USER MOD reduce.3.24.130724 H: found=0, std=0, add=1038, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1029 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 64 SER OG : rot -79:sc= -0.274 USER MOD Set 1.2: A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 151:sc= 0.0708 (180deg=0) USER MOD Single : A 3 SER OG : rot 24:sc= 1.25 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 HIS : no HE2:sc= 0.539 K(o=0.54,f=-2.2!) USER MOD Single : A 8 HIS : no HD1:sc= -0.623 K(o=-0.62,f=-2.1!) USER MOD Single : A 9 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 10 HIS : no HD1:sc= -0.0233 X(o=-0.023,f=-0.16) USER MOD Single : A 11 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 12 HIS : no HD1:sc= -0.036 X(o=-0.036,f=-0.5) USER MOD Single : A 13 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl -172:sc= -0.0686 (180deg=-0.184) USER MOD Single : A 28 ASN : amide:sc= 0.885 K(o=0.89,f=-5.6!) USER MOD Single : A 29 LYS NZ :NH3+ -143:sc= 1.22 (180deg=0.316) USER MOD Single : A 32 ASN : amide:sc= 0.374 K(o=0.37,f=-6.1!) USER MOD Single : A 35 ASN : amide:sc= -0.039 X(o=-0.039,f=-0.043) USER MOD Single : A 37 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN : amide:sc= 0.736 K(o=0.74,f=-0.26) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 TYR OH : rot 30:sc= 0 USER MOD Single : A 53 ASN : amide:sc= -0.341 X(o=-0.34,f=0) USER MOD Single : A 54 LYS NZ :NH3+ -155:sc= 0.0632 (180deg=-0.737!) USER MOD Single : A 60 SER OG : rot 180:sc= -0.291 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot -170:sc= -0.262 USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00808) USER MOD Single : A 79 SER OG : rot 55:sc= 0.92 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 85:sc= 0.0194 USER MOD Single : A 83 SER OG : rot 68:sc= 1.23 USER MOD Single : A 91 SER OG : rot 160:sc= 0 USER MOD Single : A 93 ASN : amide:sc= -0.288 K(o=-0.29,f=-0.82) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -16:sc= 0.14 USER MOD Single : A 104 ASN : amide:sc= -0.847 K(o=-0.85,f=-0.018) USER MOD Single : A 110 LYS NZ :NH3+ -162:sc= 0 (180deg=-0.175) USER MOD Single : A 112 TYR OH : rot 30:sc= -0.0056 USER MOD Single : A 114 THR OG1 : rot -86:sc= 1.6 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 MET CE :methyl -174:sc= 0 (180deg=-0.0244) USER MOD Single : A 125 LYS NZ :NH3+ 141:sc= -0.336 (180deg=-3.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -23.015 -0.868 15.159 1.00 0.00 N ATOM 2 CA MET A 1 -22.509 -1.818 14.155 1.00 0.00 C ATOM 3 C MET A 1 -22.514 -1.052 12.846 1.00 0.00 C ATOM 4 O MET A 1 -23.550 -0.476 12.530 1.00 0.00 O ATOM 5 CB MET A 1 -23.398 -3.078 14.103 1.00 0.00 C ATOM 6 CG MET A 1 -22.744 -4.279 13.405 1.00 0.00 C ATOM 7 SD MET A 1 -22.397 -4.084 11.638 1.00 0.00 S ATOM 8 CE MET A 1 -21.742 -5.733 11.260 1.00 0.00 C ATOM 0 H1 MET A 1 -23.495 -1.390 15.920 1.00 0.00 H new ATOM 0 H2 MET A 1 -22.220 -0.328 15.558 1.00 0.00 H new ATOM 0 H3 MET A 1 -23.687 -0.214 14.710 1.00 0.00 H new ATOM 0 HA MET A 1 -21.508 -2.180 14.388 1.00 0.00 H new ATOM 0 HB2 MET A 1 -23.664 -3.364 15.121 1.00 0.00 H new ATOM 0 HB3 MET A 1 -24.327 -2.833 13.587 1.00 0.00 H new ATOM 0 HG2 MET A 1 -21.808 -4.504 13.915 1.00 0.00 H new ATOM 0 HG3 MET A 1 -23.393 -5.145 13.533 1.00 0.00 H new ATOM 0 HE1 MET A 1 -21.476 -5.786 10.204 1.00 0.00 H new ATOM 0 HE2 MET A 1 -20.856 -5.920 11.867 1.00 0.00 H new ATOM 0 HE3 MET A 1 -22.499 -6.485 11.482 1.00 0.00 H new ATOM 18 N GLY A 2 -21.376 -0.971 12.161 1.00 0.00 N ATOM 19 CA GLY A 2 -21.242 -0.311 10.871 1.00 0.00 C ATOM 20 C GLY A 2 -20.273 -1.099 9.993 1.00 0.00 C ATOM 21 O GLY A 2 -19.670 -2.079 10.449 1.00 0.00 O ATOM 0 H GLY A 2 -20.502 -1.373 12.499 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -22.215 -0.240 10.384 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -20.879 0.708 11.008 1.00 0.00 H new ATOM 25 N SER A 3 -20.128 -0.693 8.737 1.00 0.00 N ATOM 26 CA SER A 3 -19.094 -1.134 7.796 1.00 0.00 C ATOM 27 C SER A 3 -18.937 -0.169 6.609 1.00 0.00 C ATOM 28 O SER A 3 -18.005 -0.340 5.829 1.00 0.00 O ATOM 29 CB SER A 3 -19.377 -2.563 7.306 1.00 0.00 C ATOM 30 OG SER A 3 -18.997 -3.505 8.294 1.00 0.00 O ATOM 0 H SER A 3 -20.761 -0.010 8.321 1.00 0.00 H new ATOM 0 HA SER A 3 -18.147 -1.132 8.336 1.00 0.00 H new ATOM 0 HB2 SER A 3 -20.437 -2.673 7.077 1.00 0.00 H new ATOM 0 HB3 SER A 3 -18.830 -2.753 6.383 1.00 0.00 H new ATOM 0 HG SER A 3 -18.996 -3.074 9.174 1.00 0.00 H new ATOM 36 N ASP A 4 -19.803 0.840 6.481 1.00 0.00 N ATOM 37 CA ASP A 4 -19.431 2.246 6.298 1.00 0.00 C ATOM 38 C ASP A 4 -18.367 2.463 5.212 1.00 0.00 C ATOM 39 O ASP A 4 -17.306 3.026 5.465 1.00 0.00 O ATOM 40 CB ASP A 4 -19.035 2.866 7.665 1.00 0.00 C ATOM 41 CG ASP A 4 -19.975 2.549 8.841 1.00 0.00 C ATOM 42 OD1 ASP A 4 -21.049 1.945 8.610 1.00 0.00 O ATOM 43 OD2 ASP A 4 -19.552 2.763 9.998 1.00 0.00 O ATOM 0 H ASP A 4 -20.813 0.697 6.502 1.00 0.00 H new ATOM 0 HA ASP A 4 -20.307 2.774 5.922 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -18.033 2.522 7.922 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -18.980 3.948 7.550 1.00 0.00 H new ATOM 48 N LYS A 5 -18.631 1.992 3.985 1.00 0.00 N ATOM 49 CA LYS A 5 -17.709 2.131 2.850 1.00 0.00 C ATOM 50 C LYS A 5 -17.474 3.608 2.528 1.00 0.00 C ATOM 51 O LYS A 5 -16.379 4.115 2.753 1.00 0.00 O ATOM 52 CB LYS A 5 -18.212 1.350 1.617 1.00 0.00 C ATOM 53 CG LYS A 5 -17.585 -0.044 1.443 1.00 0.00 C ATOM 54 CD LYS A 5 -17.772 -0.987 2.638 1.00 0.00 C ATOM 55 CE LYS A 5 -17.322 -2.402 2.254 1.00 0.00 C ATOM 56 NZ LYS A 5 -17.496 -3.384 3.345 1.00 0.00 N ATOM 0 H LYS A 5 -19.494 1.502 3.751 1.00 0.00 H new ATOM 0 HA LYS A 5 -16.751 1.694 3.133 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -19.294 1.241 1.689 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -18.010 1.939 0.723 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -18.015 -0.512 0.558 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -16.518 0.074 1.255 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -17.194 -0.629 3.490 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -18.818 -0.998 2.945 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -17.888 -2.732 1.383 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -16.272 -2.376 1.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -17.175 -4.320 3.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -16.936 -3.089 4.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -18.501 -3.435 3.609 1.00 0.00 H new ATOM 70 N ILE A 6 -18.505 4.292 2.020 1.00 0.00 N ATOM 71 CA ILE A 6 -18.408 5.575 1.330 1.00 0.00 C ATOM 72 C ILE A 6 -17.375 5.425 0.196 1.00 0.00 C ATOM 73 O ILE A 6 -17.746 4.921 -0.867 1.00 0.00 O ATOM 74 CB ILE A 6 -18.217 6.767 2.310 1.00 0.00 C ATOM 75 CG1 ILE A 6 -19.336 6.904 3.376 1.00 0.00 C ATOM 76 CG2 ILE A 6 -18.177 8.101 1.537 1.00 0.00 C ATOM 77 CD1 ILE A 6 -19.183 6.005 4.611 1.00 0.00 C ATOM 0 H ILE A 6 -19.464 3.951 2.083 1.00 0.00 H new ATOM 0 HA ILE A 6 -19.350 5.847 0.854 1.00 0.00 H new ATOM 0 HB ILE A 6 -17.278 6.553 2.820 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -19.375 7.942 3.706 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -20.293 6.684 2.904 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -18.043 8.924 2.239 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -17.347 8.087 0.831 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -19.113 8.235 0.995 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -20.016 6.178 5.293 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -19.178 4.960 4.302 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -18.246 6.238 5.117 1.00 0.00 H new ATOM 89 N HIS A 7 -16.106 5.803 0.386 1.00 0.00 N ATOM 90 CA HIS A 7 -15.063 5.527 -0.597 1.00 0.00 C ATOM 91 C HIS A 7 -14.840 4.013 -0.705 1.00 0.00 C ATOM 92 O HIS A 7 -14.806 3.304 0.306 1.00 0.00 O ATOM 93 CB HIS A 7 -13.771 6.295 -0.256 1.00 0.00 C ATOM 94 CG HIS A 7 -13.208 6.120 1.141 1.00 0.00 C ATOM 95 ND1 HIS A 7 -13.474 5.097 2.026 1.00 0.00 N ATOM 96 CD2 HIS A 7 -12.367 6.997 1.773 1.00 0.00 C ATOM 97 CE1 HIS A 7 -12.809 5.346 3.164 1.00 0.00 C ATOM 98 NE2 HIS A 7 -12.117 6.496 3.060 1.00 0.00 N ATOM 0 H HIS A 7 -15.780 6.301 1.214 1.00 0.00 H new ATOM 0 HA HIS A 7 -15.383 5.883 -1.576 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -13.003 5.997 -0.969 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -13.958 7.357 -0.414 1.00 0.00 H new ATOM 0 HD1 HIS A 7 -14.073 4.291 1.847 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -11.968 7.910 1.356 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -12.826 4.714 4.039 1.00 0.00 H new ATOM 106 N HIS A 8 -14.629 3.504 -1.915 1.00 0.00 N ATOM 107 CA HIS A 8 -14.210 2.130 -2.160 1.00 0.00 C ATOM 108 C HIS A 8 -12.923 2.147 -2.976 1.00 0.00 C ATOM 109 O HIS A 8 -12.588 3.166 -3.581 1.00 0.00 O ATOM 110 CB HIS A 8 -15.348 1.319 -2.796 1.00 0.00 C ATOM 111 CG HIS A 8 -15.728 1.661 -4.218 1.00 0.00 C ATOM 112 ND1 HIS A 8 -14.915 2.177 -5.207 1.00 0.00 N ATOM 113 CD2 HIS A 8 -16.939 1.374 -4.786 1.00 0.00 C ATOM 114 CE1 HIS A 8 -15.616 2.168 -6.351 1.00 0.00 C ATOM 115 NE2 HIS A 8 -16.852 1.673 -6.149 1.00 0.00 N ATOM 0 H HIS A 8 -14.747 4.048 -2.770 1.00 0.00 H new ATOM 0 HA HIS A 8 -13.989 1.619 -1.223 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -15.071 0.265 -2.764 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -16.234 1.434 -2.172 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -17.807 0.986 -4.273 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -15.240 2.511 -7.304 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -17.580 1.542 -6.851 1.00 0.00 H new ATOM 123 N HIS A 9 -12.239 1.005 -3.064 1.00 0.00 N ATOM 124 CA HIS A 9 -10.869 0.913 -3.561 1.00 0.00 C ATOM 125 C HIS A 9 -9.911 1.841 -2.809 1.00 0.00 C ATOM 126 O HIS A 9 -10.257 2.482 -1.811 1.00 0.00 O ATOM 127 CB HIS A 9 -10.829 1.070 -5.093 1.00 0.00 C ATOM 128 CG HIS A 9 -11.224 -0.211 -5.756 1.00 0.00 C ATOM 129 ND1 HIS A 9 -10.385 -1.287 -5.935 1.00 0.00 N ATOM 130 CD2 HIS A 9 -12.484 -0.578 -6.137 1.00 0.00 C ATOM 131 CE1 HIS A 9 -11.115 -2.297 -6.421 1.00 0.00 C ATOM 132 NE2 HIS A 9 -12.400 -1.917 -6.523 1.00 0.00 N ATOM 0 H HIS A 9 -12.630 0.104 -2.787 1.00 0.00 H new ATOM 0 HA HIS A 9 -10.497 -0.089 -3.349 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -11.502 1.870 -5.401 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -9.827 1.358 -5.410 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -13.367 0.043 -6.139 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -10.730 -3.270 -6.690 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -13.177 -2.503 -6.828 1.00 0.00 H new ATOM 140 N HIS A 10 -8.650 1.826 -3.227 1.00 0.00 N ATOM 141 CA HIS A 10 -7.594 2.683 -2.732 1.00 0.00 C ATOM 142 C HIS A 10 -6.941 3.279 -3.974 1.00 0.00 C ATOM 143 O HIS A 10 -6.793 2.592 -4.992 1.00 0.00 O ATOM 144 CB HIS A 10 -6.612 1.873 -1.868 1.00 0.00 C ATOM 145 CG HIS A 10 -6.128 2.575 -0.621 1.00 0.00 C ATOM 146 ND1 HIS A 10 -5.945 3.930 -0.429 1.00 0.00 N ATOM 147 CD2 HIS A 10 -5.802 1.951 0.552 1.00 0.00 C ATOM 148 CE1 HIS A 10 -5.509 4.111 0.828 1.00 0.00 C ATOM 149 NE2 HIS A 10 -5.390 2.932 1.466 1.00 0.00 N ATOM 0 H HIS A 10 -8.328 1.185 -3.953 1.00 0.00 H new ATOM 0 HA HIS A 10 -7.962 3.477 -2.082 1.00 0.00 H new ATOM 0 HB2 HIS A 10 -7.093 0.939 -1.577 1.00 0.00 H new ATOM 0 HB3 HIS A 10 -5.747 1.610 -2.477 1.00 0.00 H new ATOM 0 HD2 HIS A 10 -5.853 0.889 0.741 1.00 0.00 H new ATOM 0 HE1 HIS A 10 -5.284 5.072 1.267 1.00 0.00 H new ATOM 0 HE2 HIS A 10 -5.066 2.782 2.421 1.00 0.00 H new ATOM 157 N HIS A 11 -6.603 4.560 -3.903 1.00 0.00 N ATOM 158 CA HIS A 11 -6.041 5.338 -4.987 1.00 0.00 C ATOM 159 C HIS A 11 -4.902 6.156 -4.398 1.00 0.00 C ATOM 160 O HIS A 11 -5.036 7.355 -4.165 1.00 0.00 O ATOM 161 CB HIS A 11 -7.135 6.201 -5.634 1.00 0.00 C ATOM 162 CG HIS A 11 -8.171 5.373 -6.348 1.00 0.00 C ATOM 163 ND1 HIS A 11 -8.034 4.865 -7.617 1.00 0.00 N ATOM 164 CD2 HIS A 11 -9.350 4.905 -5.831 1.00 0.00 C ATOM 165 CE1 HIS A 11 -9.112 4.102 -7.862 1.00 0.00 C ATOM 166 NE2 HIS A 11 -9.931 4.080 -6.799 1.00 0.00 N ATOM 0 H HIS A 11 -6.720 5.104 -3.048 1.00 0.00 H new ATOM 0 HA HIS A 11 -5.648 4.709 -5.786 1.00 0.00 H new ATOM 0 HB2 HIS A 11 -7.621 6.803 -4.866 1.00 0.00 H new ATOM 0 HB3 HIS A 11 -6.677 6.894 -6.340 1.00 0.00 H new ATOM 0 HD2 HIS A 11 -9.756 5.131 -4.856 1.00 0.00 H new ATOM 0 HE1 HIS A 11 -9.295 3.578 -8.788 1.00 0.00 H new ATOM 0 HE2 HIS A 11 -10.806 3.563 -6.714 1.00 0.00 H new ATOM 174 N HIS A 12 -3.792 5.487 -4.102 1.00 0.00 N ATOM 175 CA HIS A 12 -2.541 6.107 -3.700 1.00 0.00 C ATOM 176 C HIS A 12 -1.483 5.669 -4.711 1.00 0.00 C ATOM 177 O HIS A 12 -0.975 6.516 -5.440 1.00 0.00 O ATOM 178 CB HIS A 12 -2.218 5.759 -2.234 1.00 0.00 C ATOM 179 CG HIS A 12 -1.349 6.783 -1.548 1.00 0.00 C ATOM 180 ND1 HIS A 12 -1.586 7.343 -0.309 1.00 0.00 N ATOM 181 CD2 HIS A 12 -0.176 7.301 -2.025 1.00 0.00 C ATOM 182 CE1 HIS A 12 -0.570 8.180 -0.039 1.00 0.00 C ATOM 183 NE2 HIS A 12 0.294 8.203 -1.066 1.00 0.00 N ATOM 0 H HIS A 12 -3.740 4.469 -4.137 1.00 0.00 H new ATOM 0 HA HIS A 12 -2.589 7.196 -3.715 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -3.151 5.656 -1.680 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -1.719 4.790 -2.201 1.00 0.00 H new ATOM 0 HD2 HIS A 12 0.297 7.059 -2.965 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -0.464 8.751 0.872 1.00 0.00 H new ATOM 0 HE2 HIS A 12 1.137 8.773 -1.134 1.00 0.00 H new ATOM 191 N MET A 13 -1.265 4.355 -4.854 1.00 0.00 N ATOM 192 CA MET A 13 -0.206 3.700 -5.631 1.00 0.00 C ATOM 193 C MET A 13 1.200 4.195 -5.273 1.00 0.00 C ATOM 194 O MET A 13 1.376 5.048 -4.400 1.00 0.00 O ATOM 195 CB MET A 13 -0.476 3.738 -7.152 1.00 0.00 C ATOM 196 CG MET A 13 -0.098 5.046 -7.868 1.00 0.00 C ATOM 197 SD MET A 13 0.280 4.870 -9.629 1.00 0.00 S ATOM 198 CE MET A 13 1.051 6.491 -9.896 1.00 0.00 C ATOM 0 H MET A 13 -1.869 3.673 -4.396 1.00 0.00 H new ATOM 0 HA MET A 13 -0.234 2.650 -5.338 1.00 0.00 H new ATOM 0 HB2 MET A 13 0.071 2.919 -7.619 1.00 0.00 H new ATOM 0 HB3 MET A 13 -1.536 3.549 -7.318 1.00 0.00 H new ATOM 0 HG2 MET A 13 -0.919 5.754 -7.757 1.00 0.00 H new ATOM 0 HG3 MET A 13 0.767 5.480 -7.367 1.00 0.00 H new ATOM 0 HE1 MET A 13 1.358 6.580 -10.938 1.00 0.00 H new ATOM 0 HE2 MET A 13 0.335 7.278 -9.660 1.00 0.00 H new ATOM 0 HE3 MET A 13 1.924 6.590 -9.250 1.00 0.00 H new ATOM 208 N PHE A 14 2.212 3.657 -5.953 1.00 0.00 N ATOM 209 CA PHE A 14 3.568 4.173 -5.925 1.00 0.00 C ATOM 210 C PHE A 14 4.249 3.778 -7.247 1.00 0.00 C ATOM 211 O PHE A 14 3.922 2.710 -7.766 1.00 0.00 O ATOM 212 CB PHE A 14 4.301 3.556 -4.725 1.00 0.00 C ATOM 213 CG PHE A 14 5.393 4.455 -4.210 1.00 0.00 C ATOM 214 CD1 PHE A 14 5.075 5.466 -3.288 1.00 0.00 C ATOM 215 CD2 PHE A 14 6.678 4.392 -4.771 1.00 0.00 C ATOM 216 CE1 PHE A 14 6.034 6.431 -2.951 1.00 0.00 C ATOM 217 CE2 PHE A 14 7.612 5.397 -4.484 1.00 0.00 C ATOM 218 CZ PHE A 14 7.292 6.419 -3.574 1.00 0.00 C ATOM 0 H PHE A 14 2.104 2.835 -6.548 1.00 0.00 H new ATOM 0 HA PHE A 14 3.584 5.258 -5.821 1.00 0.00 H new ATOM 0 HB2 PHE A 14 3.587 3.359 -3.926 1.00 0.00 H new ATOM 0 HB3 PHE A 14 4.728 2.596 -5.015 1.00 0.00 H new ATOM 0 HD1 PHE A 14 4.093 5.500 -2.840 1.00 0.00 H new ATOM 0 HD2 PHE A 14 6.946 3.572 -5.421 1.00 0.00 H new ATOM 0 HE1 PHE A 14 5.805 7.184 -2.212 1.00 0.00 H new ATOM 0 HE2 PHE A 14 8.580 5.386 -4.963 1.00 0.00 H new ATOM 0 HZ PHE A 14 8.012 7.193 -3.354 1.00 0.00 H new ATOM 228 N PRO A 15 5.180 4.565 -7.811 1.00 0.00 N ATOM 229 CA PRO A 15 5.961 4.152 -8.977 1.00 0.00 C ATOM 230 C PRO A 15 7.049 3.123 -8.637 1.00 0.00 C ATOM 231 O PRO A 15 7.850 3.296 -7.711 1.00 0.00 O ATOM 232 CB PRO A 15 6.575 5.432 -9.540 1.00 0.00 C ATOM 233 CG PRO A 15 6.633 6.353 -8.331 1.00 0.00 C ATOM 234 CD PRO A 15 5.407 5.971 -7.513 1.00 0.00 C ATOM 0 HA PRO A 15 5.319 3.650 -9.701 1.00 0.00 H new ATOM 0 HB2 PRO A 15 7.566 5.253 -9.957 1.00 0.00 H new ATOM 0 HB3 PRO A 15 5.964 5.854 -10.338 1.00 0.00 H new ATOM 0 HG2 PRO A 15 7.552 6.208 -7.763 1.00 0.00 H new ATOM 0 HG3 PRO A 15 6.604 7.402 -8.627 1.00 0.00 H new ATOM 0 HD2 PRO A 15 5.579 6.126 -6.448 1.00 0.00 H new ATOM 0 HD3 PRO A 15 4.544 6.577 -7.788 1.00 0.00 H new ATOM 242 N TYR A 16 7.124 2.062 -9.438 1.00 0.00 N ATOM 243 CA TYR A 16 8.107 0.994 -9.325 1.00 0.00 C ATOM 244 C TYR A 16 8.311 0.358 -10.703 1.00 0.00 C ATOM 245 O TYR A 16 7.616 0.697 -11.668 1.00 0.00 O ATOM 246 CB TYR A 16 7.614 0.001 -8.250 1.00 0.00 C ATOM 247 CG TYR A 16 6.338 -0.757 -8.562 1.00 0.00 C ATOM 248 CD1 TYR A 16 6.368 -1.964 -9.281 1.00 0.00 C ATOM 249 CD2 TYR A 16 5.114 -0.270 -8.079 1.00 0.00 C ATOM 250 CE1 TYR A 16 5.175 -2.668 -9.534 1.00 0.00 C ATOM 251 CE2 TYR A 16 3.917 -0.973 -8.307 1.00 0.00 C ATOM 252 CZ TYR A 16 3.943 -2.181 -9.039 1.00 0.00 C ATOM 253 OH TYR A 16 2.796 -2.888 -9.247 1.00 0.00 O ATOM 0 H TYR A 16 6.475 1.920 -10.212 1.00 0.00 H new ATOM 0 HA TYR A 16 9.082 1.362 -9.006 1.00 0.00 H new ATOM 0 HB2 TYR A 16 8.406 -0.725 -8.068 1.00 0.00 H new ATOM 0 HB3 TYR A 16 7.465 0.551 -7.321 1.00 0.00 H new ATOM 0 HD1 TYR A 16 7.309 -2.353 -9.641 1.00 0.00 H new ATOM 0 HD2 TYR A 16 5.090 0.657 -7.525 1.00 0.00 H new ATOM 0 HE1 TYR A 16 5.201 -3.583 -10.108 1.00 0.00 H new ATOM 0 HE2 TYR A 16 2.982 -0.591 -7.924 1.00 0.00 H new ATOM 0 HH TYR A 16 2.041 -2.413 -8.841 1.00 0.00 H new ATOM 263 N LYS A 17 9.277 -0.554 -10.810 1.00 0.00 N ATOM 264 CA LYS A 17 9.330 -1.581 -11.846 1.00 0.00 C ATOM 265 C LYS A 17 9.550 -2.915 -11.169 1.00 0.00 C ATOM 266 O LYS A 17 9.829 -2.977 -9.968 1.00 0.00 O ATOM 267 CB LYS A 17 10.384 -1.310 -12.942 1.00 0.00 C ATOM 268 CG LYS A 17 11.851 -1.666 -12.618 1.00 0.00 C ATOM 269 CD LYS A 17 12.665 -1.923 -13.888 1.00 0.00 C ATOM 270 CE LYS A 17 12.967 -0.628 -14.639 1.00 0.00 C ATOM 271 NZ LYS A 17 13.332 -0.877 -16.044 1.00 0.00 N ATOM 0 H LYS A 17 10.063 -0.599 -10.162 1.00 0.00 H new ATOM 0 HA LYS A 17 8.381 -1.577 -12.383 1.00 0.00 H new ATOM 0 HB2 LYS A 17 10.092 -1.863 -13.835 1.00 0.00 H new ATOM 0 HB3 LYS A 17 10.342 -0.251 -13.195 1.00 0.00 H new ATOM 0 HG2 LYS A 17 12.306 -0.853 -12.052 1.00 0.00 H new ATOM 0 HG3 LYS A 17 11.879 -2.551 -11.983 1.00 0.00 H new ATOM 0 HD2 LYS A 17 13.600 -2.418 -13.627 1.00 0.00 H new ATOM 0 HD3 LYS A 17 12.116 -2.602 -14.540 1.00 0.00 H new ATOM 0 HE2 LYS A 17 12.095 0.025 -14.601 1.00 0.00 H new ATOM 0 HE3 LYS A 17 13.781 -0.101 -14.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 13.529 0.028 -16.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 14.179 -1.479 -16.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 12.546 -1.356 -16.527 1.00 0.00 H new ATOM 285 N ILE A 18 9.534 -3.964 -11.970 1.00 0.00 N ATOM 286 CA ILE A 18 10.053 -5.256 -11.601 1.00 0.00 C ATOM 287 C ILE A 18 11.065 -5.605 -12.707 1.00 0.00 C ATOM 288 O ILE A 18 11.055 -5.031 -13.805 1.00 0.00 O ATOM 289 CB ILE A 18 8.872 -6.244 -11.407 1.00 0.00 C ATOM 290 CG1 ILE A 18 7.659 -5.615 -10.665 1.00 0.00 C ATOM 291 CG2 ILE A 18 9.344 -7.478 -10.621 1.00 0.00 C ATOM 292 CD1 ILE A 18 6.492 -6.570 -10.382 1.00 0.00 C ATOM 0 H ILE A 18 9.150 -3.935 -12.915 1.00 0.00 H new ATOM 0 HA ILE A 18 10.575 -5.294 -10.645 1.00 0.00 H new ATOM 0 HB ILE A 18 8.539 -6.520 -12.407 1.00 0.00 H new ATOM 0 HG12 ILE A 18 8.008 -5.204 -9.718 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.287 -4.779 -11.257 1.00 0.00 H new ATOM 0 HG21 ILE A 18 8.509 -8.166 -10.489 1.00 0.00 H new ATOM 0 HG22 ILE A 18 10.142 -7.976 -11.171 1.00 0.00 H new ATOM 0 HG23 ILE A 18 9.716 -7.167 -9.645 1.00 0.00 H new ATOM 0 HD11 ILE A 18 5.699 -6.032 -9.862 1.00 0.00 H new ATOM 0 HD12 ILE A 18 6.107 -6.963 -11.323 1.00 0.00 H new ATOM 0 HD13 ILE A 18 6.839 -7.395 -9.760 1.00 0.00 H new ATOM 304 N VAL A 19 12.006 -6.489 -12.407 1.00 0.00 N ATOM 305 CA VAL A 19 12.895 -7.132 -13.347 1.00 0.00 C ATOM 306 C VAL A 19 12.574 -8.635 -13.259 1.00 0.00 C ATOM 307 O VAL A 19 11.395 -8.981 -13.119 1.00 0.00 O ATOM 308 CB VAL A 19 14.338 -6.680 -13.043 1.00 0.00 C ATOM 309 CG1 VAL A 19 14.535 -5.178 -13.342 1.00 0.00 C ATOM 310 CG2 VAL A 19 14.814 -6.967 -11.616 1.00 0.00 C ATOM 0 H VAL A 19 12.174 -6.789 -11.447 1.00 0.00 H new ATOM 0 HA VAL A 19 12.766 -6.856 -14.394 1.00 0.00 H new ATOM 0 HB VAL A 19 14.951 -7.287 -13.710 1.00 0.00 H new ATOM 0 HG11 VAL A 19 15.563 -4.894 -13.116 1.00 0.00 H new ATOM 0 HG12 VAL A 19 14.328 -4.986 -14.395 1.00 0.00 H new ATOM 0 HG13 VAL A 19 13.853 -4.592 -12.726 1.00 0.00 H new ATOM 0 HG21 VAL A 19 15.838 -6.615 -11.496 1.00 0.00 H new ATOM 0 HG22 VAL A 19 14.167 -6.451 -10.906 1.00 0.00 H new ATOM 0 HG23 VAL A 19 14.775 -8.040 -11.428 1.00 0.00 H new ATOM 320 N ASP A 20 13.561 -9.524 -13.362 1.00 0.00 N ATOM 321 CA ASP A 20 13.436 -10.975 -13.391 1.00 0.00 C ATOM 322 C ASP A 20 12.522 -11.493 -12.293 1.00 0.00 C ATOM 323 O ASP A 20 11.420 -11.979 -12.562 1.00 0.00 O ATOM 324 CB ASP A 20 14.826 -11.612 -13.292 1.00 0.00 C ATOM 325 CG ASP A 20 15.531 -11.458 -14.625 1.00 0.00 C ATOM 326 OD1 ASP A 20 16.073 -10.367 -14.893 1.00 0.00 O ATOM 327 OD2 ASP A 20 15.405 -12.366 -15.477 1.00 0.00 O ATOM 0 H ASP A 20 14.534 -9.226 -13.432 1.00 0.00 H new ATOM 0 HA ASP A 20 12.976 -11.256 -14.338 1.00 0.00 H new ATOM 0 HB2 ASP A 20 15.405 -11.134 -12.502 1.00 0.00 H new ATOM 0 HB3 ASP A 20 14.740 -12.667 -13.030 1.00 0.00 H new ATOM 332 N ASP A 21 12.952 -11.335 -11.042 1.00 0.00 N ATOM 333 CA ASP A 21 12.129 -11.589 -9.865 1.00 0.00 C ATOM 334 C ASP A 21 12.376 -10.577 -8.747 1.00 0.00 C ATOM 335 O ASP A 21 11.872 -10.749 -7.643 1.00 0.00 O ATOM 336 CB ASP A 21 12.189 -13.066 -9.436 1.00 0.00 C ATOM 337 CG ASP A 21 13.252 -13.520 -8.431 1.00 0.00 C ATOM 338 OD1 ASP A 21 14.130 -12.754 -7.985 1.00 0.00 O ATOM 339 OD2 ASP A 21 13.173 -14.708 -8.028 1.00 0.00 O ATOM 0 H ASP A 21 13.896 -11.022 -10.817 1.00 0.00 H new ATOM 0 HA ASP A 21 11.088 -11.421 -10.142 1.00 0.00 H new ATOM 0 HB2 ASP A 21 11.215 -13.324 -9.020 1.00 0.00 H new ATOM 0 HB3 ASP A 21 12.318 -13.663 -10.339 1.00 0.00 H new ATOM 344 N VAL A 22 13.081 -9.478 -9.031 1.00 0.00 N ATOM 345 CA VAL A 22 13.354 -8.428 -8.055 1.00 0.00 C ATOM 346 C VAL A 22 12.476 -7.215 -8.371 1.00 0.00 C ATOM 347 O VAL A 22 12.294 -6.860 -9.537 1.00 0.00 O ATOM 348 CB VAL A 22 14.864 -8.095 -8.009 1.00 0.00 C ATOM 349 CG1 VAL A 22 15.134 -7.153 -6.829 1.00 0.00 C ATOM 350 CG2 VAL A 22 15.736 -9.362 -7.905 1.00 0.00 C ATOM 0 H VAL A 22 13.479 -9.294 -9.952 1.00 0.00 H new ATOM 0 HA VAL A 22 13.099 -8.770 -7.052 1.00 0.00 H new ATOM 0 HB VAL A 22 15.136 -7.605 -8.944 1.00 0.00 H new ATOM 0 HG11 VAL A 22 16.197 -6.914 -6.790 1.00 0.00 H new ATOM 0 HG12 VAL A 22 14.560 -6.235 -6.957 1.00 0.00 H new ATOM 0 HG13 VAL A 22 14.837 -7.640 -5.900 1.00 0.00 H new ATOM 0 HG21 VAL A 22 16.788 -9.078 -7.876 1.00 0.00 H new ATOM 0 HG22 VAL A 22 15.481 -9.905 -6.995 1.00 0.00 H new ATOM 0 HG23 VAL A 22 15.556 -10.000 -8.771 1.00 0.00 H new ATOM 360 N VAL A 23 11.923 -6.578 -7.341 1.00 0.00 N ATOM 361 CA VAL A 23 11.149 -5.345 -7.457 1.00 0.00 C ATOM 362 C VAL A 23 12.110 -4.156 -7.306 1.00 0.00 C ATOM 363 O VAL A 23 13.106 -4.252 -6.591 1.00 0.00 O ATOM 364 CB VAL A 23 10.055 -5.332 -6.370 1.00 0.00 C ATOM 365 CG1 VAL A 23 9.051 -4.204 -6.609 1.00 0.00 C ATOM 366 CG2 VAL A 23 9.280 -6.656 -6.271 1.00 0.00 C ATOM 0 H VAL A 23 12.003 -6.913 -6.381 1.00 0.00 H new ATOM 0 HA VAL A 23 10.658 -5.277 -8.428 1.00 0.00 H new ATOM 0 HB VAL A 23 10.587 -5.177 -5.431 1.00 0.00 H new ATOM 0 HG11 VAL A 23 8.292 -4.221 -5.827 1.00 0.00 H new ATOM 0 HG12 VAL A 23 9.570 -3.245 -6.591 1.00 0.00 H new ATOM 0 HG13 VAL A 23 8.574 -4.341 -7.580 1.00 0.00 H new ATOM 0 HG21 VAL A 23 8.526 -6.579 -5.488 1.00 0.00 H new ATOM 0 HG22 VAL A 23 8.793 -6.865 -7.224 1.00 0.00 H new ATOM 0 HG23 VAL A 23 9.970 -7.465 -6.032 1.00 0.00 H new ATOM 376 N ILE A 24 11.824 -3.021 -7.941 1.00 0.00 N ATOM 377 CA ILE A 24 12.590 -1.782 -7.857 1.00 0.00 C ATOM 378 C ILE A 24 11.578 -0.676 -7.550 1.00 0.00 C ATOM 379 O ILE A 24 10.817 -0.318 -8.449 1.00 0.00 O ATOM 380 CB ILE A 24 13.310 -1.523 -9.206 1.00 0.00 C ATOM 381 CG1 ILE A 24 14.507 -2.448 -9.518 1.00 0.00 C ATOM 382 CG2 ILE A 24 13.875 -0.098 -9.257 1.00 0.00 C ATOM 383 CD1 ILE A 24 14.199 -3.885 -9.915 1.00 0.00 C ATOM 0 H ILE A 24 11.014 -2.938 -8.556 1.00 0.00 H new ATOM 0 HA ILE A 24 13.358 -1.825 -7.084 1.00 0.00 H new ATOM 0 HB ILE A 24 12.526 -1.712 -9.939 1.00 0.00 H new ATOM 0 HG12 ILE A 24 15.083 -1.993 -10.323 1.00 0.00 H new ATOM 0 HG13 ILE A 24 15.151 -2.472 -8.639 1.00 0.00 H new ATOM 0 HG21 ILE A 24 14.376 0.061 -10.212 1.00 0.00 H new ATOM 0 HG22 ILE A 24 13.062 0.620 -9.150 1.00 0.00 H new ATOM 0 HG23 ILE A 24 14.590 0.039 -8.446 1.00 0.00 H new ATOM 0 HD11 ILE A 24 15.131 -4.418 -10.105 1.00 0.00 H new ATOM 0 HD12 ILE A 24 13.657 -4.377 -9.107 1.00 0.00 H new ATOM 0 HD13 ILE A 24 13.588 -3.890 -10.818 1.00 0.00 H new ATOM 395 N LEU A 25 11.535 -0.110 -6.338 1.00 0.00 N ATOM 396 CA LEU A 25 10.720 1.072 -6.099 1.00 0.00 C ATOM 397 C LEU A 25 11.497 2.307 -6.577 1.00 0.00 C ATOM 398 O LEU A 25 12.734 2.275 -6.661 1.00 0.00 O ATOM 399 CB LEU A 25 10.374 1.234 -4.619 1.00 0.00 C ATOM 400 CG LEU A 25 9.653 0.065 -3.930 1.00 0.00 C ATOM 401 CD1 LEU A 25 8.774 -0.823 -4.820 1.00 0.00 C ATOM 402 CD2 LEU A 25 10.598 -0.827 -3.155 1.00 0.00 C ATOM 0 H LEU A 25 12.048 -0.449 -5.524 1.00 0.00 H new ATOM 0 HA LEU A 25 9.785 0.963 -6.648 1.00 0.00 H new ATOM 0 HB2 LEU A 25 11.299 1.426 -4.076 1.00 0.00 H new ATOM 0 HB3 LEU A 25 9.752 2.123 -4.514 1.00 0.00 H new ATOM 0 HG LEU A 25 8.976 0.595 -3.259 1.00 0.00 H new ATOM 0 HD11 LEU A 25 8.322 -1.610 -4.216 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.989 -0.219 -5.275 1.00 0.00 H new ATOM 0 HD13 LEU A 25 9.385 -1.273 -5.602 1.00 0.00 H new ATOM 0 HD21 LEU A 25 10.035 -1.636 -2.689 1.00 0.00 H new ATOM 0 HD22 LEU A 25 11.341 -1.246 -3.833 1.00 0.00 H new ATOM 0 HD23 LEU A 25 11.099 -0.243 -2.384 1.00 0.00 H new ATOM 414 N MET A 26 10.802 3.409 -6.860 1.00 0.00 N ATOM 415 CA MET A 26 11.370 4.640 -7.415 1.00 0.00 C ATOM 416 C MET A 26 10.819 5.816 -6.612 1.00 0.00 C ATOM 417 O MET A 26 9.795 6.369 -6.990 1.00 0.00 O ATOM 418 CB MET A 26 10.948 4.760 -8.885 1.00 0.00 C ATOM 419 CG MET A 26 11.715 3.746 -9.713 1.00 0.00 C ATOM 420 SD MET A 26 10.963 3.400 -11.326 1.00 0.00 S ATOM 421 CE MET A 26 11.873 1.908 -11.777 1.00 0.00 C ATOM 0 H MET A 26 9.796 3.472 -6.705 1.00 0.00 H new ATOM 0 HA MET A 26 12.458 4.631 -7.358 1.00 0.00 H new ATOM 0 HB2 MET A 26 9.876 4.589 -8.982 1.00 0.00 H new ATOM 0 HB3 MET A 26 11.145 5.768 -9.250 1.00 0.00 H new ATOM 0 HG2 MET A 26 12.731 4.110 -9.867 1.00 0.00 H new ATOM 0 HG3 MET A 26 11.792 2.815 -9.151 1.00 0.00 H new ATOM 0 HE1 MET A 26 11.639 1.636 -12.806 1.00 0.00 H new ATOM 0 HE2 MET A 26 12.943 2.093 -11.685 1.00 0.00 H new ATOM 0 HE3 MET A 26 11.587 1.093 -11.113 1.00 0.00 H new ATOM 431 N PRO A 27 11.432 6.197 -5.484 1.00 0.00 N ATOM 432 CA PRO A 27 10.973 7.300 -4.659 1.00 0.00 C ATOM 433 C PRO A 27 11.097 8.613 -5.428 1.00 0.00 C ATOM 434 O PRO A 27 12.118 9.289 -5.380 1.00 0.00 O ATOM 435 CB PRO A 27 11.824 7.242 -3.385 1.00 0.00 C ATOM 436 CG PRO A 27 13.116 6.578 -3.855 1.00 0.00 C ATOM 437 CD PRO A 27 12.614 5.594 -4.910 1.00 0.00 C ATOM 0 HA PRO A 27 9.918 7.231 -4.392 1.00 0.00 H new ATOM 0 HB2 PRO A 27 12.008 8.237 -2.978 1.00 0.00 H new ATOM 0 HB3 PRO A 27 11.336 6.662 -2.601 1.00 0.00 H new ATOM 0 HG2 PRO A 27 13.815 7.301 -4.274 1.00 0.00 H new ATOM 0 HG3 PRO A 27 13.632 6.071 -3.040 1.00 0.00 H new ATOM 0 HD2 PRO A 27 13.373 5.419 -5.673 1.00 0.00 H new ATOM 0 HD3 PRO A 27 12.382 4.627 -4.463 1.00 0.00 H new ATOM 445 N ASN A 28 10.030 9.021 -6.102 1.00 0.00 N ATOM 446 CA ASN A 28 9.827 10.359 -6.641 1.00 0.00 C ATOM 447 C ASN A 28 9.505 11.333 -5.499 1.00 0.00 C ATOM 448 O ASN A 28 8.522 12.071 -5.549 1.00 0.00 O ATOM 449 CB ASN A 28 8.717 10.332 -7.701 1.00 0.00 C ATOM 450 CG ASN A 28 7.392 9.853 -7.122 1.00 0.00 C ATOM 451 OD1 ASN A 28 7.302 8.729 -6.643 1.00 0.00 O ATOM 452 ND2 ASN A 28 6.365 10.673 -7.117 1.00 0.00 N ATOM 0 H ASN A 28 9.246 8.399 -6.297 1.00 0.00 H new ATOM 0 HA ASN A 28 10.739 10.706 -7.128 1.00 0.00 H new ATOM 0 HB2 ASN A 28 8.591 11.330 -8.120 1.00 0.00 H new ATOM 0 HB3 ASN A 28 9.013 9.677 -8.521 1.00 0.00 H new ATOM 0 HD21 ASN A 28 5.478 10.377 -6.711 1.00 0.00 H new ATOM 0 HD22 ASN A 28 6.455 11.606 -7.520 1.00 0.00 H new ATOM 459 N LYS A 29 10.358 11.358 -4.470 1.00 0.00 N ATOM 460 CA LYS A 29 10.405 12.249 -3.302 1.00 0.00 C ATOM 461 C LYS A 29 9.116 12.417 -2.475 1.00 0.00 C ATOM 462 O LYS A 29 9.168 13.063 -1.425 1.00 0.00 O ATOM 463 CB LYS A 29 11.096 13.570 -3.699 1.00 0.00 C ATOM 464 CG LYS A 29 10.191 14.632 -4.355 1.00 0.00 C ATOM 465 CD LYS A 29 10.692 15.089 -5.730 1.00 0.00 C ATOM 466 CE LYS A 29 10.433 14.029 -6.805 1.00 0.00 C ATOM 467 NZ LYS A 29 11.080 14.347 -8.084 1.00 0.00 N ATOM 0 H LYS A 29 11.118 10.679 -4.429 1.00 0.00 H new ATOM 0 HA LYS A 29 11.012 11.731 -2.559 1.00 0.00 H new ATOM 0 HB2 LYS A 29 11.546 14.005 -2.806 1.00 0.00 H new ATOM 0 HB3 LYS A 29 11.910 13.340 -4.386 1.00 0.00 H new ATOM 0 HG2 LYS A 29 9.184 14.228 -4.459 1.00 0.00 H new ATOM 0 HG3 LYS A 29 10.121 15.497 -3.696 1.00 0.00 H new ATOM 0 HD2 LYS A 29 10.196 16.019 -6.008 1.00 0.00 H new ATOM 0 HD3 LYS A 29 11.760 15.301 -5.677 1.00 0.00 H new ATOM 0 HE2 LYS A 29 10.793 13.063 -6.451 1.00 0.00 H new ATOM 0 HE3 LYS A 29 9.359 13.931 -6.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 10.462 14.056 -8.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 11.252 15.371 -8.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 11.985 13.840 -8.151 1.00 0.00 H new ATOM 481 N GLU A 30 8.006 11.790 -2.864 1.00 0.00 N ATOM 482 CA GLU A 30 6.697 11.738 -2.206 1.00 0.00 C ATOM 483 C GLU A 30 6.711 10.873 -0.940 1.00 0.00 C ATOM 484 O GLU A 30 5.731 10.198 -0.627 1.00 0.00 O ATOM 485 CB GLU A 30 5.632 11.267 -3.216 1.00 0.00 C ATOM 486 CG GLU A 30 5.843 9.874 -3.819 1.00 0.00 C ATOM 487 CD GLU A 30 4.561 9.324 -4.469 1.00 0.00 C ATOM 488 OE1 GLU A 30 4.255 9.626 -5.650 1.00 0.00 O ATOM 489 OE2 GLU A 30 3.789 8.629 -3.770 1.00 0.00 O ATOM 0 H GLU A 30 7.998 11.253 -3.731 1.00 0.00 H new ATOM 0 HA GLU A 30 6.443 12.743 -1.870 1.00 0.00 H new ATOM 0 HB2 GLU A 30 4.660 11.283 -2.722 1.00 0.00 H new ATOM 0 HB3 GLU A 30 5.588 11.990 -4.030 1.00 0.00 H new ATOM 0 HG2 GLU A 30 6.637 9.919 -4.565 1.00 0.00 H new ATOM 0 HG3 GLU A 30 6.176 9.189 -3.040 1.00 0.00 H new ATOM 496 N LEU A 31 7.821 10.835 -0.199 1.00 0.00 N ATOM 497 CA LEU A 31 7.909 10.038 1.017 1.00 0.00 C ATOM 498 C LEU A 31 7.329 10.860 2.166 1.00 0.00 C ATOM 499 O LEU A 31 8.005 11.195 3.138 1.00 0.00 O ATOM 500 CB LEU A 31 9.326 9.490 1.241 1.00 0.00 C ATOM 501 CG LEU A 31 9.944 8.811 -0.005 1.00 0.00 C ATOM 502 CD1 LEU A 31 11.172 8.000 0.420 1.00 0.00 C ATOM 503 CD2 LEU A 31 8.965 7.895 -0.764 1.00 0.00 C ATOM 0 H LEU A 31 8.672 11.350 -0.425 1.00 0.00 H new ATOM 0 HA LEU A 31 7.309 9.132 0.938 1.00 0.00 H new ATOM 0 HB2 LEU A 31 9.975 10.307 1.556 1.00 0.00 H new ATOM 0 HB3 LEU A 31 9.301 8.770 2.059 1.00 0.00 H new ATOM 0 HG LEU A 31 10.216 9.611 -0.694 1.00 0.00 H new ATOM 0 HD11 LEU A 31 11.611 7.520 -0.454 1.00 0.00 H new ATOM 0 HD12 LEU A 31 11.906 8.664 0.876 1.00 0.00 H new ATOM 0 HD13 LEU A 31 10.874 7.239 1.141 1.00 0.00 H new ATOM 0 HD21 LEU A 31 9.470 7.456 -1.624 1.00 0.00 H new ATOM 0 HD22 LEU A 31 8.621 7.101 -0.101 1.00 0.00 H new ATOM 0 HD23 LEU A 31 8.110 8.479 -1.105 1.00 0.00 H new ATOM 515 N ASN A 32 6.056 11.223 2.011 1.00 0.00 N ATOM 516 CA ASN A 32 5.204 11.813 3.034 1.00 0.00 C ATOM 517 C ASN A 32 4.808 10.745 4.055 1.00 0.00 C ATOM 518 O ASN A 32 5.129 9.563 3.893 1.00 0.00 O ATOM 519 CB ASN A 32 3.975 12.480 2.399 1.00 0.00 C ATOM 520 CG ASN A 32 3.206 11.493 1.542 1.00 0.00 C ATOM 521 OD1 ASN A 32 2.670 10.516 2.054 1.00 0.00 O ATOM 522 ND2 ASN A 32 3.251 11.700 0.240 1.00 0.00 N ATOM 0 H ASN A 32 5.570 11.106 1.122 1.00 0.00 H new ATOM 0 HA ASN A 32 5.757 12.593 3.557 1.00 0.00 H new ATOM 0 HB2 ASN A 32 3.325 12.873 3.181 1.00 0.00 H new ATOM 0 HB3 ASN A 32 4.290 13.328 1.791 1.00 0.00 H new ATOM 0 HD21 ASN A 32 2.825 11.028 -0.398 1.00 0.00 H new ATOM 0 HD22 ASN A 32 3.711 12.532 -0.128 1.00 0.00 H new ATOM 529 N ILE A 33 4.156 11.146 5.147 1.00 0.00 N ATOM 530 CA ILE A 33 3.764 10.239 6.224 1.00 0.00 C ATOM 531 C ILE A 33 2.616 9.339 5.777 1.00 0.00 C ATOM 532 O ILE A 33 2.596 8.160 6.127 1.00 0.00 O ATOM 533 CB ILE A 33 3.418 11.059 7.490 1.00 0.00 C ATOM 534 CG1 ILE A 33 4.755 11.547 8.088 1.00 0.00 C ATOM 535 CG2 ILE A 33 2.587 10.237 8.485 1.00 0.00 C ATOM 536 CD1 ILE A 33 4.652 12.314 9.407 1.00 0.00 C ATOM 0 H ILE A 33 3.884 12.116 5.309 1.00 0.00 H new ATOM 0 HA ILE A 33 4.596 9.580 6.473 1.00 0.00 H new ATOM 0 HB ILE A 33 2.791 11.915 7.241 1.00 0.00 H new ATOM 0 HG12 ILE A 33 5.400 10.682 8.242 1.00 0.00 H new ATOM 0 HG13 ILE A 33 5.248 12.186 7.355 1.00 0.00 H new ATOM 0 HG21 ILE A 33 2.363 10.845 9.361 1.00 0.00 H new ATOM 0 HG22 ILE A 33 1.656 9.926 8.012 1.00 0.00 H new ATOM 0 HG23 ILE A 33 3.151 9.356 8.790 1.00 0.00 H new ATOM 0 HD11 ILE A 33 5.649 12.609 9.735 1.00 0.00 H new ATOM 0 HD12 ILE A 33 4.039 13.204 9.263 1.00 0.00 H new ATOM 0 HD13 ILE A 33 4.194 11.677 10.164 1.00 0.00 H new ATOM 548 N GLU A 34 1.654 9.865 5.021 1.00 0.00 N ATOM 549 CA GLU A 34 0.431 9.123 4.726 1.00 0.00 C ATOM 550 C GLU A 34 0.758 7.875 3.909 1.00 0.00 C ATOM 551 O GLU A 34 0.174 6.807 4.111 1.00 0.00 O ATOM 552 CB GLU A 34 -0.602 10.034 4.040 1.00 0.00 C ATOM 553 CG GLU A 34 -0.859 11.254 4.945 1.00 0.00 C ATOM 554 CD GLU A 34 -2.211 11.964 4.800 1.00 0.00 C ATOM 555 OE1 GLU A 34 -3.115 11.510 4.063 1.00 0.00 O ATOM 556 OE2 GLU A 34 -2.396 12.968 5.528 1.00 0.00 O ATOM 0 H GLU A 34 1.697 10.795 4.605 1.00 0.00 H new ATOM 0 HA GLU A 34 -0.023 8.785 5.657 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -0.234 10.356 3.066 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -1.530 9.490 3.866 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -0.756 10.933 5.982 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -0.072 11.985 4.758 1.00 0.00 H new ATOM 563 N ASN A 35 1.771 7.996 3.058 1.00 0.00 N ATOM 564 CA ASN A 35 2.326 6.918 2.254 1.00 0.00 C ATOM 565 C ASN A 35 3.249 6.016 3.077 1.00 0.00 C ATOM 566 O ASN A 35 3.511 4.886 2.690 1.00 0.00 O ATOM 567 CB ASN A 35 3.101 7.530 1.083 1.00 0.00 C ATOM 568 CG ASN A 35 3.700 6.474 0.167 1.00 0.00 C ATOM 569 OD1 ASN A 35 2.975 5.745 -0.501 1.00 0.00 O ATOM 570 ND2 ASN A 35 5.018 6.349 0.121 1.00 0.00 N ATOM 0 H ASN A 35 2.246 8.885 2.905 1.00 0.00 H new ATOM 0 HA ASN A 35 1.508 6.298 1.887 1.00 0.00 H new ATOM 0 HB2 ASN A 35 2.435 8.171 0.506 1.00 0.00 H new ATOM 0 HB3 ASN A 35 3.898 8.165 1.471 1.00 0.00 H new ATOM 0 HD21 ASN A 35 5.442 5.639 -0.476 1.00 0.00 H new ATOM 0 HD22 ASN A 35 5.608 6.963 0.682 1.00 0.00 H new ATOM 577 N ALA A 36 3.792 6.494 4.200 1.00 0.00 N ATOM 578 CA ALA A 36 4.818 5.802 4.969 1.00 0.00 C ATOM 579 C ALA A 36 4.268 4.591 5.706 1.00 0.00 C ATOM 580 O ALA A 36 4.799 3.498 5.537 1.00 0.00 O ATOM 581 CB ALA A 36 5.452 6.757 5.975 1.00 0.00 C ATOM 0 H ALA A 36 3.522 7.391 4.604 1.00 0.00 H new ATOM 0 HA ALA A 36 5.567 5.451 4.259 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.217 6.230 6.545 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.906 7.595 5.445 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.686 7.130 6.655 1.00 0.00 H new ATOM 587 N HIS A 37 3.238 4.748 6.545 1.00 0.00 N ATOM 588 CA HIS A 37 2.741 3.581 7.274 1.00 0.00 C ATOM 589 C HIS A 37 2.104 2.582 6.302 1.00 0.00 C ATOM 590 O HIS A 37 2.179 1.374 6.532 1.00 0.00 O ATOM 591 CB HIS A 37 1.782 3.976 8.403 1.00 0.00 C ATOM 592 CG HIS A 37 1.705 2.918 9.477 1.00 0.00 C ATOM 593 ND1 HIS A 37 2.554 2.806 10.558 1.00 0.00 N ATOM 594 CD2 HIS A 37 0.827 1.868 9.527 1.00 0.00 C ATOM 595 CE1 HIS A 37 2.189 1.716 11.251 1.00 0.00 C ATOM 596 NE2 HIS A 37 1.150 1.104 10.659 1.00 0.00 N ATOM 0 H HIS A 37 2.754 5.626 6.730 1.00 0.00 H new ATOM 0 HA HIS A 37 3.590 3.093 7.753 1.00 0.00 H new ATOM 0 HB2 HIS A 37 2.110 4.917 8.844 1.00 0.00 H new ATOM 0 HB3 HIS A 37 0.788 4.147 7.991 1.00 0.00 H new ATOM 0 HD2 HIS A 37 0.032 1.665 8.824 1.00 0.00 H new ATOM 0 HE1 HIS A 37 2.665 1.378 12.159 1.00 0.00 H new ATOM 0 HE2 HIS A 37 0.686 0.251 10.971 1.00 0.00 H new ATOM 604 N LEU A 38 1.521 3.069 5.197 1.00 0.00 N ATOM 605 CA LEU A 38 0.941 2.232 4.171 1.00 0.00 C ATOM 606 C LEU A 38 2.045 1.554 3.350 1.00 0.00 C ATOM 607 O LEU A 38 1.797 0.468 2.850 1.00 0.00 O ATOM 608 CB LEU A 38 -0.111 3.044 3.377 1.00 0.00 C ATOM 609 CG LEU A 38 0.257 3.509 1.954 1.00 0.00 C ATOM 610 CD1 LEU A 38 0.177 2.352 0.963 1.00 0.00 C ATOM 611 CD2 LEU A 38 -0.695 4.615 1.484 1.00 0.00 C ATOM 0 H LEU A 38 1.445 4.067 5.001 1.00 0.00 H new ATOM 0 HA LEU A 38 0.384 1.398 4.598 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -1.016 2.440 3.307 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -0.362 3.928 3.963 1.00 0.00 H new ATOM 0 HG LEU A 38 1.278 3.888 1.991 1.00 0.00 H new ATOM 0 HD11 LEU A 38 0.441 2.707 -0.033 1.00 0.00 H new ATOM 0 HD12 LEU A 38 0.870 1.567 1.264 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -0.838 1.954 0.949 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -0.419 4.930 0.478 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.717 4.237 1.478 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -0.627 5.466 2.162 1.00 0.00 H new ATOM 623 N PHE A 39 3.272 2.093 3.291 1.00 0.00 N ATOM 624 CA PHE A 39 4.403 1.546 2.532 1.00 0.00 C ATOM 625 C PHE A 39 4.601 0.065 2.825 1.00 0.00 C ATOM 626 O PHE A 39 4.840 -0.720 1.912 1.00 0.00 O ATOM 627 CB PHE A 39 5.696 2.309 2.872 1.00 0.00 C ATOM 628 CG PHE A 39 6.749 2.407 1.788 1.00 0.00 C ATOM 629 CD1 PHE A 39 6.521 3.233 0.672 1.00 0.00 C ATOM 630 CD2 PHE A 39 8.007 1.801 1.956 1.00 0.00 C ATOM 631 CE1 PHE A 39 7.559 3.538 -0.222 1.00 0.00 C ATOM 632 CE2 PHE A 39 9.026 2.043 1.019 1.00 0.00 C ATOM 633 CZ PHE A 39 8.816 2.930 -0.053 1.00 0.00 C ATOM 0 H PHE A 39 3.511 2.951 3.788 1.00 0.00 H new ATOM 0 HA PHE A 39 4.176 1.665 1.473 1.00 0.00 H new ATOM 0 HB2 PHE A 39 5.422 3.321 3.169 1.00 0.00 H new ATOM 0 HB3 PHE A 39 6.150 1.833 3.741 1.00 0.00 H new ATOM 0 HD1 PHE A 39 5.534 3.638 0.501 1.00 0.00 H new ATOM 0 HD2 PHE A 39 8.189 1.153 2.801 1.00 0.00 H new ATOM 0 HE1 PHE A 39 7.394 4.233 -1.032 1.00 0.00 H new ATOM 0 HE2 PHE A 39 9.978 1.544 1.123 1.00 0.00 H new ATOM 0 HZ PHE A 39 9.618 3.143 -0.744 1.00 0.00 H new ATOM 643 N LYS A 40 4.483 -0.322 4.103 1.00 0.00 N ATOM 644 CA LYS A 40 4.490 -1.725 4.486 1.00 0.00 C ATOM 645 C LYS A 40 3.343 -2.435 3.771 1.00 0.00 C ATOM 646 O LYS A 40 3.596 -3.324 2.972 1.00 0.00 O ATOM 647 CB LYS A 40 4.412 -1.893 6.014 1.00 0.00 C ATOM 648 CG LYS A 40 4.682 -3.364 6.356 1.00 0.00 C ATOM 649 CD LYS A 40 4.324 -3.777 7.782 1.00 0.00 C ATOM 650 CE LYS A 40 2.811 -3.981 7.910 1.00 0.00 C ATOM 651 NZ LYS A 40 2.454 -4.533 9.228 1.00 0.00 N ATOM 0 H LYS A 40 4.382 0.325 4.885 1.00 0.00 H new ATOM 0 HA LYS A 40 5.432 -2.181 4.181 1.00 0.00 H new ATOM 0 HB2 LYS A 40 5.143 -1.250 6.504 1.00 0.00 H new ATOM 0 HB3 LYS A 40 3.429 -1.593 6.378 1.00 0.00 H new ATOM 0 HG2 LYS A 40 4.122 -3.990 5.662 1.00 0.00 H new ATOM 0 HG3 LYS A 40 5.739 -3.571 6.190 1.00 0.00 H new ATOM 0 HD2 LYS A 40 4.846 -4.698 8.044 1.00 0.00 H new ATOM 0 HD3 LYS A 40 4.656 -3.012 8.484 1.00 0.00 H new ATOM 0 HE2 LYS A 40 2.300 -3.030 7.761 1.00 0.00 H new ATOM 0 HE3 LYS A 40 2.465 -4.654 7.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 1.423 -4.660 9.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 2.923 -5.452 9.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 2.763 -3.878 9.974 1.00 0.00 H new ATOM 665 N LYS A 41 2.105 -2.048 4.072 1.00 0.00 N ATOM 666 CA LYS A 41 0.861 -2.613 3.557 1.00 0.00 C ATOM 667 C LYS A 41 0.932 -2.837 2.046 1.00 0.00 C ATOM 668 O LYS A 41 0.648 -3.953 1.600 1.00 0.00 O ATOM 669 CB LYS A 41 -0.283 -1.651 3.955 1.00 0.00 C ATOM 670 CG LYS A 41 -1.607 -2.335 4.310 1.00 0.00 C ATOM 671 CD LYS A 41 -2.564 -2.375 3.117 1.00 0.00 C ATOM 672 CE LYS A 41 -3.876 -3.052 3.511 1.00 0.00 C ATOM 673 NZ LYS A 41 -5.020 -2.529 2.747 1.00 0.00 N ATOM 0 H LYS A 41 1.934 -1.282 4.724 1.00 0.00 H new ATOM 0 HA LYS A 41 0.680 -3.597 3.989 1.00 0.00 H new ATOM 0 HB2 LYS A 41 0.042 -1.057 4.809 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -0.458 -0.958 3.132 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -1.411 -3.351 4.653 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -2.079 -1.805 5.137 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -2.761 -1.362 2.766 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -2.103 -2.915 2.290 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -3.792 -4.126 3.348 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -4.054 -2.904 4.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -5.889 -3.016 3.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -5.117 -1.508 2.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -4.864 -2.693 1.732 1.00 0.00 H new ATOM 687 N TRP A 42 1.330 -1.814 1.286 1.00 0.00 N ATOM 688 CA TRP A 42 1.499 -1.875 -0.155 1.00 0.00 C ATOM 689 C TRP A 42 2.570 -2.898 -0.510 1.00 0.00 C ATOM 690 O TRP A 42 2.212 -3.897 -1.124 1.00 0.00 O ATOM 691 CB TRP A 42 1.789 -0.490 -0.742 1.00 0.00 C ATOM 692 CG TRP A 42 2.453 -0.482 -2.088 1.00 0.00 C ATOM 693 CD1 TRP A 42 2.016 -1.077 -3.223 1.00 0.00 C ATOM 694 CD2 TRP A 42 3.754 0.075 -2.420 1.00 0.00 C ATOM 695 NE1 TRP A 42 2.931 -0.882 -4.234 1.00 0.00 N ATOM 696 CE2 TRP A 42 4.050 -0.220 -3.780 1.00 0.00 C ATOM 697 CE3 TRP A 42 4.736 0.759 -1.682 1.00 0.00 C ATOM 698 CZ2 TRP A 42 5.263 0.152 -4.375 1.00 0.00 C ATOM 699 CZ3 TRP A 42 5.952 1.144 -2.262 1.00 0.00 C ATOM 700 CH2 TRP A 42 6.205 0.868 -3.618 1.00 0.00 C ATOM 0 H TRP A 42 1.548 -0.896 1.674 1.00 0.00 H new ATOM 0 HA TRP A 42 0.564 -2.205 -0.608 1.00 0.00 H new ATOM 0 HB2 TRP A 42 0.849 0.057 -0.817 1.00 0.00 H new ATOM 0 HB3 TRP A 42 2.421 0.057 -0.042 1.00 0.00 H new ATOM 0 HD1 TRP A 42 1.089 -1.623 -3.321 1.00 0.00 H new ATOM 0 HE1 TRP A 42 2.797 -1.189 -5.197 1.00 0.00 H new ATOM 0 HE3 TRP A 42 4.549 0.993 -0.644 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 5.471 -0.108 -5.402 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 6.696 1.653 -1.667 1.00 0.00 H new ATOM 0 HH2 TRP A 42 7.122 1.206 -4.076 1.00 0.00 H new ATOM 711 N VAL A 43 3.847 -2.698 -0.146 1.00 0.00 N ATOM 712 CA VAL A 43 4.928 -3.619 -0.525 1.00 0.00 C ATOM 713 C VAL A 43 4.596 -5.067 -0.130 1.00 0.00 C ATOM 714 O VAL A 43 4.963 -5.999 -0.850 1.00 0.00 O ATOM 715 CB VAL A 43 6.280 -3.146 0.067 1.00 0.00 C ATOM 716 CG1 VAL A 43 7.443 -4.129 -0.153 1.00 0.00 C ATOM 717 CG2 VAL A 43 6.718 -1.809 -0.548 1.00 0.00 C ATOM 0 H VAL A 43 4.156 -1.903 0.413 1.00 0.00 H new ATOM 0 HA VAL A 43 5.024 -3.607 -1.611 1.00 0.00 H new ATOM 0 HB VAL A 43 6.085 -3.061 1.136 1.00 0.00 H new ATOM 0 HG11 VAL A 43 8.352 -3.723 0.291 1.00 0.00 H new ATOM 0 HG12 VAL A 43 7.206 -5.084 0.316 1.00 0.00 H new ATOM 0 HG13 VAL A 43 7.597 -4.277 -1.222 1.00 0.00 H new ATOM 0 HG21 VAL A 43 7.669 -1.503 -0.113 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.832 -1.924 -1.626 1.00 0.00 H new ATOM 0 HG23 VAL A 43 5.964 -1.049 -0.342 1.00 0.00 H new ATOM 727 N PHE A 44 3.896 -5.268 0.988 1.00 0.00 N ATOM 728 CA PHE A 44 3.416 -6.553 1.428 1.00 0.00 C ATOM 729 C PHE A 44 2.466 -7.120 0.374 1.00 0.00 C ATOM 730 O PHE A 44 2.812 -8.085 -0.290 1.00 0.00 O ATOM 731 CB PHE A 44 2.800 -6.452 2.833 1.00 0.00 C ATOM 732 CG PHE A 44 3.779 -6.729 3.966 1.00 0.00 C ATOM 733 CD1 PHE A 44 4.944 -5.953 4.127 1.00 0.00 C ATOM 734 CD2 PHE A 44 3.539 -7.791 4.859 1.00 0.00 C ATOM 735 CE1 PHE A 44 5.840 -6.215 5.181 1.00 0.00 C ATOM 736 CE2 PHE A 44 4.440 -8.061 5.907 1.00 0.00 C ATOM 737 CZ PHE A 44 5.589 -7.270 6.073 1.00 0.00 C ATOM 0 H PHE A 44 3.647 -4.509 1.623 1.00 0.00 H new ATOM 0 HA PHE A 44 4.243 -7.257 1.526 1.00 0.00 H new ATOM 0 HB2 PHE A 44 2.384 -5.453 2.964 1.00 0.00 H new ATOM 0 HB3 PHE A 44 1.970 -7.155 2.905 1.00 0.00 H new ATOM 0 HD1 PHE A 44 5.152 -5.150 3.436 1.00 0.00 H new ATOM 0 HD2 PHE A 44 2.657 -8.403 4.739 1.00 0.00 H new ATOM 0 HE1 PHE A 44 6.722 -5.604 5.304 1.00 0.00 H new ATOM 0 HE2 PHE A 44 4.247 -8.879 6.585 1.00 0.00 H new ATOM 0 HZ PHE A 44 6.275 -7.472 6.882 1.00 0.00 H new ATOM 747 N ASP A 45 1.287 -6.538 0.203 1.00 0.00 N ATOM 748 CA ASP A 45 0.240 -7.080 -0.670 1.00 0.00 C ATOM 749 C ASP A 45 0.669 -7.135 -2.133 1.00 0.00 C ATOM 750 O ASP A 45 0.367 -8.100 -2.836 1.00 0.00 O ATOM 751 CB ASP A 45 -1.074 -6.293 -0.535 1.00 0.00 C ATOM 752 CG ASP A 45 -2.030 -6.882 0.503 1.00 0.00 C ATOM 753 OD1 ASP A 45 -1.999 -8.113 0.749 1.00 0.00 O ATOM 754 OD2 ASP A 45 -2.749 -6.097 1.159 1.00 0.00 O ATOM 0 H ASP A 45 1.022 -5.669 0.667 1.00 0.00 H new ATOM 0 HA ASP A 45 0.070 -8.103 -0.336 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -0.845 -5.262 -0.264 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -1.573 -6.265 -1.503 1.00 0.00 H new ATOM 759 N GLU A 46 1.374 -6.104 -2.589 1.00 0.00 N ATOM 760 CA GLU A 46 1.794 -5.932 -3.971 1.00 0.00 C ATOM 761 C GLU A 46 2.884 -6.944 -4.340 1.00 0.00 C ATOM 762 O GLU A 46 2.942 -7.363 -5.495 1.00 0.00 O ATOM 763 CB GLU A 46 2.293 -4.486 -4.130 1.00 0.00 C ATOM 764 CG GLU A 46 2.553 -4.027 -5.566 1.00 0.00 C ATOM 765 CD GLU A 46 1.288 -3.712 -6.351 1.00 0.00 C ATOM 766 OE1 GLU A 46 0.834 -2.547 -6.302 1.00 0.00 O ATOM 767 OE2 GLU A 46 0.774 -4.599 -7.072 1.00 0.00 O ATOM 0 H GLU A 46 1.678 -5.341 -1.984 1.00 0.00 H new ATOM 0 HA GLU A 46 0.959 -6.113 -4.648 1.00 0.00 H new ATOM 0 HB2 GLU A 46 1.559 -3.817 -3.682 1.00 0.00 H new ATOM 0 HB3 GLU A 46 3.216 -4.375 -3.560 1.00 0.00 H new ATOM 0 HG2 GLU A 46 3.186 -3.140 -5.545 1.00 0.00 H new ATOM 0 HG3 GLU A 46 3.110 -4.804 -6.090 1.00 0.00 H new ATOM 774 N PHE A 47 3.739 -7.356 -3.390 1.00 0.00 N ATOM 775 CA PHE A 47 4.902 -8.176 -3.702 1.00 0.00 C ATOM 776 C PHE A 47 5.107 -9.298 -2.687 1.00 0.00 C ATOM 777 O PHE A 47 5.140 -10.463 -3.071 1.00 0.00 O ATOM 778 CB PHE A 47 6.171 -7.332 -3.850 1.00 0.00 C ATOM 779 CG PHE A 47 6.031 -6.042 -4.640 1.00 0.00 C ATOM 780 CD1 PHE A 47 5.863 -6.068 -6.036 1.00 0.00 C ATOM 781 CD2 PHE A 47 6.084 -4.807 -3.971 1.00 0.00 C ATOM 782 CE1 PHE A 47 5.740 -4.863 -6.751 1.00 0.00 C ATOM 783 CE2 PHE A 47 5.944 -3.601 -4.678 1.00 0.00 C ATOM 784 CZ PHE A 47 5.777 -3.631 -6.073 1.00 0.00 C ATOM 0 H PHE A 47 3.639 -7.130 -2.400 1.00 0.00 H new ATOM 0 HA PHE A 47 4.699 -8.643 -4.666 1.00 0.00 H new ATOM 0 HB2 PHE A 47 6.536 -7.085 -2.853 1.00 0.00 H new ATOM 0 HB3 PHE A 47 6.936 -7.945 -4.327 1.00 0.00 H new ATOM 0 HD1 PHE A 47 5.828 -7.012 -6.559 1.00 0.00 H new ATOM 0 HD2 PHE A 47 6.234 -4.785 -2.902 1.00 0.00 H new ATOM 0 HE1 PHE A 47 5.617 -4.884 -7.824 1.00 0.00 H new ATOM 0 HE2 PHE A 47 5.965 -2.657 -4.153 1.00 0.00 H new ATOM 0 HZ PHE A 47 5.677 -2.708 -6.625 1.00 0.00 H new ATOM 794 N LEU A 48 5.276 -9.005 -1.399 1.00 0.00 N ATOM 795 CA LEU A 48 5.647 -10.042 -0.431 1.00 0.00 C ATOM 796 C LEU A 48 4.597 -11.153 -0.377 1.00 0.00 C ATOM 797 O LEU A 48 4.929 -12.321 -0.574 1.00 0.00 O ATOM 798 CB LEU A 48 5.884 -9.457 0.965 1.00 0.00 C ATOM 799 CG LEU A 48 6.979 -8.372 1.025 1.00 0.00 C ATOM 800 CD1 LEU A 48 7.269 -7.999 2.481 1.00 0.00 C ATOM 801 CD2 LEU A 48 8.294 -8.791 0.357 1.00 0.00 C ATOM 0 H LEU A 48 5.164 -8.072 -1.003 1.00 0.00 H new ATOM 0 HA LEU A 48 6.586 -10.476 -0.774 1.00 0.00 H new ATOM 0 HB2 LEU A 48 4.949 -9.033 1.331 1.00 0.00 H new ATOM 0 HB3 LEU A 48 6.154 -10.266 1.643 1.00 0.00 H new ATOM 0 HG LEU A 48 6.587 -7.519 0.471 1.00 0.00 H new ATOM 0 HD11 LEU A 48 8.043 -7.232 2.513 1.00 0.00 H new ATOM 0 HD12 LEU A 48 6.361 -7.617 2.947 1.00 0.00 H new ATOM 0 HD13 LEU A 48 7.610 -8.882 3.022 1.00 0.00 H new ATOM 0 HD21 LEU A 48 9.017 -7.980 0.437 1.00 0.00 H new ATOM 0 HD22 LEU A 48 8.687 -9.678 0.853 1.00 0.00 H new ATOM 0 HD23 LEU A 48 8.113 -9.013 -0.695 1.00 0.00 H new ATOM 813 N ASN A 49 3.337 -10.776 -0.170 1.00 0.00 N ATOM 814 CA ASN A 49 2.162 -11.643 -0.149 1.00 0.00 C ATOM 815 C ASN A 49 1.847 -12.183 -1.549 1.00 0.00 C ATOM 816 O ASN A 49 1.065 -13.123 -1.676 1.00 0.00 O ATOM 817 CB ASN A 49 0.925 -10.874 0.360 1.00 0.00 C ATOM 818 CG ASN A 49 1.043 -10.275 1.759 1.00 0.00 C ATOM 819 OD1 ASN A 49 1.859 -10.694 2.576 1.00 0.00 O ATOM 820 ND2 ASN A 49 0.223 -9.295 2.098 1.00 0.00 N ATOM 0 H ASN A 49 3.095 -9.799 -0.003 1.00 0.00 H new ATOM 0 HA ASN A 49 2.389 -12.472 0.521 1.00 0.00 H new ATOM 0 HB2 ASN A 49 0.707 -10.069 -0.342 1.00 0.00 H new ATOM 0 HB3 ASN A 49 0.070 -11.550 0.346 1.00 0.00 H new ATOM 0 HD21 ASN A 49 0.270 -8.891 3.033 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -0.457 -8.943 1.424 1.00 0.00 H new ATOM 827 N LYS A 50 2.415 -11.593 -2.609 1.00 0.00 N ATOM 828 CA LYS A 50 2.394 -12.153 -3.960 1.00 0.00 C ATOM 829 C LYS A 50 3.361 -13.329 -4.082 1.00 0.00 C ATOM 830 O LYS A 50 3.122 -14.197 -4.924 1.00 0.00 O ATOM 831 CB LYS A 50 2.779 -11.072 -4.992 1.00 0.00 C ATOM 832 CG LYS A 50 1.588 -10.554 -5.794 1.00 0.00 C ATOM 833 CD LYS A 50 2.037 -9.941 -7.120 1.00 0.00 C ATOM 834 CE LYS A 50 1.084 -8.819 -7.525 1.00 0.00 C ATOM 835 NZ LYS A 50 1.439 -8.300 -8.852 1.00 0.00 N ATOM 0 H LYS A 50 2.908 -10.702 -2.548 1.00 0.00 H new ATOM 0 HA LYS A 50 1.382 -12.507 -4.158 1.00 0.00 H new ATOM 0 HB2 LYS A 50 3.251 -10.237 -4.475 1.00 0.00 H new ATOM 0 HB3 LYS A 50 3.520 -11.482 -5.678 1.00 0.00 H new ATOM 0 HG2 LYS A 50 0.893 -11.371 -5.985 1.00 0.00 H new ATOM 0 HG3 LYS A 50 1.050 -9.808 -5.209 1.00 0.00 H new ATOM 0 HD2 LYS A 50 3.051 -9.552 -7.026 1.00 0.00 H new ATOM 0 HD3 LYS A 50 2.060 -10.707 -7.895 1.00 0.00 H new ATOM 0 HE2 LYS A 50 0.059 -9.190 -7.535 1.00 0.00 H new ATOM 0 HE3 LYS A 50 1.125 -8.015 -6.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 0.782 -7.538 -9.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 2.410 -7.928 -8.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 1.377 -9.066 -9.552 1.00 0.00 H new ATOM 849 N GLY A 51 4.441 -13.340 -3.299 1.00 0.00 N ATOM 850 CA GLY A 51 5.487 -14.352 -3.307 1.00 0.00 C ATOM 851 C GLY A 51 6.898 -13.796 -3.520 1.00 0.00 C ATOM 852 O GLY A 51 7.840 -14.585 -3.577 1.00 0.00 O ATOM 0 H GLY A 51 4.614 -12.607 -2.611 1.00 0.00 H new ATOM 0 HA2 GLY A 51 5.461 -14.893 -2.361 1.00 0.00 H new ATOM 0 HA3 GLY A 51 5.271 -15.075 -4.094 1.00 0.00 H new ATOM 856 N TYR A 52 7.087 -12.480 -3.642 1.00 0.00 N ATOM 857 CA TYR A 52 8.412 -11.904 -3.829 1.00 0.00 C ATOM 858 C TYR A 52 9.218 -11.972 -2.534 1.00 0.00 C ATOM 859 O TYR A 52 8.673 -12.039 -1.431 1.00 0.00 O ATOM 860 CB TYR A 52 8.310 -10.453 -4.309 1.00 0.00 C ATOM 861 CG TYR A 52 7.857 -10.316 -5.750 1.00 0.00 C ATOM 862 CD1 TYR A 52 6.499 -10.422 -6.096 1.00 0.00 C ATOM 863 CD2 TYR A 52 8.811 -10.111 -6.760 1.00 0.00 C ATOM 864 CE1 TYR A 52 6.083 -10.308 -7.429 1.00 0.00 C ATOM 865 CE2 TYR A 52 8.424 -10.039 -8.107 1.00 0.00 C ATOM 866 CZ TYR A 52 7.054 -10.128 -8.444 1.00 0.00 C ATOM 867 OH TYR A 52 6.670 -10.028 -9.744 1.00 0.00 O ATOM 0 H TYR A 52 6.333 -11.794 -3.614 1.00 0.00 H new ATOM 0 HA TYR A 52 8.928 -12.488 -4.592 1.00 0.00 H new ATOM 0 HB2 TYR A 52 7.613 -9.915 -3.666 1.00 0.00 H new ATOM 0 HB3 TYR A 52 9.282 -9.973 -4.196 1.00 0.00 H new ATOM 0 HD1 TYR A 52 5.765 -10.594 -5.323 1.00 0.00 H new ATOM 0 HD2 TYR A 52 9.853 -10.008 -6.497 1.00 0.00 H new ATOM 0 HE1 TYR A 52 5.034 -10.357 -7.680 1.00 0.00 H new ATOM 0 HE2 TYR A 52 9.168 -9.916 -8.881 1.00 0.00 H new ATOM 0 HH TYR A 52 5.776 -9.630 -9.791 1.00 0.00 H new ATOM 877 N ASN A 53 10.538 -11.874 -2.675 1.00 0.00 N ATOM 878 CA ASN A 53 11.524 -11.924 -1.609 1.00 0.00 C ATOM 879 C ASN A 53 12.629 -10.899 -1.825 1.00 0.00 C ATOM 880 O ASN A 53 13.448 -10.706 -0.927 1.00 0.00 O ATOM 881 CB ASN A 53 12.096 -13.347 -1.495 1.00 0.00 C ATOM 882 CG ASN A 53 11.397 -14.148 -0.408 1.00 0.00 C ATOM 883 OD1 ASN A 53 10.741 -15.148 -0.671 1.00 0.00 O ATOM 884 ND2 ASN A 53 11.579 -13.797 0.851 1.00 0.00 N ATOM 0 H ASN A 53 10.968 -11.750 -3.591 1.00 0.00 H new ATOM 0 HA ASN A 53 11.033 -11.669 -0.670 1.00 0.00 H new ATOM 0 HB2 ASN A 53 11.989 -13.860 -2.451 1.00 0.00 H new ATOM 0 HB3 ASN A 53 13.163 -13.294 -1.279 1.00 0.00 H new ATOM 0 HD21 ASN A 53 11.174 -14.358 1.600 1.00 0.00 H new ATOM 0 HD22 ASN A 53 12.125 -12.965 1.075 1.00 0.00 H new ATOM 891 N LYS A 54 12.670 -10.231 -2.981 1.00 0.00 N ATOM 892 CA LYS A 54 13.721 -9.298 -3.343 1.00 0.00 C ATOM 893 C LYS A 54 13.097 -7.992 -3.804 1.00 0.00 C ATOM 894 O LYS A 54 12.227 -7.986 -4.675 1.00 0.00 O ATOM 895 CB LYS A 54 14.590 -9.919 -4.433 1.00 0.00 C ATOM 896 CG LYS A 54 15.603 -10.941 -3.891 1.00 0.00 C ATOM 897 CD LYS A 54 15.603 -12.218 -4.730 1.00 0.00 C ATOM 898 CE LYS A 54 14.306 -12.992 -4.487 1.00 0.00 C ATOM 899 NZ LYS A 54 14.159 -14.082 -5.464 1.00 0.00 N ATOM 0 H LYS A 54 11.955 -10.331 -3.701 1.00 0.00 H new ATOM 0 HA LYS A 54 14.355 -9.085 -2.482 1.00 0.00 H new ATOM 0 HB2 LYS A 54 13.948 -10.407 -5.166 1.00 0.00 H new ATOM 0 HB3 LYS A 54 15.127 -9.127 -4.956 1.00 0.00 H new ATOM 0 HG2 LYS A 54 16.601 -10.503 -3.891 1.00 0.00 H new ATOM 0 HG3 LYS A 54 15.361 -11.183 -2.856 1.00 0.00 H new ATOM 0 HD2 LYS A 54 15.698 -11.970 -5.787 1.00 0.00 H new ATOM 0 HD3 LYS A 54 16.462 -12.837 -4.469 1.00 0.00 H new ATOM 0 HE2 LYS A 54 14.304 -13.400 -3.476 1.00 0.00 H new ATOM 0 HE3 LYS A 54 13.454 -12.316 -4.559 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 13.151 -14.314 -5.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 14.549 -13.782 -6.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 14.672 -14.922 -5.127 1.00 0.00 H new ATOM 913 N ILE A 55 13.561 -6.886 -3.235 1.00 0.00 N ATOM 914 CA ILE A 55 13.141 -5.519 -3.517 1.00 0.00 C ATOM 915 C ILE A 55 14.415 -4.672 -3.546 1.00 0.00 C ATOM 916 O ILE A 55 15.370 -5.016 -2.848 1.00 0.00 O ATOM 917 CB ILE A 55 12.140 -5.077 -2.418 1.00 0.00 C ATOM 918 CG1 ILE A 55 10.718 -5.632 -2.677 1.00 0.00 C ATOM 919 CG2 ILE A 55 11.997 -3.556 -2.339 1.00 0.00 C ATOM 920 CD1 ILE A 55 10.108 -6.320 -1.458 1.00 0.00 C ATOM 0 H ILE A 55 14.287 -6.922 -2.519 1.00 0.00 H new ATOM 0 HA ILE A 55 12.627 -5.412 -4.472 1.00 0.00 H new ATOM 0 HB ILE A 55 12.553 -5.472 -1.490 1.00 0.00 H new ATOM 0 HG12 ILE A 55 10.067 -4.815 -2.988 1.00 0.00 H new ATOM 0 HG13 ILE A 55 10.757 -6.341 -3.504 1.00 0.00 H new ATOM 0 HG21 ILE A 55 11.285 -3.298 -1.555 1.00 0.00 H new ATOM 0 HG22 ILE A 55 12.966 -3.111 -2.111 1.00 0.00 H new ATOM 0 HG23 ILE A 55 11.638 -3.174 -3.295 1.00 0.00 H new ATOM 0 HD11 ILE A 55 9.112 -6.686 -1.707 1.00 0.00 H new ATOM 0 HD12 ILE A 55 10.738 -7.158 -1.160 1.00 0.00 H new ATOM 0 HD13 ILE A 55 10.038 -5.608 -0.636 1.00 0.00 H new ATOM 932 N PHE A 56 14.402 -3.535 -4.249 1.00 0.00 N ATOM 933 CA PHE A 56 15.398 -2.474 -4.169 1.00 0.00 C ATOM 934 C PHE A 56 14.746 -1.105 -4.087 1.00 0.00 C ATOM 935 O PHE A 56 13.632 -0.924 -4.579 1.00 0.00 O ATOM 936 CB PHE A 56 16.315 -2.483 -5.396 1.00 0.00 C ATOM 937 CG PHE A 56 17.086 -3.760 -5.593 1.00 0.00 C ATOM 938 CD1 PHE A 56 17.693 -4.387 -4.491 1.00 0.00 C ATOM 939 CD2 PHE A 56 17.184 -4.326 -6.876 1.00 0.00 C ATOM 940 CE1 PHE A 56 18.409 -5.575 -4.681 1.00 0.00 C ATOM 941 CE2 PHE A 56 17.897 -5.516 -7.064 1.00 0.00 C ATOM 942 CZ PHE A 56 18.508 -6.143 -5.963 1.00 0.00 C ATOM 0 H PHE A 56 13.661 -3.325 -4.918 1.00 0.00 H new ATOM 0 HA PHE A 56 15.977 -2.663 -3.265 1.00 0.00 H new ATOM 0 HB2 PHE A 56 15.712 -2.297 -6.285 1.00 0.00 H new ATOM 0 HB3 PHE A 56 17.021 -1.657 -5.311 1.00 0.00 H new ATOM 0 HD1 PHE A 56 17.608 -3.955 -3.505 1.00 0.00 H new ATOM 0 HD2 PHE A 56 16.709 -3.843 -7.717 1.00 0.00 H new ATOM 0 HE1 PHE A 56 18.887 -6.056 -3.840 1.00 0.00 H new ATOM 0 HE2 PHE A 56 17.978 -5.950 -8.049 1.00 0.00 H new ATOM 0 HZ PHE A 56 19.055 -7.064 -6.103 1.00 0.00 H new ATOM 952 N LEU A 57 15.474 -0.123 -3.547 1.00 0.00 N ATOM 953 CA LEU A 57 15.022 1.272 -3.469 1.00 0.00 C ATOM 954 C LEU A 57 16.087 2.166 -4.107 1.00 0.00 C ATOM 955 O LEU A 57 17.206 2.168 -3.591 1.00 0.00 O ATOM 956 CB LEU A 57 14.798 1.602 -1.978 1.00 0.00 C ATOM 957 CG LEU A 57 14.258 3.007 -1.665 1.00 0.00 C ATOM 958 CD1 LEU A 57 12.825 3.161 -2.171 1.00 0.00 C ATOM 959 CD2 LEU A 57 14.255 3.229 -0.147 1.00 0.00 C ATOM 0 H LEU A 57 16.401 -0.274 -3.148 1.00 0.00 H new ATOM 0 HA LEU A 57 14.089 1.437 -4.008 1.00 0.00 H new ATOM 0 HB2 LEU A 57 14.104 0.869 -1.566 1.00 0.00 H new ATOM 0 HB3 LEU A 57 15.745 1.475 -1.453 1.00 0.00 H new ATOM 0 HG LEU A 57 14.900 3.735 -2.161 1.00 0.00 H new ATOM 0 HD11 LEU A 57 12.463 4.163 -1.939 1.00 0.00 H new ATOM 0 HD12 LEU A 57 12.802 3.008 -3.250 1.00 0.00 H new ATOM 0 HD13 LEU A 57 12.186 2.423 -1.686 1.00 0.00 H new ATOM 0 HD21 LEU A 57 13.872 4.225 0.074 1.00 0.00 H new ATOM 0 HD22 LEU A 57 13.619 2.482 0.329 1.00 0.00 H new ATOM 0 HD23 LEU A 57 15.271 3.138 0.236 1.00 0.00 H new ATOM 971 N VAL A 58 15.829 2.864 -5.230 1.00 0.00 N ATOM 972 CA VAL A 58 16.872 3.738 -5.785 1.00 0.00 C ATOM 973 C VAL A 58 16.689 5.155 -5.232 1.00 0.00 C ATOM 974 O VAL A 58 15.654 5.762 -5.477 1.00 0.00 O ATOM 975 CB VAL A 58 16.776 3.701 -7.309 1.00 0.00 C ATOM 976 CG1 VAL A 58 17.756 4.659 -7.979 1.00 0.00 C ATOM 977 CG2 VAL A 58 16.932 2.274 -7.875 1.00 0.00 C ATOM 0 H VAL A 58 14.950 2.842 -5.748 1.00 0.00 H new ATOM 0 HA VAL A 58 17.866 3.397 -5.496 1.00 0.00 H new ATOM 0 HB VAL A 58 15.769 4.042 -7.549 1.00 0.00 H new ATOM 0 HG11 VAL A 58 17.647 4.593 -9.061 1.00 0.00 H new ATOM 0 HG12 VAL A 58 17.548 5.678 -7.654 1.00 0.00 H new ATOM 0 HG13 VAL A 58 18.775 4.391 -7.700 1.00 0.00 H new ATOM 0 HG21 VAL A 58 16.856 2.303 -8.962 1.00 0.00 H new ATOM 0 HG22 VAL A 58 17.905 1.874 -7.590 1.00 0.00 H new ATOM 0 HG23 VAL A 58 16.145 1.635 -7.473 1.00 0.00 H new ATOM 987 N LEU A 59 17.668 5.703 -4.509 1.00 0.00 N ATOM 988 CA LEU A 59 17.536 6.995 -3.826 1.00 0.00 C ATOM 989 C LEU A 59 17.976 8.201 -4.670 1.00 0.00 C ATOM 990 O LEU A 59 17.850 9.330 -4.204 1.00 0.00 O ATOM 991 CB LEU A 59 18.213 6.939 -2.437 1.00 0.00 C ATOM 992 CG LEU A 59 17.293 6.202 -1.437 1.00 0.00 C ATOM 993 CD1 LEU A 59 17.703 4.749 -1.222 1.00 0.00 C ATOM 994 CD2 LEU A 59 17.266 6.893 -0.074 1.00 0.00 C ATOM 0 H LEU A 59 18.579 5.263 -4.379 1.00 0.00 H new ATOM 0 HA LEU A 59 16.471 7.167 -3.674 1.00 0.00 H new ATOM 0 HB2 LEU A 59 19.172 6.426 -2.510 1.00 0.00 H new ATOM 0 HB3 LEU A 59 18.418 7.949 -2.081 1.00 0.00 H new ATOM 0 HG LEU A 59 16.302 6.230 -1.889 1.00 0.00 H new ATOM 0 HD11 LEU A 59 17.023 4.280 -0.511 1.00 0.00 H new ATOM 0 HD12 LEU A 59 17.660 4.215 -2.171 1.00 0.00 H new ATOM 0 HD13 LEU A 59 18.719 4.712 -0.830 1.00 0.00 H new ATOM 0 HD21 LEU A 59 16.608 6.344 0.599 1.00 0.00 H new ATOM 0 HD22 LEU A 59 18.273 6.917 0.342 1.00 0.00 H new ATOM 0 HD23 LEU A 59 16.897 7.912 -0.190 1.00 0.00 H new ATOM 1006 N SER A 60 18.398 7.982 -5.917 1.00 0.00 N ATOM 1007 CA SER A 60 19.024 8.956 -6.810 1.00 0.00 C ATOM 1008 C SER A 60 18.244 10.271 -6.955 1.00 0.00 C ATOM 1009 O SER A 60 18.808 11.366 -6.953 1.00 0.00 O ATOM 1010 CB SER A 60 19.213 8.255 -8.164 1.00 0.00 C ATOM 1011 OG SER A 60 17.983 7.788 -8.689 1.00 0.00 O ATOM 0 H SER A 60 18.306 7.066 -6.355 1.00 0.00 H new ATOM 0 HA SER A 60 19.977 9.268 -6.382 1.00 0.00 H new ATOM 0 HB2 SER A 60 19.671 8.947 -8.871 1.00 0.00 H new ATOM 0 HB3 SER A 60 19.900 7.417 -8.047 1.00 0.00 H new ATOM 0 HG SER A 60 18.141 7.349 -9.551 1.00 0.00 H new ATOM 1017 N ASP A 61 16.924 10.180 -7.120 1.00 0.00 N ATOM 1018 CA ASP A 61 16.069 11.343 -7.370 1.00 0.00 C ATOM 1019 C ASP A 61 15.985 12.243 -6.131 1.00 0.00 C ATOM 1020 O ASP A 61 15.806 13.461 -6.217 1.00 0.00 O ATOM 1021 CB ASP A 61 14.672 10.840 -7.755 1.00 0.00 C ATOM 1022 CG ASP A 61 13.808 11.949 -8.353 1.00 0.00 C ATOM 1023 OD1 ASP A 61 13.367 12.870 -7.634 1.00 0.00 O ATOM 1024 OD2 ASP A 61 13.544 11.908 -9.581 1.00 0.00 O ATOM 0 H ASP A 61 16.416 9.296 -7.084 1.00 0.00 H new ATOM 0 HA ASP A 61 16.494 11.938 -8.179 1.00 0.00 H new ATOM 0 HB2 ASP A 61 14.765 10.026 -8.474 1.00 0.00 H new ATOM 0 HB3 ASP A 61 14.178 10.432 -6.873 1.00 0.00 H new ATOM 1029 N VAL A 62 16.146 11.650 -4.952 1.00 0.00 N ATOM 1030 CA VAL A 62 15.810 12.232 -3.668 1.00 0.00 C ATOM 1031 C VAL A 62 17.051 12.873 -3.073 1.00 0.00 C ATOM 1032 O VAL A 62 18.172 12.415 -3.289 1.00 0.00 O ATOM 1033 CB VAL A 62 15.255 11.130 -2.728 1.00 0.00 C ATOM 1034 CG1 VAL A 62 14.210 11.742 -1.792 1.00 0.00 C ATOM 1035 CG2 VAL A 62 14.549 9.972 -3.443 1.00 0.00 C ATOM 0 H VAL A 62 16.532 10.709 -4.868 1.00 0.00 H new ATOM 0 HA VAL A 62 15.043 12.997 -3.792 1.00 0.00 H new ATOM 0 HB VAL A 62 16.131 10.734 -2.214 1.00 0.00 H new ATOM 0 HG11 VAL A 62 13.818 10.970 -1.130 1.00 0.00 H new ATOM 0 HG12 VAL A 62 14.672 12.530 -1.197 1.00 0.00 H new ATOM 0 HG13 VAL A 62 13.395 12.162 -2.382 1.00 0.00 H new ATOM 0 HG21 VAL A 62 14.195 9.251 -2.706 1.00 0.00 H new ATOM 0 HG22 VAL A 62 13.702 10.357 -4.010 1.00 0.00 H new ATOM 0 HG23 VAL A 62 15.248 9.483 -4.122 1.00 0.00 H new ATOM 1045 N GLU A 63 16.841 13.911 -2.271 1.00 0.00 N ATOM 1046 CA GLU A 63 17.823 14.323 -1.293 1.00 0.00 C ATOM 1047 C GLU A 63 17.872 13.263 -0.189 1.00 0.00 C ATOM 1048 O GLU A 63 18.928 12.698 0.092 1.00 0.00 O ATOM 1049 CB GLU A 63 17.414 15.700 -0.760 1.00 0.00 C ATOM 1050 CG GLU A 63 18.296 16.118 0.419 1.00 0.00 C ATOM 1051 CD GLU A 63 17.980 17.519 0.910 1.00 0.00 C ATOM 1052 OE1 GLU A 63 18.491 18.476 0.281 1.00 0.00 O ATOM 1053 OE2 GLU A 63 17.260 17.627 1.932 1.00 0.00 O ATOM 0 H GLU A 63 15.994 14.480 -2.284 1.00 0.00 H new ATOM 0 HA GLU A 63 18.822 14.409 -1.722 1.00 0.00 H new ATOM 0 HB2 GLU A 63 17.492 16.440 -1.557 1.00 0.00 H new ATOM 0 HB3 GLU A 63 16.370 15.677 -0.447 1.00 0.00 H new ATOM 0 HG2 GLU A 63 18.163 15.411 1.237 1.00 0.00 H new ATOM 0 HG3 GLU A 63 19.343 16.068 0.121 1.00 0.00 H new ATOM 1060 N SER A 64 16.735 13.036 0.478 1.00 0.00 N ATOM 1061 CA SER A 64 16.658 12.245 1.692 1.00 0.00 C ATOM 1062 C SER A 64 15.209 11.852 1.990 1.00 0.00 C ATOM 1063 O SER A 64 14.257 12.258 1.319 1.00 0.00 O ATOM 1064 CB SER A 64 17.264 13.102 2.817 1.00 0.00 C ATOM 1065 OG SER A 64 17.321 12.495 4.103 1.00 0.00 O ATOM 0 H SER A 64 15.833 13.406 0.178 1.00 0.00 H new ATOM 0 HA SER A 64 17.210 11.311 1.593 1.00 0.00 H new ATOM 0 HB2 SER A 64 18.275 13.385 2.526 1.00 0.00 H new ATOM 0 HB3 SER A 64 16.686 14.022 2.897 1.00 0.00 H new ATOM 0 HG SER A 64 16.436 12.534 4.523 1.00 0.00 H new ATOM 1071 N ILE A 65 15.055 11.071 3.048 1.00 0.00 N ATOM 1072 CA ILE A 65 13.822 10.641 3.674 1.00 0.00 C ATOM 1073 C ILE A 65 13.707 11.368 5.030 1.00 0.00 C ATOM 1074 O ILE A 65 14.625 12.120 5.386 1.00 0.00 O ATOM 1075 CB ILE A 65 13.924 9.103 3.733 1.00 0.00 C ATOM 1076 CG1 ILE A 65 12.579 8.453 4.074 1.00 0.00 C ATOM 1077 CG2 ILE A 65 15.052 8.628 4.674 1.00 0.00 C ATOM 1078 CD1 ILE A 65 12.539 6.997 3.597 1.00 0.00 C ATOM 0 H ILE A 65 15.868 10.689 3.532 1.00 0.00 H new ATOM 0 HA ILE A 65 12.902 10.891 3.145 1.00 0.00 H new ATOM 0 HB ILE A 65 14.193 8.768 2.731 1.00 0.00 H new ATOM 0 HG12 ILE A 65 12.414 8.492 5.151 1.00 0.00 H new ATOM 0 HG13 ILE A 65 11.770 9.015 3.607 1.00 0.00 H new ATOM 0 HG21 ILE A 65 15.084 7.539 4.682 1.00 0.00 H new ATOM 0 HG22 ILE A 65 16.007 9.017 4.322 1.00 0.00 H new ATOM 0 HG23 ILE A 65 14.862 8.993 5.683 1.00 0.00 H new ATOM 0 HD11 ILE A 65 11.574 6.557 3.851 1.00 0.00 H new ATOM 0 HD12 ILE A 65 12.680 6.964 2.517 1.00 0.00 H new ATOM 0 HD13 ILE A 65 13.334 6.433 4.084 1.00 0.00 H new ATOM 1090 N ASP A 66 12.624 11.169 5.788 1.00 0.00 N ATOM 1091 CA ASP A 66 12.486 11.657 7.168 1.00 0.00 C ATOM 1092 C ASP A 66 12.300 10.486 8.130 1.00 0.00 C ATOM 1093 O ASP A 66 12.168 9.344 7.690 1.00 0.00 O ATOM 1094 CB ASP A 66 11.331 12.655 7.325 1.00 0.00 C ATOM 1095 CG ASP A 66 11.645 13.635 8.460 1.00 0.00 C ATOM 1096 OD1 ASP A 66 12.393 14.603 8.220 1.00 0.00 O ATOM 1097 OD2 ASP A 66 11.259 13.400 9.629 1.00 0.00 O ATOM 0 H ASP A 66 11.806 10.657 5.457 1.00 0.00 H new ATOM 0 HA ASP A 66 13.407 12.186 7.411 1.00 0.00 H new ATOM 0 HB2 ASP A 66 11.179 13.200 6.393 1.00 0.00 H new ATOM 0 HB3 ASP A 66 10.404 12.122 7.538 1.00 0.00 H new ATOM 1102 N SER A 67 12.286 10.763 9.437 1.00 0.00 N ATOM 1103 CA SER A 67 12.214 9.800 10.528 1.00 0.00 C ATOM 1104 C SER A 67 11.068 8.808 10.323 1.00 0.00 C ATOM 1105 O SER A 67 11.246 7.615 10.573 1.00 0.00 O ATOM 1106 CB SER A 67 12.062 10.589 11.842 1.00 0.00 C ATOM 1107 OG SER A 67 12.215 9.782 12.992 1.00 0.00 O ATOM 0 H SER A 67 12.327 11.724 9.777 1.00 0.00 H new ATOM 0 HA SER A 67 13.125 9.202 10.562 1.00 0.00 H new ATOM 0 HB2 SER A 67 12.801 11.390 11.866 1.00 0.00 H new ATOM 0 HB3 SER A 67 11.080 11.061 11.864 1.00 0.00 H new ATOM 0 HG SER A 67 12.110 10.334 13.795 1.00 0.00 H new ATOM 1113 N PHE A 68 9.909 9.291 9.865 1.00 0.00 N ATOM 1114 CA PHE A 68 8.712 8.478 9.800 1.00 0.00 C ATOM 1115 C PHE A 68 8.881 7.334 8.804 1.00 0.00 C ATOM 1116 O PHE A 68 8.777 6.181 9.221 1.00 0.00 O ATOM 1117 CB PHE A 68 7.465 9.337 9.558 1.00 0.00 C ATOM 1118 CG PHE A 68 6.177 8.676 10.025 1.00 0.00 C ATOM 1119 CD1 PHE A 68 5.682 7.544 9.353 1.00 0.00 C ATOM 1120 CD2 PHE A 68 5.468 9.182 11.132 1.00 0.00 C ATOM 1121 CE1 PHE A 68 4.495 6.921 9.772 1.00 0.00 C ATOM 1122 CE2 PHE A 68 4.274 8.568 11.549 1.00 0.00 C ATOM 1123 CZ PHE A 68 3.784 7.438 10.869 1.00 0.00 C ATOM 0 H PHE A 68 9.784 10.248 9.534 1.00 0.00 H new ATOM 0 HA PHE A 68 8.555 8.007 10.770 1.00 0.00 H new ATOM 0 HB2 PHE A 68 7.583 10.290 10.074 1.00 0.00 H new ATOM 0 HB3 PHE A 68 7.386 9.558 8.494 1.00 0.00 H new ATOM 0 HD1 PHE A 68 6.221 7.149 8.505 1.00 0.00 H new ATOM 0 HD2 PHE A 68 5.843 10.045 11.662 1.00 0.00 H new ATOM 0 HE1 PHE A 68 4.130 6.047 9.253 1.00 0.00 H new ATOM 0 HE2 PHE A 68 3.731 8.965 12.394 1.00 0.00 H new ATOM 0 HZ PHE A 68 2.865 6.969 11.189 1.00 0.00 H new ATOM 1133 N SER A 69 9.161 7.592 7.520 1.00 0.00 N ATOM 1134 CA SER A 69 9.325 6.522 6.565 1.00 0.00 C ATOM 1135 C SER A 69 10.597 5.708 6.793 1.00 0.00 C ATOM 1136 O SER A 69 10.573 4.498 6.587 1.00 0.00 O ATOM 1137 CB SER A 69 9.399 7.122 5.180 1.00 0.00 C ATOM 1138 OG SER A 69 8.201 7.710 4.746 1.00 0.00 O ATOM 0 H SER A 69 9.275 8.529 7.134 1.00 0.00 H new ATOM 0 HA SER A 69 8.474 5.851 6.682 1.00 0.00 H new ATOM 0 HB2 SER A 69 10.188 7.874 5.163 1.00 0.00 H new ATOM 0 HB3 SER A 69 9.686 6.343 4.473 1.00 0.00 H new ATOM 0 HG SER A 69 8.272 7.934 3.795 1.00 0.00 H new ATOM 1144 N LEU A 70 11.697 6.344 7.199 1.00 0.00 N ATOM 1145 CA LEU A 70 13.034 5.757 7.316 1.00 0.00 C ATOM 1146 C LEU A 70 13.030 4.437 8.082 1.00 0.00 C ATOM 1147 O LEU A 70 13.652 3.478 7.623 1.00 0.00 O ATOM 1148 CB LEU A 70 13.890 6.825 8.011 1.00 0.00 C ATOM 1149 CG LEU A 70 15.303 6.457 8.479 1.00 0.00 C ATOM 1150 CD1 LEU A 70 16.240 6.196 7.298 1.00 0.00 C ATOM 1151 CD2 LEU A 70 15.808 7.661 9.287 1.00 0.00 C ATOM 0 H LEU A 70 11.680 7.328 7.468 1.00 0.00 H new ATOM 0 HA LEU A 70 13.435 5.498 6.336 1.00 0.00 H new ATOM 0 HB2 LEU A 70 13.979 7.670 7.329 1.00 0.00 H new ATOM 0 HB3 LEU A 70 13.336 7.175 8.882 1.00 0.00 H new ATOM 0 HG LEU A 70 15.282 5.541 9.070 1.00 0.00 H new ATOM 0 HD11 LEU A 70 17.232 5.938 7.670 1.00 0.00 H new ATOM 0 HD12 LEU A 70 15.851 5.372 6.700 1.00 0.00 H new ATOM 0 HD13 LEU A 70 16.306 7.092 6.681 1.00 0.00 H new ATOM 0 HD21 LEU A 70 16.816 7.459 9.650 1.00 0.00 H new ATOM 0 HD22 LEU A 70 15.822 8.546 8.651 1.00 0.00 H new ATOM 0 HD23 LEU A 70 15.145 7.834 10.135 1.00 0.00 H new ATOM 1163 N GLY A 71 12.300 4.350 9.199 1.00 0.00 N ATOM 1164 CA GLY A 71 12.241 3.103 9.957 1.00 0.00 C ATOM 1165 C GLY A 71 11.036 2.221 9.605 1.00 0.00 C ATOM 1166 O GLY A 71 10.774 1.228 10.287 1.00 0.00 O ATOM 0 H GLY A 71 11.752 5.116 9.590 1.00 0.00 H new ATOM 0 HA2 GLY A 71 13.157 2.538 9.781 1.00 0.00 H new ATOM 0 HA3 GLY A 71 12.210 3.337 11.021 1.00 0.00 H new ATOM 1170 N VAL A 72 10.315 2.533 8.525 1.00 0.00 N ATOM 1171 CA VAL A 72 9.532 1.569 7.753 1.00 0.00 C ATOM 1172 C VAL A 72 10.460 0.897 6.731 1.00 0.00 C ATOM 1173 O VAL A 72 10.372 -0.312 6.559 1.00 0.00 O ATOM 1174 CB VAL A 72 8.314 2.221 7.047 1.00 0.00 C ATOM 1175 CG1 VAL A 72 7.322 1.132 6.607 1.00 0.00 C ATOM 1176 CG2 VAL A 72 7.559 3.215 7.941 1.00 0.00 C ATOM 0 H VAL A 72 10.259 3.483 8.157 1.00 0.00 H new ATOM 0 HA VAL A 72 9.122 0.827 8.438 1.00 0.00 H new ATOM 0 HB VAL A 72 8.714 2.768 6.193 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.469 1.596 6.112 1.00 0.00 H new ATOM 0 HG12 VAL A 72 7.815 0.448 5.916 1.00 0.00 H new ATOM 0 HG13 VAL A 72 6.978 0.579 7.481 1.00 0.00 H new ATOM 0 HG21 VAL A 72 6.719 3.636 7.389 1.00 0.00 H new ATOM 0 HG22 VAL A 72 7.189 2.699 8.827 1.00 0.00 H new ATOM 0 HG23 VAL A 72 8.233 4.017 8.243 1.00 0.00 H new ATOM 1186 N ILE A 73 11.384 1.633 6.095 1.00 0.00 N ATOM 1187 CA ILE A 73 12.279 1.110 5.056 1.00 0.00 C ATOM 1188 C ILE A 73 13.065 -0.088 5.606 1.00 0.00 C ATOM 1189 O ILE A 73 12.893 -1.213 5.147 1.00 0.00 O ATOM 1190 CB ILE A 73 13.205 2.231 4.512 1.00 0.00 C ATOM 1191 CG1 ILE A 73 12.488 3.501 4.003 1.00 0.00 C ATOM 1192 CG2 ILE A 73 14.090 1.714 3.379 1.00 0.00 C ATOM 1193 CD1 ILE A 73 11.334 3.280 3.023 1.00 0.00 C ATOM 0 H ILE A 73 11.531 2.623 6.292 1.00 0.00 H new ATOM 0 HA ILE A 73 11.689 0.758 4.210 1.00 0.00 H new ATOM 0 HB ILE A 73 13.789 2.520 5.386 1.00 0.00 H new ATOM 0 HG12 ILE A 73 12.105 4.047 4.865 1.00 0.00 H new ATOM 0 HG13 ILE A 73 13.227 4.142 3.523 1.00 0.00 H new ATOM 0 HG21 ILE A 73 14.728 2.521 3.018 1.00 0.00 H new ATOM 0 HG22 ILE A 73 14.711 0.897 3.746 1.00 0.00 H new ATOM 0 HG23 ILE A 73 13.463 1.354 2.563 1.00 0.00 H new ATOM 0 HD11 ILE A 73 10.910 4.243 2.737 1.00 0.00 H new ATOM 0 HD12 ILE A 73 11.704 2.768 2.135 1.00 0.00 H new ATOM 0 HD13 ILE A 73 10.565 2.671 3.498 1.00 0.00 H new ATOM 1205 N VAL A 74 13.890 0.139 6.634 1.00 0.00 N ATOM 1206 CA VAL A 74 14.489 -0.903 7.476 1.00 0.00 C ATOM 1207 C VAL A 74 13.569 -2.086 7.760 1.00 0.00 C ATOM 1208 O VAL A 74 13.961 -3.243 7.684 1.00 0.00 O ATOM 1209 CB VAL A 74 14.994 -0.260 8.765 1.00 0.00 C ATOM 1210 CG1 VAL A 74 13.883 0.140 9.665 1.00 0.00 C ATOM 1211 CG2 VAL A 74 15.830 -1.261 9.556 1.00 0.00 C ATOM 0 H VAL A 74 14.168 1.080 6.911 1.00 0.00 H new ATOM 0 HA VAL A 74 15.319 -1.337 6.919 1.00 0.00 H new ATOM 0 HB VAL A 74 15.569 0.615 8.462 1.00 0.00 H new ATOM 0 HG11 VAL A 74 14.292 0.593 10.569 1.00 0.00 H new ATOM 0 HG12 VAL A 74 13.244 0.861 9.155 1.00 0.00 H new ATOM 0 HG13 VAL A 74 13.297 -0.739 9.933 1.00 0.00 H new ATOM 0 HG21 VAL A 74 16.186 -0.793 10.474 1.00 0.00 H new ATOM 0 HG22 VAL A 74 15.219 -2.129 9.804 1.00 0.00 H new ATOM 0 HG23 VAL A 74 16.683 -1.577 8.956 1.00 0.00 H new ATOM 1221 N ASN A 75 12.362 -1.778 8.190 1.00 0.00 N ATOM 1222 CA ASN A 75 11.448 -2.738 8.757 1.00 0.00 C ATOM 1223 C ASN A 75 11.143 -3.812 7.725 1.00 0.00 C ATOM 1224 O ASN A 75 11.166 -4.995 8.061 1.00 0.00 O ATOM 1225 CB ASN A 75 10.185 -1.986 9.101 1.00 0.00 C ATOM 1226 CG ASN A 75 9.517 -2.476 10.356 1.00 0.00 C ATOM 1227 OD1 ASN A 75 9.378 -3.674 10.593 1.00 0.00 O ATOM 1228 ND2 ASN A 75 9.197 -1.555 11.242 1.00 0.00 N ATOM 0 H ASN A 75 11.985 -0.831 8.152 1.00 0.00 H new ATOM 0 HA ASN A 75 11.870 -3.217 9.641 1.00 0.00 H new ATOM 0 HB2 ASN A 75 10.421 -0.928 9.214 1.00 0.00 H new ATOM 0 HB3 ASN A 75 9.485 -2.069 8.270 1.00 0.00 H new ATOM 0 HD21 ASN A 75 8.824 -1.829 12.151 1.00 0.00 H new ATOM 0 HD22 ASN A 75 9.323 -0.568 11.019 1.00 0.00 H new ATOM 1235 N ILE A 76 10.931 -3.392 6.470 1.00 0.00 N ATOM 1236 CA ILE A 76 10.695 -4.271 5.338 1.00 0.00 C ATOM 1237 C ILE A 76 11.871 -5.256 5.241 1.00 0.00 C ATOM 1238 O ILE A 76 11.628 -6.454 5.086 1.00 0.00 O ATOM 1239 CB ILE A 76 10.402 -3.441 4.058 1.00 0.00 C ATOM 1240 CG1 ILE A 76 9.083 -2.628 4.209 1.00 0.00 C ATOM 1241 CG2 ILE A 76 10.313 -4.381 2.843 1.00 0.00 C ATOM 1242 CD1 ILE A 76 8.729 -1.727 3.023 1.00 0.00 C ATOM 0 H ILE A 76 10.921 -2.404 6.217 1.00 0.00 H new ATOM 0 HA ILE A 76 9.798 -4.876 5.469 1.00 0.00 H new ATOM 0 HB ILE A 76 11.217 -2.733 3.909 1.00 0.00 H new ATOM 0 HG12 ILE A 76 8.262 -3.326 4.371 1.00 0.00 H new ATOM 0 HG13 ILE A 76 9.157 -2.010 5.104 1.00 0.00 H new ATOM 0 HG21 ILE A 76 10.107 -3.797 1.946 1.00 0.00 H new ATOM 0 HG22 ILE A 76 11.258 -4.911 2.723 1.00 0.00 H new ATOM 0 HG23 ILE A 76 9.510 -5.102 2.999 1.00 0.00 H new ATOM 0 HD11 ILE A 76 7.794 -1.206 3.228 1.00 0.00 H new ATOM 0 HD12 ILE A 76 9.525 -0.998 2.869 1.00 0.00 H new ATOM 0 HD13 ILE A 76 8.616 -2.335 2.125 1.00 0.00 H new ATOM 1254 N LEU A 77 13.120 -4.804 5.442 1.00 0.00 N ATOM 1255 CA LEU A 77 14.307 -5.650 5.427 1.00 0.00 C ATOM 1256 C LEU A 77 14.189 -6.731 6.478 1.00 0.00 C ATOM 1257 O LEU A 77 14.365 -7.901 6.161 1.00 0.00 O ATOM 1258 CB LEU A 77 15.575 -4.804 5.662 1.00 0.00 C ATOM 1259 CG LEU A 77 16.925 -5.478 5.412 1.00 0.00 C ATOM 1260 CD1 LEU A 77 17.346 -6.410 6.542 1.00 0.00 C ATOM 1261 CD2 LEU A 77 16.986 -6.230 4.085 1.00 0.00 C ATOM 0 H LEU A 77 13.328 -3.822 5.622 1.00 0.00 H new ATOM 0 HA LEU A 77 14.387 -6.123 4.448 1.00 0.00 H new ATOM 0 HB2 LEU A 77 15.515 -3.922 5.024 1.00 0.00 H new ATOM 0 HB3 LEU A 77 15.559 -4.453 6.694 1.00 0.00 H new ATOM 0 HG LEU A 77 17.632 -4.650 5.368 1.00 0.00 H new ATOM 0 HD11 LEU A 77 18.311 -6.857 6.304 1.00 0.00 H new ATOM 0 HD12 LEU A 77 17.427 -5.844 7.470 1.00 0.00 H new ATOM 0 HD13 LEU A 77 16.601 -7.197 6.661 1.00 0.00 H new ATOM 0 HD21 LEU A 77 17.970 -6.685 3.969 1.00 0.00 H new ATOM 0 HD22 LEU A 77 16.223 -7.008 4.072 1.00 0.00 H new ATOM 0 HD23 LEU A 77 16.809 -5.535 3.264 1.00 0.00 H new ATOM 1273 N LYS A 78 13.893 -6.348 7.717 1.00 0.00 N ATOM 1274 CA LYS A 78 13.844 -7.275 8.842 1.00 0.00 C ATOM 1275 C LYS A 78 12.861 -8.405 8.555 1.00 0.00 C ATOM 1276 O LYS A 78 13.205 -9.571 8.737 1.00 0.00 O ATOM 1277 CB LYS A 78 13.507 -6.512 10.130 1.00 0.00 C ATOM 1278 CG LYS A 78 14.572 -5.457 10.425 1.00 0.00 C ATOM 1279 CD LYS A 78 14.279 -4.769 11.757 1.00 0.00 C ATOM 1280 CE LYS A 78 15.519 -4.125 12.371 1.00 0.00 C ATOM 1281 NZ LYS A 78 16.483 -5.098 12.931 1.00 0.00 N ATOM 0 H LYS A 78 13.680 -5.383 7.969 1.00 0.00 H new ATOM 0 HA LYS A 78 14.822 -7.736 8.983 1.00 0.00 H new ATOM 0 HB2 LYS A 78 12.532 -6.035 10.032 1.00 0.00 H new ATOM 0 HB3 LYS A 78 13.438 -7.210 10.965 1.00 0.00 H new ATOM 0 HG2 LYS A 78 15.557 -5.923 10.457 1.00 0.00 H new ATOM 0 HG3 LYS A 78 14.595 -4.719 9.623 1.00 0.00 H new ATOM 0 HD2 LYS A 78 13.515 -4.006 11.607 1.00 0.00 H new ATOM 0 HD3 LYS A 78 13.869 -5.498 12.456 1.00 0.00 H new ATOM 0 HE2 LYS A 78 16.021 -3.527 11.610 1.00 0.00 H new ATOM 0 HE3 LYS A 78 15.208 -3.440 13.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 17.265 -4.588 13.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 16.003 -5.698 13.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 16.860 -5.693 12.166 1.00 0.00 H new ATOM 1295 N SER A 79 11.678 -8.074 8.040 1.00 0.00 N ATOM 1296 CA SER A 79 10.685 -9.060 7.634 1.00 0.00 C ATOM 1297 C SER A 79 11.247 -9.978 6.550 1.00 0.00 C ATOM 1298 O SER A 79 11.123 -11.197 6.644 1.00 0.00 O ATOM 1299 CB SER A 79 9.380 -8.383 7.184 1.00 0.00 C ATOM 1300 OG SER A 79 9.512 -6.998 6.906 1.00 0.00 O ATOM 0 H SER A 79 11.383 -7.109 7.893 1.00 0.00 H new ATOM 0 HA SER A 79 10.445 -9.677 8.500 1.00 0.00 H new ATOM 0 HB2 SER A 79 9.010 -8.888 6.292 1.00 0.00 H new ATOM 0 HB3 SER A 79 8.627 -8.517 7.961 1.00 0.00 H new ATOM 0 HG SER A 79 10.220 -6.864 6.242 1.00 0.00 H new ATOM 1306 N ILE A 80 11.885 -9.408 5.529 1.00 0.00 N ATOM 1307 CA ILE A 80 12.447 -10.151 4.413 1.00 0.00 C ATOM 1308 C ILE A 80 13.571 -11.082 4.893 1.00 0.00 C ATOM 1309 O ILE A 80 13.631 -12.226 4.450 1.00 0.00 O ATOM 1310 CB ILE A 80 12.865 -9.135 3.322 1.00 0.00 C ATOM 1311 CG1 ILE A 80 11.609 -8.625 2.584 1.00 0.00 C ATOM 1312 CG2 ILE A 80 13.858 -9.712 2.313 1.00 0.00 C ATOM 1313 CD1 ILE A 80 11.933 -7.536 1.560 1.00 0.00 C ATOM 0 H ILE A 80 12.026 -8.400 5.457 1.00 0.00 H new ATOM 0 HA ILE A 80 11.713 -10.821 3.965 1.00 0.00 H new ATOM 0 HB ILE A 80 13.372 -8.314 3.828 1.00 0.00 H new ATOM 0 HG12 ILE A 80 11.124 -9.461 2.080 1.00 0.00 H new ATOM 0 HG13 ILE A 80 10.897 -8.235 3.312 1.00 0.00 H new ATOM 0 HG21 ILE A 80 14.111 -8.951 1.575 1.00 0.00 H new ATOM 0 HG22 ILE A 80 14.762 -10.028 2.833 1.00 0.00 H new ATOM 0 HG23 ILE A 80 13.410 -10.569 1.811 1.00 0.00 H new ATOM 0 HD11 ILE A 80 11.015 -7.213 1.070 1.00 0.00 H new ATOM 0 HD12 ILE A 80 12.393 -6.687 2.065 1.00 0.00 H new ATOM 0 HD13 ILE A 80 12.623 -7.931 0.814 1.00 0.00 H new ATOM 1325 N SER A 81 14.440 -10.644 5.801 1.00 0.00 N ATOM 1326 CA SER A 81 15.458 -11.466 6.438 1.00 0.00 C ATOM 1327 C SER A 81 14.825 -12.644 7.179 1.00 0.00 C ATOM 1328 O SER A 81 15.214 -13.788 6.959 1.00 0.00 O ATOM 1329 CB SER A 81 16.271 -10.577 7.384 1.00 0.00 C ATOM 1330 OG SER A 81 17.308 -9.928 6.677 1.00 0.00 O ATOM 0 H SER A 81 14.453 -9.676 6.122 1.00 0.00 H new ATOM 0 HA SER A 81 16.120 -11.891 5.683 1.00 0.00 H new ATOM 0 HB2 SER A 81 15.619 -9.837 7.848 1.00 0.00 H new ATOM 0 HB3 SER A 81 16.692 -11.180 8.189 1.00 0.00 H new ATOM 0 HG SER A 81 17.819 -9.362 7.292 1.00 0.00 H new ATOM 1336 N SER A 82 13.833 -12.379 8.030 1.00 0.00 N ATOM 1337 CA SER A 82 13.101 -13.410 8.752 1.00 0.00 C ATOM 1338 C SER A 82 12.314 -14.346 7.821 1.00 0.00 C ATOM 1339 O SER A 82 12.097 -15.510 8.170 1.00 0.00 O ATOM 1340 CB SER A 82 12.199 -12.705 9.757 1.00 0.00 C ATOM 1341 OG SER A 82 12.987 -12.054 10.749 1.00 0.00 O ATOM 0 H SER A 82 13.515 -11.432 8.237 1.00 0.00 H new ATOM 0 HA SER A 82 13.803 -14.066 9.268 1.00 0.00 H new ATOM 0 HB2 SER A 82 11.570 -11.976 9.245 1.00 0.00 H new ATOM 0 HB3 SER A 82 11.532 -13.427 10.228 1.00 0.00 H new ATOM 0 HG SER A 82 13.256 -11.169 10.425 1.00 0.00 H new ATOM 1347 N SER A 83 11.921 -13.874 6.636 1.00 0.00 N ATOM 1348 CA SER A 83 11.278 -14.684 5.618 1.00 0.00 C ATOM 1349 C SER A 83 12.284 -15.605 4.938 1.00 0.00 C ATOM 1350 O SER A 83 12.008 -16.798 4.814 1.00 0.00 O ATOM 1351 CB SER A 83 10.627 -13.797 4.561 1.00 0.00 C ATOM 1352 OG SER A 83 9.657 -12.946 5.139 1.00 0.00 O ATOM 0 H SER A 83 12.046 -12.900 6.359 1.00 0.00 H new ATOM 0 HA SER A 83 10.516 -15.287 6.111 1.00 0.00 H new ATOM 0 HB2 SER A 83 11.390 -13.199 4.063 1.00 0.00 H new ATOM 0 HB3 SER A 83 10.161 -14.419 3.797 1.00 0.00 H new ATOM 0 HG SER A 83 10.100 -12.290 5.717 1.00 0.00 H new ATOM 1358 N GLY A 84 13.404 -15.060 4.454 1.00 0.00 N ATOM 1359 CA GLY A 84 14.279 -15.757 3.523 1.00 0.00 C ATOM 1360 C GLY A 84 14.502 -15.005 2.210 1.00 0.00 C ATOM 1361 O GLY A 84 14.531 -15.646 1.159 1.00 0.00 O ATOM 0 H GLY A 84 13.724 -14.123 4.700 1.00 0.00 H new ATOM 0 HA2 GLY A 84 15.243 -15.928 4.002 1.00 0.00 H new ATOM 0 HA3 GLY A 84 13.855 -16.737 3.303 1.00 0.00 H new ATOM 1365 N GLY A 85 14.613 -13.670 2.219 1.00 0.00 N ATOM 1366 CA GLY A 85 14.878 -12.872 1.033 1.00 0.00 C ATOM 1367 C GLY A 85 15.966 -11.832 1.287 1.00 0.00 C ATOM 1368 O GLY A 85 16.644 -11.868 2.321 1.00 0.00 O ATOM 0 H GLY A 85 14.518 -13.113 3.068 1.00 0.00 H new ATOM 0 HA2 GLY A 85 15.182 -13.525 0.215 1.00 0.00 H new ATOM 0 HA3 GLY A 85 13.962 -12.372 0.718 1.00 0.00 H new ATOM 1372 N PHE A 86 16.126 -10.898 0.349 1.00 0.00 N ATOM 1373 CA PHE A 86 17.208 -9.918 0.286 1.00 0.00 C ATOM 1374 C PHE A 86 16.675 -8.577 -0.230 1.00 0.00 C ATOM 1375 O PHE A 86 16.200 -8.511 -1.358 1.00 0.00 O ATOM 1376 CB PHE A 86 18.300 -10.457 -0.653 1.00 0.00 C ATOM 1377 CG PHE A 86 19.360 -11.286 0.059 1.00 0.00 C ATOM 1378 CD1 PHE A 86 20.481 -10.690 0.684 1.00 0.00 C ATOM 1379 CD2 PHE A 86 19.191 -12.683 0.136 1.00 0.00 C ATOM 1380 CE1 PHE A 86 21.358 -11.491 1.436 1.00 0.00 C ATOM 1381 CE2 PHE A 86 20.104 -13.482 0.843 1.00 0.00 C ATOM 1382 CZ PHE A 86 21.177 -12.880 1.517 1.00 0.00 C ATOM 0 H PHE A 86 15.470 -10.801 -0.426 1.00 0.00 H new ATOM 0 HA PHE A 86 17.624 -9.757 1.281 1.00 0.00 H new ATOM 0 HB2 PHE A 86 17.834 -11.066 -1.427 1.00 0.00 H new ATOM 0 HB3 PHE A 86 18.783 -9.618 -1.155 1.00 0.00 H new ATOM 0 HD1 PHE A 86 20.661 -9.630 0.584 1.00 0.00 H new ATOM 0 HD2 PHE A 86 18.348 -13.145 -0.355 1.00 0.00 H new ATOM 0 HE1 PHE A 86 22.183 -11.030 1.959 1.00 0.00 H new ATOM 0 HE2 PHE A 86 19.981 -14.555 0.868 1.00 0.00 H new ATOM 0 HZ PHE A 86 21.861 -13.483 2.096 1.00 0.00 H new ATOM 1392 N PHE A 87 16.771 -7.494 0.549 1.00 0.00 N ATOM 1393 CA PHE A 87 16.440 -6.139 0.090 1.00 0.00 C ATOM 1394 C PHE A 87 17.658 -5.235 0.277 1.00 0.00 C ATOM 1395 O PHE A 87 18.445 -5.420 1.211 1.00 0.00 O ATOM 1396 CB PHE A 87 15.158 -5.626 0.783 1.00 0.00 C ATOM 1397 CG PHE A 87 15.016 -4.118 0.986 1.00 0.00 C ATOM 1398 CD1 PHE A 87 15.066 -3.213 -0.093 1.00 0.00 C ATOM 1399 CD2 PHE A 87 14.813 -3.607 2.285 1.00 0.00 C ATOM 1400 CE1 PHE A 87 14.910 -1.838 0.133 1.00 0.00 C ATOM 1401 CE2 PHE A 87 14.681 -2.227 2.527 1.00 0.00 C ATOM 1402 CZ PHE A 87 14.722 -1.345 1.435 1.00 0.00 C ATOM 0 H PHE A 87 17.082 -7.532 1.520 1.00 0.00 H new ATOM 0 HA PHE A 87 16.208 -6.140 -0.975 1.00 0.00 H new ATOM 0 HB2 PHE A 87 14.302 -5.968 0.201 1.00 0.00 H new ATOM 0 HB3 PHE A 87 15.091 -6.104 1.760 1.00 0.00 H new ATOM 0 HD1 PHE A 87 15.225 -3.579 -1.096 1.00 0.00 H new ATOM 0 HD2 PHE A 87 14.757 -4.294 3.117 1.00 0.00 H new ATOM 0 HE1 PHE A 87 14.935 -1.152 -0.701 1.00 0.00 H new ATOM 0 HE2 PHE A 87 14.551 -1.854 3.532 1.00 0.00 H new ATOM 0 HZ PHE A 87 14.609 -0.283 1.597 1.00 0.00 H new ATOM 1412 N ALA A 88 17.829 -4.275 -0.634 1.00 0.00 N ATOM 1413 CA ALA A 88 18.963 -3.376 -0.670 1.00 0.00 C ATOM 1414 C ALA A 88 18.603 -2.043 -1.325 1.00 0.00 C ATOM 1415 O ALA A 88 17.479 -1.869 -1.798 1.00 0.00 O ATOM 1416 CB ALA A 88 20.077 -4.066 -1.433 1.00 0.00 C ATOM 0 H ALA A 88 17.159 -4.104 -1.384 1.00 0.00 H new ATOM 0 HA ALA A 88 19.282 -3.147 0.347 1.00 0.00 H new ATOM 0 HB1 ALA A 88 20.947 -3.411 -1.477 1.00 0.00 H new ATOM 0 HB2 ALA A 88 20.345 -4.993 -0.926 1.00 0.00 H new ATOM 0 HB3 ALA A 88 19.740 -4.290 -2.445 1.00 0.00 H new ATOM 1422 N LEU A 89 19.527 -1.080 -1.295 1.00 0.00 N ATOM 1423 CA LEU A 89 19.311 0.272 -1.809 1.00 0.00 C ATOM 1424 C LEU A 89 20.320 0.565 -2.909 1.00 0.00 C ATOM 1425 O LEU A 89 21.305 -0.166 -3.036 1.00 0.00 O ATOM 1426 CB LEU A 89 19.396 1.334 -0.699 1.00 0.00 C ATOM 1427 CG LEU A 89 18.814 0.986 0.683 1.00 0.00 C ATOM 1428 CD1 LEU A 89 18.554 2.256 1.500 1.00 0.00 C ATOM 1429 CD2 LEU A 89 17.536 0.156 0.657 1.00 0.00 C ATOM 0 H LEU A 89 20.460 -1.221 -0.907 1.00 0.00 H new ATOM 0 HA LEU A 89 18.301 0.320 -2.217 1.00 0.00 H new ATOM 0 HB2 LEU A 89 20.446 1.591 -0.563 1.00 0.00 H new ATOM 0 HB3 LEU A 89 18.892 2.232 -1.057 1.00 0.00 H new ATOM 0 HG LEU A 89 19.580 0.365 1.147 1.00 0.00 H new ATOM 0 HD11 LEU A 89 18.143 1.985 2.473 1.00 0.00 H new ATOM 0 HD12 LEU A 89 19.490 2.797 1.640 1.00 0.00 H new ATOM 0 HD13 LEU A 89 17.844 2.891 0.970 1.00 0.00 H new ATOM 0 HD21 LEU A 89 17.206 -0.036 1.678 1.00 0.00 H new ATOM 0 HD22 LEU A 89 16.759 0.701 0.121 1.00 0.00 H new ATOM 0 HD23 LEU A 89 17.728 -0.791 0.153 1.00 0.00 H new ATOM 1441 N VAL A 90 20.087 1.607 -3.702 1.00 0.00 N ATOM 1442 CA VAL A 90 20.909 1.959 -4.856 1.00 0.00 C ATOM 1443 C VAL A 90 21.054 3.473 -4.933 1.00 0.00 C ATOM 1444 O VAL A 90 20.104 4.192 -4.608 1.00 0.00 O ATOM 1445 CB VAL A 90 20.235 1.383 -6.115 1.00 0.00 C ATOM 1446 CG1 VAL A 90 20.814 1.856 -7.453 1.00 0.00 C ATOM 1447 CG2 VAL A 90 20.245 -0.145 -6.076 1.00 0.00 C ATOM 0 H VAL A 90 19.304 2.244 -3.557 1.00 0.00 H new ATOM 0 HA VAL A 90 21.911 1.539 -4.770 1.00 0.00 H new ATOM 0 HB VAL A 90 19.219 1.775 -6.078 1.00 0.00 H new ATOM 0 HG11 VAL A 90 20.266 1.390 -8.272 1.00 0.00 H new ATOM 0 HG12 VAL A 90 20.723 2.940 -7.526 1.00 0.00 H new ATOM 0 HG13 VAL A 90 21.866 1.576 -7.514 1.00 0.00 H new ATOM 0 HG21 VAL A 90 19.765 -0.535 -6.973 1.00 0.00 H new ATOM 0 HG22 VAL A 90 21.274 -0.501 -6.031 1.00 0.00 H new ATOM 0 HG23 VAL A 90 19.703 -0.490 -5.195 1.00 0.00 H new ATOM 1457 N SER A 91 22.204 3.948 -5.417 1.00 0.00 N ATOM 1458 CA SER A 91 22.526 5.362 -5.571 1.00 0.00 C ATOM 1459 C SER A 91 22.313 6.135 -4.248 1.00 0.00 C ATOM 1460 O SER A 91 21.472 7.033 -4.178 1.00 0.00 O ATOM 1461 CB SER A 91 21.709 5.891 -6.764 1.00 0.00 C ATOM 1462 OG SER A 91 22.441 6.754 -7.609 1.00 0.00 O ATOM 0 H SER A 91 22.960 3.335 -5.722 1.00 0.00 H new ATOM 0 HA SER A 91 23.583 5.512 -5.792 1.00 0.00 H new ATOM 0 HB2 SER A 91 21.345 5.046 -7.348 1.00 0.00 H new ATOM 0 HB3 SER A 91 20.833 6.420 -6.388 1.00 0.00 H new ATOM 0 HG SER A 91 22.006 6.800 -8.486 1.00 0.00 H new ATOM 1468 N PRO A 92 22.982 5.751 -3.143 1.00 0.00 N ATOM 1469 CA PRO A 92 22.886 6.450 -1.870 1.00 0.00 C ATOM 1470 C PRO A 92 23.724 7.732 -1.903 1.00 0.00 C ATOM 1471 O PRO A 92 24.852 7.767 -1.409 1.00 0.00 O ATOM 1472 CB PRO A 92 23.375 5.438 -0.834 1.00 0.00 C ATOM 1473 CG PRO A 92 24.448 4.660 -1.607 1.00 0.00 C ATOM 1474 CD PRO A 92 23.924 4.644 -3.036 1.00 0.00 C ATOM 0 HA PRO A 92 21.875 6.781 -1.633 1.00 0.00 H new ATOM 0 HB2 PRO A 92 23.786 5.928 0.049 1.00 0.00 H new ATOM 0 HB3 PRO A 92 22.570 4.787 -0.491 1.00 0.00 H new ATOM 0 HG2 PRO A 92 25.421 5.148 -1.543 1.00 0.00 H new ATOM 0 HG3 PRO A 92 24.571 3.651 -1.215 1.00 0.00 H new ATOM 0 HD2 PRO A 92 24.740 4.758 -3.750 1.00 0.00 H new ATOM 0 HD3 PRO A 92 23.435 3.696 -3.260 1.00 0.00 H new ATOM 1482 N ASN A 93 23.169 8.798 -2.476 1.00 0.00 N ATOM 1483 CA ASN A 93 23.775 10.128 -2.443 1.00 0.00 C ATOM 1484 C ASN A 93 24.076 10.520 -0.998 1.00 0.00 C ATOM 1485 O ASN A 93 23.287 10.238 -0.095 1.00 0.00 O ATOM 1486 CB ASN A 93 22.895 11.199 -3.112 1.00 0.00 C ATOM 1487 CG ASN A 93 21.423 10.832 -3.193 1.00 0.00 C ATOM 1488 OD1 ASN A 93 21.029 10.121 -4.108 1.00 0.00 O ATOM 1489 ND2 ASN A 93 20.594 11.269 -2.264 1.00 0.00 N ATOM 0 H ASN A 93 22.282 8.764 -2.979 1.00 0.00 H new ATOM 0 HA ASN A 93 24.701 10.078 -3.016 1.00 0.00 H new ATOM 0 HB2 ASN A 93 22.995 12.133 -2.559 1.00 0.00 H new ATOM 0 HB3 ASN A 93 23.268 11.383 -4.119 1.00 0.00 H new ATOM 0 HD21 ASN A 93 19.607 11.015 -2.301 1.00 0.00 H new ATOM 0 HD22 ASN A 93 20.940 11.861 -1.509 1.00 0.00 H new ATOM 1496 N GLU A 94 25.190 11.226 -0.788 1.00 0.00 N ATOM 1497 CA GLU A 94 25.917 11.291 0.484 1.00 0.00 C ATOM 1498 C GLU A 94 25.047 11.724 1.667 1.00 0.00 C ATOM 1499 O GLU A 94 25.205 11.227 2.785 1.00 0.00 O ATOM 1500 CB GLU A 94 27.092 12.271 0.324 1.00 0.00 C ATOM 1501 CG GLU A 94 28.025 12.228 1.541 1.00 0.00 C ATOM 1502 CD GLU A 94 29.014 13.387 1.607 1.00 0.00 C ATOM 1503 OE1 GLU A 94 29.952 13.428 0.775 1.00 0.00 O ATOM 1504 OE2 GLU A 94 28.899 14.213 2.540 1.00 0.00 O ATOM 0 H GLU A 94 25.625 11.786 -1.521 1.00 0.00 H new ATOM 0 HA GLU A 94 26.263 10.283 0.713 1.00 0.00 H new ATOM 0 HB2 GLU A 94 27.654 12.024 -0.577 1.00 0.00 H new ATOM 0 HB3 GLU A 94 26.709 13.283 0.193 1.00 0.00 H new ATOM 0 HG2 GLU A 94 27.421 12.227 2.449 1.00 0.00 H new ATOM 0 HG3 GLU A 94 28.581 11.290 1.527 1.00 0.00 H new ATOM 1511 N LYS A 95 24.108 12.640 1.422 1.00 0.00 N ATOM 1512 CA LYS A 95 23.175 13.136 2.416 1.00 0.00 C ATOM 1513 C LYS A 95 22.486 11.960 3.085 1.00 0.00 C ATOM 1514 O LYS A 95 22.245 12.011 4.284 1.00 0.00 O ATOM 1515 CB LYS A 95 22.168 14.079 1.728 1.00 0.00 C ATOM 1516 CG LYS A 95 20.804 14.157 2.418 1.00 0.00 C ATOM 1517 CD LYS A 95 20.822 14.769 3.825 1.00 0.00 C ATOM 1518 CE LYS A 95 20.053 13.932 4.848 1.00 0.00 C ATOM 1519 NZ LYS A 95 19.077 14.727 5.627 1.00 0.00 N ATOM 0 H LYS A 95 23.978 13.063 0.503 1.00 0.00 H new ATOM 0 HA LYS A 95 23.695 13.701 3.190 1.00 0.00 H new ATOM 0 HB2 LYS A 95 22.597 15.080 1.684 1.00 0.00 H new ATOM 0 HB3 LYS A 95 22.023 13.749 0.699 1.00 0.00 H new ATOM 0 HG2 LYS A 95 20.130 14.742 1.792 1.00 0.00 H new ATOM 0 HG3 LYS A 95 20.388 13.152 2.481 1.00 0.00 H new ATOM 0 HD2 LYS A 95 21.855 14.878 4.155 1.00 0.00 H new ATOM 0 HD3 LYS A 95 20.393 15.770 3.786 1.00 0.00 H new ATOM 0 HE2 LYS A 95 19.529 13.128 4.331 1.00 0.00 H new ATOM 0 HE3 LYS A 95 20.761 13.464 5.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 18.586 14.108 6.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 19.576 15.479 6.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 18.382 15.153 4.981 1.00 0.00 H new ATOM 1533 N VAL A 96 22.103 10.937 2.335 1.00 0.00 N ATOM 1534 CA VAL A 96 21.320 9.864 2.892 1.00 0.00 C ATOM 1535 C VAL A 96 22.234 8.888 3.624 1.00 0.00 C ATOM 1536 O VAL A 96 21.826 8.345 4.645 1.00 0.00 O ATOM 1537 CB VAL A 96 20.444 9.264 1.774 1.00 0.00 C ATOM 1538 CG1 VAL A 96 20.975 7.973 1.137 1.00 0.00 C ATOM 1539 CG2 VAL A 96 19.011 9.079 2.296 1.00 0.00 C ATOM 0 H VAL A 96 22.325 10.835 1.345 1.00 0.00 H new ATOM 0 HA VAL A 96 20.624 10.208 3.657 1.00 0.00 H new ATOM 0 HB VAL A 96 20.467 9.985 0.956 1.00 0.00 H new ATOM 0 HG11 VAL A 96 20.283 7.637 0.364 1.00 0.00 H new ATOM 0 HG12 VAL A 96 21.952 8.162 0.692 1.00 0.00 H new ATOM 0 HG13 VAL A 96 21.067 7.201 1.901 1.00 0.00 H new ATOM 0 HG21 VAL A 96 18.389 8.655 1.508 1.00 0.00 H new ATOM 0 HG22 VAL A 96 19.020 8.406 3.153 1.00 0.00 H new ATOM 0 HG23 VAL A 96 18.606 10.045 2.598 1.00 0.00 H new ATOM 1549 N GLU A 97 23.492 8.739 3.208 1.00 0.00 N ATOM 1550 CA GLU A 97 24.450 7.940 3.972 1.00 0.00 C ATOM 1551 C GLU A 97 24.684 8.550 5.359 1.00 0.00 C ATOM 1552 O GLU A 97 24.929 7.820 6.323 1.00 0.00 O ATOM 1553 CB GLU A 97 25.771 7.724 3.216 1.00 0.00 C ATOM 1554 CG GLU A 97 25.553 6.854 1.970 1.00 0.00 C ATOM 1555 CD GLU A 97 26.835 6.158 1.506 1.00 0.00 C ATOM 1556 OE1 GLU A 97 27.802 6.849 1.118 1.00 0.00 O ATOM 1557 OE2 GLU A 97 26.898 4.905 1.567 1.00 0.00 O ATOM 0 H GLU A 97 23.868 9.156 2.356 1.00 0.00 H new ATOM 0 HA GLU A 97 24.011 6.952 4.107 1.00 0.00 H new ATOM 0 HB2 GLU A 97 26.189 8.687 2.923 1.00 0.00 H new ATOM 0 HB3 GLU A 97 26.498 7.248 3.874 1.00 0.00 H new ATOM 0 HG2 GLU A 97 24.793 6.102 2.185 1.00 0.00 H new ATOM 0 HG3 GLU A 97 25.168 7.475 1.161 1.00 0.00 H new ATOM 1564 N ARG A 98 24.504 9.873 5.509 1.00 0.00 N ATOM 1565 CA ARG A 98 24.606 10.509 6.819 1.00 0.00 C ATOM 1566 C ARG A 98 23.573 9.902 7.760 1.00 0.00 C ATOM 1567 O ARG A 98 23.871 9.621 8.917 1.00 0.00 O ATOM 1568 CB ARG A 98 24.584 12.053 6.735 1.00 0.00 C ATOM 1569 CG ARG A 98 23.218 12.721 6.942 1.00 0.00 C ATOM 1570 CD ARG A 98 22.911 13.066 8.401 1.00 0.00 C ATOM 1571 NE ARG A 98 23.501 14.363 8.734 1.00 0.00 N ATOM 1572 CZ ARG A 98 23.074 15.545 8.288 1.00 0.00 C ATOM 1573 NH1 ARG A 98 21.782 15.769 8.060 1.00 0.00 N ATOM 1574 NH2 ARG A 98 23.964 16.490 8.037 1.00 0.00 N ATOM 0 H ARG A 98 24.289 10.512 4.743 1.00 0.00 H new ATOM 0 HA ARG A 98 25.585 10.298 7.248 1.00 0.00 H new ATOM 0 HB2 ARG A 98 25.275 12.447 7.480 1.00 0.00 H new ATOM 0 HB3 ARG A 98 24.966 12.349 5.758 1.00 0.00 H new ATOM 0 HG2 ARG A 98 23.177 13.633 6.347 1.00 0.00 H new ATOM 0 HG3 ARG A 98 22.439 12.058 6.564 1.00 0.00 H new ATOM 0 HD2 ARG A 98 21.833 13.094 8.559 1.00 0.00 H new ATOM 0 HD3 ARG A 98 23.310 12.294 9.059 1.00 0.00 H new ATOM 0 HE ARG A 98 24.306 14.363 9.360 1.00 0.00 H new ATOM 0 HH11 ARG A 98 21.099 15.030 8.226 1.00 0.00 H new ATOM 0 HH12 ARG A 98 21.475 16.680 7.719 1.00 0.00 H new ATOM 0 HH21 ARG A 98 24.957 16.308 8.185 1.00 0.00 H new ATOM 0 HH22 ARG A 98 23.658 17.401 7.695 1.00 0.00 H new ATOM 1588 N VAL A 99 22.344 9.718 7.276 1.00 0.00 N ATOM 1589 CA VAL A 99 21.234 9.383 8.135 1.00 0.00 C ATOM 1590 C VAL A 99 21.233 7.873 8.290 1.00 0.00 C ATOM 1591 O VAL A 99 21.159 7.390 9.414 1.00 0.00 O ATOM 1592 CB VAL A 99 19.936 10.055 7.627 1.00 0.00 C ATOM 1593 CG1 VAL A 99 19.288 9.529 6.352 1.00 0.00 C ATOM 1594 CG2 VAL A 99 18.872 10.001 8.723 1.00 0.00 C ATOM 0 H VAL A 99 22.103 9.798 6.288 1.00 0.00 H new ATOM 0 HA VAL A 99 21.320 9.786 9.144 1.00 0.00 H new ATOM 0 HB VAL A 99 20.283 11.056 7.371 1.00 0.00 H new ATOM 0 HG11 VAL A 99 18.390 10.107 6.135 1.00 0.00 H new ATOM 0 HG12 VAL A 99 19.989 9.622 5.522 1.00 0.00 H new ATOM 0 HG13 VAL A 99 19.021 8.481 6.485 1.00 0.00 H new ATOM 0 HG21 VAL A 99 17.957 10.474 8.366 1.00 0.00 H new ATOM 0 HG22 VAL A 99 18.666 8.962 8.980 1.00 0.00 H new ATOM 0 HG23 VAL A 99 19.232 10.528 9.606 1.00 0.00 H new ATOM 1604 N LEU A 100 21.436 7.134 7.198 1.00 0.00 N ATOM 1605 CA LEU A 100 21.511 5.683 7.184 1.00 0.00 C ATOM 1606 C LEU A 100 22.628 5.175 8.100 1.00 0.00 C ATOM 1607 O LEU A 100 22.494 4.065 8.609 1.00 0.00 O ATOM 1608 CB LEU A 100 21.711 5.171 5.743 1.00 0.00 C ATOM 1609 CG LEU A 100 20.497 5.159 4.778 1.00 0.00 C ATOM 1610 CD1 LEU A 100 19.826 3.786 4.635 1.00 0.00 C ATOM 1611 CD2 LEU A 100 19.354 6.120 5.116 1.00 0.00 C ATOM 0 H LEU A 100 21.556 7.547 6.273 1.00 0.00 H new ATOM 0 HA LEU A 100 20.568 5.292 7.565 1.00 0.00 H new ATOM 0 HB2 LEU A 100 22.492 5.777 5.283 1.00 0.00 H new ATOM 0 HB3 LEU A 100 22.093 4.152 5.805 1.00 0.00 H new ATOM 0 HG LEU A 100 20.989 5.477 3.859 1.00 0.00 H new ATOM 0 HD11 LEU A 100 18.987 3.861 3.944 1.00 0.00 H new ATOM 0 HD12 LEU A 100 20.549 3.066 4.251 1.00 0.00 H new ATOM 0 HD13 LEU A 100 19.466 3.454 5.609 1.00 0.00 H new ATOM 0 HD21 LEU A 100 18.564 6.022 4.372 1.00 0.00 H new ATOM 0 HD22 LEU A 100 18.956 5.880 6.102 1.00 0.00 H new ATOM 0 HD23 LEU A 100 19.727 7.144 5.115 1.00 0.00 H new ATOM 1623 N SER A 101 23.672 5.961 8.391 1.00 0.00 N ATOM 1624 CA SER A 101 24.660 5.556 9.377 1.00 0.00 C ATOM 1625 C SER A 101 24.079 5.779 10.774 1.00 0.00 C ATOM 1626 O SER A 101 24.086 4.891 11.631 1.00 0.00 O ATOM 1627 CB SER A 101 25.940 6.364 9.149 1.00 0.00 C ATOM 1628 OG SER A 101 26.842 6.150 10.214 1.00 0.00 O ATOM 0 H SER A 101 23.846 6.869 7.959 1.00 0.00 H new ATOM 0 HA SER A 101 24.908 4.499 9.281 1.00 0.00 H new ATOM 0 HB2 SER A 101 26.402 6.071 8.206 1.00 0.00 H new ATOM 0 HB3 SER A 101 25.701 7.425 9.071 1.00 0.00 H new ATOM 0 HG SER A 101 27.659 6.669 10.060 1.00 0.00 H new ATOM 1634 N LEU A 102 23.596 6.995 11.033 1.00 0.00 N ATOM 1635 CA LEU A 102 23.139 7.450 12.338 1.00 0.00 C ATOM 1636 C LEU A 102 22.015 6.573 12.881 1.00 0.00 C ATOM 1637 O LEU A 102 22.119 6.076 14.001 1.00 0.00 O ATOM 1638 CB LEU A 102 22.700 8.914 12.221 1.00 0.00 C ATOM 1639 CG LEU A 102 23.892 9.884 12.145 1.00 0.00 C ATOM 1640 CD1 LEU A 102 23.359 11.257 11.735 1.00 0.00 C ATOM 1641 CD2 LEU A 102 24.661 9.953 13.471 1.00 0.00 C ATOM 0 H LEU A 102 23.511 7.712 10.312 1.00 0.00 H new ATOM 0 HA LEU A 102 23.959 7.372 13.052 1.00 0.00 H new ATOM 0 HB2 LEU A 102 22.081 9.034 11.332 1.00 0.00 H new ATOM 0 HB3 LEU A 102 22.079 9.173 13.079 1.00 0.00 H new ATOM 0 HG LEU A 102 24.606 9.525 11.404 1.00 0.00 H new ATOM 0 HD11 LEU A 102 24.186 11.965 11.674 1.00 0.00 H new ATOM 0 HD12 LEU A 102 22.872 11.183 10.763 1.00 0.00 H new ATOM 0 HD13 LEU A 102 22.639 11.604 12.476 1.00 0.00 H new ATOM 0 HD21 LEU A 102 25.494 10.649 13.373 1.00 0.00 H new ATOM 0 HD22 LEU A 102 23.993 10.295 14.261 1.00 0.00 H new ATOM 0 HD23 LEU A 102 25.043 8.963 13.722 1.00 0.00 H new ATOM 1653 N THR A 103 20.961 6.337 12.099 1.00 0.00 N ATOM 1654 CA THR A 103 19.821 5.539 12.546 1.00 0.00 C ATOM 1655 C THR A 103 20.174 4.042 12.593 1.00 0.00 C ATOM 1656 O THR A 103 19.404 3.258 13.143 1.00 0.00 O ATOM 1657 CB THR A 103 18.566 5.911 11.721 1.00 0.00 C ATOM 1658 OG1 THR A 103 17.419 5.148 12.021 1.00 0.00 O ATOM 1659 CG2 THR A 103 18.779 5.808 10.211 1.00 0.00 C ATOM 0 H THR A 103 20.874 6.691 11.146 1.00 0.00 H new ATOM 0 HA THR A 103 19.568 5.777 13.579 1.00 0.00 H new ATOM 0 HB THR A 103 18.399 6.947 12.016 1.00 0.00 H new ATOM 0 HG1 THR A 103 17.681 4.347 12.522 1.00 0.00 H new ATOM 0 HG21 THR A 103 17.859 6.083 9.694 1.00 0.00 H new ATOM 0 HG22 THR A 103 19.580 6.483 9.910 1.00 0.00 H new ATOM 0 HG23 THR A 103 19.050 4.785 9.951 1.00 0.00 H new ATOM 1667 N ASN A 104 21.372 3.640 12.141 1.00 0.00 N ATOM 1668 CA ASN A 104 21.839 2.261 12.002 1.00 0.00 C ATOM 1669 C ASN A 104 20.960 1.580 10.959 1.00 0.00 C ATOM 1670 O ASN A 104 20.046 0.826 11.289 1.00 0.00 O ATOM 1671 CB ASN A 104 21.865 1.448 13.318 1.00 0.00 C ATOM 1672 CG ASN A 104 22.780 1.941 14.437 1.00 0.00 C ATOM 1673 OD1 ASN A 104 23.223 1.138 15.249 1.00 0.00 O ATOM 1674 ND2 ASN A 104 23.055 3.226 14.578 1.00 0.00 N ATOM 0 H ASN A 104 22.079 4.313 11.846 1.00 0.00 H new ATOM 0 HA ASN A 104 22.883 2.296 11.691 1.00 0.00 H new ATOM 0 HB2 ASN A 104 20.848 1.409 13.709 1.00 0.00 H new ATOM 0 HB3 ASN A 104 22.153 0.425 13.075 1.00 0.00 H new ATOM 0 HD21 ASN A 104 23.632 3.542 15.358 1.00 0.00 H new ATOM 0 HD22 ASN A 104 22.691 3.902 13.907 1.00 0.00 H new ATOM 1681 N LEU A 105 21.213 1.883 9.692 1.00 0.00 N ATOM 1682 CA LEU A 105 20.384 1.485 8.561 1.00 0.00 C ATOM 1683 C LEU A 105 21.248 0.781 7.519 1.00 0.00 C ATOM 1684 O LEU A 105 20.938 -0.350 7.166 1.00 0.00 O ATOM 1685 CB LEU A 105 19.674 2.714 7.992 1.00 0.00 C ATOM 1686 CG LEU A 105 18.147 2.624 7.801 1.00 0.00 C ATOM 1687 CD1 LEU A 105 17.620 1.458 6.957 1.00 0.00 C ATOM 1688 CD2 LEU A 105 17.444 2.555 9.149 1.00 0.00 C ATOM 0 H LEU A 105 22.028 2.430 9.414 1.00 0.00 H new ATOM 0 HA LEU A 105 19.616 0.780 8.881 1.00 0.00 H new ATOM 0 HB2 LEU A 105 19.882 3.558 8.649 1.00 0.00 H new ATOM 0 HB3 LEU A 105 20.122 2.945 7.025 1.00 0.00 H new ATOM 0 HG LEU A 105 17.922 3.533 7.243 1.00 0.00 H new ATOM 0 HD11 LEU A 105 16.533 1.511 6.901 1.00 0.00 H new ATOM 0 HD12 LEU A 105 18.038 1.518 5.952 1.00 0.00 H new ATOM 0 HD13 LEU A 105 17.914 0.514 7.416 1.00 0.00 H new ATOM 0 HD21 LEU A 105 16.367 2.492 8.995 1.00 0.00 H new ATOM 0 HD22 LEU A 105 17.785 1.674 9.692 1.00 0.00 H new ATOM 0 HD23 LEU A 105 17.676 3.450 9.727 1.00 0.00 H new ATOM 1700 N ASP A 106 22.366 1.374 7.083 1.00 0.00 N ATOM 1701 CA ASP A 106 23.357 0.714 6.204 1.00 0.00 C ATOM 1702 C ASP A 106 23.953 -0.535 6.869 1.00 0.00 C ATOM 1703 O ASP A 106 24.398 -1.489 6.228 1.00 0.00 O ATOM 1704 CB ASP A 106 24.502 1.686 5.867 1.00 0.00 C ATOM 1705 CG ASP A 106 25.583 1.678 6.956 1.00 0.00 C ATOM 1706 OD1 ASP A 106 25.287 2.228 8.042 1.00 0.00 O ATOM 1707 OD2 ASP A 106 26.623 1.000 6.770 1.00 0.00 O ATOM 0 H ASP A 106 22.616 2.332 7.328 1.00 0.00 H new ATOM 0 HA ASP A 106 22.836 0.417 5.294 1.00 0.00 H new ATOM 0 HB2 ASP A 106 24.945 1.410 4.910 1.00 0.00 H new ATOM 0 HB3 ASP A 106 24.104 2.694 5.755 1.00 0.00 H new ATOM 1712 N ARG A 107 23.935 -0.534 8.200 1.00 0.00 N ATOM 1713 CA ARG A 107 24.439 -1.613 9.030 1.00 0.00 C ATOM 1714 C ARG A 107 23.483 -2.803 9.035 1.00 0.00 C ATOM 1715 O ARG A 107 23.798 -3.835 9.624 1.00 0.00 O ATOM 1716 CB ARG A 107 24.713 -1.103 10.458 1.00 0.00 C ATOM 1717 CG ARG A 107 25.238 0.344 10.494 1.00 0.00 C ATOM 1718 CD ARG A 107 25.905 0.788 11.791 1.00 0.00 C ATOM 1719 NE ARG A 107 25.350 0.150 12.993 1.00 0.00 N ATOM 1720 CZ ARG A 107 26.028 0.025 14.134 1.00 0.00 C ATOM 1721 NH1 ARG A 107 27.142 0.719 14.346 1.00 0.00 N ATOM 1722 NH2 ARG A 107 25.584 -0.829 15.044 1.00 0.00 N ATOM 0 H ARG A 107 23.557 0.243 8.742 1.00 0.00 H new ATOM 0 HA ARG A 107 25.381 -1.962 8.606 1.00 0.00 H new ATOM 0 HB2 ARG A 107 23.794 -1.164 11.041 1.00 0.00 H new ATOM 0 HB3 ARG A 107 25.440 -1.759 10.938 1.00 0.00 H new ATOM 0 HG2 ARG A 107 25.953 0.469 9.681 1.00 0.00 H new ATOM 0 HG3 ARG A 107 24.404 1.016 10.291 1.00 0.00 H new ATOM 0 HD2 ARG A 107 26.971 0.568 11.734 1.00 0.00 H new ATOM 0 HD3 ARG A 107 25.807 1.869 11.887 1.00 0.00 H new ATOM 0 HE ARG A 107 24.399 -0.215 12.952 1.00 0.00 H new ATOM 0 HH11 ARG A 107 27.489 1.358 13.630 1.00 0.00 H new ATOM 0 HH12 ARG A 107 27.650 0.613 15.224 1.00 0.00 H new ATOM 0 HH21 ARG A 107 24.740 -1.373 14.864 1.00 0.00 H new ATOM 0 HH22 ARG A 107 26.086 -0.942 15.925 1.00 0.00 H new ATOM 1736 N ILE A 108 22.289 -2.648 8.457 1.00 0.00 N ATOM 1737 CA ILE A 108 21.160 -3.549 8.618 1.00 0.00 C ATOM 1738 C ILE A 108 20.602 -3.902 7.235 1.00 0.00 C ATOM 1739 O ILE A 108 20.202 -5.045 7.041 1.00 0.00 O ATOM 1740 CB ILE A 108 20.128 -2.916 9.588 1.00 0.00 C ATOM 1741 CG1 ILE A 108 20.843 -2.453 10.884 1.00 0.00 C ATOM 1742 CG2 ILE A 108 18.994 -3.897 9.924 1.00 0.00 C ATOM 1743 CD1 ILE A 108 19.934 -2.141 12.074 1.00 0.00 C ATOM 0 H ILE A 108 22.081 -1.861 7.843 1.00 0.00 H new ATOM 0 HA ILE A 108 21.458 -4.492 9.077 1.00 0.00 H new ATOM 0 HB ILE A 108 19.680 -2.054 9.093 1.00 0.00 H new ATOM 0 HG12 ILE A 108 21.548 -3.228 11.184 1.00 0.00 H new ATOM 0 HG13 ILE A 108 21.428 -1.562 10.655 1.00 0.00 H new ATOM 0 HG21 ILE A 108 18.290 -3.420 10.606 1.00 0.00 H new ATOM 0 HG22 ILE A 108 18.476 -4.182 9.008 1.00 0.00 H new ATOM 0 HG23 ILE A 108 19.410 -4.786 10.397 1.00 0.00 H new ATOM 0 HD11 ILE A 108 20.541 -1.828 12.923 1.00 0.00 H new ATOM 0 HD12 ILE A 108 19.245 -1.340 11.805 1.00 0.00 H new ATOM 0 HD13 ILE A 108 19.367 -3.033 12.343 1.00 0.00 H new ATOM 1755 N VAL A 109 20.621 -2.978 6.270 1.00 0.00 N ATOM 1756 CA VAL A 109 20.220 -3.170 4.884 1.00 0.00 C ATOM 1757 C VAL A 109 21.470 -3.051 4.004 1.00 0.00 C ATOM 1758 O VAL A 109 22.393 -2.294 4.308 1.00 0.00 O ATOM 1759 CB VAL A 109 19.172 -2.105 4.476 1.00 0.00 C ATOM 1760 CG1 VAL A 109 18.372 -2.554 3.252 1.00 0.00 C ATOM 1761 CG2 VAL A 109 18.154 -1.716 5.568 1.00 0.00 C ATOM 0 H VAL A 109 20.935 -2.025 6.451 1.00 0.00 H new ATOM 0 HA VAL A 109 19.766 -4.153 4.758 1.00 0.00 H new ATOM 0 HB VAL A 109 19.782 -1.226 4.270 1.00 0.00 H new ATOM 0 HG11 VAL A 109 17.645 -1.785 2.991 1.00 0.00 H new ATOM 0 HG12 VAL A 109 19.049 -2.713 2.413 1.00 0.00 H new ATOM 0 HG13 VAL A 109 17.851 -3.484 3.479 1.00 0.00 H new ATOM 0 HG21 VAL A 109 17.469 -0.965 5.175 1.00 0.00 H new ATOM 0 HG22 VAL A 109 17.591 -2.598 5.871 1.00 0.00 H new ATOM 0 HG23 VAL A 109 18.683 -1.309 6.430 1.00 0.00 H new ATOM 1771 N LYS A 110 21.496 -3.768 2.882 1.00 0.00 N ATOM 1772 CA LYS A 110 22.541 -3.647 1.866 1.00 0.00 C ATOM 1773 C LYS A 110 22.376 -2.358 1.072 1.00 0.00 C ATOM 1774 O LYS A 110 21.278 -1.800 1.013 1.00 0.00 O ATOM 1775 CB LYS A 110 22.481 -4.879 0.980 1.00 0.00 C ATOM 1776 CG LYS A 110 23.221 -6.028 1.677 1.00 0.00 C ATOM 1777 CD LYS A 110 24.599 -6.325 1.085 1.00 0.00 C ATOM 1778 CE LYS A 110 25.600 -5.172 0.912 1.00 0.00 C ATOM 1779 NZ LYS A 110 26.165 -4.612 2.161 1.00 0.00 N ATOM 0 H LYS A 110 20.782 -4.459 2.650 1.00 0.00 H new ATOM 0 HA LYS A 110 23.524 -3.593 2.334 1.00 0.00 H new ATOM 0 HB2 LYS A 110 21.444 -5.158 0.791 1.00 0.00 H new ATOM 0 HB3 LYS A 110 22.936 -4.670 0.012 1.00 0.00 H new ATOM 0 HG2 LYS A 110 23.335 -5.786 2.734 1.00 0.00 H new ATOM 0 HG3 LYS A 110 22.610 -6.929 1.620 1.00 0.00 H new ATOM 0 HD2 LYS A 110 25.072 -7.079 1.714 1.00 0.00 H new ATOM 0 HD3 LYS A 110 24.446 -6.777 0.105 1.00 0.00 H new ATOM 0 HE2 LYS A 110 26.423 -5.522 0.289 1.00 0.00 H new ATOM 0 HE3 LYS A 110 25.107 -4.367 0.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 26.572 -3.675 1.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 25.412 -4.523 2.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 26.908 -5.245 2.520 1.00 0.00 H new ATOM 1793 N ILE A 111 23.443 -1.931 0.404 1.00 0.00 N ATOM 1794 CA ILE A 111 23.489 -0.687 -0.350 1.00 0.00 C ATOM 1795 C ILE A 111 24.412 -0.923 -1.561 1.00 0.00 C ATOM 1796 O ILE A 111 25.391 -1.661 -1.420 1.00 0.00 O ATOM 1797 CB ILE A 111 23.961 0.435 0.627 1.00 0.00 C ATOM 1798 CG1 ILE A 111 23.222 1.778 0.460 1.00 0.00 C ATOM 1799 CG2 ILE A 111 25.471 0.697 0.580 1.00 0.00 C ATOM 1800 CD1 ILE A 111 22.245 2.033 1.610 1.00 0.00 C ATOM 0 H ILE A 111 24.318 -2.453 0.372 1.00 0.00 H new ATOM 0 HA ILE A 111 22.526 -0.367 -0.747 1.00 0.00 H new ATOM 0 HB ILE A 111 23.702 0.023 1.602 1.00 0.00 H new ATOM 0 HG12 ILE A 111 23.948 2.590 0.413 1.00 0.00 H new ATOM 0 HG13 ILE A 111 22.680 1.780 -0.486 1.00 0.00 H new ATOM 0 HG21 ILE A 111 25.725 1.489 1.285 1.00 0.00 H new ATOM 0 HG22 ILE A 111 26.007 -0.213 0.848 1.00 0.00 H new ATOM 0 HG23 ILE A 111 25.756 1.002 -0.427 1.00 0.00 H new ATOM 0 HD11 ILE A 111 21.744 2.989 1.456 1.00 0.00 H new ATOM 0 HD12 ILE A 111 21.503 1.235 1.641 1.00 0.00 H new ATOM 0 HD13 ILE A 111 22.791 2.057 2.553 1.00 0.00 H new ATOM 1812 N TYR A 112 24.119 -0.330 -2.723 1.00 0.00 N ATOM 1813 CA TYR A 112 24.814 -0.574 -3.991 1.00 0.00 C ATOM 1814 C TYR A 112 24.851 0.670 -4.887 1.00 0.00 C ATOM 1815 O TYR A 112 24.198 1.677 -4.602 1.00 0.00 O ATOM 1816 CB TYR A 112 24.087 -1.698 -4.735 1.00 0.00 C ATOM 1817 CG TYR A 112 24.144 -3.037 -4.044 1.00 0.00 C ATOM 1818 CD1 TYR A 112 25.273 -3.849 -4.236 1.00 0.00 C ATOM 1819 CD2 TYR A 112 23.080 -3.476 -3.235 1.00 0.00 C ATOM 1820 CE1 TYR A 112 25.321 -5.142 -3.699 1.00 0.00 C ATOM 1821 CE2 TYR A 112 23.114 -4.786 -2.723 1.00 0.00 C ATOM 1822 CZ TYR A 112 24.224 -5.625 -2.959 1.00 0.00 C ATOM 1823 OH TYR A 112 24.236 -6.877 -2.430 1.00 0.00 O ATOM 0 H TYR A 112 23.368 0.355 -2.810 1.00 0.00 H new ATOM 0 HA TYR A 112 25.844 -0.846 -3.762 1.00 0.00 H new ATOM 0 HB2 TYR A 112 23.043 -1.414 -4.867 1.00 0.00 H new ATOM 0 HB3 TYR A 112 24.519 -1.797 -5.731 1.00 0.00 H new ATOM 0 HD1 TYR A 112 26.112 -3.473 -4.803 1.00 0.00 H new ATOM 0 HD2 TYR A 112 22.252 -2.819 -3.011 1.00 0.00 H new ATOM 0 HE1 TYR A 112 26.191 -5.763 -3.851 1.00 0.00 H new ATOM 0 HE2 TYR A 112 22.281 -5.154 -2.143 1.00 0.00 H new ATOM 0 HH TYR A 112 25.158 -7.134 -2.219 1.00 0.00 H new ATOM 1833 N ASP A 113 25.571 0.576 -6.009 1.00 0.00 N ATOM 1834 CA ASP A 113 25.757 1.681 -6.951 1.00 0.00 C ATOM 1835 C ASP A 113 24.679 1.683 -8.032 1.00 0.00 C ATOM 1836 O ASP A 113 24.118 2.733 -8.353 1.00 0.00 O ATOM 1837 CB ASP A 113 27.144 1.600 -7.605 1.00 0.00 C ATOM 1838 CG ASP A 113 28.035 2.741 -7.141 1.00 0.00 C ATOM 1839 OD1 ASP A 113 28.446 2.790 -5.965 1.00 0.00 O ATOM 1840 OD2 ASP A 113 28.348 3.628 -7.969 1.00 0.00 O ATOM 0 H ASP A 113 26.047 -0.281 -6.291 1.00 0.00 H new ATOM 0 HA ASP A 113 25.676 2.610 -6.386 1.00 0.00 H new ATOM 0 HB2 ASP A 113 27.611 0.646 -7.358 1.00 0.00 H new ATOM 0 HB3 ASP A 113 27.041 1.633 -8.690 1.00 0.00 H new ATOM 1845 N THR A 114 24.369 0.516 -8.595 1.00 0.00 N ATOM 1846 CA THR A 114 23.417 0.345 -9.687 1.00 0.00 C ATOM 1847 C THR A 114 22.379 -0.703 -9.285 1.00 0.00 C ATOM 1848 O THR A 114 22.558 -1.418 -8.296 1.00 0.00 O ATOM 1849 CB THR A 114 24.167 -0.017 -10.986 1.00 0.00 C ATOM 1850 OG1 THR A 114 24.919 -1.206 -10.853 1.00 0.00 O ATOM 1851 CG2 THR A 114 25.116 1.088 -11.458 1.00 0.00 C ATOM 0 H THR A 114 24.788 -0.363 -8.293 1.00 0.00 H new ATOM 0 HA THR A 114 22.884 1.275 -9.884 1.00 0.00 H new ATOM 0 HB THR A 114 23.380 -0.153 -11.728 1.00 0.00 H new ATOM 0 HG1 THR A 114 25.798 -0.996 -10.474 1.00 0.00 H new ATOM 0 HG21 THR A 114 25.613 0.773 -12.375 1.00 0.00 H new ATOM 0 HG22 THR A 114 24.548 1.999 -11.647 1.00 0.00 H new ATOM 0 HG23 THR A 114 25.863 1.280 -10.688 1.00 0.00 H new ATOM 1859 N ILE A 115 21.295 -0.821 -10.058 1.00 0.00 N ATOM 1860 CA ILE A 115 20.376 -1.937 -9.933 1.00 0.00 C ATOM 1861 C ILE A 115 21.141 -3.207 -10.265 1.00 0.00 C ATOM 1862 O ILE A 115 20.909 -4.211 -9.604 1.00 0.00 O ATOM 1863 CB ILE A 115 19.137 -1.759 -10.845 1.00 0.00 C ATOM 1864 CG1 ILE A 115 18.123 -0.734 -10.292 1.00 0.00 C ATOM 1865 CG2 ILE A 115 18.397 -3.089 -11.116 1.00 0.00 C ATOM 1866 CD1 ILE A 115 17.653 -0.994 -8.858 1.00 0.00 C ATOM 0 H ILE A 115 21.039 -0.147 -10.780 1.00 0.00 H new ATOM 0 HA ILE A 115 19.992 -1.992 -8.914 1.00 0.00 H new ATOM 0 HB ILE A 115 19.544 -1.381 -11.783 1.00 0.00 H new ATOM 0 HG12 ILE A 115 18.572 0.258 -10.336 1.00 0.00 H new ATOM 0 HG13 ILE A 115 17.251 -0.719 -10.946 1.00 0.00 H new ATOM 0 HG21 ILE A 115 17.538 -2.903 -11.760 1.00 0.00 H new ATOM 0 HG22 ILE A 115 19.074 -3.788 -11.607 1.00 0.00 H new ATOM 0 HG23 ILE A 115 18.057 -3.515 -10.172 1.00 0.00 H new ATOM 0 HD11 ILE A 115 16.944 -0.221 -8.562 1.00 0.00 H new ATOM 0 HD12 ILE A 115 17.169 -1.969 -8.805 1.00 0.00 H new ATOM 0 HD13 ILE A 115 18.511 -0.977 -8.185 1.00 0.00 H new ATOM 1878 N SER A 116 22.021 -3.201 -11.269 1.00 0.00 N ATOM 1879 CA SER A 116 22.617 -4.442 -11.716 1.00 0.00 C ATOM 1880 C SER A 116 23.591 -4.963 -10.669 1.00 0.00 C ATOM 1881 O SER A 116 23.620 -6.166 -10.428 1.00 0.00 O ATOM 1882 CB SER A 116 23.255 -4.246 -13.086 1.00 0.00 C ATOM 1883 OG SER A 116 23.560 -5.476 -13.721 1.00 0.00 O ATOM 0 H SER A 116 22.325 -2.367 -11.772 1.00 0.00 H new ATOM 0 HA SER A 116 21.849 -5.206 -11.832 1.00 0.00 H new ATOM 0 HB2 SER A 116 22.580 -3.671 -13.719 1.00 0.00 H new ATOM 0 HB3 SER A 116 24.168 -3.660 -12.978 1.00 0.00 H new ATOM 0 HG SER A 116 23.965 -5.301 -14.596 1.00 0.00 H new ATOM 1889 N GLU A 117 24.314 -4.066 -9.990 1.00 0.00 N ATOM 1890 CA GLU A 117 25.183 -4.439 -8.890 1.00 0.00 C ATOM 1891 C GLU A 117 24.405 -4.900 -7.677 1.00 0.00 C ATOM 1892 O GLU A 117 25.028 -5.325 -6.716 1.00 0.00 O ATOM 1893 CB GLU A 117 26.039 -3.240 -8.495 1.00 0.00 C ATOM 1894 CG GLU A 117 27.273 -3.200 -9.381 1.00 0.00 C ATOM 1895 CD GLU A 117 27.932 -1.838 -9.287 1.00 0.00 C ATOM 1896 OE1 GLU A 117 27.460 -0.911 -9.980 1.00 0.00 O ATOM 1897 OE2 GLU A 117 28.904 -1.704 -8.504 1.00 0.00 O ATOM 0 H GLU A 117 24.307 -3.067 -10.193 1.00 0.00 H new ATOM 0 HA GLU A 117 25.803 -5.269 -9.230 1.00 0.00 H new ATOM 0 HB2 GLU A 117 25.468 -2.318 -8.603 1.00 0.00 H new ATOM 0 HB3 GLU A 117 26.330 -3.314 -7.447 1.00 0.00 H new ATOM 0 HG2 GLU A 117 27.976 -3.975 -9.076 1.00 0.00 H new ATOM 0 HG3 GLU A 117 26.996 -3.409 -10.414 1.00 0.00 H new ATOM 1904 N ALA A 118 23.078 -4.811 -7.691 1.00 0.00 N ATOM 1905 CA ALA A 118 22.252 -5.325 -6.633 1.00 0.00 C ATOM 1906 C ALA A 118 21.603 -6.621 -7.110 1.00 0.00 C ATOM 1907 O ALA A 118 21.581 -7.603 -6.381 1.00 0.00 O ATOM 1908 CB ALA A 118 21.252 -4.233 -6.267 1.00 0.00 C ATOM 0 H ALA A 118 22.553 -4.374 -8.449 1.00 0.00 H new ATOM 0 HA ALA A 118 22.815 -5.574 -5.734 1.00 0.00 H new ATOM 0 HB1 ALA A 118 20.605 -4.586 -5.464 1.00 0.00 H new ATOM 0 HB2 ALA A 118 21.789 -3.344 -5.935 1.00 0.00 H new ATOM 0 HB3 ALA A 118 20.647 -3.987 -7.139 1.00 0.00 H new ATOM 1914 N MET A 119 21.081 -6.657 -8.335 1.00 0.00 N ATOM 1915 CA MET A 119 20.150 -7.651 -8.819 1.00 0.00 C ATOM 1916 C MET A 119 20.686 -9.060 -8.692 1.00 0.00 C ATOM 1917 O MET A 119 19.993 -9.932 -8.178 1.00 0.00 O ATOM 1918 CB MET A 119 19.817 -7.339 -10.289 1.00 0.00 C ATOM 1919 CG MET A 119 18.406 -7.819 -10.601 1.00 0.00 C ATOM 1920 SD MET A 119 18.106 -8.270 -12.329 1.00 0.00 S ATOM 1921 CE MET A 119 18.583 -6.741 -13.180 1.00 0.00 C ATOM 0 H MET A 119 21.312 -5.959 -9.042 1.00 0.00 H new ATOM 0 HA MET A 119 19.252 -7.604 -8.203 1.00 0.00 H new ATOM 0 HB2 MET A 119 19.897 -6.267 -10.472 1.00 0.00 H new ATOM 0 HB3 MET A 119 20.534 -7.829 -10.948 1.00 0.00 H new ATOM 0 HG2 MET A 119 18.187 -8.683 -9.974 1.00 0.00 H new ATOM 0 HG3 MET A 119 17.703 -7.035 -10.320 1.00 0.00 H new ATOM 0 HE1 MET A 119 18.352 -6.828 -14.242 1.00 0.00 H new ATOM 0 HE2 MET A 119 18.032 -5.902 -12.756 1.00 0.00 H new ATOM 0 HE3 MET A 119 19.653 -6.573 -13.054 1.00 0.00 H new ATOM 1931 N GLU A 120 21.886 -9.287 -9.201 1.00 0.00 N ATOM 1932 CA GLU A 120 22.564 -10.569 -9.266 1.00 0.00 C ATOM 1933 C GLU A 120 23.674 -10.654 -8.217 1.00 0.00 C ATOM 1934 O GLU A 120 24.549 -11.513 -8.282 1.00 0.00 O ATOM 1935 CB GLU A 120 23.090 -10.729 -10.689 1.00 0.00 C ATOM 1936 CG GLU A 120 23.979 -9.560 -11.134 1.00 0.00 C ATOM 1937 CD GLU A 120 24.668 -9.843 -12.473 1.00 0.00 C ATOM 1938 OE1 GLU A 120 24.803 -11.022 -12.875 1.00 0.00 O ATOM 1939 OE2 GLU A 120 25.002 -8.873 -13.191 1.00 0.00 O ATOM 0 H GLU A 120 22.445 -8.535 -9.604 1.00 0.00 H new ATOM 0 HA GLU A 120 21.881 -11.387 -9.037 1.00 0.00 H new ATOM 0 HB2 GLU A 120 23.658 -11.657 -10.759 1.00 0.00 H new ATOM 0 HB3 GLU A 120 22.247 -10.819 -11.374 1.00 0.00 H new ATOM 0 HG2 GLU A 120 23.375 -8.657 -11.220 1.00 0.00 H new ATOM 0 HG3 GLU A 120 24.733 -9.367 -10.371 1.00 0.00 H new ATOM 1946 N GLU A 121 23.663 -9.726 -7.266 1.00 0.00 N ATOM 1947 CA GLU A 121 24.641 -9.595 -6.202 1.00 0.00 C ATOM 1948 C GLU A 121 23.975 -9.899 -4.865 1.00 0.00 C ATOM 1949 O GLU A 121 24.345 -10.867 -4.205 1.00 0.00 O ATOM 1950 CB GLU A 121 25.236 -8.182 -6.270 1.00 0.00 C ATOM 1951 CG GLU A 121 26.721 -8.109 -5.918 1.00 0.00 C ATOM 1952 CD GLU A 121 27.564 -8.769 -7.006 1.00 0.00 C ATOM 1953 OE1 GLU A 121 27.842 -8.141 -8.053 1.00 0.00 O ATOM 1954 OE2 GLU A 121 27.953 -9.942 -6.811 1.00 0.00 O ATOM 0 H GLU A 121 22.935 -9.013 -7.218 1.00 0.00 H new ATOM 0 HA GLU A 121 25.458 -10.308 -6.314 1.00 0.00 H new ATOM 0 HB2 GLU A 121 25.093 -7.788 -7.276 1.00 0.00 H new ATOM 0 HB3 GLU A 121 24.681 -7.534 -5.592 1.00 0.00 H new ATOM 0 HG2 GLU A 121 27.021 -7.068 -5.799 1.00 0.00 H new ATOM 0 HG3 GLU A 121 26.899 -8.603 -4.963 1.00 0.00 H new ATOM 1961 N VAL A 122 22.922 -9.155 -4.514 1.00 0.00 N ATOM 1962 CA VAL A 122 22.111 -9.304 -3.312 1.00 0.00 C ATOM 1963 C VAL A 122 21.698 -10.758 -3.124 1.00 0.00 C ATOM 1964 O VAL A 122 21.742 -11.260 -2.004 1.00 0.00 O ATOM 1965 CB VAL A 122 20.918 -8.317 -3.377 1.00 0.00 C ATOM 1966 CG1 VAL A 122 19.654 -8.877 -4.072 1.00 0.00 C ATOM 1967 CG2 VAL A 122 20.625 -7.796 -1.967 1.00 0.00 C ATOM 0 H VAL A 122 22.597 -8.387 -5.101 1.00 0.00 H new ATOM 0 HA VAL A 122 22.690 -9.047 -2.425 1.00 0.00 H new ATOM 0 HB VAL A 122 21.217 -7.490 -4.021 1.00 0.00 H new ATOM 0 HG11 VAL A 122 18.872 -8.118 -4.071 1.00 0.00 H new ATOM 0 HG12 VAL A 122 19.894 -9.149 -5.100 1.00 0.00 H new ATOM 0 HG13 VAL A 122 19.304 -9.759 -3.535 1.00 0.00 H new ATOM 0 HG21 VAL A 122 19.787 -7.100 -2.003 1.00 0.00 H new ATOM 0 HG22 VAL A 122 20.375 -8.633 -1.315 1.00 0.00 H new ATOM 0 HG23 VAL A 122 21.505 -7.284 -1.578 1.00 0.00 H new ATOM 1977 N ARG A 123 21.365 -11.458 -4.219 1.00 0.00 N ATOM 1978 CA ARG A 123 20.877 -12.831 -4.158 1.00 0.00 C ATOM 1979 C ARG A 123 21.876 -13.725 -3.435 1.00 0.00 C ATOM 1980 O ARG A 123 21.465 -14.695 -2.798 1.00 0.00 O ATOM 1981 CB ARG A 123 20.589 -13.371 -5.572 1.00 0.00 C ATOM 1982 CG ARG A 123 19.296 -12.793 -6.167 1.00 0.00 C ATOM 1983 CD ARG A 123 18.914 -13.431 -7.520 1.00 0.00 C ATOM 1984 NE ARG A 123 19.065 -12.479 -8.629 1.00 0.00 N ATOM 1985 CZ ARG A 123 19.148 -12.729 -9.941 1.00 0.00 C ATOM 1986 NH1 ARG A 123 18.977 -13.958 -10.419 1.00 0.00 N ATOM 1987 NH2 ARG A 123 19.403 -11.715 -10.763 1.00 0.00 N ATOM 0 H ARG A 123 21.429 -11.084 -5.166 1.00 0.00 H new ATOM 0 HA ARG A 123 19.944 -12.836 -3.595 1.00 0.00 H new ATOM 0 HB2 ARG A 123 21.426 -13.131 -6.227 1.00 0.00 H new ATOM 0 HB3 ARG A 123 20.515 -14.458 -5.535 1.00 0.00 H new ATOM 0 HG2 ARG A 123 18.480 -12.940 -5.459 1.00 0.00 H new ATOM 0 HG3 ARG A 123 19.413 -11.717 -6.299 1.00 0.00 H new ATOM 0 HD2 ARG A 123 19.541 -14.304 -7.701 1.00 0.00 H new ATOM 0 HD3 ARG A 123 17.883 -13.782 -7.479 1.00 0.00 H new ATOM 0 HE ARG A 123 19.113 -11.495 -8.363 1.00 0.00 H new ATOM 0 HH11 ARG A 123 18.779 -14.730 -9.782 1.00 0.00 H new ATOM 0 HH12 ARG A 123 19.044 -14.129 -11.422 1.00 0.00 H new ATOM 0 HH21 ARG A 123 19.530 -10.775 -10.389 1.00 0.00 H new ATOM 0 HH22 ARG A 123 19.472 -11.878 -11.768 1.00 0.00 H new ATOM 2001 N ARG A 124 23.171 -13.420 -3.516 1.00 0.00 N ATOM 2002 CA ARG A 124 24.249 -14.233 -2.977 1.00 0.00 C ATOM 2003 C ARG A 124 25.369 -13.370 -2.423 1.00 0.00 C ATOM 2004 O ARG A 124 26.547 -13.703 -2.579 1.00 0.00 O ATOM 2005 CB ARG A 124 24.696 -15.285 -4.012 1.00 0.00 C ATOM 2006 CG ARG A 124 24.637 -14.896 -5.499 1.00 0.00 C ATOM 2007 CD ARG A 124 25.400 -13.622 -5.882 1.00 0.00 C ATOM 2008 NE ARG A 124 26.726 -13.873 -6.469 1.00 0.00 N ATOM 2009 CZ ARG A 124 27.897 -13.368 -6.059 1.00 0.00 C ATOM 2010 NH1 ARG A 124 28.035 -12.823 -4.853 1.00 0.00 N ATOM 2011 NH2 ARG A 124 28.951 -13.429 -6.860 1.00 0.00 N ATOM 0 H ARG A 124 23.504 -12.572 -3.974 1.00 0.00 H new ATOM 0 HA ARG A 124 23.886 -14.798 -2.118 1.00 0.00 H new ATOM 0 HB2 ARG A 124 25.723 -15.568 -3.780 1.00 0.00 H new ATOM 0 HB3 ARG A 124 24.081 -16.174 -3.873 1.00 0.00 H new ATOM 0 HG2 ARG A 124 25.030 -15.724 -6.089 1.00 0.00 H new ATOM 0 HG3 ARG A 124 23.592 -14.771 -5.782 1.00 0.00 H new ATOM 0 HD2 ARG A 124 24.801 -13.052 -6.592 1.00 0.00 H new ATOM 0 HD3 ARG A 124 25.519 -13.001 -4.994 1.00 0.00 H new ATOM 0 HE ARG A 124 26.757 -14.498 -7.274 1.00 0.00 H new ATOM 0 HH11 ARG A 124 27.238 -12.783 -4.217 1.00 0.00 H new ATOM 0 HH12 ARG A 124 28.937 -12.445 -4.564 1.00 0.00 H new ATOM 0 HH21 ARG A 124 28.867 -13.858 -7.781 1.00 0.00 H new ATOM 0 HH22 ARG A 124 29.846 -13.047 -6.555 1.00 0.00 H new ATOM 2025 N LYS A 125 25.018 -12.261 -1.774 1.00 0.00 N ATOM 2026 CA LYS A 125 25.976 -11.509 -0.982 1.00 0.00 C ATOM 2027 C LYS A 125 26.555 -12.447 0.066 1.00 0.00 C ATOM 2028 O LYS A 125 27.682 -12.221 0.546 1.00 0.00 O ATOM 2029 CB LYS A 125 25.301 -10.237 -0.426 1.00 0.00 C ATOM 2030 CG LYS A 125 24.571 -10.463 0.903 1.00 0.00 C ATOM 2031 CD LYS A 125 25.462 -10.150 2.130 1.00 0.00 C ATOM 2032 CE LYS A 125 25.429 -11.185 3.262 1.00 0.00 C ATOM 2033 NZ LYS A 125 26.368 -12.300 3.021 1.00 0.00 N ATOM 0 H LYS A 125 24.077 -11.868 -1.784 1.00 0.00 H new ATOM 0 HA LYS A 125 26.816 -11.145 -1.573 1.00 0.00 H new ATOM 0 HB2 LYS A 125 26.057 -9.464 -0.289 1.00 0.00 H new ATOM 0 HB3 LYS A 125 24.591 -9.861 -1.162 1.00 0.00 H new ATOM 0 HG2 LYS A 125 23.680 -9.836 0.936 1.00 0.00 H new ATOM 0 HG3 LYS A 125 24.234 -11.498 0.957 1.00 0.00 H new ATOM 0 HD2 LYS A 125 26.492 -10.045 1.790 1.00 0.00 H new ATOM 0 HD3 LYS A 125 25.161 -9.185 2.537 1.00 0.00 H new ATOM 0 HE2 LYS A 125 25.678 -10.699 4.205 1.00 0.00 H new ATOM 0 HE3 LYS A 125 24.418 -11.579 3.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 26.819 -12.574 3.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 25.849 -13.113 2.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 27.098 -11.999 2.344 1.00 0.00 H new TER 2047 LYS A 125