 1.00 0.00 H new ATOM 0 HB3 CYS A 100 -9.095 -0.142 -5.841 1.00 0.00 H new ATOM 0 HG CYS A 100 -10.570 -1.365 -3.997 1.00 0.00 H new ATOM 1701 N GLY A 101 -10.723 1.887 -6.083 1.00 0.00 N ATOM 1702 CA GLY A 101 -11.451 3.029 -5.564 1.00 0.00 C ATOM 1703 C GLY A 101 -10.749 3.682 -4.389 1.00 0.00 C ATOM 1704 O GLY A 101 -11.398 4.150 -3.454 1.00 0.00 O ATOM 0 H GLY A 101 -9.841 1.688 -5.610 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -11.582 3.764 -6.359 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -12.447 2.711 -5.257 1.00 0.00 H new ATOM 1708 N GLY A 102 -9.421 3.717 -4.438 1.00 0.00 N ATOM 1709 CA GLY A 102 -8.653 4.324 -3.364 1.00 0.00 C ATOM 1710 C GLY A 102 -9.087 5.747 -3.076 1.00 0.00 C ATOM 1711 O GLY A 102 -9.429 6.083 -1.943 1.00 0.00 O ATOM 0 H GLY A 102 -8.862 3.336 -5.202 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -8.761 3.724 -2.460 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -7.595 4.316 -3.628 1.00 0.00 H new ATOM 1715 N ILE A 103 -9.072 6.582 -4.108 1.00 0.00 N ATOM 1716 CA ILE A 103 -9.468 7.976 -3.972 1.00 0.00 C ATOM 1717 C ILE A 103 -10.882 8.098 -3.416 1.00 0.00 C ATOM 1718 O ILE A 103 -11.157 8.956 -2.577 1.00 0.00 O ATOM 1719 CB ILE A 103 -9.392 8.703 -5.326 1.00 0.00 C ATOM 1720 CG1 ILE A 103 -8.050 8.417 -6.000 1.00 0.00 C ATOM 1721 CG2 ILE A 103 -9.596 10.199 -5.143 1.00 0.00 C ATOM 1722 CD1 ILE A 103 -8.113 7.301 -7.017 1.00 0.00 C ATOM 0 H ILE A 103 -8.789 6.315 -5.051 1.00 0.00 H new ATOM 0 HA ILE A 103 -8.772 8.441 -3.274 1.00 0.00 H new ATOM 0 HB ILE A 103 -10.190 8.331 -5.969 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -7.697 9.325 -6.490 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -7.316 8.161 -5.236 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -9.539 10.695 -6.112 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -10.575 10.381 -4.699 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -8.821 10.594 -4.486 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -7.126 7.152 -7.456 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -8.435 6.381 -6.529 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -8.823 7.563 -7.801 1.00 0.00 H new ATOM 1734 N GLN A 104 -11.776 7.231 -3.883 1.00 0.00 N ATOM 1735 CA GLN A 104 -13.161 7.242 -3.427 1.00 0.00 C ATOM 1736 C GLN A 104 -13.231 7.014 -1.922 1.00 0.00 C ATOM 1737 O GLN A 104 -13.897 7.757 -1.200 1.00 0.00 O ATOM 1738 CB GLN A 104 -13.972 6.171 -4.159 1.00 0.00 C ATOM 1739 CG GLN A 104 -14.853 6.726 -5.268 1.00 0.00 C ATOM 1740 CD GLN A 104 -14.049 7.270 -6.433 1.00 0.00 C ATOM 1741 OE1 GLN A 104 -14.109 8.461 -6.741 1.00 0.00 O ATOM 1742 NE2 GLN A 104 -13.290 6.399 -7.087 1.00 0.00 N ATOM 0 H GLN A 104 -11.566 6.513 -4.576 1.00 0.00 H new ATOM 0 HA GLN A 104 -13.587 8.220 -3.651 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -13.288 5.436 -4.583 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -14.598 5.645 -3.438 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -15.519 5.941 -5.626 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -15.483 7.519 -4.864 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -13.271 5.421 -6.797 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -12.726 6.708 -7.879 1.00 0.00 H new ATOM 1751 N TYR A 105 -12.529 5.986 -1.452 1.00 0.00 N ATOM 1752 CA TYR A 105 -12.503 5.664 -0.031 1.00 0.00 C ATOM 1753 C TYR A 105 -11.918 6.824 0.766 1.00 0.00 C ATOM 1754 O TYR A 105 -12.423 7.180 1.831 1.00 0.00 O ATOM 1755 CB TYR A 105 -11.682 4.394 0.207 1.00 0.00 C ATOM 1756 CG TYR A 105 -11.514 4.036 1.667 1.00 0.00 C ATOM 1757 CD1 TYR A 105 -12.496 3.326 2.346 1.00 0.00 C ATOM 1758 CD2 TYR A 105 -10.372 4.409 2.366 1.00 0.00 C ATOM 1759 CE1 TYR A 105 -12.345 2.997 3.680 1.00 0.00 C ATOM 1760 CE2 TYR A 105 -10.213 4.083 3.700 1.00 0.00 C ATOM 1761 CZ TYR A 105 -11.202 3.378 4.352 1.00 0.00 C ATOM 1762 OH TYR A 105 -11.050 3.053 5.679 1.00 0.00 O ATOM 0 H TYR A 105 -11.971 5.363 -2.036 1.00 0.00 H new ATOM 0 HA TYR A 105 -13.525 5.491 0.305 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -12.162 3.562 -0.308 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -10.697 4.521 -0.241 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -13.392 3.026 1.823 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -9.596 4.963 1.859 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -13.118 2.444 4.194 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -9.319 4.379 4.228 1.00 0.00 H new ATOM 0 HH TYR A 105 -10.484 2.257 5.758 1.00 0.00 H new ATOM 1772 N LEU A 106 -10.851 7.413 0.235 1.00 0.00 N ATOM 1773 CA LEU A 106 -10.194 8.538 0.886 1.00 0.00 C ATOM 1774 C LEU A 106 -11.123 9.745 0.939 1.00 0.00 C ATOM 1775 O LEU A 106 -11.193 10.447 1.948 1.00 0.00 O ATOM 1776 CB LEU A 106 -8.904 8.897 0.146 1.00 0.00 C ATOM 1777 CG LEU A 106 -7.646 8.902 1.011 1.00 0.00 C ATOM 1778 CD1 LEU A 106 -6.396 8.916 0.145 1.00 0.00 C ATOM 1779 CD2 LEU A 106 -7.654 10.095 1.957 1.00 0.00 C ATOM 0 H LEU A 106 -10.423 7.128 -0.646 1.00 0.00 H new ATOM 0 HA LEU A 106 -9.946 8.248 1.907 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -8.762 8.190 -0.671 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -9.022 9.883 -0.303 1.00 0.00 H new ATOM 0 HG LEU A 106 -7.638 7.989 1.606 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -5.512 8.919 0.782 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -6.383 8.030 -0.489 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -6.396 9.809 -0.480 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -6.750 10.083 2.566 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -7.689 11.018 1.378 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -8.529 10.040 2.605 1.00 0.00 H new ATOM 1791 N GLN A 107 -11.836 9.978 -0.157 1.00 0.00 N ATOM 1792 CA GLN A 107 -12.766 11.099 -0.242 1.00 0.00 C ATOM 1793 C GLN A 107 -13.889 10.947 0.778 1.00 0.00 C ATOM 1794 O GLN A 107 -14.398 11.935 1.307 1.00 0.00 O ATOM 1795 CB GLN A 107 -13.350 11.196 -1.653 1.00 0.00 C ATOM 1796 CG GLN A 107 -12.816 12.374 -2.452 1.00 0.00 C ATOM 1797 CD GLN A 107 -13.224 13.710 -1.863 1.00 0.00 C ATOM 1798 OE1 GLN A 107 -12.506 14.284 -1.045 1.00 0.00 O ATOM 1799 NE2 GLN A 107 -14.381 14.212 -2.278 1.00 0.00 N ATOM 0 H GLN A 107 -11.788 9.405 -1.000 1.00 0.00 H new ATOM 0 HA GLN A 107 -12.219 12.015 -0.020 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -13.132 10.274 -2.192 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -14.435 11.276 -1.584 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -11.728 12.317 -2.494 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -13.179 12.307 -3.478 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -14.944 13.701 -2.958 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -14.707 15.109 -1.917 1.00 0.00 H new ATOM 1808 N SER A 108 -14.266 9.703 1.052 1.00 0.00 N ATOM 1809 CA SER A 108 -15.328 9.418 2.012 1.00 0.00 C ATOM 1810 C SER A 108 -14.884 9.781 3.422 1.00 0.00 C ATOM 1811 O SER A 108 -15.584 10.497 4.139 1.00 0.00 O ATOM 1812 CB SER A 108 -15.723 7.941 1.949 1.00 0.00 C ATOM 1813 OG SER A 108 -16.820 7.741 1.075 1.00 0.00 O ATOM 0 H SER A 108 -13.852 8.875 0.623 1.00 0.00 H new ATOM 0 HA SER A 108 -16.196 10.024 1.753 1.00 0.00 H new ATOM 0 HB2 SER A 108 -14.873 7.349 1.611 1.00 0.00 H new ATOM 0 HB3 SER A 108 -15.981 7.588 2.947 1.00 0.00 H new ATOM 0 HG SER A 108 -17.051 6.789 1.052 1.00 0.00 H new ATOM 1819 N ALA A 109 -13.707 9.303 3.810 1.00 0.00 N ATOM 1820 CA ALA A 109 -13.166 9.604 5.128 1.00 0.00 C ATOM 1821 C ALA A 109 -12.804 11.078 5.202 1.00 0.00 C ATOM 1822 O ALA A 109 -12.972 11.730 6.234 1.00 0.00 O ATOM 1823 CB ALA A 109 -11.949 8.737 5.414 1.00 0.00 C ATOM 0 H ALA A 109 -13.112 8.708 3.233 1.00 0.00 H new ATOM 0 HA ALA A 109 -13.920 9.385 5.884 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -11.557 8.975 6.403 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -12.235 7.686 5.380 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -11.182 8.928 4.664 1.00 0.00 H new ATOM 1829 N ILE A 110 -12.324 11.595 4.077 1.00 0.00 N ATOM 1830 CA ILE A 110 -11.948 12.994 3.967 1.00 0.00 C ATOM 1831 C ILE A 110 -13.149 13.891 4.256 1.00 0.00 C ATOM 1832 O ILE A 110 -13.062 14.832 5.045 1.00 0.00 O ATOM 1833 CB ILE A 110 -11.392 13.291 2.553 1.00 0.00 C ATOM 1834 CG1 ILE A 110 -9.879 13.076 2.520 1.00 0.00 C ATOM 1835 CG2 ILE A 110 -11.735 14.703 2.107 1.00 0.00 C ATOM 1836 CD1 ILE A 110 -9.295 13.113 1.124 1.00 0.00 C ATOM 0 H ILE A 110 -12.186 11.057 3.221 1.00 0.00 H new ATOM 0 HA ILE A 110 -11.170 13.202 4.702 1.00 0.00 H new ATOM 0 HB ILE A 110 -11.863 12.597 1.857 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -9.398 13.843 3.127 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -9.646 12.114 2.977 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -11.330 14.878 1.110 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -12.818 14.825 2.085 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -11.304 15.420 2.805 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -8.218 12.953 1.176 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -9.749 12.329 0.519 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -9.497 14.084 0.671 1.00 0.00 H new ATOM 1848 N GLU A 111 -14.271 13.585 3.610 1.00 0.00 N ATOM 1849 CA GLU A 111 -15.495 14.355 3.791 1.00 0.00 C ATOM 1850 C GLU A 111 -16.038 14.181 5.206 1.00 0.00 C ATOM 1851 O GLU A 111 -16.661 15.088 5.760 1.00 0.00 O ATOM 1852 CB GLU A 111 -16.547 13.921 2.767 1.00 0.00 C ATOM 1853 CG GLU A 111 -17.007 12.485 2.936 1.00 0.00 C ATOM 1854 CD GLU A 111 -18.381 12.239 2.342 1.00 0.00 C ATOM 1855 OE1 GLU A 111 -18.695 12.851 1.300 1.00 0.00 O ATOM 1856 OE2 GLU A 111 -19.144 11.436 2.920 1.00 0.00 O ATOM 0 H GLU A 111 -14.356 12.807 2.956 1.00 0.00 H new ATOM 0 HA GLU A 111 -15.264 15.409 3.638 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -17.411 14.581 2.845 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -16.139 14.047 1.764 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -16.286 11.818 2.463 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -17.024 12.235 3.997 1.00 0.00 H new ATOM 1863 N SER A 112 -15.796 13.010 5.787 1.00 0.00 N ATOM 1864 CA SER A 112 -16.259 12.715 7.139 1.00 0.00 C ATOM 1865 C SER A 112 -15.257 13.202 8.185 1.00 0.00 C ATOM 1866 O SER A 112 -15.531 13.153 9.385 1.00 0.00 O ATOM 1867 CB SER A 112 -16.493 11.212 7.301 1.00 0.00 C ATOM 1868 OG SER A 112 -17.681 10.806 6.644 1.00 0.00 O ATOM 0 H SER A 112 -15.282 12.249 5.343 1.00 0.00 H new ATOM 0 HA SER A 112 -17.199 13.244 7.295 1.00 0.00 H new ATOM 0 HB2 SER A 112 -15.644 10.663 6.895 1.00 0.00 H new ATOM 0 HB3 SER A 112 -16.556 10.963 8.360 1.00 0.00 H new ATOM 0 HG SER A 112 -17.806 9.841 6.761 1.00 0.00 H new ATOM 1874 N ARG A 113 -14.094 13.666 7.727 1.00 0.00 N ATOM 1875 CA ARG A 113 -13.051 14.158 8.624 1.00 0.00 C ATOM 1876 C ARG A 113 -12.423 13.011 9.408 1.00 0.00 C ATOM 1877 O ARG A 113 -11.942 13.198 10.526 1.00 0.00 O ATOM 1878 CB ARG A 113 -13.613 15.209 9.586 1.00 0.00 C ATOM 1879 CG ARG A 113 -14.326 16.354 8.886 1.00 0.00 C ATOM 1880 CD ARG A 113 -13.427 17.024 7.859 1.00 0.00 C ATOM 1881 NE ARG A 113 -14.018 18.252 7.331 1.00 0.00 N ATOM 1882 CZ ARG A 113 -13.990 19.422 7.965 1.00 0.00 C ATOM 1883 NH1 ARG A 113 -13.406 19.528 9.152 1.00 0.00 N ATOM 1884 NH2 ARG A 113 -14.546 20.490 7.409 1.00 0.00 N ATOM 0 H ARG A 113 -13.851 13.711 6.737 1.00 0.00 H new ATOM 0 HA ARG A 113 -12.278 14.624 8.013 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -14.307 14.726 10.274 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -12.798 15.612 10.187 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -15.224 15.979 8.396 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -14.648 17.089 9.624 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -12.464 17.252 8.315 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -13.236 16.332 7.039 1.00 0.00 H new ATOM 0 HE ARG A 113 -14.480 18.210 6.422 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -12.975 18.710 9.583 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -13.388 20.427 9.633 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -14.995 20.414 6.496 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -14.525 21.387 7.894 1.00 0.00 H new ATOM 1898 N GLN A 114 -12.422 11.824 8.809 1.00 0.00 N ATOM 1899 CA GLN A 114 -11.846 10.646 9.444 1.00 0.00 C ATOM 1900 C GLN A 114 -10.443 10.379 8.907 1.00 0.00 C ATOM 1901 O GLN A 114 -9.615 9.768 9.583 1.00 0.00 O ATOM 1902 CB GLN A 114 -12.736 9.425 9.207 1.00 0.00 C ATOM 1903 CG GLN A 114 -14.201 9.668 9.530 1.00 0.00 C ATOM 1904 CD GLN A 114 -14.417 10.105 10.963 1.00 0.00 C ATOM 1905 OE1 GLN A 114 -13.989 9.433 11.902 1.00 0.00 O ATOM 1906 NE2 GLN A 114 -15.087 11.239 11.142 1.00 0.00 N ATOM 0 H GLN A 114 -12.815 11.654 7.883 1.00 0.00 H new ATOM 0 HA GLN A 114 -11.780 10.833 10.516 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -12.648 9.119 8.165 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -12.371 8.597 9.814 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -14.596 10.430 8.858 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -14.767 8.755 9.343 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -15.424 11.765 10.336 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -15.264 11.583 12.086 1.00 0.00 H new ATOM 1915 N ALA A 115 -10.183 10.846 7.688 1.00 0.00 N ATOM 1916 CA ALA A 115 -8.882 10.662 7.058 1.00 0.00 C ATOM 1917 C ALA A 115 -7.771 11.266 7.914 1.00 0.00 C ATOM 1918 O ALA A 115 -7.975 11.564 9.091 1.00 0.00 O ATOM 1919 CB ALA A 115 -8.882 11.285 5.669 1.00 0.00 C ATOM 0 H ALA A 115 -10.858 11.355 7.118 1.00 0.00 H new ATOM 0 HA ALA A 115 -8.692 9.593 6.966 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -7.905 11.142 5.206 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -9.647 10.808 5.056 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -9.094 12.351 5.749 1.00 0.00 H new ATOM 1925 N ARG A 116 -6.596 11.440 7.318 1.00 0.00 N ATOM 1926 CA ARG A 116 -5.457 12.006 8.033 1.00 0.00 C ATOM 1927 C ARG A 116 -4.666 12.960 7.140 1.00 0.00 C ATOM 1928 O ARG A 116 -3.733 12.544 6.451 1.00 0.00 O ATOM 1929 CB ARG A 116 -4.544 10.888 8.540 1.00 0.00 C ATOM 1930 CG ARG A 116 -3.535 11.352 9.578 1.00 0.00 C ATOM 1931 CD ARG A 116 -3.115 10.213 10.494 1.00 0.00 C ATOM 1932 NE ARG A 116 -2.969 10.653 11.880 1.00 0.00 N ATOM 1933 CZ ARG A 116 -2.922 9.823 12.920 1.00 0.00 C ATOM 1934 NH1 ARG A 116 -3.014 8.511 12.737 1.00 0.00 N ATOM 1935 NH2 ARG A 116 -2.784 10.306 14.147 1.00 0.00 N ATOM 0 H ARG A 116 -6.407 11.198 6.345 1.00 0.00 H new ATOM 0 HA ARG A 116 -5.839 12.571 8.883 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -5.157 10.096 8.970 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -4.010 10.454 7.694 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -2.657 11.760 9.077 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -3.966 12.158 10.172 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -3.855 9.414 10.443 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -2.171 9.795 10.144 1.00 0.00 H new ATOM 0 HE ARG A 116 -2.899 11.654 12.061 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -3.121 8.134 11.795 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -2.977 7.881 13.538 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -2.714 11.313 14.294 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -2.748 9.671 14.944 1.00 0.00 H new ATOM 1949 N PRO A 117 -5.026 14.256 7.142 1.00 0.00 N ATOM 1950 CA PRO A 117 -4.343 15.270 6.330 1.00 0.00 C ATOM 1951 C PRO A 117 -2.830 15.245 6.523 1.00 0.00 C ATOM 1952 O PRO A 117 -2.290 15.957 7.370 1.00 0.00 O ATOM 1953 CB PRO A 117 -4.926 16.587 6.847 1.00 0.00 C ATOM 1954 CG PRO A 117 -6.271 16.220 7.372 1.00 0.00 C ATOM 1955 CD PRO A 117 -6.126 14.834 7.938 1.00 0.00 C ATOM 0 HA PRO A 117 -4.496 15.109 5.263 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -4.300 17.019 7.628 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -4.999 17.328 6.051 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -6.597 16.923 8.138 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -7.019 16.243 6.580 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -5.885 14.857 9.001 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -7.045 14.258 7.832 1.00 0.00 H new ATOM 1963 N THR A 118 -2.152 14.419 5.732 1.00 0.00 N ATOM 1964 CA THR A 118 -0.701 14.296 5.813 1.00 0.00 C ATOM 1965 C THR A 118 -0.062 14.490 4.442 1.00 0.00 C ATOM 1966 O THR A 118 0.932 15.203 4.302 1.00 0.00 O ATOM 1967 CB THR A 118 -0.314 12.930 6.379 1.00 0.00 C ATOM 1968 OG1 THR A 118 1.094 12.774 6.398 1.00 0.00 O ATOM 1969 CG2 THR A 118 -0.893 11.772 5.595 1.00 0.00 C ATOM 0 H THR A 118 -2.586 13.824 5.026 1.00 0.00 H new ATOM 0 HA THR A 118 -0.332 15.075 6.480 1.00 0.00 H new ATOM 0 HB THR A 118 -0.727 12.909 7.388 1.00 0.00 H new ATOM 0 HG1 THR A 118 1.321 11.894 6.765 1.00 0.00 H new ATOM 0 HG21 THR A 118 -0.580 10.832 6.050 1.00 0.00 H new ATOM 0 HG22 THR A 118 -1.981 11.835 5.604 1.00 0.00 H new ATOM 0 HG23 THR A 118 -0.535 11.814 4.566 1.00 0.00 H new ATOM 1977 N TYR A 119 -0.641 13.853 3.429 1.00 0.00 N ATOM 1978 CA TYR A 119 -0.131 13.956 2.067 1.00 0.00 C ATOM 1979 C TYR A 119 -1.125 13.370 1.068 1.00 0.00 C ATOM 1980 O TYR A 119 -1.623 14.072 0.188 1.00 0.00 O ATOM 1981 CB TYR A 119 1.214 13.237 1.943 1.00 0.00 C ATOM 1982 CG TYR A 119 1.782 13.256 0.541 1.00 0.00 C ATOM 1983 CD1 TYR A 119 1.327 12.365 -0.425 1.00 0.00 C ATOM 1984 CD2 TYR A 119 2.767 14.165 0.181 1.00 0.00 C ATOM 1985 CE1 TYR A 119 1.840 12.382 -1.708 1.00 0.00 C ATOM 1986 CE2 TYR A 119 3.285 14.189 -1.099 1.00 0.00 C ATOM 1987 CZ TYR A 119 2.818 13.295 -2.041 1.00 0.00 C ATOM 1988 OH TYR A 119 3.331 13.313 -3.317 1.00 0.00 O ATOM 0 H TYR A 119 -1.465 13.259 3.526 1.00 0.00 H new ATOM 0 HA TYR A 119 0.009 15.013 1.840 1.00 0.00 H new ATOM 0 HB2 TYR A 119 1.929 13.701 2.622 1.00 0.00 H new ATOM 0 HB3 TYR A 119 1.095 12.202 2.264 1.00 0.00 H new ATOM 0 HD1 TYR A 119 0.561 11.649 -0.168 1.00 0.00 H new ATOM 0 HD2 TYR A 119 3.135 14.866 0.915 1.00 0.00 H new ATOM 0 HE1 TYR A 119 1.476 11.683 -2.447 1.00 0.00 H new ATOM 0 HE2 TYR A 119 4.051 14.903 -1.361 1.00 0.00 H new ATOM 0 HH TYR A 119 4.010 14.016 -3.387 1.00 0.00 H new ATOM 1998 N ALA A 120 -1.405 12.077 1.208 1.00 0.00 N ATOM 1999 CA ALA A 120 -2.334 11.395 0.315 1.00 0.00 C ATOM 2000 C ALA A 120 -3.678 12.111 0.262 1.00 0.00 C ATOM 2001 O ALA A 120 -4.308 12.187 -0.792 1.00 0.00 O ATOM 2002 CB ALA A 120 -2.524 9.953 0.755 1.00 0.00 C ATOM 0 H ALA A 120 -1.001 11.482 1.931 1.00 0.00 H new ATOM 0 HA ALA A 120 -1.906 11.408 -0.688 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.220 9.455 0.080 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -1.564 9.436 0.733 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -2.924 9.932 1.769 1.00 0.00 H new ATOM 2008 N THR A 121 -4.112 12.635 1.401 1.00 0.00 N ATOM 2009 CA THR A 121 -5.382 13.344 1.475 1.00 0.00 C ATOM 2010 C THR A 121 -5.309 14.656 0.700 1.00 0.00 C ATOM 2011 O THR A 121 -6.249 15.026 -0.005 1.00 0.00 O ATOM 2012 CB THR A 121 -5.763 13.606 2.933 1.00 0.00 C ATOM 2013 OG1 THR A 121 -4.619 13.554 3.769 1.00 0.00 O ATOM 2014 CG2 THR A 121 -6.774 12.614 3.469 1.00 0.00 C ATOM 0 H THR A 121 -3.604 12.582 2.284 1.00 0.00 H new ATOM 0 HA THR A 121 -6.152 12.719 1.022 1.00 0.00 H new ATOM 0 HB THR A 121 -6.210 14.600 2.944 1.00 0.00 H new ATOM 0 HG1 THR A 121 -4.655 12.746 4.323 1.00 0.00 H new ATOM 0 HG21 THR A 121 -7.003 12.853 4.507 1.00 0.00 H new ATOM 0 HG22 THR A 121 -7.686 12.667 2.875 1.00 0.00 H new ATOM 0 HG23 THR A 121 -6.361 11.607 3.411 1.00 0.00 H new ATOM 2022 N ALA A 122 -4.183 15.352 0.829 1.00 0.00 N ATOM 2023 CA ALA A 122 -3.985 16.616 0.133 1.00 0.00 C ATOM 2024 C ALA A 122 -3.941 16.395 -1.373 1.00 0.00 C ATOM 2025 O ALA A 122 -4.721 16.985 -2.125 1.00 0.00 O ATOM 2026 CB ALA A 122 -2.706 17.288 0.609 1.00 0.00 C ATOM 0 H ALA A 122 -3.396 15.061 1.409 1.00 0.00 H new ATOM 0 HA ALA A 122 -4.826 17.271 0.360 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -2.572 18.231 0.080 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -2.772 17.479 1.680 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -1.856 16.636 0.409 1.00 0.00 H new ATOM 2032 N MET A 123 -3.030 15.532 -1.807 1.00 0.00 N ATOM 2033 CA MET A 123 -2.890 15.216 -3.222 1.00 0.00 C ATOM 2034 C MET A 123 -4.220 14.735 -3.791 1.00 0.00 C ATOM 2035 O MET A 123 -4.505 14.930 -4.973 1.00 0.00 O ATOM 2036 CB MET A 123 -1.787 14.176 -3.439 1.00 0.00 C ATOM 2037 CG MET A 123 -1.926 12.939 -2.569 1.00 0.00 C ATOM 2038 SD MET A 123 -2.219 11.443 -3.530 1.00 0.00 S ATOM 2039 CE MET A 123 -3.534 11.995 -4.610 1.00 0.00 C ATOM 0 H MET A 123 -2.377 15.039 -1.198 1.00 0.00 H new ATOM 0 HA MET A 123 -2.601 16.122 -3.754 1.00 0.00 H new ATOM 0 HB2 MET A 123 -1.788 13.873 -4.486 1.00 0.00 H new ATOM 0 HB3 MET A 123 -0.820 14.640 -3.242 1.00 0.00 H new ATOM 0 HG2 MET A 123 -1.020 12.813 -1.976 1.00 0.00 H new ATOM 0 HG3 MET A 123 -2.749 13.083 -1.868 1.00 0.00 H new ATOM 0 HE1 MET A 123 -3.841 11.174 -5.258 1.00 0.00 H new ATOM 0 HE2 MET A 123 -4.384 12.322 -4.011 1.00 0.00 H new ATOM 0 HE3 MET A 123 -3.179 12.826 -5.220 1.00 0.00 H new ATOM 2049 N LEU A 124 -5.040 14.121 -2.941 1.00 0.00 N ATOM 2050 CA LEU A 124 -6.350 13.634 -3.363 1.00 0.00 C ATOM 2051 C LEU A 124 -7.236 14.804 -3.768 1.00 0.00 C ATOM 2052 O LEU A 124 -7.803 14.824 -4.863 1.00 0.00 O ATOM 2053 CB LEU A 124 -7.020 12.848 -2.232 1.00 0.00 C ATOM 2054 CG LEU A 124 -7.919 11.693 -2.684 1.00 0.00 C ATOM 2055 CD1 LEU A 124 -7.239 10.356 -2.441 1.00 0.00 C ATOM 2056 CD2 LEU A 124 -9.260 11.752 -1.967 1.00 0.00 C ATOM 0 H LEU A 124 -4.821 13.950 -1.960 1.00 0.00 H new ATOM 0 HA LEU A 124 -6.213 12.972 -4.218 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -6.244 12.449 -1.579 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -7.615 13.538 -1.634 1.00 0.00 H new ATOM 0 HG LEU A 124 -8.096 11.794 -3.755 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -7.895 9.549 -2.769 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -6.305 10.315 -3.002 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -7.029 10.243 -1.378 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -9.887 10.925 -2.299 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -9.101 11.677 -0.891 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -9.754 12.696 -2.196 1.00 0.00 H new ATOM 2068 N GLN A 125 -7.343 15.783 -2.875 1.00 0.00 N ATOM 2069 CA GLN A 125 -8.154 16.970 -3.129 1.00 0.00 C ATOM 2070 C GLN A 125 -7.763 17.617 -4.452 1.00 0.00 C ATOM 2071 O GLN A 125 -8.622 18.026 -5.232 1.00 0.00 O ATOM 2072 CB GLN A 125 -7.992 17.977 -1.988 1.00 0.00 C ATOM 2073 CG GLN A 125 -8.387 17.425 -0.627 1.00 0.00 C ATOM 2074 CD GLN A 125 -9.887 17.418 -0.415 1.00 0.00 C ATOM 2075 OE1 GLN A 125 -10.484 18.442 -0.082 1.00 0.00 O ATOM 2076 NE2 GLN A 125 -10.507 16.260 -0.604 1.00 0.00 N ATOM 0 H GLN A 125 -6.878 15.778 -1.967 1.00 0.00 H new ATOM 0 HA GLN A 125 -9.198 16.663 -3.187 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -6.953 18.306 -1.950 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -8.597 18.857 -2.203 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -8.005 16.409 -0.526 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -7.916 18.022 0.154 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -9.974 15.435 -0.880 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -11.517 16.195 -0.474 1.00 0.00 H new ATOM 2085 N ASN A 126 -6.461 17.698 -4.697 1.00 0.00 N ATOM 2086 CA ASN A 126 -5.956 18.288 -5.931 1.00 0.00 C ATOM 2087 C ASN A 126 -6.071 17.301 -7.085 1.00 0.00 C ATOM 2088 O ASN A 126 -6.260 17.694 -8.237 1.00 0.00 O ATOM 2089 CB ASN A 126 -4.500 18.727 -5.759 1.00 0.00 C ATOM 2090 CG ASN A 126 -4.367 19.973 -4.906 1.00 0.00 C ATOM 2091 OD1 ASN A 126 -4.115 21.064 -5.418 1.00 0.00 O ATOM 2092 ND2 ASN A 126 -4.536 19.815 -3.599 1.00 0.00 N ATOM 0 H ASN A 126 -5.738 17.364 -4.060 1.00 0.00 H new ATOM 0 HA ASN A 126 -6.562 19.164 -6.161 1.00 0.00 H new ATOM 0 HB2 ASN A 126 -3.931 17.916 -5.304 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -4.062 18.913 -6.739 1.00 0.00 H new ATOM 0 HD21 ASN A 126 -4.458 20.617 -2.974 1.00 0.00 H new ATOM 0 HD22 ASN A 126 -4.744 18.891 -3.220 1.00 0.00 H new ATOM 2099 N LEU A 127 -5.969 16.018 -6.767 1.00 0.00 N ATOM 2100 CA LEU A 127 -6.076 14.970 -7.768 1.00 0.00 C ATOM 2101 C LEU A 127 -7.534 14.765 -8.175 1.00 0.00 C ATOM 2102 O LEU A 127 -7.825 14.025 -9.116 1.00 0.00 O ATOM 2103 CB LEU A 127 -5.482 13.672 -7.217 1.00 0.00 C ATOM 2104 CG LEU A 127 -5.886 12.400 -7.957 1.00 0.00 C ATOM 2105 CD1 LEU A 127 -4.756 11.383 -7.917 1.00 0.00 C ATOM 2106 CD2 LEU A 127 -7.154 11.821 -7.351 1.00 0.00 C ATOM 0 H LEU A 127 -5.811 15.678 -5.818 1.00 0.00 H new ATOM 0 HA LEU A 127 -5.517 15.266 -8.656 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -4.395 13.753 -7.236 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -5.776 13.573 -6.172 1.00 0.00 H new ATOM 0 HG LEU A 127 -6.085 12.648 -9.000 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -5.059 10.481 -8.449 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -3.870 11.804 -8.393 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -4.528 11.134 -6.881 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -7.432 10.914 -7.887 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -6.980 11.583 -6.302 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -7.960 12.550 -7.429 1.00 0.00 H new ATOM 2118 N LEU A 128 -8.447 15.425 -7.465 1.00 0.00 N ATOM 2119 CA LEU A 128 -9.871 15.312 -7.759 1.00 0.00 C ATOM 2120 C LEU A 128 -10.309 16.356 -8.787 1.00 0.00 C ATOM 2121 O LEU A 128 -11.423 16.297 -9.307 1.00 0.00 O ATOM 2122 CB LEU A 128 -10.692 15.468 -6.479 1.00 0.00 C ATOM 2123 CG LEU A 128 -10.624 14.281 -5.517 1.00 0.00 C ATOM 2124 CD1 LEU A 128 -10.719 14.756 -4.074 1.00 0.00 C ATOM 2125 CD2 LEU A 128 -11.729 13.283 -5.826 1.00 0.00 C ATOM 0 H LEU A 128 -8.225 16.042 -6.684 1.00 0.00 H new ATOM 0 HA LEU A 128 -10.047 14.322 -8.180 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -10.352 16.361 -5.954 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -11.734 15.636 -6.752 1.00 0.00 H new ATOM 0 HG LEU A 128 -9.663 13.783 -5.650 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -10.669 13.897 -3.404 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -9.892 15.433 -3.859 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -11.664 15.278 -3.924 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -11.666 12.444 -5.132 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -12.699 13.770 -5.720 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -11.615 12.919 -6.847 1.00 0.00 H new ATOM 2137 N LYS A 129 -9.429 17.312 -9.079 1.00 0.00 N ATOM 2138 CA LYS A 129 -9.731 18.363 -10.045 1.00 0.00 C ATOM 2139 C LYS A 129 -10.144 17.770 -11.389 1.00 0.00 C ATOM 2140 O LYS A 129 -11.323 17.928 -11.769 1.00 0.00 O ATOM 2141 CB LYS A 129 -8.519 19.279 -10.230 1.00 0.00 C ATOM 2142 CG LYS A 129 -8.023 19.905 -8.936 1.00 0.00 C ATOM 2143 CD LYS A 129 -8.875 21.096 -8.529 1.00 0.00 C ATOM 2144 CE LYS A 129 -8.017 22.290 -8.140 1.00 0.00 C ATOM 2145 NZ LYS A 129 -8.806 23.552 -8.099 1.00 0.00 N ATOM 2146 OXT LYS A 129 -9.283 17.152 -12.050 1.00 0.00 O ATOM 0 H LYS A 129 -8.502 17.379 -8.660 1.00 0.00 H new ATOM 0 HA LYS A 129 -10.565 18.947 -9.656 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -7.708 18.707 -10.681 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -8.778 20.072 -10.931 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -8.036 19.159 -8.142 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -6.987 20.222 -9.058 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -9.532 21.373 -9.353 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -9.514 20.818 -7.691 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -7.568 22.111 -7.163 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -7.199 22.396 -8.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -8.185 24.341 -7.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -9.214 23.737 -9.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -9.571 23.460 -7.401 1.00 0.00 H new TER 2160 LYS A 129