USER MOD reduce.3.24.130724 H: found=0, std=0, add=800, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 804 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 107 HIS : no HE2:sc= -0.916 K(o=-4.2,f=-11!) USER MOD Set 1.2: B 34 MET CE :methyl -148:sc= -3.24! (180deg=-3.63!) USER MOD Set 2.1: A 101 SER OG : rot -38:sc= 0.163 USER MOD Set 2.2: A 135 GLN : amide:sc= -1.07 X(o=-0.91,f=-1) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 163:sc= -0.0238 (180deg=-0.429) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 20:sc= 0.3 USER MOD Single : A 94 LYS NZ :NH3+ -162:sc= -0.05 (180deg=-0.442) USER MOD Single : A 97 ASN : amide:sc= 0.0968 K(o=0.097,f=-12!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl -145:sc= -2.57! (180deg=-3.86!) USER MOD Single : A 110 THR OG1 : rot -84:sc= 0.448 USER MOD Single : A 111 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 151:sc= -2.01! USER MOD Single : A 124 MET CE :methyl 156:sc= -0.43 (180deg=-2.81) USER MOD Single : A 137 ASN : amide:sc= -1.82! C(o=-1.8!,f=-8.4!) USER MOD Single : A 138 TYR OH : rot 150:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -0.0939 K(o=-0.094,f=-2.8!) USER MOD Single : A 144 MET CE :methyl 165:sc= -0.0329 (180deg=-0.566) USER MOD Single : A 145 MET CE :methyl 143:sc= -0.0591 (180deg=-1.71!) USER MOD Single : A 146 THR OG1 : rot -90:sc= 0.728 USER MOD Single : A 148 LYS NZ :NH3+ 179:sc= -3.72 (180deg=-3.76) USER MOD Single : B 39 THR OG1 : rot 148:sc= 0.77 USER MOD Single : B 47 GLN : amide:sc= -5.55! C(o=-5.6!,f=-12!) USER MOD Single : B 48 SER OG : rot 180:sc= 0 USER MOD Single : B 49 GLN : amide:sc= -0.31 X(o=-0.31,f=-0.5) USER MOD Single : B 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 54 GLN :FLIP amide:sc= -2.21! C(o=-3.7!,f=-2.2!) USER MOD Single : B 55 LYS NZ :NH3+ -144:sc=-0.00141 (180deg=-0.0901) USER MOD Single : B 56 LYS NZ :NH3+ -120:sc= -0.0631 (180deg=-0.453) USER MOD Single : B 57 LYS NZ :NH3+ -160:sc= -0.06 (180deg=-0.552) USER MOD Single : B 60 SER OG : rot 23:sc= 0.321 USER MOD Single : B 61 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 76 13.162 -9.992 -20.692 1.00 0.00 N ATOM 2 CA MET A 76 11.839 -10.192 -21.347 1.00 0.00 C ATOM 3 C MET A 76 11.018 -11.187 -20.534 1.00 0.00 C ATOM 4 O MET A 76 9.895 -11.529 -20.906 1.00 0.00 O ATOM 5 CB MET A 76 12.052 -10.728 -22.767 1.00 0.00 C ATOM 6 CG MET A 76 10.830 -10.404 -23.632 1.00 0.00 C ATOM 7 SD MET A 76 10.756 -8.622 -23.940 1.00 0.00 S ATOM 8 CE MET A 76 9.156 -8.606 -24.787 1.00 0.00 C ATOM 0 HA MET A 76 11.305 -9.243 -21.398 1.00 0.00 H new ATOM 0 HB2 MET A 76 12.946 -10.283 -23.203 1.00 0.00 H new ATOM 0 HB3 MET A 76 12.214 -11.806 -22.739 1.00 0.00 H new ATOM 0 HG2 MET A 76 10.888 -10.944 -24.577 1.00 0.00 H new ATOM 0 HG3 MET A 76 9.920 -10.734 -23.131 1.00 0.00 H new ATOM 0 HE1 MET A 76 8.906 -7.584 -25.073 1.00 0.00 H new ATOM 0 HE2 MET A 76 9.210 -9.230 -25.679 1.00 0.00 H new ATOM 0 HE3 MET A 76 8.387 -8.994 -24.119 1.00 0.00 H new ATOM 20 N LYS A 77 11.584 -11.652 -19.425 1.00 0.00 N ATOM 21 CA LYS A 77 10.888 -12.611 -18.575 1.00 0.00 C ATOM 22 C LYS A 77 9.585 -12.018 -18.046 1.00 0.00 C ATOM 23 O LYS A 77 8.601 -12.736 -17.865 1.00 0.00 O ATOM 24 CB LYS A 77 11.792 -13.017 -17.407 1.00 0.00 C ATOM 25 CG LYS A 77 12.105 -11.794 -16.541 1.00 0.00 C ATOM 26 CD LYS A 77 13.058 -12.197 -15.413 1.00 0.00 C ATOM 27 CE LYS A 77 13.450 -10.955 -14.609 1.00 0.00 C ATOM 28 NZ LYS A 77 12.235 -10.367 -13.978 1.00 0.00 N ATOM 0 H LYS A 77 12.512 -11.384 -19.097 1.00 0.00 H new ATOM 0 HA LYS A 77 10.647 -13.493 -19.169 1.00 0.00 H new ATOM 0 HB2 LYS A 77 11.302 -13.783 -16.806 1.00 0.00 H new ATOM 0 HB3 LYS A 77 12.717 -13.452 -17.786 1.00 0.00 H new ATOM 0 HG2 LYS A 77 12.556 -11.010 -17.150 1.00 0.00 H new ATOM 0 HG3 LYS A 77 11.184 -11.385 -16.125 1.00 0.00 H new ATOM 0 HD2 LYS A 77 12.579 -12.929 -14.762 1.00 0.00 H new ATOM 0 HD3 LYS A 77 13.948 -12.672 -15.826 1.00 0.00 H new ATOM 0 HE2 LYS A 77 14.179 -11.220 -13.843 1.00 0.00 H new ATOM 0 HE3 LYS A 77 13.925 -10.222 -15.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 12.519 -9.717 -13.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 11.690 -9.845 -14.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 11.647 -11.128 -13.582 1.00 0.00 H new ATOM 42 N ASP A 78 9.596 -10.712 -17.782 1.00 0.00 N ATOM 43 CA ASP A 78 8.418 -10.025 -17.254 1.00 0.00 C ATOM 44 C ASP A 78 8.059 -10.571 -15.876 1.00 0.00 C ATOM 45 O ASP A 78 8.344 -9.942 -14.858 1.00 0.00 O ATOM 46 CB ASP A 78 7.225 -10.183 -18.205 1.00 0.00 C ATOM 47 CG ASP A 78 7.612 -9.726 -19.608 1.00 0.00 C ATOM 48 OD1 ASP A 78 8.152 -8.640 -19.728 1.00 0.00 O ATOM 49 OD2 ASP A 78 7.361 -10.472 -20.541 1.00 0.00 O ATOM 0 H ASP A 78 10.406 -10.109 -17.925 1.00 0.00 H new ATOM 0 HA ASP A 78 8.655 -8.965 -17.166 1.00 0.00 H new ATOM 0 HB2 ASP A 78 6.904 -11.224 -18.229 1.00 0.00 H new ATOM 0 HB3 ASP A 78 6.380 -9.597 -17.843 1.00 0.00 H new ATOM 54 N THR A 79 7.438 -11.745 -15.850 1.00 0.00 N ATOM 55 CA THR A 79 7.052 -12.366 -14.588 1.00 0.00 C ATOM 56 C THR A 79 6.082 -11.472 -13.821 1.00 0.00 C ATOM 57 O THR A 79 6.388 -11.027 -12.715 1.00 0.00 O ATOM 58 CB THR A 79 8.292 -12.628 -13.731 1.00 0.00 C ATOM 59 OG1 THR A 79 9.309 -13.206 -14.537 1.00 0.00 O ATOM 60 CG2 THR A 79 7.936 -13.584 -12.592 1.00 0.00 C ATOM 0 H THR A 79 7.193 -12.283 -16.681 1.00 0.00 H new ATOM 0 HA THR A 79 6.558 -13.312 -14.810 1.00 0.00 H new ATOM 0 HB THR A 79 8.650 -11.687 -13.313 1.00 0.00 H new ATOM 0 HG1 THR A 79 10.105 -13.373 -13.990 1.00 0.00 H new ATOM 0 HG21 THR A 79 8.821 -13.769 -11.983 1.00 0.00 H new ATOM 0 HG22 THR A 79 7.156 -13.139 -11.974 1.00 0.00 H new ATOM 0 HG23 THR A 79 7.577 -14.526 -13.006 1.00 0.00 H new ATOM 68 N ASP A 80 4.926 -11.211 -14.438 1.00 0.00 N ATOM 69 CA ASP A 80 3.888 -10.359 -13.846 1.00 0.00 C ATOM 70 C ASP A 80 4.000 -10.301 -12.324 1.00 0.00 C ATOM 71 O ASP A 80 3.451 -11.142 -11.615 1.00 0.00 O ATOM 72 CB ASP A 80 2.504 -10.883 -14.236 1.00 0.00 C ATOM 73 CG ASP A 80 2.520 -12.406 -14.293 1.00 0.00 C ATOM 74 OD1 ASP A 80 3.226 -13.001 -13.495 1.00 0.00 O ATOM 75 OD2 ASP A 80 1.828 -12.956 -15.134 1.00 0.00 O ATOM 0 H ASP A 80 4.683 -11.581 -15.357 1.00 0.00 H new ATOM 0 HA ASP A 80 4.029 -9.349 -14.232 1.00 0.00 H new ATOM 0 HB2 ASP A 80 1.761 -10.546 -13.513 1.00 0.00 H new ATOM 0 HB3 ASP A 80 2.212 -10.478 -15.205 1.00 0.00 H new ATOM 80 N SER A 81 4.722 -9.295 -11.842 1.00 0.00 N ATOM 81 CA SER A 81 4.926 -9.098 -10.408 1.00 0.00 C ATOM 82 C SER A 81 3.726 -8.400 -9.781 1.00 0.00 C ATOM 83 O SER A 81 3.669 -8.216 -8.568 1.00 0.00 O ATOM 84 CB SER A 81 6.186 -8.271 -10.162 1.00 0.00 C ATOM 85 OG SER A 81 7.319 -8.991 -10.631 1.00 0.00 O ATOM 0 H SER A 81 5.180 -8.597 -12.428 1.00 0.00 H new ATOM 0 HA SER A 81 5.042 -10.078 -9.945 1.00 0.00 H new ATOM 0 HB2 SER A 81 6.112 -7.312 -10.675 1.00 0.00 H new ATOM 0 HB3 SER A 81 6.292 -8.056 -9.099 1.00 0.00 H new ATOM 0 HG SER A 81 7.031 -9.671 -11.276 1.00 0.00 H new ATOM 91 N GLU A 82 2.779 -7.996 -10.613 1.00 0.00 N ATOM 92 CA GLU A 82 1.603 -7.300 -10.112 1.00 0.00 C ATOM 93 C GLU A 82 0.923 -8.159 -9.056 1.00 0.00 C ATOM 94 O GLU A 82 0.407 -7.655 -8.060 1.00 0.00 O ATOM 95 CB GLU A 82 0.622 -7.042 -11.259 1.00 0.00 C ATOM 96 CG GLU A 82 1.199 -6.003 -12.218 1.00 0.00 C ATOM 97 CD GLU A 82 0.330 -5.906 -13.467 1.00 0.00 C ATOM 98 OE1 GLU A 82 -0.497 -6.782 -13.658 1.00 0.00 O ATOM 99 OE2 GLU A 82 0.504 -4.957 -14.214 1.00 0.00 O ATOM 0 H GLU A 82 2.799 -8.135 -11.623 1.00 0.00 H new ATOM 0 HA GLU A 82 1.907 -6.348 -9.677 1.00 0.00 H new ATOM 0 HB2 GLU A 82 0.423 -7.971 -11.793 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -0.331 -6.692 -10.862 1.00 0.00 H new ATOM 0 HG2 GLU A 82 1.252 -5.032 -11.726 1.00 0.00 H new ATOM 0 HG3 GLU A 82 2.217 -6.277 -12.494 1.00 0.00 H new ATOM 106 N GLU A 83 0.942 -9.460 -9.288 1.00 0.00 N ATOM 107 CA GLU A 83 0.338 -10.412 -8.362 1.00 0.00 C ATOM 108 C GLU A 83 1.107 -10.467 -7.040 1.00 0.00 C ATOM 109 O GLU A 83 0.546 -10.819 -6.002 1.00 0.00 O ATOM 110 CB GLU A 83 0.345 -11.801 -9.002 1.00 0.00 C ATOM 111 CG GLU A 83 1.791 -12.299 -9.128 1.00 0.00 C ATOM 112 CD GLU A 83 1.835 -13.546 -10.004 1.00 0.00 C ATOM 113 OE1 GLU A 83 0.786 -13.948 -10.481 1.00 0.00 O ATOM 114 OE2 GLU A 83 2.916 -14.080 -10.186 1.00 0.00 O ATOM 0 H GLU A 83 1.369 -9.886 -10.111 1.00 0.00 H new ATOM 0 HA GLU A 83 -0.682 -10.089 -8.152 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -0.238 -12.495 -8.397 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -0.125 -11.763 -9.985 1.00 0.00 H new ATOM 0 HG2 GLU A 83 2.418 -11.518 -9.560 1.00 0.00 H new ATOM 0 HG3 GLU A 83 2.195 -12.523 -8.141 1.00 0.00 H new ATOM 121 N GLU A 84 2.398 -10.139 -7.083 1.00 0.00 N ATOM 122 CA GLU A 84 3.223 -10.182 -5.875 1.00 0.00 C ATOM 123 C GLU A 84 2.699 -9.205 -4.827 1.00 0.00 C ATOM 124 O GLU A 84 2.565 -9.553 -3.653 1.00 0.00 O ATOM 125 CB GLU A 84 4.676 -9.840 -6.222 1.00 0.00 C ATOM 126 CG GLU A 84 5.549 -9.967 -4.970 1.00 0.00 C ATOM 127 CD GLU A 84 7.009 -9.700 -5.323 1.00 0.00 C ATOM 128 OE1 GLU A 84 7.277 -9.423 -6.480 1.00 0.00 O ATOM 129 OE2 GLU A 84 7.836 -9.775 -4.429 1.00 0.00 O ATOM 0 H GLU A 84 2.890 -9.845 -7.927 1.00 0.00 H new ATOM 0 HA GLU A 84 3.177 -11.190 -5.463 1.00 0.00 H new ATOM 0 HB2 GLU A 84 5.041 -10.509 -7.001 1.00 0.00 H new ATOM 0 HB3 GLU A 84 4.737 -8.826 -6.618 1.00 0.00 H new ATOM 0 HG2 GLU A 84 5.215 -9.260 -4.210 1.00 0.00 H new ATOM 0 HG3 GLU A 84 5.446 -10.965 -4.544 1.00 0.00 H new ATOM 136 N ILE A 85 2.397 -7.986 -5.257 1.00 0.00 N ATOM 137 CA ILE A 85 1.881 -6.973 -4.347 1.00 0.00 C ATOM 138 C ILE A 85 0.424 -7.261 -4.013 1.00 0.00 C ATOM 139 O ILE A 85 -0.069 -6.896 -2.945 1.00 0.00 O ATOM 140 CB ILE A 85 2.009 -5.587 -4.963 1.00 0.00 C ATOM 141 CG1 ILE A 85 3.434 -5.423 -5.492 1.00 0.00 C ATOM 142 CG2 ILE A 85 1.723 -4.524 -3.893 1.00 0.00 C ATOM 143 CD1 ILE A 85 3.805 -3.946 -5.509 1.00 0.00 C ATOM 0 H ILE A 85 2.500 -7.677 -6.224 1.00 0.00 H new ATOM 0 HA ILE A 85 2.468 -7.002 -3.429 1.00 0.00 H new ATOM 0 HB ILE A 85 1.295 -5.467 -5.778 1.00 0.00 H new ATOM 0 HG12 ILE A 85 4.132 -5.977 -4.864 1.00 0.00 H new ATOM 0 HG13 ILE A 85 3.510 -5.839 -6.497 1.00 0.00 H new ATOM 0 HG21 ILE A 85 1.814 -3.531 -4.333 1.00 0.00 H new ATOM 0 HG22 ILE A 85 0.712 -4.658 -3.508 1.00 0.00 H new ATOM 0 HG23 ILE A 85 2.439 -4.627 -3.078 1.00 0.00 H new ATOM 0 HD11 ILE A 85 4.821 -3.830 -5.886 1.00 0.00 H new ATOM 0 HD12 ILE A 85 3.114 -3.405 -6.155 1.00 0.00 H new ATOM 0 HD13 ILE A 85 3.746 -3.544 -4.497 1.00 0.00 H new ATOM 155 N ARG A 86 -0.252 -7.948 -4.920 1.00 0.00 N ATOM 156 CA ARG A 86 -1.644 -8.308 -4.711 1.00 0.00 C ATOM 157 C ARG A 86 -1.757 -9.199 -3.480 1.00 0.00 C ATOM 158 O ARG A 86 -2.644 -9.020 -2.648 1.00 0.00 O ATOM 159 CB ARG A 86 -2.169 -9.045 -5.943 1.00 0.00 C ATOM 160 CG ARG A 86 -3.659 -9.337 -5.790 1.00 0.00 C ATOM 161 CD ARG A 86 -4.164 -10.011 -7.065 1.00 0.00 C ATOM 162 NE ARG A 86 -5.584 -10.320 -6.946 1.00 0.00 N ATOM 163 CZ ARG A 86 -6.246 -10.898 -7.943 1.00 0.00 C ATOM 164 NH1 ARG A 86 -5.626 -11.199 -9.050 1.00 0.00 N ATOM 165 NH2 ARG A 86 -7.518 -11.164 -7.816 1.00 0.00 N ATOM 0 H ARG A 86 0.140 -8.267 -5.806 1.00 0.00 H new ATOM 0 HA ARG A 86 -2.238 -7.408 -4.555 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -1.999 -8.443 -6.835 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -1.621 -9.977 -6.079 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -3.830 -9.983 -4.929 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -4.208 -8.413 -5.609 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -3.998 -9.357 -7.921 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -3.600 -10.925 -7.249 1.00 0.00 H new ATOM 0 HE ARG A 86 -6.077 -10.089 -6.084 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -4.633 -10.991 -9.151 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -6.134 -11.643 -9.815 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -8.004 -10.928 -6.951 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -8.025 -11.608 -8.582 1.00 0.00 H new ATOM 179 N GLU A 87 -0.830 -10.149 -3.369 1.00 0.00 N ATOM 180 CA GLU A 87 -0.809 -11.064 -2.234 1.00 0.00 C ATOM 181 C GLU A 87 -0.650 -10.273 -0.943 1.00 0.00 C ATOM 182 O GLU A 87 -1.292 -10.565 0.064 1.00 0.00 O ATOM 183 CB GLU A 87 0.353 -12.050 -2.385 1.00 0.00 C ATOM 184 CG GLU A 87 0.342 -13.047 -1.224 1.00 0.00 C ATOM 185 CD GLU A 87 1.465 -14.064 -1.401 1.00 0.00 C ATOM 186 OE1 GLU A 87 2.185 -13.957 -2.380 1.00 0.00 O ATOM 187 OE2 GLU A 87 1.588 -14.934 -0.555 1.00 0.00 O ATOM 0 H GLU A 87 -0.087 -10.303 -4.050 1.00 0.00 H new ATOM 0 HA GLU A 87 -1.746 -11.620 -2.202 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.270 -12.581 -3.333 1.00 0.00 H new ATOM 0 HB3 GLU A 87 1.300 -11.510 -2.404 1.00 0.00 H new ATOM 0 HG2 GLU A 87 0.464 -12.519 -0.279 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -0.620 -13.558 -1.182 1.00 0.00 H new ATOM 194 N ALA A 88 0.201 -9.258 -0.991 1.00 0.00 N ATOM 195 CA ALA A 88 0.429 -8.411 0.168 1.00 0.00 C ATOM 196 C ALA A 88 -0.867 -7.729 0.575 1.00 0.00 C ATOM 197 O ALA A 88 -1.135 -7.558 1.760 1.00 0.00 O ATOM 198 CB ALA A 88 1.493 -7.356 -0.149 1.00 0.00 C ATOM 0 H ALA A 88 0.742 -9.003 -1.817 1.00 0.00 H new ATOM 0 HA ALA A 88 0.781 -9.032 0.992 1.00 0.00 H new ATOM 0 HB1 ALA A 88 1.655 -6.728 0.727 1.00 0.00 H new ATOM 0 HB2 ALA A 88 2.426 -7.850 -0.419 1.00 0.00 H new ATOM 0 HB3 ALA A 88 1.156 -6.738 -0.981 1.00 0.00 H new ATOM 204 N PHE A 89 -1.684 -7.364 -0.409 1.00 0.00 N ATOM 205 CA PHE A 89 -2.960 -6.733 -0.113 1.00 0.00 C ATOM 206 C PHE A 89 -3.930 -7.754 0.485 1.00 0.00 C ATOM 207 O PHE A 89 -4.655 -7.460 1.435 1.00 0.00 O ATOM 208 CB PHE A 89 -3.543 -6.105 -1.379 1.00 0.00 C ATOM 209 CG PHE A 89 -2.877 -4.769 -1.601 1.00 0.00 C ATOM 210 CD1 PHE A 89 -3.124 -3.716 -0.713 1.00 0.00 C ATOM 211 CD2 PHE A 89 -2.008 -4.581 -2.684 1.00 0.00 C ATOM 212 CE1 PHE A 89 -2.506 -2.475 -0.907 1.00 0.00 C ATOM 213 CE2 PHE A 89 -1.389 -3.339 -2.878 1.00 0.00 C ATOM 214 CZ PHE A 89 -1.640 -2.288 -1.988 1.00 0.00 C ATOM 0 H PHE A 89 -1.487 -7.493 -1.402 1.00 0.00 H new ATOM 0 HA PHE A 89 -2.802 -5.942 0.621 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -3.378 -6.758 -2.236 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -4.621 -5.979 -1.277 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -3.792 -3.861 0.123 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -1.815 -5.393 -3.369 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -2.698 -1.663 -0.222 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -0.719 -3.193 -3.713 1.00 0.00 H new ATOM 0 HZ PHE A 89 -1.163 -1.330 -2.137 1.00 0.00 H new ATOM 224 N ARG A 90 -3.945 -8.950 -0.097 1.00 0.00 N ATOM 225 CA ARG A 90 -4.844 -10.010 0.362 1.00 0.00 C ATOM 226 C ARG A 90 -4.863 -10.106 1.887 1.00 0.00 C ATOM 227 O ARG A 90 -5.906 -10.391 2.477 1.00 0.00 O ATOM 228 CB ARG A 90 -4.420 -11.368 -0.217 1.00 0.00 C ATOM 229 CG ARG A 90 -5.355 -11.789 -1.361 1.00 0.00 C ATOM 230 CD ARG A 90 -5.137 -10.876 -2.566 1.00 0.00 C ATOM 231 NE ARG A 90 -5.857 -11.389 -3.726 1.00 0.00 N ATOM 232 CZ ARG A 90 -5.325 -12.328 -4.503 1.00 0.00 C ATOM 233 NH1 ARG A 90 -4.144 -12.810 -4.228 1.00 0.00 N ATOM 234 NH2 ARG A 90 -5.984 -12.769 -5.539 1.00 0.00 N ATOM 0 H ARG A 90 -3.349 -9.211 -0.883 1.00 0.00 H new ATOM 0 HA ARG A 90 -5.844 -9.756 0.012 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -3.395 -11.309 -0.582 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -4.435 -12.124 0.568 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -5.163 -12.825 -1.638 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -6.393 -11.734 -1.034 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -5.479 -9.868 -2.334 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -4.073 -10.807 -2.791 1.00 0.00 H new ATOM 0 HE ARG A 90 -6.783 -11.022 -3.945 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -3.629 -12.467 -3.417 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -3.736 -13.530 -4.824 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -6.908 -12.394 -5.753 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -5.575 -13.489 -6.135 1.00 0.00 H new ATOM 248 N VAL A 91 -3.720 -9.882 2.530 1.00 0.00 N ATOM 249 CA VAL A 91 -3.663 -9.969 3.988 1.00 0.00 C ATOM 250 C VAL A 91 -4.690 -9.039 4.619 1.00 0.00 C ATOM 251 O VAL A 91 -5.219 -9.321 5.694 1.00 0.00 O ATOM 252 CB VAL A 91 -2.266 -9.602 4.499 1.00 0.00 C ATOM 253 CG1 VAL A 91 -2.025 -8.108 4.314 1.00 0.00 C ATOM 254 CG2 VAL A 91 -2.161 -9.948 5.991 1.00 0.00 C ATOM 0 H VAL A 91 -2.838 -9.644 2.077 1.00 0.00 H new ATOM 0 HA VAL A 91 -3.887 -10.998 4.270 1.00 0.00 H new ATOM 0 HB VAL A 91 -1.520 -10.163 3.936 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -1.030 -7.852 4.679 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -2.100 -7.856 3.256 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -2.773 -7.547 4.874 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -1.167 -9.687 6.356 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -2.911 -9.387 6.548 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -2.330 -11.016 6.130 1.00 0.00 H new ATOM 264 N PHE A 92 -4.974 -7.933 3.943 1.00 0.00 N ATOM 265 CA PHE A 92 -5.943 -6.978 4.450 1.00 0.00 C ATOM 266 C PHE A 92 -7.303 -7.242 3.809 1.00 0.00 C ATOM 267 O PHE A 92 -8.347 -6.988 4.413 1.00 0.00 O ATOM 268 CB PHE A 92 -5.479 -5.550 4.142 1.00 0.00 C ATOM 269 CG PHE A 92 -4.046 -5.376 4.604 1.00 0.00 C ATOM 270 CD1 PHE A 92 -3.733 -5.444 5.964 1.00 0.00 C ATOM 271 CD2 PHE A 92 -3.032 -5.148 3.670 1.00 0.00 C ATOM 272 CE1 PHE A 92 -2.405 -5.288 6.388 1.00 0.00 C ATOM 273 CE2 PHE A 92 -1.705 -4.992 4.092 1.00 0.00 C ATOM 274 CZ PHE A 92 -1.393 -5.064 5.451 1.00 0.00 C ATOM 0 H PHE A 92 -4.550 -7.679 3.051 1.00 0.00 H new ATOM 0 HA PHE A 92 -6.031 -7.090 5.531 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -5.554 -5.354 3.072 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -6.125 -4.830 4.644 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -4.514 -5.617 6.689 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -3.272 -5.092 2.619 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -2.165 -5.341 7.440 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -0.924 -4.816 3.367 1.00 0.00 H new ATOM 0 HZ PHE A 92 -0.370 -4.947 5.778 1.00 0.00 H new ATOM 284 N ASP A 93 -7.280 -7.757 2.580 1.00 0.00 N ATOM 285 CA ASP A 93 -8.505 -8.061 1.855 1.00 0.00 C ATOM 286 C ASP A 93 -8.984 -9.471 2.223 1.00 0.00 C ATOM 287 O ASP A 93 -9.058 -10.365 1.379 1.00 0.00 O ATOM 288 CB ASP A 93 -8.243 -7.957 0.341 1.00 0.00 C ATOM 289 CG ASP A 93 -6.927 -7.233 0.079 1.00 0.00 C ATOM 290 OD1 ASP A 93 -6.617 -6.317 0.816 1.00 0.00 O ATOM 291 OD2 ASP A 93 -6.242 -7.612 -0.858 1.00 0.00 O ATOM 0 H ASP A 93 -6.424 -7.971 2.069 1.00 0.00 H new ATOM 0 HA ASP A 93 -9.282 -7.347 2.127 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -8.211 -8.954 -0.098 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -9.062 -7.423 -0.141 1.00 0.00 H new ATOM 296 N LYS A 94 -9.313 -9.676 3.495 1.00 0.00 N ATOM 297 CA LYS A 94 -9.778 -10.980 3.952 1.00 0.00 C ATOM 298 C LYS A 94 -11.176 -11.285 3.439 1.00 0.00 C ATOM 299 O LYS A 94 -11.590 -12.443 3.378 1.00 0.00 O ATOM 300 CB LYS A 94 -9.778 -11.015 5.478 1.00 0.00 C ATOM 301 CG LYS A 94 -10.798 -10.013 6.031 1.00 0.00 C ATOM 302 CD LYS A 94 -10.739 -10.021 7.560 1.00 0.00 C ATOM 303 CE LYS A 94 -11.824 -9.098 8.117 1.00 0.00 C ATOM 304 NZ LYS A 94 -11.563 -7.699 7.671 1.00 0.00 N ATOM 0 H LYS A 94 -9.267 -8.962 4.222 1.00 0.00 H new ATOM 0 HA LYS A 94 -9.100 -11.737 3.558 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -10.019 -12.020 5.826 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -8.783 -10.777 5.854 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -10.584 -9.013 5.653 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -11.801 -10.274 5.693 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -10.881 -11.035 7.935 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -9.757 -9.691 7.898 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -12.806 -9.424 7.773 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -11.835 -9.148 9.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -12.094 -7.038 8.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -10.546 -7.495 7.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -11.867 -7.587 6.683 1.00 0.00 H new ATOM 318 N ASP A 95 -11.894 -10.241 3.064 1.00 0.00 N ATOM 319 CA ASP A 95 -13.247 -10.404 2.548 1.00 0.00 C ATOM 320 C ASP A 95 -13.212 -10.942 1.123 1.00 0.00 C ATOM 321 O ASP A 95 -14.157 -11.586 0.667 1.00 0.00 O ATOM 322 CB ASP A 95 -13.986 -9.065 2.578 1.00 0.00 C ATOM 323 CG ASP A 95 -14.291 -8.671 4.018 1.00 0.00 C ATOM 324 OD1 ASP A 95 -14.172 -9.526 4.882 1.00 0.00 O ATOM 325 OD2 ASP A 95 -14.640 -7.524 4.239 1.00 0.00 O ATOM 0 H ASP A 95 -11.568 -9.275 3.106 1.00 0.00 H new ATOM 0 HA ASP A 95 -13.774 -11.118 3.180 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -13.379 -8.295 2.102 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -14.912 -9.139 2.008 1.00 0.00 H new ATOM 330 N GLY A 96 -12.116 -10.667 0.424 1.00 0.00 N ATOM 331 CA GLY A 96 -11.967 -11.125 -0.951 1.00 0.00 C ATOM 332 C GLY A 96 -12.913 -10.370 -1.878 1.00 0.00 C ATOM 333 O GLY A 96 -13.290 -10.872 -2.936 1.00 0.00 O ATOM 0 H GLY A 96 -11.324 -10.134 0.784 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -10.937 -10.980 -1.278 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -12.172 -12.194 -1.007 1.00 0.00 H new ATOM 337 N ASN A 97 -13.294 -9.160 -1.476 1.00 0.00 N ATOM 338 CA ASN A 97 -14.197 -8.351 -2.287 1.00 0.00 C ATOM 339 C ASN A 97 -13.415 -7.431 -3.223 1.00 0.00 C ATOM 340 O ASN A 97 -14.003 -6.732 -4.048 1.00 0.00 O ATOM 341 CB ASN A 97 -15.103 -7.515 -1.380 1.00 0.00 C ATOM 342 CG ASN A 97 -14.272 -6.503 -0.598 1.00 0.00 C ATOM 343 OD1 ASN A 97 -13.043 -6.548 -0.637 1.00 0.00 O ATOM 344 ND2 ASN A 97 -14.872 -5.590 0.114 1.00 0.00 N ATOM 0 H ASN A 97 -12.995 -8.723 -0.604 1.00 0.00 H new ATOM 0 HA ASN A 97 -14.806 -9.022 -2.893 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -15.852 -6.997 -1.979 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -15.641 -8.166 -0.691 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -14.322 -4.911 0.640 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -15.891 -5.555 0.145 1.00 0.00 H new ATOM 351 N GLY A 98 -12.090 -7.450 -3.098 1.00 0.00 N ATOM 352 CA GLY A 98 -11.241 -6.615 -3.946 1.00 0.00 C ATOM 353 C GLY A 98 -10.886 -5.292 -3.263 1.00 0.00 C ATOM 354 O GLY A 98 -10.155 -4.476 -3.824 1.00 0.00 O ATOM 0 H GLY A 98 -11.585 -8.027 -2.426 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -10.326 -7.156 -4.190 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -11.753 -6.413 -4.887 1.00 0.00 H new ATOM 358 N TYR A 99 -11.431 -5.079 -2.067 1.00 0.00 N ATOM 359 CA TYR A 99 -11.186 -3.835 -1.333 1.00 0.00 C ATOM 360 C TYR A 99 -10.640 -4.100 0.064 1.00 0.00 C ATOM 361 O TYR A 99 -10.824 -5.177 0.630 1.00 0.00 O ATOM 362 CB TYR A 99 -12.481 -3.030 -1.203 1.00 0.00 C ATOM 363 CG TYR A 99 -13.028 -2.696 -2.569 1.00 0.00 C ATOM 364 CD1 TYR A 99 -13.533 -3.714 -3.380 1.00 0.00 C ATOM 365 CD2 TYR A 99 -13.012 -1.374 -3.031 1.00 0.00 C ATOM 366 CE1 TYR A 99 -14.026 -3.419 -4.653 1.00 0.00 C ATOM 367 CE2 TYR A 99 -13.505 -1.077 -4.307 1.00 0.00 C ATOM 368 CZ TYR A 99 -14.011 -2.100 -5.120 1.00 0.00 C ATOM 369 OH TYR A 99 -14.497 -1.807 -6.377 1.00 0.00 O ATOM 0 H TYR A 99 -12.039 -5.743 -1.588 1.00 0.00 H new ATOM 0 HA TYR A 99 -10.445 -3.272 -1.900 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -13.218 -3.602 -0.638 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -12.293 -2.113 -0.645 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -13.542 -4.733 -3.022 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -12.620 -0.586 -2.405 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -14.419 -4.209 -5.277 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -13.495 -0.058 -4.665 1.00 0.00 H new ATOM 0 HH TYR A 99 -14.414 -0.845 -6.544 1.00 0.00 H new ATOM 379 N ILE A 100 -9.995 -3.080 0.621 1.00 0.00 N ATOM 380 CA ILE A 100 -9.446 -3.154 1.967 1.00 0.00 C ATOM 381 C ILE A 100 -9.928 -1.927 2.730 1.00 0.00 C ATOM 382 O ILE A 100 -10.041 -0.850 2.149 1.00 0.00 O ATOM 383 CB ILE A 100 -7.906 -3.173 1.909 1.00 0.00 C ATOM 384 CG1 ILE A 100 -7.347 -1.751 2.030 1.00 0.00 C ATOM 385 CG2 ILE A 100 -7.472 -3.733 0.559 1.00 0.00 C ATOM 386 CD1 ILE A 100 -5.858 -1.747 1.684 1.00 0.00 C ATOM 0 H ILE A 100 -9.840 -2.186 0.155 1.00 0.00 H new ATOM 0 HA ILE A 100 -9.776 -4.066 2.465 1.00 0.00 H new ATOM 0 HB ILE A 100 -7.532 -3.785 2.730 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -7.887 -1.080 1.361 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -7.495 -1.378 3.043 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -6.383 -3.752 0.506 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -7.858 -4.746 0.444 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -7.864 -3.103 -0.239 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -5.467 -0.733 1.772 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -5.323 -2.403 2.371 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -5.721 -2.101 0.662 1.00 0.00 H new ATOM 398 N SER A 101 -10.226 -2.067 4.011 1.00 0.00 N ATOM 399 CA SER A 101 -10.701 -0.918 4.765 1.00 0.00 C ATOM 400 C SER A 101 -9.633 0.174 4.778 1.00 0.00 C ATOM 401 O SER A 101 -8.456 -0.100 5.015 1.00 0.00 O ATOM 402 CB SER A 101 -11.038 -1.327 6.199 1.00 0.00 C ATOM 403 OG SER A 101 -12.114 -2.257 6.182 1.00 0.00 O ATOM 0 H SER A 101 -10.151 -2.937 4.538 1.00 0.00 H new ATOM 0 HA SER A 101 -11.602 -0.534 4.286 1.00 0.00 H new ATOM 0 HB2 SER A 101 -10.165 -1.772 6.677 1.00 0.00 H new ATOM 0 HB3 SER A 101 -11.310 -0.449 6.785 1.00 0.00 H new ATOM 0 HG SER A 101 -12.757 -2.001 5.488 1.00 0.00 H new ATOM 409 N ALA A 102 -10.050 1.410 4.521 1.00 0.00 N ATOM 410 CA ALA A 102 -9.120 2.537 4.506 1.00 0.00 C ATOM 411 C ALA A 102 -8.489 2.735 5.883 1.00 0.00 C ATOM 412 O ALA A 102 -7.308 3.061 5.997 1.00 0.00 O ATOM 413 CB ALA A 102 -9.846 3.817 4.079 1.00 0.00 C ATOM 0 H ALA A 102 -11.019 1.657 4.321 1.00 0.00 H new ATOM 0 HA ALA A 102 -8.330 2.317 3.788 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -9.142 4.649 4.072 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -10.261 3.684 3.080 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -10.652 4.030 4.781 1.00 0.00 H new ATOM 419 N ALA A 103 -9.293 2.548 6.924 1.00 0.00 N ATOM 420 CA ALA A 103 -8.812 2.725 8.291 1.00 0.00 C ATOM 421 C ALA A 103 -7.655 1.773 8.585 1.00 0.00 C ATOM 422 O ALA A 103 -6.674 2.159 9.222 1.00 0.00 O ATOM 423 CB ALA A 103 -9.950 2.467 9.281 1.00 0.00 C ATOM 0 H ALA A 103 -10.273 2.276 6.850 1.00 0.00 H new ATOM 0 HA ALA A 103 -8.458 3.750 8.400 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -9.584 2.601 10.299 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -10.762 3.169 9.092 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -10.315 1.447 9.158 1.00 0.00 H new ATOM 429 N GLU A 104 -7.765 0.537 8.112 1.00 0.00 N ATOM 430 CA GLU A 104 -6.711 -0.450 8.325 1.00 0.00 C ATOM 431 C GLU A 104 -5.423 -0.031 7.620 1.00 0.00 C ATOM 432 O GLU A 104 -4.331 -0.213 8.155 1.00 0.00 O ATOM 433 CB GLU A 104 -7.174 -1.826 7.817 1.00 0.00 C ATOM 434 CG GLU A 104 -5.967 -2.719 7.499 1.00 0.00 C ATOM 435 CD GLU A 104 -5.465 -2.448 6.081 1.00 0.00 C ATOM 436 OE1 GLU A 104 -6.289 -2.212 5.213 1.00 0.00 O ATOM 437 OE2 GLU A 104 -4.263 -2.477 5.884 1.00 0.00 O ATOM 0 H GLU A 104 -8.567 0.195 7.582 1.00 0.00 H new ATOM 0 HA GLU A 104 -6.506 -0.514 9.394 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -7.800 -2.306 8.570 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -7.787 -1.703 6.924 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -5.168 -2.532 8.217 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -6.246 -3.768 7.599 1.00 0.00 H new ATOM 444 N LEU A 105 -5.549 0.516 6.416 1.00 0.00 N ATOM 445 CA LEU A 105 -4.372 0.929 5.660 1.00 0.00 C ATOM 446 C LEU A 105 -3.588 1.982 6.440 1.00 0.00 C ATOM 447 O LEU A 105 -2.364 1.899 6.548 1.00 0.00 O ATOM 448 CB LEU A 105 -4.804 1.504 4.306 1.00 0.00 C ATOM 449 CG LEU A 105 -3.571 1.862 3.465 1.00 0.00 C ATOM 450 CD1 LEU A 105 -2.781 0.593 3.131 1.00 0.00 C ATOM 451 CD2 LEU A 105 -4.024 2.533 2.167 1.00 0.00 C ATOM 0 H LEU A 105 -6.440 0.682 5.948 1.00 0.00 H new ATOM 0 HA LEU A 105 -3.733 0.061 5.498 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -5.418 0.778 3.773 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -5.419 2.391 4.459 1.00 0.00 H new ATOM 0 HG LEU A 105 -2.934 2.542 4.031 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -1.907 0.855 2.534 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -2.459 0.112 4.054 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -3.414 -0.092 2.567 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -3.151 2.789 1.566 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -4.662 1.849 1.607 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -4.582 3.440 2.402 1.00 0.00 H new ATOM 463 N ARG A 106 -4.292 2.983 6.961 1.00 0.00 N ATOM 464 CA ARG A 106 -3.629 4.052 7.702 1.00 0.00 C ATOM 465 C ARG A 106 -2.853 3.491 8.891 1.00 0.00 C ATOM 466 O ARG A 106 -1.683 3.815 9.080 1.00 0.00 O ATOM 467 CB ARG A 106 -4.670 5.066 8.196 1.00 0.00 C ATOM 468 CG ARG A 106 -3.973 6.216 8.931 1.00 0.00 C ATOM 469 CD ARG A 106 -4.099 6.022 10.445 1.00 0.00 C ATOM 470 NE ARG A 106 -5.504 5.985 10.833 1.00 0.00 N ATOM 471 CZ ARG A 106 -6.198 7.105 11.008 1.00 0.00 C ATOM 472 NH1 ARG A 106 -5.624 8.263 10.831 1.00 0.00 N ATOM 473 NH2 ARG A 106 -7.454 7.047 11.359 1.00 0.00 N ATOM 0 H ARG A 106 -5.305 3.077 6.886 1.00 0.00 H new ATOM 0 HA ARG A 106 -2.925 4.547 7.033 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -5.240 5.455 7.352 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -5.380 4.576 8.861 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -2.921 6.256 8.647 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -4.418 7.168 8.640 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -3.608 5.096 10.742 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -3.591 6.834 10.966 1.00 0.00 H new ATOM 0 HE ARG A 106 -5.962 5.084 10.972 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -4.642 8.309 10.558 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -6.157 9.122 10.965 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -7.903 6.142 11.499 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -7.986 7.907 11.493 1.00 0.00 H new ATOM 487 N HIS A 107 -3.498 2.648 9.691 1.00 0.00 N ATOM 488 CA HIS A 107 -2.842 2.056 10.855 1.00 0.00 C ATOM 489 C HIS A 107 -1.624 1.233 10.441 1.00 0.00 C ATOM 490 O HIS A 107 -0.549 1.358 11.019 1.00 0.00 O ATOM 491 CB HIS A 107 -3.846 1.169 11.595 1.00 0.00 C ATOM 492 CG HIS A 107 -3.149 0.394 12.678 1.00 0.00 C ATOM 493 ND1 HIS A 107 -2.634 1.002 13.812 1.00 0.00 N ATOM 494 CD2 HIS A 107 -2.893 -0.948 12.819 1.00 0.00 C ATOM 495 CE1 HIS A 107 -2.096 0.035 14.580 1.00 0.00 C ATOM 496 NE2 HIS A 107 -2.226 -1.171 14.021 1.00 0.00 N ATOM 0 H HIS A 107 -4.467 2.360 9.558 1.00 0.00 H new ATOM 0 HA HIS A 107 -2.497 2.856 11.510 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -4.636 1.783 12.027 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -4.322 0.483 10.895 1.00 0.00 H new ATOM 0 HD1 HIS A 107 -2.658 1.999 14.026 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -3.167 -1.713 12.107 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -1.618 0.213 15.532 1.00 0.00 H new ATOM 505 N VAL A 108 -1.817 0.396 9.437 1.00 0.00 N ATOM 506 CA VAL A 108 -0.759 -0.469 8.922 1.00 0.00 C ATOM 507 C VAL A 108 0.425 0.347 8.394 1.00 0.00 C ATOM 508 O VAL A 108 1.579 -0.064 8.524 1.00 0.00 O ATOM 509 CB VAL A 108 -1.351 -1.357 7.813 1.00 0.00 C ATOM 510 CG1 VAL A 108 -0.259 -2.113 7.044 1.00 0.00 C ATOM 511 CG2 VAL A 108 -2.290 -2.379 8.457 1.00 0.00 C ATOM 0 H VAL A 108 -2.709 0.293 8.953 1.00 0.00 H new ATOM 0 HA VAL A 108 -0.377 -1.091 9.731 1.00 0.00 H new ATOM 0 HB VAL A 108 -1.881 -0.716 7.109 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -0.718 -2.728 6.270 1.00 0.00 H new ATOM 0 HG12 VAL A 108 0.422 -1.398 6.582 1.00 0.00 H new ATOM 0 HG13 VAL A 108 0.296 -2.750 7.732 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -2.719 -3.017 7.684 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -1.731 -2.992 9.164 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -3.090 -1.858 8.982 1.00 0.00 H new ATOM 521 N MET A 109 0.132 1.490 7.791 1.00 0.00 N ATOM 522 CA MET A 109 1.184 2.345 7.235 1.00 0.00 C ATOM 523 C MET A 109 1.841 3.206 8.303 1.00 0.00 C ATOM 524 O MET A 109 2.956 3.687 8.108 1.00 0.00 O ATOM 525 CB MET A 109 0.603 3.246 6.145 1.00 0.00 C ATOM 526 CG MET A 109 0.652 2.526 4.797 1.00 0.00 C ATOM 527 SD MET A 109 0.303 0.763 5.033 1.00 0.00 S ATOM 528 CE MET A 109 0.677 0.221 3.351 1.00 0.00 C ATOM 0 H MET A 109 -0.815 1.849 7.672 1.00 0.00 H new ATOM 0 HA MET A 109 1.947 1.690 6.813 1.00 0.00 H new ATOM 0 HB2 MET A 109 -0.426 3.510 6.389 1.00 0.00 H new ATOM 0 HB3 MET A 109 1.167 4.177 6.091 1.00 0.00 H new ATOM 0 HG2 MET A 109 -0.077 2.963 4.114 1.00 0.00 H new ATOM 0 HG3 MET A 109 1.634 2.654 4.341 1.00 0.00 H new ATOM 0 HE1 MET A 109 0.004 -0.590 3.072 1.00 0.00 H new ATOM 0 HE2 MET A 109 0.545 1.055 2.662 1.00 0.00 H new ATOM 0 HE3 MET A 109 1.708 -0.130 3.303 1.00 0.00 H new ATOM 538 N THR A 110 1.155 3.409 9.420 1.00 0.00 N ATOM 539 CA THR A 110 1.710 4.236 10.483 1.00 0.00 C ATOM 540 C THR A 110 2.226 3.373 11.635 1.00 0.00 C ATOM 541 O THR A 110 3.058 3.824 12.422 1.00 0.00 O ATOM 542 CB THR A 110 0.640 5.209 10.994 1.00 0.00 C ATOM 543 OG1 THR A 110 -0.412 4.478 11.611 1.00 0.00 O ATOM 544 CG2 THR A 110 0.075 6.027 9.830 1.00 0.00 C ATOM 0 H THR A 110 0.231 3.021 9.612 1.00 0.00 H new ATOM 0 HA THR A 110 2.550 4.800 10.078 1.00 0.00 H new ATOM 0 HB THR A 110 1.093 5.885 11.720 1.00 0.00 H new ATOM 0 HG1 THR A 110 -1.042 4.170 10.926 1.00 0.00 H new ATOM 0 HG21 THR A 110 -0.684 6.715 10.203 1.00 0.00 H new ATOM 0 HG22 THR A 110 0.879 6.594 9.360 1.00 0.00 H new ATOM 0 HG23 THR A 110 -0.373 5.356 9.097 1.00 0.00 H new ATOM 552 N ASN A 111 1.716 2.142 11.744 1.00 0.00 N ATOM 553 CA ASN A 111 2.129 1.247 12.827 1.00 0.00 C ATOM 554 C ASN A 111 2.997 0.087 12.330 1.00 0.00 C ATOM 555 O ASN A 111 4.029 -0.220 12.926 1.00 0.00 O ATOM 556 CB ASN A 111 0.896 0.672 13.526 1.00 0.00 C ATOM 557 CG ASN A 111 1.326 -0.297 14.623 1.00 0.00 C ATOM 558 OD1 ASN A 111 1.336 -1.510 14.412 1.00 0.00 O ATOM 559 ND2 ASN A 111 1.688 0.168 15.787 1.00 0.00 N ATOM 0 H ASN A 111 1.026 1.748 11.105 1.00 0.00 H new ATOM 0 HA ASN A 111 2.724 1.843 13.519 1.00 0.00 H new ATOM 0 HB2 ASN A 111 0.301 1.478 13.954 1.00 0.00 H new ATOM 0 HB3 ASN A 111 0.263 0.158 12.802 1.00 0.00 H new ATOM 0 HD21 ASN A 111 1.980 -0.474 16.524 1.00 0.00 H new ATOM 0 HD22 ASN A 111 1.679 1.173 15.960 1.00 0.00 H new ATOM 566 N LEU A 112 2.558 -0.580 11.263 1.00 0.00 N ATOM 567 CA LEU A 112 3.297 -1.731 10.737 1.00 0.00 C ATOM 568 C LEU A 112 4.248 -1.345 9.607 1.00 0.00 C ATOM 569 O LEU A 112 3.932 -0.501 8.772 1.00 0.00 O ATOM 570 CB LEU A 112 2.316 -2.780 10.214 1.00 0.00 C ATOM 571 CG LEU A 112 1.384 -3.245 11.336 1.00 0.00 C ATOM 572 CD1 LEU A 112 0.371 -4.242 10.768 1.00 0.00 C ATOM 573 CD2 LEU A 112 2.198 -3.925 12.443 1.00 0.00 C ATOM 0 H LEU A 112 1.707 -0.349 10.751 1.00 0.00 H new ATOM 0 HA LEU A 112 3.891 -2.131 11.559 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.730 -2.363 9.395 1.00 0.00 H new ATOM 0 HB3 LEU A 112 2.865 -3.632 9.812 1.00 0.00 H new ATOM 0 HG LEU A 112 0.863 -2.383 11.752 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -0.295 -4.576 11.563 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -0.213 -3.760 9.984 1.00 0.00 H new ATOM 0 HD13 LEU A 112 0.899 -5.100 10.352 1.00 0.00 H new ATOM 0 HD21 LEU A 112 1.528 -4.253 13.238 1.00 0.00 H new ATOM 0 HD22 LEU A 112 2.723 -4.787 12.031 1.00 0.00 H new ATOM 0 HD23 LEU A 112 2.923 -3.219 12.848 1.00 0.00 H new ATOM 585 N GLY A 113 5.405 -2.011 9.590 1.00 0.00 N ATOM 586 CA GLY A 113 6.422 -1.786 8.563 1.00 0.00 C ATOM 587 C GLY A 113 6.808 -0.315 8.465 1.00 0.00 C ATOM 588 O GLY A 113 5.942 0.531 8.258 1.00 0.00 O ATOM 0 H GLY A 113 5.661 -2.715 10.282 1.00 0.00 H new ATOM 0 HA2 GLY A 113 7.307 -2.380 8.791 1.00 0.00 H new ATOM 0 HA3 GLY A 113 6.047 -2.129 7.599 1.00 0.00 H new ATOM 592 N GLU A 114 8.115 -0.034 8.603 1.00 0.00 N ATOM 593 CA GLU A 114 8.645 1.337 8.516 1.00 0.00 C ATOM 594 C GLU A 114 7.526 2.365 8.609 1.00 0.00 C ATOM 595 O GLU A 114 6.976 2.786 7.595 1.00 0.00 O ATOM 596 CB GLU A 114 9.396 1.519 7.196 1.00 0.00 C ATOM 597 CG GLU A 114 10.556 0.519 7.118 1.00 0.00 C ATOM 598 CD GLU A 114 10.079 -0.797 6.510 1.00 0.00 C ATOM 599 OE1 GLU A 114 8.878 -0.977 6.393 1.00 0.00 O ATOM 600 OE2 GLU A 114 10.924 -1.611 6.173 1.00 0.00 O ATOM 0 H GLU A 114 8.827 -0.743 8.776 1.00 0.00 H new ATOM 0 HA GLU A 114 9.326 1.491 9.353 1.00 0.00 H new ATOM 0 HB2 GLU A 114 8.717 1.369 6.357 1.00 0.00 H new ATOM 0 HB3 GLU A 114 9.776 2.538 7.120 1.00 0.00 H new ATOM 0 HG2 GLU A 114 11.364 0.934 6.515 1.00 0.00 H new ATOM 0 HG3 GLU A 114 10.960 0.342 8.115 1.00 0.00 H new ATOM 607 N LYS A 115 7.163 2.731 9.826 1.00 0.00 N ATOM 608 CA LYS A 115 6.070 3.669 10.038 1.00 0.00 C ATOM 609 C LYS A 115 6.196 4.895 9.133 1.00 0.00 C ATOM 610 O LYS A 115 7.252 5.521 9.052 1.00 0.00 O ATOM 611 CB LYS A 115 6.077 4.127 11.496 1.00 0.00 C ATOM 612 CG LYS A 115 5.881 2.919 12.416 1.00 0.00 C ATOM 613 CD LYS A 115 5.885 3.382 13.875 1.00 0.00 C ATOM 614 CE LYS A 115 5.718 2.175 14.797 1.00 0.00 C ATOM 615 NZ LYS A 115 5.725 2.629 16.217 1.00 0.00 N ATOM 0 H LYS A 115 7.606 2.395 10.681 1.00 0.00 H new ATOM 0 HA LYS A 115 5.137 3.160 9.797 1.00 0.00 H new ATOM 0 HB2 LYS A 115 7.020 4.623 11.727 1.00 0.00 H new ATOM 0 HB3 LYS A 115 5.284 4.856 11.662 1.00 0.00 H new ATOM 0 HG2 LYS A 115 4.940 2.421 12.184 1.00 0.00 H new ATOM 0 HG3 LYS A 115 6.676 2.191 12.252 1.00 0.00 H new ATOM 0 HD2 LYS A 115 6.818 3.898 14.101 1.00 0.00 H new ATOM 0 HD3 LYS A 115 5.078 4.095 14.043 1.00 0.00 H new ATOM 0 HE2 LYS A 115 4.784 1.660 14.573 1.00 0.00 H new ATOM 0 HE3 LYS A 115 6.524 1.461 14.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 5.611 1.808 16.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 6.627 3.102 16.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 4.941 3.295 16.373 1.00 0.00 H new ATOM 629 N LEU A 116 5.085 5.249 8.486 1.00 0.00 N ATOM 630 CA LEU A 116 5.048 6.426 7.622 1.00 0.00 C ATOM 631 C LEU A 116 4.614 7.622 8.463 1.00 0.00 C ATOM 632 O LEU A 116 3.997 7.447 9.514 1.00 0.00 O ATOM 633 CB LEU A 116 4.045 6.234 6.472 1.00 0.00 C ATOM 634 CG LEU A 116 4.712 5.561 5.261 1.00 0.00 C ATOM 635 CD1 LEU A 116 5.730 6.510 4.617 1.00 0.00 C ATOM 636 CD2 LEU A 116 5.428 4.288 5.709 1.00 0.00 C ATOM 0 H LEU A 116 4.203 4.739 8.544 1.00 0.00 H new ATOM 0 HA LEU A 116 6.037 6.585 7.193 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.207 5.626 6.814 1.00 0.00 H new ATOM 0 HB3 LEU A 116 3.637 7.201 6.176 1.00 0.00 H new ATOM 0 HG LEU A 116 3.941 5.315 4.531 1.00 0.00 H new ATOM 0 HD11 LEU A 116 6.194 6.020 3.761 1.00 0.00 H new ATOM 0 HD12 LEU A 116 5.223 7.416 4.285 1.00 0.00 H new ATOM 0 HD13 LEU A 116 6.497 6.770 5.346 1.00 0.00 H new ATOM 0 HD21 LEU A 116 5.900 3.814 4.848 1.00 0.00 H new ATOM 0 HD22 LEU A 116 6.190 4.539 6.447 1.00 0.00 H new ATOM 0 HD23 LEU A 116 4.706 3.601 6.152 1.00 0.00 H new ATOM 648 N THR A 117 4.916 8.833 8.011 1.00 0.00 N ATOM 649 CA THR A 117 4.521 10.021 8.757 1.00 0.00 C ATOM 650 C THR A 117 3.179 10.538 8.248 1.00 0.00 C ATOM 651 O THR A 117 2.655 10.048 7.248 1.00 0.00 O ATOM 652 CB THR A 117 5.588 11.109 8.625 1.00 0.00 C ATOM 653 OG1 THR A 117 5.690 11.507 7.269 1.00 0.00 O ATOM 654 CG2 THR A 117 6.934 10.567 9.105 1.00 0.00 C ATOM 0 H THR A 117 5.425 9.017 7.146 1.00 0.00 H new ATOM 0 HA THR A 117 4.421 9.756 9.809 1.00 0.00 H new ATOM 0 HB THR A 117 5.309 11.968 9.234 1.00 0.00 H new ATOM 0 HG1 THR A 117 5.978 12.443 7.223 1.00 0.00 H new ATOM 0 HG21 THR A 117 7.693 11.343 9.010 1.00 0.00 H new ATOM 0 HG22 THR A 117 6.853 10.264 10.149 1.00 0.00 H new ATOM 0 HG23 THR A 117 7.217 9.707 8.498 1.00 0.00 H new ATOM 662 N ASP A 118 2.622 11.520 8.947 1.00 0.00 N ATOM 663 CA ASP A 118 1.333 12.080 8.559 1.00 0.00 C ATOM 664 C ASP A 118 1.387 12.650 7.144 1.00 0.00 C ATOM 665 O ASP A 118 0.454 12.472 6.361 1.00 0.00 O ATOM 666 CB ASP A 118 0.931 13.186 9.536 1.00 0.00 C ATOM 667 CG ASP A 118 -0.449 13.725 9.175 1.00 0.00 C ATOM 668 OD1 ASP A 118 -1.407 12.982 9.312 1.00 0.00 O ATOM 669 OD2 ASP A 118 -0.527 14.872 8.765 1.00 0.00 O ATOM 0 H ASP A 118 3.038 11.942 9.778 1.00 0.00 H new ATOM 0 HA ASP A 118 0.594 11.279 8.584 1.00 0.00 H new ATOM 0 HB2 ASP A 118 0.924 12.798 10.555 1.00 0.00 H new ATOM 0 HB3 ASP A 118 1.664 13.992 9.507 1.00 0.00 H new ATOM 674 N GLU A 119 2.476 13.337 6.818 1.00 0.00 N ATOM 675 CA GLU A 119 2.623 13.925 5.490 1.00 0.00 C ATOM 676 C GLU A 119 2.644 12.840 4.412 1.00 0.00 C ATOM 677 O GLU A 119 2.012 12.987 3.366 1.00 0.00 O ATOM 678 CB GLU A 119 3.908 14.759 5.426 1.00 0.00 C ATOM 679 CG GLU A 119 4.046 15.401 4.041 1.00 0.00 C ATOM 680 CD GLU A 119 5.285 16.288 3.999 1.00 0.00 C ATOM 681 OE1 GLU A 119 6.361 15.781 4.274 1.00 0.00 O ATOM 682 OE2 GLU A 119 5.142 17.459 3.692 1.00 0.00 O ATOM 0 H GLU A 119 3.263 13.500 7.447 1.00 0.00 H new ATOM 0 HA GLU A 119 1.766 14.573 5.304 1.00 0.00 H new ATOM 0 HB2 GLU A 119 3.889 15.532 6.194 1.00 0.00 H new ATOM 0 HB3 GLU A 119 4.772 14.127 5.631 1.00 0.00 H new ATOM 0 HG2 GLU A 119 4.117 14.626 3.277 1.00 0.00 H new ATOM 0 HG3 GLU A 119 3.158 15.991 3.815 1.00 0.00 H new ATOM 689 N GLU A 120 3.358 11.747 4.674 1.00 0.00 N ATOM 690 CA GLU A 120 3.422 10.651 3.714 1.00 0.00 C ATOM 691 C GLU A 120 2.067 9.965 3.586 1.00 0.00 C ATOM 692 O GLU A 120 1.593 9.715 2.484 1.00 0.00 O ATOM 693 CB GLU A 120 4.466 9.627 4.166 1.00 0.00 C ATOM 694 CG GLU A 120 5.863 10.105 3.768 1.00 0.00 C ATOM 695 CD GLU A 120 5.969 11.618 3.917 1.00 0.00 C ATOM 696 OE1 GLU A 120 5.745 12.101 5.011 1.00 0.00 O ATOM 697 OE2 GLU A 120 6.274 12.271 2.933 1.00 0.00 O ATOM 0 H GLU A 120 3.892 11.599 5.530 1.00 0.00 H new ATOM 0 HA GLU A 120 3.702 11.061 2.744 1.00 0.00 H new ATOM 0 HB2 GLU A 120 4.412 9.491 5.246 1.00 0.00 H new ATOM 0 HB3 GLU A 120 4.260 8.658 3.712 1.00 0.00 H new ATOM 0 HG2 GLU A 120 6.612 9.618 4.392 1.00 0.00 H new ATOM 0 HG3 GLU A 120 6.072 9.819 2.737 1.00 0.00 H new ATOM 704 N VAL A 121 1.452 9.670 4.728 1.00 0.00 N ATOM 705 CA VAL A 121 0.149 9.005 4.749 1.00 0.00 C ATOM 706 C VAL A 121 -0.925 9.879 4.104 1.00 0.00 C ATOM 707 O VAL A 121 -1.758 9.386 3.351 1.00 0.00 O ATOM 708 CB VAL A 121 -0.255 8.691 6.198 1.00 0.00 C ATOM 709 CG1 VAL A 121 -1.698 8.190 6.233 1.00 0.00 C ATOM 710 CG2 VAL A 121 0.659 7.608 6.777 1.00 0.00 C ATOM 0 H VAL A 121 1.833 9.880 5.651 1.00 0.00 H new ATOM 0 HA VAL A 121 0.234 8.080 4.179 1.00 0.00 H new ATOM 0 HB VAL A 121 -0.163 9.601 6.791 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -1.981 7.968 7.262 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -2.360 8.958 5.832 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -1.784 7.286 5.630 1.00 0.00 H new ATOM 0 HG21 VAL A 121 0.364 7.394 7.804 1.00 0.00 H new ATOM 0 HG22 VAL A 121 0.574 6.701 6.178 1.00 0.00 H new ATOM 0 HG23 VAL A 121 1.692 7.957 6.762 1.00 0.00 H new ATOM 720 N ASP A 122 -0.919 11.173 4.398 1.00 0.00 N ATOM 721 CA ASP A 122 -1.933 12.055 3.830 1.00 0.00 C ATOM 722 C ASP A 122 -1.906 11.948 2.313 1.00 0.00 C ATOM 723 O ASP A 122 -2.952 11.917 1.664 1.00 0.00 O ATOM 724 CB ASP A 122 -1.675 13.502 4.252 1.00 0.00 C ATOM 725 CG ASP A 122 -1.998 13.677 5.731 1.00 0.00 C ATOM 726 OD1 ASP A 122 -2.621 12.790 6.289 1.00 0.00 O ATOM 727 OD2 ASP A 122 -1.618 14.696 6.284 1.00 0.00 O ATOM 0 H ASP A 122 -0.242 11.628 5.011 1.00 0.00 H new ATOM 0 HA ASP A 122 -2.913 11.753 4.199 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -0.634 13.764 4.065 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -2.286 14.179 3.655 1.00 0.00 H new ATOM 732 N GLU A 123 -0.708 11.855 1.760 1.00 0.00 N ATOM 733 CA GLU A 123 -0.556 11.708 0.323 1.00 0.00 C ATOM 734 C GLU A 123 -1.190 10.390 -0.118 1.00 0.00 C ATOM 735 O GLU A 123 -1.813 10.309 -1.178 1.00 0.00 O ATOM 736 CB GLU A 123 0.931 11.724 -0.049 1.00 0.00 C ATOM 737 CG GLU A 123 1.098 11.628 -1.570 1.00 0.00 C ATOM 738 CD GLU A 123 0.485 12.852 -2.243 1.00 0.00 C ATOM 739 OE1 GLU A 123 0.316 13.853 -1.568 1.00 0.00 O ATOM 740 OE2 GLU A 123 0.197 12.770 -3.426 1.00 0.00 O ATOM 0 H GLU A 123 0.168 11.879 2.281 1.00 0.00 H new ATOM 0 HA GLU A 123 -1.053 12.536 -0.182 1.00 0.00 H new ATOM 0 HB2 GLU A 123 1.395 12.639 0.318 1.00 0.00 H new ATOM 0 HB3 GLU A 123 1.443 10.891 0.434 1.00 0.00 H new ATOM 0 HG2 GLU A 123 2.156 11.555 -1.824 1.00 0.00 H new ATOM 0 HG3 GLU A 123 0.619 10.722 -1.940 1.00 0.00 H new ATOM 747 N MET A 124 -1.025 9.362 0.713 1.00 0.00 N ATOM 748 CA MET A 124 -1.580 8.042 0.422 1.00 0.00 C ATOM 749 C MET A 124 -3.104 8.058 0.537 1.00 0.00 C ATOM 750 O MET A 124 -3.803 7.431 -0.258 1.00 0.00 O ATOM 751 CB MET A 124 -1.007 7.025 1.413 1.00 0.00 C ATOM 752 CG MET A 124 0.499 6.926 1.197 1.00 0.00 C ATOM 753 SD MET A 124 1.244 5.864 2.458 1.00 0.00 S ATOM 754 CE MET A 124 0.577 4.299 1.857 1.00 0.00 C ATOM 0 H MET A 124 -0.512 9.418 1.593 1.00 0.00 H new ATOM 0 HA MET A 124 -1.311 7.766 -0.598 1.00 0.00 H new ATOM 0 HB2 MET A 124 -1.222 7.332 2.436 1.00 0.00 H new ATOM 0 HB3 MET A 124 -1.474 6.051 1.267 1.00 0.00 H new ATOM 0 HG2 MET A 124 0.706 6.524 0.205 1.00 0.00 H new ATOM 0 HG3 MET A 124 0.945 7.920 1.238 1.00 0.00 H new ATOM 0 HE1 MET A 124 1.213 3.480 2.193 1.00 0.00 H new ATOM 0 HE2 MET A 124 -0.431 4.159 2.247 1.00 0.00 H new ATOM 0 HE3 MET A 124 0.546 4.311 0.768 1.00 0.00 H new ATOM 764 N ILE A 125 -3.609 8.776 1.543 1.00 0.00 N ATOM 765 CA ILE A 125 -5.050 8.867 1.770 1.00 0.00 C ATOM 766 C ILE A 125 -5.752 9.459 0.548 1.00 0.00 C ATOM 767 O ILE A 125 -6.847 9.032 0.183 1.00 0.00 O ATOM 768 CB ILE A 125 -5.320 9.712 3.029 1.00 0.00 C ATOM 769 CG1 ILE A 125 -5.681 8.795 4.210 1.00 0.00 C ATOM 770 CG2 ILE A 125 -6.455 10.718 2.800 1.00 0.00 C ATOM 771 CD1 ILE A 125 -4.507 7.869 4.543 1.00 0.00 C ATOM 0 H ILE A 125 -3.043 9.300 2.210 1.00 0.00 H new ATOM 0 HA ILE A 125 -5.452 7.866 1.927 1.00 0.00 H new ATOM 0 HB ILE A 125 -4.410 10.268 3.255 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -5.936 9.397 5.082 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -6.562 8.202 3.963 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -6.617 11.296 3.709 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -6.186 11.390 1.985 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -7.369 10.183 2.542 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -4.777 7.226 5.381 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -4.271 7.254 3.675 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -3.636 8.467 4.811 1.00 0.00 H new ATOM 783 N ARG A 126 -5.115 10.441 -0.078 1.00 0.00 N ATOM 784 CA ARG A 126 -5.687 11.083 -1.259 1.00 0.00 C ATOM 785 C ARG A 126 -5.726 10.115 -2.439 1.00 0.00 C ATOM 786 O ARG A 126 -6.564 10.243 -3.332 1.00 0.00 O ATOM 787 CB ARG A 126 -4.863 12.315 -1.635 1.00 0.00 C ATOM 788 CG ARG A 126 -5.050 13.400 -0.571 1.00 0.00 C ATOM 789 CD ARG A 126 -4.131 14.582 -0.881 1.00 0.00 C ATOM 790 NE ARG A 126 -4.500 15.187 -2.154 1.00 0.00 N ATOM 791 CZ ARG A 126 -3.750 16.133 -2.709 1.00 0.00 C ATOM 792 NH1 ARG A 126 -2.661 16.534 -2.113 1.00 0.00 N ATOM 793 NH2 ARG A 126 -4.101 16.659 -3.851 1.00 0.00 N ATOM 0 H ARG A 126 -4.208 10.810 0.208 1.00 0.00 H new ATOM 0 HA ARG A 126 -6.707 11.385 -1.022 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -3.809 12.049 -1.717 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -5.174 12.690 -2.610 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -6.089 13.729 -0.551 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -4.823 12.999 0.417 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -4.199 15.323 -0.085 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -3.095 14.246 -0.917 1.00 0.00 H new ATOM 0 HE ARG A 126 -5.349 14.879 -2.628 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -2.386 16.121 -1.222 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -2.085 17.260 -2.538 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -4.951 16.344 -4.318 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -3.525 17.385 -4.277 1.00 0.00 H new ATOM 807 N GLU A 127 -4.817 9.145 -2.432 1.00 0.00 N ATOM 808 CA GLU A 127 -4.760 8.154 -3.505 1.00 0.00 C ATOM 809 C GLU A 127 -5.515 6.884 -3.114 1.00 0.00 C ATOM 810 O GLU A 127 -5.746 6.008 -3.948 1.00 0.00 O ATOM 811 CB GLU A 127 -3.303 7.808 -3.817 1.00 0.00 C ATOM 812 CG GLU A 127 -2.558 9.072 -4.251 1.00 0.00 C ATOM 813 CD GLU A 127 -3.116 9.575 -5.579 1.00 0.00 C ATOM 814 OE1 GLU A 127 -3.737 8.788 -6.274 1.00 0.00 O ATOM 815 OE2 GLU A 127 -2.913 10.740 -5.880 1.00 0.00 O ATOM 0 H GLU A 127 -4.115 9.023 -1.703 1.00 0.00 H new ATOM 0 HA GLU A 127 -5.232 8.581 -4.390 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -2.825 7.375 -2.938 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -3.258 7.058 -4.606 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -2.660 9.844 -3.488 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -1.493 8.861 -4.351 1.00 0.00 H new ATOM 822 N ALA A 128 -5.878 6.785 -1.840 1.00 0.00 N ATOM 823 CA ALA A 128 -6.586 5.607 -1.343 1.00 0.00 C ATOM 824 C ALA A 128 -8.066 5.634 -1.728 1.00 0.00 C ATOM 825 O ALA A 128 -8.503 4.809 -2.523 1.00 0.00 O ATOM 826 CB ALA A 128 -6.444 5.536 0.177 1.00 0.00 C ATOM 0 H ALA A 128 -5.696 7.500 -1.135 1.00 0.00 H new ATOM 0 HA ALA A 128 -6.142 4.723 -1.801 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -6.971 4.658 0.551 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -5.389 5.465 0.441 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -6.871 6.434 0.625 1.00 0.00 H new ATOM 832 N ASP A 129 -8.821 6.589 -1.164 1.00 0.00 N ATOM 833 CA ASP A 129 -10.262 6.730 -1.452 1.00 0.00 C ATOM 834 C ASP A 129 -10.980 7.442 -0.299 1.00 0.00 C ATOM 835 O ASP A 129 -10.959 8.668 -0.203 1.00 0.00 O ATOM 836 CB ASP A 129 -10.924 5.356 -1.691 1.00 0.00 C ATOM 837 CG ASP A 129 -10.928 4.988 -3.180 1.00 0.00 C ATOM 838 OD1 ASP A 129 -10.377 5.737 -3.970 1.00 0.00 O ATOM 839 OD2 ASP A 129 -11.478 3.949 -3.506 1.00 0.00 O ATOM 0 H ASP A 129 -8.459 7.278 -0.504 1.00 0.00 H new ATOM 0 HA ASP A 129 -10.353 7.327 -2.359 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -10.391 4.591 -1.127 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -11.947 5.373 -1.316 1.00 0.00 H new ATOM 844 N ILE A 130 -11.627 6.657 0.561 1.00 0.00 N ATOM 845 CA ILE A 130 -12.371 7.185 1.699 1.00 0.00 C ATOM 846 C ILE A 130 -13.507 8.097 1.241 1.00 0.00 C ATOM 847 O ILE A 130 -14.426 7.662 0.549 1.00 0.00 O ATOM 848 CB ILE A 130 -11.445 7.955 2.638 1.00 0.00 C ATOM 849 CG1 ILE A 130 -10.280 7.055 3.054 1.00 0.00 C ATOM 850 CG2 ILE A 130 -12.234 8.366 3.886 1.00 0.00 C ATOM 851 CD1 ILE A 130 -9.217 7.892 3.766 1.00 0.00 C ATOM 0 H ILE A 130 -11.649 5.640 0.487 1.00 0.00 H new ATOM 0 HA ILE A 130 -12.799 6.336 2.233 1.00 0.00 H new ATOM 0 HB ILE A 130 -11.059 8.840 2.132 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -10.636 6.263 3.713 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -9.850 6.571 2.177 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -11.582 8.917 4.564 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -13.072 8.999 3.594 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -12.610 7.475 4.389 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -8.387 7.251 4.062 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -8.853 8.668 3.092 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -9.652 8.355 4.652 1.00 0.00 H new ATOM 863 N ASP A 131 -13.442 9.362 1.653 1.00 0.00 N ATOM 864 CA ASP A 131 -14.477 10.333 1.304 1.00 0.00 C ATOM 865 C ASP A 131 -15.724 10.101 2.153 1.00 0.00 C ATOM 866 O ASP A 131 -16.506 11.020 2.397 1.00 0.00 O ATOM 867 CB ASP A 131 -14.835 10.214 -0.182 1.00 0.00 C ATOM 868 CG ASP A 131 -15.298 11.562 -0.729 1.00 0.00 C ATOM 869 OD1 ASP A 131 -15.553 12.452 0.067 1.00 0.00 O ATOM 870 OD2 ASP A 131 -15.392 11.685 -1.939 1.00 0.00 O ATOM 0 H ASP A 131 -12.687 9.737 2.227 1.00 0.00 H new ATOM 0 HA ASP A 131 -14.094 11.334 1.499 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -13.969 9.865 -0.744 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -15.622 9.471 -0.314 1.00 0.00 H new ATOM 875 N GLY A 132 -15.898 8.862 2.600 1.00 0.00 N ATOM 876 CA GLY A 132 -17.045 8.499 3.425 1.00 0.00 C ATOM 877 C GLY A 132 -17.032 7.005 3.726 1.00 0.00 C ATOM 878 O GLY A 132 -16.891 6.594 4.877 1.00 0.00 O ATOM 0 H GLY A 132 -15.259 8.091 2.405 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -17.024 9.064 4.357 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -17.969 8.765 2.911 1.00 0.00 H new ATOM 882 N ASP A 133 -17.219 6.200 2.686 1.00 0.00 N ATOM 883 CA ASP A 133 -17.268 4.753 2.852 1.00 0.00 C ATOM 884 C ASP A 133 -16.116 4.268 3.721 1.00 0.00 C ATOM 885 O ASP A 133 -16.284 3.354 4.528 1.00 0.00 O ATOM 886 CB ASP A 133 -17.196 4.068 1.485 1.00 0.00 C ATOM 887 CG ASP A 133 -18.503 4.266 0.728 1.00 0.00 C ATOM 888 OD1 ASP A 133 -19.467 4.688 1.346 1.00 0.00 O ATOM 889 OD2 ASP A 133 -18.522 3.991 -0.461 1.00 0.00 O ATOM 0 H ASP A 133 -17.338 6.522 1.726 1.00 0.00 H new ATOM 0 HA ASP A 133 -18.208 4.498 3.342 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -16.367 4.478 0.908 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -16.999 3.004 1.613 1.00 0.00 H new ATOM 894 N GLY A 134 -14.956 4.886 3.573 1.00 0.00 N ATOM 895 CA GLY A 134 -13.808 4.501 4.377 1.00 0.00 C ATOM 896 C GLY A 134 -13.214 3.178 3.912 1.00 0.00 C ATOM 897 O GLY A 134 -12.600 2.460 4.701 1.00 0.00 O ATOM 0 H GLY A 134 -14.785 5.645 2.914 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -13.048 5.280 4.323 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -14.107 4.419 5.422 1.00 0.00 H new ATOM 901 N GLN A 135 -13.368 2.876 2.623 1.00 0.00 N ATOM 902 CA GLN A 135 -12.804 1.651 2.066 1.00 0.00 C ATOM 903 C GLN A 135 -11.838 2.017 0.951 1.00 0.00 C ATOM 904 O GLN A 135 -12.004 3.047 0.295 1.00 0.00 O ATOM 905 CB GLN A 135 -13.893 0.735 1.507 1.00 0.00 C ATOM 906 CG GLN A 135 -15.007 0.555 2.539 1.00 0.00 C ATOM 907 CD GLN A 135 -14.441 -0.012 3.834 1.00 0.00 C ATOM 908 OE1 GLN A 135 -13.824 -1.077 3.828 1.00 0.00 O ATOM 909 NE2 GLN A 135 -14.617 0.638 4.951 1.00 0.00 N ATOM 0 H GLN A 135 -13.873 3.456 1.953 1.00 0.00 H new ATOM 0 HA GLN A 135 -12.289 1.116 2.864 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -14.301 1.160 0.590 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -13.467 -0.234 1.248 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -15.490 1.513 2.734 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -15.772 -0.114 2.145 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -15.129 1.520 4.952 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -14.243 0.264 5.823 1.00 0.00 H new ATOM 918 N VAL A 136 -10.822 1.191 0.752 1.00 0.00 N ATOM 919 CA VAL A 136 -9.820 1.452 -0.273 1.00 0.00 C ATOM 920 C VAL A 136 -9.616 0.260 -1.193 1.00 0.00 C ATOM 921 O VAL A 136 -9.481 -0.877 -0.741 1.00 0.00 O ATOM 922 CB VAL A 136 -8.501 1.816 0.399 1.00 0.00 C ATOM 923 CG1 VAL A 136 -7.372 1.787 -0.633 1.00 0.00 C ATOM 924 CG2 VAL A 136 -8.627 3.218 0.988 1.00 0.00 C ATOM 0 H VAL A 136 -10.669 0.335 1.285 1.00 0.00 H new ATOM 0 HA VAL A 136 -10.176 2.279 -0.888 1.00 0.00 H new ATOM 0 HB VAL A 136 -8.274 1.100 1.189 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -6.430 2.048 -0.150 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -7.296 0.787 -1.061 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -7.584 2.505 -1.425 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -7.691 3.494 1.473 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -8.847 3.929 0.191 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -9.434 3.234 1.721 1.00 0.00 H new ATOM 934 N ASN A 137 -9.565 0.539 -2.491 1.00 0.00 N ATOM 935 CA ASN A 137 -9.345 -0.505 -3.477 1.00 0.00 C ATOM 936 C ASN A 137 -7.851 -0.600 -3.789 1.00 0.00 C ATOM 937 O ASN A 137 -7.273 0.318 -4.371 1.00 0.00 O ATOM 938 CB ASN A 137 -10.116 -0.183 -4.758 1.00 0.00 C ATOM 939 CG ASN A 137 -9.555 1.081 -5.405 1.00 0.00 C ATOM 940 OD1 ASN A 137 -8.961 1.918 -4.724 1.00 0.00 O ATOM 941 ND2 ASN A 137 -9.709 1.271 -6.687 1.00 0.00 N ATOM 0 H ASN A 137 -9.673 1.476 -2.880 1.00 0.00 H new ATOM 0 HA ASN A 137 -9.698 -1.456 -3.079 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -10.045 -1.019 -5.454 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -11.173 -0.046 -4.531 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -9.337 2.113 -7.126 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -10.201 0.577 -7.250 1.00 0.00 H new ATOM 948 N TYR A 138 -7.218 -1.692 -3.380 1.00 0.00 N ATOM 949 CA TYR A 138 -5.784 -1.848 -3.611 1.00 0.00 C ATOM 950 C TYR A 138 -5.441 -1.850 -5.096 1.00 0.00 C ATOM 951 O TYR A 138 -4.267 -1.784 -5.461 1.00 0.00 O ATOM 952 CB TYR A 138 -5.261 -3.136 -2.974 1.00 0.00 C ATOM 953 CG TYR A 138 -5.981 -4.339 -3.542 1.00 0.00 C ATOM 954 CD1 TYR A 138 -5.557 -4.907 -4.750 1.00 0.00 C ATOM 955 CD2 TYR A 138 -7.064 -4.893 -2.853 1.00 0.00 C ATOM 956 CE1 TYR A 138 -6.221 -6.028 -5.266 1.00 0.00 C ATOM 957 CE2 TYR A 138 -7.727 -6.011 -3.364 1.00 0.00 C ATOM 958 CZ TYR A 138 -7.306 -6.581 -4.573 1.00 0.00 C ATOM 959 OH TYR A 138 -7.959 -7.687 -5.081 1.00 0.00 O ATOM 0 H TYR A 138 -7.663 -2.471 -2.895 1.00 0.00 H new ATOM 0 HA TYR A 138 -5.301 -0.989 -3.145 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -4.190 -3.228 -3.153 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -5.401 -3.097 -1.894 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -4.720 -4.482 -5.283 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -7.389 -4.454 -1.921 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -5.896 -6.466 -6.198 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -8.563 -6.436 -2.828 1.00 0.00 H new ATOM 0 HH TYR A 138 -8.321 -8.221 -4.343 1.00 0.00 H new ATOM 969 N GLU A 139 -6.449 -1.941 -5.954 1.00 0.00 N ATOM 970 CA GLU A 139 -6.181 -1.964 -7.386 1.00 0.00 C ATOM 971 C GLU A 139 -5.439 -0.696 -7.802 1.00 0.00 C ATOM 972 O GLU A 139 -4.416 -0.765 -8.483 1.00 0.00 O ATOM 973 CB GLU A 139 -7.497 -2.080 -8.164 1.00 0.00 C ATOM 974 CG GLU A 139 -7.208 -2.145 -9.667 1.00 0.00 C ATOM 975 CD GLU A 139 -8.508 -2.334 -10.439 1.00 0.00 C ATOM 976 OE1 GLU A 139 -9.547 -2.404 -9.804 1.00 0.00 O ATOM 977 OE2 GLU A 139 -8.446 -2.408 -11.656 1.00 0.00 O ATOM 0 H GLU A 139 -7.434 -1.999 -5.694 1.00 0.00 H new ATOM 0 HA GLU A 139 -5.557 -2.828 -7.614 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -8.038 -2.972 -7.850 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -8.137 -1.225 -7.944 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -6.713 -1.229 -9.991 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -6.526 -2.968 -9.879 1.00 0.00 H new ATOM 984 N GLU A 140 -5.957 0.463 -7.402 1.00 0.00 N ATOM 985 CA GLU A 140 -5.329 1.732 -7.760 1.00 0.00 C ATOM 986 C GLU A 140 -3.906 1.806 -7.212 1.00 0.00 C ATOM 987 O GLU A 140 -2.990 2.232 -7.911 1.00 0.00 O ATOM 988 CB GLU A 140 -6.162 2.898 -7.209 1.00 0.00 C ATOM 989 CG GLU A 140 -5.530 4.241 -7.600 1.00 0.00 C ATOM 990 CD GLU A 140 -5.509 4.392 -9.118 1.00 0.00 C ATOM 991 OE1 GLU A 140 -6.289 3.718 -9.770 1.00 0.00 O ATOM 992 OE2 GLU A 140 -4.713 5.177 -9.604 1.00 0.00 O ATOM 0 H GLU A 140 -6.801 0.550 -6.836 1.00 0.00 H new ATOM 0 HA GLU A 140 -5.283 1.801 -8.847 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -7.179 2.841 -7.597 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -6.230 2.823 -6.124 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -6.094 5.060 -7.154 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -4.515 4.302 -7.207 1.00 0.00 H new ATOM 999 N PHE A 141 -3.723 1.379 -5.970 1.00 0.00 N ATOM 1000 CA PHE A 141 -2.391 1.404 -5.372 1.00 0.00 C ATOM 1001 C PHE A 141 -1.437 0.530 -6.176 1.00 0.00 C ATOM 1002 O PHE A 141 -0.304 0.915 -6.438 1.00 0.00 O ATOM 1003 CB PHE A 141 -2.436 0.912 -3.925 1.00 0.00 C ATOM 1004 CG PHE A 141 -2.506 2.090 -2.981 1.00 0.00 C ATOM 1005 CD1 PHE A 141 -1.427 2.979 -2.906 1.00 0.00 C ATOM 1006 CD2 PHE A 141 -3.630 2.284 -2.167 1.00 0.00 C ATOM 1007 CE1 PHE A 141 -1.472 4.064 -2.024 1.00 0.00 C ATOM 1008 CE2 PHE A 141 -3.670 3.367 -1.283 1.00 0.00 C ATOM 1009 CZ PHE A 141 -2.594 4.258 -1.213 1.00 0.00 C ATOM 0 H PHE A 141 -4.461 1.018 -5.366 1.00 0.00 H new ATOM 0 HA PHE A 141 -2.035 2.434 -5.382 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -3.302 0.266 -3.779 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -1.551 0.313 -3.708 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -0.559 2.827 -3.530 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -4.463 1.599 -2.222 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -0.641 4.751 -1.970 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -4.534 3.516 -0.653 1.00 0.00 H new ATOM 0 HZ PHE A 141 -2.630 5.096 -0.532 1.00 0.00 H new ATOM 1019 N VAL A 142 -1.906 -0.639 -6.584 1.00 0.00 N ATOM 1020 CA VAL A 142 -1.077 -1.535 -7.378 1.00 0.00 C ATOM 1021 C VAL A 142 -0.734 -0.897 -8.716 1.00 0.00 C ATOM 1022 O VAL A 142 0.400 -0.993 -9.187 1.00 0.00 O ATOM 1023 CB VAL A 142 -1.785 -2.871 -7.581 1.00 0.00 C ATOM 1024 CG1 VAL A 142 -1.050 -3.686 -8.646 1.00 0.00 C ATOM 1025 CG2 VAL A 142 -1.756 -3.637 -6.258 1.00 0.00 C ATOM 0 H VAL A 142 -2.843 -0.987 -6.382 1.00 0.00 H new ATOM 0 HA VAL A 142 -0.147 -1.718 -6.840 1.00 0.00 H new ATOM 0 HB VAL A 142 -2.813 -2.702 -7.903 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -1.558 -4.640 -8.789 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -1.043 -3.134 -9.586 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -0.025 -3.866 -8.323 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -2.258 -4.597 -6.382 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -0.722 -3.805 -5.957 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -2.268 -3.057 -5.490 1.00 0.00 H new ATOM 1035 N GLN A 143 -1.711 -0.232 -9.319 1.00 0.00 N ATOM 1036 CA GLN A 143 -1.480 0.429 -10.595 1.00 0.00 C ATOM 1037 C GLN A 143 -0.420 1.512 -10.422 1.00 0.00 C ATOM 1038 O GLN A 143 0.455 1.677 -11.269 1.00 0.00 O ATOM 1039 CB GLN A 143 -2.781 1.032 -11.119 1.00 0.00 C ATOM 1040 CG GLN A 143 -3.713 -0.099 -11.543 1.00 0.00 C ATOM 1041 CD GLN A 143 -5.090 0.456 -11.866 1.00 0.00 C ATOM 1042 OE1 GLN A 143 -5.504 1.470 -11.304 1.00 0.00 O ATOM 1043 NE2 GLN A 143 -5.828 -0.154 -12.745 1.00 0.00 N ATOM 0 H GLN A 143 -2.658 -0.137 -8.951 1.00 0.00 H new ATOM 0 HA GLN A 143 -1.125 -0.302 -11.322 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -3.253 1.640 -10.347 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -2.578 1.690 -11.964 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -3.304 -0.611 -12.414 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -3.788 -0.838 -10.745 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -5.481 -0.994 -13.208 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -6.755 0.207 -12.972 1.00 0.00 H new ATOM 1052 N MET A 144 -0.495 2.231 -9.305 1.00 0.00 N ATOM 1053 CA MET A 144 0.479 3.278 -9.021 1.00 0.00 C ATOM 1054 C MET A 144 1.871 2.656 -8.969 1.00 0.00 C ATOM 1055 O MET A 144 2.834 3.197 -9.514 1.00 0.00 O ATOM 1056 CB MET A 144 0.161 3.920 -7.664 1.00 0.00 C ATOM 1057 CG MET A 144 -1.123 4.744 -7.760 1.00 0.00 C ATOM 1058 SD MET A 144 -1.804 5.014 -6.099 1.00 0.00 S ATOM 1059 CE MET A 144 -0.409 5.929 -5.398 1.00 0.00 C ATOM 0 H MET A 144 -1.212 2.109 -8.590 1.00 0.00 H new ATOM 0 HA MET A 144 0.439 4.040 -9.800 1.00 0.00 H new ATOM 0 HB2 MET A 144 0.050 3.146 -6.904 1.00 0.00 H new ATOM 0 HB3 MET A 144 0.988 4.557 -7.352 1.00 0.00 H new ATOM 0 HG2 MET A 144 -0.917 5.701 -8.239 1.00 0.00 H new ATOM 0 HG3 MET A 144 -1.853 4.227 -8.383 1.00 0.00 H new ATOM 0 HE1 MET A 144 -0.722 6.419 -4.476 1.00 0.00 H new ATOM 0 HE2 MET A 144 0.407 5.239 -5.183 1.00 0.00 H new ATOM 0 HE3 MET A 144 -0.071 6.680 -6.112 1.00 0.00 H new ATOM 1069 N MET A 145 1.959 1.513 -8.296 1.00 0.00 N ATOM 1070 CA MET A 145 3.217 0.792 -8.142 1.00 0.00 C ATOM 1071 C MET A 145 3.653 0.125 -9.444 1.00 0.00 C ATOM 1072 O MET A 145 4.819 -0.238 -9.595 1.00 0.00 O ATOM 1073 CB MET A 145 3.042 -0.276 -7.063 1.00 0.00 C ATOM 1074 CG MET A 145 2.730 0.407 -5.735 1.00 0.00 C ATOM 1075 SD MET A 145 2.232 -0.843 -4.524 1.00 0.00 S ATOM 1076 CE MET A 145 1.576 0.278 -3.263 1.00 0.00 C ATOM 0 H MET A 145 1.164 1.062 -7.844 1.00 0.00 H new ATOM 0 HA MET A 145 3.989 1.508 -7.860 1.00 0.00 H new ATOM 0 HB2 MET A 145 2.236 -0.957 -7.335 1.00 0.00 H new ATOM 0 HB3 MET A 145 3.949 -0.874 -6.975 1.00 0.00 H new ATOM 0 HG2 MET A 145 3.605 0.949 -5.377 1.00 0.00 H new ATOM 0 HG3 MET A 145 1.934 1.140 -5.868 1.00 0.00 H new ATOM 0 HE1 MET A 145 0.699 -0.171 -2.798 1.00 0.00 H new ATOM 0 HE2 MET A 145 2.338 0.458 -2.504 1.00 0.00 H new ATOM 0 HE3 MET A 145 1.296 1.224 -3.727 1.00 0.00 H new ATOM 1086 N THR A 146 2.713 -0.047 -10.373 1.00 0.00 N ATOM 1087 CA THR A 146 3.021 -0.689 -11.649 1.00 0.00 C ATOM 1088 C THR A 146 2.780 0.266 -12.815 1.00 0.00 C ATOM 1089 O THR A 146 2.693 -0.160 -13.967 1.00 0.00 O ATOM 1090 CB THR A 146 2.160 -1.942 -11.817 1.00 0.00 C ATOM 1091 OG1 THR A 146 0.787 -1.581 -11.781 1.00 0.00 O ATOM 1092 CG2 THR A 146 2.462 -2.920 -10.681 1.00 0.00 C ATOM 0 H THR A 146 1.742 0.246 -10.267 1.00 0.00 H new ATOM 0 HA THR A 146 4.075 -0.967 -11.648 1.00 0.00 H new ATOM 0 HB THR A 146 2.385 -2.414 -12.773 1.00 0.00 H new ATOM 0 HG1 THR A 146 0.462 -1.624 -10.858 1.00 0.00 H new ATOM 0 HG21 THR A 146 1.850 -3.814 -10.798 1.00 0.00 H new ATOM 0 HG22 THR A 146 3.516 -3.196 -10.709 1.00 0.00 H new ATOM 0 HG23 THR A 146 2.236 -2.448 -9.725 1.00 0.00 H new ATOM 1100 N ALA A 147 2.687 1.557 -12.509 1.00 0.00 N ATOM 1101 CA ALA A 147 2.472 2.570 -13.538 1.00 0.00 C ATOM 1102 C ALA A 147 3.538 3.653 -13.434 1.00 0.00 C ATOM 1103 O ALA A 147 3.228 4.844 -13.410 1.00 0.00 O ATOM 1104 CB ALA A 147 1.087 3.200 -13.381 1.00 0.00 C ATOM 0 H ALA A 147 2.757 1.926 -11.560 1.00 0.00 H new ATOM 0 HA ALA A 147 2.537 2.091 -14.515 1.00 0.00 H new ATOM 0 HB1 ALA A 147 0.940 3.954 -14.155 1.00 0.00 H new ATOM 0 HB2 ALA A 147 0.323 2.428 -13.477 1.00 0.00 H new ATOM 0 HB3 ALA A 147 1.009 3.668 -12.400 1.00 0.00 H new ATOM 1110 N LYS A 148 4.797 3.230 -13.368 1.00 0.00 N ATOM 1111 CA LYS A 148 5.905 4.169 -13.261 1.00 0.00 C ATOM 1112 C LYS A 148 6.378 4.599 -14.646 1.00 0.00 C ATOM 1113 O LYS A 148 5.692 4.292 -15.607 1.00 0.00 O ATOM 1114 CB LYS A 148 7.063 3.513 -12.504 1.00 0.00 C ATOM 1115 CG LYS A 148 7.503 4.409 -11.340 1.00 0.00 C ATOM 1116 CD LYS A 148 6.387 4.504 -10.291 1.00 0.00 C ATOM 1117 CE LYS A 148 7.005 4.500 -8.892 1.00 0.00 C ATOM 1118 NZ LYS A 148 7.945 5.650 -8.764 1.00 0.00 N ATOM 1119 OXT LYS A 148 7.419 5.231 -14.725 1.00 0.00 O ATOM 0 H LYS A 148 5.073 2.248 -13.387 1.00 0.00 H new ATOM 0 HA LYS A 148 5.564 5.051 -12.718 1.00 0.00 H new ATOM 0 HB2 LYS A 148 6.756 2.538 -12.127 1.00 0.00 H new ATOM 0 HB3 LYS A 148 7.901 3.344 -13.180 1.00 0.00 H new ATOM 0 HG2 LYS A 148 8.407 4.006 -10.884 1.00 0.00 H new ATOM 0 HG3 LYS A 148 7.749 5.404 -11.711 1.00 0.00 H new ATOM 0 HD2 LYS A 148 5.807 5.414 -10.442 1.00 0.00 H new ATOM 0 HD3 LYS A 148 5.699 3.666 -10.399 1.00 0.00 H new ATOM 0 HE2 LYS A 148 6.223 4.570 -8.136 1.00 0.00 H new ATOM 0 HE3 LYS A 148 7.534 3.563 -8.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 8.354 5.659 -7.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 8.707 5.555 -9.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 7.431 6.539 -8.929 1.00 0.00 H new TER 1133 LYS A 148 ATOM 1134 N PHE B 30 -9.550 -3.649 12.262 1.00 0.00 N ATOM 1135 CA PHE B 30 -8.681 -4.237 11.205 1.00 0.00 C ATOM 1136 C PHE B 30 -9.031 -5.711 11.031 1.00 0.00 C ATOM 1137 O PHE B 30 -9.183 -6.196 9.910 1.00 0.00 O ATOM 1138 CB PHE B 30 -7.215 -4.092 11.617 1.00 0.00 C ATOM 1139 CG PHE B 30 -7.050 -2.838 12.444 1.00 0.00 C ATOM 1140 CD1 PHE B 30 -7.477 -1.605 11.936 1.00 0.00 C ATOM 1141 CD2 PHE B 30 -6.474 -2.908 13.719 1.00 0.00 C ATOM 1142 CE1 PHE B 30 -7.327 -0.442 12.701 1.00 0.00 C ATOM 1143 CE2 PHE B 30 -6.325 -1.745 14.484 1.00 0.00 C ATOM 1144 CZ PHE B 30 -6.751 -0.513 13.975 1.00 0.00 C ATOM 0 HA PHE B 30 -8.840 -3.716 10.261 1.00 0.00 H new ATOM 0 HB2 PHE B 30 -6.899 -4.964 12.190 1.00 0.00 H new ATOM 0 HB3 PHE B 30 -6.580 -4.044 10.733 1.00 0.00 H new ATOM 0 HD1 PHE B 30 -7.922 -1.551 10.954 1.00 0.00 H new ATOM 0 HD2 PHE B 30 -6.145 -3.859 14.112 1.00 0.00 H new ATOM 0 HE1 PHE B 30 -7.655 0.509 12.309 1.00 0.00 H new ATOM 0 HE2 PHE B 30 -5.881 -1.799 15.467 1.00 0.00 H new ATOM 0 HZ PHE B 30 -6.635 0.384 14.566 1.00 0.00 H new ATOM 1154 N ASP B 31 -9.165 -6.416 12.149 1.00 0.00 N ATOM 1155 CA ASP B 31 -9.505 -7.834 12.113 1.00 0.00 C ATOM 1156 C ASP B 31 -8.534 -8.603 11.223 1.00 0.00 C ATOM 1157 O ASP B 31 -8.945 -9.459 10.438 1.00 0.00 O ATOM 1158 CB ASP B 31 -10.932 -8.016 11.594 1.00 0.00 C ATOM 1159 CG ASP B 31 -11.931 -7.478 12.612 1.00 0.00 C ATOM 1160 OD1 ASP B 31 -11.533 -7.263 13.746 1.00 0.00 O ATOM 1161 OD2 ASP B 31 -13.078 -7.288 12.244 1.00 0.00 O ATOM 0 H ASP B 31 -9.044 -6.032 13.086 1.00 0.00 H new ATOM 0 HA ASP B 31 -9.433 -8.228 13.127 1.00 0.00 H new ATOM 0 HB2 ASP B 31 -11.051 -7.494 10.645 1.00 0.00 H new ATOM 0 HB3 ASP B 31 -11.127 -9.072 11.404 1.00 0.00 H new ATOM 1166 N ILE B 32 -7.245 -8.295 11.353 1.00 0.00 N ATOM 1167 CA ILE B 32 -6.219 -8.966 10.558 1.00 0.00 C ATOM 1168 C ILE B 32 -5.226 -9.657 11.477 1.00 0.00 C ATOM 1169 O ILE B 32 -5.143 -9.341 12.665 1.00 0.00 O ATOM 1170 CB ILE B 32 -5.470 -7.948 9.689 1.00 0.00 C ATOM 1171 CG1 ILE B 32 -4.522 -7.118 10.558 1.00 0.00 C ATOM 1172 CG2 ILE B 32 -6.465 -7.012 9.016 1.00 0.00 C ATOM 1173 CD1 ILE B 32 -4.030 -5.912 9.762 1.00 0.00 C ATOM 0 H ILE B 32 -6.888 -7.589 11.997 1.00 0.00 H new ATOM 0 HA ILE B 32 -6.703 -9.702 9.916 1.00 0.00 H new ATOM 0 HB ILE B 32 -4.899 -8.487 8.933 1.00 0.00 H new ATOM 0 HG12 ILE B 32 -5.035 -6.787 11.461 1.00 0.00 H new ATOM 0 HG13 ILE B 32 -3.676 -7.727 10.877 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -5.927 -6.291 8.400 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -7.142 -7.591 8.389 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -7.039 -6.483 9.777 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -3.355 -5.320 10.379 1.00 0.00 H new ATOM 0 HD12 ILE B 32 -3.502 -6.254 8.872 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -4.882 -5.300 9.466 1.00 0.00 H new ATOM 1185 N ASP B 33 -4.462 -10.588 10.927 1.00 0.00 N ATOM 1186 CA ASP B 33 -3.469 -11.291 11.720 1.00 0.00 C ATOM 1187 C ASP B 33 -2.209 -10.440 11.829 1.00 0.00 C ATOM 1188 O ASP B 33 -1.245 -10.641 11.092 1.00 0.00 O ATOM 1189 CB ASP B 33 -3.135 -12.637 11.075 1.00 0.00 C ATOM 1190 CG ASP B 33 -4.307 -13.598 11.236 1.00 0.00 C ATOM 1191 OD1 ASP B 33 -5.192 -13.296 12.020 1.00 0.00 O ATOM 1192 OD2 ASP B 33 -4.303 -14.622 10.573 1.00 0.00 O ATOM 0 H ASP B 33 -4.510 -10.871 9.948 1.00 0.00 H new ATOM 0 HA ASP B 33 -3.871 -11.472 12.717 1.00 0.00 H new ATOM 0 HB2 ASP B 33 -2.912 -12.497 10.017 1.00 0.00 H new ATOM 0 HB3 ASP B 33 -2.242 -13.059 11.536 1.00 0.00 H new ATOM 1197 N MET B 34 -2.233 -9.476 12.744 1.00 0.00 N ATOM 1198 CA MET B 34 -1.094 -8.585 12.928 1.00 0.00 C ATOM 1199 C MET B 34 0.102 -9.338 13.503 1.00 0.00 C ATOM 1200 O MET B 34 1.252 -8.970 13.262 1.00 0.00 O ATOM 1201 CB MET B 34 -1.463 -7.432 13.863 1.00 0.00 C ATOM 1202 CG MET B 34 -2.521 -6.555 13.193 1.00 0.00 C ATOM 1203 SD MET B 34 -2.845 -5.086 14.206 1.00 0.00 S ATOM 1204 CE MET B 34 -1.410 -4.103 13.691 1.00 0.00 C ATOM 0 H MET B 34 -3.022 -9.293 13.364 1.00 0.00 H new ATOM 0 HA MET B 34 -0.823 -8.187 11.950 1.00 0.00 H new ATOM 0 HB2 MET B 34 -1.843 -7.822 14.807 1.00 0.00 H new ATOM 0 HB3 MET B 34 -0.578 -6.840 14.096 1.00 0.00 H new ATOM 0 HG2 MET B 34 -2.181 -6.255 12.202 1.00 0.00 H new ATOM 0 HG3 MET B 34 -3.442 -7.122 13.056 1.00 0.00 H new ATOM 0 HE1 MET B 34 -1.083 -3.475 14.519 1.00 0.00 H new ATOM 0 HE2 MET B 34 -0.598 -4.769 13.399 1.00 0.00 H new ATOM 0 HE3 MET B 34 -1.685 -3.474 12.845 1.00 0.00 H new ATOM 1214 N ASP B 35 -0.176 -10.379 14.280 1.00 0.00 N ATOM 1215 CA ASP B 35 0.886 -11.162 14.903 1.00 0.00 C ATOM 1216 C ASP B 35 1.552 -12.094 13.895 1.00 0.00 C ATOM 1217 O ASP B 35 2.480 -12.827 14.237 1.00 0.00 O ATOM 1218 CB ASP B 35 0.314 -11.982 16.061 1.00 0.00 C ATOM 1219 CG ASP B 35 -0.655 -13.035 15.531 1.00 0.00 C ATOM 1220 OD1 ASP B 35 -0.824 -13.103 14.324 1.00 0.00 O ATOM 1221 OD2 ASP B 35 -1.214 -13.757 16.339 1.00 0.00 O ATOM 0 H ASP B 35 -1.121 -10.699 14.493 1.00 0.00 H new ATOM 0 HA ASP B 35 1.640 -10.470 15.278 1.00 0.00 H new ATOM 0 HB2 ASP B 35 1.123 -12.465 16.609 1.00 0.00 H new ATOM 0 HB3 ASP B 35 -0.199 -11.325 16.763 1.00 0.00 H new ATOM 1226 N ALA B 36 1.083 -12.058 12.652 1.00 0.00 N ATOM 1227 CA ALA B 36 1.658 -12.903 11.613 1.00 0.00 C ATOM 1228 C ALA B 36 2.827 -12.177 10.924 1.00 0.00 C ATOM 1229 O ALA B 36 2.611 -11.142 10.294 1.00 0.00 O ATOM 1230 CB ALA B 36 0.594 -13.237 10.567 1.00 0.00 C ATOM 0 H ALA B 36 0.316 -11.461 12.343 1.00 0.00 H new ATOM 0 HA ALA B 36 2.022 -13.821 12.075 1.00 0.00 H new ATOM 0 HB1 ALA B 36 1.030 -13.869 9.793 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -0.232 -13.765 11.044 1.00 0.00 H new ATOM 0 HB3 ALA B 36 0.224 -12.316 10.117 1.00 0.00 H new ATOM 1236 N PRO B 37 4.047 -12.677 11.005 1.00 0.00 N ATOM 1237 CA PRO B 37 5.214 -12.017 10.339 1.00 0.00 C ATOM 1238 C PRO B 37 4.933 -11.696 8.874 1.00 0.00 C ATOM 1239 O PRO B 37 5.492 -10.752 8.317 1.00 0.00 O ATOM 1240 CB PRO B 37 6.324 -13.062 10.447 1.00 0.00 C ATOM 1241 CG PRO B 37 5.994 -13.840 11.670 1.00 0.00 C ATOM 1242 CD PRO B 37 4.470 -13.893 11.735 1.00 0.00 C ATOM 0 HA PRO B 37 5.462 -11.062 10.803 1.00 0.00 H new ATOM 0 HB2 PRO B 37 6.351 -13.703 9.566 1.00 0.00 H new ATOM 0 HB3 PRO B 37 7.304 -12.592 10.530 1.00 0.00 H new ATOM 0 HG2 PRO B 37 6.418 -14.843 11.621 1.00 0.00 H new ATOM 0 HG3 PRO B 37 6.406 -13.363 12.559 1.00 0.00 H new ATOM 0 HD2 PRO B 37 4.080 -14.797 11.267 1.00 0.00 H new ATOM 0 HD3 PRO B 37 4.112 -13.887 12.765 1.00 0.00 H new ATOM 1250 N GLU B 38 4.070 -12.494 8.254 1.00 0.00 N ATOM 1251 CA GLU B 38 3.731 -12.292 6.850 1.00 0.00 C ATOM 1252 C GLU B 38 3.096 -10.919 6.641 1.00 0.00 C ATOM 1253 O GLU B 38 3.376 -10.244 5.650 1.00 0.00 O ATOM 1254 CB GLU B 38 2.757 -13.379 6.391 1.00 0.00 C ATOM 1255 CG GLU B 38 3.470 -14.732 6.374 1.00 0.00 C ATOM 1256 CD GLU B 38 4.511 -14.762 5.259 1.00 0.00 C ATOM 1257 OE1 GLU B 38 4.428 -13.923 4.377 1.00 0.00 O ATOM 1258 OE2 GLU B 38 5.374 -15.623 5.304 1.00 0.00 O ATOM 0 H GLU B 38 3.596 -13.281 8.697 1.00 0.00 H new ATOM 0 HA GLU B 38 4.647 -12.348 6.262 1.00 0.00 H new ATOM 0 HB2 GLU B 38 1.898 -13.418 7.060 1.00 0.00 H new ATOM 0 HB3 GLU B 38 2.376 -13.144 5.397 1.00 0.00 H new ATOM 0 HG2 GLU B 38 3.951 -14.911 7.336 1.00 0.00 H new ATOM 0 HG3 GLU B 38 2.745 -15.532 6.227 1.00 0.00 H new ATOM 1265 N THR B 39 2.243 -10.510 7.574 1.00 0.00 N ATOM 1266 CA THR B 39 1.585 -9.213 7.469 1.00 0.00 C ATOM 1267 C THR B 39 2.618 -8.092 7.522 1.00 0.00 C ATOM 1268 O THR B 39 2.538 -7.125 6.766 1.00 0.00 O ATOM 1269 CB THR B 39 0.570 -9.034 8.604 1.00 0.00 C ATOM 1270 OG1 THR B 39 -0.406 -10.064 8.530 1.00 0.00 O ATOM 1271 CG2 THR B 39 -0.119 -7.673 8.466 1.00 0.00 C ATOM 0 H THR B 39 1.993 -11.050 8.402 1.00 0.00 H new ATOM 0 HA THR B 39 1.060 -9.170 6.515 1.00 0.00 H new ATOM 0 HB THR B 39 1.086 -9.085 9.563 1.00 0.00 H new ATOM 0 HG1 THR B 39 -0.717 -10.286 9.433 1.00 0.00 H new ATOM 0 HG21 THR B 39 -0.840 -7.547 9.273 1.00 0.00 H new ATOM 0 HG22 THR B 39 0.627 -6.880 8.519 1.00 0.00 H new ATOM 0 HG23 THR B 39 -0.635 -7.622 7.507 1.00 0.00 H new ATOM 1279 N GLU B 40 3.589 -8.232 8.418 1.00 0.00 N ATOM 1280 CA GLU B 40 4.634 -7.225 8.559 1.00 0.00 C ATOM 1281 C GLU B 40 5.406 -7.088 7.250 1.00 0.00 C ATOM 1282 O GLU B 40 5.697 -5.977 6.806 1.00 0.00 O ATOM 1283 CB GLU B 40 5.589 -7.624 9.690 1.00 0.00 C ATOM 1284 CG GLU B 40 6.657 -6.542 9.886 1.00 0.00 C ATOM 1285 CD GLU B 40 6.006 -5.239 10.339 1.00 0.00 C ATOM 1286 OE1 GLU B 40 4.889 -5.294 10.825 1.00 0.00 O ATOM 1287 OE2 GLU B 40 6.636 -4.203 10.193 1.00 0.00 O ATOM 0 H GLU B 40 3.674 -9.026 9.053 1.00 0.00 H new ATOM 0 HA GLU B 40 4.175 -6.266 8.800 1.00 0.00 H new ATOM 0 HB2 GLU B 40 5.030 -7.766 10.615 1.00 0.00 H new ATOM 0 HB3 GLU B 40 6.064 -8.577 9.456 1.00 0.00 H new ATOM 0 HG2 GLU B 40 7.386 -6.870 10.627 1.00 0.00 H new ATOM 0 HG3 GLU B 40 7.199 -6.382 8.954 1.00 0.00 H new ATOM 1294 N ARG B 41 5.729 -8.220 6.633 1.00 0.00 N ATOM 1295 CA ARG B 41 6.462 -8.200 5.372 1.00 0.00 C ATOM 1296 C ARG B 41 5.636 -7.503 4.298 1.00 0.00 C ATOM 1297 O ARG B 41 6.163 -6.728 3.501 1.00 0.00 O ATOM 1298 CB ARG B 41 6.780 -9.632 4.926 1.00 0.00 C ATOM 1299 CG ARG B 41 7.851 -10.246 5.838 1.00 0.00 C ATOM 1300 CD ARG B 41 9.249 -9.884 5.325 1.00 0.00 C ATOM 1301 NE ARG B 41 9.494 -10.523 4.037 1.00 0.00 N ATOM 1302 CZ ARG B 41 10.577 -10.237 3.322 1.00 0.00 C ATOM 1303 NH1 ARG B 41 11.442 -9.367 3.766 1.00 0.00 N ATOM 1304 NH2 ARG B 41 10.773 -10.824 2.173 1.00 0.00 N ATOM 0 H ARG B 41 5.499 -9.151 6.980 1.00 0.00 H new ATOM 0 HA ARG B 41 7.394 -7.654 5.518 1.00 0.00 H new ATOM 0 HB2 ARG B 41 5.875 -10.239 4.956 1.00 0.00 H new ATOM 0 HB3 ARG B 41 7.129 -9.630 3.893 1.00 0.00 H new ATOM 0 HG2 ARG B 41 7.724 -9.882 6.858 1.00 0.00 H new ATOM 0 HG3 ARG B 41 7.736 -11.329 5.869 1.00 0.00 H new ATOM 0 HD2 ARG B 41 9.339 -8.802 5.225 1.00 0.00 H new ATOM 0 HD3 ARG B 41 10.002 -10.202 6.046 1.00 0.00 H new ATOM 0 HE ARG B 41 8.822 -11.202 3.679 1.00 0.00 H new ATOM 0 HH11 ARG B 41 11.287 -8.906 4.663 1.00 0.00 H new ATOM 0 HH12 ARG B 41 12.273 -9.148 3.217 1.00 0.00 H new ATOM 0 HH21 ARG B 41 10.095 -11.502 1.824 1.00 0.00 H new ATOM 0 HH22 ARG B 41 11.604 -10.605 1.624 1.00 0.00 H new ATOM 1318 N ALA B 42 4.336 -7.779 4.289 1.00 0.00 N ATOM 1319 CA ALA B 42 3.444 -7.165 3.314 1.00 0.00 C ATOM 1320 C ALA B 42 3.421 -5.652 3.496 1.00 0.00 C ATOM 1321 O ALA B 42 3.424 -4.899 2.522 1.00 0.00 O ATOM 1322 CB ALA B 42 2.029 -7.724 3.474 1.00 0.00 C ATOM 0 H ALA B 42 3.880 -8.418 4.940 1.00 0.00 H new ATOM 0 HA ALA B 42 3.811 -7.396 2.314 1.00 0.00 H new ATOM 0 HB1 ALA B 42 1.369 -7.259 2.741 1.00 0.00 H new ATOM 0 HB2 ALA B 42 2.044 -8.802 3.317 1.00 0.00 H new ATOM 0 HB3 ALA B 42 1.664 -7.509 4.478 1.00 0.00 H new ATOM 1328 N ALA B 43 3.400 -5.214 4.751 1.00 0.00 N ATOM 1329 CA ALA B 43 3.379 -3.788 5.052 1.00 0.00 C ATOM 1330 C ALA B 43 4.638 -3.111 4.517 1.00 0.00 C ATOM 1331 O ALA B 43 4.580 -2.011 3.967 1.00 0.00 O ATOM 1332 CB ALA B 43 3.287 -3.573 6.567 1.00 0.00 C ATOM 0 H ALA B 43 3.397 -5.822 5.570 1.00 0.00 H new ATOM 0 HA ALA B 43 2.507 -3.347 4.569 1.00 0.00 H new ATOM 0 HB1 ALA B 43 3.272 -2.505 6.783 1.00 0.00 H new ATOM 0 HB2 ALA B 43 2.374 -4.032 6.945 1.00 0.00 H new ATOM 0 HB3 ALA B 43 4.150 -4.029 7.052 1.00 0.00 H new ATOM 1338 N VAL B 44 5.775 -3.775 4.694 1.00 0.00 N ATOM 1339 CA VAL B 44 7.056 -3.238 4.242 1.00 0.00 C ATOM 1340 C VAL B 44 7.106 -3.092 2.721 1.00 0.00 C ATOM 1341 O VAL B 44 7.572 -2.076 2.205 1.00 0.00 O ATOM 1342 CB VAL B 44 8.190 -4.153 4.699 1.00 0.00 C ATOM 1343 CG1 VAL B 44 9.499 -3.713 4.041 1.00 0.00 C ATOM 1344 CG2 VAL B 44 8.332 -4.068 6.221 1.00 0.00 C ATOM 0 H VAL B 44 5.837 -4.687 5.147 1.00 0.00 H new ATOM 0 HA VAL B 44 7.172 -2.247 4.681 1.00 0.00 H new ATOM 0 HB VAL B 44 7.966 -5.180 4.411 1.00 0.00 H new ATOM 0 HG11 VAL B 44 10.308 -4.366 4.368 1.00 0.00 H new ATOM 0 HG12 VAL B 44 9.399 -3.773 2.957 1.00 0.00 H new ATOM 0 HG13 VAL B 44 9.724 -2.686 4.329 1.00 0.00 H new ATOM 0 HG21 VAL B 44 9.141 -4.721 6.548 1.00 0.00 H new ATOM 0 HG22 VAL B 44 8.556 -3.041 6.509 1.00 0.00 H new ATOM 0 HG23 VAL B 44 7.400 -4.382 6.691 1.00 0.00 H new ATOM 1354 N ALA B 45 6.652 -4.118 2.007 1.00 0.00 N ATOM 1355 CA ALA B 45 6.682 -4.088 0.546 1.00 0.00 C ATOM 1356 C ALA B 45 5.849 -2.936 -0.005 1.00 0.00 C ATOM 1357 O ALA B 45 6.277 -2.237 -0.923 1.00 0.00 O ATOM 1358 CB ALA B 45 6.150 -5.409 -0.012 1.00 0.00 C ATOM 0 H ALA B 45 6.263 -4.971 2.409 1.00 0.00 H new ATOM 0 HA ALA B 45 7.717 -3.942 0.237 1.00 0.00 H new ATOM 0 HB1 ALA B 45 6.175 -5.380 -1.101 1.00 0.00 H new ATOM 0 HB2 ALA B 45 6.772 -6.231 0.344 1.00 0.00 H new ATOM 0 HB3 ALA B 45 5.124 -5.559 0.324 1.00 0.00 H new ATOM 1364 N ILE B 46 4.663 -2.738 0.556 1.00 0.00 N ATOM 1365 CA ILE B 46 3.794 -1.662 0.100 1.00 0.00 C ATOM 1366 C ILE B 46 4.449 -0.305 0.338 1.00 0.00 C ATOM 1367 O ILE B 46 4.462 0.556 -0.542 1.00 0.00 O ATOM 1368 CB ILE B 46 2.457 -1.720 0.843 1.00 0.00 C ATOM 1369 CG1 ILE B 46 1.688 -2.969 0.406 1.00 0.00 C ATOM 1370 CG2 ILE B 46 1.634 -0.473 0.513 1.00 0.00 C ATOM 1371 CD1 ILE B 46 0.489 -3.182 1.333 1.00 0.00 C ATOM 0 H ILE B 46 4.285 -3.301 1.318 1.00 0.00 H new ATOM 0 HA ILE B 46 3.623 -1.788 -0.969 1.00 0.00 H new ATOM 0 HB ILE B 46 2.639 -1.760 1.917 1.00 0.00 H new ATOM 0 HG12 ILE B 46 1.349 -2.858 -0.624 1.00 0.00 H new ATOM 0 HG13 ILE B 46 2.342 -3.840 0.435 1.00 0.00 H new ATOM 0 HG21 ILE B 46 0.682 -0.515 1.042 1.00 0.00 H new ATOM 0 HG22 ILE B 46 2.182 0.417 0.822 1.00 0.00 H new ATOM 0 HG23 ILE B 46 1.451 -0.432 -0.561 1.00 0.00 H new ATOM 0 HD11 ILE B 46 -0.058 -4.072 1.021 1.00 0.00 H new ATOM 0 HD12 ILE B 46 0.839 -3.312 2.357 1.00 0.00 H new ATOM 0 HD13 ILE B 46 -0.169 -2.315 1.282 1.00 0.00 H new ATOM 1383 N GLN B 47 4.980 -0.123 1.541 1.00 0.00 N ATOM 1384 CA GLN B 47 5.626 1.131 1.908 1.00 0.00 C ATOM 1385 C GLN B 47 6.883 1.376 1.077 1.00 0.00 C ATOM 1386 O GLN B 47 7.155 2.504 0.666 1.00 0.00 O ATOM 1387 CB GLN B 47 6.005 1.091 3.384 1.00 0.00 C ATOM 1388 CG GLN B 47 4.737 1.120 4.238 1.00 0.00 C ATOM 1389 CD GLN B 47 5.117 0.992 5.704 1.00 0.00 C ATOM 1390 OE1 GLN B 47 6.286 1.151 6.050 1.00 0.00 O ATOM 1391 NE2 GLN B 47 4.198 0.712 6.588 1.00 0.00 N ATOM 0 H GLN B 47 4.976 -0.828 2.279 1.00 0.00 H new ATOM 0 HA GLN B 47 4.924 1.942 1.716 1.00 0.00 H new ATOM 0 HB2 GLN B 47 6.580 0.190 3.598 1.00 0.00 H new ATOM 0 HB3 GLN B 47 6.641 1.941 3.630 1.00 0.00 H new ATOM 0 HG2 GLN B 47 4.193 2.050 4.071 1.00 0.00 H new ATOM 0 HG3 GLN B 47 4.072 0.306 3.950 1.00 0.00 H new ATOM 0 HE21 GLN B 47 3.230 0.581 6.294 1.00 0.00 H new ATOM 0 HE22 GLN B 47 4.448 0.624 7.573 1.00 0.00 H new ATOM 1400 N SER B 48 7.654 0.316 0.844 1.00 0.00 N ATOM 1401 CA SER B 48 8.886 0.443 0.072 1.00 0.00 C ATOM 1402 C SER B 48 8.585 0.943 -1.334 1.00 0.00 C ATOM 1403 O SER B 48 9.241 1.858 -1.832 1.00 0.00 O ATOM 1404 CB SER B 48 9.594 -0.910 -0.004 1.00 0.00 C ATOM 1405 OG SER B 48 10.787 -0.773 -0.767 1.00 0.00 O ATOM 0 H SER B 48 7.451 -0.628 1.174 1.00 0.00 H new ATOM 0 HA SER B 48 9.534 1.164 0.570 1.00 0.00 H new ATOM 0 HB2 SER B 48 9.829 -1.268 0.999 1.00 0.00 H new ATOM 0 HB3 SER B 48 8.939 -1.651 -0.462 1.00 0.00 H new ATOM 0 HG SER B 48 11.245 -1.638 -0.817 1.00 0.00 H new ATOM 1411 N GLN B 49 7.583 0.346 -1.965 1.00 0.00 N ATOM 1412 CA GLN B 49 7.195 0.749 -3.309 1.00 0.00 C ATOM 1413 C GLN B 49 6.652 2.173 -3.281 1.00 0.00 C ATOM 1414 O GLN B 49 6.907 2.967 -4.187 1.00 0.00 O ATOM 1415 CB GLN B 49 6.129 -0.204 -3.859 1.00 0.00 C ATOM 1416 CG GLN B 49 6.736 -1.594 -4.092 1.00 0.00 C ATOM 1417 CD GLN B 49 7.833 -1.530 -5.151 1.00 0.00 C ATOM 1418 OE1 GLN B 49 7.637 -0.942 -6.215 1.00 0.00 O ATOM 1419 NE2 GLN B 49 8.983 -2.104 -4.922 1.00 0.00 N ATOM 0 H GLN B 49 7.028 -0.414 -1.571 1.00 0.00 H new ATOM 0 HA GLN B 49 8.070 0.710 -3.958 1.00 0.00 H new ATOM 0 HB2 GLN B 49 5.297 -0.275 -3.159 1.00 0.00 H new ATOM 0 HB3 GLN B 49 5.727 0.187 -4.794 1.00 0.00 H new ATOM 0 HG2 GLN B 49 7.146 -1.979 -3.158 1.00 0.00 H new ATOM 0 HG3 GLN B 49 5.958 -2.288 -4.408 1.00 0.00 H new ATOM 0 HE21 GLN B 49 9.143 -2.591 -4.040 1.00 0.00 H new ATOM 0 HE22 GLN B 49 9.721 -2.066 -5.625 1.00 0.00 H new ATOM 1428 N PHE B 50 5.902 2.487 -2.227 1.00 0.00 N ATOM 1429 CA PHE B 50 5.324 3.816 -2.077 1.00 0.00 C ATOM 1430 C PHE B 50 6.419 4.878 -2.023 1.00 0.00 C ATOM 1431 O PHE B 50 6.274 5.958 -2.598 1.00 0.00 O ATOM 1432 CB PHE B 50 4.451 3.881 -0.816 1.00 0.00 C ATOM 1433 CG PHE B 50 3.873 5.273 -0.676 1.00 0.00 C ATOM 1434 CD1 PHE B 50 3.026 5.781 -1.671 1.00 0.00 C ATOM 1435 CD2 PHE B 50 4.204 6.066 0.434 1.00 0.00 C ATOM 1436 CE1 PHE B 50 2.510 7.076 -1.556 1.00 0.00 C ATOM 1437 CE2 PHE B 50 3.688 7.363 0.543 1.00 0.00 C ATOM 1438 CZ PHE B 50 2.843 7.867 -0.453 1.00 0.00 C ATOM 0 H PHE B 50 5.682 1.841 -1.469 1.00 0.00 H new ATOM 0 HA PHE B 50 4.696 4.016 -2.945 1.00 0.00 H new ATOM 0 HB2 PHE B 50 3.648 3.146 -0.878 1.00 0.00 H new ATOM 0 HB3 PHE B 50 5.044 3.631 0.064 1.00 0.00 H new ATOM 0 HD1 PHE B 50 2.772 5.172 -2.526 1.00 0.00 H new ATOM 0 HD2 PHE B 50 4.855 5.676 1.202 1.00 0.00 H new ATOM 0 HE1 PHE B 50 1.854 7.465 -2.320 1.00 0.00 H new ATOM 0 HE2 PHE B 50 3.942 7.975 1.396 1.00 0.00 H new ATOM 0 HZ PHE B 50 2.448 8.869 -0.369 1.00 0.00 H new ATOM 1448 N ARG B 51 7.513 4.569 -1.335 1.00 0.00 N ATOM 1449 CA ARG B 51 8.620 5.513 -1.220 1.00 0.00 C ATOM 1450 C ARG B 51 9.144 5.879 -2.608 1.00 0.00 C ATOM 1451 O ARG B 51 9.426 7.043 -2.887 1.00 0.00 O ATOM 1452 CB ARG B 51 9.751 4.898 -0.391 1.00 0.00 C ATOM 1453 CG ARG B 51 10.888 5.911 -0.238 1.00 0.00 C ATOM 1454 CD ARG B 51 11.955 5.344 0.699 1.00 0.00 C ATOM 1455 NE ARG B 51 11.426 5.215 2.053 1.00 0.00 N ATOM 1456 CZ ARG B 51 12.147 4.661 3.023 1.00 0.00 C ATOM 1457 NH1 ARG B 51 13.350 4.223 2.772 1.00 0.00 N ATOM 1458 NH2 ARG B 51 11.650 4.554 4.225 1.00 0.00 N ATOM 0 H ARG B 51 7.657 3.682 -0.853 1.00 0.00 H new ATOM 0 HA ARG B 51 8.260 6.414 -0.723 1.00 0.00 H new ATOM 0 HB2 ARG B 51 9.378 4.605 0.590 1.00 0.00 H new ATOM 0 HB3 ARG B 51 10.119 3.994 -0.875 1.00 0.00 H new ATOM 0 HG2 ARG B 51 11.325 6.133 -1.212 1.00 0.00 H new ATOM 0 HG3 ARG B 51 10.502 6.850 0.159 1.00 0.00 H new ATOM 0 HD2 ARG B 51 12.286 4.371 0.337 1.00 0.00 H new ATOM 0 HD3 ARG B 51 12.828 5.996 0.703 1.00 0.00 H new ATOM 0 HE ARG B 51 10.487 5.556 2.259 1.00 0.00 H new ATOM 0 HH11 ARG B 51 13.737 4.306 1.832 1.00 0.00 H new ATOM 0 HH12 ARG B 51 13.904 3.798 3.516 1.00 0.00 H new ATOM 0 HH21 ARG B 51 10.709 4.895 4.420 1.00 0.00 H new ATOM 0 HH22 ARG B 51 12.203 4.129 4.969 1.00 0.00 H new ATOM 1472 N LYS B 52 9.263 4.880 -3.474 1.00 0.00 N ATOM 1473 CA LYS B 52 9.742 5.109 -4.833 1.00 0.00 C ATOM 1474 C LYS B 52 8.802 6.065 -5.565 1.00 0.00 C ATOM 1475 O LYS B 52 9.241 6.932 -6.320 1.00 0.00 O ATOM 1476 CB LYS B 52 9.827 3.778 -5.589 1.00 0.00 C ATOM 1477 CG LYS B 52 10.445 4.004 -6.977 1.00 0.00 C ATOM 1478 CD LYS B 52 10.443 2.698 -7.784 1.00 0.00 C ATOM 1479 CE LYS B 52 11.535 1.750 -7.274 1.00 0.00 C ATOM 1480 NZ LYS B 52 11.651 0.588 -8.201 1.00 0.00 N ATOM 0 H LYS B 52 9.036 3.908 -3.262 1.00 0.00 H new ATOM 0 HA LYS B 52 10.735 5.556 -4.787 1.00 0.00 H new ATOM 0 HB2 LYS B 52 10.430 3.067 -5.024 1.00 0.00 H new ATOM 0 HB3 LYS B 52 8.833 3.343 -5.690 1.00 0.00 H new ATOM 0 HG2 LYS B 52 9.883 4.770 -7.512 1.00 0.00 H new ATOM 0 HG3 LYS B 52 11.466 4.372 -6.872 1.00 0.00 H new ATOM 0 HD2 LYS B 52 9.469 2.216 -7.705 1.00 0.00 H new ATOM 0 HD3 LYS B 52 10.606 2.916 -8.840 1.00 0.00 H new ATOM 0 HE2 LYS B 52 12.488 2.275 -7.210 1.00 0.00 H new ATOM 0 HE3 LYS B 52 11.293 1.405 -6.269 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 12.391 -0.057 -7.858 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 10.743 0.083 -8.240 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 11.900 0.926 -9.152 1.00 0.00 H new ATOM 1494 N PHE B 53 7.505 5.889 -5.336 1.00 0.00 N ATOM 1495 CA PHE B 53 6.494 6.727 -5.973 1.00 0.00 C ATOM 1496 C PHE B 53 6.701 8.194 -5.605 1.00 0.00 C ATOM 1497 O PHE B 53 6.525 9.084 -6.436 1.00 0.00 O ATOM 1498 CB PHE B 53 5.099 6.281 -5.532 1.00 0.00 C ATOM 1499 CG PHE B 53 4.053 7.009 -6.341 1.00 0.00 C ATOM 1500 CD1 PHE B 53 3.623 6.480 -7.563 1.00 0.00 C ATOM 1501 CD2 PHE B 53 3.509 8.210 -5.868 1.00 0.00 C ATOM 1502 CE1 PHE B 53 2.649 7.151 -8.314 1.00 0.00 C ATOM 1503 CE2 PHE B 53 2.536 8.880 -6.618 1.00 0.00 C ATOM 1504 CZ PHE B 53 2.106 8.351 -7.841 1.00 0.00 C ATOM 0 H PHE B 53 7.128 5.174 -4.714 1.00 0.00 H new ATOM 0 HA PHE B 53 6.588 6.620 -7.054 1.00 0.00 H new ATOM 0 HB2 PHE B 53 4.992 5.205 -5.665 1.00 0.00 H new ATOM 0 HB3 PHE B 53 4.960 6.486 -4.471 1.00 0.00 H new ATOM 0 HD1 PHE B 53 4.042 5.554 -7.927 1.00 0.00 H new ATOM 0 HD2 PHE B 53 3.840 8.619 -4.925 1.00 0.00 H new ATOM 0 HE1 PHE B 53 2.317 6.743 -9.257 1.00 0.00 H new ATOM 0 HE2 PHE B 53 2.116 9.806 -6.253 1.00 0.00 H new ATOM 0 HZ PHE B 53 1.355 8.869 -8.419 1.00 0.00 H new ATOM 1514 N GLN B 54 7.067 8.437 -4.351 1.00 0.00 N ATOM 1515 CA GLN B 54 7.285 9.800 -3.875 1.00 0.00 C ATOM 1516 C GLN B 54 8.404 10.473 -4.664 1.00 0.00 C ATOM 1517 O GLN B 54 8.327 11.661 -4.975 1.00 0.00 O ATOM 1518 CB GLN B 54 7.657 9.780 -2.393 1.00 0.00 C ATOM 1519 CG GLN B 54 6.443 9.359 -1.566 1.00 0.00 C ATOM 1520 CD GLN B 54 6.852 9.168 -0.110 1.00 0.00 C ATOM 1521 OE1 GLN B 54 8.049 9.516 0.274 1.00 0.00 O flip ATOM 1522 NE2 GLN B 54 6.059 8.690 0.698 1.00 0.00 N flip ATOM 0 H GLN B 54 7.218 7.713 -3.649 1.00 0.00 H new ATOM 0 HA GLN B 54 6.363 10.363 -4.016 1.00 0.00 H new ATOM 0 HB2 GLN B 54 8.482 9.088 -2.224 1.00 0.00 H new ATOM 0 HB3 GLN B 54 7.999 10.767 -2.080 1.00 0.00 H new ATOM 0 HG2 GLN B 54 5.662 10.116 -1.638 1.00 0.00 H new ATOM 0 HG3 GLN B 54 6.026 8.433 -1.961 1.00 0.00 H new ATOM 0 HE21 GLN B 54 5.124 8.419 0.395 1.00 0.00 H new ATOM 0 HE22 GLN B 54 6.336 8.565 1.672 1.00 0.00 H new ATOM 1531 N LYS B 55 9.445 9.710 -4.979 1.00 0.00 N ATOM 1532 CA LYS B 55 10.574 10.250 -5.726 1.00 0.00 C ATOM 1533 C LYS B 55 10.119 10.758 -7.091 1.00 0.00 C ATOM 1534 O LYS B 55 10.582 11.798 -7.561 1.00 0.00 O ATOM 1535 CB LYS B 55 11.647 9.172 -5.908 1.00 0.00 C ATOM 1536 CG LYS B 55 12.334 8.898 -4.567 1.00 0.00 C ATOM 1537 CD LYS B 55 13.514 9.858 -4.384 1.00 0.00 C ATOM 1538 CE LYS B 55 14.770 9.253 -5.015 1.00 0.00 C ATOM 1539 NZ LYS B 55 15.330 8.214 -4.106 1.00 0.00 N ATOM 0 H LYS B 55 9.530 8.724 -4.731 1.00 0.00 H new ATOM 0 HA LYS B 55 10.993 11.084 -5.163 1.00 0.00 H new ATOM 0 HB2 LYS B 55 11.196 8.256 -6.290 1.00 0.00 H new ATOM 0 HB3 LYS B 55 12.382 9.497 -6.645 1.00 0.00 H new ATOM 0 HG2 LYS B 55 11.622 9.022 -3.751 1.00 0.00 H new ATOM 0 HG3 LYS B 55 12.684 7.866 -4.531 1.00 0.00 H new ATOM 0 HD2 LYS B 55 13.289 10.819 -4.846 1.00 0.00 H new ATOM 0 HD3 LYS B 55 13.682 10.046 -3.324 1.00 0.00 H new ATOM 0 HE2 LYS B 55 14.528 8.813 -5.983 1.00 0.00 H new ATOM 0 HE3 LYS B 55 15.511 10.032 -5.195 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 16.369 8.235 -4.153 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 15.023 8.404 -3.131 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 14.989 7.276 -4.399 1.00 0.00 H new ATOM 1553 N LYS B 56 9.207 10.025 -7.723 1.00 0.00 N ATOM 1554 CA LYS B 56 8.698 10.425 -9.031 1.00 0.00 C ATOM 1555 C LYS B 56 8.028 11.792 -8.951 1.00 0.00 C ATOM 1556 O LYS B 56 8.209 12.634 -9.831 1.00 0.00 O ATOM 1557 CB LYS B 56 7.689 9.392 -9.544 1.00 0.00 C ATOM 1558 CG LYS B 56 8.392 8.363 -10.439 1.00 0.00 C ATOM 1559 CD LYS B 56 8.862 9.024 -11.745 1.00 0.00 C ATOM 1560 CE LYS B 56 8.547 8.104 -12.925 1.00 0.00 C ATOM 1561 NZ LYS B 56 7.070 8.021 -13.107 1.00 0.00 N ATOM 0 H LYS B 56 8.809 9.161 -7.356 1.00 0.00 H new ATOM 0 HA LYS B 56 9.540 10.483 -9.721 1.00 0.00 H new ATOM 0 HB2 LYS B 56 7.214 8.888 -8.702 1.00 0.00 H new ATOM 0 HB3 LYS B 56 6.899 9.892 -10.104 1.00 0.00 H new ATOM 0 HG2 LYS B 56 9.245 7.936 -9.912 1.00 0.00 H new ATOM 0 HG3 LYS B 56 7.712 7.541 -10.664 1.00 0.00 H new ATOM 0 HD2 LYS B 56 8.366 9.985 -11.877 1.00 0.00 H new ATOM 0 HD3 LYS B 56 9.933 9.222 -11.700 1.00 0.00 H new ATOM 0 HE2 LYS B 56 9.016 8.485 -13.833 1.00 0.00 H new ATOM 0 HE3 LYS B 56 8.959 7.111 -12.746 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 6.762 7.033 -13.003 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 6.598 8.608 -12.390 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 6.817 8.364 -14.056 1.00 0.00 H new ATOM 1575 N LYS B 57 7.256 12.009 -7.891 1.00 0.00 N ATOM 1576 CA LYS B 57 6.571 13.283 -7.713 1.00 0.00 C ATOM 1577 C LYS B 57 7.591 14.412 -7.622 1.00 0.00 C ATOM 1578 O LYS B 57 7.421 15.469 -8.229 1.00 0.00 O ATOM 1579 CB LYS B 57 5.719 13.247 -6.440 1.00 0.00 C ATOM 1580 CG LYS B 57 4.968 14.573 -6.280 1.00 0.00 C ATOM 1581 CD LYS B 57 4.083 14.511 -5.035 1.00 0.00 C ATOM 1582 CE LYS B 57 3.315 15.827 -4.888 1.00 0.00 C ATOM 1583 NZ LYS B 57 4.279 16.944 -4.680 1.00 0.00 N ATOM 0 H LYS B 57 7.090 11.327 -7.150 1.00 0.00 H new ATOM 0 HA LYS B 57 5.921 13.458 -8.570 1.00 0.00 H new ATOM 0 HB2 LYS B 57 5.010 12.421 -6.489 1.00 0.00 H new ATOM 0 HB3 LYS B 57 6.354 13.071 -5.572 1.00 0.00 H new ATOM 0 HG2 LYS B 57 5.677 15.397 -6.195 1.00 0.00 H new ATOM 0 HG3 LYS B 57 4.359 14.767 -7.163 1.00 0.00 H new ATOM 0 HD2 LYS B 57 3.385 13.677 -5.113 1.00 0.00 H new ATOM 0 HD3 LYS B 57 4.694 14.333 -4.150 1.00 0.00 H new ATOM 0 HE2 LYS B 57 2.715 16.012 -5.779 1.00 0.00 H new ATOM 0 HE3 LYS B 57 2.625 15.766 -4.046 1.00 0.00 H new ATOM 0 HZ1 LYS B 57 3.786 17.753 -4.252 1.00 0.00 H new ATOM 0 HZ2 LYS B 57 5.043 16.630 -4.048 1.00 0.00 H new ATOM 0 HZ3 LYS B 57 4.682 17.230 -5.595 1.00 0.00 H new ATOM 1597 N ALA B 58 8.654 14.175 -6.861 1.00 0.00 N ATOM 1598 CA ALA B 58 9.702 15.172 -6.697 1.00 0.00 C ATOM 1599 C ALA B 58 10.885 14.855 -7.606 1.00 0.00 C ATOM 1600 O ALA B 58 12.037 14.895 -7.176 1.00 0.00 O ATOM 1601 CB ALA B 58 10.170 15.205 -5.241 1.00 0.00 C ATOM 0 H ALA B 58 8.811 13.306 -6.351 1.00 0.00 H new ATOM 0 HA ALA B 58 9.297 16.147 -6.969 1.00 0.00 H new ATOM 0 HB1 ALA B 58 10.954 15.954 -5.128 1.00 0.00 H new ATOM 0 HB2 ALA B 58 9.330 15.459 -4.594 1.00 0.00 H new ATOM 0 HB3 ALA B 58 10.560 14.226 -4.962 1.00 0.00 H new ATOM 1607 N GLY B 59 10.593 14.538 -8.864 1.00 0.00 N ATOM 1608 CA GLY B 59 11.646 14.215 -9.819 1.00 0.00 C ATOM 1609 C GLY B 59 12.593 15.397 -9.985 1.00 0.00 C ATOM 1610 O GLY B 59 13.810 15.228 -10.043 1.00 0.00 O ATOM 0 H GLY B 59 9.647 14.498 -9.242 1.00 0.00 H new ATOM 0 HA2 GLY B 59 12.201 13.342 -9.477 1.00 0.00 H new ATOM 0 HA3 GLY B 59 11.206 13.956 -10.782 1.00 0.00 H new ATOM 1614 N SER B 60 12.024 16.597 -10.045 1.00 0.00 N ATOM 1615 CA SER B 60 12.828 17.803 -10.184 1.00 0.00 C ATOM 1616 C SER B 60 12.226 18.936 -9.361 1.00 0.00 C ATOM 1617 O SER B 60 11.033 19.223 -9.463 1.00 0.00 O ATOM 1618 CB SER B 60 12.896 18.217 -11.655 1.00 0.00 C ATOM 1619 OG SER B 60 11.583 18.488 -12.128 1.00 0.00 O ATOM 0 H SER B 60 11.018 16.758 -10.000 1.00 0.00 H new ATOM 0 HA SER B 60 13.834 17.596 -9.820 1.00 0.00 H new ATOM 0 HB2 SER B 60 13.525 19.100 -11.767 1.00 0.00 H new ATOM 0 HB3 SER B 60 13.352 17.424 -12.247 1.00 0.00 H new ATOM 0 HG SER B 60 11.003 18.713 -11.371 1.00 0.00 H new ATOM 1625 N GLN B 61 13.059 19.576 -8.549 1.00 0.00 N ATOM 1626 CA GLN B 61 12.598 20.679 -7.715 1.00 0.00 C ATOM 1627 C GLN B 61 12.203 21.877 -8.572 1.00 0.00 C ATOM 1628 O GLN B 61 11.218 22.558 -8.288 1.00 0.00 O ATOM 1629 CB GLN B 61 13.695 21.080 -6.728 1.00 0.00 C ATOM 1630 CG GLN B 61 13.871 19.968 -5.693 1.00 0.00 C ATOM 1631 CD GLN B 61 14.961 20.344 -4.697 1.00 0.00 C ATOM 1632 OE1 GLN B 61 15.034 21.491 -4.258 1.00 0.00 O ATOM 1633 NE2 GLN B 61 15.817 19.438 -4.308 1.00 0.00 N ATOM 0 H GLN B 61 14.049 19.353 -8.450 1.00 0.00 H new ATOM 0 HA GLN B 61 11.719 20.349 -7.161 1.00 0.00 H new ATOM 0 HB2 GLN B 61 14.632 21.252 -7.258 1.00 0.00 H new ATOM 0 HB3 GLN B 61 13.432 22.015 -6.234 1.00 0.00 H new ATOM 0 HG2 GLN B 61 12.931 19.798 -5.168 1.00 0.00 H new ATOM 0 HG3 GLN B 61 14.131 19.034 -6.192 1.00 0.00 H new ATOM 0 HE21 GLN B 61 15.755 18.488 -4.673 1.00 0.00 H new ATOM 0 HE22 GLN B 61 16.548 19.681 -3.639 1.00 0.00 H new ATOM 1642 N SER B 62 12.982 22.129 -9.620 1.00 0.00 N ATOM 1643 CA SER B 62 12.709 23.248 -10.514 1.00 0.00 C ATOM 1644 C SER B 62 12.083 22.756 -11.815 1.00 0.00 C ATOM 1645 O SER B 62 11.319 23.506 -12.402 1.00 0.00 O ATOM 1646 CB SER B 62 14.007 23.997 -10.821 1.00 0.00 C ATOM 1647 OG SER B 62 14.551 24.508 -9.613 1.00 0.00 O ATOM 1648 OXT SER B 62 12.375 21.638 -12.205 1.00 0.00 O ATOM 0 H SER B 62 13.802 21.577 -9.870 1.00 0.00 H new ATOM 0 HA SER B 62 12.008 23.921 -10.020 1.00 0.00 H new ATOM 0 HB2 SER B 62 14.722 23.328 -11.301 1.00 0.00 H new ATOM 0 HB3 SER B 62 13.814 24.811 -11.519 1.00 0.00 H new ATOM 0 HG SER B 62 15.384 24.987 -9.806 1.00 0.00 H new TER 1654 SER B 62