USER MOD reduce.3.24.130724 H: found=0, std=0, add=1128, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1128 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 NoAdj-H: A 34 HIS HE2 : A 34 HIS NE2 : A 201 ZNZN :(H bumps) USER MOD NoAdj-H: A 122 HIS HD1 : A 122 HIS ND1 : A 201 ZNZN :(H bumps) USER MOD Set 1.1: A 73 ASN : amide:sc= -4.45! C(o=-5.6!,f=-7.2!) USER MOD Set 1.2: A 113 THR OG1 : rot 21:sc= -1.15! USER MOD Set 2.1: A 79 HIS : no HE2:sc= -6.65! C(o=-6.7!,f=-10!) USER MOD Set 2.2: A 83 MET CE :methyl -117:sc= -0.584 (180deg=-0.56) USER MOD Set 2.3: A 85 THR OG1 : rot 120:sc= -0.243 USER MOD Set 2.4: A 145 TYR OH : rot -158:sc= 0.805 USER MOD Set 3.1: A 45 THR OG1 : rot 96:sc= 1.24 USER MOD Set 3.2: A 110 THR OG1 : rot 132:sc= 0.516 USER MOD Set 4.1: A 21 THR OG1 : rot 180:sc= 0.195 USER MOD Set 4.2: A 23 ASN : amide:sc= -0.733 X(o=-0.54,f=-1) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 144:sc= 0.0172 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 HIS : no HD1:sc= -0.0401 X(o=-0.04,f=-0.1) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 9 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -31:sc= 0.754 USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc= -0.0098 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= -0.0478 USER MOD Single : A 29 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 TYR OH : rot 180:sc= -0.474 USER MOD Single : A 52 ASN : amide:sc= -3.63! K(o=-3.6!,f=-1.3) USER MOD Single : A 54 THR OG1 : rot 180:sc= -0.0514 USER MOD Single : A 56 LYS NZ :NH3+ 151:sc= 0 (180deg=-0.938) USER MOD Single : A 60 ASN : amide:sc= -3.54! K(o=-3.5!,f=-0.27) USER MOD Single : A 63 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 HIS : no HE2:sc= -5.04! C(o=-5!,f=-6.6!) USER MOD Single : A 67 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= -0.106 X(o=-0.11,f=-0.11) USER MOD Single : A 84 HIS : no HD1:sc= -2.15! C(o=-2.1!,f=-1.7!) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 HIS : no HD1:sc= -0.176 X(o=-0.18,f=-0.37) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot -46:sc= 0.00162 USER MOD Single : A 96 SER OG : rot 180:sc=-0.000202 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0.0215 USER MOD Single : A 99 SER OG : rot -139:sc= -0.661 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.0141 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN : amide:sc= -8.14! K(o=-8.1!,f=-1.6) USER MOD Single : A 105 GLN : amide:sc= -1.21 K(o=-1.2,f=0) USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 THR OG1 : rot -30:sc= 0.733 USER MOD Single : A 120 HIS : no HD1:sc= -1.69 K(o=-1.7,f=-0.16) USER MOD Single : A 125 MET CE :methyl 145:sc= -1.89 (180deg=-2.29) USER MOD Single : A 129 ASN : amide:sc= -0.577 X(o=-0.58,f=-0.58) USER MOD Single : A 131 ASN : amide:sc= -0.171 K(o=-0.17,f=-1.2) USER MOD Single : A 133 GLN : amide:sc= -6.55! K(o=-6.6!,f=-3) USER MOD Single : A 134 ASN : amide:sc= -0.292 X(o=-0.29,f=0) USER MOD Single : A 137 SER OG : rot -42:sc= 0.418 USER MOD Single : A 143 THR OG1 : rot 180:sc= -0.107 USER MOD Single : A 148 ASN : amide:sc= 0.55 K(o=0.55,f=0.012) USER MOD Single : A 153 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 155 THR OG1 : rot 48:sc= 0.184 USER MOD Single : A 156 THR OG1 : rot 180:sc= 0 USER MOD Single : A 158 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -6.448 -32.438 -21.799 1.00 0.00 N ATOM 2 CA MET A 1 -6.917 -31.036 -21.963 1.00 0.00 C ATOM 3 C MET A 1 -5.749 -30.100 -22.254 1.00 0.00 C ATOM 4 O MET A 1 -4.658 -30.266 -21.701 1.00 0.00 O ATOM 5 CB MET A 1 -7.656 -30.569 -20.706 1.00 0.00 C ATOM 6 CG MET A 1 -9.067 -31.124 -20.585 1.00 0.00 C ATOM 7 SD MET A 1 -9.903 -30.577 -19.084 1.00 0.00 S ATOM 8 CE MET A 1 -11.536 -31.267 -19.334 1.00 0.00 C ATOM 0 H1 MET A 1 -7.016 -32.911 -21.067 1.00 0.00 H new ATOM 0 H2 MET A 1 -6.552 -32.947 -22.700 1.00 0.00 H new ATOM 0 H3 MET A 1 -5.448 -32.438 -21.515 1.00 0.00 H new ATOM 0 HA MET A 1 -7.602 -31.009 -22.810 1.00 0.00 H new ATOM 0 HB2 MET A 1 -7.082 -30.864 -19.827 1.00 0.00 H new ATOM 0 HB3 MET A 1 -7.702 -29.480 -20.706 1.00 0.00 H new ATOM 0 HG2 MET A 1 -9.650 -30.816 -21.453 1.00 0.00 H new ATOM 0 HG3 MET A 1 -9.027 -32.213 -20.597 1.00 0.00 H new ATOM 0 HE1 MET A 1 -12.172 -31.013 -18.486 1.00 0.00 H new ATOM 0 HE2 MET A 1 -11.968 -30.857 -20.247 1.00 0.00 H new ATOM 0 HE3 MET A 1 -11.463 -32.351 -19.421 1.00 0.00 H new ATOM 20 N ARG A 2 -5.996 -29.119 -23.127 1.00 0.00 N ATOM 21 CA ARG A 2 -4.976 -28.136 -23.515 1.00 0.00 C ATOM 22 C ARG A 2 -5.263 -26.762 -22.895 1.00 0.00 C ATOM 23 O ARG A 2 -4.354 -26.115 -22.364 1.00 0.00 O ATOM 24 CB ARG A 2 -4.865 -28.035 -25.054 1.00 0.00 C ATOM 25 CG ARG A 2 -6.191 -27.805 -25.794 1.00 0.00 C ATOM 26 CD ARG A 2 -6.194 -26.490 -26.562 1.00 0.00 C ATOM 27 NE ARG A 2 -5.380 -26.557 -27.782 1.00 0.00 N ATOM 28 CZ ARG A 2 -5.047 -25.500 -28.538 1.00 0.00 C ATOM 29 NH1 ARG A 2 -5.446 -24.270 -28.221 1.00 0.00 N ATOM 30 NH2 ARG A 2 -4.309 -25.681 -29.625 1.00 0.00 N ATOM 0 H ARG A 2 -6.899 -28.983 -23.582 1.00 0.00 H new ATOM 0 HA ARG A 2 -4.017 -28.481 -23.128 1.00 0.00 H new ATOM 0 HB2 ARG A 2 -4.185 -27.220 -25.300 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -4.412 -28.952 -25.430 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -6.368 -28.629 -26.485 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -7.012 -27.808 -25.077 1.00 0.00 H new ATOM 0 HD2 ARG A 2 -7.219 -26.228 -26.825 1.00 0.00 H new ATOM 0 HD3 ARG A 2 -5.817 -25.695 -25.919 1.00 0.00 H new ATOM 0 HE ARG A 2 -5.043 -27.474 -28.076 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -6.016 -24.117 -27.389 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -5.181 -23.480 -28.810 1.00 0.00 H new ATOM 0 HH21 ARG A 2 -3.999 -26.619 -29.881 1.00 0.00 H new ATOM 0 HH22 ARG A 2 -4.051 -24.883 -30.205 1.00 0.00 H new ATOM 44 N GLY A 3 -6.530 -26.332 -22.968 1.00 0.00 N ATOM 45 CA GLY A 3 -6.930 -25.045 -22.417 1.00 0.00 C ATOM 46 C GLY A 3 -7.483 -24.104 -23.471 1.00 0.00 C ATOM 47 O GLY A 3 -7.143 -24.221 -24.652 1.00 0.00 O ATOM 0 H GLY A 3 -7.287 -26.859 -23.403 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -7.683 -25.203 -21.645 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -6.072 -24.579 -21.934 1.00 0.00 H new ATOM 51 N SER A 4 -8.337 -23.174 -23.035 1.00 0.00 N ATOM 52 CA SER A 4 -8.952 -22.196 -23.931 1.00 0.00 C ATOM 53 C SER A 4 -8.517 -20.780 -23.566 1.00 0.00 C ATOM 54 O SER A 4 -8.552 -20.398 -22.392 1.00 0.00 O ATOM 55 CB SER A 4 -10.477 -22.306 -23.876 1.00 0.00 C ATOM 56 OG SER A 4 -10.912 -23.577 -24.326 1.00 0.00 O ATOM 0 H SER A 4 -8.619 -23.079 -22.059 1.00 0.00 H new ATOM 0 HA SER A 4 -8.619 -22.410 -24.947 1.00 0.00 H new ATOM 0 HB2 SER A 4 -10.820 -22.141 -22.855 1.00 0.00 H new ATOM 0 HB3 SER A 4 -10.924 -21.526 -24.492 1.00 0.00 H new ATOM 0 HG SER A 4 -11.890 -23.623 -24.280 1.00 0.00 H new ATOM 62 N HIS A 5 -8.108 -20.015 -24.581 1.00 0.00 N ATOM 63 CA HIS A 5 -7.655 -18.635 -24.389 1.00 0.00 C ATOM 64 C HIS A 5 -8.645 -17.635 -24.994 1.00 0.00 C ATOM 65 O HIS A 5 -8.931 -17.679 -26.195 1.00 0.00 O ATOM 66 CB HIS A 5 -6.245 -18.430 -24.984 1.00 0.00 C ATOM 67 CG HIS A 5 -6.073 -18.938 -26.390 1.00 0.00 C ATOM 68 ND1 HIS A 5 -6.245 -18.142 -27.504 1.00 0.00 N ATOM 69 CD2 HIS A 5 -5.744 -20.166 -26.855 1.00 0.00 C ATOM 70 CE1 HIS A 5 -6.030 -18.861 -28.592 1.00 0.00 C ATOM 71 NE2 HIS A 5 -5.725 -20.091 -28.225 1.00 0.00 N ATOM 0 H HIS A 5 -8.081 -20.331 -25.551 1.00 0.00 H new ATOM 0 HA HIS A 5 -7.605 -18.451 -23.316 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -6.010 -17.366 -24.966 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -5.519 -18.928 -24.341 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -5.535 -21.042 -26.259 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -6.093 -18.503 -29.609 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -5.510 -20.862 -28.858 1.00 0.00 H new ATOM 80 N HIS A 6 -9.161 -16.740 -24.143 1.00 0.00 N ATOM 81 CA HIS A 6 -10.116 -15.713 -24.566 1.00 0.00 C ATOM 82 C HIS A 6 -9.731 -14.349 -24.002 1.00 0.00 C ATOM 83 O HIS A 6 -9.271 -14.250 -22.861 1.00 0.00 O ATOM 84 CB HIS A 6 -11.535 -16.075 -24.116 1.00 0.00 C ATOM 85 CG HIS A 6 -12.150 -17.195 -24.898 1.00 0.00 C ATOM 86 ND1 HIS A 6 -12.500 -17.082 -26.228 1.00 0.00 N ATOM 87 CD2 HIS A 6 -12.482 -18.456 -24.531 1.00 0.00 C ATOM 88 CE1 HIS A 6 -13.021 -18.223 -26.643 1.00 0.00 C ATOM 89 NE2 HIS A 6 -13.020 -19.072 -25.633 1.00 0.00 N ATOM 0 H HIS A 6 -8.930 -16.708 -23.150 1.00 0.00 H new ATOM 0 HA HIS A 6 -10.091 -15.664 -25.655 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -11.513 -16.350 -23.061 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -12.170 -15.193 -24.202 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -12.348 -18.895 -23.553 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -13.386 -18.426 -27.639 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -13.364 -20.032 -25.666 1.00 0.00 H new ATOM 98 N HIS A 7 -9.924 -13.306 -24.816 1.00 0.00 N ATOM 99 CA HIS A 7 -9.611 -11.934 -24.416 1.00 0.00 C ATOM 100 C HIS A 7 -10.811 -11.018 -24.651 1.00 0.00 C ATOM 101 O HIS A 7 -11.240 -10.819 -25.793 1.00 0.00 O ATOM 102 CB HIS A 7 -8.387 -11.416 -25.184 1.00 0.00 C ATOM 103 CG HIS A 7 -7.098 -12.054 -24.766 1.00 0.00 C ATOM 104 ND1 HIS A 7 -6.250 -11.495 -23.832 1.00 0.00 N ATOM 105 CD2 HIS A 7 -6.511 -13.208 -25.161 1.00 0.00 C ATOM 106 CE1 HIS A 7 -5.197 -12.278 -23.672 1.00 0.00 C ATOM 107 NE2 HIS A 7 -5.332 -13.324 -24.466 1.00 0.00 N ATOM 0 H HIS A 7 -10.298 -13.389 -25.761 1.00 0.00 H new ATOM 0 HA HIS A 7 -9.379 -11.933 -23.351 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -8.538 -11.588 -26.250 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -8.311 -10.338 -25.043 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -6.898 -13.907 -25.887 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -4.368 -12.093 -23.005 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -4.668 -14.094 -24.550 1.00 0.00 H new ATOM 116 N HIS A 8 -11.353 -10.473 -23.554 1.00 0.00 N ATOM 117 CA HIS A 8 -12.513 -9.578 -23.617 1.00 0.00 C ATOM 118 C HIS A 8 -12.339 -8.373 -22.688 1.00 0.00 C ATOM 119 O HIS A 8 -12.648 -7.241 -23.074 1.00 0.00 O ATOM 120 CB HIS A 8 -13.794 -10.341 -23.253 1.00 0.00 C ATOM 121 CG HIS A 8 -14.945 -10.048 -24.165 1.00 0.00 C ATOM 122 ND1 HIS A 8 -15.119 -10.677 -25.381 1.00 0.00 N ATOM 123 CD2 HIS A 8 -15.985 -9.190 -24.036 1.00 0.00 C ATOM 124 CE1 HIS A 8 -16.214 -10.217 -25.960 1.00 0.00 C ATOM 125 NE2 HIS A 8 -16.757 -9.315 -25.165 1.00 0.00 N ATOM 0 H HIS A 8 -11.004 -10.638 -22.610 1.00 0.00 H new ATOM 0 HA HIS A 8 -12.594 -9.208 -24.639 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -13.588 -11.411 -23.274 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -14.078 -10.091 -22.231 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -16.172 -8.531 -23.201 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -16.599 -10.527 -26.920 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -17.613 -8.794 -25.358 1.00 0.00 H new ATOM 134 N HIS A 9 -11.845 -8.627 -21.468 1.00 0.00 N ATOM 135 CA HIS A 9 -11.630 -7.571 -20.476 1.00 0.00 C ATOM 136 C HIS A 9 -10.157 -7.448 -20.102 1.00 0.00 C ATOM 137 O HIS A 9 -9.424 -8.441 -20.102 1.00 0.00 O ATOM 138 CB HIS A 9 -12.458 -7.845 -19.220 1.00 0.00 C ATOM 139 CG HIS A 9 -13.886 -7.416 -19.338 1.00 0.00 C ATOM 140 ND1 HIS A 9 -14.875 -8.219 -19.867 1.00 0.00 N ATOM 141 CD2 HIS A 9 -14.493 -6.257 -18.986 1.00 0.00 C ATOM 142 CE1 HIS A 9 -16.027 -7.574 -19.836 1.00 0.00 C ATOM 143 NE2 HIS A 9 -15.822 -6.382 -19.306 1.00 0.00 N ATOM 0 H HIS A 9 -11.587 -9.560 -21.146 1.00 0.00 H new ATOM 0 HA HIS A 9 -11.949 -6.630 -20.923 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -12.425 -8.912 -18.999 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -12.001 -7.330 -18.375 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -14.020 -5.396 -18.538 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -16.975 -7.956 -20.185 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -16.536 -5.669 -19.158 1.00 0.00 H new ATOM 152 N HIS A 10 -9.745 -6.220 -19.771 1.00 0.00 N ATOM 153 CA HIS A 10 -8.360 -5.928 -19.385 1.00 0.00 C ATOM 154 C HIS A 10 -8.239 -5.800 -17.867 1.00 0.00 C ATOM 155 O HIS A 10 -9.126 -5.240 -17.216 1.00 0.00 O ATOM 156 CB HIS A 10 -7.885 -4.635 -20.056 1.00 0.00 C ATOM 157 CG HIS A 10 -7.653 -4.775 -21.529 1.00 0.00 C ATOM 158 ND1 HIS A 10 -8.660 -4.660 -22.465 1.00 0.00 N ATOM 159 CD2 HIS A 10 -6.521 -5.033 -22.227 1.00 0.00 C ATOM 160 CE1 HIS A 10 -8.158 -4.842 -23.674 1.00 0.00 C ATOM 161 NE2 HIS A 10 -6.862 -5.069 -23.556 1.00 0.00 N ATOM 0 H HIS A 10 -10.358 -5.405 -19.763 1.00 0.00 H new ATOM 0 HA HIS A 10 -7.731 -6.754 -19.716 1.00 0.00 H new ATOM 0 HB2 HIS A 10 -8.626 -3.854 -19.886 1.00 0.00 H new ATOM 0 HB3 HIS A 10 -6.961 -4.307 -19.580 1.00 0.00 H new ATOM 0 HD2 HIS A 10 -5.534 -5.182 -21.815 1.00 0.00 H new ATOM 0 HE1 HIS A 10 -8.713 -4.811 -24.600 1.00 0.00 H new ATOM 0 HE2 HIS A 10 -6.219 -5.243 -24.328 1.00 0.00 H new ATOM 170 N GLY A 11 -7.141 -6.330 -17.315 1.00 0.00 N ATOM 171 CA GLY A 11 -6.909 -6.271 -15.879 1.00 0.00 C ATOM 172 C GLY A 11 -6.167 -7.488 -15.358 1.00 0.00 C ATOM 173 O GLY A 11 -6.683 -8.212 -14.501 1.00 0.00 O ATOM 0 H GLY A 11 -6.406 -6.801 -17.843 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -6.338 -5.373 -15.643 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -7.865 -6.185 -15.363 1.00 0.00 H new ATOM 177 N SER A 12 -4.956 -7.706 -15.881 1.00 0.00 N ATOM 178 CA SER A 12 -4.118 -8.842 -15.483 1.00 0.00 C ATOM 179 C SER A 12 -3.136 -8.475 -14.386 1.00 0.00 C ATOM 180 O SER A 12 -2.901 -7.293 -14.112 1.00 0.00 O ATOM 181 CB SER A 12 -3.303 -9.354 -16.664 1.00 0.00 C ATOM 182 OG SER A 12 -3.934 -10.454 -17.296 1.00 0.00 O ATOM 0 H SER A 12 -4.531 -7.105 -16.587 1.00 0.00 H new ATOM 0 HA SER A 12 -4.804 -9.607 -15.119 1.00 0.00 H new ATOM 0 HB2 SER A 12 -3.163 -8.550 -17.386 1.00 0.00 H new ATOM 0 HB3 SER A 12 -2.312 -9.650 -16.321 1.00 0.00 H new ATOM 0 HG SER A 12 -3.386 -10.757 -18.050 1.00 0.00 H new ATOM 188 N ALA A 13 -2.573 -9.515 -13.751 1.00 0.00 N ATOM 189 CA ALA A 13 -1.566 -9.355 -12.725 1.00 0.00 C ATOM 190 C ALA A 13 -0.762 -10.645 -12.560 1.00 0.00 C ATOM 191 O ALA A 13 -1.294 -11.671 -12.120 1.00 0.00 O ATOM 192 CB ALA A 13 -2.177 -8.918 -11.396 1.00 0.00 C ATOM 0 H ALA A 13 -2.813 -10.487 -13.945 1.00 0.00 H new ATOM 0 HA ALA A 13 -0.889 -8.563 -13.044 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -1.388 -8.809 -10.651 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -2.687 -7.964 -11.527 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -2.892 -9.669 -11.060 1.00 0.00 H new ATOM 198 N THR A 14 0.525 -10.578 -12.921 1.00 0.00 N ATOM 199 CA THR A 14 1.430 -11.720 -12.845 1.00 0.00 C ATOM 200 C THR A 14 2.149 -11.814 -11.483 1.00 0.00 C ATOM 201 O THR A 14 3.019 -12.671 -11.293 1.00 0.00 O ATOM 202 CB THR A 14 2.461 -11.692 -14.016 1.00 0.00 C ATOM 203 OG1 THR A 14 3.259 -12.883 -14.002 1.00 0.00 O ATOM 204 CG2 THR A 14 3.378 -10.465 -13.972 1.00 0.00 C ATOM 0 H THR A 14 0.964 -9.728 -13.274 1.00 0.00 H new ATOM 0 HA THR A 14 0.817 -12.616 -12.942 1.00 0.00 H new ATOM 0 HB THR A 14 1.883 -11.636 -14.938 1.00 0.00 H new ATOM 0 HG1 THR A 14 3.361 -13.198 -13.080 1.00 0.00 H new ATOM 0 HG21 THR A 14 4.073 -10.500 -14.811 1.00 0.00 H new ATOM 0 HG22 THR A 14 2.776 -9.559 -14.037 1.00 0.00 H new ATOM 0 HG23 THR A 14 3.938 -10.462 -13.037 1.00 0.00 H new ATOM 212 N TYR A 15 1.767 -10.937 -10.547 1.00 0.00 N ATOM 213 CA TYR A 15 2.359 -10.899 -9.230 1.00 0.00 C ATOM 214 C TYR A 15 1.474 -11.560 -8.210 1.00 0.00 C ATOM 215 O TYR A 15 0.258 -11.349 -8.178 1.00 0.00 O ATOM 216 CB TYR A 15 2.687 -9.475 -8.830 1.00 0.00 C ATOM 217 CG TYR A 15 4.175 -9.189 -8.783 1.00 0.00 C ATOM 218 CD1 TYR A 15 4.974 -9.707 -7.766 1.00 0.00 C ATOM 219 CD2 TYR A 15 4.783 -8.404 -9.754 1.00 0.00 C ATOM 220 CE1 TYR A 15 6.330 -9.450 -7.721 1.00 0.00 C ATOM 221 CE2 TYR A 15 6.140 -8.142 -9.715 1.00 0.00 C ATOM 222 CZ TYR A 15 6.908 -8.668 -8.698 1.00 0.00 C ATOM 223 OH TYR A 15 8.259 -8.408 -8.656 1.00 0.00 O ATOM 0 H TYR A 15 1.038 -10.239 -10.694 1.00 0.00 H new ATOM 0 HA TYR A 15 3.291 -11.464 -9.267 1.00 0.00 H new ATOM 0 HB2 TYR A 15 2.215 -8.790 -9.535 1.00 0.00 H new ATOM 0 HB3 TYR A 15 2.255 -9.272 -7.850 1.00 0.00 H new ATOM 0 HD1 TYR A 15 4.525 -10.321 -6.999 1.00 0.00 H new ATOM 0 HD2 TYR A 15 4.186 -7.991 -10.553 1.00 0.00 H new ATOM 0 HE1 TYR A 15 6.934 -9.859 -6.925 1.00 0.00 H new ATOM 0 HE2 TYR A 15 6.596 -7.528 -10.478 1.00 0.00 H new ATOM 0 HH TYR A 15 8.507 -7.843 -9.417 1.00 0.00 H new ATOM 233 N THR A 16 2.121 -12.357 -7.373 1.00 0.00 N ATOM 234 CA THR A 16 1.436 -13.114 -6.342 1.00 0.00 C ATOM 235 C THR A 16 1.419 -12.384 -4.988 1.00 0.00 C ATOM 236 O THR A 16 1.937 -11.269 -4.865 1.00 0.00 O ATOM 237 CB THR A 16 2.055 -14.523 -6.172 1.00 0.00 C ATOM 238 OG1 THR A 16 3.459 -14.420 -5.900 1.00 0.00 O ATOM 239 CG2 THR A 16 1.836 -15.384 -7.414 1.00 0.00 C ATOM 0 H THR A 16 3.131 -12.495 -7.391 1.00 0.00 H new ATOM 0 HA THR A 16 0.404 -13.217 -6.677 1.00 0.00 H new ATOM 0 HB THR A 16 1.555 -15.003 -5.331 1.00 0.00 H new ATOM 0 HG1 THR A 16 3.838 -15.317 -5.793 1.00 0.00 H new ATOM 0 HG21 THR A 16 2.283 -16.366 -7.260 1.00 0.00 H new ATOM 0 HG22 THR A 16 0.767 -15.497 -7.595 1.00 0.00 H new ATOM 0 HG23 THR A 16 2.301 -14.905 -8.276 1.00 0.00 H new ATOM 247 N ARG A 17 0.816 -13.036 -3.977 1.00 0.00 N ATOM 248 CA ARG A 17 0.686 -12.503 -2.629 1.00 0.00 C ATOM 249 C ARG A 17 1.994 -12.627 -1.817 1.00 0.00 C ATOM 250 O ARG A 17 2.413 -13.742 -1.487 1.00 0.00 O ATOM 251 CB ARG A 17 -0.432 -13.264 -1.908 1.00 0.00 C ATOM 252 CG ARG A 17 -1.488 -12.391 -1.237 1.00 0.00 C ATOM 253 CD ARG A 17 -2.895 -12.942 -1.458 1.00 0.00 C ATOM 254 NE ARG A 17 -3.004 -14.379 -1.157 1.00 0.00 N ATOM 255 CZ ARG A 17 -4.133 -14.997 -0.781 1.00 0.00 C ATOM 256 NH1 ARG A 17 -5.276 -14.324 -0.653 1.00 0.00 N ATOM 257 NH2 ARG A 17 -4.116 -16.299 -0.532 1.00 0.00 N ATOM 0 H ARG A 17 0.402 -13.962 -4.086 1.00 0.00 H new ATOM 0 HA ARG A 17 0.453 -11.441 -2.708 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -0.927 -13.916 -2.627 1.00 0.00 H new ATOM 0 HB3 ARG A 17 0.018 -13.907 -1.152 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -1.284 -12.329 -0.168 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -1.427 -11.377 -1.632 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -3.597 -12.391 -0.832 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -3.188 -12.770 -2.494 1.00 0.00 H new ATOM 0 HE ARG A 17 -2.160 -14.945 -1.241 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -5.302 -13.322 -0.842 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -6.125 -14.811 -0.366 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -3.247 -16.825 -0.627 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -4.972 -16.775 -0.246 1.00 0.00 H new ATOM 271 N PRO A 18 2.666 -11.484 -1.481 1.00 0.00 N ATOM 272 CA PRO A 18 3.901 -11.495 -0.663 1.00 0.00 C ATOM 273 C PRO A 18 3.638 -11.939 0.780 1.00 0.00 C ATOM 274 O PRO A 18 4.544 -12.418 1.468 1.00 0.00 O ATOM 275 CB PRO A 18 4.364 -10.031 -0.666 1.00 0.00 C ATOM 276 CG PRO A 18 3.622 -9.375 -1.780 1.00 0.00 C ATOM 277 CD PRO A 18 2.323 -10.113 -1.914 1.00 0.00 C ATOM 0 HA PRO A 18 4.634 -12.194 -1.066 1.00 0.00 H new ATOM 0 HB2 PRO A 18 4.145 -9.549 0.287 1.00 0.00 H new ATOM 0 HB3 PRO A 18 5.441 -9.961 -0.819 1.00 0.00 H new ATOM 0 HG2 PRO A 18 3.449 -8.321 -1.564 1.00 0.00 H new ATOM 0 HG3 PRO A 18 4.193 -9.421 -2.707 1.00 0.00 H new ATOM 0 HD2 PRO A 18 1.545 -9.676 -1.288 1.00 0.00 H new ATOM 0 HD3 PRO A 18 1.954 -10.095 -2.939 1.00 0.00 H new ATOM 285 N LEU A 19 2.381 -11.776 1.214 1.00 0.00 N ATOM 286 CA LEU A 19 1.945 -12.137 2.544 1.00 0.00 C ATOM 287 C LEU A 19 0.615 -12.844 2.490 1.00 0.00 C ATOM 288 O LEU A 19 0.085 -13.183 1.427 1.00 0.00 O ATOM 289 CB LEU A 19 1.776 -10.893 3.437 1.00 0.00 C ATOM 290 CG LEU A 19 2.620 -10.779 4.721 1.00 0.00 C ATOM 291 CD1 LEU A 19 2.139 -11.762 5.789 1.00 0.00 C ATOM 292 CD2 LEU A 19 4.103 -10.986 4.446 1.00 0.00 C ATOM 0 H LEU A 19 1.639 -11.384 0.634 1.00 0.00 H new ATOM 0 HA LEU A 19 2.711 -12.790 2.962 1.00 0.00 H new ATOM 0 HB2 LEU A 19 1.987 -10.016 2.825 1.00 0.00 H new ATOM 0 HB3 LEU A 19 0.727 -10.835 3.726 1.00 0.00 H new ATOM 0 HG LEU A 19 2.487 -9.764 5.096 1.00 0.00 H new ATOM 0 HD11 LEU A 19 2.754 -11.658 6.683 1.00 0.00 H new ATOM 0 HD12 LEU A 19 1.099 -11.550 6.037 1.00 0.00 H new ATOM 0 HD13 LEU A 19 2.221 -12.780 5.409 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.662 -10.897 5.378 1.00 0.00 H new ATOM 0 HD22 LEU A 19 4.259 -11.978 4.022 1.00 0.00 H new ATOM 0 HD23 LEU A 19 4.451 -10.231 3.741 1.00 0.00 H new ATOM 304 N ASP A 20 0.111 -13.037 3.676 1.00 0.00 N ATOM 305 CA ASP A 20 -1.171 -13.635 3.924 1.00 0.00 C ATOM 306 C ASP A 20 -1.959 -12.732 4.847 1.00 0.00 C ATOM 307 O ASP A 20 -3.194 -12.748 4.860 1.00 0.00 O ATOM 308 CB ASP A 20 -1.017 -14.996 4.567 1.00 0.00 C ATOM 309 CG ASP A 20 -1.561 -16.117 3.705 1.00 0.00 C ATOM 310 OD1 ASP A 20 -2.756 -16.449 3.850 1.00 0.00 O ATOM 311 OD2 ASP A 20 -0.791 -16.664 2.889 1.00 0.00 O ATOM 0 H ASP A 20 0.601 -12.772 4.530 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.692 -13.760 2.975 1.00 0.00 H new ATOM 0 HB2 ASP A 20 0.038 -15.179 4.771 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -1.532 -14.999 5.528 1.00 0.00 H new ATOM 316 N THR A 21 -1.204 -11.936 5.618 1.00 0.00 N ATOM 317 CA THR A 21 -1.754 -11.022 6.597 1.00 0.00 C ATOM 318 C THR A 21 -0.683 -10.039 7.125 1.00 0.00 C ATOM 319 O THR A 21 0.389 -9.885 6.550 1.00 0.00 O ATOM 320 CB THR A 21 -2.449 -11.810 7.755 1.00 0.00 C ATOM 321 OG1 THR A 21 -3.284 -10.934 8.523 1.00 0.00 O ATOM 322 CG2 THR A 21 -1.452 -12.511 8.685 1.00 0.00 C ATOM 0 H THR A 21 -0.185 -11.918 5.569 1.00 0.00 H new ATOM 0 HA THR A 21 -2.515 -10.416 6.105 1.00 0.00 H new ATOM 0 HB THR A 21 -3.052 -12.585 7.282 1.00 0.00 H new ATOM 0 HG1 THR A 21 -3.714 -11.440 9.243 1.00 0.00 H new ATOM 0 HG21 THR A 21 -1.995 -13.040 9.468 1.00 0.00 H new ATOM 0 HG22 THR A 21 -0.857 -13.222 8.111 1.00 0.00 H new ATOM 0 HG23 THR A 21 -0.794 -11.770 9.138 1.00 0.00 H new ATOM 330 N GLY A 22 -1.052 -9.342 8.183 1.00 0.00 N ATOM 331 CA GLY A 22 -0.184 -8.401 8.875 1.00 0.00 C ATOM 332 C GLY A 22 -0.900 -7.741 10.040 1.00 0.00 C ATOM 333 O GLY A 22 -1.796 -6.922 9.833 1.00 0.00 O ATOM 0 H GLY A 22 -1.982 -9.414 8.596 1.00 0.00 H new ATOM 0 HA2 GLY A 22 0.703 -8.921 9.238 1.00 0.00 H new ATOM 0 HA3 GLY A 22 0.158 -7.637 8.176 1.00 0.00 H new ATOM 337 N ASN A 23 -0.479 -8.076 11.271 1.00 0.00 N ATOM 338 CA ASN A 23 -1.101 -7.542 12.487 1.00 0.00 C ATOM 339 C ASN A 23 -0.138 -7.481 13.643 1.00 0.00 C ATOM 340 O ASN A 23 0.458 -8.487 14.041 1.00 0.00 O ATOM 341 CB ASN A 23 -2.349 -8.363 12.873 1.00 0.00 C ATOM 342 CG ASN A 23 -2.127 -9.866 12.764 1.00 0.00 C ATOM 343 OD1 ASN A 23 -1.904 -10.550 13.763 1.00 0.00 O ATOM 344 ND2 ASN A 23 -2.170 -10.375 11.537 1.00 0.00 N ATOM 0 H ASN A 23 0.294 -8.718 11.447 1.00 0.00 H new ATOM 0 HA ASN A 23 -1.405 -6.520 12.262 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -2.638 -8.117 13.895 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -3.180 -8.076 12.229 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -2.015 -11.373 11.393 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -2.359 -9.768 10.739 1.00 0.00 H new ATOM 351 N ILE A 24 -0.026 -6.276 14.187 1.00 0.00 N ATOM 352 CA ILE A 24 0.833 -6.023 15.336 1.00 0.00 C ATOM 353 C ILE A 24 -0.029 -5.917 16.584 1.00 0.00 C ATOM 354 O ILE A 24 -0.032 -4.915 17.313 1.00 0.00 O ATOM 355 CB ILE A 24 1.688 -4.746 15.194 1.00 0.00 C ATOM 356 CG1 ILE A 24 1.786 -4.271 13.739 1.00 0.00 C ATOM 357 CG2 ILE A 24 3.080 -4.948 15.776 1.00 0.00 C ATOM 358 CD1 ILE A 24 0.573 -3.489 13.295 1.00 0.00 C ATOM 0 H ILE A 24 -0.524 -5.453 13.848 1.00 0.00 H new ATOM 0 HA ILE A 24 1.529 -6.859 15.405 1.00 0.00 H new ATOM 0 HB ILE A 24 1.180 -3.967 15.762 1.00 0.00 H new ATOM 0 HG12 ILE A 24 2.675 -3.651 13.623 1.00 0.00 H new ATOM 0 HG13 ILE A 24 1.914 -5.135 13.087 1.00 0.00 H new ATOM 0 HG21 ILE A 24 3.659 -4.032 15.661 1.00 0.00 H new ATOM 0 HG22 ILE A 24 2.999 -5.196 16.834 1.00 0.00 H new ATOM 0 HG23 ILE A 24 3.580 -5.761 15.250 1.00 0.00 H new ATOM 0 HD11 ILE A 24 0.699 -3.179 12.258 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -0.315 -4.115 13.381 1.00 0.00 H new ATOM 0 HD13 ILE A 24 0.458 -2.607 13.925 1.00 0.00 H new ATOM 370 N THR A 25 -0.731 -6.994 16.807 1.00 0.00 N ATOM 371 CA THR A 25 -1.629 -7.153 17.953 1.00 0.00 C ATOM 372 C THR A 25 -1.017 -8.077 19.009 1.00 0.00 C ATOM 373 O THR A 25 -1.296 -7.941 20.204 1.00 0.00 O ATOM 374 CB THR A 25 -3.021 -7.684 17.499 1.00 0.00 C ATOM 375 OG1 THR A 25 -3.881 -7.882 18.630 1.00 0.00 O ATOM 376 CG2 THR A 25 -2.923 -8.985 16.695 1.00 0.00 C ATOM 0 H THR A 25 -0.705 -7.809 16.195 1.00 0.00 H new ATOM 0 HA THR A 25 -1.769 -6.171 18.404 1.00 0.00 H new ATOM 0 HB THR A 25 -3.444 -6.922 16.844 1.00 0.00 H new ATOM 0 HG1 THR A 25 -4.751 -8.214 18.325 1.00 0.00 H new ATOM 0 HG21 THR A 25 -3.922 -9.309 16.405 1.00 0.00 H new ATOM 0 HG22 THR A 25 -2.322 -8.816 15.801 1.00 0.00 H new ATOM 0 HG23 THR A 25 -2.455 -9.756 17.307 1.00 0.00 H new ATOM 384 N THR A 26 -0.177 -9.000 18.543 1.00 0.00 N ATOM 385 CA THR A 26 0.485 -9.969 19.419 1.00 0.00 C ATOM 386 C THR A 26 1.998 -9.745 19.439 1.00 0.00 C ATOM 387 O THR A 26 2.567 -9.351 20.463 1.00 0.00 O ATOM 388 CB THR A 26 0.158 -11.429 18.990 1.00 0.00 C ATOM 389 OG1 THR A 26 -1.208 -11.523 18.565 1.00 0.00 O ATOM 390 CG2 THR A 26 0.391 -12.415 20.129 1.00 0.00 C ATOM 0 H THR A 26 0.063 -9.098 17.557 1.00 0.00 H new ATOM 0 HA THR A 26 0.102 -9.817 20.428 1.00 0.00 H new ATOM 0 HB THR A 26 0.826 -11.685 18.167 1.00 0.00 H new ATOM 0 HG1 THR A 26 -1.404 -12.445 18.295 1.00 0.00 H new ATOM 0 HG21 THR A 26 0.152 -13.424 19.792 1.00 0.00 H new ATOM 0 HG22 THR A 26 1.435 -12.374 20.438 1.00 0.00 H new ATOM 0 HG23 THR A 26 -0.248 -12.154 20.973 1.00 0.00 H new ATOM 398 N GLY A 27 2.617 -9.992 18.298 1.00 0.00 N ATOM 399 CA GLY A 27 4.058 -9.832 18.147 1.00 0.00 C ATOM 400 C GLY A 27 4.493 -9.915 16.699 1.00 0.00 C ATOM 401 O GLY A 27 4.269 -10.934 16.041 1.00 0.00 O ATOM 0 H GLY A 27 2.141 -10.307 17.453 1.00 0.00 H new ATOM 0 HA2 GLY A 27 4.361 -8.870 18.561 1.00 0.00 H new ATOM 0 HA3 GLY A 27 4.570 -10.603 18.723 1.00 0.00 H new ATOM 405 N PHE A 28 5.136 -8.845 16.211 1.00 0.00 N ATOM 406 CA PHE A 28 5.596 -8.764 14.827 1.00 0.00 C ATOM 407 C PHE A 28 6.827 -9.607 14.544 1.00 0.00 C ATOM 408 O PHE A 28 7.558 -9.996 15.458 1.00 0.00 O ATOM 409 CB PHE A 28 5.786 -7.311 14.393 1.00 0.00 C ATOM 410 CG PHE A 28 5.110 -7.013 13.075 1.00 0.00 C ATOM 411 CD1 PHE A 28 3.721 -7.008 12.958 1.00 0.00 C ATOM 412 CD2 PHE A 28 5.865 -6.772 11.943 1.00 0.00 C ATOM 413 CE1 PHE A 28 3.116 -6.766 11.739 1.00 0.00 C ATOM 414 CE2 PHE A 28 5.264 -6.525 10.727 1.00 0.00 C ATOM 415 CZ PHE A 28 3.889 -6.523 10.625 1.00 0.00 C ATOM 0 H PHE A 28 5.349 -8.016 16.766 1.00 0.00 H new ATOM 0 HA PHE A 28 4.804 -9.199 14.217 1.00 0.00 H new ATOM 0 HB2 PHE A 28 5.386 -6.649 15.162 1.00 0.00 H new ATOM 0 HB3 PHE A 28 6.851 -7.095 14.309 1.00 0.00 H new ATOM 0 HD1 PHE A 28 3.111 -7.195 13.829 1.00 0.00 H new ATOM 0 HD2 PHE A 28 6.943 -6.777 12.012 1.00 0.00 H new ATOM 0 HE1 PHE A 28 2.039 -6.767 11.660 1.00 0.00 H new ATOM 0 HE2 PHE A 28 5.870 -6.333 9.854 1.00 0.00 H new ATOM 0 HZ PHE A 28 3.418 -6.331 9.672 1.00 0.00 H new ATOM 425 N ASN A 29 6.979 -9.928 13.249 1.00 0.00 N ATOM 426 CA ASN A 29 8.039 -10.771 12.708 1.00 0.00 C ATOM 427 C ASN A 29 9.477 -10.304 12.989 1.00 0.00 C ATOM 428 O ASN A 29 10.394 -10.547 12.191 1.00 0.00 O ATOM 429 CB ASN A 29 7.812 -10.899 11.209 1.00 0.00 C ATOM 430 CG ASN A 29 6.617 -11.752 10.861 1.00 0.00 C ATOM 431 OD1 ASN A 29 6.680 -12.981 10.880 1.00 0.00 O ATOM 432 ND2 ASN A 29 5.523 -11.091 10.527 1.00 0.00 N ATOM 0 H ASN A 29 6.339 -9.591 12.529 1.00 0.00 H new ATOM 0 HA ASN A 29 7.968 -11.728 13.226 1.00 0.00 H new ATOM 0 HB2 ASN A 29 7.678 -9.905 10.782 1.00 0.00 H new ATOM 0 HB3 ASN A 29 8.702 -11.327 10.748 1.00 0.00 H new ATOM 0 HD21 ASN A 29 4.678 -11.601 10.269 1.00 0.00 H new ATOM 0 HD22 ASN A 29 5.523 -10.071 10.527 1.00 0.00 H new ATOM 439 N GLY A 30 9.664 -9.665 14.126 1.00 0.00 N ATOM 440 CA GLY A 30 10.977 -9.180 14.511 1.00 0.00 C ATOM 441 C GLY A 30 11.101 -7.697 14.289 1.00 0.00 C ATOM 442 O GLY A 30 12.145 -7.107 14.572 1.00 0.00 O ATOM 0 H GLY A 30 8.925 -9.469 14.801 1.00 0.00 H new ATOM 0 HA2 GLY A 30 11.157 -9.409 15.561 1.00 0.00 H new ATOM 0 HA3 GLY A 30 11.742 -9.701 13.935 1.00 0.00 H new ATOM 446 N TYR A 31 10.027 -7.112 13.751 1.00 0.00 N ATOM 447 CA TYR A 31 9.968 -5.666 13.504 1.00 0.00 C ATOM 448 C TYR A 31 9.126 -5.001 14.619 1.00 0.00 C ATOM 449 O TYR A 31 7.915 -4.806 14.448 1.00 0.00 O ATOM 450 CB TYR A 31 9.373 -5.346 12.113 1.00 0.00 C ATOM 451 CG TYR A 31 9.879 -6.216 10.970 1.00 0.00 C ATOM 452 CD1 TYR A 31 10.835 -5.736 10.085 1.00 0.00 C ATOM 453 CD2 TYR A 31 9.394 -7.509 10.770 1.00 0.00 C ATOM 454 CE1 TYR A 31 11.295 -6.513 9.038 1.00 0.00 C ATOM 455 CE2 TYR A 31 9.852 -8.289 9.725 1.00 0.00 C ATOM 456 CZ TYR A 31 10.800 -7.785 8.863 1.00 0.00 C ATOM 457 OH TYR A 31 11.255 -8.558 7.821 1.00 0.00 O ATOM 0 H TYR A 31 9.184 -7.618 13.477 1.00 0.00 H new ATOM 0 HA TYR A 31 10.983 -5.268 13.516 1.00 0.00 H new ATOM 0 HB2 TYR A 31 8.289 -5.444 12.169 1.00 0.00 H new ATOM 0 HB3 TYR A 31 9.587 -4.304 11.876 1.00 0.00 H new ATOM 0 HD1 TYR A 31 11.226 -4.738 10.217 1.00 0.00 H new ATOM 0 HD2 TYR A 31 8.649 -7.907 11.443 1.00 0.00 H new ATOM 0 HE1 TYR A 31 12.040 -6.123 8.360 1.00 0.00 H new ATOM 0 HE2 TYR A 31 9.468 -9.289 9.585 1.00 0.00 H new ATOM 0 HH TYR A 31 10.806 -9.429 7.839 1.00 0.00 H new ATOM 467 N PRO A 32 9.744 -4.648 15.796 1.00 0.00 N ATOM 468 CA PRO A 32 9.020 -4.037 16.926 1.00 0.00 C ATOM 469 C PRO A 32 8.735 -2.548 16.728 1.00 0.00 C ATOM 470 O PRO A 32 9.596 -1.803 16.250 1.00 0.00 O ATOM 471 CB PRO A 32 9.968 -4.231 18.125 1.00 0.00 C ATOM 472 CG PRO A 32 11.136 -5.015 17.615 1.00 0.00 C ATOM 473 CD PRO A 32 11.173 -4.807 16.131 1.00 0.00 C ATOM 0 HA PRO A 32 8.041 -4.499 17.051 1.00 0.00 H new ATOM 0 HB2 PRO A 32 10.290 -3.270 18.525 1.00 0.00 H new ATOM 0 HB3 PRO A 32 9.467 -4.762 18.935 1.00 0.00 H new ATOM 0 HG2 PRO A 32 12.063 -4.675 18.078 1.00 0.00 H new ATOM 0 HG3 PRO A 32 11.028 -6.073 17.856 1.00 0.00 H new ATOM 0 HD2 PRO A 32 11.754 -3.926 15.859 1.00 0.00 H new ATOM 0 HD3 PRO A 32 11.619 -5.656 15.613 1.00 0.00 H new ATOM 481 N GLY A 33 7.519 -2.131 17.099 1.00 0.00 N ATOM 482 CA GLY A 33 7.126 -0.728 16.972 1.00 0.00 C ATOM 483 C GLY A 33 6.433 -0.416 15.654 1.00 0.00 C ATOM 484 O GLY A 33 6.097 0.740 15.383 1.00 0.00 O ATOM 0 H GLY A 33 6.798 -2.740 17.486 1.00 0.00 H new ATOM 0 HA2 GLY A 33 6.461 -0.468 17.795 1.00 0.00 H new ATOM 0 HA3 GLY A 33 8.011 -0.099 17.067 1.00 0.00 H new ATOM 488 N HIS A 34 6.202 -1.463 14.850 1.00 0.00 N ATOM 489 CA HIS A 34 5.566 -1.358 13.555 1.00 0.00 C ATOM 490 C HIS A 34 4.059 -1.173 13.721 1.00 0.00 C ATOM 491 O HIS A 34 3.431 -1.837 14.551 1.00 0.00 O ATOM 492 CB HIS A 34 5.883 -2.624 12.739 1.00 0.00 C ATOM 493 CG HIS A 34 5.812 -2.446 11.250 1.00 0.00 C ATOM 494 ND1 HIS A 34 5.057 -3.242 10.425 1.00 0.00 N ATOM 495 CD2 HIS A 34 6.401 -1.528 10.438 1.00 0.00 C ATOM 496 CE1 HIS A 34 5.203 -2.790 9.175 1.00 0.00 C ATOM 497 NE2 HIS A 34 6.004 -1.750 9.135 1.00 0.00 N ATOM 0 H HIS A 34 6.461 -2.418 15.097 1.00 0.00 H new ATOM 0 HA HIS A 34 5.949 -0.488 13.022 1.00 0.00 H new ATOM 0 HB2 HIS A 34 6.883 -2.968 13.003 1.00 0.00 H new ATOM 0 HB3 HIS A 34 5.188 -3.411 13.031 1.00 0.00 H new ATOM 0 HD1 HIS A 34 4.486 -4.037 10.714 1.00 0.00 H new ATOM 0 HD2 HIS A 34 7.074 -0.748 10.762 1.00 0.00 H new ATOM 0 HE1 HIS A 34 4.724 -3.224 8.310 1.00 0.00 H new ATOM 505 N VAL A 35 3.504 -0.249 12.946 1.00 0.00 N ATOM 506 CA VAL A 35 2.075 0.066 12.997 1.00 0.00 C ATOM 507 C VAL A 35 1.329 -0.529 11.804 1.00 0.00 C ATOM 508 O VAL A 35 0.108 -0.683 11.850 1.00 0.00 O ATOM 509 CB VAL A 35 1.805 1.596 13.048 1.00 0.00 C ATOM 510 CG1 VAL A 35 1.342 2.029 14.439 1.00 0.00 C ATOM 511 CG2 VAL A 35 3.025 2.411 12.623 1.00 0.00 C ATOM 0 H VAL A 35 4.026 0.303 12.266 1.00 0.00 H new ATOM 0 HA VAL A 35 1.705 -0.381 13.920 1.00 0.00 H new ATOM 0 HB VAL A 35 1.006 1.796 12.334 1.00 0.00 H new ATOM 0 HG11 VAL A 35 1.161 3.104 14.444 1.00 0.00 H new ATOM 0 HG12 VAL A 35 0.421 1.505 14.696 1.00 0.00 H new ATOM 0 HG13 VAL A 35 2.113 1.788 15.171 1.00 0.00 H new ATOM 0 HG21 VAL A 35 2.789 3.474 12.675 1.00 0.00 H new ATOM 0 HG22 VAL A 35 3.859 2.192 13.290 1.00 0.00 H new ATOM 0 HG23 VAL A 35 3.299 2.150 11.601 1.00 0.00 H new ATOM 521 N GLY A 36 2.070 -0.872 10.745 1.00 0.00 N ATOM 522 CA GLY A 36 1.476 -1.445 9.553 1.00 0.00 C ATOM 523 C GLY A 36 2.046 -2.807 9.240 1.00 0.00 C ATOM 524 O GLY A 36 2.437 -3.550 10.146 1.00 0.00 O ATOM 0 H GLY A 36 3.083 -0.759 10.698 1.00 0.00 H new ATOM 0 HA2 GLY A 36 0.397 -1.525 9.687 1.00 0.00 H new ATOM 0 HA3 GLY A 36 1.643 -0.778 8.707 1.00 0.00 H new ATOM 528 N VAL A 37 2.075 -3.131 7.955 1.00 0.00 N ATOM 529 CA VAL A 37 2.610 -4.406 7.475 1.00 0.00 C ATOM 530 C VAL A 37 3.596 -4.164 6.315 1.00 0.00 C ATOM 531 O VAL A 37 3.427 -3.218 5.539 1.00 0.00 O ATOM 532 CB VAL A 37 1.462 -5.395 7.081 1.00 0.00 C ATOM 533 CG1 VAL A 37 0.601 -4.850 5.948 1.00 0.00 C ATOM 534 CG2 VAL A 37 2.002 -6.784 6.734 1.00 0.00 C ATOM 0 H VAL A 37 1.730 -2.521 7.214 1.00 0.00 H new ATOM 0 HA VAL A 37 3.161 -4.882 8.286 1.00 0.00 H new ATOM 0 HB VAL A 37 0.825 -5.495 7.960 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -0.182 -5.569 5.708 1.00 0.00 H new ATOM 0 HG12 VAL A 37 0.147 -3.908 6.257 1.00 0.00 H new ATOM 0 HG13 VAL A 37 1.222 -4.682 5.068 1.00 0.00 H new ATOM 0 HG21 VAL A 37 1.174 -7.440 6.466 1.00 0.00 H new ATOM 0 HG22 VAL A 37 2.690 -6.707 5.892 1.00 0.00 H new ATOM 0 HG23 VAL A 37 2.527 -7.196 7.596 1.00 0.00 H new ATOM 544 N ASP A 38 4.605 -5.036 6.204 1.00 0.00 N ATOM 545 CA ASP A 38 5.625 -4.907 5.162 1.00 0.00 C ATOM 546 C ASP A 38 5.756 -6.171 4.329 1.00 0.00 C ATOM 547 O ASP A 38 5.795 -7.287 4.854 1.00 0.00 O ATOM 548 CB ASP A 38 6.970 -4.498 5.789 1.00 0.00 C ATOM 549 CG ASP A 38 6.913 -3.115 6.409 1.00 0.00 C ATOM 550 OD1 ASP A 38 6.076 -2.295 5.965 1.00 0.00 O ATOM 551 OD2 ASP A 38 7.641 -2.887 7.396 1.00 0.00 O ATOM 0 H ASP A 38 4.735 -5.836 6.823 1.00 0.00 H new ATOM 0 HA ASP A 38 5.309 -4.121 4.476 1.00 0.00 H new ATOM 0 HB2 ASP A 38 7.250 -5.225 6.551 1.00 0.00 H new ATOM 0 HB3 ASP A 38 7.747 -4.521 5.025 1.00 0.00 H new ATOM 556 N TYR A 39 5.828 -5.955 3.012 1.00 0.00 N ATOM 557 CA TYR A 39 5.932 -7.028 2.026 1.00 0.00 C ATOM 558 C TYR A 39 7.163 -6.808 1.150 1.00 0.00 C ATOM 559 O TYR A 39 7.209 -5.865 0.348 1.00 0.00 O ATOM 560 CB TYR A 39 4.693 -7.082 1.112 1.00 0.00 C ATOM 561 CG TYR A 39 3.342 -6.872 1.777 1.00 0.00 C ATOM 562 CD1 TYR A 39 2.951 -5.606 2.179 1.00 0.00 C ATOM 563 CD2 TYR A 39 2.442 -7.920 1.954 1.00 0.00 C ATOM 564 CE1 TYR A 39 1.716 -5.384 2.736 1.00 0.00 C ATOM 565 CE2 TYR A 39 1.199 -7.699 2.521 1.00 0.00 C ATOM 566 CZ TYR A 39 0.843 -6.432 2.906 1.00 0.00 C ATOM 567 OH TYR A 39 -0.399 -6.211 3.456 1.00 0.00 O ATOM 0 H TYR A 39 5.815 -5.022 2.600 1.00 0.00 H new ATOM 0 HA TYR A 39 6.009 -7.967 2.574 1.00 0.00 H new ATOM 0 HB2 TYR A 39 4.811 -6.326 0.335 1.00 0.00 H new ATOM 0 HB3 TYR A 39 4.680 -8.052 0.614 1.00 0.00 H new ATOM 0 HD1 TYR A 39 3.631 -4.777 2.052 1.00 0.00 H new ATOM 0 HD2 TYR A 39 2.717 -8.918 1.645 1.00 0.00 H new ATOM 0 HE1 TYR A 39 1.431 -4.388 3.040 1.00 0.00 H new ATOM 0 HE2 TYR A 39 0.512 -8.521 2.660 1.00 0.00 H new ATOM 0 HH TYR A 39 -0.891 -7.057 3.504 1.00 0.00 H new ATOM 577 N ALA A 40 8.161 -7.672 1.326 1.00 0.00 N ATOM 578 CA ALA A 40 9.413 -7.623 0.555 1.00 0.00 C ATOM 579 C ALA A 40 9.175 -7.664 -0.965 1.00 0.00 C ATOM 580 O ALA A 40 8.859 -8.716 -1.536 1.00 0.00 O ATOM 581 CB ALA A 40 10.338 -8.754 0.990 1.00 0.00 C ATOM 0 H ALA A 40 8.129 -8.430 2.008 1.00 0.00 H new ATOM 0 HA ALA A 40 9.889 -6.666 0.768 1.00 0.00 H new ATOM 0 HB1 ALA A 40 11.262 -8.710 0.414 1.00 0.00 H new ATOM 0 HB2 ALA A 40 10.566 -8.650 2.051 1.00 0.00 H new ATOM 0 HB3 ALA A 40 9.848 -9.712 0.817 1.00 0.00 H new ATOM 587 N VAL A 41 9.321 -6.492 -1.600 1.00 0.00 N ATOM 588 CA VAL A 41 9.129 -6.343 -3.040 1.00 0.00 C ATOM 589 C VAL A 41 10.131 -5.295 -3.592 1.00 0.00 C ATOM 590 O VAL A 41 10.108 -4.139 -3.158 1.00 0.00 O ATOM 591 CB VAL A 41 7.639 -5.989 -3.400 1.00 0.00 C ATOM 592 CG1 VAL A 41 7.191 -4.640 -2.833 1.00 0.00 C ATOM 593 CG2 VAL A 41 7.405 -6.047 -4.910 1.00 0.00 C ATOM 0 H VAL A 41 9.575 -5.625 -1.126 1.00 0.00 H new ATOM 0 HA VAL A 41 9.332 -7.300 -3.521 1.00 0.00 H new ATOM 0 HB VAL A 41 7.022 -6.750 -2.922 1.00 0.00 H new ATOM 0 HG11 VAL A 41 6.155 -4.453 -3.115 1.00 0.00 H new ATOM 0 HG12 VAL A 41 7.274 -4.657 -1.746 1.00 0.00 H new ATOM 0 HG13 VAL A 41 7.825 -3.849 -3.233 1.00 0.00 H new ATOM 0 HG21 VAL A 41 6.366 -5.798 -5.127 1.00 0.00 H new ATOM 0 HG22 VAL A 41 8.061 -5.333 -5.408 1.00 0.00 H new ATOM 0 HG23 VAL A 41 7.620 -7.052 -5.273 1.00 0.00 H new ATOM 603 N PRO A 42 11.019 -5.685 -4.562 1.00 0.00 N ATOM 604 CA PRO A 42 12.031 -4.774 -5.150 1.00 0.00 C ATOM 605 C PRO A 42 11.507 -3.429 -5.617 1.00 0.00 C ATOM 606 O PRO A 42 10.389 -3.282 -6.115 1.00 0.00 O ATOM 607 CB PRO A 42 12.575 -5.560 -6.342 1.00 0.00 C ATOM 608 CG PRO A 42 12.391 -6.986 -5.972 1.00 0.00 C ATOM 609 CD PRO A 42 11.133 -7.048 -5.147 1.00 0.00 C ATOM 0 HA PRO A 42 12.768 -4.509 -4.392 1.00 0.00 H new ATOM 0 HB2 PRO A 42 12.035 -5.316 -7.257 1.00 0.00 H new ATOM 0 HB3 PRO A 42 13.625 -5.330 -6.521 1.00 0.00 H new ATOM 0 HG2 PRO A 42 12.304 -7.611 -6.861 1.00 0.00 H new ATOM 0 HG3 PRO A 42 13.246 -7.355 -5.406 1.00 0.00 H new ATOM 0 HD2 PRO A 42 10.266 -7.293 -5.760 1.00 0.00 H new ATOM 0 HD3 PRO A 42 11.201 -7.811 -4.371 1.00 0.00 H new ATOM 617 N VAL A 43 12.389 -2.467 -5.417 1.00 0.00 N ATOM 618 CA VAL A 43 12.212 -1.063 -5.750 1.00 0.00 C ATOM 619 C VAL A 43 11.991 -0.814 -7.249 1.00 0.00 C ATOM 620 O VAL A 43 12.641 -1.438 -8.094 1.00 0.00 O ATOM 621 CB VAL A 43 13.461 -0.284 -5.233 1.00 0.00 C ATOM 622 CG1 VAL A 43 14.773 -0.936 -5.674 1.00 0.00 C ATOM 623 CG2 VAL A 43 13.442 1.194 -5.628 1.00 0.00 C ATOM 0 H VAL A 43 13.299 -2.653 -4.995 1.00 0.00 H new ATOM 0 HA VAL A 43 11.303 -0.708 -5.264 1.00 0.00 H new ATOM 0 HB VAL A 43 13.406 -0.334 -4.146 1.00 0.00 H new ATOM 0 HG11 VAL A 43 15.614 -0.358 -5.290 1.00 0.00 H new ATOM 0 HG12 VAL A 43 14.823 -1.953 -5.284 1.00 0.00 H new ATOM 0 HG13 VAL A 43 14.818 -0.963 -6.763 1.00 0.00 H new ATOM 0 HG21 VAL A 43 14.335 1.685 -5.241 1.00 0.00 H new ATOM 0 HG22 VAL A 43 13.422 1.280 -6.714 1.00 0.00 H new ATOM 0 HG23 VAL A 43 12.556 1.671 -5.210 1.00 0.00 H new ATOM 633 N GLY A 44 11.065 0.099 -7.546 1.00 0.00 N ATOM 634 CA GLY A 44 10.796 0.459 -8.916 1.00 0.00 C ATOM 635 C GLY A 44 9.562 -0.201 -9.501 1.00 0.00 C ATOM 636 O GLY A 44 9.261 -0.006 -10.682 1.00 0.00 O ATOM 0 H GLY A 44 10.500 0.592 -6.855 1.00 0.00 H new ATOM 0 HA2 GLY A 44 10.680 1.541 -8.980 1.00 0.00 H new ATOM 0 HA3 GLY A 44 11.660 0.194 -9.526 1.00 0.00 H new ATOM 640 N THR A 45 8.849 -0.983 -8.680 1.00 0.00 N ATOM 641 CA THR A 45 7.640 -1.657 -9.108 1.00 0.00 C ATOM 642 C THR A 45 6.425 -0.731 -8.913 1.00 0.00 C ATOM 643 O THR A 45 6.236 -0.212 -7.810 1.00 0.00 O ATOM 644 CB THR A 45 7.426 -2.986 -8.342 1.00 0.00 C ATOM 645 OG1 THR A 45 8.684 -3.645 -8.143 1.00 0.00 O ATOM 646 CG2 THR A 45 6.490 -3.926 -9.099 1.00 0.00 C ATOM 0 H THR A 45 9.101 -1.159 -7.707 1.00 0.00 H new ATOM 0 HA THR A 45 7.747 -1.897 -10.166 1.00 0.00 H new ATOM 0 HB THR A 45 6.972 -2.741 -7.382 1.00 0.00 H new ATOM 0 HG1 THR A 45 9.030 -3.427 -7.253 1.00 0.00 H new ATOM 0 HG21 THR A 45 6.363 -4.848 -8.532 1.00 0.00 H new ATOM 0 HG22 THR A 45 5.521 -3.445 -9.231 1.00 0.00 H new ATOM 0 HG23 THR A 45 6.917 -4.156 -10.075 1.00 0.00 H new ATOM 654 N PRO A 46 5.575 -0.505 -9.968 1.00 0.00 N ATOM 655 CA PRO A 46 4.402 0.384 -9.856 1.00 0.00 C ATOM 656 C PRO A 46 3.406 -0.057 -8.780 1.00 0.00 C ATOM 657 O PRO A 46 2.965 -1.210 -8.755 1.00 0.00 O ATOM 658 CB PRO A 46 3.743 0.319 -11.242 1.00 0.00 C ATOM 659 CG PRO A 46 4.802 -0.183 -12.160 1.00 0.00 C ATOM 660 CD PRO A 46 5.684 -1.077 -11.335 1.00 0.00 C ATOM 0 HA PRO A 46 4.708 1.387 -9.560 1.00 0.00 H new ATOM 0 HB2 PRO A 46 2.880 -0.347 -11.236 1.00 0.00 H new ATOM 0 HB3 PRO A 46 3.386 1.301 -11.554 1.00 0.00 H new ATOM 0 HG2 PRO A 46 4.365 -0.731 -12.995 1.00 0.00 H new ATOM 0 HG3 PRO A 46 5.373 0.643 -12.584 1.00 0.00 H new ATOM 0 HD2 PRO A 46 5.346 -2.113 -11.365 1.00 0.00 H new ATOM 0 HD3 PRO A 46 6.713 -1.067 -11.693 1.00 0.00 H new ATOM 668 N VAL A 47 3.076 0.883 -7.894 1.00 0.00 N ATOM 669 CA VAL A 47 2.142 0.663 -6.818 1.00 0.00 C ATOM 670 C VAL A 47 0.802 1.208 -7.207 1.00 0.00 C ATOM 671 O VAL A 47 0.657 2.382 -7.566 1.00 0.00 O ATOM 672 CB VAL A 47 2.600 1.292 -5.471 1.00 0.00 C ATOM 673 CG1 VAL A 47 1.751 0.799 -4.300 1.00 0.00 C ATOM 674 CG2 VAL A 47 4.067 0.997 -5.204 1.00 0.00 C ATOM 0 H VAL A 47 3.462 1.827 -7.914 1.00 0.00 H new ATOM 0 HA VAL A 47 2.086 -0.413 -6.654 1.00 0.00 H new ATOM 0 HB VAL A 47 2.465 2.370 -5.560 1.00 0.00 H new ATOM 0 HG11 VAL A 47 2.101 1.261 -3.377 1.00 0.00 H new ATOM 0 HG12 VAL A 47 0.708 1.069 -4.468 1.00 0.00 H new ATOM 0 HG13 VAL A 47 1.837 -0.285 -4.219 1.00 0.00 H new ATOM 0 HG21 VAL A 47 4.362 1.448 -4.256 1.00 0.00 H new ATOM 0 HG22 VAL A 47 4.218 -0.081 -5.156 1.00 0.00 H new ATOM 0 HG23 VAL A 47 4.674 1.413 -6.008 1.00 0.00 H new ATOM 684 N ARG A 48 -0.152 0.311 -7.143 1.00 0.00 N ATOM 685 CA ARG A 48 -1.515 0.609 -7.472 1.00 0.00 C ATOM 686 C ARG A 48 -2.359 0.787 -6.234 1.00 0.00 C ATOM 687 O ARG A 48 -2.088 0.194 -5.185 1.00 0.00 O ATOM 688 CB ARG A 48 -2.128 -0.477 -8.369 1.00 0.00 C ATOM 689 CG ARG A 48 -1.474 -0.620 -9.738 1.00 0.00 C ATOM 690 CD ARG A 48 -1.101 -2.066 -10.022 1.00 0.00 C ATOM 691 NE ARG A 48 -0.627 -2.250 -11.397 1.00 0.00 N ATOM 692 CZ ARG A 48 -0.504 -3.436 -12.008 1.00 0.00 C ATOM 693 NH1 ARG A 48 -0.819 -4.570 -11.382 1.00 0.00 N ATOM 694 NH2 ARG A 48 -0.065 -3.487 -13.257 1.00 0.00 N ATOM 0 H ARG A 48 0.003 -0.656 -6.857 1.00 0.00 H new ATOM 0 HA ARG A 48 -1.506 1.550 -8.022 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -2.066 -1.434 -7.851 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -3.187 -0.258 -8.509 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -2.155 -0.260 -10.509 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -0.582 0.004 -9.784 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -0.325 -2.384 -9.325 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -1.967 -2.705 -9.848 1.00 0.00 H new ATOM 0 HE ARG A 48 -0.373 -1.416 -11.926 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -1.160 -4.544 -10.421 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -0.719 -5.463 -11.864 1.00 0.00 H new ATOM 0 HH21 ARG A 48 0.177 -2.626 -13.748 1.00 0.00 H new ATOM 0 HH22 ARG A 48 0.031 -4.387 -13.728 1.00 0.00 H new ATOM 708 N ALA A 49 -3.413 1.592 -6.389 1.00 0.00 N ATOM 709 CA ALA A 49 -4.323 1.888 -5.305 1.00 0.00 C ATOM 710 C ALA A 49 -5.215 0.687 -5.004 1.00 0.00 C ATOM 711 O ALA A 49 -5.913 0.183 -5.883 1.00 0.00 O ATOM 712 CB ALA A 49 -5.159 3.117 -5.629 1.00 0.00 C ATOM 0 H ALA A 49 -3.650 2.050 -7.269 1.00 0.00 H new ATOM 0 HA ALA A 49 -3.735 2.102 -4.413 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -5.838 3.324 -4.802 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -4.502 3.973 -5.783 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -5.737 2.935 -6.535 1.00 0.00 H new ATOM 718 N VAL A 50 -5.138 0.203 -3.769 1.00 0.00 N ATOM 719 CA VAL A 50 -5.928 -0.961 -3.332 1.00 0.00 C ATOM 720 C VAL A 50 -7.453 -0.687 -3.322 1.00 0.00 C ATOM 721 O VAL A 50 -8.254 -1.627 -3.303 1.00 0.00 O ATOM 722 CB VAL A 50 -5.445 -1.485 -1.954 1.00 0.00 C ATOM 723 CG1 VAL A 50 -6.150 -2.772 -1.532 1.00 0.00 C ATOM 724 CG2 VAL A 50 -3.938 -1.715 -1.952 1.00 0.00 C ATOM 0 H VAL A 50 -4.536 0.595 -3.044 1.00 0.00 H new ATOM 0 HA VAL A 50 -5.759 -1.741 -4.074 1.00 0.00 H new ATOM 0 HB VAL A 50 -5.700 -0.709 -1.232 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -5.772 -3.092 -0.561 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -7.223 -2.593 -1.463 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -5.959 -3.551 -2.270 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -3.627 -2.082 -0.974 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -3.681 -2.451 -2.714 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -3.426 -0.777 -2.167 1.00 0.00 H new ATOM 734 N ALA A 51 -7.838 0.597 -3.357 1.00 0.00 N ATOM 735 CA ALA A 51 -9.234 1.018 -3.374 1.00 0.00 C ATOM 736 C ALA A 51 -9.333 2.510 -3.629 1.00 0.00 C ATOM 737 O ALA A 51 -8.474 3.287 -3.202 1.00 0.00 O ATOM 738 CB ALA A 51 -9.945 0.663 -2.078 1.00 0.00 C ATOM 0 H ALA A 51 -7.178 1.374 -3.374 1.00 0.00 H new ATOM 0 HA ALA A 51 -9.728 0.481 -4.184 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -10.983 0.993 -2.130 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.915 -0.417 -1.930 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -9.448 1.158 -1.243 1.00 0.00 H new ATOM 744 N ASN A 52 -10.378 2.889 -4.362 1.00 0.00 N ATOM 745 CA ASN A 52 -10.660 4.271 -4.710 1.00 0.00 C ATOM 746 C ASN A 52 -10.897 5.150 -3.477 1.00 0.00 C ATOM 747 O ASN A 52 -11.281 4.650 -2.414 1.00 0.00 O ATOM 748 CB ASN A 52 -11.880 4.334 -5.645 1.00 0.00 C ATOM 749 CG ASN A 52 -13.042 3.423 -5.263 1.00 0.00 C ATOM 750 OD1 ASN A 52 -13.707 2.849 -6.124 1.00 0.00 O ATOM 751 ND2 ASN A 52 -13.291 3.304 -3.976 1.00 0.00 N ATOM 0 H ASN A 52 -11.061 2.230 -4.735 1.00 0.00 H new ATOM 0 HA ASN A 52 -9.780 4.664 -5.219 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -12.241 5.362 -5.676 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -11.557 4.079 -6.654 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -14.062 2.717 -3.658 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -12.713 3.799 -3.297 1.00 0.00 H new ATOM 758 N GLY A 53 -10.670 6.452 -3.643 1.00 0.00 N ATOM 759 CA GLY A 53 -10.859 7.393 -2.550 1.00 0.00 C ATOM 760 C GLY A 53 -10.259 8.762 -2.813 1.00 0.00 C ATOM 761 O GLY A 53 -10.549 9.390 -3.836 1.00 0.00 O ATOM 0 H GLY A 53 -10.358 6.873 -4.518 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -11.926 7.504 -2.359 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -10.415 6.979 -1.645 1.00 0.00 H new ATOM 765 N THR A 54 -9.408 9.213 -1.880 1.00 0.00 N ATOM 766 CA THR A 54 -8.774 10.503 -1.937 1.00 0.00 C ATOM 767 C THR A 54 -7.397 10.428 -1.288 1.00 0.00 C ATOM 768 O THR A 54 -7.217 9.749 -0.280 1.00 0.00 O ATOM 769 CB THR A 54 -9.627 11.548 -1.209 1.00 0.00 C ATOM 770 OG1 THR A 54 -10.994 11.452 -1.629 1.00 0.00 O ATOM 771 CG2 THR A 54 -9.129 12.977 -1.439 1.00 0.00 C ATOM 0 H THR A 54 -9.148 8.669 -1.057 1.00 0.00 H new ATOM 0 HA THR A 54 -8.670 10.797 -2.982 1.00 0.00 H new ATOM 0 HB THR A 54 -9.544 11.334 -0.144 1.00 0.00 H new ATOM 0 HG1 THR A 54 -11.529 12.123 -1.156 1.00 0.00 H new ATOM 0 HG21 THR A 54 -9.769 13.676 -0.901 1.00 0.00 H new ATOM 0 HG22 THR A 54 -8.105 13.069 -1.076 1.00 0.00 H new ATOM 0 HG23 THR A 54 -9.158 13.205 -2.504 1.00 0.00 H new ATOM 779 N VAL A 55 -6.450 11.157 -1.869 1.00 0.00 N ATOM 780 CA VAL A 55 -5.081 11.225 -1.397 1.00 0.00 C ATOM 781 C VAL A 55 -4.988 12.287 -0.298 1.00 0.00 C ATOM 782 O VAL A 55 -5.168 13.479 -0.545 1.00 0.00 O ATOM 783 CB VAL A 55 -4.094 11.579 -2.548 1.00 0.00 C ATOM 784 CG1 VAL A 55 -2.640 11.349 -2.143 1.00 0.00 C ATOM 785 CG2 VAL A 55 -4.409 10.798 -3.822 1.00 0.00 C ATOM 0 H VAL A 55 -6.621 11.727 -2.698 1.00 0.00 H new ATOM 0 HA VAL A 55 -4.801 10.246 -1.008 1.00 0.00 H new ATOM 0 HB VAL A 55 -4.228 12.641 -2.751 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -1.985 11.608 -2.975 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -2.399 11.974 -1.283 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -2.497 10.301 -1.882 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -3.699 11.072 -4.602 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.333 9.729 -3.622 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -5.420 11.034 -4.153 1.00 0.00 H new ATOM 795 N LYS A 56 -4.741 11.818 0.901 1.00 0.00 N ATOM 796 CA LYS A 56 -4.618 12.675 2.086 1.00 0.00 C ATOM 797 C LYS A 56 -3.158 13.015 2.357 1.00 0.00 C ATOM 798 O LYS A 56 -2.849 13.920 3.137 1.00 0.00 O ATOM 799 CB LYS A 56 -5.236 12.031 3.353 1.00 0.00 C ATOM 800 CG LYS A 56 -6.367 11.012 3.123 1.00 0.00 C ATOM 801 CD LYS A 56 -7.431 11.496 2.131 1.00 0.00 C ATOM 802 CE LYS A 56 -8.510 12.355 2.785 1.00 0.00 C ATOM 803 NZ LYS A 56 -8.022 13.729 3.089 1.00 0.00 N ATOM 0 H LYS A 56 -4.616 10.825 1.098 1.00 0.00 H new ATOM 0 HA LYS A 56 -5.176 13.585 1.866 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -4.439 11.536 3.908 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -5.620 12.829 3.989 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -5.937 10.080 2.757 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -6.845 10.790 4.077 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -6.948 12.069 1.340 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -7.899 10.632 1.659 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -9.375 12.415 2.124 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -8.845 11.877 3.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -8.819 14.396 3.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -7.596 13.744 4.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -7.309 14.008 2.385 1.00 0.00 H new ATOM 817 N PHE A 57 -2.271 12.257 1.708 1.00 0.00 N ATOM 818 CA PHE A 57 -0.835 12.435 1.815 1.00 0.00 C ATOM 819 C PHE A 57 -0.150 11.910 0.563 1.00 0.00 C ATOM 820 O PHE A 57 -0.524 10.870 0.015 1.00 0.00 O ATOM 821 CB PHE A 57 -0.251 11.730 3.052 1.00 0.00 C ATOM 822 CG PHE A 57 1.031 12.343 3.542 1.00 0.00 C ATOM 823 CD1 PHE A 57 2.246 11.969 2.987 1.00 0.00 C ATOM 824 CD2 PHE A 57 1.022 13.305 4.539 1.00 0.00 C ATOM 825 CE1 PHE A 57 3.426 12.542 3.418 1.00 0.00 C ATOM 826 CE2 PHE A 57 2.201 13.881 4.975 1.00 0.00 C ATOM 827 CZ PHE A 57 3.404 13.499 4.413 1.00 0.00 C ATOM 0 H PHE A 57 -2.541 11.494 1.087 1.00 0.00 H new ATOM 0 HA PHE A 57 -0.651 13.504 1.923 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -0.987 11.755 3.856 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -0.075 10.681 2.813 1.00 0.00 H new ATOM 0 HD1 PHE A 57 2.269 11.221 2.209 1.00 0.00 H new ATOM 0 HD2 PHE A 57 0.084 13.608 4.980 1.00 0.00 H new ATOM 0 HE1 PHE A 57 4.365 12.242 2.977 1.00 0.00 H new ATOM 0 HE2 PHE A 57 2.182 14.629 5.754 1.00 0.00 H new ATOM 0 HZ PHE A 57 4.326 13.948 4.752 1.00 0.00 H new ATOM 837 N ALA A 58 0.862 12.655 0.139 1.00 0.00 N ATOM 838 CA ALA A 58 1.663 12.345 -1.028 1.00 0.00 C ATOM 839 C ALA A 58 3.087 12.837 -0.796 1.00 0.00 C ATOM 840 O ALA A 58 3.426 13.999 -1.056 1.00 0.00 O ATOM 841 CB ALA A 58 1.063 12.958 -2.296 1.00 0.00 C ATOM 0 H ALA A 58 1.152 13.511 0.611 1.00 0.00 H new ATOM 0 HA ALA A 58 1.675 11.265 -1.177 1.00 0.00 H new ATOM 0 HB1 ALA A 58 1.688 12.706 -3.153 1.00 0.00 H new ATOM 0 HB2 ALA A 58 0.059 12.563 -2.451 1.00 0.00 H new ATOM 0 HB3 ALA A 58 1.014 14.042 -2.188 1.00 0.00 H new ATOM 847 N GLY A 59 3.899 11.928 -0.274 1.00 0.00 N ATOM 848 CA GLY A 59 5.294 12.209 0.016 1.00 0.00 C ATOM 849 C GLY A 59 6.215 11.793 -1.113 1.00 0.00 C ATOM 850 O GLY A 59 6.700 10.652 -1.134 1.00 0.00 O ATOM 0 H GLY A 59 3.608 10.978 -0.041 1.00 0.00 H new ATOM 0 HA2 GLY A 59 5.415 13.276 0.205 1.00 0.00 H new ATOM 0 HA3 GLY A 59 5.584 11.688 0.928 1.00 0.00 H new ATOM 854 N ASN A 60 6.446 12.738 -2.043 1.00 0.00 N ATOM 855 CA ASN A 60 7.297 12.535 -3.222 1.00 0.00 C ATOM 856 C ASN A 60 8.774 12.471 -2.878 1.00 0.00 C ATOM 857 O ASN A 60 9.352 13.399 -2.307 1.00 0.00 O ATOM 858 CB ASN A 60 7.051 13.642 -4.255 1.00 0.00 C ATOM 859 CG ASN A 60 5.691 13.539 -4.902 1.00 0.00 C ATOM 860 OD1 ASN A 60 5.552 13.685 -6.116 1.00 0.00 O ATOM 861 ND2 ASN A 60 4.677 13.301 -4.088 1.00 0.00 N ATOM 0 H ASN A 60 6.041 13.673 -1.993 1.00 0.00 H new ATOM 0 HA ASN A 60 7.021 11.568 -3.643 1.00 0.00 H new ATOM 0 HB2 ASN A 60 7.146 14.614 -3.771 1.00 0.00 H new ATOM 0 HB3 ASN A 60 7.821 13.593 -5.025 1.00 0.00 H new ATOM 0 HD21 ASN A 60 3.730 13.231 -4.460 1.00 0.00 H new ATOM 0 HD22 ASN A 60 4.842 13.187 -3.088 1.00 0.00 H new ATOM 868 N GLY A 61 9.350 11.344 -3.262 1.00 0.00 N ATOM 869 CA GLY A 61 10.764 11.055 -3.038 1.00 0.00 C ATOM 870 C GLY A 61 11.688 11.705 -4.053 1.00 0.00 C ATOM 871 O GLY A 61 12.910 11.555 -3.970 1.00 0.00 O ATOM 0 H GLY A 61 8.849 10.596 -3.742 1.00 0.00 H new ATOM 0 HA2 GLY A 61 11.041 11.392 -2.039 1.00 0.00 H new ATOM 0 HA3 GLY A 61 10.914 9.976 -3.063 1.00 0.00 H new ATOM 875 N ALA A 62 11.101 12.427 -5.013 1.00 0.00 N ATOM 876 CA ALA A 62 11.857 13.095 -6.064 1.00 0.00 C ATOM 877 C ALA A 62 12.547 14.362 -5.576 1.00 0.00 C ATOM 878 O ALA A 62 13.640 14.702 -6.040 1.00 0.00 O ATOM 879 CB ALA A 62 10.943 13.415 -7.234 1.00 0.00 C ATOM 0 H ALA A 62 10.092 12.561 -5.079 1.00 0.00 H new ATOM 0 HA ALA A 62 12.641 12.409 -6.383 1.00 0.00 H new ATOM 0 HB1 ALA A 62 11.515 13.914 -8.016 1.00 0.00 H new ATOM 0 HB2 ALA A 62 10.519 12.491 -7.628 1.00 0.00 H new ATOM 0 HB3 ALA A 62 10.138 14.069 -6.899 1.00 0.00 H new ATOM 885 N ASN A 63 11.900 15.046 -4.635 1.00 0.00 N ATOM 886 CA ASN A 63 12.412 16.290 -4.089 1.00 0.00 C ATOM 887 C ASN A 63 12.221 16.370 -2.572 1.00 0.00 C ATOM 888 O ASN A 63 12.121 17.468 -2.005 1.00 0.00 O ATOM 889 CB ASN A 63 11.735 17.473 -4.764 1.00 0.00 C ATOM 890 CG ASN A 63 12.707 18.555 -5.157 1.00 0.00 C ATOM 891 OD1 ASN A 63 13.139 19.358 -4.331 1.00 0.00 O ATOM 892 ND2 ASN A 63 13.037 18.584 -6.435 1.00 0.00 N ATOM 0 H ASN A 63 11.010 14.751 -4.234 1.00 0.00 H new ATOM 0 HA ASN A 63 13.483 16.321 -4.288 1.00 0.00 H new ATOM 0 HB2 ASN A 63 11.207 17.125 -5.652 1.00 0.00 H new ATOM 0 HB3 ASN A 63 10.986 17.890 -4.091 1.00 0.00 H new ATOM 0 HD21 ASN A 63 13.680 19.297 -6.780 1.00 0.00 H new ATOM 0 HD22 ASN A 63 12.649 17.893 -7.078 1.00 0.00 H new ATOM 899 N HIS A 64 12.171 15.209 -1.911 1.00 0.00 N ATOM 900 CA HIS A 64 11.961 15.151 -0.491 1.00 0.00 C ATOM 901 C HIS A 64 13.235 15.457 0.331 1.00 0.00 C ATOM 902 O HIS A 64 14.214 14.707 0.260 1.00 0.00 O ATOM 903 CB HIS A 64 11.365 13.791 -0.095 1.00 0.00 C ATOM 904 CG HIS A 64 12.211 12.572 -0.391 1.00 0.00 C ATOM 905 ND1 HIS A 64 13.367 12.596 -1.152 1.00 0.00 N ATOM 906 CD2 HIS A 64 12.061 11.287 0.011 1.00 0.00 C ATOM 907 CE1 HIS A 64 13.885 11.381 -1.201 1.00 0.00 C ATOM 908 NE2 HIS A 64 13.113 10.570 -0.504 1.00 0.00 N ATOM 0 H HIS A 64 12.276 14.298 -2.357 1.00 0.00 H new ATOM 0 HA HIS A 64 11.250 15.941 -0.248 1.00 0.00 H new ATOM 0 HB2 HIS A 64 11.155 13.809 0.974 1.00 0.00 H new ATOM 0 HB3 HIS A 64 10.409 13.675 -0.606 1.00 0.00 H new ATOM 0 HD1 HIS A 64 13.758 13.422 -1.604 1.00 0.00 H new ATOM 0 HD2 HIS A 64 11.261 10.898 0.624 1.00 0.00 H new ATOM 0 HE1 HIS A 64 14.788 11.100 -1.723 1.00 0.00 H new ATOM 917 N PRO A 65 13.249 16.578 1.118 1.00 0.00 N ATOM 918 CA PRO A 65 14.370 16.954 1.982 1.00 0.00 C ATOM 919 C PRO A 65 14.536 15.996 3.130 1.00 0.00 C ATOM 920 O PRO A 65 13.679 15.173 3.383 1.00 0.00 O ATOM 921 CB PRO A 65 13.969 18.336 2.531 1.00 0.00 C ATOM 922 CG PRO A 65 12.950 18.821 1.595 1.00 0.00 C ATOM 923 CD PRO A 65 12.191 17.596 1.230 1.00 0.00 C ATOM 0 HA PRO A 65 15.314 16.950 1.436 1.00 0.00 H new ATOM 0 HB2 PRO A 65 13.574 18.261 3.544 1.00 0.00 H new ATOM 0 HB3 PRO A 65 14.824 19.011 2.571 1.00 0.00 H new ATOM 0 HG2 PRO A 65 12.305 19.568 2.058 1.00 0.00 H new ATOM 0 HG3 PRO A 65 13.401 19.288 0.719 1.00 0.00 H new ATOM 0 HD2 PRO A 65 11.456 17.334 1.991 1.00 0.00 H new ATOM 0 HD3 PRO A 65 11.649 17.720 0.293 1.00 0.00 H new ATOM 931 N TRP A 66 15.686 16.037 3.744 1.00 0.00 N ATOM 932 CA TRP A 66 15.935 15.229 4.916 1.00 0.00 C ATOM 933 C TRP A 66 15.677 16.090 6.146 1.00 0.00 C ATOM 934 O TRP A 66 15.944 15.686 7.285 1.00 0.00 O ATOM 935 CB TRP A 66 17.353 14.687 4.961 1.00 0.00 C ATOM 936 CG TRP A 66 17.706 13.769 3.824 1.00 0.00 C ATOM 937 CD1 TRP A 66 17.957 14.129 2.528 1.00 0.00 C ATOM 938 CD2 TRP A 66 17.843 12.339 3.876 1.00 0.00 C ATOM 939 NE1 TRP A 66 18.238 13.015 1.775 1.00 0.00 N ATOM 940 CE2 TRP A 66 18.176 11.906 2.578 1.00 0.00 C ATOM 941 CE3 TRP A 66 17.718 11.382 4.891 1.00 0.00 C ATOM 942 CZ2 TRP A 66 18.384 10.564 2.270 1.00 0.00 C ATOM 943 CZ3 TRP A 66 17.924 10.051 4.582 1.00 0.00 C ATOM 944 CH2 TRP A 66 18.253 9.652 3.282 1.00 0.00 C ATOM 0 H TRP A 66 16.470 16.621 3.455 1.00 0.00 H new ATOM 0 HA TRP A 66 15.269 14.366 4.887 1.00 0.00 H new ATOM 0 HB2 TRP A 66 18.049 15.526 4.964 1.00 0.00 H new ATOM 0 HB3 TRP A 66 17.494 14.152 5.900 1.00 0.00 H new ATOM 0 HD1 TRP A 66 17.937 15.141 2.152 1.00 0.00 H new ATOM 0 HE1 TRP A 66 18.457 13.013 0.779 1.00 0.00 H new ATOM 0 HE3 TRP A 66 17.465 11.679 5.898 1.00 0.00 H new ATOM 0 HZ2 TRP A 66 18.640 10.254 1.268 1.00 0.00 H new ATOM 0 HZ3 TRP A 66 17.829 9.306 5.358 1.00 0.00 H new ATOM 0 HH2 TRP A 66 18.407 8.604 3.073 1.00 0.00 H new ATOM 955 N MET A 67 15.121 17.289 5.886 1.00 0.00 N ATOM 956 CA MET A 67 14.812 18.249 6.929 1.00 0.00 C ATOM 957 C MET A 67 13.589 17.811 7.699 1.00 0.00 C ATOM 958 O MET A 67 13.572 17.855 8.932 1.00 0.00 O ATOM 959 CB MET A 67 14.605 19.653 6.347 1.00 0.00 C ATOM 960 CG MET A 67 15.891 20.342 5.915 1.00 0.00 C ATOM 961 SD MET A 67 16.703 19.505 4.542 1.00 0.00 S ATOM 962 CE MET A 67 18.039 20.646 4.197 1.00 0.00 C ATOM 0 H MET A 67 14.880 17.605 4.947 1.00 0.00 H new ATOM 0 HA MET A 67 15.661 18.291 7.611 1.00 0.00 H new ATOM 0 HB2 MET A 67 13.936 19.584 5.489 1.00 0.00 H new ATOM 0 HB3 MET A 67 14.105 20.273 7.091 1.00 0.00 H new ATOM 0 HG2 MET A 67 15.669 21.370 5.628 1.00 0.00 H new ATOM 0 HG3 MET A 67 16.575 20.389 6.762 1.00 0.00 H new ATOM 0 HE1 MET A 67 18.636 20.267 3.367 1.00 0.00 H new ATOM 0 HE2 MET A 67 17.627 21.620 3.932 1.00 0.00 H new ATOM 0 HE3 MET A 67 18.669 20.747 5.081 1.00 0.00 H new ATOM 972 N LEU A 68 12.576 17.377 6.959 1.00 0.00 N ATOM 973 CA LEU A 68 11.372 16.885 7.576 1.00 0.00 C ATOM 974 C LEU A 68 11.108 15.445 7.129 1.00 0.00 C ATOM 975 O LEU A 68 10.021 14.909 7.372 1.00 0.00 O ATOM 976 CB LEU A 68 10.172 17.834 7.307 1.00 0.00 C ATOM 977 CG LEU A 68 9.688 17.982 5.862 1.00 0.00 C ATOM 978 CD1 LEU A 68 8.548 17.002 5.579 1.00 0.00 C ATOM 979 CD2 LEU A 68 9.236 19.409 5.596 1.00 0.00 C ATOM 0 H LEU A 68 12.573 17.359 5.939 1.00 0.00 H new ATOM 0 HA LEU A 68 11.503 16.871 8.658 1.00 0.00 H new ATOM 0 HB2 LEU A 68 9.331 17.489 7.908 1.00 0.00 H new ATOM 0 HB3 LEU A 68 10.440 18.825 7.673 1.00 0.00 H new ATOM 0 HG LEU A 68 10.518 17.752 5.195 1.00 0.00 H new ATOM 0 HD11 LEU A 68 8.215 17.119 4.548 1.00 0.00 H new ATOM 0 HD12 LEU A 68 8.899 15.982 5.733 1.00 0.00 H new ATOM 0 HD13 LEU A 68 7.717 17.206 6.254 1.00 0.00 H new ATOM 0 HD21 LEU A 68 8.895 19.496 4.564 1.00 0.00 H new ATOM 0 HD22 LEU A 68 8.419 19.664 6.271 1.00 0.00 H new ATOM 0 HD23 LEU A 68 10.070 20.092 5.762 1.00 0.00 H new ATOM 991 N TRP A 69 12.115 14.806 6.473 1.00 0.00 N ATOM 992 CA TRP A 69 11.927 13.436 5.993 1.00 0.00 C ATOM 993 C TRP A 69 13.056 12.511 6.432 1.00 0.00 C ATOM 994 O TRP A 69 14.208 12.936 6.569 1.00 0.00 O ATOM 995 CB TRP A 69 11.775 13.384 4.455 1.00 0.00 C ATOM 996 CG TRP A 69 10.978 14.523 3.851 1.00 0.00 C ATOM 997 CD1 TRP A 69 11.263 15.854 3.952 1.00 0.00 C ATOM 998 CD2 TRP A 69 9.800 14.437 3.038 1.00 0.00 C ATOM 999 NE1 TRP A 69 10.325 16.594 3.304 1.00 0.00 N ATOM 1000 CE2 TRP A 69 9.420 15.755 2.720 1.00 0.00 C ATOM 1001 CE3 TRP A 69 9.021 13.386 2.558 1.00 0.00 C ATOM 1002 CZ2 TRP A 69 8.305 16.049 1.949 1.00 0.00 C ATOM 1003 CZ3 TRP A 69 7.916 13.680 1.789 1.00 0.00 C ATOM 1004 CH2 TRP A 69 7.565 15.002 1.491 1.00 0.00 C ATOM 0 H TRP A 69 13.030 15.212 6.276 1.00 0.00 H new ATOM 0 HA TRP A 69 11.002 13.081 6.447 1.00 0.00 H new ATOM 0 HB2 TRP A 69 12.769 13.378 4.007 1.00 0.00 H new ATOM 0 HB3 TRP A 69 11.297 12.442 4.184 1.00 0.00 H new ATOM 0 HD1 TRP A 69 12.115 16.262 4.474 1.00 0.00 H new ATOM 0 HE1 TRP A 69 10.301 17.613 3.261 1.00 0.00 H new ATOM 0 HE3 TRP A 69 9.278 12.362 2.784 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 8.034 17.069 1.721 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 7.308 12.873 1.408 1.00 0.00 H new ATOM 0 HH2 TRP A 69 6.691 15.195 0.887 1.00 0.00 H new ATOM 1015 N MET A 70 12.685 11.256 6.719 1.00 0.00 N ATOM 1016 CA MET A 70 13.634 10.212 7.130 1.00 0.00 C ATOM 1017 C MET A 70 13.185 8.835 6.612 1.00 0.00 C ATOM 1018 O MET A 70 14.020 7.984 6.293 1.00 0.00 O ATOM 1019 CB MET A 70 13.833 10.181 8.668 1.00 0.00 C ATOM 1020 CG MET A 70 12.551 10.069 9.497 1.00 0.00 C ATOM 1021 SD MET A 70 11.598 11.599 9.519 1.00 0.00 S ATOM 1022 CE MET A 70 10.345 11.193 10.731 1.00 0.00 C ATOM 0 H MET A 70 11.718 10.936 6.673 1.00 0.00 H new ATOM 0 HA MET A 70 14.598 10.456 6.683 1.00 0.00 H new ATOM 0 HB2 MET A 70 14.480 9.339 8.916 1.00 0.00 H new ATOM 0 HB3 MET A 70 14.360 11.087 8.967 1.00 0.00 H new ATOM 0 HG2 MET A 70 11.932 9.267 9.095 1.00 0.00 H new ATOM 0 HG3 MET A 70 12.808 9.791 10.519 1.00 0.00 H new ATOM 0 HE1 MET A 70 9.674 12.042 10.859 1.00 0.00 H new ATOM 0 HE2 MET A 70 9.776 10.328 10.390 1.00 0.00 H new ATOM 0 HE3 MET A 70 10.822 10.961 11.683 1.00 0.00 H new ATOM 1032 N ALA A 71 11.857 8.653 6.498 1.00 0.00 N ATOM 1033 CA ALA A 71 11.262 7.390 6.034 1.00 0.00 C ATOM 1034 C ALA A 71 11.174 7.309 4.509 1.00 0.00 C ATOM 1035 O ALA A 71 11.043 6.219 3.946 1.00 0.00 O ATOM 1036 CB ALA A 71 9.882 7.213 6.646 1.00 0.00 C ATOM 0 H ALA A 71 11.171 9.373 6.724 1.00 0.00 H new ATOM 0 HA ALA A 71 11.919 6.584 6.360 1.00 0.00 H new ATOM 0 HB1 ALA A 71 9.447 6.276 6.298 1.00 0.00 H new ATOM 0 HB2 ALA A 71 9.966 7.193 7.733 1.00 0.00 H new ATOM 0 HB3 ALA A 71 9.242 8.043 6.347 1.00 0.00 H new ATOM 1042 N GLY A 72 11.248 8.469 3.858 1.00 0.00 N ATOM 1043 CA GLY A 72 11.199 8.532 2.404 1.00 0.00 C ATOM 1044 C GLY A 72 9.817 8.827 1.841 1.00 0.00 C ATOM 1045 O GLY A 72 9.148 9.771 2.274 1.00 0.00 O ATOM 0 H GLY A 72 11.342 9.375 4.317 1.00 0.00 H new ATOM 0 HA2 GLY A 72 11.891 9.301 2.061 1.00 0.00 H new ATOM 0 HA3 GLY A 72 11.550 7.583 1.998 1.00 0.00 H new ATOM 1049 N ASN A 73 9.399 8.002 0.865 1.00 0.00 N ATOM 1050 CA ASN A 73 8.114 8.141 0.186 1.00 0.00 C ATOM 1051 C ASN A 73 6.967 7.545 0.990 1.00 0.00 C ATOM 1052 O ASN A 73 7.103 6.469 1.584 1.00 0.00 O ATOM 1053 CB ASN A 73 8.151 7.449 -1.177 1.00 0.00 C ATOM 1054 CG ASN A 73 9.014 8.156 -2.199 1.00 0.00 C ATOM 1055 OD1 ASN A 73 8.506 8.851 -3.078 1.00 0.00 O ATOM 1056 ND2 ASN A 73 10.324 7.971 -2.098 1.00 0.00 N ATOM 0 H ASN A 73 9.954 7.215 0.528 1.00 0.00 H new ATOM 0 HA ASN A 73 7.942 9.211 0.070 1.00 0.00 H new ATOM 0 HB2 ASN A 73 8.519 6.431 -1.047 1.00 0.00 H new ATOM 0 HB3 ASN A 73 7.135 7.374 -1.563 1.00 0.00 H new ATOM 0 HD21 ASN A 73 10.955 8.414 -2.766 1.00 0.00 H new ATOM 0 HD22 ASN A 73 10.700 7.386 -1.352 1.00 0.00 H new ATOM 1063 N ALA A 74 5.824 8.236 0.962 1.00 0.00 N ATOM 1064 CA ALA A 74 4.631 7.796 1.678 1.00 0.00 C ATOM 1065 C ALA A 74 3.365 8.313 1.014 1.00 0.00 C ATOM 1066 O ALA A 74 3.352 9.414 0.465 1.00 0.00 O ATOM 1067 CB ALA A 74 4.678 8.221 3.143 1.00 0.00 C ATOM 0 H ALA A 74 5.703 9.108 0.446 1.00 0.00 H new ATOM 0 HA ALA A 74 4.613 6.707 1.640 1.00 0.00 H new ATOM 0 HB1 ALA A 74 3.776 7.879 3.650 1.00 0.00 H new ATOM 0 HB2 ALA A 74 5.553 7.781 3.622 1.00 0.00 H new ATOM 0 HB3 ALA A 74 4.739 9.308 3.205 1.00 0.00 H new ATOM 1073 N VAL A 75 2.297 7.510 1.081 1.00 0.00 N ATOM 1074 CA VAL A 75 1.012 7.873 0.481 1.00 0.00 C ATOM 1075 C VAL A 75 -0.130 7.463 1.395 1.00 0.00 C ATOM 1076 O VAL A 75 -0.292 6.286 1.710 1.00 0.00 O ATOM 1077 CB VAL A 75 0.753 7.210 -0.911 1.00 0.00 C ATOM 1078 CG1 VAL A 75 -0.190 8.067 -1.751 1.00 0.00 C ATOM 1079 CG2 VAL A 75 2.035 6.948 -1.685 1.00 0.00 C ATOM 0 H VAL A 75 2.299 6.602 1.547 1.00 0.00 H new ATOM 0 HA VAL A 75 1.057 8.953 0.342 1.00 0.00 H new ATOM 0 HB VAL A 75 0.289 6.244 -0.710 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -0.356 7.587 -2.715 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -1.142 8.177 -1.231 1.00 0.00 H new ATOM 0 HG13 VAL A 75 0.254 9.050 -1.907 1.00 0.00 H new ATOM 0 HG21 VAL A 75 1.794 6.487 -2.643 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.556 7.890 -1.856 1.00 0.00 H new ATOM 0 HG23 VAL A 75 2.676 6.279 -1.111 1.00 0.00 H new ATOM 1089 N LEU A 76 -0.926 8.440 1.790 1.00 0.00 N ATOM 1090 CA LEU A 76 -2.079 8.190 2.616 1.00 0.00 C ATOM 1091 C LEU A 76 -3.285 8.605 1.842 1.00 0.00 C ATOM 1092 O LEU A 76 -3.348 9.694 1.275 1.00 0.00 O ATOM 1093 CB LEU A 76 -2.011 8.918 3.948 1.00 0.00 C ATOM 1094 CG LEU A 76 -2.351 8.080 5.187 1.00 0.00 C ATOM 1095 CD1 LEU A 76 -1.169 8.043 6.143 1.00 0.00 C ATOM 1096 CD2 LEU A 76 -3.581 8.636 5.889 1.00 0.00 C ATOM 0 H LEU A 76 -0.788 9.421 1.546 1.00 0.00 H new ATOM 0 HA LEU A 76 -2.121 7.129 2.862 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -1.005 9.320 4.070 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -2.692 9.769 3.910 1.00 0.00 H new ATOM 0 HG LEU A 76 -2.569 7.062 4.863 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -1.426 7.445 7.017 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -0.309 7.601 5.641 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -0.924 9.057 6.457 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -3.806 8.028 6.765 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -3.390 9.663 6.200 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -4.430 8.616 5.206 1.00 0.00 H new ATOM 1108 N ILE A 77 -4.214 7.698 1.829 1.00 0.00 N ATOM 1109 CA ILE A 77 -5.445 7.820 1.101 1.00 0.00 C ATOM 1110 C ILE A 77 -6.608 7.286 1.930 1.00 0.00 C ATOM 1111 O ILE A 77 -6.448 6.416 2.787 1.00 0.00 O ATOM 1112 CB ILE A 77 -5.335 7.058 -0.262 1.00 0.00 C ATOM 1113 CG1 ILE A 77 -4.430 7.824 -1.234 1.00 0.00 C ATOM 1114 CG2 ILE A 77 -6.697 6.784 -0.917 1.00 0.00 C ATOM 1115 CD1 ILE A 77 -3.579 6.935 -2.124 1.00 0.00 C ATOM 0 H ILE A 77 -4.135 6.820 2.343 1.00 0.00 H new ATOM 0 HA ILE A 77 -5.634 8.874 0.895 1.00 0.00 H new ATOM 0 HB ILE A 77 -4.894 6.087 -0.034 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -5.050 8.462 -1.863 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -3.774 8.480 -0.662 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -6.548 6.253 -1.858 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -7.306 6.175 -0.249 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -7.205 7.729 -1.110 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -2.969 7.555 -2.781 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -2.931 6.315 -1.505 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -4.226 6.296 -2.726 1.00 0.00 H new ATOM 1127 N GLN A 78 -7.760 7.866 1.667 1.00 0.00 N ATOM 1128 CA GLN A 78 -9.001 7.502 2.288 1.00 0.00 C ATOM 1129 C GLN A 78 -9.771 6.602 1.327 1.00 0.00 C ATOM 1130 O GLN A 78 -10.159 7.017 0.235 1.00 0.00 O ATOM 1131 CB GLN A 78 -9.810 8.748 2.645 1.00 0.00 C ATOM 1132 CG GLN A 78 -11.173 8.443 3.252 1.00 0.00 C ATOM 1133 CD GLN A 78 -12.255 9.326 2.703 1.00 0.00 C ATOM 1134 OE1 GLN A 78 -12.579 10.379 3.251 1.00 0.00 O ATOM 1135 NE2 GLN A 78 -12.808 8.880 1.597 1.00 0.00 N ATOM 0 H GLN A 78 -7.854 8.626 0.993 1.00 0.00 H new ATOM 0 HA GLN A 78 -8.811 6.965 3.217 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -9.237 9.353 3.348 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -9.949 9.349 1.747 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -11.427 7.400 3.061 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -11.122 8.566 4.334 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -12.496 7.998 1.190 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -13.549 9.416 1.146 1.00 0.00 H new ATOM 1144 N HIS A 79 -9.972 5.375 1.764 1.00 0.00 N ATOM 1145 CA HIS A 79 -10.661 4.345 0.986 1.00 0.00 C ATOM 1146 C HIS A 79 -12.148 4.594 0.800 1.00 0.00 C ATOM 1147 O HIS A 79 -12.687 5.629 1.205 1.00 0.00 O ATOM 1148 CB HIS A 79 -10.430 2.969 1.603 1.00 0.00 C ATOM 1149 CG HIS A 79 -9.154 2.319 1.159 1.00 0.00 C ATOM 1150 ND1 HIS A 79 -8.578 2.572 -0.067 1.00 0.00 N ATOM 1151 CD2 HIS A 79 -8.340 1.433 1.780 1.00 0.00 C ATOM 1152 CE1 HIS A 79 -7.462 1.873 -0.182 1.00 0.00 C ATOM 1153 NE2 HIS A 79 -7.297 1.173 0.923 1.00 0.00 N ATOM 0 H HIS A 79 -9.660 5.053 2.680 1.00 0.00 H new ATOM 0 HA HIS A 79 -10.224 4.387 -0.012 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -10.421 3.064 2.689 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -11.267 2.320 1.347 1.00 0.00 H new ATOM 0 HD1 HIS A 79 -8.955 3.201 -0.776 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -8.483 1.010 2.763 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -6.799 1.875 -1.035 1.00 0.00 H new ATOM 1162 N ALA A 80 -12.791 3.603 0.171 1.00 0.00 N ATOM 1163 CA ALA A 80 -14.204 3.652 -0.163 1.00 0.00 C ATOM 1164 C ALA A 80 -15.146 3.678 1.047 1.00 0.00 C ATOM 1165 O ALA A 80 -16.314 4.060 0.914 1.00 0.00 O ATOM 1166 CB ALA A 80 -14.566 2.498 -1.084 1.00 0.00 C ATOM 0 H ALA A 80 -12.333 2.739 -0.120 1.00 0.00 H new ATOM 0 HA ALA A 80 -14.352 4.605 -0.670 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -15.627 2.546 -1.327 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -13.980 2.567 -2.001 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -14.350 1.553 -0.585 1.00 0.00 H new ATOM 1172 N ASP A 81 -14.635 3.286 2.211 1.00 0.00 N ATOM 1173 CA ASP A 81 -15.424 3.259 3.435 1.00 0.00 C ATOM 1174 C ASP A 81 -15.100 4.456 4.319 1.00 0.00 C ATOM 1175 O ASP A 81 -15.785 4.713 5.317 1.00 0.00 O ATOM 1176 CB ASP A 81 -15.205 1.962 4.194 1.00 0.00 C ATOM 1177 CG ASP A 81 -16.450 1.099 4.232 1.00 0.00 C ATOM 1178 OD1 ASP A 81 -16.583 0.211 3.364 1.00 0.00 O ATOM 1179 OD2 ASP A 81 -17.294 1.312 5.128 1.00 0.00 O ATOM 0 H ASP A 81 -13.669 2.981 2.330 1.00 0.00 H new ATOM 0 HA ASP A 81 -16.476 3.317 3.154 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -14.393 1.404 3.728 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -14.892 2.189 5.213 1.00 0.00 H new ATOM 1184 N GLY A 82 -14.053 5.185 3.931 1.00 0.00 N ATOM 1185 CA GLY A 82 -13.633 6.363 4.655 1.00 0.00 C ATOM 1186 C GLY A 82 -12.387 6.115 5.473 1.00 0.00 C ATOM 1187 O GLY A 82 -11.824 7.048 6.050 1.00 0.00 O ATOM 0 H GLY A 82 -13.483 4.970 3.113 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -13.448 7.174 3.950 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -14.438 6.690 5.313 1.00 0.00 H new ATOM 1191 N MET A 83 -11.949 4.847 5.507 1.00 0.00 N ATOM 1192 CA MET A 83 -10.769 4.430 6.221 1.00 0.00 C ATOM 1193 C MET A 83 -9.503 5.006 5.588 1.00 0.00 C ATOM 1194 O MET A 83 -9.547 5.492 4.455 1.00 0.00 O ATOM 1195 CB MET A 83 -10.717 2.897 6.281 1.00 0.00 C ATOM 1196 CG MET A 83 -11.044 2.167 4.978 1.00 0.00 C ATOM 1197 SD MET A 83 -11.817 0.557 5.243 1.00 0.00 S ATOM 1198 CE MET A 83 -11.975 -0.028 3.555 1.00 0.00 C ATOM 0 H MET A 83 -12.424 4.083 5.026 1.00 0.00 H new ATOM 0 HA MET A 83 -10.820 4.818 7.238 1.00 0.00 H new ATOM 0 HB2 MET A 83 -9.719 2.599 6.601 1.00 0.00 H new ATOM 0 HB3 MET A 83 -11.413 2.559 7.049 1.00 0.00 H new ATOM 0 HG2 MET A 83 -11.709 2.788 4.378 1.00 0.00 H new ATOM 0 HG3 MET A 83 -10.127 2.033 4.404 1.00 0.00 H new ATOM 0 HE1 MET A 83 -13.030 -0.153 3.310 1.00 0.00 H new ATOM 0 HE2 MET A 83 -11.528 0.698 2.875 1.00 0.00 H new ATOM 0 HE3 MET A 83 -11.463 -0.985 3.452 1.00 0.00 H new ATOM 1208 N HIS A 84 -8.384 4.942 6.308 1.00 0.00 N ATOM 1209 CA HIS A 84 -7.152 5.485 5.796 1.00 0.00 C ATOM 1210 C HIS A 84 -6.160 4.377 5.489 1.00 0.00 C ATOM 1211 O HIS A 84 -6.108 3.374 6.203 1.00 0.00 O ATOM 1212 CB HIS A 84 -6.533 6.489 6.775 1.00 0.00 C ATOM 1213 CG HIS A 84 -7.275 7.788 6.877 1.00 0.00 C ATOM 1214 ND1 HIS A 84 -6.863 8.946 6.249 1.00 0.00 N ATOM 1215 CD2 HIS A 84 -8.397 8.113 7.559 1.00 0.00 C ATOM 1216 CE1 HIS A 84 -7.700 9.926 6.545 1.00 0.00 C ATOM 1217 NE2 HIS A 84 -8.639 9.445 7.336 1.00 0.00 N ATOM 0 H HIS A 84 -8.317 4.523 7.235 1.00 0.00 H new ATOM 0 HA HIS A 84 -7.388 6.012 4.872 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -6.485 6.033 7.764 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -5.507 6.693 6.468 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -8.992 7.447 8.167 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -7.627 10.946 6.198 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -9.420 9.977 7.720 1.00 0.00 H new ATOM 1226 N THR A 85 -5.374 4.559 4.427 1.00 0.00 N ATOM 1227 CA THR A 85 -4.394 3.592 4.029 1.00 0.00 C ATOM 1228 C THR A 85 -3.116 4.281 3.610 1.00 0.00 C ATOM 1229 O THR A 85 -3.129 5.195 2.778 1.00 0.00 O ATOM 1230 CB THR A 85 -4.901 2.734 2.865 1.00 0.00 C ATOM 1231 OG1 THR A 85 -6.051 3.335 2.253 1.00 0.00 O ATOM 1232 CG2 THR A 85 -5.242 1.333 3.343 1.00 0.00 C ATOM 0 H THR A 85 -5.412 5.385 3.830 1.00 0.00 H new ATOM 0 HA THR A 85 -4.203 2.947 4.887 1.00 0.00 H new ATOM 0 HB THR A 85 -4.105 2.669 2.123 1.00 0.00 H new ATOM 0 HG1 THR A 85 -5.859 3.523 1.311 1.00 0.00 H new ATOM 0 HG21 THR A 85 -5.600 0.739 2.502 1.00 0.00 H new ATOM 0 HG22 THR A 85 -4.352 0.866 3.765 1.00 0.00 H new ATOM 0 HG23 THR A 85 -6.019 1.388 4.106 1.00 0.00 H new ATOM 1240 N GLY A 86 -2.025 3.849 4.214 1.00 0.00 N ATOM 1241 CA GLY A 86 -0.729 4.391 3.899 1.00 0.00 C ATOM 1242 C GLY A 86 0.078 3.443 3.042 1.00 0.00 C ATOM 1243 O GLY A 86 -0.138 2.224 3.073 1.00 0.00 O ATOM 0 H GLY A 86 -2.017 3.121 4.928 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -0.848 5.341 3.378 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -0.187 4.599 4.822 1.00 0.00 H new ATOM 1247 N TYR A 87 1.011 4.021 2.286 1.00 0.00 N ATOM 1248 CA TYR A 87 1.897 3.306 1.403 1.00 0.00 C ATOM 1249 C TYR A 87 3.278 3.921 1.628 1.00 0.00 C ATOM 1250 O TYR A 87 3.577 5.015 1.127 1.00 0.00 O ATOM 1251 CB TYR A 87 1.440 3.442 -0.080 1.00 0.00 C ATOM 1252 CG TYR A 87 -0.025 3.073 -0.369 1.00 0.00 C ATOM 1253 CD1 TYR A 87 -0.345 1.950 -1.133 1.00 0.00 C ATOM 1254 CD2 TYR A 87 -1.085 3.854 0.107 1.00 0.00 C ATOM 1255 CE1 TYR A 87 -1.668 1.621 -1.408 1.00 0.00 C ATOM 1256 CE2 TYR A 87 -2.400 3.523 -0.163 1.00 0.00 C ATOM 1257 CZ TYR A 87 -2.684 2.409 -0.918 1.00 0.00 C ATOM 1258 OH TYR A 87 -3.993 2.081 -1.188 1.00 0.00 O ATOM 0 H TYR A 87 1.166 5.029 2.280 1.00 0.00 H new ATOM 0 HA TYR A 87 1.902 2.236 1.611 1.00 0.00 H new ATOM 0 HB2 TYR A 87 1.604 4.472 -0.397 1.00 0.00 H new ATOM 0 HB3 TYR A 87 2.081 2.812 -0.697 1.00 0.00 H new ATOM 0 HD1 TYR A 87 0.448 1.326 -1.517 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -0.871 4.733 0.697 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -1.897 0.750 -2.004 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -3.202 4.138 0.218 1.00 0.00 H new ATOM 0 HH TYR A 87 -4.588 2.737 -0.769 1.00 0.00 H new ATOM 1268 N ALA A 88 4.096 3.252 2.439 1.00 0.00 N ATOM 1269 CA ALA A 88 5.421 3.771 2.769 1.00 0.00 C ATOM 1270 C ALA A 88 6.541 2.903 2.211 1.00 0.00 C ATOM 1271 O ALA A 88 6.314 1.769 1.778 1.00 0.00 O ATOM 1272 CB ALA A 88 5.558 3.959 4.278 1.00 0.00 C ATOM 0 H ALA A 88 3.868 2.359 2.875 1.00 0.00 H new ATOM 0 HA ALA A 88 5.520 4.744 2.288 1.00 0.00 H new ATOM 0 HB1 ALA A 88 6.551 4.346 4.508 1.00 0.00 H new ATOM 0 HB2 ALA A 88 4.804 4.664 4.627 1.00 0.00 H new ATOM 0 HB3 ALA A 88 5.418 3.001 4.778 1.00 0.00 H new ATOM 1278 N HIS A 89 7.773 3.457 2.256 1.00 0.00 N ATOM 1279 CA HIS A 89 8.998 2.807 1.742 1.00 0.00 C ATOM 1280 C HIS A 89 8.941 2.631 0.214 1.00 0.00 C ATOM 1281 O HIS A 89 9.309 1.588 -0.331 1.00 0.00 O ATOM 1282 CB HIS A 89 9.279 1.470 2.462 1.00 0.00 C ATOM 1283 CG HIS A 89 9.777 1.651 3.862 1.00 0.00 C ATOM 1284 ND1 HIS A 89 10.966 2.282 4.159 1.00 0.00 N ATOM 1285 CD2 HIS A 89 9.234 1.298 5.053 1.00 0.00 C ATOM 1286 CE1 HIS A 89 11.133 2.311 5.469 1.00 0.00 C ATOM 1287 NE2 HIS A 89 10.097 1.722 6.033 1.00 0.00 N ATOM 0 H HIS A 89 7.946 4.379 2.655 1.00 0.00 H new ATOM 0 HA HIS A 89 9.835 3.469 1.961 1.00 0.00 H new ATOM 0 HB2 HIS A 89 8.366 0.876 2.482 1.00 0.00 H new ATOM 0 HB3 HIS A 89 10.015 0.904 1.891 1.00 0.00 H new ATOM 0 HD2 HIS A 89 8.298 0.780 5.203 1.00 0.00 H new ATOM 0 HE1 HIS A 89 11.975 2.743 5.989 1.00 0.00 H new ATOM 0 HE2 HIS A 89 9.959 1.601 7.036 1.00 0.00 H new ATOM 1296 N LEU A 90 8.457 3.680 -0.457 1.00 0.00 N ATOM 1297 CA LEU A 90 8.355 3.729 -1.909 1.00 0.00 C ATOM 1298 C LEU A 90 9.476 4.596 -2.486 1.00 0.00 C ATOM 1299 O LEU A 90 10.182 5.279 -1.738 1.00 0.00 O ATOM 1300 CB LEU A 90 6.968 4.254 -2.328 1.00 0.00 C ATOM 1301 CG LEU A 90 5.769 3.716 -1.522 1.00 0.00 C ATOM 1302 CD1 LEU A 90 4.526 4.526 -1.830 1.00 0.00 C ATOM 1303 CD2 LEU A 90 5.529 2.240 -1.808 1.00 0.00 C ATOM 0 H LEU A 90 8.122 4.527 0.003 1.00 0.00 H new ATOM 0 HA LEU A 90 8.467 2.722 -2.310 1.00 0.00 H new ATOM 0 HB2 LEU A 90 6.974 5.341 -2.250 1.00 0.00 H new ATOM 0 HB3 LEU A 90 6.812 4.011 -3.379 1.00 0.00 H new ATOM 0 HG LEU A 90 6.001 3.816 -0.462 1.00 0.00 H new ATOM 0 HD11 LEU A 90 3.686 4.136 -1.255 1.00 0.00 H new ATOM 0 HD12 LEU A 90 4.696 5.569 -1.563 1.00 0.00 H new ATOM 0 HD13 LEU A 90 4.301 4.456 -2.894 1.00 0.00 H new ATOM 0 HD21 LEU A 90 4.677 1.890 -1.225 1.00 0.00 H new ATOM 0 HD22 LEU A 90 5.322 2.104 -2.870 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.415 1.668 -1.535 1.00 0.00 H new ATOM 1315 N SER A 91 9.654 4.545 -3.810 1.00 0.00 N ATOM 1316 CA SER A 91 10.688 5.308 -4.480 1.00 0.00 C ATOM 1317 C SER A 91 10.126 6.540 -5.172 1.00 0.00 C ATOM 1318 O SER A 91 10.876 7.469 -5.489 1.00 0.00 O ATOM 1319 CB SER A 91 11.420 4.440 -5.506 1.00 0.00 C ATOM 1320 OG SER A 91 12.635 5.044 -5.917 1.00 0.00 O ATOM 0 H SER A 91 9.085 3.975 -4.435 1.00 0.00 H new ATOM 0 HA SER A 91 11.388 5.636 -3.712 1.00 0.00 H new ATOM 0 HB2 SER A 91 11.626 3.460 -5.076 1.00 0.00 H new ATOM 0 HB3 SER A 91 10.779 4.279 -6.373 1.00 0.00 H new ATOM 0 HG SER A 91 13.082 4.467 -6.571 1.00 0.00 H new ATOM 1326 N LYS A 92 8.802 6.557 -5.392 1.00 0.00 N ATOM 1327 CA LYS A 92 8.150 7.654 -6.082 1.00 0.00 C ATOM 1328 C LYS A 92 6.643 7.599 -5.935 1.00 0.00 C ATOM 1329 O LYS A 92 6.063 6.571 -5.570 1.00 0.00 O ATOM 1330 CB LYS A 92 8.498 7.647 -7.573 1.00 0.00 C ATOM 1331 CG LYS A 92 9.153 8.921 -8.043 1.00 0.00 C ATOM 1332 CD LYS A 92 9.839 8.708 -9.378 1.00 0.00 C ATOM 1333 CE LYS A 92 10.345 10.017 -9.958 1.00 0.00 C ATOM 1334 NZ LYS A 92 11.243 9.799 -11.125 1.00 0.00 N ATOM 0 H LYS A 92 8.169 5.814 -5.096 1.00 0.00 H new ATOM 0 HA LYS A 92 8.516 8.571 -5.620 1.00 0.00 H new ATOM 0 HB2 LYS A 92 9.163 6.808 -7.779 1.00 0.00 H new ATOM 0 HB3 LYS A 92 7.588 7.481 -8.150 1.00 0.00 H new ATOM 0 HG2 LYS A 92 8.405 9.709 -8.134 1.00 0.00 H new ATOM 0 HG3 LYS A 92 9.880 9.256 -7.304 1.00 0.00 H new ATOM 0 HD2 LYS A 92 10.673 8.017 -9.254 1.00 0.00 H new ATOM 0 HD3 LYS A 92 9.142 8.244 -10.076 1.00 0.00 H new ATOM 0 HE2 LYS A 92 9.497 10.631 -10.263 1.00 0.00 H new ATOM 0 HE3 LYS A 92 10.880 10.572 -9.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 11.566 10.717 -11.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 12.066 9.235 -10.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 10.726 9.292 -11.871 1.00 0.00 H new ATOM 1348 N ILE A 93 6.043 8.732 -6.242 1.00 0.00 N ATOM 1349 CA ILE A 93 4.614 8.919 -6.199 1.00 0.00 C ATOM 1350 C ILE A 93 4.099 9.480 -7.520 1.00 0.00 C ATOM 1351 O ILE A 93 4.793 10.229 -8.214 1.00 0.00 O ATOM 1352 CB ILE A 93 4.228 9.853 -5.015 1.00 0.00 C ATOM 1353 CG1 ILE A 93 3.804 9.053 -3.786 1.00 0.00 C ATOM 1354 CG2 ILE A 93 3.160 10.870 -5.363 1.00 0.00 C ATOM 1355 CD1 ILE A 93 4.960 8.684 -2.872 1.00 0.00 C ATOM 0 H ILE A 93 6.552 9.566 -6.535 1.00 0.00 H new ATOM 0 HA ILE A 93 4.144 7.948 -6.042 1.00 0.00 H new ATOM 0 HB ILE A 93 5.135 10.412 -4.786 1.00 0.00 H new ATOM 0 HG12 ILE A 93 3.075 9.632 -3.220 1.00 0.00 H new ATOM 0 HG13 ILE A 93 3.304 8.141 -4.111 1.00 0.00 H new ATOM 0 HG21 ILE A 93 2.944 11.484 -4.489 1.00 0.00 H new ATOM 0 HG22 ILE A 93 3.514 11.506 -6.175 1.00 0.00 H new ATOM 0 HG23 ILE A 93 2.253 10.353 -5.676 1.00 0.00 H new ATOM 0 HD11 ILE A 93 4.584 8.117 -2.020 1.00 0.00 H new ATOM 0 HD12 ILE A 93 5.680 8.078 -3.422 1.00 0.00 H new ATOM 0 HD13 ILE A 93 5.447 9.592 -2.517 1.00 0.00 H new ATOM 1367 N SER A 94 2.879 9.089 -7.839 1.00 0.00 N ATOM 1368 CA SER A 94 2.186 9.537 -9.023 1.00 0.00 C ATOM 1369 C SER A 94 1.016 10.428 -8.632 1.00 0.00 C ATOM 1370 O SER A 94 0.353 11.024 -9.490 1.00 0.00 O ATOM 1371 CB SER A 94 1.641 8.346 -9.782 1.00 0.00 C ATOM 1372 OG SER A 94 1.433 8.652 -11.150 1.00 0.00 O ATOM 0 H SER A 94 2.336 8.440 -7.270 1.00 0.00 H new ATOM 0 HA SER A 94 2.888 10.091 -9.646 1.00 0.00 H new ATOM 0 HB2 SER A 94 2.336 7.510 -9.697 1.00 0.00 H new ATOM 0 HB3 SER A 94 0.701 8.026 -9.333 1.00 0.00 H new ATOM 0 HG SER A 94 0.974 9.514 -11.226 1.00 0.00 H new ATOM 1378 N VAL A 95 0.775 10.508 -7.324 1.00 0.00 N ATOM 1379 CA VAL A 95 -0.310 11.243 -6.785 1.00 0.00 C ATOM 1380 C VAL A 95 0.122 12.580 -6.181 1.00 0.00 C ATOM 1381 O VAL A 95 1.287 12.977 -6.264 1.00 0.00 O ATOM 1382 CB VAL A 95 -1.100 10.414 -5.745 1.00 0.00 C ATOM 1383 CG1 VAL A 95 -2.247 9.680 -6.415 1.00 0.00 C ATOM 1384 CG2 VAL A 95 -0.213 9.435 -4.977 1.00 0.00 C ATOM 0 H VAL A 95 1.351 10.048 -6.619 1.00 0.00 H new ATOM 0 HA VAL A 95 -0.968 11.464 -7.626 1.00 0.00 H new ATOM 0 HB VAL A 95 -1.501 11.117 -5.015 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.793 9.101 -5.670 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -2.920 10.402 -6.878 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -1.853 9.009 -7.178 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -0.819 8.880 -4.261 1.00 0.00 H new ATOM 0 HG22 VAL A 95 0.251 8.739 -5.676 1.00 0.00 H new ATOM 0 HG23 VAL A 95 0.562 9.987 -4.445 1.00 0.00 H new ATOM 1394 N SER A 96 -0.852 13.257 -5.575 1.00 0.00 N ATOM 1395 CA SER A 96 -0.675 14.550 -4.955 1.00 0.00 C ATOM 1396 C SER A 96 -1.702 14.712 -3.855 1.00 0.00 C ATOM 1397 O SER A 96 -2.846 14.273 -3.990 1.00 0.00 O ATOM 1398 CB SER A 96 -0.812 15.691 -5.973 1.00 0.00 C ATOM 1399 OG SER A 96 0.136 15.559 -7.017 1.00 0.00 O ATOM 0 H SER A 96 -1.807 12.904 -5.505 1.00 0.00 H new ATOM 0 HA SER A 96 0.332 14.601 -4.542 1.00 0.00 H new ATOM 0 HB2 SER A 96 -1.819 15.692 -6.390 1.00 0.00 H new ATOM 0 HB3 SER A 96 -0.674 16.649 -5.471 1.00 0.00 H new ATOM 0 HG SER A 96 0.027 16.297 -7.653 1.00 0.00 H new ATOM 1405 N THR A 97 -1.284 15.360 -2.778 1.00 0.00 N ATOM 1406 CA THR A 97 -2.131 15.599 -1.610 1.00 0.00 C ATOM 1407 C THR A 97 -3.433 16.329 -1.991 1.00 0.00 C ATOM 1408 O THR A 97 -3.392 17.358 -2.671 1.00 0.00 O ATOM 1409 CB THR A 97 -1.371 16.427 -0.548 1.00 0.00 C ATOM 1410 OG1 THR A 97 -0.021 15.958 -0.433 1.00 0.00 O ATOM 1411 CG2 THR A 97 -2.040 16.354 0.823 1.00 0.00 C ATOM 0 H THR A 97 -0.342 15.739 -2.685 1.00 0.00 H new ATOM 0 HA THR A 97 -2.391 14.625 -1.196 1.00 0.00 H new ATOM 0 HB THR A 97 -1.385 17.465 -0.880 1.00 0.00 H new ATOM 0 HG1 THR A 97 0.454 16.489 0.240 1.00 0.00 H new ATOM 0 HG21 THR A 97 -1.472 16.950 1.537 1.00 0.00 H new ATOM 0 HG22 THR A 97 -3.056 16.742 0.753 1.00 0.00 H new ATOM 0 HG23 THR A 97 -2.070 15.317 1.158 1.00 0.00 H new ATOM 1419 N ASP A 98 -4.575 15.753 -1.562 1.00 0.00 N ATOM 1420 CA ASP A 98 -5.936 16.298 -1.796 1.00 0.00 C ATOM 1421 C ASP A 98 -6.503 15.848 -3.149 1.00 0.00 C ATOM 1422 O ASP A 98 -7.666 16.131 -3.458 1.00 0.00 O ATOM 1423 CB ASP A 98 -5.992 17.839 -1.669 1.00 0.00 C ATOM 1424 CG ASP A 98 -7.332 18.337 -1.156 1.00 0.00 C ATOM 1425 OD1 ASP A 98 -8.220 18.614 -1.989 1.00 0.00 O ATOM 1426 OD2 ASP A 98 -7.490 18.451 0.077 1.00 0.00 O ATOM 0 H ASP A 98 -4.581 14.881 -1.034 1.00 0.00 H new ATOM 0 HA ASP A 98 -6.564 15.885 -1.007 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -5.203 18.173 -0.995 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -5.791 18.287 -2.642 1.00 0.00 H new ATOM 1431 N SER A 99 -5.689 15.131 -3.947 1.00 0.00 N ATOM 1432 CA SER A 99 -6.120 14.629 -5.239 1.00 0.00 C ATOM 1433 C SER A 99 -6.938 13.357 -5.072 1.00 0.00 C ATOM 1434 O SER A 99 -6.761 12.622 -4.101 1.00 0.00 O ATOM 1435 CB SER A 99 -4.914 14.340 -6.127 1.00 0.00 C ATOM 1436 OG SER A 99 -4.105 15.492 -6.286 1.00 0.00 O ATOM 0 H SER A 99 -4.727 14.892 -3.706 1.00 0.00 H new ATOM 0 HA SER A 99 -6.739 15.394 -5.709 1.00 0.00 H new ATOM 0 HB2 SER A 99 -4.323 13.535 -5.691 1.00 0.00 H new ATOM 0 HB3 SER A 99 -5.253 13.993 -7.103 1.00 0.00 H new ATOM 0 HG SER A 99 -3.802 15.553 -7.216 1.00 0.00 H new ATOM 1442 N THR A 100 -7.849 13.117 -6.011 1.00 0.00 N ATOM 1443 CA THR A 100 -8.681 11.931 -5.992 1.00 0.00 C ATOM 1444 C THR A 100 -7.981 10.747 -6.633 1.00 0.00 C ATOM 1445 O THR A 100 -7.221 10.904 -7.593 1.00 0.00 O ATOM 1446 CB THR A 100 -10.024 12.143 -6.693 1.00 0.00 C ATOM 1447 OG1 THR A 100 -9.851 12.895 -7.902 1.00 0.00 O ATOM 1448 CG2 THR A 100 -10.995 12.850 -5.769 1.00 0.00 C ATOM 0 H THR A 100 -8.026 13.739 -6.800 1.00 0.00 H new ATOM 0 HA THR A 100 -8.867 11.722 -4.938 1.00 0.00 H new ATOM 0 HB THR A 100 -10.434 11.167 -6.951 1.00 0.00 H new ATOM 0 HG1 THR A 100 -10.720 13.019 -8.337 1.00 0.00 H new ATOM 0 HG21 THR A 100 -11.946 12.994 -6.282 1.00 0.00 H new ATOM 0 HG22 THR A 100 -11.152 12.246 -4.875 1.00 0.00 H new ATOM 0 HG23 THR A 100 -10.586 13.819 -5.484 1.00 0.00 H new ATOM 1456 N VAL A 101 -8.252 9.569 -6.089 1.00 0.00 N ATOM 1457 CA VAL A 101 -7.665 8.353 -6.568 1.00 0.00 C ATOM 1458 C VAL A 101 -8.714 7.304 -6.911 1.00 0.00 C ATOM 1459 O VAL A 101 -9.894 7.447 -6.580 1.00 0.00 O ATOM 1460 CB VAL A 101 -6.678 7.741 -5.555 1.00 0.00 C ATOM 1461 CG1 VAL A 101 -5.250 8.069 -5.940 1.00 0.00 C ATOM 1462 CG2 VAL A 101 -6.969 8.173 -4.121 1.00 0.00 C ATOM 0 H VAL A 101 -8.888 9.443 -5.302 1.00 0.00 H new ATOM 0 HA VAL A 101 -7.124 8.633 -7.472 1.00 0.00 H new ATOM 0 HB VAL A 101 -6.812 6.660 -5.589 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -4.567 7.629 -5.213 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -5.038 7.664 -6.929 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -5.116 9.151 -5.955 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -6.245 7.714 -3.448 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -6.896 9.258 -4.046 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -7.974 7.857 -3.843 1.00 0.00 H new ATOM 1472 N LYS A 102 -8.242 6.237 -7.561 1.00 0.00 N ATOM 1473 CA LYS A 102 -9.050 5.131 -7.978 1.00 0.00 C ATOM 1474 C LYS A 102 -8.277 3.842 -7.809 1.00 0.00 C ATOM 1475 O LYS A 102 -7.055 3.804 -7.955 1.00 0.00 O ATOM 1476 CB LYS A 102 -9.477 5.326 -9.421 1.00 0.00 C ATOM 1477 CG LYS A 102 -10.656 4.456 -9.871 1.00 0.00 C ATOM 1478 CD LYS A 102 -10.323 3.617 -11.101 1.00 0.00 C ATOM 1479 CE LYS A 102 -11.452 3.656 -12.119 1.00 0.00 C ATOM 1480 NZ LYS A 102 -11.152 2.822 -13.315 1.00 0.00 N ATOM 0 H LYS A 102 -7.258 6.134 -7.810 1.00 0.00 H new ATOM 0 HA LYS A 102 -9.946 5.076 -7.360 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -9.741 6.373 -9.568 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -8.624 5.119 -10.068 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -10.951 3.797 -9.054 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -11.512 5.094 -10.091 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -9.405 3.987 -11.558 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -10.137 2.586 -10.801 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -12.373 3.304 -11.653 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -11.625 4.686 -12.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -11.946 2.876 -13.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -10.288 3.173 -13.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -11.012 1.834 -13.023 1.00 0.00 H new ATOM 1494 N GLN A 103 -9.022 2.790 -7.522 1.00 0.00 N ATOM 1495 CA GLN A 103 -8.483 1.459 -7.315 1.00 0.00 C ATOM 1496 C GLN A 103 -7.710 0.973 -8.544 1.00 0.00 C ATOM 1497 O GLN A 103 -8.132 1.171 -9.687 1.00 0.00 O ATOM 1498 CB GLN A 103 -9.622 0.493 -6.967 1.00 0.00 C ATOM 1499 CG GLN A 103 -9.186 -0.800 -6.268 1.00 0.00 C ATOM 1500 CD GLN A 103 -8.937 -1.934 -7.234 1.00 0.00 C ATOM 1501 OE1 GLN A 103 -9.025 -3.108 -6.874 1.00 0.00 O ATOM 1502 NE2 GLN A 103 -8.642 -1.586 -8.468 1.00 0.00 N ATOM 0 H GLN A 103 -10.036 2.838 -7.425 1.00 0.00 H new ATOM 0 HA GLN A 103 -7.778 1.494 -6.484 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -10.335 1.012 -6.326 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -10.150 0.232 -7.884 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -8.277 -0.610 -5.697 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -9.954 -1.099 -5.555 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -8.580 -0.599 -8.719 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -8.475 -2.303 -9.174 1.00 0.00 H new ATOM 1511 N GLY A 104 -6.578 0.340 -8.264 1.00 0.00 N ATOM 1512 CA GLY A 104 -5.697 -0.200 -9.287 1.00 0.00 C ATOM 1513 C GLY A 104 -4.848 0.844 -9.989 1.00 0.00 C ATOM 1514 O GLY A 104 -3.961 0.499 -10.771 1.00 0.00 O ATOM 0 H GLY A 104 -6.244 0.187 -7.312 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -5.040 -0.940 -8.831 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -6.299 -0.723 -10.030 1.00 0.00 H new ATOM 1518 N GLN A 105 -5.132 2.120 -9.716 1.00 0.00 N ATOM 1519 CA GLN A 105 -4.406 3.234 -10.307 1.00 0.00 C ATOM 1520 C GLN A 105 -3.013 3.308 -9.738 1.00 0.00 C ATOM 1521 O GLN A 105 -2.797 3.059 -8.552 1.00 0.00 O ATOM 1522 CB GLN A 105 -5.182 4.532 -10.062 1.00 0.00 C ATOM 1523 CG GLN A 105 -4.650 5.777 -10.756 1.00 0.00 C ATOM 1524 CD GLN A 105 -5.608 6.936 -10.600 1.00 0.00 C ATOM 1525 OE1 GLN A 105 -6.374 7.253 -11.510 1.00 0.00 O ATOM 1526 NE2 GLN A 105 -5.595 7.552 -9.424 1.00 0.00 N ATOM 0 H GLN A 105 -5.874 2.404 -9.077 1.00 0.00 H new ATOM 0 HA GLN A 105 -4.314 3.085 -11.383 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -6.214 4.379 -10.378 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -5.202 4.721 -8.989 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -3.680 6.044 -10.338 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -4.495 5.569 -11.815 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -4.942 7.254 -8.699 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -6.238 8.323 -9.245 1.00 0.00 H new ATOM 1535 N ILE A 106 -2.074 3.631 -10.610 1.00 0.00 N ATOM 1536 CA ILE A 106 -0.691 3.733 -10.231 1.00 0.00 C ATOM 1537 C ILE A 106 -0.482 4.991 -9.398 1.00 0.00 C ATOM 1538 O ILE A 106 -0.441 6.114 -9.912 1.00 0.00 O ATOM 1539 CB ILE A 106 0.261 3.669 -11.444 1.00 0.00 C ATOM 1540 CG1 ILE A 106 0.156 2.285 -12.119 1.00 0.00 C ATOM 1541 CG2 ILE A 106 1.717 3.963 -11.043 1.00 0.00 C ATOM 1542 CD1 ILE A 106 0.572 2.259 -13.578 1.00 0.00 C ATOM 0 H ILE A 106 -2.256 3.828 -11.594 1.00 0.00 H new ATOM 0 HA ILE A 106 -0.438 2.866 -9.620 1.00 0.00 H new ATOM 0 HB ILE A 106 -0.043 4.440 -12.152 1.00 0.00 H new ATOM 0 HG12 ILE A 106 0.775 1.578 -11.566 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -0.874 1.935 -12.042 1.00 0.00 H new ATOM 0 HG21 ILE A 106 2.355 3.908 -11.925 1.00 0.00 H new ATOM 0 HG22 ILE A 106 1.781 4.961 -10.610 1.00 0.00 H new ATOM 0 HG23 ILE A 106 2.048 3.228 -10.309 1.00 0.00 H new ATOM 0 HD11 ILE A 106 0.466 1.247 -13.969 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.062 2.937 -14.149 1.00 0.00 H new ATOM 0 HD13 ILE A 106 1.612 2.574 -13.666 1.00 0.00 H new ATOM 1554 N ILE A 107 -0.389 4.757 -8.105 1.00 0.00 N ATOM 1555 CA ILE A 107 -0.207 5.796 -7.122 1.00 0.00 C ATOM 1556 C ILE A 107 1.272 6.044 -6.771 1.00 0.00 C ATOM 1557 O ILE A 107 1.580 6.968 -6.011 1.00 0.00 O ATOM 1558 CB ILE A 107 -0.994 5.464 -5.830 1.00 0.00 C ATOM 1559 CG1 ILE A 107 -0.922 3.964 -5.476 1.00 0.00 C ATOM 1560 CG2 ILE A 107 -2.446 5.908 -5.963 1.00 0.00 C ATOM 1561 CD1 ILE A 107 -0.768 3.694 -3.995 1.00 0.00 C ATOM 0 H ILE A 107 -0.439 3.820 -7.704 1.00 0.00 H new ATOM 0 HA ILE A 107 -0.592 6.711 -7.572 1.00 0.00 H new ATOM 0 HB ILE A 107 -0.525 6.014 -5.014 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -1.826 3.472 -5.834 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -0.083 3.514 -6.007 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -2.985 5.668 -5.047 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -2.483 6.984 -6.134 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -2.909 5.391 -6.803 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -0.725 2.618 -3.824 1.00 0.00 H new ATOM 0 HD12 ILE A 107 0.151 4.156 -3.635 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -1.619 4.113 -3.458 1.00 0.00 H new ATOM 1573 N GLY A 108 2.173 5.220 -7.324 1.00 0.00 N ATOM 1574 CA GLY A 108 3.588 5.382 -7.087 1.00 0.00 C ATOM 1575 C GLY A 108 4.400 4.190 -7.551 1.00 0.00 C ATOM 1576 O GLY A 108 3.948 3.392 -8.373 1.00 0.00 O ATOM 0 H GLY A 108 1.933 4.440 -7.936 1.00 0.00 H new ATOM 0 HA2 GLY A 108 3.938 6.277 -7.601 1.00 0.00 H new ATOM 0 HA3 GLY A 108 3.758 5.539 -6.022 1.00 0.00 H new ATOM 1580 N TYR A 109 5.606 4.108 -7.010 1.00 0.00 N ATOM 1581 CA TYR A 109 6.564 3.055 -7.286 1.00 0.00 C ATOM 1582 C TYR A 109 7.257 2.679 -5.985 1.00 0.00 C ATOM 1583 O TYR A 109 7.621 3.554 -5.197 1.00 0.00 O ATOM 1584 CB TYR A 109 7.622 3.492 -8.316 1.00 0.00 C ATOM 1585 CG TYR A 109 7.062 4.054 -9.606 1.00 0.00 C ATOM 1586 CD1 TYR A 109 6.972 3.275 -10.753 1.00 0.00 C ATOM 1587 CD2 TYR A 109 6.632 5.370 -9.672 1.00 0.00 C ATOM 1588 CE1 TYR A 109 6.466 3.796 -11.930 1.00 0.00 C ATOM 1589 CE2 TYR A 109 6.122 5.899 -10.841 1.00 0.00 C ATOM 1590 CZ TYR A 109 6.043 5.109 -11.968 1.00 0.00 C ATOM 1591 OH TYR A 109 5.538 5.632 -13.136 1.00 0.00 O ATOM 0 H TYR A 109 5.954 4.798 -6.344 1.00 0.00 H new ATOM 0 HA TYR A 109 6.027 2.205 -7.706 1.00 0.00 H new ATOM 0 HB2 TYR A 109 8.265 4.244 -7.858 1.00 0.00 H new ATOM 0 HB3 TYR A 109 8.252 2.635 -8.553 1.00 0.00 H new ATOM 0 HD1 TYR A 109 7.302 2.247 -10.725 1.00 0.00 H new ATOM 0 HD2 TYR A 109 6.697 5.993 -8.792 1.00 0.00 H new ATOM 0 HE1 TYR A 109 6.402 3.179 -12.814 1.00 0.00 H new ATOM 0 HE2 TYR A 109 5.787 6.925 -10.872 1.00 0.00 H new ATOM 0 HH TYR A 109 5.285 6.568 -12.993 1.00 0.00 H new ATOM 1601 N THR A 110 7.447 1.378 -5.785 1.00 0.00 N ATOM 1602 CA THR A 110 8.083 0.824 -4.582 1.00 0.00 C ATOM 1603 C THR A 110 9.536 1.280 -4.423 1.00 0.00 C ATOM 1604 O THR A 110 10.201 1.569 -5.422 1.00 0.00 O ATOM 1605 CB THR A 110 8.051 -0.712 -4.615 1.00 0.00 C ATOM 1606 OG1 THR A 110 8.126 -1.188 -5.965 1.00 0.00 O ATOM 1607 CG2 THR A 110 6.795 -1.250 -3.946 1.00 0.00 C ATOM 0 H THR A 110 7.162 0.666 -6.458 1.00 0.00 H new ATOM 0 HA THR A 110 7.512 1.198 -3.733 1.00 0.00 H new ATOM 0 HB THR A 110 8.918 -1.073 -4.061 1.00 0.00 H new ATOM 0 HG1 THR A 110 8.808 -1.889 -6.027 1.00 0.00 H new ATOM 0 HG21 THR A 110 6.800 -2.339 -3.985 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.768 -0.924 -2.906 1.00 0.00 H new ATOM 0 HG23 THR A 110 5.915 -0.873 -4.467 1.00 0.00 H new ATOM 1615 N GLY A 111 10.021 1.368 -3.168 1.00 0.00 N ATOM 1616 CA GLY A 111 11.396 1.784 -2.951 1.00 0.00 C ATOM 1617 C GLY A 111 11.939 1.424 -1.592 1.00 0.00 C ATOM 1618 O GLY A 111 11.424 0.536 -0.910 1.00 0.00 O ATOM 0 H GLY A 111 9.490 1.161 -2.322 1.00 0.00 H new ATOM 0 HA2 GLY A 111 12.027 1.330 -3.715 1.00 0.00 H new ATOM 0 HA3 GLY A 111 11.463 2.864 -3.083 1.00 0.00 H new ATOM 1622 N ALA A 112 13.015 2.120 -1.225 1.00 0.00 N ATOM 1623 CA ALA A 112 13.672 1.958 0.053 1.00 0.00 C ATOM 1624 C ALA A 112 14.310 3.294 0.450 1.00 0.00 C ATOM 1625 O ALA A 112 15.504 3.373 0.771 1.00 0.00 O ATOM 1626 CB ALA A 112 14.721 0.840 0.016 1.00 0.00 C ATOM 0 H ALA A 112 13.454 2.820 -1.823 1.00 0.00 H new ATOM 0 HA ALA A 112 12.931 1.666 0.797 1.00 0.00 H new ATOM 0 HB1 ALA A 112 15.192 0.750 0.995 1.00 0.00 H new ATOM 0 HB2 ALA A 112 14.239 -0.103 -0.243 1.00 0.00 H new ATOM 0 HB3 ALA A 112 15.479 1.077 -0.731 1.00 0.00 H new ATOM 1632 N THR A 113 13.491 4.349 0.412 1.00 0.00 N ATOM 1633 CA THR A 113 13.940 5.713 0.711 1.00 0.00 C ATOM 1634 C THR A 113 14.028 6.009 2.219 1.00 0.00 C ATOM 1635 O THR A 113 14.355 7.133 2.616 1.00 0.00 O ATOM 1636 CB THR A 113 13.014 6.748 0.037 1.00 0.00 C ATOM 1637 OG1 THR A 113 11.645 6.432 0.314 1.00 0.00 O ATOM 1638 CG2 THR A 113 13.233 6.775 -1.471 1.00 0.00 C ATOM 0 H THR A 113 12.501 4.283 0.174 1.00 0.00 H new ATOM 0 HA THR A 113 14.949 5.793 0.308 1.00 0.00 H new ATOM 0 HB THR A 113 13.253 7.731 0.442 1.00 0.00 H new ATOM 0 HG1 THR A 113 11.595 5.862 1.110 1.00 0.00 H new ATOM 0 HG21 THR A 113 12.569 7.512 -1.922 1.00 0.00 H new ATOM 0 HG22 THR A 113 14.268 7.041 -1.684 1.00 0.00 H new ATOM 0 HG23 THR A 113 13.019 5.791 -1.887 1.00 0.00 H new ATOM 1646 N GLY A 114 13.748 4.995 3.045 1.00 0.00 N ATOM 1647 CA GLY A 114 13.817 5.156 4.492 1.00 0.00 C ATOM 1648 C GLY A 114 14.974 4.380 5.092 1.00 0.00 C ATOM 1649 O GLY A 114 15.894 3.982 4.371 1.00 0.00 O ATOM 0 H GLY A 114 13.474 4.063 2.734 1.00 0.00 H new ATOM 0 HA2 GLY A 114 13.924 6.213 4.735 1.00 0.00 H new ATOM 0 HA3 GLY A 114 12.882 4.819 4.940 1.00 0.00 H new ATOM 1653 N GLN A 115 14.923 4.153 6.412 1.00 0.00 N ATOM 1654 CA GLN A 115 15.979 3.409 7.108 1.00 0.00 C ATOM 1655 C GLN A 115 15.633 1.916 7.155 1.00 0.00 C ATOM 1656 O GLN A 115 14.977 1.437 8.089 1.00 0.00 O ATOM 1657 CB GLN A 115 16.186 3.959 8.529 1.00 0.00 C ATOM 1658 CG GLN A 115 16.868 5.319 8.572 1.00 0.00 C ATOM 1659 CD GLN A 115 17.106 5.808 9.989 1.00 0.00 C ATOM 1660 OE1 GLN A 115 16.267 6.496 10.570 1.00 0.00 O ATOM 1661 NE2 GLN A 115 18.255 5.452 10.552 1.00 0.00 N ATOM 0 H GLN A 115 14.165 4.473 7.016 1.00 0.00 H new ATOM 0 HA GLN A 115 16.911 3.534 6.556 1.00 0.00 H new ATOM 0 HB2 GLN A 115 15.218 4.034 9.024 1.00 0.00 H new ATOM 0 HB3 GLN A 115 16.782 3.247 9.100 1.00 0.00 H new ATOM 0 HG2 GLN A 115 17.821 5.260 8.047 1.00 0.00 H new ATOM 0 HG3 GLN A 115 16.255 6.046 8.039 1.00 0.00 H new ATOM 0 HE21 GLN A 115 18.922 4.881 10.033 1.00 0.00 H new ATOM 0 HE22 GLN A 115 18.471 5.750 11.503 1.00 0.00 H new ATOM 1670 N VAL A 116 16.099 1.189 6.132 1.00 0.00 N ATOM 1671 CA VAL A 116 15.858 -0.255 6.002 1.00 0.00 C ATOM 1672 C VAL A 116 16.995 -0.927 5.228 1.00 0.00 C ATOM 1673 O VAL A 116 17.717 -0.266 4.476 1.00 0.00 O ATOM 1674 CB VAL A 116 14.489 -0.582 5.318 1.00 0.00 C ATOM 1675 CG1 VAL A 116 13.341 -0.394 6.304 1.00 0.00 C ATOM 1676 CG2 VAL A 116 14.248 0.260 4.061 1.00 0.00 C ATOM 0 H VAL A 116 16.653 1.584 5.372 1.00 0.00 H new ATOM 0 HA VAL A 116 15.820 -0.652 7.016 1.00 0.00 H new ATOM 0 HB VAL A 116 14.531 -1.626 5.007 1.00 0.00 H new ATOM 0 HG11 VAL A 116 12.397 -0.626 5.811 1.00 0.00 H new ATOM 0 HG12 VAL A 116 13.479 -1.061 7.155 1.00 0.00 H new ATOM 0 HG13 VAL A 116 13.325 0.639 6.651 1.00 0.00 H new ATOM 0 HG21 VAL A 116 13.285 -0.005 3.624 1.00 0.00 H new ATOM 0 HG22 VAL A 116 14.247 1.317 4.326 1.00 0.00 H new ATOM 0 HG23 VAL A 116 15.040 0.068 3.337 1.00 0.00 H new ATOM 1686 N THR A 117 17.132 -2.246 5.407 1.00 0.00 N ATOM 1687 CA THR A 117 18.187 -3.022 4.736 1.00 0.00 C ATOM 1688 C THR A 117 17.776 -3.483 3.320 1.00 0.00 C ATOM 1689 O THR A 117 18.591 -4.077 2.605 1.00 0.00 O ATOM 1690 CB THR A 117 18.641 -4.243 5.598 1.00 0.00 C ATOM 1691 OG1 THR A 117 19.660 -4.985 4.913 1.00 0.00 O ATOM 1692 CG2 THR A 117 17.482 -5.181 5.953 1.00 0.00 C ATOM 0 H THR A 117 16.526 -2.801 6.011 1.00 0.00 H new ATOM 0 HA THR A 117 19.034 -2.346 4.624 1.00 0.00 H new ATOM 0 HB THR A 117 19.034 -3.837 6.530 1.00 0.00 H new ATOM 0 HG1 THR A 117 19.528 -4.906 3.945 1.00 0.00 H new ATOM 0 HG21 THR A 117 17.856 -6.011 6.552 1.00 0.00 H new ATOM 0 HG22 THR A 117 16.731 -4.632 6.522 1.00 0.00 H new ATOM 0 HG23 THR A 117 17.033 -5.568 5.038 1.00 0.00 H new ATOM 1700 N GLY A 118 16.524 -3.208 2.925 1.00 0.00 N ATOM 1701 CA GLY A 118 16.056 -3.605 1.605 1.00 0.00 C ATOM 1702 C GLY A 118 14.741 -2.940 1.195 1.00 0.00 C ATOM 1703 O GLY A 118 14.047 -2.388 2.055 1.00 0.00 O ATOM 0 H GLY A 118 15.833 -2.720 3.496 1.00 0.00 H new ATOM 0 HA2 GLY A 118 16.822 -3.361 0.869 1.00 0.00 H new ATOM 0 HA3 GLY A 118 15.928 -4.687 1.585 1.00 0.00 H new ATOM 1707 N PRO A 119 14.366 -2.964 -0.127 1.00 0.00 N ATOM 1708 CA PRO A 119 13.111 -2.365 -0.625 1.00 0.00 C ATOM 1709 C PRO A 119 11.905 -3.265 -0.391 1.00 0.00 C ATOM 1710 O PRO A 119 12.004 -4.487 -0.535 1.00 0.00 O ATOM 1711 CB PRO A 119 13.363 -2.188 -2.136 1.00 0.00 C ATOM 1712 CG PRO A 119 14.767 -2.644 -2.386 1.00 0.00 C ATOM 1713 CD PRO A 119 15.125 -3.552 -1.250 1.00 0.00 C ATOM 0 HA PRO A 119 12.877 -1.434 -0.109 1.00 0.00 H new ATOM 0 HB2 PRO A 119 12.654 -2.775 -2.719 1.00 0.00 H new ATOM 0 HB3 PRO A 119 13.234 -1.147 -2.432 1.00 0.00 H new ATOM 0 HG2 PRO A 119 14.842 -3.167 -3.339 1.00 0.00 H new ATOM 0 HG3 PRO A 119 15.449 -1.795 -2.434 1.00 0.00 H new ATOM 0 HD2 PRO A 119 14.830 -4.583 -1.445 1.00 0.00 H new ATOM 0 HD3 PRO A 119 16.198 -3.558 -1.057 1.00 0.00 H new ATOM 1721 N HIS A 120 10.772 -2.657 0.012 1.00 0.00 N ATOM 1722 CA HIS A 120 9.548 -3.395 0.268 1.00 0.00 C ATOM 1723 C HIS A 120 8.326 -2.474 0.249 1.00 0.00 C ATOM 1724 O HIS A 120 8.391 -1.333 -0.218 1.00 0.00 O ATOM 1725 CB HIS A 120 9.652 -4.213 1.586 1.00 0.00 C ATOM 1726 CG HIS A 120 9.917 -3.407 2.824 1.00 0.00 C ATOM 1727 ND1 HIS A 120 11.180 -3.239 3.352 1.00 0.00 N ATOM 1728 CD2 HIS A 120 9.073 -2.744 3.648 1.00 0.00 C ATOM 1729 CE1 HIS A 120 11.102 -2.510 4.449 1.00 0.00 C ATOM 1730 NE2 HIS A 120 9.835 -2.196 4.650 1.00 0.00 N ATOM 0 H HIS A 120 10.693 -1.651 0.164 1.00 0.00 H new ATOM 0 HA HIS A 120 9.411 -4.112 -0.541 1.00 0.00 H new ATOM 0 HB2 HIS A 120 8.723 -4.766 1.725 1.00 0.00 H new ATOM 0 HB3 HIS A 120 10.448 -4.949 1.475 1.00 0.00 H new ATOM 0 HD2 HIS A 120 8.002 -2.661 3.538 1.00 0.00 H new ATOM 0 HE1 HIS A 120 11.932 -2.220 5.076 1.00 0.00 H new ATOM 0 HE2 HIS A 120 9.480 -1.636 5.425 1.00 0.00 H new ATOM 1739 N LEU A 121 7.223 -3.010 0.748 1.00 0.00 N ATOM 1740 CA LEU A 121 5.956 -2.337 0.785 1.00 0.00 C ATOM 1741 C LEU A 121 5.420 -2.252 2.200 1.00 0.00 C ATOM 1742 O LEU A 121 5.376 -3.240 2.934 1.00 0.00 O ATOM 1743 CB LEU A 121 4.957 -3.048 -0.154 1.00 0.00 C ATOM 1744 CG LEU A 121 3.448 -2.785 0.053 1.00 0.00 C ATOM 1745 CD1 LEU A 121 3.060 -1.373 -0.380 1.00 0.00 C ATOM 1746 CD2 LEU A 121 2.629 -3.813 -0.714 1.00 0.00 C ATOM 0 H LEU A 121 7.195 -3.949 1.146 1.00 0.00 H new ATOM 0 HA LEU A 121 6.094 -1.314 0.434 1.00 0.00 H new ATOM 0 HB2 LEU A 121 5.206 -2.770 -1.178 1.00 0.00 H new ATOM 0 HB3 LEU A 121 5.123 -4.122 -0.066 1.00 0.00 H new ATOM 0 HG LEU A 121 3.235 -2.876 1.118 1.00 0.00 H new ATOM 0 HD11 LEU A 121 1.992 -1.224 -0.220 1.00 0.00 H new ATOM 0 HD12 LEU A 121 3.620 -0.645 0.208 1.00 0.00 H new ATOM 0 HD13 LEU A 121 3.291 -1.240 -1.437 1.00 0.00 H new ATOM 0 HD21 LEU A 121 1.567 -3.619 -0.562 1.00 0.00 H new ATOM 0 HD22 LEU A 121 2.862 -3.744 -1.777 1.00 0.00 H new ATOM 0 HD23 LEU A 121 2.871 -4.813 -0.354 1.00 0.00 H new ATOM 1758 N HIS A 122 5.035 -1.048 2.558 1.00 0.00 N ATOM 1759 CA HIS A 122 4.455 -0.769 3.840 1.00 0.00 C ATOM 1760 C HIS A 122 2.996 -0.374 3.644 1.00 0.00 C ATOM 1761 O HIS A 122 2.698 0.693 3.102 1.00 0.00 O ATOM 1762 CB HIS A 122 5.243 0.328 4.595 1.00 0.00 C ATOM 1763 CG HIS A 122 4.531 0.891 5.807 1.00 0.00 C ATOM 1764 ND1 HIS A 122 4.827 0.467 7.079 1.00 0.00 N ATOM 1765 CD2 HIS A 122 3.496 1.771 5.867 1.00 0.00 C ATOM 1766 CE1 HIS A 122 3.960 1.083 7.877 1.00 0.00 C ATOM 1767 NE2 HIS A 122 3.144 1.882 7.183 1.00 0.00 N ATOM 0 H HIS A 122 5.119 -0.229 1.956 1.00 0.00 H new ATOM 0 HA HIS A 122 4.506 -1.665 4.459 1.00 0.00 H new ATOM 0 HB2 HIS A 122 6.202 -0.083 4.911 1.00 0.00 H new ATOM 0 HB3 HIS A 122 5.458 1.143 3.904 1.00 0.00 H new ATOM 0 HD2 HIS A 122 3.039 2.284 5.034 1.00 0.00 H new ATOM 0 HE1 HIS A 122 3.920 0.954 8.949 1.00 0.00 H new ATOM 0 HE2 HIS A 122 2.399 2.465 7.564 1.00 0.00 H new ATOM 1775 N PHE A 123 2.108 -1.225 4.126 1.00 0.00 N ATOM 1776 CA PHE A 123 0.678 -0.997 4.018 1.00 0.00 C ATOM 1777 C PHE A 123 0.054 -0.894 5.412 1.00 0.00 C ATOM 1778 O PHE A 123 -0.001 -1.874 6.163 1.00 0.00 O ATOM 1779 CB PHE A 123 0.030 -2.137 3.213 1.00 0.00 C ATOM 1780 CG PHE A 123 -1.390 -1.888 2.771 1.00 0.00 C ATOM 1781 CD1 PHE A 123 -1.663 -1.132 1.643 1.00 0.00 C ATOM 1782 CD2 PHE A 123 -2.451 -2.429 3.484 1.00 0.00 C ATOM 1783 CE1 PHE A 123 -2.965 -0.921 1.234 1.00 0.00 C ATOM 1784 CE2 PHE A 123 -3.754 -2.218 3.080 1.00 0.00 C ATOM 1785 CZ PHE A 123 -4.012 -1.464 1.953 1.00 0.00 C ATOM 0 H PHE A 123 2.357 -2.092 4.602 1.00 0.00 H new ATOM 0 HA PHE A 123 0.501 -0.057 3.495 1.00 0.00 H new ATOM 0 HB2 PHE A 123 0.640 -2.328 2.330 1.00 0.00 H new ATOM 0 HB3 PHE A 123 0.051 -3.044 3.817 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -0.849 -0.703 1.077 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -2.255 -3.022 4.365 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -3.165 -0.331 0.352 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -4.571 -2.642 3.645 1.00 0.00 H new ATOM 0 HZ PHE A 123 -5.031 -1.299 1.634 1.00 0.00 H new ATOM 1795 N GLU A 124 -0.392 0.310 5.743 1.00 0.00 N ATOM 1796 CA GLU A 124 -1.026 0.595 6.999 1.00 0.00 C ATOM 1797 C GLU A 124 -2.452 1.074 6.743 1.00 0.00 C ATOM 1798 O GLU A 124 -2.684 1.998 5.972 1.00 0.00 O ATOM 1799 CB GLU A 124 -0.215 1.652 7.764 1.00 0.00 C ATOM 1800 CG GLU A 124 -0.410 1.625 9.274 1.00 0.00 C ATOM 1801 CD GLU A 124 0.341 2.741 9.977 1.00 0.00 C ATOM 1802 OE1 GLU A 124 -0.318 3.643 10.532 1.00 0.00 O ATOM 1803 OE2 GLU A 124 1.590 2.713 9.967 1.00 0.00 O ATOM 0 H GLU A 124 -0.317 1.121 5.129 1.00 0.00 H new ATOM 0 HA GLU A 124 -1.065 -0.307 7.610 1.00 0.00 H new ATOM 0 HB2 GLU A 124 0.843 1.509 7.544 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -0.487 2.640 7.393 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -1.473 1.707 9.501 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -0.074 0.664 9.663 1.00 0.00 H new ATOM 1810 N MET A 125 -3.385 0.426 7.406 1.00 0.00 N ATOM 1811 CA MET A 125 -4.784 0.720 7.307 1.00 0.00 C ATOM 1812 C MET A 125 -5.279 1.160 8.664 1.00 0.00 C ATOM 1813 O MET A 125 -4.934 0.581 9.699 1.00 0.00 O ATOM 1814 CB MET A 125 -5.519 -0.507 6.772 1.00 0.00 C ATOM 1815 CG MET A 125 -6.922 -0.756 7.321 1.00 0.00 C ATOM 1816 SD MET A 125 -8.096 0.532 6.873 1.00 0.00 S ATOM 1817 CE MET A 125 -9.523 -0.011 7.806 1.00 0.00 C ATOM 0 H MET A 125 -3.177 -0.341 8.045 1.00 0.00 H new ATOM 0 HA MET A 125 -4.974 1.534 6.607 1.00 0.00 H new ATOM 0 HB2 MET A 125 -5.588 -0.417 5.688 1.00 0.00 H new ATOM 0 HB3 MET A 125 -4.910 -1.387 6.981 1.00 0.00 H new ATOM 0 HG2 MET A 125 -7.285 -1.715 6.951 1.00 0.00 H new ATOM 0 HG3 MET A 125 -6.872 -0.832 8.407 1.00 0.00 H new ATOM 0 HE1 MET A 125 -10.075 0.858 8.166 1.00 0.00 H new ATOM 0 HE2 MET A 125 -10.169 -0.612 7.166 1.00 0.00 H new ATOM 0 HE3 MET A 125 -9.196 -0.610 8.656 1.00 0.00 H new ATOM 1827 N LEU A 126 -6.103 2.174 8.614 1.00 0.00 N ATOM 1828 CA LEU A 126 -6.658 2.800 9.789 1.00 0.00 C ATOM 1829 C LEU A 126 -8.112 3.247 9.545 1.00 0.00 C ATOM 1830 O LEU A 126 -8.563 3.255 8.399 1.00 0.00 O ATOM 1831 CB LEU A 126 -5.811 4.041 10.140 1.00 0.00 C ATOM 1832 CG LEU A 126 -4.599 3.801 11.036 1.00 0.00 C ATOM 1833 CD1 LEU A 126 -3.357 3.522 10.203 1.00 0.00 C ATOM 1834 CD2 LEU A 126 -4.380 4.999 11.941 1.00 0.00 C ATOM 0 H LEU A 126 -6.414 2.597 7.739 1.00 0.00 H new ATOM 0 HA LEU A 126 -6.647 2.077 10.605 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -5.465 4.493 9.210 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.458 4.770 10.628 1.00 0.00 H new ATOM 0 HG LEU A 126 -4.790 2.924 11.654 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -2.506 3.354 10.863 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -3.521 2.636 9.590 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -3.152 4.376 9.558 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -3.513 4.821 12.578 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -4.207 5.887 11.333 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -5.262 5.151 12.563 1.00 0.00 H new ATOM 1846 N PRO A 127 -8.882 3.604 10.621 1.00 0.00 N ATOM 1847 CA PRO A 127 -10.260 4.115 10.498 1.00 0.00 C ATOM 1848 C PRO A 127 -10.333 5.421 9.736 1.00 0.00 C ATOM 1849 O PRO A 127 -9.312 5.948 9.286 1.00 0.00 O ATOM 1850 CB PRO A 127 -10.683 4.416 11.941 1.00 0.00 C ATOM 1851 CG PRO A 127 -9.428 4.426 12.733 1.00 0.00 C ATOM 1852 CD PRO A 127 -8.503 3.485 12.041 1.00 0.00 C ATOM 0 HA PRO A 127 -10.880 3.391 9.969 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -11.195 5.376 12.007 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -11.374 3.660 12.312 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -9.003 5.429 12.779 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -9.611 4.110 13.760 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -7.460 3.758 12.201 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -8.625 2.464 12.404 1.00 0.00 H new ATOM 1860 N ALA A 128 -11.551 5.948 9.620 1.00 0.00 N ATOM 1861 CA ALA A 128 -11.766 7.225 8.992 1.00 0.00 C ATOM 1862 C ALA A 128 -11.204 8.328 9.888 1.00 0.00 C ATOM 1863 O ALA A 128 -10.766 9.379 9.411 1.00 0.00 O ATOM 1864 CB ALA A 128 -13.244 7.450 8.735 1.00 0.00 C ATOM 0 H ALA A 128 -12.401 5.497 9.959 1.00 0.00 H new ATOM 0 HA ALA A 128 -11.251 7.244 8.031 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -13.387 8.420 8.260 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -13.623 6.666 8.080 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -13.786 7.426 9.681 1.00 0.00 H new ATOM 1870 N ASN A 129 -11.200 8.028 11.202 1.00 0.00 N ATOM 1871 CA ASN A 129 -10.709 8.926 12.247 1.00 0.00 C ATOM 1872 C ASN A 129 -10.329 8.108 13.451 1.00 0.00 C ATOM 1873 O ASN A 129 -11.184 7.679 14.235 1.00 0.00 O ATOM 1874 CB ASN A 129 -11.712 10.037 12.620 1.00 0.00 C ATOM 1875 CG ASN A 129 -11.904 11.054 11.512 1.00 0.00 C ATOM 1876 OD1 ASN A 129 -12.917 11.044 10.813 1.00 0.00 O ATOM 1877 ND2 ASN A 129 -10.922 11.926 11.335 1.00 0.00 N ATOM 0 H ASN A 129 -11.545 7.139 11.565 1.00 0.00 H new ATOM 0 HA ASN A 129 -9.835 9.447 11.856 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -12.674 9.585 12.862 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -11.364 10.547 13.518 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -10.988 12.625 10.596 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -10.100 11.898 11.938 1.00 0.00 H new ATOM 1884 N PRO A 130 -9.010 7.879 13.606 1.00 0.00 N ATOM 1885 CA PRO A 130 -8.480 7.065 14.674 1.00 0.00 C ATOM 1886 C PRO A 130 -8.521 7.663 16.065 1.00 0.00 C ATOM 1887 O PRO A 130 -8.693 8.871 16.259 1.00 0.00 O ATOM 1888 CB PRO A 130 -7.022 6.797 14.306 1.00 0.00 C ATOM 1889 CG PRO A 130 -6.854 7.353 12.925 1.00 0.00 C ATOM 1890 CD PRO A 130 -7.937 8.357 12.720 1.00 0.00 C ATOM 0 HA PRO A 130 -9.113 6.180 14.744 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -6.344 7.280 15.010 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -6.800 5.730 14.330 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -5.874 7.816 12.813 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -6.919 6.560 12.180 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -7.611 9.362 12.988 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -8.260 8.394 11.680 1.00 0.00 H new ATOM 1898 N ASN A 131 -8.359 6.754 17.013 1.00 0.00 N ATOM 1899 CA ASN A 131 -8.311 7.042 18.407 1.00 0.00 C ATOM 1900 C ASN A 131 -6.938 6.644 18.907 1.00 0.00 C ATOM 1901 O ASN A 131 -6.772 5.675 19.662 1.00 0.00 O ATOM 1902 CB ASN A 131 -9.397 6.270 19.113 1.00 0.00 C ATOM 1903 CG ASN A 131 -10.040 7.053 20.220 1.00 0.00 C ATOM 1904 OD1 ASN A 131 -9.597 7.027 21.368 1.00 0.00 O ATOM 1905 ND2 ASN A 131 -11.101 7.758 19.869 1.00 0.00 N ATOM 0 H ASN A 131 -8.255 5.761 16.807 1.00 0.00 H new ATOM 0 HA ASN A 131 -8.477 8.101 18.603 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -10.159 5.979 18.390 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -8.977 5.351 19.521 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -11.595 8.317 20.565 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -11.426 7.744 18.902 1.00 0.00 H new ATOM 1912 N TRP A 132 -5.947 7.438 18.485 1.00 0.00 N ATOM 1913 CA TRP A 132 -4.534 7.223 18.828 1.00 0.00 C ATOM 1914 C TRP A 132 -4.275 7.341 20.343 1.00 0.00 C ATOM 1915 O TRP A 132 -3.126 7.399 20.798 1.00 0.00 O ATOM 1916 CB TRP A 132 -3.633 8.234 18.092 1.00 0.00 C ATOM 1917 CG TRP A 132 -4.000 8.471 16.657 1.00 0.00 C ATOM 1918 CD1 TRP A 132 -3.744 7.646 15.604 1.00 0.00 C ATOM 1919 CD2 TRP A 132 -4.698 9.604 16.120 1.00 0.00 C ATOM 1920 NE1 TRP A 132 -4.225 8.199 14.445 1.00 0.00 N ATOM 1921 CE2 TRP A 132 -4.816 9.394 14.738 1.00 0.00 C ATOM 1922 CE3 TRP A 132 -5.235 10.775 16.670 1.00 0.00 C ATOM 1923 CZ2 TRP A 132 -5.440 10.298 13.896 1.00 0.00 C ATOM 1924 CZ3 TRP A 132 -5.857 11.679 15.829 1.00 0.00 C ATOM 1925 CH2 TRP A 132 -5.957 11.434 14.453 1.00 0.00 C ATOM 0 H TRP A 132 -6.103 8.253 17.892 1.00 0.00 H new ATOM 0 HA TRP A 132 -4.293 6.208 18.514 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -3.667 9.185 18.624 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -2.603 7.881 18.136 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -3.236 6.695 15.672 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -4.153 7.785 13.516 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.165 10.968 17.730 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -5.516 10.112 12.835 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -6.272 12.588 16.239 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -6.452 12.156 13.821 1.00 0.00 H new ATOM 1936 N GLN A 133 -5.368 7.351 21.102 1.00 0.00 N ATOM 1937 CA GLN A 133 -5.361 7.484 22.540 1.00 0.00 C ATOM 1938 C GLN A 133 -5.076 6.160 23.258 1.00 0.00 C ATOM 1939 O GLN A 133 -5.571 5.888 24.360 1.00 0.00 O ATOM 1940 CB GLN A 133 -6.702 8.050 22.966 1.00 0.00 C ATOM 1941 CG GLN A 133 -6.961 9.487 22.504 1.00 0.00 C ATOM 1942 CD GLN A 133 -7.502 9.559 21.079 1.00 0.00 C ATOM 1943 OE1 GLN A 133 -8.706 9.700 20.865 1.00 0.00 O ATOM 1944 NE2 GLN A 133 -6.609 9.423 20.097 1.00 0.00 N ATOM 0 H GLN A 133 -6.307 7.264 20.713 1.00 0.00 H new ATOM 0 HA GLN A 133 -4.551 8.155 22.824 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -7.493 7.409 22.577 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -6.768 8.014 24.053 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -7.671 9.960 23.182 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -6.034 10.057 22.565 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -5.620 9.308 20.319 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -6.915 9.434 19.124 1.00 0.00 H new ATOM 1953 N ASN A 134 -4.265 5.351 22.585 1.00 0.00 N ATOM 1954 CA ASN A 134 -3.801 4.033 23.033 1.00 0.00 C ATOM 1955 C ASN A 134 -4.910 3.013 22.936 1.00 0.00 C ATOM 1956 O ASN A 134 -6.023 3.239 23.422 1.00 0.00 O ATOM 1957 CB ASN A 134 -3.212 4.075 24.451 1.00 0.00 C ATOM 1958 CG ASN A 134 -1.883 4.796 24.482 1.00 0.00 C ATOM 1959 OD1 ASN A 134 -0.824 4.174 24.554 1.00 0.00 O ATOM 1960 ND2 ASN A 134 -1.937 6.119 24.407 1.00 0.00 N ATOM 0 H ASN A 134 -3.893 5.603 21.669 1.00 0.00 H new ATOM 0 HA ASN A 134 -2.995 3.731 22.364 1.00 0.00 H new ATOM 0 HB2 ASN A 134 -3.912 4.573 25.122 1.00 0.00 H new ATOM 0 HB3 ASN A 134 -3.083 3.058 24.822 1.00 0.00 H new ATOM 0 HD21 ASN A 134 -1.076 6.665 24.407 1.00 0.00 H new ATOM 0 HD22 ASN A 134 -2.840 6.590 24.349 1.00 0.00 H new ATOM 1967 N GLY A 135 -4.590 1.898 22.295 1.00 0.00 N ATOM 1968 CA GLY A 135 -5.559 0.847 22.124 1.00 0.00 C ATOM 1969 C GLY A 135 -5.355 0.051 20.851 1.00 0.00 C ATOM 1970 O GLY A 135 -5.371 -1.183 20.885 1.00 0.00 O ATOM 0 H GLY A 135 -3.673 1.707 21.891 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -5.509 0.173 22.979 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -6.559 1.281 22.118 1.00 0.00 H new ATOM 1974 N PHE A 136 -5.187 0.754 19.722 1.00 0.00 N ATOM 1975 CA PHE A 136 -4.963 0.106 18.418 1.00 0.00 C ATOM 1976 C PHE A 136 -4.161 0.994 17.477 1.00 0.00 C ATOM 1977 O PHE A 136 -3.571 0.514 16.507 1.00 0.00 O ATOM 1978 CB PHE A 136 -6.298 -0.293 17.737 1.00 0.00 C ATOM 1979 CG PHE A 136 -7.489 0.644 17.927 1.00 0.00 C ATOM 1980 CD1 PHE A 136 -7.351 2.032 18.029 1.00 0.00 C ATOM 1981 CD2 PHE A 136 -8.769 0.111 17.973 1.00 0.00 C ATOM 1982 CE1 PHE A 136 -8.456 2.841 18.175 1.00 0.00 C ATOM 1983 CE2 PHE A 136 -9.875 0.924 18.124 1.00 0.00 C ATOM 1984 CZ PHE A 136 -9.718 2.290 18.224 1.00 0.00 C ATOM 0 H PHE A 136 -5.202 1.773 19.684 1.00 0.00 H new ATOM 0 HA PHE A 136 -4.389 -0.798 18.621 1.00 0.00 H new ATOM 0 HB2 PHE A 136 -6.114 -0.392 16.667 1.00 0.00 H new ATOM 0 HB3 PHE A 136 -6.583 -1.279 18.104 1.00 0.00 H new ATOM 0 HD1 PHE A 136 -6.367 2.475 17.993 1.00 0.00 H new ATOM 0 HD2 PHE A 136 -8.903 -0.957 17.889 1.00 0.00 H new ATOM 0 HE1 PHE A 136 -8.333 3.911 18.251 1.00 0.00 H new ATOM 0 HE2 PHE A 136 -10.863 0.490 18.164 1.00 0.00 H new ATOM 0 HZ PHE A 136 -10.582 2.927 18.341 1.00 0.00 H new ATOM 1994 N SER A 137 -4.151 2.300 17.783 1.00 0.00 N ATOM 1995 CA SER A 137 -3.473 3.347 16.997 1.00 0.00 C ATOM 1996 C SER A 137 -4.170 3.459 15.657 1.00 0.00 C ATOM 1997 O SER A 137 -3.656 4.026 14.688 1.00 0.00 O ATOM 1998 CB SER A 137 -1.956 3.092 16.849 1.00 0.00 C ATOM 1999 OG SER A 137 -1.307 4.199 16.245 1.00 0.00 O ATOM 0 H SER A 137 -4.627 2.669 18.606 1.00 0.00 H new ATOM 0 HA SER A 137 -3.546 4.297 17.527 1.00 0.00 H new ATOM 0 HB2 SER A 137 -1.519 2.901 17.829 1.00 0.00 H new ATOM 0 HB3 SER A 137 -1.792 2.198 16.247 1.00 0.00 H new ATOM 0 HG SER A 137 -1.857 4.538 15.508 1.00 0.00 H new ATOM 2005 N GLY A 138 -5.392 2.909 15.665 1.00 0.00 N ATOM 2006 CA GLY A 138 -6.255 2.892 14.516 1.00 0.00 C ATOM 2007 C GLY A 138 -5.823 1.886 13.469 1.00 0.00 C ATOM 2008 O GLY A 138 -6.554 1.619 12.518 1.00 0.00 O ATOM 0 H GLY A 138 -5.797 2.463 16.488 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -7.272 2.663 14.835 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -6.277 3.886 14.070 1.00 0.00 H new ATOM 2012 N ARG A 139 -4.630 1.313 13.643 1.00 0.00 N ATOM 2013 CA ARG A 139 -4.118 0.353 12.665 1.00 0.00 C ATOM 2014 C ARG A 139 -4.665 -1.059 12.882 1.00 0.00 C ATOM 2015 O ARG A 139 -4.603 -1.596 13.991 1.00 0.00 O ATOM 2016 CB ARG A 139 -2.575 0.334 12.622 1.00 0.00 C ATOM 2017 CG ARG A 139 -1.865 0.318 13.978 1.00 0.00 C ATOM 2018 CD ARG A 139 -1.774 -1.077 14.580 1.00 0.00 C ATOM 2019 NE ARG A 139 -1.026 -1.084 15.841 1.00 0.00 N ATOM 2020 CZ ARG A 139 -1.375 -1.782 16.931 1.00 0.00 C ATOM 2021 NH1 ARG A 139 -2.466 -2.546 16.941 1.00 0.00 N ATOM 2022 NH2 ARG A 139 -0.625 -1.710 18.021 1.00 0.00 N ATOM 0 H ARG A 139 -4.012 1.492 14.435 1.00 0.00 H new ATOM 0 HA ARG A 139 -4.479 0.699 11.696 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -2.258 -0.543 12.058 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -2.236 1.209 12.067 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -0.860 0.725 13.862 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -2.396 0.973 14.669 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -2.778 -1.464 14.752 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -1.292 -1.748 13.869 1.00 0.00 H new ATOM 0 HE ARG A 139 -0.180 -0.517 15.893 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -3.053 -2.608 16.109 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -2.714 -3.069 17.780 1.00 0.00 H new ATOM 0 HH21 ARG A 139 0.211 -1.126 18.027 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -0.884 -2.238 18.854 1.00 0.00 H new ATOM 2036 N ILE A 140 -5.226 -1.638 11.814 1.00 0.00 N ATOM 2037 CA ILE A 140 -5.760 -3.000 11.873 1.00 0.00 C ATOM 2038 C ILE A 140 -5.234 -3.888 10.727 1.00 0.00 C ATOM 2039 O ILE A 140 -4.378 -3.467 9.943 1.00 0.00 O ATOM 2040 CB ILE A 140 -7.311 -3.067 11.937 1.00 0.00 C ATOM 2041 CG1 ILE A 140 -7.954 -1.709 12.246 1.00 0.00 C ATOM 2042 CG2 ILE A 140 -7.746 -4.086 12.982 1.00 0.00 C ATOM 2043 CD1 ILE A 140 -8.408 -0.964 11.015 1.00 0.00 C ATOM 0 H ILE A 140 -5.321 -1.186 10.904 1.00 0.00 H new ATOM 0 HA ILE A 140 -5.388 -3.396 12.818 1.00 0.00 H new ATOM 0 HB ILE A 140 -7.654 -3.370 10.948 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -8.809 -1.862 12.904 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -7.239 -1.093 12.791 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -8.835 -4.126 13.020 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -7.356 -5.069 12.717 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -7.360 -3.794 13.958 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -8.853 -0.013 11.309 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -7.553 -0.779 10.365 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -9.147 -1.561 10.481 1.00 0.00 H new ATOM 2055 N ASP A 141 -5.797 -5.108 10.630 1.00 0.00 N ATOM 2056 CA ASP A 141 -5.382 -6.131 9.659 1.00 0.00 C ATOM 2057 C ASP A 141 -5.776 -5.825 8.193 1.00 0.00 C ATOM 2058 O ASP A 141 -6.911 -5.407 7.941 1.00 0.00 O ATOM 2059 CB ASP A 141 -5.996 -7.476 10.049 1.00 0.00 C ATOM 2060 CG ASP A 141 -5.302 -8.115 11.232 1.00 0.00 C ATOM 2061 OD1 ASP A 141 -5.395 -7.559 12.347 1.00 0.00 O ATOM 2062 OD2 ASP A 141 -4.665 -9.172 11.045 1.00 0.00 O ATOM 0 H ASP A 141 -6.562 -5.411 11.233 1.00 0.00 H new ATOM 0 HA ASP A 141 -4.293 -6.147 9.695 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -7.051 -7.334 10.285 1.00 0.00 H new ATOM 0 HB3 ASP A 141 -5.948 -8.153 9.196 1.00 0.00 H new ATOM 2067 N PRO A 142 -4.835 -6.014 7.200 1.00 0.00 N ATOM 2068 CA PRO A 142 -5.117 -5.803 5.763 1.00 0.00 C ATOM 2069 C PRO A 142 -5.907 -6.961 5.120 1.00 0.00 C ATOM 2070 O PRO A 142 -6.209 -6.923 3.922 1.00 0.00 O ATOM 2071 CB PRO A 142 -3.733 -5.709 5.106 1.00 0.00 C ATOM 2072 CG PRO A 142 -2.721 -5.929 6.185 1.00 0.00 C ATOM 2073 CD PRO A 142 -3.441 -6.459 7.392 1.00 0.00 C ATOM 0 HA PRO A 142 -5.735 -4.916 5.628 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -3.628 -6.457 4.320 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -3.593 -4.734 4.639 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -1.959 -6.635 5.855 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -2.210 -4.997 6.425 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -3.373 -7.545 7.452 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -3.019 -6.062 8.315 1.00 0.00 H new ATOM 2081 N THR A 143 -6.266 -7.968 5.939 1.00 0.00 N ATOM 2082 CA THR A 143 -6.984 -9.174 5.508 1.00 0.00 C ATOM 2083 C THR A 143 -8.249 -8.891 4.696 1.00 0.00 C ATOM 2084 O THR A 143 -8.691 -9.733 3.906 1.00 0.00 O ATOM 2085 CB THR A 143 -7.343 -10.041 6.723 1.00 0.00 C ATOM 2086 OG1 THR A 143 -7.690 -9.218 7.845 1.00 0.00 O ATOM 2087 CG2 THR A 143 -6.188 -10.960 7.094 1.00 0.00 C ATOM 0 H THR A 143 -6.059 -7.962 6.938 1.00 0.00 H new ATOM 0 HA THR A 143 -6.299 -9.703 4.845 1.00 0.00 H new ATOM 0 HB THR A 143 -8.203 -10.654 6.454 1.00 0.00 H new ATOM 0 HG1 THR A 143 -7.918 -9.787 8.610 1.00 0.00 H new ATOM 0 HG21 THR A 143 -6.467 -11.564 7.958 1.00 0.00 H new ATOM 0 HG22 THR A 143 -5.959 -11.614 6.253 1.00 0.00 H new ATOM 0 HG23 THR A 143 -5.310 -10.361 7.338 1.00 0.00 H new ATOM 2095 N GLY A 144 -8.806 -7.700 4.894 1.00 0.00 N ATOM 2096 CA GLY A 144 -10.011 -7.285 4.185 1.00 0.00 C ATOM 2097 C GLY A 144 -9.740 -7.025 2.712 1.00 0.00 C ATOM 2098 O GLY A 144 -10.622 -7.206 1.871 1.00 0.00 O ATOM 0 H GLY A 144 -8.440 -7.003 5.542 1.00 0.00 H new ATOM 0 HA2 GLY A 144 -10.774 -8.057 4.283 1.00 0.00 H new ATOM 0 HA3 GLY A 144 -10.411 -6.382 4.646 1.00 0.00 H new ATOM 2102 N TYR A 145 -8.491 -6.637 2.419 1.00 0.00 N ATOM 2103 CA TYR A 145 -8.050 -6.344 1.063 1.00 0.00 C ATOM 2104 C TYR A 145 -7.225 -7.497 0.479 1.00 0.00 C ATOM 2105 O TYR A 145 -6.915 -7.500 -0.719 1.00 0.00 O ATOM 2106 CB TYR A 145 -7.196 -5.066 1.009 1.00 0.00 C ATOM 2107 CG TYR A 145 -7.707 -3.910 1.840 1.00 0.00 C ATOM 2108 CD1 TYR A 145 -8.485 -2.905 1.276 1.00 0.00 C ATOM 2109 CD2 TYR A 145 -7.402 -3.825 3.189 1.00 0.00 C ATOM 2110 CE1 TYR A 145 -8.941 -1.848 2.040 1.00 0.00 C ATOM 2111 CE2 TYR A 145 -7.855 -2.775 3.958 1.00 0.00 C ATOM 2112 CZ TYR A 145 -8.622 -1.788 3.382 1.00 0.00 C ATOM 2113 OH TYR A 145 -9.064 -0.738 4.149 1.00 0.00 O ATOM 0 H TYR A 145 -7.762 -6.520 3.123 1.00 0.00 H new ATOM 0 HA TYR A 145 -8.955 -6.204 0.472 1.00 0.00 H new ATOM 0 HB2 TYR A 145 -6.186 -5.310 1.338 1.00 0.00 H new ATOM 0 HB3 TYR A 145 -7.123 -4.741 -0.029 1.00 0.00 H new ATOM 0 HD1 TYR A 145 -8.736 -2.951 0.227 1.00 0.00 H new ATOM 0 HD2 TYR A 145 -6.799 -4.595 3.646 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -9.544 -1.073 1.590 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -7.609 -2.727 5.009 1.00 0.00 H new ATOM 0 HH TYR A 145 -8.494 -0.649 4.941 1.00 0.00 H new ATOM 2123 N ILE A 146 -6.878 -8.470 1.328 1.00 0.00 N ATOM 2124 CA ILE A 146 -6.076 -9.612 0.910 1.00 0.00 C ATOM 2125 C ILE A 146 -6.966 -10.828 0.621 1.00 0.00 C ATOM 2126 O ILE A 146 -6.510 -11.818 0.040 1.00 0.00 O ATOM 2127 CB ILE A 146 -4.980 -9.970 1.977 1.00 0.00 C ATOM 2128 CG1 ILE A 146 -4.226 -8.708 2.490 1.00 0.00 C ATOM 2129 CG2 ILE A 146 -3.978 -11.003 1.445 1.00 0.00 C ATOM 2130 CD1 ILE A 146 -3.568 -7.841 1.416 1.00 0.00 C ATOM 0 H ILE A 146 -7.144 -8.484 2.313 1.00 0.00 H new ATOM 0 HA ILE A 146 -5.564 -9.332 -0.010 1.00 0.00 H new ATOM 0 HB ILE A 146 -5.512 -10.412 2.820 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -4.929 -8.090 3.048 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -3.457 -9.029 3.192 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -3.238 -11.222 2.215 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -4.506 -11.919 1.179 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -3.477 -10.603 0.563 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -3.073 -6.992 1.887 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -2.833 -8.433 0.871 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -4.329 -7.480 0.724 1.00 0.00 H new ATOM 2142 N ALA A 147 -8.237 -10.726 1.012 1.00 0.00 N ATOM 2143 CA ALA A 147 -9.230 -11.774 0.780 1.00 0.00 C ATOM 2144 C ALA A 147 -9.699 -11.806 -0.670 1.00 0.00 C ATOM 2145 O ALA A 147 -10.159 -12.841 -1.162 1.00 0.00 O ATOM 2146 CB ALA A 147 -10.420 -11.567 1.685 1.00 0.00 C ATOM 0 H ALA A 147 -8.607 -9.911 1.500 1.00 0.00 H new ATOM 0 HA ALA A 147 -8.752 -12.728 1.001 1.00 0.00 H new ATOM 0 HB1 ALA A 147 -11.155 -12.352 1.505 1.00 0.00 H new ATOM 0 HB2 ALA A 147 -10.097 -11.604 2.725 1.00 0.00 H new ATOM 0 HB3 ALA A 147 -10.869 -10.596 1.479 1.00 0.00 H new ATOM 2152 N ASN A 148 -9.594 -10.655 -1.330 1.00 0.00 N ATOM 2153 CA ASN A 148 -9.994 -10.495 -2.698 1.00 0.00 C ATOM 2154 C ASN A 148 -8.769 -10.453 -3.584 1.00 0.00 C ATOM 2155 O ASN A 148 -8.825 -10.049 -4.754 1.00 0.00 O ATOM 2156 CB ASN A 148 -10.814 -9.207 -2.833 1.00 0.00 C ATOM 2157 CG ASN A 148 -11.434 -8.751 -1.527 1.00 0.00 C ATOM 2158 OD1 ASN A 148 -12.583 -9.065 -1.217 1.00 0.00 O ATOM 2159 ND2 ASN A 148 -10.658 -8.013 -0.760 1.00 0.00 N ATOM 0 H ASN A 148 -9.221 -9.803 -0.910 1.00 0.00 H new ATOM 0 HA ASN A 148 -10.611 -11.338 -3.010 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -10.172 -8.415 -3.219 1.00 0.00 H new ATOM 0 HB3 ASN A 148 -11.604 -9.363 -3.567 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -11.003 -7.674 0.138 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -9.712 -7.781 -1.064 1.00 0.00 H new ATOM 2166 N ALA A 149 -7.665 -10.896 -3.002 1.00 0.00 N ATOM 2167 CA ALA A 149 -6.406 -10.908 -3.656 1.00 0.00 C ATOM 2168 C ALA A 149 -6.086 -12.260 -4.331 1.00 0.00 C ATOM 2169 O ALA A 149 -6.655 -13.291 -3.962 1.00 0.00 O ATOM 2170 CB ALA A 149 -5.349 -10.509 -2.650 1.00 0.00 C ATOM 0 H ALA A 149 -7.639 -11.258 -2.049 1.00 0.00 H new ATOM 0 HA ALA A 149 -6.428 -10.190 -4.476 1.00 0.00 H new ATOM 0 HB1 ALA A 149 -4.370 -10.511 -3.130 1.00 0.00 H new ATOM 0 HB2 ALA A 149 -5.566 -9.510 -2.272 1.00 0.00 H new ATOM 0 HB3 ALA A 149 -5.348 -11.218 -1.822 1.00 0.00 H new ATOM 2176 N PRO A 150 -5.173 -12.252 -5.349 1.00 0.00 N ATOM 2177 CA PRO A 150 -4.745 -13.457 -6.107 1.00 0.00 C ATOM 2178 C PRO A 150 -4.197 -14.600 -5.246 1.00 0.00 C ATOM 2179 O PRO A 150 -4.084 -14.484 -4.023 1.00 0.00 O ATOM 2180 CB PRO A 150 -3.639 -12.920 -7.025 1.00 0.00 C ATOM 2181 CG PRO A 150 -3.964 -11.490 -7.198 1.00 0.00 C ATOM 2182 CD PRO A 150 -4.513 -11.042 -5.874 1.00 0.00 C ATOM 0 HA PRO A 150 -5.598 -13.904 -6.618 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -2.654 -13.052 -6.578 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -3.628 -13.443 -7.981 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -3.078 -10.916 -7.470 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -4.694 -11.347 -7.995 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -3.723 -10.695 -5.208 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -5.217 -10.218 -5.989 1.00 0.00 H new ATOM 2190 N VAL A 151 -3.836 -15.690 -5.933 1.00 0.00 N ATOM 2191 CA VAL A 151 -3.328 -16.901 -5.320 1.00 0.00 C ATOM 2192 C VAL A 151 -1.810 -16.966 -5.408 1.00 0.00 C ATOM 2193 O VAL A 151 -1.217 -16.783 -6.473 1.00 0.00 O ATOM 2194 CB VAL A 151 -3.917 -18.163 -5.981 1.00 0.00 C ATOM 2195 CG1 VAL A 151 -3.335 -19.440 -5.375 1.00 0.00 C ATOM 2196 CG2 VAL A 151 -5.440 -18.175 -5.890 1.00 0.00 C ATOM 0 H VAL A 151 -3.894 -15.746 -6.950 1.00 0.00 H new ATOM 0 HA VAL A 151 -3.633 -16.871 -4.274 1.00 0.00 H new ATOM 0 HB VAL A 151 -3.637 -18.134 -7.034 1.00 0.00 H new ATOM 0 HG11 VAL A 151 -3.774 -20.309 -5.866 1.00 0.00 H new ATOM 0 HG12 VAL A 151 -2.254 -19.450 -5.517 1.00 0.00 H new ATOM 0 HG13 VAL A 151 -3.561 -19.473 -4.309 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -5.826 -19.077 -6.365 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -5.742 -18.159 -4.843 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -5.842 -17.298 -6.397 1.00 0.00 H new ATOM 2206 N PHE A 152 -1.228 -17.246 -4.265 1.00 0.00 N ATOM 2207 CA PHE A 152 0.216 -17.401 -4.099 1.00 0.00 C ATOM 2208 C PHE A 152 0.536 -18.890 -3.893 1.00 0.00 C ATOM 2209 O PHE A 152 0.327 -19.438 -2.805 1.00 0.00 O ATOM 2210 CB PHE A 152 0.702 -16.523 -2.916 1.00 0.00 C ATOM 2211 CG PHE A 152 2.112 -16.793 -2.444 1.00 0.00 C ATOM 2212 CD1 PHE A 152 3.196 -16.142 -3.011 1.00 0.00 C ATOM 2213 CD2 PHE A 152 2.344 -17.713 -1.435 1.00 0.00 C ATOM 2214 CE1 PHE A 152 4.483 -16.406 -2.582 1.00 0.00 C ATOM 2215 CE2 PHE A 152 3.628 -17.979 -1.000 1.00 0.00 C ATOM 2216 CZ PHE A 152 4.698 -17.324 -1.575 1.00 0.00 C ATOM 0 H PHE A 152 -1.750 -17.377 -3.398 1.00 0.00 H new ATOM 0 HA PHE A 152 0.746 -17.063 -4.989 1.00 0.00 H new ATOM 0 HB2 PHE A 152 0.630 -15.476 -3.209 1.00 0.00 H new ATOM 0 HB3 PHE A 152 0.022 -16.666 -2.076 1.00 0.00 H new ATOM 0 HD1 PHE A 152 3.033 -15.420 -3.797 1.00 0.00 H new ATOM 0 HD2 PHE A 152 1.510 -18.229 -0.982 1.00 0.00 H new ATOM 0 HE1 PHE A 152 5.319 -15.894 -3.035 1.00 0.00 H new ATOM 0 HE2 PHE A 152 3.794 -18.698 -0.212 1.00 0.00 H new ATOM 0 HZ PHE A 152 5.703 -17.530 -1.237 1.00 0.00 H new ATOM 2226 N ASN A 153 1.030 -19.531 -4.970 1.00 0.00 N ATOM 2227 CA ASN A 153 1.417 -20.966 -4.992 1.00 0.00 C ATOM 2228 C ASN A 153 0.205 -21.904 -4.975 1.00 0.00 C ATOM 2229 O ASN A 153 0.195 -22.917 -5.682 1.00 0.00 O ATOM 2230 CB ASN A 153 2.377 -21.328 -3.843 1.00 0.00 C ATOM 2231 CG ASN A 153 3.833 -21.195 -4.241 1.00 0.00 C ATOM 2232 OD1 ASN A 153 4.480 -22.175 -4.611 1.00 0.00 O ATOM 2233 ND2 ASN A 153 4.353 -19.976 -4.179 1.00 0.00 N ATOM 0 H ASN A 153 1.176 -19.065 -5.865 1.00 0.00 H new ATOM 0 HA ASN A 153 1.941 -21.111 -5.937 1.00 0.00 H new ATOM 0 HB2 ASN A 153 2.176 -20.681 -2.989 1.00 0.00 H new ATOM 0 HB3 ASN A 153 2.184 -22.351 -3.521 1.00 0.00 H new ATOM 0 HD21 ASN A 153 5.326 -19.822 -4.444 1.00 0.00 H new ATOM 0 HD22 ASN A 153 3.780 -19.192 -3.866 1.00 0.00 H new ATOM 2240 N GLY A 154 -0.813 -21.554 -4.179 1.00 0.00 N ATOM 2241 CA GLY A 154 -2.012 -22.374 -4.073 1.00 0.00 C ATOM 2242 C GLY A 154 -2.305 -22.775 -2.642 1.00 0.00 C ATOM 2243 O GLY A 154 -1.854 -23.830 -2.185 1.00 0.00 O ATOM 0 H GLY A 154 -0.825 -20.712 -3.604 1.00 0.00 H new ATOM 0 HA2 GLY A 154 -2.863 -21.825 -4.476 1.00 0.00 H new ATOM 0 HA3 GLY A 154 -1.893 -23.270 -4.683 1.00 0.00 H new ATOM 2247 N THR A 155 -3.062 -21.927 -1.938 1.00 0.00 N ATOM 2248 CA THR A 155 -3.425 -22.152 -0.560 1.00 0.00 C ATOM 2249 C THR A 155 -4.795 -22.816 -0.449 1.00 0.00 C ATOM 2250 O THR A 155 -5.836 -22.182 -0.659 1.00 0.00 O ATOM 2251 CB THR A 155 -3.444 -20.816 0.202 1.00 0.00 C ATOM 2252 OG1 THR A 155 -4.135 -19.817 -0.561 1.00 0.00 O ATOM 2253 CG2 THR A 155 -2.033 -20.342 0.515 1.00 0.00 C ATOM 0 H THR A 155 -3.437 -21.061 -2.325 1.00 0.00 H new ATOM 0 HA THR A 155 -2.681 -22.818 -0.123 1.00 0.00 H new ATOM 0 HB THR A 155 -3.969 -20.976 1.144 1.00 0.00 H new ATOM 0 HG1 THR A 155 -4.981 -20.185 -0.891 1.00 0.00 H new ATOM 0 HG21 THR A 155 -2.078 -19.396 1.054 1.00 0.00 H new ATOM 0 HG22 THR A 155 -1.527 -21.086 1.130 1.00 0.00 H new ATOM 0 HG23 THR A 155 -1.481 -20.204 -0.415 1.00 0.00 H new ATOM 2261 N THR A 156 -4.767 -24.105 -0.134 1.00 0.00 N ATOM 2262 CA THR A 156 -5.984 -24.900 0.043 1.00 0.00 C ATOM 2263 C THR A 156 -6.268 -25.125 1.538 1.00 0.00 C ATOM 2264 O THR A 156 -5.329 -25.394 2.292 1.00 0.00 O ATOM 2265 CB THR A 156 -5.883 -26.272 -0.658 1.00 0.00 C ATOM 2266 OG1 THR A 156 -4.614 -26.878 -0.381 1.00 0.00 O ATOM 2267 CG2 THR A 156 -6.069 -26.136 -2.165 1.00 0.00 C ATOM 0 H THR A 156 -3.904 -24.631 0.006 1.00 0.00 H new ATOM 0 HA THR A 156 -6.799 -24.337 -0.412 1.00 0.00 H new ATOM 0 HB THR A 156 -6.680 -26.906 -0.268 1.00 0.00 H new ATOM 0 HG1 THR A 156 -4.562 -27.748 -0.829 1.00 0.00 H new ATOM 0 HG21 THR A 156 -5.993 -27.118 -2.631 1.00 0.00 H new ATOM 0 HG22 THR A 156 -7.051 -25.711 -2.374 1.00 0.00 H new ATOM 0 HG23 THR A 156 -5.297 -25.482 -2.569 1.00 0.00 H new ATOM 2275 N PRO A 157 -7.554 -25.014 2.007 1.00 0.00 N ATOM 2276 CA PRO A 157 -7.895 -25.222 3.418 1.00 0.00 C ATOM 2277 C PRO A 157 -8.070 -26.695 3.785 1.00 0.00 C ATOM 2278 O PRO A 157 -7.615 -27.147 4.841 1.00 0.00 O ATOM 2279 CB PRO A 157 -9.223 -24.464 3.605 1.00 0.00 C ATOM 2280 CG PRO A 157 -9.640 -23.985 2.248 1.00 0.00 C ATOM 2281 CD PRO A 157 -8.761 -24.672 1.237 1.00 0.00 C ATOM 0 HA PRO A 157 -7.093 -24.866 4.065 1.00 0.00 H new ATOM 0 HB2 PRO A 157 -9.983 -25.116 4.036 1.00 0.00 H new ATOM 0 HB3 PRO A 157 -9.097 -23.625 4.290 1.00 0.00 H new ATOM 0 HG2 PRO A 157 -10.689 -24.217 2.065 1.00 0.00 H new ATOM 0 HG3 PRO A 157 -9.536 -22.903 2.174 1.00 0.00 H new ATOM 0 HD2 PRO A 157 -9.240 -25.561 0.826 1.00 0.00 H new ATOM 0 HD3 PRO A 157 -8.529 -24.018 0.397 1.00 0.00 H new ATOM 2289 N THR A 158 -8.727 -27.422 2.889 1.00 0.00 N ATOM 2290 CA THR A 158 -9.011 -28.845 3.054 1.00 0.00 C ATOM 2291 C THR A 158 -9.357 -29.474 1.705 1.00 0.00 C ATOM 2292 O THR A 158 -8.649 -30.352 1.205 1.00 0.00 O ATOM 2293 CB THR A 158 -10.148 -29.103 4.103 1.00 0.00 C ATOM 2294 OG1 THR A 158 -10.405 -30.507 4.236 1.00 0.00 O ATOM 2295 CG2 THR A 158 -11.461 -28.373 3.788 1.00 0.00 C ATOM 0 H THR A 158 -9.083 -27.035 2.015 1.00 0.00 H new ATOM 0 HA THR A 158 -8.110 -29.319 3.443 1.00 0.00 H new ATOM 0 HB THR A 158 -9.776 -28.695 5.043 1.00 0.00 H new ATOM 0 HG1 THR A 158 -11.116 -30.648 4.896 1.00 0.00 H new ATOM 0 HG21 THR A 158 -12.198 -28.601 4.558 1.00 0.00 H new ATOM 0 HG22 THR A 158 -11.283 -27.298 3.763 1.00 0.00 H new ATOM 0 HG23 THR A 158 -11.836 -28.701 2.819 1.00 0.00 H new ATOM 2303 N GLU A 159 -10.461 -28.994 1.145 1.00 0.00 N ATOM 2304 CA GLU A 159 -10.968 -29.443 -0.149 1.00 0.00 C ATOM 2305 C GLU A 159 -10.222 -28.777 -1.309 1.00 0.00 C ATOM 2306 O GLU A 159 -9.620 -29.512 -2.121 1.00 0.00 O ATOM 2307 CB GLU A 159 -12.470 -29.165 -0.260 1.00 0.00 C ATOM 2308 CG GLU A 159 -13.338 -30.197 0.445 1.00 0.00 C ATOM 2309 CD GLU A 159 -14.815 -29.866 0.363 1.00 0.00 C ATOM 2310 OE1 GLU A 159 -15.327 -29.201 1.288 1.00 0.00 O ATOM 2311 OE2 GLU A 159 -15.460 -30.270 -0.628 1.00 0.00 O ATOM 2312 OXT GLU A 159 -10.237 -27.530 -1.390 1.00 0.00 O ATOM 0 H GLU A 159 -11.037 -28.274 1.581 1.00 0.00 H new ATOM 0 HA GLU A 159 -10.798 -30.518 -0.214 1.00 0.00 H new ATOM 0 HB2 GLU A 159 -12.680 -28.180 0.158 1.00 0.00 H new ATOM 0 HB3 GLU A 159 -12.747 -29.130 -1.314 1.00 0.00 H new ATOM 0 HG2 GLU A 159 -13.163 -31.178 0.002 1.00 0.00 H new ATOM 0 HG3 GLU A 159 -13.041 -30.263 1.492 1.00 0.00 H new TER 2319 GLU A 159 HETATM 2320 ZN ZN A 201 6.374 -0.860 7.337 1.00 0.00 ZN HETATM 2321 O UNL A 202 8.104 0.208 7.579 1.00 0.00 O