USER MOD reduce.3.24.130724 H: found=0, std=0, add=723, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 723 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 78 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 79 HIS : no HE2:sc= 0.451 K(o=0.45,f=-1.5!) USER MOD Set 2.1: A 67 SER OG : rot 68:sc= 0.553 USER MOD Set 2.2: A 68 ASN : amide:sc= -0.192 X(o=0.82,f=1.1) USER MOD Set 2.3: A 71 GLN : amide:sc= 0.459 K(o=0.82,f=-1.9!) USER MOD Set 3.1: A 17 GLN : amide:sc= 0.512 K(o=0.51,f=-0.074) USER MOD Set 3.2: A 20 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl 161:sc= -0.126 (180deg=-0.579) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 HIS : no HD1:sc= -0.0326 X(o=-0.033,f=-0.027) USER MOD Single : A 3 HIS : no HD1:sc= 0.00172 X(o=0.0017,f=-0.034) USER MOD Single : A 4 HIS : no HD1:sc=-0.00992 X(o=-0.0099,f=0) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HE2:sc= 0.0868 K(o=0.087,f=-0.48) USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 SER OG : rot 180:sc= -0.0549 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 HIS : no HD1:sc= -0.0974 X(o=-0.097,f=-0.11) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0.0354 USER MOD Single : A 30 SER OG : rot 40:sc= 0.299 USER MOD Single : A 37 SER OG : rot 180:sc= 0.00194 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ 169:sc= 0.637 (180deg=0.572) USER MOD Single : A 41 LYS NZ :NH3+ 141:sc= -7.54! (180deg=-10.7!) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= 0.358 K(o=0.36,f=-2.4!) USER MOD Single : A 47 LYS NZ :NH3+ -142:sc= 0.8 (180deg=-0.291) USER MOD Single : A 50 SER OG : rot 180:sc= 0.0363 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ -121:sc= 0.471 (180deg=0.228) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot -41:sc= 0.137 USER MOD Single : A 70 LYS NZ :NH3+ 171:sc=-0.00122 (180deg=-0.0733) USER MOD Single : A 74 GLN :FLIP amide:sc= -0.0159 F(o=-0.85,f=-0.016) USER MOD Single : A 75 TYR OH : rot -140:sc= -1.05 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 ASN : amide:sc= -0.375 K(o=-0.37,f=-1.7) USER MOD Single : A 91 THR OG1 : rot -39:sc= 0.376 USER MOD Single : A 92 THR OG1 : rot 160:sc= 0 USER MOD Single : A 93 SER OG : rot -65:sc= 0.261 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -17.039 -9.593 -76.079 1.00 0.00 N ATOM 2 CA MET A 1 -18.513 -9.535 -75.946 1.00 0.00 C ATOM 3 C MET A 1 -19.141 -10.548 -76.913 1.00 0.00 C ATOM 4 O MET A 1 -18.845 -10.520 -78.116 1.00 0.00 O ATOM 5 CB MET A 1 -19.035 -8.104 -76.236 1.00 0.00 C ATOM 6 CG MET A 1 -20.551 -7.939 -76.064 1.00 0.00 C ATOM 7 SD MET A 1 -21.162 -6.316 -76.566 1.00 0.00 S ATOM 8 CE MET A 1 -20.749 -6.289 -78.312 1.00 0.00 C ATOM 0 H1 MET A 1 -16.604 -8.909 -75.427 1.00 0.00 H new ATOM 0 H2 MET A 1 -16.707 -10.551 -75.848 1.00 0.00 H new ATOM 0 H3 MET A 1 -16.769 -9.359 -77.056 1.00 0.00 H new ATOM 0 HA MET A 1 -18.794 -9.787 -74.924 1.00 0.00 H new ATOM 0 HB2 MET A 1 -18.527 -7.403 -75.573 1.00 0.00 H new ATOM 0 HB3 MET A 1 -18.765 -7.831 -77.256 1.00 0.00 H new ATOM 0 HG2 MET A 1 -21.060 -8.706 -76.647 1.00 0.00 H new ATOM 0 HG3 MET A 1 -20.810 -8.109 -75.019 1.00 0.00 H new ATOM 0 HE1 MET A 1 -21.346 -5.529 -78.815 1.00 0.00 H new ATOM 0 HE2 MET A 1 -19.691 -6.058 -78.432 1.00 0.00 H new ATOM 0 HE3 MET A 1 -20.959 -7.264 -78.751 1.00 0.00 H new ATOM 20 N HIS A 2 -20.008 -11.434 -76.390 1.00 0.00 N ATOM 21 CA HIS A 2 -20.633 -12.512 -77.183 1.00 0.00 C ATOM 22 C HIS A 2 -22.151 -12.539 -76.929 1.00 0.00 C ATOM 23 O HIS A 2 -22.597 -12.581 -75.775 1.00 0.00 O ATOM 24 CB HIS A 2 -19.977 -13.890 -76.863 1.00 0.00 C ATOM 25 CG HIS A 2 -20.174 -14.393 -75.447 1.00 0.00 C ATOM 26 ND1 HIS A 2 -20.734 -15.619 -75.159 1.00 0.00 N ATOM 27 CD2 HIS A 2 -19.866 -13.836 -74.248 1.00 0.00 C ATOM 28 CE1 HIS A 2 -20.767 -15.790 -73.852 1.00 0.00 C ATOM 29 NE2 HIS A 2 -20.251 -14.726 -73.278 1.00 0.00 N ATOM 0 H HIS A 2 -20.295 -11.425 -75.411 1.00 0.00 H new ATOM 0 HA HIS A 2 -20.467 -12.312 -78.242 1.00 0.00 H new ATOM 0 HB2 HIS A 2 -20.378 -14.633 -77.553 1.00 0.00 H new ATOM 0 HB3 HIS A 2 -18.907 -13.818 -77.059 1.00 0.00 H new ATOM 0 HD2 HIS A 2 -19.404 -12.873 -74.088 1.00 0.00 H new ATOM 0 HE1 HIS A 2 -21.153 -16.658 -73.339 1.00 0.00 H new ATOM 0 HE2 HIS A 2 -20.153 -14.585 -72.273 1.00 0.00 H new ATOM 38 N HIS A 3 -22.941 -12.452 -78.012 1.00 0.00 N ATOM 39 CA HIS A 3 -24.407 -12.576 -77.964 1.00 0.00 C ATOM 40 C HIS A 3 -24.843 -13.613 -79.009 1.00 0.00 C ATOM 41 O HIS A 3 -24.999 -13.300 -80.193 1.00 0.00 O ATOM 42 CB HIS A 3 -25.105 -11.201 -78.197 1.00 0.00 C ATOM 43 CG HIS A 3 -24.753 -10.160 -77.161 1.00 0.00 C ATOM 44 ND1 HIS A 3 -25.106 -10.278 -75.832 1.00 0.00 N ATOM 45 CD2 HIS A 3 -24.033 -9.013 -77.251 1.00 0.00 C ATOM 46 CE1 HIS A 3 -24.615 -9.259 -75.155 1.00 0.00 C ATOM 47 NE2 HIS A 3 -23.962 -8.477 -75.990 1.00 0.00 N ATOM 0 H HIS A 3 -22.578 -12.293 -78.952 1.00 0.00 H new ATOM 0 HA HIS A 3 -24.711 -12.910 -76.972 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -24.831 -10.827 -79.183 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -26.185 -11.347 -78.200 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -23.597 -8.599 -78.148 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -24.729 -9.093 -74.094 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -23.481 -7.613 -75.740 1.00 0.00 H new ATOM 56 N HIS A 4 -25.007 -14.866 -78.546 1.00 0.00 N ATOM 57 CA HIS A 4 -25.343 -16.037 -79.392 1.00 0.00 C ATOM 58 C HIS A 4 -26.872 -16.205 -79.517 1.00 0.00 C ATOM 59 O HIS A 4 -27.406 -17.317 -79.412 1.00 0.00 O ATOM 60 CB HIS A 4 -24.669 -17.321 -78.811 1.00 0.00 C ATOM 61 CG HIS A 4 -23.169 -17.389 -78.983 1.00 0.00 C ATOM 62 ND1 HIS A 4 -22.521 -18.497 -79.487 1.00 0.00 N ATOM 63 CD2 HIS A 4 -22.190 -16.490 -78.702 1.00 0.00 C ATOM 64 CE1 HIS A 4 -21.221 -18.280 -79.509 1.00 0.00 C ATOM 65 NE2 HIS A 4 -20.990 -17.072 -79.038 1.00 0.00 N ATOM 0 H HIS A 4 -24.909 -15.102 -77.558 1.00 0.00 H new ATOM 0 HA HIS A 4 -24.955 -15.872 -80.397 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -24.901 -17.385 -77.748 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -25.114 -18.194 -79.288 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -22.328 -15.501 -78.291 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -20.471 -18.976 -79.855 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -20.072 -16.639 -78.939 1.00 0.00 H new ATOM 74 N HIS A 5 -27.563 -15.080 -79.764 1.00 0.00 N ATOM 75 CA HIS A 5 -29.021 -15.029 -80.015 1.00 0.00 C ATOM 76 C HIS A 5 -29.319 -13.988 -81.107 1.00 0.00 C ATOM 77 O HIS A 5 -28.428 -13.217 -81.507 1.00 0.00 O ATOM 78 CB HIS A 5 -29.819 -14.703 -78.717 1.00 0.00 C ATOM 79 CG HIS A 5 -29.884 -15.842 -77.721 1.00 0.00 C ATOM 80 ND1 HIS A 5 -29.597 -15.698 -76.378 1.00 0.00 N ATOM 81 CD2 HIS A 5 -30.248 -17.141 -77.879 1.00 0.00 C ATOM 82 CE1 HIS A 5 -29.772 -16.853 -75.763 1.00 0.00 C ATOM 83 NE2 HIS A 5 -30.166 -17.744 -76.649 1.00 0.00 N ATOM 0 H HIS A 5 -27.120 -14.162 -79.796 1.00 0.00 H new ATOM 0 HA HIS A 5 -29.344 -16.014 -80.353 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -29.365 -13.838 -78.233 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -30.835 -14.418 -78.991 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -30.547 -17.613 -78.803 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -29.618 -17.036 -74.710 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -30.376 -18.723 -76.453 1.00 0.00 H new ATOM 92 N HIS A 6 -30.584 -13.969 -81.588 1.00 0.00 N ATOM 93 CA HIS A 6 -31.024 -13.032 -82.650 1.00 0.00 C ATOM 94 C HIS A 6 -31.073 -11.576 -82.140 1.00 0.00 C ATOM 95 O HIS A 6 -31.003 -11.324 -80.929 1.00 0.00 O ATOM 96 CB HIS A 6 -32.410 -13.450 -83.216 1.00 0.00 C ATOM 97 CG HIS A 6 -33.571 -13.285 -82.250 1.00 0.00 C ATOM 98 ND1 HIS A 6 -34.318 -12.122 -82.159 1.00 0.00 N ATOM 99 CD2 HIS A 6 -34.119 -14.143 -81.355 1.00 0.00 C ATOM 100 CE1 HIS A 6 -35.266 -12.278 -81.250 1.00 0.00 C ATOM 101 NE2 HIS A 6 -35.171 -13.494 -80.752 1.00 0.00 N ATOM 0 H HIS A 6 -31.320 -14.593 -81.257 1.00 0.00 H new ATOM 0 HA HIS A 6 -30.287 -13.082 -83.452 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -32.614 -12.861 -84.110 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -32.360 -14.494 -83.526 1.00 0.00 H new ATOM 0 HD1 HIS A 6 -34.161 -11.277 -82.708 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -33.790 -15.151 -81.153 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -35.995 -11.534 -80.964 1.00 0.00 H new ATOM 110 N HIS A 7 -31.218 -10.627 -83.084 1.00 0.00 N ATOM 111 CA HIS A 7 -31.264 -9.187 -82.776 1.00 0.00 C ATOM 112 C HIS A 7 -32.558 -8.843 -82.015 1.00 0.00 C ATOM 113 O HIS A 7 -33.664 -9.100 -82.501 1.00 0.00 O ATOM 114 CB HIS A 7 -31.153 -8.347 -84.073 1.00 0.00 C ATOM 115 CG HIS A 7 -29.868 -8.569 -84.836 1.00 0.00 C ATOM 116 ND1 HIS A 7 -29.788 -8.511 -86.209 1.00 0.00 N ATOM 117 CD2 HIS A 7 -28.608 -8.838 -84.404 1.00 0.00 C ATOM 118 CE1 HIS A 7 -28.549 -8.740 -86.591 1.00 0.00 C ATOM 119 NE2 HIS A 7 -27.815 -8.939 -85.517 1.00 0.00 N ATOM 0 H HIS A 7 -31.306 -10.837 -84.078 1.00 0.00 H new ATOM 0 HA HIS A 7 -30.414 -8.943 -82.139 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -31.996 -8.585 -84.722 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -31.235 -7.290 -83.818 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -28.291 -8.951 -83.378 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -28.195 -8.761 -87.611 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -26.814 -9.137 -85.514 1.00 0.00 H new ATOM 128 N SER A 8 -32.388 -8.292 -80.809 1.00 0.00 N ATOM 129 CA SER A 8 -33.486 -7.911 -79.919 1.00 0.00 C ATOM 130 C SER A 8 -33.077 -6.650 -79.130 1.00 0.00 C ATOM 131 O SER A 8 -31.946 -6.154 -79.278 1.00 0.00 O ATOM 132 CB SER A 8 -33.829 -9.094 -78.970 1.00 0.00 C ATOM 133 OG SER A 8 -34.969 -8.814 -78.170 1.00 0.00 O ATOM 0 H SER A 8 -31.467 -8.095 -80.418 1.00 0.00 H new ATOM 0 HA SER A 8 -34.381 -7.682 -80.498 1.00 0.00 H new ATOM 0 HB2 SER A 8 -34.010 -9.992 -79.560 1.00 0.00 H new ATOM 0 HB3 SER A 8 -32.975 -9.303 -78.326 1.00 0.00 H new ATOM 0 HG SER A 8 -35.156 -9.580 -77.588 1.00 0.00 H new ATOM 139 N SER A 9 -34.005 -6.131 -78.308 1.00 0.00 N ATOM 140 CA SER A 9 -33.763 -4.963 -77.443 1.00 0.00 C ATOM 141 C SER A 9 -32.918 -5.389 -76.209 1.00 0.00 C ATOM 142 O SER A 9 -33.419 -5.451 -75.078 1.00 0.00 O ATOM 143 CB SER A 9 -35.120 -4.321 -77.033 1.00 0.00 C ATOM 144 OG SER A 9 -34.937 -3.137 -76.272 1.00 0.00 O ATOM 0 H SER A 9 -34.948 -6.511 -78.224 1.00 0.00 H new ATOM 0 HA SER A 9 -33.194 -4.208 -77.985 1.00 0.00 H new ATOM 0 HB2 SER A 9 -35.698 -4.091 -77.928 1.00 0.00 H new ATOM 0 HB3 SER A 9 -35.701 -5.039 -76.454 1.00 0.00 H new ATOM 0 HG SER A 9 -35.811 -2.762 -76.035 1.00 0.00 H new ATOM 150 N GLY A 10 -31.628 -5.712 -76.465 1.00 0.00 N ATOM 151 CA GLY A 10 -30.716 -6.234 -75.446 1.00 0.00 C ATOM 152 C GLY A 10 -29.840 -5.139 -74.856 1.00 0.00 C ATOM 153 O GLY A 10 -28.671 -5.003 -75.220 1.00 0.00 O ATOM 0 H GLY A 10 -31.201 -5.614 -77.386 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -31.292 -6.706 -74.650 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -30.085 -7.007 -75.885 1.00 0.00 H new ATOM 157 N ARG A 11 -30.435 -4.334 -73.965 1.00 0.00 N ATOM 158 CA ARG A 11 -29.752 -3.214 -73.273 1.00 0.00 C ATOM 159 C ARG A 11 -28.938 -3.748 -72.082 1.00 0.00 C ATOM 160 O ARG A 11 -27.890 -3.196 -71.730 1.00 0.00 O ATOM 161 CB ARG A 11 -30.793 -2.148 -72.800 1.00 0.00 C ATOM 162 CG ARG A 11 -31.344 -1.201 -73.905 1.00 0.00 C ATOM 163 CD ARG A 11 -31.870 -1.940 -75.142 1.00 0.00 C ATOM 164 NE ARG A 11 -32.531 -1.049 -76.107 1.00 0.00 N ATOM 165 CZ ARG A 11 -32.535 -1.214 -77.436 1.00 0.00 C ATOM 166 NH1 ARG A 11 -31.762 -2.130 -78.017 1.00 0.00 N ATOM 167 NH2 ARG A 11 -33.306 -0.443 -78.182 1.00 0.00 N ATOM 0 H ARG A 11 -31.414 -4.437 -73.696 1.00 0.00 H new ATOM 0 HA ARG A 11 -29.068 -2.733 -73.972 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -31.634 -2.668 -72.341 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -30.333 -1.539 -72.022 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -32.147 -0.595 -73.485 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -30.554 -0.515 -74.211 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -31.041 -2.448 -75.634 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -32.574 -2.710 -74.826 1.00 0.00 H new ATOM 0 HE ARG A 11 -33.027 -0.239 -75.734 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -31.154 -2.720 -77.448 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -31.778 -2.242 -79.031 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -33.891 0.269 -77.745 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -33.317 -0.560 -79.195 1.00 0.00 H new ATOM 181 N GLU A 12 -29.438 -4.848 -71.490 1.00 0.00 N ATOM 182 CA GLU A 12 -28.802 -5.540 -70.351 1.00 0.00 C ATOM 183 C GLU A 12 -27.594 -6.403 -70.825 1.00 0.00 C ATOM 184 O GLU A 12 -27.045 -6.157 -71.910 1.00 0.00 O ATOM 185 CB GLU A 12 -29.886 -6.390 -69.626 1.00 0.00 C ATOM 186 CG GLU A 12 -31.053 -5.546 -69.069 1.00 0.00 C ATOM 187 CD GLU A 12 -32.135 -6.383 -68.368 1.00 0.00 C ATOM 188 OE1 GLU A 12 -31.963 -6.715 -67.174 1.00 0.00 O ATOM 189 OE2 GLU A 12 -33.156 -6.719 -69.007 1.00 0.00 O ATOM 0 H GLU A 12 -30.307 -5.288 -71.793 1.00 0.00 H new ATOM 0 HA GLU A 12 -28.396 -4.812 -69.648 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -30.282 -7.131 -70.321 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -29.420 -6.938 -68.807 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -30.658 -4.814 -68.365 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -31.509 -4.988 -69.886 1.00 0.00 H new ATOM 196 N ASN A 13 -27.189 -7.394 -69.992 1.00 0.00 N ATOM 197 CA ASN A 13 -25.997 -8.257 -70.207 1.00 0.00 C ATOM 198 C ASN A 13 -24.714 -7.445 -69.966 1.00 0.00 C ATOM 199 O ASN A 13 -23.974 -7.091 -70.898 1.00 0.00 O ATOM 200 CB ASN A 13 -25.978 -8.972 -71.586 1.00 0.00 C ATOM 201 CG ASN A 13 -27.228 -9.810 -71.841 1.00 0.00 C ATOM 202 OD1 ASN A 13 -27.300 -10.976 -71.458 1.00 0.00 O ATOM 203 ND2 ASN A 13 -28.209 -9.225 -72.515 1.00 0.00 N ATOM 0 H ASN A 13 -27.691 -7.621 -69.134 1.00 0.00 H new ATOM 0 HA ASN A 13 -26.053 -9.064 -69.477 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -25.881 -8.226 -72.375 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -25.099 -9.614 -71.644 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -29.059 -9.745 -72.732 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -28.113 -8.255 -72.816 1.00 0.00 H new ATOM 210 N LEU A 14 -24.512 -7.114 -68.686 1.00 0.00 N ATOM 211 CA LEU A 14 -23.361 -6.340 -68.198 1.00 0.00 C ATOM 212 C LEU A 14 -23.085 -6.699 -66.718 1.00 0.00 C ATOM 213 O LEU A 14 -23.618 -7.695 -66.210 1.00 0.00 O ATOM 214 CB LEU A 14 -23.569 -4.798 -68.407 1.00 0.00 C ATOM 215 CG LEU A 14 -24.630 -4.063 -67.516 1.00 0.00 C ATOM 216 CD1 LEU A 14 -24.516 -2.531 -67.678 1.00 0.00 C ATOM 217 CD2 LEU A 14 -26.068 -4.538 -67.806 1.00 0.00 C ATOM 0 H LEU A 14 -25.157 -7.382 -67.943 1.00 0.00 H new ATOM 0 HA LEU A 14 -22.482 -6.607 -68.784 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -22.608 -4.309 -68.251 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -23.842 -4.638 -69.450 1.00 0.00 H new ATOM 0 HG LEU A 14 -24.411 -4.322 -66.480 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -25.262 -2.042 -67.051 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -23.520 -2.206 -67.377 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -24.686 -2.262 -68.720 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -26.765 -4.000 -67.164 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -26.312 -4.343 -68.850 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -26.145 -5.607 -67.609 1.00 0.00 H new ATOM 229 N TYR A 15 -22.247 -5.890 -66.036 1.00 0.00 N ATOM 230 CA TYR A 15 -21.765 -6.183 -64.674 1.00 0.00 C ATOM 231 C TYR A 15 -21.598 -4.861 -63.882 1.00 0.00 C ATOM 232 O TYR A 15 -20.587 -4.155 -64.019 1.00 0.00 O ATOM 233 CB TYR A 15 -20.426 -7.005 -64.753 1.00 0.00 C ATOM 234 CG TYR A 15 -19.246 -6.281 -65.451 1.00 0.00 C ATOM 235 CD1 TYR A 15 -19.362 -5.790 -66.755 1.00 0.00 C ATOM 236 CD2 TYR A 15 -18.034 -6.053 -64.787 1.00 0.00 C ATOM 237 CE1 TYR A 15 -18.333 -5.103 -67.361 1.00 0.00 C ATOM 238 CE2 TYR A 15 -16.998 -5.369 -65.397 1.00 0.00 C ATOM 239 CZ TYR A 15 -17.155 -4.893 -66.684 1.00 0.00 C ATOM 240 OH TYR A 15 -16.127 -4.200 -67.297 1.00 0.00 O ATOM 0 H TYR A 15 -21.887 -5.015 -66.417 1.00 0.00 H new ATOM 0 HA TYR A 15 -22.494 -6.793 -64.140 1.00 0.00 H new ATOM 0 HB2 TYR A 15 -20.121 -7.270 -63.741 1.00 0.00 H new ATOM 0 HB3 TYR A 15 -20.622 -7.938 -65.281 1.00 0.00 H new ATOM 0 HD1 TYR A 15 -20.280 -5.953 -67.300 1.00 0.00 H new ATOM 0 HD2 TYR A 15 -17.906 -6.418 -63.779 1.00 0.00 H new ATOM 0 HE1 TYR A 15 -18.452 -4.730 -68.367 1.00 0.00 H new ATOM 0 HE2 TYR A 15 -16.070 -5.208 -64.869 1.00 0.00 H new ATOM 0 HH TYR A 15 -15.365 -4.136 -66.685 1.00 0.00 H new ATOM 250 N PHE A 16 -22.623 -4.482 -63.096 1.00 0.00 N ATOM 251 CA PHE A 16 -22.547 -3.280 -62.244 1.00 0.00 C ATOM 252 C PHE A 16 -21.774 -3.635 -60.961 1.00 0.00 C ATOM 253 O PHE A 16 -22.327 -4.237 -60.030 1.00 0.00 O ATOM 254 CB PHE A 16 -23.958 -2.702 -61.926 1.00 0.00 C ATOM 255 CG PHE A 16 -23.909 -1.354 -61.194 1.00 0.00 C ATOM 256 CD1 PHE A 16 -23.737 -0.161 -61.904 1.00 0.00 C ATOM 257 CD2 PHE A 16 -23.994 -1.279 -59.799 1.00 0.00 C ATOM 258 CE1 PHE A 16 -23.650 1.052 -61.244 1.00 0.00 C ATOM 259 CE2 PHE A 16 -23.913 -0.062 -59.143 1.00 0.00 C ATOM 260 CZ PHE A 16 -23.738 1.101 -59.865 1.00 0.00 C ATOM 0 H PHE A 16 -23.507 -4.986 -63.033 1.00 0.00 H new ATOM 0 HA PHE A 16 -22.016 -2.494 -62.781 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -24.513 -2.583 -62.857 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -24.508 -3.419 -61.317 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -23.671 -0.187 -62.982 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -24.125 -2.184 -59.225 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -23.513 1.963 -61.808 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -23.987 -0.023 -58.066 1.00 0.00 H new ATOM 0 HZ PHE A 16 -23.670 2.049 -59.353 1.00 0.00 H new ATOM 270 N GLN A 17 -20.485 -3.286 -60.961 1.00 0.00 N ATOM 271 CA GLN A 17 -19.561 -3.566 -59.855 1.00 0.00 C ATOM 272 C GLN A 17 -18.344 -2.630 -59.950 1.00 0.00 C ATOM 273 O GLN A 17 -18.242 -1.818 -60.886 1.00 0.00 O ATOM 274 CB GLN A 17 -19.097 -5.052 -59.897 1.00 0.00 C ATOM 275 CG GLN A 17 -18.392 -5.450 -61.208 1.00 0.00 C ATOM 276 CD GLN A 17 -17.796 -6.854 -61.172 1.00 0.00 C ATOM 277 OE1 GLN A 17 -18.463 -7.833 -61.507 1.00 0.00 O ATOM 278 NE2 GLN A 17 -16.537 -6.958 -60.776 1.00 0.00 N ATOM 0 H GLN A 17 -20.046 -2.794 -61.739 1.00 0.00 H new ATOM 0 HA GLN A 17 -20.077 -3.392 -58.911 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -18.420 -5.235 -59.062 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -19.964 -5.697 -59.752 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -19.106 -5.387 -62.029 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -17.599 -4.732 -61.418 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -16.017 -6.123 -60.506 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -16.087 -7.873 -60.741 1.00 0.00 H new ATOM 287 N GLY A 18 -17.425 -2.756 -58.979 1.00 0.00 N ATOM 288 CA GLY A 18 -16.141 -2.045 -59.002 1.00 0.00 C ATOM 289 C GLY A 18 -15.019 -2.932 -59.538 1.00 0.00 C ATOM 290 O GLY A 18 -15.201 -3.626 -60.553 1.00 0.00 O ATOM 0 H GLY A 18 -17.552 -3.351 -58.161 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -16.229 -1.153 -59.622 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -15.892 -1.710 -57.995 1.00 0.00 H new ATOM 294 N HIS A 19 -13.861 -2.913 -58.851 1.00 0.00 N ATOM 295 CA HIS A 19 -12.665 -3.695 -59.232 1.00 0.00 C ATOM 296 C HIS A 19 -12.685 -5.095 -58.581 1.00 0.00 C ATOM 297 O HIS A 19 -13.247 -5.274 -57.491 1.00 0.00 O ATOM 298 CB HIS A 19 -11.372 -2.927 -58.827 1.00 0.00 C ATOM 299 CG HIS A 19 -11.271 -2.581 -57.353 1.00 0.00 C ATOM 300 ND1 HIS A 19 -11.518 -1.315 -56.868 1.00 0.00 N ATOM 301 CD2 HIS A 19 -10.946 -3.333 -56.266 1.00 0.00 C ATOM 302 CE1 HIS A 19 -11.355 -1.304 -55.558 1.00 0.00 C ATOM 303 NE2 HIS A 19 -11.009 -2.511 -55.167 1.00 0.00 N ATOM 0 H HIS A 19 -13.726 -2.352 -58.010 1.00 0.00 H new ATOM 0 HA HIS A 19 -12.675 -3.828 -60.314 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -10.507 -3.529 -59.104 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -11.317 -2.005 -59.406 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -10.687 -4.381 -56.267 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -11.484 -0.446 -54.914 1.00 0.00 H new ATOM 0 HE2 HIS A 19 -10.819 -2.791 -54.205 1.00 0.00 H new ATOM 312 N MET A 20 -12.070 -6.075 -59.265 1.00 0.00 N ATOM 313 CA MET A 20 -11.849 -7.442 -58.745 1.00 0.00 C ATOM 314 C MET A 20 -10.494 -7.956 -59.264 1.00 0.00 C ATOM 315 O MET A 20 -10.345 -8.220 -60.464 1.00 0.00 O ATOM 316 CB MET A 20 -12.988 -8.429 -59.176 1.00 0.00 C ATOM 317 CG MET A 20 -14.349 -8.201 -58.500 1.00 0.00 C ATOM 318 SD MET A 20 -15.599 -9.416 -58.993 1.00 0.00 S ATOM 319 CE MET A 20 -17.007 -8.900 -58.004 1.00 0.00 C ATOM 0 H MET A 20 -11.706 -5.941 -60.208 1.00 0.00 H new ATOM 0 HA MET A 20 -11.854 -7.397 -57.656 1.00 0.00 H new ATOM 0 HB2 MET A 20 -13.121 -8.355 -60.255 1.00 0.00 H new ATOM 0 HB3 MET A 20 -12.662 -9.447 -58.964 1.00 0.00 H new ATOM 0 HG2 MET A 20 -14.221 -8.238 -57.418 1.00 0.00 H new ATOM 0 HG3 MET A 20 -14.707 -7.201 -58.745 1.00 0.00 H new ATOM 0 HE1 MET A 20 -17.853 -9.558 -58.203 1.00 0.00 H new ATOM 0 HE2 MET A 20 -16.748 -8.953 -56.947 1.00 0.00 H new ATOM 0 HE3 MET A 20 -17.276 -7.876 -58.261 1.00 0.00 H new ATOM 329 N ALA A 21 -9.507 -8.072 -58.364 1.00 0.00 N ATOM 330 CA ALA A 21 -8.178 -8.608 -58.702 1.00 0.00 C ATOM 331 C ALA A 21 -8.195 -10.145 -58.635 1.00 0.00 C ATOM 332 O ALA A 21 -9.062 -10.739 -57.978 1.00 0.00 O ATOM 333 CB ALA A 21 -7.114 -8.025 -57.752 1.00 0.00 C ATOM 0 H ALA A 21 -9.605 -7.799 -57.386 1.00 0.00 H new ATOM 0 HA ALA A 21 -7.923 -8.314 -59.720 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -6.135 -8.428 -58.011 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -7.096 -6.939 -57.848 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -7.357 -8.295 -56.724 1.00 0.00 H new ATOM 339 N SER A 22 -7.239 -10.779 -59.332 1.00 0.00 N ATOM 340 CA SER A 22 -7.014 -12.240 -59.263 1.00 0.00 C ATOM 341 C SER A 22 -6.185 -12.579 -57.998 1.00 0.00 C ATOM 342 O SER A 22 -6.082 -11.755 -57.082 1.00 0.00 O ATOM 343 CB SER A 22 -6.309 -12.718 -60.562 1.00 0.00 C ATOM 344 OG SER A 22 -5.059 -12.070 -60.748 1.00 0.00 O ATOM 0 H SER A 22 -6.597 -10.297 -59.961 1.00 0.00 H new ATOM 0 HA SER A 22 -7.966 -12.765 -59.187 1.00 0.00 H new ATOM 0 HB2 SER A 22 -6.157 -13.797 -60.518 1.00 0.00 H new ATOM 0 HB3 SER A 22 -6.953 -12.521 -61.419 1.00 0.00 H new ATOM 0 HG SER A 22 -4.642 -12.395 -61.573 1.00 0.00 H new ATOM 350 N GLY A 23 -5.636 -13.800 -57.920 1.00 0.00 N ATOM 351 CA GLY A 23 -4.798 -14.182 -56.787 1.00 0.00 C ATOM 352 C GLY A 23 -4.179 -15.550 -56.958 1.00 0.00 C ATOM 353 O GLY A 23 -4.543 -16.293 -57.884 1.00 0.00 O ATOM 0 H GLY A 23 -5.758 -14.529 -58.623 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -4.007 -13.443 -56.659 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -5.397 -14.169 -55.876 1.00 0.00 H new ATOM 357 N SER A 24 -3.215 -15.848 -56.064 1.00 0.00 N ATOM 358 CA SER A 24 -2.504 -17.141 -55.991 1.00 0.00 C ATOM 359 C SER A 24 -1.657 -17.400 -57.270 1.00 0.00 C ATOM 360 O SER A 24 -1.493 -16.510 -58.124 1.00 0.00 O ATOM 361 CB SER A 24 -3.513 -18.296 -55.708 1.00 0.00 C ATOM 362 OG SER A 24 -2.861 -19.531 -55.455 1.00 0.00 O ATOM 0 H SER A 24 -2.902 -15.182 -55.357 1.00 0.00 H new ATOM 0 HA SER A 24 -1.800 -17.103 -55.159 1.00 0.00 H new ATOM 0 HB2 SER A 24 -4.132 -18.032 -54.851 1.00 0.00 H new ATOM 0 HB3 SER A 24 -4.181 -18.409 -56.562 1.00 0.00 H new ATOM 0 HG SER A 24 -3.531 -20.225 -55.282 1.00 0.00 H new ATOM 368 N GLU A 25 -1.090 -18.607 -57.365 1.00 0.00 N ATOM 369 CA GLU A 25 -0.369 -19.083 -58.558 1.00 0.00 C ATOM 370 C GLU A 25 -0.450 -20.630 -58.589 1.00 0.00 C ATOM 371 O GLU A 25 -1.100 -21.234 -57.716 1.00 0.00 O ATOM 372 CB GLU A 25 1.112 -18.563 -58.533 1.00 0.00 C ATOM 373 CG GLU A 25 1.829 -18.558 -59.904 1.00 0.00 C ATOM 374 CD GLU A 25 3.243 -17.945 -59.858 1.00 0.00 C ATOM 375 OE1 GLU A 25 4.235 -18.693 -59.875 1.00 0.00 O ATOM 376 OE2 GLU A 25 3.361 -16.699 -59.786 1.00 0.00 O ATOM 0 H GLU A 25 -1.117 -19.291 -56.609 1.00 0.00 H new ATOM 0 HA GLU A 25 -0.823 -18.694 -59.469 1.00 0.00 H new ATOM 0 HB2 GLU A 25 1.118 -17.549 -58.134 1.00 0.00 H new ATOM 0 HB3 GLU A 25 1.686 -19.181 -57.842 1.00 0.00 H new ATOM 0 HG2 GLU A 25 1.897 -19.581 -60.273 1.00 0.00 H new ATOM 0 HG3 GLU A 25 1.224 -18.001 -60.619 1.00 0.00 H new ATOM 383 N GLU A 26 0.162 -21.254 -59.617 1.00 0.00 N ATOM 384 CA GLU A 26 0.267 -22.723 -59.735 1.00 0.00 C ATOM 385 C GLU A 26 0.835 -23.361 -58.445 1.00 0.00 C ATOM 386 O GLU A 26 1.771 -22.823 -57.832 1.00 0.00 O ATOM 387 CB GLU A 26 1.161 -23.091 -60.951 1.00 0.00 C ATOM 388 CG GLU A 26 1.375 -24.603 -61.172 1.00 0.00 C ATOM 389 CD GLU A 26 2.332 -24.912 -62.332 1.00 0.00 C ATOM 390 OE1 GLU A 26 1.861 -25.156 -63.474 1.00 0.00 O ATOM 391 OE2 GLU A 26 3.562 -24.892 -62.112 1.00 0.00 O ATOM 0 H GLU A 26 0.598 -20.752 -60.390 1.00 0.00 H new ATOM 0 HA GLU A 26 -0.737 -23.120 -59.886 1.00 0.00 H new ATOM 0 HB2 GLU A 26 0.716 -22.667 -61.851 1.00 0.00 H new ATOM 0 HB3 GLU A 26 2.134 -22.617 -60.824 1.00 0.00 H new ATOM 0 HG2 GLU A 26 1.768 -25.046 -60.257 1.00 0.00 H new ATOM 0 HG3 GLU A 26 0.412 -25.076 -61.367 1.00 0.00 H new ATOM 398 N GLU A 27 0.259 -24.514 -58.061 1.00 0.00 N ATOM 399 CA GLU A 27 0.617 -25.227 -56.832 1.00 0.00 C ATOM 400 C GLU A 27 2.005 -25.887 -56.986 1.00 0.00 C ATOM 401 O GLU A 27 2.123 -27.036 -57.428 1.00 0.00 O ATOM 402 CB GLU A 27 -0.474 -26.288 -56.514 1.00 0.00 C ATOM 403 CG GLU A 27 -0.306 -27.017 -55.165 1.00 0.00 C ATOM 404 CD GLU A 27 -1.292 -28.182 -54.974 1.00 0.00 C ATOM 405 OE1 GLU A 27 -2.515 -27.940 -54.943 1.00 0.00 O ATOM 406 OE2 GLU A 27 -0.855 -29.341 -54.871 1.00 0.00 O ATOM 0 H GLU A 27 -0.472 -24.976 -58.601 1.00 0.00 H new ATOM 0 HA GLU A 27 0.671 -24.522 -56.002 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -1.448 -25.799 -56.526 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -0.480 -27.030 -57.312 1.00 0.00 H new ATOM 0 HG2 GLU A 27 0.713 -27.397 -55.090 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -0.440 -26.301 -54.354 1.00 0.00 H new ATOM 413 N VAL A 28 3.061 -25.117 -56.689 1.00 0.00 N ATOM 414 CA VAL A 28 4.436 -25.631 -56.654 1.00 0.00 C ATOM 415 C VAL A 28 4.671 -26.345 -55.307 1.00 0.00 C ATOM 416 O VAL A 28 4.755 -25.722 -54.246 1.00 0.00 O ATOM 417 CB VAL A 28 5.509 -24.502 -56.936 1.00 0.00 C ATOM 418 CG1 VAL A 28 5.459 -24.073 -58.427 1.00 0.00 C ATOM 419 CG2 VAL A 28 5.336 -23.269 -56.007 1.00 0.00 C ATOM 0 H VAL A 28 2.986 -24.124 -56.467 1.00 0.00 H new ATOM 0 HA VAL A 28 4.564 -26.353 -57.461 1.00 0.00 H new ATOM 0 HB VAL A 28 6.488 -24.927 -56.716 1.00 0.00 H new ATOM 0 HG11 VAL A 28 6.202 -23.296 -58.607 1.00 0.00 H new ATOM 0 HG12 VAL A 28 5.673 -24.934 -59.061 1.00 0.00 H new ATOM 0 HG13 VAL A 28 4.467 -23.688 -58.662 1.00 0.00 H new ATOM 0 HG21 VAL A 28 6.097 -22.526 -56.243 1.00 0.00 H new ATOM 0 HG22 VAL A 28 4.347 -22.836 -56.158 1.00 0.00 H new ATOM 0 HG23 VAL A 28 5.442 -23.579 -54.967 1.00 0.00 H new ATOM 429 N VAL A 29 4.734 -27.678 -55.382 1.00 0.00 N ATOM 430 CA VAL A 29 4.752 -28.566 -54.208 1.00 0.00 C ATOM 431 C VAL A 29 6.195 -28.848 -53.763 1.00 0.00 C ATOM 432 O VAL A 29 7.010 -29.327 -54.550 1.00 0.00 O ATOM 433 CB VAL A 29 3.965 -29.909 -54.499 1.00 0.00 C ATOM 434 CG1 VAL A 29 2.445 -29.636 -54.577 1.00 0.00 C ATOM 435 CG2 VAL A 29 4.454 -30.615 -55.797 1.00 0.00 C ATOM 0 H VAL A 29 4.775 -28.180 -56.269 1.00 0.00 H new ATOM 0 HA VAL A 29 4.243 -28.059 -53.389 1.00 0.00 H new ATOM 0 HB VAL A 29 4.169 -30.585 -53.669 1.00 0.00 H new ATOM 0 HG11 VAL A 29 1.918 -30.569 -54.778 1.00 0.00 H new ATOM 0 HG12 VAL A 29 2.101 -29.221 -53.630 1.00 0.00 H new ATOM 0 HG13 VAL A 29 2.244 -28.926 -55.379 1.00 0.00 H new ATOM 0 HG21 VAL A 29 3.882 -31.530 -55.951 1.00 0.00 H new ATOM 0 HG22 VAL A 29 4.311 -29.950 -56.649 1.00 0.00 H new ATOM 0 HG23 VAL A 29 5.512 -30.860 -55.702 1.00 0.00 H new ATOM 445 N SER A 30 6.504 -28.527 -52.495 1.00 0.00 N ATOM 446 CA SER A 30 7.827 -28.757 -51.899 1.00 0.00 C ATOM 447 C SER A 30 7.661 -29.183 -50.425 1.00 0.00 C ATOM 448 O SER A 30 7.202 -28.395 -49.585 1.00 0.00 O ATOM 449 CB SER A 30 8.686 -27.478 -52.015 1.00 0.00 C ATOM 450 OG SER A 30 8.038 -26.356 -51.444 1.00 0.00 O ATOM 0 H SER A 30 5.838 -28.098 -51.853 1.00 0.00 H new ATOM 0 HA SER A 30 8.338 -29.557 -52.435 1.00 0.00 H new ATOM 0 HB2 SER A 30 9.643 -27.637 -51.518 1.00 0.00 H new ATOM 0 HB3 SER A 30 8.901 -27.278 -53.065 1.00 0.00 H new ATOM 0 HG SER A 30 7.583 -26.626 -50.619 1.00 0.00 H new ATOM 456 N VAL A 31 8.042 -30.432 -50.131 1.00 0.00 N ATOM 457 CA VAL A 31 7.972 -31.021 -48.787 1.00 0.00 C ATOM 458 C VAL A 31 9.376 -31.011 -48.164 1.00 0.00 C ATOM 459 O VAL A 31 10.335 -31.485 -48.781 1.00 0.00 O ATOM 460 CB VAL A 31 7.431 -32.501 -48.849 1.00 0.00 C ATOM 461 CG1 VAL A 31 7.348 -33.142 -47.437 1.00 0.00 C ATOM 462 CG2 VAL A 31 6.066 -32.572 -49.590 1.00 0.00 C ATOM 0 H VAL A 31 8.414 -31.073 -50.832 1.00 0.00 H new ATOM 0 HA VAL A 31 7.286 -30.432 -48.178 1.00 0.00 H new ATOM 0 HB VAL A 31 8.148 -33.086 -49.424 1.00 0.00 H new ATOM 0 HG11 VAL A 31 6.971 -34.161 -47.522 1.00 0.00 H new ATOM 0 HG12 VAL A 31 8.340 -33.158 -46.986 1.00 0.00 H new ATOM 0 HG13 VAL A 31 6.674 -32.557 -46.811 1.00 0.00 H new ATOM 0 HG21 VAL A 31 5.719 -33.605 -49.616 1.00 0.00 H new ATOM 0 HG22 VAL A 31 5.335 -31.957 -49.065 1.00 0.00 H new ATOM 0 HG23 VAL A 31 6.185 -32.204 -50.609 1.00 0.00 H new ATOM 472 N GLU A 32 9.489 -30.466 -46.950 1.00 0.00 N ATOM 473 CA GLU A 32 10.757 -30.414 -46.219 1.00 0.00 C ATOM 474 C GLU A 32 11.000 -31.748 -45.492 1.00 0.00 C ATOM 475 O GLU A 32 10.327 -32.068 -44.511 1.00 0.00 O ATOM 476 CB GLU A 32 10.760 -29.223 -45.225 1.00 0.00 C ATOM 477 CG GLU A 32 10.566 -27.848 -45.896 1.00 0.00 C ATOM 478 CD GLU A 32 10.544 -26.681 -44.898 1.00 0.00 C ATOM 479 OE1 GLU A 32 9.639 -26.653 -44.035 1.00 0.00 O ATOM 480 OE2 GLU A 32 11.408 -25.782 -44.978 1.00 0.00 O ATOM 0 H GLU A 32 8.705 -30.049 -46.447 1.00 0.00 H new ATOM 0 HA GLU A 32 11.571 -30.259 -46.927 1.00 0.00 H new ATOM 0 HB2 GLU A 32 9.968 -29.373 -44.491 1.00 0.00 H new ATOM 0 HB3 GLU A 32 11.704 -29.220 -44.680 1.00 0.00 H new ATOM 0 HG2 GLU A 32 11.369 -27.686 -46.615 1.00 0.00 H new ATOM 0 HG3 GLU A 32 9.632 -27.854 -46.457 1.00 0.00 H new ATOM 487 N LEU A 33 11.946 -32.525 -46.030 1.00 0.00 N ATOM 488 CA LEU A 33 12.364 -33.838 -45.489 1.00 0.00 C ATOM 489 C LEU A 33 13.396 -33.633 -44.338 1.00 0.00 C ATOM 490 O LEU A 33 13.931 -32.528 -44.212 1.00 0.00 O ATOM 491 CB LEU A 33 12.938 -34.697 -46.676 1.00 0.00 C ATOM 492 CG LEU A 33 11.915 -35.525 -47.525 1.00 0.00 C ATOM 493 CD1 LEU A 33 11.402 -36.753 -46.756 1.00 0.00 C ATOM 494 CD2 LEU A 33 10.750 -34.654 -48.011 1.00 0.00 C ATOM 0 H LEU A 33 12.458 -32.260 -46.872 1.00 0.00 H new ATOM 0 HA LEU A 33 11.520 -34.374 -45.056 1.00 0.00 H new ATOM 0 HB2 LEU A 33 13.471 -34.027 -47.350 1.00 0.00 H new ATOM 0 HB3 LEU A 33 13.674 -35.389 -46.266 1.00 0.00 H new ATOM 0 HG LEU A 33 12.449 -35.886 -48.404 1.00 0.00 H new ATOM 0 HD11 LEU A 33 10.695 -37.302 -47.377 1.00 0.00 H new ATOM 0 HD12 LEU A 33 12.241 -37.401 -46.503 1.00 0.00 H new ATOM 0 HD13 LEU A 33 10.906 -36.428 -45.842 1.00 0.00 H new ATOM 0 HD21 LEU A 33 10.061 -35.262 -48.597 1.00 0.00 H new ATOM 0 HD22 LEU A 33 10.225 -34.236 -47.152 1.00 0.00 H new ATOM 0 HD23 LEU A 33 11.135 -33.844 -48.630 1.00 0.00 H new ATOM 506 N PRO A 34 13.681 -34.682 -43.467 1.00 0.00 N ATOM 507 CA PRO A 34 14.589 -34.546 -42.285 1.00 0.00 C ATOM 508 C PRO A 34 15.954 -33.896 -42.609 1.00 0.00 C ATOM 509 O PRO A 34 16.535 -34.140 -43.671 1.00 0.00 O ATOM 510 CB PRO A 34 14.760 -36.013 -41.774 1.00 0.00 C ATOM 511 CG PRO A 34 14.218 -36.876 -42.878 1.00 0.00 C ATOM 512 CD PRO A 34 13.126 -36.063 -43.518 1.00 0.00 C ATOM 0 HA PRO A 34 14.163 -33.872 -41.542 1.00 0.00 H new ATOM 0 HB2 PRO A 34 15.807 -36.241 -41.573 1.00 0.00 H new ATOM 0 HB3 PRO A 34 14.214 -36.173 -40.844 1.00 0.00 H new ATOM 0 HG2 PRO A 34 14.996 -37.127 -43.599 1.00 0.00 H new ATOM 0 HG3 PRO A 34 13.830 -37.817 -42.487 1.00 0.00 H new ATOM 0 HD2 PRO A 34 12.928 -36.383 -44.541 1.00 0.00 H new ATOM 0 HD3 PRO A 34 12.187 -36.143 -42.971 1.00 0.00 H new ATOM 520 N ALA A 35 16.457 -33.085 -41.664 1.00 0.00 N ATOM 521 CA ALA A 35 17.590 -32.179 -41.889 1.00 0.00 C ATOM 522 C ALA A 35 18.454 -32.038 -40.619 1.00 0.00 C ATOM 523 O ALA A 35 17.950 -32.264 -39.509 1.00 0.00 O ATOM 524 CB ALA A 35 17.040 -30.802 -42.300 1.00 0.00 C ATOM 0 H ALA A 35 16.084 -33.041 -40.716 1.00 0.00 H new ATOM 0 HA ALA A 35 18.222 -32.589 -42.677 1.00 0.00 H new ATOM 0 HB1 ALA A 35 17.869 -30.115 -42.471 1.00 0.00 H new ATOM 0 HB2 ALA A 35 16.456 -30.902 -43.215 1.00 0.00 H new ATOM 0 HB3 ALA A 35 16.404 -30.412 -41.505 1.00 0.00 H new ATOM 530 N PRO A 36 19.777 -31.675 -40.776 1.00 0.00 N ATOM 531 CA PRO A 36 20.618 -31.163 -39.661 1.00 0.00 C ATOM 532 C PRO A 36 19.992 -29.891 -39.048 1.00 0.00 C ATOM 533 O PRO A 36 19.348 -29.129 -39.766 1.00 0.00 O ATOM 534 CB PRO A 36 21.983 -30.835 -40.340 1.00 0.00 C ATOM 535 CG PRO A 36 21.993 -31.662 -41.587 1.00 0.00 C ATOM 536 CD PRO A 36 20.554 -31.768 -42.041 1.00 0.00 C ATOM 0 HA PRO A 36 20.717 -31.878 -38.844 1.00 0.00 H new ATOM 0 HB2 PRO A 36 22.067 -29.772 -40.568 1.00 0.00 H new ATOM 0 HB3 PRO A 36 22.820 -31.088 -39.690 1.00 0.00 H new ATOM 0 HG2 PRO A 36 22.610 -31.197 -42.356 1.00 0.00 H new ATOM 0 HG3 PRO A 36 22.413 -32.649 -41.395 1.00 0.00 H new ATOM 0 HD2 PRO A 36 20.292 -30.966 -42.732 1.00 0.00 H new ATOM 0 HD3 PRO A 36 20.366 -32.709 -42.558 1.00 0.00 H new ATOM 544 N SER A 37 20.218 -29.667 -37.742 1.00 0.00 N ATOM 545 CA SER A 37 19.626 -28.542 -36.988 1.00 0.00 C ATOM 546 C SER A 37 20.010 -27.169 -37.600 1.00 0.00 C ATOM 547 O SER A 37 19.158 -26.286 -37.766 1.00 0.00 O ATOM 548 CB SER A 37 20.060 -28.654 -35.502 1.00 0.00 C ATOM 549 OG SER A 37 21.468 -28.826 -35.391 1.00 0.00 O ATOM 0 H SER A 37 20.820 -30.263 -37.174 1.00 0.00 H new ATOM 0 HA SER A 37 18.539 -28.603 -37.050 1.00 0.00 H new ATOM 0 HB2 SER A 37 19.757 -27.757 -34.963 1.00 0.00 H new ATOM 0 HB3 SER A 37 19.550 -29.495 -35.033 1.00 0.00 H new ATOM 0 HG SER A 37 21.716 -28.892 -34.445 1.00 0.00 H new ATOM 555 N SER A 38 21.292 -27.038 -37.981 1.00 0.00 N ATOM 556 CA SER A 38 21.850 -25.805 -38.585 1.00 0.00 C ATOM 557 C SER A 38 21.254 -25.543 -39.992 1.00 0.00 C ATOM 558 O SER A 38 21.061 -24.392 -40.385 1.00 0.00 O ATOM 559 CB SER A 38 23.400 -25.910 -38.663 1.00 0.00 C ATOM 560 OG SER A 38 23.999 -24.702 -39.117 1.00 0.00 O ATOM 0 H SER A 38 21.978 -27.786 -37.880 1.00 0.00 H new ATOM 0 HA SER A 38 21.578 -24.962 -37.950 1.00 0.00 H new ATOM 0 HB2 SER A 38 23.795 -26.162 -37.679 1.00 0.00 H new ATOM 0 HB3 SER A 38 23.674 -26.724 -39.334 1.00 0.00 H new ATOM 0 HG SER A 38 24.972 -24.812 -39.150 1.00 0.00 H new ATOM 566 N TRP A 39 20.957 -26.625 -40.733 1.00 0.00 N ATOM 567 CA TRP A 39 20.440 -26.549 -42.120 1.00 0.00 C ATOM 568 C TRP A 39 18.938 -26.878 -42.173 1.00 0.00 C ATOM 569 O TRP A 39 18.288 -27.052 -41.140 1.00 0.00 O ATOM 570 CB TRP A 39 21.225 -27.544 -43.027 1.00 0.00 C ATOM 571 CG TRP A 39 22.591 -27.064 -43.444 1.00 0.00 C ATOM 572 CD1 TRP A 39 23.667 -26.815 -42.644 1.00 0.00 C ATOM 573 CD2 TRP A 39 23.013 -26.775 -44.782 1.00 0.00 C ATOM 574 NE1 TRP A 39 24.736 -26.413 -43.405 1.00 0.00 N ATOM 575 CE2 TRP A 39 24.357 -26.383 -44.720 1.00 0.00 C ATOM 576 CE3 TRP A 39 22.379 -26.817 -46.028 1.00 0.00 C ATOM 577 CZ2 TRP A 39 25.081 -26.040 -45.850 1.00 0.00 C ATOM 578 CZ3 TRP A 39 23.099 -26.474 -47.152 1.00 0.00 C ATOM 579 CH2 TRP A 39 24.441 -26.088 -47.059 1.00 0.00 C ATOM 0 H TRP A 39 21.067 -27.580 -40.391 1.00 0.00 H new ATOM 0 HA TRP A 39 20.580 -25.530 -42.480 1.00 0.00 H new ATOM 0 HB2 TRP A 39 21.332 -28.491 -42.498 1.00 0.00 H new ATOM 0 HB3 TRP A 39 20.635 -27.744 -43.922 1.00 0.00 H new ATOM 0 HD1 TRP A 39 23.676 -26.919 -41.569 1.00 0.00 H new ATOM 0 HE1 TRP A 39 25.662 -26.175 -43.049 1.00 0.00 H new ATOM 0 HE3 TRP A 39 21.343 -27.113 -46.108 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 26.117 -25.744 -45.779 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 22.620 -26.504 -48.120 1.00 0.00 H new ATOM 0 HH2 TRP A 39 24.981 -25.824 -47.956 1.00 0.00 H new ATOM 590 N LYS A 40 18.409 -26.911 -43.407 1.00 0.00 N ATOM 591 CA LYS A 40 17.126 -27.539 -43.737 1.00 0.00 C ATOM 592 C LYS A 40 17.285 -28.309 -45.058 1.00 0.00 C ATOM 593 O LYS A 40 18.094 -27.944 -45.913 1.00 0.00 O ATOM 594 CB LYS A 40 15.948 -26.521 -43.808 1.00 0.00 C ATOM 595 CG LYS A 40 15.403 -26.058 -42.433 1.00 0.00 C ATOM 596 CD LYS A 40 14.019 -25.383 -42.535 1.00 0.00 C ATOM 597 CE LYS A 40 14.005 -24.191 -43.496 1.00 0.00 C ATOM 598 NZ LYS A 40 12.672 -23.545 -43.543 1.00 0.00 N ATOM 0 H LYS A 40 18.871 -26.494 -44.215 1.00 0.00 H new ATOM 0 HA LYS A 40 16.863 -28.226 -42.933 1.00 0.00 H new ATOM 0 HB2 LYS A 40 16.277 -25.644 -44.366 1.00 0.00 H new ATOM 0 HB3 LYS A 40 15.132 -26.971 -44.373 1.00 0.00 H new ATOM 0 HG2 LYS A 40 15.335 -26.918 -41.766 1.00 0.00 H new ATOM 0 HG3 LYS A 40 16.110 -25.361 -41.983 1.00 0.00 H new ATOM 0 HD2 LYS A 40 13.286 -26.118 -42.866 1.00 0.00 H new ATOM 0 HD3 LYS A 40 13.710 -25.048 -41.545 1.00 0.00 H new ATOM 0 HE2 LYS A 40 14.753 -23.462 -43.184 1.00 0.00 H new ATOM 0 HE3 LYS A 40 14.284 -24.525 -44.495 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 12.742 -22.640 -44.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 12.001 -24.168 -44.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 12.336 -23.372 -42.574 1.00 0.00 H new ATOM 612 N LYS A 41 16.519 -29.391 -45.177 1.00 0.00 N ATOM 613 CA LYS A 41 16.475 -30.261 -46.354 1.00 0.00 C ATOM 614 C LYS A 41 15.063 -30.191 -46.925 1.00 0.00 C ATOM 615 O LYS A 41 14.083 -30.490 -46.244 1.00 0.00 O ATOM 616 CB LYS A 41 16.887 -31.715 -45.954 1.00 0.00 C ATOM 617 CG LYS A 41 16.400 -32.859 -46.875 1.00 0.00 C ATOM 618 CD LYS A 41 16.866 -32.728 -48.336 1.00 0.00 C ATOM 619 CE LYS A 41 16.342 -33.869 -49.207 1.00 0.00 C ATOM 620 NZ LYS A 41 14.866 -33.911 -49.215 1.00 0.00 N ATOM 0 H LYS A 41 15.891 -29.698 -44.434 1.00 0.00 H new ATOM 0 HA LYS A 41 17.181 -29.937 -47.119 1.00 0.00 H new ATOM 0 HB2 LYS A 41 17.975 -31.758 -45.906 1.00 0.00 H new ATOM 0 HB3 LYS A 41 16.515 -31.908 -44.948 1.00 0.00 H new ATOM 0 HG2 LYS A 41 16.754 -33.809 -46.475 1.00 0.00 H new ATOM 0 HG3 LYS A 41 15.311 -32.890 -46.853 1.00 0.00 H new ATOM 0 HD2 LYS A 41 16.525 -31.776 -48.742 1.00 0.00 H new ATOM 0 HD3 LYS A 41 17.955 -32.717 -48.370 1.00 0.00 H new ATOM 0 HE2 LYS A 41 16.709 -33.748 -50.226 1.00 0.00 H new ATOM 0 HE3 LYS A 41 16.732 -34.818 -48.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 14.531 -34.147 -50.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 14.536 -34.633 -48.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 14.491 -32.982 -48.936 1.00 0.00 H new ATOM 634 N LEU A 42 14.985 -29.771 -48.178 1.00 0.00 N ATOM 635 CA LEU A 42 13.741 -29.670 -48.932 1.00 0.00 C ATOM 636 C LEU A 42 13.826 -30.590 -50.163 1.00 0.00 C ATOM 637 O LEU A 42 14.894 -30.780 -50.754 1.00 0.00 O ATOM 638 CB LEU A 42 13.485 -28.166 -49.289 1.00 0.00 C ATOM 639 CG LEU A 42 12.313 -27.832 -50.287 1.00 0.00 C ATOM 640 CD1 LEU A 42 11.672 -26.456 -49.988 1.00 0.00 C ATOM 641 CD2 LEU A 42 12.801 -27.865 -51.748 1.00 0.00 C ATOM 0 H LEU A 42 15.804 -29.483 -48.714 1.00 0.00 H new ATOM 0 HA LEU A 42 12.886 -30.006 -48.346 1.00 0.00 H new ATOM 0 HB2 LEU A 42 13.295 -27.630 -48.359 1.00 0.00 H new ATOM 0 HB3 LEU A 42 14.406 -27.761 -49.708 1.00 0.00 H new ATOM 0 HG LEU A 42 11.554 -28.602 -50.145 1.00 0.00 H new ATOM 0 HD11 LEU A 42 10.869 -26.266 -50.700 1.00 0.00 H new ATOM 0 HD12 LEU A 42 11.268 -26.455 -48.976 1.00 0.00 H new ATOM 0 HD13 LEU A 42 12.428 -25.676 -50.077 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.971 -27.631 -52.414 1.00 0.00 H new ATOM 0 HD22 LEU A 42 13.594 -27.129 -51.884 1.00 0.00 H new ATOM 0 HD23 LEU A 42 13.184 -28.858 -51.981 1.00 0.00 H new ATOM 653 N PHE A 43 12.684 -31.186 -50.494 1.00 0.00 N ATOM 654 CA PHE A 43 12.478 -32.019 -51.678 1.00 0.00 C ATOM 655 C PHE A 43 11.207 -31.529 -52.381 1.00 0.00 C ATOM 656 O PHE A 43 10.177 -31.377 -51.736 1.00 0.00 O ATOM 657 CB PHE A 43 12.340 -33.505 -51.237 1.00 0.00 C ATOM 658 CG PHE A 43 11.756 -34.454 -52.289 1.00 0.00 C ATOM 659 CD1 PHE A 43 12.418 -34.702 -53.487 1.00 0.00 C ATOM 660 CD2 PHE A 43 10.526 -35.090 -52.072 1.00 0.00 C ATOM 661 CE1 PHE A 43 11.872 -35.549 -54.435 1.00 0.00 C ATOM 662 CE2 PHE A 43 9.989 -35.938 -53.020 1.00 0.00 C ATOM 663 CZ PHE A 43 10.660 -36.166 -54.201 1.00 0.00 C ATOM 0 H PHE A 43 11.843 -31.099 -49.923 1.00 0.00 H new ATOM 0 HA PHE A 43 13.320 -31.948 -52.366 1.00 0.00 H new ATOM 0 HB2 PHE A 43 13.324 -33.873 -50.948 1.00 0.00 H new ATOM 0 HB3 PHE A 43 11.711 -33.545 -50.348 1.00 0.00 H new ATOM 0 HD1 PHE A 43 13.369 -34.228 -53.679 1.00 0.00 H new ATOM 0 HD2 PHE A 43 9.991 -34.914 -51.150 1.00 0.00 H new ATOM 0 HE1 PHE A 43 12.396 -35.728 -55.362 1.00 0.00 H new ATOM 0 HE2 PHE A 43 9.042 -36.423 -52.835 1.00 0.00 H new ATOM 0 HZ PHE A 43 10.238 -36.827 -54.943 1.00 0.00 H new ATOM 673 N TYR A 44 11.291 -31.251 -53.684 1.00 0.00 N ATOM 674 CA TYR A 44 10.099 -30.994 -54.512 1.00 0.00 C ATOM 675 C TYR A 44 9.547 -32.344 -55.038 1.00 0.00 C ATOM 676 O TYR A 44 10.218 -32.995 -55.848 1.00 0.00 O ATOM 677 CB TYR A 44 10.433 -30.067 -55.715 1.00 0.00 C ATOM 678 CG TYR A 44 10.402 -28.547 -55.462 1.00 0.00 C ATOM 679 CD1 TYR A 44 11.494 -27.887 -54.906 1.00 0.00 C ATOM 680 CD2 TYR A 44 9.301 -27.767 -55.844 1.00 0.00 C ATOM 681 CE1 TYR A 44 11.489 -26.515 -54.735 1.00 0.00 C ATOM 682 CE2 TYR A 44 9.292 -26.395 -55.665 1.00 0.00 C ATOM 683 CZ TYR A 44 10.386 -25.776 -55.113 1.00 0.00 C ATOM 684 OH TYR A 44 10.388 -24.411 -54.954 1.00 0.00 O ATOM 0 H TYR A 44 12.172 -31.197 -54.194 1.00 0.00 H new ATOM 0 HA TYR A 44 9.353 -30.492 -53.896 1.00 0.00 H new ATOM 0 HB2 TYR A 44 11.427 -30.329 -56.078 1.00 0.00 H new ATOM 0 HB3 TYR A 44 9.731 -30.290 -56.519 1.00 0.00 H new ATOM 0 HD1 TYR A 44 12.360 -28.456 -54.603 1.00 0.00 H new ATOM 0 HD2 TYR A 44 8.441 -28.248 -56.288 1.00 0.00 H new ATOM 0 HE1 TYR A 44 12.348 -26.021 -54.306 1.00 0.00 H new ATOM 0 HE2 TYR A 44 8.430 -25.815 -55.958 1.00 0.00 H new ATOM 0 HH TYR A 44 9.536 -24.044 -55.271 1.00 0.00 H new ATOM 694 N PRO A 45 8.341 -32.805 -54.575 1.00 0.00 N ATOM 695 CA PRO A 45 7.606 -33.902 -55.236 1.00 0.00 C ATOM 696 C PRO A 45 6.906 -33.406 -56.517 1.00 0.00 C ATOM 697 O PRO A 45 7.141 -32.281 -56.983 1.00 0.00 O ATOM 698 CB PRO A 45 6.590 -34.348 -54.148 1.00 0.00 C ATOM 699 CG PRO A 45 6.306 -33.090 -53.389 1.00 0.00 C ATOM 700 CD PRO A 45 7.623 -32.329 -53.364 1.00 0.00 C ATOM 0 HA PRO A 45 8.247 -34.719 -55.569 1.00 0.00 H new ATOM 0 HB2 PRO A 45 5.684 -34.761 -54.592 1.00 0.00 H new ATOM 0 HB3 PRO A 45 7.009 -35.119 -53.502 1.00 0.00 H new ATOM 0 HG2 PRO A 45 5.524 -32.506 -53.874 1.00 0.00 H new ATOM 0 HG3 PRO A 45 5.960 -33.310 -52.379 1.00 0.00 H new ATOM 0 HD2 PRO A 45 7.461 -31.252 -53.395 1.00 0.00 H new ATOM 0 HD3 PRO A 45 8.188 -32.541 -52.457 1.00 0.00 H new ATOM 708 N ASN A 46 6.060 -34.261 -57.079 1.00 0.00 N ATOM 709 CA ASN A 46 5.291 -33.968 -58.301 1.00 0.00 C ATOM 710 C ASN A 46 3.784 -34.133 -58.021 1.00 0.00 C ATOM 711 O ASN A 46 3.390 -34.364 -56.876 1.00 0.00 O ATOM 712 CB ASN A 46 5.751 -34.911 -59.444 1.00 0.00 C ATOM 713 CG ASN A 46 5.643 -36.400 -59.101 1.00 0.00 C ATOM 714 OD1 ASN A 46 4.604 -37.019 -59.302 1.00 0.00 O ATOM 715 ND2 ASN A 46 6.725 -36.975 -58.595 1.00 0.00 N ATOM 0 H ASN A 46 5.880 -35.191 -56.701 1.00 0.00 H new ATOM 0 HA ASN A 46 5.470 -32.938 -58.610 1.00 0.00 H new ATOM 0 HB2 ASN A 46 5.152 -34.708 -60.332 1.00 0.00 H new ATOM 0 HB3 ASN A 46 6.786 -34.681 -59.698 1.00 0.00 H new ATOM 0 HD21 ASN A 46 6.712 -37.967 -58.358 1.00 0.00 H new ATOM 0 HD22 ASN A 46 7.571 -36.425 -58.443 1.00 0.00 H new ATOM 722 N LYS A 47 2.948 -33.999 -59.064 1.00 0.00 N ATOM 723 CA LYS A 47 1.506 -34.284 -58.963 1.00 0.00 C ATOM 724 C LYS A 47 1.249 -35.790 -59.178 1.00 0.00 C ATOM 725 O LYS A 47 1.061 -36.541 -58.211 1.00 0.00 O ATOM 726 CB LYS A 47 0.705 -33.432 -59.989 1.00 0.00 C ATOM 727 CG LYS A 47 0.690 -31.918 -59.706 1.00 0.00 C ATOM 728 CD LYS A 47 0.050 -31.571 -58.339 1.00 0.00 C ATOM 729 CE LYS A 47 -0.203 -30.064 -58.170 1.00 0.00 C ATOM 730 NZ LYS A 47 1.036 -29.260 -58.327 1.00 0.00 N ATOM 0 H LYS A 47 3.247 -33.694 -59.990 1.00 0.00 H new ATOM 0 HA LYS A 47 1.164 -34.013 -57.964 1.00 0.00 H new ATOM 0 HB2 LYS A 47 1.124 -33.597 -60.982 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -0.323 -33.792 -60.014 1.00 0.00 H new ATOM 0 HG2 LYS A 47 1.711 -31.538 -59.731 1.00 0.00 H new ATOM 0 HG3 LYS A 47 0.141 -31.410 -60.499 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -0.893 -32.108 -58.237 1.00 0.00 H new ATOM 0 HD3 LYS A 47 0.703 -31.918 -57.538 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -0.940 -29.738 -58.904 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -0.631 -29.879 -57.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 1.028 -28.474 -57.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 1.865 -29.862 -58.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 1.083 -28.880 -59.294 1.00 0.00 H new ATOM 744 N VAL A 48 1.272 -36.228 -60.459 1.00 0.00 N ATOM 745 CA VAL A 48 0.918 -37.608 -60.853 1.00 0.00 C ATOM 746 C VAL A 48 2.018 -38.193 -61.780 1.00 0.00 C ATOM 747 O VAL A 48 1.864 -38.238 -63.009 1.00 0.00 O ATOM 748 CB VAL A 48 -0.513 -37.663 -61.547 1.00 0.00 C ATOM 749 CG1 VAL A 48 -0.945 -39.114 -61.883 1.00 0.00 C ATOM 750 CG2 VAL A 48 -1.597 -36.961 -60.688 1.00 0.00 C ATOM 0 H VAL A 48 1.536 -35.634 -61.245 1.00 0.00 H new ATOM 0 HA VAL A 48 0.861 -38.221 -59.953 1.00 0.00 H new ATOM 0 HB VAL A 48 -0.418 -37.118 -62.486 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -1.927 -39.101 -62.355 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.221 -39.561 -62.564 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -0.991 -39.702 -60.966 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -2.559 -37.021 -61.197 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -1.668 -37.454 -59.718 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -1.327 -35.915 -60.545 1.00 0.00 H new ATOM 760 N GLY A 49 3.156 -38.570 -61.160 1.00 0.00 N ATOM 761 CA GLY A 49 4.230 -39.341 -61.816 1.00 0.00 C ATOM 762 C GLY A 49 5.041 -38.583 -62.873 1.00 0.00 C ATOM 763 O GLY A 49 6.155 -38.117 -62.600 1.00 0.00 O ATOM 0 H GLY A 49 3.355 -38.346 -60.185 1.00 0.00 H new ATOM 0 HA2 GLY A 49 4.915 -39.701 -61.048 1.00 0.00 H new ATOM 0 HA3 GLY A 49 3.787 -40.219 -62.285 1.00 0.00 H new ATOM 767 N SER A 50 4.455 -38.451 -64.075 1.00 0.00 N ATOM 768 CA SER A 50 5.119 -37.951 -65.295 1.00 0.00 C ATOM 769 C SER A 50 5.155 -36.401 -65.362 1.00 0.00 C ATOM 770 O SER A 50 4.928 -35.801 -66.422 1.00 0.00 O ATOM 771 CB SER A 50 4.361 -38.558 -66.503 1.00 0.00 C ATOM 772 OG SER A 50 2.959 -38.332 -66.405 1.00 0.00 O ATOM 0 H SER A 50 3.477 -38.696 -64.231 1.00 0.00 H new ATOM 0 HA SER A 50 6.165 -38.258 -65.299 1.00 0.00 H new ATOM 0 HB2 SER A 50 4.738 -38.120 -67.428 1.00 0.00 H new ATOM 0 HB3 SER A 50 4.555 -39.629 -66.555 1.00 0.00 H new ATOM 0 HG SER A 50 2.509 -38.725 -67.182 1.00 0.00 H new ATOM 778 N VAL A 51 5.472 -35.761 -64.227 1.00 0.00 N ATOM 779 CA VAL A 51 5.560 -34.289 -64.111 1.00 0.00 C ATOM 780 C VAL A 51 7.044 -33.871 -64.110 1.00 0.00 C ATOM 781 O VAL A 51 7.907 -34.656 -63.702 1.00 0.00 O ATOM 782 CB VAL A 51 4.861 -33.794 -62.790 1.00 0.00 C ATOM 783 CG1 VAL A 51 4.704 -32.253 -62.724 1.00 0.00 C ATOM 784 CG2 VAL A 51 3.505 -34.504 -62.579 1.00 0.00 C ATOM 0 H VAL A 51 5.677 -36.249 -63.355 1.00 0.00 H new ATOM 0 HA VAL A 51 5.049 -33.833 -64.959 1.00 0.00 H new ATOM 0 HB VAL A 51 5.525 -34.067 -61.970 1.00 0.00 H new ATOM 0 HG11 VAL A 51 4.215 -31.977 -61.790 1.00 0.00 H new ATOM 0 HG12 VAL A 51 5.687 -31.785 -62.772 1.00 0.00 H new ATOM 0 HG13 VAL A 51 4.099 -31.913 -63.564 1.00 0.00 H new ATOM 0 HG21 VAL A 51 3.044 -34.143 -61.659 1.00 0.00 H new ATOM 0 HG22 VAL A 51 2.848 -34.291 -63.422 1.00 0.00 H new ATOM 0 HG23 VAL A 51 3.665 -35.580 -62.507 1.00 0.00 H new ATOM 794 N LYS A 52 7.320 -32.639 -64.555 1.00 0.00 N ATOM 795 CA LYS A 52 8.690 -32.084 -64.628 1.00 0.00 C ATOM 796 C LYS A 52 9.288 -31.920 -63.218 1.00 0.00 C ATOM 797 O LYS A 52 10.394 -32.405 -62.939 1.00 0.00 O ATOM 798 CB LYS A 52 8.677 -30.716 -65.362 1.00 0.00 C ATOM 799 CG LYS A 52 8.167 -30.772 -66.818 1.00 0.00 C ATOM 800 CD LYS A 52 8.048 -29.364 -67.436 1.00 0.00 C ATOM 801 CE LYS A 52 7.497 -29.374 -68.869 1.00 0.00 C ATOM 802 NZ LYS A 52 7.363 -28.001 -69.418 1.00 0.00 N ATOM 0 H LYS A 52 6.601 -31.991 -64.877 1.00 0.00 H new ATOM 0 HA LYS A 52 9.312 -32.782 -65.188 1.00 0.00 H new ATOM 0 HB2 LYS A 52 8.053 -30.022 -64.799 1.00 0.00 H new ATOM 0 HB3 LYS A 52 9.688 -30.308 -65.361 1.00 0.00 H new ATOM 0 HG2 LYS A 52 8.847 -31.377 -67.419 1.00 0.00 H new ATOM 0 HG3 LYS A 52 7.195 -31.264 -66.844 1.00 0.00 H new ATOM 0 HD2 LYS A 52 7.399 -28.753 -66.809 1.00 0.00 H new ATOM 0 HD3 LYS A 52 9.030 -28.890 -67.435 1.00 0.00 H new ATOM 0 HE2 LYS A 52 8.159 -29.958 -69.509 1.00 0.00 H new ATOM 0 HE3 LYS A 52 6.525 -29.867 -68.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 6.988 -28.050 -70.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 6.712 -27.451 -68.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 8.295 -27.540 -69.430 1.00 0.00 H new ATOM 816 N LYS A 53 8.516 -31.217 -62.359 1.00 0.00 N ATOM 817 CA LYS A 53 8.858 -30.870 -60.963 1.00 0.00 C ATOM 818 C LYS A 53 10.255 -30.187 -60.854 1.00 0.00 C ATOM 819 O LYS A 53 10.822 -29.737 -61.856 1.00 0.00 O ATOM 820 CB LYS A 53 8.674 -32.103 -59.994 1.00 0.00 C ATOM 821 CG LYS A 53 9.838 -33.117 -59.949 1.00 0.00 C ATOM 822 CD LYS A 53 9.582 -34.287 -58.967 1.00 0.00 C ATOM 823 CE LYS A 53 10.842 -35.123 -58.692 1.00 0.00 C ATOM 824 NZ LYS A 53 11.894 -34.316 -58.025 1.00 0.00 N ATOM 0 H LYS A 53 7.600 -30.862 -62.632 1.00 0.00 H new ATOM 0 HA LYS A 53 8.145 -30.119 -60.624 1.00 0.00 H new ATOM 0 HB2 LYS A 53 8.511 -31.724 -58.985 1.00 0.00 H new ATOM 0 HB3 LYS A 53 7.768 -32.635 -60.285 1.00 0.00 H new ATOM 0 HG2 LYS A 53 10.002 -33.518 -60.949 1.00 0.00 H new ATOM 0 HG3 LYS A 53 10.753 -32.600 -59.659 1.00 0.00 H new ATOM 0 HD2 LYS A 53 9.204 -33.889 -58.026 1.00 0.00 H new ATOM 0 HD3 LYS A 53 8.805 -34.934 -59.375 1.00 0.00 H new ATOM 0 HE2 LYS A 53 10.584 -35.977 -58.065 1.00 0.00 H new ATOM 0 HE3 LYS A 53 11.228 -35.522 -59.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 12.753 -34.312 -58.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 11.556 -33.341 -57.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 12.112 -34.729 -57.096 1.00 0.00 H new ATOM 838 N THR A 54 10.758 -30.046 -59.624 1.00 0.00 N ATOM 839 CA THR A 54 12.102 -29.509 -59.342 1.00 0.00 C ATOM 840 C THR A 54 12.891 -30.575 -58.539 1.00 0.00 C ATOM 841 O THR A 54 12.285 -31.497 -57.962 1.00 0.00 O ATOM 842 CB THR A 54 11.970 -28.151 -58.563 1.00 0.00 C ATOM 843 OG1 THR A 54 11.144 -27.250 -59.309 1.00 0.00 O ATOM 844 CG2 THR A 54 13.311 -27.457 -58.273 1.00 0.00 C ATOM 0 H THR A 54 10.241 -30.303 -58.783 1.00 0.00 H new ATOM 0 HA THR A 54 12.647 -29.299 -60.263 1.00 0.00 H new ATOM 0 HB THR A 54 11.528 -28.403 -57.599 1.00 0.00 H new ATOM 0 HG1 THR A 54 11.060 -26.404 -58.822 1.00 0.00 H new ATOM 0 HG21 THR A 54 13.130 -26.528 -57.733 1.00 0.00 H new ATOM 0 HG22 THR A 54 13.937 -28.113 -57.668 1.00 0.00 H new ATOM 0 HG23 THR A 54 13.818 -27.238 -59.213 1.00 0.00 H new ATOM 852 N GLU A 55 14.232 -30.480 -58.540 1.00 0.00 N ATOM 853 CA GLU A 55 15.108 -31.419 -57.811 1.00 0.00 C ATOM 854 C GLU A 55 15.163 -31.086 -56.291 1.00 0.00 C ATOM 855 O GLU A 55 14.342 -30.311 -55.771 1.00 0.00 O ATOM 856 CB GLU A 55 16.539 -31.449 -58.454 1.00 0.00 C ATOM 857 CG GLU A 55 17.314 -30.105 -58.438 1.00 0.00 C ATOM 858 CD GLU A 55 17.046 -29.206 -59.656 1.00 0.00 C ATOM 859 OE1 GLU A 55 16.176 -28.319 -59.583 1.00 0.00 O ATOM 860 OE2 GLU A 55 17.698 -29.400 -60.705 1.00 0.00 O ATOM 0 H GLU A 55 14.740 -29.753 -59.044 1.00 0.00 H new ATOM 0 HA GLU A 55 14.682 -32.418 -57.899 1.00 0.00 H new ATOM 0 HB2 GLU A 55 17.136 -32.197 -57.932 1.00 0.00 H new ATOM 0 HB3 GLU A 55 16.445 -31.781 -59.488 1.00 0.00 H new ATOM 0 HG2 GLU A 55 17.051 -29.558 -57.533 1.00 0.00 H new ATOM 0 HG3 GLU A 55 18.382 -30.315 -58.384 1.00 0.00 H new ATOM 867 N VAL A 56 16.129 -31.701 -55.587 1.00 0.00 N ATOM 868 CA VAL A 56 16.333 -31.520 -54.141 1.00 0.00 C ATOM 869 C VAL A 56 17.104 -30.217 -53.877 1.00 0.00 C ATOM 870 O VAL A 56 18.135 -29.955 -54.505 1.00 0.00 O ATOM 871 CB VAL A 56 17.128 -32.745 -53.553 1.00 0.00 C ATOM 872 CG1 VAL A 56 17.680 -32.460 -52.138 1.00 0.00 C ATOM 873 CG2 VAL A 56 16.263 -34.032 -53.560 1.00 0.00 C ATOM 0 H VAL A 56 16.797 -32.345 -56.012 1.00 0.00 H new ATOM 0 HA VAL A 56 15.361 -31.460 -53.651 1.00 0.00 H new ATOM 0 HB VAL A 56 17.985 -32.906 -54.206 1.00 0.00 H new ATOM 0 HG11 VAL A 56 18.220 -33.334 -51.775 1.00 0.00 H new ATOM 0 HG12 VAL A 56 18.356 -31.606 -52.176 1.00 0.00 H new ATOM 0 HG13 VAL A 56 16.853 -32.238 -51.463 1.00 0.00 H new ATOM 0 HG21 VAL A 56 16.840 -34.860 -53.148 1.00 0.00 H new ATOM 0 HG22 VAL A 56 15.371 -33.874 -52.954 1.00 0.00 H new ATOM 0 HG23 VAL A 56 15.970 -34.268 -54.583 1.00 0.00 H new ATOM 883 N VAL A 57 16.577 -29.403 -52.941 1.00 0.00 N ATOM 884 CA VAL A 57 17.178 -28.122 -52.549 1.00 0.00 C ATOM 885 C VAL A 57 17.455 -28.126 -51.031 1.00 0.00 C ATOM 886 O VAL A 57 16.540 -28.317 -50.233 1.00 0.00 O ATOM 887 CB VAL A 57 16.263 -26.891 -52.927 1.00 0.00 C ATOM 888 CG1 VAL A 57 16.977 -25.542 -52.628 1.00 0.00 C ATOM 889 CG2 VAL A 57 15.784 -26.968 -54.406 1.00 0.00 C ATOM 0 H VAL A 57 15.718 -29.621 -52.436 1.00 0.00 H new ATOM 0 HA VAL A 57 18.112 -28.011 -53.100 1.00 0.00 H new ATOM 0 HB VAL A 57 15.375 -26.938 -52.297 1.00 0.00 H new ATOM 0 HG11 VAL A 57 16.321 -24.715 -52.899 1.00 0.00 H new ATOM 0 HG12 VAL A 57 17.214 -25.484 -51.566 1.00 0.00 H new ATOM 0 HG13 VAL A 57 17.897 -25.481 -53.209 1.00 0.00 H new ATOM 0 HG21 VAL A 57 15.157 -26.105 -54.631 1.00 0.00 H new ATOM 0 HG22 VAL A 57 16.649 -26.970 -55.069 1.00 0.00 H new ATOM 0 HG23 VAL A 57 15.210 -27.882 -54.555 1.00 0.00 H new ATOM 899 N PHE A 58 18.728 -27.949 -50.641 1.00 0.00 N ATOM 900 CA PHE A 58 19.129 -27.803 -49.225 1.00 0.00 C ATOM 901 C PHE A 58 19.172 -26.315 -48.843 1.00 0.00 C ATOM 902 O PHE A 58 19.975 -25.561 -49.394 1.00 0.00 O ATOM 903 CB PHE A 58 20.519 -28.462 -48.969 1.00 0.00 C ATOM 904 CG PHE A 58 20.466 -29.960 -48.697 1.00 0.00 C ATOM 905 CD1 PHE A 58 20.410 -30.881 -49.736 1.00 0.00 C ATOM 906 CD2 PHE A 58 20.477 -30.443 -47.386 1.00 0.00 C ATOM 907 CE1 PHE A 58 20.373 -32.237 -49.476 1.00 0.00 C ATOM 908 CE2 PHE A 58 20.436 -31.798 -47.130 1.00 0.00 C ATOM 909 CZ PHE A 58 20.387 -32.693 -48.176 1.00 0.00 C ATOM 0 H PHE A 58 19.510 -27.903 -51.294 1.00 0.00 H new ATOM 0 HA PHE A 58 18.391 -28.312 -48.605 1.00 0.00 H new ATOM 0 HB2 PHE A 58 21.156 -28.285 -49.835 1.00 0.00 H new ATOM 0 HB3 PHE A 58 20.991 -27.968 -48.120 1.00 0.00 H new ATOM 0 HD1 PHE A 58 20.395 -30.533 -50.758 1.00 0.00 H new ATOM 0 HD2 PHE A 58 20.518 -29.746 -46.562 1.00 0.00 H new ATOM 0 HE1 PHE A 58 20.333 -32.941 -50.294 1.00 0.00 H new ATOM 0 HE2 PHE A 58 20.442 -32.156 -46.111 1.00 0.00 H new ATOM 0 HZ PHE A 58 20.360 -33.754 -47.977 1.00 0.00 H new ATOM 919 N VAL A 59 18.337 -25.911 -47.873 1.00 0.00 N ATOM 920 CA VAL A 59 18.311 -24.535 -47.360 1.00 0.00 C ATOM 921 C VAL A 59 19.483 -24.338 -46.391 1.00 0.00 C ATOM 922 O VAL A 59 19.637 -25.085 -45.415 1.00 0.00 O ATOM 923 CB VAL A 59 16.916 -24.194 -46.683 1.00 0.00 C ATOM 924 CG1 VAL A 59 17.038 -23.194 -45.496 1.00 0.00 C ATOM 925 CG2 VAL A 59 15.929 -23.650 -47.736 1.00 0.00 C ATOM 0 H VAL A 59 17.662 -26.530 -47.423 1.00 0.00 H new ATOM 0 HA VAL A 59 18.424 -23.839 -48.191 1.00 0.00 H new ATOM 0 HB VAL A 59 16.537 -25.128 -46.268 1.00 0.00 H new ATOM 0 HG11 VAL A 59 16.050 -23.003 -45.078 1.00 0.00 H new ATOM 0 HG12 VAL A 59 17.682 -23.620 -44.726 1.00 0.00 H new ATOM 0 HG13 VAL A 59 17.468 -22.258 -45.852 1.00 0.00 H new ATOM 0 HG21 VAL A 59 14.977 -23.420 -47.258 1.00 0.00 H new ATOM 0 HG22 VAL A 59 16.338 -22.744 -48.184 1.00 0.00 H new ATOM 0 HG23 VAL A 59 15.774 -24.400 -48.511 1.00 0.00 H new ATOM 935 N ALA A 60 20.305 -23.328 -46.702 1.00 0.00 N ATOM 936 CA ALA A 60 21.533 -23.021 -45.975 1.00 0.00 C ATOM 937 C ALA A 60 21.257 -22.058 -44.800 1.00 0.00 C ATOM 938 O ALA A 60 20.374 -21.198 -44.905 1.00 0.00 O ATOM 939 CB ALA A 60 22.570 -22.432 -46.937 1.00 0.00 C ATOM 0 H ALA A 60 20.128 -22.693 -47.480 1.00 0.00 H new ATOM 0 HA ALA A 60 21.930 -23.944 -45.553 1.00 0.00 H new ATOM 0 HB1 ALA A 60 23.485 -22.204 -46.391 1.00 0.00 H new ATOM 0 HB2 ALA A 60 22.788 -23.154 -47.724 1.00 0.00 H new ATOM 0 HB3 ALA A 60 22.176 -21.518 -47.382 1.00 0.00 H new ATOM 945 N PRO A 61 22.027 -22.184 -43.675 1.00 0.00 N ATOM 946 CA PRO A 61 21.868 -21.335 -42.460 1.00 0.00 C ATOM 947 C PRO A 61 22.118 -19.824 -42.707 1.00 0.00 C ATOM 948 O PRO A 61 21.520 -18.976 -42.031 1.00 0.00 O ATOM 949 CB PRO A 61 22.928 -21.919 -41.479 1.00 0.00 C ATOM 950 CG PRO A 61 23.913 -22.623 -42.356 1.00 0.00 C ATOM 951 CD PRO A 61 23.095 -23.201 -43.481 1.00 0.00 C ATOM 0 HA PRO A 61 20.844 -21.367 -42.088 1.00 0.00 H new ATOM 0 HB2 PRO A 61 23.407 -21.130 -40.899 1.00 0.00 H new ATOM 0 HB3 PRO A 61 22.471 -22.606 -40.766 1.00 0.00 H new ATOM 0 HG2 PRO A 61 24.669 -21.934 -42.732 1.00 0.00 H new ATOM 0 HG3 PRO A 61 24.439 -23.405 -41.809 1.00 0.00 H new ATOM 0 HD2 PRO A 61 23.690 -23.338 -44.384 1.00 0.00 H new ATOM 0 HD3 PRO A 61 22.682 -24.175 -43.220 1.00 0.00 H new ATOM 959 N THR A 62 23.007 -19.493 -43.670 1.00 0.00 N ATOM 960 CA THR A 62 23.319 -18.083 -44.008 1.00 0.00 C ATOM 961 C THR A 62 22.327 -17.532 -45.062 1.00 0.00 C ATOM 962 O THR A 62 22.402 -16.352 -45.429 1.00 0.00 O ATOM 963 CB THR A 62 24.803 -17.918 -44.512 1.00 0.00 C ATOM 964 OG1 THR A 62 25.199 -16.536 -44.465 1.00 0.00 O ATOM 965 CG2 THR A 62 25.008 -18.441 -45.944 1.00 0.00 C ATOM 0 H THR A 62 23.520 -20.178 -44.225 1.00 0.00 H new ATOM 0 HA THR A 62 23.211 -17.502 -43.092 1.00 0.00 H new ATOM 0 HB THR A 62 25.421 -18.516 -43.842 1.00 0.00 H new ATOM 0 HG1 THR A 62 24.458 -15.973 -44.772 1.00 0.00 H new ATOM 0 HG21 THR A 62 26.049 -18.301 -46.237 1.00 0.00 H new ATOM 0 HG22 THR A 62 24.759 -19.502 -45.983 1.00 0.00 H new ATOM 0 HG23 THR A 62 24.361 -17.891 -46.628 1.00 0.00 H new ATOM 973 N GLY A 63 21.383 -18.384 -45.525 1.00 0.00 N ATOM 974 CA GLY A 63 20.431 -17.998 -46.567 1.00 0.00 C ATOM 975 C GLY A 63 21.059 -18.027 -47.952 1.00 0.00 C ATOM 976 O GLY A 63 21.161 -16.995 -48.629 1.00 0.00 O ATOM 0 H GLY A 63 21.269 -19.340 -45.188 1.00 0.00 H new ATOM 0 HA2 GLY A 63 19.575 -18.672 -46.543 1.00 0.00 H new ATOM 0 HA3 GLY A 63 20.054 -16.996 -46.361 1.00 0.00 H new ATOM 980 N GLU A 64 21.502 -19.222 -48.357 1.00 0.00 N ATOM 981 CA GLU A 64 22.126 -19.465 -49.665 1.00 0.00 C ATOM 982 C GLU A 64 21.837 -20.920 -50.066 1.00 0.00 C ATOM 983 O GLU A 64 22.713 -21.788 -50.015 1.00 0.00 O ATOM 984 CB GLU A 64 23.657 -19.139 -49.610 1.00 0.00 C ATOM 985 CG GLU A 64 24.407 -19.274 -50.950 1.00 0.00 C ATOM 986 CD GLU A 64 25.854 -18.742 -50.900 1.00 0.00 C ATOM 987 OE1 GLU A 64 26.096 -17.607 -51.363 1.00 0.00 O ATOM 988 OE2 GLU A 64 26.749 -19.441 -50.380 1.00 0.00 O ATOM 0 H GLU A 64 21.437 -20.060 -47.779 1.00 0.00 H new ATOM 0 HA GLU A 64 21.708 -18.807 -50.427 1.00 0.00 H new ATOM 0 HB2 GLU A 64 23.782 -18.120 -49.243 1.00 0.00 H new ATOM 0 HB3 GLU A 64 24.127 -19.800 -48.881 1.00 0.00 H new ATOM 0 HG2 GLU A 64 24.424 -20.323 -51.244 1.00 0.00 H new ATOM 0 HG3 GLU A 64 23.857 -18.736 -51.722 1.00 0.00 H new ATOM 995 N GLU A 65 20.556 -21.181 -50.396 1.00 0.00 N ATOM 996 CA GLU A 65 20.051 -22.544 -50.638 1.00 0.00 C ATOM 997 C GLU A 65 20.694 -23.193 -51.883 1.00 0.00 C ATOM 998 O GLU A 65 21.188 -22.506 -52.789 1.00 0.00 O ATOM 999 CB GLU A 65 18.505 -22.555 -50.747 1.00 0.00 C ATOM 1000 CG GLU A 65 17.922 -21.720 -51.912 1.00 0.00 C ATOM 1001 CD GLU A 65 16.394 -21.866 -52.072 1.00 0.00 C ATOM 1002 OE1 GLU A 65 15.916 -22.168 -53.188 1.00 0.00 O ATOM 1003 OE2 GLU A 65 15.663 -21.664 -51.078 1.00 0.00 O ATOM 0 H GLU A 65 19.847 -20.455 -50.501 1.00 0.00 H new ATOM 0 HA GLU A 65 20.339 -23.146 -49.776 1.00 0.00 H new ATOM 0 HB2 GLU A 65 18.172 -23.587 -50.858 1.00 0.00 H new ATOM 0 HB3 GLU A 65 18.088 -22.184 -49.811 1.00 0.00 H new ATOM 0 HG2 GLU A 65 18.163 -20.669 -51.751 1.00 0.00 H new ATOM 0 HG3 GLU A 65 18.407 -22.020 -52.841 1.00 0.00 H new ATOM 1010 N ILE A 66 20.653 -24.530 -51.913 1.00 0.00 N ATOM 1011 CA ILE A 66 21.492 -25.349 -52.792 1.00 0.00 C ATOM 1012 C ILE A 66 20.620 -26.232 -53.698 1.00 0.00 C ATOM 1013 O ILE A 66 20.024 -27.185 -53.214 1.00 0.00 O ATOM 1014 CB ILE A 66 22.419 -26.275 -51.933 1.00 0.00 C ATOM 1015 CG1 ILE A 66 23.260 -25.464 -50.890 1.00 0.00 C ATOM 1016 CG2 ILE A 66 23.307 -27.144 -52.839 1.00 0.00 C ATOM 1017 CD1 ILE A 66 24.196 -24.418 -51.465 1.00 0.00 C ATOM 0 H ILE A 66 20.029 -25.079 -51.321 1.00 0.00 H new ATOM 0 HA ILE A 66 22.096 -24.681 -53.407 1.00 0.00 H new ATOM 0 HB ILE A 66 21.778 -26.941 -51.355 1.00 0.00 H new ATOM 0 HG12 ILE A 66 22.573 -24.971 -50.203 1.00 0.00 H new ATOM 0 HG13 ILE A 66 23.849 -26.167 -50.301 1.00 0.00 H new ATOM 0 HG21 ILE A 66 23.943 -27.780 -52.223 1.00 0.00 H new ATOM 0 HG22 ILE A 66 22.678 -27.767 -53.475 1.00 0.00 H new ATOM 0 HG23 ILE A 66 23.930 -26.502 -53.462 1.00 0.00 H new ATOM 0 HD11 ILE A 66 24.726 -23.919 -50.654 1.00 0.00 H new ATOM 0 HD12 ILE A 66 24.916 -24.899 -52.128 1.00 0.00 H new ATOM 0 HD13 ILE A 66 23.619 -23.683 -52.027 1.00 0.00 H new ATOM 1029 N SER A 67 20.588 -25.936 -55.001 1.00 0.00 N ATOM 1030 CA SER A 67 19.814 -26.710 -55.986 1.00 0.00 C ATOM 1031 C SER A 67 20.580 -27.951 -56.486 1.00 0.00 C ATOM 1032 O SER A 67 19.975 -28.851 -57.079 1.00 0.00 O ATOM 1033 CB SER A 67 19.444 -25.798 -57.186 1.00 0.00 C ATOM 1034 OG SER A 67 20.556 -25.047 -57.644 1.00 0.00 O ATOM 0 H SER A 67 21.098 -25.152 -55.407 1.00 0.00 H new ATOM 0 HA SER A 67 18.910 -27.066 -55.492 1.00 0.00 H new ATOM 0 HB2 SER A 67 19.059 -26.410 -58.002 1.00 0.00 H new ATOM 0 HB3 SER A 67 18.644 -25.119 -56.892 1.00 0.00 H new ATOM 0 HG SER A 67 21.214 -25.650 -58.048 1.00 0.00 H new ATOM 1040 N ASN A 68 21.912 -27.983 -56.270 1.00 0.00 N ATOM 1041 CA ASN A 68 22.771 -29.062 -56.796 1.00 0.00 C ATOM 1042 C ASN A 68 24.079 -29.198 -55.988 1.00 0.00 C ATOM 1043 O ASN A 68 24.590 -28.210 -55.459 1.00 0.00 O ATOM 1044 CB ASN A 68 23.047 -28.850 -58.318 1.00 0.00 C ATOM 1045 CG ASN A 68 23.530 -27.439 -58.662 1.00 0.00 C ATOM 1046 OD1 ASN A 68 22.731 -26.558 -58.974 1.00 0.00 O ATOM 1047 ND2 ASN A 68 24.829 -27.208 -58.594 1.00 0.00 N ATOM 0 H ASN A 68 22.414 -27.274 -55.735 1.00 0.00 H new ATOM 0 HA ASN A 68 22.236 -30.004 -56.681 1.00 0.00 H new ATOM 0 HB2 ASN A 68 23.795 -29.571 -58.647 1.00 0.00 H new ATOM 0 HB3 ASN A 68 22.135 -29.059 -58.877 1.00 0.00 H new ATOM 0 HD21 ASN A 68 25.193 -26.279 -58.803 1.00 0.00 H new ATOM 0 HD22 ASN A 68 25.468 -27.959 -58.332 1.00 0.00 H new ATOM 1054 N ARG A 69 24.634 -30.435 -55.981 1.00 0.00 N ATOM 1055 CA ARG A 69 25.765 -30.855 -55.102 1.00 0.00 C ATOM 1056 C ARG A 69 27.016 -29.972 -55.220 1.00 0.00 C ATOM 1057 O ARG A 69 27.734 -29.814 -54.231 1.00 0.00 O ATOM 1058 CB ARG A 69 26.153 -32.335 -55.374 1.00 0.00 C ATOM 1059 CG ARG A 69 25.209 -33.382 -54.748 1.00 0.00 C ATOM 1060 CD ARG A 69 25.716 -34.827 -54.935 1.00 0.00 C ATOM 1061 NE ARG A 69 25.065 -35.764 -54.007 1.00 0.00 N ATOM 1062 CZ ARG A 69 25.316 -37.077 -53.929 1.00 0.00 C ATOM 1063 NH1 ARG A 69 26.119 -37.673 -54.799 1.00 0.00 N ATOM 1064 NH2 ARG A 69 24.754 -37.791 -52.969 1.00 0.00 N ATOM 0 H ARG A 69 24.307 -31.183 -56.593 1.00 0.00 H new ATOM 0 HA ARG A 69 25.394 -30.739 -54.084 1.00 0.00 H new ATOM 0 HB2 ARG A 69 26.184 -32.494 -56.452 1.00 0.00 H new ATOM 0 HB3 ARG A 69 27.161 -32.506 -54.997 1.00 0.00 H new ATOM 0 HG2 ARG A 69 25.098 -33.175 -53.684 1.00 0.00 H new ATOM 0 HG3 ARG A 69 24.220 -33.287 -55.196 1.00 0.00 H new ATOM 0 HD2 ARG A 69 25.532 -35.146 -55.961 1.00 0.00 H new ATOM 0 HD3 ARG A 69 26.795 -34.855 -54.781 1.00 0.00 H new ATOM 0 HE ARG A 69 24.365 -35.382 -53.371 1.00 0.00 H new ATOM 0 HH11 ARG A 69 26.557 -37.130 -55.543 1.00 0.00 H new ATOM 0 HH12 ARG A 69 26.299 -38.674 -54.724 1.00 0.00 H new ATOM 0 HH21 ARG A 69 24.135 -37.341 -52.295 1.00 0.00 H new ATOM 0 HH22 ARG A 69 24.940 -38.792 -52.902 1.00 0.00 H new ATOM 1078 N LYS A 70 27.267 -29.411 -56.417 1.00 0.00 N ATOM 1079 CA LYS A 70 28.419 -28.500 -56.646 1.00 0.00 C ATOM 1080 C LYS A 70 28.358 -27.343 -55.625 1.00 0.00 C ATOM 1081 O LYS A 70 29.303 -27.121 -54.858 1.00 0.00 O ATOM 1082 CB LYS A 70 28.402 -27.955 -58.114 1.00 0.00 C ATOM 1083 CG LYS A 70 29.739 -27.368 -58.660 1.00 0.00 C ATOM 1084 CD LYS A 70 30.230 -26.088 -57.937 1.00 0.00 C ATOM 1085 CE LYS A 70 31.496 -25.487 -58.563 1.00 0.00 C ATOM 1086 NZ LYS A 70 31.263 -25.002 -59.950 1.00 0.00 N ATOM 0 H LYS A 70 26.692 -29.568 -57.244 1.00 0.00 H new ATOM 0 HA LYS A 70 29.352 -29.047 -56.508 1.00 0.00 H new ATOM 0 HB2 LYS A 70 28.092 -28.765 -58.774 1.00 0.00 H new ATOM 0 HB3 LYS A 70 27.638 -27.180 -58.180 1.00 0.00 H new ATOM 0 HG2 LYS A 70 30.513 -28.132 -58.583 1.00 0.00 H new ATOM 0 HG3 LYS A 70 29.616 -27.145 -59.720 1.00 0.00 H new ATOM 0 HD2 LYS A 70 29.435 -25.342 -57.953 1.00 0.00 H new ATOM 0 HD3 LYS A 70 30.426 -26.322 -56.891 1.00 0.00 H new ATOM 0 HE2 LYS A 70 31.847 -24.660 -57.945 1.00 0.00 H new ATOM 0 HE3 LYS A 70 32.287 -26.237 -58.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 32.095 -24.470 -60.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 31.102 -25.814 -60.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 30.428 -24.382 -59.965 1.00 0.00 H new ATOM 1100 N GLN A 71 27.193 -26.673 -55.603 1.00 0.00 N ATOM 1101 CA GLN A 71 26.937 -25.498 -54.749 1.00 0.00 C ATOM 1102 C GLN A 71 27.053 -25.861 -53.255 1.00 0.00 C ATOM 1103 O GLN A 71 27.510 -25.046 -52.461 1.00 0.00 O ATOM 1104 CB GLN A 71 25.530 -24.929 -55.037 1.00 0.00 C ATOM 1105 CG GLN A 71 25.281 -24.536 -56.503 1.00 0.00 C ATOM 1106 CD GLN A 71 23.809 -24.226 -56.802 1.00 0.00 C ATOM 1107 OE1 GLN A 71 22.915 -24.781 -56.172 1.00 0.00 O ATOM 1108 NE2 GLN A 71 23.553 -23.364 -57.776 1.00 0.00 N ATOM 0 H GLN A 71 26.395 -26.933 -56.182 1.00 0.00 H new ATOM 0 HA GLN A 71 27.689 -24.744 -54.980 1.00 0.00 H new ATOM 0 HB2 GLN A 71 24.787 -25.670 -54.743 1.00 0.00 H new ATOM 0 HB3 GLN A 71 25.372 -24.052 -54.409 1.00 0.00 H new ATOM 0 HG2 GLN A 71 25.887 -23.663 -56.747 1.00 0.00 H new ATOM 0 HG3 GLN A 71 25.614 -25.346 -57.152 1.00 0.00 H new ATOM 0 HE21 GLN A 71 24.321 -22.921 -58.280 1.00 0.00 H new ATOM 0 HE22 GLN A 71 22.588 -23.144 -58.022 1.00 0.00 H new ATOM 1117 N LEU A 72 26.649 -27.102 -52.911 1.00 0.00 N ATOM 1118 CA LEU A 72 26.705 -27.631 -51.524 1.00 0.00 C ATOM 1119 C LEU A 72 28.161 -27.641 -51.030 1.00 0.00 C ATOM 1120 O LEU A 72 28.483 -27.081 -49.985 1.00 0.00 O ATOM 1121 CB LEU A 72 26.092 -29.081 -51.481 1.00 0.00 C ATOM 1122 CG LEU A 72 25.518 -29.610 -50.118 1.00 0.00 C ATOM 1123 CD1 LEU A 72 26.562 -29.662 -48.996 1.00 0.00 C ATOM 1124 CD2 LEU A 72 24.282 -28.809 -49.689 1.00 0.00 C ATOM 0 H LEU A 72 26.274 -27.769 -53.585 1.00 0.00 H new ATOM 0 HA LEU A 72 26.120 -26.989 -50.866 1.00 0.00 H new ATOM 0 HB2 LEU A 72 25.290 -29.124 -52.218 1.00 0.00 H new ATOM 0 HB3 LEU A 72 26.864 -29.777 -51.809 1.00 0.00 H new ATOM 0 HG LEU A 72 25.217 -30.642 -50.298 1.00 0.00 H new ATOM 0 HD11 LEU A 72 26.097 -30.036 -48.084 1.00 0.00 H new ATOM 0 HD12 LEU A 72 27.376 -30.325 -49.287 1.00 0.00 H new ATOM 0 HD13 LEU A 72 26.955 -28.661 -48.818 1.00 0.00 H new ATOM 0 HD21 LEU A 72 23.907 -29.198 -48.742 1.00 0.00 H new ATOM 0 HD22 LEU A 72 24.552 -27.760 -49.569 1.00 0.00 H new ATOM 0 HD23 LEU A 72 23.508 -28.899 -50.451 1.00 0.00 H new ATOM 1136 N GLU A 73 29.021 -28.270 -51.828 1.00 0.00 N ATOM 1137 CA GLU A 73 30.420 -28.525 -51.468 1.00 0.00 C ATOM 1138 C GLU A 73 31.226 -27.223 -51.407 1.00 0.00 C ATOM 1139 O GLU A 73 31.907 -26.959 -50.407 1.00 0.00 O ATOM 1140 CB GLU A 73 31.021 -29.487 -52.501 1.00 0.00 C ATOM 1141 CG GLU A 73 30.291 -30.830 -52.588 1.00 0.00 C ATOM 1142 CD GLU A 73 30.852 -31.720 -53.696 1.00 0.00 C ATOM 1143 OE1 GLU A 73 31.768 -32.522 -53.423 1.00 0.00 O ATOM 1144 OE2 GLU A 73 30.407 -31.589 -54.857 1.00 0.00 O ATOM 0 H GLU A 73 28.767 -28.621 -52.751 1.00 0.00 H new ATOM 0 HA GLU A 73 30.461 -28.973 -50.475 1.00 0.00 H new ATOM 0 HB2 GLU A 73 31.005 -29.010 -53.481 1.00 0.00 H new ATOM 0 HB3 GLU A 73 32.067 -29.667 -52.252 1.00 0.00 H new ATOM 0 HG2 GLU A 73 30.371 -31.348 -51.632 1.00 0.00 H new ATOM 0 HG3 GLU A 73 29.230 -30.654 -52.767 1.00 0.00 H new ATOM 1151 N GLN A 74 31.108 -26.396 -52.475 1.00 0.00 N ATOM 1152 CA GLN A 74 31.805 -25.098 -52.551 1.00 0.00 C ATOM 1153 C GLN A 74 31.313 -24.141 -51.441 1.00 0.00 C ATOM 1154 O GLN A 74 32.050 -23.251 -51.026 1.00 0.00 O ATOM 1155 CB GLN A 74 31.717 -24.463 -53.982 1.00 0.00 C ATOM 1156 CG GLN A 74 30.311 -24.051 -54.503 1.00 0.00 C ATOM 1157 CD GLN A 74 29.825 -22.654 -54.077 1.00 0.00 C ATOM 1158 OE1 GLN A 74 29.047 -22.574 -53.009 1.00 0.00 O flip ATOM 1159 NE2 GLN A 74 30.130 -21.655 -54.718 1.00 0.00 N flip ATOM 0 H GLN A 74 30.536 -26.609 -53.292 1.00 0.00 H new ATOM 0 HA GLN A 74 32.865 -25.278 -52.372 1.00 0.00 H new ATOM 0 HB2 GLN A 74 32.353 -23.578 -53.996 1.00 0.00 H new ATOM 0 HB3 GLN A 74 32.143 -25.173 -54.691 1.00 0.00 H new ATOM 0 HG2 GLN A 74 30.320 -24.096 -55.592 1.00 0.00 H new ATOM 0 HG3 GLN A 74 29.586 -24.788 -54.159 1.00 0.00 H new ATOM 0 HE21 GLN A 74 30.731 -21.739 -55.538 1.00 0.00 H new ATOM 0 HE22 GLN A 74 29.783 -20.740 -54.431 1.00 0.00 H new ATOM 1168 N TYR A 75 30.073 -24.373 -50.945 1.00 0.00 N ATOM 1169 CA TYR A 75 29.517 -23.648 -49.786 1.00 0.00 C ATOM 1170 C TYR A 75 30.299 -24.029 -48.520 1.00 0.00 C ATOM 1171 O TYR A 75 30.745 -23.150 -47.800 1.00 0.00 O ATOM 1172 CB TYR A 75 27.999 -23.960 -49.610 1.00 0.00 C ATOM 1173 CG TYR A 75 27.322 -23.272 -48.414 1.00 0.00 C ATOM 1174 CD1 TYR A 75 26.596 -22.095 -48.567 1.00 0.00 C ATOM 1175 CD2 TYR A 75 27.419 -23.799 -47.124 1.00 0.00 C ATOM 1176 CE1 TYR A 75 25.998 -21.478 -47.488 1.00 0.00 C ATOM 1177 CE2 TYR A 75 26.824 -23.183 -46.047 1.00 0.00 C ATOM 1178 CZ TYR A 75 26.118 -22.027 -46.228 1.00 0.00 C ATOM 1179 OH TYR A 75 25.515 -21.423 -45.142 1.00 0.00 O ATOM 0 H TYR A 75 29.436 -25.066 -51.338 1.00 0.00 H new ATOM 0 HA TYR A 75 29.617 -22.576 -49.959 1.00 0.00 H new ATOM 0 HB2 TYR A 75 27.477 -23.666 -50.520 1.00 0.00 H new ATOM 0 HB3 TYR A 75 27.876 -25.038 -49.505 1.00 0.00 H new ATOM 0 HD1 TYR A 75 26.499 -21.656 -49.549 1.00 0.00 H new ATOM 0 HD2 TYR A 75 27.974 -24.712 -46.968 1.00 0.00 H new ATOM 0 HE1 TYR A 75 25.437 -20.566 -47.629 1.00 0.00 H new ATOM 0 HE2 TYR A 75 26.915 -23.612 -45.060 1.00 0.00 H new ATOM 0 HH TYR A 75 26.115 -21.467 -44.368 1.00 0.00 H new ATOM 1189 N LEU A 76 30.460 -25.347 -48.277 1.00 0.00 N ATOM 1190 CA LEU A 76 31.085 -25.879 -47.037 1.00 0.00 C ATOM 1191 C LEU A 76 32.547 -25.410 -46.903 1.00 0.00 C ATOM 1192 O LEU A 76 32.971 -24.960 -45.837 1.00 0.00 O ATOM 1193 CB LEU A 76 31.023 -27.429 -47.015 1.00 0.00 C ATOM 1194 CG LEU A 76 29.604 -28.069 -47.103 1.00 0.00 C ATOM 1195 CD1 LEU A 76 29.702 -29.606 -47.161 1.00 0.00 C ATOM 1196 CD2 LEU A 76 28.679 -27.599 -45.952 1.00 0.00 C ATOM 0 H LEU A 76 30.163 -26.073 -48.929 1.00 0.00 H new ATOM 0 HA LEU A 76 30.520 -25.489 -46.190 1.00 0.00 H new ATOM 0 HB2 LEU A 76 31.620 -27.806 -47.846 1.00 0.00 H new ATOM 0 HB3 LEU A 76 31.498 -27.777 -46.098 1.00 0.00 H new ATOM 0 HG LEU A 76 29.145 -27.724 -48.030 1.00 0.00 H new ATOM 0 HD11 LEU A 76 28.701 -30.032 -47.222 1.00 0.00 H new ATOM 0 HD12 LEU A 76 30.276 -29.901 -48.039 1.00 0.00 H new ATOM 0 HD13 LEU A 76 30.198 -29.973 -46.263 1.00 0.00 H new ATOM 0 HD21 LEU A 76 27.702 -28.071 -46.055 1.00 0.00 H new ATOM 0 HD22 LEU A 76 29.118 -27.879 -44.995 1.00 0.00 H new ATOM 0 HD23 LEU A 76 28.565 -26.516 -45.996 1.00 0.00 H new ATOM 1208 N LYS A 77 33.300 -25.495 -48.007 1.00 0.00 N ATOM 1209 CA LYS A 77 34.714 -25.068 -48.038 1.00 0.00 C ATOM 1210 C LYS A 77 34.853 -23.522 -48.136 1.00 0.00 C ATOM 1211 O LYS A 77 35.961 -22.988 -48.069 1.00 0.00 O ATOM 1212 CB LYS A 77 35.473 -25.831 -49.171 1.00 0.00 C ATOM 1213 CG LYS A 77 34.896 -25.686 -50.610 1.00 0.00 C ATOM 1214 CD LYS A 77 35.337 -24.398 -51.344 1.00 0.00 C ATOM 1215 CE LYS A 77 36.863 -24.297 -51.521 1.00 0.00 C ATOM 1216 NZ LYS A 77 37.262 -23.051 -52.221 1.00 0.00 N ATOM 0 H LYS A 77 32.956 -25.857 -48.897 1.00 0.00 H new ATOM 0 HA LYS A 77 35.185 -25.335 -47.092 1.00 0.00 H new ATOM 0 HB2 LYS A 77 36.507 -25.487 -49.181 1.00 0.00 H new ATOM 0 HB3 LYS A 77 35.492 -26.891 -48.916 1.00 0.00 H new ATOM 0 HG2 LYS A 77 35.202 -26.550 -51.200 1.00 0.00 H new ATOM 0 HG3 LYS A 77 33.807 -25.705 -50.556 1.00 0.00 H new ATOM 0 HD2 LYS A 77 34.860 -24.364 -52.324 1.00 0.00 H new ATOM 0 HD3 LYS A 77 34.983 -23.530 -50.787 1.00 0.00 H new ATOM 0 HE2 LYS A 77 37.344 -24.333 -50.544 1.00 0.00 H new ATOM 0 HE3 LYS A 77 37.220 -25.159 -52.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 38.297 -23.024 -52.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 36.824 -23.027 -53.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 36.945 -22.227 -51.671 1.00 0.00 H new ATOM 1230 N SER A 78 33.721 -22.812 -48.329 1.00 0.00 N ATOM 1231 CA SER A 78 33.642 -21.336 -48.201 1.00 0.00 C ATOM 1232 C SER A 78 33.131 -20.926 -46.797 1.00 0.00 C ATOM 1233 O SER A 78 33.386 -19.808 -46.340 1.00 0.00 O ATOM 1234 CB SER A 78 32.693 -20.777 -49.290 1.00 0.00 C ATOM 1235 OG SER A 78 32.538 -19.373 -49.198 1.00 0.00 O ATOM 0 H SER A 78 32.832 -23.245 -48.579 1.00 0.00 H new ATOM 0 HA SER A 78 34.641 -20.921 -48.332 1.00 0.00 H new ATOM 0 HB2 SER A 78 33.083 -21.034 -50.275 1.00 0.00 H new ATOM 0 HB3 SER A 78 31.718 -21.255 -49.199 1.00 0.00 H new ATOM 0 HG SER A 78 31.933 -19.064 -49.904 1.00 0.00 H new ATOM 1241 N HIS A 79 32.413 -21.843 -46.125 1.00 0.00 N ATOM 1242 CA HIS A 79 31.713 -21.575 -44.853 1.00 0.00 C ATOM 1243 C HIS A 79 32.029 -22.704 -43.844 1.00 0.00 C ATOM 1244 O HIS A 79 31.384 -23.761 -43.887 1.00 0.00 O ATOM 1245 CB HIS A 79 30.172 -21.486 -45.081 1.00 0.00 C ATOM 1246 CG HIS A 79 29.729 -20.378 -46.001 1.00 0.00 C ATOM 1247 ND1 HIS A 79 29.526 -20.558 -47.355 1.00 0.00 N ATOM 1248 CD2 HIS A 79 29.457 -19.075 -45.760 1.00 0.00 C ATOM 1249 CE1 HIS A 79 29.159 -19.418 -47.904 1.00 0.00 C ATOM 1250 NE2 HIS A 79 29.108 -18.500 -46.958 1.00 0.00 N ATOM 0 H HIS A 79 32.300 -22.802 -46.452 1.00 0.00 H new ATOM 0 HA HIS A 79 32.058 -20.620 -44.456 1.00 0.00 H new ATOM 0 HB2 HIS A 79 29.824 -22.436 -45.487 1.00 0.00 H new ATOM 0 HB3 HIS A 79 29.684 -21.354 -44.115 1.00 0.00 H new ATOM 0 HD1 HIS A 79 29.643 -21.440 -47.854 1.00 0.00 H new ATOM 0 HD2 HIS A 79 29.505 -18.578 -44.802 1.00 0.00 H new ATOM 0 HE1 HIS A 79 28.938 -19.262 -48.949 1.00 0.00 H new ATOM 1259 N PRO A 80 33.041 -22.520 -42.939 1.00 0.00 N ATOM 1260 CA PRO A 80 33.372 -23.526 -41.904 1.00 0.00 C ATOM 1261 C PRO A 80 32.339 -23.528 -40.751 1.00 0.00 C ATOM 1262 O PRO A 80 31.677 -22.514 -40.491 1.00 0.00 O ATOM 1263 CB PRO A 80 34.785 -23.096 -41.443 1.00 0.00 C ATOM 1264 CG PRO A 80 34.820 -21.615 -41.656 1.00 0.00 C ATOM 1265 CD PRO A 80 33.932 -21.330 -42.855 1.00 0.00 C ATOM 0 HA PRO A 80 33.348 -24.551 -42.273 1.00 0.00 H new ATOM 0 HB2 PRO A 80 34.954 -23.350 -40.397 1.00 0.00 H new ATOM 0 HB3 PRO A 80 35.560 -23.598 -42.022 1.00 0.00 H new ATOM 0 HG2 PRO A 80 34.460 -21.088 -40.773 1.00 0.00 H new ATOM 0 HG3 PRO A 80 35.839 -21.273 -41.838 1.00 0.00 H new ATOM 0 HD2 PRO A 80 33.360 -20.413 -42.718 1.00 0.00 H new ATOM 0 HD3 PRO A 80 34.519 -21.207 -43.765 1.00 0.00 H new ATOM 1273 N GLY A 81 32.196 -24.691 -40.090 1.00 0.00 N ATOM 1274 CA GLY A 81 31.174 -24.890 -39.052 1.00 0.00 C ATOM 1275 C GLY A 81 29.839 -25.368 -39.623 1.00 0.00 C ATOM 1276 O GLY A 81 28.834 -25.434 -38.907 1.00 0.00 O ATOM 0 H GLY A 81 32.780 -25.510 -40.259 1.00 0.00 H new ATOM 0 HA2 GLY A 81 31.536 -25.618 -38.326 1.00 0.00 H new ATOM 0 HA3 GLY A 81 31.021 -23.954 -38.515 1.00 0.00 H new ATOM 1280 N ASN A 82 29.827 -25.681 -40.929 1.00 0.00 N ATOM 1281 CA ASN A 82 28.642 -26.211 -41.637 1.00 0.00 C ATOM 1282 C ASN A 82 28.801 -27.732 -41.871 1.00 0.00 C ATOM 1283 O ASN A 82 29.834 -28.158 -42.402 1.00 0.00 O ATOM 1284 CB ASN A 82 28.453 -25.452 -42.975 1.00 0.00 C ATOM 1285 CG ASN A 82 27.991 -24.012 -42.760 1.00 0.00 C ATOM 1286 OD1 ASN A 82 26.801 -23.726 -42.808 1.00 0.00 O ATOM 1287 ND2 ASN A 82 28.921 -23.110 -42.479 1.00 0.00 N ATOM 0 H ASN A 82 30.644 -25.574 -41.531 1.00 0.00 H new ATOM 0 HA ASN A 82 27.752 -26.057 -41.027 1.00 0.00 H new ATOM 0 HB2 ASN A 82 29.393 -25.452 -43.527 1.00 0.00 H new ATOM 0 HB3 ASN A 82 27.723 -25.978 -43.590 1.00 0.00 H new ATOM 0 HD21 ASN A 82 28.654 -22.143 -42.294 1.00 0.00 H new ATOM 0 HD22 ASN A 82 29.903 -23.383 -42.447 1.00 0.00 H new ATOM 1294 N PRO A 83 27.789 -28.575 -41.460 1.00 0.00 N ATOM 1295 CA PRO A 83 27.846 -30.059 -41.593 1.00 0.00 C ATOM 1296 C PRO A 83 28.131 -30.529 -43.039 1.00 0.00 C ATOM 1297 O PRO A 83 27.650 -29.923 -43.997 1.00 0.00 O ATOM 1298 CB PRO A 83 26.447 -30.531 -41.097 1.00 0.00 C ATOM 1299 CG PRO A 83 25.588 -29.305 -41.069 1.00 0.00 C ATOM 1300 CD PRO A 83 26.520 -28.147 -40.817 1.00 0.00 C ATOM 0 HA PRO A 83 28.668 -30.484 -41.017 1.00 0.00 H new ATOM 0 HB2 PRO A 83 26.030 -31.285 -41.764 1.00 0.00 H new ATOM 0 HB3 PRO A 83 26.515 -30.983 -40.108 1.00 0.00 H new ATOM 0 HG2 PRO A 83 25.057 -29.180 -42.013 1.00 0.00 H new ATOM 0 HG3 PRO A 83 24.833 -29.376 -40.286 1.00 0.00 H new ATOM 0 HD2 PRO A 83 26.140 -27.224 -41.255 1.00 0.00 H new ATOM 0 HD3 PRO A 83 26.653 -27.963 -39.751 1.00 0.00 H new ATOM 1308 N ALA A 84 28.911 -31.621 -43.156 1.00 0.00 N ATOM 1309 CA ALA A 84 29.428 -32.123 -44.445 1.00 0.00 C ATOM 1310 C ALA A 84 28.319 -32.747 -45.314 1.00 0.00 C ATOM 1311 O ALA A 84 27.286 -33.179 -44.802 1.00 0.00 O ATOM 1312 CB ALA A 84 30.568 -33.133 -44.214 1.00 0.00 C ATOM 0 H ALA A 84 29.202 -32.183 -42.356 1.00 0.00 H new ATOM 0 HA ALA A 84 29.820 -31.265 -44.991 1.00 0.00 H new ATOM 0 HB1 ALA A 84 30.936 -33.492 -45.175 1.00 0.00 H new ATOM 0 HB2 ALA A 84 31.380 -32.648 -43.673 1.00 0.00 H new ATOM 0 HB3 ALA A 84 30.195 -33.975 -43.631 1.00 0.00 H new ATOM 1318 N ILE A 85 28.581 -32.828 -46.632 1.00 0.00 N ATOM 1319 CA ILE A 85 27.635 -33.387 -47.625 1.00 0.00 C ATOM 1320 C ILE A 85 27.439 -34.918 -47.423 1.00 0.00 C ATOM 1321 O ILE A 85 26.456 -35.502 -47.900 1.00 0.00 O ATOM 1322 CB ILE A 85 28.110 -33.053 -49.099 1.00 0.00 C ATOM 1323 CG1 ILE A 85 27.002 -33.398 -50.151 1.00 0.00 C ATOM 1324 CG2 ILE A 85 29.455 -33.744 -49.441 1.00 0.00 C ATOM 1325 CD1 ILE A 85 27.336 -33.029 -51.591 1.00 0.00 C ATOM 0 H ILE A 85 29.458 -32.507 -47.043 1.00 0.00 H new ATOM 0 HA ILE A 85 26.665 -32.915 -47.470 1.00 0.00 H new ATOM 0 HB ILE A 85 28.281 -31.978 -49.146 1.00 0.00 H new ATOM 0 HG12 ILE A 85 26.800 -34.468 -50.105 1.00 0.00 H new ATOM 0 HG13 ILE A 85 26.082 -32.888 -49.866 1.00 0.00 H new ATOM 0 HG21 ILE A 85 29.746 -33.490 -50.460 1.00 0.00 H new ATOM 0 HG22 ILE A 85 30.225 -33.404 -48.748 1.00 0.00 H new ATOM 0 HG23 ILE A 85 29.341 -34.825 -49.355 1.00 0.00 H new ATOM 0 HD11 ILE A 85 26.506 -33.308 -52.240 1.00 0.00 H new ATOM 0 HD12 ILE A 85 27.506 -31.955 -51.661 1.00 0.00 H new ATOM 0 HD13 ILE A 85 28.235 -33.560 -51.903 1.00 0.00 H new ATOM 1337 N ALA A 86 28.365 -35.535 -46.659 1.00 0.00 N ATOM 1338 CA ALA A 86 28.351 -36.980 -46.332 1.00 0.00 C ATOM 1339 C ALA A 86 27.087 -37.409 -45.552 1.00 0.00 C ATOM 1340 O ALA A 86 26.647 -38.556 -45.664 1.00 0.00 O ATOM 1341 CB ALA A 86 29.617 -37.346 -45.539 1.00 0.00 C ATOM 0 H ALA A 86 29.154 -35.039 -46.246 1.00 0.00 H new ATOM 0 HA ALA A 86 28.333 -37.523 -47.277 1.00 0.00 H new ATOM 0 HB1 ALA A 86 29.602 -38.410 -45.301 1.00 0.00 H new ATOM 0 HB2 ALA A 86 30.499 -37.120 -46.138 1.00 0.00 H new ATOM 0 HB3 ALA A 86 29.648 -36.768 -44.616 1.00 0.00 H new ATOM 1347 N GLU A 87 26.516 -36.485 -44.753 1.00 0.00 N ATOM 1348 CA GLU A 87 25.264 -36.743 -43.992 1.00 0.00 C ATOM 1349 C GLU A 87 24.026 -36.185 -44.738 1.00 0.00 C ATOM 1350 O GLU A 87 22.883 -36.436 -44.330 1.00 0.00 O ATOM 1351 CB GLU A 87 25.364 -36.134 -42.566 1.00 0.00 C ATOM 1352 CG GLU A 87 25.681 -34.630 -42.540 1.00 0.00 C ATOM 1353 CD GLU A 87 25.667 -34.020 -41.133 1.00 0.00 C ATOM 1354 OE1 GLU A 87 24.582 -33.659 -40.629 1.00 0.00 O ATOM 1355 OE2 GLU A 87 26.740 -33.892 -40.514 1.00 0.00 O ATOM 0 H GLU A 87 26.899 -35.550 -44.614 1.00 0.00 H new ATOM 0 HA GLU A 87 25.139 -37.822 -43.904 1.00 0.00 H new ATOM 0 HB2 GLU A 87 24.422 -36.304 -42.045 1.00 0.00 H new ATOM 0 HB3 GLU A 87 26.136 -36.666 -42.010 1.00 0.00 H new ATOM 0 HG2 GLU A 87 26.662 -34.467 -42.987 1.00 0.00 H new ATOM 0 HG3 GLU A 87 24.956 -34.104 -43.161 1.00 0.00 H new ATOM 1362 N PHE A 88 24.263 -35.433 -45.824 1.00 0.00 N ATOM 1363 CA PHE A 88 23.194 -34.764 -46.603 1.00 0.00 C ATOM 1364 C PHE A 88 22.606 -35.729 -47.639 1.00 0.00 C ATOM 1365 O PHE A 88 23.316 -36.156 -48.551 1.00 0.00 O ATOM 1366 CB PHE A 88 23.759 -33.490 -47.296 1.00 0.00 C ATOM 1367 CG PHE A 88 24.015 -32.302 -46.361 1.00 0.00 C ATOM 1368 CD1 PHE A 88 24.064 -31.019 -46.868 1.00 0.00 C ATOM 1369 CD2 PHE A 88 24.205 -32.462 -44.987 1.00 0.00 C ATOM 1370 CE1 PHE A 88 24.296 -29.937 -46.046 1.00 0.00 C ATOM 1371 CE2 PHE A 88 24.436 -31.380 -44.169 1.00 0.00 C ATOM 1372 CZ PHE A 88 24.483 -30.118 -44.701 1.00 0.00 C ATOM 0 H PHE A 88 25.200 -35.268 -46.192 1.00 0.00 H new ATOM 0 HA PHE A 88 22.395 -34.465 -45.924 1.00 0.00 H new ATOM 0 HB2 PHE A 88 24.694 -33.750 -47.793 1.00 0.00 H new ATOM 0 HB3 PHE A 88 23.061 -33.178 -48.073 1.00 0.00 H new ATOM 0 HD1 PHE A 88 23.918 -30.860 -47.926 1.00 0.00 H new ATOM 0 HD2 PHE A 88 24.170 -33.453 -44.559 1.00 0.00 H new ATOM 0 HE1 PHE A 88 24.331 -28.942 -46.464 1.00 0.00 H new ATOM 0 HE2 PHE A 88 24.580 -31.525 -43.109 1.00 0.00 H new ATOM 0 HZ PHE A 88 24.667 -29.268 -44.061 1.00 0.00 H new ATOM 1382 N ASP A 89 21.303 -36.059 -47.494 1.00 0.00 N ATOM 1383 CA ASP A 89 20.624 -37.063 -48.343 1.00 0.00 C ATOM 1384 C ASP A 89 19.914 -36.390 -49.531 1.00 0.00 C ATOM 1385 O ASP A 89 19.091 -35.494 -49.347 1.00 0.00 O ATOM 1386 CB ASP A 89 19.589 -37.895 -47.524 1.00 0.00 C ATOM 1387 CG ASP A 89 19.160 -39.178 -48.255 1.00 0.00 C ATOM 1388 OD1 ASP A 89 19.842 -40.213 -48.099 1.00 0.00 O ATOM 1389 OD2 ASP A 89 18.156 -39.155 -49.001 1.00 0.00 O ATOM 0 H ASP A 89 20.696 -35.640 -46.790 1.00 0.00 H new ATOM 0 HA ASP A 89 21.394 -37.736 -48.721 1.00 0.00 H new ATOM 0 HB2 ASP A 89 20.020 -38.157 -46.558 1.00 0.00 H new ATOM 0 HB3 ASP A 89 18.710 -37.282 -47.325 1.00 0.00 H new ATOM 1394 N TRP A 90 20.251 -36.846 -50.742 1.00 0.00 N ATOM 1395 CA TRP A 90 19.643 -36.386 -52.007 1.00 0.00 C ATOM 1396 C TRP A 90 18.774 -37.520 -52.610 1.00 0.00 C ATOM 1397 O TRP A 90 17.861 -37.258 -53.399 1.00 0.00 O ATOM 1398 CB TRP A 90 20.765 -35.975 -53.008 1.00 0.00 C ATOM 1399 CG TRP A 90 21.723 -34.921 -52.478 1.00 0.00 C ATOM 1400 CD1 TRP A 90 22.758 -35.111 -51.600 1.00 0.00 C ATOM 1401 CD2 TRP A 90 21.728 -33.518 -52.789 1.00 0.00 C ATOM 1402 NE1 TRP A 90 23.407 -33.929 -51.366 1.00 0.00 N ATOM 1403 CE2 TRP A 90 22.790 -32.934 -52.078 1.00 0.00 C ATOM 1404 CE3 TRP A 90 20.939 -32.703 -53.599 1.00 0.00 C ATOM 1405 CZ2 TRP A 90 23.078 -31.573 -52.154 1.00 0.00 C ATOM 1406 CZ3 TRP A 90 21.227 -31.351 -53.676 1.00 0.00 C ATOM 1407 CH2 TRP A 90 22.285 -30.796 -52.958 1.00 0.00 C ATOM 0 H TRP A 90 20.967 -37.559 -50.879 1.00 0.00 H new ATOM 0 HA TRP A 90 19.009 -35.521 -51.813 1.00 0.00 H new ATOM 0 HB2 TRP A 90 21.335 -36.863 -53.280 1.00 0.00 H new ATOM 0 HB3 TRP A 90 20.302 -35.601 -53.921 1.00 0.00 H new ATOM 0 HD1 TRP A 90 23.024 -36.059 -51.156 1.00 0.00 H new ATOM 0 HE1 TRP A 90 24.218 -33.808 -50.760 1.00 0.00 H new ATOM 0 HE3 TRP A 90 20.115 -33.120 -54.159 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 23.899 -31.144 -51.598 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 20.621 -30.715 -54.304 1.00 0.00 H new ATOM 0 HH2 TRP A 90 22.483 -29.737 -53.036 1.00 0.00 H new ATOM 1418 N THR A 91 19.049 -38.783 -52.182 1.00 0.00 N ATOM 1419 CA THR A 91 18.433 -40.007 -52.765 1.00 0.00 C ATOM 1420 C THR A 91 17.016 -40.274 -52.206 1.00 0.00 C ATOM 1421 O THR A 91 16.396 -41.289 -52.544 1.00 0.00 O ATOM 1422 CB THR A 91 19.357 -41.266 -52.546 1.00 0.00 C ATOM 1423 OG1 THR A 91 18.908 -42.384 -53.340 1.00 0.00 O ATOM 1424 CG2 THR A 91 19.419 -41.695 -51.073 1.00 0.00 C ATOM 0 H THR A 91 19.703 -38.980 -51.424 1.00 0.00 H new ATOM 0 HA THR A 91 18.333 -39.828 -53.836 1.00 0.00 H new ATOM 0 HB THR A 91 20.357 -40.967 -52.861 1.00 0.00 H new ATOM 0 HG1 THR A 91 17.929 -42.416 -53.335 1.00 0.00 H new ATOM 0 HG21 THR A 91 20.067 -42.566 -50.975 1.00 0.00 H new ATOM 0 HG22 THR A 91 19.816 -40.877 -50.472 1.00 0.00 H new ATOM 0 HG23 THR A 91 18.417 -41.948 -50.725 1.00 0.00 H new ATOM 1432 N THR A 92 16.491 -39.340 -51.384 1.00 0.00 N ATOM 1433 CA THR A 92 15.116 -39.420 -50.836 1.00 0.00 C ATOM 1434 C THR A 92 14.052 -39.400 -51.969 1.00 0.00 C ATOM 1435 O THR A 92 12.908 -39.832 -51.780 1.00 0.00 O ATOM 1436 CB THR A 92 14.846 -38.241 -49.847 1.00 0.00 C ATOM 1437 OG1 THR A 92 13.573 -38.397 -49.193 1.00 0.00 O ATOM 1438 CG2 THR A 92 14.886 -36.877 -50.549 1.00 0.00 C ATOM 0 H THR A 92 17.004 -38.512 -51.082 1.00 0.00 H new ATOM 0 HA THR A 92 15.035 -40.366 -50.300 1.00 0.00 H new ATOM 0 HB THR A 92 15.645 -38.271 -49.106 1.00 0.00 H new ATOM 0 HG1 THR A 92 13.558 -37.859 -48.374 1.00 0.00 H new ATOM 0 HG21 THR A 92 14.693 -36.088 -49.822 1.00 0.00 H new ATOM 0 HG22 THR A 92 15.869 -36.726 -50.996 1.00 0.00 H new ATOM 0 HG23 THR A 92 14.125 -36.847 -51.328 1.00 0.00 H new ATOM 1446 N SER A 93 14.473 -38.876 -53.137 1.00 0.00 N ATOM 1447 CA SER A 93 13.668 -38.802 -54.368 1.00 0.00 C ATOM 1448 C SER A 93 13.340 -40.207 -54.923 1.00 0.00 C ATOM 1449 O SER A 93 12.321 -40.399 -55.606 1.00 0.00 O ATOM 1450 CB SER A 93 14.465 -37.996 -55.426 1.00 0.00 C ATOM 1451 OG SER A 93 15.004 -36.807 -54.870 1.00 0.00 O ATOM 0 H SER A 93 15.407 -38.483 -53.251 1.00 0.00 H new ATOM 0 HA SER A 93 12.722 -38.312 -54.139 1.00 0.00 H new ATOM 0 HB2 SER A 93 15.271 -38.612 -55.824 1.00 0.00 H new ATOM 0 HB3 SER A 93 13.813 -37.746 -56.263 1.00 0.00 H new ATOM 0 HG SER A 93 14.274 -36.205 -54.614 1.00 0.00 H new ATOM 1457 N GLY A 94 14.228 -41.165 -54.616 1.00 0.00 N ATOM 1458 CA GLY A 94 14.180 -42.516 -55.175 1.00 0.00 C ATOM 1459 C GLY A 94 15.446 -42.815 -55.964 1.00 0.00 C ATOM 1460 O GLY A 94 16.211 -41.894 -56.287 1.00 0.00 O ATOM 0 H GLY A 94 15.002 -41.019 -53.969 1.00 0.00 H new ATOM 0 HA2 GLY A 94 14.065 -43.244 -54.372 1.00 0.00 H new ATOM 0 HA3 GLY A 94 13.309 -42.617 -55.823 1.00 0.00 H new ATOM 1464 N THR A 95 15.678 -44.099 -56.270 1.00 0.00 N ATOM 1465 CA THR A 95 16.862 -44.553 -57.008 1.00 0.00 C ATOM 1466 C THR A 95 16.528 -45.880 -57.748 1.00 0.00 C ATOM 1467 O THR A 95 16.217 -45.821 -58.959 1.00 0.00 O ATOM 1468 CB THR A 95 18.140 -44.677 -56.074 1.00 0.00 C ATOM 1469 OG1 THR A 95 19.182 -45.419 -56.730 1.00 0.00 O ATOM 1470 CG2 THR A 95 17.839 -45.313 -54.698 1.00 0.00 C ATOM 1471 OXT THR A 95 16.507 -46.955 -57.111 1.00 0.00 O ATOM 0 H THR A 95 15.045 -44.855 -56.010 1.00 0.00 H new ATOM 0 HA THR A 95 17.124 -43.801 -57.752 1.00 0.00 H new ATOM 0 HB THR A 95 18.471 -43.655 -55.888 1.00 0.00 H new ATOM 0 HG1 THR A 95 19.961 -45.482 -56.138 1.00 0.00 H new ATOM 0 HG21 THR A 95 18.757 -45.366 -54.113 1.00 0.00 H new ATOM 0 HG22 THR A 95 17.106 -44.704 -54.168 1.00 0.00 H new ATOM 0 HG23 THR A 95 17.441 -46.318 -54.841 1.00 0.00 H new TER 1479 THR A 95